Browse entries in the PDBbind-CN Database
HEADER 5TTU_COMPLEX COMPND 5TTU_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 16 THR ILE PHE GLU GLU ARG HIS LEU LYS TYR ILE SER GLN SEQRES 2 A 16 LEU GLY LYS SEQRES 1 A 58 GLY SER VAL GLU LEU CYS ARG TYR ASP PRO LEU GLY ASP SEQRES 2 A 58 ASN THR GLY ALA LEU VAL ALA VAL LYS GLN LEU GLN HIS SEQRES 3 A 58 SER GLY PRO ASP GLN GLN ARG ASP PHE GLN ARG GLU ILE SEQRES 4 A 58 GLN ILE LEU LYS ALA LEU HIS SER ASP PHE ILE VAL LYS SEQRES 5 A 58 TYR ARG GLY VAL SER TYR SEQRES 1 A 141 LEU ARG LEU VAL MET GLU TYR LEU PRO SER GLY CYS LEU SEQRES 2 A 141 ARG ASP PHE LEU GLN ARG HIS ARG ALA ARG LEU ASP ALA SEQRES 3 A 141 SER ARG LEU LEU LEU TYR SER SER GLN ILE CYS LYS GLY SEQRES 4 A 141 MET GLU TYR LEU GLY SER ARG ARG CYS VAL HIS ARG ASP SEQRES 5 A 141 LEU ALA ALA ARG ASN ILE LEU VAL GLU SER GLU ALA HIS SEQRES 6 A 141 VAL LYS ILE ALA ASP PHE GLY LEU ALA LYS LEU LEU PRO SEQRES 7 A 141 LEU ASP LYS ASP TYR TYR VAL VAL ARG GLU PRO GLY GLN SEQRES 8 A 141 SER PRO ILE PHE TRP TYR ALA PRO GLU SER LEU SER ASP SEQRES 9 A 141 ASN ILE PHE SER ARG GLN SER ASP VAL TRP SER PHE GLY SEQRES 10 A 141 VAL VAL LEU TYR GLU LEU PHE THR TYR CYS ASP LYS SER SEQRES 11 A 141 CYS SER PRO SER ALA GLU PHE LEU ARG MET MET SEQRES 1 A 56 VAL PRO ALA LEU SER ARG LEU LEU GLU LEU LEU GLU GLU SEQRES 2 A 56 GLY GLN ARG LEU PRO ALA PRO PRO ALA CYS PRO ALA GLU SEQRES 3 A 56 VAL HIS GLU LEU MET LYS LEU CYS TRP ALA PRO SER PRO SEQRES 4 A 56 GLN ASP ARG PRO SER PHE SER ALA LEU GLY PRO GLN LEU SEQRES 5 A 56 ASP MET LEU TRP HET UNN A 502 43 ATOM 1 N THR A 815 1.322 -2.382 4.237 1.00 58.62 N ATOM 2 CA THR A 815 0.169 -2.274 3.339 1.00 58.50 C ATOM 3 C THR A 815 -1.130 -1.886 4.074 1.00 59.42 C ATOM 4 O THR A 815 -2.089 -1.423 3.435 1.00 56.76 O ATOM 5 CB THR A 815 0.025 -3.519 2.443 1.00 75.05 C ATOM 6 OG1 THR A 815 0.172 -4.704 3.233 1.00 79.16 O ATOM 7 CG2 THR A 815 1.020 -3.526 1.281 1.00 75.44 C ATOM 8 HG1 THR A 815 0.079 -5.500 2.652 1.00 0.00 H ATOM 9 HN3 THR A 815 1.134 -3.111 4.955 1.00 0.00 H ATOM 10 HN2 THR A 815 1.483 -1.467 4.704 1.00 0.00 H ATOM 11 HN1 THR A 815 2.165 -2.645 3.687 1.00 0.00 H ATOM 12 N ILE A 816 -1.164 -2.102 5.415 1.00 54.35 N ATOM 13 CA ILE A 816 -2.289 -1.743 6.287 1.00 53.20 C ATOM 14 C ILE A 816 -1.781 -0.704 7.284 1.00 51.34 C ATOM 15 O ILE A 816 -0.847 -0.962 8.042 1.00 52.07 O ATOM 16 CB ILE A 816 -3.005 -2.960 6.946 1.00 57.66 C ATOM 17 CG1 ILE A 816 -3.470 -3.970 5.869 1.00 58.91 C ATOM 18 CG2 ILE A 816 -4.212 -2.499 7.795 1.00 59.22 C ATOM 19 CD1 ILE A 816 -3.515 -5.461 6.327 1.00 70.34 C ATOM 20 H ILE A 816 -0.336 -2.553 5.854 1.00 0.00 H ATOM 21 N PHE A 817 -2.343 0.507 7.202 1.00 41.52 N ATOM 22 CA PHE A 817 -1.938 1.646 8.020 1.00 37.53 C ATOM 23 C PHE A 817 -2.984 1.894 9.095 1.00 40.24 C ATOM 24 O PHE A 817 -4.159 2.076 8.770 1.00 38.32 O ATOM 25 CB PHE A 817 -1.780 2.897 7.114 1.00 36.73 C ATOM 26 CG PHE A 817 -0.545 2.869 6.235 1.00 35.62 C ATOM 27 CD1 PHE A 817 -0.535 2.157 5.039 1.00 36.82 C ATOM 28 CD2 PHE A 817 0.588 3.596 6.580 1.00 35.43 C ATOM 29 CE1 PHE A 817 0.607 2.132 4.226 1.00 36.95 C ATOM 30 CE2 PHE A 817 1.728 3.567 5.771 1.00 37.71 C ATOM 31 CZ PHE A 817 1.720 2.848 4.595 1.00 35.78 C ATOM 32 H PHE A 817 -3.113 0.645 6.516 1.00 0.00 H ATOM 33 N GLU A 818 -2.565 1.902 10.378 1.00 37.35 N ATOM 34 CA GLU A 818 -3.480 2.155 11.490 1.00 37.46 C ATOM 35 C GLU A 818 -3.776 3.651 11.582 1.00 38.32 C ATOM 36 O GLU A 818 -2.837 4.458 11.619 1.00 38.02 O ATOM 37 CB GLU A 818 -2.889 1.621 12.814 1.00 39.08 C ATOM 38 CG GLU A 818 -2.561 0.140 12.743 1.00 49.72 C ATOM 39 CD GLU A 818 -2.804 -0.645 14.013 1.00 77.94 C ATOM 40 OE1 GLU A 818 -1.831 -0.863 14.771 1.00 82.99 O ATOM 41 OE2 GLU A 818 -3.968 -1.044 14.250 1.00 69.30 O ATOM 42 H GLU A 818 -1.561 1.723 10.582 1.00 0.00 H ATOM 43 N GLU A 819 -5.075 4.018 11.589 1.00 35.08 N ATOM 44 CA GLU A 819 -5.575 5.403 11.664 1.00 35.80 C ATOM 45 C GLU A 819 -4.902 6.225 12.741 1.00 37.00 C ATOM 46 O GLU A 819 -4.489 7.350 12.484 1.00 36.83 O ATOM 47 CB GLU A 819 -7.093 5.408 11.977 1.00 38.76 C ATOM 48 CG GLU A 819 -8.015 5.440 10.772 1.00 56.30 C ATOM 49 CD GLU A 819 -8.088 6.788 10.085 1.00 86.03 C ATOM 50 OE1 GLU A 819 -7.163 7.090 9.299 1.00 88.59 O ATOM 51 OE2 GLU A 819 -9.044 7.553 10.355 1.00 77.87 O ATOM 52 H GLU A 819 -5.784 3.259 11.537 1.00 0.00 H ATOM 53 N ARG A 820 -4.823 5.666 13.977 1.00 33.87 N ATOM 54 CA ARG A 820 -4.242 6.323 15.152 1.00 33.75 C ATOM 55 C ARG A 820 -2.781 6.763 14.973 1.00 38.30 C ATOM 56 O ARG A 820 -2.330 7.666 15.682 1.00 39.15 O ATOM 57 CB ARG A 820 -4.407 5.455 16.421 1.00 33.47 C ATOM 58 CG ARG A 820 -3.639 4.129 16.397 1.00 42.36 C ATOM 59 CD ARG A 820 -4.101 3.171 17.489 1.00 47.86 C ATOM 60 NE ARG A 820 -3.237 1.992 17.567 1.00 53.44 N ATOM 61 CZ ARG A 820 -2.260 1.826 18.457 1.00 63.61 C ATOM 62 NH1 ARG A 820 -1.521 0.726 18.442 1.00 50.42 N ATOM 63 NH2 ARG A 820 -2.027 2.754 19.380 1.00 44.62 N ATOM 64 HE ARG A 820 -3.397 1.229 16.878 1.00 0.00 H ATOM 65 HH12 ARG A 820 -0.759 0.602 19.139 1.00 0.00 H ATOM 66 HH11 ARG A 820 -1.703 -0.013 17.733 1.00 0.00 H ATOM 67 HH22 ARG A 820 -1.263 2.619 20.072 1.00 0.00 H ATOM 68 HH21 ARG A 820 -2.609 3.615 19.410 1.00 0.00 H ATOM 69 H ARG A 820 -5.201 4.705 14.098 1.00 0.00 H ATOM 70 N HIS A 821 -2.039 6.095 14.058 1.00 35.37 N ATOM 71 CA HIS A 821 -0.628 6.398 13.806 1.00 35.62 C ATOM 72 C HIS A 821 -0.407 7.385 12.651 1.00 39.07 C ATOM 73 O HIS A 821 0.738 7.782 12.413 1.00 37.01 O ATOM 74 CB HIS A 821 0.186 5.124 13.581 1.00 36.57 C ATOM 75 CG HIS A 821 0.192 4.186 14.758 1.00 41.37 C ATOM 76 ND1 HIS A 821 0.269 4.655 16.055 1.00 43.54 N ATOM 77 CD2 HIS A 821 0.165 2.835 14.780 1.00 43.85 C ATOM 78 CE1 HIS A 821 0.273 3.578 16.823 1.00 43.40 C ATOM 79 NE2 HIS A 821 0.204 2.462 16.100 1.00 43.86 N ATOM 80 H HIS A 821 -2.490 5.334 13.511 1.00 0.00 H ATOM 81 N LEU A 822 -1.481 7.759 11.918 1.00 35.63 N ATOM 82 CA LEU A 822 -1.321 8.718 10.812 1.00 34.03 C ATOM 83 C LEU A 822 -1.526 10.113 11.372 1.00 38.53 C ATOM 84 O LEU A 822 -2.655 10.485 11.720 1.00 41.40 O ATOM 85 CB LEU A 822 -2.280 8.416 9.640 1.00 33.71 C ATOM 86 CG LEU A 822 -1.944 7.219 8.757 1.00 38.21 C ATOM 87 CD1 LEU A 822 -3.150 6.828 7.913 1.00 39.29 C ATOM 88 CD2 LEU A 822 -0.732 7.515 7.818 1.00 38.82 C ATOM 89 H LEU A 822 -2.420 7.369 12.136 1.00 0.00 H ATOM 90 N LYS A 823 -0.439 10.872 11.520 1.00 34.32 N ATOM 91 CA LYS A 823 -0.472 12.210 12.129 1.00 34.35 C ATOM 92 C LYS A 823 -0.626 13.317 11.094 1.00 38.56 C ATOM 93 O LYS A 823 0.226 13.453 10.211 1.00 39.07 O ATOM 94 CB LYS A 823 0.791 12.450 12.990 1.00 37.84 C ATOM 95 CG LYS A 823 1.316 11.218 13.730 1.00 51.70 C ATOM 96 CD LYS A 823 0.511 10.833 14.972 1.00 61.93 C ATOM 97 CE LYS A 823 0.905 9.451 15.439 1.00 69.40 C ATOM 98 NZ LYS A 823 0.741 9.278 16.906 1.00 78.62 N ATOM 99 HZ1 LYS A 823 1.339 9.968 17.404 1.00 0.00 H ATOM 100 HZ2 LYS A 823 -0.255 9.432 17.163 1.00 0.00 H ATOM 101 HZ3 LYS A 823 1.025 8.314 17.174 1.00 0.00 H ATOM 102 H LYS A 823 0.474 10.500 11.189 1.00 0.00 H ATOM 103 N TYR A 824 -1.704 14.095 11.191 1.00 34.69 N ATOM 104 CA TYR A 824 -1.991 15.178 10.239 1.00 34.69 C ATOM 105 C TYR A 824 -0.955 16.301 10.281 1.00 40.20 C ATOM 106 O TYR A 824 -0.678 16.843 11.361 1.00 39.63 O ATOM 107 CB TYR A 824 -3.409 15.745 10.453 1.00 36.69 C ATOM 108 CG TYR A 824 -3.677 16.992 9.644 1.00 39.90 C ATOM 109 CD1 TYR A 824 -3.905 16.921 8.271 1.00 42.04 C ATOM 110 CD2 TYR A 824 -3.617 18.253 10.231 1.00 40.47 C ATOM 111 CE1 TYR A 824 -4.112 18.069 7.515 1.00 43.44 C ATOM 112 CE2 TYR A 824 -3.798 19.409 9.478 1.00 41.82 C ATOM 113 CZ TYR A 824 -4.086 19.312 8.128 1.00 46.61 C ATOM 114 OH TYR A 824 -4.257 20.453 7.379 1.00 47.84 O ATOM 115 HH TYR A 824 -4.455 20.204 6.441 1.00 0.00 H ATOM 116 H TYR A 824 -2.370 13.929 11.973 1.00 0.00 H ATOM 117 N ILE A 825 -0.407 16.683 9.106 1.00 35.93 N ATOM 118 CA ILE A 825 0.553 17.786 9.041 1.00 35.49 C ATOM 119 C ILE A 825 -0.077 18.978 8.339 1.00 38.94 C ATOM 120 O ILE A 825 -0.242 20.044 8.942 1.00 37.22 O ATOM 121 CB ILE A 825 1.918 17.362 8.428 1.00 38.69 C ATOM 122 CG1 ILE A 825 2.573 16.287 9.299 1.00 39.29 C ATOM 123 CG2 ILE A 825 2.866 18.588 8.196 1.00 40.15 C ATOM 124 CD1 ILE A 825 3.722 15.675 8.694 1.00 43.89 C ATOM 125 H ILE A 825 -0.672 16.184 8.233 1.00 0.00 H ATOM 126 N SER A 826 -0.412 18.812 7.051 1.00 35.12 N ATOM 127 CA SER A 826 -0.962 19.910 6.262 1.00 35.25 C ATOM 128 C SER A 826 -1.781 19.388 5.097 1.00 38.64 C ATOM 129 O SER A 826 -1.812 18.177 4.838 1.00 36.05 O ATOM 130 CB SER A 826 0.173 20.782 5.714 1.00 39.34 C ATOM 131 OG SER A 826 1.108 19.981 5.009 1.00 47.19 O ATOM 132 HG SER A 826 1.836 20.555 4.660 1.00 0.00 H ATOM 133 H SER A 826 -0.277 17.882 6.605 1.00 0.00 H ATOM 134 N GLN A 827 -2.436 20.325 4.394 1.00 37.25 N ATOM 135 CA GLN A 827 -3.224 20.048 3.206 1.00 37.33 C ATOM 136 C GLN A 827 -2.275 20.072 2.005 1.00 40.16 C ATOM 137 O GLN A 827 -1.427 20.971 1.906 1.00 41.31 O ATOM 138 CB GLN A 827 -4.313 21.133 3.027 1.00 39.10 C ATOM 139 CG GLN A 827 -5.340 21.176 4.158 1.00 53.52 C ATOM 140 CD GLN A 827 -6.069 19.869 4.357 1.00 66.04 C ATOM 141 OE1 GLN A 827 -6.631 19.288 3.431 1.00 61.96 O ATOM 142 NE2 GLN A 827 -6.125 19.403 5.584 1.00 55.49 N ATOM 143 HE22 GLN A 827 -5.643 19.908 6.355 1.00 0.00 H ATOM 144 HE21 GLN A 827 -6.651 18.529 5.785 1.00 0.00 H ATOM 145 H GLN A 827 -2.375 21.311 4.720 1.00 0.00 H ATOM 146 N LEU A 828 -2.404 19.095 1.099 1.00 33.13 N ATOM 147 CA LEU A 828 -1.595 19.076 -0.137 1.00 32.69 C ATOM 148 C LEU A 828 -2.433 19.561 -1.324 1.00 39.21 C ATOM 149 O LEU A 828 -1.883 20.123 -2.272 1.00 39.63 O ATOM 150 CB LEU A 828 -0.940 17.701 -0.436 1.00 32.10 C ATOM 151 CG LEU A 828 0.122 17.226 0.564 1.00 35.07 C ATOM 152 CD1 LEU A 828 0.510 15.773 0.306 1.00 34.42 C ATOM 153 CD2 LEU A 828 1.368 18.158 0.576 1.00 38.27 C ATOM 154 H LEU A 828 -3.090 18.332 1.269 1.00 0.00 H ATOM 155 N GLY A 829 -3.751 19.409 -1.225 1.00 37.10 N ATOM 156 CA GLY A 829 -4.680 19.893 -2.250 1.00 37.98 C ATOM 157 C GLY A 829 -5.814 18.938 -2.541 1.00 40.82 C ATOM 158 O GLY A 829 -5.966 17.943 -1.832 1.00 42.08 O ATOM 159 H GLY A 829 -4.137 18.928 -0.388 1.00 0.00 H ATOM 160 N LYS A 830 -6.641 19.260 -3.559 1.00 34.84 N ATOM 161 CA LYS A 830 -7.774 18.433 -4.013 1.00 53.43 C ATOM 162 C LYS A 830 -7.322 17.654 -5.253 1.00 91.61 C ATOM 163 O LYS A 830 -6.659 18.224 -6.121 1.00 59.90 O ATOM 164 CB LYS A 830 -9.015 19.295 -4.345 1.00 55.34 C ATOM 165 CG LYS A 830 -10.256 18.486 -4.775 1.00 56.23 C ATOM 166 CD LYS A 830 -11.557 19.297 -4.680 1.00 65.35 C ATOM 167 CE LYS A 830 -12.792 18.423 -4.694 1.00 83.61 C ATOM 168 NZ LYS A 830 -13.397 18.309 -6.049 1.00 97.17 N ATOM 169 HZ1 LYS A 830 -13.670 19.254 -6.386 1.00 0.00 H ATOM 170 HZ2 LYS A 830 -12.703 17.893 -6.703 1.00 0.00 H ATOM 171 HZ3 LYS A 830 -14.239 17.700 -6.001 1.00 0.00 H ATOM 172 H LYS A 830 -6.466 20.155 -4.058 1.00 0.00 H TER 173 LYS A 830 ATOM 174 N GLY A 834 -12.557 14.840 -3.083 1.00 40.25 N ATOM 175 CA GLY A 834 -11.938 14.676 -1.769 1.00 39.41 C ATOM 176 C GLY A 834 -10.758 15.603 -1.561 1.00 41.00 C ATOM 177 O GLY A 834 -10.673 16.669 -2.185 1.00 41.19 O ATOM 178 HN3 GLY A 834 -11.856 14.636 -3.823 1.00 0.00 H ATOM 179 HN2 GLY A 834 -12.896 15.818 -3.185 1.00 0.00 H ATOM 180 HN1 GLY A 834 -13.358 14.183 -3.172 1.00 0.00 H ATOM 181 N SER A 835 -9.847 15.223 -0.645 1.00 33.80 N ATOM 182 CA SER A 835 -8.638 16.026 -0.394 1.00 32.87 C ATOM 183 C SER A 835 -7.452 15.098 -0.175 1.00 32.77 C ATOM 184 O SER A 835 -7.640 13.934 0.141 1.00 32.74 O ATOM 185 CB SER A 835 -8.823 16.910 0.837 1.00 36.66 C ATOM 186 OG SER A 835 -9.015 16.098 1.985 1.00 41.48 O ATOM 187 HG SER A 835 -8.223 15.517 2.113 1.00 0.00 H ATOM 188 H SER A 835 -10.000 14.347 -0.105 1.00 0.00 H ATOM 189 N VAL A 836 -6.241 15.617 -0.353 1.00 30.26 N ATOM 190 CA VAL A 836 -4.989 14.896 -0.139 1.00 29.07 C ATOM 191 C VAL A 836 -4.262 15.650 0.966 1.00 32.02 C ATOM 192 O VAL A 836 -4.084 16.868 0.859 1.00 30.52 O ATOM 193 CB VAL A 836 -4.122 14.765 -1.424 1.00 31.30 C ATOM 194 CG1 VAL A 836 -2.917 13.868 -1.168 1.00 30.26 C ATOM 195 CG2 VAL A 836 -4.954 14.228 -2.606 1.00 31.60 C ATOM 196 H VAL A 836 -6.181 16.607 -0.667 1.00 0.00 H ATOM 197 N GLU A 837 -3.903 14.937 2.038 1.00 28.27 N ATOM 198 CA GLU A 837 -3.234 15.537 3.178 1.00 29.15 C ATOM 199 C GLU A 837 -1.870 14.936 3.322 1.00 32.33 C ATOM 200 O GLU A 837 -1.667 13.752 3.019 1.00 30.74 O ATOM 201 CB GLU A 837 -4.053 15.295 4.456 1.00 30.85 C ATOM 202 CG GLU A 837 -5.404 16.001 4.442 1.00 37.79 C ATOM 203 CD GLU A 837 -6.251 15.845 5.693 1.00 54.70 C ATOM 204 OE1 GLU A 837 -6.105 14.824 6.404 1.00 39.77 O ATOM 205 OE2 GLU A 837 -7.110 16.724 5.929 1.00 52.45 O ATOM 206 H GLU A 837 -4.110 13.918 2.056 1.00 0.00 H ATOM 207 N LEU A 838 -0.918 15.761 3.790 1.00 29.67 N ATOM 208 CA LEU A 838 0.415 15.298 4.119 1.00 28.67 C ATOM 209 C LEU A 838 0.292 14.815 5.582 1.00 32.38 C ATOM 210 O LEU A 838 -0.204 15.553 6.438 1.00 30.53 O ATOM 211 CB LEU A 838 1.441 16.445 4.026 1.00 29.80 C ATOM 212 CG LEU A 838 2.864 16.145 4.544 1.00 33.71 C ATOM 213 CD1 LEU A 838 3.485 14.962 3.862 1.00 34.05 C ATOM 214 CD2 LEU A 838 3.752 17.391 4.496 1.00 36.81 C ATOM 215 H LEU A 838 -1.146 16.767 3.921 1.00 0.00 H ATOM 216 N CYS A 839 0.644 13.564 5.807 1.00 29.75 N ATOM 217 CA CYS A 839 0.611 12.925 7.123 1.00 31.38 C ATOM 218 C CYS A 839 1.944 12.305 7.400 1.00 35.32 C ATOM 219 O CYS A 839 2.644 11.863 6.486 1.00 34.16 O ATOM 220 CB CYS A 839 -0.495 11.872 7.216 1.00 31.59 C ATOM 221 SG CYS A 839 -2.172 12.538 7.097 1.00 36.30 S ATOM 222 H CYS A 839 0.965 12.996 4.998 1.00 0.00 H ATOM 223 N ARG A 840 2.250 12.155 8.689 1.00 32.94 N ATOM 224 CA ARG A 840 3.428 11.424 9.065 1.00 31.73 C ATOM 225 C ARG A 840 2.906 10.096 9.624 1.00 34.46 C ATOM 226 O ARG A 840 2.029 10.099 10.502 1.00 33.16 O ATOM 227 CB ARG A 840 4.210 12.200 10.146 1.00 34.50 C ATOM 228 CG ARG A 840 5.529 11.538 10.512 1.00 36.22 C ATOM 229 CD ARG A 840 6.243 12.276 11.650 1.00 44.89 C ATOM 230 NE ARG A 840 6.595 13.677 11.345 1.00 43.26 N ATOM 231 CZ ARG A 840 7.568 14.050 10.514 1.00 55.62 C ATOM 232 NH1 ARG A 840 8.290 13.138 9.868 1.00 42.91 N ATOM 233 NH2 ARG A 840 7.811 15.335 10.305 1.00 47.12 N ATOM 234 HE ARG A 840 6.045 14.426 11.812 1.00 0.00 H ATOM 235 HH12 ARG A 840 9.048 13.437 9.221 1.00 0.00 H ATOM 236 HH11 ARG A 840 8.097 12.126 10.010 1.00 0.00 H ATOM 237 HH22 ARG A 840 8.571 15.622 9.656 1.00 0.00 H ATOM 238 HH21 ARG A 840 7.242 16.058 10.790 1.00 0.00 H ATOM 239 H ARG A 840 1.637 12.567 9.421 1.00 0.00 H ATOM 240 N TYR A 841 3.404 8.973 9.114 1.00 31.86 N ATOM 241 CA TYR A 841 2.987 7.693 9.680 1.00 34.05 C ATOM 242 C TYR A 841 3.968 7.504 10.828 1.00 39.44 C ATOM 243 O TYR A 841 5.137 7.194 10.609 1.00 39.24 O ATOM 244 CB TYR A 841 3.001 6.543 8.670 1.00 36.14 C ATOM 245 CG TYR A 841 2.407 5.262 9.241 1.00 39.77 C ATOM 246 CD1 TYR A 841 1.142 5.256 9.827 1.00 42.18 C ATOM 247 CD2 TYR A 841 3.098 4.056 9.170 1.00 41.63 C ATOM 248 CE1 TYR A 841 0.572 4.077 10.312 1.00 44.49 C ATOM 249 CE2 TYR A 841 2.548 2.873 9.678 1.00 43.09 C ATOM 250 CZ TYR A 841 1.295 2.895 10.271 1.00 54.02 C ATOM 251 OH TYR A 841 0.732 1.740 10.771 1.00 60.47 O ATOM 252 HH TYR A 841 -0.157 1.947 11.154 1.00 0.00 H ATOM 253 H TYR A 841 4.080 9.006 8.324 1.00 0.00 H ATOM 254 N ASP A 842 3.515 7.841 12.042 1.00 36.06 N ATOM 255 CA ASP A 842 4.378 7.951 13.219 1.00 35.59 C ATOM 256 C ASP A 842 3.978 6.992 14.338 1.00 40.80 C ATOM 257 O ASP A 842 3.491 7.459 15.375 1.00 40.38 O ATOM 258 CB ASP A 842 4.327 9.409 13.700 1.00 37.23 C ATOM 259 CG ASP A 842 5.512 9.881 14.527 1.00 46.58 C ATOM 260 OD1 ASP A 842 5.322 10.805 15.351 1.00 45.37 O ATOM 261 OD2 ASP A 842 6.654 9.403 14.271 1.00 50.48 O ATOM 262 H ASP A 842 2.499 8.034 12.154 1.00 0.00 H ATOM 263 N PRO A 843 4.181 5.658 14.177 1.00 38.02 N ATOM 264 CA PRO A 843 3.781 4.735 15.252 1.00 38.61 C ATOM 265 C PRO A 843 4.551 4.944 16.562 1.00 44.97 C ATOM 266 O PRO A 843 4.043 4.590 17.632 1.00 44.19 O ATOM 267 CB PRO A 843 4.026 3.349 14.649 1.00 40.22 C ATOM 268 CG PRO A 843 5.033 3.563 13.575 1.00 44.81 C ATOM 269 CD PRO A 843 4.761 4.924 13.031 1.00 40.69 C ATOM 270 N LEU A 844 5.756 5.552 16.486 1.00 41.95 N ATOM 271 CA LEU A 844 6.570 5.832 17.676 1.00 41.86 C ATOM 272 C LEU A 844 6.147 7.116 18.371 1.00 45.81 C ATOM 273 O LEU A 844 6.600 7.361 19.494 1.00 44.73 O ATOM 274 CB LEU A 844 8.069 5.865 17.326 1.00 42.55 C ATOM 275 CG LEU A 844 8.921 4.604 17.577 1.00 48.78 C ATOM 276 CD1 LEU A 844 8.153 3.296 17.325 1.00 49.95 C ATOM 277 CD2 LEU A 844 10.176 4.633 16.718 1.00 52.75 C ATOM 278 H LEU A 844 6.119 5.831 15.552 1.00 0.00 H ATOM 279 N GLY A 845 5.321 7.933 17.690 1.00 40.70 N ATOM 280 CA GLY A 845 4.777 9.194 18.196 1.00 39.57 C ATOM 281 C GLY A 845 5.817 10.231 18.580 1.00 43.22 C ATOM 282 O GLY A 845 5.552 11.115 19.399 1.00 42.17 O ATOM 283 H GLY A 845 5.048 7.645 16.729 1.00 0.00 H ATOM 284 N ASP A 846 7.010 10.148 17.977 1.00 38.21 N ATOM 285 CA ASP A 846 8.106 11.049 18.328 1.00 37.88 C ATOM 286 C ASP A 846 8.514 11.999 17.207 1.00 41.19 C ATOM 287 O ASP A 846 9.562 12.650 17.319 1.00 39.99 O ATOM 288 CB ASP A 846 9.302 10.202 18.776 1.00 40.11 C ATOM 289 CG ASP A 846 9.772 9.190 17.743 1.00 49.44 C ATOM 290 OD1 ASP A 846 9.171 9.133 16.648 1.00 49.89 O ATOM 291 OD2 ASP A 846 10.757 8.476 18.020 1.00 51.63 O ATOM 292 H ASP A 846 7.160 9.427 17.243 1.00 0.00 H ATOM 293 N ASN A 847 7.656 12.112 16.142 1.00 36.70 N ATOM 294 CA ASN A 847 7.880 12.970 14.961 1.00 36.24 C ATOM 295 C ASN A 847 9.029 12.490 14.099 1.00 42.62 C ATOM 296 O ASN A 847 9.574 13.288 13.333 1.00 42.42 O ATOM 297 CB ASN A 847 8.085 14.463 15.334 1.00 36.17 C ATOM 298 CG ASN A 847 6.933 15.113 16.053 1.00 50.82 C ATOM 299 OD1 ASN A 847 5.780 14.703 15.919 1.00 45.43 O ATOM 300 ND2 ASN A 847 7.225 16.158 16.821 1.00 40.14 N ATOM 301 HD22 ASN A 847 8.211 16.478 16.911 1.00 0.00 H ATOM 302 HD21 ASN A 847 6.468 16.656 17.331 1.00 0.00 H ATOM 303 H ASN A 847 6.781 11.550 16.169 1.00 0.00 H ATOM 304 N THR A 848 9.356 11.181 14.156 1.00 40.48 N ATOM 305 CA THR A 848 10.454 10.629 13.354 1.00 40.51 C ATOM 306 C THR A 848 9.990 9.783 12.165 1.00 45.31 C ATOM 307 O THR A 848 10.799 9.526 11.279 1.00 45.93 O ATOM 308 CB THR A 848 11.460 9.844 14.223 1.00 47.25 C ATOM 309 OG1 THR A 848 10.833 8.655 14.694 1.00 45.63 O ATOM 310 CG2 THR A 848 12.022 10.665 15.395 1.00 44.52 C ATOM 311 HG1 THR A 848 10.038 8.894 15.234 1.00 0.00 H ATOM 312 H THR A 848 8.817 10.550 14.783 1.00 0.00 H ATOM 313 N GLY A 849 8.716 9.360 12.155 1.00 40.96 N ATOM 314 CA GLY A 849 8.149 8.534 11.086 1.00 40.83 C ATOM 315 C GLY A 849 8.147 9.167 9.704 1.00 45.71 C ATOM 316 O GLY A 849 8.351 10.384 9.571 1.00 44.41 O ATOM 317 H GLY A 849 8.100 9.633 12.947 1.00 0.00 H ATOM 318 N ALA A 850 7.931 8.322 8.669 1.00 40.87 N ATOM 319 CA ALA A 850 7.887 8.688 7.246 1.00 41.11 C ATOM 320 C ALA A 850 6.646 9.482 6.856 1.00 41.97 C ATOM 321 O ALA A 850 5.536 9.225 7.342 1.00 40.16 O ATOM 322 CB ALA A 850 7.977 7.441 6.381 1.00 41.31 C ATOM 323 H ALA A 850 7.782 7.320 8.902 1.00 0.00 H ATOM 324 N LEU A 851 6.836 10.399 5.910 1.00 37.94 N ATOM 325 CA LEU A 851 5.782 11.238 5.351 1.00 36.56 C ATOM 326 C LEU A 851 5.043 10.480 4.231 1.00 35.51 C ATOM 327 O LEU A 851 5.659 9.791 3.434 1.00 34.45 O ATOM 328 CB LEU A 851 6.374 12.559 4.820 1.00 36.69 C ATOM 329 CG LEU A 851 7.034 13.478 5.864 1.00 40.61 C ATOM 330 CD1 LEU A 851 7.613 14.703 5.204 1.00 41.50 C ATOM 331 CD2 LEU A 851 6.048 13.927 6.920 1.00 42.24 C ATOM 332 H LEU A 851 7.801 10.526 5.545 1.00 0.00 H ATOM 333 N VAL A 852 3.707 10.591 4.203 1.00 29.93 N ATOM 334 CA VAL A 852 2.891 9.915 3.178 1.00 27.07 C ATOM 335 C VAL A 852 1.809 10.873 2.733 1.00 28.09 C ATOM 336 O VAL A 852 1.457 11.800 3.463 1.00 28.42 O ATOM 337 CB VAL A 852 2.271 8.558 3.655 1.00 31.41 C ATOM 338 CG1 VAL A 852 3.310 7.432 3.704 1.00 31.50 C ATOM 339 CG2 VAL A 852 1.534 8.695 4.996 1.00 30.09 C ATOM 340 H VAL A 852 3.233 11.170 4.925 1.00 0.00 H ATOM 341 N ALA A 853 1.286 10.669 1.518 1.00 25.40 N ATOM 342 CA ALA A 853 0.194 11.484 0.993 1.00 25.82 C ATOM 343 C ALA A 853 -1.047 10.625 1.163 1.00 29.34 C ATOM 344 O ALA A 853 -1.078 9.453 0.756 1.00 29.11 O ATOM 345 CB ALA A 853 0.433 11.784 -0.474 1.00 26.13 C ATOM 346 H ALA A 853 1.670 9.904 0.928 1.00 0.00 H ATOM 347 N VAL A 854 -2.049 11.182 1.822 1.00 26.97 N ATOM 348 CA VAL A 854 -3.239 10.429 2.182 1.00 26.41 C ATOM 349 C VAL A 854 -4.481 11.092 1.618 1.00 27.49 C ATOM 350 O VAL A 854 -4.757 12.270 1.907 1.00 29.61 O ATOM 351 CB VAL A 854 -3.338 10.266 3.738 1.00 29.96 C ATOM 352 CG1 VAL A 854 -4.531 9.412 4.108 1.00 29.73 C ATOM 353 CG2 VAL A 854 -2.047 9.676 4.326 1.00 29.81 C ATOM 354 H VAL A 854 -1.984 12.185 2.090 1.00 0.00 H ATOM 355 N LYS A 855 -5.232 10.335 0.812 1.00 22.76 N ATOM 356 CA LYS A 855 -6.456 10.838 0.195 1.00 23.35 C ATOM 357 C LYS A 855 -7.684 10.294 0.964 1.00 28.99 C ATOM 358 O LYS A 855 -7.709 9.122 1.346 1.00 27.64 O ATOM 