Browse entries in the PDBbind-CN Database
HEADER 5TTV_COMPLEX COMPND 5TTV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 44 PRO THR ILE PHE GLU GLU ARG HIS LEU LYS TYR ILE SER SEQRES 2 A 44 GLN LEU GLY LYS GLY ASN PHE GLY SER VAL GLU LEU CYS SEQRES 3 A 44 ARG TYR ASP PRO LEU GLY ASP ASN THR GLY ALA LEU VAL SEQRES 4 A 44 ALA VAL LYS GLN LEU SEQRES 1 A 178 GLY PRO ASP GLN GLN ARG ASP PHE GLN ARG GLU ILE GLN SEQRES 2 A 178 ILE LEU LYS ALA LEU HIS SER ASP PHE ILE VAL LYS TYR SEQRES 3 A 178 ARG GLY VAL SER TYR GLY PRO GLY ARG GLN SER LEU ARG SEQRES 4 A 178 LEU VAL MET GLU TYR LEU PRO SER GLY CYS LEU ARG ASP SEQRES 5 A 178 PHE LEU GLN ARG HIS ARG ALA ARG LEU ASP ALA SER ARG SEQRES 6 A 178 LEU LEU LEU TYR SER SER GLN ILE CYS LYS GLY MET GLU SEQRES 7 A 178 TYR LEU GLY SER ARG ARG CYS VAL HIS ARG ASP LEU ALA SEQRES 8 A 178 ALA ARG ASN ILE LEU VAL GLU SER GLU ALA HIS VAL LYS SEQRES 9 A 178 ILE ALA ASP PHE GLY LEU ALA LYS LEU LEU PRO LEU ASP SEQRES 10 A 178 LYS ASP TYR TYR VAL VAL ARG GLU PRO GLY GLN SER PRO SEQRES 11 A 178 ILE PHE TRP TYR ALA PRO GLU SER LEU SER ASP ASN ILE SEQRES 12 A 178 PHE SER ARG GLN SER ASP VAL TRP SER PHE GLY VAL VAL SEQRES 13 A 178 LEU TYR GLU LEU PHE THR TYR CYS ASP LYS SER CYS SER SEQRES 14 A 178 PRO SER ALA GLU PHE LEU ARG MET MET SEQRES 1 A 58 ASP VAL PRO ALA LEU SER ARG LEU LEU GLU LEU LEU GLU SEQRES 2 A 58 GLU GLY GLN ARG LEU PRO ALA PRO PRO ALA CYS PRO ALA SEQRES 3 A 58 GLU VAL HIS GLU LEU MET LYS LEU CYS TRP ALA PRO SER SEQRES 4 A 58 PRO GLN ASP ARG PRO SER PHE SER ALA LEU GLY PRO GLN SEQRES 5 A 58 LEU ASP MET LEU TRP SER HET UNN A 406 34 ATOM 1 N PRO A 814 2.171 -4.390 6.368 1.00 51.08 N ATOM 2 CA PRO A 814 2.849 -3.248 5.736 1.00 50.46 C ATOM 3 C PRO A 814 1.869 -2.268 5.100 1.00 52.65 C ATOM 4 O PRO A 814 1.993 -1.051 5.281 1.00 51.92 O ATOM 5 CB PRO A 814 3.760 -3.917 4.697 1.00 52.21 C ATOM 6 CG PRO A 814 4.039 -5.305 5.273 1.00 56.95 C ATOM 7 CD PRO A 814 3.022 -5.596 6.363 1.00 52.74 C ATOM 8 HN2 PRO A 814 1.294 -4.593 5.847 1.00 0.00 H ATOM 9 HN1 PRO A 814 1.940 -4.144 7.352 1.00 0.00 H ATOM 10 N THR A 815 0.894 -2.815 4.360 1.00 48.37 N ATOM 11 CA THR A 815 -0.155 -2.092 3.643 1.00 47.72 C ATOM 12 C THR A 815 -1.272 -1.542 4.583 1.00 47.88 C ATOM 13 O THR A 815 -2.041 -0.679 4.141 1.00 47.89 O ATOM 14 CB THR A 815 -0.705 -2.976 2.494 1.00 59.72 C ATOM 15 OG1 THR A 815 -0.691 -4.357 2.893 1.00 54.63 O ATOM 16 CG2 THR A 815 0.092 -2.809 1.195 1.00 60.05 C ATOM 17 HG1 THR A 815 0.238 -4.630 3.101 1.00 0.00 H ATOM 18 H THR A 815 0.883 -3.853 4.289 1.00 0.00 H ATOM 19 N ILE A 816 -1.356 -2.021 5.861 1.00 41.03 N ATOM 20 CA ILE A 816 -2.340 -1.552 6.862 1.00 39.56 C ATOM 21 C ILE A 816 -1.679 -0.469 7.741 1.00 40.69 C ATOM 22 O ILE A 816 -0.949 -0.802 8.676 1.00 40.56 O ATOM 23 CB ILE A 816 -3.022 -2.704 7.721 1.00 42.88 C ATOM 24 CG1 ILE A 816 -3.737 -3.757 6.837 1.00 43.35 C ATOM 25 CG2 ILE A 816 -4.000 -2.141 8.794 1.00 43.37 C ATOM 26 CD1 ILE A 816 -4.251 -5.088 7.576 1.00 43.03 C ATOM 27 H ILE A 816 -0.685 -2.762 6.148 1.00 0.00 H ATOM 28 N PHE A 817 -1.918 0.826 7.422 1.00 34.64 N ATOM 29 CA PHE A 817 -1.365 1.950 8.189 1.00 32.62 C ATOM 30 C PHE A 817 -2.394 2.326 9.259 1.00 34.80 C ATOM 31 O PHE A 817 -3.542 2.600 8.928 1.00 34.68 O ATOM 32 CB PHE A 817 -1.070 3.171 7.279 1.00 33.01 C ATOM 33 CG PHE A 817 0.049 3.037 6.269 1.00 32.55 C ATOM 34 CD1 PHE A 817 -0.150 2.367 5.069 1.00 33.93 C ATOM 35 CD2 PHE A 817 1.278 3.644 6.486 1.00 33.64 C ATOM 36 CE1 PHE A 817 0.881 2.261 4.127 1.00 34.59 C ATOM 37 CE2 PHE A 817 2.298 3.560 5.531 1.00 35.87 C ATOM 38 CZ PHE A 817 2.094 2.869 4.359 1.00 33.73 C ATOM 39 H PHE A 817 -2.519 1.033 6.599 1.00 0.00 H ATOM 40 N GLU A 818 -2.003 2.344 10.525 1.00 30.08 N ATOM 41 CA GLU A 818 -2.963 2.696 11.583 1.00 29.49 C ATOM 42 C GLU A 818 -3.155 4.201 11.688 1.00 33.16 C ATOM 43 O GLU A 818 -2.179 4.952 11.792 1.00 31.95 O ATOM 44 CB GLU A 818 -2.606 2.039 12.918 1.00 30.19 C ATOM 45 CG GLU A 818 -2.934 0.554 12.914 1.00 38.04 C ATOM 46 CD GLU A 818 -2.447 -0.203 14.132 1.00 52.01 C ATOM 47 OE1 GLU A 818 -1.635 -1.143 13.968 1.00 46.77 O ATOM 48 OE2 GLU A 818 -2.843 0.178 15.256 1.00 30.51 O ATOM 49 H GLU A 818 -1.020 2.110 10.770 1.00 0.00 H ATOM 50 N GLU A 819 -4.435 4.640 11.603 1.00 29.06 N ATOM 51 CA GLU A 819 -4.872 6.040 11.635 1.00 27.60 C ATOM 52 C GLU A 819 -4.356 6.768 12.891 1.00 27.87 C ATOM 53 O GLU A 819 -4.126 7.973 12.877 1.00 25.95 O ATOM 54 CB GLU A 819 -6.407 6.095 11.589 1.00 29.25 C ATOM 55 CG GLU A 819 -7.016 5.937 10.204 1.00 40.66 C ATOM 56 CD GLU A 819 -6.825 7.153 9.322 1.00 57.18 C ATOM 57 OE1 GLU A 819 -5.927 7.104 8.453 1.00 23.86 O ATOM 58 OE2 GLU A 819 -7.487 8.188 9.570 1.00 52.55 O ATOM 59 H GLU A 819 -5.176 3.917 11.506 1.00 0.00 H ATOM 60 N ARG A 820 -4.196 6.031 13.979 1.00 24.41 N ATOM 61 CA ARG A 820 -3.667 6.600 15.210 1.00 26.20 C ATOM 62 C ARG A 820 -2.211 7.039 14.974 1.00 31.36 C ATOM 63 O ARG A 820 -1.793 8.060 15.511 1.00 31.66 O ATOM 64 CB ARG A 820 -3.750 5.578 16.347 1.00 27.66 C ATOM 65 CG ARG A 820 -3.214 4.189 15.970 1.00 36.62 C ATOM 66 CD ARG A 820 -3.950 3.085 16.696 1.00 33.30 C ATOM 67 NE ARG A 820 -3.588 3.057 18.106 1.00 33.87 N ATOM 68 CZ ARG A 820 -2.568 2.372 18.602 1.00 42.48 C ATOM 69 NH1 ARG A 820 -2.307 2.409 19.902 1.00 37.72 N ATOM 70 NH2 ARG A 820 -1.800 1.639 17.803 1.00 28.13 N ATOM 71 HE ARG A 820 -4.168 3.611 18.768 1.00 0.00 H ATOM 72 HH12 ARG A 820 -1.505 1.870 20.287 1.00 0.00 H ATOM 73 HH11 ARG A 820 -2.904 2.977 20.536 1.00 0.00 H ATOM 74 HH22 ARG A 820 -1.001 1.103 18.198 1.00 0.00 H ATOM 75 HH21 ARG A 820 -1.998 1.601 16.783 1.00 0.00 H ATOM 76 H ARG A 820 -4.454 5.024 13.954 1.00 0.00 H ATOM 77 N HIS A 821 -1.470 6.287 14.130 1.00 28.29 N ATOM 78 CA HIS A 821 -0.068 6.553 13.829 1.00 28.35 C ATOM 79 C HIS A 821 0.069 7.492 12.642 1.00 28.19 C ATOM 80 O HIS A 821 1.179 7.855 12.270 1.00 29.22 O ATOM 81 CB HIS A 821 0.716 5.253 13.609 1.00 30.27 C ATOM 82 CG HIS A 821 0.710 4.297 14.764 1.00 34.70 C ATOM 83 ND1 HIS A 821 0.605 4.735 16.076 1.00 37.03 N ATOM 84 CD2 HIS A 821 0.801 2.950 14.759 1.00 36.71 C ATOM 85 CE1 HIS A 821 0.651 3.648 16.822 1.00 36.73 C ATOM 86 NE2 HIS A 821 0.736 2.546 16.074 1.00 37.26 N ATOM 87 H HIS A 821 -1.925 5.473 13.669 1.00 0.00 H ATOM 88 N LEU A 822 -1.060 7.893 12.051 1.00 22.49 N ATOM 89 CA LEU A 822 -1.074 8.825 10.943 1.00 20.30 C ATOM 90 C LEU A 822 -1.343 10.179 11.549 1.00 24.22 C ATOM 91 O LEU A 822 -2.395 10.406 12.146 1.00 22.54 O ATOM 92 CB LEU A 822 -2.097 8.418 9.895 1.00 19.45 C ATOM 93 CG LEU A 822 -1.657 7.344 8.913 1.00 21.81 C ATOM 94 CD1 LEU A 822 -2.765 7.058 7.919 1.00 20.66 C ATOM 95 CD2 LEU A 822 -0.459 7.819 8.083 1.00 17.20 C ATOM 96 H LEU A 822 -1.966 7.521 12.401 1.00 0.00 H ATOM 97 N LYS A 823 -0.284 10.995 11.581 1.00 22.45 N ATOM 98 CA LYS A 823 -0.248 12.324 12.208 1.00 21.13 C ATOM 99 C LYS A 823 -0.326 13.423 11.149 1.00 21.21 C ATOM 100 O LYS A 823 0.545 13.488 10.283 1.00 19.74 O ATOM 101 CB LYS A 823 1.039 12.474 13.052 1.00 23.29 C ATOM 102 CG LYS A 823 1.401 11.275 13.937 1.00 28.32 C ATOM 103 CD LYS A 823 0.669 11.301 15.271 1.00 32.79 C ATOM 104 CE LYS A 823 1.072 10.131 16.131 1.00 44.14 C ATOM 105 NZ LYS A 823 0.321 10.114 17.413 1.00 52.70 N ATOM 106 HZ1 LYS A 823 0.513 10.991 17.938 1.00 0.00 H ATOM 107 HZ2 LYS A 823 -0.698 10.043 17.216 1.00 0.00 H ATOM 108 HZ3 LYS A 823 0.623 9.296 17.980 1.00 0.00 H ATOM 109 H LYS A 823 0.588 10.661 11.123 1.00 0.00 H ATOM 110 N TYR A 824 -1.363 14.278 11.207 1.00 19.53 N ATOM 111 CA TYR A 824 -1.579 15.354 10.202 1.00 21.41 C ATOM 112 C TYR A 824 -0.481 16.423 10.154 1.00 25.91 C ATOM 113 O TYR A 824 -0.087 16.964 11.196 1.00 22.59 O ATOM 114 CB TYR A 824 -2.953 16.031 10.427 1.00 24.07 C ATOM 115 CG TYR A 824 -3.263 17.207 9.516 1.00 28.55 C ATOM 116 CD1 TYR A 824 -3.665 17.009 8.198 1.00 30.22 C ATOM 117 CD2 TYR A 824 -3.219 18.515 9.992 1.00 29.76 C ATOM 118 CE1 TYR A 824 -3.926 18.088 7.351 1.00 30.26 C ATOM 119 CE2 TYR A 824 -3.476 19.600 9.154 1.00 30.47 C ATOM 120 CZ TYR A 824 -3.846 19.380 7.839 1.00 39.39 C ATOM 121 OH TYR A 824 -4.131 20.443 7.018 1.00 42.49 O ATOM 122 HH TYR A 824 -4.376 20.108 6.119 1.00 0.00 H ATOM 123 H TYR A 824 -2.043 14.183 11.988 1.00 0.00 H ATOM 124 N ILE A 825 -0.027 16.769 8.919 1.00 23.05 N ATOM 125 CA ILE A 825 0.887 17.885 8.702 1.00 23.01 C ATOM 126 C ILE A 825 0.184 18.998 7.938 1.00 27.30 C ATOM 127 O ILE A 825 -0.176 20.009 8.531 1.00 27.41 O ATOM 128 CB ILE A 825 2.268 17.535 8.098 1.00 25.68 C ATOM 129 CG1 ILE A 825 3.003 16.505 8.992 1.00 25.92 C ATOM 130 CG2 ILE A 825 3.103 18.840 7.886 1.00 26.54 C ATOM 131 CD1 ILE A 825 4.161 15.848 8.393 1.00 31.86 C ATOM 132 H ILE A 825 -0.344 16.216 8.097 1.00 0.00 H ATOM 133 N SER A 826 0.015 18.852 6.623 1.00 23.68 N ATOM 134 CA SER A 826 -0.619 19.957 5.889 1.00 22.57 C ATOM 135 C SER A 826 -1.651 19.489 4.857 1.00 26.87 C ATOM 136 O SER A 826 -1.893 18.291 4.748 1.00 24.34 O ATOM 137 CB SER A 826 0.445 20.846 5.254 1.00 22.57 C ATOM 138 OG SER A 826 1.399 20.080 4.544 1.00 33.80 O ATOM 139 HG SER A 826 2.074 20.684 4.145 1.00 0.00 H ATOM 140 H SER A 826 0.321 17.987 6.134 1.00 0.00 H ATOM 141 N GLN A 827 -2.332 20.445 4.170 1.00 23.86 N ATOM 142 CA GLN A 827 -3.275 20.118 3.092 1.00 23.46 C ATOM 143 C GLN A 827 -2.401 20.082 1.848 1.00 25.16 C ATOM 144 O GLN A 827 -1.658 21.040 1.624 1.00 24.33 O ATOM 145 CB GLN A 827 -4.357 21.223 2.925 1.00 24.47 C ATOM 146 CG GLN A 827 -5.681 20.943 3.640 1.00 41.03 C ATOM 147 CD GLN A 827 -6.601 19.982 2.920 1.00 61.48 C ATOM 148 OE1 GLN A 827 -6.352 19.530 1.789 1.00 51.38 O ATOM 149 NE2 GLN A 827 -7.715 19.665 3.564 1.00 59.67 N ATOM 150 HE22 GLN A 827 -7.899 20.057 4.509 1.00 0.00 H ATOM 151 HE21 GLN A 827 -8.406 19.024 3.124 1.00 0.00 H ATOM 152 H GLN A 827 -2.180 21.444 4.417 1.00 0.00 H ATOM 153 N LEU A 828 -2.408 18.979 1.081 1.00 19.47 N ATOM 154 CA LEU A 828 -1.604 18.981 -0.140 1.00 19.08 C ATOM 155 C LEU A 828 -2.427 19.514 -1.308 1.00 28.98 C ATOM 156 O LEU A 828 -1.895 20.238 -2.153 1.00 31.38 O ATOM 157 CB LEU A 828 -0.985 17.612 -0.447 1.00 16.57 C ATOM 158 CG LEU A 828 0.265 17.301 0.323 1.00 18.48 C ATOM 159 CD1 LEU A 828 0.749 15.866 0.032 1.00 16.47 C ATOM 160 CD2 LEU A 828 1.340 18.295 0.023 1.00 18.59 C ATOM 161 H LEU A 828 -2.970 18.146 1.349 1.00 0.00 H ATOM 162 N GLY A 829 -3.720 19.208 -1.299 1.00 28.26 N ATOM 163 CA GLY A 829 -4.634 19.685 -2.320 1.00 29.91 C ATOM 164 C GLY A 829 -6.069 19.230 -2.195 1.00 36.12 C ATOM 165 O GLY A 829 -6.436 18.440 -1.314 1.00 33.24 O ATOM 166 H GLY A 829 -4.089 18.607 -0.535 1.00 0.00 H ATOM 167 N LYS A 830 -6.882 19.770 -3.104 1.00 34.46 N ATOM 168 CA LYS A 830 -8.305 19.518 -3.230 1.00 33.91 C ATOM 169 C LYS A 830 -8.693 19.459 -4.707 1.00 40.98 C ATOM 170 O LYS A 830 -8.431 20.395 -5.466 1.00 41.00 O ATOM 171 CB LYS A 830 -9.131 20.578 -2.469 1.00 34.13 C ATOM 172 CG LYS A 830 -8.719 22.030 -2.734 1.00 32.82 C ATOM 173 CD LYS A 830 -9.592 23.045 -2.012 1.00 37.92 C ATOM 174 CE LYS A 830 -10.167 24.074 -2.963 1.00 47.31 C ATOM 175 NZ LYS A 830 -11.151 23.480 -3.919 1.00 46.51 N ATOM 176 HZ1 LYS A 830 -10.682 22.745 -4.486 1.00 0.00 H ATOM 177 HZ2 LYS A 830 -11.939 23.059 -3.387 1.00 0.00 H ATOM 178 HZ3 LYS A 830 -11.515 24.225 -4.547 1.00 0.00 H ATOM 179 H LYS A 830 -6.457 20.432 -3.784 1.00 0.00 H ATOM 180 N GLY A 831 -9.318 18.356 -5.090 1.00 39.20 N ATOM 181 CA GLY A 831 -9.765 18.146 -6.456 1.00 40.02 C ATOM 182 C GLY A 831 -10.579 16.888 -6.619 1.00 44.08 C ATOM 183 O GLY A 831 -10.224 15.846 -6.063 1.00 44.82 O ATOM 184 H GLY A 831 -9.496 17.612 -4.386 1.00 0.00 H ATOM 185 N ASN A 832 -11.662 16.984 -7.419 1.00 39.54 N ATOM 186 CA ASN A 832 -12.609 15.908 -7.750 1.00 39.41 C ATOM 187 C ASN A 832 -13.195 15.221 -6.482 1.00 43.92 C ATOM 188 O ASN A 832 -12.961 14.031 -6.241 1.00 43.27 O ATOM 189 CB ASN A 832 -12.010 14.891 -8.761 1.00 34.89 C ATOM 190 CG ASN A 832 -10.810 15.399 -9.543 1.00 55.60 C ATOM 191 OD1 ASN A 832 -9.665 15.101 -9.215 1.00 41.55 O ATOM 192 ND2 ASN A 832 -11.036 16.220 -10.558 1.00 52.36 N ATOM 193 HD22 ASN A 832 -12.012 16.463 -10.823 1.00 0.00 H ATOM 194 HD21 ASN A 832 -10.237 16.622 -11.089 1.00 0.00 H ATOM 195 H ASN A 832 -11.846 17.915 -7.845 1.00 0.00 H ATOM 196 N PHE A 833 -13.954 16.021 -5.678 1.00 40.83 N ATOM 197 CA PHE A 833 -14.680 15.712 -4.424 1.00 40.03 C ATOM 198 C PHE A 833 -13.799 15.491 -3.184 1.00 42.25 C ATOM 199 O PHE A 833 -14.191 15.910 -2.091 1.00 42.88 O ATOM 200 CB PHE A 833 -15.674 14.534 -4.559 1.00 42.16 C ATOM 201 CG PHE A 833 -16.928 14.772 -5.384 1.00 44.08 C ATOM 202 CD1 PHE A 833 -17.725 15.895 -5.170 1.00 47.56 C ATOM 203 CD2 PHE A 833 -17.341 13.844 -6.332 1.00 45.80 C ATOM 204 CE1 PHE A 833 -18.882 16.111 -5.929 1.00 48.41 C ATOM 205 CE2 PHE A 833 -18.502 14.053 -7.083 1.00 49.29 C ATOM 206 CZ PHE A 833 -19.270 15.183 -6.874 1.00 47.85 C ATOM 207 H PHE A 833 -14.036 17.007 -5.997 1.00 0.00 H ATOM 208 N GLY A 834 -12.660 14.821 -3.335 1.00 35.14 N ATOM 209 CA GLY A 834 -11.802 14.523 -2.193 1.00 33.09 C ATOM 210 C GLY A 834 -10.773 15.575 -1.819 1.00 34.29 C ATOM 211 O GLY A 834 -10.890 16.748 -2.196 1.00 34.70 O ATOM 212 H GLY A 834 -12.376 14.504 -4.284 1.00 0.00 H ATOM 213 N SER A 835 -9.762 15.149 -1.039 1.00 25.91 N ATOM 214 CA SER A 835 -8.653 15.986 -0.575 1.00 24.72 C ATOM 215 C SER A 835 -7.414 15.118 -0.300 1.00 24.66 C ATOM 216 O SER A 835 -7.556 13.909 -0.072 1.00 21.68 O ATOM 217 CB SER A 835 -9.063 16.814 0.650 1.00 26.37 C ATOM 218 OG SER A 835 -9.159 16.090 1.867 1.00 29.09 O ATOM 219 HG SER A 835 -9.427 16.705 2.595 1.00 0.00 H ATOM 220 H SER A 835 -9.769 14.152 -0.744 1.00 0.00 H ATOM 221 N VAL A 836 -6.193 15.692 -0.424 1.00 22.37 N ATOM 222 CA VAL A 836 -4.985 14.913 -0.173 1.00 22.66 C ATOM 223 C VAL A 836 -4.228 15.561 0.986 1.00 24.55 C ATOM 224 O VAL A 836 -3.979 16.750 0.940 1.00 25.68 O ATOM 225 CB VAL A 836 -4.099 14.683 -1.444 1.00 28.15 C ATOM 226 CG1 VAL A 836 -2.913 13.778 -1.137 1.00 27.00 C ATOM 227 CG2 VAL A 836 -4.918 14.107 -2.593 1.00 28.60 C ATOM 228 H VAL A 836 -6.116 16.692 -0.699 1.00 0.00 H ATOM 229 N GLU A 837 -3.897 14.812 2.046 1.00 20.77 N ATOM 230 CA GLU A 837 -3.210 15.461 3.155 1.00 21.42 C ATOM 231 C GLU A 837 -1.830 14.934 3.389 1.00 27.53 C ATOM 232 O GLU A 837 -1.519 13.761 3.137 1.00 26.97 O ATOM 233 CB GLU A 837 -4.053 15.459 4.431 1.00 23.66 C ATOM 234 CG GLU A 837 -5.111 16.554 4.351 1.00 33.92 C ATOM 235 CD GLU A 837 -6.326 16.482 5.259 1.00 48.83 C ATOM 236 OE1 GLU A 837 -6.374 15.597 6.146 1.00 26.86 O ATOM 237 OE2 GLU A 837 -7.224 17.341 5.094 1.00 45.83 O ATOM 238 H GLU A 837 -4.124 13.797 2.077 1.00 0.00 H ATOM 239 N LEU A 838 -0.961 15.847 3.793 1.00 24.45 N ATOM 240 CA LEU A 838 0.390 15.451 4.100 1.00 24.03 C ATOM 241 C LEU A 838 0.367 14.932 5.532 1.00 28.75 C ATOM 242 O LEU A 838 -0.076 15.627 6.442 1.00 28.49 O ATOM 243 CB LEU A 838 1.381 16.613 3.916 1.00 22.99 C ATOM 244 CG LEU A 838 2.825 16.321 4.372 1.00 25.60 C ATOM 245 CD1 LEU A 838 3.445 15.230 3.558 1.00 23.96 C ATOM 246 CD2 LEU A 838 3.690 17.575 4.312 1.00 30.42 C ATOM 247 H LEU A 838 -1.251 16.841 3.888 1.00 0.00 H ATOM 248 N CYS A 839 0.721 13.675 5.706 1.00 24.55 N ATOM 249 CA CYS A 839 0.781 13.081 7.023 1.00 24.49 C ATOM 250 C CYS A 839 2.142 12.466 7.190 1.00 29.53 C ATOM 251 O CYS A 839 2.881 12.316 6.223 1.00 29.50 O ATOM 252 CB CYS A 839 -0.318 12.040 7.201 1.00 23.96 C ATOM 253 SG CYS A 839 -1.980 12.713 7.052 1.00 26.90 S ATOM 254 H CYS A 839 0.963 13.096 4.877 1.00 0.00 H ATOM 255 N ARG A 840 2.474 12.162 8.434 1.00 26.28 N ATOM 256 CA ARG A 840 3.702 11.515 8.859 1.00 25.09 C ATOM 257 C ARG A 840 3.209 10.188 9.418 1.00 27.36 C ATOM 258 O ARG A 840 2.281 10.199 10.230 1.00 24.25 O ATOM 259 CB ARG A 840 4.376 12.322 9.998 1.00 20.89 C ATOM 260 CG ARG A 840 5.712 11.686 10.463 1.00 29.64 C ATOM 261 CD ARG A 840 6.513 12.530 11.442 1.00 21.63 C ATOM 262 NE ARG A 840 6.839 13.868 10.932 1.00 27.94 N ATOM 263 CZ ARG A 840 7.866 14.168 10.137 1.00 45.78 C ATOM 264 NH1 ARG A 840 8.700 13.218 9.725 1.00 19.68 N ATOM 265 NH2 ARG A 840 8.057 15.417 9.734 1.00 49.91 N ATOM 266 HE ARG A 840 6.214 14.649 11.216 1.00 0.00 H ATOM 267 HH12 ARG A 840 9.499 13.460 9.105 1.00 0.00 H ATOM 268 HH11 ARG A 840 8.554 12.232 10.023 1.00 0.00 H ATOM 269 HH22 ARG A 840 8.860 15.646 9.114 1.00 0.00 H ATOM 270 HH21 ARG A 840 7.404 16.167 10.038 1.00 0.00 H ATOM 271 H ARG A 840 1.791 12.410 9.178 1.00 0.00 H ATOM 272 N TYR A 841 3.771 9.062 8.962 1.00 25.73 N ATOM 273 CA TYR A 841 3.386 7.783 9.528 1.00 25.56 C ATOM 274 C TYR A 841 4.419 7.582 10.591 1.00 28.64 C ATOM 275 O TYR A 841 5.565 7.210 10.310 1.00 26.48 O ATOM 276 CB TYR A 841 3.311 6.627 8.542 1.00 27.53 C ATOM 277 CG TYR A 841 2.783 5.391 9.240 1.00 31.15 C ATOM 278 CD1 TYR A 841 1.462 5.321 9.668 1.00 33.31 C ATOM 279 CD2 TYR A 841 3.624 4.327 9.545 1.00 32.94 C ATOM 280 CE1 TYR A 841 0.976 4.203 10.342 1.00 36.97 C ATOM 281 CE2 TYR A 841 3.153 3.207 10.233 1.00 34.21 C ATOM 282 CZ TYR A 841 1.830 3.155 10.641 1.00 45.26 C ATOM 283 OH TYR A 841 1.350 2.051 11.308 1.00 54.58 O ATOM 284 HH TYR A 841 0.393 2.186 11.521 1.00 0.00 H ATOM 285 H TYR A 841 4.482 9.104 8.204 1.00 0.00 H ATOM 286 N ASP A 842 4.014 7.988 11.802 1.00 24.43 N ATOM 287 CA ASP A 842 4.820 8.078 13.009 1.00 22.58 C ATOM 288 C ASP A 842 4.348 7.100 14.099 1.00 24.50 C ATOM 289 O ASP A 842 3.752 7.532 15.083 1.00 23.94 O ATOM 290 CB ASP A 842 4.748 9.532 13.482 1.00 23.28 C ATOM 291 CG ASP A 842 5.952 10.003 14.255 1.00 27.81 C ATOM 292 OD1 ASP A 842 7.081 9.597 13.902 1.00 29.07 O ATOM 293 OD2 ASP A 842 5.774 10.816 15.172 1.00 28.60 O ATOM 294 H ASP A 842 3.016 8.269 11.888 1.00 0.00 H ATOM 295 N PRO A 843 4.672 5.787 13.997 1.00 20.90 N ATOM 296 CA PRO A 843 4.233 4.847 15.051 1.00 21.35 C ATOM 297 C PRO A 843 4.971 5.046 16.366 1.00 27.93 C ATOM 298 O PRO A 843 4.422 4.756 17.428 1.00 26.23 O ATOM 299 CB PRO A 843 4.474 3.468 14.445 1.00 23.06 C ATOM 300 CG PRO A 843 5.420 3.669 13.346 1.00 26.86 C ATOM 301 CD PRO A 843 5.403 5.099 12.920 1.00 22.75 C ATOM 302 N LEU A 844 6.195 5.606 16.290 1.00 27.32 N ATOM 303 CA LEU A 844 7.004 5.901 17.466 1.00 28.67 C ATOM 304 C LEU A 844 6.547 7.165 18.218 1.00 36.12 C ATOM 305 O LEU A 844 6.993 7.371 19.347 1.00 36.62 O ATOM 306 CB LEU A 844 8.501 5.966 17.116 1.00 28.79 C ATOM 307 CG LEU A 844 9.125 4.771 16.342 1.00 32.97 C ATOM 308 CD1 LEU A 844 10.606 5.023 16.086 1.00 31.86 C ATOM 309 CD2 LEU A 844 8.964 3.457 17.090 1.00 35.16 C ATOM 310 H LEU A 844 6.579 5.838 15.351 1.00 0.00 H ATOM 311 N GLY A 845 5.663 7.974 17.603 1.00 34.09 N ATOM 312 CA GLY A 845 5.074 9.189 18.185 1.00 33.73 C ATOM 313 C GLY A 845 6.100 10.187 18.686 1.00 34.78 C ATOM 314 O GLY A 845 5.954 10.757 19.771 1.00 36.46 O ATOM 315 H GLY A 845 5.373 7.718 16.637 1.00 0.00 H ATOM 316 N ASP A 846 7.145 10.389 17.882 1.00 26.51 N ATOM 317 CA ASP A 846 8.311 11.205 18.206 1.00 24.57 C ATOM 318 C ASP A 846 8.832 12.046 17.016 1.00 25.44 C ATOM 319 O ASP A 846 9.971 12.508 17.059 1.00 22.36 O ATOM 320 CB ASP A 846 9.410 10.257 18.718 1.00 25.49 C ATOM 321 CG ASP A 846 10.090 9.375 17.662 1.00 30.76 C ATOM 322 OD1 ASP A 846 9.427 9.025 16.652 1.00 30.91 O ATOM 323 OD2 ASP A 846 11.279 9.037 17.845 1.00 26.74 O ATOM 324 H ASP A 846 7.128 9.928 16.950 1.00 0.00 H ATOM 325 N ASN A 847 8.014 12.192 15.951 1.00 22.57 N ATOM 326 CA ASN A 847 8.290 12.942 14.711 1.00 23.11 C ATOM 327 C ASN A 847 9.531 12.468 13.938 1.00 29.27 C ATOM 328 O ASN A 847 10.259 13.304 13.400 1.00 30.08 O ATOM 329 CB ASN A 847 8.351 14.457 14.941 1.00 19.82 C ATOM 330 CG ASN A 847 7.060 15.107 15.433 1.00 44.12 C ATOM 331 OD1 ASN A 847 5.951 14.775 15.013 1.00 46.74 O ATOM 332 ND2 ASN A 847 7.181 16.105 16.291 1.00 32.79 N ATOM 333 HD22 ASN A 847 8.121 16.379 16.641 1.00 0.00 H ATOM 334 HD21 ASN A 847 6.336 16.616 16.616 1.00 0.00 H ATOM 335 H ASN A 847 7.087 11.724 16.012 1.00 0.00 H ATOM 336 N THR A 848 9.731 11.139 13.809 1.00 26.43 N ATOM 337 CA THR A 848 10.883 10.603 13.057 1.00 26.32 C ATOM 338 C THR A 848 10.472 9.744 11.854 1.00 31.74 C ATOM 339 O THR A 848 11.265 9.576 10.925 1.00 31.75 O ATOM 340 CB THR A 848 11.885 9.857 13.953 1.00 30.38 C ATOM 341 OG1 THR A 848 11.211 8.806 14.632 1.00 30.30 O ATOM 342 CG2 THR A 848 12.638 10.785 14.938 1.00 26.69 C ATOM 343 HG1 THR A 848 10.485 9.186 15.188 1.00 0.00 H ATOM 344 H THR A 848 9.059 10.478 14.249 1.00 0.00 H ATOM 345 N GLY A 849 9.244 9.242 11.880 1.00 29.45 N ATOM 346 CA GLY A 849 8.663 8.393 10.848 1.00 28.87 C ATOM 347 C GLY A 849 8.558 9.011 9.466 1.00 30.36 C ATOM 348 O GLY A 849 8.650 10.241 9.304 1.00 29.27 O ATOM 349 H GLY A 849 8.649 9.473 12.702 1.00 0.00 H ATOM 350 N ALA A 850 8.351 8.148 8.462 1.00 24.45 N ATOM 351 CA ALA A 850 8.257 8.568 7.052 1.00 23.46 C ATOM 352 C ALA A 850 7.021 9.435 6.706 1.00 27.22 C ATOM 353 O ALA A 850 5.955 9.294 7.321 1.00 27.07 O ATOM 354 CB ALA A 850 8.324 7.362 6.144 1.00 23.86 C ATOM 355 H ALA A 850 8.252 