Browse entries in the PDBbind-CN Database
HEADER 5TOZ_COMPLEX COMPND 5TOZ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 78 THR ILE PHE GLU GLU ARG HIS LEU LYS TYR ILE SER GLN SEQRES 2 A 78 LEU GLY LYS GLY ASN PHE GLY SER VAL GLU LEU CYS ARG SEQRES 3 A 78 TYR ASP PRO LEU GLY ASP ASN THR GLY ALA LEU VAL ALA SEQRES 4 A 78 VAL LYS GLN LEU GLN HIS SER GLY PRO ASP GLN GLN ARG SEQRES 5 A 78 ASP PHE GLN ARG GLU ILE GLN ILE LEU LYS ALA LEU HIS SEQRES 6 A 78 SER ASP PHE ILE VAL LYS TYR ARG GLY VAL SER TYR GLY SEQRES 1 A 142 SER LEU ARG LEU VAL MET GLU TYR LEU PRO SER GLY CYS SEQRES 2 A 142 LEU ARG ASP PHE LEU GLN ARG HIS ARG ALA ARG LEU ASP SEQRES 3 A 142 ALA SER ARG LEU LEU LEU TYR SER SER GLN ILE CYS LYS SEQRES 4 A 142 GLY MET GLU TYR LEU GLY SER ARG ARG CYS VAL HIS ARG SEQRES 5 A 142 ASP LEU ALA ALA ARG ASN ILE LEU VAL GLU SER GLU ALA SEQRES 6 A 142 HIS VAL LYS ILE ALA ASP PHE GLY LEU ALA LYS LEU LEU SEQRES 7 A 142 PRO LEU ASP LYS ASP TYR TYR VAL VAL ARG GLU PRO GLY SEQRES 8 A 142 GLN SER PRO ILE PHE TRP TYR ALA PRO GLU SER LEU SER SEQRES 9 A 142 ASP ASN ILE PHE SER ARG GLN SER ASP VAL TRP SER PHE SEQRES 10 A 142 GLY VAL VAL LEU TYR GLU LEU PHE THR TYR CYS ASP LYS SEQRES 11 A 142 SER CYS SER PRO SER ALA GLU PHE LEU ARG MET MET SEQRES 1 A 58 ASP VAL PRO ALA LEU SER ARG LEU LEU GLU LEU LEU GLU SEQRES 2 A 58 GLU GLY GLN ARG LEU PRO ALA PRO PRO ALA CYS PRO ALA SEQRES 3 A 58 GLU VAL HIS GLU LEU MET LYS LEU CYS TRP ALA PRO SER SEQRES 4 A 58 PRO GLN ASP ARG PRO SER PHE SER ALA LEU GLY PRO GLN SEQRES 5 A 58 LEU ASP MET LEU TRP SER HET UNN A 511 42 ATOM 1 N THR A 815 0.793 -2.254 4.002 1.00 47.63 N ATOM 2 CA THR A 815 -0.409 -2.059 3.186 1.00 47.51 C ATOM 3 C THR A 815 -1.608 -1.582 4.022 1.00 49.33 C ATOM 4 O THR A 815 -2.571 -1.049 3.464 1.00 46.86 O ATOM 5 CB THR A 815 -0.749 -3.319 2.370 1.00 64.22 C ATOM 6 OG1 THR A 815 -0.571 -4.490 3.184 1.00 69.87 O ATOM 7 CG2 THR A 815 0.067 -3.421 1.090 1.00 63.86 C ATOM 8 HG1 THR A 815 -0.791 -5.296 2.653 1.00 0.00 H ATOM 9 HN3 THR A 815 0.603 -2.970 4.732 1.00 0.00 H ATOM 10 HN2 THR A 815 1.052 -1.355 4.456 1.00 0.00 H ATOM 11 HN1 THR A 815 1.574 -2.575 3.395 1.00 0.00 H ATOM 12 N ILE A 816 -1.575 -1.835 5.348 1.00 46.14 N ATOM 13 CA ILE A 816 -2.638 -1.399 6.252 1.00 45.74 C ATOM 14 C ILE A 816 -2.036 -0.404 7.234 1.00 45.91 C ATOM 15 O ILE A 816 -1.026 -0.688 7.881 1.00 46.31 O ATOM 16 CB ILE A 816 -3.463 -2.543 6.919 1.00 49.73 C ATOM 17 CG1 ILE A 816 -3.965 -3.563 5.878 1.00 50.37 C ATOM 18 CG2 ILE A 816 -4.664 -1.968 7.691 1.00 51.10 C ATOM 19 H ILE A 816 -0.766 -2.358 5.740 1.00 0.00 H ATOM 20 N PHE A 817 -2.606 0.803 7.254 1.00 37.32 N ATOM 21 CA PHE A 817 -2.160 1.890 8.106 1.00 34.85 C ATOM 22 C PHE A 817 -3.223 2.117 9.170 1.00 38.25 C ATOM 23 O PHE A 817 -4.401 2.215 8.850 1.00 37.53 O ATOM 24 CB PHE A 817 -1.932 3.166 7.250 1.00 34.71 C ATOM 25 CG PHE A 817 -0.721 3.085 6.344 1.00 33.30 C ATOM 26 CD1 PHE A 817 -0.768 2.367 5.155 1.00 33.71 C ATOM 27 CD2 PHE A 817 0.463 3.729 6.679 1.00 32.89 C ATOM 28 CE1 PHE A 817 0.355 2.268 4.332 1.00 33.93 C ATOM 29 CE2 PHE A 817 1.588 3.628 5.853 1.00 35.23 C ATOM 30 CZ PHE A 817 1.519 2.912 4.676 1.00 32.26 C ATOM 31 H PHE A 817 -3.415 0.974 6.624 1.00 0.00 H ATOM 32 N GLU A 818 -2.821 2.125 10.434 1.00 35.78 N ATOM 33 CA GLU A 818 -3.753 2.357 11.534 1.00 35.59 C ATOM 34 C GLU A 818 -4.047 3.847 11.629 1.00 40.62 C ATOM 35 O GLU A 818 -3.107 4.654 11.644 1.00 40.01 O ATOM 36 CB GLU A 818 -3.171 1.825 12.860 1.00 36.65 C ATOM 37 CG GLU A 818 -2.828 0.349 12.786 1.00 47.53 C ATOM 38 CD GLU A 818 -3.033 -0.410 14.077 1.00 77.13 C ATOM 39 OE1 GLU A 818 -2.040 -0.605 14.815 1.00 78.68 O ATOM 40 OE2 GLU A 818 -4.199 -0.748 14.386 1.00 68.84 O ATOM 41 H GLU A 818 -1.816 1.962 10.647 1.00 0.00 H ATOM 42 N GLU A 819 -5.357 4.201 11.704 1.00 37.72 N ATOM 43 CA GLU A 819 -5.896 5.560 11.840 1.00 37.31 C ATOM 44 C GLU A 819 -5.151 6.381 12.884 1.00 39.41 C ATOM 45 O GLU A 819 -4.738 7.511 12.608 1.00 38.08 O ATOM 46 CB GLU A 819 -7.381 5.504 12.265 1.00 38.92 C ATOM 47 CG GLU A 819 -8.398 5.576 11.141 1.00 49.98 C ATOM 48 CD GLU A 819 -8.329 6.824 10.285 1.00 68.12 C ATOM 49 OE1 GLU A 819 -7.805 6.718 9.154 1.00 56.23 O ATOM 50 OE2 GLU A 819 -8.819 7.891 10.724 1.00 56.29 O ATOM 51 H GLU A 819 -6.051 3.428 11.660 1.00 0.00 H ATOM 52 N ARG A 820 -5.001 5.816 14.095 1.00 35.12 N ATOM 53 CA ARG A 820 -4.383 6.493 15.228 1.00 34.31 C ATOM 54 C ARG A 820 -2.920 6.888 15.002 1.00 36.45 C ATOM 55 O ARG A 820 -2.451 7.805 15.664 1.00 37.55 O ATOM 56 CB ARG A 820 -4.550 5.678 16.525 1.00 34.47 C ATOM 57 CG ARG A 820 -3.782 4.364 16.555 1.00 39.92 C ATOM 58 CD ARG A 820 -4.117 3.571 17.805 1.00 46.40 C ATOM 59 NE ARG A 820 -3.104 2.554 18.062 1.00 55.84 N ATOM 60 CZ ARG A 820 -3.068 1.371 17.460 1.00 65.27 C ATOM 61 NH1 ARG A 820 -2.092 0.514 17.729 1.00 49.36 N ATOM 62 NH2 ARG A 820 -4.003 1.039 16.575 1.00 47.49 N ATOM 63 HE ARG A 820 -2.364 2.769 18.760 1.00 0.00 H ATOM 64 HH12 ARG A 820 -2.067 -0.412 17.255 1.00 0.00 H ATOM 65 HH11 ARG A 820 -1.351 0.768 18.414 1.00 0.00 H ATOM 66 HH22 ARG A 820 -3.970 0.111 16.107 1.00 0.00 H ATOM 67 HH21 ARG A 820 -4.768 1.707 16.351 1.00 0.00 H ATOM 68 H ARG A 820 -5.344 4.844 14.230 1.00 0.00 H ATOM 69 N HIS A 821 -2.206 6.207 14.096 1.00 33.01 N ATOM 70 CA HIS A 821 -0.806 6.519 13.826 1.00 33.02 C ATOM 71 C HIS A 821 -0.606 7.551 12.705 1.00 37.56 C ATOM 72 O HIS A 821 0.498 8.077 12.567 1.00 36.60 O ATOM 73 CB HIS A 821 0.012 5.244 13.577 1.00 33.60 C ATOM 74 CG HIS A 821 0.066 4.319 14.762 1.00 37.35 C ATOM 75 ND1 HIS A 821 0.124 4.802 16.055 1.00 38.95 N ATOM 76 CD2 HIS A 821 0.107 2.966 14.800 1.00 38.90 C ATOM 77 CE1 HIS A 821 0.165 3.734 16.835 1.00 38.23 C ATOM 78 NE2 HIS A 821 0.177 2.611 16.124 1.00 38.63 N ATOM 79 H HIS A 821 -2.662 5.434 13.570 1.00 0.00 H ATOM 80 N LEU A 822 -1.650 7.856 11.916 1.00 34.24 N ATOM 81 CA LEU A 822 -1.524 8.866 10.862 1.00 33.21 C ATOM 82 C LEU A 822 -1.729 10.224 11.486 1.00 35.71 C ATOM 83 O LEU A 822 -2.831 10.527 11.946 1.00 36.82 O ATOM 84 CB LEU A 822 -2.545 8.630 9.726 1.00 33.89 C ATOM 85 CG LEU A 822 -2.240 7.523 8.725 1.00 38.66 C ATOM 86 CD1 LEU A 822 -3.466 7.217 7.884 1.00 38.41 C ATOM 87 CD2 LEU A 822 -1.071 7.894 7.820 1.00 42.37 C ATOM 88 H LEU A 822 -2.558 7.369 12.055 1.00 0.00 H ATOM 89 N LYS A 823 -0.661 11.034 11.561 1.00 30.40 N ATOM 90 CA LYS A 823 -0.689 12.372 12.164 1.00 28.51 C ATOM 91 C LYS A 823 -0.861 13.473 11.128 1.00 34.04 C ATOM 92 O LYS A 823 0.003 13.639 10.256 1.00 33.52 O ATOM 93 CB LYS A 823 0.566 12.613 13.036 1.00 29.35 C ATOM 94 CG LYS A 823 0.947 11.432 13.973 1.00 42.04 C ATOM 95 CD LYS A 823 -0.169 11.024 14.984 1.00 51.39 C ATOM 96 CE LYS A 823 0.307 10.310 16.236 1.00 62.25 C ATOM 97 NZ LYS A 823 0.952 9.001 15.955 1.00 71.29 N ATOM 98 HZ1 LYS A 823 0.272 8.377 15.476 1.00 0.00 H ATOM 99 HZ2 LYS A 823 1.780 9.148 15.343 1.00 0.00 H ATOM 100 HZ3 LYS A 823 1.254 8.565 16.850 1.00 0.00 H ATOM 101 H LYS A 823 0.240 10.693 11.169 1.00 0.00 H ATOM 102 N TYR A 824 -1.948 14.260 11.240 1.00 30.52 N ATOM 103 CA TYR A 824 -2.242 15.338 10.283 1.00 30.91 C ATOM 104 C TYR A 824 -1.198 16.446 10.331 1.00 35.83 C ATOM 105 O TYR A 824 -0.851 16.906 11.414 1.00 34.20 O ATOM 106 CB TYR A 824 -3.652 15.918 10.500 1.00 32.57 C ATOM 107 CG TYR A 824 -3.910 17.168 9.685 1.00 34.99 C ATOM 108 CD1 TYR A 824 -4.232 17.089 8.330 1.00 36.90 C ATOM 109 CD2 TYR A 824 -3.807 18.431 10.260 1.00 35.66 C ATOM 110 CE1 TYR A 824 -4.459 18.238 7.573 1.00 36.22 C ATOM 111 CE2 TYR A 824 -4.013 19.586 9.507 1.00 36.58 C ATOM 112 CZ TYR A 824 -4.368 19.483 8.172 1.00 40.88 C ATOM 113 OH TYR A 824 -4.548 20.621 7.423 1.00 41.07 O ATOM 114 HH TYR A 824 -4.797 20.370 6.498 1.00 0.00 H ATOM 115 H TYR A 824 -2.603 14.100 12.032 1.00 0.00 H ATOM 116 N ILE A 825 -0.715 16.894 9.153 1.00 33.41 N ATOM 117 CA ILE A 825 0.273 17.970 9.108 1.00 33.92 C ATOM 118 C ILE A 825 -0.284 19.187 8.388 1.00 36.42 C ATOM 119 O ILE A 825 -0.313 20.260 8.974 1.00 35.96 O ATOM 120 CB ILE A 825 1.652 17.492 8.562 1.00 37.40 C ATOM 121 CG1 ILE A 825 2.291 16.513 9.591 1.00 38.72 C ATOM 122 CG2 ILE A 825 2.585 18.700 8.257 1.00 37.69 C ATOM 123 CD1 ILE A 825 3.556 15.890 9.167 1.00 51.15 C ATOM 124 H ILE A 825 -1.050 16.468 8.266 1.00 0.00 H ATOM 125 N SER A 826 -0.740 19.027 7.129 1.00 31.99 N ATOM 126 CA SER A 826 -1.278 20.147 6.368 1.00 31.17 C ATOM 127 C SER A 826 -2.123 19.672 5.203 1.00 35.19 C ATOM 128 O SER A 826 -2.169 18.475 4.896 1.00 33.17 O ATOM 129 CB SER A 826 -0.147 21.053 5.865 1.00 32.62 C ATOM 130 OG SER A 826 0.791 20.299 5.120 1.00 39.57 O ATOM 131 HG SER A 826 1.514 20.896 4.802 1.00 0.00 H ATOM 132 H SER A 826 -0.707 18.084 6.692 1.00 0.00 H ATOM 133 N GLN A 827 -2.771 20.622 4.526 1.00 33.30 N ATOM 134 CA GLN A 827 -3.569 20.307 3.354 1.00 33.71 C ATOM 135 C GLN A 827 -2.657 20.357 2.151 1.00 37.07 C ATOM 136 O GLN A 827 -1.861 21.293 2.038 1.00 37.12 O ATOM 137 CB GLN A 827 -4.682 21.360 3.173 1.00 35.79 C ATOM 138 CG GLN A 827 -5.735 21.336 4.272 1.00 49.27 C ATOM 139 CD GLN A 827 -6.549 20.067 4.247 1.00 68.59 C ATOM 140 OE1 GLN A 827 -7.000 19.597 3.187 1.00 64.72 O ATOM 141 NE2 GLN A 827 -6.752 19.491 5.426 1.00 53.96 N ATOM 142 HE22 GLN A 827 -6.357 19.918 6.288 1.00 0.00 H ATOM 143 HE21 GLN A 827 -7.306 18.613 5.487 1.00 0.00 H ATOM 144 H GLN A 827 -2.703 21.610 4.845 1.00 0.00 H ATOM 145 N LEU A 828 -2.740 19.359 1.262 1.00 32.41 N ATOM 146 CA LEU A 828 -1.967 19.422 0.007 1.00 33.27 C ATOM 147 C LEU A 828 -2.895 19.904 -1.097 1.00 42.47 C ATOM 148 O LEU A 828 -2.498 20.731 -1.908 1.00 41.74 O ATOM 149 CB LEU A 828 -1.292 18.094 -0.373 1.00 32.75 C ATOM 150 CG LEU A 828 -0.186 17.622 0.566 1.00 35.08 C ATOM 151 CD1 LEU A 828 0.205 16.196 0.265 1.00 34.90 C ATOM 152 CD2 LEU A 828 1.022 18.554 0.525 1.00 34.12 C ATOM 153 H LEU A 828 -3.350 18.539 1.456 1.00 0.00 H ATOM 154 N GLY A 829 -4.138 19.431 -1.068 1.00 44.41 N ATOM 155 CA GLY A 829 -5.145 19.811 -2.045 1.00 46.81 C ATOM 156 C GLY A 829 -6.563 19.419 -1.706 1.00 56.54 C ATOM 157 O GLY A 829 -6.819 18.669 -0.756 1.00 55.84 O ATOM 158 H GLY A 829 -4.400 18.762 -0.316 1.00 0.00 H ATOM 159 N LYS A 830 -7.490 19.978 -2.489 1.00 57.33 N ATOM 160 CA LYS A 830 -8.935 19.746 -2.460 1.00 58.68 C ATOM 161 C LYS A 830 -9.323 19.615 -3.943 1.00 67.70 C ATOM 162 O LYS A 830 -8.818 20.373 -4.782 1.00 67.88 O ATOM 163 CB LYS A 830 -9.676 20.908 -1.741 1.00 60.55 C ATOM 164 CG LYS A 830 -11.209 20.960 -1.900 1.00 64.66 C ATOM 165 CD LYS A 830 -12.003 19.800 -1.240 1.00 63.64 C ATOM 166 CE LYS A 830 -13.267 19.509 -2.032 1.00 61.82 C ATOM 167 NZ LYS A 830 -14.017 18.280 -1.581 1.00 46.48 N ATOM 168 HZ1 LYS A 830 -13.402 17.447 -1.674 1.00 0.00 H ATOM 169 HZ2 LYS A 830 -14.301 18.394 -0.587 1.00 0.00 H ATOM 170 HZ3 LYS A 830 -14.863 18.155 -2.172 1.00 0.00 H ATOM 171 H LYS A 830 -7.146 20.655 -3.200 1.00 0.00 H ATOM 172 N GLY A 831 -10.134 18.612 -4.261 1.00 67.03 N ATOM 173 CA GLY A 831 -10.530 18.354 -5.639 1.00 67.83 C ATOM 174 C GLY A 831 -11.996 18.043 -5.811 1.00 73.04 C ATOM 175 O GLY A 831 -12.850 18.811 -5.361 1.00 73.10 O ATOM 176 H GLY A 831 -10.496 17.995 -3.506 1.00 0.00 H ATOM 177 N ASN A 832 -12.288 16.928 -6.506 1.00 69.81 N ATOM 178 CA ASN A 832 -13.653 16.468 -6.764 1.00 68.72 C ATOM 179 C ASN A 832 -14.102 15.606 -5.589 1.00 68.07 C ATOM 180 O ASN A 832 -13.638 14.471 -5.455 1.00 67.72 O ATOM 181 CB ASN A 832 -13.731 15.687 -8.084 1.00 71.36 C ATOM 182 H ASN A 832 -11.500 16.362 -6.880 1.00 0.00 H ATOM 183 N PHE A 833 -14.940 16.188 -4.692 1.00 60.73 N ATOM 184 CA PHE A 833 -15.520 15.552 -3.498 1.00 59.10 C ATOM 185 C PHE A 833 -14.481 14.975 -2.483 1.00 58.99 C ATOM 186 O PHE A 833 -14.865 14.266 -1.538 1.00 59.69 O ATOM 187 CB PHE A 833 -16.555 14.474 -3.896 1.00 60.95 C ATOM 188 H PHE A 833 -15.197 17.181 -4.866 1.00 0.00 H ATOM 189 N GLY A 834 -13.206 15.315 -2.651 1.00 50.66 N ATOM 190 CA GLY A 834 -12.177 14.845 -1.732 1.00 49.44 C ATOM 191 C GLY A 834 -11.039 15.807 -1.456 1.00 49.43 C ATOM 192 O GLY A 834 -10.916 16.856 -2.090 1.00 48.69 O ATOM 193 H GLY A 834 -12.939 15.925 -3.450 1.00 0.00 H ATOM 194 N SER A 835 -10.178 15.419 -0.523 1.00 43.03 N ATOM 195 CA SER A 835 -8.991 16.195 -0.147 1.00 41.21 C ATOM 196 C SER A 835 -7.797 15.259 -0.022 1.00 38.65 C ATOM 197 O SER A 835 -7.962 14.093 0.308 1.00 36.26 O ATOM 198 CB SER A 835 -9.212 16.874 1.201 1.00 44.04 C ATOM 199 OG SER A 835 -9.291 15.914 2.246 1.00 51.79 O ATOM 200 HG SER A 835 -8.447 15.398 2.283 1.00 0.00 H ATOM 201 H SER A 835 -10.354 14.519 -0.033 1.00 0.00 H ATOM 202 N VAL A 836 -6.609 15.794 -0.254 1.00 34.16 N ATOM 203 CA VAL A 836 -5.330 15.117 -0.081 1.00 32.25 C ATOM 204 C VAL A 836 -4.593 15.887 1.020 1.00 33.32 C ATOM 205 O VAL A 836 -4.474 17.111 0.952 1.00 31.97 O ATOM 206 CB VAL A 836 -4.496 15.029 -1.383 1.00 34.75 C ATOM 207 CG1 VAL A 836 -3.274 14.138 -1.172 1.00 34.06 C ATOM 208 CG2 VAL A 836 -5.345 14.504 -2.545 1.00 34.35 C ATOM 209 H VAL A 836 -6.586 16.779 -0.587 1.00 0.00 H ATOM 210 N GLU A 837 -4.133 15.166 2.044 1.00 29.80 N ATOM 211 CA GLU A 837 -3.435 15.757 3.169 1.00 28.76 C ATOM 212 C GLU A 837 -2.059 15.167 3.329 1.00 30.30 C ATOM 213 O GLU A 837 -1.834 13.994 3.045 1.00 28.83 O ATOM 214 CB GLU A 837 -4.206 15.504 4.480 1.00 30.11 C ATOM 215 CG GLU A 837 -5.587 16.131 4.472 1.00 38.30 C ATOM 216 CD GLU A 837 -6.419 15.931 5.717 1.00 51.81 C ATOM 217 OE1 GLU A 837 -6.205 14.928 6.439 1.00 38.05 O ATOM 218 OE2 GLU A 837 -7.338 16.754 5.934 1.00 48.77 O ATOM 219 H GLU A 837 -4.281 14.137 2.035 1.00 0.00 H ATOM 220 N LEU A 838 -1.152 15.986 3.830 1.00 27.37 N ATOM 221 CA LEU A 838 0.169 15.546 4.210 1.00 25.41 C ATOM 222 C LEU A 838 0.036 15.077 5.663 1.00 29.97 C ATOM 223 O LEU A 838 -0.468 15.815 6.527 1.00 28.99 O ATOM 224 CB LEU A 838 1.201 16.685 4.062 1.00 24.39 C ATOM 225 CG LEU A 838 2.611 16.369 4.603 1.00 27.87 C ATOM 226 CD1 LEU A 838 3.265 15.193 3.847 1.00 25.25 C ATOM 227 CD2 LEU A 838 3.510 17.628 4.587 1.00 30.94 C ATOM 228 H LEU A 838 -1.400 16.988 3.956 1.00 0.00 H ATOM 229 N CYS A 839 0.442 13.826 5.903 1.00 28.54 N ATOM 230 CA CYS A 839 0.438 13.182 7.215 1.00 29.36 C ATOM 231 C CYS A 839 1.775 12.592 7.469 1.00 32.27 C ATOM 232 O CYS A 839 2.480 12.258 6.523 1.00 31.07 O ATOM 233 CB CYS A 839 -0.637 12.091 7.292 1.00 29.52 C ATOM 234 SG CYS A 839 -2.334 12.696 7.128 1.00 33.51 S ATOM 235 H CYS A 839 0.787 13.269 5.095 1.00 0.00 H ATOM 236 N ARG A 840 2.075 12.334 8.737 1.00 28.64 N ATOM 237 CA ARG A 840 3.256 11.575 9.095 1.00 27.67 C ATOM 238 C ARG A 840 2.745 10.245 9.632 1.00 32.19 C ATOM 239 O ARG A 840 1.918 10.229 10.562 1.00 31.64 O ATOM 240 CB ARG A 840 4.072 12.308 10.180 1.00 26.47 C ATOM 241 CG ARG A 840 5.367 11.588 10.528 1.00 30.37 C ATOM 242 CD ARG A 840 6.156 12.277 11.641 1.00 32.82 C ATOM 243 NE ARG A 840 6.415 13.695 11.383 1.00 32.66 N ATOM 244 CZ ARG A 840 7.356 14.176 10.572 1.00 43.47 C ATOM 245 NH1 ARG A 840 8.140 13.352 9.889 1.00 31.31 N ATOM 246 NH2 ARG A 840 7.512 15.484 10.432 1.00 40.58 N ATOM 247 HE ARG A 840 5.813 14.386 11.875 1.00 0.00 H ATOM 248 HH12 ARG A 840 8.872 13.735 9.258 1.00 0.00 H ATOM 249 HH11 ARG A 840 8.022 12.323 9.985 1.00 0.00 H ATOM 250 HH22 ARG A 840 8.248 15.855 9.798 1.00 0.00 H ATOM 251 HH21 ARG A 840 6.898 16.140 10.956 1.00 0.00 H ATOM 252 H ARG A 840 1.448 12.685 9.489 1.00 0.00 H ATOM 253 N TYR A 841 3.240 9.128 9.096 1.00 30.42 N ATOM 254 CA TYR A 841 2.856 7.852 9.675 1.00 31.00 C ATOM 255 C TYR A 841 3.853 7.665 10.820 1.00 35.04 C ATOM 256 O TYR A 841 5.024 7.378 10.586 1.00 32.95 O ATOM 257 CB TYR A 841 2.845 6.692 8.677 1.00 33.55 C ATOM 258 CG TYR A 841 2.211 5.456 9.300 1.00 38.11 C ATOM 259 CD1 TYR A 841 0.931 5.504 9.844 1.00 40.89 C ATOM 260 CD2 TYR A 841 2.891 4.241 9.341 1.00 39.19 C ATOM 261 CE1 TYR A 841 0.330 4.370 10.392 1.00 43.54 C ATOM 262 CE2 TYR A 841 2.321 3.111 9.941 1.00 40.62 C ATOM 263 CZ TYR A 841 1.044 3.187 10.480 1.00 50.86 C ATOM 264 OH TYR A 841 0.434 2.091 11.059 1.00 56.55 O ATOM 265 HH TYR A 841 -0.466 2.348 11.381 1.00 0.00 H ATOM 266 H TYR A 841 3.886 9.170 8.282 1.00 0.00 H ATOM 267 N ASP A 842 3.399 7.990 12.040 1.00 31.62 N ATOM 268 CA ASP A 842 4.224 8.067 13.241 1.00 31.32 C ATOM 269 C ASP A 842 3.841 7.086 14.370 1.00 35.28 C ATOM 270 O ASP A 842 3.414 7.548 15.438 1.00 33.47 O ATOM 271 CB ASP A 842 4.196 9.517 13.747 1.00 32.19 C ATOM 272 CG ASP A 842 5.427 9.914 14.541 1.00 36.84 C ATOM 273 OD1 ASP A 842 6.531 9.407 14.220 1.00 34.74 O ATOM 274 OD2 ASP A 842 5.300 10.781 15.432 1.00 37.92 O ATOM 275 H ASP A 842 2.386 8.202 12.137 1.00 0.00 H ATOM 276 N PRO A 843 4.003 5.745 14.180 1.00 34.24 N ATOM 277 CA PRO A 843 3.649 4.806 15.262 1.00 34.82 C ATOM 278 C PRO A 843 4.443 5.030 16.560 1.00 41.51 C ATOM 279 O PRO A 843 3.913 4.780 17.649 1.00 42.18 O ATOM 280 CB PRO A 843 3.904 3.421 14.647 1.00 36.48 C ATOM 281 CG PRO A 843 4.875 3.657 13.534 1.00 40.31 C ATOM 282 CD PRO A 843 4.536 5.026 13.000 1.00 35.92 C ATOM 283 N LEU A 844 5.671 5.592 16.465 1.00 38.17 N ATOM 284 CA LEU A 844 6.453 5.868 17.680 1.00 37.89 C ATOM 285 C LEU A 844 5.994 7.132 18.417 1.00 40.74 C ATOM 286 O LEU A 844 6.349 7.301 19.585 1.00 40.37 O ATOM 287 CB LEU A 844 7.969 5.897 17.398 1.00 38.44 C ATOM 288 CG LEU A 844 8.566 4.628 16.739 1.00 43.49 C ATOM 289 CD1 LEU A 844 10.023 4.838 16.364 1.00 43.96 C ATOM 290 CD2 LEU A 844 8.413 3.392 17.619 1.00 45.87 C ATOM 291 H LEU A 844 6.062 5.829 15.531 1.00 0.00 H ATOM 292 N GLY A 845 5.212 7.991 17.744 1.00 34.50 N ATOM 293 CA GLY A 845 4.689 9.243 18.298 1.00 33.84 C ATOM 294 C GLY A 845 5.753 10.261 18.686 1.00 39.43 C ATOM 295 O GLY A 845 5.528 11.090 19.572 1.00 38.67 O ATOM 296 H GLY A 845 4.960 7.752 16.764 1.00 0.00 H ATOM 297 N ASP A 846 6.921 10.221 18.015 1.00 34.95 N ATOM 298 CA ASP A 846 8.062 11.073 18.371 1.00 34.03 C ATOM 299 C ASP A 846 8.523 11.993 17.246 1.00 37.74 C ATOM 300 O ASP A 846 9.605 12.592 17.357 1.00 36.66 O ATOM 301 CB ASP A 846 9.217 10.180 18.857 1.00 34.86 C ATOM 302 CG ASP A 846 9.742 9.214 17.814 1.00 40.53 C ATOM 303 OD1 ASP A 846 9.200 9.204 16.682 1.00 41.33 O ATOM 304 OD2 ASP A 846 10.679 8.456 18.132 1.00 43.69 O ATOM 305 H ASP A 846 7.017 9.562 17.216 1.00 0.00 H ATOM 306 N ASN A 847 7.694 12.091 16.156 1.00 32.75 N ATOM 307 CA ASN A 847 7.903 12.921 14.959 1.00 32.56 C ATOM 308 C ASN A 847 9.003 12.399 14.028 1.00 37.60 C ATOM 309 O ASN A 847 9.443 13.137 13.140 1.00 37.82 O ATOM 310 CB ASN A 847 8.153 14.389 15.324 1.00 31.63 C ATOM 311 CG ASN A 847 7.015 15.070 16.058 1.00 45.46 C ATOM 312 OD1 ASN A 847 5.848 14.706 15.922 1.00 41.37 O ATOM 313 ND2 ASN A 847 7.333 16.110 16.817 1.00 33.74 N ATOM 314 HD22 ASN A 847 8.328 16.397 16.915 1.00 0.00 H ATOM 315 HD21 ASN A 847 6.588 16.638 17.314 1.00 0.00 H ATOM 316 H ASN A 847 6.826 11.518 16.179 1.00 0.00 H ATOM 317 N THR A 848 9.407 11.128 14.187 1.00 33.04 N ATOM 318 CA THR A 848 10.465 10.546 13.342 1.00 33.61 C ATOM 319 C THR A 848 9.919 9.715 12.163 1.00 37.41 C ATOM 320 O THR A 848 10.680 9.383 11.259 1.00 37.09 O ATOM 321 CB THR A 848 11.481 9.750 14.189 1.00 37.35 C ATOM 322 OG1 THR A 848 10.841 8.603 14.733 1.00 37.20 O ATOM 323 CG2 THR A 848 12.104 10.592 15.313 1.00 34.53 C ATOM 324 HG1 THR A 848 10.084 8.888 15.304 1.00 0.00 H ATOM 325 H THR A 848 8.963 10.542 14.923 1.00 0.00 H ATOM 326 N GLY A 849 8.618 9.400 12.167 1.00 33.72 N ATOM 327 CA GLY A 849 7.989 8.625 11.090 1.00 33.03 C ATOM 328 C GLY A 849 8.017 9.318 9.729 1.00 37.27 C ATOM 329 O GLY A 849 8.300 10.526 9.636 1.00 35.13 O ATOM 330 H GLY A 849 8.030 9.717 12.964 1.00 0.00 H ATOM 331 N ALA A 850 7.778 8.526 8.663 1.00 33.80 N ATOM 332 CA ALA A 850 7.782 8.959 7.265 1.00 33.52 C ATOM 333 C ALA A 850 6.516 9.729 6.894 1.00 34.74 C ATOM 334 O ALA A 850 5.437 9.477 7.430 1.00 33.01 O ATOM 335 CB ALA A 850 7.948 7.760 6.341 1.00 33.94 C ATOM 336 H ALA A 850 7.574 7.524 8.851 1.00 0.00 H ATOM 337 N LEU A 851 6.679 10.697 6.005 1.00 31.16 N ATOM 338 CA LEU A 851 5.612 11.516 5.458 1.00 30.70 C ATOM 339 C LEU A 851 4.883 10.752 4.352 1.00 31.37 C ATOM 340 O LEU A 851 5.513 10.058 3.560 1.00 30.74 O ATOM 341 CB LEU A 851 6.175 12.842 4.909 1.00 30.29 C ATOM 342 CG LEU A 851 6.864 13.766 5.916 1.00 34.05 C ATOM 343 CD1 LEU A 851 7.383 14.999 5.217 1.00 33.72 C ATOM 344 CD2 LEU A 851 5.905 14.198 7.028 1.00 35.38 C ATOM 345 H LEU A 851 7.646 10.885 5.673 1.00 0.00 H ATOM 346 N VAL A 852 3.555 10.863 4.311 1.00 25.63 N ATOM 347 CA VAL A 852 2.729 10.195 3.277 1.00 24.29 C ATOM 348 C VAL A 852 1.656 11.186 2.803 1.00 28.28 C ATOM 349 O VAL A 852 1.291 12.086 3.557 1.00 27.62 O ATOM 350 CB VAL A 852 2.058 8.882 3.795 1.00 28.32 C ATOM 351 CG1 VAL A 852 3.055 7.713 3.880 1.00 28.14 C ATOM 352 CG2 VAL A 852 1.341 9.101 5.137 1.00 27.61 C ATOM 353 H VAL A 852 3.080 11.441 5.033 1.00 0.00 H ATOM 354 N ALA A 853 1.135 11.012 1.583 1.00 26.43 N ATOM 355 CA ALA A 853 0.040 11.839 1.051 1.00 26.85 C ATOM 356 C ALA A 853 -1.222 10.955 1.204 1.00 31.21 C ATOM 357 O ALA A 853 -1.230 9.773 0.812 1.00 30.00 O ATOM 358 CB ALA A 853 0.290 12.183 -0.410 1.00 27.35 C ATOM 359 H ALA A 853 1.522 10.257 0.982 1.00 0.00 H ATOM 360 N VAL A 854 -2.237 11.489 1.896 1.00 27.82 N ATOM 361 CA VAL A 854 -3.429 10.722 2.243 1.00 26.75 C ATOM 362 C VAL A 854 -4.688 11.352 1.656 1.00 30.58 C ATOM 363 O VAL A 854 -5.011 12.500 1.966 1.00 29.43 O ATOM 364 CB VAL A 854 -3.529 10.497 3.788 1.00 30.22 C ATOM 365 CG1 VAL A 854 -4.688 9.566 4.128 1.00 29.56 C ATOM 366 CG2 VAL A 