359 CB LYS A 855 -6.531 10.419 -1.292 1.00 26.98 C ATOM 360 CG LYS A 855 -7.705 11.102 -2.012 1.00 36.25 C ATOM 361 CD LYS A 855 -8.273 10.374 -3.178 1.00 42.04 C ATOM 362 CE LYS A 855 -9.728 10.769 -3.287 1.00 47.10 C ATOM 363 NZ LYS A 855 -10.300 10.450 -4.615 1.00 51.42 N ATOM 364 HZ1 LYS A 855 -9.771 10.961 -5.351 1.00 0.00 H ATOM 365 HZ2 LYS A 855 -10.230 9.426 -4.784 1.00 0.00 H ATOM 366 HZ3 LYS A 855 -11.299 10.740 -4.640 1.00 0.00 H ATOM 367 H LYS A 855 -4.935 9.357 0.618 1.00 0.00 H ATOM 368 N GLN A 856 -8.700 11.145 1.183 1.00 28.86 N ATOM 369 CA GLN A 856 -9.945 10.732 1.846 1.00 28.96 C ATOM 370 C GLN A 856 -11.111 11.549 1.288 1.00 35.84 C ATOM 371 O GLN A 856 -10.889 12.619 0.720 1.00 38.21 O ATOM 372 CB GLN A 856 -9.846 10.880 3.382 1.00 30.53 C ATOM 373 CG GLN A 856 -9.377 12.251 3.876 1.00 34.99 C ATOM 374 CD GLN A 856 -7.871 12.365 3.838 1.00 37.63 C ATOM 375 OE1 GLN A 856 -7.154 11.529 4.369 1.00 38.03 O ATOM 376 NE2 GLN A 856 -7.361 13.368 3.161 1.00 22.38 N ATOM 377 HE22 GLN A 856 -7.989 14.068 2.717 1.00 0.00 H ATOM 378 HE21 GLN A 856 -6.329 13.462 3.069 1.00 0.00 H ATOM 379 H GLN A 856 -8.602 12.133 0.872 1.00 0.00 H ATOM 380 N LEU A 857 -12.333 11.025 1.386 1.00 35.79 N ATOM 381 CA LEU A 857 -13.543 11.729 0.944 1.00 37.56 C ATOM 382 C LEU A 857 -14.002 12.568 2.149 1.00 46.12 C ATOM 383 O LEU A 857 -13.606 12.292 3.286 1.00 45.09 O ATOM 384 CB LEU A 857 -14.655 10.735 0.572 1.00 37.49 C ATOM 385 CG LEU A 857 -14.410 9.846 -0.643 1.00 42.58 C ATOM 386 CD1 LEU A 857 -15.614 8.993 -0.914 1.00 43.38 C ATOM 387 CD2 LEU A 857 -14.079 10.672 -1.876 1.00 43.68 C ATOM 388 H LEU A 857 -12.434 10.074 1.794 1.00 0.00 H ATOM 389 N GLN A 858 -14.828 13.588 1.899 1.00 46.30 N ATOM 390 CA GLN A 858 -15.394 14.460 2.939 1.00 46.78 C ATOM 391 C GLN A 858 -16.914 14.440 2.803 1.00 56.70 C ATOM 392 O GLN A 858 -17.620 15.079 3.579 1.00 57.17 O ATOM 393 CB GLN A 858 -14.853 15.891 2.792 1.00 46.97 C ATOM 394 CG GLN A 858 -13.367 15.966 2.503 1.00 48.78 C ATOM 395 CD GLN A 858 -12.949 17.296 1.949 1.00 65.08 C ATOM 396 OE1 GLN A 858 -13.076 17.562 0.748 1.00 56.29 O ATOM 397 NE2 GLN A 858 -12.393 18.141 2.807 1.00 50.28 N ATOM 398 HE22 GLN A 858 -12.304 17.880 3.810 1.00 0.00 H ATOM 399 HE21 GLN A 858 -12.046 19.064 2.477 1.00 0.00 H ATOM 400 H GLN A 858 -15.086 13.777 0.909 1.00 0.00 H ATOM 401 N HIS A 859 -17.411 13.696 1.802 1.00 57.83 N ATOM 402 CA HIS A 859 -18.825 13.582 1.509 1.00 60.07 C ATOM 403 C HIS A 859 -19.222 12.122 1.434 1.00 69.84 C ATOM 404 O HIS A 859 -18.508 11.304 0.837 1.00 70.88 O ATOM 405 CB HIS A 859 -19.159 14.313 0.203 1.00 60.84 C ATOM 406 H HIS A 859 -16.742 13.171 1.203 1.00 0.00 H ATOM 407 N SER A 860 -20.365 11.794 2.041 1.00 68.53 N ATOM 408 CA SER A 860 -20.877 10.433 2.072 1.00 69.71 C ATOM 409 C SER A 860 -21.434 10.027 0.699 1.00 74.95 C ATOM 410 O SER A 860 -20.927 10.461 -0.337 1.00 74.74 O ATOM 411 CB SER A 860 -21.910 10.272 3.189 1.00 75.10 C ATOM 412 OG SER A 860 -23.096 11.011 2.938 1.00 85.84 O ATOM 413 HG SER A 860 -23.732 10.876 3.685 1.00 0.00 H ATOM 414 H SER A 860 -20.912 12.543 2.511 1.00 0.00 H ATOM 415 N GLY A 861 -22.457 9.191 0.698 1.00 72.37 N ATOM 416 CA GLY A 861 -23.042 8.711 -0.540 1.00 72.21 C ATOM 417 C GLY A 861 -22.295 7.478 -0.986 1.00 76.00 C ATOM 418 O GLY A 861 -21.058 7.478 -1.028 1.00 76.11 O ATOM 419 H GLY A 861 -22.852 8.870 1.605 1.00 0.00 H ATOM 420 N PRO A 862 -23.029 6.394 -1.299 1.00 71.93 N ATOM 421 CA PRO A 862 -22.360 5.158 -1.720 1.00 71.26 C ATOM 422 C PRO A 862 -21.689 5.285 -3.075 1.00 72.68 C ATOM 423 O PRO A 862 -20.841 4.463 -3.372 1.00 72.64 O ATOM 424 CB PRO A 862 -23.491 4.121 -1.752 1.00 73.35 C ATOM 425 CG PRO A 862 -24.659 4.770 -1.069 1.00 78.20 C ATOM 426 CD PRO A 862 -24.494 6.231 -1.296 1.00 73.74 C ATOM 427 N ASP A 863 -22.067 6.298 -3.885 1.00 67.01 N ATOM 428 CA ASP A 863 -21.516 6.526 -5.221 1.00 65.38 C ATOM 429 C ASP A 863 -20.116 7.089 -5.180 1.00 63.77 C ATOM 430 O ASP A 863 -19.253 6.594 -5.895 1.00 62.88 O ATOM 431 CB ASP A 863 -22.438 7.429 -6.054 1.00 67.64 C ATOM 432 CG ASP A 863 -23.566 6.688 -6.741 1.00 82.87 C ATOM 433 OD1 ASP A 863 -24.326 7.337 -7.497 1.00 84.52 O ATOM 434 OD2 ASP A 863 -23.685 5.453 -6.535 1.00 88.44 O ATOM 435 H ASP A 863 -22.794 6.956 -3.538 1.00 0.00 H ATOM 436 N GLN A 864 -19.898 8.135 -4.365 1.00 56.92 N ATOM 437 CA GLN A 864 -18.591 8.763 -4.194 1.00 54.76 C ATOM 438 C GLN A 864 -17.694 7.760 -3.492 1.00 52.69 C ATOM 439 O GLN A 864 -16.534 7.644 -3.857 1.00 51.38 O ATOM 440 CB GLN A 864 -18.695 10.065 -3.386 1.00 55.80 C ATOM 441 CG GLN A 864 -19.437 11.168 -4.117 1.00 74.69 C ATOM 442 CD GLN A 864 -20.411 11.840 -3.193 1.00 96.86 C ATOM 443 OE1 GLN A 864 -20.119 12.879 -2.595 1.00 92.57 O ATOM 444 NE2 GLN A 864 -21.578 11.232 -3.018 1.00 90.37 N ATOM 445 HE22 GLN A 864 -21.792 10.357 -3.538 1.00 0.00 H ATOM 446 HE21 GLN A 864 -22.278 11.630 -2.361 1.00 0.00 H ATOM 447 H GLN A 864 -20.702 8.517 -3.828 1.00 0.00 H ATOM 448 N GLN A 865 -18.254 6.999 -2.525 1.00 45.62 N ATOM 449 CA GLN A 865 -17.553 5.944 -1.801 1.00 43.83 C ATOM 450 C GLN A 865 -17.185 4.809 -2.778 1.00 45.97 C ATOM 451 O GLN A 865 -16.051 4.340 -2.759 1.00 44.66 O ATOM 452 CB GLN A 865 -18.392 5.442 -0.605 1.00 44.62 C ATOM 453 CG GLN A 865 -17.657 4.523 0.382 1.00 59.39 C ATOM 454 CD GLN A 865 -16.283 5.003 0.811 1.00 75.98 C ATOM 455 OE1 GLN A 865 -15.271 4.340 0.560 1.00 69.87 O ATOM 456 NE2 GLN A 865 -16.207 6.163 1.459 1.00 69.10 N ATOM 457 HE22 GLN A 865 -17.072 6.704 1.660 1.00 0.00 H ATOM 458 HE21 GLN A 865 -15.283 6.528 1.765 1.00 0.00 H ATOM 459 H GLN A 865 -19.249 7.177 -2.281 1.00 0.00 H ATOM 460 N ARG A 866 -18.122 4.418 -3.670 1.00 43.60 N ATOM 461 CA ARG A 866 -17.892 3.391 -4.689 1.00 42.54 C ATOM 462 C ARG A 866 -16.828 3.861 -5.676 1.00 42.23 C ATOM 463 O ARG A 866 -15.985 3.055 -6.061 1.00 41.56 O ATOM 464 CB ARG A 866 -19.190 3.039 -5.449 1.00 43.77 C ATOM 465 CG ARG A 866 -19.090 1.734 -6.231 1.00 50.40 C ATOM 466 CD ARG A 866 -20.291 1.528 -7.138 1.00 65.06 C ATOM 467 H ARG A 866 -19.057 4.871 -3.631 1.00 0.00 H ATOM 468 N ASP A 867 -16.893 5.139 -6.096 1.00 37.28 N ATOM 469 CA ASP A 867 -15.944 5.764 -7.030 1.00 37.30 C ATOM 470 C ASP A 867 -14.561 5.752 -6.365 1.00 39.22 C ATOM 471 O ASP A 867 -13.558 5.453 -7.014 1.00 39.26 O ATOM 472 CB ASP A 867 -16.342 7.224 -7.339 1.00 39.60 C ATOM 473 CG ASP A 867 -17.377 7.411 -8.440 1.00 55.27 C ATOM 474 OD1 ASP A 867 -18.019 6.417 -8.829 1.00 55.95 O ATOM 475 OD2 ASP A 867 -17.557 8.564 -8.896 1.00 65.50 O ATOM 476 H ASP A 867 -17.671 5.727 -5.734 1.00 0.00 H ATOM 477 N PHE A 868 -14.534 6.029 -5.054 1.00 32.81 N ATOM 478 CA PHE A 868 -13.286 6.031 -4.309 1.00 31.64 C ATOM 479 C PHE A 868 -12.673 4.632 -4.253 1.00 34.46 C ATOM 480 O PHE A 868 -11.472 4.475 -4.488 1.00 31.57 O ATOM 481 CB PHE A 868 -13.504 6.607 -2.911 1.00 32.44 C ATOM 482 CG PHE A 868 -12.238 6.788 -2.115 1.00 32.99 C ATOM 483 CD1 PHE A 868 -11.043 7.132 -2.741 1.00 35.69 C ATOM 484 CD2 PHE A 868 -12.252 6.686 -0.737 1.00 34.94 C ATOM 485 CE1 PHE A 868 -9.867 7.296 -1.996 1.00 36.49 C ATOM 486 CE2 PHE A 868 -11.084 6.874 0.007 1.00 36.81 C ATOM 487 CZ PHE A 868 -9.911 7.218 -0.626 1.00 33.26 C ATOM 488 H PHE A 868 -15.423 6.247 -4.560 1.00 0.00 H ATOM 489 N GLN A 869 -13.499 3.616 -3.968 1.00 33.10 N ATOM 490 CA GLN A 869 -13.053 2.226 -3.918 1.00 34.19 C ATOM 491 C GLN A 869 -12.520 1.771 -5.285 1.00 36.10 C ATOM 492 O GLN A 869 -11.510 1.064 -5.333 1.00 33.24 O ATOM 493 CB GLN A 869 -14.175 1.310 -3.409 1.00 36.67 C ATOM 494 CG GLN A 869 -13.719 -0.110 -3.077 1.00 49.91 C ATOM 495 CD GLN A 869 -12.563 -0.145 -2.095 1.00 70.07 C ATOM 496 OE1 GLN A 869 -12.696 0.258 -0.932 1.00 66.45 O ATOM 497 NE2 GLN A 869 -11.391 -0.601 -2.557 1.00 49.70 N ATOM 498 HE22 GLN A 869 -11.313 -0.932 -3.540 1.00 0.00 H ATOM 499 HE21 GLN A 869 -10.559 -0.624 -1.933 1.00 0.00 H ATOM 500 H GLN A 869 -14.499 3.826 -3.774 1.00 0.00 H ATOM 501 N ARG A 870 -13.161 2.230 -6.382 1.00 33.30 N ATOM 502 CA ARG A 870 -12.732 1.938 -7.757 1.00 33.84 C ATOM 503 C ARG A 870 -11.315 2.510 -7.987 1.00 36.31 C ATOM 504 O ARG A 870 -10.455 1.811 -8.525 1.00 34.88 O ATOM 505 CB ARG A 870 -13.721 2.562 -8.771 1.00 38.04 C ATOM 506 CG ARG A 870 -13.306 2.498 -10.241 1.00 53.73 C ATOM 507 CD ARG A 870 -14.262 3.269 -11.156 1.00 72.04 C ATOM 508 NE ARG A 870 -15.584 2.638 -11.248 1.00 87.17 N ATOM 509 CZ ARG A 870 -16.697 3.126 -10.708 1.00103.19 C ATOM 510 NH1 ARG A 870 -16.672 4.270 -10.037 1.00 93.40 N ATOM 511 NH2 ARG A 870 -17.844 2.476 -10.840 1.00 90.27 N ATOM 512 HE ARG A 870 -15.656 1.744 -11.774 1.00 0.00 H ATOM 513 HH12 ARG A 870 -17.546 4.646 -9.617 1.00 0.00 H ATOM 514 HH11 ARG A 870 -15.778 4.791 -9.931 1.00 0.00 H ATOM 515 HH22 ARG A 870 -18.712 2.861 -10.416 1.00 0.00 H ATOM 516 HH21 ARG A 870 -17.876 1.580 -11.368 1.00 0.00 H ATOM 517 H ARG A 870 -14.005 2.823 -6.246 1.00 0.00 H ATOM 518 N GLU A 871 -11.071 3.743 -7.533 1.00 31.12 N ATOM 519 CA GLU A 871 -9.778 4.403 -7.701 1.00 30.22 C ATOM 520 C GLU A 871 -8.669 3.621 -6.991 1.00 30.27 C ATOM 521 O GLU A 871 -7.579 3.451 -7.547 1.00 28.36 O ATOM 522 CB GLU A 871 -9.852 5.847 -7.204 1.00 31.30 C ATOM 523 CG GLU A 871 -8.492 6.518 -7.221 1.00 33.98 C ATOM 524 CD GLU A 871 -8.428 7.896 -6.615 1.00 40.95 C ATOM 525 OE1 GLU A 871 -9.455 8.356 -6.072 1.00 37.09 O ATOM 526 OE2 GLU A 871 -7.356 8.533 -6.717 1.00 41.81 O ATOM 527 H GLU A 871 -11.832 4.253 -7.040 1.00 0.00 H ATOM 528 N ILE A 872 -8.936 3.193 -5.737 1.00 27.38 N ATOM 529 CA ILE A 872 -7.978 2.422 -4.930 1.00 26.67 C ATOM 530 C ILE A 872 -7.627 1.108 -5.663 1.00 30.16 C ATOM 531 O ILE A 872 -6.447 0.757 -5.741 1.00 28.54 O ATOM 532 CB ILE A 872 -8.549 2.158 -3.506 1.00 29.68 C ATOM 533 CG1 ILE A 872 -8.713 3.491 -2.722 1.00 28.99 C ATOM 534 CG2 ILE A 872 -7.668 1.166 -2.719 1.00 32.81 C ATOM 535 CD1 ILE A 872 -9.503 3.369 -1.332 1.00 30.87 C ATOM 536 H ILE A 872 -9.863 3.420 -5.323 1.00 0.00 H ATOM 537 N GLN A 873 -8.643 0.394 -6.192 1.00 29.24 N ATOM 538 CA GLN A 873 -8.411 -0.874 -6.906 1.00 30.65 C ATOM 539 C GLN A 873 -7.556 -0.661 -8.167 1.00 32.74 C ATOM 540 O GLN A 873 -6.622 -1.434 -8.400 1.00 32.80 O ATOM 541 CB GLN A 873 -9.728 -1.604 -7.242 1.00 32.72 C ATOM 542 CG GLN A 873 -10.556 -2.077 -6.027 1.00 42.60 C ATOM 543 CD GLN A 873 -9.792 -2.854 -4.980 1.00 68.14 C ATOM 544 OE1 GLN A 873 -9.651 -2.416 -3.827 1.00 61.63 O ATOM 545 NE2 GLN A 873 -9.291 -4.031 -5.347 1.00 68.54 N ATOM 546 HE22 GLN A 873 -9.425 -4.372 -6.320 1.00 0.00 H ATOM 547 HE21 GLN A 873 -8.766 -4.609 -4.661 1.00 0.00 H ATOM 548 H GLN A 873 -9.616 0.748 -6.093 1.00 0.00 H ATOM 549 N ILE A 874 -7.788 0.448 -8.898 1.00 27.07 N ATOM 550 CA ILE A 874 -6.992 0.775 -10.086 1.00 25.77 C ATOM 551 C ILE A 874 -5.544 1.048 -9.696 1.00 29.71 C ATOM 552 O ILE A 874 -4.624 0.468 -10.282 1.00 29.37 O ATOM 553 CB ILE A 874 -7.599 1.965 -10.894 1.00 27.55 C ATOM 554 CG1 ILE A 874 -8.956 1.539 -11.551 1.00 29.14 C ATOM 555 CG2 ILE A 874 -6.590 2.479 -11.956 1.00 28.15 C ATOM 556 CD1 ILE A 874 -9.827 2.674 -12.128 1.00 31.67 C ATOM 557 H ILE A 874 -8.554 1.090 -8.611 1.00 0.00 H ATOM 558 N LEU A 875 -5.334 2.002 -8.767 1.00 26.16 N ATOM 559 CA LEU A 875 -3.974 2.376 -8.379 1.00 25.34 C ATOM 560 C LEU A 875 -3.113 1.246 -7.816 1.00 28.38 C ATOM 561 O LEU A 875 -1.927 1.145 -8.154 1.00 27.85 O ATOM 562 CB LEU A 875 -3.985 3.595 -7.428 1.00 25.04 C ATOM 563 CG LEU A 875 -2.622 4.309 -7.290 1.00 29.55 C ATOM 564 CD1 LEU A 875 -2.191 4.967 -8.635 1.00 30.81 C ATOM 565 CD2 LEU A 875 -2.667 5.352 -6.193 1.00 30.55 C ATOM 566 H LEU A 875 -6.146 2.476 -8.322 1.00 0.00 H ATOM 567 N LYS A 876 -3.712 0.402 -6.980 1.00 27.70 N ATOM 568 CA LYS A 876 -3.052 -0.733 -6.331 1.00 28.59 C ATOM 569 C LYS A 876 -2.493 -1.712 -7.369 1.00 30.49 C ATOM 570 O LYS A 876 -1.458 -2.331 -7.127 1.00 31.77 O ATOM 571 CB LYS A 876 -4.070 -1.458 -5.431 1.00 31.40 C ATOM 572 CG LYS A 876 -3.545 -2.693 -4.698 1.00 44.19 C ATOM 573 CD LYS A 876 -4.580 -3.164 -3.678 1.00 49.59 C ATOM 574 CE LYS A 876 -4.143 -4.418 -2.971 1.00 61.78 C ATOM 575 NZ LYS A 876 -5.191 -4.897 -2.036 1.00 70.52 N ATOM 576 HZ1 LYS A 876 -5.381 -4.163 -1.325 1.00 0.00 H ATOM 577 HZ2 LYS A 876 -6.061 -5.100 -2.568 1.00 0.00 H ATOM 578 HZ3 LYS A 876 -4.862 -5.763 -1.563 1.00 0.00 H ATOM 579 H LYS A 876 -4.719 0.559 -6.773 1.00 0.00 H ATOM 580 N ALA A 877 -3.184 -1.843 -8.492 1.00 27.15 N ATOM 581 CA ALA A 877 -2.789 -2.758 -9.556 1.00 28.51 C ATOM 582 C ALA A 877 -1.837 -2.133 -10.606 1.00 29.91 C ATOM 583 O ALA A 877 -1.493 -2.789 -11.586 1.00 29.40 O ATOM 584 CB ALA A 877 -4.028 -3.333 -10.203 1.00 29.24 C ATOM 585 H ALA A 877 -4.043 -1.270 -8.619 1.00 0.00 H ATOM 586 N LEU A 878 -1.425 -0.852 -10.419 1.00 26.45 N ATOM 587 CA LEU A 878 -0.487 -0.225 -11.358 1.00 25.93 C ATOM 588 C LEU A 878 0.929 -0.242 -10.750 1.00 29.86 C ATOM 589 O LEU A 878 1.109 0.147 -9.602 1.00 29.27 O ATOM 590 CB LEU A 878 -0.937 1.224 -11.704 1.00 25.98 C ATOM 591 CG LEU A 878 -2.286 1.381 -12.415 1.00 29.55 C ATOM 592 CD1 LEU A 878 -2.727 2.868 -12.420 1.00 28.91 C ATOM 593 CD2 LEU A 878 -2.227 0.818 -13.868 1.00 30.64 C ATOM 594 H LEU A 878 -1.777 -0.311 -9.604 1.00 0.00 H ATOM 595 N HIS A 879 1.925 -0.719 -11.516 1.00 28.48 N ATOM 596 CA HIS A 879 3.304 -0.831 -11.064 1.00 29.32 C ATOM 597 C HIS A 879 4.193 -0.265 -12.138 1.00 33.34 C ATOM 598 O HIS A 879 4.509 -0.953 -13.095 1.00 31.50 O ATOM 599 CB HIS A 879 3.632 -2.310 -10.841 1.00 30.94 C ATOM 600 CG HIS A 879 2.672 -2.962 -9.900 1.00 34.59 C ATOM 601 ND1 HIS A 879 2.705 -2.701 -8.537 1.00 36.64 N ATOM 602 CD2 HIS A 879 1.626 -3.778 -10.167 1.00 36.98 C ATOM 603 CE1 HIS A 879 1.723 -3.419 -8.017 1.00 35.92 C ATOM 604 NE2 HIS A 879 1.039 -4.070 -8.961 1.00 36.35 N ATOM 605 H HIS A 879 1.698 -1.025 -12.484 1.00 0.00 H ATOM 606 N SER A 880 4.534 1.021 -12.017 1.00 30.01 N ATOM 607 CA SER A 880 5.317 1.699 -13.034 1.00 30.31 C ATOM 608 C SER A 880 6.151 2.781 -12.373 1.00 31.29 C ATOM 609 O SER A 880 5.675 3.479 -11.466 1.00 28.78 O ATOM 610 CB SER A 880 4.388 2.329 -14.076 1.00 32.31 C ATOM 611 OG SER A 880 5.076 3.211 -14.953 1.00 30.36 O ATOM 612 HG SER A 880 5.782 2.711 -15.435 1.00 0.00 H ATOM 613 H SER A 880 4.231 1.549 -11.174 1.00 0.00 H ATOM 614 N ASP A 881 7.341 3.017 -12.923 1.00 29.21 N ATOM 615 CA ASP A 881 8.180 4.110 -12.427 1.00 29.74 C ATOM 616 C ASP A 881 7.540 5.481 -12.753 1.00 30.93 C ATOM 617 O ASP A 881 7.918 6.485 -12.165 1.00 29.85 O ATOM 618 CB ASP A 881 9.579 4.035 -13.086 1.00 32.20 C ATOM 619 CG ASP A 881 10.400 2.789 -12.767 1.00 52.07 C ATOM 620 OD1 ASP A 881 11.391 2.533 -13.488 1.00 52.04 O ATOM 621 OD2 ASP A 881 10.050 2.068 -11.796 1.00 59.77 O ATOM 622 H ASP A 881 7.676 2.423 -13.708 1.00 0.00 H ATOM 623 N PHE A 882 6.572 5.509 -13.687 1.00 27.27 N ATOM 624 CA PHE A 882 5.944 6.745 -14.136 1.00 26.89 C ATOM 625 C PHE A 882 4.514 6.929 -13.617 1.00 27.50 C ATOM 626 O PHE A 882 3.786 7.799 -14.104 1.00 26.86 O ATOM 627 CB PHE A 882 6.031 6.861 -15.665 1.00 29.98 C ATOM 628 CG PHE A 882 7.458 6.648 -16.122 1.00 31.74 C ATOM 629 CD1 PHE A 882 7.800 5.532 -16.881 1.00 34.60 C ATOM 630 CD2 PHE A 882 8.480 7.490 -15.681 1.00 33.88 C ATOM 631 CE1 PHE A 882 9.129 5.301 -17.256 1.00 36.35 C ATOM 632 CE2 PHE A 882 9.814 7.224 -16.015 1.00 36.75 C ATOM 633 CZ PHE A 882 10.124 6.145 -16.815 1.00 34.57 C ATOM 634 H PHE A 882 6.259 4.610 -14.106 1.00 0.00 H ATOM 635 N ILE A 883 4.134 6.124 -12.619 1.00 26.25 N ATOM 636 CA ILE A 883 2.792 6.255 -11.999 1.00 25.27 C ATOM 637 C ILE A 883 3.025 6.335 -10.503 1.00 26.12 C ATOM 638 O ILE A 883 3.770 5.512 -9.943 1.00 26.74 O ATOM 639 CB ILE A 883 1.831 5.076 -12.365 1.00 28.22 C ATOM 640 CG1 ILE A 883 1.638 4.880 -13.916 1.00 29.26 C ATOM 641 CG2 ILE A 883 0.475 5.166 -11.591 1.00 29.73 C ATOM 642 CD1 ILE A 883 0.844 5.853 -14.668 1.00 34.93 C ATOM 643 H ILE A 883 4.789 5.395 -12.272 1.00 0.00 H ATOM 644 N VAL A 884 2.349 7.278 -9.838 1.00 23.22 N ATOM 645 CA VAL A 884 2.495 7.478 -8.368 1.00 23.61 C ATOM 646 C VAL A 884 2.266 6.140 -7.635 1.00 27.76 C ATOM 647 O VAL A 884 1.341 5.388 -7.988 1.00 25.58 O ATOM 648 CB VAL A 884 1.568 8.604 -7.827 1.00 27.71 C ATOM 649 CG1 VAL A 884 0.089 8.222 -7.925 1.00 27.88 C ATOM 650 CG2 VAL A 884 1.951 8.993 -6.393 1.00 27.10 C ATOM 651 H VAL A 884 1.698 7.894 -10.365 1.00 0.00 H ATOM 652 N LYS A 885 3.131 5.829 -6.630 1.00 27.06 N ATOM 653 CA LYS A 885 3.026 4.572 -5.911 1.00 27.02 C ATOM 654 C LYS A 885 1.934 4.513 -4.890 1.00 28.82 C ATOM 655 O LYS A 885 1.879 5.329 -3.964 1.00 27.47 O ATOM 656 CB LYS A 885 4.339 4.226 -5.201 1.00 30.85 C ATOM 657 CG LYS A 885 5.266 3.413 -6.071 1.00 43.81 C ATOM 658 CD LYS A 885 6.530 3.091 -5.320 1.00 54.56 C ATOM 659 CE LYS A 885 7.654 2.713 -6.249 1.00 66.66 C ATOM 660 NZ LYS A 885 8.976 2.990 -5.629 1.00 77.87 N ATOM 661 HZ1 LYS A 885 9.050 4.004 -5.412 1.00 0.00 H ATOM 662 HZ2 LYS A 885 9.069 2.439 -4.752 1.00 0.00 H ATOM 663 HZ3 LYS A 885 9.731 2.720 -6.291 1.00 0.00 H ATOM 664 H LYS A 885 3.880 6.504 -6.373 1.00 0.00 H ATOM 665 N TYR A 886 1.158 3.450 -4.977 1.00 27.07 N ATOM 666 CA TYR A 886 0.175 3.051 -3.981 1.00 26.27 C ATOM 667 C TYR A 886 0.981 2.472 -2.770 1.00 29.33 C ATOM 668 O TYR A 886 1.869 1.633 -2.987 1.00 28.29 O ATOM 669 CB TYR A 886 -0.682 1.926 -4.588 1.00 27.75 C ATOM 670 CG TYR A 886 -1.549 1.193 -3.586 1.00 28.44 C ATOM 671 CD1 TYR A 886 -2.792 1.693 -3.216 1.00 30.05 C ATOM 672 CD2 TYR A 886 -1.131 -0.014 -3.017 1.00 29.72 C ATOM 673 CE1 TYR A 886 -3.602 1.018 -2.303 1.00 32.45 C ATOM 674 CE2 TYR A 886 -1.937 -0.701 -2.110 1.00 31.00 C ATOM 675 CZ TYR A 886 -3.176 -0.182 -1.763 1.00 34.84 C ATOM 676 OH TYR A 886 -3.997 -0.832 -0.881 1.00 37.21 O ATOM 677 HH TYR A 886 -3.536 -0.925 -0.010 1.00 0.00 H ATOM 678 H TYR A 886 1.256 2.851 -5.822 1.00 0.00 H ATOM 679 N ARG A 887 0.660 2.881 -1.525 1.00 25.46 N ATOM 680 CA ARG A 887 1.327 2.293 -0.334 1.00 26.20 C ATOM 681 C ARG A 887 0.395 1.377 0.427 1.00 31.84 C ATOM 682 O ARG A 887 0.832 0.368 0.978 1.00 30.68 O ATOM 683 CB ARG A 887 1.929 3.340 0.597 1.00 25.93 C ATOM 684 CG ARG A 887 3.059 4.174 -0.037 1.00 34.17 C ATOM 685 CD ARG A 887 4.274 3.337 -0.405 1.00 43.68 C ATOM 686 NE ARG A 887 5.444 4.183 -0.633 1.00 55.18 N ATOM 687 CZ ARG A 887 6.587 3.761 -1.160 1.00 70.93 C ATOM 688 NH1 ARG A 887 6.728 2.494 -1.533 1.00 56.31 N ATOM 689 NH2 ARG A 887 7.595 4.604 -1.329 1.00 66.56 N ATOM 690 HE ARG A 887 5.376 5.185 -0.364 1.00 0.00 H ATOM 691 HH12 ARG A 887 7.626 2.170 -1.945 1.00 0.00 H ATOM 692 HH11 ARG A 887 5.940 1.826 -1.413 1.00 0.00 H ATOM 693 HH22 ARG A 887 8.489 4.270 -1.742 1.00 0.00 H ATOM 694 HH21 ARG A 887 7.492 5.600 -1.048 1.00 0.00 H ATOM 695 H ARG A 887 -0.063 3.617 -1.397 1.00 0.00 H ATOM 696 N GLY A 888 -0.872 1.758 0.504 1.00 26.48 N ATOM 697 CA GLY A 888 -1.872 0.964 1.202 1.00 26.97 C ATOM 698 C GLY A 888 -3.117 1.752 1.506 1.00 30.72 C ATOM 699 O GLY A 888 -3.348 2.807 0.920 1.00 28.94 O ATOM 700 H GLY A 888 -1.160 2.650 0.053 1.00 0.00 H ATOM 701 N VAL A 889 -3.895 1.252 2.461 1.00 27.01 N ATOM 702 CA VAL A 889 -5.143 1.868 2.889 1.00 28.64 C ATOM 703 C VAL A 889 -5.168 1.912 4.399 1.00 34.19 C ATOM 704 O VAL A 889 -4.464 1.122 5.050 1.00 32.36 O ATOM 705 CB VAL A 889 -6.426 1.186 2.314 1.00 32.31 C ATOM 706 CG1 VAL A 889 -6.520 1.340 0.799 1.00 31.38 C ATOM 707 CG2 VAL A 889 -6.536 -0.286 2.734 1.00 33.52 C ATOM 708 H VAL A 889 -3.596 0.372 2.928 1.00 0.00 H ATOM 709 N SER A 890 -5.999 2.818 4.943 1.00 33.14 N ATOM 710 CA SER A 890 -6.281 2.926 6.372 1.00 35.21 C ATOM 711 C SER A 890 -7.800 2.856 6.488 1.00 40.60 C ATOM 712 O SER A 890 -8.472 3.618 5.793 1.00 41.97 O ATOM 713 CB SER A 890 -5.770 4.255 6.918 1.00 40.59 C ATOM 714 OG SER A 890 -5.865 4.257 8.330 1.00 50.44 O ATOM 715 HG SER A 890 -5.318 3.518 8.697 1.00 0.00 H ATOM 716 H SER A 890 -6.473 3.487 4.303 1.00 0.00 H ATOM 717 N TYR A 891 -8.358 1.916 7.298 1.00 38.22 N ATOM 718 CA TYR A 891 -9.827 1.793 7.423 1.00 47.26 C ATOM 719 C TYR A 891 -10.421 2.672 8.520 1.00 89.33 C ATOM 720 O TYR A 891 -9.957 2.637 9.657 1.00 65.89 O ATOM 721 CB TYR A 891 -10.262 0.326 7.601 1.00 48.57 C ATOM 722 CG TYR A 891 -9.963 -0.533 6.394 1.00 50.50 C ATOM 723 CD1 TYR A 891 -8.834 -1.344 6.355 1.00 52.41 C ATOM 724 CD2 TYR A 891 -10.794 -0.514 5.277 1.00 51.43 C ATOM 725 CE1 TYR A 891 -8.547 -2.128 5.238 1.00 54.10 C ATOM 726 CE2 TYR A 891 -10.510 -1.282 4.151 1.00 52.27 C ATOM 727 CZ TYR A 891 -9.390 -2.097 4.140 1.00 59.46 C ATOM 728 OH TYR A 891 -9.120 -2.879 3.044 1.00 61.26 O ATOM 729 HH TYR A 891 -8.289 -3.394 3.204 1.00 0.00 H ATOM 730 H TYR A 891 -7.743 1.274 7.837 1.00 0.00 H TER 731 TYR A 891 ATOM 732 N LEU A 898 -11.976 4.009 3.758 1.00 45.16 N ATOM 733 CA LEU A 898 -11.622 5.251 4.447 1.00 44.87 C ATOM 734 C LEU A 898 -10.472 6.106 3.846 1.00 40.71 C ATOM 735 O LEU A 898 -10.767 7.190 3.359 1.00 39.80 O ATOM 736 CB LEU A 898 -11.542 5.115 5.987 1.00 46.75 C ATOM 737 CG LEU A 898 -11.882 6.372 6.805 1.00 54.19 C ATOM 738 CD1 LEU A 898 -13.436 6.650 