7.138 8.687 1.00 0.00 H ATOM 356 N LEU A 851 7.177 10.346 5.738 1.00 23.26 N ATOM 357 CA LEU A 851 6.059 11.193 5.331 1.00 23.72 C ATOM 358 C LEU A 851 5.295 10.439 4.254 1.00 24.44 C ATOM 359 O LEU A 851 5.933 9.814 3.414 1.00 20.93 O ATOM 360 CB LEU A 851 6.529 12.534 4.752 1.00 24.11 C ATOM 361 CG LEU A 851 7.567 13.355 5.471 1.00 29.40 C ATOM 362 CD1 LEU A 851 8.179 14.361 4.503 1.00 29.55 C ATOM 363 CD2 LEU A 851 6.964 14.093 6.647 1.00 32.44 C ATOM 364 H LEU A 851 8.101 10.451 5.272 1.00 0.00 H ATOM 365 N VAL A 852 3.948 10.499 4.267 1.00 22.88 N ATOM 366 CA VAL A 852 3.097 9.861 3.229 1.00 21.26 C ATOM 367 C VAL A 852 1.960 10.779 2.830 1.00 20.80 C ATOM 368 O VAL A 852 1.590 11.653 3.607 1.00 22.06 O ATOM 369 CB VAL A 852 2.589 8.435 3.584 1.00 25.50 C ATOM 370 CG1 VAL A 852 3.644 7.372 3.263 1.00 26.48 C ATOM 371 CG2 VAL A 852 2.125 8.338 5.040 1.00 24.99 C ATOM 372 H VAL A 852 3.483 11.016 5.040 1.00 0.00 H ATOM 373 N ALA A 853 1.404 10.593 1.624 1.00 14.66 N ATOM 374 CA ALA A 853 0.307 11.413 1.102 1.00 16.45 C ATOM 375 C ALA A 853 -0.983 10.635 1.226 1.00 21.16 C ATOM 376 O ALA A 853 -1.108 9.554 0.658 1.00 23.25 O ATOM 377 CB ALA A 853 0.572 11.820 -0.344 1.00 16.42 C ATOM 378 H ALA A 853 1.771 9.825 1.026 1.00 0.00 H ATOM 379 N VAL A 854 -1.921 11.144 2.027 1.00 16.86 N ATOM 380 CA VAL A 854 -3.164 10.427 2.320 1.00 17.11 C ATOM 381 C VAL A 854 -4.370 11.061 1.665 1.00 22.41 C ATOM 382 O VAL A 854 -4.623 12.263 1.847 1.00 17.42 O ATOM 383 CB VAL A 854 -3.383 10.213 3.849 1.00 19.96 C ATOM 384 CG1 VAL A 854 -4.213 8.968 4.097 1.00 21.02 C ATOM 385 CG2 VAL A 854 -2.052 10.098 4.581 1.00 19.08 C ATOM 386 H VAL A 854 -1.765 12.078 2.456 1.00 0.00 H ATOM 387 N LYS A 855 -5.141 10.236 0.913 1.00 21.93 N ATOM 388 CA LYS A 855 -6.340 10.714 0.222 1.00 21.86 C ATOM 389 C LYS A 855 -7.587 10.191 0.902 1.00 27.63 C ATOM 390 O LYS A 855 -7.665 9.012 1.244 1.00 23.00 O ATOM 391 CB LYS A 855 -6.321 10.348 -1.268 1.00 24.30 C ATOM 392 CG LYS A 855 -7.316 11.128 -2.111 1.00 38.12 C ATOM 393 CD LYS A 855 -7.079 10.912 -3.596 1.00 47.85 C ATOM 394 CE LYS A 855 -7.899 11.864 -4.437 1.00 46.51 C ATOM 395 NZ LYS A 855 -7.758 11.588 -5.891 1.00 27.74 N ATOM 396 HZ1 LYS A 855 -6.760 11.688 -6.166 1.00 0.00 H ATOM 397 HZ2 LYS A 855 -8.079 10.619 -6.091 1.00 0.00 H ATOM 398 HZ3 LYS A 855 -8.337 12.264 -6.429 1.00 0.00 H ATOM 399 H LYS A 855 -4.873 9.235 0.825 1.00 0.00 H ATOM 400 N GLN A 856 -8.580 11.078 1.058 1.00 29.05 N ATOM 401 CA GLN A 856 -9.866 10.783 1.691 1.00 30.45 C ATOM 402 C GLN A 856 -10.961 11.543 0.958 1.00 32.01 C ATOM 403 O GLN A 856 -10.680 12.591 0.387 1.00 30.68 O ATOM 404 CB GLN A 856 -9.829 11.208 3.177 1.00 32.53 C ATOM 405 CG GLN A 856 -9.418 12.681 3.432 1.00 39.98 C ATOM 406 CD GLN A 856 -8.125 12.874 4.194 1.00 45.14 C ATOM 407 OE1 GLN A 856 -8.109 13.500 5.245 1.00 38.61 O ATOM 408 NE2 GLN A 856 -6.998 12.414 3.661 1.00 32.33 N ATOM 409 HE22 GLN A 856 -7.024 11.883 2.767 1.00 0.00 H ATOM 410 HE21 GLN A 856 -6.090 12.585 4.138 1.00 0.00 H ATOM 411 H GLN A 856 -8.426 12.044 0.704 1.00 0.00 H ATOM 412 N LEU A 857 -12.206 11.038 0.990 1.00 27.96 N ATOM 413 CA LEU A 857 -13.339 11.688 0.323 1.00 41.95 C ATOM 414 C LEU A 857 -13.769 12.961 1.042 1.00 67.01 C ATOM 415 O LEU A 857 -14.350 12.887 2.122 1.00 33.89 O ATOM 416 CB LEU A 857 -14.520 10.721 0.210 1.00 41.93 C ATOM 417 CG LEU A 857 -14.279 9.467 -0.609 1.00 45.93 C ATOM 418 CD1 LEU A 857 -14.940 8.284 0.036 1.00 46.04 C ATOM 419 CD2 LEU A 857 -14.745 9.656 -2.019 1.00 47.59 C ATOM 420 H LEU A 857 -12.373 10.152 1.508 1.00 0.00 H TER 421 LEU A 857 ATOM 422 N GLY A 861 -21.432 10.770 0.692 1.00 50.78 N ATOM 423 CA GLY A 861 -21.359 10.416 -0.718 1.00 50.61 C ATOM 424 C GLY A 861 -21.555 8.937 -0.986 1.00 55.29 C ATOM 425 O GLY A 861 -20.759 8.127 -0.506 1.00 55.65 O ATOM 426 HN3 GLY A 861 -20.692 10.259 1.215 1.00 0.00 H ATOM 427 HN2 GLY A 861 -22.366 10.508 1.066 1.00 0.00 H ATOM 428 HN1 GLY A 861 -21.289 11.795 0.799 1.00 0.00 H ATOM 429 N PRO A 862 -22.607 8.545 -1.757 1.00 52.09 N ATOM 430 CA PRO A 862 -22.831 7.114 -2.041 1.00 51.80 C ATOM 431 C PRO A 862 -22.095 6.584 -3.282 1.00 56.31 C ATOM 432 O PRO A 862 -21.522 5.491 -3.225 1.00 56.52 O ATOM 433 CB PRO A 862 -24.355 7.016 -2.183 1.00 53.62 C ATOM 434 CG PRO A 862 -24.829 8.420 -2.491 1.00 57.90 C ATOM 435 CD PRO A 862 -23.664 9.374 -2.372 1.00 53.68 C ATOM 436 N ASP A 863 -22.123 7.343 -4.405 1.00 51.97 N ATOM 437 CA ASP A 863 -21.437 7.011 -5.665 1.00 50.74 C ATOM 438 C ASP A 863 -20.002 7.519 -5.581 1.00 51.91 C ATOM 439 O ASP A 863 -19.142 7.128 -6.366 1.00 49.84 O ATOM 440 CB ASP A 863 -22.169 7.589 -6.898 1.00 52.60 C ATOM 441 CG ASP A 863 -23.145 8.719 -6.617 1.00 63.64 C ATOM 442 OD1 ASP A 863 -24.177 8.461 -5.957 1.00 64.05 O ATOM 443 OD2 ASP A 863 -22.901 9.848 -7.100 1.00 69.69 O ATOM 444 H ASP A 863 -22.670 8.227 -4.374 1.00 0.00 H ATOM 445 N GLN A 864 -19.758 8.384 -4.590 1.00 48.20 N ATOM 446 CA GLN A 864 -18.460 8.931 -4.261 1.00 47.66 C ATOM 447 C GLN A 864 -17.680 7.823 -3.547 1.00 52.65 C ATOM 448 O GLN A 864 -16.533 7.576 -3.909 1.00 53.35 O ATOM 449 CB GLN A 864 -18.613 10.181 -3.386 1.00 48.40 C ATOM 450 CG GLN A 864 -18.931 11.433 -4.195 1.00 53.01 C ATOM 451 CD GLN A 864 -20.318 11.949 -3.934 1.00 61.18 C ATOM 452 OE1 GLN A 864 -20.545 12.750 -3.020 1.00 49.51 O ATOM 453 NE2 GLN A 864 -21.272 11.527 -4.753 1.00 52.39 N ATOM 454 HE22 GLN A 864 -21.045 10.853 -5.511 1.00 0.00 H ATOM 455 HE21 GLN A 864 -22.247 11.871 -4.637 1.00 0.00 H ATOM 456 H GLN A 864 -20.566 8.687 -4.010 1.00 0.00 H ATOM 457 N GLN A 865 -18.343 7.081 -2.619 1.00 48.31 N ATOM 458 CA GLN A 865 -17.751 5.953 -1.888 1.00 47.29 C ATOM 459 C GLN A 865 -17.453 4.759 -2.818 1.00 49.74 C ATOM 460 O GLN A 865 -16.484 4.031 -2.579 1.00 49.67 O ATOM 461 CB GLN A 865 -18.606 5.566 -0.656 1.00 48.08 C ATOM 462 CG GLN A 865 -18.059 4.430 0.246 1.00 48.96 C ATOM 463 CD GLN A 865 -16.595 4.524 0.641 1.00 53.57 C ATOM 464 OE1 GLN A 865 -15.762 3.709 0.219 1.00 39.95 O ATOM 465 NE2 GLN A 865 -16.259 5.462 1.524 1.00 49.97 N ATOM 466 HE22 GLN A 865 -16.974 6.136 1.865 1.00 0.00 H ATOM 467 HE21 GLN A 865 -15.281 5.521 1.873 1.00 0.00 H ATOM 468 H GLN A 865 -19.332 7.328 -2.414 1.00 0.00 H ATOM 469 N ARG A 866 -18.240 4.589 -3.904 1.00 44.37 N ATOM 470 CA ARG A 866 -17.967 3.524 -4.873 1.00 42.64 C ATOM 471 C ARG A 866 -16.780 3.941 -5.754 1.00 44.20 C ATOM 472 O ARG A 866 -16.016 3.082 -6.191 1.00 44.34 O ATOM 473 CB ARG A 866 -19.201 3.191 -5.727 1.00 40.05 C ATOM 474 CG ARG A 866 -19.425 1.680 -5.867 1.00 50.54 C ATOM 475 CD ARG A 866 -20.028 1.285 -7.206 1.00 62.23 C ATOM 476 NE ARG A 866 -19.142 0.389 -7.961 1.00 69.70 N ATOM 477 CZ ARG A 866 -18.543 0.707 -9.107 1.00 80.26 C ATOM 478 NH1 ARG A 866 -18.737 1.899 -9.658 1.00 64.50 N ATOM 479 NH2 ARG A 866 -17.754 -0.170 -9.716 1.00 64.06 N ATOM 480 HE ARG A 866 -18.970 -0.561 -7.573 1.00 0.00 H ATOM 481 HH12 ARG A 866 -18.266 2.141 -10.553 1.00 0.00 H ATOM 482 HH11 ARG A 866 -19.360 2.591 -9.195 1.00 0.00 H ATOM 483 HH22 ARG A 866 -17.288 0.083 -10.611 1.00 0.00 H ATOM 484 HH21 ARG A 866 -17.602 -1.110 -9.298 1.00 0.00 H ATOM 485 H ARG A 866 -19.051 5.223 -4.054 1.00 0.00 H ATOM 486 N ASP A 867 -16.617 5.265 -5.977 1.00 38.72 N ATOM 487 CA ASP A 867 -15.560 5.850 -6.800 1.00 37.96 C ATOM 488 C ASP A 867 -14.208 5.965 -6.110 1.00 39.60 C ATOM 489 O ASP A 867 -13.196 6.100 -6.803 1.00 39.57 O ATOM 490 CB ASP A 867 -15.978 7.203 -7.385 1.00 39.67 C ATOM 491 CG ASP A 867 -16.444 7.129 -8.825 1.00 52.75 C ATOM 492 OD1 ASP A 867 -16.148 6.108 -9.501 1.00 53.93 O ATOM 493 OD2 ASP A 867 -17.079 8.099 -9.290 1.00 60.75 O ATOM 494 H ASP A 867 -17.294 5.915 -5.530 1.00 0.00 H ATOM 495 N PHE A 868 -14.188 5.898 -4.768 1.00 33.09 N ATOM 496 CA PHE A 868 -12.979 5.930 -3.946 1.00 32.69 C ATOM 497 C PHE A 868 -12.342 4.546 -3.966 1.00 35.91 C ATOM 498 O PHE A 868 -11.135 4.421 -4.200 1.00 36.21 O ATOM 499 CB PHE A 868 -13.331 6.318 -2.507 1.00 33.92 C ATOM 500 CG PHE A 868 -12.170 6.619 -1.590 1.00 35.37 C ATOM 501 CD1 PHE A 868 -11.228 7.582 -1.925 1.00 37.52 C ATOM 502 CD2 PHE A 868 -12.048 5.976 -0.364 1.00 37.54 C ATOM 503 CE1 PHE A 868 -10.181 7.893 -1.051 1.00 37.93 C ATOM 504 CE2 PHE A 868 -11.003 6.293 0.508 1.00 39.71 C ATOM 505 CZ PHE A 868 -10.072 7.240 0.151 1.00 36.73 C ATOM 506 H PHE A 868 -15.101 5.817 -4.277 1.00 0.00 H ATOM 507 N GLN A 869 -13.179 3.506 -3.742 1.00 28.96 N ATOM 508 CA GLN A 869 -12.830 2.093 -3.768 1.00 27.61 C ATOM 509 C GLN A 869 -12.369 1.737 -5.182 1.00 31.66 C ATOM 510 O GLN A 869 -11.550 0.832 -5.356 1.00 32.30 O ATOM 511 CB GLN A 869 -14.071 1.262 -3.405 1.00 28.54 C ATOM 512 CG GLN A 869 -13.758 -0.200 -3.085 1.00 46.12 C ATOM 513 CD GLN A 869 -13.725 -0.463 -1.602 1.00 62.46 C ATOM 514 OE1 GLN A 869 -14.599 -1.147 -1.054 1.00 54.33 O ATOM 515 NE2 GLN A 869 -12.710 0.060 -0.923 1.00 54.36 N ATOM 516 HE22 GLN A 869 -11.993 0.630 -1.416 1.00 0.00 H ATOM 517 HE21 GLN A 869 -12.632 -0.100 0.102 1.00 0.00 H ATOM 518 H GLN A 869 -14.170 3.740 -3.530 1.00 0.00 H ATOM 519 N ARG A 870 -12.906 2.449 -6.191 1.00 27.43 N ATOM 520 CA ARG A 870 -12.506 2.286 -7.591 1.00 27.38 C ATOM 521 C ARG A 870 -11.062 2.805 -7.712 1.00 28.69 C ATOM 522 O ARG A 870 -10.184 2.063 -8.167 1.00 26.14 O ATOM 523 CB ARG A 870 -13.470 3.051 -8.520 1.00 30.90 C ATOM 524 CG ARG A 870 -13.401 2.663 -9.993 1.00 45.36 C ATOM 525 CD ARG A 870 -14.633 3.158 -10.756 1.00 49.40 C ATOM 526 NE ARG A 870 -14.494 2.971 -12.205 1.00 49.75 N ATOM 527 CZ ARG A 870 -14.888 1.885 -12.871 1.00 60.81 C ATOM 528 NH1 ARG A 870 -15.472 0.877 -12.229 1.00 41.57 N ATOM 529 NH2 ARG A 870 -14.709 1.803 -14.184 1.00 43.03 N ATOM 530 HE ARG A 870 -14.057 3.740 -12.751 1.00 0.00 H ATOM 531 HH12 ARG A 870 -15.777 0.033 -12.754 1.00 0.00 H ATOM 532 HH11 ARG A 870 -15.624 0.933 -11.202 1.00 0.00 H ATOM 533 HH22 ARG A 870 -15.018 0.954 -14.699 1.00 0.00 H ATOM 534 HH21 ARG A 870 -14.260 2.588 -14.698 1.00 0.00 H ATOM 535 H ARG A 870 -13.641 3.149 -5.965 1.00 0.00 H ATOM 536 N GLU A 871 -10.802 4.043 -7.219 1.00 25.18 N ATOM 537 CA GLU A 871 -9.475 4.661 -7.283 1.00 25.75 C ATOM 538 C GLU A 871 -8.410 3.766 -6.625 1.00 29.97 C ATOM 539 O GLU A 871 -7.353 3.564 -7.217 1.00 28.12 O ATOM 540 CB GLU A 871 -9.497 6.044 -6.626 1.00 27.09 C ATOM 541 CG GLU A 871 -8.243 6.867 -6.850 1.00 31.94 C ATOM 542 CD GLU A 871 -8.267 8.270 -6.281 1.00 35.29 C ATOM 543 OE1 GLU A 871 -9.343 8.739 -5.844 1.00 26.94 O ATOM 544 OE2 GLU A 871 -7.203 8.921 -6.313 1.00 26.19 O ATOM 545 H GLU A 871 -11.578 4.576 -6.777 1.00 0.00 H ATOM 546 N ILE A 872 -8.729 3.208 -5.434 1.00 26.10 N ATOM 547 CA ILE A 872 -7.873 2.349 -4.606 1.00 25.62 C ATOM 548 C ILE A 872 -7.446 1.084 -5.346 1.00 28.15 C ATOM 549 O ILE A 872 -6.249 0.802 -5.409 1.00 24.66 O ATOM 550 CB ILE A 872 -8.499 2.035 -3.213 1.00 27.49 C ATOM 551 CG1 ILE A 872 -8.537 3.301 -2.333 1.00 27.23 C ATOM 552 CG2 ILE A 872 -7.764 0.869 -2.480 1.00 27.96 C ATOM 553 CD1 ILE A 872 -9.339 3.138 -0.999 1.00 20.32 C ATOM 554 H ILE A 872 -9.681 3.409 -5.066 1.00 0.00 H ATOM 555 N GLN A 873 -8.414 0.336 -5.875 1.00 27.14 N ATOM 556 CA GLN A 873 -8.137 -0.923 -6.555 1.00 26.73 C ATOM 557 C GLN A 873 -7.336 -0.704 -7.813 1.00 29.53 C ATOM 558 O GLN A 873 -6.385 -1.442 -8.025 1.00 29.23 O ATOM 559 CB GLN A 873 -9.412 -1.748 -6.790 1.00 28.10 C ATOM 560 CG GLN A 873 -10.122 -2.183 -5.501 1.00 43.42 C ATOM 561 CD GLN A 873 -9.214 -2.872 -4.500 1.00 62.44 C ATOM 562 OE1 GLN A 873 -8.785 -2.286 -3.494 1.00 52.04 O ATOM 563 NE2 GLN A 873 -8.886 -4.127 -4.765 1.00 60.36 N ATOM 564 HE22 GLN A 873 -9.260 -4.594 -5.616 1.00 0.00 H ATOM 565 HE21 GLN A 873 -8.254 -4.646 -4.122 1.00 0.00 H ATOM 566 H GLN A 873 -9.399 0.661 -5.800 1.00 0.00 H ATOM 567 N ILE A 874 -7.628 0.390 -8.578 1.00 26.44 N ATOM 568 CA ILE A 874 -6.890 0.741 -9.787 1.00 25.24 C ATOM 569 C ILE A 874 -5.433 1.009 -9.439 1.00 27.61 C ATOM 570 O ILE A 874 -4.583 0.288 -9.933 1.00 27.84 O ATOM 571 CB ILE A 874 -7.515 1.904 -10.620 1.00 27.34 C ATOM 572 CG1 ILE A 874 -8.883 1.507 -11.254 1.00 27.53 C ATOM 573 CG2 ILE A 874 -6.521 2.388 -11.698 1.00 28.05 C ATOM 574 CD1 ILE A 874 -9.687 2.723 -11.947 1.00 24.25 C ATOM 575 H ILE A 874 -8.415 1.003 -8.284 1.00 0.00 H ATOM 576 N LEU A 875 -5.152 2.008 -8.569 1.00 23.55 N ATOM 577 CA LEU A 875 -3.786 2.428 -8.169 1.00 22.81 C ATOM 578 C LEU A 875 -2.928 1.283 -7.565 1.00 24.88 C ATOM 579 O LEU A 875 -1.746 1.156 -7.899 1.00 23.91 O ATOM 580 CB LEU A 875 -3.873 3.656 -7.233 1.00 22.29 C ATOM 581 CG LEU A 875 -2.573 4.413 -6.919 1.00 26.85 C ATOM 582 CD1 LEU A 875 -2.000 5.118 -8.144 1.00 26.26 C ATOM 583 CD2 LEU A 875 -2.787 5.400 -5.803 1.00 26.23 C ATOM 584 H LEU A 875 -5.954 2.520 -8.149 1.00 0.00 H ATOM 585 N LYS A 876 -3.560 0.424 -6.746 1.00 22.13 N ATOM 586 CA LYS A 876 -3.003 -0.765 -6.092 1.00 21.61 C ATOM 587 C LYS A 876 -2.533 -1.760 -7.144 1.00 24.90 C ATOM 588 O LYS A 876 -1.537 -2.433 -6.919 1.00 25.82 O ATOM 589 CB LYS A 876 -4.096 -1.396 -5.195 1.00 23.17 C ATOM 590 CG LYS A 876 -3.738 -2.695 -4.472 1.00 34.49 C ATOM 591 CD LYS A 876 -4.964 -3.216 -3.728 1.00 30.02 C ATOM 592 CE LYS A 876 -4.861 -4.687 -3.405 1.00 36.93 C ATOM 593 NZ LYS A 876 -6.041 -5.145 -2.626 1.00 40.05 N ATOM 594 HZ1 LYS A 876 -6.096 -4.610 -1.736 1.00 0.00 H ATOM 595 HZ2 LYS A 876 -6.905 -4.985 -3.182 1.00 0.00 H ATOM 596 HZ3 LYS A 876 -5.945 -6.159 -2.417 1.00 0.00 H ATOM 597 H LYS A 876 -4.562 0.626 -6.554 1.00 0.00 H ATOM 598 N ALA A 877 -3.254 -1.854 -8.293 1.00 19.98 N ATOM 599 CA ALA A 877 -2.905 -2.724 -9.411 1.00 20.00 C ATOM 600 C ALA A 877 -1.894 -2.084 -10.395 1.00 23.21 C ATOM 601 O ALA A 877 -1.477 -2.737 -11.338 1.00 23.52 O ATOM 602 CB ALA A 877 -4.165 -3.172 -10.154 1.00 20.91 C ATOM 603 H ALA A 877 -4.109 -1.268 -8.380 1.00 0.00 H ATOM 604 N LEU A 878 -1.481 -0.841 -10.151 1.00 21.26 N ATOM 605 CA LEU A 878 -0.524 -0.101 -10.989 1.00 20.84 C ATOM 606 C LEU A 878 0.909 -0.158 -10.410 1.00 24.01 C ATOM 607 O LEU A 878 1.122 0.264 -9.284 1.00 22.28 O ATOM 608 CB LEU A 878 -1.012 1.350 -11.187 1.00 20.91 C ATOM 609 CG LEU A 878 -2.352 1.520 -11.947 1.00 24.87 C ATOM 610 CD1 LEU A 878 -2.778 2.969 -12.014 1.00 23.96 C ATOM 611 CD2 LEU A 878 -2.308 0.934 -13.360 1.00 28.79 C ATOM 612 H LEU A 878 -1.861 -0.361 -9.311 1.00 0.00 H ATOM 613 N HIS A 879 1.875 -0.731 -11.167 1.00 21.87 N ATOM 614 CA HIS A 879 3.261 -0.914 -10.725 1.00 22.02 C ATOM 615 C HIS A 879 4.236 -0.369 -11.770 1.00 27.52 C ATOM 616 O HIS A 879 4.671 -1.092 -12.678 1.00 27.50 O ATOM 617 CB HIS A 879 3.526 -2.396 -10.383 1.00 23.27 C ATOM 618 CG HIS A 879 2.335 -3.105 -9.819 1.00 27.18 C ATOM 619 ND1 HIS A 879 2.111 -3.182 -8.444 1.00 29.32 N ATOM 620 CD2 HIS A 879 1.307 -3.702 -10.461 1.00 29.02 C ATOM 621 CE1 HIS A 879 0.974 -3.838 -8.309 1.00 28.51 C ATOM 622 NE2 HIS A 879 0.447 -4.156 -9.497 1.00 29.09 N ATOM 623 H HIS A 879 1.618 -1.061 -12.119 1.00 0.00 H ATOM 624 N SER A 880 4.523 0.932 -11.684 1.00 22.46 N ATOM 625 CA SER A 880 5.387 1.605 -12.655 1.00 22.81 C ATOM 626 C SER A 880 6.155 2.719 -12.017 1.00 24.52 C ATOM 627 O SER A 880 5.682 3.336 -11.058 1.00 22.92 O ATOM 628 CB SER A 880 4.580 2.150 -13.831 1.00 27.12 C ATOM 629 OG SER A 880 5.408 2.758 -14.812 1.00 37.92 O ATOM 630 HG SER A 880 6.049 2.090 -15.161 1.00 0.00 H ATOM 631 H SER A 880 4.119 1.485 -10.901 1.00 0.00 H ATOM 632 N ASP A 881 7.360 2.982 -12.565 1.00 20.23 N ATOM 633 CA ASP A 881 8.230 4.050 -12.121 1.00 18.95 C ATOM 634 C ASP A 881 7.611 5.392 -12.502 1.00 20.41 C ATOM 635 O ASP A 881 8.049 6.424 -12.003 1.00 19.38 O ATOM 636 CB ASP A 881 9.593 3.922 -12.819 1.00 20.17 C ATOM 637 CG ASP A 881 10.537 2.856 -12.306 1.00 27.57 C ATOM 638 OD1 ASP A 881 10.223 2.230 -11.249 1.00 24.88 O ATOM 639 OD2 ASP A 881 11.588 2.628 -12.964 1.00 31.28 O ATOM 640 H ASP A 881 7.682 2.383 -13.352 1.00 0.00 H ATOM 641 N PHE A 882 6.617 5.378 -13.404 1.00 17.18 N ATOM 642 CA PHE A 882 5.994 6.603 -13.907 1.00 17.65 C ATOM 643 C PHE A 882 4.591 6.825 -13.408 1.00 19.93 C ATOM 644 O PHE A 882 3.934 7.733 -13.915 1.00 18.42 O ATOM 645 CB PHE A 882 6.067 6.659 -15.447 1.00 20.70 C ATOM 646 CG PHE A 882 7.470 6.332 -15.921 1.00 23.44 C ATOM 647 CD1 PHE A 882 8.531 7.203 -15.665 1.00 26.22 C ATOM 648 CD2 PHE A 882 7.746 5.121 -16.542 1.00 26.68 C ATOM 649 CE1 PHE A 882 9.840 6.862 -16.012 1.00 26.13 C ATOM 650 CE2 PHE A 882 9.052 4.806 -16.943 1.00 29.12 C ATOM 651 CZ PHE A 882 10.088 5.684 -16.675 1.00 25.80 C ATOM 652 H PHE A 882 6.277 4.462 -13.759 1.00 0.00 H ATOM 653 N ILE A 883 4.127 6.005 -12.428 1.00 16.27 N ATOM 654 CA ILE A 883 2.820 6.110 -11.746 1.00 15.98 C ATOM 655 C ILE A 883 3.073 6.241 -10.252 1.00 21.29 C ATOM 656 O ILE A 883 3.811 5.407 -9.722 1.00 19.94 O ATOM 657 CB ILE A 883 1.939 4.835 -12.035 1.00 18.29 C ATOM 658 CG1 ILE A 883 1.759 4.544 -13.545 1.00 17.30 C ATOM 659 CG2 ILE A 883 0.591 4.878 -11.323 1.00 19.21 C ATOM 660 CD1 ILE A 883 0.851 5.448 -14.270 1.00 14.99 C ATOM 661 H ILE A 883 4.752 5.229 -12.129 1.00 0.00 H ATOM 662 N VAL A 884 2.407 7.225 -9.543 1.00 20.21 N ATOM 663 CA VAL A 884 2.573 7.416 -8.092 1.00 18.87 C ATOM 664 C VAL A 884 2.433 6.086 -7.373 1.00 21.91 C ATOM 665 O VAL A 884 1.488 5.335 -7.641 1.00 19.11 O ATOM 666 CB VAL A 884 1.695 8.552 -7.440 1.00 22.93 C ATOM 667 CG1 VAL A 884 0.209 8.189 -7.394 1.00 22.72 C ATOM 668 CG2 VAL A 884 2.193 8.915 -6.031 1.00 22.48 C ATOM 669 H VAL A 884 1.761 7.857 -10.057 1.00 0.00 H ATOM 670 N LYS A 885 3.404 5.780 -6.495 1.00 19.84 N ATOM 671 CA LYS A 885 3.377 4.548 -5.714 1.00 19.35 C ATOM 672 C LYS A 885 2.249 4.524 -4.687 1.00 24.96 C ATOM 673 O LYS A 885 2.140 5.429 -3.869 1.00 26.17 O ATOM 674 CB LYS A 885 4.722 4.338 -4.977 1.00 21.08 C ATOM 675 CG LYS A 885 5.898 3.999 -5.879 1.00 46.14 C ATOM 676 CD LYS A 885 7.190 3.935 -5.074 1.00 59.59 C ATOM 677 CE LYS A 885 8.281 3.172 -5.784 1.00 72.44 C ATOM 678 NZ LYS A 885 9.116 4.063 -6.628 1.00 83.66 N ATOM 679 HZ1 LYS A 885 8.517 4.521 -7.344 1.00 0.00 H ATOM 680 HZ2 LYS A 885 9.560 4.789 -6.030 1.00 0.00 H ATOM 681 HZ3 LYS A 885 9.854 3.501 -7.099 1.00 0.00 H ATOM 682 H LYS A 885 4.197 6.441 -6.369 1.00 0.00 H ATOM 683 N TYR A 886 1.438 3.475 -4.718 1.00 23.11 N ATOM 684 CA TYR A 886 0.418 3.158 -3.722 1.00 22.26 C ATOM 685 C TYR A 886 1.180 2.501 -2.548 1.00 27.30 C ATOM 686 O TYR A 886 2.000 1.593 -2.774 1.00 26.24 O ATOM 687 CB TYR A 886 -0.559 2.153 -4.354 1.00 23.12 C ATOM 688 CG TYR A 886 -1.440 1.385 -3.397 1.00 23.45 C ATOM 689 CD1 TYR A 886 -2.688 1.875 -3.025 1.00 25.36 C ATOM 690 CD2 TYR A 886 -1.080 0.112 -2.953 1.00 24.97 C ATOM 691 CE1 TYR A 886 -3.513 1.168 -2.159 1.00 24.87 C ATOM 692 CE2 TYR A 886 -1.899 -0.609 -2.084 1.00 25.79 C ATOM 693 CZ TYR A 886 -3.124 -0.084 -1.709 1.00 30.11 C ATOM 694 OH TYR A 886 -3.952 -0.787 -0.878 1.00 30.86 O ATOM 695 HH TYR A 886 -4.777 -0.265 -0.717 1.00 0.00 H ATOM 696 H TYR A 886 1.537 2.822 -5.521 1.00 0.00 H ATOM 697 N ARG A 887 0.940 2.954 -1.308 1.00 25.06 N ATOM 698 CA ARG A 887 1.605 2.329 -0.160 1.00 24.84 C ATOM 699 C ARG A 887 0.637 1.414 0.597 1.00 28.18 C ATOM 700 O ARG A 887 1.080 0.433 1.216 1.00 27.55 O ATOM 701 CB ARG A 887 2.298 3.352 0.775 1.00 26.12 C ATOM 702 CG ARG A 887 3.338 4.289 0.128 1.00 35.72 C ATOM 703 CD ARG A 887 4.616 3.596 -0.332 1.00 50.29 C ATOM 704 NE ARG A 887 5.662 4.559 -0.704 1.00 61.51 N ATOM 705 CZ ARG A 887 6.779 4.248 -1.358 1.00 72.91 C ATOM 706 NH1 ARG A 887 7.004 2.998 -1.748 1.00 63.18 N ATOM 707 NH2 ARG A 887 7.675 5.188 -1.639 1.00 50.03 N ATOM 708 HE ARG A 887 5.519 5.554 -0.437 1.00 0.00 H ATOM 709 HH12 ARG A 887 7.879 2.762 -2.259 1.00 0.00 H ATOM 710 HH11 ARG A 887 6.305 2.255 -1.543 1.00 0.00 H ATOM 711 HH22 ARG A 887 8.546 4.940 -2.150 1.00 0.00 H ATOM 712 HH21 ARG A 887 7.505 6.172 -1.348 1.00 0.00 H ATOM 713 H ARG A 887 0.283 3.747 -1.161 1.00 0.00 H ATOM 714 N GLY A 888 -0.668 1.716 0.505 1.00 22.09 N ATOM 715 CA GLY A 888 -1.701 0.944 1.174 1.00 22.01 C ATOM 716 C GLY A 888 -2.902 1.738 1.634 1.00 27.16 C ATOM 717 O GLY A 888 -3.160 2.824 1.130 1.00 25.88 O ATOM 718 H GLY A 888 -0.951 2.536 -0.069 1.00 0.00 H ATOM 719 N VAL A 889 -3.656 1.189 2.592 1.00 25.45 N ATOM 720 CA VAL A 889 -4.860 1.823 3.095 1.00 26.70 C ATOM 721 C VAL A 889 -4.926 1.827 4.591 1.00 32.94 C ATOM 722 O VAL A 889 -4.247 1.033 5.253 1.00 32.34 O ATOM 723 CB VAL A 889 -6.157 1.183 2.524 1.00 31.15 C ATOM 724 CG1 VAL A 889 -6.335 1.491 1.039 1.00 30.39 C ATOM 725 CG2 VAL A 889 -6.216 -0.324 2.803 1.00 31.21 C ATOM 726 H VAL A 889 -3.369 0.273 2.992 1.00 0.00 H ATOM 727 N SER A 890 -5.808 2.681 5.115 1.00 31.01 N ATOM 728 CA SER A 890 -6.109 2.771 6.532 1.00 32.79 C ATOM 729 C SER A 890 -7.620 2.511 6.675 1.00 39.55 C ATOM 730 O SER A 890 -8.417 3.434 6.599 1.00 39.31 O ATOM 731 CB SER A 890 -5.687 4.128 7.097 1.00 35.17 C ATOM 732 OG SER A 890 -6.470 5.202 6.611 1.00 38.65 O ATOM 733 HG SER A 890 -6.150 6.049 7.011 1.00 0.00 H ATOM 734 H SER A 890 -6.311 3.321 4.468 1.00 0.00 H ATOM 