854 -2.220 9.922 4.361 1.00 29.69 C ATOM 367 H VAL A 854 -2.173 12.483 2.196 1.00 0.00 H ATOM 368 N LYS A 855 -5.414 10.583 0.831 1.00 28.83 N ATOM 369 CA LYS A 855 -6.653 11.058 0.234 1.00 28.19 C ATOM 370 C LYS A 855 -7.835 10.424 0.960 1.00 33.88 C ATOM 371 O LYS A 855 -7.792 9.257 1.316 1.00 30.87 O ATOM 372 CB LYS A 855 -6.723 10.718 -1.259 1.00 30.66 C ATOM 373 CG LYS A 855 -8.016 11.233 -1.889 1.00 30.39 C ATOM 374 CD LYS A 855 -8.190 10.916 -3.346 1.00 35.74 C ATOM 375 CE LYS A 855 -9.571 11.377 -3.789 1.00 38.29 C ATOM 376 NZ LYS A 855 -9.696 11.416 -5.277 1.00 40.67 N ATOM 377 HZ1 LYS A 855 -8.992 12.076 -5.666 1.00 0.00 H ATOM 378 HZ2 LYS A 855 -9.531 10.464 -5.663 1.00 0.00 H ATOM 379 HZ3 LYS A 855 -10.652 11.735 -5.535 1.00 0.00 H ATOM 380 H LYS A 855 -5.083 9.622 0.612 1.00 0.00 H ATOM 381 N GLN A 856 -8.898 11.206 1.163 1.00 34.82 N ATOM 382 CA GLN A 856 -10.143 10.771 1.798 1.00 35.38 C ATOM 383 C GLN A 856 -11.306 11.568 1.202 1.00 41.97 C ATOM 384 O GLN A 856 -11.081 12.638 0.626 1.00 39.62 O ATOM 385 CB GLN A 856 -10.088 10.961 3.331 1.00 36.93 C ATOM 386 CG GLN A 856 -9.588 12.336 3.823 1.00 44.11 C ATOM 387 CD GLN A 856 -8.082 12.458 3.857 1.00 49.79 C ATOM 388 OE1 GLN A 856 -7.492 13.359 3.254 1.00 45.13 O ATOM 389 NE2 GLN A 856 -7.421 11.533 4.522 1.00 35.94 N ATOM 390 HE22 GLN A 856 -7.939 10.783 5.023 1.00 0.00 H ATOM 391 HE21 GLN A 856 -6.381 11.553 4.546 1.00 0.00 H ATOM 392 H GLN A 856 -8.837 12.195 0.847 1.00 0.00 H ATOM 393 N LEU A 857 -12.535 11.045 1.318 1.00 43.27 N ATOM 394 CA LEU A 857 -13.719 11.767 0.839 1.00 46.26 C ATOM 395 C LEU A 857 -14.065 12.838 1.869 1.00 58.41 C ATOM 396 O LEU A 857 -14.070 12.540 3.062 1.00 58.29 O ATOM 397 CB LEU A 857 -14.906 10.820 0.624 1.00 46.30 C ATOM 398 CG LEU A 857 -14.772 9.831 -0.537 1.00 50.87 C ATOM 399 CD1 LEU A 857 -16.028 9.010 -0.671 1.00 50.98 C ATOM 400 CD2 LEU A 857 -14.470 10.542 -1.865 1.00 52.36 C ATOM 401 H LEU A 857 -12.651 10.109 1.756 1.00 0.00 H ATOM 402 N GLN A 858 -14.293 14.089 1.423 1.00 60.91 N ATOM 403 CA GLN A 858 -14.581 15.214 2.323 1.00 63.32 C ATOM 404 C GLN A 858 -15.895 15.049 3.114 1.00 73.87 C ATOM 405 O GLN A 858 -15.888 15.190 4.338 1.00 73.71 O ATOM 406 CB GLN A 858 -14.530 16.545 1.563 1.00 64.51 C ATOM 407 CG GLN A 858 -13.103 17.030 1.308 1.00 74.89 C ATOM 408 CD GLN A 858 -12.536 17.833 2.449 1.00 90.09 C ATOM 409 OE1 GLN A 858 -12.469 17.385 3.597 1.00 85.41 O ATOM 410 NE2 GLN A 858 -12.084 19.037 2.149 1.00 85.12 N ATOM 411 HE22 GLN A 858 -12.153 19.390 1.173 1.00 0.00 H ATOM 412 HE21 GLN A 858 -11.659 19.632 2.889 1.00 0.00 H ATOM 413 H GLN A 858 -14.264 14.266 0.399 1.00 0.00 H ATOM 414 N HIS A 859 -16.996 14.720 2.419 1.00 75.54 N ATOM 415 CA HIS A 859 -18.326 14.494 2.989 1.00 77.81 C ATOM 416 C HIS A 859 -19.011 13.314 2.284 1.00 85.99 C ATOM 417 O HIS A 859 -18.778 13.091 1.089 1.00 85.68 O ATOM 418 CB HIS A 859 -19.195 15.776 2.954 1.00 78.99 C ATOM 419 CG HIS A 859 -19.780 16.117 1.613 1.00 82.86 C ATOM 420 ND1 HIS A 859 -19.142 16.991 0.744 1.00 84.84 N ATOM 421 CD2 HIS A 859 -20.952 15.727 1.055 1.00 84.77 C ATOM 422 CE1 HIS A 859 -19.925 17.073 -0.322 1.00 84.25 C ATOM 423 NE2 HIS A 859 -21.025 16.331 -0.183 1.00 84.52 N ATOM 424 H HIS A 859 -16.896 14.617 1.389 1.00 0.00 H ATOM 425 N SER A 860 -19.876 12.588 3.029 1.00 85.36 N ATOM 426 CA SER A 860 -20.623 11.392 2.608 1.00 86.14 C ATOM 427 C SER A 860 -21.409 11.514 1.296 1.00 90.94 C ATOM 428 O SER A 860 -21.848 12.599 0.908 1.00 90.68 O ATOM 429 CB SER A 860 -21.557 10.921 3.720 1.00 90.42 C ATOM 430 OG SER A 860 -21.115 9.686 4.259 1.00 99.61 O ATOM 431 HG SER A 860 -20.205 9.797 4.632 1.00 0.00 H ATOM 432 H SER A 860 -20.030 12.910 4.006 1.00 0.00 H ATOM 433 N GLY A 861 -21.580 10.363 0.656 1.00 88.18 N ATOM 434 CA GLY A 861 -22.278 10.169 -0.607 1.00 88.26 C ATOM 435 C GLY A 861 -22.140 8.720 -1.035 1.00 93.12 C ATOM 436 O GLY A 861 -21.050 8.151 -0.894 1.00 93.10 O ATOM 437 H GLY A 861 -21.175 9.515 1.102 1.00 0.00 H ATOM 438 N PRO A 862 -23.222 8.064 -1.520 1.00 89.64 N ATOM 439 CA PRO A 862 -23.096 6.645 -1.910 1.00 89.01 C ATOM 440 C PRO A 862 -22.313 6.428 -3.206 1.00 90.77 C ATOM 441 O PRO A 862 -21.535 5.476 -3.294 1.00 90.21 O ATOM 442 CB PRO A 862 -24.549 6.171 -2.020 1.00 90.94 C ATOM 443 CG PRO A 862 -25.331 7.400 -2.336 1.00 95.59 C ATOM 444 CD PRO A 862 -24.596 8.572 -1.736 1.00 91.23 C ATOM 445 N ASP A 863 -22.523 7.317 -4.199 1.00 85.62 N ATOM 446 CA ASP A 863 -21.885 7.294 -5.519 1.00 84.49 C ATOM 447 C ASP A 863 -20.396 7.619 -5.401 1.00 83.89 C ATOM 448 O ASP A 863 -19.577 6.967 -6.052 1.00 83.68 O ATOM 449 CB ASP A 863 -22.576 8.292 -6.471 1.00 86.86 C ATOM 450 CG ASP A 863 -24.083 8.132 -6.549 1.00100.86 C ATOM 451 OD1 ASP A 863 -24.547 7.225 -7.280 1.00101.72 O ATOM 452 OD2 ASP A 863 -24.800 8.912 -5.877 1.00107.37 O ATOM 453 H ASP A 863 -23.197 8.087 -4.012 1.00 0.00 H ATOM 454 N GLN A 864 -20.058 8.623 -4.563 1.00 76.65 N ATOM 455 CA GLN A 864 -18.692 9.076 -4.284 1.00 74.16 C ATOM 456 C GLN A 864 -17.873 7.968 -3.615 1.00 71.51 C ATOM 457 O GLN A 864 -16.699 7.805 -3.956 1.00 71.20 O ATOM 458 CB GLN A 864 -18.697 10.340 -3.407 1.00 75.59 C ATOM 459 CG GLN A 864 -19.142 11.608 -4.134 1.00 94.82 C ATOM 460 CD GLN A 864 -20.624 11.865 -3.991 1.00115.58 C ATOM 461 OE1 GLN A 864 -21.106 12.308 -2.943 1.00111.84 O ATOM 462 NE2 GLN A 864 -21.375 11.623 -5.056 1.00106.38 N ATOM 463 HE22 GLN A 864 -20.941 11.250 -5.924 1.00 0.00 H ATOM 464 HE21 GLN A 864 -22.398 11.806 -5.023 1.00 0.00 H ATOM 465 H GLN A 864 -20.832 9.116 -4.074 1.00 0.00 H ATOM 466 N GLN A 865 -18.502 7.198 -2.685 1.00 62.61 N ATOM 467 CA GLN A 865 -17.878 6.087 -1.952 1.00 60.25 C ATOM 468 C GLN A 865 -17.510 4.928 -2.876 1.00 60.64 C ATOM 469 O GLN A 865 -16.434 4.343 -2.731 1.00 59.55 O ATOM 470 CB GLN A 865 -18.774 5.619 -0.788 1.00 61.18 C ATOM 471 CG GLN A 865 -18.090 4.678 0.225 1.00 76.13 C ATOM 472 CD GLN A 865 -16.974 5.314 1.038 1.00 96.79 C ATOM 473 OE1 GLN A 865 -15.818 4.868 1.011 1.00 90.34 O ATOM 474 NE2 GLN A 865 -17.297 6.349 1.804 1.00 91.53 N ATOM 475 HE22 GLN A 865 -18.274 6.706 1.811 1.00 0.00 H ATOM 476 HE21 GLN A 865 -16.573 6.803 2.398 1.00 0.00 H ATOM 477 H GLN A 865 -19.498 7.412 -2.478 1.00 0.00 H ATOM 478 N ARG A 866 -18.410 4.596 -3.820 1.00 55.85 N ATOM 479 CA ARG A 866 -18.212 3.544 -4.815 1.00 54.69 C ATOM 480 C ARG A 866 -17.054 3.974 -5.736 1.00 55.01 C ATOM 481 O ARG A 866 -16.151 3.178 -5.988 1.00 54.21 O ATOM 482 CB ARG A 866 -19.514 3.322 -5.615 1.00 56.28 C ATOM 483 CG ARG A 866 -19.521 2.058 -6.467 1.00 70.29 C ATOM 484 CD ARG A 866 -20.634 2.085 -7.502 1.00 84.01 C ATOM 485 H ARG A 866 -19.306 5.123 -3.843 1.00 0.00 H ATOM 486 N ASP A 867 -17.068 5.251 -6.172 1.00 49.82 N ATOM 487 CA ASP A 867 -16.043 5.883 -7.017 1.00 49.35 C ATOM 488 C ASP A 867 -14.670 5.981 -6.296 1.00 49.17 C ATOM 489 O ASP A 867 -13.626 5.923 -6.946 1.00 48.09 O ATOM 490 CB ASP A 867 -16.498 7.289 -7.433 1.00 51.69 C ATOM 491 CG ASP A 867 -17.516 7.345 -8.564 1.00 64.22 C ATOM 492 OD1 ASP A 867 -17.380 6.564 -9.529 1.00 64.71 O ATOM 493 OD2 ASP A 867 -18.391 8.235 -8.529 1.00 72.63 O ATOM 494 H ASP A 867 -17.875 5.841 -5.885 1.00 0.00 H ATOM 495 N PHE A 868 -14.682 6.141 -4.966 1.00 41.58 N ATOM 496 CA PHE A 868 -13.437 6.228 -4.209 1.00 39.41 C ATOM 497 C PHE A 868 -12.784 4.845 -4.141 1.00 40.24 C ATOM 498 O PHE A 868 -11.601 4.735 -4.443 1.00 37.53 O ATOM 499 CB PHE A 868 -13.659 6.860 -2.825 1.00 40.32 C ATOM 500 CG PHE A 868 -12.405 7.040 -2.001 1.00 40.43 C ATOM 501 CD1 PHE A 868 -11.274 7.648 -2.543 1.00 43.08 C ATOM 502 CD2 PHE A 868 -12.371 6.652 -0.672 1.00 41.50 C ATOM 503 CE1 PHE A 868 -10.119 7.832 -1.767 1.00 43.29 C ATOM 504 CE2 PHE A 868 -11.213 6.828 0.096 1.00 43.73 C ATOM 505 CZ PHE A 868 -10.099 7.416 -0.459 1.00 40.86 C ATOM 506 H PHE A 868 -15.592 6.204 -4.466 1.00 0.00 H ATOM 507 N GLN A 869 -13.582 3.785 -3.845 1.00 38.19 N ATOM 508 CA GLN A 869 -13.139 2.387 -3.816 1.00 38.60 C ATOM 509 C GLN A 869 -12.579 1.959 -5.179 1.00 39.70 C ATOM 510 O GLN A 869 -11.596 1.232 -5.223 1.00 39.82 O ATOM 511 CB GLN A 869 -14.290 1.451 -3.377 1.00 41.08 C ATOM 512 CG GLN A 869 -13.845 0.017 -3.053 1.00 67.08 C ATOM 513 CD GLN A 869 -12.710 -0.052 -2.052 1.00 85.48 C ATOM 514 OE1 GLN A 869 -12.874 0.272 -0.872 1.00 83.56 O ATOM 515 NE2 GLN A 869 -11.533 -0.468 -2.507 1.00 68.11 N ATOM 516 HE22 GLN A 869 -11.426 -0.734 -3.507 1.00 0.00 H ATOM 517 HE21 GLN A 869 -10.718 -0.528 -1.863 1.00 0.00 H ATOM 518 H GLN A 869 -14.579 3.979 -3.623 1.00 0.00 H ATOM 519 N ARG A 870 -13.202 2.431 -6.274 1.00 35.31 N ATOM 520 CA ARG A 870 -12.806 2.208 -7.670 1.00 36.03 C ATOM 521 C ARG A 870 -11.395 2.786 -7.881 1.00 37.18 C ATOM 522 O ARG A 870 -10.514 2.092 -8.391 1.00 37.55 O ATOM 523 CB ARG A 870 -13.796 2.948 -8.610 1.00 38.57 C ATOM 524 CG ARG A 870 -14.244 2.139 -9.805 1.00 58.39 C ATOM 525 CD ARG A 870 -15.700 2.418 -10.185 1.00 72.09 C ATOM 526 NE ARG A 870 -15.877 3.686 -10.895 1.00 76.85 N ATOM 527 HE ARG A 870 -15.054 4.292 -11.091 1.00 0.00 H ATOM 528 H ARG A 870 -14.050 3.012 -6.116 1.00 0.00 H ATOM 529 N GLU A 871 -11.185 4.049 -7.466 1.00 32.62 N ATOM 530 CA GLU A 871 -9.887 4.734 -7.590 1.00 32.20 C ATOM 531 C GLU A 871 -8.784 3.951 -6.867 1.00 32.89 C ATOM 532 O GLU A 871 -7.712 3.757 -7.447 1.00 30.42 O ATOM 533 CB GLU A 871 -9.972 6.168 -7.055 1.00 33.46 C ATOM 534 CG GLU A 871 -8.634 6.895 -7.021 1.00 34.66 C ATOM 535 CD GLU A 871 -8.654 8.265 -6.376 1.00 42.88 C ATOM 536 OE1 GLU A 871 -9.744 8.736 -5.975 1.00 38.49 O ATOM 537 OE2 GLU A 871 -7.573 8.887 -6.303 1.00 33.39 O ATOM 538 H GLU A 871 -11.978 4.567 -7.037 1.00 0.00 H ATOM 539 N ILE A 872 -9.056 3.505 -5.609 1.00 28.44 N ATOM 540 CA ILE A 872 -8.118 2.711 -4.782 1.00 28.48 C ATOM 541 C ILE A 872 -7.776 1.397 -5.540 1.00 33.51 C ATOM 542 O ILE A 872 -6.606 1.044 -5.642 1.00 32.07 O ATOM 543 CB ILE A 872 -8.681 2.446 -3.336 1.00 30.57 C ATOM 544 CG1 ILE A 872 -8.829 3.772 -2.521 1.00 29.82 C ATOM 545 CG2 ILE A 872 -7.825 1.406 -2.555 1.00 30.58 C ATOM 546 CD1 ILE A 872 -9.698 3.650 -1.218 1.00 31.72 C ATOM 547 H ILE A 872 -9.984 3.737 -5.202 1.00 0.00 H ATOM 548 N GLN A 873 -8.800 0.704 -6.078 1.00 32.81 N ATOM 549 CA GLN A 873 -8.602 -0.553 -6.822 1.00 33.76 C ATOM 550 C GLN A 873 -7.734 -0.334 -8.068 1.00 34.79 C ATOM 551 O GLN A 873 -6.845 -1.131 -8.339 1.00 32.95 O ATOM 552 CB GLN A 873 -9.948 -1.201 -7.207 1.00 35.52 C ATOM 553 CG GLN A 873 -10.751 -1.772 -6.019 1.00 47.68 C ATOM 554 CD GLN A 873 -9.935 -2.573 -5.029 1.00 66.60 C ATOM 555 OE1 GLN A 873 -9.797 -2.198 -3.853 1.00 58.94 O ATOM 556 NE2 GLN A 873 -9.370 -3.690 -5.480 1.00 65.52 N ATOM 557 HE22 GLN A 873 -9.504 -3.977 -6.470 1.00 0.00 H ATOM 558 HE21 GLN A 873 -8.794 -4.276 -4.842 1.00 0.00 H ATOM 559 H GLN A 873 -9.767 1.070 -5.964 1.00 0.00 H ATOM 560 N ILE A 874 -7.948 0.776 -8.776 1.00 31.49 N ATOM 561 CA ILE A 874 -7.147 1.111 -9.963 1.00 30.33 C ATOM 562 C ILE A 874 -5.684 1.369 -9.582 1.00 32.98 C ATOM 563 O ILE A 874 -4.794 0.718 -10.129 1.00 32.29 O ATOM 564 CB ILE A 874 -7.792 2.272 -10.779 1.00 33.15 C ATOM 565 CG1 ILE A 874 -9.134 1.779 -11.437 1.00 33.40 C ATOM 566 CG2 ILE A 874 -6.819 2.830 -11.846 1.00 33.20 C ATOM 567 CD1 ILE A 874 -10.043 2.897 -12.051 1.00 32.01 C ATOM 568 H ILE A 874 -8.705 1.425 -8.479 1.00 0.00 H ATOM 569 N LEU A 875 -5.437 2.305 -8.639 1.00 27.81 N ATOM 570 CA LEU A 875 -4.083 2.668 -8.239 1.00 26.19 C ATOM 571 C LEU A 875 -3.284 1.517 -7.649 1.00 30.98 C ATOM 572 O LEU A 875 -2.093 1.380 -7.970 1.00 31.24 O ATOM 573 CB LEU A 875 -4.077 3.879 -7.285 1.00 25.31 C ATOM 574 CG LEU A 875 -2.723 4.586 -7.164 1.00 28.58 C ATOM 575 CD1 LEU A 875 -2.329 5.244 -8.516 1.00 28.55 C ATOM 576 CD2 LEU A 875 -2.767 5.647 -6.033 1.00 28.40 C ATOM 577 H LEU A 875 -6.240 2.783 -8.183 1.00 0.00 H ATOM 578 N LYS A 876 -3.925 0.701 -6.787 1.00 30.35 N ATOM 579 CA LYS A 876 -3.285 -0.470 -6.158 1.00 31.96 C ATOM 580 C LYS A 876 -2.676 -1.435 -7.200 1.00 34.70 C ATOM 581 O LYS A 876 -1.606 -1.992 -6.964 1.00 34.05 O ATOM 582 CB LYS A 876 -4.292 -1.210 -5.239 1.00 34.60 C ATOM 583 CG LYS A 876 -3.755 -2.474 -4.556 1.00 54.77 C ATOM 584 CD LYS A 876 -4.703 -3.030 -3.477 1.00 66.54 C ATOM 585 CE LYS A 876 -5.775 -3.945 -4.016 1.00 88.49 C ATOM 586 NZ LYS A 876 -6.571 -4.559 -2.918 1.00102.11 N ATOM 587 HZ1 LYS A 876 -5.942 -5.114 -2.304 1.00 0.00 H ATOM 588 HZ2 LYS A 876 -7.027 -3.809 -2.361 1.00 0.00 H ATOM 589 HZ3 LYS A 876 -7.298 -5.181 -3.325 1.00 0.00 H ATOM 590 H LYS A 876 -4.918 0.907 -6.555 1.00 0.00 H ATOM 591 N ALA A 877 -3.329 -1.587 -8.357 1.00 31.83 N ATOM 592 CA ALA A 877 -2.882 -2.500 -9.420 1.00 32.11 C ATOM 593 C ALA A 877 -1.964 -1.872 -10.488 1.00 36.06 C ATOM 594 O ALA A 877 -1.613 -2.552 -11.461 1.00 35.61 O ATOM 595 CB ALA A 877 -4.088 -3.155 -10.072 1.00 33.08 C ATOM 596 H ALA A 877 -4.195 -1.033 -8.513 1.00 0.00 H ATOM 597 N LEU A 878 -1.546 -0.595 -10.303 1.00 31.17 N ATOM 598 CA LEU A 878 -0.639 0.085 -11.241 1.00 28.81 C ATOM 599 C LEU A 878 0.772 0.063 -10.672 1.00 32.57 C ATOM 600 O LEU A 878 0.951 0.418 -9.519 1.00 30.79 O ATOM 601 CB LEU A 878 -1.122 1.527 -11.547 1.00 28.66 C ATOM 602 CG LEU A 878 -2.499 1.613 -12.243 1.00 33.30 C ATOM 603 CD1 LEU A 878 -3.006 3.042 -12.316 1.00 32.84 C ATOM 604 CD2 LEU A 878 -2.479 0.966 -13.638 1.00 34.79 C ATOM 605 H LEU A 878 -1.880 -0.076 -9.466 1.00 0.00 H ATOM 606 N HIS A 879 1.768 -0.414 -11.455 1.00 30.75 N ATOM 607 CA HIS A 879 3.148 -0.550 -10.995 1.00 31.96 C ATOM 608 C HIS A 879 4.081 0.003 -12.068 1.00 36.56 C ATOM 609 O HIS A 879 4.453 -0.694 -12.995 1.00 36.93 O ATOM 610 CB HIS A 879 3.467 -2.038 -10.682 1.00 34.04 C ATOM 611 CG HIS A 879 2.517 -2.666 -9.712 1.00 37.95 C ATOM 612 ND1 HIS A 879 2.628 -2.447 -8.345 1.00 39.85 N ATOM 613 CD2 HIS A 879 1.456 -3.475 -9.941 1.00 39.92 C ATOM 614 CE1 HIS A 879 1.655 -3.154 -7.788 1.00 39.19 C ATOM 615 NE2 HIS A 879 0.911 -3.773 -8.709 1.00 39.73 N ATOM 616 H HIS A 879 1.540 -0.697 -12.430 1.00 0.00 H ATOM 617 N SER A 880 4.405 1.277 -11.972 1.00 31.95 N ATOM 618 CA SER A 880 5.242 1.952 -12.959 1.00 30.21 C ATOM 619 C SER A 880 6.018 3.039 -12.271 1.00 33.52 C ATOM 620 O SER A 880 5.459 3.726 -11.399 1.00 30.28 O ATOM 621 CB SER A 880 4.357 2.585 -14.030 1.00 30.65 C ATOM 622 OG SER A 880 5.060 3.474 -14.887 1.00 32.15 O ATOM 623 HG SER A 880 5.783 2.981 -15.350 1.00 0.00 H ATOM 624 H SER A 880 4.050 1.823 -11.161 1.00 0.00 H ATOM 625 N ASP A 881 7.261 3.276 -12.745 1.00 30.60 N ATOM 626 CA ASP A 881 8.095 4.388 -12.284 1.00 31.66 C ATOM 627 C ASP A 881 7.447 5.735 -12.619 1.00 32.67 C ATOM 628 O ASP A 881 7.829 6.724 -12.016 1.00 31.47 O ATOM 629 CB ASP A 881 9.496 4.341 -12.950 1.00 34.86 C ATOM 630 CG ASP A 881 10.366 3.161 -12.536 1.00 51.05 C ATOM 631 OD1 ASP A 881 10.049 2.519 -11.506 1.00 50.99 O ATOM 632 OD2 ASP A 881 11.381 2.898 -13.229 1.00 57.31 O ATOM 633 H ASP A 881 7.644 2.638 -13.472 1.00 0.00 H ATOM 634 N PHE A 882 6.447 5.768 -13.555 1.00 28.81 N ATOM 635 CA PHE A 882 5.814 7.014 -14.002 1.00 28.24 C ATOM 636 C PHE A 882 4.370 7.179 -13.520 1.00 30.25 C ATOM 637 O PHE A 882 3.627 8.018 -14.039 1.00 29.62 O ATOM 638 CB PHE A 882 5.947 7.156 -15.533 1.00 30.33 C ATOM 639 CG PHE A 882 7.374 6.936 -15.987 1.00 32.28 C ATOM 640 CD1 PHE A 882 8.405 7.740 -15.506 1.00 34.89 C ATOM 641 CD2 PHE A 882 7.705 5.847 -16.792 1.00 36.35 C ATOM 642 CE1 PHE A 882 9.739 7.485 -15.861 1.00 36.35 C ATOM 643 CE2 PHE A 882 9.038 5.609 -17.171 1.00 38.71 C ATOM 644 CZ PHE A 882 10.042 6.434 -16.710 1.00 35.75 C ATOM 645 H PHE A 882 6.122 4.870 -13.967 1.00 0.00 H ATOM 646 N ILE A 883 3.994 6.423 -12.497 1.00 26.90 N ATOM 647 CA ILE A 883 2.665 6.508 -11.870 1.00 27.65 C ATOM 648 C ILE A 883 2.908 6.612 -10.380 1.00 29.91 C ATOM 649 O ILE A 883 3.673 5.812 -9.837 1.00 30.17 O ATOM 650 CB ILE A 883 1.682 5.324 -12.204 1.00 30.07 C ATOM 651 CG1 ILE A 883 1.513 5.055 -13.739 1.00 31.70 C ATOM 652 CG2 ILE A 883 0.317 5.502 -11.529 1.00 28.63 C ATOM 653 CD1 ILE A 883 0.860 6.098 -14.601 1.00 39.52 C ATOM 654 H ILE A 883 4.674 5.734 -12.118 1.00 0.00 H ATOM 655 N VAL A 884 2.246 7.570 -9.716 1.00 24.83 N ATOM 656 CA VAL A 884 2.371 7.750 -8.257 1.00 24.07 C ATOM 657 C VAL A 884 2.157 6.405 -7.536 1.00 28.44 C ATOM 658 O VAL A 884 1.239 5.655 -7.885 1.00 27.16 O ATOM 659 CB VAL A 884 1.492 8.920 -7.683 1.00 26.92 C ATOM 660 CG1 VAL A 884 0.002 8.597 -7.743 1.00 26.12 C ATOM 661 CG2 VAL A 884 1.898 9.276 -6.244 1.00 26.40 C ATOM 662 H VAL A 884 1.622 8.209 -10.248 1.00 0.00 H ATOM 663 N LYS A 885 3.028 6.093 -6.549 1.00 26.21 N ATOM 664 CA LYS A 885 2.929 4.815 -5.843 1.00 25.96 C ATOM 665 C LYS A 885 1.832 4.764 -4.788 1.00 29.38 C ATOM 666 O LYS A 885 1.816 5.570 -3.854 1.00 27.28 O ATOM 667 CB LYS A 885 4.261 4.472 -5.145 1.00 29.14 C ATOM 668 CG LYS A 885 5.197 3.682 -6.025 1.00 53.64 C ATOM 669 CD LYS A 885 6.393 3.162 -5.251 1.00 67.77 C ATOM 670 CE LYS A 885 7.677 3.310 -6.040 1.00 77.32 C ATOM 671 NZ LYS A 885 8.234 4.691 -5.951 1.00 85.30 N ATOM 672 HZ1 LYS A 885 7.541 5.368 -6.329 1.00 0.00 H ATOM 673 HZ2 LYS A 885 8.436 4.919 -4.957 1.00 0.00 H ATOM 674 HZ3 LYS A 885 9.112 4.746 -6.506 1.00 0.00 H ATOM 675 H LYS A 885 3.775 6.768 -6.289 1.00 0.00 H ATOM 676 N TYR A 886 0.985 3.745 -4.889 1.00 26.11 N ATOM 677 CA TYR A 886 0.002 3.379 -3.880 1.00 25.82 C ATOM 678 C TYR A 886 0.832 2.807 -2.688 1.00 29.10 C ATOM 679 O TYR A 886 1.728 2.007 -2.929 1.00 27.59 O ATOM 680 CB TYR A 886 -0.868 2.243 -4.457 1.00 26.11 C ATOM 681 CG TYR A 886 -1.711 1.489 -3.436 1.00 27.64 C ATOM 682 CD1 TYR A 886 -2.980 1.934 -3.087 1.00 28.94 C ATOM 683 CD2 TYR A 886 -1.281 0.269 -2.906 1.00 28.48 C ATOM 684 CE1 TYR A 886 -3.771 1.234 -2.168 1.00 26.33 C ATOM 685 CE2 TYR A 886 -2.068 -0.444 -1.995 1.00 29.64 C ATOM 686 CZ TYR A 886 -3.325 0.030 -1.655 1.00 33.53 C ATOM 687 OH TYR A 886 -4.122 -0.666 -0.779 1.00 39.88 O ATOM 688 HH TYR A 886 -4.303 -1.568 -1.145 1.00 0.00 H ATOM 689 H TYR A 886 1.028 3.167 -5.752 1.00 0.00 H ATOM 690 N ARG A 887 0.539 3.205 -1.434 1.00 26.00 N ATOM 691 CA ARG A 887 1.213 2.641 -0.264 1.00 27.05 C ATOM 692 C ARG A 887 0.292 1.711 0.479 1.00 32.06 C ATOM 693 O ARG A 887 0.744 0.689 0.974 1.00 33.61 O ATOM 694 CB ARG A 887 1.768 3.716 0.709 1.00 29.93 C ATOM 695 CG ARG A 887 2.916 4.562 0.175 1.00 39.97 C ATOM 696 CD ARG A 887 4.188 3.765 -0.101 1.00 53.66 C ATOM 697 NE ARG A 887 5.313 4.641 -0.439 1.00 64.91 N ATOM 698 CZ ARG A 887 6.373 4.272 -1.151 1.00 82.75 C ATOM 699 NH1 ARG A 887 6.468 3.035 -1.626 1.00 65.21 N ATOM 700 NH2 ARG A 887 7.342 5.142 -1.408 1.00 77.93 N ATOM 701 HE ARG A 887 5.280 5.623 -0.097 1.00 0.00 H ATOM 702 HH12 ARG A 887 7.301 2.754 -2.182 1.00 0.00 H ATOM 703 HH11 ARG A 887 5.710 2.348 -1.442 1.00 0.00 H ATOM 704 HH22 ARG A 887 8.170 4.849 -1.966 1.00 0.00 H ATOM 705 HH21 ARG A 887 7.274 6.117 -1.052 1.00 0.00 H ATOM 706 H ARG A 887 -0.188 3.935 -1.294 1.00 0.00 H ATOM 707 N GLY A 888 -0.972 2.089 0.619 1.00 28.24 N ATOM 708 CA GLY A 888 -1.932 1.273 1.346 1.00 28.41 C ATOM 709 C GLY A 888 -3.224 1.993 1.627 1.00 32.85 C ATOM 710 O GLY A 888 -3.531 2.999 0.985 1.00 31.31 O ATOM 711 H GLY A 888 -1.283 2.988 0.200 1.00 0.00 H ATOM 712 N VAL A 889 -3.992 1.474 2.585 1.00 30.65 N ATOM 713 CA VAL A 889 -5.267 2.052 2.989 1.00 31.16 C ATOM 714 C VAL A 889 -5.364 2.050 4.497 1.00 37.22 C ATOM 715 O VAL A 889 -4.739 1.211 5.155 1.00 37.22 O ATOM 716 CB VAL A 889 -6.510 1.324 2.361 1.00 34.84 C ATOM 717 CG1 VAL A 889 -6.553 1.485 0.851 1.00 33.97 C ATOM 718 CG2 VAL A 889 -6.567 -0.160 2.745 1.00 35.43 C ATOM 719 H VAL A 889 -3.665 0.613 3.068 1.00 0.00 H ATOM 720 N SER A 890 -6.151 2.974 5.038 1.00 35.81 N ATOM 721 CA SER A 890 -6.520 2.987 6.447 1.00 38.56 C ATOM 722 C SER A 890 -8.033 2.757 6.476 1.00 46.61 C ATOM 723 O SER A 890 -8.756 3.258 5.595 1.00 45.33 O ATOM 724 CB SER A 890 -6.130 4.293 7.137 1.00 43.59 C ATOM 725 OG SER A 890 -7.097 5.306 6.924 1.00 59.94 O ATOM 726 HG SER A 890 -6.812 6.135 7.384 1.00 0.00 H ATOM 727 H SER A 890 -6.523 3.727 4.424 1.00 0.00 H ATOM 728 N TYR A 891 -8.503 1.956 7.440 1.00 46.43 N ATOM 729 CA TYR A 891 -9.927 1.642 7.570 1.00 47.99 C ATOM 730 C TYR A 891 -10.565 2.304 8.768 1.00 55.27 C ATOM 731 O TYR A 891 -9.926 2.463 9.818 1.00 55.71 O ATOM 732 CB TYR A 891 -10.160 0.123 7.657 1.00 49.49 C ATOM 733 CG TYR A 891 -9.843 -0.636 6.393 1.00 51.30 C ATOM 734 CD1 TYR A 891 -10.752 -0.686 5.339 1.00 53.36 C ATOM 735 CD2 TYR A 891 -8.656 -1.350 6.266 1.00 52.39 C ATOM 736 CE1 TYR A 891 -10.469 -1.396 4.174 1.00 54.08 C ATOM 737 CE2 TYR A 891 -8.372 -2.081 5.114 1.00 53.62 C ATOM 738 CZ TYR A 891 -9.279 -2.096 4.067 1.00 62.98 C ATOM 739 OH TYR A 891 -8.991 -2.796 2.917 1.00 67.96 O ATOM 740 HH TYR A 891 -9.741 -2.701 2.278 1.00 0.00 H ATOM 741 H TYR A 891 -7.834 1.543 8.120 1.00 0.00 H ATOM 742 N GLY A 892 -11.842 2.633 8.603 1.00 53.48 N ATOM 743 CA GLY A 892 -12.688 3.214 9.636 1.00 95.17 C ATOM 744 C GLY A 892 -13.850 2.301 9.978 1.00123.10 C ATOM 745 O GLY A 892 -13.695 1.077 10.051 1.00 79.87 O ATOM 746 H GLY A 892 -12.268 2.463 7.669 1.00 0.00 H TER 747 GLY A 892 ATOM 748 N SER A 897 -13.126 1.296 3.271 1.00 57.82 N ATOM 749 CA SER A 897 -11.915 2.079 3.009 1.00 56.95 C ATOM 750 C SER A 897 -12.117 3.536 3.386 1.00 57.51 C ATOM 751 O SER A 897 -12.920 4.243 2.767 1.00 57.97 O ATOM 752 CB SER A 897 -11.498 1.969 1.548 1.00 60.28 C ATOM 753 OG SER A 897 -10.908 0.710 1.272 1.00 71.97 O ATOM 754 HG SER A 897 -10.649 0.670 0.317 1.00 0.00 H ATOM 