Browse entries in the PDBbind-CN Database
HEADER 5VP9_COMPLEX COMPND 5VP9_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 198 MET ALA SER MET LYS LYS LYS GLY SER VAL VAL ILE VAL SEQRES 2 A 198 GLY ARG ILE ASN LEU SER GLY ASP THR ALA TYR ALA GLN SEQRES 3 A 198 GLN THR ARG GLY GLU GLU GLY CYS GLN GLU THR SER GLN SEQRES 4 A 198 THR GLY ARG ASP LYS ASN GLN VAL GLU GLY GLU VAL GLN SEQRES 5 A 198 ILE VAL SER THR ALA THR GLN THR PHE LEU ALA THR SER SEQRES 6 A 198 ILE ASN GLY VAL LEU TRP THR VAL TYR HIS GLY ALA GLY SEQRES 7 A 198 THR ARG THR ILE ALA SER PRO LYS GLY PRO VAL THR GLN SEQRES 8 A 198 MET TYR THR ASN VAL ASP LYS ASP LEU VAL GLY TRP GLN SEQRES 9 A 198 ALA PRO GLN GLY SER ARG SER LEU THR PRO CYS THR CYS SEQRES 10 A 198 GLY SER SER ASP LEU TYR LEU VAL THR ARG HIS ALA ASP SEQRES 11 A 198 VAL ILE PRO VAL ARG ARG ARG GLY ASP SER ARG GLY SER SEQRES 12 A 198 LEU LEU SER PRO ARG PRO ILE SER TYR LEU LYS GLY SER SEQRES 13 A 198 SER GLY GLY PRO LEU LEU CYS PRO ALA GLY HIS ALA VAL SEQRES 14 A 198 GLY ILE PHE ARG ALA ALA VAL SER THR ARG GLY VAL ALA SEQRES 15 A 198 LYS ALA VAL ASP PHE ILE PRO VAL GLU SER LEU GLU THR SEQRES 16 A 198 THR MET ARG HET ZN A 1 1 HET UNN A 357 112 ATOM 1 N MET A 983 7.952 -3.973 36.168 1.00 42.69 N ATOM 2 CA MET A 983 8.361 -3.928 34.768 1.00 42.91 C ATOM 3 C MET A 983 9.445 -4.958 34.465 1.00 45.91 C ATOM 4 O MET A 983 9.436 -5.592 33.409 1.00 45.59 O ATOM 5 CB MET A 983 8.878 -2.533 34.400 1.00 40.39 C ATOM 6 CG MET A 983 7.848 -1.417 34.489 1.00 33.93 C ATOM 7 SD MET A 983 6.335 -1.705 33.542 1.00 50.61 S ATOM 8 CE MET A 983 6.958 -2.381 32.003 1.00 35.80 C ATOM 9 HN3 MET A 983 8.773 -3.774 36.774 1.00 0.00 H ATOM 10 HN2 MET A 983 7.578 -4.918 36.388 1.00 0.00 H ATOM 11 HN1 MET A 983 7.214 -3.259 36.336 1.00 0.00 H ATOM 12 N ALA A 984 10.387 -5.118 35.397 1.00 47.96 N ATOM 13 CA ALA A 984 11.533 -5.988 35.157 1.00 51.26 C ATOM 14 C ALA A 984 11.137 -7.451 35.017 1.00 49.31 C ATOM 15 O ALA A 984 11.917 -8.241 34.473 1.00 56.12 O ATOM 16 CB ALA A 984 12.552 -5.843 36.288 1.00 46.95 C ATOM 17 H ALA A 984 10.303 -4.617 36.304 1.00 0.00 H ATOM 18 N SER A 985 9.956 -7.833 35.498 1.00 46.48 N ATOM 19 CA SER A 985 9.507 -9.218 35.445 1.00 54.84 C ATOM 20 C SER A 985 8.432 -9.448 34.390 1.00 55.45 C ATOM 21 O SER A 985 7.891 -10.557 34.305 1.00 44.23 O ATOM 22 CB SER A 985 8.989 -9.653 36.817 1.00 48.94 C ATOM 23 OG SER A 985 7.827 -8.925 37.172 1.00 56.02 O ATOM 24 HG SER A 985 7.511 -9.223 38.062 1.00 0.00 H ATOM 25 H SER A 985 9.333 -7.119 35.926 1.00 0.00 H ATOM 26 N MET A 986 8.107 -8.436 33.587 1.00 52.39 N ATOM 27 CA MET A 986 7.107 -8.608 32.540 1.00 52.05 C ATOM 28 C MET A 986 7.556 -9.684 31.561 1.00 48.81 C ATOM 29 O MET A 986 8.690 -9.667 31.074 1.00 38.83 O ATOM 30 CB MET A 986 6.869 -7.286 31.807 1.00 43.56 C ATOM 31 CG MET A 986 6.121 -6.253 32.635 1.00 41.98 C ATOM 32 SD MET A 986 4.429 -6.755 33.013 1.00 48.80 S ATOM 33 CE MET A 986 3.588 -6.337 31.484 1.00 35.56 C ATOM 34 H MET A 986 8.572 -7.513 33.708 1.00 0.00 H ATOM 35 N LYS A 987 6.659 -10.622 31.278 1.00 45.22 N ATOM 36 CA LYS A 987 6.970 -11.748 30.414 1.00 42.94 C ATOM 37 C LYS A 987 6.704 -11.398 28.952 1.00 40.47 C ATOM 38 O LYS A 987 6.034 -10.415 28.625 1.00 31.51 O ATOM 39 CB LYS A 987 6.154 -12.974 30.825 1.00 37.39 C ATOM 40 CG LYS A 987 6.453 -13.452 32.248 1.00 44.98 C ATOM 41 CD LYS A 987 5.226 -14.046 32.930 1.00 48.03 C ATOM 42 CE LYS A 987 5.185 -15.556 32.808 1.00 45.66 C ATOM 43 NZ LYS A 987 3.882 -16.106 33.276 1.00 54.85 N ATOM 44 HZ1 LYS A 987 3.738 -15.852 34.274 1.00 0.00 H ATOM 45 HZ2 LYS A 987 3.112 -15.708 32.701 1.00 0.00 H ATOM 46 HZ3 LYS A 987 3.889 -17.141 33.178 1.00 0.00 H ATOM 47 H LYS A 987 5.706 -10.548 31.687 1.00 0.00 H ATOM 48 N LYS A 988 7.258 -12.219 28.070 1.00 37.57 N ATOM 49 CA LYS A 988 7.162 -12.032 26.631 1.00 42.50 C ATOM 50 C LYS A 988 6.388 -13.208 26.054 1.00 37.04 C ATOM 51 O LYS A 988 6.652 -14.360 26.410 1.00 27.84 O ATOM 52 CB LYS A 988 8.568 -11.929 26.018 1.00 40.66 C ATOM 53 CG LYS A 988 8.630 -11.822 24.507 1.00 49.24 C ATOM 54 CD LYS A 988 8.018 -10.527 24.006 1.00 50.20 C ATOM 55 CE LYS A 988 8.144 -10.414 22.495 1.00 53.04 C ATOM 56 NZ LYS A 988 7.421 -9.236 21.963 1.00 34.54 N ATOM 57 HZ1 LYS A 988 6.411 -9.314 22.200 1.00 0.00 H ATOM 58 HZ2 LYS A 988 7.812 -8.370 22.387 1.00 0.00 H ATOM 59 HZ3 LYS A 988 7.534 -9.199 20.930 1.00 0.00 H ATOM 60 H LYS A 988 7.789 -13.039 28.426 1.00 0.00 H ATOM 61 N LYS A 989 5.412 -12.925 25.197 1.00 27.72 N ATOM 62 CA LYS A 989 4.723 -14.006 24.514 1.00 32.74 C ATOM 63 C LYS A 989 5.687 -14.683 23.548 1.00 28.70 C ATOM 64 O LYS A 989 6.531 -14.034 22.924 1.00 31.33 O ATOM 65 CB LYS A 989 3.486 -13.485 23.780 1.00 40.15 C ATOM 66 CG LYS A 989 2.177 -13.765 24.526 1.00 30.19 C ATOM 67 CD LYS A 989 0.992 -13.163 23.813 1.00 33.91 C ATOM 68 CE LYS A 989 -0.324 -13.678 24.365 1.00 41.25 C ATOM 69 NZ LYS A 989 -0.441 -13.452 25.818 1.00 42.36 N ATOM 70 HZ1 LYS A 989 0.332 -13.946 26.308 1.00 0.00 H ATOM 71 HZ2 LYS A 989 -0.383 -12.432 26.015 1.00 0.00 H ATOM 72 HZ3 LYS A 989 -1.355 -13.819 26.152 1.00 0.00 H ATOM 73 H LYS A 989 5.144 -11.937 25.017 1.00 0.00 H ATOM 74 N GLY A 990 5.580 -16.001 23.452 1.00 24.59 N ATOM 75 CA GLY A 990 6.447 -16.759 22.579 1.00 22.47 C ATOM 76 C GLY A 990 6.060 -16.600 21.120 1.00 23.94 C ATOM 77 O GLY A 990 5.100 -15.919 20.764 1.00 22.43 O ATOM 78 H GLY A 990 4.860 -16.498 24.014 1.00 0.00 H ATOM 79 N SER A 991 6.853 -17.231 20.262 1.00 20.83 N ATOM 80 CA SER A 991 6.565 -17.288 18.839 1.00 12.67 C ATOM 81 C SER A 991 5.588 -18.421 18.529 1.00 16.09 C ATOM 82 O SER A 991 5.482 -19.410 19.263 1.00 18.22 O ATOM 83 CB SER A 991 7.848 -17.508 18.032 1.00 17.07 C ATOM 84 OG SER A 991 8.742 -16.413 18.155 1.00 17.05 O ATOM 85 HG SER A 991 8.989 -16.295 19.106 1.00 0.00 H ATOM 86 H SER A 991 7.709 -17.700 20.621 1.00 0.00 H ATOM 87 N VAL A 992 4.871 -18.266 17.417 1.00 12.69 N ATOM 88 CA VAL A 992 4.228 -19.406 16.779 1.00 12.36 C ATOM 89 C VAL A 992 5.316 -20.333 16.256 1.00 13.20 C ATOM 90 O VAL A 992 6.346 -19.877 15.742 1.00 15.13 O ATOM 91 CB VAL A 992 3.297 -18.926 15.651 1.00 14.44 C ATOM 92 CG1 VAL A 992 2.753 -20.090 14.848 1.00 15.76 C ATOM 93 CG2 VAL A 992 2.176 -18.075 16.221 1.00 13.11 C ATOM 94 H VAL A 992 4.769 -17.319 16.999 1.00 0.00 H ATOM 95 N VAL A 993 5.105 -21.642 16.404 1.00 11.74 N ATOM 96 CA VAL A 993 6.080 -22.658 16.015 1.00 13.32 C ATOM 97 C VAL A 993 5.421 -23.638 15.052 1.00 13.25 C ATOM 98 O VAL A 993 4.343 -24.166 15.342 1.00 11.89 O ATOM 99 CB VAL A 993 6.630 -23.409 17.242 1.00 13.97 C ATOM 100 CG1 VAL A 993 7.639 -24.476 16.818 1.00 18.71 C ATOM 101 CG2 VAL A 993 7.253 -22.436 18.238 1.00 17.25 C ATOM 102 H VAL A 993 4.203 -21.954 16.816 1.00 0.00 H ATOM 103 N ILE A 994 6.083 -23.901 13.925 1.00 12.48 N ATOM 104 CA ILE A 994 5.657 -24.973 13.030 1.00 12.51 C ATOM 105 C ILE A 994 5.996 -26.300 13.690 1.00 16.93 C ATOM 106 O ILE A 994 7.153 -26.557 14.039 1.00 15.87 O ATOM 107 CB ILE A 994 6.323 -24.848 11.652 1.00 11.18 C ATOM 108 CG1 ILE A 994 5.845 -23.578 10.945 1.00 16.24 C ATOM 109 CG2 ILE A 994 6.021 -26.076 10.801 1.00 18.60 C ATOM 110 CD1 ILE A 994 6.632 -23.245 9.680 1.00 17.56 C ATOM 111 H ILE A 994 6.918 -23.332 13.679 1.00 0.00 H ATOM 112 N VAL A 995 4.986 -27.145 13.885 1.00 13.39 N ATOM 113 CA VAL A 995 5.189 -28.430 14.545 1.00 15.50 C ATOM 114 C VAL A 995 4.893 -29.610 13.637 1.00 17.37 C ATOM 115 O VAL A 995 5.061 -30.757 14.060 1.00 18.80 O ATOM 116 CB VAL A 995 4.357 -28.540 15.838 1.00 13.71 C ATOM 117 CG1 VAL A 995 4.815 -27.517 16.854 1.00 16.16 C ATOM 118 CG2 VAL A 995 2.868 -28.399 15.548 1.00 16.89 C ATOM 119 H VAL A 995 4.033 -26.884 13.560 1.00 0.00 H ATOM 120 N GLY A 996 4.469 -29.370 12.404 1.00 14.12 N ATOM 121 CA GLY A 996 4.174 -30.453 11.492 1.00 14.00 C ATOM 122 C GLY A 996 3.585 -29.891 10.216 1.00 16.32 C ATOM 123 O GLY A 996 3.640 -28.683 9.963 1.00 12.91 O ATOM 124 H GLY A 996 4.347 -28.387 12.087 1.00 0.00 H ATOM 125 N ARG A 997 3.005 -30.785 9.427 1.00 12.44 N ATOM 126 CA ARG A 997 2.419 -30.372 8.162 1.00 17.71 C ATOM 127 C ARG A 997 1.333 -31.353 7.756 1.00 17.17 C ATOM 128 O ARG A 997 1.316 -32.511 8.185 1.00 16.36 O ATOM 129 CB ARG A 997 3.481 -30.292 7.068 1.00 20.38 C ATOM 130 CG ARG A 997 3.933 -31.652 6.571 1.00 22.12 C ATOM 131 CD ARG A 997 4.970 -31.510 5.486 1.00 31.14 C ATOM 132 NE