735 N TYR A 891 -7.992 1.230 6.815 1.00 39.50 N ATOM 736 CA TYR A 891 -9.345 0.653 6.889 1.00 40.94 C ATOM 737 C TYR A 891 -10.350 1.300 7.849 1.00 48.42 C ATOM 738 O TYR A 891 -9.964 1.983 8.802 1.00 48.52 O ATOM 739 CB TYR A 891 -9.242 -0.838 7.236 1.00 42.56 C ATOM 740 CG TYR A 891 -8.926 -1.725 6.058 1.00 44.14 C ATOM 741 CD1 TYR A 891 -9.894 -2.018 5.102 1.00 46.86 C ATOM 742 CD2 TYR A 891 -7.683 -2.335 5.935 1.00 44.46 C ATOM 743 CE1 TYR A 891 -9.624 -2.880 4.038 1.00 46.72 C ATOM 744 CE2 TYR A 891 -7.398 -3.188 4.868 1.00 45.14 C ATOM 745 CZ TYR A 891 -8.367 -3.448 3.915 1.00 51.12 C ATOM 746 OH TYR A 891 -8.083 -4.282 2.855 1.00 50.25 O ATOM 747 HH TYR A 891 -8.881 -4.358 2.274 1.00 0.00 H ATOM 748 H TYR A 891 -7.212 0.545 6.881 1.00 0.00 H ATOM 749 N GLY A 892 -11.636 1.033 7.588 1.00 47.29 N ATOM 750 CA GLY A 892 -12.768 1.531 8.369 1.00 48.10 C ATOM 751 C GLY A 892 -13.909 0.536 8.522 1.00 54.64 C ATOM 752 O GLY A 892 -13.665 -0.627 8.864 1.00 54.28 O ATOM 753 H GLY A 892 -11.845 0.427 6.769 1.00 0.00 H ATOM 754 N PRO A 893 -15.184 0.953 8.292 1.00 53.36 N ATOM 755 CA PRO A 893 -16.309 0.023 8.481 1.00 53.66 C ATOM 756 C PRO A 893 -16.558 -0.879 7.264 1.00 58.66 C ATOM 757 O PRO A 893 -17.417 -0.605 6.413 1.00 57.56 O ATOM 758 CB PRO A 893 -17.484 0.950 8.836 1.00 55.67 C ATOM 759 CG PRO A 893 -16.933 2.391 8.722 1.00 60.19 C ATOM 760 CD PRO A 893 -15.679 2.290 7.923 1.00 55.42 C ATOM 761 N GLY A 894 -15.776 -1.959 7.214 1.00 55.96 N ATOM 762 CA GLY A 894 -15.765 -2.963 6.156 1.00 55.89 C ATOM 763 C GLY A 894 -14.386 -3.591 6.040 1.00 60.65 C ATOM 764 O GLY A 894 -13.745 -3.744 7.082 1.00 61.42 O ATOM 765 H GLY A 894 -15.113 -2.098 8.003 1.00 0.00 H ATOM 766 N ARG A 895 -13.841 -3.945 4.818 1.00 55.89 N ATOM 767 CA ARG A 895 -14.313 -3.868 3.415 1.00 55.36 C ATOM 768 C ARG A 895 -14.362 -2.427 2.827 1.00 57.67 C ATOM 769 O ARG A 895 -14.347 -2.267 1.600 1.00 56.30 O ATOM 770 CB ARG A 895 -15.653 -4.592 3.198 1.00 55.78 C ATOM 771 H ARG A 895 -12.889 -4.356 4.903 1.00 0.00 H ATOM 772 N GLN A 896 -14.418 -1.401 3.697 1.00 53.63 N ATOM 773 CA GLN A 896 -14.480 0.015 3.327 1.00 53.18 C ATOM 774 C GLN A 896 -13.284 0.737 3.918 1.00 55.88 C ATOM 775 O GLN A 896 -13.289 1.130 5.084 1.00 55.00 O ATOM 776 CB GLN A 896 -15.804 0.658 3.786 1.00 54.41 C ATOM 777 CG GLN A 896 -15.998 2.103 3.317 1.00 66.95 C ATOM 778 CD GLN A 896 -17.023 2.833 4.142 1.00 84.34 C ATOM 779 OE1 GLN A 896 -16.694 3.677 4.980 1.00 77.69 O ATOM 780 NE2 GLN A 896 -18.292 2.529 3.920 1.00 79.36 N ATOM 781 HE22 GLN A 896 -18.538 1.813 3.207 1.00 0.00 H ATOM 782 HE21 GLN A 896 -19.043 3.006 4.459 1.00 0.00 H ATOM 783 H GLN A 896 -14.417 -1.632 4.711 1.00 0.00 H ATOM 784 N SER A 897 -12.255 0.901 3.100 1.00 53.08 N ATOM 785 CA SER A 897 -11.025 1.569 3.492 1.00 52.66 C ATOM 786 C SER A 897 -11.272 3.065 3.658 1.00 53.34 C ATOM 787 O SER A 897 -11.584 3.771 2.686 1.00 53.33 O ATOM 788 CB SER A 897 -9.916 1.280 2.489 1.00 57.66 C ATOM 789 OG SER A 897 -9.781 -0.121 2.307 1.00 65.63 O ATOM 790 HG SER A 897 -9.059 -0.300 1.654 1.00 0.00 H ATOM 791 H SER A 897 -12.331 0.534 2.130 1.00 0.00 H ATOM 792 N LEU A 898 -11.206 3.516 4.930 1.00 45.56 N ATOM 793 CA LEU A 898 -11.408 4.888 5.365 1.00 42.83 C ATOM 794 C LEU A 898 -10.556 5.874 4.528 1.00 44.46 C ATOM 795 O LEU A 898 -11.121 6.859 4.055 1.00 44.85 O ATOM 796 CB LEU A 898 -11.114 5.001 6.884 1.00 42.07 C ATOM 797 CG LEU A 898 -11.928 5.989 7.740 1.00 45.58 C ATOM 798 CD1 LEU A 898 -13.390 5.537 7.902 1.00 44.43 C ATOM 799 CD2 LEU A 898 -11.310 6.133 9.127 1.00 45.98 C ATOM 800 H LEU A 898 -10.990 2.815 5.667 1.00 0.00 H ATOM 801 N ARG A 899 -9.228 5.576 4.288 1.00 37.78 N ATOM 802 CA ARG A 899 -8.292 6.431 3.509 1.00 35.54 C ATOM 803 C ARG A 899 -7.261 5.662 2.678 1.00 33.64 C ATOM 804 O ARG A 899 -6.849 4.572 3.078 1.00 30.95 O ATOM 805 CB ARG A 899 -7.547 7.417 4.425 1.00 35.21 C ATOM 806 CG ARG A 899 -8.426 8.475 5.093 1.00 41.64 C ATOM 807 CD ARG A 899 -7.653 9.675 5.608 1.00 48.84 C ATOM 808 NE ARG A 899 -6.772 9.331 6.724 1.00 59.99 N ATOM 809 CZ ARG A 899 -5.931 10.177 7.304 1.00 71.82 C ATOM 810 NH1 ARG A 899 -5.840 11.432 6.879 1.00 57.13 N ATOM 811 NH2 ARG A 899 -5.167 9.774 8.307 1.00 59.69 N ATOM 812 HE ARG A 899 -6.807 8.357 7.087 1.00 0.00 H ATOM 813 HH12 ARG A 899 -5.178 12.090 7.338 1.00 0.00 H ATOM 814 HH11 ARG A 899 -6.430 11.757 6.087 1.00 0.00 H ATOM 815 HH22 ARG A 899 -4.509 10.440 8.759 1.00 0.00 H ATOM 816 HH21 ARG A 899 -5.225 8.791 8.643 1.00 0.00 H ATOM 817 H ARG A 899 -8.855 4.688 4.681 1.00 0.00 H ATOM 818 N LEU A 900 -6.791 6.277 1.557 1.00 29.43 N ATOM 819 CA LEU A 900 -5.781 5.744 0.621 1.00 27.96 C ATOM 820 C LEU A 900 -4.428 6.408 0.890 1.00 30.79 C ATOM 821 O LEU A 900 -4.339 7.637 0.904 1.00 28.50 O ATOM 822 CB LEU A 900 -6.206 5.943 -0.861 1.00 27.35 C ATOM 823 CG LEU A 900 -5.087 6.060 -1.926 1.00 30.66 C ATOM 824 CD1 LEU A 900 -4.455 4.713 -2.231 1.00 30.09 C ATOM 825 CD2 LEU A 900 -5.601 6.703 -3.197 1.00 33.63 C ATOM 826 H LEU A 900 -7.183 7.215 1.339 1.00 0.00 H ATOM 827 N VAL A 901 -3.371 5.595 1.005 1.00 26.43 N ATOM 828 CA VAL A 901 -2.021 6.058 1.335 1.00 25.31 C ATOM 829 C VAL A 901 -1.086 5.938 0.131 1.00 26.80 C ATOM 830 O VAL A 901 -0.928 4.861 -0.423 1.00 27.14 O ATOM 831 CB VAL A 901 -1.474 5.302 2.588 1.00 29.62 C ATOM 832 CG1 VAL A 901 -0.069 5.784 2.980 1.00 29.30 C ATOM 833 CG2 VAL A 901 -2.443 5.405 3.777 1.00 29.16 C ATOM 834 H VAL A 901 -3.516 4.577 0.851 1.00 0.00 H ATOM 835 N MET A 902 -0.462 7.052 -0.252 1.00 20.17 N ATOM 836 CA MET A 902 0.465 7.105 -1.360 1.00 19.66 C ATOM 837 C MET A 902 1.827 7.642 -0.885 1.00 24.58 C ATOM 838 O MET A 902 1.939 8.242 0.203 1.00 23.71 O ATOM 839 CB MET A 902 -0.084 8.040 -2.466 1.00 20.14 C ATOM 840 CG MET A 902 -1.311 7.512 -3.204 1.00 21.40 C ATOM 841 SD MET A 902 -2.182 8.801 -4.180 1.00 23.02 S ATOM 842 CE MET A 902 -2.853 9.776 -2.902 1.00 20.53 C ATOM 843 H MET A 902 -0.652 7.929 0.274 1.00 0.00 H ATOM 844 N GLU A 903 2.841 7.476 -1.729 1.00 22.21 N ATOM 845 CA GLU A 903 4.180 8.036 -1.491 1.00 22.21 C ATOM 846 C GLU A 903 4.110 9.533 -1.539 1.00 22.64 C ATOM 847 O GLU A 903 3.282 10.086 -2.264 1.00 20.58 O ATOM 848 CB GLU A 903 5.196 7.538 -2.527 1.00 23.90 C ATOM 849 CG GLU A 903 4.862 7.750 -4.010 1.00 27.44 C ATOM 850 CD GLU A 903 6.031 7.558 -4.966 1.00 35.52 C ATOM 851 OE1 GLU A 903 7.186 7.720 -4.516 1.00 31.48 O ATOM 852 OE2 GLU A 903 5.802 7.264 -6.163 1.00 26.54 O ATOM 853 H GLU A 903 2.680 6.925 -2.596 1.00 0.00 H ATOM 854 N TYR A 904 4.978 10.207 -0.796 1.00 18.31 N ATOM 855 CA TYR A 904 4.982 11.667 -0.827 1.00 17.37 C ATOM 856 C TYR A 904 6.170 12.191 -1.643 1.00 20.52 C ATOM 857 O TYR A 904 7.286 11.681 -1.512 1.00 21.27 O ATOM 858 CB TYR A 904 4.894 12.239 0.600 1.00 17.51 C ATOM 859 CG TYR A 904 5.169 13.727 0.686 1.00 18.40 C ATOM 860 CD1 TYR A 904 4.281 14.654 0.140 1.00 21.06 C ATOM 861 CD2 TYR A 904 6.338 14.204 1.262 1.00 18.80 C ATOM 862 CE1 TYR A 904 4.545 16.024 0.185 1.00 22.82 C ATOM 863 CE2 TYR A 904 6.617 15.572 1.313 1.00 20.21 C ATOM 864 CZ TYR A 904 5.708 16.479 0.790 1.00 31.22 C ATOM 865 OH TYR A 904 5.974 17.822 0.861 1.00 33.14 O ATOM 866 HH TYR A 904 5.231 18.327 0.445 1.00 0.00 H ATOM 867 H TYR A 904 5.654 9.697 -0.193 1.00 0.00 H ATOM 868 N LEU A 905 5.900 13.106 -2.583 1.00 18.19 N ATOM 869 CA LEU A 905 6.919 13.722 -3.435 1.00 18.48 C ATOM 870 C LEU A 905 6.999 15.197 -3.024 1.00 24.14 C ATOM 871 O LEU A 905 6.093 15.969 -3.382 1.00 23.74 O ATOM 872 CB LEU A 905 6.549 13.557 -4.925 1.00 19.97 C ATOM 873 CG LEU A 905 6.600 12.124 -5.498 1.00 25.27 C ATOM 874 CD1 LEU A 905 5.398 11.323 -5.104 1.00 28.03 C ATOM 875 CD2 LEU A 905 6.562 12.148 -6.955 1.00 26.47 C ATOM 876 H LEU A 905 4.910 13.396 -2.715 1.00 0.00 H ATOM 877 N PRO A 906 7.989 15.612 -2.189 1.00 20.45 N ATOM 878 CA PRO A 906 7.993 17.005 -1.713 1.00 21.50 C ATOM 879 C PRO A 906 8.104 18.056 -2.794 1.00 27.44 C ATOM 880 O PRO A 906 7.669 19.181 -2.550 1.00 28.54 O ATOM 881 CB PRO A 906 9.154 17.070 -0.706 1.00 22.85 C ATOM 882 CG PRO A 906 9.974 15.922 -0.998 1.00 26.90 C ATOM 883 CD PRO A 906 9.102 14.846 -1.591 1.00 22.47 C ATOM 884 N SER A 907 8.636 17.698 -3.985 1.00 24.03 N ATOM 885 CA SER A 907 8.688 18.639 -5.100 1.00 22.75 C ATOM 886 C SER A 907 7.270 18.957 -5.624 1.00 26.95 C ATOM 887 O SER A 907 7.049 20.031 -6.181 1.00 25.03 O ATOM 888 CB SER A 907 9.614 18.147 -6.202 1.00 24.68 C ATOM 889 OG SER A 907 10.923 17.983 -5.682 1.00 21.49 O ATOM 890 HG SER A 907 11.251 18.851 -5.338 1.00 0.00 H ATOM 891 H SER A 907 9.014 16.737 -4.108 1.00 0.00 H ATOM 892 N GLY A 908 6.308 18.071 -5.369 1.00 24.35 N ATOM 893 CA GLY A 908 4.915 18.333 -5.720 1.00 24.20 C ATOM 894 C GLY A 908 4.534 18.249 -7.190 1.00 26.26 C ATOM 895 O GLY A 908 5.144 17.512 -7.963 1.00 26.77 O ATOM 896 H GLY A 908 6.555 17.172 -4.909 1.00 0.00 H ATOM 897 N CYS A 909 3.490 18.988 -7.563 1.00 21.96 N ATOM 898 CA CYS A 909 2.887 18.981 -8.896 1.00 21.15 C ATOM 899 C CYS A 909 3.761 19.657 -9.928 1.00 22.11 C ATOM 900 O CYS A 909 4.426 20.645 -9.625 1.00 21.70 O ATOM 901 CB CYS A 909 1.465 19.538 -8.873 1.00 21.81 C ATOM 902 SG CYS A 909 1.350 21.342 -8.953 1.00 26.44 S ATOM 903 H CYS A 909 3.071 19.619 -6.851 1.00 0.00 H ATOM 904 N LEU A 910 3.803 19.091 -11.132 1.00 18.91 N ATOM 905 CA LEU A 910 4.712 19.523 -12.199 1.00 17.94 C ATOM 906 C LEU A 910 4.472 20.959 -12.663 1.00 22.00 C ATOM 907 O LEU A 910 5.442 21.667 -12.949 1.00 21.29 O ATOM 908 CB LEU A 910 4.666 18.516 -13.364 1.00 18.24 C ATOM 909 CG LEU A 910 5.484 18.788 -14.661 1.00 21.88 C ATOM 910 CD1 LEU A 910 6.970 19.031 -14.375 1.00 21.28 C ATOM 911 CD2 LEU A 910 5.250 17.652 -15.711 1.00 20.28 C ATOM 912 H LEU A 910 3.157 18.300 -11.327 1.00 0.00 H ATOM 913 N ARG A 911 3.204 21.380 -12.711 1.00 19.71 N ATOM 914 CA ARG A 911 2.753 22.722 -13.081 1.00 20.42 C ATOM 915 C ARG A 911 3.501 23.793 -12.260 1.00 25.25 C ATOM 916 O ARG A 911 4.086 24.704 -12.845 1.00 22.63 O ATOM 917 CB ARG A 911 1.227 22.844 -12.870 1.00 20.27 C ATOM 918 CG ARG A 911 0.684 24.255 -13.127 1.00 25.02 C ATOM 919 CD ARG A 911 -0.776 24.422 -12.740 1.00 31.01 C ATOM 920 NE ARG A 911 -0.946 24.530 -11.293 1.00 37.86 N ATOM 921 CZ ARG A 911 -2.119 24.455 -10.675 1.00 47.75 C ATOM 922 NH1 ARG A 911 -3.236 24.272 -11.372 1.00 30.88 N ATOM 923 NH2 ARG A 911 -2.187 24.559 -9.358 1.00 36.09 N ATOM 924 HE ARG A 911 -0.096 24.674 -10.711 1.00 0.00 H ATOM 925 HH12 ARG A 911 -4.151 24.214 -10.882 1.00 0.00 H ATOM 926 HH11 ARG A 911 -3.195 24.187 -12.408 1.00 0.00 H ATOM 927 HH22 ARG A 911 -3.108 24.500 -8.879 1.00 0.00 H ATOM 928 HH21 ARG A 911 -1.319 24.700 -8.802 1.00 0.00 H ATOM 929 H ARG A 911 2.469 20.688 -12.462 1.00 0.00 H ATOM 930 N ASP A 912 3.506 23.670 -10.919 1.00 23.33 N ATOM 931 CA ASP A 912 4.204 24.676 -10.105 1.00 24.66 C ATOM 932 C ASP A 912 5.728 24.456 -10.097 1.00 27.55 C ATOM 933 O ASP A 912 6.465 25.431 -9.958 1.00 25.69 O ATOM 934 CB ASP A 912 3.616 24.797 -8.697 1.00 27.15 C ATOM 935 CG ASP A 912 2.120 25.062 -8.611 1.00 39.09 C ATOM 936 OD1 ASP A 912 1.510 25.409 -9.648 1.00 42.57 O ATOM 937 OD2 ASP A 912 1.559 24.919 -7.511 1.00 48.44 O ATOM 938 H ASP A 912 3.021 22.871 -10.463 1.00 0.00 H ATOM 939 N PHE A 913 6.201 23.195 -10.303 1.00 23.46 N ATOM 940 CA PHE A 913 7.637 22.896 -10.404 1.00 22.69 C ATOM 941 C PHE A 913 8.209 23.585 -11.630 1.00 24.95 C ATOM 942 O PHE A 913 9.316 24.118 -11.552 1.00 24.45 O ATOM 943 CB PHE A 913 7.922 21.375 -10.471 1.00 23.29 C ATOM 944 CG PHE A 913 9.400 21.018 -10.519 1.00 22.36 C ATOM 945 CD1 PHE A 913 10.173 21.012 -9.361 1.00 25.02 C ATOM 946 CD2 PHE A 913 10.019 20.704 -11.721 1.00 21.83 C ATOM 947 CE1 PHE A 913 11.540 20.686 -9.405 1.00 24.33 C ATOM 948 CE2 PHE A 913 11.389 20.415 -11.770 1.00 23.74 C ATOM 949 CZ PHE A 913 12.145 20.419 -10.611 1.00 21.55 C ATOM 950 H PHE A 913 5.520 22.414 -10.392 1.00 0.00 H ATOM 951 N LEU A 914 7.454 23.560 -12.758 1.00 21.89 N ATOM 952 CA LEU A 914 7.787 24.179 -14.040 1.00 23.03 C ATOM 953 C LEU A 914 7.944 25.674 -13.890 1.00 29.48 C ATOM 954 O LEU A 914 8.940 26.238 -14.343 1.00 29.99 O ATOM 955 CB LEU A 914 6.703 23.879 -15.095 1.00 22.74 C ATOM 956 CG LEU A 914 6.904 22.579 -15.854 1.00 26.73 C ATOM 957 CD1 LEU A 914 5.668 22.224 -16.644 1.00 26.41 C ATOM 958 CD2 LEU A 914 8.109 22.676 -16.782 1.00 27.30 C ATOM 959 H LEU A 914 6.549 23.050 -12.705 1.00 0.00 H ATOM 960 N GLN A 915 6.982 26.301 -13.212 1.00 27.79 N ATOM 961 CA GLN A 915 6.968 27.735 -12.955 1.00 28.50 C ATOM 962 C GLN A 915 8.120 28.147 -12.051 1.00 31.72 C ATOM 963 O GLN A 915 8.837 29.079 -12.394 1.00 32.07 O ATOM 964 CB GLN A 915 5.623 28.153 -12.354 1.00 29.99 C ATOM 965 CG GLN A 915 4.482 28.049 -13.345 1.00 41.61 C ATOM 966 CD GLN A 915 3.212 28.656 -12.833 1.00 62.51 C ATOM 967 OE1 GLN A 915 2.878 29.794 -13.166 1.00 59.54 O ATOM 968 NE2 GLN A 915 2.446 27.899 -12.056 1.00 55.26 N ATOM 969 HE22 GLN A 915 2.757 26.942 -11.793 1.00 0.00 H ATOM 970 HE21 GLN A 915 1.535 28.263 -11.711 1.00 0.00 H ATOM 971 H GLN A 915 6.193 25.731 -12.844 1.00 0.00 H ATOM 972 N ARG A 916 8.322 27.412 -10.934 1.00 27.52 N ATOM 973 CA ARG A 916 9.358 27.617 -9.905 1.00 27.16 C ATOM 974 C ARG A 916 10.776 27.468 -10.433 1.00 30.45 C ATOM 975 O ARG A 916 11.643 28.225 -10.000 1.00 32.01 O ATOM 976 CB ARG A 916 9.140 26.606 -8.748 1.00 26.89 C ATOM 977 CG ARG A 916 9.516 27.061 -7.343 1.00 39.42 C ATOM 978 CD ARG A 916 9.323 25.946 -6.318 1.00 46.82 C ATOM 979 NE ARG A 916 7.942 25.827 -5.831 1.00 56.59 N ATOM 980 CZ ARG A 916 7.052 24.941 -6.277 1.00 65.51 C ATOM 981 NH1 ARG A 916 7.374 24.096 -7.244 1.00 52.49 N ATOM 982 NH2 ARG A 916 5.828 24.906 -5.767 1.00 44.72 N ATOM 983 HE ARG A 916 7.637 26.482 -5.083 1.00 0.00 H ATOM 984 HH12 ARG A 916 6.674 23.407 -7.587 1.00 0.00 H ATOM 985 HH11 ARG A 916 8.327 24.121 -7.661 1.00 0.00 H ATOM 986 HH22 ARG A 916 5.138 24.212 -6.119 1.00 0.00 H ATOM 987 HH21 ARG A 916 5.559 25.572 -5.015 1.00 0.00 H ATOM 988 H ARG A 916 7.674 26.613 -10.784 1.00 0.00 H ATOM 989 N HIS A 917 11.025 26.503 -11.351 1.00 24.83 N ATOM 990 CA HIS A 917 12.376 26.210 -11.877 1.00 24.86 C ATOM 991 C HIS A 917 12.569 26.364 -13.420 1.00 24.10 C ATOM 992 O HIS A 917 13.455 25.719 -13.958 1.00 25.15 O ATOM 993 CB HIS A 917 12.809 24.778 -11.451 1.00 25.85 C ATOM 994 CG HIS A 917 12.918 24.551 -9.967 1.00 29.76 C ATOM 995 ND1 HIS A 917 14.151 24.515 -9.327 1.00 31.09 N ATOM 996 CD2 HIS A 917 11.950 24.281 -9.059 1.00 31.71 C ATOM 997 CE1 HIS A 917 13.888 24.281 -8.057 1.00 30.62 C ATOM 998 NE2 HIS A 917 12.581 24.115 -7.848 1.00 31.17 N ATOM 999 H HIS A 917 10.225 25.940 -11.704 1.00 0.00 H ATOM 1000 N ARG A 918 11.790 27.222 -14.105 1.00 21.31 N ATOM 1001 CA ARG A 918 11.810 27.383 -15.579 1.00 22.01 C ATOM 1002 C ARG A 918 13.158 27.816 -16.149 1.00 29.70 C ATOM 1003 O ARG A 918 13.636 27.227 -17.128 1.00 28.97 O ATOM 1004 CB ARG A 918 10.674 28.305 -16.078 1.00 25.27 C ATOM 1005 CG ARG A 918 10.691 29.784 -15.690 1.00 35.59 C ATOM 1006 CD ARG A 918 9.585 30.542 -16.439 1.00 40.73 C ATOM 1007 NE ARG A 918 9.765 30.489 -17.890 1.00 33.74 N ATOM 1008 CZ ARG A 918 8.798 30.659 -18.791 1.00 48.26 C ATOM 1009 NH1 ARG A 918 7.561 30.947 -18.403 1.00 36.96 N ATOM 1010 NH2 ARG A 918 9.066 30.566 -20.086 1.00 32.80 N ATOM 1011 HE ARG A 918 10.724 30.304 -18.247 1.00 0.00 H ATOM 1012 HH12 ARG A 918 6.811 31.078 -19.111 1.00 0.00 H ATOM 1013 HH11 ARG A 918 7.342 31.041 -17.391 1.00 0.00 H ATOM 1014 HH22 ARG A 918 8.308 30.700 -20.785 1.00 0.00 H ATOM 1015 HH21 ARG A 918 10.035 30.359 -20.403 1.00 0.00 H ATOM 1016 H ARG A 918 11.128 27.813 -13.563 1.00 0.00 H ATOM 1017 N ALA A 919 13.779 28.810 -15.499 1.00 27.82 N ATOM 1018 CA ALA A 919 15.064 29.382 -15.850 1.00 29.27 C ATOM 1019 C ALA A 919 16.161 28.309 -15.934 1.00 35.92 C ATOM 1020 O ALA A 919 17.194 28.532 -16.578 1.00 37.05 O ATOM 1021 CB ALA A 919 15.429 30.436 -14.818 1.00 30.51 C ATOM 1022 H ALA A 919 13.296 29.207 -14.668 1.00 0.00 H ATOM 1023 N ARG A 920 15.890 27.122 -15.327 1.00 34.06 N ATOM 1024 CA ARG A 920 16.769 25.963 -15.211 1.00 34.82 C ATOM 1025 C ARG A 920 16.369 24.762 -16.110 1.00 40.21 C ATOM 1026 O ARG A 920 17.237 23.945 -16.433 1.00 41.76 O ATOM 1027 CB ARG A 920 16.861 25.553 -13.725 1.00 38.30 C ATOM 1028 CG ARG A 920 17.631 24.269 -13.429 1.00 52.14 C ATOM 1029 CD ARG A 920 17.584 23.924 -11.963 1.00 62.20 C ATOM 1030 NE ARG A 920 18.401 24.848 -11.181 1.00 68.62 N ATOM 1031 CZ ARG A 920 18.521 24.827 -9.858 1.00 75.33 C ATOM 1032 NH1 ARG A 920 17.868 23.923 -9.136 1.00 52.20 N ATOM 1033 NH2 ARG A 920 19.295 25.706 -9.248 1.00 60.04 N ATOM 1034 HE ARG A 920 18.929 25.578 -11.699 1.00 0.00 H ATOM 1035 HH12 ARG A 920 17.968 23.914 -8.101 1.00 0.00 H ATOM 1036 HH11 ARG A 920 17.257 23.225 -9.606 1.00 0.00 H ATOM 1037 HH22 ARG A 920 19.387 25.687 -8.212 1.00 0.00 H ATOM 1038 HH21 ARG A 920 19.812 26.417 -9.803 1.00 0.00 H ATOM 1039 H ARG A 920 14.948 27.030 -14.896 1.00 0.00 H ATOM 1040 N LEU A 921 15.088 24.642 -16.506 1.00 34.84 N ATOM 1041 CA LEU A 921 14.651 23.513 -17.326 1.00 33.54 C ATOM 1042 C LEU A 921 14.628 23.872 -18.791 1.00 36.78 C ATOM 1043 O LEU A 921 13.952 24.826 -19.154 1.00 37.40 O ATOM 1044 CB LEU A 921 13.306 22.951 -16.829 1.00 33.06 C ATOM 1045 CG LEU A 921 13.237 22.691 -15.313 1.00 36.01 C ATOM 1046 CD1 LEU A 921 11.810 22.694 -14.796 1.00 35.54 C ATOM 1047 CD2 LEU A 921 14.037 21.484 -14.906 1.00 36.54 C ATOM 1048 H LEU A 921 14.396 25.366 -16.224 1.00 0.00 H ATOM 1049 N ASP A 922 15.455 23.184 -19.624 1.00 32.21 N ATOM 1050 CA ASP A 922 15.523 23.483 -21.049 1.00 31.02 C ATOM 1051 C ASP A 922 14.689 22.452 -21.867 1.00 31.29 C ATOM 1052 O ASP A 922 14.001 21.609 -21.265 1.00 29.44 O ATOM 1053 CB ASP A 922 16.998 23.702 -21.556 1.00 31.45 C ATOM 1054 CG ASP A 922 17.967 22.521 -21.658 1.00 33.37 C ATOM 1055 OD1 ASP A 922 17.872 21.592 -20.829 1.00 34.72 O ATOM 1056 OD2 ASP A 922 18.875 22.571 -22.518 1.00 36.29 O ATOM 1057 H ASP A 922 16.053 22.427 -19.235 1.00 0.00 H ATOM 1058 N ALA A 923 14.657 22.603 -23.218 1.00 25.81 N ATOM 1059 CA ALA A 923 13.896 21.763 -24.154 1.00 24.74 C ATOM 1060 C ALA A 923 14.154 20.275 -23.886 1.00 27.87 C ATOM 1061 O ALA A 923 13.198 19.494 -23.688 1.00 25.69 O ATOM 1062 CB ALA A 923 14.272 22.111 -25.596 1.00 24.89 C ATOM 1063 H ALA A 923 15.219 23.379 -23.624 1.00 0.00 H ATOM 1064 N SER A 924 15.449 19.906 -23.840 1.00 23.20 N ATOM 1065 CA SER A 924 15.897 18.542 -23.562 1.00 23.70 C ATOM 1066 C SER A 924 15.310 17.990 -22.267 1.00 27.85 C ATOM 1067 O SER A 924 14.788 16.864 -22.260 1.00 27.15 O ATOM 1068 CB SER A 924 17.414 18.484 -23.536 1.00 26.87 C ATOM 1069 OG SER A 924 17.915 18.747 -24.833 1.00 32.24 O ATOM 1070 HG SER A 924 18.904 18.709 -24.817 1.00 0.00 H ATOM 1071 H SER A 924 16.172 20.633 -24.012 1.00 0.00 H ATOM 1072 N ARG A 925 15.353 18.798 -21.185 1.00 25.13 N ATOM 1073 CA ARG A 925 14.754 18.432 -19.906 1.00 25.17 C ATOM 1074 C ARG A 925 13.228 18.241 -20.028 1.00 28.47 C ATOM 1075 O ARG A 925 12.691 17.284 -19.462 1.00 28.70 O ATOM 1076 CB ARG A 925 15.143 19.432 -18.809 1.00 26.89 C ATOM 1077 CG ARG A 925 14.970 18.951 -17.352 1.00 43.05 C ATOM 1078 CD ARG A 925 15.623 17.618 -16.949 1.00 62.11 C ATOM 1079 NE ARG A 925 16.984 17.438 -17.469 1.00 80.55 N ATOM 1080 CZ ARG A 925 18.025 17.035 -16.744 1.00 99.14 C ATOM 1081 NH1 ARG A 925 17.885 16.784 -15.448 1.00 90.62 N ATOM 1082 NH2 ARG A 925 19.218 16.892 -17.308 1.00 83.95 N ATOM 1083 HE ARG A 925 17.146 17.640 -18.476 1.00 0.00 H ATOM 1084 HH12 ARG A 925 18.703 16.469 -14.888 1.00 0.00 H ATOM 1085 HH11 ARG A 925 16.957 16.902 -14.993 1.00 0.00 H ATOM 1086 HH22 ARG A 925 20.028 16.577 -16.738 1.00 0.00 H ATOM 1087 HH21 ARG A 925 19.342 17.095 -18.320 1.00 0.00 H ATOM 1088 H ARG A 925 15.832 19.717 -21.267 1.00 0.00 H ATOM 1089 N LEU A 926 12.546 19.081 -20.824 1.00 24.13 N ATOM 1090 CA LEU A 926 11.095 18.946 -21.052 1.00 22.96 C ATOM 1091 C LEU A 926 10.692 17.716 -21.895 1.00 24.33 C ATOM 1092 O LEU A 926 9.593 17.178 -21.692 1.00 21.11 O ATOM 1093 CB LEU A 926 10.509 20.219 -21.687 1.00 22.87 C ATOM 1094 CG LEU A 926 10.804 21.557 -21.004 1.00 27.54 C ATOM 1095 CD1 LEU A 926 10.406 22.705 -21.882 1.00 28.14 C ATOM 1096 CD2 LEU A 926 10.112 21.682 -19.674 1.00 31.49 C ATOM 1097 H LEU A 926 13.059 19.853 -21.296 1.00 0.00 H ATOM 1098 N LEU A 927 11.555 17.286 -22.856 1.00 22.28 N ATOM 1099 CA LEU A 927 11.263 16.127 -23.719 1.00 21.80 C ATOM 1100 C LEU A 927 11.344 14.829 -22.929 1.00 23.39 C ATOM 1101 O LEU A 927 10.557 13.902 -23.172 1.00 22.16 O ATOM 1102 CB LEU A 927 12.220 16.036 -24.918 1.00 21.44 C ATOM 1103 CG LEU A 927 12.226 17.222 -25.875 1.00 27.43 C ATOM 1104 CD1 LEU A 927 13.607 17.453 -26.401 1.00 27.36 C ATOM 1105 CD2 LEU A 927 11.230 17.027 -26.999 1.00 28.87 C ATOM 1106 H LEU A 927 12.453 17.794 -22.986 1.00 0.00 H ATOM 1107 N LEU A 928 12.309 14.767 -21.993 1.00 18.90 N ATOM 1108 CA LEU A 928 12.501 13.634 -21.075 1.00 18.59 C ATOM 1109 C LEU A 928 