755 HN3 SER A 897 -13.914 1.680 2.711 1.00 0.00 H ATOM 756 HN2 SER A 897 -13.360 1.350 4.283 1.00 0.00 H ATOM 757 HN1 SER A 897 -12.961 0.304 3.005 1.00 0.00 H ATOM 758 N LEU A 898 -11.415 3.973 4.424 1.00 50.13 N ATOM 759 CA LEU A 898 -11.507 5.348 4.868 1.00 48.06 C ATOM 760 C LEU A 898 -10.519 6.219 4.073 1.00 45.59 C ATOM 761 O LEU A 898 -10.917 7.251 3.524 1.00 43.93 O ATOM 762 CB LEU A 898 -11.275 5.444 6.402 1.00 48.24 C ATOM 763 CG LEU A 898 -11.340 6.834 7.087 1.00 53.21 C ATOM 764 CD1 LEU A 898 -12.531 7.668 6.615 1.00 53.64 C ATOM 765 CD2 LEU A 898 -11.413 6.688 8.577 1.00 55.34 C ATOM 766 H LEU A 898 -10.787 3.315 4.928 1.00 0.00 H ATOM 767 N ARG A 899 -9.238 5.811 4.008 1.00 37.82 N ATOM 768 CA ARG A 899 -8.228 6.642 3.367 1.00 35.26 C ATOM 769 C ARG A 899 -7.344 5.870 2.411 1.00 36.07 C ATOM 770 O ARG A 899 -7.042 4.709 2.656 1.00 36.09 O ATOM 771 CB ARG A 899 -7.363 7.335 4.445 1.00 34.68 C ATOM 772 CG ARG A 899 -8.138 8.182 5.479 1.00 45.35 C ATOM 773 CD ARG A 899 -7.240 8.798 6.548 1.00 49.56 C ATOM 774 NE ARG A 899 -7.972 9.101 7.777 1.00 53.62 N ATOM 775 CZ ARG A 899 -8.613 10.241 8.022 1.00 66.99 C ATOM 776 NH1 ARG A 899 -8.616 11.217 7.123 1.00 56.36 N ATOM 777 NH2 ARG A 899 -9.251 10.417 9.172 1.00 46.38 N ATOM 778 HE ARG A 899 -7.993 8.370 8.516 1.00 0.00 H ATOM 779 HH12 ARG A 899 -9.119 12.105 7.321 1.00 0.00 H ATOM 780 HH11 ARG A 899 -8.115 11.094 6.220 1.00 0.00 H ATOM 781 HH22 ARG A 899 -9.750 11.310 9.358 1.00 0.00 H ATOM 782 HH21 ARG A 899 -9.252 9.662 9.887 1.00 0.00 H ATOM 783 H ARG A 899 -8.967 4.895 4.419 1.00 0.00 H ATOM 784 N LEU A 900 -6.899 6.538 1.337 1.00 29.85 N ATOM 785 CA LEU A 900 -5.959 6.009 0.348 1.00 27.93 C ATOM 786 C LEU A 900 -4.577 6.616 0.702 1.00 29.95 C ATOM 787 O LEU A 900 -4.407 7.837 0.645 1.00 29.17 O ATOM 788 CB LEU A 900 -6.401 6.415 -1.081 1.00 27.11 C ATOM 789 CG LEU A 900 -5.381 6.236 -2.232 1.00 29.77 C ATOM 790 CD1 LEU A 900 -4.927 4.765 -2.370 1.00 28.21 C ATOM 791 CD2 LEU A 900 -5.981 6.712 -3.554 1.00 29.75 C ATOM 792 H LEU A 900 -7.249 7.507 1.196 1.00 0.00 H ATOM 793 N VAL A 901 -3.602 5.762 1.068 1.00 25.15 N ATOM 794 CA VAL A 901 -2.268 6.216 1.454 1.00 23.69 C ATOM 795 C VAL A 901 -1.315 6.086 0.242 1.00 27.39 C ATOM 796 O VAL A 901 -1.237 5.011 -0.366 1.00 26.83 O ATOM 797 CB VAL A 901 -1.741 5.464 2.713 1.00 26.86 C ATOM 798 CG1 VAL A 901 -0.393 6.042 3.175 1.00 24.44 C ATOM 799 CG2 VAL A 901 -2.771 5.509 3.853 1.00 27.39 C ATOM 800 H VAL A 901 -3.806 4.742 1.076 1.00 0.00 H ATOM 801 N MET A 902 -0.607 7.191 -0.107 1.00 23.79 N ATOM 802 CA MET A 902 0.294 7.232 -1.266 1.00 22.71 C ATOM 803 C MET A 902 1.630 7.816 -0.865 1.00 27.34 C ATOM 804 O MET A 902 1.719 8.485 0.165 1.00 26.25 O ATOM 805 CB MET A 902 -0.316 8.108 -2.408 1.00 23.90 C ATOM 806 CG MET A 902 -1.665 7.621 -2.915 1.00 25.59 C ATOM 807 SD MET A 902 -2.519 8.795 -4.021 1.00 28.27 S ATOM 808 CE MET A 902 -3.193 9.897 -2.820 1.00 22.74 C ATOM 809 H MET A 902 -0.708 8.048 0.473 1.00 0.00 H ATOM 810 N GLU A 903 2.670 7.611 -1.695 1.00 23.53 N ATOM 811 CA GLU A 903 3.961 8.254 -1.427 1.00 24.17 C ATOM 812 C GLU A 903 3.791 9.780 -1.555 1.00 28.20 C ATOM 813 O GLU A 903 2.949 10.267 -2.331 1.00 25.87 O ATOM 814 CB GLU A 903 5.046 7.773 -2.410 1.00 25.06 C ATOM 815 CG GLU A 903 4.677 7.999 -3.873 1.00 30.94 C ATOM 816 CD GLU A 903 5.748 7.645 -4.887 1.00 39.27 C ATOM 817 OE1 GLU A 903 6.919 7.483 -4.482 1.00 34.27 O ATOM 818 OE2 GLU A 903 5.431 7.614 -6.097 1.00 30.66 O ATOM 819 H GLU A 903 2.558 6.997 -2.527 1.00 0.00 H ATOM 820 N TYR A 904 4.559 10.517 -0.754 1.00 25.35 N ATOM 821 CA TYR A 904 4.520 11.954 -0.743 1.00 25.35 C ATOM 822 C TYR A 904 5.648 12.492 -1.638 1.00 29.97 C ATOM 823 O TYR A 904 6.810 12.140 -1.433 1.00 28.65 O ATOM 824 CB TYR A 904 4.672 12.474 0.698 1.00 26.14 C ATOM 825 CG TYR A 904 4.883 13.967 0.790 1.00 27.79 C ATOM 826 CD1 TYR A 904 3.985 14.857 0.203 1.00 28.01 C ATOM 827 CD2 TYR A 904 5.950 14.497 1.519 1.00 28.62 C ATOM 828 CE1 TYR A 904 4.195 16.233 0.258 1.00 29.62 C ATOM 829 CE2 TYR A 904 6.127 15.870 1.642 1.00 29.27 C ATOM 830 CZ TYR A 904 5.247 16.734 1.009 1.00 36.10 C ATOM 831 OH TYR A 904 5.413 18.084 1.139 1.00 35.61 O ATOM 832 HH TYR A 904 4.706 18.553 0.629 1.00 0.00 H ATOM 833 H TYR A 904 5.215 10.032 -0.109 1.00 0.00 H ATOM 834 N LEU A 905 5.298 13.348 -2.621 1.00 26.32 N ATOM 835 CA LEU A 905 6.288 13.938 -3.522 1.00 27.80 C ATOM 836 C LEU A 905 6.378 15.449 -3.175 1.00 33.02 C ATOM 837 O LEU A 905 5.500 16.229 -3.584 1.00 32.19 O ATOM 838 CB LEU A 905 5.889 13.682 -4.997 1.00 28.41 C ATOM 839 CG LEU A 905 6.456 12.411 -5.654 1.00 33.78 C ATOM 840 CD1 LEU A 905 6.105 11.154 -4.871 1.00 33.99 C ATOM 841 CD2 LEU A 905 5.907 12.226 -7.072 1.00 35.48 C ATOM 842 H LEU A 905 4.295 13.595 -2.741 1.00 0.00 H ATOM 843 N PRO A 906 7.361 15.843 -2.309 1.00 31.14 N ATOM 844 CA PRO A 906 7.425 17.238 -1.838 1.00 31.80 C ATOM 845 C PRO A 906 7.556 18.298 -2.930 1.00 36.43 C ATOM 846 O PRO A 906 6.997 19.375 -2.742 1.00 36.21 O ATOM 847 CB PRO A 906 8.609 17.259 -0.851 1.00 32.91 C ATOM 848 CG PRO A 906 9.366 16.048 -1.120 1.00 36.43 C ATOM 849 CD PRO A 906 8.419 15.024 -1.679 1.00 32.44 C ATOM 850 N SER A 907 8.165 17.973 -4.097 1.00 32.69 N ATOM 851 CA SER A 907 8.229 18.954 -5.195 1.00 32.13 C ATOM 852 C SER A 907 6.819 19.309 -5.734 1.00 35.22 C ATOM 853 O SER A 907 6.653 20.370 -6.308 1.00 35.69 O ATOM 854 CB SER A 907 9.160 18.489 -6.307 1.00 32.55 C ATOM 855 OG SER A 907 10.458 18.251 -5.796 1.00 34.87 O ATOM 856 HG SER A 907 10.413 17.550 -5.098 1.00 0.00 H ATOM 857 H SER A 907 8.587 17.030 -4.217 1.00 0.00 H ATOM 858 N GLY A 908 5.823 18.461 -5.469 1.00 31.02 N ATOM 859 CA GLY A 908 4.431 18.734 -5.826 1.00 30.33 C ATOM 860 C GLY A 908 4.088 18.683 -7.301 1.00 31.58 C ATOM 861 O GLY A 908 4.774 18.011 -8.068 1.00 29.36 O ATOM 862 H GLY A 908 6.046 17.567 -4.987 1.00 0.00 H ATOM 863 N CYS A 909 3.009 19.393 -7.701 1.00 28.63 N ATOM 864 CA CYS A 909 2.475 19.350 -9.071 1.00 29.66 C ATOM 865 C CYS A 909 3.406 19.984 -10.110 1.00 33.13 C ATOM 866 O CYS A 909 4.099 20.973 -9.835 1.00 33.02 O ATOM 867 CB CYS A 909 1.060 19.926 -9.153 1.00 31.52 C ATOM 868 SG CYS A 909 0.973 21.734 -8.998 1.00 36.21 S ATOM 869 H CYS A 909 2.532 20.001 -7.004 1.00 0.00 H ATOM 870 N LEU A 910 3.416 19.397 -11.305 1.00 28.40 N ATOM 871 CA LEU A 910 4.245 19.854 -12.415 1.00 28.88 C ATOM 872 C LEU A 910 3.945 21.298 -12.843 1.00 30.94 C ATOM 873 O LEU A 910 4.876 22.015 -13.185 1.00 30.50 O ATOM 874 CB LEU A 910 4.061 18.913 -13.625 1.00 29.27 C ATOM 875 CG LEU A 910 4.855 19.242 -14.890 1.00 31.82 C ATOM 876 CD1 LEU A 910 6.360 19.079 -14.646 1.00 30.26 C ATOM 877 CD2 LEU A 910 4.375 18.372 -16.057 1.00 32.44 C ATOM 878 H LEU A 910 2.802 18.571 -11.455 1.00 0.00 H ATOM 879 N ARG A 911 2.667 21.699 -12.836 1.00 27.17 N ATOM 880 CA ARG A 911 2.215 23.033 -13.221 1.00 28.01 C ATOM 881 C ARG A 911 2.932 24.138 -12.425 1.00 33.03 C ATOM 882 O ARG A 911 3.502 25.046 -13.034 1.00 33.96 O ATOM 883 CB ARG A 911 0.696 23.143 -13.056 1.00 30.30 C ATOM 884 CG ARG A 911 0.160 24.541 -13.411 1.00 37.54 C ATOM 885 CD ARG A 911 -1.251 24.742 -12.954 1.00 36.88 C ATOM 886 NE ARG A 911 -1.319 24.866 -11.501 1.00 41.71 N ATOM 887 CZ ARG A 911 -2.446 24.770 -10.804 1.00 55.39 C ATOM 888 NH1 ARG A 911 -3.599 24.536 -11.422 1.00 36.50 N ATOM 889 NH2 ARG A 911 -2.428 24.888 -9.483 1.00 44.27 N ATOM 890 HE ARG A 911 -0.435 25.039 -10.982 1.00 0.00 H ATOM 891 HH12 ARG A 911 -4.478 24.462 -10.872 1.00 0.00 H ATOM 892 HH11 ARG A 911 -3.622 24.427 -12.456 1.00 0.00 H ATOM 893 HH22 ARG A 911 -3.313 24.812 -8.942 1.00 0.00 H ATOM 894 HH21 ARG A 911 -1.529 25.056 -8.988 1.00 0.00 H ATOM 895 H ARG A 911 1.946 21.012 -12.535 1.00 0.00 H ATOM 896 N ASP A 912 2.907 24.055 -11.084 1.00 29.91 N ATOM 897 CA ASP A 912 3.571 25.036 -10.211 1.00 30.18 C ATOM 898 C ASP A 912 5.081 24.896 -10.276 1.00 33.89 C ATOM 899 O ASP A 912 5.783 25.903 -10.176 1.00 33.30 O ATOM 900 CB ASP A 912 3.068 24.935 -8.756 1.00 31.56 C ATOM 901 CG ASP A 912 1.578 25.192 -8.600 1.00 41.87 C ATOM 902 OD1 ASP A 912 0.905 25.451 -9.626 1.00 43.65 O ATOM 903 OD2 ASP A 912 1.074 25.088 -7.461 1.00 49.69 O ATOM 904 H ASP A 912 2.396 23.263 -10.644 1.00 0.00 H ATOM 905 N PHE A 913 5.588 23.647 -10.452 1.00 29.86 N ATOM 906 CA PHE A 913 7.030 23.383 -10.563 1.00 29.71 C ATOM 907 C PHE A 913 7.619 24.091 -11.796 1.00 34.60 C ATOM 908 O PHE A 913 8.699 24.690 -11.713 1.00 34.96 O ATOM 909 CB PHE A 913 7.297 21.869 -10.646 1.00 30.39 C ATOM 910 CG PHE A 913 8.753 21.482 -10.638 1.00 31.81 C ATOM 911 CD1 PHE A 913 9.450 21.352 -9.438 1.00 35.12 C ATOM 912 CD2 PHE A 913 9.424 21.211 -11.827 1.00 32.28 C ATOM 913 CE1 PHE A 913 10.811 21.002 -9.432 1.00 36.25 C ATOM 914 CE2 PHE A 913 10.772 20.837 -11.817 1.00 35.93 C ATOM 915 CZ PHE A 913 11.456 20.724 -10.617 1.00 34.09 C ATOM 916 H PHE A 913 4.928 22.845 -10.511 1.00 0.00 H ATOM 917 N LEU A 914 6.949 23.950 -12.952 1.00 29.73 N ATOM 918 CA LEU A 914 7.406 24.569 -14.202 1.00 29.26 C ATOM 919 C LEU A 914 7.455 26.106 -14.088 1.00 32.55 C ATOM 920 O LEU A 914 8.396 26.724 -14.568 1.00 30.75 O ATOM 921 CB LEU A 914 6.486 24.159 -15.356 1.00 28.74 C ATOM 922 CG LEU A 914 6.602 22.700 -15.844 1.00 31.87 C ATOM 923 CD1 LEU A 914 5.503 22.396 -16.848 1.00 30.19 C ATOM 924 CD2 LEU A 914 7.980 22.421 -16.466 1.00 34.89 C ATOM 925 H LEU A 914 6.077 23.383 -12.961 1.00 0.00 H ATOM 926 N GLN A 915 6.457 26.700 -13.421 1.00 30.27 N ATOM 927 CA GLN A 915 6.366 28.147 -13.222 1.00 32.12 C ATOM 928 C GLN A 915 7.532 28.682 -12.394 1.00 37.86 C ATOM 929 O GLN A 915 8.067 29.733 -12.725 1.00 36.55 O ATOM 930 CB GLN A 915 5.035 28.515 -12.564 1.00 33.62 C ATOM 931 CG GLN A 915 3.821 28.430 -13.495 1.00 39.45 C ATOM 932 CD GLN A 915 2.507 28.402 -12.740 1.00 51.55 C ATOM 933 OE1 GLN A 915 1.425 28.367 -13.323 1.00 51.98 O ATOM 934 NE2 GLN A 915 2.558 28.379 -11.422 1.00 48.25 N ATOM 935 HE22 GLN A 915 3.477 28.409 -10.937 1.00 0.00 H ATOM 936 HE21 GLN A 915 1.679 28.331 -10.868 1.00 0.00 H ATOM 937 H GLN A 915 5.706 26.101 -13.023 1.00 0.00 H ATOM 938 N ARG A 916 7.965 27.930 -11.361 1.00 36.23 N ATOM 939 CA ARG A 916 9.060 28.323 -10.467 1.00 36.15 C ATOM 940 C ARG A 916 10.443 28.048 -11.038 1.00 41.38 C ATOM 941 O ARG A 916 11.383 28.790 -10.734 1.00 40.99 O ATOM 942 CB ARG A 916 8.928 27.614 -9.110 1.00 37.80 C ATOM 943 CG ARG A 916 7.712 28.035 -8.291 1.00 54.73 C ATOM 944 CD ARG A 916 7.563 27.228 -7.016 1.00 70.61 C ATOM 945 NE ARG A 916 8.568 27.594 -6.019 1.00 92.64 N ATOM 946 CZ ARG A 916 9.651 26.873 -5.751 1.00115.57 C ATOM 947 NH1 ARG A 916 9.863 25.721 -6.377 1.00108.90 N ATOM 948 NH2 ARG A 916 10.524 27.291 -4.844 1.00103.17 N ATOM 949 HE ARG A 916 8.426 28.475 -5.485 1.00 0.00 H ATOM 950 HH12 ARG A 916 10.713 25.161 -6.163 1.00 0.00 H ATOM 951 HH11 ARG A 916 9.179 25.379 -7.082 1.00 0.00 H ATOM 952 HH22 ARG A 916 11.371 26.724 -4.637 1.00 0.00 H ATOM 953 HH21 ARG A 916 10.362 28.186 -4.340 1.00 0.00 H ATOM 954 H ARG A 916 7.495 27.018 -11.188 1.00 0.00 H ATOM 955 N HIS A 917 10.601 26.972 -11.822 1.00 37.97 N ATOM 956 CA HIS A 917 11.931 26.613 -12.316 1.00 38.70 C ATOM 957 C HIS A 917 12.134 26.878 -13.785 1.00 40.02 C ATOM 958 O HIS A 917 13.103 26.371 -14.350 1.00 38.19 O ATOM 959 CB HIS A 917 12.257 25.146 -11.969 1.00 41.04 C ATOM 960 CG HIS A 917 12.090 24.842 -10.514 1.00 46.08 C ATOM 961 ND1 HIS A 917 13.108 25.078 -9.606 1.00 49.15 N ATOM 962 CD2 HIS A 917 10.999 24.413 -9.841 1.00 48.18 C ATOM 963 CE1 HIS A 917 12.617 24.751 -8.422 1.00 48.42 C ATOM 964 NE2 HIS A 917 11.355 24.332 -8.514 1.00 48.46 N ATOM 965 H HIS A 917 9.777 26.392 -12.079 1.00 0.00 H ATOM 966 N ARG A 918 11.269 27.712 -14.403 1.00 37.88 N ATOM 967 CA ARG A 918 11.317 27.993 -15.844 1.00 38.34 C ATOM 968 C ARG A 918 12.684 28.473 -16.360 1.00 44.67 C ATOM 969 O ARG A 918 13.094 28.011 -17.423 1.00 45.31 O ATOM 970 CB ARG A 918 10.182 28.941 -16.318 1.00 37.99 C ATOM 971 CG ARG A 918 10.173 30.364 -15.774 1.00 44.57 C ATOM 972 CD ARG A 918 9.255 31.254 -16.624 1.00 54.81 C ATOM 973 NE ARG A 918 9.673 31.292 -18.029 1.00 55.71 N ATOM 974 CZ ARG A 918 8.865 31.106 -19.071 1.00 61.27 C ATOM 975 NH1 ARG A 918 7.566 30.905 -18.887 1.00 48.78 N ATOM 976 NH2 ARG A 918 9.344 31.153 -20.305 1.00 41.00 N ATOM 977 HE ARG A 918 10.677 31.478 -18.227 1.00 0.00 H ATOM 978 HH12 ARG A 918 6.941 30.760 -19.706 1.00 0.00 H ATOM 979 HH11 ARG A 918 7.173 30.892 -17.924 1.00 0.00 H ATOM 980 HH22 ARG A 918 8.709 31.007 -21.115 1.00 0.00 H ATOM 981 HH21 ARG A 918 10.355 31.336 -20.464 1.00 0.00 H ATOM 982 H ARG A 918 10.535 28.177 -13.832 1.00 0.00 H ATOM 983 N ALA A 919 13.424 29.310 -15.602 1.00 41.49 N ATOM 984 CA ALA A 919 14.742 29.771 -16.056 1.00 41.74 C ATOM 985 C ALA A 919 15.868 28.721 -15.917 1.00 46.75 C ATOM 986 O ALA A 919 16.994 28.948 -16.379 1.00 47.38 O ATOM 987 CB ALA A 919 15.112 31.068 -15.350 1.00 42.63 C ATOM 988 H ALA A 919 13.056 29.632 -14.684 1.00 0.00 H ATOM 989 N ARG A 920 15.542 27.550 -15.350 1.00 43.43 N ATOM 990 CA ARG A 920 16.471 26.448 -15.104 1.00 44.03 C ATOM 991 C ARG A 920 16.259 25.237 -16.048 1.00 48.70 C ATOM 992 O ARG A 920 17.213 24.522 -16.359 1.00 50.46 O ATOM 993 CB ARG A 920 16.352 26.031 -13.618 1.00 44.27 C ATOM 994 CG ARG A 920 17.281 24.919 -13.151 1.00 53.00 C ATOM 995 CD ARG A 920 17.048 24.579 -11.690 1.00 51.32 C ATOM 996 NE ARG A 920 17.599 25.611 -10.809 1.00 54.34 N ATOM 997 CZ ARG A 920 17.833 25.448 -9.511 1.00 63.06 C ATOM 998 NH1 ARG A 920 17.563 24.289 -8.922 1.00 46.55 N ATOM 999 NH2 ARG A 920 18.335 26.445 -8.790 1.00 47.35 N ATOM 1000 HE ARG A 920 17.823 26.536 -11.228 1.00 0.00 H ATOM 1001 HH12 ARG A 920 17.748 24.167 -7.906 1.00 0.00 H ATOM 1002 HH11 ARG A 920 17.167 23.504 -9.477 1.00 0.00 H ATOM 1003 HH22 ARG A 920 18.516 26.312 -7.775 1.00 0.00 H ATOM 1004 HH21 ARG A 920 18.547 27.358 -9.241 1.00 0.00 H ATOM 1005 H ARG A 920 14.551 27.415 -15.063 1.00 0.00 H ATOM 1006 N LEU A 921 15.024 25.011 -16.496 1.00 42.41 N ATOM 1007 CA LEU A 921 14.692 23.866 -17.338 1.00 40.93 C ATOM 1008 C LEU A 921 14.721 24.196 -18.821 1.00 44.82 C ATOM 1009 O LEU A 921 13.995 25.073 -19.259 1.00 46.38 O ATOM 1010 CB LEU A 921 13.311 23.302 -16.943 1.00 40.71 C ATOM 1011 CG LEU A 921 13.029 23.119 -15.440 1.00 44.99 C ATOM 1012 CD1 LEU A 921 11.558 22.886 -15.190 1.00 45.64 C ATOM 1013 CD2 LEU A 921 13.887 22.018 -14.827 1.00 45.13 C ATOM 1014 H LEU A 921 14.268 25.676 -16.236 1.00 0.00 H ATOM 1015 N ASP A 922 15.517 23.465 -19.601 1.00 40.87 N ATOM 1016 CA ASP A 922 15.598 23.670 -21.046 1.00 39.90 C ATOM 1017 C ASP A 922 14.656 22.734 -21.820 1.00 41.74 C ATOM 1018 O ASP A 922 13.936 21.926 -21.213 1.00 38.40 O ATOM 1019 CB ASP A 922 17.059 23.559 -21.538 1.00 42.18 C ATOM 1020 CG ASP A 922 17.790 22.276 -21.196 1.00 50.71 C ATOM 1021 OD1 ASP A 922 17.140 21.213 -21.154 1.00 50.80 O ATOM 1022 OD2 ASP A 922 19.026 22.322 -21.052 1.00 56.21 O ATOM 1023 H ASP A 922 16.101 22.723 -19.166 1.00 0.00 H ATOM 1024 N ALA A 923 14.680 22.835 -23.163 1.00 38.64 N ATOM 1025 CA ALA A 923 13.854 22.047 -24.067 1.00 38.45 C ATOM 1026 C ALA A 923 14.101 20.549 -23.908 1.00 42.25 C ATOM 1027 O ALA A 923 13.138 19.779 -23.945 1.00 42.54 O ATOM 1028 CB ALA A 923 14.081 22.485 -25.505 1.00 38.83 C ATOM 1029 H ALA A 923 15.335 23.525 -23.584 1.00 0.00 H ATOM 1030 N SER A 924 15.367 20.141 -23.648 1.00 38.46 N ATOM 1031 CA SER A 924 15.723 18.737 -23.445 1.00 38.05 C ATOM 1032 C SER A 924 14.977 18.178 -22.226 1.00 40.10 C ATOM 1033 O SER A 924 14.446 17.072 -22.271 1.00 40.41 O ATOM 1034 CB SER A 924 17.228 18.581 -23.256 1.00 42.36 C ATOM 1035 OG SER A 924 17.904 18.945 -24.447 1.00 56.96 O ATOM 1036 HG SER A 924 17.605 18.359 -25.187 1.00 0.00 H ATOM 1037 H SER A 924 16.118 20.858 -23.590 1.00 0.00 H ATOM 1038 N ARG A 925 14.936 18.960 -21.158 1.00 34.64 N ATOM 1039 CA ARG A 925 14.269 18.623 -19.919 1.00 33.85 C ATOM 1040 C ARG A 925 12.746 18.502 -20.092 1.00 34.69 C ATOM 1041 O ARG A 925 12.136 17.614 -19.495 1.00 34.81 O ATOM 1042 CB ARG A 925 14.651 19.646 -18.848 1.00 36.77 C ATOM 1043 CG ARG A 925 14.263 19.292 -17.423 1.00 45.15 C ATOM 1044 CD ARG A 925 14.497 17.842 -17.017 1.00 49.59 C ATOM 1045 NE ARG A 925 15.884 17.379 -17.061 1.00 54.37 N ATOM 1046 CZ ARG A 925 16.846 17.743 -16.219 1.00 65.57 C ATOM 1047 NH1 ARG A 925 16.626 18.687 -15.319 1.00 54.19 N ATOM 1048 NH2 ARG A 925 18.053 17.205 -16.311 1.00 59.15 N ATOM 1049 HE ARG A 925 16.139 16.709 -17.814 1.00 0.00 H ATOM 1050 HH12 ARG A 925 17.383 18.967 -14.663 1.00 0.00 H ATOM 1051 HH11 ARG A 925 15.696 19.149 -15.267 1.00 0.00 H ATOM 1052 HH22 ARG A 925 18.802 17.493 -15.650 1.00 0.00 H ATOM 1053 HH21 ARG A 925 18.251 16.495 -17.044 1.00 0.00 H ATOM 1054 H ARG A 925 15.417 19.881 -21.214 1.00 0.00 H ATOM 1055 N LEU A 926 12.137 19.381 -20.903 1.00 30.38 N ATOM 1056 CA LEU A 926 10.695 19.334 -21.158 1.00 29.45 C ATOM 1057 C LEU A 926 10.346 18.095 -21.952 1.00 31.49 C ATOM 1058 O LEU A 926 9.308 17.478 -21.706 1.00 30.05 O ATOM 1059 CB LEU A 926 10.207 20.609 -21.872 1.00 28.89 C ATOM 1060 CG LEU A 926 10.402 21.916 -21.109 1.00 33.14 C ATOM 1061 CD1 LEU A 926 9.983 23.100 -21.963 1.00 34.06 C ATOM 1062 CD2 LEU A 926 9.670 21.905 -19.758 1.00 34.10 C ATOM 1063 H LEU A 926 12.706 20.119 -21.365 1.00 0.00 H ATOM 1064 N LEU A 927 11.235 17.717 -22.894 1.00 29.78 N ATOM 1065 CA LEU A 927 11.117 16.529 -23.746 1.00 30.55 C ATOM 1066 C LEU A 927 11.229 15.254 -22.903 1.00 32.99 C ATOM 1067 O LEU A 927 10.534 14.270 -23.189 1.00 32.92 O ATOM 1068 CB LEU A 927 12.243 16.561 -24.806 1.00 32.01 C ATOM 1069 CG LEU A 927 11.926 16.873 -26.287 1.00 37.53 C ATOM 1070 CD1 LEU A 927 10.448 17.191 -26.574 1.00 36.61 C ATOM 1071 CD2 LEU A 927 12.921 17.852 -26.879 1.00 41.71 C ATOM 1072 H LEU A 927 12.073 18.318 -23.027 1.00 0.00 H ATOM 1073 N LEU A 928 12.087 15.279 -21.859 1.00 28.74 N ATOM 1074 CA LEU A 928 12.273 14.171 -20.923 1.00 28.86 C ATOM 1075 C LEU A 928 10.986 13.969 -20.150 1.00 30.81 C ATOM 1076 O LEU A 928 10.479 12.837 -20.107 1.00 30.27 O ATOM 1077 CB LEU A 928 13.465 14.427 -19.962 1.00 30.22 C ATOM 1078 CG LEU A 928 13.678 13.394 -18.828 1.00 36.15 C ATOM 1079 CD1 LEU A 928 14.064 11.992 -19.373 1.00 36.54 C ATOM 1080 CD2 LEU A 928 14.677 13.908 -17.788 1.00 36.80 C ATOM 1081 H LEU A 928 12.651 16.141 -21.712 1.00 0.00 H ATOM 1082 N TYR A 929 10.398 15.073 -19.633 1.00 26.28 N ATOM 1083 CA TYR A 929 9.119 14.979 -18.907 1.00 25.75 C ATOM 1084 C TYR A 929 8.025 14.434 -19.825 1.00 29.77 C ATOM 1085 O TYR A 929 7.289 13.527 -19.428 1.00 28.45 O ATOM 1086 CB TYR A 929 8.694 16.334 -18.319 1.00 24.83 C ATOM 1087 CG TYR A 929 9.645 16.978 -17.324 1.00 25.88 C ATOM 1088 CD1 TYR A 929 10.467 16.204 -16.504 1.00 26.80 C ATOM 1089 CD2 TYR A 929 9.663 18.357 -17.146 1.00 27.04 C ATOM 1090 CE1 TYR A 929 11.307 16.796 -15.554 1.00 28.03 C ATOM 1091 CE2 TYR A 929 10.521 18.960 -16.225 1.00 28.36 C ATOM 1092 CZ TYR A 929 11.343 18.179 -15.431 1.00 33.86 C ATOM 1093 OH TYR A 929 12.171 18.812 -14.519 1.00 33.06 O ATOM 1094 HH TYR A 929 12.696 18.133 -14.026 1.00 0.00 H ATOM 1095 H TYR A 929 10.855 16.000 -19.750 1.00 0.00 H ATOM 1096 N SER A 930 7.971 14.942 -21.079 1.00 26.96 N ATOM 1097 CA SER A 930 6.980 14.524 -22.083 1.00 27.60 C ATOM 1098 C SER A 930 7.079 13.013 -22.337 1.00 30.63 C ATOM 1099 O SER A 930 6.054 12.326 -22.368 1.00 28.90 O ATOM 1100 CB SER A 930 7.188 15.277 -23.405 1.00 30.52 C ATOM 1101 OG SER A 930 7.208 16.692 -23.255 1.00 37.82 O ATOM 1102 HG SER A 930 7.947 16.948 -22.648 1.00 0.00 H ATOM 1103 H SER A 930 8.667 15.667 -21.347 1.00 0.00 H ATOM 1104 N SER A 931 8.315 12.502 -22.480 1.00 29.12 N ATOM 1105 CA SER A 931 8.604 11.073 -22.723 1.00 30.06 C ATOM 1106 C SER A 931 8.157 10.188 -21.541 1.00 32.77 C ATOM 1107 O SER A 931 7.558 9.136 -21.746 1.00 31.92 O ATOM 1108 CB SER A 931 10.092 10.875 -22.991 1.00 32.80 C ATOM 1109 OG SER A 931 10.389 9.494 -23.081 1.00 48.12 O ATOM 1110 HG SER A 931 11.356 9.376 -23.255 1.00 0.00 H ATOM 1111 H SER A 931 9.121 13.156 -22.415 1.00 0.00 H ATOM 1112 N GLN A 932 8.432 10.641 -20.314 1.00 30.24 N ATOM 1113 CA GLN A 932 8.034 9.967 -19.081 1.00 29.89 C ATOM 1114 C GLN A 932 6.511 9.905 -18.936 1.00 32.20 C ATOM 1115 O GLN A 932 5.990 8.842 -18.616 1.00 32.62 O ATOM 1116 CB GLN A 932 8.682 10.657 -17.887 1.00 31.49 C ATOM 1117 CG GLN A 932 10.191 10.421 -17.856 1.00 28.50 C ATOM 1118 CD GLN A 932 10.857 11.200 -16.759 1.00 38.39 C ATOM 1119 OE1 GLN A 932 10.290 12.142 -16.197 1.00 30.73 O ATOM 1120 NE2 GLN A 932 12.081 10.825 -16.433 1.00 31.40 N ATOM 1121 HE22 GLN A 932 12.529 10.027 -16.927 1.00 0.00 H ATOM 1122 HE21 GLN A 932 12.596 11.328 -15.683 1.00 0.00 H ATOM 1123 H GLN A 932 8.964 11.531 -20.232 1.00 0.00 H ATOM 1124 N ILE A 933 5.790 11.030 -19.181 1.00 27.12 N ATOM 1125 CA ILE A 933 4.315 11.043 -19.121 1.00 25.35 C ATOM 1126 C ILE A 933 3.751 10.092 -20.213 1.00 28.55 C ATOM 1127 O ILE A 933 2.818 9.329 -19.957 1.00 27.29 O ATOM 1128 CB ILE A 933 3.732 12.495 -19.281 1.00 26.51 C ATOM 1129 CG1 ILE A 933 4.151 13.405 -18.093 1.00 25.38 C ATOM 1130 CG2 ILE A 933 2.182 12.460 -19.450 1.00 24.78 C ATOM 1131 CD1 ILE A 933 4.273 14.915 -18.447 1.00 25.11 C ATOM 1132 H ILE A 933 6.293 11.909 -19.418 1.00 0.00 H ATOM 1133 N CYS A 934 4.313 10.157 -21.426 1.00 28.26 N ATOM 1134 CA CYS A 934 3.899 9.293 -22.527 1.00 30.29 C ATOM 1135 C CYS A 934 4.138 7.789 -22.177 1.00 32.47 C ATOM 1136 O CYS A 934 3.280 6.959 -22.453 1.00 32.16 