Browse entries in the PDBbind-CN Database
HEADER 6CVX_COMPLEX COMPND 6CVX_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 63 GLY SER HIS MET ALA SER MET LYS LYS LYS GLY SER VAL SEQRES 2 A 63 VAL ILE VAL GLY ARG ILE ASN LEU SER GLY ASP THR ALA SEQRES 3 A 63 TYR ALA GLN GLN THR ARG GLY GLU GLU GLY CYS GLN GLU SEQRES 4 A 63 THR SER GLN THR GLY ARG ASP LYS ASN GLN VAL GLU GLY SEQRES 5 A 63 GLU VAL GLN ILE VAL SER THR ALA THR GLN THR SEQRES 1 A 5 PHE LEU ALA THR SER SEQRES 1 A 75 ILE ASN GLY VAL LEU TRP THR VAL TYR HIS GLY ALA GLY SEQRES 2 A 75 THR ARG THR ILE ALA SER PRO LYS GLY PRO VAL THR GLN SEQRES 3 A 75 MET TYR THR ASN VAL ASP LYS ASP LEU VAL GLY TRP GLN SEQRES 4 A 75 ALA PRO GLN GLY SER ARG SER LEU THR PRO CYS THR CYS SEQRES 5 A 75 GLY SER SER ASP LEU TYR LEU VAL THR ARG HIS ALA ASP SEQRES 6 A 75 VAL ILE PRO VAL ARG ARG ARG GLY ASP SER SEQRES 1 A 57 ARG GLY SER LEU LEU SER PRO ARG PRO ILE SER TYR LEU SEQRES 2 A 57 LYS GLY SER SER GLY GLY PRO LEU LEU CYS PRO ALA GLY SEQRES 3 A 57 HIS ALA VAL GLY ILE PHE ARG ALA ALA VAL CYS THR ARG SEQRES 4 A 57 GLY VAL ALA LYS ALA VAL ASP PHE ILE PRO VAL GLU SER SEQRES 5 A 57 LEU GLU THR THR MET HET ZN A 1 1 HET FH A 4 109 ATOM 1 N GLY A 980 1.312 -23.788 -4.826 1.00 16.37 N ATOM 2 CA GLY A 980 2.193 -23.930 -5.942 1.00 29.36 C ATOM 3 C GLY A 980 2.885 -25.283 -5.887 1.00 30.68 C ATOM 4 O GLY A 980 2.987 -25.897 -4.834 1.00 30.27 O ATOM 5 HN3 GLY A 980 1.858 -23.859 -3.944 1.00 0.00 H ATOM 6 HN2 GLY A 980 0.596 -24.541 -4.853 1.00 0.00 H ATOM 7 HN1 GLY A 980 0.843 -22.861 -4.872 1.00 0.00 H ATOM 8 N SER A 981 3.363 -25.769 -7.024 1.00 27.79 N ATOM 9 CA SER A 981 4.094 -27.017 -7.027 1.00 24.44 C ATOM 10 C SER A 981 5.605 -26.813 -7.011 1.00 21.41 C ATOM 11 O SER A 981 6.337 -27.801 -6.885 1.00 24.73 O ATOM 12 CB SER A 981 3.706 -27.852 -8.254 1.00 26.75 C ATOM 13 OG SER A 981 4.276 -27.223 -9.412 1.00 33.87 O ATOM 14 HG SER A 981 4.039 -27.744 -10.220 1.00 0.00 H ATOM 15 H SER A 981 3.212 -25.253 -7.914 1.00 0.00 H ATOM 16 N HIS A 982 6.073 -25.575 -7.121 1.00 19.40 N ATOM 17 CA HIS A 982 7.497 -25.272 -7.230 1.00 23.40 C ATOM 18 C HIS A 982 7.986 -24.760 -5.880 1.00 22.31 C ATOM 19 O HIS A 982 7.931 -23.555 -5.577 1.00 20.01 O ATOM 20 CB HIS A 982 7.783 -24.239 -8.334 1.00 23.87 C ATOM 21 CG HIS A 982 9.263 -23.997 -8.531 1.00 26.87 C ATOM 22 ND1 HIS A 982 9.895 -22.839 -8.128 1.00 21.07 N ATOM 23 CD2 HIS A 982 10.241 -24.805 -9.019 1.00 25.72 C ATOM 24 CE1 HIS A 982 11.185 -22.923 -8.387 1.00 26.17 C ATOM 25 NE2 HIS A 982 11.425 -24.111 -8.929 1.00 23.75 N ATOM 26 H HIS A 982 5.395 -24.786 -7.130 1.00 0.00 H ATOM 27 N MET A 983 8.502 -25.674 -5.061 1.00 23.03 N ATOM 28 CA MET A 983 8.780 -25.331 -3.686 1.00 20.72 C ATOM 29 C MET A 983 9.889 -24.295 -3.596 1.00 18.11 C ATOM 30 O MET A 983 9.862 -23.455 -2.705 1.00 23.39 O ATOM 31 CB MET A 983 9.129 -26.597 -2.885 1.00 29.52 C ATOM 32 CG MET A 983 7.923 -27.539 -2.649 1.00 21.96 C ATOM 33 SD MET A 983 6.522 -26.769 -1.748 1.00 24.97 S ATOM 34 CE MET A 983 5.385 -26.583 -3.120 1.00 28.48 C ATOM 35 H MET A 983 8.704 -26.632 -5.410 1.00 0.00 H ATOM 36 N ALA A 984 10.850 -24.320 -4.519 1.00 20.70 N ATOM 37 CA ALA A 984 11.981 -23.425 -4.336 1.00 20.58 C ATOM 38 C ALA A 984 11.573 -21.974 -4.393 1.00 20.76 C ATOM 39 O ALA A 984 12.317 -21.111 -3.912 1.00 23.10 O ATOM 40 CB ALA A 984 13.046 -23.679 -5.383 1.00 18.48 C ATOM 41 H ALA A 984 10.793 -24.956 -5.340 1.00 0.00 H ATOM 42 N SER A 985 10.432 -21.666 -5.001 1.00 18.04 N ATOM 43 CA SER A 985 10.006 -20.262 -5.117 1.00 21.88 C ATOM 44 C SER A 985 8.824 -19.959 -4.217 1.00 23.31 C ATOM 45 O SER A 985 8.212 -18.885 -4.327 1.00 21.24 O ATOM 46 CB SER A 985 9.669 -19.939 -6.580 1.00 23.62 C ATOM 47 OG SER A 985 8.564 -20.695 -7.012 1.00 21.55 O ATOM 48 HG SER A 985 8.775 -21.659 -6.936 1.00 0.00 H ATOM 49 H SER A 985 9.837 -22.421 -5.397 1.00 0.00 H ATOM 50 N MET A 986 8.477 -20.887 -3.318 1.00 20.61 N ATOM 51 CA MET A 986 7.400 -20.611 -2.389 1.00 20.00 C ATOM 52 C MET A 986 7.872 -19.551 -1.395 1.00 20.64 C ATOM 53 O MET A 986 9.004 -19.591 -0.884 1.00 23.58 O ATOM 54 CB MET A 986 6.963 -21.900 -1.666 1.00 17.54 C ATOM 55 CG MET A 986 6.155 -22.837 -2.622 1.00 18.75 C ATOM 56 SD MET A 986 4.469 -22.284 -3.021 1.00 22.98 S ATOM 57 CE MET A 986 3.701 -22.783 -1.473 1.00 21.75 C ATOM 58 H MET A 986 8.976 -21.799 -3.286 1.00 0.00 H ATOM 59 N LYS A 987 7.001 -18.590 -1.153 1.00 20.58 N ATOM 60 CA LYS A 987 7.299 -17.504 -0.251 1.00 17.31 C ATOM 61 C LYS A 987 7.010 -17.905 1.195 1.00 21.34 C ATOM 62 O LYS A 987 6.398 -18.926 1.481 1.00 16.81 O ATOM 63 CB LYS A 987 6.452 -16.308 -0.615 1.00 20.82 C ATOM 64 CG LYS A 987 6.596 -15.771 -2.040 1.00 30.06 C ATOM 65 CD LYS A 987 5.614 -14.613 -2.226 1.00 30.28 C ATOM 66 CE LYS A 987 5.341 -14.251 -3.693 1.00 39.88 C ATOM 67 NZ LYS A 987 3.892 -13.872 -3.890 1.00 45.13 N ATOM 68 HZ1 LYS A 987 3.286 -14.674 -3.623 1.00 0.00 H ATOM 69 HZ2 LYS A 987 3.665 -13.051 -3.293 1.00 0.00 H ATOM 70 HZ3 LYS A 987 3.731 -13.631 -4.889 1.00 0.00 H ATOM 71 H LYS A 987 6.075 -18.616 -1.625 1.00 0.00 H ATOM 72 N LYS A 988 7.436 -17.065 2.102 1.00 22.19 N ATOM 73 CA LYS A 988 7.273 -17.239 3.536 1.00 22.43 C ATOM 74 C LYS A 988 6.531 -16.013 4.039 1.00 23.19 C ATOM 75 O LYS A 988 6.831 -14.916 3.631 1.00 17.76 O ATOM 76 CB LYS A 988 8.667 -17.393 4.182 1.00 25.73 C ATOM 77 CG LYS A 988 8.731 -17.503 5.643 1.00 27.73 C ATOM 78 CD LYS A 988 8.067 -18.782 6.146 1.00 27.28 C ATOM 79 CE LYS A 988 8.168 -18.848 7.655 1.00 33.70 C ATOM 80 NZ LYS A 988 7.485 -20.008 8.148 1.00 21.39 N ATOM 81 HZ1 LYS A 988 6.482 -19.960 7.876 1.00 0.00 H ATOM 82 HZ2 LYS A 988 7.916 -20.862 7.740 1.00 0.00 H ATOM 83 HZ3 LYS A 988 7.563 -20.040 9.185 1.00 0.00 H ATOM 84 H LYS A 988 7.928 -16.209 1.773 1.00 0.00 H ATOM 85 N LYS A 989 5.552 -16.194 4.918 1.00 19.61 N ATOM 86 CA LYS A 989 4.924 -15.037 5.527 1.00 21.12 C ATOM 87 C LYS A 989 5.915 -14.365 6.492 1.00 16.20 C ATOM 88 O LYS A 989 6.774 -15.026 7.108 1.00 19.59 O ATOM 89 CB LYS A 989 3.626 -15.427 6.236 1.00 26.24 C ATOM 90 CG LYS A 989 2.428 -15.429 5.254 1.00 19.56 C ATOM 91 CD LYS A 989 1.138 -15.689 5.894 1.00 18.59 C ATOM 92 CE LYS A 989 0.032 -15.807 4.877 1.00 24.63 C ATOM 93 NZ LYS A 989 -1.325 -16.035 5.469 1.00 26.47 N ATOM 94 HZ1 LYS A 989 -1.319 -16.919 6.018 1.00 0.00 H ATOM 95 HZ2 LYS A 989 -1.568 -15.240 6.094 1.00 0.00 H ATOM 96 HZ3 LYS A 989 -2.028 -16.105 4.705 1.00 0.00 H ATOM 97 H LYS A 989 5.239 -17.154 5.167 1.00 0.00 H ATOM 98 N GLY A 990 5.806 -13.062 6.582 1.00 16.96 N ATOM 99 CA GLY A 990 6.648 -12.328 7.492 1.00 14.06 C ATOM 100 C GLY A 990 6.165 -12.461 8.921 1.00 14.30 C ATOM 101 O GLY A 990 5.142 -13.084 9.183 1.00 14.97 O ATOM 102 H GLY A 990 5.111 -12.557 5.996 1.00 0.00 H ATOM 103 N SER A 991 6.946 -11.902 9.817 1.00 13.73 N ATOM 104 CA SER A 991 6.627 -11.862 11.233 1.00 9.07 C ATOM 105 C SER A 991 5.644 -10.744 11.538 1.00 9.92 C ATOM 106 O SER A 991 5.624 -9.699 10.870 1.00 10.13 O ATOM 107 CB SER A 991 7.904 -11.684 12.031 1.00 11.56 C ATOM 108 OG SER A 991 8.759 -12.827 12.006 1.00 13.00 O ATOM 109 HG SER A 991 9.570 -12.643 12.544 1.00 0.00 H ATOM 110 H SER A 991 7.835 -11.467 9.497 1.00 0.00 H ATOM 111 N VAL A 992 4.871 -10.922 12.613 1.00 7.97 N ATOM 112 CA VAL A 992 4.221 -9.773 13.246 1.00 8.21 C ATOM 113 C VAL A 992 5.307 -8.842 13.805 1.00 8.59 C ATOM 114 O VAL A 992 6.327 -9.300 14.323 1.00 9.20 O ATOM 115 CB VAL A 992 3.281 -10.247 14.376 1.00 6.99 C ATOM 116 CG1 VAL A 992 2.723 -9.110 15.147 1.00 11.19 C ATOM 117 CG2 VAL A 992 2.207 -11.164 13.808 1.00 7.62 C ATOM 118 H VAL A 992 4.731 -11.877 13.000 1.00 0.00 H ATOM 119 N VAL A 993 5.089 -7.536 13.684 1.00 7.34 N ATOM 120 CA VAL A 993 6.027 -6.509 14.114 1.00 7.43 C ATOM 121 C VAL A 993 5.356 -5.529 15.061 1.00 7.29 C ATOM 122 O VAL A 993 4.301 -4.984 14.751 1.00 8.19 O ATOM 123 CB VAL A 993 6.606 -5.744 12.901 1.00 9.45 C ATOM 124 CG1 VAL A 993 7.631 -4.701 13.348 1.00 12.57 C ATOM 125 CG2 VAL A 993 7.260 -6.751 11.910 1.00 10.79 C ATOM 126 H VAL A 993 4.193 -7.229 13.255 1.00 0.00 H ATOM 127 N ILE A 994 6.023 -5.240 16.188 1.00 6.33 N ATOM 128 CA ILE A 994 5.593 -4.168 17.072 1.00 7.43 C ATOM 129 C ILE A 994 5.944 -2.828 16.448 1.00 10.36 C ATOM 130 O ILE A 994 7.109 -2.562 16.150 1.00 11.44 O ATOM 131 CB ILE A 994 6.226 -4.314 18.473 1.00 9.39 C ATOM 132 CG1 ILE A 994 5.713 -5.557 19.151 1.00 10.11 C ATOM 133 CG2 ILE A 994 5.975 -3.033 19.285 1.00 9.81 C ATOM 134 CD1 ILE A 994 6.513 -6.001 20.340 1.00 13.70 C ATOM 135 H ILE A 994 6.867 -5.795 16.436 1.00 0.00 H ATOM 136 N VAL A 995 4.932 -2.004 16.192 1.00 7.61 N ATOM 137 CA VAL A 995 5.133 -0.710 15.558 1.00 9.69 C ATOM 138 C VAL A 995 4.822 0.467 16.480 1.00 10.74 C ATOM 139 O VAL A 995 5.005 1.610 16.079 1.00 10.28 O ATOM 140 CB VAL A 995 4.329 -0.587 14.262 1.00 10.24 C ATOM 141 CG1 VAL A 995 4.777 -1.603 13.281 1.00 11.63 C ATOM 142 CG2 VAL A 995 2.895 -0.681 14.498 1.00 11.36 C ATOM 143 H VAL A 995 3.968 -2.293 16.453 1.00 0.00 H ATOM 144 N GLY A 996 4.342 0.222 17.689 1.00 7.95 N ATOM 145 CA GLY A 996 4.123 1.305 18.622 1.00 7.85 C ATOM 146 C GLY A 996 3.471 0.767 19.851 1.00 7.39 C ATOM 147 O GLY A 996 3.477 -0.461 20.090 1.00 7.04 O ATOM 148 H GLY A 996 4.121 -0.755 17.970 1.00 0.00 H ATOM 149 N ARG A 997 2.914 1.679 20.664 1.00 6.99 N ATOM 150 CA ARG A 997 2.315 1.230 21.914 1.00 7.71 C ATOM 151 C ARG A 997 1.210 2.175 22.332 1.00 8.42 C ATOM 152 O ARG A 997 1.129 3.313 21.858 1.00 8.19 O ATOM 153 CB ARG A 997 3.365 1.109 22.997 1.00 11.21 C ATOM 154 CG ARG A 997 3.818 2.466 23.477 1.00 12.50 C ATOM 155 CD ARG A 997 4.830 2.371 24.621 1.00 12.13 C ATOM 156 NE ARG A 997 6.065 1.857 24.104 1.00 13.89 N ATOM 157 CZ ARG A 997 7.083 2.594 23.691 1.00 17.00 C ATOM 158 NH1 ARG A 997 7.033 3.926 23.729 1.00 18.85 N ATOM 159 NH2 ARG A 997 8.132 1.989 23.209 1.00 13.22 N ATOM 160 HE ARG A 997 6.168 0.824 24.049 1.00 0.00 H ATOM 161 HH12 ARG A 997 7.845 4.486 23.399 1.00 0.00 H ATOM 162 HH11 ARG A 997 6.182 4.404 24.088 1.00 0.00 H ATOM 163 HH22 ARG A 997 8.946 2.545 22.877 1.00 0.00 H ATOM 164 HH21 ARG A 997 8.155 0.951 23.156 1.00 0.00 H ATOM 165 H ARG A 997 2.910 2.687 20.406 1.00 0.00 H ATOM 166 N ILE A 998 0.346 1.688 23.234 1.00 8.54 N ATOM 167 CA ILE A 998 -0.603 2.570 23.900 1.00 9.26 C ATOM 168 C ILE A 998 -0.018 2.879 25.264 1.00 12.03 C ATOM 169 O ILE A 998 0.075 2.014 26.151 1.00 10.58 O ATOM 170 CB ILE A 998 -1.995 1.967 24.013 1.00 9.41 C ATOM 171 CG1 ILE A 998 -2.487 1.455 22.662 1.00 10.06 C ATOM 172 CG2 ILE A 998 -2.988 3.027 24.549 1.00 11.16 C ATOM 173 CD1 ILE A 998 -2.559 2.536 21.603 1.00 12.48 C ATOM 174 H ILE A 998 0.353 0.673 23.460 1.00 0.00 H ATOM 175 N ASN A 999 0.357 4.136 25.458 1.00 11.33 N ATOM 176 CA ASN A 999 1.021 4.565 26.687 1.00 10.32 C ATOM 177 C ASN A 999 -0.029 4.826 27.752 1.00 12.63 C ATOM 178 O ASN A 999 -0.893 5.712 27.602 1.00 11.36 O ATOM 179 CB ASN A 999 1.889 5.813 26.435 1.00 10.58 C ATOM 180 CG ASN A 999 2.860 6.059 27.546 1.00 16.20 C ATOM 181 OD1 ASN A 999 2.451 6.164 28.692 1.00 16.86 O ATOM 182 ND2 ASN A 999 4.149 6.153 27.232 1.00 17.53 N ATOM 183 HD22 ASN A 999 4.451 6.057 26.242 1.00 0.00 H ATOM 184 HD21 ASN A 999 4.855 6.323 27.977 1.00 0.00 H ATOM 185 H ASN A 999 0.173 4.838 24.713 1.00 0.00 H ATOM 186 N LEU A1000 0.051 4.037 28.820 1.00 13.00 N ATOM 187 CA LEU A1000 -0.873 4.145 29.930 1.00 12.02 C ATOM 188 C LEU A1000 -0.123 4.451 31.241 1.00 16.82 C ATOM 189 O LEU A1000 -0.653 4.206 32.315 1.00 17.61 O ATOM 190 CB LEU A1000 -1.662 2.845 30.087 1.00 12.61 C ATOM 191 CG LEU A1000 -2.476 2.387 28.872 1.00 15.17 C ATOM 192 CD1 LEU A1000 -3.061 1.019 29.112 1.00 14.85 C ATOM 193 CD2 LEU A1000 -3.588 3.386 28.598 1.00 11.73 C ATOM 194 H LEU A1000 0.802 3.319 28.859 1.00 0.00 H ATOM 195 N SER A1001 1.108 4.948 31.151 1.00 17.38 N ATOM 196 CA SER A1001 1.948 5.044 32.333 1.00 22.14 C ATOM 197 C SER A1001 1.686 6.301 33.140 1.00 24.14 C ATOM 198 O SER A1001 2.002 6.316 34.338 1.00 21.73 O ATOM 199 CB SER A1001 3.427 4.958 31.937 1.00 19.65 C ATOM 200 OG SER A1001 3.863 6.081 31.193 1.00 29.00 O ATOM 201 HG SER A1001 3.331 6.151 30.361 1.00 0.00 H ATOM 202 H SER A1001 1.471 5.269 30.231 1.00 0.00 H ATOM 203 N GLY A1002 1.087 7.325 32.540 1.00 19.35 N ATOM 204 CA GLY A1002 0.888 8.578 33.236 1.00 21.10 C ATOM 205 C GLY A1002 -0.576 8.849 33.473 1.00 20.56 C ATOM 206 O GLY A1002 -1.343 7.909 33.730 1.00 22.27 O ATOM 207 H GLY A1002 0.758 7.224 31.559 1.00 0.00 H ATOM 208 N ASP A1003 -0.971 10.123 33.428 1.00 17.86 N ATOM 209 CA ASP A1003 -2.347 10.533 33.621 1.00 19.21 C ATOM 210 C ASP A1003 -3.154 10.624 32.342 1.00 18.55 C ATOM 211 O ASP A1003 -4.384 10.747 32.409 1.00 18.96 O ATOM 212 CB ASP A1003 -2.400 11.891 34.347 1.00 28.05 C ATOM 213 CG ASP A1003 -1.698 13.017 33.594 1.00 37.24 C ATOM 214 OD1 ASP A1003 -1.095 12.797 32.501 1.00 32.90 O ATOM 215 OD2 ASP A1003 -1.768 14.166 34.114 1.00 43.33 O ATOM 216 H ASP A1003 -0.257 10.857 33.246 1.00 0.00 H ATOM 217 N THR A1004 -2.506 10.485 31.177 1.00 17.29 N ATOM 218 CA THR A1004 -3.143 10.614 29.878 1.00 16.88 C ATOM 219 C THR A1004 -2.807 9.382 29.052 1.00 14.27 C ATOM 220 O THR A1004 -1.683 8.912 29.102 1.00 15.95 O ATOM 221 CB THR A1004 -2.672 11.889 29.167 1.00 23.49 C ATOM 222 OG1 THR A1004 -2.972 13.021 30.010 1.00 22.43 O ATOM 223 CG2 THR A1004 -3.382 12.056 27.842 1.00 21.16 C ATOM 224 HG1 THR A1004 -2.500 12.922 30.874 1.00 0.00 H ATOM 225 H THR A1004 -1.488 10.273 31.205 1.00 0.00 H ATOM 226 N ALA A1005 -3.806 8.782 28.431 1.00 12.11 N ATOM 227 CA ALA A1005 -3.554 7.638 27.566 1.00 12.98 C ATOM 228 C ALA A1005 -3.272 8.191 26.182 1.00 10.01 C ATOM 229 O ALA A1005 -4.028 9.044 25.715 1.00 11.04 O ATOM 230 CB ALA A1005 -4.761 6.715 27.502 1.00 13.25 C ATOM 231 H ALA A1005 -4.778 9.128 28.560 1.00 0.00 H ATOM 232 N TYR A1006 -2.211 7.709 25.527 1.00 11.15 N ATOM 233 CA TYR A1006 -1.957 8.143 24.179 1.00 9.86 C ATOM 234 C TYR A1006 -1.189 7.090 23.425 1.00 9.61 C ATOM 235 O TYR A1006 -0.340 6.398 23.973 1.00 9.20 O ATOM 236 CB TYR A1006 -1.212 9.488 24.116 1.00 10.06 C ATOM 237 CG TYR A1006 0.163 9.517 24.781 1.00 11.09 C ATOM 238 CD1 TYR A1006 0.294 9.540 26.140 1.00 12.42 C ATOM 239 CD2 TYR A1006 1.316 9.582 24.011 1.00 11.72 C ATOM 240 CE1 TYR A1006 1.559 9.597 26.747 1.00 15.45 C ATOM 241 CE2 TYR A1006 2.574 9.622 24.577 1.00 15.80 C ATOM 242 CZ TYR A1006 2.691 9.684 25.966 1.00 16.88 C ATOM 243 OH TYR A1006 3.948 9.731 26.533 1.00 16.23 O ATOM 244 HH TYR A1006 3.863 9.772 27.518 1.00 0.00 H ATOM 245 H TYR A1006 -1.575 7.027 25.987 1.00 0.00 H ATOM 246 N ALA A1007 -1.466 7.058 22.117 1.00 7.06 N ATOM 247 CA ALA A1007 -0.715 6.209 21.192 1.00 9.11 C ATOM 248 C ALA A1007 0.646 6.799 20.836 1.00 8.40 C ATOM 249 O ALA A1007 0.801 8.018 20.660 1.00 8.23 O ATOM 250 CB ALA A1007 -1.517 6.014 19.911 1.00 8.18 C ATOM 251 H ALA A1007 -2.235 7.652 21.748 1.00 0.00 H ATOM 252 N GLN A1008 1.631 5.907 20.733 1.00 5.16 N ATOM 253 CA GLN A1008 2.976 6.239 20.264 1.00 7.94 C ATOM 254 C GLN A1008 3.359 5.303 19.134 1.00 8.40 C ATOM 255 O GLN A1008 3.167 4.068 19.234 1.00 8.30 O ATOM 256 CB GLN A1008 4.019 6.108 21.388 1.00 7.30 C ATOM 257 CG GLN A1008 3.768 6.956 22.558 1.00 9.54 C ATOM 258 CD GLN A1008 4.720 6.681 23.691 1.00 13.70 C ATOM 259 OE1 GLN A1008 4.613 5.635 24.352 1.00 13.41 O ATOM 260 NE2 GLN A1008 5.615 7.608 23.953 1.00 14.21 N ATOM 261 HE22 GLN A1008 5.662 8.466 23.367 1.00 0.00 H ATOM 262 HE21 GLN A1008 6.276 7.483 24.746 1.00 0.00 H ATOM 263 H GLN A1008 1.432 4.922 21.001 1.00 0.00 H ATOM 264 N GLN A1009 