11.265 13.524 -20.202 1.00 21.55 C ATOM 1110 O LEU A 928 10.783 12.409 -19.995 1.00 21.64 O ATOM 1111 CB LEU A 928 13.732 13.872 -20.203 1.00 18.90 C ATOM 1112 CG LEU A 928 13.940 12.968 -18.968 1.00 22.20 C ATOM 1113 CD1 LEU A 928 14.248 11.525 -19.363 1.00 21.93 C ATOM 1114 CD2 LEU A 928 15.071 13.513 -18.097 1.00 26.79 C ATOM 1115 H LEU A 928 12.962 15.573 -21.914 1.00 0.00 H ATOM 1116 N TYR A 929 10.723 14.681 -19.726 1.00 19.71 N ATOM 1117 CA TYR A 929 9.471 14.711 -18.941 1.00 18.88 C ATOM 1118 C TYR A 929 8.344 14.203 -19.823 1.00 23.39 C ATOM 1119 O TYR A 929 7.522 13.425 -19.357 1.00 23.93 O ATOM 1120 CB TYR A 929 9.113 16.139 -18.472 1.00 21.67 C ATOM 1121 CG TYR A 929 10.010 16.796 -17.443 1.00 23.45 C ATOM 1122 CD1 TYR A 929 10.725 16.035 -16.521 1.00 24.87 C ATOM 1123 CD2 TYR A 929 10.056 18.181 -17.317 1.00 24.88 C ATOM 1124 CE1 TYR A 929 11.530 16.637 -15.555 1.00 25.37 C ATOM 1125 CE2 TYR A 929 10.842 18.796 -16.346 1.00 26.18 C ATOM 1126 CZ TYR A 929 11.594 18.018 -15.480 1.00 29.99 C ATOM 1127 OH TYR A 929 12.382 18.624 -14.541 1.00 30.76 O ATOM 1128 HH TYR A 929 12.849 17.933 -14.008 1.00 0.00 H ATOM 1129 H TYR A 929 11.210 15.578 -19.923 1.00 0.00 H ATOM 1130 N SER A 930 8.324 14.615 -21.115 1.00 21.07 N ATOM 1131 CA SER A 930 7.311 14.219 -22.080 1.00 21.10 C ATOM 1132 C SER A 930 7.301 12.715 -22.316 1.00 25.18 C ATOM 1133 O SER A 930 6.233 12.103 -22.316 1.00 23.98 O ATOM 1134 CB SER A 930 7.512 14.947 -23.402 1.00 23.98 C ATOM 1135 OG SER A 930 7.294 16.344 -23.324 1.00 32.17 O ATOM 1136 HG SER A 930 7.925 16.739 -22.671 1.00 0.00 H ATOM 1137 H SER A 930 9.080 15.254 -21.435 1.00 0.00 H ATOM 1138 N SER A 931 8.489 12.142 -22.557 1.00 23.56 N ATOM 1139 CA SER A 931 8.713 10.733 -22.844 1.00 23.39 C ATOM 1140 C SER A 931 8.390 9.842 -21.632 1.00 25.80 C ATOM 1141 O SER A 931 7.932 8.712 -21.825 1.00 25.77 O ATOM 1142 CB SER A 931 10.138 10.514 -23.356 1.00 27.80 C ATOM 1143 OG SER A 931 10.938 9.722 -22.491 1.00 38.16 O ATOM 1144 HG SER A 931 11.842 9.621 -22.881 1.00 0.00 H ATOM 1145 H SER A 931 9.325 12.760 -22.537 1.00 0.00 H ATOM 1146 N GLN A 932 8.609 10.355 -20.401 1.00 19.44 N ATOM 1147 CA GLN A 932 8.310 9.651 -19.134 1.00 19.18 C ATOM 1148 C GLN A 932 6.802 9.603 -18.904 1.00 20.04 C ATOM 1149 O GLN A 932 6.272 8.539 -18.634 1.00 17.36 O ATOM 1150 CB GLN A 932 9.037 10.278 -17.942 1.00 19.67 C ATOM 1151 CG GLN A 932 10.530 10.048 -18.009 1.00 18.48 C ATOM 1152 CD GLN A 932 11.274 10.551 -16.818 1.00 35.94 C ATOM 1153 OE1 GLN A 932 10.747 11.312 -16.001 1.00 32.62 O ATOM 1154 NE2 GLN A 932 12.525 10.120 -16.685 1.00 32.48 N ATOM 1155 HE22 GLN A 932 12.933 9.479 -17.396 1.00 0.00 H ATOM 1156 HE21 GLN A 932 13.096 10.424 -15.870 1.00 0.00 H ATOM 1157 H GLN A 932 9.016 11.310 -20.340 1.00 0.00 H ATOM 1158 N ILE A 933 6.110 10.747 -19.087 1.00 17.51 N ATOM 1159 CA ILE A 933 4.645 10.833 -19.020 1.00 16.59 C ATOM 1160 C ILE A 933 4.117 9.847 -20.120 1.00 20.32 C ATOM 1161 O ILE A 933 3.237 9.002 -19.865 1.00 17.75 O ATOM 1162 CB ILE A 933 4.164 12.300 -19.288 1.00 17.67 C ATOM 1163 CG1 ILE A 933 4.611 13.251 -18.164 1.00 15.75 C ATOM 1164 CG2 ILE A 933 2.630 12.313 -19.432 1.00 14.03 C ATOM 1165 CD1 ILE A 933 4.636 14.696 -18.494 1.00 15.12 C ATOM 1166 H ILE A 933 6.644 11.617 -19.287 1.00 0.00 H ATOM 1167 N CYS A 934 4.726 9.920 -21.309 1.00 17.38 N ATOM 1168 CA CYS A 934 4.332 9.062 -22.394 1.00 20.31 C ATOM 1169 C CYS A 934 4.396 7.555 -22.051 1.00 25.31 C ATOM 1170 O CYS A 934 3.406 6.867 -22.272 1.00 25.99 O ATOM 1171 CB CYS A 934 5.099 9.385 -23.661 1.00 21.82 C ATOM 1172 SG CYS A 934 4.492 8.476 -25.087 1.00 26.42 S ATOM 1173 H CYS A 934 5.495 10.606 -21.451 1.00 0.00 H ATOM 1174 N LYS A 935 5.506 7.069 -21.484 1.00 19.93 N ATOM 1175 CA LYS A 935 5.638 5.650 -21.087 1.00 20.17 C ATOM 1176 C LYS A 935 4.652 5.266 -19.960 1.00 21.82 C ATOM 1177 O LYS A 935 4.078 4.172 -19.979 1.00 20.60 O ATOM 1178 CB LYS A 935 7.080 5.316 -20.695 1.00 23.09 C ATOM 1179 CG LYS A 935 8.001 5.215 -21.906 1.00 43.14 C ATOM 1180 CD LYS A 935 9.430 5.605 -21.555 1.00 58.18 C ATOM 1181 CE LYS A 935 10.417 5.238 -22.635 1.00 67.63 C ATOM 1182 NZ LYS A 935 11.780 5.733 -22.312 1.00 77.67 N ATOM 1183 HZ1 LYS A 935 11.759 6.769 -22.221 1.00 0.00 H ATOM 1184 HZ2 LYS A 935 12.097 5.311 -21.416 1.00 0.00 H ATOM 1185 HZ3 LYS A 935 12.435 5.464 -23.074 1.00 0.00 H ATOM 1186 H LYS A 935 6.306 7.712 -21.316 1.00 0.00 H ATOM 1187 N GLY A 936 4.431 6.188 -19.022 1.00 16.89 N ATOM 1188 CA GLY A 936 3.434 6.003 -17.978 1.00 15.62 C ATOM 1189 C GLY A 936 2.059 5.809 -18.598 1.00 16.38 C ATOM 1190 O GLY A 936 1.323 4.918 -18.194 1.00 14.55 O ATOM 1191 H GLY A 936 4.988 7.066 -19.037 1.00 0.00 H ATOM 1192 N MET A 937 1.708 6.641 -19.580 1.00 15.83 N ATOM 1193 CA MET A 937 0.407 6.564 -20.261 1.00 16.46 C ATOM 1194 C MET A 937 0.243 5.329 -21.117 1.00 22.37 C ATOM 1195 O MET A 937 -0.870 4.810 -21.214 1.00 24.14 O ATOM 1196 CB MET A 937 0.131 7.825 -21.079 1.00 18.23 C ATOM 1197 CG MET A 937 -0.260 9.011 -20.213 1.00 20.41 C ATOM 1198 SD MET A 937 -1.559 8.720 -18.981 1.00 23.33 S ATOM 1199 CE MET A 937 -2.965 8.416 -20.016 1.00 21.92 C ATOM 1200 H MET A 937 2.383 7.375 -19.876 1.00 0.00 H ATOM 1201 N GLU A 938 1.337 4.893 -21.779 1.00 18.75 N ATOM 1202 CA GLU A 938 1.413 3.665 -22.606 1.00 17.08 C ATOM 1203 C GLU A 938 1.143 2.477 -21.666 1.00 20.11 C ATOM 1204 O GLU A 938 0.399 1.535 -22.018 1.00 17.87 O ATOM 1205 CB GLU A 938 2.815 3.573 -23.254 1.00 17.45 C ATOM 1206 CG GLU A 938 3.150 2.254 -23.942 1.00 27.84 C ATOM 1207 CD GLU A 938 4.602 1.789 -23.957 1.00 56.73 C ATOM 1208 OE1 GLU A 938 5.481 2.474 -23.380 1.00 43.73 O ATOM 1209 OE2 GLU A 938 4.850 0.699 -24.522 1.00 53.91 O ATOM 1210 H GLU A 938 2.200 5.468 -21.702 1.00 0.00 H ATOM 1211 N TYR A 939 1.710 2.548 -20.439 1.00 17.84 N ATOM 1212 CA TYR A 939 1.466 1.514 -19.434 1.00 18.57 C ATOM 1213 C TYR A 939 0.025 1.515 -18.957 1.00 23.87 C ATOM 1214 O TYR A 939 -0.564 0.453 -18.847 1.00 23.44 O ATOM 1215 CB TYR A 939 2.463 1.566 -18.265 1.00 19.91 C ATOM 1216 CG TYR A 939 2.107 0.646 -17.115 1.00 21.34 C ATOM 1217 CD1 TYR A 939 2.277 -0.735 -17.217 1.00 22.93 C ATOM 1218 CD2 TYR A 939 1.570 1.151 -15.937 1.00 22.83 C ATOM 1219 CE1 TYR A 939 1.932 -1.588 -16.168 1.00 19.95 C ATOM 1220 CE2 TYR A 939 1.213 0.312 -14.889 1.00 23.90 C ATOM 1221 CZ TYR A 939 1.386 -1.058 -15.009 1.00 26.64 C ATOM 1222 OH TYR A 939 1.066 -1.856 -13.935 1.00 19.79 O ATOM 1223 HH TYR A 939 1.240 -2.803 -14.166 1.00 0.00 H ATOM 1224 H TYR A 939 2.329 3.351 -20.207 1.00 0.00 H ATOM 1225 N LEU A 940 -0.538 2.689 -18.644 1.00 21.98 N ATOM 1226 CA LEU A 940 -1.920 2.787 -18.191 1.00 20.79 C ATOM 1227 C LEU A 940 -2.877 2.231 -19.237 1.00 22.05 C ATOM 1228 O LEU A 940 -3.846 1.565 -18.873 1.00 19.79 O ATOM 1229 CB LEU A 940 -2.296 4.238 -17.920 1.00 20.59 C ATOM 1230 CG LEU A 940 -1.933 4.834 -16.599 1.00 25.93 C ATOM 1231 CD1 LEU A 940 -2.567 6.188 -16.484 1.00 25.91 C ATOM 1232 CD2 LEU A 940 -2.451 3.999 -15.466 1.00 29.47 C ATOM 1233 H LEU A 940 0.028 3.557 -18.727 1.00 0.00 H ATOM 1234 N GLY A 941 -2.595 2.490 -20.511 1.00 18.07 N ATOM 1235 CA GLY A 941 -3.404 2.004 -21.634 1.00 17.41 C ATOM 1236 C GLY A 941 -3.390 0.495 -21.737 1.00 19.19 C ATOM 1237 O GLY A 941 -4.432 -0.128 -21.983 1.00 15.84 O ATOM 1238 H GLY A 941 -1.756 3.068 -20.722 1.00 0.00 H ATOM 1239 N SER A 942 -2.215 -0.100 -21.407 1.00 15.67 N ATOM 1240 CA SER A 942 -1.967 -1.541 -21.368 1.00 16.90 C ATOM 1241 C SER A 942 -2.825 -2.235 -20.306 1.00 23.74 C ATOM 1242 O SER A 942 -3.089 -3.432 -20.456 1.00 25.40 O ATOM 1243 CB SER A 942 -0.485 -1.820 -21.112 1.00 18.40 C ATOM 1244 OG SER A 942 -0.213 -2.061 -19.743 1.00 18.12 O ATOM 1245 HG SER A 942 -0.473 -1.267 -19.211 1.00 0.00 H ATOM 1246 H SER A 942 -1.421 0.524 -21.160 1.00 0.00 H ATOM 1247 N ARG A 943 -3.176 -1.507 -19.198 1.00 20.05 N ATOM 1248 CA ARG A 943 -4.010 -1.975 -18.069 1.00 18.86 C ATOM 1249 C ARG A 943 -5.484 -1.759 -18.334 1.00 22.46 C ATOM 1250 O ARG A 943 -6.306 -2.054 -17.463 1.00 21.66 O ATOM 1251 CB ARG A 943 -3.627 -1.248 -16.741 1.00 15.87 C ATOM 1252 CG ARG A 943 -2.254 -1.618 -16.209 1.00 26.62 C ATOM 1253 CD ARG A 943 -2.259 -3.011 -15.597 1.00 32.01 C ATOM 1254 NE ARG A 943 -1.606 -3.963 -16.479 1.00 34.11 N ATOM 1255 CZ ARG A 943 -1.839 -5.272 -16.495 1.00 41.32 C ATOM 1256 NH1 ARG A 943 -2.737 -5.807 -15.671 1.00 26.34 N ATOM 1257 NH2 ARG A 943 -1.181 -6.056 -17.335 1.00 17.97 N ATOM 1258 HE ARG A 943 -0.902 -3.592 -17.149 1.00 0.00 H ATOM 1259 HH12 ARG A 943 -2.914 -6.832 -15.689 1.00 0.00 H ATOM 1260 HH11 ARG A 943 -3.262 -5.200 -15.009 1.00 0.00 H ATOM 1261 HH22 ARG A 943 -1.366 -7.079 -17.344 1.00 0.00 H ATOM 1262 HH21 ARG A 943 -0.479 -5.648 -17.985 1.00 0.00 H ATOM 1263 H ARG A 943 -2.821 -0.531 -19.146 1.00 0.00 H ATOM 1264 N ARG A 944 -5.814 -1.207 -19.522 1.00 19.38 N ATOM 1265 CA ARG A 944 -7.156 -0.838 -19.966 1.00 20.65 C ATOM 1266 C ARG A 944 -7.633 0.383 -19.171 1.00 25.89 C ATOM 1267 O ARG A 944 -8.828 0.594 -19.055 1.00 25.93 O ATOM 1268 CB ARG A 944 -8.157 -2.011 -19.858 1.00 22.69 C ATOM 1269 CG ARG A 944 -7.775 -3.258 -20.647 1.00 26.52 C ATOM 1270 CD ARG A 944 -9.033 -3.974 -21.060 1.00 34.67 C ATOM 1271 NE ARG A 944 -8.987 -4.339 -22.477 1.00 50.48 N ATOM 1272 CZ ARG A 944 -9.676 -3.735 -23.439 1.00 62.72 C ATOM 1273 NH1 ARG A 944 -9.547 -4.125 -24.699 1.00 60.71 N ATOM 1274 NH2 ARG A 944 -10.512 -2.747 -23.147 1.00 41.21 N ATOM 1275 HE ARG A 944 -8.369 -5.130 -22.751 1.00 0.00 H ATOM 1276 HH12 ARG A 944 -10.088 -3.649 -25.449 1.00 0.00 H ATOM 1277 HH11 ARG A 944 -8.904 -4.907 -24.938 1.00 0.00 H ATOM 1278 HH22 ARG A 944 -11.048 -2.278 -23.905 1.00 0.00 H ATOM 1279 HH21 ARG A 944 -10.631 -2.441 -22.160 1.00 0.00 H ATOM 1280 H ARG A 944 -5.035 -1.027 -20.187 1.00 0.00 H ATOM 1281 N CYS A 945 -6.690 1.209 -18.652 1.00 22.23 N ATOM 1282 CA CYS A 945 -6.996 2.378 -17.827 1.00 21.86 C ATOM 1283 C CYS A 945 -6.996 3.678 -18.613 1.00 23.14 C ATOM 1284 O CYS A 945 -6.050 3.971 -19.331 1.00 20.97 O ATOM 1285 CB CYS A 945 -6.057 2.448 -16.626 1.00 22.70 C ATOM 1286 SG CYS A 945 -6.519 3.698 -15.399 1.00 27.48 S ATOM 1287 H CYS A 945 -5.691 0.999 -18.852 1.00 0.00 H ATOM 1288 N VAL A 946 -8.040 4.474 -18.427 1.00 21.84 N ATOM 1289 CA VAL A 946 -8.187 5.784 -19.067 1.00 22.42 C ATOM 1290 C VAL A 946 -8.251 6.730 -17.909 1.00 24.95 C ATOM 1291 O VAL A 946 -9.113 6.590 -17.041 1.00 24.36 O ATOM 1292 CB VAL A 946 -9.421 5.858 -19.994 1.00 27.91 C ATOM 1293 CG1 VAL A 946 -9.698 7.290 -20.449 1.00 26.96 C ATOM 1294 CG2 VAL A 946 -9.251 4.929 -21.187 1.00 28.62 C ATOM 1295 H VAL A 946 -8.797 4.151 -17.791 1.00 0.00 H ATOM 1296 N HIS A 947 -7.257 7.621 -17.855 1.00 21.09 N ATOM 1297 CA HIS A 947 -7.008 8.528 -16.759 1.00 18.30 C ATOM 1298 C HIS A 947 -8.071 9.590 -16.627 1.00 22.20 C ATOM 1299 O HIS A 947 -8.598 9.768 -15.525 1.00 19.23 O ATOM 1300 CB HIS A 947 -5.592 9.108 -16.850 1.00 16.77 C ATOM 1301 CG HIS A 947 -5.155 9.786 -15.593 1.00 18.36 C ATOM 1302 ND1 HIS A 947 -5.519 11.093 -15.323 1.00 19.00 N ATOM 1303 CD2 HIS A 947 -4.277 9.373 -14.649 1.00 18.47 C ATOM 1304 CE1 HIS A 947 -4.898 11.410 -14.200 1.00 17.35 C ATOM 1305 NE2 HIS A 947 -4.124 10.410 -13.772 1.00 16.98 N ATOM 1306 H HIS A 947 -6.610 7.665 -18.668 1.00 0.00 H ATOM 1307 N ARG A 948 -8.395 10.272 -17.755 1.00 19.62 N ATOM 1308 CA ARG A 948 -9.463 11.254 -17.914 1.00 20.79 C ATOM 1309 C ARG A 948 -9.135 12.648 -17.325 1.00 25.60 C ATOM 1310 O ARG A 948 -9.817 13.626 -17.642 1.00 25.48 O ATOM 1311 CB ARG A 948 -10.806 10.673 -17.386 1.00 21.79 C ATOM 1312 CG ARG A 948 -11.991 11.645 -17.379 1.00 30.49 C ATOM 1313 CD ARG A 948 -13.343 10.968 -17.569 1.00 37.47 C ATOM 1314 NE ARG A 948 -13.680 9.949 -16.577 1.00 31.02 N ATOM 1315 CZ ARG A 948 -14.321 10.199 -15.439 1.00 54.09 C ATOM 1316 NH1 ARG A 948 -14.621 11.445 -15.101 1.00 33.06 N ATOM 1317 NH2 ARG A 948 -14.610 9.210 -14.600 1.00 46.59 N ATOM 1318 HE ARG A 948 -13.401 8.967 -16.773 1.00 0.00 H ATOM 1319 HH12 ARG A 948 -15.122 11.636 -14.210 1.00 0.00 H ATOM 1320 HH11 ARG A 948 -14.355 12.232 -15.727 1.00 0.00 H ATOM 1321 HH22 ARG A 948 -15.111 9.412 -13.711 1.00 0.00 H ATOM 1322 HH21 ARG A 948 -14.335 8.234 -14.832 1.00 0.00 H ATOM 1323 H ARG A 948 -7.819 10.073 -18.598 1.00 0.00 H ATOM 1324 N ASP A 949 -8.071 12.773 -16.549 1.00 21.30 N ATOM 1325 CA ASP A 949 -7.733 14.090 -16.016 1.00 20.53 C ATOM 1326 C ASP A 949 -6.242 14.319 -16.171 1.00 24.86 C ATOM 1327 O ASP A 949 -5.590 14.828 -15.270 1.00 25.52 O ATOM 1328 CB ASP A 949 -8.191 14.180 -14.554 1.00 22.36 C ATOM 1329 CG ASP A 949 -8.444 15.583 -14.027 1.00 30.27 C ATOM 1330 OD1 ASP A 949 -8.683 16.494 -14.845 1.00 29.47 O ATOM 1331 OD2 ASP A 949 -8.522 15.743 -12.801 1.00 37.45 O ATOM 1332 H ASP A 949 -7.484 11.945 -16.322 1.00 0.00 H ATOM 1333 N LEU A 950 -5.681 13.908 -17.305 1.00 21.58 N ATOM 1334 CA LEU A 950 -4.258 14.076 -17.524 1.00 22.31 C ATOM 1335 C LEU A 950 -3.983 15.547 -17.790 1.00 26.19 C ATOM 1336 O LEU A 950 -4.534 16.125 -18.721 1.00 24.11 O ATOM 1337 CB LEU A 950 -3.770 13.164 -18.648 1.00 22.70 C ATOM 1338 CG LEU A 950 -2.272 12.950 -18.787 1.00 28.19 C ATOM 1339 CD1 LEU A 950 -1.711 12.118 -17.622 1.00 28.56 C ATOM 1340 CD2 LEU A 950 -1.988 12.241 -20.075 1.00 31.53 C ATOM 1341 H LEU A 950 -6.267 13.463 -18.040 1.00 0.00 H ATOM 1342 N ALA A 951 -3.254 16.171 -16.863 1.00 23.11 N ATOM 1343 CA ALA A 951 -2.871 17.596 -16.880 1.00 21.61 C ATOM 1344 C ALA A 951 -1.514 17.729 -16.133 1.00 26.84 C ATOM 1345 O ALA A 951 -1.211 16.864 -15.304 1.00 28.19 O ATOM 1346 CB ALA A 951 -3.940 18.415 -16.164 1.00 20.90 C ATOM 1347 H ALA A 951 -2.926 15.602 -16.056 1.00 0.00 H ATOM 1348 N ALA A 952 -0.738 18.820 -16.346 1.00 22.58 N ATOM 1349 CA ALA A 952 0.544 19.002 -15.615 1.00 22.23 C ATOM 1350 C ALA A 952 0.324 19.173 -14.108 1.00 25.51 C ATOM 1351 O ALA A 952 1.176 18.777 -13.304 1.00 25.68 O ATOM 1352 CB ALA A 952 1.342 20.177 -16.173 1.00 23.39 C ATOM 1353 H ALA A 952 -1.044 19.540 -17.031 1.00 0.00 H ATOM 1354 N ARG A 953 -0.863 19.651 -13.724 1.00 21.28 N ATOM 1355 CA ARG A 953 -1.221 19.797 -12.318 1.00 20.91 C ATOM 1356 C ARG A 953 -1.397 18.413 -11.670 1.00 22.83 C ATOM 1357 O ARG A 953 -1.331 18.301 -10.446 1.00 22.13 O ATOM 1358 CB ARG A 953 -2.494 20.666 -12.166 1.00 19.35 C ATOM 1359 CG ARG A 953 -3.825 19.913 -12.296 1.00 21.99 C ATOM 1360 CD ARG A 953 -5.015 20.812 -12.607 1.00 28.87 C ATOM 1361 NE ARG A 953 -5.724 20.341 -13.801 1.00 25.62 N ATOM 1362 CZ ARG A 953 -6.753 19.495 -13.796 1.00 36.71 C ATOM 1363 NH1 ARG A 953 -7.260 19.061 -12.653 1.00 25.29 N ATOM 1364 NH2 ARG A 953 -7.290 19.092 -14.934 1.00 29.51 N ATOM 1365 HE ARG A 953 -5.398 20.695 -14.723 1.00 0.00 H ATOM 1366 HH12 ARG A 953 -8.063 18.401 -12.658 1.00 0.00 H ATOM 1367 HH11 ARG A 953 -6.855 19.380 -11.750 1.00 0.00 H ATOM 1368 HH22 ARG A 953 -8.093 18.431 -14.925 1.00 0.00 H ATOM 1369 HH21 ARG A 953 -6.909 19.435 -15.839 1.00 0.00 H ATOM 1370 H ARG A 953 -1.553 19.928 -14.451 1.00 0.00 H ATOM 1371 N ASN A 954 -1.607 17.370 -12.502 1.00 17.28 N ATOM 1372 CA ASN A 954 -1.825 16.017 -12.024 1.00 15.64 C ATOM 1373 C ASN A 954 -0.602 15.129 -12.293 1.00 18.88 C ATOM 1374 O ASN A 954 -0.684 13.913 -12.183 1.00 15.93 O ATOM 1375 CB ASN A 954 -3.131 15.442 -12.591 1.00 15.41 C ATOM 1376 CG ASN A 954 -4.383 16.088 -12.026 1.00 32.88 C ATOM 1377 OD1 ASN A 954 -4.439 16.564 -10.887 1.00 29.10 O ATOM 1378 ND2 ASN A 954 -5.420 16.129 -12.811 1.00 29.24 N ATOM 1379 HD22 ASN A 954 -5.364 15.726 -13.768 1.00 0.00 H ATOM 1380 HD21 ASN A 954 -6.305 16.565 -12.481 1.00 0.00 H ATOM 1381 H ASN A 954 -1.613 17.544 -13.527 1.00 0.00 H ATOM 1382 N ILE A 955 0.536 15.759 -12.599 1.00 17.78 N ATOM 1383 CA ILE A 955 1.793 15.050 -12.796 1.00 18.76 C ATOM 1384 C ILE A 955 2.678 15.469 -11.600 1.00 22.77 C ATOM 1385 O ILE A 955 2.556 16.592 -11.141 1.00 21.02 O ATOM 1386 CB ILE A 955 2.362 15.244 -14.240 1.00 21.53 C ATOM 1387 CG1 ILE A 955 1.294 14.701 -15.254 1.00 22.62 C ATOM 1388 CG2 ILE A 955 3.715 14.496 -14.428 1.00 21.99 C ATOM 1389 CD1 ILE A 955 1.355 15.087 -16.651 1.00 25.61 C ATOM 1390 H ILE A 955 0.524 16.794 -12.700 1.00 0.00 H ATOM 1391 N LEU A 956 3.382 14.517 -10.972 1.00 20.98 N ATOM 1392 CA LEU A 956 4.201 14.823 -9.794 1.00 20.05 C ATOM 1393 C LEU A 956 5.667 14.749 -10.142 1.00 24.12 C ATOM 1394 O LEU A 956 6.033 14.123 -11.139 1.00 23.21 O ATOM 1395 CB LEU A 956 3.881 13.922 -8.575 1.00 18.91 C ATOM 1396 CG LEU A 956 2.497 14.030 -7.900 1.00 21.34 C ATOM 1397 CD1 LEU A 956 2.282 12.895 -6.981 1.00 20.63 C ATOM 1398 CD2 LEU A 956 2.321 15.329 -7.096 1.00 15.62 C ATOM 1399 H LEU A 956 3.347 13.540 -11.327 1.00 0.00 H ATOM 1400 N VAL A 957 6.506 15.444 -9.356 1.00 20.94 N ATOM 1401 CA VAL A 957 7.952 15.444 -9.595 1.00 20.02 C ATOM 1402 C VAL A 957 8.602 14.661 -8.458 1.00 21.90 C ATOM 1403 O VAL A 957 8.479 15.077 -7.295 1.00 17.90 O ATOM 1404 CB VAL A 957 8.538 16.878 -9.720 1.00 24.60 C ATOM 1405 CG1 VAL A 957 9.899 16.863 -10.414 1.00 24.08 C ATOM 1406 CG2 VAL A 957 7.582 17.806 -10.461 1.00 24.97 C ATOM 1407 H VAL A 957 6.121 15.994 -8.561 1.00 0.00 H ATOM 1408 N GLU A 958 9.237 13.495 -8.811 1.00 19.10 N ATOM 1409 CA GLU A 958 9.975 12.580 -7.924 1.00 19.59 C ATOM 1410 C GLU A 958 11.331 13.207 -7.645 1.00 23.22 C ATOM 1411 O GLU A 958 11.680 13.394 -6.479 1.00 21.27 O ATOM 1412 CB GLU A 958 10.119 11.173 -8.574 1.00 21.30 C ATOM 1413 CG GLU A 958 11.138 10.239 -7.929 1.00 34.73 C ATOM 1414 CD GLU A 958 10.799 9.667 -6.561 1.00 52.46 C ATOM 1415 OE1 GLU A 958 10.750 10.447 -5.582 1.00 55.80 O ATOM 1416 OE2 GLU A 958 10.681 8.425 -6.453 1.00 38.85 O ATOM 1417 H GLU A 958 9.191 13.229 -9.815 1.00 0.00 H ATOM 1418 N SER A 959 12.066 13.555 -8.729 1.00 21.92 N ATOM 1419 CA SER A 959 13.338 14.264 -8.706 1.00 21.54 C ATOM 1420 C SER A 959 13.462 15.191 -9.951 1.00 26.39 C ATOM 1421 O SER A 959 12.556 15.192 -10.800 1.00 26.21 O ATOM 1422 CB SER A 959 14.504 13.287 -8.571 1.00 25.16 C ATOM 1423 OG SER A 959 14.697 12.516 -9.744 1.00 39.66 O ATOM 1424 HG SER A 959 15.460 11.900 -9.611 1.00 0.00 H ATOM 1425 H SER A 959 11.688 13.292 -9.661 1.00 0.00 H ATOM 1426 N GLU A 960 14.568 15.981 -10.037 1.00 20.44 N ATOM 1427 CA GLU A 960 14.877 16.899 -11.138 1.00 20.93 C ATOM 1428 C GLU A 960 14.594 16.327 -12.535 1.00 22.95 C ATOM 1429 O GLU A 960 14.085 17.027 -13.395 1.00 22.82 O ATOM 1430 CB GLU A 960 16.333 17.378 -11.030 1.00 22.84 C ATOM 1431 CG GLU A 960 17.363 16.272 -10.794 1.00 36.98 C ATOM 1432 CD GLU A 960 17.405 15.607 -9.425 1.00 58.47 C ATOM 1433 OE1 GLU A 960 17.675 14.384 -9.374 1.00 43.42 O ATOM 1434 OE2 GLU A 960 17.120 16.287 -8.413 1.00 52.19 O ATOM 1435 H GLU A 960 15.252 15.929 -9.255 1.00 0.00 H ATOM 1436 N ALA A 961 14.887 15.049 -12.747 1.00 20.97 N ATOM 1437 CA ALA A 961 14.719 14.386 -14.059 1.00 20.41 C ATOM 1438 C ALA A 961 13.748 13.162 -14.055 1.00 22.26 C ATOM 1439 O ALA A 961 13.897 12.254 -14.879 1.00 21.10 O ATOM 1440 CB ALA A 961 16.095 13.961 -14.552 1.00 20.84 C ATOM 1441 H ALA A 961 15.252 14.487 -11.952 1.00 0.00 H ATOM 1442 N HIS A 962 12.809 13.114 -13.098 1.00 20.74 N ATOM 1443 CA HIS A 962 11.873 11.991 -12.954 1.00 21.22 C ATOM 1444 C HIS A 962 10.461 12.445 -12.527 1.00 23.34 C ATOM 1445 O HIS A 962 10.280 12.970 -11.431 1.00 22.97 O ATOM 1446 CB HIS A 962 12.465 10.920 -11.979 1.00 23.06 C ATOM 1447 CG HIS A 962 11.700 9.630 -11.878 1.00 27.49 C ATOM 1448 ND1 HIS A 962 11.933 8.738 -10.846 1.00 30.22 N ATOM 1449 CD2 HIS A 962 10.744 9.111 -12.687 1.00 30.33 C ATOM 1450 CE1 HIS A 962 11.108 7.723 -11.049 1.00 29.69 C ATOM 1451 NE2 HIS A 962 10.365 7.910 -12.137 1.00 30.17 N ATOM 1452 H HIS A 962 12.741 13.907 -12.428 1.00 0.00 H ATOM 1453 N VAL A 963 9.476 12.260 -13.422 1.00 18.23 N ATOM 1454 CA VAL A 963 8.081 12.622 -13.190 1.00 19.02 C ATOM 1455 C VAL A 963 7.187 11.385 -13.093 1.00 21.86 C ATOM 1456 O VAL A 963 7.600 10.292 -13.497 1.00 20.05 O ATOM 1457 CB VAL A 963 7.541 13.666 -14.197 1.00 23.13 C ATOM 1458 CG1 VAL A 963 8.212 15.013 -13.980 1.00 24.09 C ATOM 1459 CG2 VAL A 963 7.719 13.196 -15.639 1.00 22.66 C ATOM 1460 H VAL A 963 9.723 11.832 -14.337 1.00 0.00 H ATOM 1461 N LYS A 964 6.006 11.538 -12.456 1.00 19.03 N ATOM 1462 CA LYS A 964 5.070 10.422 -12.255 1.00 19.04 C ATOM 1463 C LYS A 964 3.650 10.863 -12.453 1.00 19.94 C ATOM 1464 O LYS A 964 3.327 11.986 -12.078 1.00 19.04 O ATOM 1465 CB LYS A 964 5.208 9.834 -10.839 1.00 21.73 C ATOM 1466 CG LYS A 964 6.626 9.382 -10.435 1.00 20.27 C ATOM 1467 CD LYS A 964 6.551 8.282 -9.377 1.00 20.53 C ATOM 1468 CE LYS A 964 7.893 8.057 -8.712 1.00 24.73 C ATOM 1469 NZ LYS A 964 7.907 6.830 -7.880 1.00 30.33 N ATOM 1470 HZ1 LYS A 964 7.186 6.910 -7.135 1.00 0.00 H ATOM 1471 HZ2 LYS A 964 7.700 6.005 -8.478 1.00 0.00 H ATOM 1472 HZ3 LYS A 964 8.845 6.718 -7.446 1.00 0.00 H ATOM 1473 H LYS A 964 5.749 12.479 -12.095 1.00 0.00 H ATOM 1474 N ILE A 965 2.781 9.979 -13.009 1.00 15.49 N ATOM 1475 CA ILE A 965 1.348 10.251 -13.192 