O ATOM 1137 CB CYS A 934 4.596 9.690 -23.827 1.00 32.02 C ATOM 1138 SG CYS A 934 4.087 8.686 -25.237 1.00 36.71 S ATOM 1139 H CYS A 934 5.072 10.848 -21.590 1.00 0.00 H ATOM 1140 N LYS A 935 5.259 7.461 -21.518 1.00 29.53 N ATOM 1141 CA LYS A 935 5.517 6.077 -21.071 1.00 29.53 C ATOM 1142 C LYS A 935 4.496 5.645 -19.997 1.00 31.46 C ATOM 1143 O LYS A 935 3.962 4.546 -20.077 1.00 31.43 O ATOM 1144 CB LYS A 935 6.958 5.904 -20.564 1.00 32.73 C ATOM 1145 CG LYS A 935 7.974 5.747 -21.699 1.00 37.32 C ATOM 1146 CD LYS A 935 9.391 5.722 -21.165 1.00 46.68 C ATOM 1147 CE LYS A 935 10.426 5.754 -22.266 1.00 53.11 C ATOM 1148 H LYS A 935 5.964 8.199 -21.317 1.00 0.00 H ATOM 1149 N GLY A 936 4.171 6.530 -19.055 1.00 25.37 N ATOM 1150 CA GLY A 936 3.156 6.216 -18.046 1.00 24.66 C ATOM 1151 C GLY A 936 1.790 6.003 -18.684 1.00 28.14 C ATOM 1152 O GLY A 936 1.075 5.083 -18.315 1.00 29.31 O ATOM 1153 H GLY A 936 4.644 7.456 -19.036 1.00 0.00 H ATOM 1154 N MET A 937 1.441 6.825 -19.680 1.00 24.69 N ATOM 1155 CA MET A 937 0.159 6.742 -20.404 1.00 23.91 C ATOM 1156 C MET A 937 0.056 5.495 -21.286 1.00 27.48 C ATOM 1157 O MET A 937 -1.025 4.918 -21.432 1.00 26.68 O ATOM 1158 CB MET A 937 -0.098 8.016 -21.229 1.00 25.18 C ATOM 1159 CG MET A 937 -0.455 9.254 -20.374 1.00 26.69 C ATOM 1160 SD MET A 937 -1.758 9.006 -19.141 1.00 29.40 S ATOM 1161 CE MET A 937 -3.155 8.798 -20.160 1.00 26.86 C ATOM 1162 H MET A 937 2.114 7.567 -19.960 1.00 0.00 H ATOM 1163 N GLU A 938 1.176 5.091 -21.888 1.00 25.91 N ATOM 1164 CA GLU A 938 1.233 3.871 -22.685 1.00 26.83 C ATOM 1165 C GLU A 938 0.955 2.682 -21.752 1.00 29.66 C ATOM 1166 O GLU A 938 0.152 1.816 -22.076 1.00 29.63 O ATOM 1167 CB GLU A 938 2.603 3.734 -23.379 1.00 28.49 C ATOM 1168 CG GLU A 938 2.529 2.761 -24.543 1.00 45.86 C ATOM 1169 CD GLU A 938 3.828 2.141 -25.025 1.00 73.90 C ATOM 1170 OE1 GLU A 938 4.883 2.812 -24.949 1.00 62.57 O ATOM 1171 OE2 GLU A 938 3.776 0.995 -25.529 1.00 73.11 O ATOM 1172 H GLU A 938 2.037 5.665 -21.785 1.00 0.00 H ATOM 1173 N TYR A 939 1.568 2.680 -20.562 1.00 26.96 N ATOM 1174 CA TYR A 939 1.311 1.659 -19.552 1.00 26.24 C ATOM 1175 C TYR A 939 -0.159 1.675 -19.088 1.00 30.06 C ATOM 1176 O TYR A 939 -0.760 0.609 -19.017 1.00 28.96 O ATOM 1177 CB TYR A 939 2.293 1.765 -18.368 1.00 26.83 C ATOM 1178 CG TYR A 939 1.907 0.890 -17.188 1.00 29.12 C ATOM 1179 CD1 TYR A 939 2.046 -0.498 -17.247 1.00 30.82 C ATOM 1180 CD2 TYR A 939 1.448 1.451 -15.998 1.00 29.34 C ATOM 1181 CE1 TYR A 939 1.699 -1.307 -16.164 1.00 33.04 C ATOM 1182 CE2 TYR A 939 1.078 0.653 -14.916 1.00 30.45 C ATOM 1183 CZ TYR A 939 1.219 -0.727 -14.997 1.00 36.58 C ATOM 1184 OH TYR A 939 0.862 -1.517 -13.931 1.00 33.72 O ATOM 1185 HH TYR A 939 1.026 -2.467 -14.156 1.00 0.00 H ATOM 1186 H TYR A 939 2.252 3.434 -20.350 1.00 0.00 H ATOM 1187 N LEU A 940 -0.769 2.869 -18.840 1.00 27.54 N ATOM 1188 CA LEU A 940 -2.193 2.928 -18.436 1.00 27.56 C ATOM 1189 C LEU A 940 -3.104 2.319 -19.486 1.00 30.28 C ATOM 1190 O LEU A 940 -4.092 1.662 -19.153 1.00 30.01 O ATOM 1191 CB LEU A 940 -2.670 4.375 -18.200 1.00 27.20 C ATOM 1192 CG LEU A 940 -2.271 5.032 -16.931 1.00 31.87 C ATOM 1193 CD1 LEU A 940 -2.978 6.394 -16.815 1.00 32.86 C ATOM 1194 CD2 LEU A 940 -2.600 4.144 -15.734 1.00 30.39 C ATOM 1195 H LEU A 940 -0.227 3.751 -18.936 1.00 0.00 H ATOM 1196 N GLY A 941 -2.790 2.607 -20.741 1.00 27.16 N ATOM 1197 CA GLY A 941 -3.501 2.075 -21.888 1.00 27.11 C ATOM 1198 C GLY A 941 -3.419 0.568 -21.965 1.00 30.72 C ATOM 1199 O GLY A 941 -4.414 -0.079 -22.292 1.00 30.53 O ATOM 1200 H GLY A 941 -1.990 3.249 -20.913 1.00 0.00 H ATOM 1201 N SER A 942 -2.244 -0.002 -21.615 1.00 28.66 N ATOM 1202 CA SER A 942 -2.020 -1.455 -21.600 1.00 28.09 C ATOM 1203 C SER A 942 -2.877 -2.112 -20.499 1.00 33.93 C ATOM 1204 O SER A 942 -3.261 -3.278 -20.616 1.00 34.59 O ATOM 1205 CB SER A 942 -0.535 -1.770 -21.440 1.00 27.41 C ATOM 1206 OG SER A 942 -0.112 -1.764 -20.092 1.00 31.87 O ATOM 1207 HG SER A 942 -0.274 -0.869 -19.700 1.00 0.00 H ATOM 1208 H SER A 942 -1.457 0.620 -21.342 1.00 0.00 H ATOM 1209 N ARG A 943 -3.257 -1.320 -19.472 1.00 30.16 N ATOM 1210 CA ARG A 943 -4.100 -1.780 -18.367 1.00 28.39 C ATOM 1211 C ARG A 943 -5.550 -1.549 -18.656 1.00 32.52 C ATOM 1212 O ARG A 943 -6.388 -1.847 -17.802 1.00 33.17 O ATOM 1213 CB ARG A 943 -3.706 -1.104 -17.023 1.00 27.59 C ATOM 1214 CG ARG A 943 -2.235 -1.235 -16.612 1.00 30.98 C ATOM 1215 CD ARG A 943 -1.632 -2.618 -16.828 1.00 27.82 C ATOM 1216 NE ARG A 943 -2.407 -3.672 -16.180 1.00 32.75 N ATOM 1217 CZ ARG A 943 -2.155 -4.973 -16.303 1.00 51.27 C ATOM 1218 NH1 ARG A 943 -1.117 -5.394 -17.024 1.00 37.87 N ATOM 1219 NH2 ARG A 943 -2.918 -5.859 -15.687 1.00 33.30 N ATOM 1220 HE ARG A 943 -3.209 -3.387 -15.583 1.00 0.00 H ATOM 1221 HH12 ARG A 943 -0.926 -6.412 -17.116 1.00 0.00 H ATOM 1222 HH11 ARG A 943 -0.497 -4.704 -17.495 1.00 0.00 H ATOM 1223 HH22 ARG A 943 -2.718 -6.875 -15.785 1.00 0.00 H ATOM 1224 HH21 ARG A 943 -3.718 -5.540 -15.104 1.00 0.00 H ATOM 1225 H ARG A 943 -2.934 -0.332 -19.466 1.00 0.00 H ATOM 1226 N ARG A 944 -5.863 -0.988 -19.856 1.00 30.35 N ATOM 1227 CA ARG A 944 -7.222 -0.632 -20.293 1.00 29.61 C ATOM 1228 C ARG A 944 -7.783 0.523 -19.409 1.00 31.89 C ATOM 1229 O ARG A 944 -8.995 0.686 -19.259 1.00 30.77 O ATOM 1230 CB ARG A 944 -8.157 -1.863 -20.282 1.00 29.97 C ATOM 1231 CG ARG A 944 -7.676 -3.011 -21.190 1.00 36.98 C ATOM 1232 CD ARG A 944 -8.770 -4.018 -21.513 1.00 39.29 C ATOM 1233 NE ARG A 944 -9.928 -3.437 -22.211 1.00 32.90 N ATOM 1234 CZ ARG A 944 -9.954 -3.095 -23.495 1.00 41.33 C ATOM 1235 NH1 ARG A 944 -11.059 -2.593 -24.031 1.00 31.67 N ATOM 1236 NH2 ARG A 944 -8.869 -3.215 -24.243 1.00 36.24 N ATOM 1237 HE ARG A 944 -10.794 -3.282 -21.656 1.00 0.00 H ATOM 1238 HH12 ARG A 944 -11.075 -2.327 -25.036 1.00 0.00 H ATOM 1239 HH11 ARG A 944 -11.909 -2.466 -23.446 1.00 0.00 H ATOM 1240 HH22 ARG A 944 -8.897 -2.945 -25.247 1.00 0.00 H ATOM 1241 HH21 ARG A 944 -7.988 -3.579 -23.827 1.00 0.00 H ATOM 1242 H ARG A 944 -5.081 -0.796 -20.515 1.00 0.00 H ATOM 1243 N CYS A 945 -6.882 1.317 -18.827 1.00 27.92 N ATOM 1244 CA CYS A 945 -7.261 2.432 -17.978 1.00 27.96 C ATOM 1245 C CYS A 945 -7.310 3.747 -18.742 1.00 31.66 C ATOM 1246 O CYS A 945 -6.348 4.133 -19.400 1.00 30.18 O ATOM 1247 CB CYS A 945 -6.342 2.528 -16.765 1.00 28.47 C ATOM 1248 SG CYS A 945 -6.775 3.877 -15.628 1.00 32.40 S ATOM 1249 H CYS A 945 -5.872 1.130 -18.987 1.00 0.00 H ATOM 1250 N VAL A 946 -8.439 4.439 -18.633 1.00 29.40 N ATOM 1251 CA VAL A 946 -8.644 5.776 -19.198 1.00 28.61 C ATOM 1252 C VAL A 946 -8.464 6.741 -17.996 1.00 30.16 C ATOM 1253 O VAL A 946 -9.176 6.590 -17.011 1.00 28.04 O ATOM 1254 CB VAL A 946 -10.033 5.914 -19.875 1.00 32.39 C ATOM 1255 CG1 VAL A 946 -10.331 7.365 -20.232 1.00 32.87 C ATOM 1256 CG2 VAL A 946 -10.097 5.060 -21.143 1.00 31.97 C ATOM 1257 H VAL A 946 -9.228 4.004 -18.113 1.00 0.00 H ATOM 1258 N HIS A 947 -7.490 7.659 -18.057 1.00 26.65 N ATOM 1259 CA HIS A 947 -7.238 8.612 -16.948 1.00 27.77 C ATOM 1260 C HIS A 947 -8.348 9.681 -16.809 1.00 31.30 C ATOM 1261 O HIS A 947 -8.817 9.915 -15.691 1.00 30.52 O ATOM 1262 CB HIS A 947 -5.833 9.251 -17.049 1.00 27.91 C ATOM 1263 CG HIS A 947 -5.452 10.076 -15.850 1.00 30.28 C ATOM 1264 ND1 HIS A 947 -5.950 11.354 -15.660 1.00 32.02 N ATOM 1265 CD2 HIS A 947 -4.615 9.782 -14.827 1.00 31.44 C ATOM 1266 CE1 HIS A 947 -5.404 11.792 -14.530 1.00 31.47 C ATOM 1267 NE2 HIS A 947 -4.596 10.881 -13.995 1.00 31.01 N ATOM 1268 H HIS A 947 -6.893 7.705 -18.907 1.00 0.00 H ATOM 1269 N ARG A 948 -8.774 10.286 -17.946 1.00 29.65 N ATOM 1270 CA ARG A 948 -9.849 11.296 -18.092 1.00 31.01 C ATOM 1271 C ARG A 948 -9.504 12.687 -17.499 1.00 35.85 C ATOM 1272 O ARG A 948 -10.264 13.631 -17.718 1.00 37.83 O ATOM 1273 CB ARG A 948 -11.218 10.773 -17.530 1.00 33.35 C ATOM 1274 CG ARG A 948 -12.361 11.832 -17.536 1.00 43.43 C ATOM 1275 CD ARG A 948 -13.796 11.313 -17.446 1.00 53.98 C ATOM 1276 NE ARG A 948 -13.981 10.278 -16.428 1.00 50.43 N ATOM 1277 CZ ARG A 948 -15.002 10.240 -15.586 1.00 66.53 C ATOM 1278 NH1 ARG A 948 -15.927 11.190 -15.613 1.00 61.00 N ATOM 1279 NH2 ARG A 948 -15.103 9.258 -14.701 1.00 56.38 N ATOM 1280 HE ARG A 948 -13.266 9.526 -16.362 1.00 0.00 H ATOM 1281 HH12 ARG A 948 -16.727 11.156 -14.950 1.00 0.00 H ATOM 1282 HH11 ARG A 948 -15.852 11.969 -16.298 1.00 0.00 H ATOM 1283 HH22 ARG A 948 -15.907 9.233 -14.042 1.00 0.00 H ATOM 1284 HH21 ARG A 948 -14.378 8.513 -14.666 1.00 0.00 H ATOM 1285 H ARG A 948 -8.287 10.007 -18.822 1.00 0.00 H ATOM 1286 N ASP A 949 -8.372 12.839 -16.789 1.00 30.32 N ATOM 1287 CA ASP A 949 -8.063 14.140 -16.180 1.00 29.10 C ATOM 1288 C ASP A 949 -6.583 14.487 -16.326 1.00 31.84 C ATOM 1289 O ASP A 949 -5.980 15.060 -15.425 1.00 31.74 O ATOM 1290 CB ASP A 949 -8.518 14.123 -14.708 1.00 30.84 C ATOM 1291 CG ASP A 949 -8.788 15.496 -14.089 1.00 42.50 C ATOM 1292 OD1 ASP A 949 -8.945 16.476 -14.852 1.00 43.26 O ATOM 1293 OD2 ASP A 949 -8.883 15.575 -12.846 1.00 44.37 O ATOM 1294 H ASP A 949 -7.718 12.039 -16.671 1.00 0.00 H ATOM 1295 N LEU A 950 -5.969 14.093 -17.449 1.00 27.77 N ATOM 1296 CA LEU A 950 -4.556 14.353 -17.640 1.00 27.81 C ATOM 1297 C LEU A 950 -4.319 15.849 -17.895 1.00 31.81 C ATOM 1298 O LEU A 950 -4.855 16.412 -18.845 1.00 31.77 O ATOM 1299 CB LEU A 950 -4.021 13.482 -18.785 1.00 28.44 C ATOM 1300 CG LEU A 950 -2.532 13.513 -19.036 1.00 33.97 C ATOM 1301 CD1 LEU A 950 -1.756 12.953 -17.823 1.00 34.67 C ATOM 1302 CD2 LEU A 950 -2.202 12.734 -20.320 1.00 36.07 C ATOM 1303 H LEU A 950 -6.509 13.598 -18.188 1.00 0.00 H ATOM 1304 N ALA A 951 -3.559 16.497 -17.005 1.00 27.33 N ATOM 1305 CA ALA A 951 -3.248 17.935 -17.080 1.00 27.27 C ATOM 1306 C ALA A 951 -2.015 18.140 -16.204 1.00 31.49 C ATOM 1307 O ALA A 951 -1.785 17.318 -15.313 1.00 29.87 O ATOM 1308 CB ALA A 951 -4.432 18.757 -16.563 1.00 27.81 C ATOM 1309 H ALA A 951 -3.164 15.953 -16.212 1.00 0.00 H ATOM 1310 N ALA A 952 -1.201 19.202 -16.452 1.00 30.11 N ATOM 1311 CA ALA A 952 0.043 19.425 -15.680 1.00 28.74 C ATOM 1312 C ALA A 952 -0.173 19.557 -14.179 1.00 31.20 C ATOM 1313 O ALA A 952 0.709 19.186 -13.417 1.00 31.74 O ATOM 1314 CB ALA A 952 0.825 20.605 -16.224 1.00 29.13 C ATOM 1315 H ALA A 952 -1.459 19.874 -17.203 1.00 0.00 H ATOM 1316 N ARG A 953 -1.352 20.026 -13.756 1.00 29.09 N ATOM 1317 CA ARG A 953 -1.739 20.142 -12.343 1.00 30.13 C ATOM 1318 C ARG A 953 -1.888 18.751 -11.684 1.00 34.22 C ATOM 1319 O ARG A 953 -1.853 18.670 -10.454 1.00 32.42 O ATOM 1320 CB ARG A 953 -3.064 20.919 -12.204 1.00 31.40 C ATOM 1321 CG ARG A 953 -4.287 20.166 -12.728 1.00 43.78 C ATOM 1322 CD ARG A 953 -5.574 20.951 -12.558 1.00 56.94 C ATOM 1323 NE ARG A 953 -5.987 21.499 -13.845 1.00 65.02 N ATOM 1324 CZ ARG A 953 -6.792 20.883 -14.702 1.00 68.45 C ATOM 1325 NH1 ARG A 953 -7.339 19.713 -14.388 1.00 49.07 N ATOM 1326 NH2 ARG A 953 -7.080 21.444 -15.865 1.00 46.93 N ATOM 1327 HE ARG A 953 -5.626 22.438 -14.110 1.00 0.00 H ATOM 1328 HH12 ARG A 953 -7.969 19.235 -15.064 1.00 0.00 H ATOM 1329 HH11 ARG A 953 -7.137 19.275 -13.467 1.00 0.00 H ATOM 1330 HH22 ARG A 953 -7.711 20.959 -16.534 1.00 0.00 H ATOM 1331 HH21 ARG A 953 -6.675 22.370 -16.110 1.00 0.00 H ATOM 1332 H ARG A 953 -2.040 20.329 -14.474 1.00 0.00 H ATOM 1333 N ASN A 954 -2.101 17.671 -12.510 1.00 31.83 N ATOM 1334 CA ASN A 954 -2.316 16.278 -12.060 1.00 31.99 C ATOM 1335 C ASN A 954 -1.111 15.389 -12.273 1.00 33.27 C ATOM 1336 O ASN A 954 -1.220 14.171 -12.194 1.00 33.27 O ATOM 1337 CB ASN A 954 -3.579 15.665 -12.704 1.00 32.31 C ATOM 1338 CG ASN A 954 -4.827 16.370 -12.292 1.00 53.35 C ATOM 1339 OD1 ASN A 954 -4.964 16.806 -11.145 1.00 47.29 O ATOM 1340 ND2 ASN A 954 -5.738 16.565 -13.236 1.00 38.70 N ATOM 1341 HD22 ASN A 954 -5.587 16.182 -14.191 1.00 0.00 H ATOM 1342 HD21 ASN A 954 -6.603 17.101 -13.021 1.00 0.00 H ATOM 1343 H ASN A 954 -2.112 17.849 -13.535 1.00 0.00 H ATOM 1344 N ILE A 955 0.008 15.999 -12.639 1.00 28.46 N ATOM 1345 CA ILE A 955 1.287 15.322 -12.786 1.00 27.44 C ATOM 1346 C ILE A 955 2.103 15.795 -11.580 1.00 28.75 C ATOM 1347 O ILE A 955 1.980 16.950 -11.190 1.00 26.85 O ATOM 1348 CB ILE A 955 1.942 15.590 -14.162 1.00 30.84 C ATOM 1349 CG1 ILE A 955 1.160 14.796 -15.260 1.00 31.41 C ATOM 1350 CG2 ILE A 955 3.432 15.175 -14.172 1.00 29.81 C ATOM 1351 CD1 ILE A 955 0.903 15.533 -16.443 1.00 39.63 C ATOM 1352 H ILE A 955 -0.031 17.020 -12.832 1.00 0.00 H ATOM 1353 N LEU A 956 2.849 14.883 -10.945 1.00 25.33 N ATOM 1354 CA LEU A 956 3.688 15.190 -9.789 1.00 25.02 C ATOM 1355 C LEU A 956 5.160 15.084 -10.145 1.00 29.00 C ATOM 1356 O LEU A 956 5.517 14.363 -11.047 1.00 27.38 O ATOM 1357 CB LEU A 956 3.380 14.228 -8.651 1.00 24.97 C ATOM 1358 CG LEU A 956 2.065 14.338 -7.948 1.00 29.28 C ATOM 1359 CD1 LEU A 956 1.928 13.164 -6.985 1.00 29.52 C ATOM 1360 CD2 LEU A 956 1.985 15.627 -7.151 1.00 32.96 C ATOM 1361 H LEU A 956 2.830 13.903 -11.293 1.00 0.00 H ATOM 1362 N VAL A 957 6.009 15.788 -9.404 1.00 28.20 N ATOM 1363 CA VAL A 957 7.439 15.832 -9.652 1.00 27.73 C ATOM 1364 C VAL A 957 8.161 15.032 -8.557 1.00 29.45 C ATOM 1365 O VAL A 957 8.119 15.399 -7.385 1.00 29.12 O ATOM 1366 CB VAL A 957 7.930 17.304 -9.731 1.00 31.02 C ATOM 1367 CG1 VAL A 957 9.443 17.379 -9.874 1.00 31.21 C ATOM 1368 CG2 VAL A 957 7.227 18.076 -10.859 1.00 30.08 C ATOM 1369 H VAL A 957 5.630 16.336 -8.605 1.00 0.00 H ATOM 1370 N GLU A 958 8.842 13.967 -8.960 1.00 26.53 N ATOM 1371 CA GLU A 958 9.632 13.120 -8.058 1.00 27.08 C ATOM 1372 C GLU A 958 10.985 13.807 -7.853 1.00 34.29 C ATOM 1373 O GLU A 958 11.475 13.895 -6.728 1.00 34.11 O ATOM 1374 CB GLU A 958 9.792 11.711 -8.671 1.00 28.24 C ATOM 1375 CG GLU A 958 10.796 10.797 -7.976 1.00 40.12 C ATOM 1376 CD GLU A 958 10.425 10.350 -6.575 1.00 56.14 C ATOM 1377 OE1 GLU A 958 9.237 10.034 -6.330 1.00 49.06 O ATOM 1378 OE2 GLU A 958 11.344 10.271 -5.730 1.00 59.50 O ATOM 1379 H GLU A 958 8.815 13.719 -9.970 1.00 0.00 H ATOM 1380 N SER A 959 11.576 14.298 -8.948 1.00 32.28 N ATOM 1381 CA SER A 959 12.845 15.024 -8.936 1.00 32.95 C ATOM 1382 C SER A 959 12.913 15.882 -10.189 1.00 37.28 C ATOM 1383 O SER A 959 12.057 15.774 -11.059 1.00 35.88 O ATOM 1384 CB SER A 959 14.027 14.046 -8.914 1.00 36.14 C ATOM 1385 OG SER A 959 14.242 13.473 -10.196 1.00 43.40 O ATOM 1386 HG SER A 959 15.008 12.848 -10.152 1.00 0.00 H ATOM 1387 H SER A 959 11.104 14.155 -9.864 1.00 0.00 H ATOM 1388 N GLU A 960 13.978 16.684 -10.300 1.00 36.26 N ATOM 1389 CA GLU A 960 14.353 17.527 -11.434 1.00 36.61 C ATOM 1390 C GLU A 960 14.328 16.719 -12.759 1.00 37.35 C ATOM 1391 O GLU A 960 14.081 17.294 -13.803 1.00 36.95 O ATOM 1392 CB GLU A 960 15.791 18.059 -11.144 1.00 38.87 C ATOM 1393 CG GLU A 960 16.449 18.901 -12.214 1.00 55.21 C ATOM 1394 CD GLU A 960 16.775 20.347 -11.890 1.00 73.33 C ATOM 1395 OE1 GLU A 960 16.318 20.870 -10.845 1.00 68.69 O ATOM 1396 OE2 GLU A 960 17.466 20.971 -12.726 1.00 54.51 O ATOM 1397 H GLU A 960 14.617 16.711 -9.480 1.00 0.00 H ATOM 1398 N ALA A 961 14.589 15.404 -12.723 1.00 33.73 N ATOM 1399 CA ALA A 961 14.627 14.568 -13.932 1.00 33.40 C ATOM 1400 C ALA A 961 13.583 13.418 -13.906 1.00 34.78 C ATOM 1401 O ALA A 961 13.765 12.402 -14.577 1.00 33.42 O ATOM 1402 CB ALA A 961 16.038 14.007 -14.098 1.00 34.45 C ATOM 1403 H ALA A 961 14.772 14.957 -11.802 1.00 0.00 H ATOM 1404 N HIS A 962 12.483 13.576 -13.134 1.00 31.96 N ATOM 1405 CA HIS A 962 11.511 12.481 -12.995 1.00 30.26 C ATOM 1406 C HIS A 962 10.137 12.969 -12.598 1.00 31.31 C ATOM 1407 O HIS A 962 9.964 13.551 -11.527 1.00 28.71 O ATOM 1408 CB HIS A 962 12.057 11.425 -11.990 1.00 30.60 C ATOM 1409 CG HIS A 962 11.288 10.137 -11.870 1.00 34.07 C ATOM 1410 ND1 HIS A 962 11.703 9.139 -11.003 1.00 36.29 N ATOM 1411 CD2 HIS A 962 10.140 9.733 -12.470 1.00 34.72 C ATOM 1412 CE1 HIS A 962 10.814 8.162 -11.121 1.00 34.83 C ATOM 1413 NE2 HIS A 962 9.860 8.476 -11.997 1.00 34.38 N ATOM 1414 H HIS A 962 12.324 14.476 -12.637 1.00 0.00 H ATOM 1415 N VAL A 963 9.154 12.697 -13.469 1.00 28.06 N ATOM 1416 CA VAL A 963 7.754 13.037 -13.240 1.00 27.94 C ATOM 1417 C VAL A 963 6.885 11.758 -13.157 1.00 30.65 C ATOM 1418 O VAL A 963 7.258 10.702 -13.685 1.00 28.04 O ATOM 1419 CB VAL A 963 7.168 14.107 -14.218 1.00 30.68 C ATOM 1420 CG1 VAL A 963 7.919 15.433 -14.117 1.00 29.90 C ATOM 1421 CG2 VAL A 963 7.119 13.603 -15.665 1.00 30.49 C ATOM 1422 H VAL A 963 9.404 12.217 -14.357 1.00 0.00 H ATOM 1423 N LYS A 964 5.726 11.880 -12.504 1.00 27.40 N ATOM 1424 CA LYS A 964 4.792 10.773 -12.297 1.00 27.29 C ATOM 1425 C LYS A 964 3.362 11.248 -12.482 1.00 30.95 C ATOM 1426 O LYS A 964 2.994 12.319 -11.996 1.00 30.17 O ATOM 1427 CB LYS A 964 4.948 10.197 -10.859 1.00 28.42 C ATOM 1428 CG LYS A 964 6.266 9.483 -10.620 1.00 29.45 C ATOM 1429 CD LYS A 964 6.254 8.738 -9.314 1.00 30.69 C ATOM 1430 CE LYS A 964 7.628 8.260 -8.912 1.00 33.49 C ATOM 1431 NZ LYS A 964 7.549 7.277 -7.802 1.00 34.56 N ATOM 1432 HZ1 LYS A 964 7.097 7.722 -6.978 1.00 0.00 H ATOM 1433 HZ2 LYS A 964 6.987 6.457 -8.106 1.00 0.00 H ATOM 1434 HZ3 LYS A 964 8.508 6.966 -7.547 1.00 0.00 H ATOM 1435 H LYS A 964 5.474 12.814 -12.122 1.00 0.00 H ATOM 1436 N ILE A 965 2.543 10.441 -13.150 1.00 26.88 N ATOM 1437 CA ILE A 965 1.123 10.758 -13.332 1.00 25.78 C ATOM 1438 C ILE A 965 0.418 10.459 -11.993 1.00 27.58 C ATOM 1439 O ILE A 965 0.714 9.438 -11.360 1.00 25.06 O ATOM 1440 CB ILE A 965 0.524 9.909 -14.499 1.00 28.81 C ATOM 1441 CG1 ILE A 965 1.250 10.204 -15.837 1.00 29.39 C ATOM 1442 CG2 ILE A 965 -1.010 10.064 -14.614 1.00 26.87 C ATOM 1443 CD1 ILE A 965 1.102 9.093 -16.893 1.00 32.81 C ATOM 1444 H ILE A 965 2.920 9.560 -13.555 1.00 0.00 H ATOM 1445 N ALA A 966 -0.486 11.352 -11.559 1.00 24.46 N ATOM 1446 CA ALA A 966 -1.255 11.153 -10.321 1.00 24.41 C ATOM 1447 C ALA A 966 -2.741 11.420 -10.539 1.00 29.47 C ATOM 1448 O ALA A 966 -3.176 11.631 -11.678 1.00 28.82 O ATOM 1449 CB ALA A 966 -0.712 12.062 -9.224 1.00 25.33 C ATOM 1450 H ALA A 966 -0.648 12.214 -12.118 1.00 0.00 H ATOM 1451 N ASP A 967 -3.529 11.418 -9.435 1.00 27.48 N ATOM 1452 CA ASP A 967 -4.963 11.711 -9.408 1.00 27.58 C ATOM 1453 C ASP A 967 -5.793 10.832 -10.360 1.00 31.34 C ATOM 1454 O ASP A 967 -6.201 11.267 -11.441 1.00 31.85 O ATOM 1455 CB ASP A 967 -5.239 13.212 -9.631 1.00 29.69 C ATOM 1456 CG ASP A 967 -6.649 13.663 -9.257 1.00 39.03 C ATOM 1457 OD1 ASP A 967 -7.476 12.802 -8.894 1.00 37.16 O ATOM 1458 OD2 ASP A 967 -6.909 14.876 -9.296 1.00 50.48 O ATOM 1459 H ASP A 967 -3.075 11.188 -8.528 1.00 0.00 H ATOM 1460 N PHE A 968 -6.139 9.631 -9.884 1.00 27.28 N ATOM 1461 CA PHE A 968 -6.955 8.668 -10.632 1.00 26.97 C ATOM 1462 C PHE A 968 -8.423 8.747 -10.197 1.00 31.55 C ATOM 1463 O PHE A 968 -9.194 7.808 -10.430 1.00 31.15 O ATOM 1464 CB PHE A 968 -6.369 7.241 -10.487 1.00 27.75 C ATOM 1465 CG PHE A 968 -5.081 7.118 -11.269 1.00 27.11 C ATOM 1466 CD1 PHE A 968 -3.898 7.692 -10.792 1.00 28.70 C ATOM 1467 CD2 PHE A 968 -5.061 6.486 -12.505 1.00 26.78 C ATOM 1468 CE1 PHE A 968 -2.725 7.640 -11.551 1.00 28.87 C ATOM 1469 CE2 PHE A 968 -3.892 6.430 -13.256 1.00 28.97 C ATOM 1470 CZ PHE A 968 -2.735 7.021 -12.782 1.00 26.40 C ATOM 1471 H PHE A 968 -5.812 9.366 -8.933 1.00 0.00 H ATOM 1472 N GLY A 969 -8.804 9.904 -9.647 1.00 28.20 N ATOM 1473 CA GLY A 969 -10.160 10.180 -9.171 1.00 28.60 C ATOM 1474 C GLY A 969 -11.253 10.073 -10.224 1.00 32.79 C ATOM 1475 O GLY A 969 -12.394 9.777 -9.883 1.00 34.15 O ATOM 1476 H GLY A 969 -8.092 10.656 -9.551 1.00 0.00 H ATOM 1477 N LEU A 970 -10.931 10.302 -11.503 1.00 30.56 N ATOM 1478 CA LEU A 970 -11.913 10.181 -12.605 1.00 30.87 C ATOM 1479 C LEU A 970 -11.604 9.002 -13.551 1.00 34.73 C ATOM 1480 O LEU A 970 -12.307 8.803 -14.544 1.00 34.29 O ATOM 1481 CB LEU A 970 -12.019 11.505 -13.409 1.00 30.83 C ATOM 1482 CG LEU A 970 -12.484 12.753 -12.602 1.00 35.46 C ATOM 1483 CD1 LEU A 970 -12.189 14.023 -13.360 1.00 35.97 C ATOM 1484 CD2 LEU A 970 -13.950 12.649 -12.237 1.00 37.55 C ATOM 1485 H LEU A 970 -9.954 10.575 -11.732 1.00 0.00 H ATOM 1486 N ALA A 971 -10.562 8.229 -13.241 1.00 31.53 N ATOM 1487 CA ALA A 971 -10.120 7.104 -14.078 1.00 30.63 C ATOM 1488 C ALA A 971 -11.165 5.992 -14.200 1.00 34.87 C ATOM 1489 O ALA A 971 -11.927 5.748 -13.265 1.00 33.10 O ATOM 1490 CB ALA A 971 -8.792 6.547 -13.580 1.00 30.42 C ATOM 1491 H ALA A 971 -10.038 8.432 -12.366 1.00 0.00 H ATOM 1492 N LYS A 972 -11.199 5.339 -15.361 1.00 33.37 N ATOM 1493 CA LYS A 972 -12.137 4.244 -15.642 1.00 34.47 C ATOM 1494 C LYS A 972 -11.439 3.095 -16.349 1.00 36.72 C ATOM 1495 O LYS A 972 -10.561 3.324 -17.176 1.00 34.35 O ATOM 1496 CB LYS A 972 -13.294 4.728 -16.526 1.00 38.09 C ATOM 1497 CG LYS A 972 -14.305 5.602 -15.789 1.00 65.99 C ATOM 1498 CD LYS A 972 -15.640 4.921 -15.615 1.00 82.77 C ATOM 1499 CE LYS A 972 -16.640 5.832 -14.941 1.00101.89 C ATOM 1500 NZ LYS A 972 -16.482 5.847 -13.459 1.00111.76 N ATOM 1501 HZ1 LYS A 972 -16.619 4.886 -13.087 1.00 0.00 H ATOM 1502 HZ2 LYS A 972 -15.527 6.180 -13.217 1.00 0.00 H ATOM 1503 HZ3 LYS A 972 -17.190 6.485 -13.043 1.00 0.00 H ATOM 1504 H LYS A 972 -10.528 5.618 -16.105 1.00 0.00 H ATOM 1505 N LEU A 973 -11.849 1.874 -16.034 1.00 34.03 N ATOM 1506 CA LEU A 973 -11.324 0.677 -16.672 1.00 35.56 C ATOM 1507 C LEU A 973 -12.275 0.329 -17.807 1.00 39.00 C ATOM 1508 O LEU A 973 -13.490 0.270 -17.597 1.00 39.87 O ATOM 1509 CB LEU A 973 -11.276 -0.479 -15.657 1.00 35.91 C ATOM 1510 CG LEU A 973 -9.936 -0.864 -15.011 1.00 39.97 C ATOM 1511 CD1 LEU A 973 -8.887 0.240 -15.069 1.00 39.13 C ATOM 1512 CD2 LEU A 973 -10.146 -1.394 -13.635 1.00 40.71 C ATOM 1513 H LEU A 973 -12.577 1.768 -15.299 1.00 0.00 H ATOM 1514 N LEU A 974 -11.734 0.136 -19.007 1.00 33.11 N ATOM 1515 CA LEU A 974 -12.548 -0.226 -20.165 1.00 32.91 C ATOM 1516 C LEU A 974 -12.907 -1.703 -20.155 1.00 38.15 C ATOM 1517 O LEU A 974 -12.018 -2.541 -19.991 1.00 36.94 O ATOM 1518 CB LEU A 974 -11.826 0.093 -21.477 1.00 32.82 C ATOM 1519 CG LEU A 974 -11.496 1.563 -21.743 1.00 35.63 C ATOM 1520 CD1 LEU A 974 -10.496 1.686 -22.853 1.00 33.68 C ATOM 1521 CD2 LEU A 974 -12.753 2.364 -22.032 1.00 37.96 C ATOM 1522 H LEU A 974 -10.706 0.246 -19.124 1.00 0.00 H ATOM 1523 N PRO A 975 -14.177 -2.065 -20.439 1.00 37.73 N ATOM 1524 CA PRO A 975 -14.520 -3.502 -20.547 1.00 37.27 C ATOM 1525 C PRO A 975 -13.720 -4.148 -21.690 1.00 38.12 C ATOM 1526 O PRO A 975 -13.240 -3.439 -22.572 1.00 34.39 O ATOM 1527 CB PRO A 975 -16.026 -3.484 -20.843 1.00 39.49 C ATOM 1528 CG PRO A 975 -16.495 -2.117 -20.386 1.00 43.71 C ATOM 1529 CD PRO A 975 -15.351 -1.210 -20.706 1.00 39.24 C ATOM 1530 N LEU A 976 -13.519 -5.477 -21.657 1.00 35.81 N ATOM 1531 CA LEU A 976 -12.721 -6.147 -22.704 1.00 35.58 C ATOM 1532 C LEU A 976 -13.269 -5.994 -24.133 1.00 39.00 C ATOM 1533 O LEU A 976 -12.485 -6.040 -25.083 1.00 37.26 O ATOM 1534 CB LEU A 976 -12.498 -7.635 -22.374 1.00 36.01 C ATOM 1535 CG LEU A 976 -11.697 -7.953 -21.097 1.00 40.85 C ATOM 1536 CD1 LEU A 976 -11.735 -9.438 -20.792 1.00 42.01 C ATOM 1537 CD2 LEU A 976 -10.256 -7.492 -21.209 1.00 40.14 C ATOM 1538 H LEU A 976 -13.930 -6.040 -20.885 1.00 0.00 H ATOM 1539 N ASP A 977 -14.587 -5.779 -24.289 1.00 37.41 N ATOM 1540 CA ASP A 977 -15.210 -5.707 -25.621 1.00 38.37 C ATOM 1541 C ASP A 977 -15.608 -4.289 -26.105 1.00 44.23 C ATOM 1542 O ASP A 977 -16.200 -4.166 -27.179 1.00 43.64 O ATOM 1543 CB ASP A 977 -16.425 -6.648 -25.653 1.00 39.97 C ATOM 1544 CG ASP A 977 -17.600 -6.188 -24.797 1.00 45.05 C ATOM 1545 OD1 ASP A 977 -17.418 -5.249 -23.986 1.00 43.84 O ATOM 1546 OD2 ASP A 977 -18.703 -6.739 -24.967 1.00 50.18 O ATOM 1547 H ASP A 977 -15.183 -5.660 -23.445 1.00 0.00 H ATOM 1548 N LYS A 978 -15.283 -3.228 -25.315 1.00 42.37 N ATOM 1549 CA LYS A 978 -15.626 -1.833 -25.611 1.00 42.27 C ATOM 1550 C LYS A 978 -14.382 -0.955 -25.399 1.00 45.79 C ATOM 1551 O LYS A 978 -13.775 -1.039 -24.329 1.00 45.09 O ATOM 1552 CB LYS A 978 -16.780 -1.394 -24.684 1.00 44.96 C ATOM 1553 CG LYS A 978 -17.658 -0.282 -25.244 1.00 51.83 C ATOM 1554 CD LYS A 978 -18.870 -0.058 -24.342 1.00 59.00 C ATOM 1555 CE LYS A 978 -19.743 1.060 -24.849 1.00 70.70 C ATOM 1556 NZ LYS A 978 -20.903 1.311 -23.958 1.00 75.46 N ATOM 1557 HZ1 LYS A 978 -21.483 0.450 -23.895 1.00 0.00 H ATOM 1558 HZ2 LYS A 978 -20.561 1.570 -23.011 1.00 0.00 H ATOM 1559 HZ3 LYS A 978 -21.475 2.088 -24.346 1.00 0.00 H ATOM 1560 H LYS A 978 -14.754 -3.421 -24.440 1.00 0.00 H ATOM 1561 N ASP A 979 -13.969 -0.169 -26.433 1.00 42.15 N ATOM 1562 CA ASP A 979 -12.755 0.671 -26.386 1.00 41.57 C ATOM 1563 C ASP A 979 -12.992 2.155 -26.004 1.00 43.35 C ATOM 1564 O ASP A 979 -12.072 2.967 -26.093 1.00 42.26 O ATOM 1565 CB ASP A 979 -11.959 0.574 -27.693 1.00 43.67 C ATOM 1566 CG ASP A 979 -11.402 -0.811 -27.998 1.00 56.20 C ATOM 1567 OD1 ASP A 979 -10.847 -1.454 -27.070 1.00 54.75 O ATOM 1568 OD2 ASP A 979 -11.523 -1.253 -29.163 1.00 65.36 O ATOM 1569 H ASP A 979 -14.540 -0.160 -27.302 1.00 0.00 H ATOM 1570 N TYR A 980 -14.189 2.485 -25.527 1.00 38.73 N ATOM 1571 CA TYR A 980 -14.555 3.828 -25.087 1.00 38.76 C ATOM 1572 C TYR A 980 -15.631 3.658 -24.021 1.00 44.27 C ATOM 1573 O TYR A 980 -16.110 2.539 -23.812 1.00 44.38 O ATOM 1574 CB TYR A 980 -15.097 4.683 -26.275 1.00 40.52 C ATOM 1575 CG TYR A 980 -16.394 4.157 -26.858 1.00 43.18 C ATOM 1576 CD1 TYR A 980 -16.390 3.169 -27.840 1.00 45.77 C ATOM 1577 CD2 TYR A 980 -17.623 4.575 -26.361 1.00 44.21 C ATOM 1578 CE1 TYR A 980 -17.579 2.615 -28.316 1.00 47.88 C ATOM 1579 CE2 TYR A 980 -18.818 4.042 -26.839 1.00 45.85 C ATOM 1580 CZ TYR A 980 -18.792 3.066 -27.823 1.00 54.83 C ATOM 1581 OH TYR A 980 -19.969 2.549 -28.305 1.00 52.82 O ATOM 1582 HH TYR A 980 -19.771 1.869 -28.997 1.00 0.00 H ATOM 1583 H TYR A 980 -14.910 1.739 -25.463 1.00 0.00 H ATOM 1584 N TYR A 981 -16.025 4.754 -23.366 1.00 42.67 N ATOM 1585 CA TYR A 981 -17.129 4.759 -22.410 1.00 44.90 C ATOM 1586 C TYR A 981 -17.890 6.085 -22.469 1.00 48.97 C ATOM 1587 O TYR A 981 -17.343 7.101 -22.908 1.00 48.43 O ATOM 1588 CB TYR A 981 -16.706 4.356 -20.977 1.00 48.54 C ATOM 1589 CG TYR A 981 -15.871 5.378 -20.250 1.00 53.27 C ATOM 1590 CD1 TYR A 981 -16.465 6.357 -19.456 1.00 55.65 C ATOM 1591 CD2 TYR A 981 -14.483 5.341 -20.310 1.00 55.30 C ATOM 1592 CE1 TYR A 981 -15.695 7.307 -18.781 1.00 58.03 C ATOM 1593 CE2 TYR A 981 -13.702 6.280 -19.636 1.00 56.98 C ATOM 1594 CZ TYR A 981 -14.312 7.262 -18.869 1.00 65.49 C ATOM 1595 OH TYR A 981 -13.534 8.187 -18.209 1.00 64.43 O ATOM 1596 HH TYR A 981 -14.118 8.813 -17.711 1.00 0.00 H ATOM 1597 H TYR A 981 -15.521 5.646 -23.546 1.00 0.00 H ATOM 1598 N VAL A 982 -19.169 6.053 -22.095 1.00 46.86 N ATOM 1599 CA VAL A 982 -20.033 7.232 -22.116 1.00 47.36 C ATOM 1600 C VAL A 982 -20.458 7.590 -20.689 1.00 55.20 C ATOM 1601 O VAL A 982 -20.949 6.732 -19.952 1.00 55.19 O ATOM 1602 CB VAL A 982 -21.239 7.074 -23.082 1.00 50.20 C ATOM 1603 CG1 VAL A 982 -22.039 8.372 -23.181 1.00 49.54 C ATOM 1604 CG2 VAL A 982 -20.786 6.626 -24.472 1.00 50.13 C ATOM 1605 H VAL A 982 -19.570 5.149 -21.774 1.00 0.00 H ATOM 1606 N VAL A 983 -20.253 8.856 -20.306 1.00 54.83 N ATOM 1607 CA VAL A 983 -20.605 9.396 -18.985 1.00 55.95 C ATOM 1608 C VAL A 983 -22.003 10.027 -19.082 1.00 61.80 C ATOM 1609 O VAL A 983 -22.293 10.731 -20.055 1.00 60.68 O ATOM 1610 CB VAL A 983 -19.537 10.403 -18.460 1.00 60.10 C ATOM 1611 CG1 VAL A 983 -19.804 10.792 -17.013 1.00 60.20 C ATOM 1612 CG2 VAL A 983 -18.133 9.833 -18.584 1.00 59.87 C ATOM 1613 H VAL A 983 -19.814 9.503 -20.991 1.00 0.00 H ATOM 1614 N ARG A 984 -22.870 9.744 -18.090 1.00 60.92 N ATOM 1615 CA ARG A 984 -24.246 10.248 -18.036 1.00 61.98 C ATOM 1616 C ARG A 984 -24.307 11.779 -17.947 1.00 66.95 C ATOM 1617 O ARG A 984 -24.896 12.422 -18.823 1.00 66.59 O ATOM 1618 CB ARG A 984 -25.019 9.591 -16.872 1.00 64.13 C ATOM 1619 H ARG A 984 -22.543 9.131 -17.316 1.00 0.00 H ATOM 1620 N GLU A 985 -23.684 12.355 -16.905 1.00 64.29 N ATOM 1621 CA GLU A 985 -23.648 13.797 -16.681 1.00 64.61 C ATOM 1622 C GLU A 985 -22.340 14.404 -17.219 1.00 68.74 C ATOM 1623 O GLU A 985 -21.288 13.777 -17.057 1.00 68.61 O ATOM 1624 CB GLU A 985 -23.811 14.108 -15.181 1.00 66.05 C ATOM 1625 H GLU A 985 -23.201 11.739 -16.220 1.00 0.00 H ATOM 1626 N PRO A 986 -22.357 15.622 -17.832 1.00 64.63 N ATOM 1627 CA PRO A 986 -21.093 16.219 -18.317 1.00 63.59 C ATOM 1628 C PRO A 986 -20.096 16.559 -17.196 1.00 63.33 C ATOM 1629 O PRO A 986 -20.484 16.764 -16.037 1.00 62.38 O ATOM 1630 CB PRO A 986 -21.551 17.451 -19.114 1.00 65.59 C ATOM 1631 CG PRO A 986 -23.045 17.245 -19.338 1.00 70.44 C ATOM 1632 CD PRO A 986 -23.500 16.512 -18.118 1.00 66.09 C ATOM 1633 N GLY A 987 -18.815 16.568 -17.562 1.00 56.67 N ATOM 1634 CA GLY A 987 -17.689 16.786 -16.663 1.00 54.51 C ATOM 1635 C GLY A 987 -17.683 18.063 -15.849 1.00 53.72 C ATOM 1636 O GLY A 987 -18.386 19.029 -16.155 1.00 53.29 O ATOM 1637 H GLY A 987 -18.602 16.407 -18.567 1.00 0.00 H ATOM 1638 N GLN A 988 -16.867 18.066 -14.804 1.00 46.29 N ATOM 1639 CA GLN A 988 -16.727 19.203 -13.920 1.00 44.07 C ATOM 1640 C GLN A 988 -15.305 19.774 -13.926 1.00 43.56 C ATOM 1641 O GLN A 988 -14.974 20.611 -13.086 1.00 42.59 O ATOM 1642 CB GLN A 988 -17.222 18.836 -12.502 1.00 45.84 C ATOM 1643 CG GLN A 988 -18.733 19.049 -12.324 1.00 61.60 C ATOM 1644 CD GLN A 988 -19.193 20.478 -12.594 1.00 77.22 C ATOM 1645 OE1 GLN A 988 -18.569 21.468 -12.172 1.00 68.51 O ATOM 1646 NE2 GLN A 988 -20.293 20.611 -13.326 1.00 69.64 N ATOM 1647 HE22 GLN A 988 -20.796 19.767 -13.667 1.00 0.00 H ATOM 1648 HE21 GLN A 988 -20.651 21.559 -13.559 1.00 0.00 H ATOM 1649 H GLN A 988 -16.303 17.214 -14.611 1.00 0.00 H ATOM 1650 N SER A 989 -14.467 19.336 -14.879 1.00 37.59 N ATOM 1651 CA SER A 989 -13.076 19.824 -14.969 1.00 36.75 C ATOM 1652 C SER A 989 -12.984 21.014 -15.929 1.00 37.32 C ATOM 1653 O SER A 989 -13.795 21.093 -16.852 1.00 34.98 O ATOM 1654 CB SER A 989 -12.144 18.710 -15.464 1.00 39.18 C ATOM 1655 OG SER A 989 -12.174 17.587 -14.597 1.00 47.99 O ATOM 1656 HG SER A 989 -13.096 17.230 -14.553 1.00 0.00 H ATOM 1657 H SER A 989 -14.805 18.636 -15.570 1.00 0.00 H ATOM 1658 N PRO A 990 -11.959 21.899 -15.808 1.00 35.80 N ATOM 1659 CA PRO A 990 -11.783 22.965 -16.823 1.00 35.11 C ATOM 1660 C PRO A 990 -11.895 22.360 -18.230 1.00 36.62 C ATOM 1661 O PRO A 990 -11.282 21.342 -18.519 1.00 35.74 O ATOM 1662 CB PRO A 990 -10.386 23.501 -16.502 1.00 37.25 C ATOM 1663 CG PRO A 990 -10.291 23.330 -15.005 1.00 40.83 C ATOM 1664 CD PRO A 990 -10.882 21.963 -14.794 1.00 36.94 C ATOM 1665 N ILE A 991 -12.792 22.917 -19.059 1.00 32.90 N ATOM 1666 CA ILE A 991 -13.176 22.369 -20.364 1.00 31.85 C ATOM 1667 C ILE A 991 -12.066 22.351 -21.427 1.00 32.68 C ATOM 1668 O ILE A 991 -12.223 21.685 -22.433 1.00 30.82 O ATOM 1669 CB ILE A 991 -14.454 23.101 -20.914 1.00 35.13 C ATOM 1670 CG1 ILE A 991 -14.189 24.614 -21.185 1.00 35.47 C ATOM 1671 CG2 ILE A 991 -15.648 22.870 -19.980 1.00 36.68 C ATOM 1672 CD1 ILE A 991 -15.305 25.396 -22.006 1.00 39.69 C ATOM 1673 H ILE A 991 -13.247 23.801 -18.754 1.00 0.00 H ATOM 1674 N PHE A 992 -10.974 23.096 -21.215 1.00 30.23 N ATOM 1675 CA PHE A 992 -9.907 23.333 -22.194 1.00 28.25 C ATOM 1676 C PHE A 992 -8.959 22.143 -22.425 1.00 31.37 C ATOM 1677 O PHE A 992 -8.080 22.228 -23.289 1.00 29.76 O ATOM 1678 CB PHE A 992 -9.149 24.607 -21.808 1.00 29.69 C ATOM 1679 CG PHE A 992 -10.079 25.776 -21.525 1.00 30.77 C ATOM 1680 CD1 PHE A 992 -10.786 26.391 -22.554 1.00 33.28 C ATOM 1681 CD2 PHE A 992 -10.310 26.202 -20.220 1.00 32.77 C ATOM 1682 CE1 PHE A 992 -11.670 27.447 -22.290 1.00 34.85 C ATOM 1683 CE2 PHE A 992 -11.176 27.276 -19.960 1.00 35.80 C ATOM 1684 CZ PHE A 992 -11.842 27.892 -21.000 1.00 34.08 C ATOM 1685 H PHE A 992 -10.874 23.543 -20.281 1.00 0.00 H ATOM 1686 N TRP A 993 -9.156 21.030 -21.703 1.00 28.19 N ATOM 1687 CA TRP A 993 -8.359 19.808 -21.893 1.00 28.23 C ATOM 1688 C TRP A 993 -9.197 18.703 -22.592 1.00 32.67 C ATOM 1689 O TRP A 993 -8.630 17.710 -23.042 1.00 31.99 O ATOM 1690 CB TRP A 993 -7.809 19.295 -20.533 1.00 27.22 C ATOM 1691 CG TRP A 993 -6.611 20.067 -20.027 1.00 27.76 C ATOM 1692 CD1 TRP A 993 -5.300 19.682 -20.079 1.00 29.74 C ATOM 1693 CD2 TRP A 993 -6.624 21.375 -19.425 1.00 27.65 C ATOM 1694 NE1 TRP A 993 -4.496 20.662 -19.530 1.00 29.05 N ATOM 1695 CE2 TRP A 993 -5.285 21.708 -19.114 1.00 30.82 C ATOM 1696 CE3 TRP A 993 -7.643 22.293 -19.101 1.00 28.77 C ATOM 1697 CZ2 TRP A 993 -4.934 22.937 -18.533 1.00 30.41 C ATOM 1698 CZ3 TRP A 993 -7.293 23.504 -18.516 1.00 30.04 C ATOM 1699 CH2 TRP A 993 -5.953 23.821 -18.250 1.00 30.55 C ATOM 1700 HE1 TRP A 993 -3.460 20.616 -19.445 1.00 0.00 H ATOM 1701 H TRP A 993 -9.903 21.031 -20.979 1.00 0.00 H ATOM 1702 N TYR A 994 -10.538 18.853 -22.644 1.00 30.39 N ATOM 1703 CA TYR A 994 -11.424 17.821 -23.224 1.00 31.85 C ATOM 1704 C TYR A 994 -11.363 17.715 -24.729 1.00 35.50 C ATOM 1705 O TYR A 994 -11.386 18.730 -25.428 1.00 35.63 O ATOM 1706 CB TYR A 994 -12.902 18.048 -22.853 1.00 33.55 C ATOM 1707 CG TYR A 994 -13.282 17.931 -21.388 1.00 36.42 C ATOM 1708 CD1 TYR A 994 -13.101 16.738 -20.691 1.00 38.34 C ATOM 1709 CD2 TYR A 994 -13.987 18.948 -20.755 1.00 37.64 C ATOM 1710 CE1 TYR A 994 -13.542 16.594 -19.373 1.00 38.36 C ATOM 1711 CE2 TYR A 994 -14.411 18.828 -19.434 1.00 38.60 C ATOM 1712 CZ TYR A 994 -14.196 17.646 -18.748 1.00 46.06 C ATOM 1713 OH TYR A 994 -14.618 17.560 -17.440 1.00 45.25 O ATOM 1714 HH TYR A 994 -14.399 16.664 -17.082 1.00 0.00 H ATOM 1715 H TYR A 994 -10.962 19.723 -22.263 1.00 0.00 H ATOM 1716 N ALA A 995 -11.418 16.473 -25.236 1.00 33.04 N ATOM 1717 CA ALA A 995 -11.485 16.179 -26.664 1.00 32.59 C ATOM 1718 C ALA A 995 -12.855 16.627 -27.258 1.00 36.55 C ATOM 1719 O ALA A 995 -13.823 16.749 -26.488 1.00 36.37 O ATOM 1720 CB ALA A 995 -11.278 14.679 -26.887 1.00 33.29 C ATOM 1721 H ALA A 995 -11.413 15.673 -24.572 1.00 0.00 H ATOM 1722 N PRO A 996 -12.975 16.896 -28.590 1.00 34.14 N ATOM 1723 CA PRO A 996 -14.293 17.304 -29.147 1.00 34.89 C ATOM 1724 C PRO A 996 -15.406 16.303 -28.877 1.00 38.42 C ATOM 1725 O PRO A 996 -16.493 16.724 -28.488 1.00 36.38 O ATOM 1726 CB PRO A 996 -14.032 17.461 -30.651 1.00 36.35 C ATOM 1727 CG PRO A 996 -12.578 17.596 -30.784 1.00 40.71 C ATOM 1728 CD PRO A 996 -11.954 16.832 -29.652 1.00 35.97 C ATOM 1729 N GLU A 997 -15.110 14.975 -28.982 1.00 36.06 N ATOM 1730 CA GLU A 997 -16.099 13.921 -28.714 1.00 34.99 C ATOM 1731 C GLU A 997 -16.527 13.893 -27.251 1.00 38.46 C ATOM 1732 O GLU A 997 -17.664 13.521 -26.979 1.00 38.68 O ATOM 1733 CB GLU A 997 -15.651 12.530 -29.223 1.00 36.40 C ATOM 1734 CG GLU A 997 -14.466 11.899 -28.493 1.00 39.67 C ATOM 1735 CD GLU A 997 -13.077 12.307 -28.939 1.00 47.54 C ATOM 1736 OE1 GLU A 997 -12.104 11.671 -28.471 1.00 39.93 O ATOM 1737 OE2 GLU A 997 -12.951 13.260 -29.743 1.00 40.34 O ATOM 1738 H GLU A 997 -14.148 14.698 -29.262 1.00 0.00 H ATOM 1739 N SER A 998 -15.645 14.319 -26.305 1.00 32.84 N ATOM 1740 CA SER A 998 -16.033 14.395 -24.898 1.00 32.49 C ATOM 1741 C SER A 998 -16.926 15.622 -24.717 1.00 38.11 C ATOM 1742 O SER A 998 -17.940 15.539 -24.018 1.00 36.68 O ATOM 1743 CB SER A 998 -14.810 14.488 -23.982 1.00 34.30 C ATOM 1744 OG SER A 998 -13.882 13.448 -24.256 1.00 38.28 O ATOM 1745 HG SER A 998 -13.104 13.534 -23.650 1.00 0.00 H ATOM 1746 H SER A 998 -14.683 14.594 -26.587 1.00 0.00 H ATOM 1747 N LEU A 999 -16.550 16.764 -25.342 1.00 36.69 N ATOM 1748 CA LEU A 999 -17.348 18.001 -25.265 1.00 37.62 C ATOM 1749 C LEU A 999 -18.741 17.777 -25.877 1.00 43.75 C ATOM 1750 O LEU A 999 -19.743 18.130 -25.259 1.00 44.09 O ATOM 1751 CB LEU A 999 -16.654 19.189 -25.982 1.00 36.88 C ATOM 1752 CG LEU A 999 -15.354 19.758 -25.357 1.00 40.75 C ATOM 1753 CD1 LEU A 999 -14.727 20.768 -26.267 1.00 40.53 C ATOM 1754 CD2 LEU A 999 -15.605 20.406 -23.995 1.00 40.13 C ATOM 1755 H LEU A 999 -15.669 16.768 -25.895 1.00 0.00 H ATOM 1756 N SER A1000 -18.804 17.149 -27.047 1.00 42.52 N ATOM 1757 CA SER A1000 -20.088 16.922 -27.715 1.00 44.16 C ATOM 1758 C SER A1000 -20.891 15.755 -27.181 1.00 51.00 C ATOM 1759 O SER A1000 -22.085 15.935 -26.928 1.00 52.44 O ATOM 1760 CB SER A1000 -19.916 16.790 -29.223 1.00 48.12 C ATOM 1761 OG SER A1000 -19.021 15.756 -29.596 1.00 56.94 O ATOM 1762 HG SER A1000 -18.129 15.938 -29.208 1.00 0.00 H ATOM 1763 H SER A1000 -17.928 16.813 -27.495 1.00 0.00 H ATOM 1764 N ASP A1001 -20.276 14.563 -27.007 1.00 47.15 N ATOM 1765 CA ASP A1001 -21.057 13.382 -26.626 1.00 46.48 C ATOM 1766 C ASP A1001 -20.696 12.692 -25.305 1.00 48.14 C ATOM 1767 O ASP A1001 -21.279 11.642 -25.027 1.00 46.67 O ATOM 1768 CB ASP A1001 -20.993 12.362 -27.773 1.00 48.54 C ATOM 1769 CG ASP A1001 -21.591 12.888 -29.065 1.00 59.99 C ATOM 1770 OD1 ASP A1001 -22.831 13.027 -29.131 1.00 62.77 O ATOM 1771 OD2 ASP A1001 -20.816 13.191 -29.998 1.00 63.66 O ATOM 1772 H ASP A1001 -19.248 14.484 -27.144 1.00 0.00 H ATOM 1773 N ASN A1002 -19.780 13.268 -24.479 1.00 42.92 N ATOM 1774 CA ASN A1002 -19.329 12.673 -23.202 1.00 41.63 C ATOM 1775 C ASN A1002 -18.650 11.316 -23.410 1.00 41.76 C ATOM 1776 O ASN A1002 -18.750 10.423 -22.560 1.00 41.04 O ATOM 1777 CB ASN A1002 -20.457 12.587 -22.146 1.00 45.79 C ATOM 1778 CG ASN A1002 -21.075 13.914 -21.781 1.00 76.46 C ATOM 1779 OD1 ASN A1002 -20.401 14.839 -21.324 1.00 74.45 O ATOM 1780 ND2 ASN A1002 -22.382 14.028 -21.952 1.00 71.64 N ATOM 1781 HD22 ASN A1002 -22.927 13.232 -22.340 1.00 0.00 H ATOM 1782 HD21 ASN A1002 -22.864 14.914 -21.699 1.00 0.00 H ATOM 1783 H ASN A1002 -19.373 14.182 -24.763 1.00 0.00 H ATOM 1784 N ILE A1003 -17.974 11.172 -24.562 1.00 36.48 N ATOM 1785 CA ILE A1003 -17.261 9.966 -24.954 1.00 35.49 C ATOM 1786 C ILE A1003 -15.823 10.090 -24.482 1.00 37.68 C ATOM 1787 O ILE A1003 -15.143 11.060 -24.814 1.00 37.58 O ATOM 1788 CB ILE A1003 -17.347 9.688 -26.490 1.00 38.13 C ATOM 1789 CG1 ILE A1003 -18.802 9.373 -26.932 1.00 37.99 C ATOM 1790 CG2 ILE A1003 -16.383 8.542 -26.916 1.00 38.62 C ATOM 1791 CD1 ILE A1003 -19.002 9.269 -28.446 1.00 42.86 C ATOM 1792 H ILE A1003 -17.959 11.978 -25.219 1.00 0.00 H ATOM 1793 N PHE A1004 -15.357 9.097 -23.735 1.00 33.51 N ATOM 1794 CA PHE A1004 -13.978 9.065 -23.248 1.00 32.70 C ATOM 1795 C PHE A1004 -13.324 7.744 -23.645 1.00 38.14 C ATOM 1796 O PHE A1004 -13.970 6.695 -23.659 1.00 37.75 O ATOM 1797 CB PHE A1004 -13.922 9.318 -21.736 1.00 33.95 C ATOM 1798 CG PHE A1004 -14.431 10.682 -21.312 1.00 34.71 C ATOM 1799 CD1 PHE A1004 -15.793 10.907 -21.119 1.00 36.80 C ATOM 1800 CD2 PHE A1004 -13.549 11.732 -21.087 1.00 36.26 C ATOM 1801 CE1 PHE A1004 -16.261 12.168 -20.731 1.00 37.82 C ATOM 1802 CE2 PHE A1004 -14.013 12.984 -20.669 1.00 37.52 C ATOM 1803 CZ PHE A1004 -15.364 13.192 -20.490 1.00 36.50 C ATOM 1804 H PHE A1004 -15.995 8.314 -23.487 1.00 0.00 H ATOM 1805 N SER A1005 -12.051 7.809 -24.010 1.00 34.83 N ATOM 1806 CA SER A1005 -11.276 6.652 -24.454 1.00 34.60 C ATOM 1807 C SER A1005 -9.789 6.951 -24.239 1.00 35.86 C ATOM 1808 O SER A1005 -9.442 8.039 -23.784 1.00 32.49 O ATOM 1809 CB SER A1005 -11.526 6.417 -25.947 1.00 37.06 C ATOM 1810 OG SER A1005 -10.885 7.421 -26.720 1.00 39.16 O ATOM 1811 HG SER A1005 -11.243 8.309 -26.468 1.00 0.00 H ATOM 1812 H SER A1005 -11.578 8.735 -23.979 1.00 0.00 H ATOM 1813 N ARG A1006 -8.919 6.028 -24.670 1.00 32.02 N ATOM 1814 CA ARG A1006 -7.482 6.229 -24.605 1.00 32.38 C ATOM 1815 C ARG A1006 -7.062 7.289 -25.630 1.00 36.09 C ATOM 1816 O ARG A1006 -6.063 7.974 -25.425 1.00 34.60 O ATOM 1817 CB ARG A1006 -6.736 4.893 -24.779 1.00 35.31 C ATOM 1818 CG ARG A1006 -7.012 3.940 -23.590 1.00 37.26 C ATOM 1819 CD ARG A1006 -6.556 2.517 -23.843 1.00 40.71 C ATOM 1820 NE ARG A1006 -7.333 1.895 -24.915 1.00 45.70 N ATOM 1821 CZ ARG A1006 -7.371 0.597 -25.170 1.00 45.70 C ATOM 1822 NH1 ARG A1006 -6.686 -0.253 -24.420 1.00 28.95 N ATOM 1823 NH2 ARG A1006 -8.105 0.136 -26.165 1.00 37.33 N ATOM 1824 HE ARG A1006 -7.899 2.521 -25.523 1.00 0.00 H ATOM 1825 HH12 ARG A1006 -6.720 -1.272 -24.625 1.00 0.00 H ATOM 1826 HH11 ARG A1006 -6.114 0.098 -23.626 1.00 0.00 H ATOM 1827 HH22 ARG A1006 -8.132 -0.885 -26.362 1.00 0.00 H ATOM 1828 HH21 ARG A1006 -8.657 0.794 -26.752 1.00 0.00 H ATOM 1829 H ARG A1006 -9.285 5.138 -25.064 1.00 0.00 H ATOM 1830 N GLN A1007 -7.881 7.468 -26.701 1.00 31.34 N ATOM 1831 CA GLN A1007 -7.684 8.457 -27.755 1.00 30.76 C ATOM 1832 C GLN A1007 -8.078 9.877 -27.270 1.00 32.79 C ATOM 1833 O GLN A1007 -7.514 10.859 -27.745 1.00 33.61 O ATOM 1834 CB GLN A1007 -8.464 8.047 -29.024 1.00 32.99 C ATOM 1835 CG GLN A1007 -7.918 6.759 -29.715 1.00 37.19 C ATOM 1836 CD GLN A1007 -8.262 5.460 -28.993 1.00 59.76 C ATOM 1837 OE1 GLN A1007 -9.312 5.315 -28.344 1.00 53.85 O ATOM 1838 NE2 GLN A1007 -7.356 4.486 -29.054 1.00 54.29 N ATOM 1839 HE22 GLN A1007 -6.482 4.622 -29.601 1.00 0.00 H ATOM 1840 HE21 GLN A1007 -7.522 3.589 -28.554 1.00 0.00 H ATOM 1841 H GLN A1007 -8.714 6.850 -26.774 1.00 0.00 H ATOM 1842 N SER A1008 -9.022 9.991 -26.320 1.00 29.11 N ATOM 1843 CA SER A1008 -9.345 11.297 -25.746 1.00 28.11 C ATOM 1844 C SER A1008 -8.243 11.669 -24.717 1.00 32.60 C ATOM 1845 O SER A1008 -7.964 12.856 -24.552 1.00 31.29 O ATOM 1846 CB SER A1008 -10.749 11.336 -25.157 1.00 26.67 C ATOM 1847 OG SER A1008 -10.905 10.472 -24.050 1.00 32.83 O ATOM 1848 HG SER A1008 -10.271 10.734 -23.336 1.00 0.00 H ATOM 1849 H SER A1008 -9.527 9.144 -25.990 1.00 0.00 H ATOM 1850 N ASP A1009 -7.556 10.646 -24.096 1.00 28.73 N ATOM 1851 CA ASP A1009 -6.401 10.888 -23.216 1.00 27.80 C ATOM 1852 C ASP A1009 -5.231 11.425 -24.065 1.00 31.98 C ATOM 1853 O ASP A1009 -4.452 12.260 -23.581 1.00 29.53 O ATOM 1854 CB ASP A1009 -5.975 9.612 -22.475 1.00 29.27 C ATOM 1855 CG ASP A1009 -6.659 9.346 -21.145 1.00 32.82 C ATOM 1856 OD1 ASP A1009 -7.520 10.178 -20.728 1.00 32.50 O ATOM 1857 OD2 ASP A1009 -6.400 8.271 -20.551 1.00 31.16 O ATOM 1858 H ASP A1009 -7.866 9.666 -24.256 1.00 0.00 H ATOM 1859 N VAL A1010 -5.125 10.956 -25.338 1.00 28.85 N ATOM 1860 CA VAL A1010 -4.109 11.418 -26.298 1.00 28.01 C ATOM 1861 C VAL A1010 -4.359 12.907 -26.591 1.00 31.87 C ATOM 1862 O VAL A1010 -3.391 13.661 -26.634 1.00 30.03 O ATOM 1863 CB VAL A1010 -4.014 10.578 -27.609 1.00 31.53 C ATOM 1864 CG1 VAL A1010 -3.044 11.214 -28.612 1.00 30.47 C ATOM 1865 CG2 VAL A1010 -3.596 9.137 -27.326 1.00 31.83 C ATOM 1866 H VAL A1010 -5.800 10.230 -25.651 1.00 0.00 H ATOM 1867 N TRP A1011 -5.638 13.317 -26.819 1.00 29.50 N ATOM 1868 CA TRP A1011 -5.983 14.737 -27.044 1.00 30.54 C ATOM 1869 C TRP A1011 -5.466 15.565 -25.832 1.00 31.34 C ATOM 1870 O TRP A1011 -4.758 16.537 -26.024 1.00 29.61 O ATOM 1871 CB TRP A1011 -7.504 14.947 -27.215 1.00 29.98 C ATOM 1872 CG TRP A1011 -7.900 16.401 -27.374 1.00 31.87 C ATOM 1873 CD1 TRP A1011 -7.983 17.344 -26.385 1.00 35.04 C ATOM 1874 CD2 TRP A1011 -8.269 17.064 -28.590 1.00 31.72 C ATOM 1875 NE1 TRP A1011 -8.362 18.554 -26.914 1.00 34.46 N ATOM 1876 CE2 TRP A1011 -8.561 18.409 -28.264 1.00 35.12 C ATOM 1877 CE3 TRP A1011 -8.406 16.646 -29.928 1.00 33.63 C ATOM 1878 CZ2 TRP A1011 -8.977 19.340 -29.218 1.00 34.69 C