3.928 5.859 18.050 1.00 6.13 N ATOM 265 CA GLN A1009 4.514 5.020 17.017 1.00 6.77 C ATOM 266 C GLN A1009 6.003 4.914 17.270 1.00 8.30 C ATOM 267 O GLN A1009 6.669 5.917 17.581 1.00 8.27 O ATOM 268 CB GLN A1009 4.248 5.567 15.608 1.00 8.19 C ATOM 269 CG GLN A1009 4.686 4.545 14.571 1.00 9.13 C ATOM 270 CD GLN A1009 4.384 4.973 13.172 1.00 10.17 C ATOM 271 OE1 GLN A1009 3.399 4.548 12.520 1.00 12.16 O ATOM 272 NE2 GLN A1009 5.267 5.814 12.662 1.00 8.42 N ATOM 273 HE22 GLN A1009 6.068 6.140 13.239 1.00 0.00 H ATOM 274 HE21 GLN A1009 5.160 6.150 11.683 1.00 0.00 H ATOM 275 H GLN A1009 3.949 6.894 17.950 1.00 0.00 H ATOM 276 N THR A1010 6.523 3.701 17.199 1.00 8.12 N ATOM 277 CA THR A1010 7.944 3.454 17.397 1.00 6.50 C ATOM 278 C THR A1010 8.652 2.971 16.126 1.00 10.87 C ATOM 279 O THR A1010 9.880 2.983 16.097 1.00 12.44 O ATOM 280 CB THR A1010 8.157 2.449 18.529 1.00 9.48 C ATOM 281 OG1 THR A1010 7.453 1.248 18.234 1.00 10.75 O ATOM 282 CG2 THR A1010 7.615 2.995 19.813 1.00 12.81 C ATOM 283 HG1 THR A1010 7.591 0.597 18.967 1.00 0.00 H ATOM 284 H THR A1010 5.896 2.896 16.995 1.00 0.00 H ATOM 285 N ARG A1011 7.923 2.593 15.101 1.00 10.69 N ATOM 286 CA ARG A1011 8.481 2.179 13.811 1.00 11.96 C ATOM 287 C ARG A1011 7.556 2.539 12.671 1.00 11.44 C ATOM 288 O ARG A1011 6.350 2.298 12.732 1.00 11.78 O ATOM 289 CB ARG A1011 8.756 0.662 13.818 1.00 15.89 C ATOM 290 CG ARG A1011 9.659 0.253 12.695 1.00 24.28 C ATOM 291 CD ARG A1011 9.852 -1.240 12.728 1.00 22.29 C ATOM 292 NE ARG A1011 10.856 -1.732 13.649 1.00 22.87 N ATOM 293 CZ ARG A1011 12.169 -1.651 13.458 1.00 24.43 C ATOM 294 NH1 ARG A1011 12.687 -1.017 12.394 1.00 20.77 N ATOM 295 NH2 ARG A1011 12.965 -2.214 14.328 1.00 21.14 N ATOM 296 HE ARG A1011 10.525 -2.183 14.526 1.00 0.00 H ATOM 297 HH12 ARG A1011 13.718 -0.969 12.269 1.00 0.00 H ATOM 298 HH11 ARG A1011 12.057 -0.574 11.695 1.00 0.00 H ATOM 299 HH22 ARG A1011 13.996 -2.163 14.199 1.00 0.00 H ATOM 300 HH21 ARG A1011 12.568 -2.713 15.150 1.00 0.00 H ATOM 301 H ARG A1011 6.889 2.587 15.211 1.00 0.00 H ATOM 302 N GLY A1012 8.144 3.171 11.586 1.00 13.30 N ATOM 303 CA GLY A1012 7.370 3.515 10.421 1.00 13.85 C ATOM 304 C GLY A1012 7.221 2.364 9.401 1.00 23.73 C ATOM 305 O GLY A1012 7.822 1.289 9.520 1.00 22.86 O ATOM 306 H GLY A1012 9.158 3.400 11.614 1.00 0.00 H ATOM 307 N GLU A1013 6.377 2.621 8.387 1.00 27.22 N ATOM 308 CA GLU A1013 5.832 1.549 7.551 1.00 26.97 C ATOM 309 C GLU A1013 6.938 0.808 6.810 1.00 27.89 C ATOM 310 O GLU A1013 6.860 -0.432 6.630 1.00 27.85 O ATOM 311 CB GLU A1013 4.784 2.106 6.566 1.00 25.71 C ATOM 312 H GLU A1013 6.104 3.605 8.191 1.00 0.00 H ATOM 313 N GLU A1014 7.986 1.530 6.408 1.00 29.05 N ATOM 314 CA GLU A1014 9.081 0.917 5.674 1.00 29.55 C ATOM 315 C GLU A1014 9.887 -0.009 6.562 1.00 34.19 C ATOM 316 O GLU A1014 10.169 -1.167 6.190 1.00 30.48 O ATOM 317 CB GLU A1014 9.992 1.983 5.071 1.00 33.43 C ATOM 318 H GLU A1014 8.020 2.547 6.623 1.00 0.00 H ATOM 319 N GLY A1015 10.320 0.498 7.724 1.00 26.43 N ATOM 320 CA GLY A1015 11.113 -0.316 8.632 1.00 22.56 C ATOM 321 C GLY A1015 10.316 -1.484 9.211 1.00 20.43 C ATOM 322 O GLY A1015 10.892 -2.527 9.550 1.00 21.56 O ATOM 323 H GLY A1015 10.088 1.479 7.978 1.00 0.00 H ATOM 324 N CYS A1016 9.003 -1.325 9.332 1.00 19.93 N ATOM 325 CA CYS A1016 8.138 -2.465 9.638 1.00 20.83 C ATOM 326 C CYS A1016 8.262 -3.554 8.573 1.00 21.47 C ATOM 327 O CYS A1016 8.431 -4.746 8.885 1.00 18.19 O ATOM 328 CB CYS A1016 6.703 -2.001 9.716 1.00 17.91 C ATOM 329 SG CYS A1016 5.464 -3.238 10.074 1.00 17.33 S ATOM 330 H CYS A1016 8.585 -0.381 9.208 1.00 0.00 H ATOM 331 N GLN A1017 8.138 -3.157 7.302 1.00 23.96 N ATOM 332 CA GLN A1017 8.255 -4.112 6.195 1.00 23.54 C ATOM 333 C GLN A1017 9.554 -4.893 6.292 1.00 23.20 C ATOM 334 O GLN A1017 9.558 -6.135 6.179 1.00 22.23 O ATOM 335 CB GLN A1017 8.141 -3.361 4.862 1.00 24.22 C ATOM 336 H GLN A1017 7.956 -2.154 7.095 1.00 0.00 H ATOM 337 N GLU A1018 10.680 -4.202 6.503 1.00 20.92 N ATOM 338 CA GLU A1018 11.972 -4.873 6.581 1.00 21.76 C ATOM 339 C GLU A1018 12.051 -5.798 7.790 1.00 24.29 C ATOM 340 O GLU A1018 12.660 -6.882 7.729 1.00 22.10 O ATOM 341 CB GLU A1018 13.108 -3.853 6.627 1.00 22.96 C ATOM 342 H GLU A1018 10.633 -3.169 6.613 1.00 0.00 H ATOM 343 N THR A1019 11.508 -5.354 8.929 1.00 20.44 N ATOM 344 CA THR A1019 11.564 -6.147 10.157 1.00 17.86 C ATOM 345 C THR A1019 10.683 -7.382 10.025 1.00 15.73 C ATOM 346 O THR A1019 10.988 -8.429 10.592 1.00 16.05 O ATOM 347 CB THR A1019 11.112 -5.269 11.337 1.00 18.71 C ATOM 348 OG1 THR A1019 11.928 -4.076 11.372 1.00 20.25 O ATOM 349 CG2 THR A1019 11.225 -5.987 12.637 1.00 15.21 C ATOM 350 HG1 THR A1019 11.820 -3.578 10.523 1.00 0.00 H ATOM 351 H THR A1019 11.037 -4.427 8.942 1.00 0.00 H ATOM 352 N SER A1020 9.599 -7.262 9.294 1.00 14.74 N ATOM 353 CA SER A1020 8.705 -8.396 9.086 1.00 17.09 C ATOM 354 C SER A1020 9.388 -9.498 8.289 1.00 18.99 C ATOM 355 O SER A1020 9.208 -10.685 8.575 1.00 13.88 O ATOM 356 CB SER A1020 7.458 -7.890 8.389 1.00 16.92 C ATOM 357 OG SER A1020 6.484 -8.921 8.241 1.00 20.63 O ATOM 358 HG SER A1020 6.227 -9.261 9.134 1.00 0.00 H ATOM 359 H SER A1020 9.374 -6.345 8.857 1.00 0.00 H ATOM 360 N GLN A1021 10.211 -9.119 7.295 1.00 18.31 N ATOM 361 CA GLN A1021 10.881 -10.115 6.473 1.00 20.25 C ATOM 362 C GLN A1021 12.032 -10.758 7.207 1.00 18.81 C ATOM 363 O GLN A1021 12.235 -11.968 7.113 1.00 22.27 O ATOM 364 CB GLN A1021 11.346 -9.460 5.146 1.00 18.77 C ATOM 365 H GLN A1021 10.369 -8.107 7.113 1.00 0.00 H ATOM 366 N THR A1022 12.784 -9.994 7.982 1.00 19.36 N ATOM 367 CA THR A1022 13.914 -10.540 8.693 1.00 16.19 C ATOM 368 C THR A1022 13.532 -11.196 10.005 1.00 19.18 C ATOM 369 O THR A1022 14.237 -12.088 10.471 1.00 19.32 O ATOM 370 CB THR A1022 14.984 -9.473 8.995 1.00 24.13 C ATOM 371 OG1 THR A1022 14.497 -8.578 10.011 1.00 22.00 O ATOM 372 CG2 THR A1022 15.330 -8.693 7.714 1.00 27.09 C ATOM 373 HG1 THR A1022 15.186 -7.893 10.204 1.00 0.00 H ATOM 374 H THR A1022 12.557 -8.984 8.080 1.00 0.00 H ATOM 375 N GLY A1023 12.451 -10.735 10.644 1.00 15.86 N ATOM 376 CA GLY A1023 12.168 -11.189 11.989 1.00 14.13 C ATOM 377 C GLY A1023 13.069 -10.646 13.069 1.00 16.57 C ATOM 378 O GLY A1023 13.011 -11.107 14.215 1.00 14.48 O ATOM 379 H GLY A1023 11.818 -10.055 10.177 1.00 0.00 H ATOM 380 N ARG A1024 13.889 -9.649 12.745 1.00 16.01 N ATOM 381 CA ARG A1024 14.900 -9.131 13.632 1.00 14.64 C ATOM 382 C ARG A1024 14.510 -7.710 14.019 1.00 14.32 C ATOM 383 O ARG A1024 14.555 -6.814 13.186 1.00 18.20 O ATOM 384 CB ARG A1024 16.278 -9.144 12.951 1.00 19.46 C ATOM 385 H ARG A1024 13.795 -9.221 11.802 1.00 0.00 H ATOM 386 N ASP A1025 14.076 -7.533 15.257 1.00 15.97 N ATOM 387 CA ASP A1025 13.577 -6.255 15.733 1.00 16.76 C ATOM 388 C ASP A1025 14.392 -5.876 16.952 1.00 18.97 C ATOM 389 O ASP A1025 14.237 -6.454 18.026 1.00 18.34 O ATOM 390 CB ASP A1025 12.096 -6.333 16.073 1.00 18.13 C ATOM 391 CG ASP A1025 11.543 -4.996 16.562 1.00 21.79 C ATOM 392 OD1 ASP A1025 12.303 -3.970 16.601 1.00 19.78 O ATOM 393 OD2 ASP A1025 10.356 -4.985 16.877 1.00 19.78 O ATOM 394 H ASP A1025 14.093 -8.340 15.913 1.00 0.00 H ATOM 395 N LYS A1026 15.267 -4.905 16.780 1.00 19.49 N ATOM 396 CA LYS A1026 16.098 -4.438 17.885 1.00 19.41 C ATOM 397 C LYS A1026 15.515 -3.234 18.608 1.00 19.88 C ATOM 398 O LYS A1026 16.190 -2.685 19.486 1.00 17.62 O ATOM 399 CB LYS A1026 17.498 -4.074 17.346 1.00 22.20 C ATOM 400 H LYS A1026 15.367 -4.465 15.843 1.00 0.00 H ATOM 401 N ASN A1027 14.298 -2.792 18.259 1.00 15.36 N ATOM 402 CA ASN A1027 13.777 -1.599 18.903 1.00 15.40 C ATOM 403 C ASN A1027 13.394 -1.875 20.328 1.00 18.54 C ATOM 404 O ASN A1027 12.987 -2.973 20.681 1.00 21.29 O ATOM 405 CB ASN A1027 12.558 -1.055 18.146 1.00 18.97 C ATOM 406 CG ASN A1027 12.936 -0.097 17.022 1.00 28.96 C ATOM 407 OD1 ASN A1027 14.119 0.015 16.641 1.00 26.00 O ATOM 408 ND2 ASN A1027 11.938 0.548 16.434 1.00 27.73 N ATOM 409 HD22 ASN A1027 10.965 0.428 16.781 1.00 0.00 H ATOM 410 HD21 ASN A1027 12.128 1.174 15.625 1.00 0.00 H ATOM 411 H ASN A1027 13.738 -3.294 17.541 1.00 0.00 H ATOM 412 N GLN A1028 13.539 -0.856 21.183 1.00 17.46 N ATOM 413 CA GLN A1028 13.162 -0.969 22.575 1.00 17.56 C ATOM 414 C GLN A1028 11.642 -1.058 22.692 1.00 19.04 C ATOM 415 O GLN A1028 10.900 -0.303 22.025 1.00 16.79 O ATOM 416 CB GLN A1028 13.665 0.256 23.356 1.00 19.11 C ATOM 417 H GLN A1028 13.934 0.042 20.837 1.00 0.00 H ATOM 418 N VAL A1029 11.194 -2.006 23.519 1.00 15.00 N ATOM 419 CA VAL A1029 9.767 -2.227 23.783 1.00 13.78 C ATOM 420 C VAL A1029 9.491 -1.764 25.195 1.00 12.74 C ATOM 421 O VAL A1029 10.281 -2.017 26.101 1.00 12.64 O ATOM 422 CB VAL A1029 9.376 -3.714 23.637 1.00 13.70 C ATOM 423 CG1 VAL A1029 7.942 -3.926 24.112 1.00 11.21 C ATOM 424 CG2 VAL A1029 9.557 -4.123 22.161 1.00 15.05 C ATOM 425 H VAL A1029 11.888 -2.615 23.998 1.00 0.00 H ATOM 426 N GLU A1030 8.367 -1.095 25.388 1.00 11.63 N ATOM 427 CA GLU A1030 7.961 -0.630 26.712 1.00 10.91 C ATOM 428 C GLU A1030 6.466 -0.847 26.813 1.00 9.48 C ATOM 429 O GLU A1030 5.767 -0.848 25.788 1.00 10.92 O ATOM 430 CB GLU A1030 8.288 0.847 26.920 1.00 16.06 C ATOM 431 CG GLU A1030 9.750 1.168 26.748 1.00 16.19 C ATOM 432 CD GLU A1030 10.075 2.621 26.982 1.00 25.84 C ATOM 433 OE1 GLU A1030 9.266 3.281 27.614 1.00 27.18 O ATOM 434 OE2 GLU A1030 11.137 3.079 26.525 1.00 37.28 O ATOM 435 H GLU A1030 7.753 -0.894 24.573 1.00 0.00 H ATOM 436 N GLY A1031 5.987 -1.071 28.022 1.00 10.52 N ATOM 437 CA GLY A1031 4.557 -0.979 28.269 1.00 13.24 C ATOM 438 C GLY A1031 3.819 -2.290 28.077 1.00 11.87 C ATOM 439 O GLY A1031 4.389 -3.324 27.748 1.00 9.82 O ATOM 440 H GLY A1031 6.633 -1.314 28.800 1.00 0.00 H ATOM 441 N GLU A1032 2.511 -2.217 28.313 1.00 11.70 N ATOM 442 CA GLU A1032 1.644 -3.400 28.354 1.00 9.42 C ATOM 443 C GLU A1032 0.915 -3.659 27.054 1.00 8.23 C ATOM 444 O GLU A1032 0.654 -4.825 26.708 1.00 8.84 O ATOM 445 CB GLU A1032 0.562 -3.211 29.407 1.00 13.12 C ATOM 446 CG GLU A1032 1.066 -3.054 30.854 1.00 17.25 C ATOM 447 CD GLU A1032 1.192 -1.627 31.270 1.00 28.95 C ATOM 448 OE1 GLU A1032 1.114 -0.712 30.403 1.00 18.93 O ATOM 449 OE2 GLU A1032 1.367 -1.438 32.494 1.00 40.73 O ATOM 450 H GLU A1032 2.086 -1.282 28.475 1.00 0.00 H ATOM 451 N VAL A1033 0.550 -2.599 26.355 1.00 7.18 N ATOM 452 CA VAL A1033 -0.278 -2.707 25.162 1.00 7.35 C ATOM 453 C VAL A1033 0.533 -2.254 23.970 1.00 7.40 C ATOM 454 O VAL A1033 0.875 -1.076 23.861 1.00 9.22 O ATOM 455 CB VAL A1033 -1.555 -1.857 25.284 1.00 8.13 C ATOM 456 CG1 VAL A1033 -2.362 -2.051 24.040 1.00 7.05 C ATOM 457 CG2 VAL A1033 -2.358 -2.304 26.549 1.00 8.23 C ATOM 458 H VAL A1033 0.864 -1.658 26.667 1.00 0.00 H ATOM 459 N GLN A1034 0.792 -3.185 23.037 1.00 6.36 N ATOM 460 CA GLN A1034 1.564 -2.908 21.833 1.00 7.01 C ATOM 461 C GLN A1034 0.641 -2.760 20.644 1.00 7.20 C ATOM 462 O GLN A1034 -0.408 -3.397 20.565 1.00 7.74 O ATOM 463 CB GLN A1034 2.551 -4.020 21.531 1.00 7.56 C ATOM 464 CG GLN A1034 3.396 -4.404 22.722 1.00 8.73 C ATOM 465 CD GLN A1034 4.223 -3.261 23.246 1.00 10.21 C ATOM 466 OE1 GLN A1034 4.822 -2.497 22.468 1.00 9.49 O ATOM 467 NE2 GLN A1034 4.241 -3.115 24.546 1.00 9.99 N ATOM 468 HE22 GLN A1034 3.722 -3.783 25.152 1.00 0.00 H ATOM 469 HE21 GLN A1034 4.774 -2.331 24.974 1.00 0.00 H ATOM 470 H GLN A1034 0.425 -4.147 23.181 1.00 0.00 H ATOM 471 N ILE A1035 1.028 -1.897 19.735 1.00 6.22 N ATOM 472 CA ILE A1035 0.427 -1.837 18.405 1.00 7.00 C ATOM 473 C ILE A1035 1.277 -2.708 17.492 1.00 7.32 C ATOM 474 O ILE A1035 2.504 -2.522 17.423 1.00 6.38 O ATOM 475 CB ILE A1035 0.381 -0.396 17.885 1.00 5.50 C ATOM 476 CG1 ILE A1035 -0.351 0.511 18.895 1.00 6.51 C ATOM 477 CG2 ILE A1035 -0.323 -0.358 16.592 1.00 8.17 C ATOM 478 CD1 ILE A1035 -0.231 2.037 18.494 1.00 7.65 C ATOM 479 H ILE A1035 1.791 -1.231 19.970 1.00 0.00 H ATOM 480 N VAL A1036 0.652 -3.667 16.812 1.00 7.27 N ATOM 481 CA VAL A1036 1.394 -4.608 15.979 1.00 6.90 C ATOM 482 C VAL A1036 0.862 -4.570 14.540 1.00 8.17 C ATOM 483 O VAL A1036 -0.268 -4.135 14.279 1.00 8.10 O ATOM 484 CB VAL A1036 1.312 -6.045 16.540 1.00 7.89 C ATOM 485 CG1 VAL A1036 1.948 -6.069 17.943 1.00 8.83 C ATOM 486 CG2 VAL A1036 -0.087 -6.522 16.649 1.00 7.67 C ATOM 487 H VAL A1036 -0.383 -3.747 16.876 1.00 0.00 H ATOM 488 N SER A1037 1.702 -5.022 13.617 1.00 8.16 N ATOM 489 CA SER A1037 1.342 -5.053 12.208 1.00 8.24 C ATOM 490 C SER A1037 1.932 -6.256 11.516 1.00 9.96 C ATOM 491 O SER A1037 3.005 -6.746 11.873 1.00 8.54 O ATOM 492 CB SER A1037 1.795 -3.808 11.466 1.00 10.90 C ATOM 493 OG SER A1037 1.172 -2.606 12.026 1.00 15.31 O ATOM 494 HG SER A1037 1.483 -1.811 11.526 1.00 0.00 H ATOM 495 H SER A1037 2.641 -5.362 13.908 1.00 0.00 H ATOM 496 N THR A1038 1.203 -6.708 10.511 1.00 8.44 N ATOM 497 CA THR A1038 1.716 -7.582 9.453 1.00 10.08 C ATOM 498 C THR A1038 1.804 -6.769 8.165 1.00 10.79 C ATOM 499 O THR A1038 1.594 -5.545 8.136 1.00 10.73 O ATOM 500 CB THR A1038 0.810 -8.775 9.275 1.00 9.49 C ATOM 501 OG1 THR A1038 -0.444 -8.319 8.751 1.00 10.84 O ATOM 502 CG2 THR A1038 0.519 -9.486 10.583 1.00 11.02 C ATOM 503 HG1 THR A1038 -1.050 -9.092 8.629 1.00 0.00 H ATOM 504 H THR A1038 0.203 -6.426 10.468 1.00 0.00 H ATOM 505 N ALA A1039 2.052 -7.475 7.061 1.00 12.98 N ATOM 506 CA ALA A1039 2.081 -6.754 5.796 1.00 16.89 C ATOM 507 C ALA A1039 0.720 -6.193 5.417 1.00 16.40 C ATOM 508 O ALA A1039 0.656 -5.239 4.642 1.00 16.45 O ATOM 509 CB ALA A1039 2.561 -7.707 4.694 1.00 17.30 C ATOM 510 H ALA A1039 2.218 -8.501 7.102 1.00 0.00 H ATOM 511 N THR A1040 -0.367 -6.775 5.939 1.00 13.99 N ATOM 512 CA THR A1040 -1.698 -6.473 5.470 1.00 11.83 C ATOM 513 C THR A1040 -2.659 -6.003 6.557 1.00 14.19 C ATOM 514 O THR A1040 -3.737 -5.523 6.209 1.00 13.66 O ATOM 515 CB THR A1040 -2.289 -7.729 4.817 1.00 16.67 C ATOM 516 OG1 THR A1040 -2.146 -8.813 5.739 1.00 17.66 O ATOM 517 CG2 THR A1040 -1.560 -8.028 3.532 1.00 17.29 C ATOM 518 HG1 THR A1040 -2.521 -9.637 5.339 1.00 0.00 H ATOM 519 H THR A1040 -0.248 -7.467 6.707 1.00 0.00 H ATOM 520 N GLN A1041 -2.301 -6.107 7.836 1.00 11.18 N ATOM 521 CA GLN A1041 -3.225 -5.737 8.908 1.00 10.89 C ATOM 522 C GLN A1041 -2.471 -5.044 10.048 1.00 10.24 C ATOM 523 O GLN A1041 -1.263 -5.200 10.227 1.00 7.97 O ATOM 524 CB GLN A1041 -3.940 -7.024 9.455 1.00 11.87 C ATOM 525 CG GLN A1041 -4.778 -7.788 8.437 1.00 13.12 C ATOM 526 CD GLN A1041 -5.655 -8.913 9.009 1.00 21.20 C ATOM 527 OE1 GLN A1041 -5.160 -9.942 9.455 1.00 26.08 O ATOM 528 NE2 GLN A1041 -6.974 -8.731 8.953 1.00 24.56 N ATOM 529 HE22 GLN A1041 -7.361 -7.846 8.568 1.00 0.00 H ATOM 530 HE21 GLN A1041 -7.616 -9.474 9.294 1.00 0.00 H ATOM 531 H GLN A1041 -1.351 -6.456 8.076 1.00 0.00 H ATOM 532 N THR A1042 -3.216 -4.284 10.856 1.00 8.39 N ATOM 533 HN3 THR A1042 -2.852 -3.310 10.846 1.00 0.00 H ATOM 534 HN2 THR A1042 -3.172 -4.662 11.824 1.00 0.00 H ATOM 535 HN1 THR A1042 -4.202 -4.291 10.525 1.00 0.00 H TER 536 THR A1042 ATOM 537 N PHE A1043 -3.267 -4.150 14.380 1.00 7.97 N ATOM 538 CA PHE A1043 -4.121 -4.497 15.509 1.00 5.83 C ATOM 539 C PHE A1043 -3.274 -4.316 16.759 1.00 8.22 C ATOM 540 O PHE A1043 -2.238 -3.648 16.730 1.00 7.77 O ATOM 541 CB PHE A1043 -4.764 -5.872 15.328 1.00 7.39 C ATOM 542 CG PHE A1043 -3.795 -6.953 14.903 1.00 6.45 C ATOM 543 CD1 PHE A1043 -3.362 -7.066 13.606 1.00 8.18 C ATOM 544 CD2 PHE A1043 -3.320 -7.883 15.853 1.00 6.55 C ATOM 545 CE1 PHE A1043 -2.467 -8.094 13.214 1.00 8.11 C ATOM 546 CE2 PHE A1043 -2.439 -8.865 15.504 1.00 7.57 C ATOM 547 CZ PHE A1043 -1.981 -8.977 14.189 1.00 7.80 C ATOM 548 H PHE A1043 -2.238 -4.135 14.532 1.00 0.00 H ATOM 549 