ARG A 997 6.208 -30.954 6.011 1.00 26.68 N ATOM 133 CZ ARG A 997 7.209 -31.673 6.508 1.00 31.17 C ATOM 134 NH1 ARG A 997 7.136 -32.999 6.560 1.00 30.75 N ATOM 135 NH2 ARG A 997 8.287 -31.059 6.960 1.00 18.66 N ATOM 136 HE ARG A 997 6.317 -29.920 5.996 1.00 0.00 H ATOM 137 HH12 ARG A 997 7.927 -33.548 6.952 1.00 0.00 H ATOM 138 HH11 ARG A 997 6.287 -33.487 6.209 1.00 0.00 H ATOM 139 HH22 ARG A 997 9.076 -31.613 7.351 1.00 0.00 H ATOM 140 HH21 ARG A 997 8.347 -30.021 6.925 1.00 0.00 H ATOM 141 H ARG A 997 2.969 -31.784 9.714 1.00 0.00 H ATOM 142 N ILE A 998 0.445 -30.881 6.891 1.00 14.97 N ATOM 143 CA ILE A 998 -0.507 -31.748 6.210 1.00 14.81 C ATOM 144 C ILE A 998 0.096 -32.070 4.853 1.00 20.35 C ATOM 145 O ILE A 998 0.231 -31.191 3.995 1.00 22.13 O ATOM 146 CB ILE A 998 -1.888 -31.099 6.075 1.00 16.37 C ATOM 147 CG1 ILE A 998 -2.401 -30.645 7.445 1.00 19.32 C ATOM 148 CG2 ILE A 998 -2.866 -32.086 5.418 1.00 19.34 C ATOM 149 CD1 ILE A 998 -2.481 -31.762 8.481 1.00 20.51 C ATOM 150 H ILE A 998 0.428 -29.860 6.693 1.00 0.00 H ATOM 151 N ASN A 999 0.474 -33.329 4.660 1.00 17.78 N ATOM 152 CA ASN A 999 1.153 -33.739 3.441 1.00 19.16 C ATOM 153 C ASN A 999 0.120 -33.961 2.348 1.00 20.71 C ATOM 154 O ASN A 999 -0.775 -34.801 2.492 1.00 24.05 O ATOM 155 CB ASN A 999 1.972 -35.007 3.686 1.00 16.15 C ATOM 156 CG ASN A 999 2.968 -35.277 2.579 1.00 22.03 C ATOM 157 OD1 ASN A 999 2.604 -35.357 1.409 1.00 32.90 O ATOM 158 ND2 ASN A 999 4.237 -35.401 2.943 1.00 29.12 N ATOM 159 HD22 ASN A 999 4.500 -35.326 3.946 1.00 0.00 H ATOM 160 HD21 ASN A 999 4.969 -35.573 2.225 1.00 0.00 H ATOM 161 H ASN A 999 0.280 -34.037 5.397 1.00 0.00 H ATOM 162 N LEU A1000 0.237 -33.195 1.268 1.00 19.66 N ATOM 163 CA LEU A1000 -0.669 -33.282 0.132 1.00 24.19 C ATOM 164 C LEU A1000 0.076 -33.604 -1.156 1.00 26.75 C ATOM 165 O LEU A1000 -0.484 -33.436 -2.242 1.00 27.70 O ATOM 166 CB LEU A1000 -1.439 -31.966 -0.029 1.00 20.90 C ATOM 167 CG LEU A1000 -2.260 -31.492 1.174 1.00 24.60 C ATOM 168 CD1 LEU A1000 -2.722 -30.059 0.970 1.00 26.94 C ATOM 169 CD2 LEU A1000 -3.440 -32.415 1.399 1.00 20.23 C ATOM 170 H LEU A1000 1.011 -32.502 1.233 1.00 0.00 H ATOM 171 N SER A1001 1.330 -34.050 -1.061 1.00 27.81 N ATOM 172 CA SER A1001 2.170 -34.213 -2.243 1.00 38.25 C ATOM 173 C SER A1001 1.807 -35.444 -3.066 1.00 42.70 C ATOM 174 O SER A1001 2.028 -35.453 -4.282 1.00 49.39 O ATOM 175 CB SER A1001 3.639 -34.294 -1.830 1.00 39.02 C ATOM 176 OG SER A1001 3.889 -35.444 -1.038 1.00 37.04 O ATOM 177 HG SER A1001 3.333 -35.407 -0.220 1.00 0.00 H ATOM 178 H SER A1001 1.717 -34.286 -0.125 1.00 0.00 H ATOM 179 N GLY A1002 1.270 -36.485 -2.439 1.00 36.69 N ATOM 180 CA GLY A1002 1.000 -37.723 -3.146 1.00 40.63 C ATOM 181 C GLY A1002 -0.474 -37.986 -3.371 1.00 31.08 C ATOM 182 O GLY A1002 -1.269 -37.052 -3.501 1.00 45.29 O ATOM 183 H GLY A1002 1.040 -36.412 -1.427 1.00 0.00 H ATOM 184 N ASP A1003 -0.846 -39.267 -3.424 1.00 34.71 N ATOM 185 CA ASP A1003 -2.241 -39.664 -3.570 1.00 30.15 C ATOM 186 C ASP A1003 -2.990 -39.711 -2.243 1.00 33.55 C ATOM 187 O ASP A1003 -4.221 -39.822 -2.250 1.00 36.17 O ATOM 188 CB ASP A1003 -2.322 -41.036 -4.245 1.00 35.71 C ATOM 189 H ASP A1003 -0.117 -40.006 -3.359 1.00 0.00 H ATOM 190 N THR A1004 -2.284 -39.616 -1.117 1.00 31.21 N ATOM 191 CA THR A1004 -2.871 -39.760 0.209 1.00 30.18 C ATOM 192 C THR A1004 -2.521 -38.540 1.045 1.00 21.65 C ATOM 193 O THR A1004 -1.344 -38.186 1.166 1.00 36.26 O ATOM 194 CB THR A1004 -2.357 -41.035 0.898 1.00 37.37 C ATOM 195 OG1 THR A1004 -2.566 -42.166 0.040 1.00 30.72 O ATOM 196 CG2 THR A1004 -3.079 -41.267 2.214 1.00 30.45 C ATOM 197 HG1 THR A1004 -2.234 -42.984 0.488 1.00 0.00 H ATOM 198 H THR A1004 -1.263 -39.430 -1.188 1.00 0.00 H ATOM 199 N ALA A1005 -3.534 -37.893 1.614 1.00 22.83 N ATOM 200 CA ALA A1005 -3.306 -36.769 2.513 1.00 22.46 C ATOM 201 C ALA A1005 -3.103 -37.312 3.919 1.00 23.54 C ATOM 202 O ALA A1005 -3.849 -38.189 4.365 1.00 20.76 O ATOM 203 CB ALA A1005 -4.474 -35.782 2.485 1.00 23.77 C ATOM 204 H ALA A1005 -4.509 -38.195 1.413 1.00 0.00 H ATOM 205 N TYR A1006 -2.074 -36.821 4.602 1.00 16.58 N ATOM 206 CA TYR A1006 -1.837 -37.293 5.953 1.00 15.76 C ATOM 207 C TYR A1006 -1.038 -36.260 6.721 1.00 17.60 C ATOM 208 O TYR A1006 -0.240 -35.505 6.150 1.00 15.77 O ATOM 209 CB TYR A1006 -1.117 -38.646 5.981 1.00 17.42 C ATOM 210 CG TYR A1006 0.268 -38.663 5.377 1.00 19.79 C ATOM 211 CD1 TYR A1006 0.446 -38.716 4.003 1.00 21.93 C ATOM 212 CD2 TYR A1006 1.397 -38.668 6.185 1.00 22.80 C ATOM 213 CE1 TYR A1006 1.711 -38.756 3.447 1.00 28.06 C ATOM 214 CE2 TYR A1006 2.668 -38.706 5.637 1.00 25.75 C ATOM 215 CZ TYR A1006 2.817 -38.753 4.266 1.00 31.36 C ATOM 216 OH TYR A1006 4.076 -38.792 3.710 1.00 31.02 O ATOM 217 HH TYR A1006 3.999 -38.823 2.723 1.00 0.00 H ATOM 218 H TYR A1006 -1.448 -36.109 4.174 1.00 0.00 H ATOM 219 N ALA A1007 -1.286 -36.236 8.021 1.00 12.15 N ATOM 220 CA ALA A1007 -0.598 -35.331 8.919 1.00 15.59 C ATOM 221 C ALA A1007 0.740 -35.925 9.326 1.00 13.57 C ATOM 222 O ALA A1007 0.865 -37.138 9.537 1.00 15.18 O ATOM 223 CB ALA A1007 -1.452 -35.058 10.159 1.00 17.87 C ATOM 224 H ALA A1007 -1.997 -36.887 8.410 1.00 0.00 H ATOM 225 N GLN A1008 1.740 -35.059 9.420 1.00 11.25 N ATOM 226 CA GLN A1008 3.070 -35.411 9.891 1.00 13.81 C ATOM 227 C GLN A1008 3.462 -34.442 10.991 1.00 19.65 C ATOM 228 O GLN A1008 3.321 -33.227 10.825 1.00 17.40 O ATOM 229 CB GLN A1008 4.114 -35.323 8.770 1.00 17.61 C ATOM 230 CG GLN A1008 3.870 -36.187 7.562 1.00 23.02 C ATOM 231 CD GLN A1008 4.890 -35.923 6.466 1.00 34.78 C ATOM 232 OE1 GLN A1008 4.845 -34.888 5.805 1.00 25.98 O ATOM 233 NE2 GLN A1008 5.819 -36.856 6.276 1.00 29.19 N ATOM 234 HE22 GLN A1008 5.818 -37.717 6.859 1.00 0.00 H ATOM 235 HE21 GLN A1008 6.546 -36.725 5.544 1.00 0.00 H ATOM 236 H GLN A1008 1.563 -34.073 9.141 1.00 0.00 H ATOM 237 N GLN A1009 3.974 -34.963 12.098 1.00 12.36 N ATOM 238 CA GLN A1009 4.574 -34.115 13.111 1.00 13.28 C ATOM 239 C GLN A1009 6.077 -34.046 12.899 1.00 16.80 C ATOM 240 O GLN A1009 6.731 -35.058 12.636 1.00 14.95 O ATOM 241 CB GLN A1009 4.271 -34.626 14.519 1.00 16.44 C ATOM 242 CG GLN A1009 4.589 -33.587 15.584 1.00 16.39 C ATOM 243 CD GLN A1009 4.282 -34.075 16.973 1.00 17.03 C ATOM 244 OE1 GLN A1009 3.286 -33.697 17.602 1.00 13.24 O ATOM 245 NE2 GLN A1009 5.136 -34.924 17.457 1.00 12.10 N ATOM 246 HE22 GLN A1009 5.959 -35.213 16.891 1.00 0.00 H ATOM 247 HE21 GLN A1009 4.997 -35.315 18.411 1.00 0.00 H ATOM 248 H GLN A1009 3.945 -35.993 12.242 1.00 0.00 H ATOM 249 N THR A1010 6.613 -32.833 12.990 1.00 16.17 N ATOM 250 CA THR A1010 8.038 -32.597 12.825 1.00 11.33 C ATOM 251 C THR A1010 8.708 -32.099 14.096 1.00 16.51 C ATOM 252 O THR A1010 9.942 -32.048 14.146 1.00 19.77 O ATOM 253 CB THR A1010 8.279 -31.583 11.694 1.00 17.44 C ATOM 254 OG1 THR A1010 7.566 -30.369 11.967 1.00 17.85 O ATOM 255 CG2 THR A1010 7.813 -32.143 10.367 1.00 21.28 C ATOM 256 HG1 THR A1010 7.726 -29.722 11.235 1.00 0.00 H ATOM 257 H THR A1010 5.990 -32.023 13.186 1.00 0.00 H ATOM 258 N ARG A1011 7.939 -31.738 15.120 1.00 15.88 N ATOM 259 CA ARG A1011 8.512 -31.304 16.383 1.00 18.51 C ATOM 260 C ARG A1011 7.594 -31.715 17.523 1.00 18.06 C ATOM 261 O ARG A1011 6.380 -31.507 17.452 1.00 18.14 O ATOM 262 CB ARG A1011 8.731 -29.786 16.393 1.00 22.63 C ATOM 263 CG ARG A1011 9.538 -29.309 17.576 1.00 26.48 C ATOM 264 CD ARG A1011 9.751 -27.814 17.539 1.00 27.48 C ATOM 265 NE ARG A1011 10.756 -27.383 16.568 1.00 25.97 N ATOM 266 CZ ARG A1011 12.072 -27.495 16.736 1.00 33.95 C ATOM 267 NH1 ARG A1011 12.574 -28.064 17.830 1.00 25.69 N ATOM 268 NH2 ARG A1011 12.892 -27.039 15.799 1.00 25.86 N ATOM 269 HE ARG A1011 10.418 -26.958 15.681 1.00 0.00 H ATOM 270 HH12 ARG A1011 13.604 -28.145 17.948 1.00 0.00 H ATOM 271 HH11 ARG A1011 11.936 -28.428 18.566 1.00 0.00 H ATOM 272 HH22 ARG A1011 13.921 -27.123 15.923 1.00 0.00 H ATOM 273 HH21 ARG A1011 12.506 -26.598 14.940 1.00 0.00 H ATOM 274 H ARG A1011 6.905 -31.767 15.014 1.00 0.00 H ATOM 275 N GLY A1012 8.185 -32.296 18.568 1.00 17.24 N ATOM 276 CA GLY A1012 7.456 -32.665 19.756 1.00 17.65 C ATOM 277 C GLY A1012 7.319 -31.511 20.729 1.00 22.58 C ATOM 278 O GLY A1012 7.868 -30.423 20.550 1.00 23.52 O ATOM 279 H GLY A1012 9.206 -32.489 18.524 1.00 0.00 H ATOM 280 N GLU A1013 6.585 -31.778 21.808 1.00 26.19 N ATOM 281 CA GLU A1013 6.092 -30.700 22.655 1.00 30.12 C ATOM 282 