6.839 1.00 54.81 C ATOM 739 CD2 LEU A 898 -11.377 6.237 8.242 1.00 59.46 C ATOM 740 HN3 LEU A 898 -11.149 3.379 3.735 1.00 0.00 H ATOM 741 HN2 LEU A 898 -12.275 4.226 2.786 1.00 0.00 H ATOM 742 HN1 LEU A 898 -12.755 3.542 4.265 1.00 0.00 H ATOM 743 N ARG A 899 -9.185 5.669 3.904 1.00 32.41 N ATOM 744 CA ARG A 899 -8.084 6.487 3.379 1.00 30.07 C ATOM 745 C ARG A 899 -7.157 5.735 2.420 1.00 31.20 C ATOM 746 O ARG A 899 -6.803 4.580 2.677 1.00 30.21 O ATOM 747 CB ARG A 899 -7.251 7.100 4.543 1.00 31.69 C ATOM 748 CG ARG A 899 -8.050 8.096 5.430 1.00 48.26 C ATOM 749 CD ARG A 899 -7.212 8.799 6.488 1.00 57.49 C ATOM 750 NE ARG A 899 -7.994 9.131 7.686 1.00 69.91 N ATOM 751 CZ ARG A 899 -8.432 10.348 8.004 1.00 84.49 C ATOM 752 NH1 ARG A 899 -8.184 11.381 7.206 1.00 79.05 N ATOM 753 NH2 ARG A 899 -9.125 10.540 9.120 1.00 60.25 N ATOM 754 HE ARG A 899 -8.224 8.354 8.338 1.00 0.00 H ATOM 755 HH12 ARG A 899 -8.529 12.329 7.460 1.00 0.00 H ATOM 756 HH11 ARG A 899 -7.645 11.242 6.327 1.00 0.00 H ATOM 757 HH22 ARG A 899 -9.465 11.492 9.364 1.00 0.00 H ATOM 758 HH21 ARG A 899 -9.328 9.738 9.750 1.00 0.00 H ATOM 759 H ARG A 899 -8.978 4.742 4.327 1.00 0.00 H ATOM 760 N LEU A 900 -6.765 6.389 1.327 1.00 27.09 N ATOM 761 CA LEU A 900 -5.827 5.815 0.368 1.00 25.31 C ATOM 762 C LEU A 900 -4.444 6.429 0.700 1.00 27.38 C ATOM 763 O LEU A 900 -4.290 7.653 0.647 1.00 26.69 O ATOM 764 CB LEU A 900 -6.267 6.179 -1.072 1.00 24.46 C ATOM 765 CG LEU A 900 -5.189 6.082 -2.179 1.00 26.99 C ATOM 766 CD1 LEU A 900 -4.678 4.627 -2.338 1.00 26.93 C ATOM 767 CD2 LEU A 900 -5.773 6.591 -3.527 1.00 26.67 C ATOM 768 H LEU A 900 -7.141 7.343 1.151 1.00 0.00 H ATOM 769 N VAL A 901 -3.435 5.579 0.973 1.00 23.63 N ATOM 770 CA VAL A 901 -2.090 6.035 1.314 1.00 24.47 C ATOM 771 C VAL A 901 -1.167 5.852 0.121 1.00 25.18 C ATOM 772 O VAL A 901 -1.103 4.765 -0.430 1.00 25.82 O ATOM 773 CB VAL A 901 -1.523 5.316 2.582 1.00 27.42 C ATOM 774 CG1 VAL A 901 -0.186 5.942 3.013 1.00 27.39 C ATOM 775 CG2 VAL A 901 -2.523 5.354 3.746 1.00 27.55 C ATOM 776 H VAL A 901 -3.621 4.556 0.940 1.00 0.00 H ATOM 777 N MET A 902 -0.478 6.944 -0.302 1.00 22.52 N ATOM 778 CA MET A 902 0.425 6.906 -1.472 1.00 22.12 C ATOM 779 C MET A 902 1.768 7.489 -1.057 1.00 25.45 C ATOM 780 O MET A 902 1.839 8.176 -0.041 1.00 26.11 O ATOM 781 CB MET A 902 -0.154 7.831 -2.596 1.00 24.59 C ATOM 782 CG MET A 902 -1.503 7.327 -3.118 1.00 26.34 C ATOM 783 SD MET A 902 -2.316 8.581 -4.172 1.00 28.93 S ATOM 784 CE MET A 902 -2.939 9.795 -2.965 1.00 25.31 C ATOM 785 H MET A 902 -0.590 7.839 0.216 1.00 0.00 H ATOM 786 N GLU A 903 2.800 7.312 -1.898 1.00 24.61 N ATOM 787 CA GLU A 903 4.091 7.957 -1.624 1.00 25.70 C ATOM 788 C GLU A 903 3.922 9.475 -1.700 1.00 30.40 C ATOM 789 O GLU A 903 3.048 9.969 -2.424 1.00 29.26 O ATOM 790 CB GLU A 903 5.136 7.490 -2.630 1.00 27.04 C ATOM 791 CG GLU A 903 4.754 7.818 -4.065 1.00 30.63 C ATOM 792 CD GLU A 903 5.848 7.518 -5.061 1.00 41.73 C ATOM 793 OE1 GLU A 903 7.033 7.443 -4.655 1.00 40.16 O ATOM 794 OE2 GLU A 903 5.509 7.335 -6.248 1.00 31.43 O ATOM 795 H GLU A 903 2.685 6.718 -2.744 1.00 0.00 H ATOM 796 N TYR A 904 4.697 10.208 -0.891 1.00 26.49 N ATOM 797 CA TYR A 904 4.649 11.658 -0.885 1.00 26.79 C ATOM 798 C TYR A 904 5.781 12.159 -1.767 1.00 29.70 C ATOM 799 O TYR A 904 6.928 11.740 -1.597 1.00 28.48 O ATOM 800 CB TYR A 904 4.796 12.194 0.550 1.00 27.89 C ATOM 801 CG TYR A 904 5.042 13.688 0.679 1.00 29.29 C ATOM 802 CD1 TYR A 904 4.171 14.617 0.101 1.00 30.55 C ATOM 803 CD2 TYR A 904 6.091 14.176 1.454 1.00 30.95 C ATOM 804 CE1 TYR A 904 4.390 15.988 0.229 1.00 30.93 C ATOM 805 CE2 TYR A 904 6.298 15.544 1.616 1.00 30.51 C ATOM 806 CZ TYR A 904 5.432 16.443 1.024 1.00 35.68 C ATOM 807 OH TYR A 904 5.636 17.784 1.206 1.00 40.46 O ATOM 808 HH TYR A 904 6.528 18.032 0.855 1.00 0.00 H ATOM 809 H TYR A 904 5.354 9.723 -0.247 1.00 0.00 H ATOM 810 N LEU A 905 5.458 13.068 -2.698 1.00 26.88 N ATOM 811 CA LEU A 905 6.444 13.694 -3.589 1.00 26.09 C ATOM 812 C LEU A 905 6.458 15.191 -3.235 1.00 29.65 C ATOM 813 O LEU A 905 5.567 15.960 -3.651 1.00 27.59 O ATOM 814 CB LEU A 905 6.095 13.442 -5.080 1.00 26.64 C ATOM 815 CG LEU A 905 6.055 11.961 -5.520 1.00 32.36 C ATOM 816 CD1 LEU A 905 5.923 11.832 -7.017 1.00 33.44 C ATOM 817 CD2 LEU A 905 7.278 11.232 -5.113 1.00 39.75 C ATOM 818 H LEU A 905 4.460 13.344 -2.794 1.00 0.00 H ATOM 819 N PRO A 906 7.416 15.598 -2.362 1.00 28.47 N ATOM 820 CA PRO A 906 7.439 16.997 -1.884 1.00 28.36 C ATOM 821 C PRO A 906 7.584 18.065 -2.961 1.00 29.42 C ATOM 822 O PRO A 906 7.059 19.144 -2.747 1.00 30.44 O ATOM 823 CB PRO A 906 8.584 17.041 -0.852 1.00 30.44 C ATOM 824 CG PRO A 906 9.430 15.868 -1.185 1.00 34.56 C ATOM 825 CD PRO A 906 8.488 14.796 -1.739 1.00 29.73 C ATOM 826 N SER A 907 8.190 17.746 -4.117 1.00 27.92 N ATOM 827 CA SER A 907 8.266 18.719 -5.226 1.00 28.45 C ATOM 828 C SER A 907 6.869 19.064 -5.786 1.00 31.49 C ATOM 829 O SER A 907 6.733 20.072 -6.461 1.00 31.30 O ATOM 830 CB SER A 907 9.189 18.236 -6.333 1.00 32.28 C ATOM 831 OG SER A 907 10.524 18.228 -5.857 1.00 35.63 O ATOM 832 HG SER A 907 10.782 19.144 -5.585 1.00 0.00 H ATOM 833 H SER A 907 8.611 16.802 -4.233 1.00 0.00 H ATOM 834 N GLY A 908 5.856 18.244 -5.479 1.00 26.98 N ATOM 835 CA GLY A 908 4.480 18.540 -5.873 1.00 25.66 C ATOM 836 C GLY A 908 4.206 18.456 -7.367 1.00 26.58 C ATOM 837 O GLY A 908 4.941 17.796 -8.085 1.00 26.78 O ATOM 838 H GLY A 908 6.054 17.373 -4.946 1.00 0.00 H ATOM 839 N CYS A 909 3.125 19.108 -7.825 1.00 24.94 N ATOM 840 CA CYS A 909 2.674 19.028 -9.205 1.00 25.08 C ATOM 841 C CYS A 909 3.625 19.666 -10.205 1.00 27.49 C ATOM 842 O CYS A 909 4.289 20.675 -9.924 1.00 27.34 O ATOM 843 CB CYS A 909 1.253 19.554 -9.363 1.00 26.99 C ATOM 844 SG CYS A 909 1.132 21.360 -9.188 1.00 31.12 S ATOM 845 H CYS A 909 2.585 19.698 -7.161 1.00 0.00 H ATOM 846 N LEU A 910 3.630 19.099 -11.403 1.00 24.18 N ATOM 847 CA LEU A 910 4.476 19.569 -12.494 1.00 24.29 C ATOM 848 C LEU A 910 4.123 21.000 -12.891 1.00 26.56 C ATOM 849 O LEU A 910 5.009 21.760 -13.226 1.00 27.39 O ATOM 850 CB LEU A 910 4.291 18.623 -13.700 1.00 24.42 C ATOM 851 CG LEU A 910 5.078 18.981 -14.945 1.00 29.30 C ATOM 852 CD1 LEU A 910 6.558 18.976 -14.668 1.00 28.09 C ATOM 853 CD2 LEU A 910 4.718 17.988 -16.097 1.00 34.21 C ATOM 854 H LEU A 910 3.005 18.285 -11.572 1.00 0.00 H ATOM 855 N ARG A 911 2.835 21.374 -12.836 1.00 25.37 N ATOM 856 CA ARG A 911 2.439 22.719 -13.216 1.00 26.22 C ATOM 857 C ARG A 911 3.186 23.804 -12.421 1.00 30.05 C ATOM 858 O ARG A 911 3.740 24.721 -13.028 1.00 29.12 O ATOM 859 CB ARG A 911 0.930 22.879 -13.107 1.00 27.63 C ATOM 860 CG ARG A 911 0.485 24.285 -13.469 1.00 31.04 C ATOM 861 CD ARG A 911 -0.897 24.587 -12.998 1.00 34.66 C ATOM 862 NE ARG A 911 -0.974 24.647 -11.538 1.00 38.20 N ATOM 863 CZ ARG A 911 -2.114 24.607 -10.864 1.00 52.20 C ATOM 864 NH1 ARG A 911 -3.271 24.517 -11.510 1.00 38.18 N ATOM 865 NH2 ARG A 911 -2.108 24.658 -9.536 1.00 44.03 N ATOM 866 HE ARG A 911 -0.087 24.725 -11.001 1.00 0.00 H ATOM 867 HH12 ARG A 911 -4.163 24.486 -10.977 1.00 0.00 H ATOM 868 HH11 ARG A 911 -3.285 24.478 -12.549 1.00 0.00 H ATOM 869 HH22 ARG A 911 -3.005 24.626 -9.010 1.00 0.00 H ATOM 870 HH21 ARG A 911 -1.206 24.730 -9.022 1.00 0.00 H ATOM 871 H ARG A 911 2.114 20.695 -12.519 1.00 0.00 H ATOM 872 N ASP A 912 3.185 23.701 -11.080 1.00 28.65 N ATOM 873 CA ASP A 912 3.829 24.691 -10.208 1.00 27.64 C ATOM 874 C ASP A 912 5.321 24.582 -10.304 1.00 30.13 C ATOM 875 O ASP A 912 6.008 25.607 -10.258 1.00 30.21 O ATOM 876 CB ASP A 912 3.364 24.501 -8.764 1.00 29.12 C ATOM 877 CG ASP A 912 1.893 24.788 -8.562 1.00 40.61 C ATOM 878 OD1 ASP A 912 1.260 25.331 -9.489 1.00 41.87 O ATOM 879 OD2 ASP A 912 1.380 24.488 -7.475 1.00 44.60 O ATOM 880 H ASP A 912 2.708 22.887 -10.643 1.00 0.00 H ATOM 881 N PHE A 913 5.835 23.352 -10.444 1.00 26.70 N ATOM 882 CA PHE A 913 7.282 23.103 -10.559 1.00 26.52 C ATOM 883 C PHE A 913 7.876 23.822 -11.778 1.00 30.12 C ATOM 884 O PHE A 913 8.968 24.403 -11.693 1.00 29.28 O ATOM 885 CB PHE A 913 7.536 21.610 -10.684 1.00 28.13 C ATOM 886 CG PHE A 913 8.979 21.198 -10.751 1.00 29.71 C ATOM 887 CD1 PHE A 913 9.702 20.951 -9.593 1.00 33.37 C ATOM 888 CD2 PHE A 913 9.611 21.010 -11.977 1.00 31.02 C ATOM 889 CE1 PHE A 913 11.041 20.540 -9.661 1.00 33.38 C ATOM 890 CE2 PHE A 913 10.932 20.585 -12.039 1.00 33.45 C ATOM 891 CZ PHE A 913 11.642 20.377 -10.882 1.00 32.92 C ATOM 892 H PHE A 913 5.185 22.540 -10.473 1.00 0.00 H ATOM 893 N LEU A 914 7.167 23.738 -12.913 1.00 26.87 N ATOM 894 CA LEU A 914 7.595 24.372 -14.161 1.00 26.69 C ATOM 895 C LEU A 914 7.607 25.888 -14.008 1.00 32.02 C ATOM 896 O LEU A 914 8.537 26.521 -14.496 1.00 31.02 O ATOM 897 CB LEU A 914 6.655 24.019 -15.298 1.00 26.22 C ATOM 898 CG LEU A 914 6.776 22.587 -15.800 1.00 29.71 C ATOM 899 CD1 LEU A 914 5.677 22.293 -16.773 1.00 29.08 C ATOM 900 CD2 LEU A 914 8.147 22.330 -16.414 1.00 31.69 C ATOM 901 H LEU A 914 6.277 23.200 -12.906 1.00 0.00 H ATOM 902 N GLN A 915 6.605 26.449 -13.319 1.00 29.72 N ATOM 903 CA GLN A 915 6.530 27.906 -13.106 1.00 30.67 C ATOM 904 C GLN A 915 7.711 28.383 -12.251 1.00 36.12 C ATOM 905 O GLN A 915 8.322 29.395 -12.569 1.00 36.61 O ATOM 906 CB GLN A 915 5.205 28.296 -12.427 1.00 31.87 C ATOM 907 CG GLN A 915 3.992 28.211 -13.361 1.00 37.53 C ATOM 908 CD GLN A 915 2.630 28.135 -12.684 1.00 45.45 C ATOM 909 OE1 GLN A 915 1.598 28.182 -13.344 1.00 46.29 O ATOM 910 NE2 GLN A 915 2.563 27.971 -11.374 1.00 36.29 N ATOM 911 HE22 GLN A 915 3.436 27.930 -10.810 1.00 0.00 H ATOM 912 HE21 GLN A 915 1.638 27.882 -10.908 1.00 0.00 H ATOM 913 H GLN A 915 5.860 25.841 -12.924 1.00 0.00 H ATOM 914 N ARG A 916 8.012 27.637 -11.185 1.00 33.89 N ATOM 915 CA ARG A 916 9.050 27.863 -10.173 1.00 35.74 C ATOM 916 C ARG A 916 10.457 27.647 -10.765 1.00 40.95 C ATOM 917 O ARG A 916 11.431 28.258 -10.290 1.00 41.27 O ATOM 918 CB ARG A 916 8.785 26.835 -9.043 1.00 40.21 C ATOM 919 CG ARG A 916 9.324 27.070 -7.664 1.00 51.17 C ATOM 920 CD ARG A 916 8.583 26.196 -6.632 1.00 40.41 C ATOM 921 NE ARG A 916 8.895 24.753 -6.690 1.00 40.60 N ATOM 922 CZ ARG A 916 7.989 23.790 -6.870 1.00 47.22 C ATOM 923 NH1 ARG A 916 6.706 24.095 -7.034 1.00 37.07 N ATOM 924 NH2 ARG A 916 8.355 22.516 -6.864 1.00 40.52 N ATOM 925 HE ARG A 916 9.889 24.468 -6.583 1.00 0.00 H ATOM 926 HH12 ARG A 916 6.006 23.339 -7.174 1.00 0.00 H ATOM 927 HH11 ARG A 916 6.402 25.090 -7.023 1.00 0.00 H ATOM 928 HH22 ARG A 916 7.644 21.770 -7.005 1.00 0.00 H ATOM 929 HH21 ARG A 916 9.353 22.262 -6.718 1.00 0.00 H ATOM 930 H ARG A 916 7.434 26.782 -11.055 1.00 0.00 H ATOM 931 N HIS A 917 10.585 26.769 -11.776 1.00 35.76 N ATOM 932 CA HIS A 917 11.908 26.465 -12.312 1.00 36.27 C ATOM 933 C HIS A 917 12.113 26.887 -13.764 1.00 36.33 C ATOM 934 O HIS A 917 13.089 26.435 -14.363 1.00 36.51 O ATOM 935 CB HIS A 917 12.201 24.956 -12.172 1.00 38.59 C ATOM 936 CG HIS A 917 12.267 24.473 -10.760 1.00 43.40 C ATOM 937 ND1 HIS A 917 11.141 24.430 -9.964 1.00 45.51 N ATOM 938 CD2 HIS A 917 13.317 23.983 -10.062 1.00 46.75 C ATOM 939 CE1 HIS A 917 11.545 23.976 -8.788 1.00 45.80 C ATOM 940 NE2 HIS A 917 12.845 23.680 -8.800 1.00 46.48 N ATOM 941 H HIS A 917 9.743 26.308 -12.175 1.00 0.00 H ATOM 942 N ARG A 918 11.223 27.733 -14.331 1.00 33.75 N ATOM 943 CA ARG A 918 11.306 28.089 -15.756 1.00 35.90 C ATOM 944 C ARG A 918 12.678 28.497 -16.263 1.00 44.49 C ATOM 945 O ARG A 918 13.189 27.862 -17.192 1.00 47.01 O ATOM 946 CB ARG A 918 10.150 28.986 -16.265 1.00 37.95 C ATOM 947 CG ARG A 918 10.017 30.379 -15.651 1.00 49.78 C ATOM 948 CD ARG A 918 9.097 31.268 -16.499 1.00 52.93 C ATOM 949 NE ARG A 918 9.543 31.323 -17.894 1.00 53.44 N ATOM 950 CZ ARG A 918 8.791 31.044 -18.957 1.00 58.59 C ATOM 951 NH1 ARG A 918 7.502 30.757 -18.812 1.00 50.79 N ATOM 952 NH2 ARG A 918 9.310 31.096 -20.175 1.00 37.16 N ATOM 953 HE ARG A 918 10.529 31.603 -18.068 1.00 0.00 H ATOM 954 HH12 ARG A 918 6.920 30.540 -19.646 1.00 0.00 H ATOM 955 HH11 ARG A 918 7.074 30.749 -17.864 1.00 0.00 H ATOM 956 HH22 ARG A 918 8.719 30.877 -21.002 1.00 0.00 H ATOM 957 HH21 ARG A 918 10.309 31.356 -20.304 1.00 0.00 H ATOM 958 H ARG A 918 10.464 28.140 -13.748 1.00 0.00 H ATOM 959 N ALA A 919 13.344 29.414 -15.545 1.00 40.20 N ATOM 960 CA ALA A 919 14.683 29.885 -15.918 1.00 40.76 C ATOM 961 C ALA A 919 15.791 28.818 -15.824 1.00 44.29 C ATOM 962 O ALA A 919 16.917 29.071 -16.272 1.00 44.05 O ATOM 963 CB ALA A 919 15.042 31.122 -15.108 1.00 41.36 C ATOM 964 H ALA A 919 12.895 29.806 -14.693 1.00 0.00 H ATOM 965 N ARG A 920 15.472 27.615 -15.287 1.00 40.32 N ATOM 966 CA ARG A 920 16.446 26.531 -15.102 1.00 40.54 C ATOM 967 C ARG A 920 16.267 25.287 -15.990 1.00 45.49 C ATOM 968 O ARG A 920 17.232 24.549 -16.183 1.00 48.80 O ATOM 969 CB ARG A 920 16.506 26.105 -13.603 1.00 42.83 C ATOM 970 H ARG A 920 14.489 27.451 -14.991 1.00 0.00 H ATOM 971 N LEU A 921 15.055 25.011 -16.487 1.00 38.08 N ATOM 972 CA LEU A 921 14.819 23.798 -17.283 1.00 36.60 C ATOM 973 C LEU A 921 14.880 24.104 -18.776 1.00 40.71 C ATOM 974 O LEU A 921 14.244 25.049 -19.203 1.00 41.92 O ATOM 975 CB LEU A 921 13.450 23.170 -16.933 1.00 36.31 C ATOM 976 CG LEU A 921 13.142 22.893 -15.451 1.00 40.33 C ATOM 977 CD1 LEU A 921 11.653 22.602 -15.252 1.00 40.45 C ATOM 978 CD2 LEU A 921 13.972 21.749 -14.903 1.00 39.81 C ATOM 979 H LEU A 921 14.267 25.666 -16.307 1.00 0.00 H ATOM 980 N ASP A 922 15.640 23.321 -19.560 1.00 36.02 N ATOM 981 CA ASP A 922 15.772 23.533 -21.009 1.00 34.89 C ATOM 982 C ASP A 922 14.859 22.592 -21.795 1.00 38.14 C ATOM 983 O ASP A 922 14.177 21.754 -21.188 1.00 35.97 O ATOM 984 CB ASP A 922 17.265 23.414 -21.455 1.00 36.88 C ATOM 985 CG ASP A 922 17.960 22.091 -21.166 1.00 47.66 C ATOM 986 OD1 ASP A 922 19.207 22.058 -21.196 1.00 50.52 O ATOM 987 OD2 ASP A 922 17.261 21.092 -20.900 1.00 45.40 O ATOM 988 H ASP A 922 16.157 22.531 -19.123 1.00 0.00 H ATOM 989 N ALA A 923 14.841 22.717 -23.134 1.00 34.81 N ATOM 990 CA ALA A 923 14.017 21.887 -24.023 1.00 34.25 C ATOM 991 C ALA A 923 14.261 20.395 -23.826 1.00 37.11 C ATOM 992 O ALA A 923 13.300 19.606 -23.841 1.00 33.26 O ATOM 993 CB ALA A 923 14.255 22.272 -25.478 1.00 35.14 C ATOM 994 H ALA A 923 15.446 23.444 -23.566 1.00 0.00 H ATOM 995 N SER A 924 15.539 20.000 -23.592 1.00 34.96 N ATOM 996 CA SER A 924 15.872 18.588 -23.367 1.00 35.57 C ATOM 997 C SER A 924 15.134 18.046 -22.137 1.00 35.35 C ATOM 998 O SER A 924 14.623 16.925 -22.171 1.00 34.55 O ATOM 999 CB SER A 924 17.378 18.405 -23.194 1.00 43.45 C ATOM 1000 OG SER A 924 18.061 18.809 -24.370 1.00 58.77 O ATOM 1001 HG SER A 924 19.035 18.685 -24.244 1.00 0.00 H ATOM 1002 H SER A 924 16.297 20.712 -23.572 1.00 0.00 H ATOM 1003 N ARG A 925 15.117 18.820 -21.056 1.00 32.23 N ATOM 1004 CA ARG A 925 14.445 18.442 -19.824 1.00 31.72 C ATOM 1005 C ARG A 925 12.917 18.295 -20.056 1.00 32.20 C ATOM 1006 O ARG A 925 12.329 17.308 -19.594 1.00 29.65 O ATOM 1007 CB ARG A 925 14.762 19.439 -18.706 1.00 34.38 C ATOM 1008 CG ARG A 925 14.347 19.021 -17.302 1.00 41.17 C ATOM 1009 CD ARG A 925 14.571 17.555 -16.932 1.00 46.76 C ATOM 1010 NE ARG A 925 15.914 17.052 -17.219 1.00 53.46 N ATOM 1011 CZ ARG A 925 16.952 17.142 -16.395 1.00 64.14 C ATOM 1012 NH1 ARG A 925 16.832 17.763 -15.232 1.00 48.62 N ATOM 1013 NH2 ARG A 925 18.122 16.622 -16.737 1.00 53.34 N ATOM 1014 HE ARG A 925 16.068 16.589 -18.137 1.00 0.00 H ATOM 1015 HH12 ARG A 925 17.649 17.830 -14.592 1.00 0.00 H ATOM 1016 HH11 ARG A 925 15.921 18.184 -14.959 1.00 0.00 H ATOM 1017 HH22 ARG A 925 18.932 16.694 -16.089 1.00 0.00 H ATOM 1018 HH21 ARG A 925 18.230 16.142 -17.653 1.00 0.00 H ATOM 1019 H ARG A 925 15.606 19.737 -21.094 1.00 0.00 H ATOM 1020 N LEU A 926 12.301 19.249 -20.783 1.00 28.18 N ATOM 1021 CA LEU A 926 10.862 19.174 -21.118 1.00 26.69 C ATOM 1022 C LEU A 926 10.556 17.910 -21.938 1.00 30.42 C ATOM 1023 O LEU A 926 9.518 17.256 -21.736 1.00 26.98 O ATOM 1024 CB LEU A 926 10.394 20.443 -21.861 1.00 26.69 C ATOM 1025 CG LEU A 926 10.594 21.757 -21.095 1.00 29.67 C ATOM 1026 CD1 LEU A 926 10.109 22.932 -21.930 1.00 29.76 C ATOM 1027 CD2 LEU A 926 9.885 21.719 -19.692 1.00 30.71 C ATOM 1028 H LEU A 926 12.855 20.063 -21.119 1.00 0.00 H ATOM 1029 N LEU A 927 11.491 17.540 -22.845 1.00 28.10 N ATOM 1030 CA LEU A 927 11.355 16.351 -23.696 1.00 27.87 C ATOM 1031 C LEU A 927 11.497 15.094 -22.864 1.00 29.37 C ATOM 1032 O LEU A 927 10.802 14.117 -23.128 1.00 28.65 O ATOM 1033 CB LEU A 927 12.371 16.386 -24.857 1.00 27.43 C ATOM 1034 CG LEU A 927 12.005 17.411 -25.937 1.00 32.19 C ATOM 1035 CD1 LEU A 927 13.203 17.685 -26.857 1.00 34.33 C ATOM 1036 CD2 LEU A 927 10.747 16.964 -26.714 1.00 30.93 C ATOM 1037 H LEU A 927 12.345 18.125 -22.943 1.00 0.00 H ATOM 1038 N LEU A 928 12.369 15.130 -21.839 1.00 27.36 N ATOM 1039 CA LEU A 928 12.507 14.005 -20.912 1.00 27.86 C ATOM 1040 C LEU A 928 11.172 13.809 -20.154 1.00 29.18 C ATOM 1041 O LEU A 928 10.676 12.690 -20.129 1.00 28.59 O ATOM 1042 CB LEU A 928 13.647 14.239 -19.911 1.00 28.73 C ATOM 1043 CG LEU A 928 13.871 13.126 -18.862 1.00 34.09 C ATOM 1044 CD1 LEU A 928 14.306 11.804 -19.507 1.00 36.04 C ATOM 1045 CD2 LEU A 928 14.835 13.579 -17.769 1.00 38.74 C ATOM 1046 H LEU A 928 12.958 15.976 -21.702 1.00 0.00 H ATOM 1047 N TYR A 929 10.559 14.896 -19.635 1.00 25.72 N ATOM 1048 CA TYR A 929 9.269 14.764 -18.919 1.00 25.19 C ATOM 1049 C TYR A 929 8.198 14.251 -19.845 1.00 28.44 C ATOM 1050 O TYR A 929 7.447 13.359 -19.460 1.00 25.82 O ATOM 1051 CB TYR A 929 8.807 16.077 -18.288 1.00 24.51 C ATOM 1052 CG TYR A 929 9.765 16.744 -17.313 1.00 26.11 C ATOM 1053 CD1 TYR A 929 10.611 15.989 -16.497 1.00 25.77 C ATOM 1054 CD2 TYR A 929 9.758 18.122 -17.143 1.00 28.11 C ATOM 1055 CE1 TYR A 929 11.410 16.601 -15.526 1.00 26.45 C ATOM 1056 CE2 TYR A 929 10.602 18.747 -16.226 1.00 28.73 C ATOM 1057 CZ TYR A 929 11.431 17.986 -15.424 1.00 29.83 C ATOM 1058 OH TYR A 929 12.256 18.644 -14.540 1.00 33.02 O ATOM 1059 HH TYR A 929 12.790 17.982 -14.034 1.00 0.00 H ATOM 1060 H TYR A 929 10.997 15.834 -19.739 1.00 0.00 H ATOM 1061 N SER A 930 8.149 14.785 -21.095 1.00 25.48 N ATOM 1062 CA SER A 930 7.166 14.364 -22.097 1.00 24.93 C ATOM 1063 C SER A 930 7.283 12.846 -22.344 1.00 28.39 C ATOM 1064 O SER A 930 6.265 12.151 -22.396 1.00 25.77 O ATOM 1065 CB SER A 930 7.441 15.092 -23.418 1.00 28.43 C ATOM 1066 OG SER A 930 7.356 16.504 -23.242 1.00 34.11 O ATOM 1067 HG SER A 930 8.025 16.793 -22.572 1.00 0.00 H ATOM 1068 H SER A 930 8.837 15.522 -21.350 1.00 0.00 H ATOM 1069 N SER A 931 8.536 12.350 -22.496 1.00 27.13 N ATOM 1070 CA SER A 931 8.793 10.928 -22.755 1.00 27.35 C ATOM 1071 C SER A 931 8.332 10.050 -21.575 1.00 29.90 C ATOM 1072 O SER A 931 7.716 9.002 -21.788 1.00 29.82 O ATOM 1073 CB SER A 931 10.263 10.698 -23.095 1.00 30.85 C ATOM 1074 OG SER A 931 11.111 10.811 -21.964 1.00 36.68 O ATOM 1075 HG SER A 931 11.027 11.719 -21.579 1.00 0.00 H ATOM 1076 H SER A 931 9.344 13.001 -22.427 1.00 0.00 H ATOM 1077 N GLN A 932 8.596 10.489 -20.351 1.00 26.63 N ATOM 1078 CA GLN A 932 8.189 9.773 -19.135 1.00 25.53 C ATOM 1079 C GLN A 932 6.671 9.732 -19.004 1.00 28.09 C ATOM 1080 O GLN A 932 6.125 8.688 -18.671 1.00 27.79 O ATOM 1081 CB GLN A 932 8.828 10.423 -17.918 1.00 27.73 C ATOM 1082 CG GLN A 932 10.341 10.220 -17.918 1.00 28.76 C ATOM 1083 CD GLN A 932 11.009 10.912 -16.762 1.00 35.67 C ATOM 1084 OE1 GLN A 932 10.454 11.829 -16.141 1.00 32.68 O ATOM 1085 NE2 GLN A 932 12.231 10.476 -16.458 1.00 31.92 N ATOM 1086 HE22 GLN A 932 12.659 9.703 -17.007 1.00 0.00 H ATOM 1087 HE21 GLN A 932 12.757 10.909 -15.672 1.00 0.00 H ATOM 1088 H GLN A 932 9.116 11.384 -20.248 1.00 0.00 H ATOM 1089 N ILE A 933 5.973 10.854 -19.285 1.00 24.15 N ATOM 1090 CA ILE A 933 4.510 10.883 -19.204 1.00 23.27 C ATOM 1091 C ILE A 933 3.949 9.946 -20.268 1.00 27.60 C ATOM 1092 O ILE A 933 2.997 9.204 -20.016 1.00 25.76 O ATOM 1093 CB ILE A 933 3.974 12.340 -19.360 1.00 24.86 C ATOM 1094 CG1 ILE A 933 4.456 13.195 -18.171 1.00 24.95 C ATOM 1095 CG2 ILE A 933 2.408 12.379 -19.507 1.00 25.52 C ATOM 1096 CD1 ILE A 933 4.576 14.746 -18.479 1.00 26.29 C ATOM 1097 H ILE A 933 6.485 11.715 -19.565 1.00 0.00 H ATOM 1098 N CYS A 934 4.549 9.990 -21.477 1.00 27.13 N ATOM 1099 CA CYS A 934 4.104 9.149 -22.579 1.00 28.09 C ATOM 1100 C CYS A 934 4.232 7.649 -22.185 1.00 30.38 C ATOM 1101 O CYS A 934 3.310 6.873 -22.398 1.00 29.63 O ATOM 1102 CB CYS A 934 4.921 9.464 -23.821 1.00 29.69 C ATOM 1103 SG CYS A 934 4.327 8.604 -25.285 1.00 33.78 S ATOM 1104 H CYS A 934 5.348 10.640 -21.624 1.00 0.00 H ATOM 1105 N LYS A 935 5.382 7.264 -21.613 1.00 28.40 N ATOM 1106 CA LYS A 935 5.623 5.877 -21.145 1.00 28.83 C ATOM 1107 C LYS A 935 4.604 5.456 -20.077 1.00 30.67 C ATOM 1108 O LYS A 935 4.118 4.325 -20.129 1.00 29.29 O ATOM 1109 CB LYS A 935 7.049 5.712 -20.607 1.00 33.38 C ATOM 1110 CG LYS A 935 8.072 5.624 -21.732 1.00 44.13 C ATOM 1111 CD LYS A 935 9.488 5.833 -21.234 1.00 58.18 C ATOM 1112 CE LYS A 935 10.471 5.946 -22.375 