N LEU A1044 -3.752 -4.823 17.880 1.00 6.81 N ATOM 550 CA LEU A1044 -3.075 -4.641 19.179 1.00 5.79 C ATOM 551 C LEU A1044 -2.624 -5.987 19.720 1.00 6.52 C ATOM 552 O LEU A1044 -3.140 -7.035 19.334 1.00 6.41 O ATOM 553 CB LEU A1044 -4.023 -3.987 20.171 1.00 7.73 C ATOM 554 CG LEU A1044 -4.502 -2.590 19.809 1.00 6.11 C ATOM 555 CD1 LEU A1044 -5.452 -2.084 20.873 1.00 6.62 C ATOM 556 CD2 LEU A1044 -3.292 -1.639 19.665 1.00 6.12 C ATOM 557 H LEU A1044 -4.636 -5.370 17.847 1.00 0.00 H ATOM 558 N ALA A1045 -1.758 -5.933 20.721 1.00 5.23 N ATOM 559 CA ALA A1045 -1.323 -7.116 21.465 1.00 7.66 C ATOM 560 C ALA A1045 -1.029 -6.680 22.894 1.00 8.06 C ATOM 561 O ALA A1045 -0.541 -5.574 23.114 1.00 7.49 O ATOM 562 CB ALA A1045 -0.100 -7.740 20.800 1.00 7.96 C ATOM 563 H ALA A1045 -1.369 -5.007 20.991 1.00 0.00 H ATOM 564 N THR A1046 -1.392 -7.512 23.866 1.00 5.83 N ATOM 565 CA THR A1046 -1.445 -7.128 25.288 1.00 6.23 C ATOM 566 C THR A1046 -0.680 -8.134 26.119 1.00 8.08 C ATOM 567 O THR A1046 -0.936 -9.353 26.019 1.00 7.33 O ATOM 568 CB THR A1046 -2.889 -7.109 25.814 1.00 6.80 C ATOM 569 OG1 THR A1046 -3.607 -6.111 25.116 1.00 9.42 O ATOM 570 CG2 THR A1046 -2.946 -6.762 27.271 1.00 8.84 C ATOM 571 HG1 THR A1046 -3.602 -6.319 24.148 1.00 0.00 H ATOM 572 H THR A1046 -1.652 -8.486 23.609 1.00 0.00 H ATOM 573 N SER A1047 0.209 -7.648 26.984 1.00 6.91 N ATOM 574 HN3 SER A1047 1.144 -8.057 26.785 1.00 0.00 H ATOM 575 HN2 SER A1047 -0.080 -7.896 27.952 1.00 0.00 H ATOM 576 HN1 SER A1047 0.254 -6.613 26.888 1.00 0.00 H TER 577 SER A1047 ATOM 578 N ILE A1048 0.013 -10.133 29.446 1.00 7.38 N ATOM 579 CA ILE A1048 -0.590 -10.584 30.688 1.00 6.73 C ATOM 580 C ILE A1048 0.205 -11.823 31.132 1.00 9.43 C ATOM 581 O ILE A1048 0.386 -12.756 30.337 1.00 8.56 O ATOM 582 CB ILE A1048 -2.075 -10.942 30.521 1.00 7.05 C ATOM 583 CG1 ILE A1048 -2.823 -9.773 29.890 1.00 9.54 C ATOM 584 CG2 ILE A1048 -2.655 -11.412 31.863 1.00 8.42 C ATOM 585 CD1 ILE A1048 -4.209 -10.135 29.366 1.00 8.78 C ATOM 586 H ILE A1048 0.300 -10.854 28.754 1.00 0.00 H ATOM 587 N ASN A1049 0.617 -11.857 32.387 1.00 9.58 N ATOM 588 CA ASN A1049 1.338 -13.023 32.908 1.00 10.80 C ATOM 589 C ASN A1049 2.580 -13.357 32.065 1.00 10.66 C ATOM 590 O ASN A1049 2.915 -14.510 31.927 1.00 13.28 O ATOM 591 CB ASN A1049 0.460 -14.288 32.946 1.00 13.69 C ATOM 592 CG ASN A1049 -0.648 -14.222 33.962 1.00 19.47 C ATOM 593 OD1 ASN A1049 -0.538 -13.521 34.962 1.00 19.02 O ATOM 594 ND2 ASN A1049 -1.729 -14.982 33.710 1.00 22.13 N ATOM 595 HD22 ASN A1049 -1.769 -15.558 32.845 1.00 0.00 H ATOM 596 HD21 ASN A1049 -2.524 -14.994 34.380 1.00 0.00 H ATOM 597 H ASN A1049 0.428 -11.048 33.012 1.00 0.00 H ATOM 598 N GLY A1050 3.276 -12.381 31.499 1.00 9.08 N ATOM 599 CA GLY A1050 4.512 -12.692 30.814 1.00 9.85 C ATOM 600 C GLY A1050 4.357 -13.225 29.397 1.00 9.00 C ATOM 601 O GLY A1050 5.332 -13.681 28.809 1.00 8.29 O ATOM 602 H GLY A1050 2.936 -11.399 31.547 1.00 0.00 H ATOM 603 N VAL A1051 3.165 -13.116 28.835 1.00 8.55 N ATOM 604 CA VAL A1051 2.823 -13.560 27.484 1.00 8.78 C ATOM 605 C VAL A1051 2.195 -12.368 26.771 1.00 7.18 C ATOM 606 O VAL A1051 1.316 -11.716 27.333 1.00 8.80 O ATOM 607 CB VAL A1051 1.820 -14.726 27.534 1.00 7.21 C ATOM 608 CG1 VAL A1051 1.474 -15.169 26.163 1.00 6.51 C ATOM 609 CG2 VAL A1051 2.393 -15.914 28.373 1.00 10.12 C ATOM 610 H VAL A1051 2.409 -12.679 29.400 1.00 0.00 H ATOM 611 N LEU A1052 2.653 -12.086 25.550 1.00 6.66 N ATOM 612 CA LEU A1052 2.018 -11.113 24.677 1.00 5.94 C ATOM 613 C LEU A1052 0.932 -11.817 23.877 1.00 7.58 C ATOM 614 O LEU A1052 1.227 -12.682 23.029 1.00 7.82 O ATOM 615 CB LEU A1052 3.049 -10.481 23.768 1.00 6.68 C ATOM 616 CG LEU A1052 2.585 -9.315 22.914 1.00 6.61 C ATOM 617 CD1 LEU A1052 2.301 -8.117 23.779 1.00 8.86 C ATOM 618 CD2 LEU A1052 3.638 -8.987 21.892 1.00 7.53 C ATOM 619 H LEU A1052 3.500 -12.583 25.209 1.00 0.00 H ATOM 620 N TRP A1053 -0.324 -11.467 24.177 1.00 6.76 N ATOM 621 CA TRP A1053 -1.489 -12.097 23.591 1.00 6.71 C ATOM 622 C TRP A1053 -2.089 -11.262 22.460 1.00 5.65 C ATOM 623 O TRP A1053 -2.108 -10.029 22.529 1.00 6.11 O ATOM 624 CB TRP A1053 -2.543 -12.266 24.651 1.00 7.79 C ATOM 625 CG TRP A1053 -2.143 -13.060 25.837 1.00 6.32 C ATOM 626 CD1 TRP A1053 -1.775 -12.574 27.063 1.00 7.25 C ATOM 627 CD2 TRP A1053 -2.155 -14.493 25.957 1.00 7.21 C ATOM 628 NE1 TRP A1053 -1.527 -13.641 27.924 1.00 8.48 N ATOM 629 CE2 TRP A1053 -1.771 -14.813 27.264 1.00 7.67 C ATOM 630 CE3 TRP A1053 -2.426 -15.543 25.060 1.00 6.49 C ATOM 631 CZ2 TRP A1053 -1.666 -16.130 27.695 1.00 9.88 C ATOM 632 CZ3 TRP A1053 -2.323 -16.854 25.521 1.00 10.02 C ATOM 633 CH2 TRP A1053 -1.957 -17.128 26.812 1.00 9.65 C ATOM 634 HE1 TRP A1053 -1.208 -13.559 28.910 1.00 0.00 H ATOM 635 H TRP A1053 -0.471 -10.703 24.867 1.00 0.00 H ATOM 636 N THR A1054 -2.600 -11.933 21.425 1.00 6.39 N ATOM 637 CA THR A1054 -3.410 -11.235 20.447 1.00 6.53 C ATOM 638 C THR A1054 -4.391 -12.217 19.821 1.00 8.24 C ATOM 639 O THR A1054 -4.584 -13.340 20.330 1.00 6.68 O ATOM 640 CB THR A1054 -2.523 -10.510 19.426 1.00 6.34 C ATOM 641 OG1 THR A1054 -3.299 -9.663 18.569 1.00 6.40 O ATOM 642 CG2 THR A1054 -1.771 -11.489 18.550 1.00 7.14 C ATOM 643 HG1 THR A1054 -3.770 -8.985 19.115 1.00 0.00 H ATOM 644 H THR A1054 -2.418 -12.952 21.321 1.00 0.00 H ATOM 645 N VAL A1055 -5.030 -11.769 18.751 1.00 7.50 N ATOM 646 CA VAL A1055 -6.049 -12.546 18.046 1.00 4.92 C ATOM 647 C VAL A1055 -5.481 -13.324 16.877 1.00 7.32 C ATOM 648 O VAL A1055 -4.651 -12.834 16.107 1.00 8.32 O ATOM 649 CB VAL A1055 -7.194 -11.632 17.560 1.00 7.13 C ATOM 650 CG1 VAL A1055 -8.082 -11.274 18.727 1.00 7.10 C ATOM 651 CG2 VAL A1055 -6.644 -10.419 16.830 1.00 7.49 C ATOM 652 H VAL A1055 -4.796 -10.820 18.395 1.00 0.00 H ATOM 653 N TYR A1056 -5.962 -14.551 16.717 1.00 6.36 N ATOM 654 CA TYR A1056 -5.564 -15.388 15.575 1.00 5.32 C ATOM 655 C TYR A1056 -5.986 -14.752 14.255 1.00 6.79 C ATOM 656 O TYR A1056 -5.278 -14.892 13.243 1.00 7.36 O ATOM 657 CB TYR A1056 -6.189 -16.805 15.746 1.00 7.02 C ATOM 658 CG TYR A1056 -5.752 -17.791 14.708 1.00 6.73 C ATOM 659 CD1 TYR A1056 -6.392 -17.868 13.462 1.00 7.34 C ATOM 660 CD2 TYR A1056 -4.690 -18.655 14.953 1.00 7.14 C ATOM 661 CE1 TYR A1056 -5.957 -18.745 12.529 1.00 8.49 C ATOM 662 CE2 TYR A1056 -4.261 -19.556 13.988 1.00 8.30 C ATOM 663 CZ TYR A1056 -4.924 -19.589 12.804 1.00 7.58 C ATOM 664 OH TYR A1056 -4.510 -20.446 11.802 1.00 8.32 O ATOM 665 HH TYR A1056 -5.101 -20.341 11.014 1.00 0.00 H ATOM 666 H TYR A1056 -6.635 -14.929 17.414 1.00 0.00 H ATOM 667 N HIS A1057 -7.125 -14.052 14.220 1.00 7.87 N ATOM 668 CA HIS A1057 -7.581 -13.480 12.941 1.00 6.75 C ATOM 669 C HIS A1057 -6.685 -12.328 12.503 1.00 8.34 C ATOM 670 O HIS A1057 -6.754 -11.928 11.331 1.00 9.19 O ATOM 671 CB HIS A1057 -9.057 -13.065 12.997 1.00 7.59 C ATOM 672 CG HIS A1057 -9.350 -11.779 13.731 1.00 8.13 C ATOM 673 ND1 HIS A1057 -9.805 -11.750 15.032 1.00 6.68 N ATOM 674 CD2 HIS A1057 -9.361 -10.501 13.308 1.00 7.35 C ATOM 675 CE1 HIS A1057 -10.006 -10.504 15.404 1.00 8.09 C ATOM 676 NE2 HIS A1057 -9.763 -9.715 14.362 1.00 7.61 N ATOM 677 H HIS A1057 -7.683 -13.913 15.086 1.00 0.00 H ATOM 678 N GLY A1058 -5.867 -11.802 13.399 1.00 7.18 N ATOM 679 CA GLY A1058 -4.818 -10.845 13.038 1.00 7.55 C ATOM 680 C GLY A1058 -3.471 -11.480 12.736 1.00 9.39 C ATOM 681 O GLY A1058 -2.854 -11.204 11.708 1.00 8.21 O ATOM 682 H GLY A1058 -5.972 -12.078 14.396 1.00 0.00 H ATOM 683 N ALA A1059 -3.018 -12.371 13.610 1.00 6.61 N ATOM 684 CA ALA A1059 -1.666 -12.895 13.504 1.00 6.24 C ATOM 685 C ALA A1059 -1.560 -14.219 12.775 1.00 7.59 C ATOM 686 O ALA A1059 -0.450 -14.586 12.350 1.00 7.67 O ATOM 687 CB ALA A1059 -1.086 -13.114 14.906 1.00 6.40 C ATOM 688 H ALA A1059 -3.637 -12.698 14.379 1.00 0.00 H ATOM 689 N GLY A1060 -2.645 -14.974 12.657 1.00 6.63 N ATOM 690 CA GLY A1060 -2.517 -16.352 12.195 1.00 8.00 C ATOM 691 C GLY A1060 -1.503 -17.089 13.046 1.00 6.22 C ATOM 692 O GLY A1060 -1.405 -16.875 14.233 1.00 8.00 O ATOM 693 H GLY A1060 -3.581 -14.586 12.892 1.00 0.00 H ATOM 694 N THR A1061 -0.709 -17.960 12.400 1.00 7.61 N ATOM 695 CA THR A1061 0.343 -18.688 13.028 1.00 6.21 C ATOM 696 C THR A1061 1.707 -17.979 12.962 1.00 7.97 C ATOM 697 O THR A1061 2.743 -18.640 13.173 1.00 7.04 O ATOM 698 CB THR A1061 0.461 -20.066 12.380 1.00 8.80 C ATOM 699 OG1 THR A1061 0.737 -19.895 10.968 1.00 8.05 O ATOM 700 CG2 THR A1061 -0.859 -20.830 12.528 1.00 7.20 C ATOM 701 HG1 THR A1061 1.586 -19.397 10.857 1.00 0.00 H ATOM 702 H THR A1061 -0.872 -18.111 11.384 1.00 0.00 H ATOM 703 N ARG A1062 1.739 -16.684 12.667 1.00 6.84 N ATOM 704 CA ARG A1062 3.006 -16.019 12.432 1.00 6.70 C ATOM 705 C ARG A1062 3.882 -15.936 13.680 1.00 8.99 C ATOM 706 O ARG A1062 3.402 -15.770 14.803 1.00 7.13 O ATOM 707 CB ARG A1062 2.816 -14.570 11.935 1.00 7.43 C ATOM 708 CG ARG A1062 2.213 -14.458 10.542 1.00 11.54 C ATOM 709 CD ARG A1062 1.923 -12.987 10.232 1.00 10.58 C ATOM 710 NE ARG A1062 0.954 -12.847 9.093 1.00 12.82 N ATOM 711 CZ ARG A1062 1.218 -12.328 7.927 1.00 22.97 C ATOM 712 NH1 ARG A1062 2.432 -11.853 7.599 1.00 26.66 N ATOM 713 NH2 ARG A1062 0.199 -12.264 7.075 1.00 23.12 N ATOM 714 HE ARG A1062 -0.014 -13.195 9.249 1.00 0.00 H ATOM 715 HH12 ARG A1062 2.594 -11.448 6.655 1.00 0.00 H ATOM 716 HH11 ARG A1062 3.209 -11.891 8.289 1.00 0.00 H ATOM 717 HH22 ARG A1062 0.339 -11.861 6.126 1.00 0.00 H ATOM 718 HH21 ARG A1062 -0.738 -12.617 7.357 1.00 0.00 H ATOM 719 H ARG A1062 0.852 -16.145 12.604 1.00 0.00 H ATOM 720 N THR A1063 5.193 -15.952 13.427 1.00 9.24 N ATOM 721 CA THR A1063 6.186 -15.552 14.384 1.00 8.45 C ATOM 722 C THR A1063 6.077 -14.072 14.672 1.00 6.99 C ATOM 723 O THR A1063 5.506 -13.313 13.891 1.00 8.55 O ATOM 724 CB THR A1063 7.581 -15.851 13.844 1.00 8.34 C ATOM 725 OG1 THR A1063 7.746 -15.224 12.582 1.00 8.59 O ATOM 726 CG2 THR A1063 7.793 -17.334 13.688 1.00 10.29 C ATOM 727 HG1 THR A1063 7.634 -14.246 12.684 1.00 0.00 H ATOM 728 H THR A1063 5.511 -16.270 12.489 1.00 0.00 H ATOM 729 N ILE A1064 6.701 -13.646 15.804 1.00 7.84 N ATOM 730 CA ILE A1064 6.859 -12.223 16.101 1.00 8.16 C ATOM 731 C ILE A1064 8.344 -11.875 15.973 1.00 8.51 C ATOM 732 O ILE A1064 9.214 -12.675 16.338 1.00 10.00 O ATOM 733 CB ILE A1064 6.321 -11.881 17.501 1.00 8.16 C ATOM 734 CG1 ILE A1064 6.244 -10.354 17.684 1.00 9.24 C ATOM 735 CG2 ILE A1064 7.123 -12.557 18.614 1.00 9.61 C ATOM 736 CD1 ILE A1064 5.427 -9.964 18.873 1.00 9.85 C ATOM 737 H ILE A1064 7.074 -14.349 16.473 1.00 0.00 H ATOM 738 N ALA A1065 8.621 -10.690 15.441 1.00 8.69 N ATOM 739 CA ALA A1065 10.005 -10.213 15.342 1.00 11.28 C ATOM 740 C ALA A1065 10.532 -9.844 16.706 1.00 11.91 C ATOM 741 O ALA A1065 9.806 -9.328 17.574 1.00 11.57 O ATOM 742 CB ALA A1065 10.091 -9.016 14.374 1.00 10.41 C ATOM 743 H ALA A1065 7.846 -10.092 15.090 1.00 0.00 H ATOM 744 N SER A1066 11.817 -10.137 16.915 1.00 12.84 N ATOM 745 CA SER A1066 12.456 -10.119 18.210 1.00 15.39 C ATOM 746 C SER A1066 13.918 -9.730 17.987 1.00 15.10 C ATOM 747 O SER A1066 14.444 -9.883 16.879 1.00 14.79 O ATOM 748 CB SER A1066 12.394 -11.510 18.847 1.00 18.76 C ATOM 749 OG SER A1066 12.879 -11.567 20.106 1.00 26.88 O ATOM 750 HG SER A1066 12.358 -10.958 20.687 1.00 0.00 H ATOM 751 H SER A1066 12.397 -10.395 16.091 1.00 0.00 H ATOM 752 N PRO A1067 14.624 -9.335 19.020 1.00 16.40 N ATOM 753 CA PRO A1067 16.017 -8.875 18.791 1.00 20.17 C ATOM 754 C PRO A1067 16.907 -9.934 18.174 1.00 22.35 C ATOM 755 O PRO A1067 17.847 -9.603 17.449 1.00 24.65 O ATOM 756 CB PRO A1067 16.492 -8.493 20.194 1.00 18.45 C ATOM 757 CG PRO A1067 15.234 -8.129 20.935 1.00 24.90 C ATOM 758 CD PRO A1067 14.195 -9.123 20.415 1.00 16.79 C ATOM 759 N LYS A1068 16.608 -11.202 18.402 1.00 22.60 N ATOM 760 CA LYS A1068 17.460 -12.311 17.994 1.00 24.84 C ATOM 761 C LYS A1068 16.856 -13.140 16.876 1.00 25.30 C ATOM 762 O LYS A1068 17.342 -14.230 16.589 1.00 27.48 O ATOM 763 CB LYS A1068 17.729 -13.198 19.218 1.00 25.13 C ATOM 764 CG LYS A1068 18.364 -12.451 20.381 1.00 28.53 C ATOM 765 CD LYS A1068 18.087 -13.173 21.692 1.00 33.84 C ATOM 766 CE LYS A1068 18.752 -14.569 21.711 1.00 32.97 C ATOM 767 NZ LYS A1068 18.659 -15.188 23.017 1.00 25.62 N ATOM 768 HZ1 LYS A1068 19.137 -14.587 23.719 1.00 0.00 H ATOM 769 HZ2 LYS A1068 17.658 -15.298 23.277 1.00 0.00 H ATOM 770 HZ3 LYS A1068 19.116 -16.122 22.990 1.00 0.00 H ATOM 771 H LYS A1068 15.720 -11.418 18.898 1.00 0.00 H ATOM 772 N GLY A1069 15.821 -12.643 16.228 1.00 17.87 N ATOM 773 CA GLY A1069 15.200 -13.337 15.147 1.00 16.53 C ATOM 774 C GLY A1069 13.770 -13.714 15.505 1.00 15.67 C ATOM 775 O GLY A1069 13.269 -13.403 16.588 1.00 16.25 O ATOM 776 H GLY A1069 15.445 -11.716 16.514 1.00 0.00 H ATOM 777 N PRO A1070 13.102 -14.386 14.581 1.00 15.43 N ATOM 778 CA PRO A1070 11.681 -14.682 14.770 1.00 13.47 C ATOM 779 C PRO A1070 11.455 -15.614 15.939 1.00 15.46 C ATOM 780 O PRO A1070 12.223 -16.554 16.171 1.00 14.72 O ATOM 781 CB PRO A1070 11.267 -15.348 13.451 1.00 16.55 C ATOM 782 CG PRO A1070 12.401 -15.221 12.504 1.00 17.54 C ATOM 783 CD PRO A1070 13.633 -14.840 13.290 1.00 14.26 C ATOM 784 N VAL A1071 10.375 -15.354 16.660 1.00 9.90 N ATOM 785 CA VAL A1071 9.958 -16.148 17.818 1.00 9.60 C ATOM 786 C VAL A1071 8.621 -16.808 17.536 1.00 8.40 C ATOM 787 O VAL A1071 7.640 -16.129 17.163 1.00 7.73 O ATOM 788 CB VAL A1071 9.884 -15.271 19.071 1.00 12.37 C ATOM 789 CG1 VAL A1071 9.177 -15.957 20.200 1.00 12.52 C ATOM 790 CG2 VAL A1071 11.313 -14.859 19.523 1.00 14.36 C ATOM 791 H VAL A1071 9.789 -14.539 16.388 1.00 0.00 H ATOM 792 N THR A1072 8.574 -18.128 17.713 1.00 9.81 N ATOM 793 CA THR A1072 7.374 -18.930 17.380 1.00 7.21 C ATOM 794 C THR A1072 6.328 -18.742 18.495 1.00 7.83 C ATOM 795 O THR A1072 6.662 -18.613 19.678 1.00 8.83 O ATOM 796 CB THR A1072 7.780 -20.429 17.295 1.00 8.88 C ATOM 797 OG1 THR A1072 8.671 -20.605 16.172 1.00 12.16 O ATOM 798 CG2 THR A1072 6.574 -21.355 17.131 1.00 9.65 C ATOM 799 HG1 THR A1072 9.477 -20.045 16.301 1.00 0.00 H ATOM 800 H THR A1072 9.410 -18.612 18.099 1.00 0.00 H ATOM 801 N GLN A1073 5.060 -18.738 18.116 1.00 7.61 N ATOM 802 CA GLN A1073 4.006 -18.710 19.118 1.00 6.13 C ATOM 803 C GLN A1073 4.209 -19.805 20.143 1.00 8.31 C ATOM 804 O GLN A1073 4.561 -20.934 19.799 1.00 9.06 O ATOM 805 CB GLN A1073 2.666 -18.884 18.458 1.00 6.84 C ATOM 806 CG GLN A1073 2.287 -17.637 17.636 1.00 6.60 C ATOM 807 CD GLN A1073 1.012 -17.787 16.817 1.00 7.45 C ATOM 808 OE1 GLN A1073 0.207 -18.668 17.025 1.00 8.05 O ATOM 809 NE2 GLN A1073 0.833 -16.852 15.881 1.00 7.16 N ATOM 810 HE22 GLN A1073 1.552 -16.115 15.738 1.00 0.00 H ATOM 811 HE21 GLN A1073 -0.026 -16.861 15.294 1.00 0.00 H ATOM 812 H GLN A1073 4.818 -18.755 17.105 1.00 0.00 H ATOM 813 N MET A1074 3.965 -19.479 21.418 1.00 8.57 N ATOM 814 CA MET A1074 3.878 -20.517 22.432 1.00 6.53 C ATOM 815 C MET A1074 2.458 -20.941 22.719 1.00 8.12 C ATOM 816 O MET A1074 2.251 -22.001 23.293 1.00 8.57 O ATOM 817 CB MET A1074 4.527 -20.058 23.742 1.00 10.28 C ATOM 818 CG MET A1074 4.145 -18.732 24.266 1.00 11.42 C ATOM 819 SD MET A1074 4.849 -18.590 26.002 1.00 9.79 S ATOM 820 CE MET A1074 6.579 -18.920 25.767 1.00 8.76 C ATOM 821 H MET A1074 3.837 -18.482 21.684 1.00 0.00 H ATOM 822 N TYR A1075 1.476 -20.154 22.304 1.00 7.28 N ATOM 823 CA TYR A1075 0.080 -20.541 22.369 1.00 7.31 C ATOM 824 C TYR A1075 -0.596 -20.229 21.042 1.00 7.03 C ATOM 825 O TYR A1075 -0.403 -19.137 20.492 1.00 7.54 O ATOM 826 CB TYR A1075 -0.687 -19.824 23.455 1.00 6.85 C ATOM 827 CG TYR A1075 -0.041 -19.918 24.840 1.00 7.76 C ATOM 828 CD1 TYR A1075 -0.111 -21.101 25.572 1.00 9.64 C ATOM 829 CD2 TYR A1075 0.690 -18.859 25.360 1.00 7.00 C ATOM 830 CE1 TYR A1075 0.491 -21.207 26.804 1.00 10.14 C ATOM 831 CE2 TYR A1075 1.291 -18.963 26.601 1.00 6.78 C ATOM 832 CZ TYR A1075 1.168 -20.148 27.324 1.00 8.94 C ATOM 833 OH TYR A1075 1.741 -20.233 28.578 1.00 9.21 O ATOM 834 HH TYR A1075 1.567 -21.130 28.959 1.00 0.00 H ATOM 835 H TYR A1075 1.717 -19.220 21.915 1.00 0.00 H ATOM 836 N THR A1076 -1.431 -21.150 20.582 1.00 5.77 N ATOM 837 CA THR A1076 -2.265 -20.945 19.395 1.00 7.36 C ATOM 838 C THR A1076 -3.583 -21.632 19.625 1.00 8.13 C ATOM 839 O THR A1076 -3.587 -22.849 19.857 1.00 7.89 O ATOM 840 CB THR A1076 -1.623 -21.531 18.140 1.00 7.01 C ATOM 841 OG1 THR A1076 -0.242 -21.148 18.110 1.00 7.85 O ATOM 842 CG2 THR A1076 -2.338 -21.060 16.946 1.00 7.21 C ATOM 843 HG1 THR A1076 0.214 -21.497 18.916 1.00 0.00 H ATOM 844 H THR A1076 -1.497 -22.058 21.086 1.00 0.00 H ATOM 845 N ASN A1077 -4.681 -20.879 19.619 1.00 8.14 N ATOM 846 CA ASN A1077 -6.000 -21.517 19.746 1.00 6.99 C ATOM 847 C ASN A1077 -7.007 -20.862 18.819 1.00 8.35 C ATOM 848 O ASN A1077 -7.656 -19.887 19.176 1.00 8.12 O ATOM 849 CB ASN A1077 -6.493 -21.527 21.189 1.00 9.01 C ATOM 850 CG ASN A1077 -7.717 -22.399 21.333 1.00 11.19 C ATOM 851 OD1 ASN A1077 -8.516 -22.464 20.416 1.00 9.17 O ATOM 852 ND2 ASN A1077 -7.867 -23.074 22.472 1.00 13.47 N ATOM 853 HD22 ASN A1077 -7.157 -22.985 23.226 1.00 0.00 H ATOM 854 HD21 ASN A1077 -8.694 -23.689 22.607 1.00 0.00 H ATOM 855 H ASN A1077 -4.606 -19.846 19.525 1.00 0.00 H ATOM 856 N VAL A1078 -7.190 -21.464 17.633 1.00 8.20 N ATOM 857 CA VAL A1078 -8.072 -20.885 16.622 1.00 7.32 C ATOM 858 C VAL A1078 -9.492 -20.855 17.106 1.00 10.70 C ATOM 859 O VAL A1078 -10.278 -19.983 16.702 1.00 7.31 O ATOM 860 CB VAL A1078 -7.948 -21.667 15.296 1.00 6.88 C ATOM 861 CG1 VAL A1078 -8.464 -23.081 15.408 1.00 8.85 C ATOM 862 CG2 VAL A1078 -8.675 -20.970 14.191 1.00 9.58 C ATOM 863 H VAL A1078 -6.696 -22.357 17.431 1.00 0.00 H ATOM 864 N ASP A1079 -9.838 -21.795 17.993 1.00 10.21 N ATOM 865 CA ASP A1079 -11.221 -21.890 18.459 1.00 10.48 C ATOM 866 C ASP A1079 -11.569 -20.755 19.413 1.00 12.78 C ATOM 867 O ASP A1079 -12.737 -20.421 19.566 1.00 14.19 O ATOM 868 CB ASP A1079 -11.454 -23.234 19.163 1.00 11.30 C ATOM 869 CG ASP A1079 -11.415 -24.434 18.216 1.00 14.74 C ATOM 870 OD1 ASP A1079 -11.855 -24.314 17.085 1.00 15.41 O ATOM 871 OD2 ASP A1079 -10.931 -25.463 18.658 1.00 17.48 O ATOM 872 H ASP A1079 -9.122 -22.459 18.352 1.00 0.00 H ATOM 873 N LYS A1080 -10.592 -20.162 20.039 1.00 8.33 N ATOM 874 CA LYS A1080 -10.772 -18.979 20.868 1.00 7.72 C ATOM 875 C LYS A1080 -10.334 -17.697 20.153 1.00 9.17 C ATOM 876 O LYS A1080 -10.398 -16.629 20.752 1.00 9.39 O ATOM 877 CB LYS A1080 -9.974 -19.089 22.169 1.00 11.45 C ATOM 878 CG LYS A1080 -10.386 -20.271 23.105 1.00 15.16 C ATOM 879 CD LYS A1080 -9.515 -20.239 24.371 1.00 16.37 C ATOM 880 CE LYS A1080 -9.786 -21.428 25.290 1.00 25.32 C ATOM 881 NZ LYS A1080 -8.846 -21.408 26.500 1.00 18.64 N ATOM 882 HZ1 LYS A1080 -7.860 -21.455 26.172 1.00 0.00 H ATOM 883 HZ2 LYS A1080 -8.992 -20.529 27.037 1.00 0.00 H ATOM 884 HZ3 LYS A1080 -9.050 -22.226 27.109 1.00 0.00 H ATOM 885 H LYS A1080 -9.634 -20.554 19.941 1.00 0.00 H ATOM 886 N ASP A1081 -9.836 -17.802 18.922 1.00 8.19 N ATOM 887 CA ASP A1081 -9.273 -16.700 18.197 1.00 8.17 C ATOM 888 C ASP A1081 -8.105 -16.073 18.945 1.00 8.25 C ATOM 889 O ASP A1081 -7.987 -14.842 19.000 1.00 7.32 O ATOM 890 CB ASP A1081 -10.349 -15.637 17.903 1.00 8.88 C ATOM 891 CG ASP A1081 -9.917 -14.628 16.860 1.00 7.76 C ATOM 892 OD1 ASP A1081 -8.943 -14.872 16.072 1.00 7.83 O ATOM 893 OD2 ASP A1081 -10.592 -13.552 16.797 1.00 7.31 O ATOM 894 H ASP A1081 -9.857 -18.734 18.461 1.00 0.00 H ATOM 895 N LEU A1082 -7.218 -16.940 19.487 1.00 6.64 N ATOM 896 CA LEU A1082 -6.197 -16.528 20.445 1.00 6.95 C ATOM 897 C LEU A1082 -4.816 -17.034 20.079 1.00 7.44 C ATOM 898 O LEU A1082 -4.665 -18.201 19.703 1.00 8.27 O ATOM 899 CB LEU A1082 -6.549 -17.047 21.831 1.00 7.44 C ATOM 900 CG LEU A1082 -5.600 -16.652 22.958 1.00 7.91 C ATOM 901 CD1 LEU A1082 -5.636 -15.175 23.358 1.00 9.43 C ATOM 902 CD2 LEU A1082 -5.953 -17.547 24.183 1.00 13.15 C ATOM 903 H LEU A1082 -7.266 -17.941 19.209 1.00 0.00 H ATOM 904 N VAL A1083 -3.813 -16.150 20.160 1.00 6.33 N ATOM 905 CA VAL A1083 -2.425 -16.584 20.086 1.00 7.21 C ATOM 906 C VAL A1083 -1.615 -15.843 21.156 1.00 6.84 C ATOM 907 O VAL A1083 -2.017 -14.797 21.663 1.00 7.03 O ATOM 908 CB VAL A1083 -1.812 -16.361 18.708 1.00 6.99 C ATOM 909 CG1 VAL A1083 -2.725 -16.936 17.585 1.00 8.27 C ATOM 910 CG2 VAL A1083 -1.493 -14.970 18.498 1.00 7.93 C ATOM 911 H VAL A1083 -4.029 -15.139 20.277 1.00 0.00 H ATOM 912 N GLY A1084 -0.438 -16.358 21.416 1.00 6.68 N ATOM 913 CA GLY A1084 0.451 -15.714 22.364 1.00 6.96 C ATOM 914 C GLY A1084 1.881 -16.078 22.063 1.00 8.31 C ATOM 915 O GLY A1084 2.179 -17.192 21.637 1.00 7.27 O ATOM 916 H GLY A1084 -0.140 -17.233 20.940 1.00 0.00 H ATOM 917 N TRP A1085 2.758 -15.150 22.367 1.00 6.73 N ATOM 918 CA TRP A1085 4.206 -15.312 22.343 1.00 6.84 C ATOM 919 C TRP A1085 4.769 -14.907 23.694 1.00 6.43 C ATOM 920 O TRP A1085 4.216 -14.065 24.413 1.00 7.68 O ATOM 921 CB TRP A1085 4.842 -14.403 21.306 1.00 5.62 C ATOM 922 CG TRP A1085 4.352 -14.445 19.879 1.00 7.61 C ATOM 923 CD1 TRP A1085 4.806 -15.239 18.875 1.00 7.24 C ATOM 924 CD2 TRP A1085 3.371 -13.576 19.305 1.00 8.22 C ATOM 925 NE1 TRP A1085 4.130 -14.929 17.684 1.00 6.78 N ATOM 926 CE2 TRP A1085 3.242 -13.918 17.946 1.00 7.60 C ATOM 927 CE3 TRP A1085 2.587 -12.549 19.815 1.00 7.29 C ATOM 928 CZ2 TRP A1085 2.358 -13.261 17.089 1.00 8.47 C ATOM 929 CZ3 TRP A1085 1.719 -11.904 18.957 1.00 8.53 C ATOM 930 CH2 TRP A1085 1.613 -12.248 17.621 1.00 6.73 C ATOM 931 HE1 TRP A1085 4.278 -15.387 16.762 1.00 0.00 H ATOM 932 H TRP A1085 2.388 -14.220 22.649 1.00 0.00 H ATOM 933 N GLN A1086 5.943 -15.413 24.015 1.00 7.42 N ATOM 934 CA GLN A1086 6.664 -14.912 25.169 1.00 6.96 C ATOM 935 C GLN A1086 6.759 -13.386 25.089 1.00 8.62 C ATOM 936 O GLN A1086 7.034 -12.810 24.037 1.00 7.87 O ATOM 937 CB GLN A1086 8.072 -15.536 25.253 1.00 9.87 C ATOM 938 CG GLN A1086 8.974 -15.181 24.088 1.00 9.05 C ATOM 939 CD GLN A1086 9.908 -16.316 23.682 1.00 12.35 C ATOM 940 OE1 GLN A1086 9.481 -17.454 23.486 1.00 12.51 O ATOM 941 NE2 GLN A1086 11.180 -16.001 23.572 1.00 15.57 N ATOM 942 HE22 GLN A1086 11.491 -15.024 23.748 1.00 0.00 H ATOM 943 HE21 GLN A1086 11.875 -16.729 23.309 1.00 0.00 H ATOM 944 H GLN A1086 6.354 -16.175 23.438 1.00 0.00 H ATOM 945 N ALA A1087 6.577 -12.732 26.230 1.00 9.74 N ATOM 946 CA ALA A1087 6.519 -11.268 26.205 1.00 9.45 C ATOM 947 C ALA A1087 7.897 -10.682 25.932 1.00 9.69 C ATOM 948 O ALA A1087 8.901 -11.150 26.476 1.00 10.34 O ATOM 949 CB ALA A1087 5.977 -10.721 27.515 1.00 7.88 C ATOM 950 H ALA A1087 6.477 -13.250 27.126 1.00 0.00 H ATOM 951 N PRO A1088 7.981 -9.664 25.081 1.00 10.08 N ATOM 952 CA PRO A1088 9.285 -9.051 24.748 1.00 11.82 C ATOM 953 C PRO A1088 9.990 -8.467 25.939 1.00 14.92 C ATOM 954 O PRO A1088 9.365 -7.877 26.818 1.00 13.70 O ATOM 955 CB PRO A1088 8.902 -7.909 23.778 1.00 12.07 C ATOM 956 CG PRO A1088 7.615 -8.238 23.291 1.00 15.97 C ATOM 957 CD PRO A1088 6.876 -9.032 24.339 1.00 13.99 C ATOM 958 N GLN A1089 11.324 -8.573 25.925 1.00 13.51 N ATOM 959 CA GLN A1089 12.100 -7.935 26.963 1.00 15.09 C ATOM 960 C GLN A1089 11.780 -6.454 26.937 1.00 14.95 C ATOM 961 O GLN A1089 11.698 -5.845 25.871 1.00 14.75 O ATOM 962 CB GLN A1089 13.598 -8.182 26.744 1.00 22.28 C ATOM 963 CG GLN A1089 14.003 -9.599 27.083 1.00 28.45 C ATOM 964 CD GLN A1089 13.856 -9.946 28.586 1.00 32.73 C ATOM 965 OE1 GLN A1089 12.997 -10.785 29.000 1.00 32.44 O ATOM 966 NE2 GLN A1089 14.638 -9.259 29.408 1.00 33.10 N ATOM 967 HE22 GLN A1089 15.328 -8.582 29.025 1.00 0.00 H ATOM 968 HE21 GLN A1089 14.561 -9.397 30.436 1.00 0.00 H ATOM 969 H GLN A1089 11.799 -9.111 25.172 1.00 0.00 H ATOM 970 N GLY A1090 11.555 -5.883 28.101 1.00 14.88 N ATOM 971 CA GLY A1090 11.223 -4.479 28.194 1.00 16.81 C ATOM 972 C GLY A1090 9.748 -4.220 28.392 1.00 12.01 C ATOM 973 O GLY A1090 9.381 -3.188 28.944 1.00 13.90 O ATOM 974 H GLY A1090 11.617 -6.452 28.969 1.00 0.00 H ATOM 975 N SER A1091 8.893 -5.133 27.956 1.00 12.49 N ATOM 976 CA SER A1091 7.471 -4.942 28.183 1.00 11.31 C ATOM 977 C SER A1091 7.156 -5.077 29.681 1.00 11.80 C ATOM 978 O SER A1091 7.952 -5.546 30.474 1.00 12.02 O ATOM 979 CB SER A1091 6.669 -5.941 27.328 1.00 11.76 C ATOM 980 OG SER A1091 6.937 -7.292 27.704 1.00 12.00 O ATOM 981 HG SER A1091 6.406 -7.903 27.135 1.00 0.00 H ATOM 982 H SER A1091 9.236 -5.978 27.456 1.00 0.00 H ATOM 983 N ARG A1092 5.955 -4.651 30.056 1.00 10.76 N ATOM 984 CA ARG A1092 5.382 -4.863 31.371 1.00 12.60 C ATOM 985 C ARG A1092 4.075 -5.621 31.174 1.00 11.53 C ATOM 986 O ARG A1092 3.419 -5.491 30.145 1.00 12.32 O ATOM 987 CB ARG A1092 5.141 -3.501 32.100 1.00 16.36 C ATOM 988 H ARG A1092 5.387 -4.130 29.358 1.00 0.00 H ATOM 989 N SER A1093 3.732 -6.465 32.128 1.00 9.11 N ATOM 990 CA SER A1093 2.549 -7.301 32.007 1.00 9.11 C ATOM 991 C SER A1093 1.441 -6.808 32.924 1.00 9.90 C ATOM 992 O SER A1093 1.701 -6.379 34.078 1.00 11.13 O ATOM 993 CB SER A1093 2.867 -8.752 32.420 1.00 11.62 C ATOM 994 OG SER A1093 3.198 -9.572 31.369 1.00 13.70 O ATOM 995 HG SER A1093 4.001 -9.215 30.913 1.00 0.00 H ATOM 996 H SER A1093 4.319 -6.534 32.983 1.00 0.00 H ATOM 997 N LEU A1094 0.210 -6.881 32.441 1.00 10.00 N ATOM 998 CA LEU A1094 -0.944 -6.690 33.304 1.00 10.20 C ATOM 999 C LEU A1094 -1.147 -7.913 34.218 1.00 11.42 C ATOM 1000 O LEU A1094 -0.869 -9.037 33.853 1.00 11.29 O ATOM 1001 CB LEU A1094 -2.205 -6.463 32.489 1.00 10.67 C ATOM 1002 CG LEU A1094 -2.207 -5.251 31.553 1.00 10.88 C ATOM 1003 CD1 LEU A1094 -3.339 -5.321 30.612 1.00 10.87 C ATOM 1004 CD2 LEU A1094 -2.269 -3.960 32.365 1.00 14.05 C ATOM 1005 H LEU A1094 0.067 -7.078 31.430 1.00 0.00 H ATOM 1006 N THR A1095 -1.765 -7.667 35.401 1.00 11.76 N ATOM 1007 CA THR A1095 -2.121 -8.722 36.317 1.00 10.46 C ATOM 1008 C THR A1095 -3.542 -9.216 36.056 1.00 8.50 C ATOM 1009 O THR A1095 -4.447 -8.389 35.888 1.00 10.65 O ATOM 1010 CB THR A1095 -2.015 -8.192 37.745 1.00 18.31 C ATOM 1011 OG1 THR A1095 -0.669 -7.773 37.986 1.00 19.83 O ATOM 1012 CG2 THR A1095 -2.371 -9.271 38.695 1.00 20.30 C ATOM 1013 HG1 THR A1095 -0.427 -7.058 37.345 1.00 0.00 H ATOM 1014 H THR A1095 -1.989 -6.684 35.655 1.00 0.00 H ATOM 1015 N PRO A1096 -3.761 -10.524 35.972 1.00 10.40 N ATOM 1016 CA PRO A1096 -5.128 -11.030 35.776 1.00 12.10 C ATOM 1017 C PRO A1096 -6.052 -10.581 36.916 1.00 12.77 C ATOM 1018 O PRO A1096 -5.694 -10.617 38.095 1.00 12.18 O ATOM 1019 CB PRO A1096 -4.967 -12.545 35.760 1.00 14.10 C ATOM 1020 CG PRO A1096 -3.485 -12.767 35.405 1.00 20.05 C ATOM 1021 CD PRO A1096 -2.762 -11.614 36.029 1.00 15.10 C ATOM 1022 N CYS A1097 -7.252 -10.148 36.544 1.00 11.47 N ATOM 1023 CA CYS A1097 -8.191 -9.616 37.535 1.00 10.23 C ATOM 1024 C CYS A1097 -8.818 -10.717 38.375 1.00 11.99 C ATOM 1025 O CYS A1097 -9.259 -11.734 37.852 1.00 12.10 O ATOM 1026 CB CYS A1097 -9.285 -8.833 36.813 1.00 10.86 C ATOM 1027 SG CYS A1097 -10.507 -8.076 37.958 1.00 9.75 S ATOM 1028 H CYS A1097 -7.527 -10.187 35.542 1.00 0.00 H ATOM 1029 N THR A1098 -8.865 -10.479 39.702 1.00 10.15 N ATOM 1030 CA THR A1098 -9.572 -11.342 40.638 1.00 15.27 C ATOM 1031 C THR A1098 -10.638 -10.592 41.417 1.00 12.35 C ATOM 1032 O THR A1098 -11.070 -11.072 42.454 1.00 12.91 O ATOM 1033 CB THR A1098 -8.594 -12.004 41.612 1.00 10.95 C ATOM 1034 OG1 THR A1098 -7.953 -11.009 42.409 1.00 13.45 O ATOM 1035 CG2 THR A1098 -7.557 -12.819 40.852 1.00 17.07 C ATOM 1036 HG1 THR A1098 -8.636 -10.508 42.922 1.00 0.00 H ATOM 1037 H THR A1098 -8.374 -9.641 40.074 1.00 0.00 H ATOM 1038 N CYS A1099 -11.067 -9.434 40.918 1.00 9.11 N ATOM 1039 CA CYS A1099 -11.986 -8.532 41.607 1.00 12.14 C ATOM 1040 C CYS A1099 -13.432 -9.001 41.516 1.00 12.59 C ATOM 1041 O CYS A1099 -14.264 -8.633 42.347 1.00 11.73 O ATOM 1042 CB CYS A1099 -11.879 -7.089 40.991 1.00 11.01 C ATOM 1043 SG CYS A1099 -10.289 -6.311 41.264 1.00 11.16 S ATOM 1044 H CYS A1099 -10.725 -9.154 39.977 1.00 0.00 H ATOM 1045 N GLY A1100 -13.777 -9.762 40.499 1.00 10.45 N ATOM 1046 CA GLY A1100 -15.171 -10.157 40.322 1.00 10.01 C ATOM 1047 C GLY A1100 -16.094 -9.015 40.023 1.00 11.49 C ATOM 1048 O GLY A1100 -17.303 -9.164 40.262 1.00 13.87 O ATOM 1049 H GLY A1100 -13.056 -10.082 39.821 1.00 0.00 H ATOM 1050 N SER A1101 -15.572 -7.931 39.399 1.00 10.51 N ATOM 1051 CA SER A1101 -16.245 -6.620 39.170 1.00 13.65 C ATOM 1052 C SER A1101 -16.713 -6.539 37.717 1.00 14.27 C ATOM 1053 O SER A1101 -16.038 -7.035 36.840 1.00 11.30 O ATOM 1054 CB SER A1101 -15.229 -5.448 39.405 1.00 13.68 C ATOM 1055 OG SER A1101 -15.578 -4.169 38.695 1.00 22.19 O ATOM 1056 HG SER A1101 -16.462 -3.851 39.006 1.00 0.00 H ATOM 1057 H SER A1101 -14.599 -8.023 39.042 1.00 0.00 H ATOM 1058 N SER A1102 -17.863 -5.905 37.463 1.00 10.89 N ATOM 1059 CA SER A1102 -18.379 -5.833 36.100 1.00 9.29 C ATOM 1060 C SER A1102 -18.296 -4.459 35.472 1.00 9.97 C ATOM 1061 O SER A1102 -18.837 -4.259 34.360 1.00 8.73 O ATOM 1062 CB SER A1102 -19.829 -6.299 36.054 1.00 10.05 C ATOM 1063 OG SER A1102 -19.821 -7.688 36.217 1.00 10.95 O ATOM 1064 HG SER A1102 -20.751 -8.027 36.192 1.00 0.00 H ATOM 1065 H SER A1102 -18.392 -5.461 38.241 1.00 0.00 H ATOM 1066 N ASP A1103 -17.593 -3.513 36.111 1.00 7.50 N ATOM 1067 CA ASP A1103 -17.419 -2.193 35.524 1.00 8.66 C ATOM 1068 C ASP A1103 -16.050 -2.217 34.860 1.00 9.29 C ATOM 1069 O ASP A1103 -15.033 -2.230 35.548 1.00 10.17 O ATOM 1070 CB ASP A1103 -17.567 -1.114 36.577 1.00 9.06 C ATOM 1071 CG ASP A1103 -18.977 -0.992 37.081 1.00 9.65 C ATOM 1072 OD1 ASP A1103 -19.961 -1.248 36.294 1.00 9.02 O ATOM 1073 OD2 ASP A1103 -19.147 -0.621 38.250 1.00 10.29 O ATOM 1074 H ASP A1103 -17.168 -3.725 37.036 1.00 0.00 H ATOM 1075 N LEU A1104 -16.042 -2.300 33.525 1.00 8.10 N ATOM 1076 CA LEU A1104 -14.820 -2.483 32.761 1.00 7.78 C ATOM 1077 C LEU A1104 -14.531 -1.297 31.864 1.00 8.71 C ATOM 1078 O LEU A1104 -15.326 -0.382 31.729 1.00 8.31 O ATOM 1079 CB LEU A1104 -14.862 -3.730 31.870 1.00 8.97 C ATOM 1080 CG LEU A1104 -15.438 -4.982 32.542 1.00 8.91 C ATOM 1081 CD1 LEU A1104 -15.461 -6.135 31.594 1.00 11.44 C ATOM 1082 CD2 LEU A1104 -14.613 -5.363 33.696 1.00 10.80 C ATOM 1083 H LEU A1104 -16.945 -2.231 33.014 1.00 0.00 H ATOM 1084 N TYR A1105 -13.322 -1.340 31.275 1.00 7.28 N ATOM 1085 CA TYR A1105 -12.810 -0.284 30.414 1.00 7.72 C ATOM 1086 C TYR A1105 -12.035 -0.922 29.278 1.00 9.71 C ATOM 1087 O TYR A1105 -11.067 -1.674 29.522 1.00 9.05 O ATOM 1088 CB TYR A1105 -11.877 0.667 31.210 1.00 8.74 C ATOM 1089 CG TYR A1105 -12.638 1.204 32.411 1.00 9.35 C ATOM 1090 CD1 TYR A1105 -13.451 2.324 32.271 1.00 13.37 C ATOM 1091 CD2 TYR A1105 -12.655 0.506 33.609 1.00 12.09 C ATOM 1092 CE1 TYR A1105 -14.242 2.760 33.352 1.00 13.89 C ATOM 1093 CE2 TYR A1105 -13.443 0.944 34.682 1.00 13.07 C ATOM 1094 CZ TYR A1105 -14.229 2.060 34.530 1.00 14.80 C ATOM 1095 OH TYR A1105 -15.020 2.535 35.579 1.00 18.74 O ATOM 1096 HH TYR A1105 -14.442 2.765 36.349 1.00 0.00 H ATOM 1097 H TYR A1105 -12.721 -2.172 31.444 1.00 0.00 H ATOM 1098 N LEU A1106 -12.449 -0.607 28.048 1.00 7.75 N ATOM 1099 CA LEU A1106 -11.765 -1.095 26.858 1.00 8.22 C ATOM 1100 C LEU A1106 -10.798 -0.030 26.360 1.00 7.88 C ATOM 1101 O LEU A1106 -11.156 1.145 26.295 1.00 8.94 O ATOM 1102 CB LEU A1106 -12.789 -1.412 25.762 1.00 8.11 C ATOM 1103 CG LEU A1106 -12.221 -1.804 24.397 