C GLU A1013 7.225 -29.951 23.348 1.00 37.27 C ATOM 283 O GLU A1013 7.187 -28.718 23.441 1.00 30.93 O ATOM 284 CB GLU A1013 5.112 -31.254 23.680 1.00 45.96 C ATOM 285 CG GLU A1013 3.992 -30.298 23.985 1.00 45.74 C ATOM 286 CD GLU A1013 3.244 -30.670 25.236 1.00 63.37 C ATOM 287 OE1 GLU A1013 2.581 -31.731 25.253 1.00 52.72 O ATOM 288 OE2 GLU A1013 3.333 -29.896 26.209 1.00 76.02 O ATOM 289 H GLU A1013 6.362 -32.765 22.048 1.00 0.00 H ATOM 290 N GLU A1014 8.237 -30.666 23.847 1.00 28.48 N ATOM 291 CA GLU A1014 9.333 -29.992 24.538 1.00 38.04 C ATOM 292 C GLU A1014 10.110 -29.099 23.580 1.00 38.77 C ATOM 293 O GLU A1014 10.410 -27.941 23.895 1.00 28.28 O ATOM 294 CB GLU A1014 10.265 -31.016 25.190 1.00 33.51 C ATOM 295 CG GLU A1014 11.394 -30.387 25.997 1.00 49.56 C ATOM 296 CD GLU A1014 12.240 -31.411 26.734 1.00 56.75 C ATOM 297 OE1 GLU A1014 11.840 -32.595 26.775 1.00 59.46 O ATOM 298 OE2 GLU A1014 13.306 -31.031 27.268 1.00 54.64 O ATOM 299 H GLU A1014 8.244 -31.701 23.744 1.00 0.00 H ATOM 300 N GLY A1015 10.454 -29.625 22.405 1.00 27.58 N ATOM 301 CA GLY A1015 11.106 -28.796 21.408 1.00 27.36 C ATOM 302 C GLY A1015 10.251 -27.609 21.005 1.00 19.72 C ATOM 303 O GLY A1015 10.765 -26.512 20.768 1.00 25.30 O ATOM 304 H GLY A1015 10.256 -30.626 22.203 1.00 0.00 H ATOM 305 N CYS A1016 8.933 -27.812 20.921 1.00 21.93 N ATOM 306 CA CYS A1016 8.036 -26.716 20.572 1.00 24.88 C ATOM 307 C CYS A1016 8.094 -25.609 21.618 1.00 22.45 C ATOM 308 O CYS A1016 8.204 -24.425 21.282 1.00 20.24 O ATOM 309 CB CYS A1016 6.605 -27.229 20.421 1.00 22.57 C ATOM 310 SG CYS A1016 5.393 -25.933 20.020 1.00 21.72 S ATOM 311 H CYS A1016 8.544 -28.759 21.106 1.00 0.00 H ATOM 312 N GLN A1017 8.000 -25.976 22.897 1.00 27.36 N ATOM 313 CA GLN A1017 8.037 -24.970 23.952 1.00 27.32 C ATOM 314 C GLN A1017 9.351 -24.203 23.931 1.00 27.43 C ATOM 315 O GLN A1017 9.359 -22.974 24.061 1.00 27.77 O ATOM 316 CB GLN A1017 7.817 -25.623 25.318 1.00 34.14 C ATOM 317 CG GLN A1017 6.443 -26.260 25.487 1.00 47.43 C ATOM 318 CD GLN A1017 5.314 -25.242 25.530 1.00 68.31 C ATOM 319 OE1 GLN A1017 5.537 -24.052 25.768 1.00 59.97 O ATOM 320 NE2 GLN A1017 4.090 -25.709 25.299 1.00 68.11 N ATOM 321 HE22 GLN A1017 3.948 -26.720 25.102 1.00 0.00 H ATOM 322 HE21 GLN A1017 3.275 -25.063 25.315 1.00 0.00 H ATOM 323 H GLN A1017 7.900 -26.982 23.142 1.00 0.00 H ATOM 324 N GLU A1018 10.473 -24.906 23.755 1.00 28.78 N ATOM 325 CA GLU A1018 11.766 -24.233 23.695 1.00 25.13 C ATOM 326 C GLU A1018 11.869 -23.333 22.467 1.00 28.23 C ATOM 327 O GLU A1018 12.371 -22.204 22.552 1.00 23.59 O ATOM 328 CB GLU A1018 12.883 -25.273 23.697 1.00 34.26 C ATOM 329 CG GLU A1018 14.287 -24.707 23.548 1.00 37.69 C ATOM 330 CD GLU A1018 14.713 -23.850 24.726 1.00 52.24 C ATOM 331 OE1 GLU A1018 13.889 -23.628 25.637 1.00 62.92 O ATOM 332 OE2 GLU A1018 15.880 -23.404 24.742 1.00 54.58 O ATOM 333 H GLU A1018 10.425 -25.941 23.660 1.00 0.00 H ATOM 334 N THR A1019 11.412 -23.822 21.313 1.00 26.14 N ATOM 335 CA THR A1019 11.457 -23.034 20.087 1.00 18.58 C ATOM 336 C THR A1019 10.564 -21.809 20.184 1.00 14.61 C ATOM 337 O THR A1019 10.888 -20.758 19.622 1.00 20.56 O ATOM 338 CB THR A1019 11.032 -23.911 18.906 1.00 22.54 C ATOM 339 OG1 THR A1019 11.847 -25.089 18.875 1.00 24.69 O ATOM 340 CG2 THR A1019 11.174 -23.167 17.592 1.00 20.15 C ATOM 341 HG1 THR A1019 11.731 -25.591 19.720 1.00 0.00 H ATOM 342 H THR A1019 11.016 -24.783 21.287 1.00 0.00 H ATOM 343 N SER A1020 9.435 -21.924 20.884 1.00 19.37 N ATOM 344 CA SER A1020 8.548 -20.779 21.059 1.00 16.63 C ATOM 345 C SER A1020 9.230 -19.674 21.861 1.00 25.05 C ATOM 346 O SER A1020 9.051 -18.485 21.574 1.00 20.09 O ATOM 347 CB SER A1020 7.260 -21.228 21.747 1.00 18.91 C ATOM 348 OG SER A1020 6.328 -20.173 21.878 1.00 27.45 O ATOM 349 HG SER A1020 6.093 -19.828 20.980 1.00 0.00 H ATOM 350 H SER A1020 9.184 -22.839 21.310 1.00 0.00 H ATOM 351 N GLN A1021 10.024 -20.051 22.868 1.00 20.52 N ATOM 352 CA GLN A1021 10.698 -19.056 23.700 1.00 24.28 C ATOM 353 C GLN A1021 11.848 -18.391 22.955 1.00 24.08 C ATOM 354 O GLN A1021 12.008 -17.168 23.020 1.00 25.45 O ATOM 355 CB GLN A1021 11.206 -19.707 24.988 1.00 26.85 C ATOM 356 H GLN A1021 10.164 -21.063 23.062 1.00 0.00 H ATOM 357 N THR A1022 12.668 -19.172 22.252 1.00 25.43 N ATOM 358 CA THR A1022 13.804 -18.593 21.541 1.00 23.82 C ATOM 359 C THR A1022 13.409 -17.955 20.215 1.00 25.05 C ATOM 360 O THR A1022 14.088 -17.031 19.754 1.00 20.71 O ATOM 361 CB THR A1022 14.868 -19.654 21.266 1.00 29.28 C ATOM 362 OG1 THR A1022 14.374 -20.580 20.289 1.00 23.90 O ATOM 363 CG2 THR A1022 15.247 -20.392 22.547 1.00 36.51 C ATOM 364 HG1 THR A1022 15.063 -21.268 20.110 1.00 0.00 H ATOM 365 H THR A1022 12.498 -20.197 22.210 1.00 0.00 H ATOM 366 N GLY A1023 12.341 -18.433 19.582 1.00 19.92 N ATOM 367 CA GLY A1023 12.037 -18.006 18.233 1.00 19.35 C ATOM 368 C GLY A1023 12.977 -18.539 17.177 1.00 19.38 C ATOM 369 O GLY A1023 12.891 -18.118 16.017 1.00 17.54 O ATOM 370 H GLY A1023 11.721 -19.118 20.059 1.00 0.00 H ATOM 371 N ARG A1024 13.865 -19.465 17.533 1.00 22.86 N ATOM 372 CA ARG A1024 14.858 -20.008 16.613 1.00 22.98 C ATOM 373 C ARG A1024 14.454 -21.426 16.234 1.00 21.45 C ATOM 374 O ARG A1024 14.490 -22.332 17.074 1.00 19.56 O ATOM 375 CB ARG A1024 16.254 -20.001 17.236 1.00 29.16 C ATOM 376 CG ARG A1024 16.820 -18.619 17.515 1.00 50.32 C ATOM 377 CD ARG A1024 18.285 -18.684 17.959 1.00 66.04 C ATOM 378 NE ARG A1024 19.121 -19.429 17.018 1.00 72.66 N ATOM 379 CZ ARG A1024 19.475 -20.707 17.153 1.00 83.18 C ATOM 380 NH1 ARG A1024 19.079 -21.417 18.201 1.00 71.62 N ATOM 381 NH2 ARG A1024 20.238 -21.282 16.231 1.00 80.44 N ATOM 382 HE ARG A1024 19.466 -18.922 16.178 1.00 0.00 H ATOM 383 HH12 ARG A1024 19.364 -22.413 18.292 1.00 0.00 H ATOM 384 HH11 ARG A1024 18.484 -20.978 18.932 1.00 0.00 H ATOM 385 HH22 ARG A1024 20.516 -22.279 16.334 1.00 0.00 H ATOM 386 HH21 ARG A1024 20.558 -20.735 15.406 1.00 0.00 H ATOM 387 H ARG A1024 13.850 -19.817 18.511 1.00 0.00 H ATOM 388 N ASP A1025 14.094 -21.617 14.966 1.00 21.62 N ATOM 389 CA ASP A1025 13.618 -22.902 14.462 1.00 24.88 C ATOM 390 C ASP A1025 14.460 -23.277 13.253 1.00 23.69 C ATOM 391 O ASP A1025 14.285 -22.706 12.172 1.00 20.80 O ATOM 392 CB ASP A1025 12.136 -22.836 14.092 1.00 19.11 C ATOM 393 CG ASP A1025 11.591 -24.179 13.621 1.00 24.01 C ATOM 394 OD1 ASP A1025 12.363 -25.164 13.587 1.00 20.17 O ATOM 395 OD2 ASP A1025 10.391 -24.249 13.287 1.00 22.06 O ATOM 396 H ASP A1025 14.155 -20.816 14.306 1.00 0.00 H ATOM 397 N LYS A1026 15.360 -24.242 13.433 1.00 25.05 N ATOM 398 CA LYS A1026 16.231 -24.708 12.365 1.00 26.83 C ATOM 399 C LYS A1026 15.662 -25.900 11.608 1.00 32.44 C ATOM 400 O LYS A1026 16.330 -26.419 10.709 1.00 23.65 O ATOM 401 CB LYS A1026 17.603 -25.085 12.935 1.00 27.64 C ATOM 402 CG LYS A1026 18.393 -23.912 13.501 1.00 43.11 C ATOM 403 CD LYS A1026 19.226 -23.233 12.433 1.00 45.56 C ATOM 404 CE LYS A1026 20.109 -22.149 13.027 1.00 56.93 C ATOM 405 NZ LYS A1026 20.707 -21.287 11.970 1.00 58.74 N ATOM 406 HZ1 LYS A1026 21.287 -21.872 11.335 1.00 0.00 H ATOM 407 HZ2 LYS A1026 19.947 -20.830 11.426 1.00 0.00 H ATOM 408 HZ3 LYS A1026 21.303 -20.559 12.414 1.00 0.00 H ATOM 409 H LYS A1026 15.443 -24.679 14.373 1.00 0.00 H ATOM 410 N ASN A1027 14.456 -26.348 11.943 1.00 20.87 N ATOM 411 CA ASN A1027 13.888 -27.500 11.262 1.00 19.09 C ATOM 412 C ASN A1027 13.571 -27.160 9.816 1.00 21.40 C ATOM 413 O ASN A1027 13.203 -26.032 9.484 1.00 24.20 O ATOM 414 CB ASN A1027 12.623 -27.981 11.972 1.00 26.19 C ATOM 415 CG ASN A1027 12.916 -28.978 13.078 1.00 33.14 C ATOM 416 OD1 ASN A1027 14.077 -29.246 13.400 1.00 33.66 O ATOM 417 ND2 ASN A1027 11.863 -29.524 13.675 1.00 37.51 N ATOM 418 HD22 ASN A1027 10.902 -29.268 13.370 1.00 0.00 H ATOM 419 HD21 ASN A1027 11.999 -30.207 14.447 1.00 0.00 H ATOM 420 H ASN A1027 13.917 -25.873 12.695 1.00 0.00 H ATOM 421 N GLN A1028 13.731 -28.155 8.952 1.00 22.98 N ATOM 422 CA GLN A1028 13.396 -27.998 7.547 1.00 27.59 C ATOM 423 C GLN A1028 11.881 -27.933 7.379 1.00 24.84 C ATOM 424 O GLN A1028 11.144 -28.734 7.965 1.00 24.11 O ATOM 425 CB GLN A1028 13.966 -29.166 6.741 1.00 34.19 C ATOM 426 CG GLN A1028 13.812 -29.028 5.237 1.00 49.30 C ATOM 427 CD GLN A1028 14.019 -30.349 4.518 1.00 55.24 C ATOM 428 OE1 GLN A1028 14.776 -31.203 4.978 1.00 49.31 O ATOM 429 NE2 GLN A1028 13.333 -30.528 3.393 1.00 47.88 N