1.00 73.67 C ATOM 1113 NZ LYS A 935 10.731 4.635 -23.030 1.00 88.09 N ATOM 1114 HZ1 LYS A 935 11.123 3.972 -22.332 1.00 0.00 H ATOM 1115 HZ2 LYS A 935 9.840 4.255 -23.409 1.00 0.00 H ATOM 1116 HZ3 LYS A 935 11.411 4.765 -23.806 1.00 0.00 H ATOM 1117 H LYS A 935 6.138 7.968 -21.492 1.00 0.00 H ATOM 1118 N GLY A 936 4.281 6.356 -19.139 1.00 26.81 N ATOM 1119 CA GLY A 936 3.262 6.086 -18.121 1.00 25.49 C ATOM 1120 C GLY A 936 1.900 5.861 -18.765 1.00 28.39 C ATOM 1121 O GLY A 936 1.164 4.927 -18.402 1.00 25.18 O ATOM 1122 H GLY A 936 4.768 7.275 -19.133 1.00 0.00 H ATOM 1123 N MET A 937 1.602 6.659 -19.790 1.00 25.65 N ATOM 1124 CA MET A 937 0.328 6.556 -20.520 1.00 24.93 C ATOM 1125 C MET A 937 0.210 5.291 -21.387 1.00 27.70 C ATOM 1126 O MET A 937 -0.881 4.709 -21.492 1.00 25.85 O ATOM 1127 CB MET A 937 0.043 7.821 -21.331 1.00 26.16 C ATOM 1128 CG MET A 937 -0.306 9.048 -20.460 1.00 27.10 C ATOM 1129 SD MET A 937 -1.573 8.813 -19.190 1.00 29.58 S ATOM 1130 CE MET A 937 -2.981 8.511 -20.178 1.00 28.16 C ATOM 1131 H MET A 937 2.293 7.379 -20.084 1.00 0.00 H ATOM 1132 N GLU A 938 1.322 4.889 -22.006 1.00 26.16 N ATOM 1133 CA GLU A 938 1.404 3.658 -22.789 1.00 27.29 C ATOM 1134 C GLU A 938 1.084 2.496 -21.839 1.00 28.96 C ATOM 1135 O GLU A 938 0.259 1.630 -22.156 1.00 27.79 O ATOM 1136 CB GLU A 938 2.807 3.501 -23.376 1.00 28.77 C ATOM 1137 CG GLU A 938 2.888 2.343 -24.361 1.00 40.26 C ATOM 1138 CD GLU A 938 4.269 1.994 -24.891 1.00 66.93 C ATOM 1139 OE1 GLU A 938 5.217 2.787 -24.690 1.00 59.14 O ATOM 1140 OE2 GLU A 938 4.402 0.910 -25.503 1.00 62.45 O ATOM 1141 H GLU A 938 2.173 5.482 -21.927 1.00 0.00 H ATOM 1142 N TYR A 939 1.704 2.510 -20.657 1.00 26.35 N ATOM 1143 CA TYR A 939 1.434 1.486 -19.653 1.00 26.26 C ATOM 1144 C TYR A 939 -0.046 1.519 -19.213 1.00 27.75 C ATOM 1145 O TYR A 939 -0.710 0.471 -19.178 1.00 24.92 O ATOM 1146 CB TYR A 939 2.395 1.641 -18.466 1.00 27.55 C ATOM 1147 CG TYR A 939 2.051 0.734 -17.307 1.00 28.22 C ATOM 1148 CD1 TYR A 939 2.092 -0.660 -17.444 1.00 29.73 C ATOM 1149 CD2 TYR A 939 1.591 1.256 -16.102 1.00 27.09 C ATOM 1150 CE1 TYR A 939 1.761 -1.503 -16.377 1.00 27.84 C ATOM 1151 CE2 TYR A 939 1.267 0.429 -15.031 1.00 28.89 C ATOM 1152 CZ TYR A 939 1.349 -0.952 -15.173 1.00 35.04 C ATOM 1153 OH TYR A 939 1.019 -1.748 -14.109 1.00 30.07 O ATOM 1154 HH TYR A 939 1.127 -2.699 -14.363 1.00 0.00 H ATOM 1155 H TYR A 939 2.391 3.263 -20.448 1.00 0.00 H ATOM 1156 N LEU A 940 -0.586 2.700 -18.910 1.00 25.22 N ATOM 1157 CA LEU A 940 -1.992 2.763 -18.506 1.00 25.89 C ATOM 1158 C LEU A 940 -2.919 2.185 -19.569 1.00 27.75 C ATOM 1159 O LEU A 940 -3.839 1.468 -19.221 1.00 27.11 O ATOM 1160 CB LEU A 940 -2.476 4.192 -18.205 1.00 26.54 C ATOM 1161 CG LEU A 940 -2.042 4.825 -16.943 1.00 31.76 C ATOM 1162 CD1 LEU A 940 -2.663 6.238 -16.853 1.00 30.24 C ATOM 1163 CD2 LEU A 940 -2.526 3.998 -15.740 1.00 34.55 C ATOM 1164 H LEU A 940 -0.014 3.567 -18.960 1.00 0.00 H ATOM 1165 N GLY A 941 -2.641 2.476 -20.835 1.00 25.85 N ATOM 1166 CA GLY A 941 -3.409 1.978 -21.971 1.00 25.63 C ATOM 1167 C GLY A 941 -3.340 0.461 -22.058 1.00 29.46 C ATOM 1168 O GLY A 941 -4.342 -0.184 -22.369 1.00 29.32 O ATOM 1169 H GLY A 941 -1.828 3.095 -21.028 1.00 0.00 H ATOM 1170 N SER A 942 -2.162 -0.116 -21.746 1.00 26.27 N ATOM 1171 CA SER A 942 -1.935 -1.583 -21.727 1.00 26.11 C ATOM 1172 C SER A 942 -2.774 -2.245 -20.626 1.00 31.01 C ATOM 1173 O SER A 942 -3.090 -3.451 -20.712 1.00 30.03 O ATOM 1174 CB SER A 942 -0.450 -1.925 -21.564 1.00 25.75 C ATOM 1175 OG SER A 942 -0.031 -1.897 -20.206 1.00 27.84 O ATOM 1176 HG SER A 942 -0.178 -0.991 -19.835 1.00 0.00 H ATOM 1177 H SER A 942 -1.363 0.505 -21.504 1.00 0.00 H ATOM 1178 N ARG A 943 -3.165 -1.454 -19.589 1.00 25.10 N ATOM 1179 CA ARG A 943 -4.009 -1.933 -18.507 1.00 24.08 C ATOM 1180 C ARG A 943 -5.483 -1.646 -18.766 1.00 27.75 C ATOM 1181 O ARG A 943 -6.327 -1.922 -17.914 1.00 29.10 O ATOM 1182 CB ARG A 943 -3.556 -1.367 -17.146 1.00 25.14 C ATOM 1183 CG ARG A 943 -2.044 -1.482 -16.843 1.00 27.32 C ATOM 1184 CD ARG A 943 -1.469 -2.869 -17.032 1.00 30.97 C ATOM 1185 NE ARG A 943 -2.243 -3.883 -16.316 1.00 29.03 N ATOM 1186 CZ ARG A 943 -2.085 -5.182 -16.498 1.00 42.48 C ATOM 1187 NH1 ARG A 943 -1.171 -5.635 -17.351 1.00 33.68 N ATOM 1188 NH2 ARG A 943 -2.843 -6.040 -15.845 1.00 30.72 N ATOM 1189 HE ARG A 943 -2.955 -3.565 -15.628 1.00 0.00 H ATOM 1190 HH12 ARG A 943 -1.051 -6.659 -17.490 1.00 0.00 H ATOM 1191 HH11 ARG A 943 -0.576 -4.966 -17.879 1.00 0.00 H ATOM 1192 HH22 ARG A 943 -2.716 -7.062 -15.991 1.00 0.00 H ATOM 1193 HH21 ARG A 943 -3.568 -5.695 -15.184 1.00 0.00 H ATOM 1194 H ARG A 943 -2.846 -0.464 -19.570 1.00 0.00 H ATOM 1195 N ARG A 944 -5.792 -1.129 -19.958 1.00 25.79 N ATOM 1196 CA ARG A 944 -7.132 -0.737 -20.395 1.00 26.64 C ATOM 1197 C ARG A 944 -7.660 0.390 -19.504 1.00 29.69 C ATOM 1198 O ARG A 944 -8.856 0.483 -19.279 1.00 29.44 O ATOM 1199 CB ARG A 944 -8.111 -1.940 -20.420 1.00 27.22 C ATOM 1200 CG ARG A 944 -7.635 -3.070 -21.330 1.00 32.31 C ATOM 1201 CD ARG A 944 -8.756 -4.055 -21.649 1.00 33.05 C ATOM 1202 NE ARG A 944 -9.884 -3.464 -22.385 1.00 34.33 N ATOM 1203 CZ ARG A 944 -9.883 -3.149 -23.681 1.00 35.52 C ATOM 1204 NH1 ARG A 944 -10.965 -2.640 -24.247 1.00 31.34 N ATOM 1205 NH2 ARG A 944 -8.791 -3.313 -24.412 1.00 35.11 N ATOM 1206 HE ARG A 944 -10.756 -3.276 -21.850 1.00 0.00 H ATOM 1207 HH12 ARG A 944 -10.957 -2.397 -25.258 1.00 0.00 H ATOM 1208 HH11 ARG A 944 -11.823 -2.483 -23.681 1.00 0.00 H ATOM 1209 HH22 ARG A 944 -8.799 -3.065 -25.422 1.00 0.00 H ATOM 1210 HH21 ARG A 944 -7.925 -3.690 -23.976 1.00 0.00 H ATOM 1211 H ARG A 944 -5.013 -0.993 -20.634 1.00 0.00 H ATOM 1212 N CYS A 945 -6.760 1.242 -19.006 1.00 27.84 N ATOM 1213 CA CYS A 945 -7.165 2.318 -18.112 1.00 26.29 C ATOM 1214 C CYS A 945 -7.184 3.645 -18.878 1.00 28.51 C ATOM 1215 O CYS A 945 -6.195 3.973 -19.534 1.00 29.04 O ATOM 1216 CB CYS A 945 -6.232 2.390 -16.907 1.00 26.39 C ATOM 1217 SG CYS A 945 -6.675 3.708 -15.729 1.00 29.99 S ATOM 1218 H CYS A 945 -5.757 1.136 -19.260 1.00 0.00 H ATOM 1219 N VAL A 946 -8.313 4.370 -18.813 1.00 24.40 N ATOM 1220 CA VAL A 946 -8.475 5.729 -19.375 1.00 24.65 C ATOM 1221 C VAL A 946 -8.342 6.649 -18.129 1.00 25.52 C ATOM 1222 O VAL A 946 -9.057 6.487 -17.143 1.00 27.09 O ATOM 1223 CB VAL A 946 -9.848 5.914 -20.094 1.00 29.10 C ATOM 1224 CG1 VAL A 946 -10.042 7.369 -20.524 1.00 29.82 C ATOM 1225 CG2 VAL A 946 -9.944 4.987 -21.322 1.00 29.04 C ATOM 1226 H VAL A 946 -9.132 3.945 -18.333 1.00 0.00 H ATOM 1227 N HIS A 947 -7.386 7.564 -18.170 1.00 24.34 N ATOM 1228 CA HIS A 947 -7.100 8.462 -17.050 1.00 24.38 C ATOM 1229 C HIS A 947 -8.180 9.555 -16.934 1.00 28.17 C ATOM 1230 O HIS A 947 -8.690 9.789 -15.833 1.00 27.66 O ATOM 1231 CB HIS A 947 -5.675 9.055 -17.177 1.00 24.49 C ATOM 1232 CG HIS A 947 -5.292 9.896 -15.988 1.00 26.27 C ATOM 1233 ND1 HIS A 947 -5.812 11.181 -15.806 1.00 27.94 N ATOM 1234 CD2 HIS A 947 -4.466 9.605 -14.956 1.00 26.65 C ATOM 1235 CE1 HIS A 947 -5.279 11.637 -14.676 1.00 26.48 C ATOM 1236 NE2 HIS A 947 -4.454 10.731 -14.120 1.00 25.93 N ATOM 1237 H HIS A 947 -6.814 7.648 -19.035 1.00 0.00 H ATOM 1238 N ARG A 948 -8.549 10.181 -18.064 1.00 25.00 N ATOM 1239 CA ARG A 948 -9.612 11.210 -18.197 1.00 26.01 C ATOM 1240 C ARG A 948 -9.265 12.617 -17.661 1.00 32.18 C ATOM 1241 O ARG A 948 -10.030 13.567 -17.911 1.00 32.45 O ATOM 1242 CB ARG A 948 -10.933 10.768 -17.516 1.00 28.70 C ATOM 1243 CG ARG A 948 -11.846 9.914 -18.361 1.00 50.14 C ATOM 1244 CD ARG A 948 -13.112 9.547 -17.601 1.00 61.01 C ATOM 1245 NE ARG A 948 -13.913 10.717 -17.226 1.00 55.57 N ATOM 1246 CZ ARG A 948 -14.748 10.747 -16.194 1.00 69.53 C ATOM 1247 NH1 ARG A 948 -14.863 9.694 -15.393 1.00 59.95 N ATOM 1248 NH2 ARG A 948 -15.454 11.839 -15.937 1.00 63.06 N ATOM 1249 HE ARG A 948 -13.821 11.577 -17.804 1.00 0.00 H ATOM 1250 HH12 ARG A 948 -15.519 9.723 -14.586 1.00 0.00 H ATOM 1251 HH11 ARG A 948 -14.297 8.840 -15.572 1.00 0.00 H ATOM 1252 HH22 ARG A 948 -16.107 11.858 -15.128 1.00 0.00 H ATOM 1253 HH21 ARG A 948 -15.355 12.677 -16.545 1.00 0.00 H ATOM 1254 H ARG A 948 -8.040 9.919 -18.932 1.00 0.00 H ATOM 1255 N ASP A 949 -8.152 12.758 -16.924 1.00 27.95 N ATOM 1256 CA ASP A 949 -7.822 14.052 -16.319 1.00 28.53 C ATOM 1257 C ASP A 949 -6.324 14.338 -16.452 1.00 30.70 C ATOM 1258 O ASP A 949 -5.684 14.843 -15.516 1.00 32.23 O ATOM 1259 CB ASP A 949 -8.261 14.020 -14.836 1.00 30.35 C ATOM 1260 CG ASP A 949 -8.481 15.378 -14.176 1.00 37.32 C ATOM 1261 OD1 ASP A 949 -8.705 16.366 -14.902 1.00 39.39 O ATOM 1262 OD2 ASP A 949 -8.503 15.429 -12.944 1.00 38.86 O ATOM 1263 H ASP A 949 -7.520 11.944 -16.781 1.00 0.00 H ATOM 1264 N LEU A 950 -5.735 13.961 -17.588 1.00 24.74 N ATOM 1265 CA LEU A 950 -4.311 14.202 -17.735 1.00 23.82 C ATOM 1266 C LEU A 950 -4.090 15.719 -17.941 1.00 29.18 C ATOM 1267 O LEU A 950 -4.667 16.319 -18.849 1.00 29.89 O ATOM 1268 CB LEU A 950 -3.726 13.368 -18.896 1.00 24.68 C ATOM 1269 CG LEU A 950 -2.204 13.375 -19.001 1.00 31.56 C ATOM 1270 CD1 LEU A 950 -1.552 12.611 -17.805 1.00 32.30 C ATOM 1271 CD2 LEU A 950 -1.774 12.772 -20.330 1.00 37.58 C ATOM 1272 H LEU A 950 -6.281 13.507 -18.348 1.00 0.00 H ATOM 1273 N ALA A 951 -3.293 16.338 -17.053 1.00 25.64 N ATOM 1274 CA ALA A 951 -2.990 17.785 -17.091 1.00 25.33 C ATOM 1275 C ALA A 951 -1.772 17.965 -16.234 1.00 27.11 C ATOM 1276 O ALA A 951 -1.522 17.122 -15.367 1.00 25.37 O ATOM 1277 CB ALA A 951 -4.140 18.601 -16.508 1.00 27.05 C ATOM 1278 H ALA A 951 -2.865 15.767 -16.296 1.00 0.00 H ATOM 1279 N ALA A 952 -0.993 19.046 -16.461 1.00 25.48 N ATOM 1280 CA ALA A 952 0.244 19.236 -15.694 1.00 25.34 C ATOM 1281 C ALA A 952 -0.035 19.345 -14.185 1.00 24.64 C ATOM 1282 O ALA A 952 0.811 18.979 -13.391 1.00 24.84 O ATOM 1283 CB ALA A 952 1.020 20.461 -16.201 1.00 25.38 C ATOM 1284 H ALA A 952 -1.270 19.744 -17.180 1.00 0.00 H ATOM 1285 N ARG A 953 -1.210 19.819 -13.797 1.00 25.94 N ATOM 1286 CA ARG A 953 -1.563 19.931 -12.376 1.00 26.73 C ATOM 1287 C ARG A 953 -1.755 18.523 -11.734 1.00 29.44 C ATOM 1288 O ARG A 953 -1.760 18.410 -10.509 1.00 29.41 O ATOM 1289 CB ARG A 953 -2.838 20.790 -12.207 1.00 30.57 C ATOM 1290 CG ARG A 953 -4.107 20.081 -12.674 1.00 36.42 C ATOM 1291 CD ARG A 953 -5.348 20.946 -12.577 1.00 54.32 C ATOM 1292 NE ARG A 953 -5.732 21.430 -13.902 1.00 71.24 N ATOM 1293 CZ ARG A 953 -6.525 20.780 -14.749 1.00 83.35 C ATOM 1294 NH1 ARG A 953 -6.795 21.296 -15.935 1.00 66.63 N ATOM 1295 NH2 ARG A 953 -7.068 19.616 -14.405 1.00 66.67 N ATOM 1296 HE ARG A 953 -5.357 22.352 -14.205 1.00 0.00 H ATOM 1297 HH12 ARG A 953 -7.415 20.785 -16.595 1.00 0.00 H ATOM 1298 HH11 ARG A 953 -6.387 22.213 -16.208 1.00 0.00 H ATOM 1299 HH22 ARG A 953 -7.687 19.113 -15.073 1.00 0.00 H ATOM 1300 HH21 ARG A 953 -6.874 19.208 -13.468 1.00 0.00 H ATOM 1301 H ARG A 953 -1.899 20.119 -14.516 1.00 0.00 H ATOM 1302 N ASN A 954 -1.911 17.464 -12.567 1.00 26.07 N ATOM 1303 CA ASN A 954 -2.136 16.087 -12.091 1.00 25.35 C ATOM 1304 C ASN A 954 -0.947 15.160 -12.273 1.00 28.48 C ATOM 1305 O ASN A 954 -1.065 13.930 -12.168 1.00 29.45 O ATOM 1306 CB ASN A 954 -3.397 15.540 -12.764 1.00 26.42 C ATOM 1307 CG ASN A 954 -4.622 16.324 -12.380 1.00 40.39 C ATOM 1308 OD1 ASN A 954 -4.812 16.680 -11.209 1.00 36.32 O ATOM 1309 ND2 ASN A 954 -5.508 16.590 -13.339 1.00 32.40 N ATOM 1310 HD22 ASN A 954 -5.326 16.281 -14.315 1.00 0.00 H ATOM 1311 HD21 ASN A 954 -6.381 17.107 -13.111 1.00 0.00 H ATOM 1312 H ASN A 954 -1.870 17.632 -13.593 1.00 0.00 H ATOM 1313 N ILE A 955 0.206 15.750 -12.572 1.00 24.06 N ATOM 1314 CA ILE A 955 1.453 15.027 -12.746 1.00 22.74 C ATOM 1315 C ILE A 955 2.318 15.522 -11.596 1.00 24.58 C ATOM 1316 O ILE A 955 2.312 16.721 -11.317 1.00 25.30 O ATOM 1317 CB ILE A 955 2.030 15.348 -14.143 1.00 25.53 C ATOM 1318 CG1 ILE A 955 1.085 14.739 -15.241 1.00 26.19 C ATOM 1319 CG2 ILE A 955 3.464 14.817 -14.271 1.00 25.27 C ATOM 1320 CD1 ILE A 955 1.307 15.251 -16.625 1.00 30.60 C ATOM 1321 H ILE A 955 0.215 16.784 -12.687 1.00 0.00 H ATOM 1322 N LEU A 956 3.044 14.608 -10.944 1.00 23.04 N ATOM 1323 CA LEU A 956 3.898 14.940 -9.817 1.00 23.69 C ATOM 1324 C LEU A 956 5.335 14.869 -10.221 1.00 26.51 C ATOM 1325 O LEU A 956 5.678 14.126 -11.116 1.00 27.14 O ATOM 1326 CB LEU A 956 3.659 13.963 -8.646 1.00 24.43 C ATOM 1327 CG LEU A 956 2.259 13.955 -8.072 1.00 27.09 C ATOM 1328 CD1 LEU A 956 2.106 12.834 -7.032 1.00 27.88 C ATOM 1329 CD2 LEU A 956 1.872 15.320 -7.544 1.00 27.51 C ATOM 1330 H LEU A 956 2.995 13.617 -11.257 1.00 0.00 H ATOM 1331 N VAL A 957 6.181 15.595 -9.497 1.00 26.35 N ATOM 1332 CA VAL A 957 7.611 15.635 -9.748 1.00 25.60 C ATOM 1333 C VAL A 957 8.287 14.859 -8.609 1.00 28.94 C ATOM 1334 O VAL A 957 8.145 15.235 -7.440 1.00 29.70 O ATOM 1335 CB VAL A 957 8.104 17.107 -9.788 1.00 28.80 C ATOM 1336 CG1 VAL A 957 9.593 17.151 -10.084 1.00 29.64 C ATOM 1337 CG2 VAL A 957 7.331 17.911 -10.852 1.00 27.82 C ATOM 1338 H VAL A 957 5.800 16.162 -8.713 1.00 0.00 H ATOM 1339 N GLU A 958 8.980 13.778 -8.962 1.00 27.99 N ATOM 1340 CA GLU A 958 9.702 12.900 -8.012 1.00 29.09 C ATOM 1341 C GLU A 958 11.085 13.526 -7.792 1.00 36.37 C ATOM 1342 O GLU A 958 11.608 13.509 -6.676 1.00 35.06 O ATOM 1343 CB GLU A 958 9.839 11.484 -8.587 1.00 30.23 C ATOM 1344 CG GLU A 958 10.766 10.542 -7.813 1.00 44.06 C ATOM 1345 CD GLU A 958 10.227 9.939 -6.532 1.00 82.98 C ATOM 1346 OE1 GLU A 958 9.602 8.856 -6.598 1.00 84.95 O ATOM 1347 OE2 GLU A 958 10.460 10.531 -5.454 1.00 90.87 O ATOM 1348 H GLU A 958 9.017 13.534 -9.972 1.00 0.00 H ATOM 1349 N SER A 959 11.666 14.078 -8.870 1.00 33.45 N ATOM 1350 CA SER A 959 12.965 14.746 -8.837 1.00 34.18 C ATOM 1351 C SER A 959 13.092 15.592 -10.107 1.00 37.87 C ATOM 1352 O SER A 959 12.260 15.481 -11.009 1.00 34.88 O ATOM 1353 CB SER A 959 14.098 13.722 -8.777 1.00 37.29 C ATOM 1354 OG SER A 959 14.217 12.974 -9.975 1.00 49.66 O ATOM 1355 HG SER A 959 14.961 12.327 -9.886 1.00 0.00 H ATOM 1356 H SER A 959 11.163 14.027 -9.779 1.00 0.00 H ATOM 1357 N GLU A 960 14.157 16.406 -10.175 1.00 36.25 N ATOM 1358 CA GLU A 960 14.522 17.270 -11.299 1.00 36.55 C ATOM 1359 C GLU A 960 14.440 16.512 -12.650 1.00 35.58 C ATOM 1360 O GLU A 960 14.177 17.130 -13.676 1.00 34.27 O ATOM 1361 CB GLU A 960 16.001 17.717 -11.053 1.00 38.77 C ATOM 1362 CG GLU A 960 16.565 18.746 -12.019 1.00 52.64 C ATOM 1363 CD GLU A 960 16.237 20.202 -11.744 1.00 75.70 C ATOM 1364 OE1 GLU A 960 15.589 20.502 -10.713 1.00 71.64 O ATOM 1365 OE2 GLU A 960 16.657 21.052 -12.561 1.00 65.91 O ATOM 1366 H GLU A 960 14.786 16.425 -9.347 1.00 0.00 H ATOM 1367 N ALA A 961 14.668 15.184 -12.642 1.00 32.59 N ATOM 1368 CA ALA A 961 14.713 14.362 -13.846 1.00 32.83 C ATOM 1369 C ALA A 961 13.685 13.203 -13.858 1.00 31.88 C ATOM 1370 O ALA A 961 13.863 12.221 -14.567 1.00 31.54 O ATOM 1371 CB ALA A 961 16.131 13.819 -14.011 1.00 34.62 C ATOM 1372 H ALA A 961 14.821 14.718 -11.725 1.00 0.00 H ATOM 1373 N HIS A 962 12.600 13.322 -13.093 1.00 29.74 N ATOM 1374 CA HIS A 962 11.637 12.208 -13.048 1.00 29.46 C ATOM 1375 C HIS A 962 10.275 12.725 -12.624 1.00 29.50 C ATOM 1376 O HIS A 962 10.150 13.345 -11.575 1.00 28.63 O ATOM 1377 CB HIS A 962 12.155 11.121 -12.063 1.00 31.68 C ATOM 1378 CG HIS A 962 11.378 9.837 -12.012 1.00 37.28 C ATOM 1379 ND1 HIS A 962 11.701 8.843 -11.093 1.00 40.77 N ATOM 1380 CD2 HIS A 962 10.284 9.440 -12.709 1.00 39.70 C ATOM 1381 CE1 HIS A 962 10.807 7.880 -11.282 1.00 39.78 C ATOM 1382 NE2 HIS A 962 9.960 8.185 -12.265 1.00 39.52 N ATOM 1383 H HIS A 962 12.436 14.186 -12.538 1.00 0.00 H ATOM 1384 N VAL A 963 9.265 12.449 -13.453 1.00 26.09 N ATOM 1385 CA VAL A 963 7.853 12.797 -13.175 1.00 26.27 C ATOM 1386 C VAL A 963 7.015 11.535 -13.128 1.00 26.75 C ATOM 1387 O VAL A 963 7.416 10.498 -13.683 1.00 26.97 O ATOM 1388 CB VAL A 963 7.249 13.853 -14.138 1.00 27.61 C ATOM 1389 CG1 VAL A 963 8.004 15.175 -14.018 1.00 28.37 C ATOM 1390 CG2 VAL A 963 7.216 13.347 -15.591 1.00 27.05 C ATOM 1391 H VAL A 963 9.483 11.961 -14.345 1.00 0.00 H ATOM 1392 N LYS A 964 5.835 11.629 -12.490 1.00 24.82 N ATOM 1393 CA LYS A 964 4.908 10.498 -12.354 1.00 24.39 C ATOM 1394 C LYS A 964 3.465 10.990 -12.493 1.00 25.99 C ATOM 1395 O LYS A 964 3.103 12.020 -11.909 1.00 26.84 O ATOM 1396 CB LYS A 964 5.053 9.917 -10.921 1.00 27.24 C ATOM 1397 CG LYS A 964 6.350 9.156 -10.706 1.00 26.73 C ATOM 1398 CD LYS A 964 6.310 8.413 -9.372 1.00 29.27 C ATOM 1399 CE LYS A 964 7.677 7.896 -9.006 1.00 34.43 C ATOM 1400 NZ LYS A 964 7.629 6.839 -7.957 1.00 32.77 N ATOM 1401 HZ1 LYS A 964 7.193 7.226 -7.096 1.00 0.00 H ATOM 1402 HZ2 LYS A 964 7.065 6.036 -8.301 1.00 0.00 H ATOM 1403 HZ3 LYS A 964 8.596 6.520 -7.744 1.00 0.00 H ATOM 1404 H LYS A 964 5.567 12.544 -12.074 1.00 0.00 H ATOM 1405 N ILE A 965 2.615 10.202 -13.171 1.00 23.56 N ATOM 1406 CA ILE A 965 1.198 10.523 -13.302 1.00 22.89 C ATOM 1407 C ILE A 965 0.492 10.226 -11.999 1.00 25.13 C ATOM 1408 O ILE A 965 0.723 9.172 -11.398 1.00 25.53 O ATOM 1409 CB ILE A 965 0.615 9.726 -14.497 1.00 26.32 C ATOM 1410 CG1 ILE A 965 1.403 10.081 -15.810 1.00 27.31 C ATOM 1411 CG2 ILE A 965 -0.912 9.958 -14.675 1.00 26.85 C ATOM 1412 CD1 ILE A 965 1.327 8.978 -16.885 1.00 30.96 C ATOM 1413 H ILE A 965 2.978 9.335 -13.617 1.00 0.00 H ATOM 1414 N ALA A 966 -0.396 11.133 -11.570 1.00 22.43 N ATOM 1415 CA ALA A 966 -1.167 10.917 -10.351 1.00 22.25 C ATOM 1416 C ALA A 966 -2.618 11.264 -10.603 1.00 25.77 C ATOM 1417 O ALA A 966 -3.016 11.370 -11.763 1.00 27.10 O ATOM 1418 CB ALA A 966 -0.600 11.782 -9.235 1.00 23.89 C ATOM 1419 H ALA A 966 -0.538 12.007 -12.116 1.00 0.00 H ATOM 1420 N ASP A 967 -3.406 11.444 -9.502 1.00 25.60 N ATOM 1421 CA ASP A 967 -4.806 11.912 -9.575 1.00 25.36 C ATOM 1422 C ASP A 967 -5.699 10.979 -10.413 1.00 26.60 C ATOM 1423 O ASP A 967 -6.189 11.368 -11.475 1.00 27.42 O ATOM 1424 CB ASP A 967 -4.870 13.382 -10.093 1.00 27.48 C ATOM 1425 CG ASP A 967 -6.209 13.842 -10.672 1.00 40.54 C ATOM 1426 OD1 ASP A 967 -7.163 14.008 -9.899 1.00 40.49 O ATOM 1427 OD2 ASP A 967 -6.306 13.990 -11.912 1.00 49.89 O ATOM 1428 H ASP A 967 -3.001 11.242 -8.566 1.00 0.00 H ATOM 1429 N PHE A 968 -5.877 9.746 -9.960 1.00 22.40 N ATOM 1430 CA PHE A 968 -6.660 8.703 -10.632 1.00 24.04 C ATOM 1431 C PHE A 968 -8.156 8.687 -10.295 1.00 27.73 C ATOM 1432 O PHE A 968 -8.857 7.718 -10.625 1.00 27.23 O ATOM 1433 CB PHE A 968 -6.016 7.331 -10.318 1.00 26.52 C ATOM 1434 CG PHE A 968 -4.804 7.122 -11.195 1.00 25.64 C ATOM 1435 CD1 PHE A 968 -4.905 6.418 -12.396 1.00 27.82 C ATOM 1436 CD2 PHE A 968 -3.570 7.671 -10.854 1.00 26.88 C ATOM 1437 CE1 PHE A 968 -3.801 6.291 -13.243 1.00 27.33 C ATOM 1438 CE2 PHE A 968 -2.466 7.537 -11.713 1.00 27.08 C ATOM 1439 CZ PHE A 968 -2.590 6.851 -12.896 1.00 26.59 C ATOM 1440 H PHE A 968 -5.426 9.498 -9.056 1.00 0.00 H ATOM 1441 N GLY A 969 -8.647 9.762 -9.681 1.00 26.24 N ATOM 1442 CA GLY A 969 -10.046 9.870 -9.242 1.00 25.84 C ATOM 1443 C GLY A 969 -11.118 9.791 -10.327 1.00 30.84 C ATOM 1444 O GLY A 969 -12.256 9.396 -10.041 1.00 32.72 O ATOM 1445 H GLY A 969 -8.010 10.564 -9.503 1.00 0.00 H ATOM 1446 N LEU A 970 -10.755 10.075 -11.581 1.00 27.02 N ATOM 1447 CA LEU A 970 -11.707 10.002 -12.705 1.00 27.44 C ATOM 1448 C LEU A 970 -11.404 8.820 -13.633 1.00 30.13 C ATOM 1449 O LEU A 970 -12.108 8.617 -14.620 1.00 29.51 O ATOM 1450 CB LEU A 970 -11.682 11.322 -13.507 1.00 28.02 C ATOM 1451 CG LEU A 970 -12.182 12.575 -12.727 1.00 33.39 C ATOM 1452 CD1 LEU A 970 -11.949 13.831 -13.519 1.00 35.58 C ATOM 1453 CD2 LEU A 970 -13.651 12.461 -12.367 1.00 38.02 C ATOM 1454 H LEU A 970 -9.772 10.356 -11.770 1.00 0.00 H ATOM 1455 N ALA A 971 -10.377 8.042 -13.309 1.00 25.53 N ATOM 1456 CA ALA A 971 -9.946 6.942 -14.168 1.00 24.85 C ATOM 1457 C ALA A 971 -10.989 5.826 -14.236 1.00 28.78 C ATOM 1458 O ALA A 971 -11.720 5.591 -13.272 1.00 28.52 O ATOM 1459 CB ALA A 971 -8.604 6.381 -13.709 1.00 26.49 C ATOM 1460 H ALA A 971 -9.867 8.221 -12.421 1.00 0.00 H ATOM 1461 N LYS A 972 -11.050 5.158 -15.380 1.00 28.34 N ATOM 1462 CA LYS A 972 -12.010 4.067 -15.591 1.00 29.26 C ATOM 1463 C LYS A 972 -11.322 2.941 -16.341 1.00 31.99 C ATOM 1464 O LYS A 972 -10.430 3.209 -17.146 1.00 29.95 O ATOM 1465 CB LYS A 972 -13.183 4.593 -16.434 1.00 33.03 C ATOM 1466 CG LYS A 972 -14.493 4.677 -15.650 1.00 57.94 C ATOM 1467 CD LYS A 972 -15.020 6.113 -15.540 1.00 68.45 C ATOM 1468 CE LYS A 972 -15.673 6.417 -14.201 1.00 81.03 C ATOM 1469 NZ LYS A 972 -16.985 5.728 -14.025 1.00 92.02 N ATOM 1470 HZ1 LYS A 972 -17.639 6.034 -14.774 1.00 0.00 H ATOM 1471 HZ2 LYS A 972 -16.845 4.699 -14.084 1.00 0.00 H ATOM 1472 HZ3 LYS A 972 -17.382 5.973 -13.095 1.00 0.00 H ATOM 1473 H LYS A 972 -10.399 5.414 -16.150 1.00 0.00 H ATOM 1474 N LEU A 973 -11.756 1.693 -16.098 1.00 28.84 N ATOM 1475 CA LEU A 973 -11.182 0.572 -16.840 1.00 29.48 C ATOM 1476 C LEU A 973 -12.126 0.231 -17.984 1.00 34.67 C ATOM 1477 O LEU A 973 -13.344 0.186 -17.780 1.00 35.18 O ATOM 1478 CB LEU A 973 -10.954 -0.654 -15.960 1.00 29.92 C ATOM 1479 