1.00 10.19 C ATOM 1104 CD1 LEU A1106 -11.492 -3.056 24.459 1.00 12.01 C ATOM 1105 CD2 LEU A1106 -13.393 -1.969 23.449 1.00 13.29 C ATOM 1106 H LEU A1106 -13.283 0.004 27.937 1.00 0.00 H ATOM 1107 N VAL A1107 -9.583 -0.435 26.034 1.00 7.59 N ATOM 1108 CA VAL A1107 -8.575 0.487 25.521 1.00 6.53 C ATOM 1109 C VAL A1107 -8.371 0.233 24.030 1.00 9.33 C ATOM 1110 O VAL A1107 -8.051 -0.887 23.655 1.00 9.07 O ATOM 1111 CB VAL A1107 -7.237 0.322 26.252 1.00 10.81 C ATOM 1112 CG1 VAL A1107 -6.232 1.366 25.682 1.00 10.26 C ATOM 1113 CG2 VAL A1107 -7.367 0.535 27.711 1.00 11.01 C ATOM 1114 H VAL A1107 -9.338 -1.440 26.146 1.00 0.00 H ATOM 1115 N THR A1108 -8.558 1.263 23.196 1.00 9.00 N ATOM 1116 CA THR A1108 -8.429 1.100 21.758 1.00 6.70 C ATOM 1117 C THR A1108 -7.059 1.526 21.239 1.00 6.48 C ATOM 1118 O THR A1108 -6.210 2.082 21.954 1.00 7.71 O ATOM 1119 CB THR A1108 -9.482 1.918 21.010 1.00 8.95 C ATOM 1120 OG1 THR A1108 -9.017 3.279 21.022 1.00 8.21 O ATOM 1121 CG2 THR A1108 -10.812 1.848 21.650 1.00 8.67 C ATOM 1122 HG1 THR A1108 -9.668 3.853 20.547 1.00 0.00 H ATOM 1123 H THR A1108 -8.800 2.197 23.584 1.00 0.00 H ATOM 1124 N ARG A1109 -6.845 1.267 19.938 1.00 6.14 N ATOM 1125 CA ARG A1109 -5.571 1.552 19.297 1.00 7.31 C ATOM 1126 C ARG A1109 -5.339 3.038 19.165 1.00 7.49 C ATOM 1127 O ARG A1109 -4.234 3.447 18.810 1.00 8.26 O ATOM 1128 CB ARG A1109 -5.497 0.908 17.911 1.00 7.83 C ATOM 1129 CG ARG A1109 -6.419 1.561 16.887 1.00 9.69 C ATOM 1130 CD ARG A1109 -6.202 0.957 15.499 1.00 9.77 C ATOM 1131 NE ARG A1109 -4.907 1.228 14.899 1.00 10.41 N ATOM 1132 CZ ARG A1109 -3.936 0.327 14.712 1.00 11.41 C ATOM 1133 NH1 ARG A1109 -4.089 -0.921 15.117 1.00 10.17 N ATOM 1134 NH2 ARG A1109 -2.803 0.684 14.091 1.00 11.58 N ATOM 1135 HE ARG A1109 -4.719 2.203 14.589 1.00 0.00 H ATOM 1136 HH12 ARG A1109 -3.328 -1.614 14.967 1.00 0.00 H ATOM 1137 HH11 ARG A1109 -4.971 -1.211 15.586 1.00 0.00 H ATOM 1138 HH22 ARG A1109 -2.047 -0.016 13.945 1.00 0.00 H ATOM 1139 HH21 ARG A1109 -2.680 1.661 13.755 1.00 0.00 H ATOM 1140 H ARG A1109 -7.613 0.851 19.373 1.00 0.00 H ATOM 1141 N HIS A1110 -6.374 3.833 19.387 1.00 8.50 N ATOM 1142 CA HIS A1110 -6.240 5.291 19.387 1.00 9.30 C ATOM 1143 C HIS A1110 -6.138 5.868 20.779 1.00 9.34 C ATOM 1144 O HIS A1110 -6.247 7.107 20.946 1.00 13.16 O ATOM 1145 CB HIS A1110 -7.417 5.910 18.629 1.00 11.12 C ATOM 1146 CG HIS A1110 -7.643 5.328 17.273 1.00 11.58 C ATOM 1147 ND1 HIS A1110 -6.732 5.459 16.254 1.00 11.07 N ATOM 1148 CD2 HIS A1110 -8.682 4.608 16.765 1.00 13.80 C ATOM 1149 CE1 HIS A1110 -7.180 4.824 15.177 1.00 12.61 C ATOM 1150 NE2 HIS A1110 -8.368 4.308 15.455 1.00 10.75 N ATOM 1151 H HIS A1110 -7.307 3.411 19.566 1.00 0.00 H ATOM 1152 N ALA A1111 -5.982 4.988 21.790 1.00 9.23 N ATOM 1153 CA ALA A1111 -5.866 5.283 23.198 1.00 7.36 C ATOM 1154 C ALA A1111 -7.160 5.876 23.762 1.00 10.89 C ATOM 1155 O ALA A1111 -7.142 6.624 24.753 1.00 12.27 O ATOM 1156 CB ALA A1111 -4.688 6.192 23.527 1.00 10.21 C ATOM 1157 H ALA A1111 -5.941 3.983 21.524 1.00 0.00 H ATOM 1158 N ASP A1112 -8.274 5.550 23.123 1.00 10.17 N ATOM 1159 CA ASP A1112 -9.569 5.901 23.700 1.00 9.16 C ATOM 1160 C ASP A1112 -9.854 4.879 24.796 1.00 13.06 C ATOM 1161 O ASP A1112 -9.618 3.699 24.607 1.00 12.77 O ATOM 1162 CB ASP A1112 -10.652 5.903 22.645 1.00 11.71 C ATOM 1163 CG ASP A1112 -10.503 7.054 21.661 1.00 13.81 C ATOM 1164 OD1 ASP A1112 -10.372 8.191 22.132 1.00 15.06 O ATOM 1165 OD2 ASP A1112 -10.471 6.822 20.441 1.00 18.27 O ATOM 1166 H ASP A1112 -8.226 5.046 22.214 1.00 0.00 H ATOM 1167 N VAL A1113 -10.415 5.336 25.913 1.00 10.44 N ATOM 1168 CA VAL A1113 -10.811 4.438 26.997 1.00 12.08 C ATOM 1169 C VAL A1113 -12.326 4.411 27.010 1.00 16.62 C ATOM 1170 O VAL A1113 -12.981 5.457 27.132 1.00 18.77 O ATOM 1171 CB VAL A1113 -10.258 4.892 28.349 1.00 15.89 C ATOM 1172 CG1 VAL A1113 -10.873 4.051 29.460 1.00 19.86 C ATOM 1173 CG2 VAL A1113 -8.757 4.781 28.396 1.00 17.07 C ATOM 1174 H VAL A1113 -10.576 6.358 26.018 1.00 0.00 H ATOM 1175 N ILE A1114 -12.897 3.240 26.783 1.00 11.32 N ATOM 1176 CA ILE A1114 -14.325 3.092 26.534 1.00 11.73 C ATOM 1177 C ILE A1114 -14.925 2.343 27.723 1.00 12.06 C ATOM 1178 O ILE A1114 -14.627 1.153 27.924 1.00 9.59 O ATOM 1179 CB ILE A1114 -14.557 2.316 25.230 1.00 9.69 C ATOM 1180 CG1 ILE A1114 -14.044 3.127 24.015 1.00 16.94 C ATOM 1181 CG2 ILE A1114 -16.053 1.965 25.016 1.00 16.79 C ATOM 1182 CD1 ILE A1114 -14.138 2.361 22.729 1.00 18.41 C ATOM 1183 H ILE A1114 -12.301 2.388 26.782 1.00 0.00 H ATOM 1184 N PRO A1115 -15.777 2.965 28.524 1.00 9.57 N ATOM 1185 CA PRO A1115 -16.451 2.202 29.587 1.00 9.97 C ATOM 1186 C PRO A1115 -17.347 1.125 29.000 1.00 8.65 C ATOM 1187 O PRO A1115 -18.100 1.362 28.052 1.00 7.92 O ATOM 1188 CB PRO A1115 -17.287 3.267 30.320 1.00 13.22 C ATOM 1189 CG PRO A1115 -16.480 4.576 30.064 1.00 14.32 C ATOM 1190 CD PRO A1115 -15.969 4.425 28.654 1.00 14.27 C ATOM 1191 N VAL A1116 -17.306 -0.022 29.636 1.00 8.10 N ATOM 1192 CA VAL A1116 -17.994 -1.243 29.202 1.00 7.35 C ATOM 1193 C VAL A1116 -18.547 -1.918 30.444 1.00 7.46 C ATOM 1194 O VAL A1116 -17.808 -2.162 31.406 1.00 8.83 O ATOM 1195 CB VAL A1116 -17.047 -2.214 28.487 1.00 8.05 C ATOM 1196 CG1 VAL A1116 -17.718 -3.530 28.278 1.00 9.68 C ATOM 1197 CG2 VAL A1116 -16.543 -1.659 27.138 1.00 9.02 C ATOM 1198 H VAL A1116 -16.745 -0.069 30.511 1.00 0.00 H ATOM 1199 N ARG A1117 -19.848 -2.207 30.442 1.00 7.93 N ATOM 1200 CA ARG A1117 -20.453 -2.977 31.519 1.00 7.46 C ATOM 1201 C ARG A1117 -20.408 -4.465 31.144 1.00 8.55 C ATOM 1202 O ARG A1117 -20.875 -4.857 30.055 1.00 7.00 O ATOM 1203 CB ARG A1117 -21.902 -2.523 31.747 1.00 7.92 C ATOM 1204 CG ARG A1117 -22.631 -3.407 32.725 1.00 8.83 C ATOM 1205 CD ARG A1117 -22.112 -3.224 34.136 1.00 8.86 C ATOM 1206 NE ARG A1117 -22.841 -4.131 35.081 1.00 7.87 N ATOM 1207 CZ ARG A1117 -22.730 -4.137 36.396 1.00 9.60 C ATOM 1208 NH1 ARG A1117 -23.448 -4.983 37.101 1.00 8.75 N ATOM 1209 NH2 ARG A1117 -21.964 -3.251 37.039 1.00 10.14 N ATOM 1210 HE ARG A1117 -23.496 -4.821 34.661 1.00 0.00 H ATOM 1211 HH12 ARG A1117 -23.368 -4.995 38.138 1.00 0.00 H ATOM 1212 HH11 ARG A1117 -24.096 -5.640 36.622 1.00 0.00 H ATOM 1213 HH22 ARG A1117 -21.895 -3.279 38.076 1.00 0.00 H ATOM 1214 HH21 ARG A1117 -21.437 -2.533 36.502 1.00 0.00 H ATOM 1215 H ARG A1117 -20.443 -1.876 29.656 1.00 0.00 H ATOM 1216 N ARG A1118 -19.817 -5.284 32.007 1.00 5.93 N ATOM 1217 CA ARG A1118 -19.758 -6.717 31.724 1.00 5.75 C ATOM 1218 C ARG A1118 -21.169 -7.299 31.763 1.00 7.26 C ATOM 1219 O ARG A1118 -21.954 -6.996 32.671 1.00 8.40 O ATOM 1220 CB ARG A1118 -18.899 -7.453 32.712 1.00 6.89 C ATOM 1221 CG ARG A1118 -18.447 -8.821 32.198 1.00 6.86 C ATOM 1222 CD ARG A1118 -17.620 -9.578 33.184 1.00 9.39 C ATOM 1223 NE ARG A1118 -17.073 -10.818 32.592 1.00 8.94 N ATOM 1224 CZ ARG A1118 -15.968 -11.424 32.993 1.00 9.82 C ATOM 1225 NH1 ARG A1118 -15.289 -10.981 34.016 1.00 12.10 N ATOM 1226 NH2 ARG A1118 -15.558 -12.509 32.381 1.00 11.28 N ATOM 1227 HE ARG A1118 -17.596 -11.245 31.801 1.00 0.00 H ATOM 1228 HH12 ARG A1118 -14.422 -11.471 34.316 1.00 0.00 H ATOM 1229 HH11 ARG A1118 -15.615 -10.138 34.531 1.00 0.00 H ATOM 1230 HH22 ARG A1118 -14.689 -12.987 32.695 1.00 0.00 H ATOM 1231 HH21 ARG A1118 -16.102 -12.892 31.581 1.00 0.00 H ATOM 1232 H ARG A1118 -19.398 -4.907 32.881 1.00 0.00 H ATOM 1233 N ARG A1119 -21.492 -8.109 30.754 1.00 7.66 N ATOM 1234 CA ARG A1119 -22.834 -8.644 30.570 1.00 7.17 C ATOM 1235 C ARG A1119 -22.885 -10.167 30.512 1.00 8.82 C ATOM 1236 O ARG A1119 -23.992 -10.714 30.470 1.00 8.70 O ATOM 1237 CB ARG A1119 -23.484 -8.109 29.302 1.00 8.33 C ATOM 1238 CG ARG A1119 -23.681 -6.586 29.280 1.00 8.22 C ATOM 1239 CD ARG A1119 -24.644 -6.139 30.317 1.00 11.36 C ATOM 1240 NE ARG A1119 -25.053 -4.748 30.105 1.00 12.01 N ATOM 1241 CZ ARG A1119 -25.813 -4.078 30.935 1.00 13.02 C ATOM 1242 NH1 ARG A1119 -26.210 -4.677 32.063 1.00 10.72 N ATOM 1243 NH2 ARG A1119 -26.206 -2.837 30.629 1.00 15.97 N ATOM 1244 HE ARG A1119 -24.721 -4.265 29.246 1.00 0.00 H ATOM 1245 HH12 ARG A1119 -26.814 -4.166 32.738 1.00 0.00 H ATOM 1246 HH11 ARG A1119 -25.915 -5.654 32.265 1.00 0.00 H ATOM 1247 HH22 ARG A1119 -26.809 -2.305 31.288 1.00 0.00 H ATOM 1248 HH21 ARG A1119 -25.908 -2.404 29.732 1.00 0.00 H ATOM 1249 H ARG A1119 -20.754 -8.370 30.069 1.00 0.00 H ATOM 1250 N GLY A1120 -21.741 -10.834 30.522 1.00 8.76 N ATOM 1251 CA GLY A1120 -21.661 -12.277 30.548 1.00 7.18 C ATOM 1252 C GLY A1120 -20.206 -12.661 30.711 1.00 6.94 C ATOM 1253 O GLY A1120 -19.334 -11.794 30.945 1.00 8.28 O ATOM 1254 H GLY A1120 -20.854 -10.291 30.511 1.00 0.00 H ATOM 1255 N ASP A1121 -19.925 -13.931 30.498 1.00 9.36 N ATOM 1256 CA ASP A1121 -18.541 -14.421 30.581 1.00 8.45 C ATOM 1257 C ASP A1121 -17.651 -13.725 29.575 1.00 8.95 C ATOM 1258 O ASP A1121 -16.474 -13.372 29.887 1.00 8.16 O ATOM 1259 CB ASP A1121 -18.495 -15.939 30.417 1.00 10.03 C ATOM 1260 CG ASP A1121 -19.288 -16.491 29.223 1.00 11.81 C ATOM 1261 OD1 ASP A1121 -19.895 -15.756 28.427 1.00 11.70 O ATOM 1262 OD2 ASP A1121 -19.296 -17.746 29.116 1.00 15.14 O ATOM 1263 H ASP A1121 -20.692 -14.595 30.268 1.00 0.00 H ATOM 1264 N SER A1122 -18.165 -13.502 28.383 1.00 7.61 N ATOM 1265 HN3 SER A1122 -17.586 -13.978 27.662 1.00 0.00 H ATOM 1266 HN2 SER A1122 -18.178 -12.479 28.198 1.00 0.00 H ATOM 1267 HN1 SER A1122 -19.136 -13.873 28.350 1.00 0.00 H TER 1268 SER A1122 ATOM 1269 N ARG A1123 -18.915 -11.130 27.138 1.00 9.90 N ATOM 1270 CA ARG A1123 -19.588 -10.021 26.480 1.00 7.68 C ATOM 1271 C ARG A1123 -19.615 -8.809 27.418 1.00 7.88 C ATOM 1272 O ARG A1123 -19.745 -8.951 28.639 1.00 8.96 O ATOM 1273 CB ARG A1123 -21.072 -10.362 26.114 1.00 9.60 C ATOM 1274 CG ARG A1123 -21.231 -11.419 25.087 1.00 14.20 C ATOM 1275 CD ARG A1123 -20.689 -10.988 23.733 1.00 13.30 C ATOM 1276 NE ARG A1123 -20.778 -12.083 22.757 1.00 14.48 N ATOM 1277 CZ ARG A1123 -21.810 -12.258 21.939 1.00 16.03 C ATOM 1278 NH1 ARG A1123 -22.820 -11.422 21.971 1.00 20.10 N ATOM 1279 NH2 ARG A1123 -21.825 -13.282 21.109 1.00 19.88 N ATOM 1280 HE ARG A1123 -19.989 -12.759 22.704 1.00 0.00 H ATOM 1281 HH12 ARG A1123 -23.628 -11.558 21.331 1.00 0.00 H ATOM 1282 HH11 ARG A1123 -22.813 -10.623 22.636 1.00 0.00 H ATOM 1283 HH22 ARG A1123 -22.632 -13.420 20.468 1.00 0.00 H ATOM 1284 HH21 ARG A1123 -21.030 -13.952 21.095 1.00 0.00 H ATOM 1285 H ARG A1123 -19.195 -11.384 28.107 1.00 0.00 H ATOM 1286 N GLY A1124 -19.595 -7.631 26.844 1.00 7.32 N ATOM 1287 CA GLY A1124 -19.833 -6.424 27.630 1.00 6.73 C ATOM 1288 C GLY A1124 -20.429 -5.380 26.725 1.00 10.09 C ATOM 1289 O GLY A1124 -20.148 -5.344 25.531 1.00 9.42 O ATOM 1290 H GLY A1124 -19.409 -7.556 25.824 1.00 0.00 H ATOM 1291 N SER A1125 -21.249 -4.501 27.304 1.00 9.18 N ATOM 1292 CA SER A1125 -21.943 -3.482 26.526 1.00 9.50 C ATOM 1293 C SER A1125 -21.214 -2.155 26.636 1.00 8.17 C ATOM 1294 O SER A1125 -20.683 -1.797 27.683 1.00 7.83 O ATOM 1295 CB SER A1125 -23.412 -3.344 26.941 1.00 11.93 C ATOM 1296 OG SER A1125 -23.526 -3.055 28.320 1.00 11.99 O ATOM 1297 HG SER A1125 -23.059 -2.205 28.517 1.00 0.00 H ATOM 1298 H SER A1125 -21.396 -4.544 28.333 1.00 0.00 H ATOM 1299 N LEU A1126 -21.162 -1.406 25.521 1.00 9.97 N ATOM 1300 CA LEU A1126 -20.602 -0.060 25.584 1.00 10.47 C ATOM 1301 C LEU A1126 -21.614 0.852 26.254 1.00 9.18 C ATOM 1302 O LEU A1126 -22.798 0.855 25.888 1.00 10.30 O ATOM 1303 CB LEU A1126 -20.279 0.489 24.210 1.00 10.07 C ATOM 1304 CG LEU A1126 -19.442 -0.269 23.184 1.00 20.47 C ATOM 1305 CD1 LEU A1126 -18.764 0.785 22.224 1.00 15.08 C ATOM 1306 CD2 LEU A1126 -18.515 -1.147 23.743 1.00 16.81 C ATOM 1307 H LEU A1126 -21.518 -1.783 24.620 1.00 0.00 H ATOM 1308 N LEU A1127 -21.167 1.616 27.242 1.00 11.97 N ATOM 1309 CA LEU A1127 -22.066 2.586 27.847 1.00 12.18 C ATOM 1310 C LEU A1127 -22.497 3.606 26.825 1.00 13.21 C ATOM 1311 O LEU A1127 -23.638 4.093 26.860 1.00 11.06 O ATOM 1312 CB LEU A1127 -21.394 3.243 29.032 1.00 13.88 C ATOM 1313 CG LEU A1127 -21.541 2.496 30.355 1.00 16.22 C ATOM 1314 CD1 LEU A1127 -21.102 1.079 30.227 1.00 15.55 C ATOM 1315 CD2 LEU A1127 -20.776 3.190 31.498 1.00 22.14 C ATOM 1316 H LEU A1127 -20.188 1.523 27.579 1.00 0.00 H ATOM 1317 N SER A1128 -21.597 3.972 25.912 1.00 12.32 N ATOM 1318 CA SER A1128 -21.915 4.863 24.794 1.00 15.27 C ATOM 1319 C SER A1128 -21.545 4.157 23.500 1.00 14.35 C ATOM 1320 O SER A1128 -20.357 4.136 23.150 1.00 14.93 O ATOM 1321 CB SER A1128 -21.150 6.191 24.883 1.00 19.59 C ATOM 1322 OG SER A1128 -21.394 6.825 26.140 1.00 21.36 O ATOM 1323 HG SER A1128 -21.094 6.230 26.872 1.00 0.00 H ATOM 1324 H SER A1128 -20.626 3.609 25.997 1.00 0.00 H ATOM 1325 N PRO A1129 -22.500 3.627 22.770 1.00 16.74 N ATOM 1326 CA PRO A1129 -22.184 2.934 21.515 1.00 16.24 C ATOM 1327 C PRO A1129 -21.426 3.808 20.523 1.00 15.40 C ATOM 1328 O PRO A1129 -21.569 5.025 20.493 1.00 14.23 O ATOM 1329 CB PRO A1129 -23.555 2.572 20.955 1.00 14.70 C ATOM 1330 CG PRO A1129 -24.439 2.553 22.188 1.00 17.83 C ATOM 1331 CD PRO A1129 -23.934 3.545 23.106 1.00 15.98 C ATOM 1332 N ARG A1130 -20.612 3.145 19.706 1.00 14.14 N ATOM 1333 CA ARG A1130 -19.789 3.814 18.719 1.00 14.84 C ATOM 1334 C ARG A1130 -19.858 3.055 17.403 1.00 12.33 C ATOM 1335 O ARG A1130 -20.108 1.841 17.366 1.00 12.49 O ATOM 1336 CB ARG A1130 -18.317 3.905 19.171 1.00 19.11 C ATOM 1337 CG ARG A1130 -18.026 4.353 20.594 1.00 21.85 C ATOM 1338 CD ARG A1130 -18.380 5.791 20.835 1.00 26.42 C ATOM 1339 NE ARG A1130 -17.386 6.503 21.623 1.00 35.11 N ATOM 1340 CZ ARG A1130 -17.074 6.253 22.914 1.00 41.78 C ATOM 1341 NH1 ARG A1130 -17.662 5.270 23.648 1.00 35.75 N ATOM 1342 NH2 ARG A1130 -16.141 6.998 23.490 1.00 40.20 N ATOM 1343 HE ARG A1130 -16.870 7.273 21.151 1.00 0.00 H ATOM 1344 HH12 ARG A1130 -17.382 5.123 24.639 1.00 0.00 H ATOM 1345 HH11 ARG A1130 -18.391 4.666 23.218 1.00 0.00 H ATOM 1346 HH22 ARG A1130 -15.880 6.829 24.482 1.00 0.00 H ATOM 1347 HH21 ARG A1130 -15.670 7.752 22.950 1.00 0.00 H ATOM 1348 H ARG A1130 -20.565 2.109 19.778 1.00 0.00 H ATOM 1349 N PRO A1131 -19.610 3.737 16.289 1.00 10.91 N ATOM 1350 CA PRO A1131 -19.573 3.016 15.016 1.00 12.07 C ATOM 1351 C PRO A1131 -18.441 2.012 15.010 1.00 9.60 C ATOM 1352 O PRO A1131 -17.435 2.188 15.695 1.00 12.35 O ATOM 1353 CB PRO A1131 -19.316 4.112 13.980 1.00 13.54 C ATOM 1354 CG PRO A1131 -19.714 5.357 14.601 1.00 20.38 C ATOM 1355 CD PRO A1131 -19.466 5.193 16.118 1.00 12.91 C ATOM 1356 N ILE A1132 -18.623 0.928 14.242 1.00 10.10 N ATOM 1357 CA ILE A1132 -17.601 -0.113 14.159 1.00 10.49 C ATOM 1358 C ILE A1132 -16.238 0.487 13.832 1.00 9.10 C ATOM 1359 O ILE A1132 -15.194 -0.016 14.282 1.00 9.78 O ATOM 1360 CB ILE A1132 -17.987 -1.181 13.082 1.00 17.37 C ATOM 1361 H ILE A1132 -19.504 0.827 13.698 1.00 0.00 H ATOM 1362 N SER A1133 -16.223 1.560 13.037 1.00 10.06 N ATOM 1363 CA SER A1133 -14.952 2.155 12.604 1.00 8.12 C ATOM 1364 C SER A1133 -14.058 2.530 13.771 1.00 10.86 C ATOM 1365 O SER A1133 -12.830 2.622 13.636 1.00 11.24 O ATOM 1366 CB SER A1133 -15.290 3.427 11.818 1.00 9.26 C ATOM 1367 OG SER A1133 -16.274 3.158 10.856 1.00 12.72 O ATOM 1368 HG SER A1133 -16.482 3.988 10.357 1.00 0.00 H ATOM 1369 H SER A1133 -17.121 1.979 12.721 1.00 0.00 H ATOM 1370 N TYR A1134 -14.691 2.909 14.893 1.00 8.48 N ATOM 1371 CA TYR A1134 -14.000 3.438 16.044 1.00 9.60 C ATOM 1372 C TYR A1134 -13.233 2.339 16.751 1.00 8.32 C ATOM 1373 O TYR A1134 -12.297 2.611 17.491 1.00 9.84 O ATOM 1374 CB TYR A1134 -15.059 3.983 16.969 1.00 9.98 C ATOM 1375 CG TYR A1134 -14.616 4.853 18.140 1.00 15.89 C ATOM 1376 CD1 TYR A1134 -14.309 6.199 17.934 1.00 18.45 C ATOM 1377 CD2 TYR A1134 -14.592 4.359 19.441 1.00 17.88 C ATOM 1378 CE1 TYR A1134 -13.921 7.014 18.983 1.00 20.46 C ATOM 1379 CE2 TYR A1134 -14.212 5.232 20.528 1.00 15.63 C ATOM 1380 CZ TYR A1134 -13.897 6.506 20.296 1.00 16.45 C ATOM 1381 OH TYR A1134 -13.519 7.360 21.349 1.00 22.26 O ATOM 1382 HH TYR A1134 -13.323 8.261 20.988 1.00 0.00 H ATOM 1383 H TYR A1134 -15.726 2.817 14.934 1.00 0.00 H ATOM 1384 N LEU A1135 -13.712 1.117 16.599 1.00 7.92 N ATOM 1385 CA LEU A1135 -13.131 -0.068 17.212 1.00 7.00 C ATOM 1386 C LEU A1135 -12.231 -0.865 16.286 1.00 7.18 C ATOM 1387 O LEU A1135 -11.457 -1.696 16.787 1.00 6.97 O ATOM 1388 CB LEU A1135 -14.276 -0.988 17.697 1.00 8.30 C ATOM 1389 CG LEU A1135 -15.200 -0.388 18.740 1.00 9.85 C ATOM 1390 CD1 LEU A1135 -16.216 -1.403 19.197 1.00 12.30 C ATOM 1391 CD2 LEU A1135 -14.416 0.192 19.900 1.00 11.54 C ATOM 1392 H LEU A1135 -14.556 0.994 16.004 1.00 0.00 H ATOM 1393 N LYS A1136 -12.346 -0.680 14.966 1.00 7.86 N ATOM 1394 CA LYS A1136 -11.545 -1.430 14.014 1.00 7.17 C ATOM 1395 C LYS A1136 -10.063 -1.223 14.294 1.00 6.52 C ATOM 1396 O LYS A1136 -9.596 -0.106 14.494 1.00 7.49 O ATOM 1397 CB LYS A1136 -11.903 -0.992 12.583 1.00 8.50 C ATOM 1398 CG LYS A1136 -11.192 -1.769 11.493 1.00 9.67 C ATOM 1399 CD LYS A1136 -11.587 -1.340 10.094 1.00 10.25 C ATOM 1400 CE LYS A1136 -10.922 -2.205 9.031 1.00 13.53 C ATOM 1401 NZ LYS A1136 -9.479 -2.026 8.983 1.00 14.15 N ATOM 1402 HZ1 LYS A1136 -9.261 -1.032 8.768 1.00 0.00 H ATOM 1403 HZ2 LYS A1136 -9.069 -2.280 9.904 1.00 0.00 H ATOM 1404 HZ3 LYS A1136 -9.079 -2.638 8.243 1.00 0.00 H ATOM 1405 H LYS A1136 -13.028 0.020 14.611 1.00 0.00 H ATOM 1406 N GLY A1137 -9.303 -2.324 14.301 1.00 6.50 N ATOM 1407 CA GLY A1137 -7.877 -2.296 14.569 1.00 8.11 C ATOM 1408 C GLY A1137 -7.540 -2.425 16.035 1.00 6.90 C ATOM 1409 O GLY A1137 -6.361 -2.247 16.416 1.00 6.23 O ATOM 1410 H GLY A1137 -9.754 -3.241 14.106 1.00 0.00 H ATOM 1411 N SER A1138 -8.533 -2.688 16.898 1.00 5.31 N ATOM 1412 CA SER A1138 -8.296 -2.750 18.320 1.00 5.27 C ATOM 1413 C SER A1138 -8.422 -4.159 18.879 1.00 7.01 C ATOM 1414 O SER A1138 -8.206 -4.343 20.079 1.00 6.54 O ATOM 1415 CB SER A1138 -9.260 -1.811 19.062 1.00 8.58 C ATOM 1416 OG SER A1138 -8.879 -0.422 18.908 1.00 7.95 O ATOM 1417 HG SER A1138 -8.888 -0.183 17.947 1.00 0.00 H ATOM 1418 H SER A1138 -9.494 -2.851 16.534 1.00 0.00 H ATOM 1419 N SER A1139 -8.697 -5.162 18.034 1.00 6.39 N ATOM 1420 CA SER A1139 -8.638 -6.528 18.500 1.00 5.82 C ATOM 1421 C SER A1139 -7.273 -6.774 19.083 1.00 5.90 C ATOM 1422 O SER A1139 -6.259 -6.221 18.637 1.00 6.98 O ATOM 1423 CB SER A1139 -8.935 -7.532 17.388 1.00 7.03 C ATOM 1424 OG SER A1139 -7.938 -7.562 16.387 1.00 6.63 O ATOM 1425 HG SER A1139 -7.863 -6.667 15.971 1.00 0.00 H ATOM 1426 H SER A1139 -8.952 -4.958 17.047 1.00 0.00 H ATOM 1427 N GLY A1140 -7.222 -7.626 20.122 1.00 6.06 N ATOM 1428 CA GLY A1140 -6.002 -7.811 20.861 1.00 5.97 C ATOM 1429 C GLY A1140 -5.776 -6.831 21.999 1.00 6.92 C ATOM 1430 O GLY A1140 -4.871 -7.058 22.815 1.00 8.64 O ATOM 1431 H GLY A1140 -8.074 -8.157 20.394 1.00 0.00 H ATOM 1432 N GLY A1141 -6.569 -5.771 22.089 1.00 7.03 N ATOM 1433 CA GLY A1141 -6.486 -4.810 23.173 1.00 7.04 C ATOM 1434 C GLY A1141 -7.177 -5.295 24.423 1.00 5.80 C ATOM 1435 O GLY A1141 -7.920 -6.264 24.424 1.00 8.94 O ATOM 1436 H GLY A1141 -7.283 -5.622 21.348 1.00 0.00 H ATOM 1437 N PRO A1142 -6.902 -4.629 25.542 1.00 6.14 N ATOM 1438 CA PRO A1142 -7.414 -5.117 26.823 1.00 7.14 C ATOM 1439 C PRO A1142 -8.749 -4.519 27.223 1.00 6.89 C ATOM 1440 O PRO A1142 -9.069 -3.369 26.918 1.00 8.72 O ATOM 1441 CB PRO A1142 -6.346 -4.649 27.821 1.00 7.98 C ATOM 1442 CG PRO A1142 -5.917 -3.368 27.237 1.00 8.30 C ATOM 1443 CD PRO A1142 -5.969 -3.522 25.741 1.00 8.08 C ATOM 1444 N LEU A1143 -9.507 -5.335 27.961 1.00 7.54 N ATOM 1445 CA LEU A1143 -10.513 -4.822 28.888 1.00 7.30 C ATOM 1446 C LEU A1143 -9.942 -4.916 30.294 1.00 7.74 C ATOM 1447 O LEU A1143 -9.415 -5.966 30.695 1.00 7.64 O ATOM 1448 CB LEU A1143 -11.823 -5.607 28.821 1.00 11.37 C ATOM 1449 CG LEU A1143 -12.583 -5.351 27.515 1.00 14.72 C ATOM 1450 CD1 LEU A1143 -12.161 -6.320 26.430 1.00 10.92 C ATOM 1451 CD2 LEU A1143 -14.047 -5.376 27.774 1.00 17.95 C ATOM 1452 H LEU A1143 -9.377 -6.363 27.873 1.00 0.00 H ATOM 1453 N LEU A1144 -10.030 -3.823 31.026 1.00 7.75 N ATOM 1454 CA LEU A1144 -9.452 -3.678 32.342 1.00 8.38 C ATOM 1455 C LEU A1144 -10.548 -3.418 33.377 1.00 9.18 C ATOM 1456 O LEU A1144 -11.589 -2.840 33.050 1.00 10.17 O ATOM 1457 CB LEU A1144 -8.469 -2.519 32.366 1.00 9.00 C ATOM 1458 CG LEU A1144 -7.337 -2.448 31.345 1.00 11.38 C ATOM 1459 CD1 LEU A1144 -6.461 -1.226 31.560 1.00 25.30 C ATOM 1460 CD2 LEU A1144 -6.507 -3.664 31.468 1.00 10.79 C ATOM 1461 H LEU A1144 -10.549 -3.013 30.631 1.00 0.00 H ATOM 1462 N CYS A1145 -10.274 -3.800 34.616 1.00 8.64 N ATOM 1463 CA CYS A1145 -11.150 -3.457 35.747 1.00 8.80 C ATOM 1464 C CYS A1145 -10.782 -2.087 36.289 1.00 10.12 C ATOM 1465 O CYS A1145 -9.829 -1.426 35.823 1.00 9.53 O ATOM 1466 CB CYS A1145 -11.049 -4.558 36.830 1.00 10.48 C ATOM 1467 SG CYS A1145 -9.578 -4.382 37.854 1.00 10.14 S ATOM 1468 H CYS A1145 -9.415 -4.358 34.794 1.00 0.00 H ATOM 1469 N PRO A1146 -11.580 -1.569 37.224 1.00 9.68 N ATOM 1470 CA PRO A1146 -11.265 -0.251 37.789 1.00 13.63 C ATOM 1471 C PRO A1146 -9.887 -0.161 38.411 1.00 10.72 C ATOM 1472 O PRO A1146 -9.340 0.950 38.489 1.00 16.86 O ATOM 1473 CB PRO A1146 -12.381 -0.039 38.825 1.00 10.91 C ATOM 1474 CG PRO A1146 -13.511 -0.958 38.406 1.00 9.84 C ATOM 1475 CD PRO A1146 -12.807 -2.150 37.802 1.00 8.79 C ATOM 1476 N ALA A1147 -9.292 -1.267 38.868 1.00 9.23 N ATOM 1477 CA ALA A1147 -7.959 -1.256 39.438 1.00 11.74 C ATOM 1478 C ALA A1147 -6.858 -1.437 38.391 1.00 14.02 C ATOM 1479 O ALA A1147 -5.684 -1.466 38.747 1.00 14.07 O ATOM 1480 CB ALA A1147 -7.821 -2.339 40.483 1.00 14.19 C ATOM 1481 H ALA A1147 -9.805 -2.170 38.813 1.00 0.00 H ATOM 1482 N GLY A1148 -7.205 -1.629 37.140 1.00 12.82 N ATOM 1483 CA GLY A1148 -6.191 -1.780 36.110 1.00 12.63 C ATOM 1484 C GLY A1148 -5.762 -3.196 35.878 1.00 11.52 C ATOM 1485 O GLY A1148 -4.737 -3.416 35.207 1.00 12.44 O ATOM 1486 H GLY A1148 -8.212 -1.673 36.884 1.00 0.00 H ATOM 1487 N HIS A1149 -6.481 -4.158 36.415 1.00 9.32 N ATOM 1488 CA HIS A1149 -6.211 -5.547 36.121 1.00 8.62 C ATOM 1489 C HIS A1149 -6.756 -5.903 34.737 1.00 9.04 C ATOM 1490 O HIS A1149 -7.725 -5.327 34.265 1.00 10.14 O ATOM 1491 CB HIS A1149 -6.863 -6.472 37.125 1.00 10.76 C ATOM 1492 CG HIS A1149 -6.518 -6.204 38.551 1.00 13.88 C ATOM 1493 ND1 HIS A1149 -7.434 -6.365 39.581 1.00 12.87 N ATOM 1494 CD2 HIS A1149 -5.351 -5.832 39.123 1.00 18.05 C ATOM 1495 CE1 HIS A1149 -6.823 -6.081 40.722 1.00 14.75 C ATOM 1496 NE2 HIS A1149 -5.556 -5.792 40.479 1.00 17.41 N ATOM 1497 H HIS A1149 -7.258 -3.915 37.063 1.00 0.00 H ATOM 1498 N ALA A1150 -6.174 -6.941 34.132 1.00 9.52 N ATOM 1499 CA ALA A1150 -6.693 -7.464 32.857 1.00 7.77 C ATOM 1500 C ALA A1150 -7.889 -8.358 33.116 1.00 6.76 C ATOM 1501 O ALA A1150 -7.795 -9.312 33.897 1.00 7.34 O ATOM 1502 CB ALA A1150 -5.601 -8.204 32.091 1.00 8.66 C ATOM 1503 H ALA A1150 -5.342 -7.387 34.568 1.00 0.00 H ATOM 1504 N VAL A1151 -9.016 -8.051 32.473 1.00 7.49 N ATOM 1505 CA VAL A1151 -10.210 -8.880 32.481 1.00 7.79 C ATOM 1506 C VAL A1151 -10.372 -9.693 31.200 1.00 7.97 C ATOM 1507 O VAL A1151 -10.906 -10.823 31.222 1.00 8.86 O ATOM 1508 CB VAL A1151 -11.459 -8.005 32.730 1.00 7.27 C ATOM 1509 CG1 VAL A1151 -12.703 -8.781 32.659 1.00 8.81 C ATOM 1510 CG2 VAL A1151 -11.326 -7.289 34.045 1.00 9.02 C ATOM 1511 H VAL A1151 -9.042 -7.163 31.932 1.00 0.00 H ATOM 1512 N GLY A1152 -9.923 -9.155 30.078 1.00 8.46 N ATOM 1513 CA GLY A1152 -10.096 -9.883 28.824 1.00 10.70 C ATOM 1514 C GLY A1152 -9.363 -9.218 27.685 1.00 7.51 C ATOM 1515 O GLY A1152 -8.818 -8.130 27.832 1.00 8.69 O ATOM 1516 H GLY A1152 -9.454 -8.227 30.089 1.00 0.00 H ATOM 1517 N ILE A1153 -9.347 -9.909 26.550 1.00 7.52 N ATOM 1518 CA ILE A1153 -8.715 -9.482 25.318 1.00 8.42 C ATOM 1519 C ILE A1153 -9.822 -9.289 24.265 1.00 7.81 C ATOM 1520 O ILE A1153 -10.601 -10.217 23.992 1.00 7.22 O ATOM 1521 CB ILE A1153 -7.708 -10.520 24.825 1.00 7.82 C ATOM 1522 CG1 ILE A1153 -6.499 -10.673 25.730 1.00 9.01 C ATOM 1523 CG2 ILE A1153 -7.218 -10.143 23.394 1.00 9.74 C ATOM 1524 CD1 ILE A1153 -5.687 -9.499 25.772 1.00 8.90 C ATOM 1525 H ILE A1153 -9.827 -10.831 26.546 1.00 0.00 H ATOM 1526 N PHE A1154 -9.930 -8.075 23.732 1.00 6.53 N ATOM 1527 CA PHE A1154 -10.984 -7.736 22.754 1.00 6.42 C ATOM 1528 C PHE A1154 -10.829 -8.582 21.491 1.00 7.20 C ATOM 1529 O PHE A1154 -9.779 -8.569 20.875 1.00 6.95 O ATOM 1530 CB PHE A1154 -10.873 -6.231 22.450 1.00 7.60 C ATOM 1531 CG PHE A1154 -11.848 -5.670 21.451 1.00 6.34 C ATOM 1532 CD1 PHE A1154 -13.187 -6.129 21.379 1.00 7.11 C ATOM 1533 CD2 PHE A1154 -11.494 -4.592 20.675 1.00 8.19 C ATOM 1534 CE1 PHE A1154 -14.060 -5.580 20.485 1.00 7.14 C ATOM 1535 CE2 PHE A1154 -12.407 -4.007 19.820 1.00 7.57 C ATOM 1536 CZ PHE A1154 -13.689 -4.528 19.701 1.00 7.76 C ATOM 1537 H PHE A1154 -9.250 -7.340 24.013 1.00 0.00 H ATOM 1538 N ARG A1155 -11.921 -9.228 21.078 1.00 6.68 N ATOM 1539 CA ARG A1155 -11.921 -10.133 19.952 1.00 8.67 C ATOM 1540 C ARG A1155 -12.851 -9.702 18.832 1.00 8.39 C ATOM 1541 O ARG A1155 -12.471 -9.802 17.673 1.00 7.59 O ATOM 1542 CB ARG A1155 -12.321 -11.535 20.479 1.00 10.78 C ATOM 1543 CG ARG A1155 -12.455 -12.561 19.521 1.00 17.62 C ATOM 1544 CD ARG A1155 -12.566 -13.927 20.287 1.00 11.90 C ATOM 1545 NE ARG A1155 -13.724 -14.048 21.212 1.00 15.36 N ATOM 1546 CZ ARG A1155 -13.892 -15.049 22.055 1.00 13.06 C ATOM 1547 NH1 ARG A1155 -14.959 -15.126 22.813 1.00 14.83 N ATOM 1548 NH2 ARG A1155 -12.999 -16.054 22.146 1.00 11.61 N ATOM 1549 HE ARG A1155 -14.445 -13.299 21.193 1.00 0.00 H ATOM 1550 HH12 ARG A1155 -15.073 -15.923 23.471 1.00 0.00 H ATOM 1551 HH11 ARG A1155 -15.692 -14.390 22.756 1.00 0.00 H ATOM 1552 HH22 ARG A1155 -13.157 -16.831 22.820 1.00 0.00 H ATOM 1553 HH21 ARG A1155 -12.152 -16.053 21.543 1.00 0.00 H ATOM 1554 H ARG A1155 -12.813 -9.073 21.590 1.00 0.00 H ATOM 1555 N ALA A1156 -14.084 -9.306 19.135 1.00 7.01 N ATOM 1556 CA ALA A1156 -15.019 -9.040 18.054 1.00 8.02 C ATOM 1557 C ALA A1156 -16.043 -8.032 18.538 1.00 8.58 C ATOM 1558 O ALA A1156 -16.285 -7.927 19.752 1.00 7.61 O ATOM 1559 CB ALA A1156 -15.727 -10.342 17.580 1.00 8.25 C ATOM 1560 H ALA A1156 -14.374 -9.189 20.127 1.00 0.00 H ATOM 1561 N ALA A1157 -16.606 -7.268 17.612 1.00 9.10 N ATOM 1562 CA ALA A1157 -17.647 -6.313 17.981 1.00 7.58 C ATOM 1563 C ALA A1157 -19.033 -6.874 17.698 1.00 11.78 C ATOM 1564 O ALA A1157 -19.260 -7.530 16.674 1.00 9.17 O ATOM 1565 CB ALA A1157 -17.494 -5.003 17.204 1.00 8.55 C ATOM 1566 H ALA A1157 -16.305 -7.349 16.620 1.00 0.00 H ATOM 1567 N VAL A1158 -19.978 -6.527 18.555 1.00 11.15 N ATOM 1568 CA VAL A1158 -21.378 -6.920 18.389 1.00 12.89 C ATOM 1569 C VAL A1158 -22.074 -5.727 17.777 1.00 14.72 C ATOM 1570 O VAL A1158 -22.249 -4.699 18.430 1.00 12.44 O ATOM 1571 CB VAL A1158 -22.026 -7.337 19.705 1.00 11.74 C ATOM 1572 CG1 VAL A1158 -23.466 -7.805 19.447 1.00 16.22 C ATOM 1573 CG2 VAL A1158 -21.214 -8.369 20.381 1.00 15.98 C ATOM 1574 H VAL A1158 -19.716 -5.951 19.381 1.00 0.00 H ATOM 1575 N CYS A1159 -22.436 -5.862 16.509 1.00 14.41 N ATOM 1576 CA CYS A1159 -22.774 -4.746 15.672 1.00 18.98 C ATOM 1577 C CYS A1159 -24.223 -4.838 15.175 1.00 17.38 C ATOM 1578 O CYS A1159 -24.662 -5.898 14.782 1.00 23.06 O ATOM 1579 CB CYS A1159 -21.810 -4.726 14.468 1.00 20.85 C ATOM 1580 SG CYS A1159 -22.139 -3.499 13.405 1.00 38.44 S ATOM 1581 H CYS A1159 -22.477 -6.819 16.103 1.00 0.00 H ATOM 1582 N THR A1160 -24.902 -3.708 15.188 1.00 18.95 N ATOM 1583 CA THR A1160 -26.236 -3.515 14.629 1.00 23.80 C ATOM 1584 C THR A1160 -26.193 -2.278 13.733 1.00 18.68 C ATOM 1585 O THR A1160 -26.013 -1.154 14.218 1.00 20.67 O ATOM 1586 CB THR A1160 -27.272 -3.342 15.736 1.00 26.09 C ATOM 1587 OG1 THR A1160 -27.276 -4.534 16.545 1.00 30.48 O ATOM 1588 CG2 THR A1160 -28.618 -3.066 15.166 1.00 31.94 C ATOM 1589 HG1 THR A1160 -27.944 -4.438 17.269 1.00 0.00 H ATOM 1590 H THR A1160 -24.449 -2.885 15.634 1.00 0.00 H ATOM 1591 N ARG A1161 -26.361 -2.480 12.439 1.00 26.89 N ATOM 1592 CA ARG A1161 -26.395 -1.363 11.491 1.00 27.04 C ATOM 1593 C ARG A1161 -25.123 -0.529 11.601 1.00 21.01 C ATOM 1594 O ARG A1161 -25.178 0.703 11.632 1.00 23.03 O ATOM 1595 CB ARG A1161 -27.605 -0.467 11.696 1.00 29.79 C ATOM 1596 CG ARG A1161 -28.967 -1.149 11.505 1.00 42.40 C ATOM 1597 CD ARG A1161 -30.092 -0.160 11.846 1.00 44.50 C ATOM 1598 NE ARG A1161 -31.287 -0.823 12.371 1.00 58.98 N ATOM 1599 CZ ARG A1161 -32.548 -0.478 12.064 1.00 69.28 C ATOM 1600 NH1 ARG A1161 -32.796 0.523 11.212 1.00 67.36 N ATOM 1601 NH2 ARG A1161 -33.574 -1.146 12.601 1.00 59.50 N ATOM 1602 HE ARG A1161 -31.150 -1.617 13.028 1.00 0.00 H ATOM 1603 HH12 ARG A1161 -33.777 0.780 10.983 1.00 0.00 H ATOM 1604 HH11 ARG A1161 -32.007 1.044 10.779 1.00 0.00 H ATOM 1605 HH22 ARG A1161 -34.550 -0.878 12.363 1.00 0.00 H ATOM 1606 HH21 ARG A1161 -33.396 -1.933 13.257 1.00 0.00 H ATOM 1607 H ARG A1161 -26.471 -3.452 12.085 1.00 0.00 H ATOM 1608 N GLY A1162 -23.997 -1.211 11.738 1.00 24.13 N ATOM 1609 CA GLY A1162 -22.713 -0.543 11.833 1.00 18.06 C ATOM 1610 C GLY A1162 -22.389 0.104 13.154 1.00 16.62 C ATOM 1611 O GLY A1162 -21.326 0.713 13.261 1.00 14.02 O ATOM 1612 H GLY A1162 -24.034 -2.250 11.778 1.00 0.00 H ATOM 1613 N VAL A1163 -23.272 0.004 14.180 1.00 14.74 N ATOM 1614 CA VAL A1163 -22.992 0.599 15.475 1.00 14.76 C ATOM 1615 C VAL A1163 -22.629 -0.531 16.426 1.00 15.08 C ATOM 1616 O VAL A1163 -23.335 -1.562 16.492 1.00 14.40 O ATOM 1617 CB VAL A1163 -24.196 1.406 15.997 1.00 17.16 C ATOM 1618 CG1 VAL A1163 -23.900 2.005 17.359 1.00 20.06 C ATOM 1619 CG2 VAL A1163 -24.513 2.511 15.000 1.00 18.96 C ATOM 1620 H VAL A1163 -24.166 -0.508 14.036 1.00 0.00 H ATOM 1621 N ALA A1164 -21.517 -0.370 17.121 1.00 12.83 N ATOM 1622 CA ALA A1164 -21.083 -1.380 18.086 1.00 12.65 C ATOM 1623 C ALA A1164 -21.793 -1.057 19.401 1.00 12.32 C ATOM 1624 O ALA A1164 -21.497 -0.042 20.012 1.00 13.58 O ATOM 1625 CB ALA A1164 -19.568 -1.340 18.237 1.00 12.72 C ATOM 1626 H ALA A1164 -20.943 0.486 16.980 1.00 0.00 H ATOM 1627 N LYS A1165 -22.774 -1.900 19.803 1.00 11.24 N ATOM 1628 CA LYS A1165 -23.392 -1.750 21.112 1.00 11.41 C ATOM 1629 C LYS A1165 -22.703 -2.585 22.177 1.00 12.55 C ATOM 1630 O LYS A1165 -22.917 -2.326 23.366 1.00 9.34 O ATOM 1631 CB LYS A1165 -24.879 -2.129 21.073 1.00 14.28 C ATOM 1632 H LYS A1165 -23.089 -2.662 19.170 1.00 0.00 H ATOM 1633 N ALA A1166 -21.939 -3.594 21.771 1.00 9.72 N ATOM 1634 CA ALA A1166 -21.318 -4.535 22.721 1.00 8.37 C ATOM 1635 C ALA A1166 -20.048 -5.091 22.106 1.00 9.50 C ATOM 1636 O ALA A1166 -19.769 -4.917 20.921 1.00 10.27 O ATOM 1637 CB ALA A1166 -22.272 -5.645 23.078 1.00 9.84 C ATOM 1638 H ALA A1166 -21.774 -3.724 20.752 1.00 0.00 H ATOM 1639 N VAL A1167 -19.246 -5.698 22.954 1.00 8.78 N ATOM 1640 CA VAL A1167 -18.009 -6.348 22.519 1.00 8.03 C ATOM 1641 C VAL A1167 -17.956 -7.776 23.035 1.00 8.34 C ATOM 1642 O VAL A1167 -18.516 -8.105 24.086 1.00 8.54 O ATOM 1643 CB VAL A1167 -16.781 -5.575 22.970 1.00 7.69 C ATOM 1644 CG1 VAL A1167 -16.759 -4.199 22.244 1.00 8.47 C ATOM 1645 CG2 VAL A1167 -16.614 -5.450 24.496 1.00 9.15 C ATOM 1646 H VAL A1167 -19.498 -5.716 23.963 1.00 0.00 H ATOM 1647 N ASP A1168 -17.242 -8.599 22.285 1.00 8.23 N ATOM 1648 CA ASP A1168 -16.901 -9.984 22.610 1.00 8.16 C