1.00 16.04 C ATOM 1476 C ILE A 965 0.621 10.078 -11.847 1.00 18.21 C ATOM 1477 O ILE A 965 0.880 9.098 -11.163 1.00 19.52 O ATOM 1478 CB ILE A 965 0.685 9.447 -14.347 1.00 18.44 C ATOM 1479 CG1 ILE A 965 1.435 9.697 -15.676 1.00 18.75 C ATOM 1480 CG2 ILE A 965 -0.796 9.868 -14.515 1.00 20.25 C ATOM 1481 CD1 ILE A 965 1.192 8.705 -16.677 1.00 23.91 C ATOM 1482 H ILE A 965 3.150 9.059 -13.323 1.00 0.00 H ATOM 1483 N ALA A 966 -0.270 11.043 -11.469 1.00 13.43 N ATOM 1484 CA ALA A 966 -0.997 11.026 -10.207 1.00 12.51 C ATOM 1485 C ALA A 966 -2.466 11.340 -10.394 1.00 19.19 C ATOM 1486 O ALA A 966 -2.925 11.470 -11.525 1.00 19.10 O ATOM 1487 CB ALA A 966 -0.383 12.043 -9.246 1.00 12.49 C ATOM 1488 H ALA A 966 -0.439 11.836 -12.121 1.00 0.00 H ATOM 1489 N ASP A 967 -3.200 11.485 -9.272 1.00 17.56 N ATOM 1490 CA ASP A 967 -4.633 11.812 -9.212 1.00 18.91 C ATOM 1491 C ASP A 967 -5.487 10.964 -10.149 1.00 23.07 C ATOM 1492 O ASP A 967 -5.818 11.396 -11.254 1.00 20.96 O ATOM 1493 CB ASP A 967 -4.869 13.315 -9.430 1.00 21.14 C ATOM 1494 CG ASP A 967 -6.224 13.843 -9.003 1.00 34.60 C ATOM 1495 OD1 ASP A 967 -7.012 13.064 -8.417 1.00 36.89 O ATOM 1496 OD2 ASP A 967 -6.470 15.054 -9.190 1.00 43.71 O ATOM 1497 H ASP A 967 -2.708 11.354 -8.365 1.00 0.00 H ATOM 1498 N PHE A 968 -5.806 9.738 -9.690 1.00 20.55 N ATOM 1499 CA PHE A 968 -6.570 8.721 -10.391 1.00 20.24 C ATOM 1500 C PHE A 968 -8.051 8.672 -9.942 1.00 26.09 C ATOM 1501 O PHE A 968 -8.715 7.633 -10.088 1.00 26.39 O ATOM 1502 CB PHE A 968 -5.887 7.339 -10.200 1.00 22.04 C ATOM 1503 CG PHE A 968 -4.632 7.133 -11.014 1.00 23.37 C ATOM 1504 CD1 PHE A 968 -3.411 7.643 -10.585 1.00 25.36 C ATOM 1505 CD2 PHE A 968 -4.669 6.426 -12.204 1.00 26.35 C ATOM 1506 CE1 PHE A 968 -2.261 7.492 -11.361 1.00 27.52 C ATOM 1507 CE2 PHE A 968 -3.520 6.297 -12.994 1.00 29.36 C ATOM 1508 CZ PHE A 968 -2.325 6.828 -12.565 1.00 28.20 C ATOM 1509 H PHE A 968 -5.471 9.495 -8.736 1.00 0.00 H ATOM 1510 N GLY A 969 -8.551 9.795 -9.419 1.00 23.51 N ATOM 1511 CA GLY A 969 -9.920 9.919 -8.937 1.00 23.16 C ATOM 1512 C GLY A 969 -10.979 9.712 -9.989 1.00 26.89 C ATOM 1513 O GLY A 969 -12.072 9.230 -9.666 1.00 28.43 O ATOM 1514 H GLY A 969 -7.929 10.626 -9.352 1.00 0.00 H ATOM 1515 N LEU A 970 -10.662 10.063 -11.257 1.00 20.84 N ATOM 1516 CA LEU A 970 -11.611 9.944 -12.360 1.00 21.72 C ATOM 1517 C LEU A 970 -11.223 8.871 -13.367 1.00 26.49 C ATOM 1518 O LEU A 970 -11.848 8.787 -14.410 1.00 25.03 O ATOM 1519 CB LEU A 970 -11.821 11.294 -13.067 1.00 22.07 C ATOM 1520 CG LEU A 970 -11.875 12.524 -12.183 1.00 25.95 C ATOM 1521 CD1 LEU A 970 -11.588 13.765 -12.981 1.00 26.23 C ATOM 1522 CD2 LEU A 970 -13.191 12.615 -11.462 1.00 25.31 C ATOM 1523 H LEU A 970 -9.709 10.430 -11.453 1.00 0.00 H ATOM 1524 N ALA A 971 -10.202 8.060 -13.039 1.00 25.76 N ATOM 1525 CA ALA A 971 -9.712 6.963 -13.872 1.00 26.55 C ATOM 1526 C ALA A 971 -10.751 5.850 -13.950 1.00 32.61 C ATOM 1527 O ALA A 971 -11.441 5.581 -12.969 1.00 34.92 O ATOM 1528 CB ALA A 971 -8.413 6.421 -13.317 1.00 26.88 C ATOM 1529 H ALA A 971 -9.727 8.225 -12.128 1.00 0.00 H ATOM 1530 N LYS A 972 -10.863 5.222 -15.120 1.00 28.81 N ATOM 1531 CA LYS A 972 -11.804 4.139 -15.388 1.00 29.23 C ATOM 1532 C LYS A 972 -11.150 3.021 -16.191 1.00 31.61 C ATOM 1533 O LYS A 972 -10.200 3.253 -16.951 1.00 28.10 O ATOM 1534 CB LYS A 972 -13.061 4.652 -16.117 1.00 31.91 C ATOM 1535 CG LYS A 972 -14.079 5.343 -15.195 1.00 52.39 C ATOM 1536 CD LYS A 972 -15.541 4.923 -15.471 1.00 62.54 C ATOM 1537 CE LYS A 972 -16.557 6.033 -15.242 1.00 72.76 C ATOM 1538 NZ LYS A 972 -16.711 6.413 -13.806 1.00 75.86 N ATOM 1539 HZ1 LYS A 972 -17.026 5.585 -13.261 1.00 0.00 H ATOM 1540 HZ2 LYS A 972 -15.797 6.745 -13.437 1.00 0.00 H ATOM 1541 HZ3 LYS A 972 -17.417 7.172 -13.723 1.00 0.00 H ATOM 1542 H LYS A 972 -10.238 5.524 -15.894 1.00 0.00 H ATOM 1543 N LEU A 973 -11.632 1.797 -15.971 1.00 29.45 N ATOM 1544 CA LEU A 973 -11.114 0.649 -16.682 1.00 30.22 C ATOM 1545 C LEU A 973 -12.016 0.418 -17.875 1.00 34.14 C ATOM 1546 O LEU A 973 -13.226 0.669 -17.809 1.00 34.06 O ATOM 1547 CB LEU A 973 -11.038 -0.595 -15.803 1.00 30.65 C ATOM 1548 CG LEU A 973 -9.954 -1.590 -16.200 1.00 36.31 C ATOM 1549 CD1 LEU A 973 -8.670 -1.347 -15.393 1.00 36.42 C ATOM 1550 CD2 LEU A 973 -10.428 -3.009 -15.991 1.00 39.09 C ATOM 1551 H LEU A 973 -12.394 1.666 -15.276 1.00 0.00 H ATOM 1552 N LEU A 974 -11.431 0.017 -18.987 1.00 29.05 N ATOM 1553 CA LEU A 974 -12.232 -0.204 -20.173 1.00 28.02 C ATOM 1554 C LEU A 974 -12.676 -1.641 -20.218 1.00 33.08 C ATOM 1555 O LEU A 974 -11.852 -2.523 -19.958 1.00 32.89 O ATOM 1556 CB LEU A 974 -11.446 0.106 -21.425 1.00 27.94 C ATOM 1557 CG LEU A 974 -10.960 1.504 -21.613 1.00 30.66 C ATOM 1558 CD1 LEU A 974 -9.952 1.525 -22.700 1.00 30.08 C ATOM 1559 CD2 LEU A 974 -12.104 2.443 -21.912 1.00 32.71 C ATOM 1560 H LEU A 974 -10.403 -0.139 -19.012 1.00 0.00 H ATOM 1561 N PRO A 975 -13.960 -1.907 -20.567 1.00 29.96 N ATOM 1562 CA PRO A 975 -14.414 -3.302 -20.674 1.00 29.11 C ATOM 1563 C PRO A 975 -13.611 -4.027 -21.753 1.00 30.30 C ATOM 1564 O PRO A 975 -13.192 -3.389 -22.704 1.00 30.50 O ATOM 1565 CB PRO A 975 -15.900 -3.167 -21.050 1.00 30.91 C ATOM 1566 CG PRO A 975 -16.291 -1.779 -20.661 1.00 35.47 C ATOM 1567 CD PRO A 975 -15.052 -0.959 -20.881 1.00 31.62 C ATOM 1568 N LEU A 976 -13.387 -5.335 -21.602 1.00 24.56 N ATOM 1569 CA LEU A 976 -12.618 -6.131 -22.562 1.00 24.54 C ATOM 1570 C LEU A 976 -13.167 -6.127 -24.014 1.00 28.80 C ATOM 1571 O LEU A 976 -12.386 -6.312 -24.939 1.00 29.16 O ATOM 1572 CB LEU A 976 -12.438 -7.572 -22.058 1.00 24.39 C ATOM 1573 CG LEU A 976 -11.707 -7.784 -20.722 1.00 28.46 C ATOM 1574 CD1 LEU A 976 -11.567 -9.256 -20.427 1.00 29.22 C ATOM 1575 CD2 LEU A 976 -10.319 -7.177 -20.720 1.00 30.91 C ATOM 1576 H LEU A 976 -13.777 -5.811 -20.763 1.00 0.00 H ATOM 1577 N ASP A 977 -14.473 -5.863 -24.218 1.00 25.56 N ATOM 1578 CA ASP A 977 -15.110 -5.821 -25.559 1.00 24.78 C ATOM 1579 C ASP A 977 -15.340 -4.396 -26.035 1.00 30.97 C ATOM 1580 O ASP A 977 -15.934 -4.169 -27.094 1.00 31.74 O ATOM 1581 CB ASP A 977 -16.468 -6.568 -25.522 1.00 26.27 C ATOM 1582 CG ASP A 977 -17.547 -5.947 -24.655 1.00 28.25 C ATOM 1583 OD1 ASP A 977 -17.267 -4.929 -23.982 1.00 30.67 O ATOM 1584 OD2 ASP A 977 -18.665 -6.479 -24.638 1.00 38.43 O ATOM 1585 H ASP A 977 -15.070 -5.678 -23.387 1.00 0.00 H ATOM 1586 N LYS A 978 -14.910 -3.430 -25.221 1.00 27.53 N ATOM 1587 CA LYS A 978 -15.118 -2.022 -25.460 1.00 27.29 C ATOM 1588 C LYS A 978 -13.785 -1.260 -25.360 1.00 33.20 C ATOM 1589 O LYS A 978 -12.924 -1.610 -24.549 1.00 32.90 O ATOM 1590 CB LYS A 978 -16.110 -1.526 -24.404 1.00 29.61 C ATOM 1591 CG LYS A 978 -17.146 -0.526 -24.876 1.00 45.67 C ATOM 1592 CD LYS A 978 -18.112 -0.222 -23.726 1.00 55.96 C ATOM 1593 CE LYS A 978 -19.011 0.966 -23.975 1.00 75.79 C ATOM 1594 NZ LYS A 978 -19.990 0.727 -25.070 1.00 90.40 N ATOM 1595 HZ1 LYS A 978 -19.479 0.524 -25.952 1.00 0.00 H ATOM 1596 HZ2 LYS A 978 -20.593 -0.083 -24.823 1.00 0.00 H ATOM 1597 HZ3 LYS A 978 -20.580 1.574 -25.197 1.00 0.00 H ATOM 1598 H LYS A 978 -14.394 -3.709 -24.362 1.00 0.00 H ATOM 1599 N ASP A 979 -13.589 -0.259 -26.220 1.00 29.36 N ATOM 1600 CA ASP A 979 -12.348 0.509 -26.169 1.00 28.89 C ATOM 1601 C ASP A 979 -12.602 1.988 -25.773 1.00 30.37 C ATOM 1602 O ASP A 979 -11.682 2.790 -25.766 1.00 29.06 O ATOM 1603 CB ASP A 979 -11.555 0.343 -27.480 1.00 31.26 C ATOM 1604 CG ASP A 979 -11.278 -1.118 -27.824 1.00 47.78 C ATOM 1605 OD1 ASP A 979 -10.301 -1.686 -27.275 1.00 46.53 O ATOM 1606 OD2 ASP A 979 -12.049 -1.699 -28.627 1.00 57.05 O ATOM 1607 H ASP A 979 -14.318 -0.026 -26.925 1.00 0.00 H ATOM 1608 N TYR A 980 -13.850 2.321 -25.407 1.00 26.83 N ATOM 1609 CA TYR A 980 -14.285 3.653 -24.997 1.00 27.44 C ATOM 1610 C TYR A 980 -15.382 3.557 -23.946 1.00 33.57 C ATOM 1611 O TYR A 980 -16.091 2.557 -23.912 1.00 33.95 O ATOM 1612 CB TYR A 980 -14.837 4.426 -26.211 1.00 28.59 C ATOM 1613 CG TYR A 980 -16.172 3.905 -26.707 1.00 31.02 C ATOM 1614 CD1 TYR A 980 -16.251 2.740 -27.465 1.00 33.09 C ATOM 1615 CD2 TYR A 980 -17.358 4.564 -26.401 1.00 32.40 C ATOM 1616 CE1 TYR A 980 -17.479 2.252 -27.920 1.00 35.52 C ATOM 1617 CE2 TYR A 980 -18.592 4.079 -26.841 1.00 34.48 C ATOM 1618 CZ TYR A 980 -18.647 2.931 -27.620 1.00 40.41 C ATOM 1619 OH TYR A 980 -19.860 2.446 -28.064 1.00 41.52 O ATOM 1620 HH TYR A 980 -19.710 1.628 -28.601 1.00 0.00 H ATOM 1621 H TYR A 980 -14.567 1.567 -25.416 1.00 0.00 H ATOM 1622 N TYR A 981 -15.582 4.611 -23.151 1.00 32.50 N ATOM 1623 CA TYR A 981 -16.685 4.683 -22.183 1.00 33.71 C ATOM 1624 C TYR A 981 -17.296 6.072 -22.207 1.00 34.92 C ATOM 1625 O TYR A 981 -16.585 7.054 -22.385 1.00 33.41 O ATOM 1626 CB TYR A 981 -16.298 4.230 -20.756 1.00 37.24 C ATOM 1627 CG TYR A 981 -15.355 5.163 -20.037 1.00 41.73 C ATOM 1628 CD1 TYR A 981 -13.988 5.129 -20.285 1.00 44.58 C ATOM 1629 CD2 TYR A 981 -15.826 6.081 -19.103 1.00 43.68 C ATOM 1630 CE1 TYR A 981 -13.108 5.985 -19.624 1.00 47.96 C ATOM 1631 CE2 TYR A 981 -14.957 6.958 -18.448 1.00 45.34 C ATOM 1632 CZ TYR A 981 -13.597 6.908 -18.716 1.00 55.93 C ATOM 1633 OH TYR A 981 -12.711 7.744 -18.076 1.00 61.66 O ATOM 1634 HH TYR A 981 -11.793 7.559 -18.398 1.00 0.00 H ATOM 1635 H TYR A 981 -14.928 5.417 -23.220 1.00 0.00 H ATOM 1636 N VAL A 982 -18.614 6.134 -22.056 1.00 30.53 N ATOM 1637 CA VAL A 982 -19.414 7.344 -22.065 1.00 30.69 C ATOM 1638 C VAL A 982 -19.782 7.657 -20.588 1.00 36.70 C ATOM 1639 O VAL A 982 -20.227 6.754 -19.874 1.00 34.67 O ATOM 1640 CB VAL A 982 -20.685 7.120 -22.949 1.00 34.89 C ATOM 1641 CG1 VAL A 982 -21.232 8.439 -23.486 1.00 34.68 C ATOM 1642 CG2 VAL A 982 -20.412 6.149 -24.105 1.00 34.37 C ATOM 1643 H VAL A 982 -19.118 5.234 -21.919 1.00 0.00 H ATOM 1644 N VAL A 983 -19.535 8.902 -20.121 1.00 36.13 N ATOM 1645 CA VAL A 983 -19.874 9.325 -18.746 1.00 38.00 C ATOM 1646 C VAL A 983 -21.270 9.967 -18.733 1.00 43.75 C ATOM 1647 O VAL A 983 -21.585 10.761 -19.618 1.00 44.29 O ATOM 1648 CB VAL A 983 -18.790 10.217 -18.074 1.00 42.32 C ATOM 1649 CG1 VAL A 983 -19.114 10.477 -16.601 1.00 42.41 C ATOM 1650 CG2 VAL A 983 -17.421 9.574 -18.188 1.00 41.98 C ATOM 1651 H VAL A 983 -19.087 9.592 -20.757 1.00 0.00 H ATOM 1652 N ARG A 984 -22.110 9.595 -17.747 1.00 41.89 N ATOM 1653 CA ARG A 984 -23.480 10.096 -17.604 1.00 42.36 C ATOM 1654 C ARG A 984 -23.527 11.586 -17.232 1.00 45.71 C ATOM 1655 O ARG A 984 -24.200 12.367 -17.908 1.00 44.67 O ATOM 1656 CB ARG A 984 -24.248 9.258 -16.568 1.00 43.41 C ATOM 1657 H ARG A 984 -21.765 8.910 -17.044 1.00 0.00 H ATOM 1658 N GLU A 985 -22.803 11.960 -16.160 1.00 42.04 N ATOM 1659 CA GLU A 985 -22.735 13.313 -15.603 1.00 42.21 C ATOM 1660 C GLU A 985 -21.628 14.146 -16.263 1.00 48.38 C ATOM 1661 O GLU A 985 -20.589 13.579 -16.626 1.00 48.25 O ATOM 1662 CB GLU A 985 -22.527 13.242 -14.088 1.00 43.37 C ATOM 1663 H GLU A 985 -22.243 11.223 -15.686 1.00 0.00 H ATOM 1664 N PRO A 986 -21.823 15.486 -16.422 1.00 46.19 N ATOM 1665 CA PRO A 986 -20.811 16.311 -17.108 1.00 45.95 C ATOM 1666 C PRO A 986 -19.449 16.410 -16.432 1.00 49.07 C ATOM 1667 O PRO A 986 -19.274 15.986 -15.284 1.00 49.33 O ATOM 1668 CB PRO A 986 -21.484 17.692 -17.208 1.00 47.65 C ATOM 1669 CG PRO A 986 -22.924 17.435 -17.054 1.00 52.07 C ATOM 1670 CD PRO A 986 -23.009 16.299 -16.080 1.00 47.88 C ATOM 1671 N GLY A 987 -18.498 16.968 -17.178 1.00 44.32 N ATOM 1672 CA GLY A 987 -17.131 17.192 -16.730 1.00 43.27 C ATOM 1673 C GLY A 987 -17.019 18.288 -15.686 1.00 44.94 C ATOM 1674 O GLY A 987 -17.750 19.281 -15.745 1.00 44.65 O ATOM 1675 H GLY A 987 -18.748 17.263 -18.143 1.00 0.00 H ATOM 1676 N GLN A 988 -16.108 18.108 -14.705 1.00 38.48 N ATOM 1677 CA GLN A 988 -15.905 19.100 -13.653 1.00 36.27 C ATOM 1678 C GLN A 988 -14.490 19.659 -13.612 1.00 36.96 C ATOM 1679 O GLN A 988 -14.241 20.656 -12.929 1.00 37.00 O ATOM 1680 CB GLN A 988 -16.347 18.574 -12.282 1.00 37.50 C ATOM 1681 CG GLN A 988 -17.818 18.865 -11.987 1.00 37.00 C ATOM 1682 CD GLN A 988 -18.179 20.325 -12.170 1.00 61.53 C ATOM 1683 OE1 GLN A 988 -17.692 21.215 -11.462 1.00 57.03 O ATOM 1684 NE2 GLN A 988 -19.011 20.604 -13.161 1.00 60.19 N ATOM 1685 HE22 GLN A 988 -19.406 19.836 -13.740 1.00 0.00 H ATOM 1686 HE21 GLN A 988 -19.270 21.591 -13.360 1.00 0.00 H ATOM 1687 H GLN A 988 -15.536 17.240 -14.699 1.00 0.00 H ATOM 1688 N SER A 989 -13.580 19.059 -14.399 1.00 31.46 N ATOM 1689 CA SER A 989 -12.191 19.491 -14.538 1.00 29.00 C ATOM 1690 C SER A 989 -12.164 20.659 -15.550 1.00 27.17 C ATOM 1691 O SER A 989 -13.190 20.877 -16.205 1.00 24.94 O ATOM 1692 CB SER A 989 -11.347 18.320 -15.037 1.00 33.06 C ATOM 1693 OG SER A 989 -11.437 17.207 -14.160 1.00 35.15 O ATOM 1694 HG SER A 989 -10.881 16.467 -14.510 1.00 0.00 H ATOM 1695 H SER A 989 -13.886 18.230 -14.947 1.00 0.00 H ATOM 1696 N PRO A 990 -11.058 21.451 -15.678 1.00 21.15 N ATOM 1697 CA PRO A 990 -11.038 22.532 -16.675 1.00 20.88 C ATOM 1698 C PRO A 990 -11.360 21.971 -18.069 1.00 25.07 C ATOM 1699 O PRO A 990 -10.895 20.882 -18.405 1.00 25.19 O ATOM 1700 CB PRO A 990 -9.611 23.077 -16.557 1.00 23.25 C ATOM 1701 CG PRO A 990 -9.190 22.753 -15.166 1.00 28.12 C ATOM 1702 CD PRO A 990 -9.757 21.369 -14.979 1.00 24.17 C ATOM 1703 N ILE A 991 -12.248 22.648 -18.829 1.00 21.68 N ATOM 1704 CA ILE A 991 -12.774 22.123 -20.092 1.00 21.13 C ATOM 1705 C ILE A 991 -11.715 21.963 -21.175 1.00 25.01 C ATOM 1706 O ILE A 991 -11.864 21.073 -22.000 1.00 23.98 O ATOM 1707 CB ILE A 991 -14.032 22.888 -20.640 1.00 24.23 C ATOM 1708 CG1 ILE A 991 -13.709 24.360 -21.009 1.00 25.41 C ATOM 1709 CG2 ILE A 991 -15.247 22.779 -19.664 1.00 25.57 C ATOM 1710 CD1 ILE A 991 -14.873 25.177 -21.637 1.00 33.52 C ATOM 1711 H ILE A 991 -12.572 23.581 -18.504 1.00 0.00 H ATOM 1712 N PHE A 992 -10.628 22.754 -21.105 1.00 21.20 N ATOM 1713 CA PHE A 992 -9.568 22.908 -22.116 1.00 19.99 C ATOM 1714 C PHE A 992 -8.663 21.711 -22.334 1.00 23.84 C ATOM 1715 O PHE A 992 -7.938 21.688 -23.340 1.00 23.92 O ATOM 1716 CB PHE A 992 -8.732 24.143 -21.814 1.00 21.08 C ATOM 1717 CG PHE A 992 -9.595 25.340 -21.486 1.00 23.32 C ATOM 1718 CD1 PHE A 992 -10.095 26.148 -22.488 1.00 27.10 C ATOM 1719 CD2 PHE A 992 -9.927 25.638 -20.172 1.00 25.27 C ATOM 1720 CE1 PHE A 992 -10.871 27.269 -22.175 1.00 28.03 C ATOM 1721 CE2 PHE A 992 -10.731 26.733 -19.868 1.00 28.09 C ATOM 1722 CZ PHE A 992 -11.177 27.557 -20.867 1.00 26.78 C ATOM 1723 H PHE A 992 -10.525 23.321 -20.239 1.00 0.00 H ATOM 1724 N TRP A 993 -8.686 20.733 -21.429 1.00 19.65 N ATOM 1725 CA TRP A 993 -7.894 19.520 -21.543 1.00 19.23 C ATOM 1726 C TRP A 993 -8.715 18.395 -22.241 1.00 23.72 C ATOM 1727 O TRP A 993 -8.116 17.437 -22.711 1.00 24.45 O ATOM 1728 CB TRP A 993 -7.413 19.083 -20.156 1.00 19.42 C ATOM 1729 CG TRP A 993 -6.169 19.783 -19.703 1.00 21.45 C ATOM 1730 CD1 TRP A 993 -4.895 19.292 -19.743 1.00 24.25 C ATOM 1731 CD2 TRP A 993 -6.066 21.127 -19.223 1.00 21.89 C ATOM 1732 NE1 TRP A 993 -4.011 20.234 -19.272 1.00 23.79 N ATOM 1733 CE2 TRP A 993 -4.706 21.358 -18.913 1.00 26.18 C ATOM 1734 CE3 TRP A 993 -7.002 22.137 -18.947 1.00 23.57 C ATOM 1735 CZ2 TRP A 993 -4.246 22.589 -18.410 1.00 25.43 C ATOM 1736 CZ3 TRP A 993 -6.553 23.327 -18.388 1.00 25.46 C ATOM 1737 CH2 TRP A 993 -5.188 23.552 -18.149 1.00 26.02 C ATOM 1738 HE1 TRP A 993 -2.981 20.112 -19.200 1.00 0.00 H ATOM 1739 H TRP A 993 -9.302 20.844 -20.599 1.00 0.00 H ATOM 1740 N TYR A 994 -10.059 18.539 -22.379 1.00 20.60 N ATOM 1741 CA TYR A 994 -10.924 17.526 -23.032 1.00 21.59 C ATOM 1742 C TYR A 994 -10.877 17.541 -24.550 1.00 26.10 C ATOM 1743 O TYR A 994 -10.795 18.597 -25.167 1.00 26.72 O ATOM 1744 CB TYR A 994 -12.414 17.721 -22.681 1.00 24.06 C ATOM 1745 CG TYR A 994 -12.809 17.548 -21.239 1.00 25.72 C ATOM 1746 CD1 TYR A 994 -12.736 16.305 -20.622 1.00 28.24 C ATOM 1747 CD2 TYR A 994 -13.410 18.586 -20.534 1.00 25.76 C ATOM 1748 CE1 TYR A 994 -13.139 16.129 -19.299 1.00 30.00 C ATOM 1749 CE2 TYR A 994 -13.833 18.419 -19.218 1.00 26.51 C ATOM 1750 CZ TYR A 994 -13.678 17.191 -18.595 1.00 32.85 C ATOM 1751 OH TYR A 994 -14.075 16.999 -17.289 1.00 30.84 O ATOM 1752 HH TYR A 994 -13.885 16.065 -17.022 1.00 0.00 H ATOM 1753 H TYR A 994 -10.504 19.403 -22.008 1.00 0.00 H ATOM 1754 N ALA A 995 -11.085 16.372 -25.137 1.00 22.99 N ATOM 1755 CA ALA A 995 -11.165 16.109 -26.575 1.00 23.47 C ATOM 1756 C ALA A 995 -12.574 16.514 -27.125 1.00 25.70 C ATOM 1757 O ALA A 995 -13.471 16.674 -26.303 1.00 24.03 O ATOM 1758 CB ALA A 995 -10.883 14.634 -26.807 1.00 24.16 C ATOM 1759 H ALA A 995 -11.204 15.552 -24.508 1.00 0.00 H ATOM 1760 N PRO A 996 -12.803 16.798 -28.452 1.00 22.59 N ATOM 1761 CA PRO A 996 -14.144 17.227 -28.889 1.00 21.07 C ATOM 1762 C PRO A 996 -15.256 16.204 -28.621 1.00 22.35 C ATOM 1763 O PRO A 996 -16.384 16.632 -28.416 1.00 20.86 O ATOM 1764 CB PRO A 996 -13.974 17.511 -30.395 1.00 23.26 C ATOM 1765 CG PRO A 996 -12.538 17.611 -30.610 1.00 28.24 C ATOM 1766 CD PRO A 996 -11.886 16.719 -29.604 1.00 24.37 C ATOM 1767 N GLU A 997 -14.931 14.880 -28.560 1.00 18.93 N ATOM 1768 CA GLU A 997 -15.863 13.773 -28.246 1.00 18.02 C ATOM 1769 C GLU A 997 -16.233 13.707 -26.768 1.00 20.98 C ATOM 1770 O GLU A 997 -17.325 13.236 -26.401 1.00 19.21 O ATOM 1771 CB GLU A 997 -15.322 12.418 -28.747 1.00 19.42 C ATOM 1772 CG GLU A 997 -14.085 11.868 -28.029 1.00 18.70 C ATOM 1773 CD GLU A 997 -12.741 12.077 -28.709 1.00 18.04 C ATOM 1774 OE1 GLU A 997 -11.721 11.601 -28.163 1.00 31.41 O ATOM 1775 OE2 GLU A 997 -12.701 12.697 -29.792 1.00 34.02 O ATOM 1776 H GLU A 997 -13.941 14.626 -28.751 1.00 0.00 H ATOM 1777 N SER A 998 -15.308 14.161 -25.910 1.00 18.31 N ATOM 1778 CA SER A 998 -15.529 14.244 -24.476 1.00 20.49 C ATOM 1779 C SER A 998 -16.474 15.437 -24.212 1.00 27.51 C ATOM 1780 O SER A 998 -17.428 15.317 -23.437 1.00 27.04 O ATOM 1781 CB SER A 998 -14.194 14.444 -23.763 1.00 26.10 C ATOM 1782 OG SER A 998 -13.299 13.379 -24.047 1.00 36.58 O ATOM 1783 HG SER A 998 -12.443 13.533 -23.573 1.00 0.00 H ATOM 1784 H SER A 998 -14.389 14.468 -26.288 1.00 0.00 H ATOM 1785 N LEU A 999 -16.224 16.576 -24.890 1.00 25.54 N ATOM 1786 CA LEU A 999 -17.006 17.804 -24.732 1.00 25.69 C ATOM 1787 C LEU A 999 -18.461 17.611 -25.207 1.00 31.72 C ATOM 1788 O LEU A 999 -19.388 17.729 -24.398 1.00 32.40 O ATOM 1789 CB LEU A 999 -16.344 19.007 -25.441 1.00 25.41 C ATOM 1790 CG LEU A 999 -14.976 19.551 -24.943 1.00 30.37 C ATOM 1791 CD1 LEU A 999 -14.401 20.597 -25.937 1.00 29.82 C ATOM 1792 CD2 LEU A 999 -15.088 20.226 -23.564 1.00 31.58 C ATOM 1793 H LEU A 999 -15.431 16.582 -25.563 1.00 0.00 H ATOM 1794 N SER A1000 -18.640 17.241 -26.491 1.00 29.43 N ATOM 1795 CA SER A1000 -19.933 17.069 -27.168 1.00 28.15 C ATOM 1796 C SER A1000 -20.691 15.795 -26.825 1.00 31.47 C ATOM 1797 O SER A1000 -21.910 15.776 -26.973 1.00 29.87 O ATOM 1798 CB SER A1000 -19.764 17.173 -28.683 1.00 30.56 C ATOM 1799 OG SER A1000 -18.934 16.151 -29.213 1.00 38.80 O ATOM 1800 HG SER A1000 -18.035 16.211 -28.802 1.00 0.00 H ATOM 1801 H SER A1000 -17.784 17.061 -27.054 1.00 0.00 H ATOM 1802 N ASP A1001 -20.000 14.727 -26.400 1.00 28.87 N ATOM 1803 CA ASP A1001 -20.709 13.473 -26.122 1.00 29.07 C ATOM 1804 C ASP A1001 -20.304 12.751 -24.829 1.00 31.72 C ATOM 1805 O ASP A1001 -20.850 11.683 -24.547 1.00 31.04 O ATOM 1806 CB ASP A1001 -20.558 12.527 -27.336 1.00 29.96 C ATOM 1807 CG ASP A1001 -21.529 12.795 -28.462 1.00 35.55 C ATOM 1808 OD1 ASP A1001 -22.733 12.490 -28.290 1.00 38.47 O ATOM 1809 OD2 ASP A1001 -21.080 13.280 -29.537 1.00 30.03 O ATOM 1810 H ASP A1001 -18.970 14.787 -26.269 1.00 0.00 H ATOM 1811 N ASN A1002 -19.363 13.329 -24.037 1.00 29.63 N ATOM 1812 CA ASN A1002 -18.811 12.723 -22.808 1.00 28.40 C ATOM 1813 C ASN A1002 -18.212 11.338 -23.066 1.00 27.99 C ATOM 1814 O ASN A1002 -18.285 10.466 -22.213 1.00 27.45 O ATOM 1815 CB ASN A1002 -19.820 12.710 -21.638 1.00 33.99 C ATOM 1816 CG ASN A1002 -19.436 13.570 -20.445 1.00 49.00 C ATOM 1817 OD1 ASN A1002 -18.297 14.066 -20.291 1.00 49.79 O ATOM 1818 ND2 ASN A1002 -20.387 13.738 -19.548 1.00 19.86 N ATOM 1819 HD22 ASN A1002 -21.325 13.316 -19.699 1.00 0.00 H ATOM 1820 HD21 ASN A1002 -20.199 14.293 -18.689 1.00 0.00 H ATOM 1821 H ASN A1002 -19.006 14.265 -24.316 1.00 0.00 H ATOM 1822 N ILE A1003 -17.616 11.154 -24.253 1.00 23.17 N ATOM 1823 CA ILE A1003 -16.938 9.925 -24.655 1.00 20.45 C ATOM 1824 C ILE A1003 -15.466 10.000 -24.229 1.00 23.33 C ATOM 1825 O ILE A1003 -14.751 10.948 -24.578 1.00 24.66 O ATOM 1826 CB ILE A1003 -17.127 9.640 -26.181 1.00 22.03 C ATOM 1827 CG1 ILE A1003 -18.532 9.033 -26.463 1.00 20.39 C ATOM 1828 CG2 ILE A1003 -15.999 8.713 -26.730 1.00 23.10 C ATOM 1829 CD1 ILE A1003 -19.116 9.364 -27.754 1.00 26.10 C ATOM 1830 H ILE A1003 -17.638 11.940 -24.934 1.00 0.00 H ATOM 1831 N PHE A1004 -15.012 8.984 -23.507 1.00 21.16 N ATOM 1832 CA PHE A1004 -13.621 8.865 -23.055 1.00 21.80 C ATOM 1833 C PHE A1004 -12.964 7.558 -23.492 1.00 25.40 C ATOM 1834 O PHE A1004 -13.614 6.515 -23.527 