CG LEU A 973 -9.971 -0.498 -14.792 1.00 33.45 C ATOM 1480 CD1 LEU A 973 -9.930 -1.760 -13.944 1.00 37.54 C ATOM 1481 CD2 LEU A 973 -8.571 -0.096 -15.275 1.00 33.48 C ATOM 1482 H LEU A 973 -12.496 1.526 -15.386 1.00 0.00 H ATOM 1483 N LEU A 974 -11.569 0.036 -19.183 1.00 30.59 N ATOM 1484 CA LEU A 974 -12.366 -0.297 -20.358 1.00 30.09 C ATOM 1485 C LEU A 974 -12.689 -1.779 -20.328 1.00 33.90 C ATOM 1486 O LEU A 974 -11.777 -2.602 -20.198 1.00 33.29 O ATOM 1487 CB LEU A 974 -11.609 0.026 -21.663 1.00 29.98 C ATOM 1488 CG LEU A 974 -11.253 1.485 -21.929 1.00 32.79 C ATOM 1489 CD1 LEU A 974 -10.206 1.588 -23.032 1.00 31.30 C ATOM 1490 CD2 LEU A 974 -12.494 2.312 -22.271 1.00 35.46 C ATOM 1491 H LEU A 974 -10.537 0.124 -19.281 1.00 0.00 H ATOM 1492 N PRO A 975 -13.954 -2.163 -20.529 1.00 33.16 N ATOM 1493 CA PRO A 975 -14.265 -3.605 -20.618 1.00 32.86 C ATOM 1494 C PRO A 975 -13.504 -4.223 -21.798 1.00 32.51 C ATOM 1495 O PRO A 975 -13.090 -3.525 -22.712 1.00 29.78 O ATOM 1496 CB PRO A 975 -15.785 -3.629 -20.844 1.00 35.20 C ATOM 1497 CG PRO A 975 -16.268 -2.289 -20.387 1.00 40.35 C ATOM 1498 CD PRO A 975 -15.159 -1.342 -20.760 1.00 36.04 C ATOM 1499 N LEU A 976 -13.329 -5.538 -21.791 1.00 32.45 N ATOM 1500 CA LEU A 976 -12.552 -6.186 -22.862 1.00 32.17 C ATOM 1501 C LEU A 976 -13.112 -5.991 -24.286 1.00 35.04 C ATOM 1502 O LEU A 976 -12.343 -5.958 -25.233 1.00 34.89 O ATOM 1503 CB LEU A 976 -12.355 -7.678 -22.546 1.00 32.75 C ATOM 1504 CG LEU A 976 -11.643 -7.996 -21.231 1.00 38.22 C ATOM 1505 CD1 LEU A 976 -11.723 -9.469 -20.911 1.00 42.56 C ATOM 1506 CD2 LEU A 976 -10.192 -7.551 -21.263 1.00 40.07 C ATOM 1507 H LEU A 976 -13.741 -6.112 -21.028 1.00 0.00 H ATOM 1508 N ASP A 977 -14.434 -5.833 -24.435 1.00 31.68 N ATOM 1509 CA ASP A 977 -15.030 -5.744 -25.768 1.00 32.22 C ATOM 1510 C ASP A 977 -15.393 -4.335 -26.255 1.00 37.51 C ATOM 1511 O ASP A 977 -16.070 -4.198 -27.283 1.00 35.60 O ATOM 1512 CB ASP A 977 -16.258 -6.662 -25.802 1.00 34.26 C ATOM 1513 CG ASP A 977 -17.448 -6.133 -24.990 1.00 45.19 C ATOM 1514 OD1 ASP A 977 -18.542 -6.743 -25.072 1.00 44.58 O ATOM 1515 OD2 ASP A 977 -17.269 -5.142 -24.229 1.00 46.01 O ATOM 1516 H ASP A 977 -15.043 -5.773 -23.594 1.00 0.00 H ATOM 1517 N LYS A 978 -14.967 -3.292 -25.514 1.00 33.84 N ATOM 1518 CA LYS A 978 -15.328 -1.918 -25.837 1.00 33.91 C ATOM 1519 C LYS A 978 -14.144 -1.017 -25.551 1.00 38.83 C ATOM 1520 O LYS A 978 -13.604 -1.079 -24.437 1.00 40.02 O ATOM 1521 CB LYS A 978 -16.545 -1.531 -24.986 1.00 36.88 C ATOM 1522 CG LYS A 978 -17.358 -0.371 -25.533 1.00 47.05 C ATOM 1523 CD LYS A 978 -18.563 -0.093 -24.645 1.00 53.16 C ATOM 1524 CE LYS A 978 -19.292 1.148 -25.098 1.00 61.65 C ATOM 1525 NZ LYS A 978 -20.526 1.390 -24.304 1.00 62.52 N ATOM 1526 HZ1 LYS A 978 -21.168 0.579 -24.408 1.00 0.00 H ATOM 1527 HZ2 LYS A 978 -20.274 1.508 -23.302 1.00 0.00 H ATOM 1528 HZ3 LYS A 978 -20.995 2.252 -24.649 1.00 0.00 H ATOM 1529 H LYS A 978 -14.363 -3.474 -24.687 1.00 0.00 H ATOM 1530 N ASP A 979 -13.691 -0.245 -26.575 1.00 34.54 N ATOM 1531 CA ASP A 979 -12.508 0.622 -26.450 1.00 34.20 C ATOM 1532 C ASP A 979 -12.796 2.080 -26.081 1.00 36.82 C ATOM 1533 O ASP A 979 -11.884 2.894 -26.132 1.00 38.52 O ATOM 1534 CB ASP A 979 -11.614 0.522 -27.693 1.00 35.75 C ATOM 1535 CG ASP A 979 -10.885 -0.808 -27.843 1.00 45.12 C ATOM 1536 OD1 ASP A 979 -11.042 -1.683 -26.959 1.00 43.17 O ATOM 1537 OD2 ASP A 979 -10.144 -0.967 -28.831 1.00 54.24 O ATOM 1538 H ASP A 979 -14.200 -0.268 -27.482 1.00 0.00 H ATOM 1539 N TYR A 980 -14.020 2.390 -25.652 1.00 32.43 N ATOM 1540 CA TYR A 980 -14.418 3.734 -25.206 1.00 32.45 C ATOM 1541 C TYR A 980 -15.488 3.633 -24.105 1.00 38.83 C ATOM 1542 O TYR A 980 -16.044 2.552 -23.861 1.00 39.98 O ATOM 1543 CB TYR A 980 -14.902 4.585 -26.390 1.00 34.51 C ATOM 1544 CG TYR A 980 -16.206 4.094 -26.997 1.00 37.42 C ATOM 1545 CD1 TYR A 980 -16.221 3.045 -27.918 1.00 40.52 C ATOM 1546 CD2 TYR A 980 -17.422 4.655 -26.626 1.00 39.50 C ATOM 1547 CE1 TYR A 980 -17.422 2.575 -28.463 1.00 42.45 C ATOM 1548 CE2 TYR A 980 -18.628 4.194 -27.157 1.00 41.50 C ATOM 1549 CZ TYR A 980 -18.622 3.160 -28.083 1.00 50.98 C ATOM 1550 OH TYR A 980 -19.813 2.715 -28.598 1.00 52.90 O ATOM 1551 HH TYR A 980 -19.640 1.981 -29.239 1.00 0.00 H ATOM 1552 H TYR A 980 -14.736 1.636 -25.632 1.00 0.00 H ATOM 1553 N TYR A 981 -15.787 4.752 -23.444 1.00 36.01 N ATOM 1554 CA TYR A 981 -16.790 4.798 -22.389 1.00 37.72 C ATOM 1555 C TYR A 981 -17.587 6.080 -22.566 1.00 41.31 C ATOM 1556 O TYR A 981 -17.041 7.079 -23.026 1.00 39.59 O ATOM 1557 CB TYR A 981 -16.122 4.757 -20.978 1.00 40.99 C ATOM 1558 H TYR A 981 -15.283 5.628 -23.692 1.00 0.00 H ATOM 1559 N VAL A 982 -18.880 6.037 -22.257 1.00 39.54 N ATOM 1560 CA VAL A 982 -19.739 7.210 -22.324 1.00 40.86 C ATOM 1561 C VAL A 982 -20.135 7.572 -20.890 1.00 48.70 C ATOM 1562 O VAL A 982 -20.657 6.722 -20.167 1.00 47.11 O ATOM 1563 CB VAL A 982 -20.971 7.027 -23.252 1.00 44.32 C ATOM 1564 CG1 VAL A 982 -21.814 8.296 -23.293 1.00 43.64 C ATOM 1565 CG2 VAL A 982 -20.545 6.620 -24.660 1.00 44.31 C ATOM 1566 H VAL A 982 -19.293 5.131 -21.956 1.00 0.00 H ATOM 1567 N VAL A 983 -19.838 8.816 -20.469 1.00 49.69 N ATOM 1568 CA VAL A 983 -20.200 9.288 -19.128 1.00 51.28 C ATOM 1569 C VAL A 983 -21.597 9.925 -19.190 1.00 57.68 C ATOM 1570 O VAL A 983 -21.940 10.537 -20.205 1.00 57.17 O ATOM 1571 CB VAL A 983 -19.105 10.174 -18.437 1.00 55.98 C ATOM 1572 CG1 VAL A 983 -17.723 9.528 -18.527 1.00 55.65 C ATOM 1573 CG2 VAL A 983 -19.061 11.584 -19.000 1.00 56.36 C ATOM 1574 H VAL A 983 -19.337 9.461 -21.113 1.00 0.00 H ATOM 1575 N ARG A 984 -22.427 9.723 -18.151 1.00 57.40 N ATOM 1576 CA ARG A 984 -23.803 10.249 -18.125 1.00 58.64 C ATOM 1577 C ARG A 984 -23.866 11.781 -18.038 1.00 63.47 C ATOM 1578 O ARG A 984 -24.517 12.422 -18.869 1.00 62.05 O ATOM 1579 CB ARG A 984 -24.612 9.605 -16.984 1.00 60.88 C ATOM 1580 H ARG A 984 -22.085 9.175 -17.336 1.00 0.00 H ATOM 1581 N GLU A 985 -23.177 12.356 -17.041 1.00 61.36 N ATOM 1582 CA GLU A 985 -23.133 13.794 -16.810 1.00 61.94 C ATOM 1583 C GLU A 985 -21.825 14.378 -17.376 1.00 67.02 C ATOM 1584 O GLU A 985 -20.765 13.790 -17.130 1.00 66.55 O ATOM 1585 CB GLU A 985 -23.237 14.081 -15.299 1.00 63.48 C ATOM 1586 CG GLU A 985 -23.841 15.434 -14.966 1.00 75.53 C ATOM 1587 H GLU A 985 -22.643 11.740 -16.395 1.00 0.00 H ATOM 1588 N PRO A 986 -21.856 15.544 -18.084 1.00 64.09 N ATOM 1589 CA PRO A 986 -20.597 16.138 -18.578 1.00 63.57 C ATOM 1590 C PRO A 986 -19.600 16.427 -17.453 1.00 65.21 C ATOM 1591 O PRO A 986 -19.974 16.524 -16.277 1.00 65.19 O ATOM 1592 CB PRO A 986 -21.051 17.429 -19.273 1.00 65.67 C ATOM 1593 CG PRO A 986 -22.501 17.220 -19.571 1.00 70.68 C ATOM 1594 CD PRO A 986 -23.017 16.383 -18.446 1.00 66.03 C ATOM 1595 N GLY A 987 -18.334 16.524 -17.828 1.00 59.18 N ATOM 1596 CA GLY A 987 -17.239 16.745 -16.898 1.00 57.58 C ATOM 1597 C GLY A 987 -17.321 17.996 -16.048 1.00 57.99 C ATOM 1598 O GLY A 987 -17.972 18.978 -16.414 1.00 57.88 O ATOM 1599 H GLY A 987 -18.111 16.438 -18.840 1.00 0.00 H ATOM 1600 N GLN A 988 -16.639 17.949 -14.901 1.00 50.76 N ATOM 1601 CA GLN A 988 -16.541 19.041 -13.949 1.00 47.94 C ATOM 1602 C GLN A 988 -15.135 19.633 -13.980 1.00 45.79 C ATOM 1603 O GLN A 988 -14.830 20.562 -13.225 1.00 45.41 O ATOM 1604 CB GLN A 988 -16.893 18.541 -12.537 1.00 49.52 C ATOM 1605 CG GLN A 988 -18.397 18.440 -12.243 1.00 60.16 C ATOM 1606 CD GLN A 988 -19.156 19.747 -12.374 1.00 75.80 C ATOM 1607 OE1 GLN A 988 -20.308 19.761 -12.815 1.00 73.00 O ATOM 1608 NE2 GLN A 988 -18.538 20.876 -12.015 1.00 63.45 N ATOM 1609 HE22 GLN A 988 -17.566 20.842 -11.645 1.00 0.00 H ATOM 1610 HE21 GLN A 988 -19.029 21.789 -12.105 1.00 0.00 H ATOM 1611 H GLN A 988 -16.141 17.065 -14.673 1.00 0.00 H ATOM 1612 N SER A 989 -14.273 19.094 -14.847 1.00 36.95 N ATOM 1613 CA SER A 989 -12.895 19.583 -14.968 1.00 36.59 C ATOM 1614 C SER A 989 -12.826 20.793 -15.928 1.00 38.93 C ATOM 1615 O SER A 989 -13.690 20.894 -16.794 1.00 35.49 O ATOM 1616 CB SER A 989 -11.986 18.466 -15.479 1.00 40.26 C ATOM 1617 OG SER A 989 -12.157 17.272 -14.733 1.00 49.47 O ATOM 1618 HG SER A 989 -11.555 16.572 -15.090 1.00 0.00 H ATOM 1619 H SER A 989 -14.587 18.308 -15.451 1.00 0.00 H ATOM 1620 N PRO A 990 -11.802 21.690 -15.841 1.00 38.50 N ATOM 1621 CA PRO A 990 -11.696 22.801 -16.827 1.00 37.82 C ATOM 1622 C PRO A 990 -11.753 22.235 -18.242 1.00 41.86 C ATOM 1623 O PRO A 990 -11.074 21.250 -18.535 1.00 42.61 O ATOM 1624 CB PRO A 990 -10.344 23.440 -16.486 1.00 39.30 C ATOM 1625 CG PRO A 990 -10.178 23.155 -15.002 1.00 43.83 C ATOM 1626 CD PRO A 990 -10.680 21.736 -14.876 1.00 39.44 C ATOM 1627 N ILE A 991 -12.651 22.786 -19.085 1.00 35.59 N ATOM 1628 CA ILE A 991 -12.985 22.244 -20.404 1.00 34.57 C ATOM 1629 C ILE A 991 -11.856 22.199 -21.459 1.00 33.95 C ATOM 1630 O ILE A 991 -11.997 21.554 -22.489 1.00 32.32 O ATOM 1631 CB ILE A 991 -14.263 22.949 -20.964 1.00 37.90 C ATOM 1632 CG1 ILE A 991 -13.993 24.454 -21.242 1.00 37.21 C ATOM 1633 CG2 ILE A 991 -15.453 22.738 -19.999 1.00 40.72 C ATOM 1634 CD1 ILE A 991 -15.148 25.197 -21.974 1.00 38.22 C ATOM 1635 H ILE A 991 -13.138 23.652 -18.778 1.00 0.00 H ATOM 1636 N PHE A 992 -10.765 22.909 -21.189 1.00 30.38 N ATOM 1637 CA PHE A 992 -9.664 23.139 -22.135 1.00 28.19 C ATOM 1638 C PHE A 992 -8.730 21.968 -22.413 1.00 30.23 C ATOM 1639 O PHE A 992 -7.823 22.100 -23.253 1.00 28.19 O ATOM 1640 CB PHE A 992 -8.907 24.412 -21.730 1.00 29.08 C ATOM 1641 CG PHE A 992 -9.842 25.568 -21.437 1.00 31.06 C ATOM 1642 CD1 PHE A 992 -10.118 25.944 -20.126 1.00 35.35 C ATOM 1643 CD2 PHE A 992 -10.515 26.217 -22.463 1.00 32.94 C ATOM 1644 CE1 PHE A 992 -11.004 27.004 -19.855 1.00 37.10 C ATOM 1645 CE2 PHE A 992 -11.400 27.271 -22.192 1.00 37.41 C ATOM 1646 CZ PHE A 992 -11.629 27.663 -20.895 1.00 36.56 C ATOM 1647 H PHE A 992 -10.685 23.331 -20.242 1.00 0.00 H ATOM 1648 N TRP A 993 -8.914 20.847 -21.697 1.00 28.00 N ATOM 1649 CA TRP A 993 -8.118 19.641 -21.901 1.00 26.75 C ATOM 1650 C TRP A 993 -8.925 18.538 -22.616 1.00 29.98 C ATOM 1651 O TRP A 993 -8.354 17.506 -22.964 1.00 31.18 O ATOM 1652 CB TRP A 993 -7.610 19.115 -20.538 1.00 25.84 C ATOM 1653 CG TRP A 993 -6.408 19.853 -20.019 1.00 27.13 C ATOM 1654 CD1 TRP A 993 -5.105 19.443 -20.075 1.00 29.07 C ATOM 1655 CD2 TRP A 993 -6.397 21.147 -19.402 1.00 26.83 C ATOM 1656 NE1 TRP A 993 -4.287 20.393 -19.514 1.00 27.28 N ATOM 1657 CE2 TRP A 993 -5.050 21.465 -19.119 1.00 29.18 C ATOM 1658 CE3 TRP A 993 -7.396 22.086 -19.072 1.00 29.17 C ATOM 1659 CZ2 TRP A 993 -4.684 22.640 -18.440 1.00 29.30 C ATOM 1660 CZ3 TRP A 993 -7.016 23.297 -18.492 1.00 30.85 C ATOM 1661 CH2 TRP A 993 -5.681 23.561 -18.180 1.00 31.68 C ATOM 1662 HE1 TRP A 993 -3.256 20.314 -19.406 1.00 0.00 H ATOM 1663 H TRP A 993 -9.654 20.838 -20.967 1.00 0.00 H ATOM 1664 N TYR A 994 -10.255 18.714 -22.752 1.00 28.33 N ATOM 1665 CA TYR A 994 -11.133 17.681 -23.334 1.00 29.26 C ATOM 1666 C TYR A 994 -11.059 17.595 -24.846 1.00 32.27 C ATOM 1667 O TYR A 994 -11.087 18.620 -25.539 1.00 31.60 O ATOM 1668 CB TYR A 994 -12.603 17.939 -22.988 1.00 31.88 C ATOM 1669 CG TYR A 994 -12.999 17.826 -21.531 1.00 36.83 C ATOM 1670 CD1 TYR A 994 -13.652 18.874 -20.886 1.00 40.44 C ATOM 1671 CD2 TYR A 994 -12.779 16.655 -20.815 1.00 37.06 C ATOM 1672 CE1 TYR A 994 -14.097 18.752 -19.571 1.00 43.32 C ATOM 1673 CE2 TYR A 994 -13.231 16.516 -19.502 1.00 38.10 C ATOM 1674 CZ TYR A 994 -13.870 17.576 -18.878 1.00 47.00 C ATOM 1675 OH TYR A 994 -14.281 17.487 -17.570 1.00 48.28 O ATOM 1676 HH TYR A 994 -14.928 16.743 -17.478 1.00 0.00 H ATOM 1677 H TYR A 994 -10.677 19.610 -22.435 1.00 0.00 H ATOM 1678 N ALA A 995 -11.083 16.360 -25.358 1.00 28.65 N ATOM 1679 CA ALA A 995 -11.114 16.071 -26.794 1.00 28.25 C ATOM 1680 C ALA A 995 -12.503 16.501 -27.348 1.00 31.18 C ATOM 1681 O ALA A 995 -13.477 16.524 -26.586 1.00 30.85 O ATOM 1682 CB ALA A 995 -10.916 14.561 -26.999 1.00 28.79 C ATOM 1683 H ALA A 995 -11.079 15.557 -24.698 1.00 0.00 H ATOM 1684 N PRO A 996 -12.624 16.808 -28.658 1.00 30.29 N ATOM 1685 CA PRO A 996 -13.939 17.231 -29.204 1.00 31.79 C ATOM 1686 C PRO A 996 -15.069 16.240 -28.925 1.00 34.34 C ATOM 1687 O PRO A 996 -16.159 16.662 -28.540 1.00 33.73 O ATOM 1688 CB PRO A 996 -13.685 17.374 -30.706 1.00 33.60 C ATOM 1689 CG PRO A 996 -12.220 17.499 -30.850 1.00 37.12 C ATOM 1690 CD PRO A 996 -11.581 16.809 -29.694 1.00 31.32 C ATOM 1691 N GLU A 997 -14.795 14.924 -29.072 1.00 32.85 N ATOM 1692 CA GLU A 997 -15.789 13.878 -28.812 1.00 32.32 C ATOM 1693 C GLU A 997 -16.225 13.803 -27.352 1.00 35.45 C ATOM 1694 O GLU A 997 -17.322 13.323 -27.064 1.00 34.65 O ATOM 1695 CB GLU A 997 -15.341 12.510 -29.358 1.00 34.21 C ATOM 1696 CG GLU A 997 -14.187 11.856 -28.607 1.00 36.35 C ATOM 1697 CD GLU A 997 -12.783 12.256 -29.023 1.00 32.98 C ATOM 1698 OE1 GLU A 997 -11.841 11.540 -28.614 1.00 33.17 O ATOM 1699 OE2 GLU A 997 -12.613 13.242 -29.783 1.00 35.84 O ATOM 1700 H GLU A 997 -13.843 14.643 -29.381 1.00 0.00 H ATOM 1701 N SER A 998 -15.356 14.259 -26.415 1.00 32.34 N ATOM 1702 CA SER A 998 -15.718 14.291 -25.004 1.00 31.72 C ATOM 1703 C SER A 998 -16.632 15.493 -24.788 1.00 35.05 C ATOM 1704 O SER A 998 -17.646 15.381 -24.098 1.00 34.35 O ATOM 1705 CB SER A 998 -14.470 14.393 -24.123 1.00 32.22 C ATOM 1706 OG SER A 998 -13.592 13.317 -24.429 1.00 33.39 O ATOM 1707 HG SER A 998 -14.052 12.458 -24.256 1.00 0.00 H ATOM 1708 H SER A 998 -14.415 14.591 -26.709 1.00 0.00 H ATOM 1709 N LEU A 999 -16.293 16.637 -25.420 1.00 32.01 N ATOM 1710 CA LEU A 999 -17.104 17.851 -25.313 1.00 32.90 C ATOM 1711 C LEU A 999 -18.495 17.646 -25.947 1.00 37.62 C ATOM 1712 O LEU A 999 -19.499 18.066 -25.377 1.00 38.04 O ATOM 1713 CB LEU A 999 -16.435 19.050 -26.013 1.00 32.14 C ATOM 1714 CG LEU A 999 -15.163 19.636 -25.397 1.00 35.31 C ATOM 1715 CD1 LEU A 999 -14.561 20.660 -26.335 1.00 35.58 C ATOM 1716 CD2 LEU A 999 -15.429 20.272 -24.022 1.00 37.78 C ATOM 1717 H LEU A 999 -15.430 16.656 -26.000 1.00 0.00 H ATOM 1718 N SER A1000 -18.539 17.029 -27.116 1.00 38.37 N ATOM 1719 CA SER A1000 -19.803 16.868 -27.849 1.00 39.14 C ATOM 1720 C SER A1000 -20.651 15.729 -27.349 1.00 44.97 C ATOM 1721 O SER A1000 -21.864 15.899 -27.163 1.00 44.41 O ATOM 1722 CB SER A1000 -19.538 16.707 -29.342 1.00 42.46 C ATOM 1723 OG SER A1000 -18.751 15.555 -29.603 1.00 49.07 O ATOM 1724 HG SER A1000 -17.883 15.637 -29.135 1.00 0.00 H ATOM 1725 H SER A1000 -17.661 16.650 -27.525 1.00 0.00 H ATOM 1726 N ASP A1001 -20.022 14.557 -27.123 1.00 41.96 N ATOM 1727 CA ASP A1001 -20.767 13.345 -26.789 1.00 41.41 C ATOM 1728 C ASP A1001 -20.432 12.619 -25.494 1.00 42.61 C ATOM 1729 O ASP A1001 -20.936 11.516 -25.294 1.00 41.72 O ATOM 1730 CB ASP A1001 -20.702 12.389 -27.989 1.00 43.12 C ATOM 1731 CG ASP A1001 -21.383 12.965 -29.217 1.00 52.95 C ATOM 1732 OD1 ASP A1001 -22.614 13.182 -29.166 1.00 55.12 O ATOM 1733 OD2 ASP A1001 -20.678 13.251 -30.202 1.00 56.49 O ATOM 1734 H ASP A1001 -18.985 14.515 -27.188 1.00 0.00 H ATOM 1735 N ASN A1002 -19.577 13.214 -24.617 1.00 37.70 N ATOM 1736 CA ASN A1002 -19.157 12.610 -23.341 1.00 36.36 C ATOM 1737 C ASN A1002 -18.456 11.279 -23.534 1.00 36.59 C ATOM 1738 O ASN A1002 -18.493 10.429 -22.648 1.00 37.19 O ATOM 1739 CB ASN A1002 -20.321 12.514 -22.327 1.00 40.91 C ATOM 1740 CG ASN A1002 -20.973 13.835 -22.011 1.00 54.93 C ATOM 1741 OD1 ASN A1002 -20.344 14.896 -22.050 1.00 45.71 O ATOM 1742 ND2 ASN A1002 -22.238 13.789 -21.639 1.00 51.49 N ATOM 1743 HD22 ASN A1002 -22.741 12.879 -21.617 1.00 0.00 H ATOM 1744 HD21 ASN A1002 -22.732 14.663 -21.368 1.00 0.00 H ATOM 1745 H ASN A1002 -19.198 14.151 -24.863 1.00 0.00 H ATOM 1746 N ILE A1003 -17.794 11.112 -24.685 1.00 32.45 N ATOM 1747 CA ILE A1003 -17.061 9.890 -25.007 1.00 32.61 C ATOM 1748 C ILE A1003 -15.623 10.017 -24.523 1.00 34.63 C ATOM 1749 O ILE A1003 -14.929 10.980 -24.873 1.00 33.14 O ATOM 1750 CB ILE A1003 -17.081 9.595 -26.538 1.00 35.54 C ATOM 1751 CG1 ILE A1003 -18.498 9.279 -27.024 1.00 36.36 C ATOM 1752 CG2 ILE A1003 -16.104 8.439 -26.913 1.00 36.04 C ATOM 1753 CD1 ILE A1003 -18.640 9.391 -28.542 1.00 40.97 C ATOM 1754 H ILE A1003 -17.802 11.885 -25.380 1.00 0.00 H ATOM 1755 N PHE A1004 -15.158 9.015 -23.791 1.00 30.53 N ATOM 1756 CA PHE A1004 -13.776 8.965 -23.335 1.00 29.96 C ATOM 1757 C PHE A1004 -13.117 7.670 -23.769 1.00 33.88 C ATOM 1758 O PHE A1004 -13.765 6.629 -23.797 1.00 34.86 O ATOM 1759 CB PHE A1004 -13.685 9.156 -21.822 1.00 30.89 C ATOM 1760 CG PHE A1004 -14.104 10.547 -21.399 1.00 31.01 C ATOM 1761 CD1 PHE A1004 -15.438 10.842 -21.144 1.00 32.66 C ATOM 1762 CD2 PHE A1004 -13.163 11.565 -21.263 1.00 32.72 C ATOM 1763 CE1 PHE A1004 -15.822 12.132 -20.743 1.00 34.48 C ATOM 1764 CE2 PHE A1004 -13.550 12.849 -20.856 1.00 33.24 C ATOM 1765 CZ PHE A1004 -14.873 13.121 -20.606 1.00 31.68 C ATOM 1766 H PHE A1004 -15.801 8.239 -23.534 1.00 0.00 H ATOM 1767 N SER A1005 -11.827 7.724 -24.065 1.00 29.62 N ATOM 1768 CA SER A1005 -11.058 6.571 -24.553 1.00 29.93 C ATOM 1769 C SER A1005 -9.566 6.841 -24.369 1.00 32.05 C ATOM 1770 O SER A1005 -9.193 7.946 -23.965 1.00 28.82 O ATOM 1771 CB SER A1005 -11.358 6.363 -26.042 1.00 29.72 C ATOM 1772 OG SER A1005 -10.815 7.444 -26.791 1.00 31.93 O ATOM 1773 HG SER A1005 -11.224 8.293 -26.487 1.00 0.00 H ATOM 1774 H SER A1005 -11.332 8.631 -23.946 1.00 0.00 H ATOM 1775 N ARG A1006 -8.707 5.873 -24.731 1.00 28.97 N ATOM 1776 CA ARG A1006 -7.258 6.089 -24.704 1.00 28.43 C ATOM 1777 C ARG A1006 -6.862 7.164 -25.711 1.00 31.16 C ATOM 1778 O ARG A1006 -5.864 7.850 -25.510 1.00 29.64 O ATOM 1779 CB ARG A1006 -6.500 4.778 -24.935 1.00 31.32 C ATOM 1780 CG ARG A1006 -6.707 3.850 -23.718 1.00 29.67 C ATOM 1781 CD ARG A1006 -6.261 2.433 -24.017 1.00 35.99 C ATOM 1782 NE ARG A1006 -7.155 1.794 -24.979 1.00 37.51 N ATOM 1783 CZ ARG A1006 -7.104 0.512 -25.302 1.00 45.94 C ATOM 1784 NH1 ARG A1006 -6.213 -0.286 -24.729 1.00 36.89 N ATOM 1785 NH2 ARG A1006 -7.933 0.019 -26.207 1.00 39.83 N ATOM 1786 HE ARG A1006 -7.877 2.384 -25.439 1.00 0.00 H ATOM 1787 HH12 ARG A1006 -6.176 -1.293 -24.986 1.00 0.00 H ATOM 1788 HH11 ARG A1006 -5.551 0.095 -24.023 1.00 0.00 H ATOM 1789 HH22 ARG A1006 -7.889 -0.989 -26.458 1.00 0.00 H ATOM 1790 HH21 ARG A1006 -8.629 0.640 -26.668 1.00 0.00 H ATOM 1791 H ARG A1006 -9.079 4.951 -25.037 1.00 0.00 H ATOM 1792 N GLN A1007 -7.687 7.348 -26.770 1.00 29.90 N ATOM 1793 CA GLN A1007 -7.480 8.355 -27.808 1.00 29.42 C ATOM 1794 C GLN A1007 -7.819 9.764 -27.335 1.00 30.54 C ATOM 1795 O GLN A1007 -7.191 10.735 -27.800 1.00 30.07 O ATOM 1796 CB GLN A1007 -8.274 7.986 -29.076 1.00 31.21 C ATOM 1797 CG GLN A1007 -7.707 6.725 -29.770 1.00 32.24 C ATOM 1798 CD GLN A1007 -8.082 5.402 -29.120 1.00 53.33 C ATOM 1799 OE1 GLN A1007 -9.112 5.259 -28.460 1.00 45.29 O ATOM 1800 NE2 GLN A1007 -7.238 4.394 -29.280 1.00 57.03 N ATOM 1801 HE22 GLN A1007 -6.371 4.525 -29.839 1.00 0.00 H ATOM 1802 HE21 GLN A1007 -7.442 3.471 -28.846 1.00 0.00 H ATOM 1803 H GLN A1007 -8.522 6.733 -26.849 1.00 0.00 H ATOM 1804 N SER A1008 -8.787 9.895 -26.410 1.00 27.68 N ATOM 1805 CA SER A1008 -9.074 11.214 -25.837 1.00 26.61 C ATOM 1806 C SER A1008 -7.952 11.560 -24.827 1.00 30.23 C ATOM 1807 O SER A1008 -7.636 12.740 -24.642 1.00 27.63 O ATOM 1808 CB SER A1008 -10.479 11.282 -25.230 1.00 28.08 C ATOM 1809 OG SER A1008 -10.696 10.409 -24.131 1.00 30.52 O ATOM 1810 HG SER A1008 -10.060 10.630 -23.405 1.00 0.00 H ATOM 1811 H SER A1008 -9.330 9.063 -26.102 1.00 0.00 H ATOM 1812 N ASP A1009 -7.300 10.514 -24.219 1.00 25.86 N ATOM 1813 CA ASP A1009 -6.142 10.749 -23.344 1.00 25.34 C ATOM 1814 C ASP A1009 -4.974 11.254 -24.197 1.00 26.68 C ATOM 1815 O ASP A1009 -4.241 12.143 -23.744 1.00 24.45 O ATOM 1816 CB ASP A1009 -5.748 9.476 -22.568 1.00 26.35 C ATOM 1817 CG ASP A1009 -6.479 9.205 -21.240 1.00 29.58 C ATOM 1818 OD1 ASP A1009 -6.310 8.098 -20.687 1.00 29.31 O ATOM 1819 OD2 ASP A1009 -7.254 10.075 -20.779 1.00 28.18 O ATOM 1820 H ASP A1009 -7.631 9.541 -24.380 1.00 0.00 H ATOM 1821 N VAL A1010 -4.830 10.767 -25.468 1.00 23.34 N ATOM 1822 CA VAL A1010 -3.799 11.305 -26.386 1.00 22.88 C ATOM 1823 C VAL A1010 -4.076 12.802 -26.651 1.00 25.08 C ATOM 1824 O VAL A1010 -3.132 13.585 -26.667 1.00 26.39 O ATOM 1825 CB VAL A1010 -3.721 10.514 -27.717 1.00 28.11 C ATOM 1826 CG1 VAL A1010 -2.808 11.216 -28.736 1.00 28.44 C ATOM 1827 CG2 VAL A1010 -3.231 9.089 -27.450 1.00 29.21 C ATOM 1828 H VAL A1010 -5.457 10.004 -25.796 1.00 0.00 H ATOM 1829 N TRP A1011 -5.338 13.186 -26.866 1.00 24.43 N ATOM 1830 CA TRP A1011 -5.673 14.614 -27.102 1.00 24.78 C ATOM 1831 C TRP A1011 -5.199 15.444 -25.879 1.00 27.77 C ATOM 1832 O TRP A1011 -4.458 16.439 -26.034 1.00 25.64 O ATOM 1833 CB TRP A1011 -7.170 14.803 -27.347 1.00 24.11 C ATOM 1834 CG TRP A1011 -7.583 16.258 -27.423 1.00 25.84 C ATOM 1835 CD1 TRP A1011 -7.690 17.149 -26.390 1.00 28.71 C ATOM 1836 CD2 TRP A1011 -7.915 16.983 -28.615 1.00 26.45 C ATOM 1837 NE1 TRP A1011 -8.077 18.391 -26.869 1.00 28.41 N ATOM 1838 CE2 TRP A1011 -8.243 18.307 -28.230 1.00 28.80 C ATOM 1839 CE3 TRP A1011 -8.034 16.621 -29.971 1.00 28.42 C ATOM 1840 CZ2 TRP A1011 -8.632 19.282 -29.157 1.00 28.78 C ATOM 1841 CZ3 TRP A1011 -8.471 17.577 -30.883 1.00 30.18 C ATOM 1842 CH2 TRP A1011 -8.725 18.900 -30.482 1.00 30.07 C ATOM 1843 HE1 TRP A1011 -8.218 19.245 -26.293 1.00 0.00 H ATOM 1844 H TRP A1011 -6.097 12.475 -26.868 1.00 0.00 H ATOM 1845 N SER A1012 -5.588 14.996 -24.680 1.00 23.79 N ATOM 1846 CA SER A1012 -5.176 15.634 -23.420 1.00 22.82 C ATOM 1847 C SER A1012 -3.666 15.722 -23.291 1.00 25.52 C ATOM 1848 O SER A1012 -3.159 16.737 -22.826 1.00 25.08 O ATOM 1849 CB SER A1012 -5.786 14.936 -22.213 1.00 23.55 C ATOM 1850 OG SER A1012 -7.193 15.112 -22.279 1.00 28.02 O ATOM 1851 HG SER A1012 -7.405 16.079 -22.262 1.00 0.00 H ATOM 1852 H SER A1012 -6.208 14.162 -24.637 1.00 0.00 H ATOM 1853 N PHE A1013 -2.940 14.680 -23.726 1.00 22.98 N ATOM 1854 CA PHE A1013 -1.475 14.673 -23.704 1.00 23.80 C ATOM 1855 C PHE A1013 -0.923 15.786 -24.613 1.00 27.51 C ATOM 1856 O PHE A1013 0.095 16.414 -24.283 1.00 24.63 O ATOM 1857 CB PHE A1013 -0.912 13.289 -24.103 1.00 25.86 C ATOM 1858 CG PHE A1013 0.605 13.222 -24.136 1.00 26.83 C ATOM 1859 CD1 PHE A1013 1.342 13.192 -22.956 1.00 28.50 C ATOM 1860 CD2 PHE A1013 1.291 13.234 -25.349 1.00 27.95 C ATOM 1861 CE1 PHE A1013 2.741 13.159 -22.986 1.00 30.31 C ATOM 1862 CE2 PHE A1013 2.692 13.214 -25.381 1.00 30.16 C ATOM 1863 CZ PHE A1013 3.409 13.174 -24.197 1.00 29.28 C ATOM 1864 H PHE A1013 -3.438 13.844 -24.093 1.00 0.00 H ATOM 1865 N GLY A1014 -1.622 16.076 -25.725 1.00 25.08 N ATOM 1866 CA GLY A1014 -1.192 17.174 -26.595 1.00 24.39 C ATOM 1867 C GLY A1014 -1.287 18.497 -25.851 1.00 24.59 C ATOM 1868 O GLY A1014 -0.413 19.364 -25.983 1.00 24.40 O ATOM 1869 H GLY A1014 -2.468 15.521 -25.967 1.00 0.00 H ATOM 1870 N VAL A1015 -2.304 18.616 -24.995 1.00 22.88 N ATOM 1871 CA VAL A1015 -2.454 19.823 -24.148 1.00 22.71 C ATOM 1872 C VAL A1015 -1.341 19.841 -23.079 1.00 25.84 C ATOM 1873 O VAL A1015 -0.782 20.892 -22.807 1.00 25.70 O ATOM 1874 CB VAL A1015 -3.858 19.984 -23.550 1.00 25.59 C ATOM 1875 CG1 VAL A1015 -3.963 21.329 -22.812 1.00 25.08 C ATOM 1876 CG2 VAL A1015 -4.910 19.907 -24.655 1.00 23.90 C ATOM 1877 H VAL A1015 -3.003 17.849 -24.921 1.00 0.00 H ATOM 1878 N VAL A1016 -0.978 18.669 -22.518 1.00 23.57 N ATOM 1879 CA VAL A1016 0.150 18.590 -21.567 1.00 22.71 C ATOM 1880 C VAL A1016 1.477 19.003 -22.251 1.00 25.13 C ATOM 1881 O VAL A1016 2.274 19.721 -21.631 1.00 23.98 O ATOM 1882 CB VAL A1016 0.214 17.178 -20.928 1.00 25.99 C ATOM 1883 CG1 VAL A1016 1.492 16.993 -20.091 1.00 26.61 C ATOM 1884 CG2 VAL A1016 -1.026 16.964 -20.055 1.00 24.96 C ATOM 1885 H VAL A1016 -1.502 17.804 -22.760 1.00 0.00 H ATOM 1886 N LEU A1017 1.704 18.592 -23.525 1.00 24.59 N ATOM 1887 CA LEU A1017 2.928 19.007 -24.260 1.00 24.66 C ATOM 1888 C LEU A1017 2.938 20.553 -24.369 1.00 26.84 C ATOM 1889 O LEU A1017 3.958 21.208 -24.120 1.00 26.28 O ATOM 1890 CB LEU A1017 2.919 18.427 -25.675 1.00 24.74 C ATOM 1891 CG LEU A1017 3.130 16.955 -25.791 1.00 30.14 C ATOM 1892 CD1 LEU A1017 3.193 16.564 -27.241 1.00 31.40 C ATOM 1893 CD2 LEU A1017 4.455 16.539 -25.127 1.00 34.18 C ATOM 1894 H LEU A1017 1.010 17.976 -23.995 1.00 0.00 H ATOM 1895 N TYR A1018 1.783 21.123 -24.688 1.00 24.81 N ATOM 1896 CA TYR A1018 1.623 22.590 -24.727 1.00 24.70 C ATOM 1897 C TYR A1018 1.959 23.223 -23.372 1.00 25.50 C ATOM 1898 O TYR A1018 2.694 24.215 -23.328 1.00 27.25 O ATOM 1899 CB TYR A1018 0.193 22.923 -25.155 1.00 25.36 C ATOM 1900 CG TYR A1018 -0.062 24.408 -25.189 1.00 24.74 C ATOM 1901 CD1 TYR A1018 0.102 25.135 -26.367 1.00 25.25 C ATOM 1902 CD2 TYR A1018 -0.481 25.092 -24.040 1.00 25.22 C ATOM 1903 CE1 TYR A1018 -0.130 26.511 -26.401 1.00 25.46 C ATOM 1904 CE2 TYR A1018 -0.700 26.466 -24.058 1.00 26.34 C ATOM 1905 CZ TYR A1018 -0.528 27.170 -25.246 1.00 29.50 C ATOM 1906 OH TYR A1018 -0.736 28.530 -25.297 1.00 29.30 O ATOM 1907 HH TYR A1018 -0.118 28.981 -24.668 1.00 0.00 H ATOM 1908 H TYR A1018 0.968 20.519 -24.917 1.00 0.00 H ATOM 1909 N GLU A1019 1.432 22.657 -22.262 1.00 23.70 N ATOM 1910 CA GLU A1019 1.712 23.145 -20.918 1.00 24.58 C ATOM 1911 C GLU A1019 3.197 23.079 -20.637 1.00 28.26 C ATOM 1912 O GLU A1019 3.756 24.035 -20.114 1.00 29.24 O ATOM 1913 CB GLU A1019 0.959 22.317 -19.859 1.00 25.92 C ATOM 1914 CG GLU A1019 -0.532 22.534 -19.892 1.00 28.56 C ATOM 1915 CD GLU A1019 -1.169 21.873 -18.681 1.00 33.77 C ATOM 1916 OE1 GLU A1019 -1.320 22.569 -17.648 1.00 32.14 O ATOM 1917 OE2 GLU A1019 -1.465 20.657 -18.748 1.00 28.74 O ATOM 1918 H GLU A1019 0.800 21.839 -22.373 1.00 0.00 H ATOM 1919 N LEU A1020 3.839 21.954 -20.960 1.00 25.00 N ATOM 1920 CA LEU A1020 5.285 21.812 -20.733 1.00 24.30 C ATOM 1921 C LEU A1020 6.061 22.903 -21.483 1.00 27.91 C ATOM 1922 O LEU A1020 6.923 23.559 -20.899 1.00 25.52 O ATOM 1923 CB LEU A1020 5.776 20.436 -21.220 1.00 25.24 C ATOM 1924 CG LEU A1020 5.549 19.255 -20.236 1.00 29.77 C ATOM 1925 CD1 LEU A1020 5.521 17.917 -20.992 1.00 29.68 C ATOM 1926 CD2 LEU A1020 6.649 19.168 -19.198 1.00 35.16 C ATOM 1927 H LEU A1020 3.307 21.165 -21.379 1.00 0.00 H ATOM 1928 N PHE A1021 5.725 23.095 -22.763 1.00 24.61 N ATOM 1929 CA PHE A1021 6.451 24.030 -23.607 1.00 25.69 C ATOM 1930 C PHE A1021 6.185 25.519 -23.355 1.00 29.33 C ATOM 1931 O PHE A1021 6.925 26.368 -23.863 1.00 28.55 O ATOM 1932 CB PHE A1021 6.482 23.570 -25.073 1.00 26.79 C ATOM 1933 CG PHE A1021 7.503 22.458 -25.244 1.00 28.24 C ATOM 1934 CD1 PHE A1021 7.172 21.135 -24.959 1.00 30.76 C ATOM 1935 CD2 PHE A1021 8.827 22.749 -25.569 1.00 31.84 C ATOM 1936 CE1 PHE A1021 8.138 20.121 -25.024 1.00 31.22 C ATOM 1937 CE2 PHE A1021 9.791 21.732 -25.642 1.00 34.35 C ATOM 1938 CZ PHE A1021 9.440 20.426 -25.355 1.00 31.67 C ATOM 1939 H PHE A1021 4.926 22.563 -23.164 1.00 0.00 H ATOM 1940 N THR A1022 5.149 25.823 -22.563 1.00 26.33 N ATOM 1941 CA THR A1022 4.835 27.190 -22.078 1.00 25.76 C ATOM 1942 C THR A1022 5.308 27.350 -20.622 1.00 29.53 C ATOM 1943 O THR A1022 5.100 28.412 -20.017 1.00 29.67 O ATOM 1944 CB THR A1022 3.341 27.510 -22.178 1.00 29.95 C ATOM 1945 OG1 THR A1022 2.534 26.578 -21.413 1.00 27.82 O ATOM 1946 CG2 THR A1022 2.838 27.585 -23.629 1.00 28.15 C ATOM 1947 HG1 THR A1022 1.578 26.819 -21.504 1.00 0.00 H ATOM 1948 H THR A1022 4.521 25.048 -22.268 1.00 0.00 H ATOM 1949 N TYR A1023 5.898 26.272 -20.029 1.00 28.19 N ATOM 1950 CA TYR A1023 6.291 26.219 -18.607 1.00 27.61 C ATOM 1951 C TYR A1023 5.116 26.569 -17.727 1.00 28.68 C ATOM 1952 O TYR A1023 5.286 27.182 -16.666 1.00 30.31 O ATOM 1953 CB TYR A1023 7.470 27.142 -18.267 1.00 29.67 C ATOM 1954 CG TYR A1023 8.744 26.733 -18.937 1.00 32.25 C ATOM 1955 CD1 TYR A1023 9.060 27.193 -20.209 1.00 34.42 C ATOM 1956 CD2 TYR A1023 9.657 25.899 -18.293 1.00 32.76 C ATOM 1957 CE1 TYR A1023 10.237 26.811 -20.842 1.00 34.13 C ATOM 1958 CE2 TYR A1023 10.843 25.517 -18.913 1.00 32.08 C ATOM 1959 CZ TYR A1023 11.128 25.980 -20.186 1.00 39.92 C ATOM 1960 OH TYR A1023 12.270 25.596 -20.832 1.00 43.89 O ATOM 1961 HH TYR A1023 13.058 25.875 -20.301 1.00 0.00 H ATOM 1962 H TYR A1023 6.083 25.434 -20.616 1.00 0.00 H ATOM 1963 N CYS A1024 3.908 26.207 -18.176 1.00 24.98 N ATOM 1964 CA CYS A1024 2.661 26.502 -17.467 1.00 25.95 C ATOM 1965 C CYS A1024 2.452 27.987 -17.145 1.00 31.20 C ATOM 1966 O CYS A1024 1.806 28.328 -16.151 1.00 30.02 O ATOM 1967 CB CYS A1024 2.487 25.612 -16.246 1.00 25.80 C ATOM 1968 SG CYS A1024 2.174 23.892 -16.686 1.00 28.73 S ATOM 1969 H CYS A1024 3.852 25.689 -19.076 1.00 0.00 H ATOM 1970 N ASP A1025 2.930 28.864 -18.060 1.00 29.15 N ATOM 1971 CA ASP A1025 2.759 30.309 -17.888 1.00 28.73 C ATOM 1972 C ASP A1025 1.289 30.593 -17.916 1.00 30.62 C ATOM 1973 O ASP A1025 0.603 30.127 -18.815 1.00 32.09 O ATOM 1974 CB ASP A1025 3.502 31.065 -19.006 1.00 30.46 C ATOM 1975 CG ASP A1025 3.648 32.531 -18.675 1.00 45.02 C ATOM 1976 OD1 ASP A1025 4.801 32.980 -18.465 1.00 45.77 O ATOM 1977 OD2 ASP A1025 2.613 33.193 -18.491 1.00 46.42 O ATOM 1978 H ASP A1025 3.427 28.505 -18.900 1.00 0.00 H ATOM 1979 N LYS A1026 0.770 31.317 -16.892 1.00 28.65 N ATOM 1980 CA LYS A1026 -0.666 31.602 -16.831 1.00 29.37 C ATOM 1981 C LYS A1026 -1.150 32.483 -17.968 1.00 32.46 C ATOM 1982 O LYS A1026 -2.289 32.342 -18.387 1.00 32.57 O ATOM 1983 CB LYS A1026 -1.043 32.220 -15.469 1.00 32.04 C ATOM 1984 CG LYS A1026 -0.716 31.290 -14.297 1.00 52.61 C ATOM 1985 CD LYS A1026 -0.775 31.997 -12.938 1.00 62.76 C ATOM 1986 CE LYS A1026 -0.305 31.112 -11.806 1.00 67.27 C ATOM 1987 NZ LYS A1026 1.180 31.068 -11.708 1.00 78.01 N ATOM 1988 HZ1 LYS A1026 1.574 30.696 -12.596 1.00 0.00 H ATOM 1989 HZ2 LYS A1026 1.544 32.028 -11.542 1.00 0.00 H ATOM 1990 HZ3 LYS A1026 1.456 30.450 -10.919 1.00 0.00 H ATOM 1991 H LYS A1026 1.398 31.673 -16.143 1.00 0.00 H ATOM 1992 N SER A1027 -0.289 33.341 -18.520 1.00 30.85 N ATOM 1993 CA SER A1027 -0.721 34.249 -19.583 1.00 30.37 C ATOM 1994 C SER A1027 -1.045 33.568 -20.902 1.00 34.94 C ATOM 1995 O SER A1027 -1.889 34.070 -21.657 1.00 34.25 O ATOM 1996 CB SER A1027 0.272 35.387 -19.782 1.00 31.20 C ATOM 1997 OG SER A1027 1.534 34.921 -20.226 1.00 35.30 O ATOM 1998 HG SER A1027 1.909 34.297 -19.555 1.00 0.00 H ATOM 1999 H SER A1027 0.698 33.364 -18.192 1.00 0.00 H ATOM 2000 N CYS A1028 -0.392 32.429 -21.182 1.00 31.96 N ATOM 2001 CA CYS A1028 -0.681 31.700 -22.413 1.00 32.33 C ATOM 2002 C CYS A1028 -1.193 30.306 -22.080 1.00 34.14 C ATOM 2003 O CYS A1028 -1.032 29.400 -22.874 1.00 33.01 O ATOM 2004 CB CYS A1028 0.536 31.654 -23.335 1.00 33.01 C ATOM 2005 SG CYS A1028 2.008 30.944 -22.569 1.00 36.76 S ATOM 2006 H CYS A1028 0.322 32.065 -20.520 1.00 0.00 H ATOM 2007 N SER A1029 -1.815 30.132 -20.919 1.00 29.17 N ATOM 2008 CA SER A1029 -2.309 28.837 -20.476 1.00 28.46 C ATOM 2009 C SER A1029 -3.470 28.383 -21.357 1.00 31.25 C ATOM 2010 O SER A1029 -4.100 29.207 -22.028 1.00 33.28 O ATOM 2011 CB SER A1029 -2.775 28.925 -19.021 1.00 33.55 C ATOM 2012 OG SER A1029 -3.970 29.683 -18.945 1.00 38.75 O ATOM 2013 HG SER A1029 -4.266 29.736 -18.002 1.00 0.00 H ATOM 2014 H SER A1029 -1.955 30.956 -20.301 1.00 0.00 H ATOM 2015 N PRO A1030 -3.781 27.075 -21.377 1.00 28.66 N ATOM 2016 CA PRO A1030 -4.904 26.600 -22.193 1.00 28.42 C ATOM 2017 C PRO A1030 -6.185 27.394 -21.953 1.00 34.27 C ATOM 2018 O PRO A1030 -6.798 27.805 -22.926 1.00 32.70 O ATOM 2019 CB PRO A1030 -5.005 25.122 -21.801 1.00 29.03 C ATOM 2020 CG PRO A1030 -3.590 24.758 -21.544 1.00 32.65 C ATOM 2021 CD PRO A1030 -3.100 25.940 -20.721 1.00 28.47 C ATOM 2022 N SER A1031 -6.524 27.712 -20.683 1.00 31.64 N ATOM 2023 CA SER A1031 -7.723 28.529 -20.420 1.00 32.57 C ATOM 2024 C SER A1031 -7.605 29.953 -20.966 1.00 36.00 C ATOM 2025 O SER A1031 -8.493 30.411 -21.673 1.00 37.22 O ATOM 2026 CB SER A1031 -8.049 28.568 -18.920 1.00 35.98 C ATOM 2027 OG SER A1031 -7.022 29.174 -18.155 1.00 41.78 O ATOM 2028 HG SER A1031 -6.181 28.664 -18.271 1.00 0.00 H ATOM 2029 H SER A1031 -5.938 27.380 -19.891 1.00 0.00 H ATOM 2030 N ALA A1032 -6.499 30.642 -20.668 1.00 33.28 N ATOM 2031 CA ALA A1032 -6.307 32.032 -21.087 1.00 32.77 C ATOM 2032 C ALA A1032 -6.295 32.156 -22.601 1.00 34.41 C ATOM 2033 O ALA A1032 -6.983 33.015 -23.151 1.00 33.52 O ATOM 2034 CB ALA A1032 -5.011 32.581 -20.503 1.00 33.36 C ATOM 2035 H ALA A1032 -5.749 30.175 -20.120 1.00 0.00 H ATOM 2036 N GLU A1033 -5.569 31.257 -23.276 1.00 30.64 N ATOM 2037 CA GLU A1033 -5.472 31.333 -24.719 1.00 30.34 C ATOM 2038 C GLU A1033 -6.741 30.934 -25.454 1.00 32.02 C ATOM 2039 O GLU A1033 -7.160 31.632 -26.377 1.00 32.64 O ATOM 2040 CB GLU A1033 -4.215 30.615 -25.235 1.00 31.81 C ATOM 2041 CG GLU A1033 -3.897 30.858 -26.698 1.00 34.06 C ATOM 2042 CD GLU A1033 -3.854 32.282 -27.231 1.00 36.64 C ATOM 2043 OE1 GLU A1033 -3.577 33.227 -26.460 1.00 35.81 O ATOM 2044 OE2 GLU A1033 -4.142 32.449 -28.436 1.00 39.15 O ATOM 2045 H GLU A1033 -5.073 30.501 -22.762 1.00 0.00 H ATOM 2046 N PHE A1034 -7.371 29.821 -25.054 1.00 29.29 N ATOM 2047 CA PHE A1034 -8.624 29.449 -25.696 1.00 28.79 C ATOM 2048 C PHE A1034 -9.698 30.526 -25.449 1.00 31.00 C ATOM 2049 O PHE A1034 -10.421 30.852 -26.382 1.00 31.13 O ATOM 2050 CB PHE A1034 -9.125 28.081 -25.218 1.00 30.12 C ATOM 2051 CG PHE A1034 -8.601 26.888 -25.999 1.00 29.39 C ATOM 2052 CD1 PHE A1034 -8.657 26.863 -27.390 1.00 30.84 C ATOM 2053 CD2 PHE A1034 -8.104 25.772 -25.340 1.00 29.98 C ATOM 2054 CE1 PHE A1034 -8.171 25.755 -28.110 1.00 31.69 C ATOM 2055 CE2 PHE A1034 -7.663 24.657 -26.055 1.00 32.22 C ATOM 2056 CZ PHE A1034 -7.710 24.647 -27.430 1.00 30.43 C ATOM 2057 H PHE A1034 -6.971 29.232 -24.296 1.00 0.00 H ATOM 2058 N LEU A1035 -9.807 31.072 -24.219 1.00 30.39 N ATOM 2059 CA LEU A1035 -10.837 32.124 -23.965 1.00 32.00 C ATOM 2060 C LEU A1035 -10.579 33.357 -24.829 1.00 35.24 C ATOM 2061 O LEU A1035 -11.514 33.951 -25.378 1.00 35.66 O ATOM 2062 CB LEU A1035 -10.911 32.522 -22.487 1.00 32.85 C ATOM 2063 CG LEU A1035 -11.523 31.502 -21.519 1.00 37.78 C ATOM 2064 CD1 LEU A1035 -11.148 31.858 -20.071 1.00 38.03 C ATOM 2065 CD2 LEU A1035 -13.058 31.420 -21.658 1.00 38.66 C ATOM 2066 H LEU A1035 -9.177 30.762 -23.452 1.00 0.00 H ATOM 2067 N ARG A1036 -9.303 33.696 -25.019 1.00 32.91 N ATOM 2068 CA ARG A1036 -8.922 34.825 -25.880 1.00 32.78 C ATOM 2069 C ARG A1036 -9.319 34.561 -27.341 1.00 35.85 C ATOM 2070 O ARG A1036 -9.850 35.449 -28.015 1.00 36.06 O ATOM 2071 CB ARG A1036 -7.420 35.102 -25.726 1.00 32.03 C ATOM 2072 CG ARG A1036 -6.975 36.397 -26.400 1.00 35.65 C ATOM 2073 CD ARG A1036 -5.462 36.444 -26.542 1.00 36.16 C ATOM 2074 NE ARG A1036 -4.983 35.501 -27.560 1.00 32.78 N ATOM 2075 CZ ARG A1036 -4.997 35.737 -28.871 1.00 40.44 C ATOM 2076 NH1 ARG A1036 -4.549 34.823 -29.719 1.00 35.57 N ATOM 2077 NH2 ARG A1036 -5.440 36.899 -29.342 1.00 31.53 N ATOM 2078 HE ARG A1036 -4.607 34.587 -27.236 1.00 0.00 H ATOM 2079 HH12 ARG A1036 -4.562 35.012 -30.742 1.00 0.00 H ATOM 2080 HH11 ARG A1036 -4.184 33.917 -29.362 1.00 0.00 H ATOM 2081 HH22 ARG A1036 -5.448 37.076 -30.367 1.00 0.00 H ATOM 2082 HH21 ARG A1036 -5.779 37.631 -28.686 1.00 0.00 H ATOM 2083 H ARG A1036 -8.558 33.147 -24.545 1.00 0.00 H ATOM 2084 N MET A1037 -9.087 33.334 -27.834 1.00 31.21 N ATOM 2085 CA MET A1037 -9.449 32.953 -29.194 1.00 31.27 C ATOM 2086 C MET A1037 -10.972 32.833 -29.382 1.00 38.23 C ATOM 2087 O MET A1037 -11.458 33.034 -30.499 1.00 39.61 O ATOM 2088 CB MET A1037 -8.815 31.589 -29.567 1.00 33.34 C ATOM 2089 CG MET A1037 -7.308 31.593 -29.636 1.00 36.29 C ATOM 2090 SD MET A1037 -6.648 29.884 -29.669 1.00 40.50 S ATOM 2091 CE MET A1037 -7.131 29.391 -31.374 1.00 38.08 C ATOM 2092 H MET A1037 -8.631 32.628 -27.222 1.00 0.00 H ATOM 2093 N MET A1038 -11.709 32.451 -28.306 1.00 36.00 N ATOM 2094 CA MET A1038 -13.160 32.198 -28.306 1.00 39.68 C ATOM 2095 C MET A1038 -14.000 33.455 -28.550 1.00 65.12 C ATOM 2096 O MET A1038 -13.637 34.543 -28.104 1.00 52.75 O ATOM 2097 CB MET A1038 -13.600 31.466 -27.012 1.00 41.44 C ATOM 2098 CG MET A1038 -13.407 29.933 -27.051 1.00 44.49 C ATOM 2099 SD MET A1038 -13.231 29.124 -25.413 1.00 47.58 S ATOM 2100 CE MET A1038 -14.851 29.432 -24.733 1.00 44.51 C ATOM 2101 H MET A1038 -11.205 32.327 -27.405 1.00 0.00 H TER 2102 MET A1038 ATOM 2103 N VAL A1044 -24.352 32.338 -26.123 1.00 52.40 N ATOM 2104 CA VAL A1044 -23.701 31.084 -26.515 1.00 52.10 C ATOM 2105 C VAL A1044 -22.855 30.492 -25.361 1.00 54.75 C ATOM 2106 O VAL A1044 -21.942 31.174 -24.873 1.00 54.92 O ATOM 2107 CB VAL A1044 -22.873 31.246 -27.807 1.00 56.41 C ATOM 2108 HN3 VAL A1044 -23.627 33.035 -25.857 1.00 0.00 H ATOM 2109 HN2 VAL A1044 -24.980 32.163 -25.313 1.00 0.00 H ATOM 2110 HN1 VAL A1044 -24.909 32.703 -26.922 1.00 0.00 H ATOM 2111 N PRO A1045 -23.145 29.246 -24.897 1.00 49.74 N ATOM 2112 CA PRO A1045 -22.349 28.667 -23.795 1.00 49.10 C ATOM 2113 C PRO A1045 -20.888 28.480 -24.199 1.00 49.84 C ATOM 2114 O PRO A1045 -20.623 28.135 -25.359 1.00 48.80 O ATOM 2115 CB PRO A1045 -23.022 27.310 -23.533 1.00 51.18 C ATOM 2116 CG PRO A1045 -24.366 27.409 -24.171 1.00 56.40 C ATOM 2117 CD PRO A1045 -24.186 28.302 -25.352 1.00 51.73 C ATOM 2118 N ALA A1046 -19.945 28.748 -23.258 1.00 43.85 N ATOM 2119 CA ALA A1046 -18.503 28.618 -23.488 1.00 42.76 C ATOM 2120 C ALA A1046 -18.103 27.243 -24.031 1.00 45.33 C ATOM 2121 O ALA A1046 -17.264 27.182 -24.929 1.00 43.33 O ATOM 2122 CB ALA A1046 -17.732 28.927 -22.218 1.00 43.32 C ATOM 2123 H ALA A1046 -20.265 29.064 -22.320 1.00 0.00 H ATOM 2124 N LEU A1047 -18.717 26.150 -23.510 1.00 41.96 N ATOM 2125 CA LEU A1047 -18.465 24.773 -23.955 1.00 42.47 C ATOM 2126 C LEU A1047 -18.759 24.643 -25.454 1.00 44.98 C ATOM 2127 O LEU A1047 -17.954 24.070 -26.191 1.00 43.66 O ATOM 2128 CB LEU A1047 -19.293 23.753 -23.142 1.00 43.26 C ATOM 2129 CG LEU A1047 -18.985 22.267 -23.411 1.00 49.57 C ATOM 2130 CD1 LEU A1047 -18.956 21.473 -22.128 1.00 50.95 C ATOM 2131 CD2 LEU A1047 -19.983 21.647 -24.398 1.00 52.21 C ATOM 2132 H LEU A1047 -19.409 26.297 -22.748 1.00 0.00 H ATOM 2133 N SER A1048 -19.911 25.191 -25.892 1.00 41.36 N ATOM 2134 CA SER A1048 -20.354 25.217 -27.283 1.00 40.87 C ATOM 2135 C SER A1048 -19.422 26.102 -28.142 1.00 42.96 C ATOM 2136 O SER A1048 -19.115 25.714 -29.266 1.00 43.04 O ATOM 2137 CB SER A1048 -21.810 25.688 -27.372 1.00 46.42 C ATOM 2138 OG SER A1048 -22.682 24.758 -26.741 1.00 50.22 O ATOM 2139 HG SER A1048 -23.615 25.082 -26.811 1.00 0.00 H ATOM 2140 H SER A1048 -20.533 25.630 -25.183 1.00 0.00 H ATOM 2141 N ARG A1049 -18.955 27.267 -27.613 1.00 38.85 N ATOM 2142 CA ARG A1049 -18.015 28.156 -28.315 1.00 38.26 C ATOM 2143 C ARG A1049 -16.658 27.440 -28.527 1.00 39.20 C ATOM 2144 O ARG A1049 -16.048 27.581 -29.587 1.00 37.97 O ATOM 2145 CB ARG A1049 -17.782 29.464 -27.535 1.00 41.16 C ATOM 2146 CG ARG A1049 -18.784 30.576 -27.814 1.00 57.88 C ATOM 2147 CD ARG A1049 -19.057 31.459 -26.596 1.00 64.31 C ATOM 2148 NE ARG A1049 -17.839 31.881 -25.896 1.00 71.72 N ATOM 2149 CZ ARG A1049 -17.771 32.121 -24.590 1.00 84.99 C ATOM 2150 NH1 ARG A1049 -18.852 32.000 -23.827 1.00 77.11 N ATOM 2151 NH2 ARG A1049 -16.622 32.486 -24.035 1.00 63.54 N ATOM 2152 HE ARG A1049 -16.972 32.000 -26.458 1.00 0.00 H ATOM 2153 HH12 ARG A1049 -18.792 32.189 -22.806 1.00 0.00 H ATOM 2154 HH11 ARG A1049 -19.758 31.716 -24.251 1.00 0.00 H ATOM 2155 HH22 ARG A1049 -16.574 32.673 -23.013 1.00 0.00 H ATOM 2156 HH21 ARG A1049 -15.769 32.585 -24.622 1.00 0.00 H ATOM 2157 H ARG A1049 -19.279 27.543 -26.664 1.00 0.00 H ATOM 2158 N LEU A1050 -16.190 26.685 -27.521 1.00 33.63 N ATOM 2159 CA LEU A1050 -14.920 25.965 -27.665 1.00 32.03 C ATOM 2160 C LEU A1050 -15.051 24.837 -28.666 1.00 35.32 C ATOM 2161 O LEU A1050 -14.162 24.631 -29.497 1.00 35.43 O ATOM 2162 CB LEU A1050 -14.425 25.440 -26.294 1.00 30.94 C ATOM 2163 CG LEU A1050 -13.142 24.591 -26.310 1.00 32.80 C ATOM 2164 CD1 LEU A1050 -11.957 25.365 -26.906 1.00 32.31 C ATOM 2165 CD2 LEU A1050 -12.807 24.109 -24.899 1.00 32.01 C ATOM 2166 H LEU A1050 -16.730 26.610 -26.635 1.00 0.00 H ATOM 2167 N LEU A1051 -16.151 24.097 -28.593 1.00 35.66 N ATOM 2168 CA LEU A1051 -16.411 22.977 -29.510 1.00 36.03 C ATOM 2169 C LEU A1051 -16.442 23.507 -30.966 1.00 37.79 C ATOM 2170 O LEU A1051 -15.836 22.904 -31.847 1.00 35.43 O ATOM 2171 CB LEU A1051 -17.747 22.328 -29.123 1.00 36.83 C ATOM 2172 CG LEU A1051 -17.959 20.821 -29.265 1.00 43.63 C ATOM 2173 CD1 LEU A1051 -19.356 20.529 -29.726 1.00 45.10 C ATOM 2174 CD2 LEU A1051 -16.911 20.121 -30.135 1.00 46.60 C ATOM 2175 H LEU A1051 -16.855 24.318 -27.860 1.00 0.00 H ATOM 2176 N GLU A1052 -17.073 24.683 -31.185 1.00 36.40 N ATOM 2177 CA GLU A1052 -17.145 25.381 -32.483 1.00 36.84 C ATOM 2178 C GLU A1052 -15.737 25.702 -33.018 1.00 39.74 C ATOM 2179 O GLU A1052 -15.428 25.369 -34.161 1.00 41.04 O ATOM 2180 CB GLU A1052 -17.959 26.686 -32.333 1.00 38.88 C ATOM 2181 CG GLU A1052 -19.446 26.527 -32.604 1.00 56.40 C ATOM 2182 CD GLU A1052 -20.348 27.690 -32.221 1.00 76.41 C ATOM 2183 OE1 GLU A1052 -19.859 28.840 -32.156 1.00 72.19 O ATOM 2184 OE2 GLU A1052 -21.559 27.451 -32.012 1.00 72.40 O ATOM 2185 H GLU A1052 -17.545 25.131 -30.374 1.00 0.00 H ATOM 2186 N LEU A1053 -14.874 26.307 -32.161 1.00 36.02 N ATOM 2187 CA LEU A1053 -13.488 26.665 -32.425 1.00 35.37 C ATOM 2188 C LEU A1053 -12.687 25.425 -32.907 1.00 35.29 C ATOM 2189 O LEU A1053 -12.000 25.487 -33.929 1.00 33.09 O ATOM 2190 CB LEU A1053 -12.892 27.189 -31.111 1.00 36.80 C ATOM 2191 CG LEU A1053 -11.535 27.853 -31.146 1.00 42.90 C ATOM 2192 CD1 LEU A1053 -11.518 29.021 -30.205 1.00 43.96 C ATOM 2193 CD2 LEU A1053 -10.429 26.880 -30.753 1.00 45.40 C ATOM 2194 H LEU A1053 -15.242 26.539 -31.217 1.00 0.00 H ATOM 2195 N LEU A1054 -12.775 24.326 -32.146 1.00 31.04 N ATOM 2196 CA LEU A1054 -12.041 23.092 -32.459 1.00 29.92 C ATOM 2197 C LEU A1054 -12.505 22.461 -33.757 1.00 36.78 C ATOM 2198 O LEU A1054 -11.677 21.999 -34.544 1.00 35.03 O ATOM 2199 CB LEU A1054 -12.153 22.092 -31.293 1.00 29.54 C ATOM 2200 CG LEU A1054 -11.472 22.576 -29.984 1.00 32.04 C ATOM 2201 CD1 