ATOM 430 HE22 GLN A1028 12.705 -29.777 3.042 1.00 0.00 H ATOM 431 HE21 GLN A1028 13.425 -31.419 2.864 1.00 0.00 H ATOM 432 H GLN A1028 14.104 -29.066 9.288 1.00 0.00 H ATOM 433 N VAL A1029 11.421 -26.982 6.573 1.00 23.39 N ATOM 434 CA VAL A1029 10.003 -26.795 6.286 1.00 19.49 C ATOM 435 C VAL A1029 9.713 -27.332 4.894 1.00 19.72 C ATOM 436 O VAL A1029 10.518 -27.166 3.971 1.00 22.53 O ATOM 437 CB VAL A1029 9.614 -25.308 6.401 1.00 22.30 C ATOM 438 CG1 VAL A1029 8.184 -25.070 5.919 1.00 19.27 C ATOM 439 CG2 VAL A1029 9.768 -24.839 7.833 1.00 25.06 C ATOM 440 H VAL A1029 12.105 -26.340 6.125 1.00 0.00 H ATOM 441 N GLU A1030 8.572 -27.996 4.745 1.00 18.23 N ATOM 442 CA GLU A1030 8.126 -28.486 3.449 1.00 16.23 C ATOM 443 C GLU A1030 6.621 -28.296 3.333 1.00 15.86 C ATOM 444 O GLU A1030 5.910 -28.240 4.339 1.00 17.97 O ATOM 445 CB GLU A1030 8.462 -29.968 3.244 1.00 19.60 C ATOM 446 CG GLU A1030 9.942 -30.273 3.156 1.00 23.69 C ATOM 447 CD GLU A1030 10.200 -31.740 2.871 1.00 33.52 C ATOM 448 OE1 GLU A1030 10.440 -32.496 3.827 1.00 34.79 O ATOM 449 OE2 GLU A1030 10.138 -32.135 1.692 1.00 47.62 O ATOM 450 H GLU A1030 7.979 -28.171 5.581 1.00 0.00 H ATOM 451 N GLY A1031 6.146 -28.172 2.097 1.00 16.10 N ATOM 452 CA GLY A1031 4.722 -28.230 1.824 1.00 21.28 C ATOM 453 C GLY A1031 4.002 -26.902 1.970 1.00 19.36 C ATOM 454 O GLY A1031 4.576 -25.857 2.296 1.00 14.94 O ATOM 455 H GLY A1031 6.810 -28.030 1.309 1.00 0.00 H ATOM 456 N GLU A1032 2.690 -26.973 1.728 1.00 18.88 N ATOM 457 CA GLU A1032 1.812 -25.810 1.666 1.00 17.00 C ATOM 458 C GLU A1032 1.064 -25.542 2.965 1.00 14.50 C ATOM 459 O GLU A1032 0.797 -24.380 3.287 1.00 16.29 O ATOM 460 CB GLU A1032 0.770 -25.995 0.553 1.00 17.07 C ATOM 461 CG GLU A1032 1.345 -26.209 -0.842 1.00 22.67 C ATOM 462 CD GLU A1032 1.625 -27.669 -1.165 1.00 33.43 C ATOM 463 OE1 GLU A1032 1.480 -28.536 -0.274 1.00 25.13 O ATOM 464 OE2 GLU A1032 1.985 -27.944 -2.326 1.00 40.42 O ATOM 465 H GLU A1032 2.270 -27.912 1.575 1.00 0.00 H ATOM 466 N VAL A1033 0.700 -26.589 3.701 1.00 12.85 N ATOM 467 CA VAL A1033 -0.124 -26.472 4.898 1.00 13.18 C ATOM 468 C VAL A1033 0.711 -26.921 6.083 1.00 17.16 C ATOM 469 O VAL A1033 1.109 -28.090 6.162 1.00 14.68 O ATOM 470 CB VAL A1033 -1.409 -27.306 4.786 1.00 13.72 C ATOM 471 CG1 VAL A1033 -2.269 -27.142 6.031 1.00 15.38 C ATOM 472 CG2 VAL A1033 -2.182 -26.920 3.526 1.00 12.63 C ATOM 473 H VAL A1033 1.018 -27.535 3.409 1.00 0.00 H ATOM 474 N GLN A1034 0.980 -25.992 6.995 1.00 13.94 N ATOM 475 CA GLN A1034 1.746 -26.253 8.202 1.00 14.42 C ATOM 476 C GLN A1034 0.798 -26.420 9.378 1.00 15.74 C ATOM 477 O GLN A1034 -0.243 -25.769 9.451 1.00 13.03 O ATOM 478 CB GLN A1034 2.716 -25.104 8.507 1.00 15.59 C ATOM 479 CG GLN A1034 3.633 -24.720 7.355 1.00 15.77 C ATOM 480 CD GLN A1034 4.454 -25.889 6.860 1.00 20.81 C ATOM 481 OE1 GLN A1034 4.954 -26.690 7.650 1.00 15.51 O ATOM 482 NE2 GLN A1034 4.588 -26.004 5.545 1.00 20.52 N ATOM 483 HE22 GLN A1034 4.148 -25.304 4.914 1.00 0.00 H ATOM 484 HE21 GLN A1034 5.133 -26.794 5.145 1.00 0.00 H ATOM 485 H GLN A1034 0.624 -25.028 6.836 1.00 0.00 H ATOM 486 N ILE A1035 1.168 -27.295 10.297 1.00 12.16 N ATOM 487 CA ILE A1035 0.546 -27.348 11.614 1.00 12.84 C ATOM 488 C ILE A1035 1.376 -26.476 12.544 1.00 13.80 C ATOM 489 O ILE A1035 2.593 -26.665 12.650 1.00 11.74 O ATOM 490 CB ILE A1035 0.478 -28.791 12.143 1.00 11.04 C ATOM 491 CG1 ILE A1035 -0.211 -29.716 11.132 1.00 18.01 C ATOM 492 CG2 ILE A1035 -0.251 -28.811 13.469 1.00 12.48 C ATOM 493 CD1 ILE A1035 -0.117 -31.197 11.508 1.00 17.69 C ATOM 494 H ILE A1035 1.928 -27.968 10.073 1.00 0.00 H ATOM 495 N VAL A1036 0.724 -25.530 13.226 1.00 11.18 N ATOM 496 CA VAL A1036 1.423 -24.548 14.046 1.00 12.34 C ATOM 497 C VAL A1036 0.872 -24.564 15.464 1.00 12.66 C ATOM 498 O VAL A1036 -0.276 -24.946 15.714 1.00 15.78 O ATOM 499 CB VAL A1036 1.332 -23.126 13.447 1.00 12.00 C ATOM 500 CG1 VAL A1036 2.037 -23.079 12.099 1.00 15.81 C ATOM 501 CG2 VAL A1036 -0.114 -22.676 13.306 1.00 13.15 C ATOM 502 H VAL A1036 -0.314 -25.493 13.170 1.00 0.00 H ATOM 503 N SER A1037 1.715 -24.142 16.403 1.00 13.22 N ATOM 504 CA SER A1037 1.341 -24.158 17.807 1.00 17.34 C ATOM 505 C SER A1037 1.888 -22.943 18.532 1.00 17.85 C ATOM 506 O SER A1037 2.972 -22.440 18.227 1.00 14.97 O ATOM 507 CB SER A1037 1.856 -25.418 18.513 1.00 19.97 C ATOM 508 OG SER A1037 1.250 -26.577 17.969 1.00 23.63 O ATOM 509 HG SER A1037 1.595 -27.379 18.437 1.00 0.00 H ATOM 510 H SER A1037 2.656 -23.795 16.128 1.00 0.00 H ATOM 511 N THR A1038 1.129 -22.504 19.517 1.00 14.25 N ATOM 512 CA THR A1038 1.617 -21.641 20.572 1.00 22.04 C ATOM 513 C THR A1038 1.700 -22.463 21.851 1.00 29.42 C ATOM 514 O THR A1038 1.473 -23.678 21.850 1.00 21.47 O ATOM 515 CB THR A1038 0.697 -20.439 20.757 1.00 23.45 C ATOM 516 OG1 THR A1038 -0.568 -20.898 21.245 1.00 22.68 O ATOM 517 CG2 THR A1038 0.505 -19.683 19.450 1.00 24.73 C ATOM 518 HG1 THR A1038 -1.173 -20.124 21.369 1.00 0.00 H ATOM 519 H THR A1038 0.130 -22.792 19.537 1.00 0.00 H ATOM 520 N ALA A1039 1.987 -21.790 22.965 1.00 24.05 N ATOM 521 CA ALA A1039 1.995 -22.489 24.244 1.00 33.44 C ATOM 522 C ALA A1039 0.618 -23.047 24.588 1.00 27.17 C ATOM 523 O ALA A1039 0.518 -24.036 25.321 1.00 35.22 O ATOM 524 CB ALA A1039 2.472 -21.548 25.350 1.00 37.94 C ATOM 525 H ALA A1039 2.204 -20.774 22.922 1.00 0.00 H ATOM 526 N THR A1040 -0.448 -22.444 24.057 1.00 23.37 N ATOM 527 CA THR A1040 -1.803 -22.735 24.495 1.00 27.17 C ATOM 528 C THR A1040 -2.737 -23.218 23.394 1.00 30.39 C ATOM 529 O THR A1040 -3.826 -23.705 23.711 1.00 33.14 O ATOM 530 CB THR A1040 -2.424 -21.486 25.142 1.00 32.98 C ATOM 531 OG1 THR A1040 -2.225 -20.356 24.284 1.00 34.50 O ATOM 532 CG2 THR A1040 -1.783 -21.206 26.489 1.00 35.74 C ATOM 533 HG1 THR A1040 -2.625 -19.552 24.701 1.00 0.00 H ATOM 534 H THR A1040 -0.304 -21.742 23.304 1.00 0.00 H ATOM 535 N GLN A1041 -2.357 -23.119 22.124 1.00 20.35 N ATOM 536 CA GLN A1041 -3.254 -23.486 21.034 1.00 21.09 C ATOM 537 C GLN A1041 -2.471 -24.169 19.923 1.00 18.27 C ATOM 538 O GLN A1041 -1.274 -23.942 19.748 1.00 17.37 O ATOM 539 CB GLN A1041 -3.971 -22.253 20.460 1.00 26.48 C ATOM 540 CG GLN A1041 -5.000 -21.628 21.379 1.00 30.98 C ATOM 541 CD GLN A1041 -5.531 -20.306 20.843 1.00 40.44 C ATOM 542 OE1 GLN A1041 -4.800 -19.542 20.216 1.00 48.96 O ATOM 543 NE2 GLN A1041 -6.807 -20.034 21.087 1.00 52.69 N ATOM 544 HE22 GLN A1041 -7.390 -20.709 21.622 1.00 0.00 H ATOM 545 HE21 GLN A1041 -7.224 -19.146 20.743 1.00 0.00 H ATOM 546 H GLN A1041 -1.401 -22.773 21.903 1.00 0.00 H ATOM 547 N THR A1042 -3.170 -24.997 19.152 1.00 18.35 N ATOM 548 CA THR A1042 -2.617 -25.543 17.924 1.00 14.70 C ATOM 549 C THR A1042 -3.644 -25.384 16.809 1.00 19.02 C ATOM 550 O THR A1042 -4.848 -25.536 17.037 1.00 20.26 O ATOM 551 CB THR A1042 -2.201 -27.016 18.089 1.00 20.35 C ATOM 552 OG1 THR A1042 -1.587 -27.479 16.880 1.00 18.32 O ATOM 553 CG2 THR A1042 -3.402 -27.889 18.421 1.00 27.51 C ATOM 554 HG1 THR A1042 -0.786 -26.930 16.686 1.00 0.00 H ATOM 555 H THR A1042 -4.136 -25.260 19.435 1.00 0.00 H ATOM 556 N PHE A1043 -3.162 -25.052 15.616 1.00 15.84 N ATOM 557 CA PHE A1043 -4.023 -24.766 14.471 1.00 14.68 C ATOM 558 C PHE A1043 -3.169 -24.904 13.208 1.00 16.23 C ATOM 559 O PHE A1043 -2.090 -25.506 13.247 1.00 15.08 O ATOM 560 CB PHE A1043 -4.699 -23.393 14.639 1.00 15.65 C ATOM 561 CG PHE A1043 -3.754 -22.283 15.037 1.00 14.70 C ATOM 562 CD1 PHE A1043 -3.322 -22.154 16.344 1.00 16.18 C ATOM 563 CD2 PHE A1043 -3.313 -21.360 14.099 1.00 11.43 C ATOM 564 CE1 PHE A1043 -2.458 -21.140 16.707 1.00 15.26 C ATOM 565 CE2 PHE A1043 -2.462 -20.344 14.455 1.00 13.92 C ATOM 566 CZ PHE A1043 -2.032 -20.230 15.761 1.00 15.30 C ATOM 567 H PHE A1043 -2.131 -24.993 15.493 1.00 0.00 H ATOM 568 N LEU A1044 -3.661 -24.390 12.086 1.00 13.80 N ATOM 569 CA LEU A1044 -2.991 -24.555 10.805 1.00 10.82 C ATOM 570 C LEU A1044 -2.577 -23.209 10.229 1.00 12.20 C ATOM 571 O LEU A1044 -3.055 -22.151 10.646 1.00 11.76 O ATOM 572 CB LEU A1044 -3.892 -25.271 9.791 1.00 11.91 C ATOM 573 CG LEU A1044 -4.388 -26.652 10.194 1.00 11.54 C ATOM 574 CD1 LEU A1044 -5.329 -27.188 9.126 1.00 15.93 C ATOM 575 CD2 LEU A1044 -3.215 -27.581 10.403 1.00 13.34 C ATOM 576 H LEU A1044 -4.551 -23.854 12.124 1.00 0.00 H ATOM 577 N ALA A1045 -1.685 -23.279 9.243 1.00 11.81 N ATOM 578 CA ALA A1045 -1.242 -22.114 8.494 1.00 13.89 C ATOM 579 C ALA