ATOM 1879 CZ3 TRP A1011 -8.809 17.579 -30.880 1.00 35.58 C ATOM 1880 CH2 TRP A1011 -9.076 18.910 -30.527 1.00 36.00 C ATOM 1881 HE1 TRP A1011 -8.479 19.437 -26.378 1.00 0.00 H ATOM 1882 H TRP A1011 -6.398 12.607 -26.835 1.00 0.00 H ATOM 1883 N SER A1012 -5.804 15.134 -24.604 1.00 28.04 N ATOM 1884 CA SER A1012 -5.379 15.772 -23.354 1.00 26.86 C ATOM 1885 C SER A1012 -3.865 15.845 -23.235 1.00 29.50 C ATOM 1886 O SER A1012 -3.344 16.862 -22.799 1.00 29.12 O ATOM 1887 CB SER A1012 -6.013 15.073 -22.160 1.00 26.97 C ATOM 1888 OG SER A1012 -7.415 15.212 -22.315 1.00 30.99 O ATOM 1889 HG SER A1012 -7.875 14.770 -21.558 1.00 0.00 H ATOM 1890 H SER A1012 -6.408 14.290 -24.536 1.00 0.00 H ATOM 1891 N PHE A1013 -3.156 14.802 -23.688 1.00 26.78 N ATOM 1892 CA PHE A1013 -1.693 14.797 -23.701 1.00 26.41 C ATOM 1893 C PHE A1013 -1.132 15.905 -24.603 1.00 30.92 C ATOM 1894 O PHE A1013 -0.108 16.509 -24.267 1.00 30.89 O ATOM 1895 CB PHE A1013 -1.134 13.421 -24.090 1.00 27.78 C ATOM 1896 CG PHE A1013 0.382 13.380 -24.133 1.00 27.80 C ATOM 1897 CD1 PHE A1013 1.126 13.336 -22.958 1.00 30.15 C ATOM 1898 CD2 PHE A1013 1.060 13.365 -25.348 1.00 28.24 C ATOM 1899 CE1 PHE A1013 2.528 13.298 -22.996 1.00 30.75 C ATOM 1900 CE2 PHE A1013 2.458 13.349 -25.387 1.00 31.01 C ATOM 1901 CZ PHE A1013 3.187 13.314 -24.211 1.00 29.60 C ATOM 1902 H PHE A1013 -3.664 13.967 -24.043 1.00 0.00 H ATOM 1903 N GLY A1014 -1.784 16.159 -25.743 1.00 29.11 N ATOM 1904 CA GLY A1014 -1.391 17.271 -26.614 1.00 28.11 C ATOM 1905 C GLY A1014 -1.480 18.591 -25.852 1.00 28.25 C ATOM 1906 O GLY A1014 -0.580 19.432 -25.952 1.00 28.31 O ATOM 1907 H GLY A1014 -2.586 15.556 -26.017 1.00 0.00 H ATOM 1908 N VAL A1015 -2.524 18.744 -25.001 1.00 24.86 N ATOM 1909 CA VAL A1015 -2.698 19.951 -24.150 1.00 24.89 C ATOM 1910 C VAL A1015 -1.608 19.958 -23.066 1.00 28.60 C ATOM 1911 O VAL A1015 -1.048 21.009 -22.773 1.00 30.40 O ATOM 1912 CB VAL A1015 -4.129 20.109 -23.570 1.00 29.43 C ATOM 1913 CG1 VAL A1015 -4.303 21.481 -22.886 1.00 29.83 C ATOM 1914 CG2 VAL A1015 -5.176 19.926 -24.655 1.00 29.25 C ATOM 1915 H VAL A1015 -3.233 17.985 -24.941 1.00 0.00 H ATOM 1916 N VAL A1016 -1.218 18.775 -22.563 1.00 25.12 N ATOM 1917 CA VAL A1016 -0.099 18.680 -21.597 1.00 24.97 C ATOM 1918 C VAL A1016 1.224 19.135 -22.239 1.00 28.58 C ATOM 1919 O VAL A1016 1.969 19.892 -21.615 1.00 28.47 O ATOM 1920 CB VAL A1016 0.030 17.284 -20.934 1.00 27.65 C ATOM 1921 CG1 VAL A1016 1.330 17.163 -20.129 1.00 26.77 C ATOM 1922 CG2 VAL A1016 -1.165 17.014 -20.036 1.00 27.25 C ATOM 1923 H VAL A1016 -1.712 17.908 -22.858 1.00 0.00 H ATOM 1924 N LEU A1017 1.506 18.697 -23.477 1.00 26.65 N ATOM 1925 CA LEU A1017 2.723 19.123 -24.217 1.00 27.24 C ATOM 1926 C LEU A1017 2.747 20.664 -24.359 1.00 30.43 C ATOM 1927 O LEU A1017 3.788 21.287 -24.154 1.00 29.72 O ATOM 1928 CB LEU A1017 2.739 18.515 -25.635 1.00 28.40 C ATOM 1929 CG LEU A1017 3.035 17.032 -25.792 1.00 34.61 C ATOM 1930 CD1 LEU A1017 2.767 16.587 -27.225 1.00 35.41 C ATOM 1931 CD2 LEU A1017 4.488 16.731 -25.453 1.00 38.32 C ATOM 1932 H LEU A1017 0.848 18.035 -23.935 1.00 0.00 H ATOM 1933 N TYR A1018 1.583 21.266 -24.700 1.00 28.34 N ATOM 1934 CA TYR A1018 1.409 22.720 -24.817 1.00 27.70 C ATOM 1935 C TYR A1018 1.767 23.368 -23.456 1.00 31.45 C ATOM 1936 O TYR A1018 2.537 24.327 -23.434 1.00 31.90 O ATOM 1937 CB TYR A1018 -0.035 23.071 -25.222 1.00 27.45 C ATOM 1938 CG TYR A1018 -0.281 24.568 -25.277 1.00 29.17 C ATOM 1939 CD1 TYR A1018 -0.042 25.290 -26.444 1.00 29.41 C ATOM 1940 CD2 TYR A1018 -0.794 25.255 -24.172 1.00 30.15 C ATOM 1941 CE1 TYR A1018 -0.247 26.670 -26.498 1.00 28.17 C ATOM 1942 CE2 TYR A1018 -1.007 26.634 -24.215 1.00 31.18 C ATOM 1943 CZ TYR A1018 -0.720 27.339 -25.379 1.00 35.57 C ATOM 1944 OH TYR A1018 -0.915 28.693 -25.451 1.00 32.20 O ATOM 1945 HH TYR A1018 -0.657 29.015 -26.351 1.00 0.00 H ATOM 1946 H TYR A1018 0.760 20.660 -24.891 1.00 0.00 H ATOM 1947 N GLU A1019 1.237 22.807 -22.337 1.00 28.41 N ATOM 1948 CA GLU A1019 1.510 23.275 -20.968 1.00 28.19 C ATOM 1949 C GLU A1019 2.989 23.234 -20.650 1.00 31.21 C ATOM 1950 O GLU A1019 3.520 24.207 -20.115 1.00 31.92 O ATOM 1951 CB GLU A1019 0.743 22.462 -19.925 1.00 29.59 C ATOM 1952 CG GLU A1019 -0.750 22.716 -19.900 1.00 32.40 C ATOM 1953 CD GLU A1019 -1.390 22.048 -18.702 1.00 42.98 C ATOM 1954 OE1 GLU A1019 -1.589 22.737 -17.676 1.00 33.41 O ATOM 1955 OE2 GLU A1019 -1.599 20.815 -18.754 1.00 33.73 O ATOM 1956 H GLU A1019 0.598 21.995 -22.455 1.00 0.00 H ATOM 1957 N LEU A1020 3.661 22.120 -20.976 1.00 27.82 N ATOM 1958 CA LEU A1020 5.105 21.972 -20.729 1.00 27.45 C ATOM 1959 C LEU A1020 5.916 23.057 -21.471 1.00 32.09 C ATOM 1960 O LEU A1020 6.815 23.679 -20.878 1.00 28.94 O ATOM 1961 CB LEU A1020 5.605 20.576 -21.168 1.00 27.18 C ATOM 1962 CG LEU A1020 5.409 19.411 -20.167 1.00 32.01 C ATOM 1963 CD1 LEU A1020 5.442 18.062 -20.890 1.00 32.27 C ATOM 1964 CD2 LEU A1020 6.495 19.389 -19.115 1.00 34.79 C ATOM 1965 H LEU A1020 3.144 21.333 -21.419 1.00 0.00 H ATOM 1966 N PHE A1021 5.582 23.289 -22.773 1.00 28.48 N ATOM 1967 CA PHE A1021 6.376 24.197 -23.597 1.00 29.45 C ATOM 1968 C PHE A1021 6.020 25.692 -23.393 1.00 32.36 C ATOM 1969 O PHE A1021 6.750 26.542 -23.899 1.00 31.66 O ATOM 1970 CB PHE A1021 6.393 23.751 -25.085 1.00 31.32 C ATOM 1971 CG PHE A1021 7.419 22.644 -25.254 1.00 33.07 C ATOM 1972 CD1 PHE A1021 7.102 21.324 -24.947 1.00 35.13 C ATOM 1973 CD2 PHE A1021 8.722 22.934 -25.642 1.00 36.50 C ATOM 1974 CE1 PHE A1021 8.064 20.311 -25.042 1.00 36.19 C ATOM 1975 CE2 PHE A1021 9.685 21.919 -25.736 1.00 39.11 C ATOM 1976 CZ PHE A1021 9.346 20.615 -25.433 1.00 36.66 C ATOM 1977 H PHE A1021 4.753 22.814 -23.184 1.00 0.00 H ATOM 1978 N THR A1022 5.000 26.000 -22.556 1.00 30.29 N ATOM 1979 CA THR A1022 4.646 27.367 -22.119 1.00 29.97 C ATOM 1980 C THR A1022 5.053 27.524 -20.636 1.00 34.25 C ATOM 1981 O THR A1022 4.743 28.545 -20.008 1.00 31.84 O ATOM 1982 CB THR A1022 3.142 27.641 -22.240 1.00 33.77 C ATOM 1983 OG1 THR A1022 2.382 26.680 -21.484 1.00 31.64 O ATOM 1984 CG2 THR A1022 2.659 27.721 -23.692 1.00 27.65 C ATOM 1985 HG1 THR A1022 2.569 25.770 -21.827 1.00 0.00 H ATOM 1986 H THR A1022 4.422 25.215 -22.193 1.00 0.00 H ATOM 1987 N TYR A1023 5.723 26.483 -20.066 1.00 31.39 N ATOM 1988 CA TYR A1023 6.100 26.391 -18.647 1.00 30.18 C ATOM 1989 C TYR A1023 4.925 26.706 -17.751 1.00 33.46 C ATOM 1990 O TYR A1023 5.096 27.325 -16.698 1.00 34.18 O ATOM 1991 CB TYR A1023 7.275 27.304 -18.312 1.00 30.87 C ATOM 1992 CG TYR A1023 8.539 26.900 -19.015 1.00 32.75 C ATOM 1993 CD1 TYR A1023 8.848 27.401 -20.277 1.00 35.21 C ATOM 1994 CD2 TYR A1023 9.454 26.047 -18.405 1.00 33.30 C ATOM 1995 CE1 TYR A1023 10.018 27.029 -20.932 1.00 35.31 C ATOM 1996 CE2 TYR A1023 10.633 25.681 -19.043 1.00 33.95 C ATOM 1997 CZ TYR A1023 10.915 26.182 -20.303 1.00 40.54 C ATOM 1998 OH TYR A1023 12.069 25.812 -20.940 1.00 41.75 O ATOM 1999 HH TYR A1023 12.848 26.083 -20.392 1.00 0.00 H ATOM 2000 H TYR A1023 5.989 25.690 -20.684 1.00 0.00 H ATOM 2001 N CYS A1024 3.716 26.345 -18.199 1.00 28.68 N ATOM 2002 CA CYS A1024 2.465 26.626 -17.488 1.00 28.44 C ATOM 2003 C CYS A1024 2.265 28.108 -17.159 1.00 34.42 C ATOM 2004 O CYS A1024 1.623 28.455 -16.149 1.00 32.20 O ATOM 2005 CB CYS A1024 2.332 25.740 -16.258 1.00 28.53 C ATOM 2006 SG CYS A1024 2.043 24.010 -16.676 1.00 32.22 S ATOM 2007 H CYS A1024 3.661 25.836 -19.104 1.00 0.00 H ATOM 2008 N ASP A1025 2.739 28.987 -18.084 1.00 31.05 N ATOM 2009 CA ASP A1025 2.570 30.432 -17.950 1.00 29.71 C ATOM 2010 C ASP A1025 1.094 30.725 -18.007 1.00 31.72 C ATOM 2011 O ASP A1025 0.424 30.299 -18.950 1.00 31.34 O ATOM 2012 CB ASP A1025 3.303 31.181 -19.082 1.00 32.00 C ATOM 2013 CG ASP A1025 3.459 32.650 -18.756 1.00 44.48 C ATOM 2014 OD1 ASP A1025 4.561 33.047 -18.322 1.00 47.86 O ATOM 2015 OD2 ASP A1025 2.447 33.359 -18.764 1.00 42.54 O ATOM 2016 H ASP A1025 3.240 28.616 -18.917 1.00 0.00 H ATOM 2017 N LYS A1026 0.574 31.437 -16.988 1.00 29.93 N ATOM 2018 CA LYS A1026 -0.845 31.778 -16.894 1.00 30.64 C ATOM 2019 C LYS A1026 -1.359 32.635 -18.057 1.00 34.92 C ATOM 2020 O LYS A1026 -2.487 32.432 -18.501 1.00 36.02 O ATOM 2021 CB LYS A1026 -1.136 32.470 -15.547 1.00 34.71 C ATOM 2022 CG LYS A1026 -2.217 31.772 -14.735 1.00 53.81 C ATOM 2023 H LYS A1026 1.212 31.759 -16.233 1.00 0.00 H ATOM 2024 N SER A1027 -0.541 33.586 -18.551 1.00 31.66 N ATOM 2025 CA SER A1027 -0.919 34.511 -19.643 1.00 30.58 C ATOM 2026 C SER A1027 -1.199 33.811 -20.997 1.00 34.65 C ATOM 2027 O SER A1027 -2.034 34.290 -21.763 1.00 33.52 O ATOM 2028 CB SER A1027 0.116 35.619 -19.796 1.00 32.58 C ATOM 2029 OG SER A1027 1.340 35.147 -20.335 1.00 37.38 O ATOM 2030 HG SER A1027 1.718 34.456 -19.736 1.00 0.00 H ATOM 2031 H SER A1027 0.411 33.675 -18.141 1.00 0.00 H ATOM 2032 N CYS A1028 -0.540 32.677 -21.282 1.00 32.68 N ATOM 2033 CA CYS A1028 -0.832 31.894 -22.502 1.00 32.01 C ATOM 2034 C CYS A1028 -1.357 30.481 -22.168 1.00 34.20 C ATOM 2035 O CYS A1028 -1.175 29.567 -22.962 1.00 32.71 O ATOM 2036 CB CYS A1028 0.368 31.839 -23.448 1.00 32.26 C ATOM 2037 SG CYS A1028 1.895 31.249 -22.677 1.00 36.56 S ATOM 2038 H CYS A1028 0.195 32.340 -20.628 1.00 0.00 H ATOM 2039 N SER A1029 -2.027 30.304 -21.011 1.00 30.07 N ATOM 2040 CA SER A1029 -2.563 29.004 -20.587 1.00 29.27 C ATOM 2041 C SER A1029 -3.673 28.537 -21.527 1.00 33.99 C ATOM 2042 O SER A1029 -4.252 29.373 -22.239 1.00 33.48 O ATOM 2043 CB SER A1029 -3.121 29.096 -19.165 1.00 32.28 C ATOM 2044 OG SER A1029 -4.194 30.017 -19.112 1.00 38.00 O ATOM 2045 HG SER A1029 -4.542 30.064 -18.186 1.00 0.00 H ATOM 2046 H SER A1029 -2.171 31.126 -20.390 1.00 0.00 H ATOM 2047 N PRO A1030 -4.033 27.229 -21.531 1.00 31.85 N ATOM 2048 CA PRO A1030 -5.144 26.786 -22.397 1.00 32.43 C ATOM 2049 C PRO A1030 -6.398 27.631 -22.195 1.00 36.93 C ATOM 2050 O PRO A1030 -7.021 28.015 -23.177 1.00 37.41 O ATOM 2051 CB PRO A1030 -5.331 25.327 -21.976 1.00 33.62 C ATOM 2052 CG PRO A1030 -3.928 24.903 -21.590 1.00 36.76 C ATOM 2053 CD PRO A1030 -3.462 26.081 -20.787 1.00 32.68 C ATOM 2054 N SER A1031 -6.722 27.984 -20.931 1.00 34.41 N ATOM 2055 CA SER A1031 -7.874 28.832 -20.618 1.00 34.42 C ATOM 2056 C SER A1031 -7.686 30.267 -21.094 1.00 38.92 C ATOM 2057 O SER A1031 -8.538 30.762 -21.816 1.00 38.87 O ATOM 2058 CB SER A1031 -8.217 28.790 -19.126 1.00 37.49 C ATOM 2059 OG SER A1031 -7.259 29.424 -18.296 1.00 43.41 O ATOM 2060 HG SER A1031 -6.382 28.979 -18.407 1.00 0.00 H ATOM 2061 H SER A1031 -6.129 27.639 -20.149 1.00 0.00 H ATOM 2062 N ALA A1032 -6.584 30.943 -20.715 1.00 37.72 N ATOM 2063 CA ALA A1032 -6.391 32.335 -21.169 1.00 38.03 C ATOM 2064 C ALA A1032 -6.406 32.432 -22.696 1.00 39.40 C ATOM 2065 O ALA A1032 -7.095 33.287 -23.239 1.00 38.54 O ATOM 2066 CB ALA A1032 -5.091 32.927 -20.608 1.00 38.53 C ATOM 2067 H ALA A1032 -5.874 30.488 -20.107 1.00 0.00 H ATOM 2068 N GLU A1033 -5.708 31.517 -23.383 1.00 35.09 N ATOM 2069 CA GLU A1033 -5.592 31.548 -24.841 1.00 34.01 C ATOM 2070 C GLU A1033 -6.864 31.096 -25.575 1.00 37.86 C ATOM 2071 O GLU A1033 -7.283 31.793 -26.501 1.00 37.11 O ATOM 2072 CB GLU A1033 -4.348 30.770 -25.284 1.00 35.13 C ATOM 2073 CG GLU A1033 -3.904 31.003 -26.714 1.00 39.02 C ATOM 2074 CD GLU A1033 -3.790 32.415 -27.265 1.00 46.19 C ATOM 2075 OE1 GLU A1033 -3.850 32.535 -28.504 1.00 43.45 O ATOM 2076 OE2 GLU A1033 -3.628 33.390 -26.494 1.00 35.06 O ATOM 2077 H GLU A1033 -5.231 30.756 -22.859 1.00 0.00 H ATOM 2078 N PHE A1034 -7.521 29.982 -25.162 1.00 35.71 N ATOM 2079 CA PHE A1034 -8.777 29.613 -25.840 1.00 35.15 C ATOM 2080 C PHE A1034 -9.841 30.704 -25.607 1.00 39.18 C ATOM 2081 O PHE A1034 -10.557 31.057 -26.549 1.00 38.02 O ATOM 2082 CB PHE A1034 -9.318 28.239 -25.393 1.00 37.07 C ATOM 2083 CG PHE A1034 -8.834 27.026 -26.163 1.00 37.55 C ATOM 2084 CD1 PHE A1034 -8.846 27.012 -27.557 1.00 39.17 C ATOM 2085 CD2 PHE A1034 -8.390 25.891 -25.493 1.00 38.25 C ATOM 2086 CE1 PHE A1034 -8.425 25.878 -28.264 1.00 40.00 C ATOM 2087 CE2 PHE A1034 -7.982 24.755 -26.200 1.00 40.82 C ATOM 2088 CZ PHE A1034 -8.001 24.755 -27.579 1.00 39.18 C ATOM 2089 H PHE A1034 -7.146 29.402 -24.384 1.00 0.00 H ATOM 2090 N LEU A1035 -9.920 31.268 -24.380 1.00 38.15 N ATOM 2091 CA LEU A1035 -10.905 32.343 -24.113 1.00 39.48 C ATOM 2092 C LEU A1035 -10.653 33.575 -24.996 1.00 45.53 C ATOM 2093 O LEU A1035 -11.598 34.133 -25.550 1.00 45.33 O ATOM 2094 CB LEU A1035 -10.989 32.723 -22.617 1.00 39.67 C ATOM 2095 CG LEU A1035 -11.630 31.662 -21.667 1.00 44.81 C ATOM 2096 CD1 LEU A1035 -11.239 31.911 -20.199 1.00 44.79 C ATOM 2097 CD2 LEU A1035 -13.150 31.579 -21.832 1.00 46.44 C ATOM 2098 H LEU A1035 -9.287 30.946 -23.621 1.00 0.00 H ATOM 2099 N ARG A1036 -9.367 33.934 -25.199 1.00 43.76 N ATOM 2100 CA ARG A1036 -8.948 35.058 -26.045 1.00 43.67 C ATOM 2101 C ARG A1036 -9.316 34.803 -27.511 1.00 46.71 C ATOM 2102 O ARG A1036 -9.788 35.710 -28.179 1.00 45.97 O ATOM 2103 CB ARG A1036 -7.440 35.287 -25.884 1.00 44.83 C ATOM 2104 CG ARG A1036 -6.930 36.638 -26.363 1.00 49.83 C ATOM 2105 CD ARG A1036 -5.413 36.618 -26.522 1.00 49.89 C ATOM 2106 NE ARG A1036 -4.988 35.640 -27.531 1.00 48.02 N ATOM 2107 CZ ARG A1036 -5.007 35.856 -28.844 1.00 54.12 C ATOM 2108 NH1 ARG A1036 -4.619 34.906 -29.685 1.00 40.04 N ATOM 2109 NH2 ARG A1036 -5.392 37.030 -29.325 1.00 32.69 N ATOM 2110 HE ARG A1036 -4.649 34.715 -27.197 1.00 0.00 H ATOM 2111 HH12 ARG A1036 -4.636 35.080 -30.710 1.00 0.00 H ATOM 2112 HH11 ARG A1036 -4.298 33.987 -29.319 1.00 0.00 H ATOM 2113 HH22 ARG A1036 -5.405 37.192 -30.352 1.00 0.00 H ATOM 2114 HH21 ARG A1036 -5.681 37.789 -28.675 1.00 0.00 H ATOM 2115 H ARG A1036 -8.626 33.379 -24.726 1.00 0.00 H ATOM 2116 N MET A1037 -9.146 33.565 -27.996 1.00 44.14 N ATOM 2117 CA MET A1037 -9.508 33.188 -29.373 1.00 43.58 C ATOM 2118 C MET A1037 -11.043 33.090 -29.560 1.00 48.41 C ATOM 2119 O MET A1037 -11.527 33.256 -30.684 1.00 48.79 O ATOM 2120 CB MET A1037 -8.881 31.826 -29.750 1.00 45.63 C ATOM 2121 CG MET A1037 -7.347 31.767 -29.726 1.00 48.80 C ATOM 2122 SD MET A1037 -6.732 30.032 -29.700 1.00 52.67 S ATOM 2123 CE MET A1037 -7.408 29.425 -31.292 1.00 49.38 C ATOM 2124 H MET A1037 -8.740 32.838 -27.372 1.00 0.00 H ATOM 2125 N MET A1038 -11.792 32.746 -28.477 1.00 44.46 N ATOM 2126 CA MET A1038 -13.253 32.546 -28.472 1.00 60.18 C ATOM 2127 C MET A1038 -14.051 33.798 -28.833 1.00 93.42 C ATOM 2128 O MET A1038 -13.828 34.860 -28.260 1.00 66.73 O ATOM 2129 CB MET A1038 -13.730 31.956 -27.124 1.00 62.15 C ATOM 2130 CG MET A1038 -13.907 30.446 -27.154 1.00 65.46 C ATOM 2131 SD MET A1038 -13.505 29.557 -25.625 1.00 68.80 S ATOM 2132 CE MET A1038 -15.026 29.771 -24.733 1.00 65.50 C ATOM 2133 H MET A1038 -11.291 32.613 -27.575 1.00 0.00 H TER 2134 MET A1038 ATOM 2135 N ASP A1043 -25.054 35.854 -27.642 1.00 78.49 N ATOM 2136 CA ASP A1043 -24.957 34.965 -26.485 1.00 78.04 C ATOM 2137 C ASP A1043 -25.012 33.489 -26.910 1.00 81.05 C ATOM 2138 O ASP A1043 -25.942 33.082 -27.614 1.00 81.42 O ATOM 2139 CB ASP A1043 -26.047 35.290 -25.450 1.00 79.73 C ATOM 2140 HN3 ASP A1043 -25.954 35.684 -28.134 1.00 0.00 H ATOM 2141 HN2 ASP A1043 -24.263 35.666 -28.290 1.00 0.00 H ATOM 2142 HN1 ASP A1043 -25.014 36.843 -27.322 1.00 0.00 H ATOM 2143 N VAL A1044 -23.986 32.707 -26.504 1.00 75.46 N ATOM 2144 CA VAL A1044 -23.790 31.276 -26.793 1.00 74.00 C ATOM 2145 C VAL A1044 -22.964 30.654 -25.631 1.00 73.89 C ATOM 2146 O VAL A1044 -22.016 31.306 -25.174 1.00 73.34 O ATOM 2147 CB VAL A1044 -23.151 31.070 -28.214 1.00 78.17 C ATOM 2148 CG1 VAL A1044 -22.155 29.908 -28.265 1.00 77.96 C ATOM 2149 CG2 VAL A1044 -24.225 30.899 -29.285 1.00 78.01 C ATOM 2150 H VAL A1044 -23.255 33.166 -25.924 1.00 0.00 H ATOM 2151 N PRO A1045 -23.311 29.433 -25.123 1.00 67.64 N ATOM 2152 CA PRO A1045 -22.512 28.834 -24.026 1.00 65.89 C ATOM 2153 C PRO A1045 -21.054 28.585 -24.424 1.00 65.07 C ATOM 2154 O PRO A1045 -20.792 28.171 -25.561 1.00 64.60 O ATOM 2155 CB PRO A1045 -23.237 27.510 -23.720 1.00 67.76 C ATOM 2156 CG PRO A1045 -24.577 27.629 -24.359 1.00 72.90 C ATOM 2157 CD PRO A1045 -24.400 28.526 -25.544 1.00 68.86 C ATOM 2158 N ALA A1046 -20.115 28.867 -23.489 1.00 57.47 N ATOM 2159 CA ALA A1046 -18.664 28.715 -23.640 1.00 55.83 C ATOM 2160 C ALA A1046 -18.224 27.339 -24.147 1.00 57.49 C ATOM 2161 O ALA A1046 -17.341 27.279 -25.007 1.00 56.19 O ATOM 2162 CB ALA A1046 -17.962 29.033 -22.335 1.00 56.14 C ATOM 2163 H ALA A1046 -20.456 29.226 -22.575 1.00 0.00 H ATOM 2164 N LEU A1047 -18.837 26.245 -23.622 1.00 52.73 N ATOM 2165 CA LEU A1047 -18.549 24.862 -24.023 1.00 52.09 C ATOM 2166 C LEU A1047 -18.856 24.667 -25.516 1.00 53.08 C ATOM 2167 O LEU A1047 -18.034 24.101 -26.240 1.00 50.83 O ATOM 2168 CB LEU A1047 -19.353 23.863 -23.156 1.00 52.43 C ATOM 2169 CG LEU A1047 -19.160 22.368 -23.460 1.00 57.80 C ATOM 2170 CD1 LEU A1047 -18.940 21.582 -22.193 1.00 58.17 C ATOM 2171 CD2 LEU A1047 -20.349 21.799 -24.216 1.00 61.31 C ATOM 2172 H LEU A1047 -19.558 26.398 -22.888 1.00 0.00 H ATOM 2173 N SER A1048 -20.055 25.136 -25.952 1.00 48.77 N ATOM 2174 CA SER A1048 -20.551 25.085 -27.329 1.00 48.00 C ATOM 2175 C SER A1048 -19.690 25.974 -28.239 1.00 49.31 C ATOM 2176 O SER A1048 -19.404 25.583 -29.370 1.00 49.09 O ATOM 2177 CB SER A1048 -22.022 25.504 -27.380 1.00 52.49 C ATOM 2178 OG SER A1048 -22.830 24.572 -26.676 1.00 56.06 O ATOM 2179 HG SER A1048 -23.777 24.859 -26.720 1.00 0.00 H ATOM 2180 H SER A1048 -20.678 25.571 -25.242 1.00 0.00 H ATOM 2181 N ARG A1049 -19.223 27.130 -27.718 1.00 44.00 N ATOM 2182 CA ARG A1049 -18.340 28.044 -28.441 1.00 43.55 C ATOM 2183 C ARG A1049 -16.922 27.427 -28.607 1.00 44.32 C ATOM 2184 O ARG A1049 -16.310 27.592 -29.661 1.00 42.51 O ATOM 2185 CB ARG A1049 -18.302 29.421 -27.750 1.00 45.83 C ATOM 2186 CG ARG A1049 -17.448 30.478 -28.440 1.00 60.50 C ATOM 2187 CD ARG A1049 -18.073 31.062 -29.706 1.00 76.48 C ATOM 2188 NE ARG A1049 -17.098 31.840 -30.476 1.00 81.57 N ATOM 2189 CZ ARG A1049 -16.310 31.335 -31.422 1.00 95.02 C ATOM 2190 NH1 ARG A1049 -16.380 30.046 -31.736 1.00 79.13 N ATOM 2191 NH2 ARG A1049 -15.449 32.115 -32.062 1.00 82.60 N ATOM 2192 HE ARG A1049 -17.017 32.856 -30.269 1.00 0.00 H ATOM 2193 HH12 ARG A1049 -15.762 29.657 -32.476 1.00 0.00 H ATOM 2194 HH11 ARG A1049 -17.053 29.426 -31.242 1.00 0.00 H ATOM 2195 HH22 ARG A1049 -14.835 31.716 -32.801 1.00 0.00 H ATOM 2196 HH21 ARG A1049 -15.388 33.126 -31.825 1.00 0.00 H ATOM 2197 H ARG A1049 -19.507 27.383 -26.750 1.00 0.00 H ATOM 2198 N LEU A1050 -16.418 26.696 -27.584 1.00 39.03 N ATOM 2199 CA LEU A1050 -15.111 26.035 -27.701 1.00 37.40 C ATOM 2200 C LEU A1050 -15.204 24.921 -28.740 1.00 39.83 C ATOM 2201 O LEU A1050 -14.338 24.821 -29.606 1.00 38.35 O ATOM 2202 CB LEU A1050 -14.609 25.514 -26.332 1.00 36.61 C ATOM 2203 CG LEU A1050 -13.306 24.676 -26.323 1.00 39.12 C ATOM 2204 CD1 LEU A1050 -12.117 25.475 -26.822 1.00 38.69 C ATOM 2205 CD2 LEU A1050 -13.002 24.174 -24.922 1.00 36.58 C ATOM 2206 H LEU A1050 -16.964 26.601 -26.704 1.00 0.00 H ATOM 2207 N LEU A1051 -16.303 24.144 -28.704 1.00 39.30 N ATOM 2208 CA LEU A1051 -16.599 23.072 -29.657 1.00 40.65 C ATOM 2209 C LEU A1051 -16.657 23.628 -31.088 1.00 44.61 C ATOM 2210 O LEU A1051 -16.105 23.010 -31.994 1.00 43.83 O ATOM 2211 CB LEU A1051 -17.939 22.410 -29.298 1.00 41.86 C ATOM 2212 CG LEU A1051 -18.015 20.885 -29.202 1.00 48.18 C ATOM 2213 CD1 LEU A1051 -19.449 20.434 -29.314 1.00 49.53 C ATOM 2214 CD2 LEU A1051 -17.189 20.184 -30.279 1.00 50.02 C ATOM 2215 H LEU A1051 -16.992 24.318 -27.944 1.00 0.00 H ATOM 2216 N GLU A1052 -17.267 24.821 -31.268 1.00 41.98 N ATOM 2217 CA GLU A1052 -17.351 25.558 -32.541 1.00 41.50 C ATOM 2218 C GLU A1052 -15.950 25.870 -33.068 1.00 43.91 C ATOM 2219 O GLU A1052 -15.674 25.563 -34.230 1.00 42.68 O ATOM 2220 CB GLU A1052 -18.098 26.886 -32.338 1.00 43.15 C ATOM 2221 CG GLU A1052 -19.592 26.877 -32.587 1.00 58.23 C ATOM 2222 CD GLU A1052 -20.218 28.260 -32.491 1.00 82.83 C ATOM 2223 OE1 GLU A1052 -21.189 28.423 -31.717 1.00 73.66 O ATOM 2224 OE2 GLU A1052 -19.714 29.189 -33.165 1.00 81.44 O ATOM 2225 H GLU A1052 -17.715 25.256 -30.436 1.00 0.00 H ATOM 2226 N LEU A1053 -15.060 26.471 -32.212 1.00 39.90 N ATOM 2227 CA LEU A1053 -13.671 26.787 -32.577 1.00 40.47 C ATOM 2228 C LEU A1053 -12.949 25.518 -33.036 1.00 40.60 C ATOM 2229 O LEU A1053 -12.280 25.527 -34.064 1.00 38.63 O ATOM 2230 CB LEU A1053 -12.857 27.324 -31.369 1.00 41.72 C ATOM 2231 CG LEU A1053 -13.017 28.745 -30.865 1.00 49.08 C ATOM 2232 CD1 LEU A1053 -12.052 28.989 -29.717 1.00 49.72 C ATOM 2233 CD2 LEU A1053 -12.692 29.761 -31.940 1.00 55.21 C ATOM 2234 H LEU A1053 -15.386 26.716 -31.255 1.00 0.00 H ATOM 2235 N LEU A1054 -13.025 24.454 -32.215 1.00 37.64 N ATOM 2236 CA LEU A1054 -12.350 23.182 -32.474 1.00 37.03 C ATOM 2237 C LEU A1054 -12.836 22.519 -33.770 1.00 42.69 C ATOM 2238 O LEU A1054 -12.007 22.102 -34.583 1.00 41.17 O ATOM 2239 CB LEU A1054 -12.440 22.228 -31.264 1.00 35.91 C ATOM 2240 CG LEU A1054 -11.743 22.707 -29.956 1.00 38.69 C ATOM 2241 CD1 LEU A1054 -12.070 21.799 -28.800 1.00 38.25 C ATOM 2242 CD2 LEU A1054 -10.233 22.814 -30.119 1.00 34.68 C ATOM 2243 H LEU A1054 -13.595 24.541 -31.349 1.00 0.00 H ATOM 2244 N GLU A1055 -14.158 22.475 -33.983 1.00 41.82 N ATOM 2245 CA GLU A1055 -14.753 21.885 -35.197 1.00 43.53 C ATOM 2246 C GLU A1055 -14.289 22.596 -36.482 1.00 49.28 C ATOM 2247 O GLU A1055 -14.073 21.931 -37.496 1.00 50.22 O ATOM 2248 CB GLU A1055 -16.282 21.799 -35.088 1.00 45.08 C ATOM 2249 CG GLU A1055 -16.735 20.601 -34.264 