LEU A1054 -11.782 21.597 -28.810 1.00 32.18 C ATOM 2202 CD2 LEU A1054 -9.927 22.790 -30.190 1.00 30.13 C ATOM 2203 H LEU A1054 -13.385 24.347 -31.304 1.00 0.00 H ATOM 2204 N GLU A1055 -13.831 22.434 -33.966 1.00 36.96 N ATOM 2205 CA GLU A1055 -14.451 21.861 -35.167 1.00 38.39 C ATOM 2206 C GLU A1055 -14.052 22.616 -36.434 1.00 43.37 C ATOM 2207 O GLU A1055 -13.880 21.991 -37.483 1.00 44.39 O ATOM 2208 CB GLU A1055 -15.974 21.738 -34.991 1.00 39.73 C ATOM 2209 CG GLU A1055 -16.384 20.559 -34.111 1.00 50.18 C ATOM 2210 CD GLU A1055 -17.844 20.484 -33.680 1.00 75.25 C ATOM 2211 OE1 GLU A1055 -18.584 21.484 -33.841 1.00 66.77 O ATOM 2212 OE2 GLU A1055 -18.243 19.420 -33.151 1.00 67.30 O ATOM 2213 H GLU A1055 -14.452 22.841 -33.238 1.00 0.00 H ATOM 2214 N GLU A1056 -13.788 23.933 -36.311 1.00 40.97 N ATOM 2215 CA GLU A1056 -13.300 24.800 -37.395 1.00 42.26 C ATOM 2216 C GLU A1056 -11.841 24.491 -37.747 1.00 44.66 C ATOM 2217 O GLU A1056 -11.336 25.025 -38.737 1.00 44.83 O ATOM 2218 CB GLU A1056 -13.367 26.281 -36.964 1.00 44.21 C ATOM 2219 CG GLU A1056 -14.746 26.910 -37.038 1.00 56.11 C ATOM 2220 CD GLU A1056 -14.860 28.256 -36.345 1.00 79.15 C ATOM 2221 OE1 GLU A1056 -16.003 28.651 -36.022 1.00 79.74 O ATOM 2222 OE2 GLU A1056 -13.816 28.908 -36.106 1.00 73.30 O ATOM 2223 H GLU A1056 -13.941 24.369 -35.379 1.00 0.00 H ATOM 2224 N GLY A1057 -11.163 23.715 -36.894 1.00 38.90 N ATOM 2225 CA GLY A1057 -9.756 23.370 -37.073 1.00 37.23 C ATOM 2226 C GLY A1057 -8.819 24.297 -36.327 1.00 35.98 C ATOM 2227 O GLY A1057 -7.604 24.190 -36.497 1.00 34.84 O ATOM 2228 H GLY A1057 -11.663 23.339 -36.063 1.00 0.00 H ATOM 2229 N GLN A1058 -9.363 25.247 -35.509 1.00 31.43 N ATOM 2230 CA GLN A1058 -8.516 26.165 -34.748 1.00 31.14 C ATOM 2231 C GLN A1058 -7.896 25.388 -33.591 1.00 31.72 C ATOM 2232 O GLN A1058 -8.533 24.501 -33.033 1.00 30.31 O ATOM 2233 CB GLN A1058 -9.313 27.347 -34.170 1.00 33.02 C ATOM 2234 CG GLN A1058 -9.808 28.354 -35.218 1.00 43.11 C ATOM 2235 CD GLN A1058 -10.191 29.656 -34.552 1.00 57.22 C ATOM 2236 OE1 GLN A1058 -9.355 30.380 -33.999 1.00 48.36 O ATOM 2237 NE2 GLN A1058 -11.473 29.955 -34.547 1.00 53.54 N ATOM 2238 HE22 GLN A1058 -12.155 29.328 -35.020 1.00 0.00 H ATOM 2239 HE21 GLN A1058 -11.804 30.818 -34.070 1.00 0.00 H ATOM 2240 H GLN A1058 -10.397 25.318 -35.426 1.00 0.00 H ATOM 2241 N ARG A1059 -6.660 25.711 -33.260 1.00 29.45 N ATOM 2242 CA ARG A1059 -5.913 25.042 -32.191 1.00 27.51 C ATOM 2243 C ARG A1059 -5.129 26.065 -31.405 1.00 30.53 C ATOM 2244 O ARG A1059 -4.889 27.184 -31.887 1.00 29.31 O ATOM 2245 CB ARG A1059 -4.916 24.012 -32.797 1.00 27.97 C ATOM 2246 CG ARG A1059 -5.545 22.848 -33.572 1.00 29.64 C ATOM 2247 CD ARG A1059 -6.376 21.951 -32.676 1.00 31.18 C ATOM 2248 NE ARG A1059 -6.917 20.783 -33.369 1.00 29.61 N ATOM 2249 CZ ARG A1059 -8.158 20.697 -33.831 1.00 34.96 C ATOM 2250 NH1 ARG A1059 -8.591 19.571 -34.376 1.00 31.29 N ATOM 2251 NH2 ARG A1059 -8.981 21.732 -33.738 1.00 31.25 N ATOM 2252 HE ARG A1059 -6.288 19.966 -33.509 1.00 0.00 H ATOM 2253 HH12 ARG A1059 -9.564 19.509 -34.737 1.00 0.00 H ATOM 2254 HH11 ARG A1059 -7.958 18.749 -34.444 1.00 0.00 H ATOM 2255 HH22 ARG A1059 -9.952 21.658 -34.102 1.00 0.00 H ATOM 2256 HH21 ARG A1059 -8.655 22.618 -33.301 1.00 0.00 H ATOM 2257 H ARG A1059 -6.193 26.478 -33.784 1.00 0.00 H ATOM 2258 N LEU A1060 -4.622 25.644 -30.229 1.00 26.75 N ATOM 2259 CA LEU A1060 -3.723 26.494 -29.446 1.00 26.03 C ATOM 2260 C LEU A1060 -2.490 26.815 -30.295 1.00 31.48 C ATOM 2261 O LEU A1060 -2.070 25.981 -31.107 1.00 30.68 O ATOM 2262 CB LEU A1060 -3.265 25.786 -28.170 1.00 25.38 C ATOM 2263 CG LEU A1060 -4.319 25.696 -27.067 1.00 26.75 C ATOM 2264 CD1 LEU A1060 -3.900 24.668 -25.986 1.00 27.72 C ATOM 2265 CD2 LEU A1060 -4.545 27.071 -26.428 1.00 28.52 C ATOM 2266 H LEU A1060 -4.874 24.700 -29.872 1.00 0.00 H ATOM 2267 N PRO A1061 -1.938 28.038 -30.169 1.00 29.22 N ATOM 2268 CA PRO A1061 -0.795 28.408 -31.012 1.00 28.44 C ATOM 2269 C PRO A1061 0.467 27.756 -30.514 1.00 31.19 C ATOM 2270 O PRO A1061 0.585 27.440 -29.325 1.00 29.48 O ATOM 2271 CB PRO A1061 -0.716 29.923 -30.833 1.00 29.89 C ATOM 2272 CG PRO A1061 -1.181 30.141 -29.413 1.00 34.92 C ATOM 2273 CD PRO A1061 -2.334 29.145 -29.278 1.00 30.55 C ATOM 2274 N ALA A1062 1.450 27.590 -31.401 1.00 29.35 N ATOM 2275 CA ALA A1062 2.723 27.053 -30.942 1.00 29.14 C ATOM 2276 C ALA A1062 3.249 27.941 -29.791 1.00 32.00 C ATOM 2277 O ALA A1062 3.261 29.185 -29.921 1.00 31.32 O ATOM 2278 CB ALA A1062 3.739 27.060 -32.088 1.00 30.06 C ATOM 2279 H ALA A1062 1.309 27.839 -32.401 1.00 0.00 H ATOM 2280 N PRO A1063 3.660 27.334 -28.652 1.00 28.08 N ATOM 2281 CA PRO A1063 4.230 28.124 -27.550 1.00 28.19 C ATOM 2282 C PRO A1063 5.429 28.982 -27.978 1.00 32.82 C ATOM 2283 O PRO A1063 6.140 28.603 -28.892 1.00 31.46 O ATOM 2284 CB PRO A1063 4.706 27.040 -26.565 1.00 29.37 C ATOM 2285 CG PRO A1063 3.759 25.914 -26.794 1.00 31.45 C ATOM 2286 CD PRO A1063 3.613 25.895 -28.296 1.00 28.58 C ATOM 2287 N PRO A1064 5.669 30.140 -27.343 1.00 30.85 N ATOM 2288 CA PRO A1064 6.875 30.922 -27.681 1.00 30.94 C ATOM 2289 C PRO A1064 8.148 30.061 -27.628 1.00 34.76 C ATOM 2290 O PRO A1064 8.331 29.259 -26.694 1.00 32.68 O ATOM 2291 CB PRO A1064 6.869 32.031 -26.612 1.00 32.38 C ATOM 2292 CG PRO A1064 5.378 32.215 -26.328 1.00 34.61 C ATOM 2293 CD PRO A1064 4.908 30.778 -26.251 1.00 30.70 C ATOM 2294 N ALA A1065 8.999 30.173 -28.668 1.00 32.11 N ATOM 2295 CA ALA A1065 10.276 29.427 -28.824 1.00 33.64 C ATOM 2296 C ALA A1065 10.135 27.890 -28.930 1.00 36.83 C ATOM 2297 O ALA A1065 11.136 27.178 -28.908 1.00 36.11 O ATOM 2298 CB ALA A1065 11.260 29.799 -27.719 1.00 34.69 C ATOM 2299 H ALA A1065 8.740 30.837 -29.425 1.00 0.00 H ATOM 2300 N CYS A1066 8.903 27.381 -29.119 1.00 33.93 N ATOM 2301 CA CYS A1066 8.672 25.942 -29.220 1.00 31.93 C ATOM 2302 C CYS A1066 9.436 25.321 -30.391 1.00 37.58 C ATOM 2303 O CYS A1066 9.321 25.821 -31.516 1.00 36.03 O ATOM 2304 CB CYS A1066 7.179 25.648 -29.327 1.00 30.96 C ATOM 2305 SG CYS A1066 6.746 23.885 -29.224 1.00 33.16 S ATOM 2306 H CYS A1066 8.094 28.030 -29.195 1.00 0.00 H ATOM 2307 N PRO A1067 10.162 24.199 -30.176 1.00 34.55 N ATOM 2308 CA PRO A1067 10.801 23.516 -31.320 1.00 34.18 C ATOM 2309 C PRO A1067 9.707 23.099 -32.305 1.00 37.90 C ATOM 2310 O PRO A1067 8.654 22.617 -31.873 1.00 35.64 O ATOM 2311 CB PRO A1067 11.455 22.285 -30.664 1.00 36.00 C ATOM 2312 CG PRO A1067 11.700 22.710 -29.238 1.00 41.06 C ATOM 2313 CD PRO A1067 10.430 23.476 -28.914 1.00 36.52 C ATOM 2314 N ALA A1068 9.920 23.317 -33.624 1.00 36.10 N ATOM 2315 CA ALA A1068 8.922 22.980 -34.653 1.00 36.72 C ATOM 2316 C ALA A1068 8.427 21.548 -34.588 1.00 37.43 C ATOM 2317 O ALA A1068 7.231 21.305 -34.713 1.00 38.25 O ATOM 2318 CB ALA A1068 9.473 23.283 -36.053 1.00 38.38 C ATOM 2319 H ALA A1068 10.823 23.739 -33.922 1.00 0.00 H ATOM 2320 N GLU A1069 9.329 20.605 -34.345 1.00 35.29 N ATOM 2321 CA GLU A1069 9.026 19.177 -34.273 1.00 35.62 C ATOM 2322 C GLU A1069 8.048 18.859 -33.128 1.00 37.08 C ATOM 2323 O GLU A1069 7.155 18.017 -33.283 1.00 35.57 O ATOM 2324 CB GLU A1069 10.320 18.336 -34.142 1.00 37.73 C ATOM 2325 CG GLU A1069 11.534 18.864 -34.906 1.00 51.22 C ATOM 2326 CD GLU A1069 12.416 19.829 -34.122 1.00 72.70 C ATOM 2327 OE1 GLU A1069 13.146 19.370 -33.213 1.00 68.51 O ATOM 2328 OE2 GLU A1069 12.368 21.048 -34.410 1.00 57.18 O ATOM 2329 H GLU A1069 10.315 20.901 -34.196 1.00 0.00 H ATOM 2330 N VAL A1070 8.189 19.578 -31.997 1.00 33.69 N ATOM 2331 CA VAL A1070 7.324 19.377 -30.831 1.00 32.15 C ATOM 2332 C VAL A1070 5.922 19.894 -31.156 1.00 31.82 C ATOM 2333 O VAL A1070 4.937 19.218 -30.881 1.00 29.79 O ATOM 2334 CB VAL A1070 7.922 20.009 -29.541 1.00 36.73 C ATOM 2335 CG1 VAL A1070 6.954 19.881 -28.371 1.00 37.07 C ATOM 2336 CG2 VAL A1070 9.264 19.363 -29.193 1.00 36.90 C ATOM 2337 H VAL A1070 8.936 20.300 -31.950 1.00 0.00 H ATOM 2338 N HIS A1071 5.840 21.088 -31.749 1.00 29.85 N ATOM 2339 CA HIS A1071 4.554 21.655 -32.141 1.00 29.63 C ATOM 2340 C HIS A1071 3.854 20.731 -33.146 1.00 31.42 C ATOM 2341 O HIS A1071 2.654 20.504 -33.037 1.00 29.76 O ATOM 2342 CB HIS A1071 4.743 23.065 -32.708 1.00 30.25 C ATOM 2343 CG HIS A1071 3.460 23.678 -33.167 1.00 33.07 C ATOM 2344 ND1 HIS A1071 3.371 24.335 -34.383 1.00 34.97 N ATOM 2345 CD2 HIS A1071 2.256 23.731 -32.550 1.00 34.26 C ATOM 2346 CE1 HIS A1071 2.122 24.757 -34.467 1.00 34.01 C ATOM 2347 NE2 HIS A1071 1.412 24.405 -33.398 1.00 34.01 N ATOM 2348 H HIS A1071 6.711 21.625 -31.935 1.00 0.00 H ATOM 2349 N GLU A1072 4.606 20.106 -34.056 1.00 29.99 N ATOM 2350 CA GLU A1072 3.981 19.162 -34.991 1.00 29.26 C ATOM 2351 C GLU A1072 3.373 17.931 -34.286 1.00 29.97 C ATOM 2352 O GLU A1072 2.312 17.481 -34.685 1.00 28.99 O ATOM 2353 CB GLU A1072 4.965 18.736 -36.114 1.00 31.23 C ATOM 2354 CG GLU A1072 5.336 19.868 -37.072 1.00 39.25 C ATOM 2355 CD GLU A1072 4.197 20.554 -37.811 1.00 55.89 C ATOM 2356 OE1 GLU A1072 3.244 19.862 -38.238 1.00 49.34 O ATOM 2357 OE2 GLU A1072 4.260 21.795 -37.962 1.00 55.44 O ATOM 2358 H GLU A1072 5.629 20.287 -34.102 1.00 0.00 H ATOM 2359 N LEU A1073 3.985 17.444 -33.204 1.00 29.70 N ATOM 2360 CA LEU A1073 3.447 16.289 -32.463 1.00 30.78 C ATOM 2361 C LEU A1073 2.171 16.676 -31.748 1.00 30.95 C ATOM 2362 O LEU A1073 1.220 15.908 -31.745 1.00 30.95 O ATOM 2363 CB LEU A1073 4.469 15.717 -31.464 1.00 31.91 C ATOM 2364 CG LEU A1073 5.623 14.911 -32.075 1.00 38.18 C ATOM 2365 CD1 LEU A1073 6.626 14.509 -30.995 1.00 38.41 C ATOM 2366 CD2 LEU A1073 5.113 13.654 -32.786 1.00 40.53 C ATOM 2367 H LEU A1073 4.864 17.891 -32.875 1.00 0.00 H ATOM 2368 N MET A1074 2.126 17.915 -31.181 1.00 27.13 N ATOM 2369 CA MET A1074 0.914 18.430 -30.547 1.00 26.17 C ATOM 2370 C MET A1074 -0.245 18.384 -31.547 1.00 29.18 C ATOM 2371 O MET A1074 -1.326 17.937 -31.204 1.00 28.98 O ATOM 2372 CB MET A1074 1.109 19.907 -30.139 1.00 27.59 C ATOM 2373 CG MET A1074 1.843 20.105 -28.898 1.00 29.86 C ATOM 2374 SD MET A1074 2.027 21.911 -28.642 1.00 32.54 S ATOM 2375 CE MET A1074 3.618 21.908 -28.059 1.00 29.63 C ATOM 2376 H MET A1074 2.978 18.511 -31.200 1.00 0.00 H ATOM 2377 N LYS A1075 -0.023 18.883 -32.780 1.00 27.48 N ATOM 2378 CA LYS A1075 -1.078 18.929 -33.800 1.00 27.12 C ATOM 2379 C LYS A1075 -1.573 17.551 -34.145 1.00 29.51 C ATOM 2380 O LYS A1075 -2.764 17.396 -34.406 1.00 30.13 O ATOM 2381 CB LYS A1075 -0.601 19.673 -35.055 1.00 29.89 C ATOM 2382 CG LYS A1075 -0.403 21.152 -34.802 1.00 32.91 C ATOM 2383 CD LYS A1075 -0.234 21.881 -36.127 1.00 42.60 C ATOM 2384 CE LYS A1075 1.183 22.055 -36.580 1.00 54.78 C ATOM 2385 NZ LYS A1075 1.235 22.685 -37.932 1.00 56.05 N ATOM 2386 HZ1 LYS A1075 0.737 22.079 -38.615 1.00 0.00 H ATOM 2387 HZ2 LYS A1075 0.777 23.618 -37.896 1.00 0.00 H ATOM 2388 HZ3 LYS A1075 2.227 22.795 -38.224 1.00 0.00 H ATOM 2389 H LYS A1075 0.923 19.246 -33.015 1.00 0.00 H ATOM 2390 N LEU A1076 -0.675 16.540 -34.123 1.00 29.22 N ATOM 2391 CA LEU A1076 -1.094 15.150 -34.385 1.00 30.21 C ATOM 2392 C LEU A1076 -1.960 14.624 -33.245 1.00 30.88 C ATOM 2393 O LEU A1076 -2.962 13.943 -33.484 1.00 29.06 O ATOM 2394 CB LEU A1076 0.125 14.225 -34.602 1.00 30.71 C ATOM 2395 CG LEU A1076 0.979 14.537 -35.829 1.00 36.36 C ATOM 2396 CD1 LEU A1076 2.184 13.612 -35.886 1.00 37.53 C ATOM 2397 CD2 LEU A1076 0.162 14.420 -37.123 1.00 39.35 C ATOM 2398 H LEU A1076 0.324 16.745 -33.919 1.00 0.00 H ATOM 2399 N CYS A1077 -1.611 14.981 -31.991 1.00 28.74 N ATOM 2400 CA CYS A1077 -2.439 14.588 -30.841 1.00 28.37 C ATOM 2401 C CYS A1077 -3.796 15.206 -30.948 1.00 29.32 C ATOM 2402 O CYS A1077 -4.761 14.667 -30.416 1.00 28.93 O ATOM 2403 CB CYS A1077 -1.768 15.003 -29.536 1.00 29.11 C ATOM 2404 SG CYS A1077 -0.216 14.148 -29.200 1.00 33.26 S ATOM 2405 H CYS A1077 -0.748 15.540 -31.836 1.00 0.00 H ATOM 2406 N TRP A1078 -3.872 16.375 -31.612 1.00 26.07 N ATOM 2407 CA TRP A1078 -5.125 17.111 -31.742 1.00 26.28 C ATOM 2408 C TRP A1078 -5.860 16.825 -33.062 1.00 31.29 C ATOM 2409 O TRP A1078 -6.685 17.635 -33.491 1.00 29.53 O ATOM 2410 CB TRP A1078 -4.901 18.621 -31.560 1.00 24.94 C ATOM 2411 CG TRP A1078 -4.322 18.995 -30.231 1.00 25.30 C ATOM 2412 CD1 TRP A1078 -4.559 18.393 -29.021 1.00 27.84 C ATOM 2413 CD2 TRP A1078 -3.467 20.117 -29.967 1.00 24.71 C ATOM 2414 NE1 TRP A1078 -3.874 19.058 -28.021 1.00 27.24 N ATOM 2415 CE2 TRP A1078 -3.200 20.124 -28.574 1.00 27.90 C ATOM 2416 CE3 TRP A1078 -2.866 21.103 -30.779 1.00 24.61 C ATOM 2417 CZ2 TRP A1078 -2.367 21.085 -27.972 1.00 26.25 C ATOM 2418 CZ3 TRP A1078 -2.086 22.086 -30.174 1.00 25.60 C ATOM 2419 CH2 TRP A1078 -1.847 22.073 -28.778 1.00 25.74 C ATOM 2420 HE1 TRP A1078 -3.869 18.796 -27.015 1.00 0.00 H ATOM 2421 H TRP A1078 -3.011 16.765 -32.046 1.00 0.00 H ATOM 2422 N ALA A1079 -5.630 15.634 -33.662 1.00 31.85 N ATOM 2423 CA ALA A1079 -6.372 15.252 -34.878 1.00 31.56 C ATOM 2424 C ALA A1079 -7.860 15.241 -34.538 1.00 36.54 C ATOM 2425 O ALA A1079 -8.249 14.751 -33.471 1.00 36.96 O ATOM 2426 CB ALA A1079 -5.936 13.867 -35.369 1.00 32.20 C ATOM 2427 H ALA A1079 -4.924 14.983 -33.262 1.00 0.00 H ATOM 2428 N PRO A1080 -8.722 15.805 -35.414 1.00 34.74 N ATOM 2429 CA PRO A1080 -10.153 15.849 -35.104 1.00 35.24 C ATOM 2430 C PRO A1080 -10.738 14.482 -34.784 1.00 39.16 C ATOM 2431 O PRO A1080 -11.508 14.356 -33.840 1.00 39.45 O ATOM 2432 CB PRO A1080 -10.773 16.420 -36.397 1.00 37.38 C ATOM 2433 CG PRO A1080 -9.683 17.151 -37.047 1.00 41.72 C ATOM 2434 CD PRO A1080 -8.425 16.448 -36.711 1.00 36.49 C ATOM 2435 N SER A1081 -10.342 13.455 -35.548 1.00 36.78 N ATOM 2436 CA SER A1081 -10.882 12.108 -35.348 1.00 36.29 C ATOM 2437 C SER A1081 -10.002 11.290 -34.404 1.00 35.02 C ATOM 2438 O SER A1081 -8.777 11.239 -34.613 1.00 33.67 O ATOM 2439 CB SER A1081 -11.082 11.391 -36.684 1.00 39.02 C ATOM 2440 H SER A1081 -9.638 13.617 -36.297 1.00 0.00 H ATOM 2441 N PRO A1082 -10.614 10.639 -33.386 1.00 33.84 N ATOM 2442 CA PRO A1082 -9.812 9.855 -32.413 1.00 34.66 C ATOM 2443 C PRO A1082 -8.933 8.793 -33.059 1.00 40.08 C ATOM 2444 O PRO A1082 -7.779 8.635 -32.661 1.00 38.52 O ATOM 2445 CB PRO A1082 -10.854 9.247 -31.457 1.00 36.41 C ATOM 2446 CG PRO A1082 -12.168 9.547 -32.018 1.00 40.61 C ATOM 2447 CD PRO A1082 -12.048 10.648 -33.022 1.00 36.15 C ATOM 2448 N GLN A1083 -9.443 8.127 -34.120 1.00 39.38 N ATOM 2449 CA GLN A1083 -8.659 7.100 -34.830 1.00 40.36 C ATOM 2450 C GLN A1083 -7.448 7.634 -35.599 1.00 43.19 C ATOM 2451 O GLN A1083 -6.550 6.859 -35.897 1.00 43.53 O ATOM 2452 CB GLN A1083 -9.549 6.167 -35.689 1.00 42.47 C ATOM 2453 CG GLN A1083 -10.419 6.898 -36.711 1.00 54.85 C ATOM 2454 H GLN A1083 -10.408 8.344 -34.442 1.00 0.00 H ATOM 2455 N ASP A1084 -7.393 8.956 -35.884 1.00 38.35 N ATOM 2456 CA ASP A1084 -6.261 9.560 -36.598 1.00 37.81 C ATOM 2457 C ASP A1084 -5.144 10.028 -35.682 1.00 39.61 C ATOM 2458 O ASP A1084 -4.066 10.373 -36.155 1.00 38.51 O ATOM 2459 CB ASP A1084 -6.744 10.709 -37.500 1.00 41.26 C ATOM 2460 CG ASP A1084 -7.616 10.218 -38.644 1.00 53.43 C ATOM 2461 OD1 ASP A1084 -8.570 10.938 -39.011 1.00 53.50 O ATOM 2462 OD2 ASP A1084 -7.387 9.075 -39.124 1.00 57.16 O ATOM 2463 H ASP A1084 -8.181 9.566 -35.587 1.00 0.00 H ATOM 2464 N ARG A1085 -5.391 10.035 -34.357 1.00 34.98 N ATOM 2465 CA ARG A1085 -4.394 10.477 -33.393 1.00 33.62 C ATOM 2466 C ARG A1085 -3.337 9.397 -33.244 1.00 36.61 C ATOM 2467 O ARG A1085 -3.680 8.213 -33.311 1.00 37.07 O ATOM 2468 CB ARG A1085 -5.081 10.727 -32.030 1.00 33.51 C ATOM 2469 CG ARG A1085 -5.919 11.992 -32.060 1.00 32.48 C ATOM 2470 CD ARG A1085 -6.816 12.159 -30.846 1.00 32.45 C ATOM 2471 NE ARG A1085 -7.962 12.979 -31.220 1.00 31.54 N ATOM 2472 CZ ARG A1085 -9.137 12.963 -30.609 1.00 32.46 C ATOM 2473 NH1 ARG A1085 -10.142 13.684 -31.078 1.00 33.87 N ATOM 2474 NH2 ARG A1085 -9.330 12.196 -29.543 1.00 27.21 N ATOM 2475 HE ARG A1085 -7.848 13.625 -32.027 1.00 0.00 H ATOM 2476 HH12 ARG A1085 -11.063 13.668 -30.595 1.00 0.00 H ATOM 2477 HH11 ARG A1085 -10.011 14.266 -31.930 1.00 0.00 H ATOM 2478 HH22 ARG A1085 -10.255 12.189 -29.068 1.00 0.00 H ATOM 2479 HH21 ARG A1085 -8.556 11.602 -29.182 1.00 0.00 H ATOM 2480 H ARG A1085 -6.319 9.716 -34.014 1.00 0.00 H ATOM 2481 N PRO A1086 -2.050 9.742 -33.066 1.00 33.16 N ATOM 2482 CA PRO A1086 -1.064 8.683 -32.873 1.00 33.64 C ATOM 2483 C PRO A1086 -1.307 8.007 -31.529 1.00 37.61 C ATOM 2484 O PRO A1086 -1.965 8.583 -30.656 1.00 36.46 O ATOM 2485 CB PRO A1086 0.271 9.416 -32.905 1.00 35.93 C ATOM 2486 CG PRO A1086 -0.044 10.814 -32.498 1.00 40.07 C ATOM 2487 CD PRO A1086 -1.450 11.083 -32.922 1.00 35.41 C ATOM 2488 N SER A1087 -0.846 6.765 -31.388 1.00 33.62 N ATOM 2489 CA SER A1087 -0.993 6.079 -30.109 1.00 32.34 C ATOM 2490 C SER A1087 0.177 6.515 -29.230 1.00 32.95 C ATOM 2491 O SER A1087 1.175 7.013 -29.752 1.00 32.61 O ATOM 2492 CB SER A1087 -0.940 4.564 -30.326 1.00 36.62 C ATOM 2493 OG SER A1087 0.355 4.221 -30.804 1.00 40.24 O ATOM 2494 HG SER A1087 0.404 3.243 -30.949 1.00 0.00 H ATOM 2495 H SER A1087 -0.383 6.286 -32.187 1.00 0.00 H ATOM 2496 N PHE A1088 0.098 6.285 -27.891 1.00 29.85 N ATOM 2497 CA PHE A1088 1.252 6.571 -27.030 1.00 28.87 C ATOM 2498 C PHE A1088 2.466 5.689 -27.417 1.00 34.77 C ATOM 2499 O PHE A1088 3.606 6.120 -27.267 1.00 33.46 O ATOM 2500 CB PHE A1088 0.899 6.425 -25.532 1.00 29.89 C ATOM 2501 CG PHE A1088 -0.041 7.489 -24.998 1.00 29.11 C ATOM 2502 CD1 PHE A1088 0.393 8.799 -24.810 1.00 29.82 C ATOM 2503 CD2 PHE A1088 -1.366 7.187 -24.707 1.00 29.82 C ATOM 2504 CE1 PHE A1088 -0.487 9.781 -24.316 1.00 29.42 C ATOM 2505 CE2 PHE A1088 -2.230 8.152 -24.178 1.00 32.34 C ATOM 2506 CZ PHE A1088 -1.796 9.453 -24.015 1.00 30.53 C ATOM 2507 H PHE A1088 -0.779 5.907 -27.478 1.00 0.00 H ATOM 2508 N SER A1089 2.230 4.467 -27.963 1.00 35.50 N ATOM 2509 CA SER A1089 3.337 3.594 -28.385 1.00 35.79 C ATOM 2510 C SER A1089 4.065 4.243 -29.555 1.00 39.59 C ATOM 2511 O SER A1089 5.289 4.197 -29.597 1.00 38.78 O ATOM 2512 CB SER A1089 2.833 2.213 -28.810 1.00 40.01 C ATOM 2513 OG SER A1089 1.787 1.742 -27.977 1.00 57.21 O ATOM 2514 HG SER A1089 1.025 2.373 -28.017 1.00 0.00 H ATOM 2515 H SER A1089 1.249 4.143 -28.085 1.00 0.00 H ATOM 2516 N ALA A1090 3.316 4.903 -30.455 1.00 39.06 N ATOM 2517 CA ALA A1090 3.893 5.605 -31.611 1.00 39.20 C ATOM 2518 C ALA A1090 4.623 6.888 -31.181 1.00 40.86 C ATOM 2519 O ALA A1090 5.719 7.152 -31.662 1.00 39.92 O ATOM 2520 CB ALA A1090 2.802 5.925 -32.629 1.00 40.16 C ATOM 2521 H ALA A1090 2.284 4.918 -30.328 1.00 0.00 H ATOM 2522 N LEU A1091 4.048 7.651 -30.223 1.00 36.26 N ATOM 2523 CA LEU A1091 4.646 8.899 -29.722 1.00 34.01 C ATOM 2524 C LEU A1091 5.976 8.763 -28.981 1.00 39.10 C ATOM 2525 O LEU A1091 6.840 9.627 -29.134 1.00 39.24 O ATOM 2526 CB LEU A1091 3.641 9.677 -28.836 1.00 33.14 C ATOM 2527 CG LEU A1091 2.491 10.370 -29.539 1.00 36.97 C ATOM 2528 CD1 LEU A1091 1.378 10.737 -28.520 1.00 36.43 C ATOM 2529 CD2 LEU A1091 2.991 11.620 -30.330 1.00 37.03 C ATOM 2530 H LEU A1091 3.140 7.341 -29.821 1.00 0.00 H ATOM 2531 N GLY A1092 6.096 7.734 -28.133 1.00 37.59 N ATOM 2532 CA GLY A1092 7.277 7.480 -27.312 1.00 38.19 C ATOM 2533 C GLY A1092 8.617 7.559 -28.029 1.00 42.94 C ATOM 2534 O GLY A1092 9.445 8.401 -27.667 1.00 42.05 O ATOM 2535 H GLY A1092 5.297 7.073 -28.054 1.00 0.00 H ATOM 2536 N PRO A1093 8.866 6.701 -29.056 1.00 43.23 N ATOM 2537 CA PRO A1093 10.165 6.746 -29.770 1.00 42.93 C ATOM 2538 C PRO A1093 10.497 8.089 -30.431 1.00 44.68 C ATOM 2539 O PRO A1093 11.660 8.463 -30.479 1.00 45.37 O ATOM 2540 CB PRO A1093 10.042 5.624 -30.808 1.00 45.24 C ATOM 2541 CG PRO A1093 8.967 4.733 -30.300 1.00 50.49 C ATOM 2542 CD PRO A1093 7.998 5.637 -29.603 1.00 45.85 C ATOM 2543 N GLN A1094 9.476 8.829 -30.897 1.00 39.73 N ATOM 2544 CA GLN A1094 9.623 10.162 -31.512 1.00 37.71 C ATOM 2545 C GLN A1094 10.068 11.196 -30.495 1.00 41.07 C ATOM 2546 O GLN A1094 10.936 12.022 -30.796 1.00 39.55 O ATOM 2547 CB GLN A1094 8.320 10.597 -32.165 1.00 38.33 C ATOM 2548 CG GLN A1094 7.847 9.591 -33.212 1.00 42.78 C ATOM 2549 CD GLN A1094 6.693 10.124 -33.995 1.00 53.40 C ATOM 2550 OE1 GLN A1094 5.562 9.639 -33.896 1.00 55.66 O ATOM 2551 NE2 GLN A1094 6.953 11.156 -34.772 1.00 43.16 N ATOM 2552 HE22 GLN A1094 7.920 11.535 -34.827 1.00 0.00 H ATOM 2553 HE21 GLN A1094 6.191 11.592 -35.330 1.00 0.00 H ATOM 2554 H GLN A1094 8.517 8.435 -30.819 1.00 0.00 H ATOM 2555 N LEU A1095 9.516 11.117 -29.266 1.00 38.41 N ATOM 2556 CA LEU A1095 9.919 12.007 -28.183 1.00 37.72 C ATOM 2557 C LEU A1095 11.358 11.690 -27.764 1.00 45.02 C ATOM 2558 O LEU A1095 12.156 12.606 -27.549 1.00 44.48 O ATOM 2559 CB LEU A1095 8.941 11.909 -26.993 1.00 36.64 C ATOM 2560 CG LEU A1095 7.536 12.453 -27.253 1.00 38.87 C ATOM 2561 CD1 LEU A1095 6.505 11.861 -26.261 1.00 38.26 C ATOM 2562 CD2 LEU A1095 7.523 13.972 -27.265 1.00 38.65 C ATOM 2563 H LEU A1095 8.783 10.402 -29.086 1.00 0.00 H ATOM 2564 N ASP A1096 11.702 10.386 -27.727 1.00 45.11 N ATOM 2565 CA ASP A1096 13.043 9.914 -27.373 1.00 46.62 C ATOM 2566 C ASP A1096 14.099 10.337 -28.390 1.00 51.22 C ATOM 