ATOM 1649 C ASP A1168 -15.414 -10.007 22.939 1.00 10.22 C ATOM 1650 O ASP A1168 -14.611 -9.439 22.206 1.00 8.24 O ATOM 1651 CB ASP A1168 -17.243 -10.874 21.424 1.00 10.73 C ATOM 1652 CG ASP A1168 -16.648 -12.257 21.498 1.00 15.62 C ATOM 1653 OD1 ASP A1168 -16.723 -12.906 22.544 1.00 13.30 O ATOM 1654 OD2 ASP A1168 -16.149 -12.721 20.434 1.00 19.86 O ATOM 1655 H ASP A1168 -16.890 -8.227 21.380 1.00 0.00 H ATOM 1656 N PHE A1169 -15.070 -10.668 24.052 1.00 8.41 N ATOM 1657 CA PHE A1169 -13.691 -10.707 24.495 1.00 7.30 C ATOM 1658 C PHE A1169 -13.336 -12.089 25.034 1.00 9.21 C ATOM 1659 O PHE A1169 -14.200 -12.841 25.470 1.00 9.88 O ATOM 1660 CB PHE A1169 -13.358 -9.657 25.552 1.00 7.18 C ATOM 1661 CG PHE A1169 -14.156 -9.755 26.838 1.00 7.94 C ATOM 1662 CD1 PHE A1169 -13.718 -10.525 27.899 1.00 8.25 C ATOM 1663 CD2 PHE A1169 -15.375 -9.056 26.993 1.00 8.11 C ATOM 1664 CE1 PHE A1169 -14.420 -10.608 29.060 1.00 7.81 C ATOM 1665 CE2 PHE A1169 -16.097 -9.167 28.171 1.00 7.23 C ATOM 1666 CZ PHE A1169 -15.634 -9.971 29.197 1.00 8.78 C ATOM 1667 H PHE A1169 -15.801 -11.159 24.605 1.00 0.00 H ATOM 1668 N ILE A1170 -12.039 -12.420 24.943 1.00 7.22 N ATOM 1669 CA ILE A1170 -11.502 -13.652 25.519 1.00 8.01 C ATOM 1670 C ILE A1170 -11.300 -13.396 27.006 1.00 9.98 C ATOM 1671 O ILE A1170 -10.413 -12.595 27.359 1.00 7.17 O ATOM 1672 CB ILE A1170 -10.176 -14.072 24.874 1.00 7.12 C ATOM 1673 CG1 ILE A1170 -10.327 -14.214 23.323 1.00 11.78 C ATOM 1674 CG2 ILE A1170 -9.699 -15.407 25.465 1.00 13.82 C ATOM 1675 CD1 ILE A1170 -9.153 -13.771 22.511 1.00 14.10 C ATOM 1676 H ILE A1170 -11.392 -11.777 24.444 1.00 0.00 H ATOM 1677 N PRO A1171 -12.023 -14.057 27.899 1.00 9.54 N ATOM 1678 CA PRO A1171 -11.834 -13.789 29.335 1.00 10.70 C ATOM 1679 C PRO A1171 -10.429 -14.174 29.780 1.00 10.58 C ATOM 1680 O PRO A1171 -9.841 -15.158 29.302 1.00 9.31 O ATOM 1681 CB PRO A1171 -12.918 -14.658 30.008 1.00 12.49 C ATOM 1682 CG PRO A1171 -13.799 -15.133 28.901 1.00 13.10 C ATOM 1683 CD PRO A1171 -13.067 -15.063 27.656 1.00 10.18 C ATOM 1684 N VAL A1172 -9.907 -13.455 30.775 1.00 11.93 N ATOM 1685 CA VAL A1172 -8.542 -13.785 31.229 1.00 11.55 C ATOM 1686 C VAL A1172 -8.486 -15.198 31.785 1.00 13.17 C ATOM 1687 O VAL A1172 -7.455 -15.877 31.688 1.00 14.07 O ATOM 1688 CB VAL A1172 -8.076 -12.724 32.245 1.00 14.29 C ATOM 1689 CG1 VAL A1172 -8.880 -12.814 33.559 1.00 16.57 C ATOM 1690 CG2 VAL A1172 -6.595 -12.849 32.529 1.00 16.54 C ATOM 1691 H VAL A1172 -10.446 -12.684 31.218 1.00 0.00 H ATOM 1692 N GLU A1173 -9.598 -15.693 32.312 1.00 12.52 N ATOM 1693 CA GLU A1173 -9.594 -17.093 32.788 1.00 17.41 C ATOM 1694 C GLU A1173 -9.359 -18.077 31.658 1.00 17.71 C ATOM 1695 O GLU A1173 -8.789 -19.179 31.849 1.00 18.19 O ATOM 1696 CB GLU A1173 -10.915 -17.445 33.459 1.00 20.50 C ATOM 1697 CG GLU A1173 -11.122 -16.699 34.776 1.00 25.12 C ATOM 1698 CD GLU A1173 -11.872 -15.378 34.565 1.00 29.13 C ATOM 1699 OE1 GLU A1173 -12.255 -14.775 35.586 1.00 30.36 O ATOM 1700 OE2 GLU A1173 -12.076 -14.959 33.392 1.00 17.40 O ATOM 1701 H GLU A1173 -10.455 -15.109 32.389 1.00 0.00 H ATOM 1702 N SER A1174 -9.865 -17.748 30.479 1.00 13.72 N ATOM 1703 CA SER A1174 -9.654 -18.589 29.321 1.00 16.16 C ATOM 1704 C SER A1174 -8.199 -18.553 28.896 1.00 17.92 C ATOM 1705 O SER A1174 -7.629 -19.585 28.511 1.00 16.73 O ATOM 1706 CB SER A1174 -10.617 -18.151 28.230 1.00 15.26 C ATOM 1707 OG SER A1174 -10.413 -18.904 27.087 1.00 19.98 O ATOM 1708 HG SER A1174 -11.045 -18.611 26.383 1.00 0.00 H ATOM 1709 H SER A1174 -10.421 -16.874 30.385 1.00 0.00 H ATOM 1710 N LEU A1175 -7.565 -17.371 28.970 1.00 15.25 N ATOM 1711 CA LEU A1175 -6.129 -17.286 28.767 1.00 13.86 C ATOM 1712 C LEU A1175 -5.411 -18.201 29.730 1.00 15.49 C ATOM 1713 O LEU A1175 -4.531 -18.969 29.335 1.00 18.36 O ATOM 1714 CB LEU A1175 -5.602 -15.861 28.982 1.00 16.47 C ATOM 1715 CG LEU A1175 -6.187 -14.751 28.108 1.00 18.84 C ATOM 1716 CD1 LEU A1175 -5.324 -13.489 28.344 1.00 12.99 C ATOM 1717 CD2 LEU A1175 -6.202 -15.090 26.693 1.00 18.56 C ATOM 1718 H LEU A1175 -8.108 -16.508 29.175 1.00 0.00 H ATOM 1719 N GLU A1176 -5.786 -18.140 31.018 1.00 15.55 N ATOM 1720 CA GLU A1176 -5.070 -18.939 32.030 1.00 16.16 C ATOM 1721 C GLU A1176 -5.277 -20.431 31.833 1.00 19.12 C ATOM 1722 O GLU A1176 -4.347 -21.224 32.013 1.00 23.06 O ATOM 1723 CB GLU A1176 -5.506 -18.473 33.424 1.00 21.90 C ATOM 1724 CG GLU A1176 -4.956 -17.084 33.713 1.00 22.33 C ATOM 1725 CD GLU A1176 -5.210 -16.537 35.098 1.00 30.39 C ATOM 1726 OE1 GLU A1176 -6.364 -16.528 35.578 1.00 35.36 O ATOM 1727 OE2 GLU A1176 -4.224 -16.057 35.688 1.00 35.48 O ATOM 1728 H GLU A1176 -6.580 -17.531 31.301 1.00 0.00 H ATOM 1729 N THR A1177 -6.470 -20.864 31.438 1.00 18.83 N ATOM 1730 CA THR A1177 -6.627 -22.276 31.082 1.00 18.99 C ATOM 1731 C THR A1177 -5.747 -22.639 29.896 1.00 23.34 C ATOM 1732 O THR A1177 -5.121 -23.710 29.880 1.00 21.53 O ATOM 1733 CB THR A1177 -8.089 -22.570 30.771 1.00 23.27 C ATOM 1734 OG1 THR A1177 -8.891 -22.325 31.943 1.00 27.93 O ATOM 1735 CG2 THR A1177 -8.261 -24.037 30.320 1.00 27.16 C ATOM 1736 HG1 THR A1177 -8.796 -21.378 32.214 1.00 0.00 H ATOM 1737 H THR A1177 -7.278 -20.211 31.383 1.00 0.00 H ATOM 1738 N THR A1178 -5.717 -21.789 28.863 1.00 21.35 N ATOM 1739 CA THR A1178 -4.802 -22.046 27.737 1.00 15.39 C ATOM 1740 C THR A1178 -3.356 -22.169 28.200 1.00 18.16 C ATOM 1741 O THR A1178 -2.597 -23.010 27.678 1.00 18.68 O ATOM 1742 CB THR A1178 -4.965 -20.958 26.675 1.00 19.28 C ATOM 1743 OG1 THR A1178 -6.192 -21.176 25.942 1.00 19.23 O ATOM 1744 CG2 THR A1178 -3.793 -20.953 25.648 1.00 16.33 C ATOM 1745 HG1 THR A1178 -6.160 -22.063 25.503 1.00 0.00 H ATOM 1746 H THR A1178 -6.335 -20.953 28.855 1.00 0.00 H ATOM 1747 N MET A1179 -2.952 -21.386 29.186 1.00 14.74 N ATOM 1748 CA MET A1179 -1.593 -21.504 29.708 1.00 15.76 C ATOM 1749 C MET A1179 -1.333 -22.880 30.372 1.00 23.50 C ATOM 1750 O MET A1179 -0.129 -23.197 30.612 1.00 19.11 O ATOM 1751 CB MET A1179 -1.275 -20.403 30.701 1.00 19.46 C ATOM 1752 CG MET A1179 -1.347 -18.990 30.056 1.00 15.51 C ATOM 1753 SD MET A1179 -1.003 -17.608 31.157 1.00 17.98 S ATOM 1754 CE MET A1179 0.744 -17.779 31.472 1.00 23.86 C ATOM 1755 H MET A1179 -3.604 -20.684 29.591 1.00 0.00 H TER 1756 MET A1179 HETATM 1757 C UNK A 1 -3.721 -3.853 13.174 1.00 8.70 C HETATM 1758 O UNK A 1 -4.918 -3.740 12.900 1.00 8.05 O HETATM 1759 C UNK A 2 0.226 -8.830 29.132 1.00 7.46 C HETATM 1760 O UNK A 2 -0.110 -7.893 29.858 1.00 8.98 O HETATM 1761 C UNK A 3 -17.948 -11.834 26.540 1.00 9.31 C HETATM 1762 O UNK A 3 -17.495 -11.518 25.419 1.00 9.56 O HETATM 1763 ZN ZN A 1 -9.479 -6.345 39.074 1.00 13.00 ZN HETATM 1764 O HOH 2 -0.892 -13.646 9.497 1.00 26.19 O HETATM 1765 O HOH 3 13.465 -5.106 21.296 1.00 31.21 O HETATM 1766 O HOH 4 -2.499 14.112 36.283 1.00 43.19 O HETATM 1767 O HOH 5 -13.167 -12.630 35.490 1.00 27.46 O HETATM 1768 O HOH 6 6.996 4.073 27.373 1.00 26.11 O HETATM 1769 O HOH 7 9.775 -2.575 15.645 1.00 19.84 O HETATM 1770 O HOH 8 16.204 -7.907 28.023 1.00 32.31 O HETATM 1771 O HOH 9 -12.379 -27.458 19.044 1.00 28.49 O HETATM 1772 O HOH 10 -4.885 10.559 23.901 1.00 24.20 O HETATM 1773 O HOH 11 8.489 -6.695 16.749 1.00 10.34 O HETATM 1774 O HOH 12 -10.808 -26.058 21.120 1.00 29.33 O HETATM 1775 O HOH 13 8.374 -28.354 -5.459 1.00 25.79 O HETATM 1776 O HOH 14 -18.925 -13.927 23.345 1.00 21.11 O HETATM 1777 O HOH 15 -8.741 -10.587 9.137 1.00 30.26 O HETATM 1778 O HOH 16 -17.920 -19.171 30.772 1.00 14.93 O HETATM 1779 O HOH 17 -5.035 -5.035 4.017 1.00 23.71 O HETATM 1780 O HOH 18 -24.191 -0.569 28.692 1.00 20.16 O HETATM 1781 O HOH 19 -6.052 -15.668 38.014 1.00 38.72 O HETATM 1782 O HOH 20 -20.921 -19.560 28.120 1.00 16.70 O HETATM 1783 O HOH 21 -5.589 10.770 34.752 1.00 21.62 O HETATM 1784 O HOH 22 6.828 -0.783 22.567 1.00 12.08 O HETATM 1785 O HOH 23 -24.532 -0.474 24.344 1.00 20.36 O HETATM 1786 O HOH 24 -12.997 9.911 20.851 1.00 33.84 O HETATM 1787 O HOH 25 0.562 7.689 29.806 1.00 17.68 O HETATM 1788 O HOH 26 -5.891 -23.487 24.674 1.00 19.58 O HETATM 1789 O HOH 27 10.235 -13.204 9.828 1.00 16.06 O HETATM 1790 O HOH 28 3.435 -21.697 15.621 1.00 13.26 O HETATM 1791 O HOH 29 5.623 -8.269 29.812 1.00 15.70 O HETATM 1792 O HOH 30 -18.568 -13.743 12.819 1.00 30.40 O HETATM 1793 O HOH 31 -18.305 -1.523 40.619 1.00 25.31 O HETATM 1794 O HOH 32 11.145 -19.545 23.456 1.00 16.27 O HETATM 1795 O HOH 33 0.486 -0.150 27.665 1.00 16.41 O HETATM 1796 O HOH 34 14.645 -17.346 15.353 1.00 16.32 O HETATM 1797 O HOH 35 -9.851 1.192 17.007 1.00 8.16 O HETATM 1798 O HOH 36 -11.703 8.937 24.331 1.00 24.00 O HETATM 1799 O HOH 37 4.201 9.654 29.198 1.00 36.69 O HETATM 1800 O HOH 38 0.764 -5.887 36.549 1.00 26.71 O HETATM 1801 O HOH 39 5.823 11.101 25.163 1.00 31.82 O HETATM 1802 O HOH 40 3.435 -5.471 26.206 1.00 12.82 O HETATM 1803 O HOH 41 -10.856 4.441 19.210 1.00 12.87 O HETATM 1804 O HOH 42 13.088 -12.952 27.372 1.00 31.29 O HETATM 1805 O HOH 43 -13.622 -8.192 37.268 1.00 20.56 O HETATM 1806 O HOH 44 15.676 -6.169 10.422 1.00 26.43 O HETATM 1807 O HOH 45 -3.880 -5.021 42.474 1.00 25.80 O HETATM 1808 O HOH 46 1.584 -22.425 19.677 1.00 12.26 O HETATM 1809 O HOH 47 -7.829 8.508 26.597 1.00 20.74 O HETATM 1810 O HOH 48 9.670 -0.351 17.668 1.00 29.13 O HETATM 1811 O HOH 49 -4.284 6.595 16.726 1.00 10.93 O HETATM 1812 O HOH 50 -19.971 -0.355 33.703 1.00 12.21 O HETATM 1813 O HOH 51 7.701 -1.145 30.164 1.00 17.53 O HETATM 1814 O HOH 52 -11.985 -26.693 15.721 1.00 23.95 O HETATM 1815 O HOH 53 -13.491 2.831 37.840 1.00 19.15 O HETATM 1816 O HOH 54 9.276 -15.117 8.241 1.00 27.55 O HETATM 1817 O HOH 55 -7.968 -3.146 10.987 1.00 12.67 O HETATM 1818 O HOH 56 5.442 -23.524 20.069 1.00 10.67 O HETATM 1819 O HOH 57 2.698 -25.029 13.265 1.00 12.21 O HETATM 1820 O HOH 58 -15.866 -2.351 40.740 1.00 14.91 O HETATM 1821 O HOH 59 6.853 -17.471 22.430 1.00 9.59 O HETATM 1822 O HOH 60 8.026 -20.630 20.966 1.00 12.48 O HETATM 1823 O HOH 61 4.019 -20.461 11.544 1.00 13.55 O HETATM 1824 O HOH 62 -12.696 -12.301 32.987 1.00 22.41 O HETATM 1825 O HOH 63 1.993 10.554 20.240 1.00 10.07 O HETATM 1826 O HOH 64 9.223 -9.348 20.278 1.00 24.41 O HETATM 1827 O HOH 65 -2.316 -10.329 9.093 1.00 13.33 O HETATM 1828 O HOH 66 -18.639 3.607 26.517 1.00 11.30 O HETATM 1829 O HOH 67 -9.995 2.634 13.959 1.00 14.49 O HETATM 1830 O HOH 68 -13.346 7.152 29.296 1.00 31.54 O HETATM 1831 O HOH 69 -19.992 -15.359 20.931 1.00 30.95 O HETATM 1832 O HOH 70 11.131 -26.309 -6.445 1.00 23.42 O HETATM 1833 O HOH 71 8.077 -20.822 13.461 1.00 22.31 O HETATM 1834 O HOH 72 -24.346 -6.263 33.899 1.00 9.99 O HETATM 1835 O HOH 73 4.475 -19.148 15.302 1.00 9.47 O HETATM 1836 O HOH 74 11.526 -11.648 22.546 1.00 30.06 O HETATM 1837 O HOH 75 7.628 7.332 19.789 1.00 13.94 O HETATM 1838 O HOH 76 -8.701 -8.572 43.549 1.00 31.50 O HETATM 1839 O HOH 77 2.370 -0.608 10.481 1.00 24.51 O HETATM 1840 O HOH 78 2.200 2.273 29.112 1.00 20.40 O HETATM 1841 O HOH 79 -23.707 6.625 21.324 1.00 33.28 O HETATM 1842 O HOH 80 12.557 -9.314 23.521 1.00 18.08 O HETATM 1843 O HOH 81 -17.227 -15.250 19.886 1.00 18.66 O HETATM 1844 O HOH 82 4.372 1.499 10.913 1.00 21.14 O HETATM 1845 O HOH 83 13.387 1.412 26.698 1.00 32.98 O HETATM 1846 O HOH 84 13.167 -3.783 24.650 1.00 24.39 O HETATM 1847 O HOH 85 -17.476 0.769 33.135 1.00 12.81 O HETATM 1848 O HOH 86 -3.699 -16.201 6.980 1.00 25.87 O HETATM 1849 O HOH 87 0.689 -24.331 23.623 1.00 22.98 O HETATM 1850 O HOH 88 12.293 -5.630 19.913 1.00 23.35 O HETATM 1851 O HOH 89 -21.726 0.039 39.222 1.00 15.99 O HETATM 1852 O HOH 90 12.083 -13.320 23.746 1.00 22.52 O HETATM 1853 O HOH 91 -13.818 -17.548 17.400 1.00 21.18 O HETATM 1854 O HOH 92 -12.959 -20.279 15.807 1.00 26.33 O HETATM 1855 O HOH 93 9.082 -12.042 22.219 1.00 17.13 O HETATM 1856 O HOH 94 -14.956 -21.494 18.143 1.00 27.79 O HETATM 1857 O HOH 95 10.600 -13.407 26.128 1.00 18.99 O HETATM 1858 O HOH 96 -12.397 -5.138 12.040 1.00 9.30 O HETATM 1859 O HOH 97 5.966 7.005 29.251 1.00 30.22 O HETATM 1860 O HOH 98 3.845 -17.200 31.984 1.00 15.60 O HETATM 1861 O HOH 99 11.119 -21.779 -0.773 1.00 28.82 O HETATM 1862 O HOH 100 5.584 -7.063 34.213 1.00 19.29 O HETATM 1863 O HOH 101 9.052 -16.621 10.465 1.00 29.36 O HETATM 1864 O HOH 102 -8.285 -3.016 6.584 1.00 24.49 O HETATM 1865 O HOH 103 1.788 -17.806 9.320 1.00 15.47 O HETATM 1866 O HOH 104 11.233 -19.329 16.037 1.00 15.68 O HETATM 1867 O HOH 105 0.729 -21.859 15.509 1.00 15.12 O HETATM 1868 O HOH 106 4.569 -26.989 20.022 1.00 18.77 O HETATM 1869 O HOH 107 -2.435 -4.940 36.006 1.00 13.25 O HETATM 1870 O HOH 108 14.803 -4.084 11.474 1.00 24.53 O HETATM 1871 O HOH 109 10.064 -7.478 30.166 1.00 19.73 O HETATM 1872 O HOH 110 -5.507 -15.469 10.430 1.00 11.03 O HETATM 1873 O HOH 111 0.263 10.871 30.429 1.00 28.47 O HETATM 1874 O HOH 112 -24.347 -18.958 24.035 1.00 28.76 O HETATM 1875 O HOH 113 7.662 13.312 22.499 1.00 25.30 O HETATM 1876 O HOH 114 -7.677 -13.458 9.044 1.00 26.73 O HETATM 1877 O HOH 115 -3.995 -12.501 39.509 1.00 17.05 O HETATM 1878 O HOH 116 -6.018 -9.297 40.666 1.00 20.87 O HETATM 1879 O HOH 117 8.087 -25.326 17.410 1.00 29.97 O HETATM 1880 O HOH 118 -13.108 -8.385 10.392 1.00 16.40 O HETATM 1881 O HOH 119 -17.561 3.168 34.271 1.00 19.41 O HETATM 1882 O HOH 120 -10.398 -24.370 23.207 1.00 24.06 O HETATM 1883 O HOH 121 -1.470 -23.601 22.208 1.00 14.55 O HETATM 1884 O HOH 122 -10.538 8.248 26.368 1.00 15.40 O HETATM 1885 O HOH 123 -19.539 -5.079 39.757 1.00 10.02 O HETATM 1886 O HOH 124 -12.717 -12.240 39.278 1.00 17.80 O HETATM 1887 O HOH 125 7.351 6.821 26.231 1.00 23.73 O HETATM 1888 O HOH 126 11.510 2.139 20.447 1.00 28.11 O HETATM 1889 O HOH 127 -9.564 -20.275 11.003 1.00 29.89 O HETATM 1890 O HOH 128 2.391 -24.161 -9.332 1.00 38.49 O HETATM 1891 O HOH 129 -5.927 -4.093 9.626 1.00 11.26 O HETATM 1892 O HOH 130 14.979 1.626 20.340 1.00 28.98 O HETATM 1893 O HOH 131 -19.252 5.981 28.049 1.00 17.09 O HETATM 1894 O HOH 132 10.417 3.730 22.373 1.00 32.84 O HETATM 1895 O HOH 133 -23.484 -9.116 23.784 1.00 16.42 O HETATM 1896 O HOH 134 -3.635 8.857 21.044 1.00 14.51 O HETATM 1897 O HOH 135 8.463 -0.720 20.289 1.00 15.43 O HETATM 1898 O HOH 136 -26.366 -12.243 24.621 1.00 27.00 O HETATM 1899 O HOH 137 14.708 -15.534 18.212 1.00 22.72 O HETATM 1900 O HOH 138 8.627 5.918 22.052 1.00 21.88 O HETATM 1901 O HOH 139 -21.749 -8.573 15.204 1.00 17.11 O HETATM 1902 O HOH 140 9.562 -23.320 17.315 1.00 17.58 O HETATM 1903 O HOH 141 -26.532 -5.225 11.019 1.00 37.35 O HETATM 1904 O HOH 142 -17.183 -17.489 26.418 1.00 25.59 O HETATM 1905 O HOH 143 12.408 -6.589 22.932 1.00 27.67 O HETATM 1906 O HOH 144 1.209 3.100 14.224 1.00 21.37 O HETATM 1907 O HOH 145 -29.406 -4.372 18.860 1.00 45.58 O HETATM 1908 O HOH 146 -24.651 -13.358 19.668 1.00 34.32 O HETATM 1909 O HOH 147 9.534 -2.686 18.904 1.00 23.95 O HETATM 1910 O HOH 148 5.602 -16.215 10.286 1.00 20.04 O HETATM 1911 O HOH 149 20.220 -8.020 18.913 1.00 33.23 O HETATM 1912 O HOH 150 14.551 -24.435 -9.580 1.00 21.99 O HETATM 1913 O HOH 151 -0.569 -16.817 8.525 1.00 15.93 O HETATM 1914 O HOH 152 13.729 -17.789 22.636 1.00 22.68 O HETATM 1915 O HOH 153 0.503 1.348 33.938 1.00 32.96 O HETATM 1916 O HOH 154 0.027 -2.700 7.893 1.00 24.43 O HETATM 1917 O HOH 155 -11.790 -11.296 35.848 1.00 30.33 O HETATM 1918 O HOH 156 -14.424 -17.281 19.483 1.00 27.79 O HETATM 1919 O HOH 157 -2.250 -25.565 31.354 1.00 36.46 O HETATM 1920 O HOH 158 -3.017 -0.752 34.413 1.00 22.02 O HETATM 1921 O HOH 159 -18.469 -15.668 22.340 1.00 31.16 O HETATM 1922 O HOH 160 -2.765 -25.952 29.490 1.00 27.61 O HETATM 1923 O HOH 161 -1.955 -25.672 