1.00 56.11 C ATOM 2250 CD GLU A1055 -18.212 20.575 -33.922 1.00 74.20 C ATOM 2251 H GLU A1055 -14.792 22.874 -33.261 1.00 0.00 H ATOM 2252 N GLU A1056 -14.031 23.919 -36.393 1.00 46.25 N ATOM 2253 CA GLU A1056 -13.519 24.767 -37.478 1.00 46.12 C ATOM 2254 C GLU A1056 -12.053 24.479 -37.817 1.00 47.39 C ATOM 2255 O GLU A1056 -11.551 24.982 -38.819 1.00 47.38 O ATOM 2256 CB GLU A1056 -13.630 26.245 -37.077 1.00 47.72 C ATOM 2257 CG GLU A1056 -15.005 26.854 -37.276 1.00 59.74 C ATOM 2258 CD GLU A1056 -15.160 28.262 -36.733 1.00 81.25 C ATOM 2259 OE1 GLU A1056 -16.322 28.699 -36.560 1.00 83.25 O ATOM 2260 OE2 GLU A1056 -14.128 28.927 -36.473 1.00 66.48 O ATOM 2261 H GLU A1056 -14.210 24.377 -35.477 1.00 0.00 H ATOM 2262 N GLY A1057 -11.362 23.751 -36.942 1.00 41.86 N ATOM 2263 CA GLY A1057 -9.951 23.417 -37.105 1.00 39.78 C ATOM 2264 C GLY A1057 -9.027 24.361 -36.365 1.00 40.39 C ATOM 2265 O GLY A1057 -7.806 24.260 -36.513 1.00 38.99 O ATOM 2266 H GLY A1057 -11.855 23.401 -36.096 1.00 0.00 H ATOM 2267 N GLN A1058 -9.596 25.287 -35.555 1.00 35.53 N ATOM 2268 CA GLN A1058 -8.803 26.237 -34.772 1.00 35.59 C ATOM 2269 C GLN A1058 -8.165 25.499 -33.595 1.00 36.27 C ATOM 2270 O GLN A1058 -8.801 24.641 -32.993 1.00 34.54 O ATOM 2271 CB GLN A1058 -9.663 27.411 -34.276 1.00 37.60 C ATOM 2272 CG GLN A1058 -10.000 28.415 -35.387 1.00 48.83 C ATOM 2273 CD GLN A1058 -10.549 29.705 -34.828 1.00 68.83 C ATOM 2274 OE1 GLN A1058 -9.858 30.456 -34.125 1.00 60.80 O ATOM 2275 NE2 GLN A1058 -11.807 29.996 -35.134 1.00 63.02 N ATOM 2276 HE22 GLN A1058 -12.362 29.346 -35.726 1.00 0.00 H ATOM 2277 HE21 GLN A1058 -12.238 30.874 -34.782 1.00 0.00 H ATOM 2278 H GLN A1058 -10.633 25.324 -35.487 1.00 0.00 H ATOM 2279 N ARG A1059 -6.914 25.813 -33.293 1.00 32.56 N ATOM 2280 CA ARG A1059 -6.157 25.135 -32.237 1.00 31.82 C ATOM 2281 C ARG A1059 -5.311 26.125 -31.469 1.00 35.57 C ATOM 2282 O ARG A1059 -5.045 27.223 -31.960 1.00 35.41 O ATOM 2283 CB ARG A1059 -5.195 24.078 -32.875 1.00 30.79 C ATOM 2284 CG ARG A1059 -5.843 22.899 -33.614 1.00 35.71 C ATOM 2285 CD ARG A1059 -6.741 22.077 -32.703 1.00 34.62 C ATOM 2286 NE ARG A1059 -7.274 20.874 -33.332 1.00 40.38 N ATOM 2287 CZ ARG A1059 -8.498 20.764 -33.835 1.00 43.21 C ATOM 2288 NH1 ARG A1059 -8.924 19.601 -34.303 1.00 33.51 N ATOM 2289 NH2 ARG A1059 -9.319 21.807 -33.839 1.00 34.49 N ATOM 2290 HE ARG A1059 -6.651 20.043 -33.391 1.00 0.00 H ATOM 2291 HH12 ARG A1059 -9.883 19.519 -34.696 1.00 0.00 H ATOM 2292 HH11 ARG A1059 -8.299 18.770 -34.277 1.00 0.00 H ATOM 2293 HH22 ARG A1059 -10.276 21.714 -34.235 1.00 0.00 H ATOM 2294 HH21 ARG A1059 -9.005 22.717 -33.447 1.00 0.00 H ATOM 2295 H ARG A1059 -6.449 26.574 -33.828 1.00 0.00 H ATOM 2296 N LEU A1060 -4.799 25.706 -30.295 1.00 30.53 N ATOM 2297 CA LEU A1060 -3.888 26.542 -29.519 1.00 28.75 C ATOM 2298 C LEU A1060 -2.637 26.829 -30.378 1.00 33.40 C ATOM 2299 O LEU A1060 -2.221 25.966 -31.151 1.00 31.78 O ATOM 2300 CB LEU A1060 -3.504 25.845 -28.215 1.00 27.23 C ATOM 2301 CG LEU A1060 -4.583 25.838 -27.119 1.00 28.08 C ATOM 2302 CD1 LEU A1060 -4.245 24.812 -26.049 1.00 27.60 C ATOM 2303 CD2 LEU A1060 -4.738 27.232 -26.480 1.00 28.04 C ATOM 2304 H LEU A1060 -5.059 24.766 -29.934 1.00 0.00 H ATOM 2305 N PRO A1061 -2.064 28.044 -30.307 1.00 31.49 N ATOM 2306 CA PRO A1061 -0.917 28.365 -31.179 1.00 31.21 C ATOM 2307 C PRO A1061 0.370 27.756 -30.642 1.00 34.97 C ATOM 2308 O PRO A1061 0.431 27.388 -29.470 1.00 34.39 O ATOM 2309 CB PRO A1061 -0.856 29.896 -31.102 1.00 32.72 C ATOM 2310 CG PRO A1061 -1.344 30.197 -29.710 1.00 37.36 C ATOM 2311 CD PRO A1061 -2.460 29.208 -29.486 1.00 32.95 C ATOM 2312 N ALA A1062 1.411 27.694 -31.469 1.00 30.42 N ATOM 2313 CA ALA A1062 2.694 27.183 -31.005 1.00 31.51 C ATOM 2314 C ALA A1062 3.211 28.061 -29.855 1.00 35.25 C ATOM 2315 O ALA A1062 3.297 29.286 -30.010 1.00 33.33 O ATOM 2316 CB ALA A1062 3.705 27.191 -32.151 1.00 32.90 C ATOM 2317 H ALA A1062 1.308 28.013 -32.454 1.00 0.00 H ATOM 2318 N PRO A1063 3.570 27.462 -28.693 1.00 32.72 N ATOM 2319 CA PRO A1063 4.115 28.269 -27.594 1.00 31.50 C ATOM 2320 C PRO A1063 5.326 29.108 -28.029 1.00 34.86 C ATOM 2321 O PRO A1063 6.043 28.715 -28.951 1.00 33.86 O ATOM 2322 CB PRO A1063 4.545 27.202 -26.572 1.00 32.77 C ATOM 2323 CG PRO A1063 3.637 26.059 -26.822 1.00 36.40 C ATOM 2324 CD PRO A1063 3.488 26.031 -28.310 1.00 33.30 C ATOM 2325 N PRO A1064 5.605 30.237 -27.346 1.00 32.61 N ATOM 2326 CA PRO A1064 6.798 31.033 -27.694 1.00 33.51 C ATOM 2327 C PRO A1064 8.077 30.191 -27.599 1.00 40.54 C ATOM 2328 O PRO A1064 8.295 29.514 -26.586 1.00 39.76 O ATOM 2329 CB PRO A1064 6.776 32.148 -26.634 1.00 34.46 C ATOM 2330 CG PRO A1064 5.322 32.287 -26.287 1.00 37.95 C ATOM 2331 CD PRO A1064 4.850 30.872 -26.245 1.00 33.78 C ATOM 2332 N ALA A1065 8.881 30.195 -28.691 1.00 39.19 N ATOM 2333 CA ALA A1065 10.163 29.490 -28.880 1.00 39.77 C ATOM 2334 C ALA A1065 10.066 27.951 -28.912 1.00 42.80 C ATOM 2335 O ALA A1065 11.090 27.277 -28.815 1.00 43.13 O ATOM 2336 CB ALA A1065 11.180 29.940 -27.837 1.00 40.83 C ATOM 2337 H ALA A1065 8.553 30.766 -29.496 1.00 0.00 H ATOM 2338 N CYS A1066 8.847 27.402 -29.099 1.00 38.29 N ATOM 2339 CA CYS A1066 8.592 25.967 -29.186 1.00 36.77 C ATOM 2340 C CYS A1066 9.323 25.390 -30.403 1.00 43.29 C ATOM 2341 O CYS A1066 9.203 25.966 -31.486 1.00 43.75 O ATOM 2342 CB CYS A1066 7.090 25.694 -29.267 1.00 35.65 C ATOM 2343 SG CYS A1066 6.630 23.934 -29.240 1.00 38.47 S ATOM 2344 H CYS A1066 8.034 28.045 -29.187 1.00 0.00 H ATOM 2345 N PRO A1067 10.042 24.238 -30.266 1.00 40.12 N ATOM 2346 CA PRO A1067 10.669 23.609 -31.458 1.00 39.67 C ATOM 2347 C PRO A1067 9.546 23.189 -32.407 1.00 43.41 C ATOM 2348 O PRO A1067 8.501 22.747 -31.916 1.00 41.21 O ATOM 2349 CB PRO A1067 11.387 22.382 -30.874 1.00 41.14 C ATOM 2350 CG PRO A1067 11.534 22.687 -29.400 1.00 45.18 C ATOM 2351 CD PRO A1067 10.275 23.428 -29.054 1.00 40.81 C ATOM 2352 N ALA A1068 9.703 23.405 -33.736 1.00 41.16 N ATOM 2353 CA ALA A1068 8.641 23.106 -34.724 1.00 41.24 C ATOM 2354 C ALA A1068 8.103 21.684 -34.655 1.00 43.54 C ATOM 2355 O ALA A1068 6.898 21.484 -34.747 1.00 44.31 O ATOM 2356 CB ALA A1068 9.101 23.434 -36.143 1.00 42.37 C ATOM 2357 H ALA A1068 10.605 23.796 -34.075 1.00 0.00 H ATOM 2358 N GLU A1069 8.978 20.714 -34.447 1.00 40.86 N ATOM 2359 CA GLU A1069 8.640 19.291 -34.357 1.00 41.49 C ATOM 2360 C GLU A1069 7.689 18.981 -33.177 1.00 43.15 C ATOM 2361 O GLU A1069 6.786 18.159 -33.316 1.00 41.83 O ATOM 2362 CB GLU A1069 9.916 18.444 -34.240 1.00 43.60 C ATOM 2363 CG GLU A1069 10.980 18.701 -35.304 1.00 57.87 C ATOM 2364 CD GLU A1069 11.908 19.886 -35.078 1.00 85.17 C ATOM 2365 OE1 GLU A1069 12.339 20.127 -33.926 1.00 78.52 O ATOM 2366 H GLU A1069 9.978 20.980 -34.340 1.00 0.00 H ATOM 2367 N VAL A1070 7.866 19.681 -32.038 1.00 38.99 N ATOM 2368 CA VAL A1070 7.032 19.498 -30.840 1.00 37.35 C ATOM 2369 C VAL A1070 5.629 20.013 -31.134 1.00 37.30 C ATOM 2370 O VAL A1070 4.654 19.328 -30.847 1.00 35.89 O ATOM 2371 CB VAL A1070 7.681 20.162 -29.591 1.00 41.25 C ATOM 2372 CG1 VAL A1070 6.743 20.132 -28.390 1.00 40.89 C ATOM 2373 CG2 VAL A1070 9.017 19.498 -29.253 1.00 41.03 C ATOM 2374 H VAL A1070 8.630 20.385 -32.005 1.00 0.00 H ATOM 2375 N HIS A1071 5.529 21.210 -31.740 1.00 34.58 N ATOM 2376 CA HIS A1071 4.243 21.777 -32.136 1.00 33.71 C ATOM 2377 C HIS A1071 3.525 20.841 -33.128 1.00 35.00 C ATOM 2378 O HIS A1071 2.316 20.634 -33.003 1.00 34.08 O ATOM 2379 CB HIS A1071 4.430 23.187 -32.732 1.00 34.82 C ATOM 2380 CG HIS A1071 3.158 23.790 -33.217 1.00 38.25 C ATOM 2381 ND1 HIS A1071 3.091 24.451 -34.431 1.00 40.03 N ATOM 2382 CD2 HIS A1071 1.934 23.808 -32.637 1.00 39.28 C ATOM 2383 CE1 HIS A1071 1.836 24.847 -34.543 1.00 39.16 C ATOM 2384 NE2 HIS A1071 1.105 24.468 -33.495 1.00 39.04 N ATOM 2385 H HIS A1071 6.397 21.750 -31.933 1.00 0.00 H ATOM 2386 N GLU A1072 4.264 20.253 -34.085 1.00 32.13 N ATOM 2387 CA GLU A1072 3.672 19.298 -35.058 1.00 32.38 C ATOM 2388 C GLU A1072 3.044 18.058 -34.359 1.00 35.69 C ATOM 2389 O GLU A1072 1.987 17.587 -34.776 1.00 35.76 O ATOM 2390 CB GLU A1072 4.715 18.858 -36.108 1.00 34.33 C ATOM 2391 CG GLU A1072 5.129 19.950 -37.088 1.00 44.70 C ATOM 2392 CD GLU A1072 4.010 20.636 -37.856 1.00 67.63 C ATOM 2393 OE1 GLU A1072 3.085 19.939 -38.335 1.00 54.72 O ATOM 2394 OE2 GLU A1072 4.045 21.884 -37.947 1.00 68.76 O ATOM 2395 H GLU A1072 5.279 20.473 -34.146 1.00 0.00 H ATOM 2396 N LEU A1073 3.668 17.571 -33.269 1.00 32.47 N ATOM 2397 CA LEU A1073 3.161 16.440 -32.475 1.00 32.11 C ATOM 2398 C LEU A1073 1.882 16.805 -31.742 1.00 33.61 C ATOM 2399 O LEU A1073 0.936 16.013 -31.752 1.00 33.09 O ATOM 2400 CB LEU A1073 4.234 15.921 -31.479 1.00 33.17 C ATOM 2401 CG LEU A1073 5.425 15.145 -32.073 1.00 38.92 C ATOM 2402 CD1 LEU A1073 6.382 14.699 -30.955 1.00 40.47 C ATOM 2403 CD2 LEU A1073 4.961 13.891 -32.855 1.00 40.29 C ATOM 2404 H LEU A1073 4.558 18.019 -32.972 1.00 0.00 H ATOM 2405 N MET A1074 1.819 18.036 -31.159 1.00 30.17 N ATOM 2406 CA MET A1074 0.618 18.553 -30.477 1.00 30.17 C ATOM 2407 C MET A1074 -0.552 18.516 -31.469 1.00 32.79 C ATOM 2408 O MET A1074 -1.641 18.090 -31.127 1.00 32.85 O ATOM 2409 CB MET A1074 0.814 20.025 -30.051 1.00 31.98 C ATOM 2410 CG MET A1074 1.799 20.248 -28.953 1.00 34.24 C ATOM 2411 SD MET A1074 1.869 22.030 -28.591 1.00 35.51 S ATOM 2412 CE MET A1074 3.516 22.151 -27.936 1.00 32.32 C ATOM 2413 H MET A1074 2.663 18.643 -31.197 1.00 0.00 H ATOM 2414 N LYS A1075 -0.313 18.982 -32.693 1.00 30.64 N ATOM 2415 CA LYS A1075 -1.312 19.005 -33.768 1.00 30.60 C ATOM 2416 C LYS A1075 -1.790 17.610 -34.146 1.00 34.35 C ATOM 2417 O LYS A1075 -2.974 17.446 -34.409 1.00 35.08 O ATOM 2418 CB LYS A1075 -0.768 19.773 -34.984 1.00 32.74 C ATOM 2419 CG LYS A1075 -0.753 21.290 -34.756 1.00 40.52 C ATOM 2420 CD LYS A1075 -0.397 22.083 -36.003 1.00 46.12 C ATOM 2421 CE LYS A1075 1.051 21.955 -36.385 1.00 46.15 C ATOM 2422 NZ LYS A1075 1.343 22.658 -37.660 1.00 53.17 N ATOM 2423 HZ1 LYS A1075 0.764 22.248 -38.421 1.00 0.00 H ATOM 2424 HZ2 LYS A1075 1.118 23.668 -37.557 1.00 0.00 H ATOM 2425 HZ3 LYS A1075 2.351 22.548 -37.892 1.00 0.00 H ATOM 2426 H LYS A1075 0.637 19.351 -32.899 1.00 0.00 H ATOM 2427 N LEU A1076 -0.905 16.592 -34.097 1.00 31.33 N ATOM 2428 CA LEU A1076 -1.312 15.196 -34.354 1.00 31.88 C ATOM 2429 C LEU A1076 -2.235 14.688 -33.216 1.00 34.71 C ATOM 2430 O LEU A1076 -3.269 14.056 -33.481 1.00 32.91 O ATOM 2431 CB LEU A1076 -0.080 14.279 -34.501 1.00 32.27 C ATOM 2432 CG LEU A1076 0.819 14.496 -35.727 1.00 37.70 C ATOM 2433 CD1 LEU A1076 2.013 13.541 -35.713 1.00 38.25 C ATOM 2434 CD2 LEU A1076 0.052 14.379 -37.034 1.00 40.10 C ATOM 2435 H LEU A1076 0.090 16.796 -33.872 1.00 0.00 H ATOM 2436 N CYS A1077 -1.902 15.049 -31.952 1.00 30.51 N ATOM 2437 CA CYS A1077 -2.717 14.679 -30.776 1.00 30.63 C ATOM 2438 C CYS A1077 -4.077 15.320 -30.854 1.00 31.41 C ATOM 2439 O CYS A1077 -5.048 14.785 -30.320 1.00 30.23 O ATOM 2440 CB CYS A1077 -2.018 15.093 -29.491 1.00 31.06 C ATOM 2441 SG CYS A1077 -0.501 14.202 -29.161 1.00 35.33 S ATOM 2442 H CYS A1077 -1.038 15.609 -31.804 1.00 0.00 H ATOM 2443 N TRP A1078 -4.140 16.483 -31.503 1.00 30.03 N ATOM 2444 CA TRP A1078 -5.394 17.213 -31.660 1.00 30.25 C ATOM 2445 C TRP A1078 -6.136 16.936 -32.970 1.00 36.18 C ATOM 2446 O TRP A1078 -6.952 17.776 -33.394 1.00 34.10 O ATOM 2447 CB TRP A1078 -5.187 18.722 -31.467 1.00 28.44 C ATOM 2448 CG TRP A1078 -4.549 19.111 -30.162 1.00 28.44 C ATOM 2449 CD1 TRP A1078 -4.794 18.581 -28.927 1.00 30.98 C ATOM 2450 CD2 TRP A1078 -3.688 20.240 -29.953 1.00 27.77 C ATOM 2451 NE1 TRP A1078 -4.037 19.235 -27.973 1.00 30.57 N ATOM 2452 CE2 TRP A1078 -3.373 20.280 -28.573 1.00 31.80 C ATOM 2453 CE3 TRP A1078 -3.123 21.205 -30.807 1.00 28.47 C ATOM 2454 CZ2 TRP A1078 -2.521 21.255 -28.028 1.00 30.10 C ATOM 2455 CZ3 TRP A1078 -2.286 22.169 -30.266 1.00 30.17 C ATOM 2456 CH2 TRP A1078 -1.996 22.190 -28.891 1.00 30.60 C ATOM 2457 HE1 TRP A1078 -3.979 18.979 -26.967 1.00 0.00 H ATOM 2458 H TRP A1078 -3.270 16.882 -31.909 1.00 0.00 H ATOM 2459 N ALA A1079 -5.909 15.745 -33.583 1.00 33.83 N ATOM 2460 CA ALA A1079 -6.621 15.340 -34.809 1.00 33.66 C ATOM 2461 C ALA A1079 -8.125 15.316 -34.518 1.00 37.42 C ATOM 2462 O ALA A1079 -8.521 14.875 -33.438 1.00 36.57 O ATOM 2463 CB ALA A1079 -6.156 13.959 -35.275 1.00 34.26 C ATOM 2464 H ALA A1079 -5.208 15.096 -33.173 1.00 0.00 H ATOM 2465 N PRO A1080 -8.983 15.820 -35.434 1.00 34.56 N ATOM 2466 CA PRO A1080 -10.427 15.853 -35.139 1.00 35.11 C ATOM 2467 C PRO A1080 -11.046 14.503 -34.751 1.00 41.33 C ATOM 2468 O PRO A1080 -11.856 14.430 -33.816 1.00 41.94 O ATOM 2469 CB PRO A1080 -11.036 16.405 -36.442 1.00 36.84 C ATOM 2470 CG PRO A1080 -9.933 17.176 -37.075 1.00 40.83 C ATOM 2471 CD PRO A1080 -8.682 16.432 -36.743 1.00 36.05 C ATOM 2472 N SER A1081 -10.671 13.435 -35.467 1.00 38.62 N ATOM 2473 CA SER A1081 -11.227 12.105 -35.210 1.00 39.34 C ATOM 2474 C SER A1081 -10.326 11.287 -34.291 1.00 38.68 C ATOM 2475 O SER A1081 -9.117 11.219 -34.540 1.00 38.39 O ATOM 2476 CB SER A1081 -11.512 11.371 -36.520 1.00 45.32 C ATOM 2477 OG SER A1081 -12.386 10.277 -36.296 1.00 62.99 O ATOM 2478 HG SER A1081 -12.560 9.814 -37.154 1.00 0.00 H ATOM 2479 H SER A1081 -9.968 13.553 -36.224 1.00 0.00 H ATOM 2480 N PRO A1082 -10.880 10.685 -33.210 1.00 34.28 N ATOM 2481 CA PRO A1082 -10.031 9.903 -32.274 1.00 34.28 C ATOM 2482 C PRO A1082 -9.164 8.836 -32.930 1.00 41.62 C ATOM 2483 O PRO A1082 -8.004 8.665 -32.550 1.00 40.56 O ATOM 2484 CB PRO A1082 -11.032 9.307 -31.276 1.00 35.66 C ATOM 2485 CG PRO A1082 -12.370 9.514 -31.864 1.00 38.44 C ATOM 2486 CD PRO A1082 -12.292 10.688 -32.772 1.00 34.36 C ATOM 2487 N GLN A1083 -9.697 8.188 -33.984 1.00 41.54 N ATOM 2488 CA GLN A1083 -9.005 7.148 -34.750 1.00 42.53 C ATOM 2489 C GLN A1083 -7.759 7.671 -35.507 1.00 44.54 C ATOM 2490 O GLN A1083 -6.830 6.896 -35.736 1.00 43.66 O ATOM 2491 CB GLN A1083 -9.992 6.405 -35.688 1.00 44.87 C ATOM 2492 CG GLN A1083 -10.767 7.302 -36.654 1.00 72.89 C ATOM 2493 CD GLN A1083 -12.151 6.767 -36.933 1.00106.32 C ATOM 2494 OE1 GLN A1083 -12.337 5.765 -37.645 1.00105.78 O ATOM 2495 NE2 GLN A1083 -13.158 7.438 -36.385 1.00 98.35 N ATOM 2496 HE22 GLN A1083 -12.967 8.272 -35.794 1.00 0.00 H ATOM 2497 HE21 GLN A1083 -14.138 7.129 -36.547 1.00 0.00 H ATOM 2498 H GLN A1083 -10.663 8.443 -34.273 1.00 0.00 H ATOM 2499 N ASP A1084 -7.708 8.986 -35.835 1.00 40.03 N ATOM 2500 CA ASP A1084 -6.562 9.577 -36.540 1.00 38.78 C ATOM 2501 C ASP A1084 -5.451 10.070 -35.629 1.00 41.52 C ATOM 2502 O ASP A1084 -4.364 10.399 -36.123 1.00 41.59 O ATOM 2503 CB ASP A1084 -7.008 10.691 -37.494 1.00 41.39 C ATOM 2504 CG ASP A1084 -7.975 10.214 -38.565 1.00 54.84 C ATOM 2505 OD1 ASP A1084 -7.738 9.113 -39.137 1.00 56.45 O ATOM 2506 OD2 ASP A1084 -8.985 10.919 -38.809 1.00 55.85 O ATOM 2507 H ASP A1084 -8.509 9.598 -35.578 1.00 0.00 H ATOM 2508 N ARG A1085 -5.704 10.125 -34.301 1.00 37.35 N ATOM 2509 CA ARG A1085 -4.706 10.582 -33.327 1.00 36.66 C ATOM 2510 C ARG A1085 -3.646 9.490 -33.182 1.00 40.73 C ATOM 2511 O ARG A1085 -4.012 8.313 -33.218 1.00 40.77 O ATOM 2512 CB ARG A1085 -5.372 10.854 -31.956 1.00 35.10 C ATOM 2513 CG ARG A1085 -6.321 12.042 -32.011 1.00 33.95 C ATOM 2514 CD ARG A1085 -7.153 12.228 -30.771 1.00 35.32 C ATOM 2515 NE ARG A1085 -8.331 13.023 -31.125 1.00 29.88 N ATOM 2516 CZ ARG A1085 -9.483 12.981 -30.480 1.00 37.43 C ATOM 2517 NH1 ARG A1085 -10.514 13.689 -30.913 1.00 33.41 N ATOM 2518 NH2 ARG A1085 -9.616 12.233 -29.397 1.00 26.91 N ATOM 2519 HE ARG A1085 -8.255 13.665 -31.940 1.00 0.00 H ATOM 2520 HH12 ARG A1085 -11.420 13.654 -30.403 1.00 0.00 H ATOM 2521 HH11 ARG A1085 -10.418 14.280 -31.763 1.00 0.00 H ATOM 2522 HH22 ARG A1085 -10.526 12.204 -28.893 1.00 0.00 H ATOM 2523 HH21 ARG A1085 -8.811 11.674 -29.049 1.00 0.00 H ATOM 2524 H ARG A1085 -6.641 9.832 -33.958 1.00 0.00 H ATOM 2525 N PRO A1086 -2.352 9.823 -32.990 1.00 37.58 N ATOM 2526 CA PRO A1086 -1.358 8.757 -32.818 1.00 37.50 C ATOM 2527 C PRO A1086 -1.562 8.055 -31.486 1.00 41.84 C ATOM 2528 O PRO A1086 -2.290 8.561 -30.627 1.00 40.58 O ATOM 2529 CB PRO A1086 -0.016 9.486 -32.886 1.00 39.34 C ATOM 2530 CG PRO A1086 -0.309 10.891 -32.529 1.00 44.29 C ATOM 2531 CD PRO A1086 -1.743 11.166 -32.859 1.00 40.01 C ATOM 2532 N SER A1087 -0.984 6.859 -31.341 1.00 37.54 N ATOM 2533 CA SER A1087 -1.114 6.111 -30.097 1.00 36.21 C ATOM 2534 C SER A1087 -0.010 6.603 -29.197 1.00 36.70 C ATOM 2535 O SER A1087 0.971 7.151 -29.692 1.00 36.85 O ATOM 2536 CB SER A1087 -0.927 4.611 -30.361 1.00 40.51 C ATOM 2537 OG SER A1087 0.417 4.318 -30.732 1.00 46.63 O ATOM 2538 HG SER A1087 0.508 3.346 -30.896 1.00 0.00 H ATOM 2539 H SER A1087 -0.434 6.456 -32.126 1.00 0.00 H ATOM 2540 N PHE A1088 -0.111 6.346 -27.887 1.00 33.85 N ATOM 2541 CA PHE A1088 0.983 6.654 -26.963 1.00 32.50 C ATOM 2542 C PHE A1088 2.215 5.819 -27.343 1.00 39.85 C ATOM 2543 O PHE A1088 3.336 6.292 -27.184 1.00 40.20 O ATOM 2544 CB PHE A1088 0.563 6.418 -25.498 1.00 32.24 C ATOM 2545 CG PHE A1088 -0.357 7.489 -24.947 1.00 31.22 C ATOM 2546 CD1 PHE A1088 0.078 8.812 -24.824 1.00 32.31 C ATOM 2547 CD2 PHE A1088 -1.651 7.181 -24.559 1.00 32.22 C ATOM 2548 CE1 PHE A1088 -0.774 9.801 -24.336 1.00 32.51 C ATOM 2549 CE2 PHE A1088 -2.498 8.167 -24.032 1.00 33.94 C ATOM 2550 CZ PHE A1088 -2.058 9.472 -23.938 1.00 31.68 C ATOM 2551 H PHE A1088 -0.984 5.919 -27.518 1.00 0.00 H ATOM 2552 N SER A1089 2.014 4.590 -27.883 1.00 40.71 N ATOM 2553 CA SER A1089 3.151 3.756 -28.321 1.00 41.87 C ATOM 2554 C SER A1089 3.861 4.359 -29.528 1.00 44.54 C ATOM 2555 O SER A1089 5.075 4.318 -29.566 1.00 44.35 O ATOM 2556 CB SER A1089 2.758 2.295 -28.546 1.00 47.23 C ATOM 2557 OG SER A1089 1.612 2.161 -29.371 1.00 60.50 O ATOM 2558 HG SER A1089 1.794 2.568 -30.255 1.00 0.00 H ATOM 2559 H SER A1089 1.044 4.230 -27.990 1.00 0.00 H ATOM 2560 N ALA A1090 3.125 4.993 -30.458 1.00 42.48 N ATOM 2561 CA ALA A1090 3.730 5.674 -31.617 1.00 42.83 C ATOM 2562 C ALA A1090 4.399 6.996 -31.210 1.00 45.16 C ATOM 2563 O ALA A1090 5.466 7.309 -31.732 1.00 45.31 O ATOM 2564 CB ALA A1090 2.686 5.919 -32.696 1.00 43.88 C ATOM 2565 H ALA A1090 2.090 5.003 -30.356 1.00 0.00 H ATOM 2566 N LEU A1091 3.803 7.755 -30.250 1.00 40.26 N ATOM 2567 CA LEU A1091 4.377 9.031 -29.774 1.00 38.18 C ATOM 2568 C LEU A1091 5.687 8.899 -29.026 1.00 41.58 C ATOM 2569 O LEU A1091 6.561 9.765 -29.163 1.00 41.23 O ATOM 2570 CB LEU A1091 3.367 9.818 -28.903 1.00 37.81 C ATOM 2571 CG LEU A1091 2.206 10.501 -29.625 1.00 40.78 C ATOM 2572 CD1 LEU A1091 1.036 10.780 -28.654 1.00 39.89 C ATOM 2573 CD2 LEU A1091 2.672 11.777 -30.331 1.00 39.93 C ATOM 2574 H LEU A1091 2.909 7.424 -29.835 1.00 0.00 H ATOM 2575 N GLY A1092 5.788 7.861 -28.194 1.00 39.37 N ATOM 2576 CA GLY A1092 6.954 7.579 -27.360 1.00 39.33 C ATOM 2577 C GLY A1092 8.306 7.615 -28.053 1.00 44.82 C ATOM 2578 O GLY A1092 9.157 8.425 -27.675 1.00 43.84 O ATOM 2579 H GLY A1092 4.981 7.208 -28.135 1.00 0.00 H ATOM 2580 N PRO A1093 8.550 6.762 -29.080 1.00 44.30 N ATOM 2581 CA PRO A1093 9.854 6.807 -29.780 1.00 44.54 C ATOM 2582 C PRO A1093 10.129 8.161 -30.429 1.00 47.64 C ATOM 2583 O PRO A1093 11.288 8.543 -30.513 1.00 47.49 O ATOM 2584 CB PRO A1093 9.736 5.710 -30.850 1.00 46.22 C ATOM 2585 CG PRO A1093 8.602 4.851 -30.422 1.00 50.91 C ATOM 2586 CD PRO A1093 7.665 5.737 -29.667 1.00 46.24 C ATOM 2587 N GLN A1094 9.067 8.879 -30.890 1.00 43.53 N ATOM 2588 CA GLN A1094 9.178 10.211 -31.511 1.00 42.33 C ATOM 2589 C GLN A1094 9.685 11.262 -30.512 1.00 46.32 C ATOM 2590 O GLN A1094 10.570 12.046 -30.853 1.00 45.64 O ATOM 2591 CB GLN A1094 7.849 10.639 -32.144 1.00 43.35 C ATOM 2592 CG GLN A1094 7.422 9.742 -33.303 1.00 45.13 C ATOM 2593 CD GLN A1094 6.245 10.305 -34.029 1.00 59.59 C ATOM 2594 OE1 GLN A1094 5.100 9.911 -33.792 1.00 57.27 O ATOM 2595 NE2 GLN A1094 6.503 11.241 -34.937 1.00 57.08 N ATOM 2596 HE22 GLN A1094 7.483 11.545 -35.106 1.00 0.00 H ATOM 2597 HE21 GLN A1094 5.725 11.669 -35.478 1.00 0.00 H ATOM 2598 H GLN A1094 8.119 8.461 -30.798 1.00 0.00 H ATOM 2599 N LEU A1095 9.162 11.246 -29.267 1.00 43.42 N ATOM 2600 CA LEU A1095 9.616 12.155 -28.207 1.00 43.60 C ATOM 2601 C LEU A1095 11.043 11.787 -27.807 1.00 52.33 C ATOM 2602 O LEU A1095 11.895 12.673 -27.679 1.00 52.10 O ATOM 2603 CB LEU A1095 8.670 12.134 -26.984 1.00 42.77 C ATOM 2604 CG LEU A1095 7.280 12.726 -27.199 1.00 47.29 C ATOM 2605 CD1 LEU A1095 6.284 12.190 -26.183 1.00 47.45 C ATOM 2606 CD2 LEU A1095 7.312 14.253 -27.203 1.00 48.82 C ATOM 2607 H LEU A1095 8.408 10.563 -29.051 1.00 0.00 H ATOM 2608 N ASP A1096 11.323 10.472 -27.699 1.00 53.64 N ATOM 2609 CA ASP A1096 12.665 9.960 -27.384 1.00 55.56 C ATOM 2610 C ASP A1096 13.685 10.319 -28.465 1.00 62.15 C ATOM 2611 O ASP A1096 14.823 10.634 -28.124 1.00 61.95 O ATOM 2612 CB ASP A1096 12.638 8.449 -27.095 1.00 57.70 C ATOM 2613 CG ASP A1096 11.981 8.121 -25.767 1.00 69.35 C ATOM 2614 OD1 ASP A1096 12.317 8.780 -24.762 1.00 70.18 O ATOM 2615 OD2 ASP A1096 11.137 7.200 -25.732 1.00 75.73 O ATOM 2616 H ASP A1096 10.553 9.788 -27.845 1.00 0.00 H ATOM 2617 N MET A1097 13.263 10.337 -29.752 1.00 61.24 N ATOM 2618 CA MET A1097 14.122 10.723 -30.877 1.00 62.65 C ATOM 2619 C MET A1097 14.508 12.206 -30.786 1.00 70.49 C ATOM 2620 O MET A1097 15.676 12.537 -30.992 1.00 70.78 O ATOM 2621 CB MET A1097 13.465 10.410 -32.229 1.00 65.01 C ATOM 2622 CG MET A1097 13.812 9.034 -32.763 1.00 68.85 C ATOM 2623 H MET A1097 12.280 10.063 -29.953 1.00 0.00 H ATOM 