2567 O ASP A1096 15.172 10.792 -27.986 1.00 51.10 O ATOM 2568 CB ASP A1096 13.043 8.409 -27.085 1.00 49.39 C ATOM 2569 CG ASP A1096 12.338 8.067 -25.780 1.00 66.29 C ATOM 2570 OD1 ASP A1096 12.651 8.706 -24.745 1.00 68.20 O ATOM 2571 OD2 ASP A1096 11.478 7.162 -25.789 1.00 74.23 O ATOM 2572 H ASP A1096 10.977 9.678 -27.962 1.00 0.00 H ATOM 2573 N MET A1097 13.750 10.306 -29.695 1.00 48.76 N ATOM 2574 CA MET A1097 14.629 10.765 -30.777 1.00 48.87 C ATOM 2575 C MET A1097 14.926 12.274 -30.632 1.00 53.28 C ATOM 2576 O MET A1097 16.086 12.685 -30.732 1.00 53.38 O ATOM 2577 CB MET A1097 13.993 10.465 -32.145 1.00 51.41 C ATOM 2578 CG MET A1097 14.133 9.010 -32.581 1.00 55.32 C ATOM 2579 H MET A1097 12.810 9.938 -29.946 1.00 0.00 H ATOM 2580 N LEU A1098 13.884 13.093 -30.346 1.00 49.54 N ATOM 2581 CA LEU A1098 14.038 14.544 -30.174 1.00 48.23 C ATOM 2582 C LEU A1098 14.867 14.896 -28.957 1.00 50.52 C ATOM 2583 O LEU A1098 15.579 15.900 -28.968 1.00 50.98 O ATOM 2584 CB LEU A1098 12.679 15.261 -30.134 1.00 48.13 C ATOM 2585 CG LEU A1098 11.822 15.183 -31.405 1.00 52.40 C ATOM 2586 CD1 LEU A1098 10.457 15.783 -31.170 1.00 51.92 C ATOM 2587 CD2 LEU A1098 12.513 15.844 -32.604 1.00 53.50 C ATOM 2588 H LEU A1098 12.936 12.677 -30.244 1.00 0.00 H ATOM 2589 N TRP A1099 14.795 14.052 -27.919 1.00 45.34 N ATOM 2590 CA TRP A1099 15.531 14.221 -26.676 1.00 61.56 C ATOM 2591 C TRP A1099 16.997 13.855 -26.889 1.00103.92 C ATOM 2592 O TRP A1099 17.873 14.626 -26.512 1.00 77.60 O ATOM 2593 CB TRP A1099 14.893 13.377 -25.559 1.00 59.97 C ATOM 2594 CG TRP A1099 15.707 13.354 -24.304 1.00 60.88 C ATOM 2595 CD1 TRP A1099 15.733 14.302 -23.326 1.00 63.50 C ATOM 2596 CD2 TRP A1099 16.676 12.365 -23.933 1.00 61.14 C ATOM 2597 NE1 TRP A1099 16.656 13.968 -22.366 1.00 62.97 N ATOM 2598 CE2 TRP A1099 17.243 12.775 -22.706 1.00 65.01 C ATOM 2599 CE3 TRP A1099 17.129 11.171 -24.526 1.00 62.69 C ATOM 2600 CZ2 TRP A1099 18.234 12.030 -22.054 1.00 64.68 C ATOM 2601 CZ3 TRP A1099 18.112 10.437 -23.883 1.00 64.52 C ATOM 2602 CH2 TRP A1099 18.648 10.861 -22.657 1.00 65.23 C ATOM 2603 HE1 TRP A1099 16.875 14.529 -21.518 1.00 0.00 H ATOM 2604 H TRP A1099 14.173 13.223 -28.008 1.00 0.00 H TER 2605 TRP A1099 HETATM 2606 O HOH 1 -3.895 12.069 -5.996 1.00 31.15 O HETATM 2607 O HOH 2 -9.363 3.362 -26.216 1.00 29.51 O HETATM 2608 O HOH 3 -7.274 16.263 -18.896 1.00 36.51 O HETATM 2609 O HOH 4 1.147 -4.340 -14.400 1.00 31.76 O HETATM 2610 O HOH 5 6.671 5.699 9.099 1.00 48.68 O HETATM 2611 O HOH 6 -5.897 18.977 0.922 1.00 48.99 O HETATM 2612 O HOH 7 5.698 5.377 -24.858 1.00 42.07 O HETATM 2613 O HOH 8 13.997 28.160 -19.689 1.00 48.92 O HETATM 2614 O HOH 9 -2.994 -2.994 0.277 1.00 51.63 O HETATM 2615 O HOH 10 -11.054 21.248 -25.167 1.00 34.00 O HETATM 2616 O HOH 11 -6.552 -3.970 -7.617 1.00 38.42 O HETATM 2617 O HOH 12 -12.873 8.605 2.571 1.00 36.95 O HETATM 2618 O HOH 13 4.957 21.804 -7.420 1.00 31.70 O HETATM 2619 O HOH 14 12.534 7.116 16.576 1.00 55.15 O HETATM 2620 O HOH 15 2.892 35.029 -16.579 1.00 50.78 O HETATM 2621 O HOH 16 -0.678 27.670 -15.443 1.00 50.61 O HETATM 2622 O HOH 17 -12.191 13.759 5.133 1.00 50.44 O HETATM 2623 O HOH 18 12.808 25.036 -23.386 1.00 44.55 O HETATM 2624 O HOH 19 -3.777 32.036 -31.049 1.00 38.73 O HETATM 2625 O HOH 20 13.034 26.078 -27.384 1.00 50.72 O HETATM 2626 O HOH 21 -8.396 18.009 -12.253 1.00 59.35 O HETATM 2627 O HOH 22 6.983 5.887 -33.649 1.00 42.06 O HETATM 2628 O HOH 23 -0.202 3.139 -26.861 1.00 45.60 O HETATM 2629 O HOH 24 15.950 10.715 -15.302 1.00 45.82 O HETATM 2630 O HOH 25 -0.875 25.509 -6.456 1.00 61.65 O HETATM 2631 O HOH 26 -10.951 -4.178 -18.195 1.00 41.19 O HETATM 2632 O HOH 27 -6.386 22.041 -37.542 1.00 43.44 O HETATM 2633 O HOH 28 -18.709 -8.909 -26.645 1.00 47.37 O HETATM 2634 O HOH 29 -15.414 9.852 -4.889 1.00 49.76 O HETATM 2635 O HOH 30 -9.394 10.362 -41.499 1.00 63.46 O HETATM 2636 O HOH 31 9.199 15.116 -4.975 1.00 30.03 O HETATM 2637 O HOH 32 -5.148 12.295 5.980 1.00 48.57 O HETATM 2638 O HOH 33 -4.595 30.337 -16.416 1.00 55.92 O HETATM 2639 O HOH 34 -9.630 11.066 -21.752 1.00 28.58 O HETATM 2640 O HOH 35 -8.022 35.041 -21.721 1.00 39.22 O HETATM 2641 O HOH 36 -8.702 13.460 -38.085 1.00 44.50 O HETATM 2642 O HOH 37 -8.381 17.918 -17.075 1.00 57.81 O HETATM 2643 O HOH 38 -0.795 -5.170 -12.629 1.00 30.74 O HETATM 2644 O HOH 39 -10.907 37.725 -27.037 1.00 48.92 O HETATM 2645 O HOH 40 -11.320 19.368 -35.002 1.00 55.37 O HETATM 2646 O HOH 41 -10.473 18.692 -19.132 1.00 61.85 O HETATM 2647 O HOH 42 -13.648 6.212 -9.598 1.00 45.50 O HETATM 2648 O HOH 43 -5.222 5.738 -21.407 1.00 29.06 O HETATM 2649 O HOH 44 -1.348 24.495 -33.242 1.00 40.57 O HETATM 2650 O HOH 45 0.481 27.419 -19.872 1.00 30.89 O HETATM 2651 O HOH 46 -9.379 13.761 -21.443 1.00 33.59 O HETATM 2652 O HOH 47 -16.744 10.582 -7.290 1.00 52.46 O HETATM 2653 O HOH 48 3.386 11.491 20.974 1.00 45.85 O HETATM 2654 O HOH 49 -2.951 20.298 -8.982 1.00 53.71 O HETATM 2655 O HOH 50 -14.273 14.993 -16.523 1.00 42.66 O HETATM 2656 O HOH 51 -3.116 5.090 -22.968 1.00 31.60 O HETATM 2657 O HOH 52 -8.382 21.061 -25.688 1.00 27.93 O HETATM 2658 O HOH 53 1.789 18.633 -3.505 1.00 33.36 O HETATM 2659 O HOH 54 -3.233 36.312 -20.955 1.00 43.37 O HETATM 2660 O HOH 55 -12.710 9.359 -27.069 1.00 43.61 O HETATM 2661 O HOH 56 5.524 2.017 -19.940 1.00 43.70 O HETATM 2662 O HOH 57 0.035 27.623 -10.259 1.00 50.99 O HETATM 2663 O HOH 58 -12.843 8.348 -7.611 1.00 49.53 O HETATM 2664 O HOH 59 -20.173 17.590 -22.790 1.00 48.33 O HETATM 2665 O HOH 60 3.262 12.271 16.342 1.00 72.85 O HETATM 2666 O HOH 61 -14.708 17.526 -1.423 1.00 58.45 O HETATM 2667 O HOH 62 -8.803 7.134 -40.395 1.00 65.50 O HETATM 2668 O HOH 63 6.003 29.798 -16.482 1.00 35.58 O HETATM 2669 O HOH 64 -11.901 -4.394 -27.419 1.00 52.22 O HETATM 2670 O HOH 65 6.954 29.064 -24.255 1.00 31.52 O HETATM 2671 O HOH 66 -11.629 15.327 -16.580 1.00 43.18 O HETATM 2672 O HOH 67 5.112 12.228 -36.472 1.00 50.43 O HETATM 2673 O HOH 68 0.621 21.201 -2.268 1.00 54.85 O HETATM 2674 O HOH 69 -4.324 -4.405 -22.948 1.00 44.38 O HETATM 2675 O HOH 70 -6.585 18.553 -10.325 1.00 51.71 O HETATM 2676 O HOH 71 0.851 2.705 -7.985 1.00 30.58 O HETATM 2677 O HOH 72 -3.348 16.599 -36.951 1.00 44.21 O HETATM 2678 O HOH 73 -14.120 34.172 -24.594 1.00 49.74 O HETATM 2679 O HOH 74 11.881 8.448 -20.830 1.00 59.42 O HETATM 2680 O HOH 75 -1.751 22.855 -0.047 1.00 61.04 O HETATM 2681 O HOH 76 -4.745 8.880 -7.446 1.00 31.87 O HETATM 2682 O HOH 77 6.185 8.720 0.975 1.00 37.85 O HETATM 2683 O HOH 78 -5.458 26.940 -17.925 1.00 32.59 O HETATM 2684 O HOH 79 9.482 11.255 -2.453 1.00 76.35 O HETATM 2685 O HOH 80 -0.758 1.412 -24.689 1.00 39.33 O HETATM 2686 O HOH 81 -3.479 34.486 -23.858 1.00 40.42 O HETATM 2687 O HOH 82 1.657 17.772 -37.423 1.00 33.65 O HETATM 2688 O HOH 83 8.224 8.873 -2.631 1.00 57.40 O HETATM 2689 O HOH 84 -11.224 14.266 -23.389 1.00 34.38 O HETATM 2690 O HOH 85 8.691 11.730 0.521 1.00 49.09 O HETATM 2691 O HOH 86 6.367 1.706 -16.871 1.00 34.32 O HETATM 2692 O HOH 87 -2.722 21.754 -15.411 1.00 26.66 O HETATM 2693 O HOH 88 0.796 -4.339 -19.194 1.00 34.15 O HETATM 2694 O HOH 89 7.196 6.668 14.396 1.00 38.07 O HETATM 2695 O HOH 90 7.402 16.110 -35.285 1.00 39.76 O HETATM 2696 O HOH 91 0.766 -0.540 -6.932 1.00 46.21 O HETATM 2697 O HOH 92 -6.738 23.915 -14.645 1.00 46.27 O HETATM 2698 O HOH 93 -8.280 10.377 -13.020 1.00 27.69 O HETATM 2699 O HOH 94 -9.814 15.722 -19.661 1.00 57.05 O HETATM 2700 O HOH 95 -12.803 9.357 -5.158 1.00 44.87 O HETATM 2701 O HOH 96 -15.406 15.590 -14.063 1.00 45.98 O HETATM 2702 O HOH 97 8.846 26.443 -25.889 1.00 31.37 O HETATM 2703 O HOH 98 -8.190 -2.844 -27.099 1.00 43.10 O HETATM 2704 O HOH 99 10.408 11.943 8.491 1.00 62.49 O HETATM 2705 O HOH 100 -11.026 5.929 -10.586 1.00 31.56 O HETATM 2706 O HOH 101 -10.571 7.977 12.659 1.00 39.59 O HETATM 2707 O HOH 102 6.611 4.456 -9.018 1.00 41.78 O HETATM 2708 O HOH 103 8.525 32.354 -30.356 1.00 61.10 O HETATM 2709 O HOH 104 10.739 13.054 -4.054 1.00 45.49 O HETATM 2710 O HOH 105 5.826 5.956 1.503 1.00 60.32 O HETATM 2711 O HOH 106 -6.573 -3.329 -15.500 1.00 46.39 O HETATM 2712 O HOH 107 -1.072 -5.874 -8.554 1.00 41.78 O HETATM 2713 O HOH 108 -5.214 23.000 -29.494 1.00 31.16 O HETATM 2714 O HOH 109 15.482 17.171 -7.815 1.00 57.05 O HETATM 2715 O HOH 110 -6.857 12.752 -19.990 1.00 26.51 O HETATM 2716 O HOH 111 -4.882 -5.007 -14.187 1.00 38.20 O HETATM 2717 O HOH 112 7.231 30.617 -22.029 1.00 50.54 O HETATM 2718 O HOH 113 -3.613 10.213 14.368 1.00 47.67 O HETATM 2719 O HOH 114 -4.357 19.706 -34.771 1.00 32.34 O HETATM 2720 O HOH 115 -1.325 -8.368 -18.070 1.00 36.07 O HETATM 2721 O HOH 116 -8.180 14.548 -4.094 1.00 45.97 O HETATM 2722 O HOH 117 6.619 29.356 -31.605 1.00 36.89 O HETATM 2723 O HOH 118 -5.788 9.430 11.008 1.00 51.57 O HETATM 2724 O HOH 119 -5.412 27.506 -35.110 1.00 45.15 O HETATM 2725 O HOH 120 -4.938 25.238 -36.567 1.00 57.67 O HETATM 2726 O HOH 121 -2.482 5.144 -27.356 1.00 49.96 O HETATM 2727 O HOH 122 11.232 6.441 12.902 1.00 56.39 O HETATM 2728 O HOH 123 6.954 26.278 -33.089 1.00 51.69 O HETATM 2729 O HOH 124 -7.365 31.993 -17.670 1.00 55.22 O HETATM 2730 O HOH 125 5.243 26.504 -6.435 1.00 49.66 O HETATM 2731 O HOH 126 -6.674 0.537 9.191 1.00 46.10 O HETATM 2732 O HOH 127 7.967 18.220 2.852 1.00 53.84 O HETATM 2733 O HOH 128 8.469 10.033 2.814 1.00 55.72 O HETATM 2734 O HOH 129 -3.462 -2.792 -13.707 1.00 30.45 O HETATM 2735 O HOH 130 4.499 -0.894 -7.156 1.00 55.95 O HETATM 2736 O HOH 131 -5.219 -0.999 -12.710 1.00 37.16 O HETATM 2737 O HOH 132 -15.800 35.402 -26.374 1.00 62.32 O HETATM 2738 O HOH 133 -13.457 1.149 -13.812 1.00 41.66 O HETATM 2739 O HOH 134 -9.886 -0.619 -0.074 1.00 53.09 O HETATM 2740 O HOH 135 -9.810 33.055 -32.942 1.00 52.07 O HETATM 2741 O HOH 136 -8.347 1.402 -28.741 1.00 43.80 O HETATM 2742 O HOH 137 -3.853 29.811 -32.619 1.00 41.59 O HETATM 2743 O HOH 138 8.333 1.304 -15.067 1.00 40.90 O HETATM 2744 O HOH 139 -21.117 29.732 -20.773 1.00 69.01 O HETATM 2745 O HOH 140 -13.981 13.660 -32.345 1.00 52.26 O HETATM 2746 O HOH 141 -9.063 36.649 -30.575 1.00 46.26 O HETATM 2747 O HOH 142 -6.191 3.159 14.660 1.00 50.33 O HETATM 2748 O HOH 143 1.135 28.377 -34.222 1.00 34.44 O HETATM 2749 O HOH 144 2.658 30.609 -32.429 1.00 38.05 O HETATM 2750 O HOH 145 -6.744 -1.900 -1.007 1.00 41.63 O HETATM 2751 O HOH 146 -18.248 20.021 -19.168 1.00 50.55 O HETATM 2752 O HOH 147 -16.263 -7.098 -22.244 1.00 42.34 O HETATM 2753 O HOH 148 -14.631 -7.015 -19.568 1.00 38.23 O HETATM 2754 O HOH 149 10.854 6.812 10.070 1.00 69.40 O HETATM 2755 O HOH 150 -4.593 7.227 -30.313 1.00 52.04 O HETATM 2756 O HOH 151 3.309 2.568 -9.765 1.00 32.71 O HETATM 2757 O HOH 152 -14.652 -0.229 -29.418 1.00 39.47 O HETATM 2758 O HOH 153 4.751 13.978 18.978 1.00 69.94 O HETATM 2759 O HOH 154 -4.192 34.313 -17.158 1.00 71.07 O HETATM 2760 O HOH 155 -20.116 3.278 -22.002 1.00 49.40 O HETATM 2761 O HOH 156 3.131 22.816 -5.685 1.00 48.13 O HETATM 2762 O HOH 157 -0.830 25.541 -17.803 1.00 43.40 O HETATM 2763 O HOH 158 -7.368 2.069 11.347 1.00 49.76 O HETATM 2764 O HOH 159 13.354 8.270 -18.187 1.00 47.01 O HETATM 2765 O HOH 160 -0.225 5.573 -34.129 1.00 48.06 O HETATM 2766 O HOH 161 -0.696 22.291 -40.269 1.00 70.55 O HETATM 2767 O HOH 162 10.211 5.548 -8.985 1.00 70.60 O HETATM 2768 O HOH 163 -2.604 23.206 5.425 1.00 53.07 O HETATM 2769 O HOH 164 -11.777 19.765 -37.643 1.00 68.04 O HETATM 2770 O HOH 165 17.780 21.788 -17.404 1.00 52.90 O HETATM 2771 O HOH 166 -4.019 24.282 -14.477 1.00 37.80 O HETATM 2772 O HOH 167 2.606 32.002 -14.530 1.00 40.39 O HETATM 2773 O HOH 168 4.057 18.259 -2.288 1.00 49.57 O HETATM 2774 O HOH 169 9.724 11.036 5.080 1.00 55.37 O HETATM 2775 O HOH 170 1.454 19.779 -40.742 1.00 65.08 O HETATM 2776 O HOH 171 1.396 1.659 -32.186 1.00 63.55 O HETATM 2777 O HOH 172 -8.680 -3.701 -16.932 1.00 52.44 O HETATM 2778 O HOH 173 -0.007 -4.642 6.792 1.00 74.26 O HETATM 2779 O HOH 174 4.612 28.297 -8.969 1.00 48.47 O HETATM 2780 O HOH 175 -6.448 13.480 9.267 1.00 60.48 O HETATM 2781 O HOH 176 17.411 15.977 -19.813 1.00 41.06 O HETATM 2782 O HOH 177 -2.426 10.134 -6.771 1.00 50.22 O HETATM 2783 O HOH 178 1.946 -1.466 -27.973 1.00 55.43 O HETATM 2784 O HOH 179 -5.558 20.185 -8.425 1.00 52.77 O HETATM 2785 O HOH 180 8.347 5.203 -25.120 1.00 52.26 O HETATM 2786 O HOH 181 -6.299 19.363 -36.653 1.00 50.14 O HETATM 2787 O HOH 182 -2.600 27.534 -34.214 1.00 55.40 O HETATM 2788 O HOH 183 -6.299 21.248 -27.642 1.00 29.20 O HETATM 2789 O HOH 184 -0.229 25.564 -37.237 1.00 49.58 O HETATM 2790 O HOH 185 11.616 21.384 -5.981 1.00 46.00 O HETATM 2791 O HOH 186 5.377 1.215 -8.701 1.00 40.54 O HETATM 2792 O HOH 187 7.383 -0.049 -10.435 1.00 60.58 O HETATM 2793 O HOH 188 -5.741 33.404 -32.616 1.00 42.71 O HETATM 2794 O HOH 189 14.389 6.443 -29.926 1.00 61.50 O HETATM 2795 O HOH 190 -14.468 -2.445 -15.831 1.00 52.94 O HETATM 2796 O HOH 191 7.588 -2.567 -12.746 1.00 51.22 O HETATM 2797 O HOH 192 0.130 -6.969 -10.722 1.00 44.10 O HETATM 2798 O HOH 193 -7.529 -2.740 -11.545 1.00 44.40 O HETATM 2799 O HOH 194 2.522 8.991 -35.627 1.00 65.95 O HETATM 2800 O HOH 195 4.362 2.019 -32.291 1.00 57.51 O HETATM 2801 O HOH 196 -13.400 11.923 -7.779 1.00 56.31 O HETATM 2802 O HOH 197 -1.833 28.070 -12.204 1.00 67.31 O HETATM 2803 O HOH 198 -19.937 7.232 -15.459 1.00 53.57 O HETATM 2804 O HOH 199 -7.656 26.031 -16.458 1.00 38.26 O HETATM 2805 O HOH 200 3.679 -0.536 -21.532 1.00 50.01 O HETATM 2806 O HOH 201 4.495 6.801 -36.220 1.00 61.96 O HETATM 2807 O HOH 202 14.975 26.491 -23.812 1.00 45.06 O HETATM 2808 O HOH 203 -11.059 14.006 -39.283 1.00 65.86 O HETATM 2809 O HOH 204 11.277 25.253 -25.533 1.00 35.94 O HETATM 2810 O HOH 205 -6.352 14.125 -39.221 1.00 56.21 O HETATM 2811 O HOH 206 3.450 15.942 -38.395 1.00 47.29 O HETATM 2812 O HOH 207 -17.774 18.425 -21.296 1.00 51.67 O HETATM 2813 O HOH 208 3.704 28.157 -35.539 1.00 53.32 O HETATM 2814 O HOH 209 0.512 36.306 -15.930 1.00 62.63 O HETATM 2815 O HOH 210 5.562 -5.272 -9.875 1.00 50.15 O HETATM 2816 O HOH 211 5.163 14.960 -36.318 1.00 62.03 O HETATM 2817 O HOH 212 -3.097 28.613 -14.940 1.00 57.06 O HETATM 2818 O HOH 213 -15.713 -9.712 -23.272 1.00 49.45 O HETATM 2819 O HOH 214 -3.349 26.134 -16.420 1.00 43.05 O HETATM 2820 O HOH 215 8.830 5.138 12.906 1.00 47.58 O HETATM 2821 O HOH 216 -14.121 7.224 -29.521 1.00 56.03 O HETATM 2822 O HOH 217 5.232 31.083 -33.262 1.00 46.05 O HETATM 2823 O HOH 218 -1.203 17.815 -38.418 1.00 48.26 O HETATM 2824 O HOH 219 16.128 9.075 -17.833 1.00 55.21 O HETATM 2825 O HOH 220 -2.925 3.674 -25.230 1.00 32.58 O HETATM 2826 O HOH 221 -10.083 -3.077 -10.705 1.00 46.52 O HETATM 2827 O HOH 222 5.266 9.108 -38.484 1.00 70.49 O HETATM 2828 O HOH 223 -13.649 21.536 -2.780 1.00 49.80 O HETATM 2829 O HOH 224 -3.779 21.567 -36.645 1.00 36.31 O HETATM 2830 O HOH 225 8.244 17.552 -37.741 1.00 54.32 O HETATM 2831 O HOH 226 -2.703 23.980 -35.563 1.00 44.52 O HETATM 2832 O HOH 227 14.781 24.299 -28.307 1.00 53.00 O HETATM 2833 O HOH 228 17.071 24.411 -26.914 1.00 58.06 O HETATM 2834 O HOH 229 9.942 13.701 1.940 1.00 48.76 O HETATM 2835 O HOH 230 2.051 14.079 -40.265 1.00 61.69 O HETATM 2836 N3 UNN A 231 1.387 11.920 -3.590 1.00 -0.27 N HETATM 2837 C4 UNN A 231 1.479 13.277 -3.543 1.00 0.14 C HETATM 2838 N2 UNN A 231 2.547 13.995 -3.163 1.00 -0.28 N HETATM 2839 C1 UNN A 231 2.369 15.317 -3.303 1.00 0.05 C HETATM 2840 N1 UNN A 231 1.287 15.983 -3.723 1.00 -0.27 N HETATM 2841 C2 UNN A 231 0.249 15.206 -4.084 1.00 0.12 C HETATM 2842 C3 UNN A 231 0.217 13.789 -4.031 1.00 0.04 C HETATM 2843 C6 UNN A 231 -0.600 12.632 -4.328 1.00 -0.05 C HETATM 2844 C5 UNN A 231 0.156 11.540 -4.061 1.00 0.02 C HETATM 2845 H14 UNN A 231 -0.167 10.509 -4.200 1.00 0.09 H HETATM 2846 H4 UNN A 231 -1.625 12.638 -4.695 1.00 0.03 H HETATM 2847 N4 UNN A 231 -0.940 15.869 -4.595 1.00 -0.28 N HETATM 2848 C8 UNN A 231 -2.097 15.191 -5.192 1.00 0.03 C HETATM 2849 C7 UNN A 231 -3.056 16.316 -5.576 1.00 -0.03 C HETATM 2850 C9 UNN A 231 -2.535 17.534 -4.806 1.00 -0.01 C HETATM 2851 C13 UNN A 231 -2.947 18.923 -5.319 1.00 -0.03 C HETATM 2852 C12 UNN A 231 -2.126 19.288 -6.565 1.00 0.03 C HETATM 2853 N5 UNN A 231 -0.682 19.223 -6.310 1.00 -0.27 N HETATM 2854 C11 UNN A 231 -0.261 17.852 -6.013 1.00 0.06 C HETATM 2855 C10 UNN A 231 -1.013 17.329 -4.793 1.00 0.07 C HETATM 2856 H15 UNN A 231 -0.585 17.840 -3.918 1.00 0.06 H HETATM 2857 H16 UNN A 231 0.820 17.839 -5.808 1.00 0.05 H HETATM 2858 H17 UNN A 231 -0.478 17.209 -6.878 1.00 0.05 H HETATM 2859 C14 UNN A 231 0.181 20.262 -6.274 1.00 0.18 C HETATM 2860 O1 UNN A 231 1.339 20.119 -5.911 1.00 -0.40 O HETATM 2861 C15 UNN A 231 -0.329 21.624 -6.685 1.00 0.03 C HETATM 2862 C16 UNN A 231 -0.230 21.769 -8.190 1.00 -0.05 C HETATM 2863 H10 UNN A 231 -0.601 22.761 -8.488 1.00 0.03 H HETATM 2864 H11 UNN A 231 -0.837 20.989 -8.674 1.00 0.03 H HETATM 2865 H12 UNN A 231 0.820 21.662 -8.500 1.00 0.03 H HETATM 2866 H20 UNN A 231 -1.379 21.731 -6.375 1.00 0.05 H HETATM 2867 H21 UNN A 231 0.278 22.404 -6.201 1.00 0.05 H HETATM 2868 H18 UNN A 231 -2.386 20.311 -6.875 1.00 0.05 H HETATM 2869 H19 UNN A 231 -2.376 18.585 -7.373 1.00 0.05 H HETATM 2870 H6 UNN A 231 -2.767 19.670 -4.532 1.00 0.03 H HETATM 2871 H7 UNN A 231 -4.016 18.913 -5.577 1.00 0.03 H HETATM 2872 H5 UNN A 231 -2.910 17.466 -3.774 1.00 0.03 H HETATM 2873 H2 UNN A 231 -3.028 16.499 -6.660 1.00 0.03 H HETATM 2874 H3 UNN A 231 -4.085 16.073 -5.271 1.00 0.03 H HETATM 2875 H8 UNN A 231 -1.794 14.620 -6.082 1.00 0.05 H HETATM 2876 H9 UNN A 231 -2.567 14.514 -4.464 1.00 0.05 H HETATM 2877 H13 UNN A 231 3.221 15.932 -3.039 1.00 0.10 H HETATM 2878 H1 UNN A 231 2.136 11.270 -3.311 1.00 0.23 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 174 175 178 179 180 CONECT 178 174 CONECT 179 174 CONECT 180 174 CONECT 732 733 740 741 742 CONECT 740 732 CONECT 741 732 CONECT 742 732 CONECT 2103 2104 2108 2109 2110 CONECT 2108 2103 CONECT 2109 2103 CONECT 2110 2103 CONECT 2836 2837 2844 2878 CONECT 2837 2836 2838 2842 CONECT 2838 2837 2839 CONECT 2839 2838 2840 2877 CONECT 2840 2839 2841 CONECT 2841 2840 2842 2847 CONECT 2842 2837 2841 2843 CONECT 2843 2842 2844 2846 CONECT 2844 2836 2843 2845 CONECT 2845 2844 CONECT 2846 2843 CONECT 2847 2841 2848 2855 CONECT 2848 2847 2849 2875 2876 CONECT 2849 2848 2850 2873 2874 CONECT 2850 2849 2851 2855 2872 CONECT 2851 2850 2852 2870 2871 CONECT 2852 2851 2853 2868 2869 CONECT 2853 2852 2854 2859 CONECT 2854 2853 2855 2857 2858 CONECT 2855 2847 2850 2854 2856 CONECT 2856 2855 CONECT 2857 2854 CONECT 2858 2854 CONECT 2859 2853 2860 2861 CONECT 2860 2859 CONECT 2861 2859 2862 2866 2867 CONECT 2862 2861 2863 2864 2865 CONECT 2863 2862 CONECT 2864 2862 CONECT 2865 2862 CONECT 2866 2861 CONECT 2867 2861 CONECT 2868 2852 CONECT 2869 2852 CONECT 2870 2851 CONECT 2871 2851 CONECT 2872 2850 CONECT 2873 2849 CONECT 2874 2849 CONECT 2875 2848 CONECT 2876 2848 CONECT 2877 2839 CONECT 2878 2836 MASTER 0 0 0 0 0 0 0 0 2874 4 59 23 END
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Related entries of code: 5ttu
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Protein Sequence Similarity
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327aa, >3LXK_1|Chain... *
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327aa, >3LXL_1|Chain... at 100%
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3zep
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4hvg
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PDBbind
314aa, >4HVG_1|Chain... at 99%
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314aa, >4HVH_1|Chain... at 99%
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4i6q
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314aa, >4I6Q_1|Chain... at 99%
4qps
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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
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PDBbind
294aa, >5LWN_1|Chain... at 98%
5toz
RCSB PDB
PDBbind
321aa, >5TOZ_1|Chain... at 100%
5tts
RCSB PDB
PDBbind
321aa, >5TTS_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%
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PDBbind
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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
5ttu
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK3
Ligand Name
7KV
EC.Number
E.C.-.-.-.-
Resolution
1.72(Å)
Affinity (Kd/Ki/IC50)
IC50=47nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 1971-1993
Ligand Properties
Formula
C
1
6
H
2
1
N
5
O
Molecular Weight
299.371
Exact Mass
299.175
No. of atoms
43
No. of bonds
46
Polar Surface Area
65.12
LOGP Value
1.67 (
Computed with XLOGP3
)
1.80 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 4
Canonical SMILES
CCC(=O)N1CC[C@@H]2[C@H](C1)N(CC2)c1ncnc2c1cc[nH]2
InChI String
InChI=1S/C16H21N5O/c1-2-14(22)20-7-4-11-5-8-21(13(11)9-20)16-12-3-6-17-15(12)18-10-19-16/h3,6,10-11,13H,2,4-5,7-9H2,1H3,(H,17,18,19)/t11-,13-/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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