1.00 24.28 O ATOM 1835 CB PHE A1004 -13.515 9.081 -21.540 1.00 23.80 C ATOM 1836 CG PHE A1004 -13.929 10.464 -21.083 1.00 25.86 C ATOM 1837 CD1 PHE A1004 -13.005 11.499 -21.027 1.00 29.78 C ATOM 1838 CD2 PHE A1004 -15.242 10.728 -20.715 1.00 27.71 C ATOM 1839 CE1 PHE A1004 -13.387 12.777 -20.599 1.00 31.90 C ATOM 1840 CE2 PHE A1004 -15.622 11.994 -20.270 1.00 31.66 C ATOM 1841 CZ PHE A1004 -14.699 13.021 -20.242 1.00 30.86 C ATOM 1842 H PHE A1004 -15.679 8.230 -23.247 1.00 0.00 H ATOM 1843 N SER A1005 -11.676 7.629 -23.843 1.00 20.54 N ATOM 1844 CA SER A1005 -10.872 6.500 -24.309 1.00 20.61 C ATOM 1845 C SER A1005 -9.371 6.850 -24.166 1.00 22.85 C ATOM 1846 O SER A1005 -9.051 7.945 -23.710 1.00 21.48 O ATOM 1847 CB SER A1005 -11.207 6.208 -25.769 1.00 24.66 C ATOM 1848 OG SER A1005 -10.709 7.219 -26.634 1.00 34.37 O ATOM 1849 HG SER A1005 -10.944 6.997 -27.570 1.00 0.00 H ATOM 1850 H SER A1005 -11.211 8.557 -23.780 1.00 0.00 H ATOM 1851 N ARG A1006 -8.456 5.940 -24.604 1.00 18.36 N ATOM 1852 CA ARG A1006 -6.999 6.153 -24.561 1.00 18.33 C ATOM 1853 C ARG A1006 -6.646 7.201 -25.607 1.00 22.17 C ATOM 1854 O ARG A1006 -5.585 7.793 -25.540 1.00 21.58 O ATOM 1855 CB ARG A1006 -6.226 4.857 -24.850 1.00 16.76 C ATOM 1856 CG ARG A1006 -6.218 3.877 -23.667 1.00 27.62 C ATOM 1857 CD ARG A1006 -5.922 2.449 -24.077 1.00 32.38 C ATOM 1858 NE ARG A1006 -7.001 1.873 -24.873 1.00 36.37 N ATOM 1859 CZ ARG A1006 -7.204 0.574 -25.054 1.00 38.52 C ATOM 1860 NH1 ARG A1006 -6.419 -0.317 -24.462 1.00 39.48 N ATOM 1861 NH2 ARG A1006 -8.204 0.156 -25.807 1.00 22.81 N ATOM 1862 HE ARG A1006 -7.662 2.531 -25.334 1.00 0.00 H ATOM 1863 HH12 ARG A1006 -6.584 -1.333 -24.608 1.00 0.00 H ATOM 1864 HH11 ARG A1006 -5.639 0.001 -23.852 1.00 0.00 H ATOM 1865 HH22 ARG A1006 -8.360 -0.863 -25.946 1.00 0.00 H ATOM 1866 HH21 ARG A1006 -8.836 0.845 -26.261 1.00 0.00 H ATOM 1867 H ARG A1006 -8.807 5.041 -24.992 1.00 0.00 H ATOM 1868 N GLN A1007 -7.590 7.469 -26.520 1.00 19.64 N ATOM 1869 CA GLN A1007 -7.483 8.448 -27.595 1.00 19.84 C ATOM 1870 C GLN A1007 -7.831 9.846 -27.081 1.00 21.99 C ATOM 1871 O GLN A1007 -7.305 10.814 -27.624 1.00 18.68 O ATOM 1872 CB GLN A1007 -8.378 8.037 -28.773 1.00 21.15 C ATOM 1873 CG GLN A1007 -7.768 6.864 -29.539 1.00 32.73 C ATOM 1874 CD GLN A1007 -8.282 5.506 -29.147 1.00 52.43 C ATOM 1875 OE1 GLN A1007 -9.205 5.358 -28.346 1.00 46.58 O ATOM 1876 NE2 GLN A1007 -7.705 4.473 -29.740 1.00 48.50 N ATOM 1877 HE22 GLN A1007 -6.927 4.627 -30.413 1.00 0.00 H ATOM 1878 HE21 GLN A1007 -8.030 3.507 -29.533 1.00 0.00 H ATOM 1879 H GLN A1007 -8.478 6.931 -26.456 1.00 0.00 H ATOM 1880 N SER A1008 -8.730 9.939 -26.057 1.00 17.42 N ATOM 1881 CA SER A1008 -9.082 11.189 -25.385 1.00 18.78 C ATOM 1882 C SER A1008 -8.008 11.508 -24.309 1.00 20.67 C ATOM 1883 O SER A1008 -7.900 12.652 -23.857 1.00 20.96 O ATOM 1884 CB SER A1008 -10.513 11.173 -24.824 1.00 23.53 C ATOM 1885 OG SER A1008 -10.743 10.342 -23.694 1.00 18.41 O ATOM 1886 HG SER A1008 -10.163 10.634 -22.947 1.00 0.00 H ATOM 1887 H SER A1008 -9.193 9.065 -25.735 1.00 0.00 H ATOM 1888 N ASP A1009 -7.222 10.498 -23.903 1.00 15.73 N ATOM 1889 CA ASP A1009 -6.115 10.717 -22.982 1.00 15.26 C ATOM 1890 C ASP A1009 -4.942 11.289 -23.824 1.00 17.51 C ATOM 1891 O ASP A1009 -4.157 12.086 -23.322 1.00 19.35 O ATOM 1892 CB ASP A1009 -5.707 9.399 -22.305 1.00 17.08 C ATOM 1893 CG ASP A1009 -6.449 9.105 -21.027 1.00 20.03 C ATOM 1894 OD1 ASP A1009 -7.265 9.954 -20.606 1.00 17.53 O ATOM 1895 OD2 ASP A1009 -6.193 8.041 -20.430 1.00 21.83 O ATOM 1896 H ASP A1009 -7.408 9.537 -24.254 1.00 0.00 H ATOM 1897 N VAL A1010 -4.804 10.822 -25.085 1.00 12.90 N ATOM 1898 CA VAL A1010 -3.810 11.309 -26.073 1.00 13.39 C ATOM 1899 C VAL A1010 -4.019 12.806 -26.393 1.00 19.25 C ATOM 1900 O VAL A1010 -3.042 13.562 -26.432 1.00 17.28 O ATOM 1901 CB VAL A1010 -3.779 10.406 -27.340 1.00 15.50 C ATOM 1902 CG1 VAL A1010 -3.157 11.123 -28.546 1.00 17.57 C ATOM 1903 CG2 VAL A1010 -3.049 9.094 -27.073 1.00 15.47 C ATOM 1904 H VAL A1010 -5.445 10.061 -25.387 1.00 0.00 H ATOM 1905 N TRP A1011 -5.283 13.249 -26.563 1.00 17.21 N ATOM 1906 CA TRP A1011 -5.588 14.680 -26.810 1.00 19.00 C ATOM 1907 C TRP A1011 -5.044 15.536 -25.670 1.00 21.88 C ATOM 1908 O TRP A1011 -4.373 16.555 -25.902 1.00 21.44 O ATOM 1909 CB TRP A1011 -7.112 14.878 -26.913 1.00 19.22 C ATOM 1910 CG TRP A1011 -7.580 16.302 -27.125 1.00 20.71 C ATOM 1911 CD1 TRP A1011 -7.801 17.250 -26.162 1.00 23.85 C ATOM 1912 CD2 TRP A1011 -8.056 16.864 -28.358 1.00 20.64 C ATOM 1913 NE1 TRP A1011 -8.290 18.405 -26.741 1.00 23.25 N ATOM 1914 CE2 TRP A1011 -8.493 18.181 -28.081 1.00 23.86 C ATOM 1915 CE3 TRP A1011 -8.084 16.408 -29.693 1.00 22.34 C ATOM 1916 CZ2 TRP A1011 -8.936 19.046 -29.084 1.00 22.79 C ATOM 1917 CZ3 TRP A1011 -8.557 17.260 -30.685 1.00 23.55 C ATOM 1918 CH2 TRP A1011 -8.941 18.572 -30.382 1.00 23.80 C ATOM 1919 HE1 TRP A1011 -8.475 19.299 -26.243 1.00 0.00 H ATOM 1920 H TRP A1011 -6.067 12.567 -26.520 1.00 0.00 H ATOM 1921 N SER A1012 -5.306 15.066 -24.428 1.00 18.08 N ATOM 1922 CA SER A1012 -4.963 15.648 -23.141 1.00 16.10 C ATOM 1923 C SER A1012 -3.497 15.759 -22.976 1.00 20.15 C ATOM 1924 O SER A1012 -3.049 16.774 -22.445 1.00 18.92 O ATOM 1925 CB SER A1012 -5.606 14.870 -21.994 1.00 19.40 C ATOM 1926 OG SER A1012 -6.991 15.169 -21.918 1.00 12.10 O ATOM 1927 HG SER A1012 -7.110 16.139 -21.760 1.00 0.00 H ATOM 1928 H SER A1012 -5.824 14.165 -24.389 1.00 0.00 H ATOM 1929 N PHE A1013 -2.739 14.741 -23.459 1.00 16.54 N ATOM 1930 CA PHE A1013 -1.271 14.692 -23.482 1.00 16.24 C ATOM 1931 C PHE A1013 -0.673 15.837 -24.294 1.00 20.62 C ATOM 1932 O PHE A1013 0.259 16.471 -23.817 1.00 20.09 O ATOM 1933 CB PHE A1013 -0.767 13.321 -24.001 1.00 18.10 C ATOM 1934 CG PHE A1013 0.742 13.151 -24.016 1.00 19.82 C ATOM 1935 CD1 PHE A1013 1.468 13.085 -22.825 1.00 21.75 C ATOM 1936 CD2 PHE A1013 1.434 13.056 -25.220 1.00 21.90 C ATOM 1937 CE1 PHE A1013 2.865 12.935 -22.847 1.00 24.99 C ATOM 1938 CE2 PHE A1013 2.823 12.904 -25.241 1.00 26.14 C ATOM 1939 CZ PHE A1013 3.532 12.847 -24.053 1.00 24.18 C ATOM 1940 H PHE A1013 -3.245 13.920 -23.849 1.00 0.00 H ATOM 1941 N GLY A1014 -1.235 16.116 -25.482 1.00 16.26 N ATOM 1942 CA GLY A1014 -0.788 17.200 -26.355 1.00 15.29 C ATOM 1943 C GLY A1014 -1.002 18.532 -25.671 1.00 19.84 C ATOM 1944 O GLY A1014 -0.267 19.497 -25.900 1.00 17.82 O ATOM 1945 H GLY A1014 -2.032 15.528 -25.798 1.00 0.00 H ATOM 1946 N VAL A1015 -1.996 18.567 -24.775 1.00 17.88 N ATOM 1947 CA VAL A1015 -2.222 19.744 -23.954 1.00 18.99 C ATOM 1948 C VAL A1015 -1.109 19.743 -22.877 1.00 18.65 C ATOM 1949 O VAL A1015 -0.627 20.795 -22.546 1.00 14.83 O ATOM 1950 CB VAL A1015 -3.647 19.828 -23.351 1.00 23.13 C ATOM 1951 CG1 VAL A1015 -3.908 21.207 -22.718 1.00 23.21 C ATOM 1952 CG2 VAL A1015 -4.701 19.547 -24.411 1.00 22.63 C ATOM 1953 H VAL A1015 -2.616 17.739 -24.665 1.00 0.00 H ATOM 1954 N VAL A1016 -0.707 18.580 -22.355 1.00 18.25 N ATOM 1955 CA VAL A1016 0.362 18.510 -21.328 1.00 19.35 C ATOM 1956 C VAL A1016 1.680 18.938 -21.960 1.00 21.44 C ATOM 1957 O VAL A1016 2.533 19.506 -21.294 1.00 22.07 O ATOM 1958 CB VAL A1016 0.412 17.100 -20.691 1.00 23.18 C ATOM 1959 CG1 VAL A1016 1.660 16.879 -19.833 1.00 23.62 C ATOM 1960 CG2 VAL A1016 -0.853 16.835 -19.894 1.00 23.13 C ATOM 1961 H VAL A1016 -1.156 17.699 -22.678 1.00 0.00 H ATOM 1962 N LEU A1017 1.849 18.603 -23.239 1.00 20.81 N ATOM 1963 CA LEU A1017 2.973 18.915 -24.103 1.00 20.24 C ATOM 1964 C LEU A1017 3.039 20.427 -24.277 1.00 22.98 C ATOM 1965 O LEU A1017 4.136 20.985 -24.202 1.00 23.42 O ATOM 1966 CB LEU A1017 2.772 18.255 -25.473 1.00 20.83 C ATOM 1967 CG LEU A1017 3.434 16.890 -25.692 1.00 25.48 C ATOM 1968 CD1 LEU A1017 3.061 16.323 -27.029 1.00 25.44 C ATOM 1969 CD2 LEU A1017 4.933 16.997 -25.625 1.00 27.88 C ATOM 1970 H LEU A1017 1.081 18.050 -23.671 1.00 0.00 H ATOM 1971 N TYR A1018 1.863 21.082 -24.515 1.00 18.00 N ATOM 1972 CA TYR A1018 1.713 22.542 -24.616 1.00 18.18 C ATOM 1973 C TYR A1018 2.129 23.187 -23.281 1.00 23.47 C ATOM 1974 O TYR A1018 2.811 24.211 -23.277 1.00 22.89 O ATOM 1975 CB TYR A1018 0.245 22.930 -24.876 1.00 17.16 C ATOM 1976 CG TYR A1018 -0.004 24.426 -24.945 1.00 15.61 C ATOM 1977 CD1 TYR A1018 0.133 25.121 -26.146 1.00 16.30 C ATOM 1978 CD2 TYR A1018 -0.353 25.150 -23.805 1.00 15.68 C ATOM 1979 CE1 TYR A1018 -0.116 26.491 -26.218 1.00 13.02 C ATOM 1980 CE2 TYR A1018 -0.573 26.525 -23.861 1.00 17.57 C ATOM 1981 CZ TYR A1018 -0.412 27.197 -25.066 1.00 19.89 C ATOM 1982 OH TYR A1018 -0.657 28.546 -25.140 1.00 27.91 O ATOM 1983 HH TYR A1018 -0.054 29.024 -24.517 1.00 0.00 H ATOM 1984 H TYR A1018 1.007 20.503 -24.634 1.00 0.00 H ATOM 1985 N GLU A1019 1.658 22.600 -22.162 1.00 20.65 N ATOM 1986 CA GLU A1019 1.914 23.065 -20.809 1.00 21.52 C ATOM 1987 C GLU A1019 3.402 23.065 -20.517 1.00 25.68 C ATOM 1988 O GLU A1019 3.906 24.079 -20.038 1.00 23.48 O ATOM 1989 CB GLU A1019 1.165 22.199 -19.780 1.00 23.24 C ATOM 1990 CG GLU A1019 -0.332 22.434 -19.706 1.00 30.07 C ATOM 1991 CD GLU A1019 -0.934 21.724 -18.514 1.00 35.92 C ATOM 1992 OE1 GLU A1019 -0.972 22.332 -17.423 1.00 18.40 O ATOM 1993 OE2 GLU A1019 -1.273 20.527 -18.645 1.00 20.37 O ATOM 1994 H GLU A1019 1.068 21.751 -22.276 1.00 0.00 H ATOM 1995 N LEU A1020 4.117 21.958 -20.849 1.00 23.84 N ATOM 1996 CA LEU A1020 5.567 21.856 -20.622 1.00 24.90 C ATOM 1997 C LEU A1020 6.336 22.928 -21.389 1.00 28.80 C ATOM 1998 O LEU A1020 7.217 23.580 -20.818 1.00 31.31 O ATOM 1999 CB LEU A1020 6.107 20.460 -20.999 1.00 25.90 C ATOM 2000 CG LEU A1020 6.019 19.342 -19.934 1.00 32.32 C ATOM 2001 CD1 LEU A1020 6.248 17.966 -20.562 1.00 32.47 C ATOM 2002 CD2 LEU A1020 7.053 19.528 -18.838 1.00 34.34 C ATOM 2003 H LEU A1020 3.620 21.152 -21.280 1.00 0.00 H ATOM 2004 N PHE A1021 5.948 23.167 -22.646 1.00 22.26 N ATOM 2005 CA PHE A1021 6.627 24.107 -23.524 1.00 23.57 C ATOM 2006 C PHE A1021 6.156 25.558 -23.299 1.00 32.59 C ATOM 2007 O PHE A1021 6.506 26.440 -24.084 1.00 36.54 O ATOM 2008 CB PHE A1021 6.558 23.634 -25.006 1.00 24.45 C ATOM 2009 CG PHE A1021 7.559 22.526 -25.263 1.00 25.23 C ATOM 2010 CD1 PHE A1021 7.294 21.218 -24.865 1.00 27.07 C ATOM 2011 CD2 PHE A1021 8.812 22.808 -25.796 1.00 26.93 C ATOM 2012 CE1 PHE A1021 8.260 20.219 -25.000 1.00 26.45 C ATOM 2013 CE2 PHE A1021 9.774 21.803 -25.942 1.00 28.42 C ATOM 2014 CZ PHE A1021 9.487 20.513 -25.558 1.00 25.30 C ATOM 2015 H PHE A1021 5.120 22.656 -23.014 1.00 0.00 H ATOM 2016 N THR A1022 5.487 25.823 -22.158 1.00 27.36 N ATOM 2017 CA THR A1022 5.117 27.169 -21.709 1.00 27.27 C ATOM 2018 C THR A1022 5.628 27.382 -20.289 1.00 31.19 C ATOM 2019 O THR A1022 5.669 28.517 -19.794 1.00 29.57 O ATOM 2020 CB THR A1022 3.628 27.418 -21.786 1.00 28.07 C ATOM 2021 OG1 THR A1022 2.913 26.408 -21.072 1.00 20.40 O ATOM 2022 CG2 THR A1022 3.129 27.579 -23.215 1.00 25.98 C ATOM 2023 HG1 THR A1022 3.112 25.522 -21.467 1.00 0.00 H ATOM 2024 H THR A1022 5.216 25.019 -21.557 1.00 0.00 H ATOM 2025 N TYR A1023 6.013 26.254 -19.638 1.00 28.52 N ATOM 2026 CA TYR A1023 6.483 26.124 -18.261 1.00 26.73 C ATOM 2027 C TYR A1023 5.284 26.473 -17.356 1.00 27.77 C ATOM 2028 O TYR A1023 5.442 27.015 -16.283 1.00 26.86 O ATOM 2029 CB TYR A1023 7.706 27.032 -18.018 1.00 28.22 C ATOM 2030 CG TYR A1023 8.925 26.654 -18.836 1.00 30.53 C ATOM 2031 CD1 TYR A1023 9.830 25.704 -18.374 1.00 31.82 C ATOM 2032 CD2 TYR A1023 9.161 27.231 -20.082 1.00 31.80 C ATOM 2033 CE1 TYR A1023 10.955 25.355 -19.116 1.00 30.30 C ATOM 2034 CE2 TYR A1023 10.290 26.900 -20.827 1.00 32.39 C ATOM 2035 CZ TYR A1023 11.190 25.969 -20.332 1.00 31.74 C ATOM 2036 OH TYR A1023 12.281 25.613 -21.066 1.00 28.34 O ATOM 2037 HH TYR A1023 12.811 24.943 -20.565 1.00 0.00 H ATOM 2038 H TYR A1023 5.968 25.373 -20.188 1.00 0.00 H ATOM 2039 N CYS A1024 4.068 26.139 -17.843 1.00 22.94 N ATOM 2040 CA CYS A1024 2.745 26.410 -17.264 1.00 21.61 C ATOM 2041 C CYS A1024 2.530 27.898 -16.892 1.00 25.94 C ATOM 2042 O CYS A1024 1.888 28.228 -15.886 1.00 23.77 O ATOM 2043 CB CYS A1024 2.444 25.462 -16.109 1.00 19.37 C ATOM 2044 SG CYS A1024 2.357 23.742 -16.630 1.00 21.52 S ATOM 2045 H CYS A1024 4.069 25.623 -18.746 1.00 0.00 H ATOM 2046 N ASP A1025 3.059 28.795 -17.754 1.00 23.16 N ATOM 2047 CA ASP A1025 2.862 30.232 -17.611 1.00 23.39 C ATOM 2048 C ASP A1025 1.334 30.529 -17.736 1.00 24.99 C ATOM 2049 O ASP A1025 0.711 30.142 -18.746 1.00 21.86 O ATOM 2050 CB ASP A1025 3.685 30.968 -18.690 1.00 25.05 C ATOM 2051 CG ASP A1025 3.477 32.464 -18.743 1.00 32.28 C ATOM 2052 OD1 ASP A1025 3.262 33.067 -17.681 1.00 27.41 O ATOM 2053 OD2 ASP A1025 3.614 33.045 -19.849 1.00 44.31 O ATOM 2054 H ASP A1025 3.629 28.446 -18.551 1.00 0.00 H ATOM 2055 N LYS A1026 0.728 31.122 -16.657 1.00 21.53 N ATOM 2056 CA LYS A1026 -0.703 31.492 -16.568 1.00 20.85 C ATOM 2057 C LYS A1026 -1.152 32.433 -17.693 1.00 19.81 C ATOM 2058 O LYS A1026 -2.308 32.381 -18.091 1.00 19.74 O ATOM 2059 CB LYS A1026 -1.010 32.207 -15.237 1.00 23.30 C ATOM 2060 CG LYS A1026 -1.868 31.406 -14.264 1.00 33.07 C ATOM 2061 CD LYS A1026 -2.298 32.304 -13.099 1.00 42.09 C ATOM 2062 CE LYS A1026 -2.264 31.638 -11.739 1.00 60.84 C ATOM 2063 NZ LYS A1026 -3.465 30.794 -11.485 1.00 73.56 N ATOM 2064 HZ1 LYS A1026 -4.319 31.386 -11.530 1.00 0.00 H ATOM 2065 HZ2 LYS A1026 -3.521 30.047 -12.206 1.00 0.00 H ATOM 2066 HZ3 LYS A1026 -3.391 30.362 -10.542 1.00 0.00 H ATOM 2067 H LYS A1026 1.325 31.329 -15.831 1.00 0.00 H ATOM 2068 N SER A1027 -0.272 33.306 -18.177 1.00 16.79 N ATOM 2069 CA SER A1027 -0.669 34.263 -19.243 1.00 17.57 C ATOM 2070 C SER A1027 -0.945 33.612 -20.584 1.00 22.74 C ATOM 2071 O SER A1027 -1.849 34.050 -21.291 1.00 23.02 O ATOM 2072 CB SER A1027 0.338 35.387 -19.384 1.00 16.11 C ATOM 2073 OG SER A1027 1.572 34.896 -19.864 1.00 16.97 O ATOM 2074 HG SER A1027 1.928 34.225 -19.229 1.00 0.00 H ATOM 2075 H SER A1027 0.700 33.319 -17.807 1.00 0.00 H ATOM 2076 N CYS A1028 -0.190 32.576 -20.943 1.00 22.15 N ATOM 2077 CA CYS A1028 -0.414 31.830 -22.186 1.00 22.99 C ATOM 2078 C CYS A1028 -0.912 30.384 -21.884 1.00 27.73 C ATOM 2079 O CYS A1028 -0.653 29.492 -22.661 1.00 26.13 O ATOM 2080 CB CYS A1028 0.852 31.814 -23.037 1.00 23.84 C ATOM 2081 SG CYS A1028 2.235 30.928 -22.273 1.00 28.22 S ATOM 2082 H CYS A1028 0.589 32.284 -20.318 1.00 0.00 H ATOM 2083 N SER A1029 -1.659 30.182 -20.803 1.00 27.12 N ATOM 2084 CA SER A1029 -2.179 28.872 -20.357 1.00 26.52 C ATOM 2085 C SER A1029 -3.307 28.346 -21.273 1.00 31.45 C ATOM 2086 O SER A1029 -3.947 29.174 -21.928 1.00 29.90 O ATOM 2087 CB SER A1029 -2.703 29.009 -18.934 1.00 28.14 C ATOM 2088 OG SER A1029 -3.879 29.788 -18.963 1.00 32.17 O ATOM 2089 HG SER A1029 -4.555 29.341 -19.531 1.00 0.00 H ATOM 2090 H SER A1029 -1.897 31.013 -20.224 1.00 0.00 H ATOM 2091 N PRO A1030 -3.657 27.019 -21.291 1.00 29.53 N ATOM 2092 CA PRO A1030 -4.744 26.569 -22.192 1.00 28.80 C ATOM 2093 C PRO A1030 -6.039 27.329 -21.964 1.00 34.32 C ATOM 2094 O PRO A1030 -6.742 27.616 -22.928 1.00 32.81 O ATOM 2095 CB PRO A1030 -4.875 25.077 -21.889 1.00 30.21 C ATOM 2096 CG PRO A1030 -3.534 24.693 -21.416 1.00 35.47 C ATOM 2097 CD PRO A1030 -3.047 25.864 -20.601 1.00 31.05 C ATOM 2098 N SER A1031 -6.323 27.702 -20.693 1.00 31.15 N ATOM 2099 CA SER A1031 -7.510 28.476 -20.363 1.00 31.43 C ATOM 2100 C SER A1031 -7.420 29.914 -20.872 1.00 35.65 C ATOM 2101 O SER A1031 -8.329 30.370 -21.546 1.00 35.85 O ATOM 2102 CB SER A1031 -7.759 28.476 -18.860 1.00 36.26 C ATOM 2103 OG SER A1031 -8.931 29.228 -18.581 1.00 50.90 O ATOM 2104 HG SER A1031 -9.096 29.230 -17.605 1.00 0.00 H ATOM 2105 H SER A1031 -5.673 27.427 -19.930 1.00 0.00 H ATOM 2106 N ALA A1032 -6.343 30.630 -20.531 1.00 33.58 N ATOM 2107 CA ALA A1032 -6.146 32.029 -20.931 1.00 33.45 C ATOM 2108 C ALA A1032 -6.110 32.204 -22.447 1.00 36.29 C ATOM 2109 O ALA A1032 -6.592 33.224 -22.943 1.00 34.20 O ATOM 2110 CB ALA A1032 -4.868 32.574 -20.314 1.00 34.37 C ATOM 2111 H ALA A1032 -5.608 30.173 -19.954 1.00 0.00 H ATOM 2112 N GLU A1033 -5.553 31.221 -23.188 1.00 33.50 N ATOM 2113 CA GLU A1033 -5.464 31.371 -24.635 1.00 34.70 C ATOM 2114 C GLU A1033 -6.819 31.175 -25.357 1.00 40.84 C ATOM 2115 O GLU A1033 -7.090 31.961 -26.265 1.00 38.43 O ATOM 2116 CB GLU A1033 -4.345 30.512 -25.241 1.00 36.01 C ATOM 2117 CG GLU A1033 -4.094 30.753 -26.727 1.00 43.89 C ATOM 2118 CD GLU A1033 -3.844 32.171 -27.227 1.00 47.39 C ATOM 2119 OE1 GLU A1033 -4.132 32.427 -28.418 1.00 24.84 O ATOM 2120 OE2 GLU A1033 -3.359 33.023 -26.446 1.00 24.35 O ATOM 2121 H GLU A1033 -5.190 30.362 -22.728 1.00 0.00 H ATOM 2122 N PHE A1034 -7.667 30.167 -24.967 1.00 42.00 N ATOM 2123 CA PHE A1034 -9.004 29.987 -25.595 1.00 43.08 C ATOM 2124 C PHE A1034 -9.867 31.198 -25.319 1.00 48.73 C ATOM 2125 O PHE A1034 -10.631 31.607 -26.189 1.00 49.07 O ATOM 2126 CB PHE A1034 -9.749 28.695 -25.174 1.00 45.67 C ATOM 2127 CG PHE A1034 -11.266 28.764 -25.338 1.00 47.87 C ATOM 2128 CD1 PHE A1034 -11.854 28.651 -26.590 1.00 51.01 C ATOM 2129 CD2 PHE A1034 -12.091 29.048 -24.251 1.00 50.13 C ATOM 2130 CE1 PHE A1034 -13.238 28.796 -26.745 1.00 51.84 C ATOM 2131 CE2 PHE A1034 -13.473 29.163 -24.406 1.00 52.54 C ATOM 2132 CZ PHE A1034 -14.039 29.025 -25.651 1.00 50.49 C ATOM 2133 H PHE A1034 -7.367 29.514 -24.215 1.00 0.00 H ATOM 2134 N LEU A1035 -9.741 31.768 -24.102 1.00 46.73 N ATOM 2135 CA LEU A1035 -10.431 32.979 -23.666 1.00 46.14 C ATOM 2136 C LEU A1035 -10.258 34.096 -24.712 1.00 48.42 C ATOM 2137 O LEU A1035 -11.199 34.846 -24.946 1.00 47.60 O ATOM 2138 CB LEU A1035 -9.865 33.441 -22.307 1.00 46.24 C ATOM 2139 CG LEU A1035 -10.647 33.087 -21.045 1.00 51.24 C ATOM 2140 CD1 LEU A1035 -9.727 32.969 -19.841 1.00 51.41 C ATOM 2141 CD2 LEU A1035 -11.734 34.117 -20.759 1.00 55.40 C ATOM 2142 H LEU A1035 -9.103 31.309 -23.421 1.00 0.00 H ATOM 2143 N ARG A1036 -9.070 34.190 -25.360 1.00 44.28 N ATOM 2144 CA ARG A1036 -8.819 35.219 -26.382 1.00 43.79 C ATOM 2145 C ARG A1036 -9.376 34.894 -27.750 1.00 46.36 C ATOM 2146 O ARG A1036 -9.935 35.780 -28.393 1.00 46.28 O ATOM 2147 CB ARG A1036 -7.330 35.570 -26.501 1.00 42.59 C ATOM 2148 CG ARG A1036 -6.884 36.582 -25.469 1.00 47.65 C ATOM 2149 CD ARG A1036 -5.463 37.024 -25.709 1.00 48.13 C ATOM 2150 NE ARG A1036 -4.781 37.341 -24.451 1.00 62.54 N ATOM 2151 CZ ARG A1036 -4.013 36.493 -23.769 1.00 76.83 C ATOM 2152 NH1 ARG A1036 -3.436 36.876 -22.639 1.00 62.90 N ATOM 2153 NH2 ARG A1036 -3.810 35.259 -24.217 1.00 64.36 N ATOM 2154 HE ARG A1036 -4.906 38.298 -24.063 1.00 0.00 H ATOM 2155 HH12 ARG A1036 -2.837 36.211 -22.109 1.00 0.00 H ATOM 2156 HH11 ARG A1036 -3.582 37.842 -22.282 1.00 0.00 H ATOM 2157 HH22 ARG A1036 -3.209 34.603 -23.679 1.00 0.00 H ATOM 2158 HH21 ARG A1036 -4.252 34.949 -25.106 1.00 0.00 H ATOM 2159 H ARG A1036 -8.314 33.515 -25.128 1.00 0.00 H ATOM 2160 N MET A1037 -9.185 33.649 -28.217 1.00 41.10 N ATOM 2161 CA MET A1037 -9.629 33.213 -29.536 1.00 39.81 C ATOM 2162 C MET A1037 -11.157 33.108 -29.666 1.00 43.14 C ATOM 2163 O MET A1037 -11.679 33.368 -30.749 1.00 42.62 O ATOM 2164 CB MET A1037 -8.930 31.899 -29.929 1.00 42.09 C ATOM 2165 CG MET A1037 -7.441 32.063 -30.206 1.00 45.01 C ATOM 2166 SD MET A1037 -6.468 30.600 -29.788 1.00 49.04 S ATOM 2167 CE MET A1037 -5.544 30.397 -31.289 1.00 45.87 C ATOM 2168 H MET A1037 -8.696 32.962 -27.608 1.00 0.00 H ATOM 2169 N MET A1038 -11.869 32.777 -28.560 1.00 39.83 N ATOM 2170 CA MET A1038 -13.332 32.652 -28.487 1.00 68.48 C ATOM 2171 C MET A1038 -14.100 33.856 -29.061 1.00 83.99 C ATOM 2172 O MET A1038 -13.596 34.976 -29.064 1.00 42.37 O ATOM 2173 CB MET A1038 -13.792 32.343 -27.046 1.00 70.93 C ATOM 2174 CG MET A1038 -13.828 33.535 -26.102 1.00 74.56 C ATOM 2175 SD MET A1038 -14.332 33.042 -24.436 1.00 78.73 S ATOM 2176 CE MET A1038 -14.242 34.594 -23.594 1.00 75.32 C ATOM 2177 H MET A1038 -11.333 32.596 -27.687 1.00 0.00 H TER 2178 MET A1038 ATOM 2179 N ASP A1043 -26.290 35.039 -27.618 1.00 39.66 N ATOM 2180 CA ASP A1043 -25.164 34.641 -26.777 1.00 39.46 C ATOM 2181 C ASP A1043 -24.930 33.133 -26.796 1.00 44.02 C ATOM 2182 O ASP A1043 -25.885 32.348 -26.862 1.00 44.42 O ATOM 2183 CB ASP A1043 -25.349 35.136 -25.338 1.00 41.51 C ATOM 2184 HN3 ASP A1043 -27.156 34.574 -27.278 1.00 0.00 H ATOM 2185 HN2 ASP A1043 -26.105 34.754 -28.601 1.00 0.00 H ATOM 2186 HN1 ASP A1043 -26.408 36.071 -27.571 1.00 0.00 H ATOM 2187 N VAL A1044 -23.645 32.734 -26.714 1.00 39.73 N ATOM 2188 CA VAL A1044 -23.191 31.339 -26.768 1.00 38.54 C ATOM 2189 C VAL A1044 -22.500 30.922 -25.454 1.00 39.61 C ATOM 2190 O VAL A1044 -21.601 31.632 -24.990 1.00 37.74 O ATOM 2191 CB VAL A1044 -22.222 31.105 -27.972 1.00 41.89 C ATOM 2192 CG1 VAL A1044 -22.240 29.650 -28.427 1.00 41.29 C ATOM 2193 CG2 VAL A1044 -22.514 32.046 -29.142 1.00 41.54 C ATOM 2194 H VAL A1044 -22.920 33.471 -26.604 1.00 0.00 H ATOM 2195 N PRO A1045 -22.840 29.750 -24.872 1.00 34.53 N ATOM 2196 CA PRO A1045 -22.140 29.314 -23.648 1.00 34.35 C ATOM 2197 C PRO A1045 -20.683 28.916 -23.936 1.00 38.80 C ATOM 2198 O PRO A1045 -20.399 28.312 -24.977 1.00 37.25 O ATOM 2199 CB PRO A1045 -22.997 28.141 -23.135 1.00 36.12 C ATOM 2200 CG PRO A1045 -24.304 28.199 -23.953 1.00 40.54 C ATOM 2201 CD PRO A1045 -23.879 28.774 -25.268 1.00 36.01 C ATOM 2202 N ALA A1046 -19.754 29.303 -23.027 1.00 36.29 N ATOM 2203 CA ALA A1046 -18.308 29.104 -23.165 1.00 36.60 C ATOM 2204 C ALA A1046 -17.843 27.677 -23.518 1.00 40.85 C ATOM 2205 O ALA A1046 -16.764 27.544 -24.105 1.00 41.41 O ATOM 2206 CB ALA A1046 -17.589 29.590 -21.929 1.00 37.05 C ATOM 2207 H ALA A1046 -20.093 29.777 -22.166 1.00 0.00 H ATOM 2208 N LEU A1047 -18.644 26.630 -23.216 1.00 36.42 N ATOM 2209 CA LEU A1047 -18.297 25.243 -23.555 1.00 35.48 C ATOM 2210 C LEU A1047 -18.548 24.990 -25.060 1.00 37.99 C ATOM 2211 O LEU A1047 -17.720 24.343 -25.707 1.00 38.51 O ATOM 2212 CB LEU A1047 -19.108 24.261 -22.686 1.00 35.12 C ATOM 2213 CG LEU A1047 -18.579 22.838 -22.510 1.00 39.02 C ATOM 2214 CD1 LEU A1047 -19.002 22.268 -21.163 1.00 38.56 C ATOM 2215 CD2 LEU A1047 -19.071 21.924 -23.609 1.00 41.22 C ATOM 2216 H LEU A1047 -19.542 26.814 -22.724 1.00 0.00 H ATOM 2217 N SER A1048 -19.698 25.482 -25.593 1.00 31.64 N ATOM 2218 CA SER A1048 -20.141 25.349 -26.990 1.00 30.64 C ATOM 2219 C SER A1048 -19.302 26.156 -27.978 1.00 34.49 C ATOM 2220 O SER A1048 -19.289 25.856 -29.177 1.00 33.85 O ATOM 2221 CB SER A1048 -21.607 25.729 -27.120 1.00 32.79 C ATOM 2222 OG SER A1048 -22.441 24.814 -26.429 1.00 42.16 O ATOM 2223 HG SER A1048 -23.387 25.088 -26.533 1.00 0.00 H ATOM 2224 H SER A1048 -20.327 26.004 -24.950 1.00 0.00 H ATOM 2225 N ARG A1049 -18.621 27.182 -27.470 1.00 31.37 N ATOM 2226 CA ARG A1049 -17.722 28.051 -28.213 1.00 32.02 C ATOM 2227 C ARG A1049 -16.426 27.276 -28.532 1.00 35.31 C ATOM 2228 O ARG A1049 -15.951 27.290 -29.668 1.00 35.21 O ATOM 2229 CB ARG A1049 -17.444 29.320 -27.361 1.00 32.19 C ATOM 2230 CG ARG A1049 -16.657 30.397 -28.073 1.00 40.03 C ATOM 2231 CD ARG A1049 -17.350 30.988 -29.294 1.00 44.91 C ATOM 2232 NE ARG A1049 -16.372 31.708 -30.103 1.00 49.56 N ATOM 2233 CZ ARG A1049 -15.766 31.208 -31.173 1.00 56.22 C ATOM 2234 NH1 ARG A1049 -16.082 29.999 -31.619 1.00 36.49 N ATOM 2235 NH2 ARG A1049 -14.855 31.923 -31.821 1.00 36.37 N ATOM 2236 HE ARG A1049 -16.133 32.680 -29.822 1.00 0.00 H ATOM 2237 HH12 ARG A1049 -15.604 29.613 -32.458 1.00 0.00 H ATOM 2238 HH11 ARG A1049 -16.808 29.438 -31.130 1.00 0.00 H ATOM 2239 HH22 ARG A1049 -14.383 31.527 -32.659 1.00 0.00 H ATOM 2240 HH21 ARG A1049 -14.613 32.879 -31.491 1.00 0.00 H ATOM 2241 H ARG A1049 -18.742 27.378 -26.456 1.00 0.00 H ATOM 2242 N LEU A1050 -15.866 26.596 -27.510 1.00 33.51 N ATOM 2243 CA LEU A1050 -14.659 25.771 -27.618 1.00 33.23 C ATOM 2244 C LEU A1050 -14.944 24.591 -28.540 1.00 37.07 C ATOM 2245 O LEU A1050 -14.116 24.275 -29.396 1.00 34.61 O ATOM 2246 CB LEU A1050 -14.194 25.332 -26.216 1.00 33.22 C ATOM 2247 CG LEU A1050 -13.053 24.327 -26.096 1.00 37.12 C ATOM 2248 CD1 LEU A1050 -11.744 24.912 -26.557 1.00 37.69 C ATOM 2249 CD2 LEU A1050 -12.887 23.896 -24.654 1.00 40.68 C ATOM 2250 H LEU A1050 -16.324 26.662 -26.578 1.00 0.00 H ATOM 2251 N LEU A1051 -16.166 24.022 -28.438 1.00 36.19 N ATOM 2252 CA LEU A1051 -16.642 22.961 -29.326 1.00 37.23 C ATOM 2253 C LEU A1051 -16.655 23.502 -30.751 1.00 41.33 C ATOM 2254 O LEU A1051 -16.006 22.922 -31.624 1.00 42.31 O ATOM 2255 CB LEU A1051 -18.049 22.477 -28.908 1.00 38.06 C ATOM 2256 CG LEU A1051 -18.101 21.259 -27.988 1.00 43.49 C ATOM 2257 CD1 LEU A1051 -19.446 21.162 -27.287 1.00 43.39 C ATOM 2258 CD2 LEU A1051 -17.795 19.983 -28.754 1.00 45.03 C ATOM 2259 H LEU A1051 -16.803 24.357 -27.687 1.00 0.00 H ATOM 2260 N GLU A1052 -17.285 24.674 -30.958 1.00 36.66 N ATOM 2261 CA GLU A1052 -17.329 25.334 -32.256 1.00 36.29 C ATOM 2262 C GLU A1052 -15.932 25.561 -32.849 1.00 38.81 C ATOM 2263 O GLU A1052 -15.689 25.111 -33.967 1.00 37.52 O ATOM 2264 CB GLU A1052 -18.108 26.646 -32.176 1.00 37.84 C ATOM 2265 CG GLU A1052 -19.549 26.531 -32.631 1.00 46.39 C ATOM 2266 CD GLU A1052 -20.072 27.816 -33.244 1.00 57.81 C ATOM 2267 OE1 GLU A1052 -20.492 27.785 -34.425 1.00 27.51 O ATOM 2268 OE2 GLU A1052 -20.005 28.866 -32.564 1.00 49.66 O ATOM 2269 H GLU A1052 -17.762 25.129 -30.154 1.00 0.00 H ATOM 2270 N LEU A1053 -15.011 26.185 -32.073 1.00 35.95 N ATOM 2271 CA LEU A1053 -13.626 26.482 -32.460 1.00 36.40 C ATOM 2272 C LEU A1053 -12.802 25.264 -32.843 1.00 36.52 C ATOM 2273 O LEU A1053 -12.161 25.283 -33.897 1.00 34.36 O ATOM 2274 CB LEU A1053 -12.884 27.258 -31.368 1.00 37.13 C ATOM 2275 CG LEU A1053 -13.018 28.760 -31.378 1.00 43.28 C ATOM 2276 CD1 LEU A1053 -12.404 29.352 -30.144 1.00 44.24 C ATOM 2277 CD2 LEU A1053 -12.368 29.372 -32.597 1.00 46.41 C ATOM 2278 H LEU A1053 -15.312 26.478 -31.122 1.00 0.00 H ATOM 2279 N LEU A1054 -12.793 24.233 -31.977 1.00 32.57 N ATOM 2280 CA LEU A1054 -12.037 22.995 -32.174 1.00 33.18 C ATOM 2281 C LEU A1054 -12.481 22.201 -33.376 1.00 38.31 C ATOM 2282 O LEU A1054 -11.636 21.589 -34.020 1.00 38.12 O ATOM 2283 CB LEU A1054 -12.107 22.076 -30.938 1.00 33.43 C ATOM 2284 CG LEU A1054 -11.361 22.505 -29.671 1.00 37.24 C ATOM 2285 CD1 LEU A1054 -11.823 21.680 -28.494 1.00 37.33 C ATOM 2286 CD2 LEU A1054 -9.862 22.409 -29.833 1.00 37.51 C ATOM 2287 H LEU A1054 -13.361 24.322 -31.110 1.00 0.00 H ATOM 2288 N GLU A1055 -13.806 22.134 -33.624 1.00 36.75 N ATOM 2289 CA GLU A1055 -14.393 21.395 -34.751 1.00 37.28 C ATOM 2290 C GLU A1055 -14.081 22.079 -36.083 1.00 39.92 C ATOM 2291 O GLU A1055 -13.879 21.390 -37.088 1.00 40.30 O ATOM 2292 CB GLU A1055 -15.909 21.219 -34.555 1.00 38.86 C ATOM 2293 CG GLU A1055 -16.284 20.258 -33.432 1.00 48.48 C ATOM 2294 CD GLU A1055 -17.674 20.429 -32.841 1.00 63.79 C ATOM 2295 OE1 GLU A1055 -18.278 21.513 -33.020 1.00 62.61 O ATOM 2296 OE2 GLU A1055 -18.145 19.486 -32.162 1.00 44.82 O ATOM 2297 H GLU A1055 -14.450 22.635 -32.979 1.00 0.00 H ATOM 2298 N GLU A1056 -14.023 23.435 -36.085 1.00 35.05 N ATOM 2299 CA GLU A1056 -13.703 24.265 -37.253 1.00 34.11 C ATOM 2300 C GLU A1056 -12.278 23.970 -37.730 1.00 38.75 C ATOM 2301 O GLU A1056 -12.074 23.746 -38.925 1.00 39.98 O ATOM 2302 CB GLU A1056 -13.837 25.758 -36.927 1.00 35.34 C ATOM 2303 CG GLU A1056 -15.264 26.259 -36.738 1.00 38.17 C ATOM 2304 CD GLU A1056 -15.383 27.725 -36.365 1.00 44.62 C ATOM 2305 OE1 GLU A1056 -16.503 28.277 -36.463 1.00 44.30 O ATOM 2306 OE2 GLU A1056 -14.352 28.329 -35.992 1.00 34.05 O ATOM 2307 H GLU A1056 -14.221 23.924 -35.189 1.00 0.00 H ATOM 2308 N GLY A1057 -11.337 23.903 -36.778 1.00 34.06 N ATOM 2309 CA GLY A1057 -9.929 23.601 -37.018 1.00 33.15 C ATOM 2310 C GLY A1057 -8.964 24.456 -36.225 1.00 33.32 C ATOM 2311 O GLY A1057 -7.773 24.509 -36.532 1.00 31.65 O ATOM 2312 H GLY A1057 -11.631 24.079 -35.796 1.00 0.00 H ATOM 2313 N GLN A1058 -9.470 25.133 -35.196 1.00 29.36 N ATOM 2314 CA GLN A1058 -8.638 26.001 -34.388 1.00 27.43 C ATOM 2315 C GLN A1058 -7.969 25.230 -33.278 1.00 29.83 C ATOM 2316 O GLN A1058 -8.561 24.361 -32.639 1.00 27.06 O ATOM 2317 CB GLN A1058 -9.438 27.190 -33.860 1.00 28.29 C ATOM 2318 CG GLN A1058 -9.653 28.284 -34.911 1.00 34.57 C ATOM 2319 CD GLN A1058 -8.869 29.523 -34.560 1.00 57.41 C ATOM 2320 OE1 GLN A1058 -7.707 29.699 -34.964 1.00 54.90 O ATOM 2321 NE2 GLN A1058 -9.477 30.400 -33.766 1.00 45.40 N ATOM 2322 HE22 GLN A1058 -10.450 30.223 -33.445 1.00 0.00 H ATOM 2323 HE21 GLN A1058 -8.979 31.262 -33.466 1.00 0.00 H ATOM 2324 H GLN A1058 -10.480 25.037 -34.968 1.00 0.00 H ATOM 2325 N ARG A1059 -6.715 25.541 -33.068 1.00 28.81 N ATOM 2326 CA ARG A1059 -5.912 24.915 -32.030 1.00 28.68 C ATOM 2327 C ARG A1059 -5.139 25.975 -31.265 1.00 30.80 C ATOM 2328 O ARG A1059 -4.967 27.107 -31.759 1.00 32.10 O ATOM 2329 CB ARG A1059 -4.907 23.923 -32.696 1.00 27.44 C ATOM 2330 CG ARG A1059 -5.554 22.794 -33.482 1.00 17.81 C ATOM 2331 CD ARG A1059 -6.188 21.841 -32.505 1.00 9.60 C ATOM 2332 NE ARG A1059 -6.810 20.670 -33.113 1.00 29.16 N ATOM 2333 CZ ARG A1059 -8.077 20.615 -33.502 1.00 44.23 C ATOM 2334 NH1 ARG A1059 -8.580 19.487 -33.977 1.00 28.63 N ATOM 2335 NH2 ARG A1059 -8.845 21.699 -33.450 1.00 28.43 N ATOM 2336 HE ARG A1059 -6.222 19.823 -33.250 1.00 0.00 H ATOM 2337 HH12 ARG A1059 -9.574 19.448 -34.281 1.00 0.00 H ATOM 2338 HH11 ARG A1059 -7.981 18.639 -34.046 1.00 0.00 H ATOM 2339 HH22 ARG A1059 -9.837 21.648 -33.757 1.00 0.00 H ATOM 2340 HH21 ARG A1059 -8.453 22.598 -33.103 1.00 0.00 H ATOM 2341 H ARG A1059 -6.274 26.266 -33.669 1.00 0.00 H ATOM 2342 N LEU A1060 -4.597 25.587 -30.100 1.00 22.81 N ATOM 2343 CA LEU A1060 -3.698 26.419 -29.327 1.00 22.74 C ATOM 2344 C LEU A1060 -2.457 26.719 -30.176 1.00 25.72 C ATOM 2345 O LEU A1060 -2.015 25.861 -30.948 1.00 23.17 O ATOM 2346 CB LEU A1060 -3.289 25.756 -28.017 1.00 22.79 C ATOM 2347 CG LEU A1060 -4.432 25.550 -27.002 1.00 24.49 C ATOM 2348 CD1 LEU A1060 -4.065 24.461 -25.994 1.00 23.66 C ATOM 2349 CD2 LEU A1060 -4.790 26.853 -26.295 1.00 26.00 C ATOM 2350 H LEU A1060 -4.834 24.643 -29.734 1.00 0.00 H ATOM 2351 N PRO A1061 -1.930 27.947 -30.082 1.00 23.85 N ATOM 2352 CA PRO A1061 -0.772 28.324 -30.908 1.00 24.28 C ATOM 2353 C PRO A1061 0.523 27.696 -30.415 1.00 28.56 C ATOM 2354 O PRO A1061 0.608 27.287 -29.252 1.00 28.20 O ATOM 2355 CB PRO A1061 -0.722 29.847 -30.729 1.00 26.45 C ATOM 2356 CG PRO A1061 -1.257 30.063 -29.361 1.00 31.42 C ATOM 2357 CD PRO A1061 -2.375 29.077 -29.240 1.00 26.19 C ATOM 2358 N ALA A1062 1.545 27.672 -31.277 1.00 25.03 N ATOM 2359 CA ALA A1062 2.838 27.157 -30.886 1.00 24.85 C ATOM 2360 C ALA A1062 3.353 27.976 -29.682 1.00 28.52 C ATOM 2361 O ALA A1062 3.366 29.200 -29.759 1.00 26.10 O ATOM 2362 CB ALA A1062 3.810 27.253 -32.044 1.00 25.04 C ATOM 2363 H ALA A1062 1.408 28.029 -32.244 1.00 0.00 H ATOM 2364 N PRO A1063 3.682 27.337 -28.536 1.00 25.16 N ATOM 2365 CA PRO A1063 4.199 28.102 -27.389 1.00 25.34 C ATOM 2366 C PRO A1063 5.461 28.910 -27.719 1.00 28.97 C ATOM 2367 O PRO A1063 6.212 28.515 -28.614 1.00 28.07 O ATOM 2368 CB PRO A1063 4.526 27.007 -26.367 1.00 27.34 C ATOM 2369 CG PRO A1063 3.688 25.854 -26.751 1.00 31.57 C ATOM 2370 CD PRO A1063 3.648 25.891 -28.235 1.00 27.00 C ATOM 2371 N PRO A1064 5.724 30.024 -27.001 1.00 26.63 N ATOM 2372 CA PRO A1064 6.946 30.820 -27.266 1.00 26.71 C ATOM 2373 C PRO A1064 8.230 29.975 -27.372 1.00 29.51 C ATOM 2374 O PRO A1064 8.485 29.120 -26.508 1.00 27.64 O ATOM 2375 CB PRO A1064 7.012 31.765 -26.059 1.00 28.21 C ATOM 2376 CG PRO A1064 5.616 31.918 -25.629 1.00 32.76 C ATOM 2377 CD PRO A1064 4.928 30.614 -25.899 1.00 28.52 C ATOM 2378 N ALA A1065 8.978 30.155 -28.492 1.00 27.30 N ATOM 2379 CA ALA A1065 10.236 29.457 -28.806 1.00 26.86 C ATOM 2380 C ALA A1065 10.147 27.930 -28.795 1.00 29.22 C ATOM 2381 O ALA A1065 11.171 27.249 -28.612 1.00 25.27 O ATOM 2382 CB ALA A1065 11.347 29.933 -27.871 1.00 27.55 C ATOM 2383 H ALA A1065 8.632 30.846 -29.188 1.00 0.00 H ATOM 2384 N CYS A1066 8.930 27.373 -29.006 1.00 27.35 N ATOM 2385 CA CYS A1066 8.750 25.920 -28.987 1.00 27.76 C ATOM 2386 C CYS A1066 9.286 25.280 -30.267 1.00 30.17 C ATOM 2387 O CYS A1066 8.922 25.760 -31.319 1.00 27.91 O ATOM 2388 CB CYS A1066 7.288 25.559 -28.759 1.00 28.21 C ATOM 2389 SG CYS A1066 6.932 23.789 -28.910 1.00 32.31 S ATOM 2390 H CYS A1066 8.110 27.988 -29.184 1.00 0.00 H ATOM 2391 N PRO A1067 10.107 24.192 -30.241 1.00 28.63 N ATOM 2392 CA PRO A1067 10.570 23.616 -31.513 1.00 28.93 C ATOM 2393 C PRO A1067 9.416 23.182 -32.398 1.00 33.23 C ATOM 2394 O PRO A1067 8.392 22.659 -31.906 1.00 33.29 O ATOM 2395 CB PRO A1067 11.461 22.457 -31.089 1.00 31.23 C ATOM 2396 CG PRO A1067 11.868 22.790 -29.685 1.00 36.30 C ATOM 2397 CD PRO A1067 10.668 23.459 -29.091 1.00 30.81 C ATOM 2398 N ALA A1068 9.563 23.451 -33.708 1.00 29.05 N ATOM 2399 CA ALA A1068 8.572 23.146 -34.748 1.00 28.86 C ATOM 2400 C ALA A1068 8.194 21.676 -34.803 1.00 30.74 C ATOM 2401 O ALA A1068 7.092 21.350 -35.240 1.00 30.47 O ATOM 2402 CB ALA A1068 9.070 23.617 -36.115 1.00 29.36 C ATOM 2403 H ALA A1068 10.447 23.910 -34.007 1.00 0.00 H ATOM 2404 N GLU A1069 9.107 20.799 -34.356 1.00 27.38 N ATOM 2405 CA GLU A1069 8.949 19.351 -34.303 1.00 27.34 C ATOM 2406 C GLU A1069 8.046 18.976 -33.127 1.00 31.40 C ATOM 2407 O GLU A1069 7.218 18.090 -33.280 1.00 30.61 O ATOM 2408 CB GLU A1069 10.325 18.670 -34.142 1.00 29.53 C ATOM 2409 CG GLU A1069 11.480 19.455 -34.756 1.00 42.26 C ATOM 2410 CD GLU A1069 12.749 18.675 -35.043 1.00 68.95 C ATOM 2411 OE1 GLU A1069 13.844 19.201 -34.740 1.00 74.31 O ATOM 2412 OE2 GLU A1069 12.658 17.561 -35.608 1.00 63.63 O ATOM 2413 H GLU A1069 10.010 21.188 -34.016 1.00 0.00 H ATOM 2414 N VAL A1070 8.206 19.645 -31.948 1.00 28.04 N ATOM 2415 CA VAL A1070 7.385 19.366 -30.751 1.00 27.33 C ATOM 2416 C VAL A1070 5.915 19.809 -31.008 1.00 29.78 C ATOM 2417 O VAL A1070 4.969 19.087 -30.681 1.00 29.41 O ATOM 2418 CB VAL A1070 7.995 19.951 -29.449 1.00 30.07 C ATOM 2419 CG1 VAL A1070 6.994 19.936 -28.286 1.00 29.20 C ATOM 2420 CG2 VAL A1070 9.268 19.210 -29.064 1.00 29.94 C ATOM 2421 H VAL A1070 8.937 20.383 -31.889 1.00 0.00 H ATOM 2422 N HIS A1071 5.747 20.969 -31.628 1.00 24.45 N ATOM 2423 CA HIS A1071 4.451 21.539 -32.001 1.00 22.69 C ATOM 2424 C HIS A1071 3.669 20.676 -32.995 1.00 25.51 C ATOM 2425 O HIS A1071 2.441 20.634 -32.897 1.00 25.96 O ATOM 2426 CB HIS A1071 4.665 22.951 -32.556 1.00 22.66 C ATOM 2427 CG HIS A1071 3.430 23.659 -33.015 1.00 26.01 C ATOM 2428 ND1 HIS A1071 3.387 24.287 -34.236 1.00 28.19 N ATOM 2429 CD2 HIS A1071 2.243 23.836 -32.392 1.00 28.04 C ATOM 2430 CE1 HIS A1071 2.188 24.835 -34.315 1.00 27.68 C ATOM 2431 NE2 HIS A1071 1.458 24.564 -33.242 1.00 27.95 N ATOM 2432 H HIS A1071 6.599 21.515 -31.867 1.00 0.00 H ATOM 2433 N GLU A1072 4.360 20.023 -33.966 1.00 21.03 N ATOM 2434 CA GLU A1072 3.704 19.177 -34.967 1.00 21.80 C ATOM 2435 C GLU A1072 3.113 17.956 -34.247 1.00 27.20 C ATOM 2436 O GLU A1072 1.972 17.600 -34.509 1.00 27.88 O ATOM 2437 CB GLU A1072 4.665 18.738 -36.086 1.00 23.72 C ATOM 2438 CG GLU A1072 4.961 19.783 -37.152 1.00 32.08 C ATOM 2439 CD GLU A1072 3.921 19.916 -38.243 1.00 52.62 C ATOM 2440 OE1 GLU A1072 3.979 19.151 -39.234 1.00 60.55 O ATOM 2441 OE2 GLU A1072 3.065 20.818 -38.119 1.00 37.39 O ATOM 2442 H GLU A1072 5.394 20.128 -34.000 1.00 0.00 H ATOM 2443 N LEU A1073 3.854 17.372 -33.285 1.00 24.21 N ATOM 2444 CA LEU A1073 3.363 16.239 -32.492 1.00 24.54 C ATOM 2445 C LEU A1073 2.125 16.615 -31.653 1.00 28.66 C ATOM 2446 O LEU A1073 1.263 15.764 -31.426 1.00 28.85 O ATOM 2447 CB LEU A1073 4.472 15.664 -31.605 1.00 24.81 C ATOM 2448 CG LEU A1073 5.425 14.662 -32.278 1.00 31.41 C ATOM 2449 CD1 LEU A1073 6.778 14.683 -31.633 1.00 31.38 C ATOM 2450 CD2 LEU A1073 4.843 13.246 -32.272 1.00 37.14 C ATOM 2451 H LEU A1073 4.809 17.738 -33.098 1.00 0.00 H ATOM 2452 N MET A1074 2.056 17.892 -31.184 1.00 24.85 N ATOM 2453 CA MET A1074 0.937 18.459 -30.423 1.00 24.07 C ATOM 2454 C MET A1074 -0.326 18.412 -31.298 1.00 27.26 C ATOM 2455 O MET A1074 -1.353 17.920 -30.843 1.00 25.04 O ATOM 2456 CB MET A1074 1.204 19.928 -30.012 1.00 25.31 C ATOM 2457 CG MET A1074 2.182 20.110 -28.880 1.00 27.73 C ATOM 2458 SD MET A1074 2.258 21.884 -28.472 1.00 29.93 S ATOM 2459 CE MET A1074 3.838 21.959 -27.670 1.00 27.22 C ATOM 2460 H MET A1074 2.863 18.517 -31.382 1.00 0.00 H ATOM 2461 N LYS A1075 -0.226 18.878 -32.562 1.00 22.57 N ATOM 2462 CA LYS A1075 -1.333 18.932 -33.507 1.00 22.98 C ATOM 2463 C LYS A1075 -1.810 17.536 -33.923 1.00 23.39 C ATOM 2464 O LYS A1075 -2.992 17.378 -34.211 1.00 22.93 O ATOM 2465 CB LYS A1075 -0.996 19.807 -34.735 1.00 27.16 C ATOM 2466 CG LYS A1075 -0.549 21.244 -34.407 1.00 36.32 C ATOM 2467 CD LYS A1075 -0.776 22.257 -35.555 1.00 44.13 C ATOM 2468 CE LYS A1075 0.096 22.063 -36.778 1.00 55.97 C ATOM 2469 NZ LYS A1075 1.482 22.547 -36.563 1.00 67.89 N ATOM 2470 HZ1 LYS A1075 1.462 23.562 -36.338 1.00 0.00 H ATOM 2471 HZ2 LYS A1075 1.912 22.024 -35.774 1.00 0.00 H ATOM 2472 HZ3 LYS A1075 2.040 22.393 -37.427 1.00 0.00 H ATOM 2473 H LYS A1075 0.703 19.221 -32.881 1.00 0.00 H ATOM 2474 N LEU A1076 -0.914 16.523 -33.903 1.00 17.83 N ATOM 2475 CA LEU A1076 -1.258 15.124 -34.200 1.00 17.32 C ATOM 2476 C LEU A1076 -2.061 14.557 -33.017 1.00 21.56 C ATOM 2477 O LEU A1076 -3.092 13.948 -33.235 1.00 19.99 O ATOM 2478 CB LEU A1076 0.004 14.265 -34.476 1.00 16.35 C ATOM 2479 CG LEU A1076 0.694 14.408 -35.856 1.00 20.28 C ATOM 2480 CD1 LEU A1076 1.959 13.549 -35.910 1.00 21.44 C ATOM 2481 CD2 LEU A1076 -0.244 14.025 -37.020 1.00 23.67 C ATOM 2482 H LEU A1076 0.073 16.746 -33.664 1.00 0.00 H ATOM 2483 N CYS A1077 -1.636 14.850 -31.757 1.00 21.59 N ATOM 2484 CA CYS A1077 -2.390 14.480 -30.533 1.00 20.79 C ATOM 2485 C CYS A1077 -3.769 15.154 -30.635 1.00 21.14 C ATOM 2486 O CYS A1077 -4.717 14.728 -29.992 1.00 19.34 O ATOM 2487 CB CYS A1077 -1.663 14.936 -29.260 1.00 22.17 C ATOM 2488 SG CYS A1077 -0.127 14.037 -28.883 1.00 26.39 S ATOM 2489 H CYS A1077 -0.736 15.360 -31.646 1.00 0.00 H ATOM 2490 N TRP A1078 -3.862 16.216 -31.458 1.00 19.10 N ATOM 2491 CA TRP A1078 -5.063 17.015 -31.613 1.00 19.32 C ATOM 2492 C TRP A1078 -5.802 16.739 -32.907 1.00 24.35 C ATOM 2493 O TRP A1078 -6.611 17.564 -33.324 1.00 23.25 O ATOM 2494 CB TRP A1078 -4.742 18.521 -31.437 1.00 17.26 C ATOM 2495 CG TRP A1078 -4.251 18.912 -30.064 1.00 17.65 C ATOM 2496 CD1 TRP A1078 -4.575 18.339 -28.863 1.00 20.40 C ATOM 2497 CD2 TRP A1078 -3.388 20.017 -29.763 1.00 17.11 C ATOM 2498 NE1 TRP A1078 -3.962 19.021 -27.837 1.00 20.07 N ATOM 2499 CE2 TRP A1078 -3.214 20.045 -28.364 1.00 21.21 C ATOM 2500 CE3 TRP A1078 -2.786 21.025 -30.545 1.00 18.65 C ATOM 2501 CZ2 TRP A1078 -2.469 21.044 -27.727 1.00 20.73 C ATOM 2502 CZ3 TRP A1078 -2.023 21.991 -29.916 1.00 20.46 C ATOM 2503 CH2 TRP A1078 -1.862 21.990 -28.521 1.00 20.60 C ATOM 2504 HE1 TRP A1078 -4.051 18.797 -26.825 1.00 0.00 H ATOM 2505 H TRP A1078 -3.024 16.479 -32.015 1.00 0.00 H ATOM 2506 N ALA A1079 -5.553 15.568 -33.533 1.00 23.60 N ATOM 2507 CA ALA A1079 -6.282 15.157 -34.743 1.00 23.33 C ATOM 2508 C ALA A1079 -7.740 15.104 -34.379 1.00 24.85 C ATOM 2509 O ALA A1079 -8.071 14.580 -33.308 1.00 19.44 O ATOM 2510 CB ALA A1079 -5.830 13.793 -35.229 1.00 24.47 C ATOM 2511 H ALA A1079 -4.822 14.937 -33.147 1.00 0.00 H ATOM 2512 N PRO A1080 -8.614 15.680 -35.236 1.00 25.74 N ATOM 2513 CA PRO A1080 -10.049 15.754 -34.892 1.00 26.91 C ATOM 2514 C PRO A1080 -10.742 14.387 -34.762 1.00 31.85 C ATOM 2515 O PRO A1080 -11.548 14.193 -33.854 1.00 30.78 O ATOM 2516 CB PRO A1080 -10.643 16.640 -35.997 1.00 29.11 C ATOM 2517 CG PRO A1080 -9.682 16.560 -37.129 1.00 33.66 C ATOM 2518 CD PRO A1080 -8.323 16.351 -36.522 1.00 28.71 C ATOM 2519 N SER A1081 -10.383 13.429 -35.619 1.00 29.76 N ATOM 2520 CA SER A1081 -10.927 12.072 -35.521 1.00 30.45 C ATOM 2521 C SER A1081 -10.054 11.320 -34.483 1.00 34.82 C ATOM 2522 O SER A1081 -8.816 11.425 -34.543 1.00 36.68 O ATOM 2523 CB SER A1081 -10.943 11.386 -36.886 1.00 34.33 C ATOM 2524 OG SER A1081 -11.723 10.202 -36.871 1.00 48.32 O ATOM 2525 HG SER A1081 -11.709 9.788 -37.770 1.00 0.00 H ATOM 2526 H SER A1081 -9.702 13.651 -36.373 1.00 0.00 H ATOM 2527 N PRO A1082 -10.662 10.643 -33.472 1.00 30.11 N ATOM 2528 CA PRO A1082 -9.838 10.002 -32.418 1.00 29.49 C ATOM 2529 C PRO A1082 -9.095 8.732 -32.822 1.00 34.29 C ATOM 2530 O PRO A1082 -8.147 8.321 -32.135 1.00 32.28 O ATOM 2531 CB PRO A1082 -10.829 9.735 -31.293 1.00 31.03 C ATOM 2532 CG PRO A1082 -12.172 9.698 -31.946 1.00 35.29 C ATOM 2533 CD PRO A1082 -12.111 10.485 -33.212 1.00 31.11 C ATOM 2534 N GLN A1083 -9.514 8.110 -33.937 1.00 31.49 N ATOM 2535 CA GLN A1083 -8.875 6.905 -34.456 1.00 31.27 C ATOM 2536 C GLN A1083 -7.576 7.284 -35.181 1.00 34.69 C ATOM 2537 O GLN A1083 -6.622 6.503 -35.185 1.00 33.93 O ATOM 2538 CB GLN A1083 -9.845 6.151 -35.389 1.00 33.70 C ATOM 2539 CG GLN A1083 -10.540 7.048 -36.421 1.00 54.33 C ATOM 2540 CD GLN A1083 -11.494 6.319 -37.328 1.00 71.70 C ATOM 2541 OE1 GLN A1083 -11.181 6.040 -38.490 1.00 68.21 O ATOM 2542 NE2 GLN A1083 -12.706 6.068 -36.846 1.00 59.40 N ATOM 2543 HE22 GLN A1083 -12.936 6.316 -35.863 1.00 0.00 H ATOM 2544 HE21 GLN A1083 -13.425 5.624 -37.452 1.00 0.00 H ATOM 2545 H GLN A1083 -10.328 8.504 -34.452 1.00 0.00 H ATOM 2546 N ASP A1084 -7.545 8.505 -35.777 1.00 30.92 N ATOM 2547 CA ASP A1084 -6.398 9.077 -36.503 1.00 29.78 C ATOM 2548 C ASP A1084 -5.259 9.458 -35.569 1.00 33.17 C ATOM 2549 O ASP A1084 -4.110 9.520 -36.017 1.00 32.92 O ATOM 2550 CB ASP A1084 -6.826 10.322 -37.301 1.00 30.90 C ATOM 2551 CG ASP A1084 -7.882 10.074 -38.362 1.00 34.95 C ATOM 2552 OD1 ASP A1084 -8.271 8.905 -38.552 1.00 33.83 O ATOM 2553 OD2 ASP A1084 -8.322 11.051 -38.993 1.00 43.76 O ATOM 2554 H ASP A1084 -8.406 9.086 -35.715 1.00 0.00 H ATOM 2555 N ARG A1085 -5.580 9.744 -34.280 1.00 28.38 N ATOM 2556 CA ARG A1085 -4.625 10.159 -33.247 1.00 27.78 C ATOM 2557 C ARG A1085 -3.502 9.144 -33.017 1.00 33.78 C ATOM 2558 O ARG A1085 -3.755 7.943 -33.110 1.00 33.63 O ATOM 2559 CB ARG A1085 -5.348 10.477 -31.921 1.00 