2624 N LEU A1098 13.544 13.088 -30.419 1.00 69.36 N ATOM 2625 CA LEU A1098 13.777 14.532 -30.244 1.00 70.20 C ATOM 2626 C LEU A1098 14.754 14.836 -29.097 1.00 79.16 C ATOM 2627 O LEU A1098 15.262 15.952 -28.999 1.00 78.33 O ATOM 2628 CB LEU A1098 12.451 15.296 -30.082 1.00 69.85 C ATOM 2629 CG LEU A1098 11.605 15.445 -31.349 1.00 73.75 C ATOM 2630 CD1 LEU A1098 10.187 15.838 -31.015 1.00 73.83 C ATOM 2631 CD2 LEU A1098 12.214 16.454 -32.306 1.00 75.44 C ATOM 2632 H LEU A1098 12.585 12.723 -30.252 1.00 0.00 H ATOM 2633 N TRP A1099 15.037 13.797 -28.270 1.00 80.94 N ATOM 2634 CA TRP A1099 15.961 13.654 -27.137 1.00 82.76 C ATOM 2635 C TRP A1099 15.346 14.050 -25.818 1.00 88.10 C ATOM 2636 O TRP A1099 15.203 15.233 -25.503 1.00 88.55 O ATOM 2637 CB TRP A1099 17.326 14.323 -27.353 1.00 82.43 C ATOM 2638 CG TRP A1099 18.059 13.730 -28.518 1.00 84.22 C ATOM 2639 CD1 TRP A1099 18.419 12.423 -28.681 1.00 87.31 C ATOM 2640 CD2 TRP A1099 18.466 14.412 -29.710 1.00 84.41 C ATOM 2641 NE1 TRP A1099 19.025 12.248 -29.902 1.00 87.24 N ATOM 2642 CE2 TRP A1099 19.083 13.457 -30.549 1.00 88.87 C ATOM 2643 CE3 TRP A1099 18.383 15.748 -30.147 1.00 85.84 C ATOM 2644 CZ2 TRP A1099 19.621 13.793 -31.800 1.00 88.36 C ATOM 2645 CZ3 TRP A1099 18.911 16.080 -31.386 1.00 87.60 C ATOM 2646 CH2 TRP A1099 19.522 15.111 -32.199 1.00 88.41 C ATOM 2647 HE1 TRP A1099 19.382 11.345 -30.275 1.00 0.00 H ATOM 2648 H TRP A1099 14.494 12.935 -28.479 1.00 0.00 H ATOM 2649 N SER A1100 15.004 13.014 -25.039 1.00 84.49 N ATOM 2650 CA SER A1100 14.417 13.090 -23.711 1.00104.30 C ATOM 2651 C SER A1100 15.502 13.363 -22.672 1.00108.59 C ATOM 2652 O SER A1100 16.244 14.332 -22.792 1.00 56.15 O ATOM 2653 CB SER A1100 13.689 11.788 -23.384 1.00107.58 C ATOM 2654 OG SER A1100 14.551 10.662 -23.391 1.00115.44 O ATOM 2655 HG SER A1100 14.031 9.848 -23.174 1.00 0.00 H ATOM 2656 H SER A1100 15.175 12.062 -25.422 1.00 0.00 H TER 2657 SER A1100 HETATM 2658 O HOH 1 -7.438 16.369 -18.960 1.00 35.91 O HETATM 2659 O HOH 2 -9.482 3.269 -26.016 1.00 34.49 O HETATM 2660 O HOH 3 12.598 7.295 16.751 1.00 46.71 O HETATM 2661 O HOH 4 12.651 25.084 -23.409 1.00 49.85 O HETATM 2662 O HOH 5 -11.306 21.362 -25.216 1.00 36.43 O HETATM 2663 O HOH 6 -4.809 16.462 -8.509 1.00 49.74 O HETATM 2664 O HOH 7 1.562 18.942 -3.459 1.00 32.10 O HETATM 2665 O HOH 8 -3.320 34.660 -24.069 1.00 46.80 O HETATM 2666 O HOH 9 -2.879 21.934 -15.482 1.00 27.22 O HETATM 2667 O HOH 10 -3.294 5.191 -22.811 1.00 26.77 O HETATM 2668 O HOH 11 -6.415 22.243 -37.586 1.00 47.95 O HETATM 2669 O HOH 12 -13.074 8.648 2.778 1.00 43.87 O HETATM 2670 O HOH 13 -9.554 13.816 -21.512 1.00 38.11 O HETATM 2671 O HOH 14 -1.581 24.911 -33.530 1.00 50.93 O HETATM 2672 O HOH 15 -11.621 14.406 -23.180 1.00 28.64 O HETATM 2673 O HOH 16 -11.985 15.413 -16.693 1.00 43.50 O HETATM 2674 O HOH 17 -0.754 1.515 -24.583 1.00 34.52 O HETATM 2675 O HOH 18 12.984 26.161 -27.270 1.00 45.29 O HETATM 2676 O HOH 19 -8.709 21.178 -25.682 1.00 31.94 O HETATM 2677 O HOH 20 -10.946 -4.070 -18.056 1.00 42.92 O HETATM 2678 O HOH 21 -8.029 35.336 -21.766 1.00 45.49 O HETATM 2679 O HOH 22 9.071 15.400 -4.868 1.00 29.08 O HETATM 2680 O HOH 23 -6.999 11.518 -6.325 1.00 34.01 O HETATM 2681 O HOH 24 6.248 1.767 -16.598 1.00 43.23 O HETATM 2682 O HOH 25 -0.819 -4.880 -12.558 1.00 30.65 O HETATM 2683 O HOH 26 -5.113 8.652 -7.380 1.00 29.02 O HETATM 2684 O HOH 27 -5.432 5.869 -21.300 1.00 29.93 O HETATM 2685 O HOH 28 -3.751 16.679 -36.877 1.00 47.69 O HETATM 2686 O HOH 29 5.597 5.414 -24.831 1.00 42.95 O HETATM 2687 O HOH 30 -9.936 11.123 -21.614 1.00 33.25 O HETATM 2688 O HOH 31 0.069 21.392 -2.449 1.00 48.17 O HETATM 2689 O HOH 32 2.076 -1.186 -0.451 1.00 66.67 O HETATM 2690 O HOH 33 -13.615 3.753 -12.562 1.00 80.99 O HETATM 2691 O HOH 34 -12.722 9.369 -27.130 1.00 50.95 O HETATM 2692 O HOH 35 14.103 28.112 -19.935 1.00 51.83 O HETATM 2693 O HOH 36 4.890 22.100 -7.422 1.00 32.06 O HETATM 2694 O HOH 37 7.119 6.763 14.315 1.00 34.29 O HETATM 2695 O HOH 38 -14.093 13.704 -32.468 1.00 47.45 O HETATM 2696 O HOH 39 -8.544 17.862 -17.151 1.00 52.44 O HETATM 2697 O HOH 40 -10.372 -3.707 -29.315 1.00 85.69 O HETATM 2698 O HOH 41 -0.264 16.840 -9.228 1.00 42.03 O HETATM 2699 O HOH 42 -3.610 32.272 -31.197 1.00 49.58 O HETATM 2700 O HOH 43 -9.795 10.717 -41.394 1.00 61.99 O HETATM 2701 O HOH 44 7.016 29.238 -24.205 1.00 31.57 O HETATM 2702 O HOH 45 -11.234 6.013 -10.469 1.00 40.42 O HETATM 2703 O HOH 46 0.996 -4.204 -14.324 1.00 32.12 O HETATM 2704 O HOH 47 -5.265 12.400 6.094 1.00 41.19 O HETATM 2705 O HOH 48 -9.679 13.483 -7.453 1.00 55.64 O HETATM 2706 O HOH 49 6.013 9.007 1.102 1.00 31.73 O HETATM 2707 O HOH 50 -3.152 -3.111 -0.084 1.00 67.88 O HETATM 2708 O HOH 51 3.145 0.423 2.234 1.00 54.31 O HETATM 2709 O HOH 52 -9.391 -1.038 -0.167 1.00 54.25 O HETATM 2710 O HOH 53 -11.951 -4.435 -27.220 1.00 51.00 O HETATM 2711 O HOH 54 -9.222 13.446 -11.177 1.00 57.98 O HETATM 2712 O HOH 55 -19.418 10.646 6.165 1.00 63.39 O HETATM 2713 O HOH 56 3.134 12.051 16.496 1.00 53.09 O HETATM 2714 O HOH 57 -4.835 30.406 -16.490 1.00 60.77 O HETATM 2715 O HOH 58 -7.959 17.926 8.317 1.00 45.97 O HETATM 2716 O HOH 59 -13.693 17.200 -12.365 1.00 43.53 O HETATM 2717 O HOH 60 -11.595 5.971 -29.685 1.00 58.92 O HETATM 2718 O HOH 61 0.876 -4.040 -18.957 1.00 35.45 O HETATM 2719 O HOH 62 -14.605 15.037 -16.401 1.00 41.41 O HETATM 2720 O HOH 63 -5.243 -0.628 -12.460 1.00 37.32 O HETATM 2721 O HOH 64 18.802 28.796 -18.420 1.00 43.06 O HETATM 2722 O HOH 65 15.917 10.873 -15.275 1.00 48.64 O HETATM 2723 O HOH 66 -4.011 10.153 14.380 1.00 57.07 O HETATM 2724 O HOH 67 -9.514 13.481 -38.025 1.00 48.74 O HETATM 2725 O HOH 68 6.682 5.806 -33.661 1.00 56.39 O HETATM 2726 O HOH 69 -10.779 7.958 12.625 1.00 37.45 O HETATM 2727 O HOH 70 -3.987 22.835 -6.129 1.00 80.33 O HETATM 2728 O HOH 71 6.546 5.678 9.083 1.00 45.17 O HETATM 2729 O HOH 72 -5.355 25.445 -36.761 1.00 50.94 O HETATM 2730 O HOH 73 1.736 20.547 -40.634 1.00 69.87 O HETATM 2731 O HOH 74 18.205 19.124 -19.746 1.00 46.82 O HETATM 2732 O HOH 75 -6.634 18.821 -10.344 1.00 59.00 O HETATM 2733 O HOH 76 -1.547 25.108 -6.669 1.00 60.82 O HETATM 2734 O HOH 77 5.821 29.964 -16.593 1.00 36.02 O HETATM 2735 O HOH 78 -5.633 27.262 -17.864 1.00 38.58 O HETATM 2736 O HOH 79 -1.026 28.094 -15.534 1.00 56.85 O HETATM 2737 O HOH 80 -5.933 9.355 10.958 1.00 43.96 O HETATM 2738 O HOH 81 -8.826 14.190 6.810 1.00 52.63 O HETATM 2739 O HOH 82 8.707 26.616 -25.827 1.00 33.66 O HETATM 2740 O HOH 83 -8.006 23.818 -12.182 1.00 49.22 O HETATM 2741 O HOH 84 7.038 26.593 -33.069 1.00 55.05 O HETATM 2742 O HOH 85 -4.664 -4.331 -22.741 1.00 42.63 O HETATM 2743 O HOH 86 -5.523 23.151 -29.556 1.00 32.43 O HETATM 2744 O HOH 87 7.154 16.285 -35.304 1.00 42.62 O HETATM 2745 O HOH 88 1.173 17.857 -37.396 1.00 39.42 O HETATM 2746 O HOH 89 3.369 -1.250 -23.978 1.00 59.52 O HETATM 2747 O HOH 90 -6.775 -3.754 -7.486 1.00 40.41 O HETATM 2748 O HOH 91 -17.328 15.115 -0.292 1.00 65.40 O HETATM 2749 O HOH 92 0.290 27.520 -19.886 1.00 33.99 O HETATM 2750 O HOH 93 0.626 -0.295 -6.868 1.00 46.61 O HETATM 2751 O HOH 94 -8.422 -2.796 -27.043 1.00 44.28 O HETATM 2752 O HOH 95 -2.606 5.270 -27.330 1.00 51.49 O HETATM 2753 O HOH 96 0.008 28.076 -10.359 1.00 45.81 O HETATM 2754 O HOH 97 1.074 29.579 -27.178 1.00 32.60 O HETATM 2755 O HOH 98 -17.618 25.038 -36.153 1.00 58.01 O HETATM 2756 O HOH 99 -6.885 -3.402 -15.546 1.00 52.79 O HETATM 2757 O HOH 100 -6.109 21.156 -9.060 1.00105.49 O HETATM 2758 O HOH 101 11.902 24.289 -5.104 1.00 56.66 O HETATM 2759 O HOH 102 -0.229 3.247 -26.882 1.00 54.56 O HETATM 2760 O HOH 103 -4.771 7.328 -30.215 1.00 53.21 O HETATM 2761 O HOH 104 4.547 -0.844 -7.079 1.00 70.64 O HETATM 2762 O HOH 105 10.213 6.417 -7.598 1.00 58.85 O HETATM 2763 O HOH 106 -8.052 1.482 -28.629 1.00 55.78 O HETATM 2764 O HOH 107 -14.220 7.069 -12.317 1.00 61.01 O HETATM 2765 O HOH 108 -15.459 15.794 -13.926 1.00 41.82 O HETATM 2766 O HOH 109 -8.477 10.562 -12.974 1.00 30.33 O HETATM 2767 O HOH 110 -5.043 -4.823 -14.150 1.00 45.43 O HETATM 2768 O HOH 111 -16.237 19.003 -3.166 1.00 68.24 O HETATM 2769 O HOH 112 -4.554 4.752 -29.318 1.00 60.90 O HETATM 2770 O HOH 113 0.983 28.538 -34.135 1.00 35.77 O HETATM 2771 O HOH 114 7.312 5.147 21.152 1.00 59.58 O HETATM 2772 O HOH 115 8.618 12.062 0.748 1.00 48.58 O HETATM 2773 O HOH 116 -6.853 0.579 9.298 1.00 53.03 O HETATM 2774 O HOH 117 0.690 2.865 -7.975 1.00 31.44 O HETATM 2775 O HOH 118 6.330 4.968 -8.938 1.00 38.83 O HETATM 2776 O HOH 119 -15.022 -0.153 -29.081 1.00 39.77 O HETATM 2777 O HOH 120 -1.048 -5.762 -8.135 1.00 51.09 O HETATM 2778 O HOH 121 8.306 8.078 -24.421 1.00 56.34 O HETATM 2779 O HOH 122 6.686 29.599 -31.593 1.00 47.53 O HETATM 2780 O HOH 123 -4.677 19.681 -34.942 1.00 41.76 O HETATM 2781 O HOH 124 -20.163 3.315 -22.050 1.00 50.01 O HETATM 2782 O HOH 125 -7.135 12.913 -19.918 1.00 30.51 O HETATM 2783 O HOH 126 -16.735 13.505 -17.124 1.00 52.24 O HETATM 2784 O HOH 127 -7.382 2.162 11.464 1.00 53.39 O HETATM 2785 O HOH 128 2.613 30.711 -32.423 1.00 44.43 O HETATM 2786 O HOH 129 -16.364 -6.924 -21.881 1.00 63.56 O HETATM 2787 O HOH 130 -17.637 15.576 -20.892 1.00 57.23 O HETATM 2788 O HOH 131 -15.074 8.837 -10.444 1.00 55.47 O HETATM 2789 O HOH 132 -6.181 21.512 -5.172 1.00 69.36 O HETATM 2790 O HOH 133 -20.143 19.213 2.318 1.00 49.65 O HETATM 2791 O HOH 134 16.889 17.854 -27.530 1.00 82.34 O HETATM 2792 O HOH 135 2.314 32.018 -14.737 1.00 47.71 O HETATM 2793 O HOH 136 5.391 2.008 -19.998 1.00 45.45 O HETATM 2794 O HOH 137 -14.774 -6.793 -19.377 1.00 46.26 O HETATM 2795 O HOH 138 -2.933 23.384 5.458 1.00 45.00 O HETATM 2796 O HOH 139 -6.829 -1.763 -0.806 1.00 43.06 O HETATM 2797 O HOH 140 4.505 28.354 -9.175 1.00 49.45 O HETATM 2798 O HOH 141 -15.452 1.217 12.407 1.00 73.31 O HETATM 2799 O HOH 142 2.856 22.697 -5.621 1.00 63.17 O HETATM 2800 O HOH 143 8.946 17.187 8.505 1.00 60.92 O HETATM 2801 O HOH 144 -3.296 14.265 13.860 1.00 48.23 O HETATM 2802 O HOH 145 2.367 -0.095 -4.896 1.00 45.71 O HETATM 2803 O HOH 146 3.993 13.197 14.176 1.00 53.14 O HETATM 2804 O HOH 147 -18.737 13.823 -19.086 1.00 79.87 O HETATM 2805 O HOH 148 -12.635 8.721 -6.927 1.00 52.26 O HETATM 2806 O HOH 149 10.903 7.529 8.949 1.00 65.99 O HETATM 2807 O HOH 150 -3.765 29.759 -32.833 1.00 58.44 O HETATM 2808 O HOH 151 -21.279 30.452 -21.256 1.00 63.33 O HETATM 2809 O HOH 152 4.569 0.742 -1.623 1.00 64.70 O HETATM 2810 O HOH 153 -3.682 -2.615 -13.605 1.00 29.91 O HETATM 2811 O HOH 154 -0.556 5.634 -34.024 1.00 56.92 O HETATM 2812 O HOH 155 -22.043 8.920 -15.346 1.00 76.07 O HETATM 2813 O HOH 156 8.307 1.418 -14.833 1.00 40.10 O HETATM 2814 O HOH 157 7.009 30.946 -22.154 1.00 53.17 O HETATM 2815 O HOH 158 -10.311 2.704 12.770 1.00 60.50 O HETATM 2816 O HOH 159 3.131 2.845 -9.741 1.00 30.25 O HETATM 2817 O HOH 160 9.184 10.912 -2.779 1.00 70.15 O HETATM 2818 O HOH 161 10.639 13.263 -3.922 1.00 40.17 O HETATM 2819 O HOH 162 -3.048 10.262 -6.712 1.00 32.15 O HETATM 2820 O HOH 163 -14.676 -2.275 -16.528 1.00 53.28 O HETATM 2821 O HOH 164 -3.195 14.559 -5.744 1.00 37.93 O HETATM 2822 O HOH 165 -7.095 24.240 -14.722 1.00 52.25 O HETATM 2823 O HOH 166 -9.042 29.165 -15.862 1.00 60.00 O HETATM 2824 O HOH 167 12.468 8.576 -21.078 1.00 63.21 O HETATM 2825 O HOH 168 15.768 17.228 -7.917 1.00 49.38 O HETATM 2826 O HOH 169 -0.707 22.021 -39.802 1.00 55.81 O HETATM 2827 O HOH 170 -5.463 27.778 -35.097 1.00 48.66 O HETATM 2828 O HOH 171 -11.736 19.998 -37.656 1.00 64.60 O HETATM 2829 O HOH 172 8.457 10.474 2.940 1.00 58.29 O HETATM 2830 O HOH 173 -13.373 15.625 5.986 1.00 56.26 O HETATM 2831 O HOH 174 -6.568 3.352 14.934 1.00 46.04 O HETATM 2832 O HOH 175 -16.607 13.930 7.009 1.00 49.99 O HETATM 2833 O HOH 176 11.300 6.212 12.908 1.00 57.64 O HETATM 2834 O HOH 177 8.537 32.618 -30.518 1.00 58.57 O HETATM 2835 O HOH 178 -13.925 1.283 -13.846 1.00 50.40 O HETATM 2836 O HOH 179 2.804 37.783 -19.567 1.00 49.57 O HETATM 2837 O HOH 180 19.661 17.891 -26.791 1.00 72.80 O HETATM 2838 O HOH 181 12.566 24.567 -34.225 1.00 56.76 O HETATM 2839 O HOH 182 13.341 8.612 -18.281 1.00 57.58 O HETATM 2840 O HOH 183 7.623 1.294 -9.912 1.00 57.64 O HETATM 2841 O HOH 184 0.032 25.529 -37.295 1.00 58.25 O HETATM 2842 O HOH 185 -18.634 20.305 -19.063 1.00 51.04 O HETATM 2843 O HOH 186 20.273 25.314 -15.866 1.00 52.39 O HETATM 2844 O HOH 187 -9.287 -4.086 -1.292 1.00 81.83 O HETATM 2845 O HOH 188 17.185 16.199 -19.758 1.00 43.35 O HETATM 2846 O HOH 189 -7.724 -2.419 -11.155 1.00 53.96 O HETATM 2847 O HOH 190 -18.271 13.334 -14.906 1.00 66.35 O HETATM 2848 O HOH 191 -4.395 24.581 -14.582 1.00 36.21 O HETATM 2849 O HOH 192 -7.678 32.649 -17.839 1.00 55.12 O HETATM 2850 O HOH 193 -1.223 26.002 -17.917 1.00 43.93 O HETATM 2851 O HOH 194 9.831 11.378 5.105 1.00 52.22 O HETATM 2852 O HOH 195 -6.626 19.129 -36.725 1.00 54.22 O HETATM 2853 O HOH 196 -11.654 -0.598 -10.083 1.00 58.47 O HETATM 2854 O HOH 197 -6.633 21.380 -27.693 1.00 38.00 O HETATM 2855 O HOH 198 7.722 -1.636 -12.920 1.00 58.26 O HETATM 2856 O HOH 199 -19.536 4.430 -14.008 1.00123.03 O HETATM 2857 O HOH 200 -16.219 19.127 -5.875 1.00 61.50 O HETATM 2858 O HOH 201 5.190 1.454 -8.619 1.00 41.32 O HETATM 2859 O HOH 202 8.284 5.336 -25.152 1.00 56.19 O HETATM 2860 O HOH 203 14.964 26.387 -23.882 1.00 49.93 O HETATM 2861 O HOH 204 4.968 31.832 -14.873 1.00 59.89 O HETATM 2862 O HOH 205 -13.242 3.675 -29.528 1.00 71.25 O HETATM 2863 O HOH 206 11.086 25.287 -25.614 1.00 40.80 O HETATM 2864 O HOH 207 -5.666 15.723 -5.818 1.00 44.00 O HETATM 2865 O HOH 208 -0.489 31.294 -11.835 1.00 54.97 O HETATM 2866 O HOH 209 4.875 7.001 -36.282 1.00 67.42 O HETATM 2867 O HOH 210 -8.040 26.139 -16.443 1.00 41.24 O HETATM 2868 O HOH 211 -16.712 2.394 -17.550 1.00 71.76 O HETATM 2869 O HOH 212 -7.158 14.372 -39.025 1.00 50.45 O HETATM 2870 O HOH 213 -3.958 37.236 -23.489 1.00 55.40 O HETATM 2871 O HOH 214 -6.014 24.318 -40.068 1.00 80.22 O HETATM 2872 O HOH 215 -4.248 -5.295 -6.968 1.00 55.21 O HETATM 2873 O HOH 216 -2.432 15.219 -8.279 1.00 33.44 O HETATM 2874 O HOH 217 -4.408 12.141 -5.475 1.00 31.31 O HETATM 2875 O HOH 218 5.137 31.237 -33.184 1.00 56.23 O HETATM 2876 O HOH 219 -1.405 18.088 -38.274 1.00 48.86 O HETATM 2877 O HOH 220 -14.266 7.295 -29.276 1.00 54.70 O HETATM 2878 O HOH 221 -3.480 26.367 -16.438 1.00 46.34 O HETATM 2879 O HOH 222 -15.419 11.546 -33.522 1.00 66.58 O HETATM 2880 O HOH 223 -3.127 3.925 -25.139 1.00 37.41 O HETATM 2881 O HOH 224 15.979 27.963 -21.920 1.00 47.03 O HETATM 2882 O HOH 225 -20.283 6.862 -15.575 1.00 60.81 O HETATM 2883 O HOH 226 -10.283 -2.932 -10.522 1.00 53.21 O HETATM 2884 O HOH 227 -3.917 21.674 -36.635 1.00 38.90 O HETATM 2885 O HOH 228 -2.686 20.482 -38.696 1.00 49.67 O HETATM 2886 O HOH 229 -3.076 24.218 -35.701 1.00 50.41 O HETATM 2887 O HOH 230 16.286 9.025 -17.962 1.00 55.98 O HETATM 2888 O HOH 231 5.692 4.492 6.778 1.00 54.47 O HETATM 2889 O HOH 232 9.896 14.092 2.079 1.00 50.09 O HETATM 2890 N3 UNN A 233 1.153 12.078 -3.567 1.00 -0.27 N HETATM 2891 C13 UNN A 233 -0.142 11.810 -4.084 1.00 0.02 C HETATM 2892 C12 UNN A 233 -0.791 13.008 -4.338 1.00 -0.05 C HETATM 2893 C11 UNN A 233 0.103 14.052 -3.949 1.00 0.04 C HETATM 2894 C10 UNN A 233 0.107 15.484 -3.945 1.00 0.12 C HETATM 2895 N2 UNN A 233 -1.034 16.144 -4.383 1.00 -0.30 N HETATM 2896 C5 UNN A 233 -1.257 17.579 -4.477 1.00 0.06 C HETATM 2897 C4 UNN A 233 -2.754 17.864 -4.456 1.00 -0.03 C HETATM 2898 C3 UNN A 233 -3.082 19.323 -4.815 1.00 -0.03 C HETATM 2899 C2 UNN A 233 -2.427 19.758 -6.121 1.00 0.04 C HETATM 2900 C1 UNN A 233 -3.124 19.209 -7.362 1.00 -0.04 C HETATM 2901 H13 UNN A 233 -4.192 19.470 -7.328 1.00 0.03 H HETATM 2902 H14 UNN A 233 -3.015 18.115 -7.390 1.00 0.03 H HETATM 2903 H15 UNN A 233 -2.668 19.646 -8.262 1.00 0.03 H HETATM 2904 N1 UNN A 233 -0.950 19.462 -6.054 1.00 -0.27 N HETATM 2905 C7 UNN A 233 0.058 20.476 -6.106 1.00 0.18 C HETATM 2906 C8 UNN A 233 -0.262 21.938 -6.503 1.00 0.03 C HETATM 2907 C9 UNN A 233 -0.519 21.978 -8.001 1.00 -0.05 C HETATM 2908 H7 UNN A 233 -0.749 23.009 -8.306 1.00 0.03 H HETATM 2909 H8 UNN A 233 -1.370 21.325 -8.245 1.00 0.03 H HETATM 2910 H9 UNN A 233 0.376 21.628 -8.536 1.00 0.03 H HETATM 2911 H11 UNN A 233 0.591 22.587 -6.254 1.00 0.05 H HETATM 2912 H12 UNN A 233 -1.156 22.284 -5.963 1.00 0.05 H HETATM 2913 O1 UNN A 233 1.228 20.249 -5.758 1.00 -0.40 O HETATM 2914 C6 UNN A 233 -0.613 18.056 -5.771 1.00 0.06 C HETATM 2915 H5 UNN A 233 -0.970 17.429 -6.601 1.00 0.05 H HETATM 2916 H6 UNN A 233 0.479 17.961 -5.683 1.00 0.05 H HETATM 2917 H16 UNN A 233 -2.527 20.852 -6.180 1.00 0.06 H HETATM 2918 H17 UNN A 233 -2.724 19.976 -4.005 1.00 0.03 H HETATM 2919 H18 UNN A 233 -4.173 19.426 -4.915 1.00 0.03 H HETATM 2920 H2 UNN A 233 -3.249 17.202 -5.182 1.00 0.03 H HETATM 2921 H3 UNN A 233 -3.139 17.654 -3.447 1.00 0.03 H HETATM 2922 H19 UNN A 233 -0.784 18.087 -3.624 1.00 0.06 H HETATM 2923 H4 UNN A 233 -1.818 15.544 -4.677 1.00 0.19 H HETATM 2924 N5 UNN A 233 1.223 16.187 -3.533 1.00 -0.27 N HETATM 2925 C15 UNN A 233 2.303 15.454 -3.133 1.00 0.05 C HETATM 2926 N4 UNN A 233 2.449 14.103 -3.062 1.00 -0.28 N HETATM 2927 C14 UNN A 233 1.311 13.437 -3.484 1.00 0.14 C HETATM 2928 H21 UNN A 233 3.168 16.031 -2.828 1.00 0.10 H HETATM 2929 H20 UNN A 233 -1.790 13.130 -4.754 1.00 0.03 H HETATM 2930 H10 UNN A 233 -0.560 10.819 -4.254 1.00 0.09 H HETATM 2931 H1 UNN A 233 1.854 11.372 -3.300 1.00 0.23 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 748 749 755 756 757 CONECT 755 748 CONECT 756 748 CONECT 757 748 CONECT 2135 2136 2140 2141 2142 CONECT 2140 2135 CONECT 2141 2135 CONECT 2142 2135 CONECT 2890 2891 2927 2931 CONECT 2891 2890 2892 2930 CONECT 2892 2891 2893 2929 CONECT 2893 2892 2894 2927 CONECT 2894 2893 2895 2924 CONECT 2895 2894 2896 2923 CONECT 2896 2895 2897 2914 2922 CONECT 2897 2896 2898 2920 2921 CONECT 2898 2897 2899 2918 2919 CONECT 2899 2898 2900 2904 2917 CONECT 2900 2899 2901 2902 2903 CONECT 2901 2900 CONECT 2902 2900 CONECT 2903 2900 CONECT 2904 2899 2905 2914 CONECT 2905 2904 2906 2913 CONECT 2906 2905 2907 2911 2912 CONECT 2907 2906 2908 2909 2910 CONECT 2908 2907 CONECT 2909 2907 CONECT 2910 2907 CONECT 2911 2906 CONECT 2912 2906 CONECT 2913 2905 CONECT 2914 2896 2904 2915 2916 CONECT 2915 2914 CONECT 2916 2914 CONECT 2917 2899 CONECT 2918 2898 CONECT 2919 2898 CONECT 2920 2897 CONECT 2921 2897 CONECT 2922 2896 CONECT 2923 2895 CONECT 2924 2894 2925 CONECT 2925 2924 2926 2928 CONECT 2926 2925 2927 CONECT 2927 2890 2893 2926 CONECT 2928 2925 CONECT 2929 2892 CONECT 2930 2891 CONECT 2931 2890 MASTER 0 0 0 0 0 0 0 0 2928 3 54 22 END
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Structure:
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Related entries of code: 5toz
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3lxk
RCSB PDB
PDBbind
327aa, >3LXK_1|Chain... *
3lxl
RCSB PDB
PDBbind
327aa, >3LXL_1|Chain... at 100%
3pjc
RCSB PDB
PDBbind
315aa, >3PJC_1|Chain... at 99%
3zc6
RCSB PDB
PDBbind
288aa, >3ZC6_1|Chains... at 99%
3zep
RCSB PDB
PDBbind
288aa, >3ZEP_1|Chains... at 99%
4hvd
RCSB PDB
PDBbind
314aa, >4HVD_1|Chain... at 99%
4hvg
RCSB PDB
PDBbind
314aa, >4HVG_1|Chain... at 99%
4hvh
RCSB PDB
PDBbind
314aa, >4HVH_1|Chain... at 99%
4hvi
RCSB PDB
PDBbind
314aa, >4HVI_1|Chain... at 99%
4i6q
RCSB PDB
PDBbind
314aa, >4I6Q_1|Chain... at 99%
4qps
RCSB PDB
PDBbind
293aa, >4QPS_1|Chains... at 99%
4qt1
RCSB PDB
PDBbind
314aa, >4QT1_1|Chain... at 99%
4rio
RCSB PDB
PDBbind
293aa, >4RIO_1|Chain... at 98%
4z16
RCSB PDB
PDBbind
316aa, >4Z16_1|Chains... at 98%
5lwm
RCSB PDB
PDBbind
294aa, >5LWM_1|Chain... at 98%
5lwn
RCSB PDB
PDBbind
294aa, >5LWN_1|Chain... at 98%
5tts
RCSB PDB
PDBbind
321aa, >5TTS_1|Chain... at 100%
5ttu
RCSB PDB
PDBbind
321aa, >5TTU_1|Chain... at 100%
5ttv
RCSB PDB
PDBbind
321aa, >5TTV_1|Chain... at 100%
5vo6
RCSB PDB
PDBbind
293aa, >5VO6_1|Chain... at 98%
5w86
RCSB PDB
PDBbind
287aa, >5W86_1|Chains... at 99%
5wfj
RCSB PDB
PDBbind
293aa, >5WFJ_1|Chain... at 98%
6aak
RCSB PDB
PDBbind
287aa, >6AAK_1|Chains... at 99%
6da4
RCSB PDB
PDBbind
321aa, >6DA4_1|Chain... at 100%
6db3
RCSB PDB
PDBbind
321aa, >6DB3_1|Chain... at 100%
6db4
RCSB PDB
PDBbind
321aa, >6DB4_1|Chain... at 100%
6dud
RCSB PDB
PDBbind
321aa, >6DUD_1|Chain... at 100%
6gl9
RCSB PDB
PDBbind
294aa, >6GL9_1|Chains... at 98%
6gla
RCSB PDB
PDBbind
294aa, >6GLA_1|Chains... at 98%
6glb
RCSB PDB
PDBbind
294aa, >6GLB_1|Chains... at 98%
6ny4
RCSB PDB
PDBbind
293aa, >6NY4_1|Chain... at 98%
6hzv
RCSB PDB
PDBbind
285aa, >6HZV_1|Chains... 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
5toz
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK3
Ligand Name
7H4
EC.Number
E.C.2.7.10.2
Resolution
1.98(Å)
Affinity (Kd/Ki/IC50)
IC50=0.346nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) ACS Chem. Biol. Vol. 11: pp. 3442-3451
Ligand Properties
Formula
C
1
5
H
2
1
N
5
O
Molecular Weight
287.360
Exact Mass
287.175
No. of atoms
42
No. of bonds
44
Polar Surface Area
73.91
LOGP Value
1.94 (
Computed with XLOGP3
)
2.17 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 3
Canonical SMILES
CCC(=O)N1C[C@@H](CC[C@@H]1C)Nc1ncnc2c1cc[nH]2
InChI String
InChI=1S/C15H21N5O/c1-3-13(21)20-8-11(5-4-10(20)2)19-15-12-6-7-16-14(12)17-9-18-15/h6-7,9-11H,3-5,8H2,1-2H3,(H2,16,17,18,19)/t10-,11+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P52333
Entrez Gene ID
NCBI Entrez Gene ID:
3718
ASD
Information of known allosteric effects of PDB entries
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