A1045 -0.928 -22.552 7.069 1.00 15.80 C ATOM 580 O ALA A1045 -0.375 -23.635 6.860 1.00 15.57 O ATOM 581 CB ALA A1045 -0.018 -21.471 9.146 1.00 13.83 C ATOM 582 H ALA A1045 -1.287 -24.208 8.998 1.00 0.00 H ATOM 583 N THR A1046 -1.279 -21.709 6.098 1.00 14.06 N ATOM 584 CA THR A1046 -1.281 -22.075 4.683 1.00 12.86 C ATOM 585 C THR A1046 -0.513 -21.044 3.874 1.00 14.50 C ATOM 586 O THR A1046 -0.749 -19.840 4.023 1.00 11.29 O ATOM 587 CB THR A1046 -2.715 -22.160 4.142 1.00 12.79 C ATOM 588 OG1 THR A1046 -3.453 -23.127 4.893 1.00 14.42 O ATOM 589 CG2 THR A1046 -2.731 -22.537 2.661 1.00 15.03 C ATOM 590 HG1 THR A1046 -3.475 -22.857 5.845 1.00 0.00 H ATOM 591 H THR A1046 -1.565 -20.744 6.360 1.00 0.00 H ATOM 592 N SER A1047 0.389 -21.515 3.011 1.00 13.87 N ATOM 593 CA SER A1047 1.196 -20.633 2.171 1.00 13.72 C ATOM 594 C SER A1047 0.475 -20.357 0.858 1.00 12.94 C ATOM 595 O SER A1047 0.146 -21.287 0.114 1.00 15.45 O ATOM 596 CB SER A1047 2.571 -21.235 1.893 1.00 15.31 C ATOM 597 OG SER A1047 3.371 -21.229 3.055 1.00 14.53 O ATOM 598 HG SER A1047 2.928 -21.762 3.762 1.00 0.00 H ATOM 599 H SER A1047 0.522 -22.544 2.934 1.00 0.00 H ATOM 600 N ILE A1048 0.243 -19.078 0.572 1.00 14.12 N ATOM 601 CA ILE A1048 -0.369 -18.635 -0.677 1.00 14.33 C ATOM 602 C ILE A1048 0.400 -17.400 -1.142 1.00 14.39 C ATOM 603 O ILE A1048 0.565 -16.444 -0.376 1.00 13.10 O ATOM 604 CB ILE A1048 -1.871 -18.311 -0.500 1.00 12.76 C ATOM 605 CG1 ILE A1048 -2.642 -19.518 0.056 1.00 16.06 C ATOM 606 CG2 ILE A1048 -2.481 -17.839 -1.821 1.00 16.84 C ATOM 607 CD1 ILE A1048 -4.048 -19.186 0.540 1.00 15.30 C ATOM 608 H ILE A1048 0.511 -18.358 1.273 1.00 0.00 H ATOM 609 N ASN A1049 0.878 -17.420 -2.388 1.00 17.15 N ATOM 610 CA ASN A1049 1.620 -16.289 -2.967 1.00 21.61 C ATOM 611 C ASN A1049 2.813 -15.876 -2.104 1.00 17.70 C ATOM 612 O ASN A1049 3.103 -14.692 -1.941 1.00 19.04 O ATOM 613 CB ASN A1049 0.711 -15.076 -3.192 1.00 24.78 C ATOM 614 CG ASN A1049 -0.306 -15.278 -4.303 1.00 35.42 C ATOM 615 OD1 ASN A1049 -1.410 -14.736 -4.235 1.00 48.88 O ATOM 616 ND2 ASN A1049 0.056 -16.034 -5.331 1.00 34.31 N ATOM 617 HD22 ASN A1049 0.999 -16.473 -5.347 1.00 0.00 H ATOM 618 HD21 ASN A1049 -0.603 -16.188 -6.121 1.00 0.00 H ATOM 619 H ASN A1049 0.720 -18.266 -2.971 1.00 0.00 H ATOM 620 N GLY A1050 3.523 -16.855 -1.555 1.00 16.67 N ATOM 621 CA GLY A1050 4.719 -16.558 -0.789 1.00 16.93 C ATOM 622 C GLY A1050 4.485 -15.988 0.592 1.00 15.15 C ATOM 623 O GLY A1050 5.436 -15.494 1.207 1.00 14.64 O ATOM 624 H GLY A1050 3.219 -17.842 -1.675 1.00 0.00 H ATOM 625 N VAL A1051 3.256 -16.048 1.100 1.00 15.68 N ATOM 626 CA VAL A1051 2.920 -15.639 2.460 1.00 14.13 C ATOM 627 C VAL A1051 2.332 -16.841 3.183 1.00 13.69 C ATOM 628 O VAL A1051 1.481 -17.541 2.625 1.00 13.54 O ATOM 629 CB VAL A1051 1.916 -14.472 2.464 1.00 13.07 C ATOM 630 CG1 VAL A1051 1.547 -14.056 3.892 1.00 15.08 C ATOM 631 CG2 VAL A1051 2.486 -13.281 1.672 1.00 15.58 C ATOM 632 H VAL A1051 2.492 -16.407 0.493 1.00 0.00 H ATOM 633 N LEU A1052 2.768 -17.064 4.424 1.00 10.91 N ATOM 634 CA LEU A1052 2.165 -18.060 5.302 1.00 11.55 C ATOM 635 C LEU A1052 1.054 -17.372 6.092 1.00 13.57 C ATOM 636 O LEU A1052 1.320 -16.498 6.925 1.00 12.10 O ATOM 637 CB LEU A1052 3.210 -18.679 6.229 1.00 13.12 C ATOM 638 CG LEU A1052 2.726 -19.839 7.102 1.00 11.46 C ATOM 639 CD1 LEU A1052 2.363 -21.047 6.260 1.00 19.43 C ATOM 640 CD2 LEU A1052 3.777 -20.202 8.150 1.00 12.95 C ATOM 641 H LEU A1052 3.570 -16.505 4.779 1.00 0.00 H ATOM 642 N TRP A1053 -0.188 -17.759 5.817 1.00 13.53 N ATOM 643 CA TRP A1053 -1.368 -17.116 6.377 1.00 9.17 C ATOM 644 C TRP A1053 -1.969 -17.965 7.493 1.00 11.05 C ATOM 645 O TRP A1053 -1.980 -19.196 7.408 1.00 12.53 O ATOM 646 CB TRP A1053 -2.424 -16.916 5.294 1.00 10.00 C ATOM 647 CG TRP A1053 -2.011 -16.120 4.116 1.00 14.05 C ATOM 648 CD1 TRP A1053 -1.603 -16.594 2.899 1.00 11.04 C ATOM 649 CD2 TRP A1053 -2.012 -14.698 4.013 1.00 11.96 C ATOM 650 NE1 TRP A1053 -1.348 -15.548 2.044 1.00 14.06 N ATOM 651 CE2 TRP A1053 -1.586 -14.372 2.707 1.00 14.13 C ATOM 652 CE3 TRP A1053 -2.321 -13.664 4.900 1.00 10.40 C ATOM 653 CZ2 TRP A1053 -1.468 -13.063 2.271 1.00 18.63 C ATOM 654 CZ3 TRP A1053 -2.200 -12.358 4.462 1.00 14.81 C ATOM 655 CH2 TRP A1053 -1.779 -12.069 3.161 1.00 19.57 C ATOM 656 HE1 TRP A1053 -1.028 -15.635 1.058 1.00 0.00 H ATOM 657 H TRP A1053 -0.323 -18.561 5.169 1.00 0.00 H ATOM 658 N THR A1054 -2.492 -17.309 8.526 1.00 12.38 N ATOM 659 CA THR A1054 -3.311 -17.999 9.513 1.00 12.27 C ATOM 660 C THR A1054 -4.288 -17.007 10.137 1.00 14.59 C ATOM 661 O THR A1054 -4.432 -15.870 9.671 1.00 12.10 O ATOM 662 CB THR A1054 -2.428 -18.696 10.558 1.00 14.92 C ATOM 663 OG1 THR A1054 -3.231 -19.571 11.354 1.00 11.75 O ATOM 664 CG2 THR A1054 -1.733 -17.697 11.458 1.00 14.01 C ATOM 665 HG1 THR A1054 -3.653 -20.251 10.771 1.00 0.00 H ATOM 666 H THR A1054 -2.313 -16.290 8.630 1.00 0.00 H ATOM 667 N VAL A1055 -4.966 -17.448 11.207 1.00 12.16 N ATOM 668 CA VAL A1055 -6.020 -16.667 11.852 1.00 8.16 C ATOM 669 C VAL A1055 -5.458 -15.861 13.013 1.00 11.94 C ATOM 670 O VAL A1055 -4.611 -16.339 13.783 1.00 13.52 O ATOM 671 CB VAL A1055 -7.167 -17.579 12.338 1.00 10.42 C ATOM 672 CG1 VAL A1055 -8.012 -18.030 11.163 1.00 11.87 C ATOM 673 CG2 VAL A1055 -6.640 -18.769 13.121 1.00 13.43 C ATOM 674 H VAL A1055 -4.732 -18.385 11.594 1.00 0.00 H ATOM 675 N TYR A1056 -5.969 -14.634 13.165 1.00 11.92 N ATOM 676 CA TYR A1056 -5.588 -13.804 14.301 1.00 13.33 C ATOM 677 C TYR A1056 -6.027 -14.427 15.619 1.00 14.23 C ATOM 678 O TYR A1056 -5.331 -14.286 16.630 1.00 13.08 O ATOM 679 CB TYR A1056 -6.181 -12.395 14.145 1.00 14.06 C ATOM 680 CG TYR A1056 -5.748 -11.413 15.215 1.00 16.13 C ATOM 681 CD1 TYR A1056 -6.401 -11.350 16.444 1.00 13.02 C ATOM 682 CD2 TYR A1056 -4.684 -10.547 15.000 1.00 15.43 C ATOM 683 CE1 TYR A1056 -5.998 -10.464 17.422 1.00 15.93 C ATOM 684 CE2 TYR A1056 -4.283 -9.655 15.977 1.00 13.95 C ATOM 685 CZ TYR A1056 -4.941 -9.619 17.180 1.00 16.26 C ATOM 686 OH TYR A1056 -4.535 -8.737 18.149 1.00 15.62 O ATOM 687 HH TYR A1056 -5.110 -8.839 18.948 1.00 0.00 H ATOM 688 H TYR A1056 -6.646 -14.268 12.465 1.00 0.00 H ATOM 689 N HIS A1057 -7.172 -15.121 15.645 1.00 12.82 N ATOM 690 CA HIS A1057 -7.625 -15.658 16.923 1.00 14.10 C ATOM 691 C HIS A1057 -6.731 -16.786 17.416 1.00 16.67 C ATOM 692 O HIS A1057 -6.764 -17.115 18.608 1.00 14.45 O ATOM 693 CB HIS A1057 -9.091 -16.087 16.830 1.00 16.59 C ATOM 694 CG HIS A1057 -9.335 -17.378 16.109 1.00 14.78 C ATOM 695 ND1 HIS A1057 -9.751 -17.419 14.797 1.00 12.47 N ATOM 696 CD2 HIS A1057 -9.314 -18.665 16.537 1.00 19.09 C ATOM 697 CE1 HIS A1057 -9.936 -18.675 14.433 1.00 17.28 C ATOM 698 NE2 HIS A1057 -9.676 -19.451 15.470 1.00 17.27 N ATOM 699 H HIS A1057 -7.724 -15.273 14.777 1.00 0.00 H ATOM 700 N GLY A1058 -5.894 -17.344 16.547 1.00 13.36 N ATOM 701 CA GLY A1058 -4.889 -18.298 16.968 1.00 18.25 C ATOM 702 C GLY A1058 -3.543 -17.654 17.250 1.00 17.01 C ATOM 703 O GLY A1058 -2.948 -17.876 18.309 1.00 15.98 O ATOM 704 H GLY A1058 -5.962 -17.089 15.541 1.00 0.00 H ATOM 705 N ALA A1059 -3.066 -16.833 16.318 1.00 10.89 N ATOM 706 CA ALA A1059 -1.711 -16.292 16.383 1.00 13.32 C ATOM 707 C ALA A1059 -1.601 -14.965 17.125 1.00 14.08 C ATOM 708 O ALA A1059 -0.498 -14.608 17.569 1.00 14.61 O ATOM 709 CB ALA A1059 -1.166 -16.093 14.969 1.00 15.78 C ATOM 710 H ALA A1059 -3.677 -16.568 15.519 1.00 0.00 H ATOM 711 N GLY A1060 -2.692 -14.221 17.254 1.00 14.03 N ATOM 712 CA GLY A1060 -2.564 -12.863 17.746 1.00 18.89 C ATOM 713 C GLY A1060 -1.558 -12.119 16.903 1.00 12.55 C ATOM 714 O GLY A1060 -1.471 -12.320 15.690 1.00 13.53 O ATOM 715 H GLY A1060 -3.626 -14.606 17.006 1.00 0.00 H ATOM 716 N THR A1061 -0.754 -11.281 17.560 1.00 14.23 N ATOM 717 CA THR A1061 0.296 -10.508 16.918 1.00 10.47 C ATOM 718 C THR A1061 1.665 -11.190 16.995 1.00 19.95 C ATOM 719 O THR A1061 2.689 -10.529 16.791 1.00 12.69 O ATOM 720 CB THR A1061 0.376 -9.124 17.563 1.00 12.66 C ATOM 721 OG1 THR A1061 0.667 -9.275 18.957 1.00 16.88 O ATOM 722 CG2 THR A1061 -0.945 -8.382 17.410 1.00 12.90 C ATOM 723 HG1 THR A1061 1.532 -9.744 19.063 1.00 0.00 H ATOM 724 H THR A1061 -0.886 -11.175 18.586 1.00 0.00 H ATOM 725 N ARG A1062 1.704 -12.491 17.280 1.00 12.44 N ATOM 726 CA ARG A1062 2.964 -13.162 17.561 1.00 13.86 C ATOM 727 C ARG A1062 3.879 -13.226 16.346 1.00 14.60 C ATOM 728 O ARG A1062 3.439 -13.331 15.199 1.00 13.52 O ATOM 729 CB ARG A1062 2.722 -14.591 18.046 1.00 12.16 C ATOM 730 CG ARG A1062 2.150 -14.725 19.434 1.00 14.48 C ATOM 731 CD ARG A1062 1.874 -16.206 19.679 1.00 15.10 C ATOM 732 NE ARG A1062 1.448 -16.521 21.038 1.00 19.34 N ATOM 733 CZ ARG A1062 0.207 -16.400 21.480 1.00 20.19 C ATOM 734 NH1 ARG A1062 -0.744 -15.934 20.680 1.00 31.09 N ATOM 735 NH2 ARG A1062 -0.077 -16.735 22.731 1.00 32.68 N ATOM 736 HE ARG A1062 2.169 -16.864 21.705 1.00 0.00 H ATOM 737 HH12 ARG A1062 -1.719 -15.840 21.031 1.00 0.00 H ATOM 738 HH11 ARG A1062 -0.515 -15.663 19.703 1.00 0.00 H ATOM 739 HH22 ARG A1062 -1.050 -16.643 23.086 1.00 0.00 H ATOM 740 HH21 ARG A1062 0.673 -17.090 23.357 1.00 0.00 H ATOM 741 H ARG A1062 0.819 -13.036 17.302 1.00 0.00 H ATOM 742 N THR A1063 5.178 -13.213 16.629 1.00 15.50 N ATOM 743 CA THR A1063 6.184 -13.607 15.663 1.00 13.13 C ATOM 744 C THR A1063 6.087 -15.109 15.408 1.00 13.07 C ATOM 745 O THR A1063 5.465 -15.850 16.168 1.00 12.79 O ATOM 746 CB THR A1063 7.578 -13.268 16.180 1.00 11.31 C ATOM 747 OG1 THR A1063 7.749 -13.836 17.482 1.00 14.66 O ATOM 748 CG2 THR A1063 7.781 -11.763 16.262 1.00 16.84 C ATOM 749 HG1 THR A1063 7.644 -14.819 17.428 1.00 0.00 H ATOM 750 H THR A1063 5.483 -12.910 17.576 1.00 0.00 H ATOM 751 N ILE A1064 6.722 -15.560 14.326 1.00 14.17 N ATOM 752 CA ILE A1064 6.871 -16.983 14.037 1.00 12.04 C ATOM 753 C ILE A1064 8.344 -17.347 14.160 1.00 17.19 C ATOM 754 O ILE A1064 9.223 -16.561 13.787 1.00 15.79 O ATOM 755 CB ILE A1064 6.319 -17.341 12.642 1.00 14.82 C ATOM 756 CG1 ILE A1064 6.265 -18.854 12.462 1.00 16.35 C ATOM 757 CG2 ILE A1064 7.160 -16.698 11.533 1.00 18.89 C ATOM 758 CD1 ILE A1064 5.535 -19.285 11.206 1.00 16.57 C ATOM 759 H ILE A1064 7.127 -14.870 13.661 1.00 0.00 H ATOM 760 N ALA A1065 8.614 -18.538 14.687 1.00 15.87 N ATOM 761 CA ALA A1065 9.990 -18.999 14.816 1.00 17.09 C ATOM 762 C ALA A1065 10.568 -19.313 13.446 1.00 16.32 C ATOM 763 O ALA A1065 9.882 -19.854 12.574 1.00 16.07 O ATOM 764 CB ALA A1065 10.053 -20.233 15.715 1.00 17.26 C ATOM 765 H ALA A1065 7.835 -19.146 15.010 1.00 0.00 H ATOM 766 N SER A1066 11.837 -18.974 13.253 1.00 15.70 N ATOM 767 CA SER A1066 12.499 -19.192 11.975 1.00 17.41 C ATOM 768 C SER A1066 13.971 -19.470 12.236 1.00 17.81 C ATOM 769 O SER A1066 14.461 -19.283 13.356 1.00 19.37 O ATOM 770 CB SER A1066 12.336 -17.985 11.044 1.00 21.46 C ATOM 771 OG SER A1066 13.403 -17.077 11.219 1.00 27.41 O ATOM 772 HG SER A1066 13.415 -16.761 12.157 1.00 0.00 H ATOM 773 H SER A1066 12.371 -18.542 14.034 1.00 0.00 H ATOM 774 N PRO A1067 14.709 -19.911 11.219 1.00 18.69 N ATOM 775 CA PRO A1067 16.105 -20.320 11.458 1.00 20.78 C ATOM 776 C PRO A1067 16.979 -19.214 12.005 1.00 22.92 C ATOM 777 O PRO A1067 17.965 -19.497 12.695 1.00 26.55 O ATOM 778 CB PRO A1067 16.574 -20.766 10.067 1.00 20.20 C ATOM 779 CG PRO A1067 15.346 -21.195 9.381 1.00 24.92 C ATOM 780 CD PRO A1067 14.287 -20.216 9.842 1.00 24.78 C ATOM 781 N LYS A1068 16.642 -17.960 11.727 1.00 19.47 N ATOM 782 CA LYS A1068 17.463 -16.817 12.108 1.00 27.88 C ATOM 783 C LYS A1068 16.861 -16.022 13.259 1.00 30.25 C ATOM 784 O LYS A1068 17.338 -14.923 13.561 1.00 30.18 O ATOM 785 CB LYS A1068 17.670 -15.911 10.893 1.00 28.15 C ATOM 786 CG LYS A1068 18.293 -16.632 9.702 1.00 35.11 C ATOM 787 CD LYS A1068 17.961 -15.953 8.376 1.00 48.64 C ATOM 788 CE LYS A1068 18.763 -14.679 8.176 1.00 43.22 C ATOM 789 NZ LYS A1068 18.601 -14.126 6.811 1.00 29.36 N ATOM 790 HZ1 LYS A1068 18.925 -14.826 6.114 1.00 0.00 H ATOM 791 HZ2 LYS A1068 17.598 -13.907 6.644 1.00 0.00 H ATOM 792 HZ3 LYS A1068 19.166 -13.258 6.721 1.00 0.00 H ATOM 793 H LYS A1068 15.754 -17.786 11.215 1.00 0.00 H ATOM 794 N GLY A1069 15.831 -16.554 13.912 1.00 22.79 N ATOM 795 CA GLY A1069 15.175 -15.871 14.998 1.00 23.36 C ATOM 796 C GLY A1069 13.751 -15.500 14.637 1.00 22.28 C ATOM 797 O GLY A1069 13.288 -15.744 13.519 1.00 20.60 O ATOM 798 H GLY A1069 15.488 -17.494 13.629 1.00 0.00 H ATOM 799 N PRO A1070 13.029 -14.895 15.577 1.00 18.54 N ATOM 800 CA PRO A1070 11.609 -14.605 15.335 1.00 20.61 C ATOM 801 C PRO A1070 11.411 -13.644 14.173 1.00 27.36 C ATOM 802 O PRO A1070 12.204 -12.725 13.946 1.00 18.56 O ATOM 803 CB PRO A1070 11.130 -14.002 16.661 1.00 26.08 C ATOM 804 CG PRO A1070 12.349 -13.657 17.421 1.00 23.17 C ATOM 805 CD PRO A1070 13.446 -14.547 16.944 1.00 15.52 C ATOM 806 N VAL A1071 10.332 -13.878 13.432 1.00 19.13 N ATOM 807 CA VAL A1071 9.972 -13.090 12.260 1.00 17.05 C ATOM 808 C VAL A1071 8.646 -12.397 12.544 1.00 16.14 C ATOM 809 O VAL A1071 7.661 -13.051 12.912 1.00 14.39 O ATOM 810 CB VAL A1071 9.888 -13.969 10.997 1.00 18.90 C ATOM 811 CG1 VAL A1071 9.238 -13.221 9.840 1.00 19.10 C ATOM 812 CG2 VAL A1071 11.285 -14.443 10.585 1.00 17.24 C ATOM 813 H VAL A1071 9.711 -14.667 13.704 1.00 0.00 H ATOM 814 N THR A1072 8.630 -11.076 12.371 1.00 14.38 N ATOM 815 CA THR A1072 7.440 -10.274 12.622 1.00 15.65 C ATOM 816 C THR A1072 6.413 -10.476 11.518 1.00 12.71 C ATOM 817 O THR A1072 6.761 -10.659 10.347 1.00 14.65 O ATOM 818 CB THR A1072 7.830 -8.791 12.714 1.00 16.64 C ATOM 819 OG1 THR A1072 8.723 -8.605 13.819 1.00 22.52 O ATOM 820 CG2 THR A1072 6.609 -7.898 12.900 1.00 25.59 C ATOM 821 HG1 THR A1072 9.535 -9.154 13.682 1.00 0.00 H ATOM 822 H THR A1072 9.496 -10.601 12.046 1.00 0.00 H ATOM 823 N GLN A1073 5.140 -10.453 11.897 1.00 12.29 N ATOM 824 CA GLN A1073 4.076 -10.509 10.910 1.00 12.61 C ATOM 825 C GLN A1073 4.256 -9.414 9.874 1.00 16.89 C ATOM 826 O GLN A1073 4.621 -8.277 10.189 1.00 17.20 O ATOM 827 CB GLN A1073 2.707 -10.367 11.583 1.00 11.89 C ATOM 828 CG GLN A1073 2.336 -11.575 12.408 1.00 11.22 C ATOM 829 CD GLN A1073 1.031 -11.420 13.158 1.00 13.50 C ATOM 830 OE1 GLN A1073 0.242 -10.499 12.913 1.00 13.08 O ATOM 831 NE2 GLN A1073 0.801 -12.325 14.093 1.00 11.71 N ATOM 832 HE22 GLN A1073 1.493 -13.082 14.265 1.00 0.00 H ATOM 833 HE21 GLN A1073 -0.072 -12.280 14.657 1.00 0.00 H ATOM 834 H GLN A1073 4.904 -10.394 12.908 1.00 0.00 H ATOM 835 N MET A1074 4.004 -9.782 8.632 1.00 13.68 N ATOM 836 CA MET A1074 3.988 -8.866 7.506 1.00 15.18 C ATOM 837 C MET A1074 2.588 -8.343 7.227 1.00 16.67 C ATOM 838 O MET A1074 2.442 -7.281 6.611 1.00 15.31 O ATOM 839 CB MET A1074 4.583 -9.625 6.318 1.00 27.08 C ATOM 840 CG MET A1074 4.356 -9.134 4.925 1.00 35.09 C ATOM 841 SD MET A1074 4.887 -10.513 3.876 1.00 18.90 S ATOM 842 CE MET A1074 6.660 -10.454 4.138 1.00 18.63 C ATOM 843 H MET A1074 3.805 -10.786 8.449 1.00 0.00 H ATOM 844 N TYR A1075 1.564 -9.057 7.698 1.00 12.30 N ATOM 845 CA TYR A1075 0.173 -8.645 7.632 1.00 12.95 C ATOM 846 C TYR A1075 -0.515 -8.982 8.942 1.00 16.25 C ATOM 847 O TYR A1075 -0.321 -10.070 9.492 1.00 13.37 O ATOM 848 CB TYR A1075 -0.581 -9.340 6.504 1.00 12.33 C ATOM 849 CG TYR A1075 0.069 -9.208 5.154 1.00 16.40 C ATOM 850 CD1 TYR A1075 -0.014 -8.027 4.432 1.00 19.32 C ATOM 851 CD2 TYR A1075 0.765 -10.269 4.600 1.00 13.40 C ATOM 852 CE1 TYR A1075 0.576 -7.908 3.195 1.00 18.35 C ATOM 853 CE2 TYR A1075 1.354 -10.163 3.368 1.00 12.93 C ATOM 854 CZ TYR A1075 1.261 -8.977 2.669 1.00 19.74 C ATOM 855 OH TYR A1075 1.851 -8.869 1.434 1.00 20.04 O ATOM 856 HH TYR A1075 1.692 -7.962 1.072 1.00 0.00 H ATOM 857 H TYR A1075 1.777 -9.972 8.143 1.00 0.00 H ATOM 858 N THR A1076 -1.353 -8.060 9.409 1.00 11.71 N ATOM 859 CA THR A1076 -2.168 -8.253 10.605 1.00 15.93 C ATOM 860 C THR A1076 -3.502 -7.565 10.369 1.00 16.27 C ATOM 861 O THR A1076 -3.530 -6.356 10.122 1.00 13.19 O ATOM 862 CB THR A1076 -1.495 -7.664 11.851 1.00 15.99 C ATOM 863 OG1 THR A1076 -0.132 -8.087 11.925 1.00 13.98 O ATOM 864 CG2 THR A1076 -2.231 -8.093 13.104 1.00 13.14 C ATOM 865 HG1 THR A1076 -0.097 -9.075 11.974 1.00 0.00 H ATOM 866 H THR A1076 -1.431 -7.158 8.897 1.00 0.00 H ATOM 867 N ASN A1077 -4.607 -8.313 10.433 1.00 14.90 N ATOM 868 CA ASN A1077 -5.928 -7.697 10.254 1.00 12.79 C ATOM 869 C ASN A1077 -6.936 -8.391 11.165 1.00 12.17 C ATOM 870 O ASN A1077 -7.561 -9.384 10.783 1.00 15.03 O ATOM 871 CB ASN A1077 -6.377 -7.733 8.801 1.00 20.69 C ATOM 872 CG ASN A1077 -7.604 -6.868 8.565 1.00 18.76 C ATOM 873 OD1 ASN A1077 -8.420 -6.689 9.463 1.00 16.55 O ATOM 874 ND2 ASN A1077 -7.719 -6.304 7.370 1.00 22.57 N ATOM 875 HD22 ASN A1077 -7.002 -6.485 6.639 1.00 0.00 H ATOM 876 HD21 ASN A1077 -8.526 -5.681 7.164 1.00 0.00 H ATOM 877 H ASN A1077 -4.531 -9.335 10.610 1.00 0.00 H ATOM 878 N VAL