26.42 C ATOM 2560 CG ARG A1085 -6.052 11.821 -31.961 1.00 25.53 C ATOM 2561 CD ARG A1085 -6.849 12.038 -30.710 1.00 24.39 C ATOM 2562 NE ARG A1085 -8.079 12.747 -31.034 1.00 30.61 N ATOM 2563 CZ ARG A1085 -9.128 12.816 -30.234 1.00 33.53 C ATOM 2564 NH1 ARG A1085 -10.214 13.471 -30.612 1.00 25.44 N ATOM 2565 NH2 ARG A1085 -9.099 12.235 -29.045 1.00 24.18 N ATOM 2566 HE ARG A1085 -8.135 13.230 -31.954 1.00 0.00 H ATOM 2567 HH12 ARG A1085 -11.037 13.522 -29.978 1.00 0.00 H ATOM 2568 HH11 ARG A1085 -10.244 13.934 -31.543 1.00 0.00 H ATOM 2569 HH22 ARG A1085 -9.927 12.292 -28.418 1.00 0.00 H ATOM 2570 HH21 ARG A1085 -8.248 11.722 -28.738 1.00 0.00 H ATOM 2571 H ARG A1085 -6.580 9.662 -34.005 1.00 0.00 H ATOM 2572 N PRO A1086 -2.259 9.601 -32.740 1.00 31.26 N ATOM 2573 CA PRO A1086 -1.160 8.639 -32.520 1.00 30.85 C ATOM 2574 C PRO A1086 -1.309 7.976 -31.170 1.00 34.43 C ATOM 2575 O PRO A1086 -1.873 8.591 -30.271 1.00 33.77 O ATOM 2576 CB PRO A1086 0.094 9.509 -32.538 1.00 33.02 C ATOM 2577 CG PRO A1086 -0.375 10.883 -32.195 1.00 37.17 C ATOM 2578 CD PRO A1086 -1.798 11.000 -32.612 1.00 32.64 C ATOM 2579 N SER A1087 -0.815 6.736 -31.018 1.00 30.36 N ATOM 2580 CA SER A1087 -0.925 6.077 -29.727 1.00 30.17 C ATOM 2581 C SER A1087 0.245 6.525 -28.886 1.00 31.52 C ATOM 2582 O SER A1087 1.198 7.115 -29.420 1.00 30.22 O ATOM 2583 CB SER A1087 -0.917 4.556 -29.887 1.00 34.75 C ATOM 2584 OG SER A1087 0.365 4.024 -30.179 1.00 43.99 O ATOM 2585 HG SER A1087 0.300 3.040 -30.270 1.00 0.00 H ATOM 2586 H SER A1087 -0.358 6.252 -31.817 1.00 0.00 H ATOM 2587 N PHE A1088 0.195 6.219 -27.582 1.00 27.38 N ATOM 2588 CA PHE A1088 1.284 6.498 -26.668 1.00 24.94 C ATOM 2589 C PHE A1088 2.527 5.670 -26.988 1.00 31.85 C ATOM 2590 O PHE A1088 3.633 6.223 -26.962 1.00 33.19 O ATOM 2591 CB PHE A1088 0.834 6.332 -25.219 1.00 25.56 C ATOM 2592 CG PHE A1088 -0.034 7.478 -24.735 1.00 25.12 C ATOM 2593 CD1 PHE A1088 0.488 8.764 -24.604 1.00 25.44 C ATOM 2594 CD2 PHE A1088 -1.373 7.268 -24.404 1.00 23.28 C ATOM 2595 CE1 PHE A1088 -0.312 9.813 -24.145 1.00 25.32 C ATOM 2596 CE2 PHE A1088 -2.161 8.313 -23.904 1.00 23.75 C ATOM 2597 CZ PHE A1088 -1.631 9.581 -23.792 1.00 21.78 C ATOM 2598 H PHE A1088 -0.662 5.762 -27.210 1.00 0.00 H ATOM 2599 N SER A1089 2.352 4.381 -27.381 1.00 28.76 N ATOM 2600 CA SER A1089 3.464 3.502 -27.759 1.00 28.34 C ATOM 2601 C SER A1089 4.128 4.014 -29.061 1.00 32.22 C ATOM 2602 O SER A1089 5.307 3.765 -29.276 1.00 30.77 O ATOM 2603 CB SER A1089 3.004 2.053 -27.889 1.00 31.27 C ATOM 2604 OG SER A1089 2.057 1.871 -28.934 1.00 37.96 O ATOM 2605 HG SER A1089 1.259 2.429 -28.755 1.00 0.00 H ATOM 2606 H SER A1089 1.385 4.000 -27.415 1.00 0.00 H ATOM 2607 N ALA A1090 3.361 4.752 -29.900 1.00 30.39 N ATOM 2608 CA ALA A1090 3.803 5.411 -31.140 1.00 30.94 C ATOM 2609 C ALA A1090 4.483 6.784 -30.854 1.00 37.39 C ATOM 2610 O ALA A1090 5.472 7.121 -31.515 1.00 36.72 O ATOM 2611 CB ALA A1090 2.629 5.597 -32.089 1.00 31.01 C ATOM 2612 H ALA A1090 2.360 4.864 -29.642 1.00 0.00 H ATOM 2613 N LEU A1091 3.968 7.544 -29.845 1.00 35.11 N ATOM 2614 CA LEU A1091 4.470 8.851 -29.371 1.00 34.81 C ATOM 2615 C LEU A1091 5.891 8.817 -28.720 1.00 38.63 C ATOM 2616 O LEU A1091 6.686 9.745 -28.913 1.00 37.98 O ATOM 2617 CB LEU A1091 3.461 9.456 -28.370 1.00 34.45 C ATOM 2618 CG LEU A1091 2.326 10.302 -28.942 1.00 39.07 C ATOM 2619 CD1 LEU A1091 1.178 10.424 -27.946 1.00 38.44 C ATOM 2620 CD2 LEU A1091 2.819 11.700 -29.333 1.00 44.06 C ATOM 2621 H LEU A1091 3.132 7.163 -29.357 1.00 0.00 H ATOM 2622 N GLY A1092 6.149 7.769 -27.934 1.00 33.84 N ATOM 2623 CA GLY A1092 7.386 7.514 -27.208 1.00 32.19 C ATOM 2624 C GLY A1092 8.694 7.538 -27.979 1.00 34.96 C ATOM 2625 O GLY A1092 9.589 8.277 -27.570 1.00 33.28 O ATOM 2626 H GLY A1092 5.391 7.064 -27.830 1.00 0.00 H ATOM 2627 N PRO A1093 8.876 6.746 -29.073 1.00 32.34 N ATOM 2628 CA PRO A1093 10.167 6.773 -29.810 1.00 32.15 C ATOM 2629 C PRO A1093 10.469 8.109 -30.497 1.00 36.50 C ATOM 2630 O PRO A1093 11.633 8.465 -30.679 1.00 36.86 O ATOM 2631 CB PRO A1093 10.034 5.639 -30.839 1.00 33.67 C ATOM 2632 CG PRO A1093 8.826 4.876 -30.462 1.00 38.33 C ATOM 2633 CD PRO A1093 7.926 5.802 -29.695 1.00 33.73 C ATOM 2634 N GLN A1094 9.409 8.841 -30.857 1.00 32.89 N ATOM 2635 CA GLN A1094 9.433 10.173 -31.485 1.00 31.80 C ATOM 2636 C GLN A1094 9.919 11.206 -30.472 1.00 36.12 C ATOM 2637 O GLN A1094 10.762 12.048 -30.800 1.00 34.37 O ATOM 2638 CB GLN A1094 8.032 10.545 -31.967 1.00 32.73 C ATOM 2639 CG GLN A1094 7.483 9.579 -33.003 1.00 42.13 C ATOM 2640 CD GLN A1094 6.151 10.055 -33.503 1.00 60.74 C ATOM 2641 OE1 GLN A1094 5.101 9.768 -32.911 1.00 56.78 O ATOM 2642 NE2 GLN A1094 6.169 10.825 -34.585 1.00 51.27 N ATOM 2643 HE22 GLN A1094 7.072 11.043 -35.053 1.00 0.00 H ATOM 2644 HE21 GLN A1094 5.280 11.210 -34.964 1.00 0.00 H ATOM 2645 H GLN A1094 8.472 8.427 -30.675 1.00 0.00 H ATOM 2646 N LEU A1095 9.434 11.103 -29.217 1.00 33.62 N ATOM 2647 CA LEU A1095 9.877 11.973 -28.120 1.00 32.55 C ATOM 2648 C LEU A1095 11.270 11.560 -27.677 1.00 35.56 C ATOM 2649 O LEU A1095 11.978 12.356 -27.059 1.00 32.14 O ATOM 2650 CB LEU A1095 8.930 11.847 -26.915 1.00 32.25 C ATOM 2651 CG LEU A1095 7.549 12.460 -27.067 1.00 36.36 C ATOM 2652 CD1 LEU A1095 6.582 11.806 -26.114 1.00 35.97 C ATOM 2653 CD2 LEU A1095 7.593 13.998 -26.928 1.00 39.19 C ATOM 2654 H LEU A1095 8.716 10.377 -29.018 1.00 0.00 H ATOM 2655 N ASP A1096 11.627 10.283 -27.927 1.00 34.35 N ATOM 2656 CA ASP A1096 12.912 9.711 -27.525 1.00 35.52 C ATOM 2657 C ASP A1096 14.016 9.918 -28.581 1.00 43.45 C ATOM 2658 O ASP A1096 15.194 9.809 -28.235 1.00 43.87 O ATOM 2659 CB ASP A1096 12.754 8.230 -27.105 1.00 36.13 C ATOM 2660 CG ASP A1096 12.231 8.063 -25.680 1.00 41.06 C ATOM 2661 OD1 ASP A1096 12.436 8.981 -24.859 1.00 37.20 O ATOM 2662 OD2 ASP A1096 11.672 6.984 -25.371 1.00 50.12 O ATOM 2663 H ASP A1096 10.953 9.673 -28.432 1.00 0.00 H ATOM 2664 N MET A1097 13.643 10.265 -29.833 1.00 42.85 N ATOM 2665 CA MET A1097 14.579 10.574 -30.919 1.00 44.30 C ATOM 2666 C MET A1097 15.109 12.009 -30.769 1.00 50.28 C ATOM 2667 O MET A1097 16.221 12.304 -31.214 1.00 49.68 O ATOM 2668 CB MET A1097 13.905 10.403 -32.288 1.00 47.13 C ATOM 2669 CG MET A1097 14.391 9.200 -33.052 1.00 51.18 C ATOM 2670 SD MET A1097 14.194 9.369 -34.850 1.00 55.75 S ATOM 2671 CE MET A1097 15.671 10.312 -35.267 1.00 52.17 C ATOM 2672 H MET A1097 12.625 10.316 -30.040 1.00 0.00 H ATOM 2673 N LEU A1098 14.311 12.896 -30.137 1.00 48.63 N ATOM 2674 CA LEU A1098 14.661 14.298 -29.871 1.00 49.27 C ATOM 2675 C LEU A1098 15.603 14.403 -28.643 1.00 57.05 C ATOM 2676 O LEU A1098 15.983 15.498 -28.215 1.00 57.21 O ATOM 2677 CB LEU A1098 13.377 15.149 -29.719 1.00 49.09 C ATOM 2678 CG LEU A1098 12.649 15.493 -31.033 1.00 53.10 C ATOM 2679 CD1 LEU A1098 11.143 15.337 -30.902 1.00 53.44 C ATOM 2680 CD2 LEU A1098 12.990 16.896 -31.504 1.00 55.28 C ATOM 2681 H LEU A1098 13.380 12.562 -29.815 1.00 0.00 H ATOM 2682 N TRP A1099 15.994 13.217 -28.125 1.00 55.99 N ATOM 2683 CA TRP A1099 16.914 12.876 -27.041 1.00 56.65 C ATOM 2684 C TRP A1099 16.414 13.254 -25.640 1.00 59.39 C ATOM 2685 O TRP A1099 15.413 13.960 -25.494 1.00 58.15 O ATOM 2686 CB TRP A1099 18.347 13.382 -27.289 1.00 56.12 C ATOM 2687 CG TRP A1099 19.266 12.289 -27.776 1.00 57.51 C ATOM 2688 CD1 TRP A1099 19.439 11.057 -27.215 1.00 60.41 C ATOM 2689 CD2 TRP A1099 20.138 12.334 -28.920 1.00 57.60 C ATOM 2690 NE1 TRP A1099 20.345 10.324 -27.947 1.00 59.92 N ATOM 2691 CE2 TRP A1099 20.803 11.087 -28.989 1.00 61.56 C ATOM 2692 CE3 TRP A1099 20.422 13.307 -29.894 1.00 58.90 C ATOM 2693 CZ2 TRP A1099 21.725 10.781 -30.000 1.00 60.99 C ATOM 2694 CZ3 TRP A1099 21.353 13.011 -30.881 1.00 60.39 C ATOM 2695 CH2 TRP A1099 21.986 11.759 -30.934 1.00 61.13 C ATOM 2696 HE1 TRP A1099 20.636 9.347 -27.742 1.00 0.00 H ATOM 2697 H TRP A1099 15.558 12.392 -28.584 1.00 0.00 H ATOM 2698 N SER A1100 17.100 12.690 -24.616 1.00 55.36 N ATOM 2699 CA SER A1100 16.831 12.804 -23.178 1.00 80.61 C ATOM 2700 C SER A1100 15.475 12.215 -22.823 1.00112.45 C ATOM 2701 O SER A1100 15.204 11.063 -23.160 1.00 74.90 O ATOM 2702 CB SER A1100 16.963 14.242 -22.685 1.00 83.79 C ATOM 2703 OG SER A1100 18.326 14.611 -22.565 1.00 92.21 O ATOM 2704 HG SER A1100 18.387 15.546 -22.244 1.00 0.00 H ATOM 2705 H SER A1100 17.917 12.105 -24.882 1.00 0.00 H TER 2706 SER A1100 HETATM 2707 O HOH 1 1.231 17.614 -36.976 1.00 30.42 O HETATM 2708 O HOH 2 13.571 28.833 -8.294 1.00 38.90 O HETATM 2709 O HOH 3 -9.596 10.992 -21.337 1.00 39.14 O HETATM 2710 O HOH 4 1.309 -4.492 -14.231 1.00 30.35 O HETATM 2711 O HOH 5 -8.156 17.355 -10.701 1.00 41.57 O HETATM 2712 O HOH 6 8.842 26.547 -25.379 1.00 29.08 O HETATM 2713 O HOH 7 3.916 14.467 13.304 1.00 37.20 O HETATM 2714 O HOH 8 0.541 -2.422 -5.219 1.00 31.88 O HETATM 2715 O HOH 9 -10.954 21.285 -25.212 1.00 43.46 O HETATM 2716 O HOH 10 8.904 21.972 -6.434 1.00 31.60 O HETATM 2717 O HOH 11 -0.340 -1.256 11.264 1.00 29.39 O HETATM 2718 O HOH 12 -9.808 15.893 -19.107 1.00 26.48 O HETATM 2719 O HOH 13 -4.651 9.235 -7.170 1.00 24.51 O HETATM 2720 O HOH 14 -9.075 3.215 -26.399 1.00 22.10 O HETATM 2721 O HOH 15 -17.260 29.368 -34.089 1.00123.30 O HETATM 2722 O HOH 16 -3.057 5.050 -22.816 1.00 12.38 O HETATM 2723 O HOH 17 4.925 -1.941 -23.857 1.00 29.10 O HETATM 2724 O HOH 18 -14.578 -1.589 -17.101 1.00 31.44 O HETATM 2725 O HOH 19 5.534 4.830 -24.753 1.00 74.09 O HETATM 2726 O HOH 20 8.606 7.595 -24.223 1.00 79.62 O HETATM 2727 O HOH 21 16.297 21.818 -9.971 1.00 33.25 O HETATM 2728 O HOH 22 -1.228 -8.788 -17.218 1.00 24.07 O HETATM 2729 O HOH 23 7.279 29.063 -23.933 1.00 25.29 O HETATM 2730 O HOH 24 0.717 27.591 -19.751 1.00 25.95 O HETATM 2731 O HOH 25 7.433 26.276 -33.565 1.00104.62 O HETATM 2732 O HOH 26 9.708 15.192 -4.841 1.00 23.80 O HETATM 2733 O HOH 27 -14.414 13.584 -31.760 1.00 27.47 O HETATM 2734 O HOH 28 -1.027 1.154 -24.347 1.00 26.01 O HETATM 2735 O HOH 29 16.890 9.357 -26.096 1.00 33.06 O HETATM 2736 O HOH 30 1.185 2.445 -7.562 1.00 36.44 O HETATM 2737 O HOH 31 13.081 24.841 -23.702 1.00 28.77 O HETATM 2738 O HOH 32 -12.743 21.604 -2.591 1.00 38.21 O HETATM 2739 O HOH 33 10.587 6.052 -8.075 1.00 44.39 O HETATM 2740 O HOH 34 3.226 2.669 -9.857 1.00 19.56 O HETATM 2741 O HOH 35 8.013 1.232 -14.657 1.00 45.21 O HETATM 2742 O HOH 36 -10.602 10.107 -3.743 1.00 54.28 O HETATM 2743 O HOH 37 5.642 32.942 -21.794 1.00 24.03 O HETATM 2744 O HOH 38 12.976 19.674 -6.596 1.00 37.65 O HETATM 2745 O HOH 39 6.153 29.746 -16.282 1.00 19.55 O HETATM 2746 O HOH 40 -6.836 -3.979 -6.692 1.00 23.27 O HETATM 2747 O HOH 41 -6.140 1.574 9.454 1.00 36.73 O HETATM 2748 O HOH 42 -11.116 6.109 -10.171 1.00 39.44 O HETATM 2749 O HOH 43 2.565 18.954 -3.090 1.00 32.47 O HETATM 2750 O HOH 44 -6.112 20.925 -27.396 1.00 27.76 O HETATM 2751 O HOH 45 -6.801 12.691 -19.701 1.00 19.68 O HETATM 2752 O HOH 46 -10.662 14.220 -23.103 1.00 52.55 O HETATM 2753 O HOH 47 -3.139 21.519 -4.495 1.00 39.38 O HETATM 2754 O HOH 48 -2.741 11.974 -6.377 1.00 40.27 O HETATM 2755 O HOH 49 6.846 8.315 0.555 1.00 18.20 O HETATM 2756 O HOH 50 1.562 -6.286 3.358 1.00 40.82 O HETATM 2757 O HOH 51 10.584 19.858 -2.249 1.00 45.55 O HETATM 2758 O HOH 52 10.262 -0.483 -12.569 1.00 66.52 O HETATM 2759 O HOH 53 -13.213 18.821 -4.780 1.00 49.33 O HETATM 2760 O HOH 54 -0.097 -6.940 -10.615 1.00 44.51 O HETATM 2761 O HOH 55 -11.200 4.063 -30.277 1.00 46.93 O HETATM 2762 O HOH 56 -14.647 7.257 -38.903 1.00 37.92 O HETATM 2763 O HOH 57 -7.244 15.887 -5.213 1.00 33.10 O HETATM 2764 O HOH 58 11.979 21.933 -5.632 1.00 20.35 O HETATM 2765 O HOH 59 -7.624 35.639 -21.151 1.00 39.11 O HETATM 2766 O HOH 60 -11.701 -3.048 9.515 1.00 30.59 O HETATM 2767 O HOH 61 -0.496 4.538 -33.392 1.00 21.47 O HETATM 2768 O HOH 62 6.343 29.562 -31.699 1.00 31.90 O HETATM 2769 O HOH 63 -2.527 14.568 14.262 1.00 29.99 O HETATM 2770 O HOH 64 -18.293 32.064 -25.015 1.00 45.37 O HETATM 2771 O HOH 65 21.088 18.739 -19.462 1.00 55.33 O HETATM 2772 O HOH 66 -17.952 18.154 -20.339 1.00 24.49 O HETATM 2773 O HOH 67 -5.311 27.334 -35.670 1.00 34.20 O HETATM 2774 O HOH 68 -0.551 25.687 -18.265 1.00 30.74 O HETATM 2775 O HOH 69 -7.863 1.493 11.541 1.00 23.35 O HETATM 2776 O HOH 70 20.069 18.681 -22.092 1.00 27.90 O HETATM 2777 O HOH 71 -8.971 24.578 -40.286 1.00 36.53 O HETATM 2778 O HOH 72 7.198 5.327 2.358 1.00 37.79 O HETATM 2779 O HOH 73 -6.297 31.977 -17.261 1.00 42.59 O HETATM 2780 O HOH 74 11.089 25.291 -25.653 1.00 29.66 O HETATM 2781 O HOH 75 -5.458 18.184 -5.981 1.00 32.62 O HETATM 2782 O HOH 76 11.562 6.158 8.247 1.00 37.76 O HETATM 2783 O HOH 77 -19.662 -6.913 -20.999 1.00 34.47 O HETATM 2784 O HOH 78 19.258 11.911 -33.487 1.00 27.40 O HETATM 2785 O HOH 79 20.723 7.208 -30.170 1.00 25.46 O HETATM 2786 O HOH 80 -25.571 16.013 -28.190 1.00 38.27 O HETATM 2787 O HOH 81 5.666 1.178 -7.772 1.00 20.59 O HETATM 2788 O HOH 82 -20.135 6.467 -15.754 1.00 29.42 O HETATM 2789 O HOH 83 5.202 -0.579 -29.104 1.00 28.25 O HETATM 2790 O HOH 84 -13.756 2.057 -29.521 1.00 34.85 O HETATM 2791 O HOH 85 10.314 6.774 21.569 1.00 24.63 O HETATM 2792 O HOH 86 8.223 4.831 -25.186 1.00 37.32 O HETATM 2793 O HOH 87 11.263 5.650 0.236 1.00 34.24 O HETATM 2794 O HOH 88 -9.914 27.291 -39.403 1.00 21.76 O HETATM 2795 O HOH 89 -21.642 20.889 -30.229 1.00 26.74 O HETATM 2796 O HOH 90 -6.275 24.335 -8.229 1.00 33.53 O HETATM 2797 O HOH 91 -9.320 14.343 -41.590 1.00 27.05 O HETATM 2798 O HOH 92 -2.842 3.940 -25.533 1.00 19.25 O HETATM 2799 O HOH 93 3.840 -2.181 -1.439 1.00 21.41 O HETATM 2800 O HOH 94 -15.491 16.210 -33.701 1.00 44.79 O HETATM 2801 O HOH 95 11.585 2.893 -0.572 1.00 22.62 O HETATM 2802 O HOH 96 -2.407 19.556 -38.407 1.00 29.09 O HETATM 2803 O HOH 97 0.843 29.617 -6.455 1.00 37.51 O HETATM 2804 O HOH 98 -23.350 1.251 -1.142 1.00 50.05 O HETATM 2805 O HOH 99 -10.990 29.781 -39.495 1.00 34.88 O HETATM 2806 O HOH 100 -1.332 0.956 -33.855 1.00 24.97 O HETATM 2807 O HOH 101 -24.395 4.175 -18.513 1.00 34.96 O HETATM 2808 O HOH 102 -13.336 30.935 -40.264 1.00 27.30 O HETATM 2809 O HOH 103 10.720 4.997 -34.369 1.00 45.58 O HETATM 2810 O HOH 104 6.711 16.931 -43.470 1.00 30.71 O HETATM 2811 O HOH 105 -0.851 35.666 -11.616 1.00 25.42 O HETATM 2812 O HOH 106 -15.881 37.583 -23.802 1.00 46.02 O HETATM 2813 O HOH 107 -13.358 -6.900 -1.783 1.00 43.15 O HETATM 2814 O HOH 108 -15.278 28.591 -42.328 1.00 34.62 O HETATM 2815 O HOH 109 12.237 5.592 4.489 1.00 49.26 O HETATM 2816 O HOH 110 14.799 5.965 7.389 1.00 32.50 O HETATM 2817 O HOH 111 -21.304 -3.385 -2.711 1.00 32.07 O HETATM 2818 O HOH 112 5.587 11.924 -41.449 1.00 48.53 O HETATM 2819 O HOH 113 -23.233 41.066 -29.897 1.00 56.80 O HETATM 2820 O HOH 114 -26.133 22.715 -34.514 1.00 35.26 O HETATM 2821 O HOH 115 -20.701 40.111 -29.773 1.00 44.56 O HETATM 2822 O HOH 116 20.560 14.335 -37.597 1.00 25.90 O HETATM 2823 O HOH 117 16.137 0.318 -5.855 1.00 27.10 O HETATM 2824 O HOH 118 1.261 9.161 -42.029 1.00 44.29 O HETATM 2825 O HOH 119 22.673 15.081 -35.842 1.00 26.49 O HETATM 2826 O HOH 120 -26.601 0.829 5.216 1.00 31.68 O HETATM 2827 O HOH 121 -2.054 27.488 -42.937 1.00 39.94 O HETATM 2828 O HOH 122 17.772 6.314 5.932 1.00 49.38 O HETATM 2829 O HOH 123 7.804 0.400 -37.076 1.00 25.45 O HETATM 2830 O HOH 124 -26.451 -2.648 2.675 1.00 38.75 O HETATM 2831 O HOH 125 -20.779 41.731 -33.438 1.00 38.12 O HETATM 2832 N3 UNN A 126 3.170 14.033 -3.123 1.00 -0.26 N HETATM 2833 C14 UNN A 126 2.020 13.431 -3.473 1.00 0.15 C HETATM 2834 N2 UNN A 126 1.769 12.088 -3.516 1.00 -0.26 N HETATM 2835 C13 UNN A 126 0.480 11.872 -3.930 1.00 0.03 C HETATM 2836 C12 UNN A 126 -0.143 13.053 -4.153 1.00 -0.05 C HETATM 2837 C11 UNN A 126 0.818 14.082 -3.852 1.00 0.03 C HETATM 2838 C10 UNN A 126 0.907 15.498 -3.806 1.00 0.05 C HETATM 2839 C8 UNN A 126 -0.203 16.395 -4.224 1.00 -0.01 C HETATM 2840 C7 UNN A 126 -1.530 16.051 -3.970 1.00 -0.06 C HETATM 2841 C6 UNN A 126 -2.567 16.865 -4.392 1.00 -0.07 C HETATM 2842 C5 UNN A 126 -2.295 18.053 -5.053 1.00 -0.04 C HETATM 2843 C4 UNN A 126 -0.975 18.428 -5.293 1.00 0.07 C HETATM 2844 C9 UNN A 126 0.064 17.588 -4.901 1.00 -0.03 C HETATM 2845 H4 UNN A 126 1.089 17.862 -5.123 1.00 0.05 H HETATM 2846 N1 UNN A 126 -0.694 19.702 -5.833 1.00 -0.23 N HETATM 2847 C3 UNN A 126 -1.282 20.290 -6.900 1.00 0.20 C HETATM 2848 C2 UNN A 126 -0.782 21.684 -7.192 1.00 0.04 C HETATM 2849 C1 UNN A 126 0.729 21.737 -7.296 1.00 -0.05 C HETATM 2850 H6 UNN A 126 1.046 22.769 -7.509 1.00 0.03 H HETATM 2851 H7 UNN A 126 1.064 21.076 -8.108 1.00 0.03 H HETATM 2852 H8 UNN A 126 1.174 21.405 -6.346 1.00 0.03 H HETATM 2853 H9 UNN A 126 -1.215 22.024 -8.144 1.00 0.05 H HETATM 2854 H10 UNN A 126 -1.106 22.354 -6.382 1.00 0.05 H HETATM 2855 O1 UNN A 126 -2.149 19.752 -7.594 1.00 -0.39 O HETATM 2856 H11 UNN A 126 0.021 20.230 -5.375 1.00 0.23 H HETATM 2857 H12 UNN A 126 -3.108 18.689 -5.383 1.00 0.05 H HETATM 2858 H3 UNN A 126 -3.594 16.573 -4.205 1.00 0.06 H HETATM 2859 H2 UNN A 126 -1.752 15.135 -3.435 1.00 0.05 H HETATM 2860 N4 UNN A 126 2.031 16.127 -3.423 1.00 -0.28 N HETATM 2861 C15 UNN A 126 3.078 15.364 -3.108 1.00 0.07 C HETATM 2862 H14 UNN A 126 3.971 15.895 -2.799 1.00 0.10 H HETATM 2863 H13 UNN A 126 -1.168 13.196 -4.493 1.00 0.03 H HETATM 2864 H5 UNN A 126 0.023 10.892 -4.061 1.00 0.10 H HETATM 2865 H1 UNN A 126 2.446 11.350 -3.274 1.00 0.23 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 422 423 426 427 428 CONECT 426 422 CONECT 427 422 CONECT 428 422 CONECT 2179 2180 2184 2185 2186 CONECT 2184 2179 CONECT 2185 2179 CONECT 2186 2179 CONECT 2832 2833 2861 CONECT 2833 2832 2834 2837 CONECT 2834 2833 2835 2865 CONECT 2835 2834 2836 2864 CONECT 2836 2835 2837 2863 CONECT 2837 2833 2836 2838 CONECT 2838 2837 2839 2860 CONECT 2839 2838 2840 2844 CONECT 2840 2839 2841 2859 CONECT 2841 2840 2842 2858 CONECT 2842 2841 2843 2857 CONECT 2843 2842 2844 2846 CONECT 2844 2839 2843 2845 CONECT 2845 2844 CONECT 2846 2843 2847 2856 CONECT 2847 2846 2848 2855 CONECT 2848 2847 2849 2853 2854 CONECT 2849 2848 2850 2851 2852 CONECT 2850 2849 CONECT 2851 2849 CONECT 2852 2849 CONECT 2853 2848 CONECT 2854 2848 CONECT 2855 2847 CONECT 2856 2846 CONECT 2857 2842 CONECT 2858 2841 CONECT 2859 2840 CONECT 2860 2838 2861 CONECT 2861 2832 2860 2862 CONECT 2862 2861 CONECT 2863 2836 CONECT 2864 2835 CONECT 2865 2834 MASTER 0 0 0 0 0 0 0 0 2862 3 45 23 END
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Related entries of code: 5ttv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3lxk
RCSB PDB
PDBbind
327aa, >3LXK_1|Chain... *
3lxl
RCSB PDB
PDBbind
327aa, >3LXL_1|Chain... at 100%
3pjc
RCSB PDB
PDBbind
315aa, >3PJC_1|Chain... at 99%
3zc6
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PDBbind
288aa, >3ZC6_1|Chains... at 99%
3zep
RCSB PDB
PDBbind
288aa, >3ZEP_1|Chains... at 99%
4hvd
RCSB PDB
PDBbind
314aa, >4HVD_1|Chain... at 99%
4hvg
RCSB PDB
PDBbind
314aa, >4HVG_1|Chain... at 99%
4hvh
RCSB PDB
PDBbind
314aa, >4HVH_1|Chain... at 99%
4hvi
RCSB PDB
PDBbind
314aa, >4HVI_1|Chain... at 99%
4i6q
RCSB PDB
PDBbind
314aa, >4I6Q_1|Chain... at 99%
4qps
RCSB PDB
PDBbind
293aa, >4QPS_1|Chains... at 99%
4qt1
RCSB PDB
PDBbind
314aa, >4QT1_1|Chain... at 99%
4rio
RCSB PDB
PDBbind
293aa, >4RIO_1|Chain... at 98%
4z16
RCSB PDB
PDBbind
316aa, >4Z16_1|Chains... at 98%
5lwm
RCSB PDB
PDBbind
294aa, >5LWM_1|Chain... at 98%
5lwn
RCSB PDB
PDBbind
294aa, >5LWN_1|Chain... at 98%
5toz
RCSB PDB
PDBbind
321aa, >5TOZ_1|Chain... at 100%
5tts
RCSB PDB
PDBbind
321aa, >5TTS_1|Chain... at 100%
5ttu
RCSB PDB
PDBbind
321aa, >5TTU_1|Chain... at 100%
5vo6
RCSB PDB
PDBbind
293aa, >5VO6_1|Chain... at 98%
5w86
RCSB PDB
PDBbind
287aa, >5W86_1|Chains... at 99%
5wfj
RCSB PDB
PDBbind
293aa, >5WFJ_1|Chain... at 98%
6aak
RCSB PDB
PDBbind
287aa, >6AAK_1|Chains... at 99%
6da4
RCSB PDB
PDBbind
321aa, >6DA4_1|Chain... at 100%
6db3
RCSB PDB
PDBbind
321aa, >6DB3_1|Chain... at 100%
6db4
RCSB PDB
PDBbind
321aa, >6DB4_1|Chain... at 100%
6dud
RCSB PDB
PDBbind
321aa, >6DUD_1|Chain... at 100%
6gl9
RCSB PDB
PDBbind
294aa, >6GL9_1|Chains... at 98%
6gla
RCSB PDB
PDBbind
294aa, >6GLA_1|Chains... at 98%
6glb
RCSB PDB
PDBbind
294aa, >6GLB_1|Chains... at 98%
6ny4
RCSB PDB
PDBbind
293aa, >6NY4_1|Chain... at 98%
6hzv
RCSB PDB
PDBbind
285aa, >6HZV_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5ttv
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK3
Ligand Name
7KX
EC.Number
E.C.-.-.-.-
Resolution
1.93(Å)
Affinity (Kd/Ki/IC50)
IC50=29nM
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
5
H
1
4
N
4
O
Molecular Weight
266.298
Exact Mass
266.117
No. of atoms
34
No. of bonds
36
Polar Surface Area
70.67
LOGP Value
1.97 (
Computed with XLOGP3
)
3.05 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 3
Canonical SMILES
CCC(=O)Nc1cccc(c1)c1ncnc2c1cc[nH]2
InChI String
InChI=1S/C15H14N4O/c1-2-13(20)19-11-5-3-4-10(8-11)14-12-6-7-16-15(12)18-9-17-14/h3-9H,2H2,1H3,(H,19,20)(H,16,17,18)
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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