20.182 1.00 29.47 O HETATM 1924 O HOH 162 -11.121 -22.429 28.657 1.00 38.62 O HETATM 1925 O HOH 163 -2.932 -12.540 6.070 1.00 32.05 O HETATM 1926 O HOH 164 15.234 -22.345 -2.952 1.00 39.35 O HETATM 1927 O HOH 165 6.709 -19.689 11.356 1.00 17.19 O HETATM 1928 O HOH 166 -6.649 -1.067 11.870 1.00 22.37 O HETATM 1929 O HOH 167 19.678 -10.971 14.989 1.00 41.70 O HETATM 1930 O HOH 168 2.154 -28.843 -3.163 1.00 30.66 O HETATM 1931 O HOH 169 -11.182 -12.968 9.991 1.00 34.32 O HETATM 1932 O HOH 170 -2.936 -24.273 33.090 1.00 36.11 O HETATM 1933 O HOH 171 -4.463 -11.566 6.381 1.00 23.97 O HETATM 1934 O HOH 172 3.578 -11.313 4.266 1.00 25.31 O HETATM 1935 O HOH 173 -26.282 -2.870 35.194 1.00 33.52 O HETATM 1936 O HOH 174 -2.210 -4.550 38.834 1.00 28.48 O HETATM 1937 O HOH 175 -16.272 6.223 14.670 1.00 20.52 O HETATM 1938 O HOH 176 5.201 2.849 28.531 1.00 28.59 O HETATM 1939 O HOH 177 2.095 10.230 30.408 1.00 32.45 O HETATM 1940 O HOH 178 -8.943 -5.714 7.928 1.00 31.60 O HETATM 1941 O HOH 179 -13.559 -18.347 25.071 1.00 15.21 O HETATM 1942 O HOH 180 -6.079 -2.603 5.528 1.00 28.71 O HETATM 1943 O HOH 181 -4.698 -14.552 39.165 1.00 28.61 O HETATM 1944 O HOH 182 -3.689 -13.983 9.120 1.00 18.78 O HETATM 1945 O HOH 183 4.202 -18.115 8.672 1.00 23.07 O HETATM 1946 O HOH 184 14.782 -10.422 23.258 1.00 30.66 O HETATM 1947 O HOH 185 10.880 -7.260 20.669 1.00 31.60 O HETATM 1948 O HOH 186 -5.036 -2.230 7.850 1.00 21.73 O HETATM 1949 O HOH 187 -0.179 -3.137 35.736 1.00 30.85 O HETATM 1950 O HOH 188 -16.987 7.429 27.360 1.00 26.12 O HETATM 1951 O HOH 189 -24.996 -11.580 18.636 1.00 38.84 O HETATM 1952 O HOH 190 -4.110 -9.085 42.198 1.00 30.86 O HETATM 1953 O HOH 191 -1.974 -2.096 7.725 1.00 26.15 O HETATM 1954 O HOH 192 12.554 -19.880 -8.701 1.00 21.01 O HETATM 1955 O HOH 193 -22.630 0.824 33.957 1.00 17.63 O HETATM 1956 O HOH 194 3.124 1.845 34.256 1.00 33.74 O HETATM 1957 O HOH 195 -24.119 -9.765 16.222 1.00 26.54 O HETATM 1958 O HOH 196 -26.314 0.729 28.149 1.00 35.18 O HETATM 1959 O HOH 197 -5.010 -24.293 34.801 1.00 33.63 O HETATM 1960 O HOH 198 5.758 14.045 24.429 1.00 39.08 O HETATM 1961 O HOH 199 1.384 -20.910 33.896 1.00 35.30 O HETATM 1962 O HOH 200 -13.009 -10.039 46.197 1.00 23.59 O HETATM 1963 O HOH 201 11.970 -19.861 13.433 1.00 26.70 O HETATM 1964 O HOH 202 -10.932 -8.232 45.746 1.00 20.70 O HETATM 1965 O HOH 203 -10.951 10.832 18.664 1.00 29.84 O HETATM 1966 O HOH 204 0.104 -24.234 14.071 1.00 17.03 O HETATM 1967 O HOH 205 5.598 -22.839 -10.654 1.00 28.35 O HETATM 1968 O HOH 206 -25.467 -7.823 22.620 1.00 25.59 O HETATM 1969 O HOH 207 -24.653 -10.417 25.981 1.00 19.38 O HETATM 1970 O HOH 208 -11.060 -10.501 10.000 1.00 21.49 O HETATM 1971 O HOH 209 0.157 -22.146 35.060 1.00 41.72 O HETATM 1972 O HOH 210 -26.117 -5.639 21.376 1.00 29.76 O HETATM 1973 O HOH 211 -14.692 10.898 18.460 1.00 31.91 O HETATM 1974 O HOH 212 -31.892 -4.168 17.590 1.00 48.79 O HETATM 1975 O HOH 213 -17.834 5.847 33.081 1.00 33.34 O HETATM 1976 O HOH 214 -19.556 6.649 30.844 1.00 25.22 O HETATM 1977 O HOH 215 -18.713 9.078 30.735 1.00 40.90 O HETATM 1978 C13 FH A 4 -13.550 -9.805 14.055 1.00 0.14 C HETATM 1979 C03 FH A 4 -12.893 -10.765 13.099 1.00 0.02 C HETATM 1980 C02 FH A 4 -13.853 -11.586 12.668 1.00 0.11 C HETATM 1981 C04 FH A 4 -15.101 -10.622 12.403 1.00 0.07 C HETATM 1982 N14 FH A 4 -15.001 -9.769 13.512 1.00 -0.25 N HETATM 1983 C01 FH A 4 -16.007 -8.929 14.086 1.00 0.21 C HETATM 1984 C16 FH A 4 -17.385 -8.973 13.447 1.00 0.14 C HETATM 1985 C24 FH A 4 -17.631 -7.665 12.693 1.00 0.00 C HETATM 1986 C26 FH A 4 -16.526 -7.385 11.664 1.00 -0.06 C HETATM 1987 H5 FH A 4 -16.739 -6.439 11.145 1.00 0.02 H HETATM 1988 H6 FH A 4 -16.491 -8.205 10.932 1.00 0.02 H HETATM 1989 H7 FH A 4 -15.556 -7.311 12.178 1.00 0.02 H HETATM 1990 C25 FH A 4 -18.986 -7.874 11.971 1.00 -0.06 C HETATM 1991 H22 FH A 4 -19.240 -6.969 11.399 1.00 0.02 H HETATM 1992 H23 FH A 4 -19.772 -8.070 12.715 1.00 0.02 H HETATM 1993 H24 FH A 4 -18.908 -8.731 11.286 1.00 0.02 H HETATM 1994 C27 FH A 4 -17.705 -6.462 13.658 1.00 -0.06 C HETATM 1995 H25 FH A 4 -16.734 -6.333 14.158 1.00 0.02 H HETATM 1996 H26 FH A 4 -18.485 -6.644 14.412 1.00 0.02 H HETATM 1997 H27 FH A 4 -17.949 -5.552 13.091 1.00 0.02 H HETATM 1998 N17 FH A 4 -18.319 -9.178 14.480 1.00 -0.24 N HETATM 1999 C18 FH A 4 -18.658 -10.512 14.822 1.00 0.32 C HETATM 2000 O19 FH A 4 -18.266 -11.489 14.220 1.00 -0.38 O HETATM 2001 O20 FH A 4 -19.502 -10.578 15.914 1.00 -0.26 O HETATM 2002 C21 FH A 4 -19.810 -11.998 16.206 1.00 0.09 C HETATM 2003 C22 FH A 4 -21.065 -12.089 16.679 1.00 -0.02 C HETATM 2004 C51 FH A 4 -20.869 -11.319 18.138 1.00 -0.05 C HETATM 2005 C52 FH A 4 -19.648 -11.756 18.635 1.00 -0.05 C HETATM 2006 C23 FH A 4 -18.920 -12.463 17.420 1.00 -0.02 C HETATM 2007 H20 FH A 4 -17.883 -12.113 17.315 1.00 0.03 H HETATM 2008 H21 FH A 4 -18.929 -13.558 17.528 1.00 0.03 H HETATM 2009 H41 FH A 4 -19.053 -10.904 18.995 1.00 0.03 H HETATM 2010 H42 FH A 4 -19.802 -12.470 19.458 1.00 0.03 H HETATM 2011 H39 FH A 4 -21.682 -11.591 18.827 1.00 0.03 H HETATM 2012 H40 FH A 4 -20.857 -10.228 17.997 1.00 0.03 H HETATM 2013 H3 FH A 4 -21.380 -13.135 16.807 1.00 0.03 H HETATM 2014 H4 FH A 4 -21.785 -11.566 16.033 1.00 0.03 H HETATM 2015 H2 FH A 4 -19.658 -12.626 15.316 1.00 0.06 H HETATM 2016 H53 FH A 4 -18.732 -8.404 14.960 1.00 0.19 H HETATM 2017 H19 FH A 4 -17.441 -9.810 12.736 1.00 0.08 H HETATM 2018 O15 FH A 4 -15.695 -8.251 15.080 1.00 -0.39 O HETATM 2019 H11 FH A 4 -16.051 -11.177 12.401 1.00 0.06 H HETATM 2020 H12 FH A 4 -14.996 -10.072 11.456 1.00 0.06 H HETATM 2021 O28 FH A 4 -14.439 -12.482 13.652 1.00 -0.29 O HETATM 2022 C29 FH A 4 -13.734 -13.633 13.887 1.00 0.20 C HETATM 2023 C30 FH A 4 -14.028 -14.413 15.116 1.00 0.09 C HETATM 2024 C31 FH A 4 -15.115 -13.931 16.057 1.00 0.01 C HETATM 2025 C53 FH A 4 -14.592 -13.953 17.473 1.00 -0.05 C HETATM 2026 H43 FH A 4 -15.377 -13.604 18.159 1.00 0.03 H HETATM 2027 H44 FH A 4 -13.717 -13.291 17.551 1.00 0.03 H HETATM 2028 H45 FH A 4 -14.301 -14.979 17.741 1.00 0.03 H HETATM 2029 C55 FH A 4 -16.264 -14.902 15.840 1.00 -0.05 C HETATM 2030 H49 FH A 4 -16.602 -14.842 14.795 1.00 0.03 H HETATM 2031 H50 FH A 4 -17.096 -14.641 16.510 1.00 0.03 H HETATM 2032 H51 FH A 4 -15.925 -15.926 16.058 1.00 0.03 H HETATM 2033 H28 FH A 4 -15.430 -12.908 15.802 1.00 0.05 H HETATM 2034 N32 FH A 4 -13.293 -15.588 15.416 1.00 -0.28 N HETATM 2035 C33 FH A 4 -12.302 -16.019 14.484 1.00 0.05 C HETATM 2036 C34 FH A 4 -11.497 -17.271 14.836 1.00 -0.04 C HETATM 2037 C35 FH A 4 -10.445 -17.709 13.885 1.00 -0.02 C HETATM 2038 C36 FH A 4 -10.199 -16.938 12.630 1.00 0.10 C HETATM 2039 C37 FH A 4 -10.964 -15.660 12.261 1.00 -0.02 C HETATM 2040 C38 FH A 4 -12.033 -15.225 13.249 1.00 0.04 C HETATM 2041 N39 FH A 4 -12.755 -14.048 12.946 1.00 -0.26 N HETATM 2042 H31 FH A 4 -10.755 -15.104 11.354 1.00 0.05 H HETATM 2043 O40 FH A 4 -9.247 -17.417 11.763 1.00 -0.32 O HETATM 2044 C41 FH A 4 -9.077 -16.601 10.621 1.00 0.06 C HETATM 2045 H32 FH A 4 -8.305 -17.037 9.970 1.00 0.06 H HETATM 2046 H33 FH A 4 -8.766 -15.593 10.933 1.00 0.06 H HETATM 2047 H34 FH A 4 -10.027 -16.538 10.071 1.00 0.06 H HETATM 2048 H30 FH A 4 -9.854 -18.591 14.102 1.00 0.06 H HETATM 2049 H29 FH A 4 -11.689 -17.821 15.751 1.00 0.06 H HETATM 2050 H8 FH A 4 -13.516 -12.137 11.777 1.00 0.07 H HETATM 2051 H9 FH A 4 -12.107 -11.337 13.614 1.00 0.03 H HETATM 2052 H10 FH A 4 -12.453 -10.217 12.253 1.00 0.03 H HETATM 2053 C11 FH A 4 -13.153 -8.389 14.105 1.00 0.20 C HETATM 2054 N10 FH A 4 -12.499 -7.999 15.285 1.00 -0.27 N HETATM 2055 C09 FH A 4 -12.201 -6.620 15.585 1.00 0.15 C HETATM 2056 C07 FH A 4 -13.449 -5.793 15.974 1.00 0.02 C HETATM 2057 C06 FH A 4 -13.450 -4.300 15.560 1.00 -0.08 C HETATM 2058 C05 FH A 4 -14.443 -3.805 14.818 1.00 -0.12 C HETATM 2059 H13 FH A 4 -14.437 -2.755 14.531 1.00 0.03 H HETATM 2060 H14 FH A 4 -15.259 -4.452 14.500 1.00 0.03 H HETATM 2061 H15 FH A 4 -12.635 -3.650 15.876 1.00 0.07 H HETATM 2062 C08 FH A 4 -12.488 -6.244 17.055 1.00 -0.00 C HETATM 2063 H17 FH A 4 -12.793 -7.022 17.770 1.00 0.03 H HETATM 2064 H18 FH A 4 -11.852 -5.506 17.566 1.00 0.03 H HETATM 2065 H16 FH A 4 -14.461 -6.219 15.908 1.00 0.05 H HETATM 2066 C42 FH A 4 -11.025 -5.904 15.055 1.00 0.25 C HETATM 2067 N44 FH A 4 -10.312 -6.699 14.133 1.00 -0.15 N HETATM 2068 S45 FH A 4 -9.017 -5.955 13.477 1.00 0.07 S HETATM 2069 C48 FH A 4 -8.365 -7.052 12.240 1.00 0.11 C HETATM 2070 C49 FH A 4 -6.944 -6.684 11.865 1.00 -0.02 C HETATM 2071 C50 FH A 4 -7.242 -7.938 12.688 1.00 -0.02 C HETATM 2072 H37 FH A 4 -7.114 -8.934 12.239 1.00 0.03 H HETATM 2073 H38 FH A 4 -6.963 -7.977 13.751 1.00 0.03 H HETATM 2074 H35 FH A 4 -6.455 -5.818 12.335 1.00 0.03 H HETATM 2075 H36 FH A 4 -6.606 -6.775 10.822 1.00 0.03 H HETATM 2076 C54 FH A 4 -9.373 -7.557 11.167 1.00 -0.04 C HETATM 2077 H46 FH A 4 -8.855 -8.224 10.462 1.00 0.03 H HETATM 2078 H47 FH A 4 -9.788 -6.697 10.621 1.00 0.03 H HETATM 2079 H48 FH A 4 -10.188 -8.107 11.660 1.00 0.03 H HETATM 2080 O46 FH A 4 -7.953 -5.466 14.355 1.00 -0.15 O HETATM 2081 O47 FH A 4 -9.526 -4.809 12.685 1.00 -0.15 O HETATM 2082 H54 FH A 4 -10.577 -7.635 13.902 1.00 0.21 H HETATM 2083 O43 FH A 4 -10.693 -4.825 15.397 1.00 -0.34 O HETATM 2084 H52 FH A 4 -12.230 -8.704 15.942 1.00 0.18 H HETATM 2085 O12 FH A 4 -13.276 -7.588 13.192 1.00 -0.39 O HETATM 2086 H1 FH A 4 -13.491 -10.219 15.072 1.00 0.08 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 532 522 533 534 535 CONECT 533 532 CONECT 534 532 CONECT 535 532 CONECT 573 566 574 575 576 CONECT 574 573 CONECT 575 573 CONECT 576 573 CONECT 1027 1026 1763 CONECT 1043 1042 1763 CONECT 1264 1257 1265 1266 1267 CONECT 1265 1264 CONECT 1266 1264 CONECT 1267 1264 CONECT 1467 1466 1763 CONECT 1493 1492 1495 1763 CONECT 1757 1758 CONECT 1758 1757 CONECT 1759 1760 CONECT 1760 1759 CONECT 1761 1762 CONECT 1762 1761 CONECT 1763 1027 1043 1467 1493 CONECT 1978 1979 1982 2053 2086 CONECT 1979 1978 1980 2051 2052 CONECT 1980 1979 1981 2021 2050 CONECT 1981 1980 1982 2019 2020 CONECT 1982 1978 1981 1983 CONECT 1983 1982 1984 2018 CONECT 1984 1983 1985 1998 2017 CONECT 1985 1984 1986 1990 1994 CONECT 1986 1985 1987 1988 1989 CONECT 1987 1986 CONECT 1988 1986 CONECT 1989 1986 CONECT 1990 1985 1991 1992 1993 CONECT 1991 1990 CONECT 1992 1990 CONECT 1993 1990 CONECT 1994 1985 1995 1996 1997 CONECT 1995 1994 CONECT 1996 1994 CONECT 1997 1994 CONECT 1998 1984 1999 2016 CONECT 1999 1998 2000 2001 CONECT 2000 1999 CONECT 2001 1999 2002 CONECT 2002 2001 2003 2006 2015 CONECT 2003 2002 2004 2013 2014 CONECT 2004 2003 2005 2011 2012 CONECT 2005 2004 2006 2009 2010 CONECT 2006 2002 2005 2007 2008 CONECT 2007 2006 CONECT 2008 2006 CONECT 2009 2005 CONECT 2010 2005 CONECT 2011 2004 CONECT 2012 2004 CONECT 2013 2003 CONECT 2014 2003 CONECT 2015 2002 CONECT 2016 1998 CONECT 2017 1984 CONECT 2018 1983 CONECT 2019 1981 CONECT 2020 1981 CONECT 2021 1980 2022 CONECT 2022 2021 2023 2041 CONECT 2023 2022 2024 2034 CONECT 2024 2023 2025 2029 2033 CONECT 2025 2024 2026 2027 2028 CONECT 2026 2025 CONECT 2027 2025 CONECT 2028 2025 CONECT 2029 2024 2030 2031 2032 CONECT 2030 2029 CONECT 2031 2029 CONECT 2032 2029 CONECT 2033 2024 CONECT 2034 2023 2035 CONECT 2035 2034 2036 2040 CONECT 2036 2035 2037 2049 CONECT 2037 2036 2038 2048 CONECT 2038 2037 2039 2043 CONECT 2039 2038 2040 2042 CONECT 2040 2035 2039 2041 CONECT 2041 2022 2040 CONECT 2042 2039 CONECT 2043 2038 2044 CONECT 2044 2043 2045 2046 2047 CONECT 2045 2044 CONECT 2046 2044 CONECT 2047 2044 CONECT 2048 2037 CONECT 2049 2036 CONECT 2050 1980 CONECT 2051 1979 CONECT 2052 1979 CONECT 2053 1978 2054 2085 CONECT 2054 2053 2055 2084 CONECT 2055 2054 2056 2062 2066 CONECT 2056 2055 2057 2062 2065 CONECT 2057 2056 2058 2061 CONECT 2058 2057 2059 2060 CONECT 2059 2058 CONECT 2060 2058 CONECT 2061 2057 CONECT 2062 2055 2056 2063 2064 CONECT 2063 2062 CONECT 2064 2062 CONECT 2065 2056 CONECT 2066 2055 2067 2083 CONECT 2067 2066 2068 2082 CONECT 2068 2067 2069 2080 2081 CONECT 2069 2068 2070 2071 2076 CONECT 2070 2069 2071 2074 2075 CONECT 2071 2069 2070 2072 2073 CONECT 2072 2071 CONECT 2073 2071 CONECT 2074 2070 CONECT 2075 2070 CONECT 2076 2069 2077 2078 2079 CONECT 2077 2076 CONECT 2078 2076 CONECT 2079 2076 CONECT 2080 2068 CONECT 2081 2068 CONECT 2082 2067 CONECT 2083 2066 CONECT 2084 2054 CONECT 2085 2053 CONECT 2086 1978 MASTER 0 0 0 0 0 0 0 0 2082 4 136 17 END
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Structure:
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Related entries of code: 6cvx
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Protein Sequence Similarity
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203aa, >3SU3_1|Chain... at 96%
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203aa, >3SU4_1|Chains... at 95%
3su5
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203aa, >3SU5_1|Chain... at 95%
3su6
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203aa, >3SU6_1|Chain... at 95%
3sud
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203aa, >3SUD_1|Chains... at 96%
3sue
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PDBbind
203aa, >3SUE_1|Chains... at 96%
3suf
RCSB PDB
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203aa, >3SUF_1|Chains... at 96%
3sug
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PDBbind
203aa, >3SUG_1|Chain... at 95%
3sv6
RCSB PDB
PDBbind
203aa, >3SV6_1|Chain... at 96%
3sv7
RCSB PDB
PDBbind
203aa, >3SV7_1|Chain... at 96%
3sv8
RCSB PDB
PDBbind
203aa, >3SV8_1|Chain... at 96%
3sv9
RCSB PDB
PDBbind
203aa, >3SV9_1|Chain... at 96%
4nwk
RCSB PDB
PDBbind
219aa, >4NWK_1|Chain... *
5epn
RCSB PDB
PDBbind
197aa, >5EPN_1|Chain... at 97%
5epy
RCSB PDB
PDBbind
198aa, >5EPY_1|Chain... at 96%
5eqq
RCSB PDB
PDBbind
190aa, >5EQQ_1|Chain... at 99%
5etx
RCSB PDB
PDBbind
194aa, >5ETX_1|Chains... at 98%
5voj
RCSB PDB
PDBbind
203aa, >5VOJ_1|Chain... at 96%
5vp9
RCSB PDB
PDBbind
203aa, >5VP9_1|Chain... at 96%
6bqj
RCSB PDB
PDBbind
219aa, >6BQJ_1|Chains... at 100%
6bqk
RCSB PDB
PDBbind
219aa, >6BQK_1|Chains... at 100%
6cvw
RCSB PDB
PDBbind
201aa, >6CVW_1|Chain... at 97%
6cvy
RCSB PDB
PDBbind
201aa, >6CVY_1|Chain... at 97%
6nzt
RCSB PDB
PDBbind
203aa, >6NZT_1|Chain... at 96%
6nzv
RCSB PDB
PDBbind
203aa, >6NZV_1|Chain... at 96%
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
6cvx
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
HCV NS3/4A WT protease
Ligand Name
FH4
EC.Number
E.C.-.-.-.-
Resolution
1.78(Å)
Affinity (Kd/Ki/IC50)
Ki=21nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ACS Med Chem Lett Vol. 9: pp. 691-696
Ligand Properties
Formula
C
3
9
H
5
4
N
6
O
9
S
Molecular Weight
782.946
Exact Mass
782.367
No. of atoms
109
No. of bonds
114
Polar Surface Area
203.6
LOGP Value
5.04 (
Computed with XLOGP3
)
6.44 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 19
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 6
Canonical SMILES
COc1ccc2c(c1)nc(c(n2)C(C)C)O[C@@H]1C[C@H](N(C1)C(=O)[C@H](C(C)(C)C)NC(=O)OC1CCCC1)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1(C)CC1
InChI String
InChI=1S/C39H54N6O9S/c1-9-23-20-39(23,35(48)44-55(50,51)38(7)16-17-38)43-32(46)29-19-26(53-33-30(22(2)3)40-27-15-14-25(52-8)18-28(27)41-33)21-45(29)34(47)31(37(4,5)6)42-36(49)54-24-12-10-11-13-24/h9,14-15,18,22-24,26,29,31H,1,10-13,16-17,19-21H2,2-8H3,(H,42,49)(H,43,46)(H,44,48)/t23-,26-,29+,31-,39-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A0A0B4WYC6
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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