A1078 -7.148 -7.803 12.341 1.00 11.12 N ATOM 879 CA VAL A1078 -8.062 -8.364 13.322 1.00 11.88 C ATOM 880 C VAL A1078 -9.482 -8.368 12.784 1.00 14.90 C ATOM 881 O VAL A1078 -10.283 -9.243 13.137 1.00 14.10 O ATOM 882 CB VAL A1078 -7.966 -7.586 14.645 1.00 12.83 C ATOM 883 CG1 VAL A1078 -8.514 -6.162 14.476 1.00 16.93 C ATOM 884 CG2 VAL A1078 -8.691 -8.325 15.755 1.00 15.97 C ATOM 885 H VAL A1078 -6.646 -6.919 12.563 1.00 0.00 H ATOM 886 N ASP A1079 -9.820 -7.401 11.925 1.00 14.69 N ATOM 887 CA ASP A1079 -11.179 -7.320 11.398 1.00 16.24 C ATOM 888 C ASP A1079 -11.482 -8.481 10.465 1.00 21.79 C ATOM 889 O ASP A1079 -12.637 -8.905 10.364 1.00 20.73 O ATOM 890 CB ASP A1079 -11.393 -6.003 10.653 1.00 17.51 C ATOM 891 CG ASP A1079 -11.354 -4.793 11.564 1.00 22.46 C ATOM 892 OD1 ASP A1079 -11.806 -4.897 12.713 1.00 20.40 O ATOM 893 OD2 ASP A1079 -10.887 -3.731 11.111 1.00 20.42 O ATOM 894 H ASP A1079 -9.109 -6.701 11.630 1.00 0.00 H ATOM 895 N LYS A1080 -10.469 -8.988 9.767 1.00 16.08 N ATOM 896 CA LYS A1080 -10.608 -10.176 8.934 1.00 16.40 C ATOM 897 C LYS A1080 -10.223 -11.463 9.655 1.00 16.85 C ATOM 898 O LYS A1080 -10.390 -12.544 9.084 1.00 14.94 O ATOM 899 CB LYS A1080 -9.740 -10.048 7.679 1.00 13.66 C ATOM 900 CG LYS A1080 -10.102 -8.895 6.744 1.00 23.43 C ATOM 901 CD LYS A1080 -9.202 -8.914 5.513 1.00 22.67 C ATOM 902 CE LYS A1080 -9.491 -7.755 4.574 1.00 34.25 C ATOM 903 NZ LYS A1080 -8.640 -7.828 3.351 1.00 23.93 N ATOM 904 HZ1 LYS A1080 -7.637 -7.792 3.625 1.00 0.00 H ATOM 905 HZ2 LYS A1080 -8.832 -8.719 2.849 1.00 0.00 H ATOM 906 HZ3 LYS A1080 -8.860 -7.024 2.729 1.00 0.00 H ATOM 907 H LYS A1080 -9.542 -8.519 9.818 1.00 0.00 H ATOM 908 N ASP A1081 -9.709 -11.371 10.880 1.00 13.64 N ATOM 909 CA ASP A1081 -9.188 -12.517 11.618 1.00 16.19 C ATOM 910 C ASP A1081 -8.026 -13.156 10.865 1.00 17.13 C ATOM 911 O ASP A1081 -7.919 -14.379 10.780 1.00 13.59 O ATOM 912 CB ASP A1081 -10.283 -13.553 11.896 1.00 14.05 C ATOM 913 CG ASP A1081 -9.900 -14.529 12.989 1.00 17.72 C ATOM 914 OD1 ASP A1081 -8.914 -14.261 13.716 1.00 15.01 O ATOM 915 OD2 ASP A1081 -10.586 -15.571 13.121 1.00 15.02 O ATOM 916 H ASP A1081 -9.677 -10.436 11.333 1.00 0.00 H ATOM 917 N LEU A1082 -7.138 -12.316 10.333 1.00 14.13 N ATOM 918 CA LEU A1082 -6.111 -12.748 9.394 1.00 12.85 C ATOM 919 C LEU A1082 -4.752 -12.206 9.798 1.00 14.25 C ATOM 920 O LEU A1082 -4.622 -11.030 10.146 1.00 13.80 O ATOM 921 CB LEU A1082 -6.450 -12.272 7.973 1.00 15.79 C ATOM 922 CG LEU A1082 -5.494 -12.623 6.830 1.00 15.28 C ATOM 923 CD1 LEU A1082 -5.484 -14.120 6.546 1.00 12.57 C ATOM 924 CD2 LEU A1082 -5.866 -11.857 5.567 1.00 20.65 C ATOM 925 H LEU A1082 -7.180 -11.311 10.599 1.00 0.00 H ATOM 926 N VAL A1083 -3.728 -13.058 9.716 1.00 11.79 N ATOM 927 CA VAL A1083 -2.345 -12.616 9.837 1.00 14.75 C ATOM 928 C VAL A1083 -1.516 -13.368 8.805 1.00 13.62 C ATOM 929 O VAL A1083 -1.919 -14.414 8.284 1.00 12.86 O ATOM 930 CB VAL A1083 -1.758 -12.816 11.256 1.00 14.84 C ATOM 931 CG1 VAL A1083 -2.668 -12.210 12.317 1.00 16.32 C ATOM 932 CG2 VAL A1083 -1.480 -14.280 11.553 1.00 11.61 C ATOM 933 H VAL A1083 -3.923 -14.068 9.561 1.00 0.00 H ATOM 934 N GLY A1084 -0.344 -12.823 8.517 1.00 10.84 N ATOM 935 CA GLY A1084 0.577 -13.473 7.605 1.00 12.69 C ATOM 936 C GLY A1084 2.016 -13.128 7.907 1.00 15.50 C ATOM 937 O GLY A1084 2.331 -12.015 8.341 1.00 13.56 O ATOM 938 H GLY A1084 -0.080 -11.916 8.951 1.00 0.00 H ATOM 939 N TRP A1085 2.892 -14.104 7.676 1.00 12.81 N ATOM 940 CA TRP A1085 4.335 -13.925 7.692 1.00 12.03 C ATOM 941 C TRP A1085 4.892 -14.338 6.336 1.00 15.69 C ATOM 942 O TRP A1085 4.305 -15.155 5.617 1.00 12.09 O ATOM 943 CB TRP A1085 5.035 -14.785 8.766 1.00 15.84 C ATOM 944 CG TRP A1085 4.495 -14.762 10.168 1.00 14.30 C ATOM 945 CD1 TRP A1085 4.910 -13.967 11.196 1.00 12.36 C ATOM 946 CD2 TRP A1085 3.483 -15.624 10.714 1.00 14.04 C ATOM 947 NE1 TRP A1085 4.207 -14.269 12.344 1.00 13.84 N ATOM 948 CE2 TRP A1085 3.327 -15.283 12.071 1.00 13.39 C ATOM 949 CE3 TRP A1085 2.692 -16.651 10.184 1.00 12.17 C ATOM 950 CZ2 TRP A1085 2.405 -15.922 12.900 1.00 12.36 C ATOM 951 CZ3 TRP A1085 1.784 -17.284 11.013 1.00 14.75 C ATOM 952 CH2 TRP A1085 1.653 -16.922 12.351 1.00 13.22 C ATOM 953 HE1 TRP A1085 4.326 -13.803 13.266 1.00 0.00 H ATOM 954 H TRP A1085 2.521 -15.054 7.471 1.00 0.00 H ATOM 955 N GLN A1086 6.060 -13.800 6.003 1.00 17.24 N ATOM 956 CA GLN A1086 6.784 -14.284 4.836 1.00 16.17 C ATOM 957 C GLN A1086 6.894 -15.799 4.901 1.00 15.39 C ATOM 958 O GLN A1086 7.213 -16.358 5.953 1.00 15.50 O ATOM 959 CB GLN A1086 8.176 -13.648 4.784 1.00 19.31 C ATOM 960 CG GLN A1086 9.057 -13.982 5.972 1.00 15.60 C ATOM 961 CD GLN A1086 9.992 -12.837 6.346 1.00 19.48 C ATOM 962 OE1 GLN A1086 9.558 -11.699 6.527 1.00 22.28 O ATOM 963 NE2 GLN A1086 11.276 -13.141 6.465 1.00 21.74 N ATOM 964 HE22 GLN A1086 11.597 -14.117 6.302 1.00 0.00 H ATOM 965 HE21 GLN A1086 11.963 -12.404 6.721 1.00 0.00 H ATOM 966 H GLN A1086 6.459 -13.030 6.578 1.00 0.00 H ATOM 967 N ALA A1087 6.645 -16.459 3.772 1.00 13.79 N ATOM 968 CA ALA A1087 6.617 -17.916 3.758 1.00 11.99 C ATOM 969 C ALA A1087 8.001 -18.484 4.073 1.00 19.20 C ATOM 970 O ALA A1087 9.007 -17.999 3.540 1.00 18.03 O ATOM 971 CB ALA A1087 6.145 -18.434 2.402 1.00 14.27 C ATOM 972 H ALA A1087 6.469 -15.931 2.893 1.00 0.00 H ATOM 973 N PRO A1088 8.095 -19.515 4.917 1.00 16.37 N ATOM 974 CA PRO A1088 9.416 -20.064 5.258 1.00 15.89 C ATOM 975 C PRO A1088 10.129 -20.652 4.050 1.00 16.06 C ATOM 976 O PRO A1088 9.512 -21.202 3.138 1.00 18.42 O ATOM 977 CB PRO A1088 9.098 -21.159 6.287 1.00 18.78 C ATOM 978 CG PRO A1088 7.755 -20.853 6.797 1.00 22.80 C ATOM 979 CD PRO A1088 7.019 -20.152 5.698 1.00 19.81 C ATOM 980 N GLN A1089 11.453 -20.536 4.051 1.00 16.14 N ATOM 981 CA GLN A1089 12.254 -21.237 3.058 1.00 19.03 C ATOM 982 C GLN A1089 11.948 -22.727 3.107 1.00 18.62 C ATOM 983 O GLN A1089 11.931 -23.335 4.181 1.00 26.01 O ATOM 984 CB GLN A1089 13.746 -20.998 3.310 1.00 27.02 C ATOM 985 CG GLN A1089 14.232 -19.640 2.880 1.00 38.29 C ATOM 986 CD GLN A1089 14.219 -19.474 1.370 1.00 49.75 C ATOM 987 OE1 GLN A1089 14.873 -20.227 0.647 1.00 51.86 O ATOM 988 NE2 GLN A1089 13.462 -18.494 0.886 1.00 44.54 N ATOM 989 HE22 GLN A1089 12.926 -17.882 1.534 1.00 0.00 H ATOM 990 HE21 GLN A1089 13.405 -18.339 -0.141 1.00 0.00 H ATOM 991 H GLN A1089 11.919 -19.941 4.765 1.00 0.00 H ATOM 992 N GLY A1090 11.687 -23.310 1.941 1.00 20.95 N ATOM 993 CA GLY A1090 11.353 -24.708 1.822 1.00 29.58 C ATOM 994 C GLY A1090 9.872 -24.968 1.639 1.00 20.17 C ATOM 995 O GLY A1090 9.502 -25.985 1.053 1.00 20.51 O ATOM 996 H GLY A1090 11.725 -22.733 1.077 1.00 0.00 H ATOM 997 N SER A1091 9.020 -24.078 2.135 1.00 19.59 N ATOM 998 CA SER A1091 7.594 -24.191 1.894 1.00 15.32 C ATOM 999 C SER A1091 7.293 -24.067 0.401 1.00 16.70 C ATOM 1000 O SER A1091 8.110 -23.596 -0.394 1.00 17.79 O ATOM 1001 CB SER A1091 6.837 -23.114 2.682 1.00 17.50 C ATOM 1002 OG SER A1091 7.193 -21.820 2.238 1.00 17.03 O ATOM 1003 HG SER A1091 8.165 -21.684 2.366 1.00 0.00 H ATOM 1004 H SER A1091 9.381 -23.287 2.706 1.00 0.00 H ATOM 1005 N ARG A1092 6.108 -24.533 0.023 1.00 19.73 N ATOM 1006 CA ARG A1092 5.556 -24.323 -1.304 1.00 20.37 C ATOM 1007 C ARG A1092 4.251 -23.562 -1.143 1.00 22.05 C ATOM 1008 O ARG A1092 3.548 -23.730 -0.145 1.00 18.24 O ATOM 1009 CB ARG A1092 5.317 -25.660 -2.037 1.00 21.73 C ATOM 1010 H ARG A1092 5.548 -25.075 0.711 1.00 0.00 H ATOM 1011 N SER A1093 3.939 -22.706 -2.113 1.00 19.35 N ATOM 1012 CA SER A1093 2.763 -21.851 -2.034 1.00 19.90 C ATOM 1013 C SER A1093 1.667 -22.351 -2.960 1.00 20.04 C ATOM 1014 O SER A1093 1.938 -22.810 -4.072 1.00 16.46 O ATOM 1015 CB SER A1093 3.093 -20.400 -2.402 1.00 18.01 C ATOM 1016 OG SER A1093 3.432 -19.646 -1.257 1.00 27.31 O ATOM 1017 HG SER A1093 4.224 -20.049 -0.820 1.00 0.00 H ATOM 1018 H SER A1093 4.552 -22.646 -2.951 1.00 0.00 H ATOM 1019 N LEU A1094 0.430 -22.248 -2.495 1.00 17.19 N ATOM 1020 CA LEU A1094 -0.718 -22.478 -3.355 1.00 18.97 C ATOM 1021 C LEU A1094 -0.959 -21.256 -4.231 1.00 16.82 C ATOM 1022 O LEU A1094 -0.618 -20.128 -3.865 1.00 17.83 O ATOM 1023 CB LEU A1094 -1.963 -22.764 -2.522 1.00 19.49 C ATOM 1024 CG LEU A1094 -1.920 -24.028 -1.665 1.00 16.90 C ATOM 1025 CD1 LEU A1094 -3.053 -24.005 -0.661 1.00 22.71 C ATOM 1026 CD2 LEU A1094 -1.994 -25.284 -2.518 1.00 21.52 C ATOM 1027 H LEU A1094 0.279 -21.998 -1.497 1.00 0.00 H ATOM 1028 N THR A1095 -1.556 -21.489 -5.393 1.00 17.30 N ATOM 1029 CA THR A1095 -1.906 -20.406 -6.306 1.00 20.65 C ATOM 1030 C THR A1095 -3.343 -19.963 -6.057 1.00 14.09 C ATOM 1031 O THR A1095 -4.235 -20.819 -5.948 1.00 17.84 O ATOM 1032 CB THR A1095 -1.756 -20.846 -7.760 1.00 33.10 C ATOM 1033 OG1 THR A1095 -0.396 -21.211 -8.007 1.00 27.48 O ATOM 1034 CG2 THR A1095 -2.134 -19.721 -8.712 1.00 30.08 C ATOM 1035 HG1 THR A1095 -0.141 -21.956 -7.407 1.00 0.00 H ATOM 1036 H THR A1095 -1.780 -22.469 -5.660 1.00 0.00 H ATOM 1037 N PRO A1096 -3.606 -18.660 -5.954 1.00 19.42 N ATOM 1038 CA PRO A1096 -4.990 -18.202 -5.782 1.00 19.59 C ATOM 1039 C PRO A1096 -5.870 -18.655 -6.937 1.00 21.20 C ATOM 1040 O PRO A1096 -5.489 -18.564 -8.108 1.00 18.02 O ATOM 1041 CB PRO A1096 -4.860 -16.677 -5.740 1.00 23.55 C ATOM 1042 CG PRO A1096 -3.454 -16.420 -5.372 1.00 27.42 C ATOM 1043 CD PRO A1096 -2.661 -17.530 -5.980 1.00 22.98 C ATOM 1044 N CYS A1097 -7.068 -19.122 -6.593 1.00 17.26 N ATOM 1045 CA CYS A1097 -7.990 -19.655 -7.585 1.00 20.39 C ATOM 1046 C CYS A1097 -8.580 -18.542 -8.439 1.00 21.71 C ATOM 1047 O CYS A1097 -8.994 -17.494 -7.932 1.00 24.20 O ATOM 1048 CB CYS A1097 -9.116 -20.422 -6.897 1.00 23.21 C ATOM 1049 SG CYS A1097 -10.292 -21.160 -8.049 1.00 18.19 S ATOM 1050 H CYS A1097 -7.352 -19.106 -5.593 1.00 0.00 H ATOM 1051 N THR A1098 -8.613 -18.777 -9.751 1.00 17.85 N ATOM 1052 CA THR A1098 -9.303 -17.896 -10.686 1.00 19.14 C ATOM 1053 C THR A1098 -10.357 -18.652 -11.495 1.00 25.06 C ATOM 1054 O THR A1098 -10.779 -18.175 -12.555 1.00 24.22 O ATOM 1055 CB THR A1098 -8.307 -17.225 -11.631 1.00 21.15 C ATOM 1056 OG1 THR A1098 -7.707 -18.218 -12.463 1.00 21.90 O ATOM 1057 CG2 THR A1098 -7.213 -16.490 -10.854 1.00 25.76 C ATOM 1058 HG1 THR A1098 -7.235 -18.880 -11.897 1.00 0.00 H ATOM 1059 H THR A1098 -8.129 -19.620 -10.121 1.00 0.00 H ATOM 1060 N CYS A1099 -10.797 -19.814 -11.002 1.00 18.56 N ATOM 1061 CA CYS A1099 -11.720 -20.688 -11.721 1.00 22.29 C ATOM 1062 C CYS A1099 -13.173 -20.247 -11.614 1.00 20.21 C ATOM 1063 O CYS A1099 -13.981 -20.612 -12.478 1.00 19.14 O ATOM 1064 CB CYS A1099 -11.611 -22.123 -11.182 1.00 20.96 C ATOM 1065 SG CYS A1099 -10.022 -22.890 -11.451 1.00 22.85 S ATOM 1066 H CYS A1099 -10.466 -20.110 -10.061 1.00 0.00 H ATOM 1067 N GLY A1100 -13.533 -19.503 -10.570 1.00 21.54 N ATOM 1068 CA GLY A1100 -14.926 -19.157 -10.360 1.00 23.46 C ATOM 1069 C GLY A1100 -15.807 -20.328 -9.986 1.00 25.52 C ATOM 1070 O GLY A1100 -17.028 -20.242 -10.141 1.00 32.55 O ATOM 1071 H GLY A1100 -12.811 -19.168 -9.901 1.00 0.00 H ATOM 1072 N SER A1101 -15.217 -21.414 -9.487 1.00 21.82 N ATOM 1073 CA SER A1101 -15.912 -22.662 -9.192 1.00 31.53 C ATOM 1074 C SER A1101 -16.393 -22.700 -7.745 1.00 25.82 C ATOM 1075 O SER A1101 -15.727 -22.190 -6.844 1.00 22.27 O ATOM 1076 CB SER A1101 -14.980 -23.851 -9.447 1.00 25.16 C ATOM 1077 OG SER A1101 -15.475 -25.062 -8.862 1.00 35.81 O ATOM 1078 HG SER A1101 -14.844 -25.801 -9.051 1.00 0.00 H ATOM 1079 H SER A1101 -14.196 -21.369 -9.296 1.00 0.00 H ATOM 1080 N SER A1102 -17.554 -23.333 -7.531 1.00 19.24 N ATOM 1081 CA SER A1102 -18.168 -23.438 -6.209 1.00 16.58 C ATOM 1082 C SER A1102 -18.075 -24.827 -5.588 1.00 16.92 C ATOM 1083 O SER A1102 -18.635 -25.046 -4.505 1.00 16.66 O ATOM 1084 CB SER A1102 -19.637 -23.014 -6.284 1.00 19.59 C ATOM 1085 OG SER A1102 -19.725 -21.606 -6.444 1.00 19.99 O ATOM 1086 HG SER A1102 -19.265 -21.341 -7.279 1.00 0.00 H ATOM 1087 H SER A1102 -18.040 -23.769 -8.341 1.00 0.00 H ATOM 1088 N ASP A1103 -17.392 -25.768 -6.221 1.00 18.83 N ATOM 1089 CA ASP A1103 -17.178 -27.088 -5.633 1.00 17.38 C ATOM 1090 C ASP A1103 -15.794 -27.085 -4.990 1.00 18.31 C ATOM 1091 O ASP A1103 -14.778 -27.119 -5.691 1.00 20.10 O ATOM 1092 CB ASP A1103 -17.329 -28.185 -6.685 1.00 20.18 C ATOM 1093 CG ASP A1103 -18.762 -28.298 -7.197 1.00 30.78 C ATOM 1094 OD1 ASP A1103 -19.699 -28.016 -6.416 1.00 17.43 O ATOM 1095 OD2 ASP A1103 -18.958 -28.655 -8.375 1.00 23.56 O ATOM 1096 H ASP A1103 -16.998 -25.562 -7.161 1.00 0.00 H ATOM 1097 N LEU A1104 -15.761 -27.033 -3.658 1.00 18.33 N ATOM 1098 CA LEU A1104 -14.534 -26.818 -2.900 1.00 19.45 C ATOM 1099 C LEU A1104 -14.224 -28.014 -2.007 1.00 22.25 C ATOM 1100 O LEU A1104 -15.024 -28.943 -1.856 1.00 21.26 O ATOM 1101 CB LEU A1104 -14.634 -25.559 -2.031 1.00 17.70 C ATOM 1102 CG LEU A1104 -15.223 -24.309 -2.691 1.00 15.60 C ATOM 1103 CD1 LEU A1104 -15.252 -23.167 -1.691 1.00 16.99 C ATOM 1104 CD2 LEU A1104 -14.434 -23.924 -3.907 1.00 18.54 C ATOM 1105 H LEU A1104 -16.652 -27.151 -3.135 1.00 0.00 H ATOM 1106 N TYR A1105 -13.035 -27.960 -1.403 1.00 14.94 N ATOM 1107 CA TYR A1105 -12.536 -29.005 -0.521 1.00 16.77 C ATOM 1108 C TYR A1105 -11.782 -28.370 0.638 1.00 19.78 C ATOM 1109 O TYR A1105 -10.869 -27.570 0.419 1.00 21.73 O ATOM 1110 CB TYR A1105 -11.619 -29.967 -1.288 1.00 22.06 C ATOM 1111 CG TYR A1105 -12.281 -30.549 -2.519 1.00 20.21 C ATOM 1112 CD1 TYR A1105 -13.009 -31.726 -2.443 1.00 25.29 C ATOM 1113 CD2 TYR A1105 -12.199 -29.906 -3.748 1.00 24.45 C ATOM 1114 CE1 TYR A1105 -13.627 -32.258 -3.561 1.00 30.33 C ATOM 1115 CE2 TYR A1105 -12.820 -30.424 -4.872 1.00 33.62 C ATOM 1116 CZ TYR A1105 -13.531 -31.602 -4.772 1.00 34.19 C ATOM 1117 OH TYR A1105 -14.148 -32.125 -5.888 1.00 45.72 O ATOM 1118 HH TYR A1105 -13.468 -32.311 -6.583 1.00 0.00 H ATOM 1119 H TYR A1105 -12.434 -27.128 -1.571 1.00 0.00 H ATOM 1120 N LEU A1106 -12.175 -28.712 1.862 1.00 12.42 N ATOM 1121 CA LEU A1106 -11.532 -28.207 3.068 1.00 14.56 C ATOM 1122 C LEU A1106 -10.558 -29.247 3.603 1.00 17.05 C ATOM 1123 O LEU A1106 -10.910 -30.423 3.724 1.00 17.30 O ATOM 1124 CB LEU A1106 -12.568 -27.876 4.140 1.00 14.92 C ATOM 1125 CG LEU A1106 -12.044 -27.479 5.519 1.00 19.16 C ATOM 1126 CD1 LEU A1106 -11.339 -26.152 5.441 1.00 24.38 C ATOM 1127 CD2 LEU A1106 -13.173 -27.419 6.521 1.00 32.25 C ATOM 1128 H LEU A1106 -12.976 -29.368 1.962 1.00 0.00 H ATOM 1129 N VAL A1107 -9.344 -28.811 3.929 1.00 15.75 N ATOM 1130 CA VAL A1107 -8.307 -29.692 4.461 1.00 17.25 C ATOM 1131 C VAL A1107 -8.183 -29.430 5.957 1.00 19.68 C ATOM 1132 O VAL A1107 -7.873 -28.307 6.371 1.00 16.36 O ATOM 1133 CB VAL A1107 -6.962 -29.463 3.751 1.00 18.85 C ATOM 1134 CG1 VAL A1107 -5.921 -30.458 4.248 1.00 20.00 C ATOM 1135 CG2 VAL A1107 -7.132 -29.560 2.244 1.00 19.99 C ATOM 1136 H VAL A1107 -9.124 -27.803 3.800 1.00 0.00 H ATOM 1137 N THR A1108 -8.406 -30.463 6.770 1.00 17.57 N ATOM 1138 CA THR A1108 -8.363 -30.320 8.219 1.00 15.21 C ATOM 1139 C THR A1108 -6.987 -30.678 8.778 1.00 13.08 C ATOM 1140 O THR A1108 -6.120 -31.225 8.091 1.00 13.41 O ATOM 1141 CB THR A1108 -9.410 -31.205 8.890 1.00 16.23 C ATOM 1142 OG1 THR A1108 -9.016 -32.572 8.752 1.00 15.57 O ATOM 1143 CG2 THR A1108 -10.785 -30.997 8.277 1.00 20.06 C ATOM 1144 HG1 THR A1108 -9.690 -33.154 9.185 1.00 0.00 H ATOM 1145 H THR A1108 -8.616 -31.395 6.359 1.00 0.00 H ATOM 1146 N ARG A1109 -6.811 -30.386 10.071 1.00 12.27 N ATOM 1147 CA ARG A1109 -5.556 -30.677 10.748 1.00 17.17 C ATOM 1148 C ARG A1109 -5.327 -32.165 10.889 1.00 18.61 C ATOM 1149 O ARG A1109 -4.206 -32.571 11.191 1.00 18.81 O ATOM 1150 CB ARG A1109 -5.517 -30.044 12.141 1.00 21.43 C ATOM 1151 CG ARG A1109 -6.407 -30.726 13.175 1.00 20.97 C ATOM 1152 CD ARG A1109 -6.243 -30.112 14.573 1.00 23.15 C ATOM 1153 NE ARG A1109 -4.954 -30.431 15.184 1.00 22.51 N ATOM 1154 CZ ARG A1109 -3.925 -29.594 15.297 1.00 27.77 C ATOM 1155 NH1 ARG A1109 -3.992 -28.352 14.840 1.00 22.40 N ATOM 1156 NH2 ARG A1109 -2.808 -30.007 15.882 1.00 30.07 N ATOM 1157 HE ARG A1109 -4.830 -31.392 15.562 1.00 0.00 H ATOM 1158 HH12 ARG A1109 -3.175 -27.716 14.940 1.00 0.00 H ATOM 1159 HH11 ARG A1109 -4.862 -28.013 14.382 1.00 0.00 H ATOM 1160 HH22 ARG A1109 -1.999 -29.360 15.974 1.00 0.00 H ATOM 1161 HH21 ARG A1109 -2.741 -30.978 16.248 1.00 0.00 H ATOM 1162 H ARG A1109 -7.586 -29.942 10.603 1.00 0.00 H ATOM 1163 N HIS A1110 -6.369 -32.973 10.708 1.00 16.44 N ATOM 1164 CA HIS A1110 -6.244 -34.423 10.701 1.00 20.88 C ATOM 1165 C HIS A1110 -6.111 -34.973 9.295 1.00 18.70 C ATOM 1166 O HIS A1110 -6.209 -36.189 9.101 1.00 22.34 O ATOM 1167 CB HIS A1110 -7.444 -35.053 11.406 1.00 23.37 C ATOM 1168 CG HIS A1110 -7.679 -34.500 12.774 1.00 21.31 C ATOM 1169 ND1 HIS A1110 -6.753 -34.614 13.787 1.00 21.14 N ATOM 1170 CD2 HIS A1110 -8.713 -33.790 13.286 1.00 22.88 C ATOM 1171 CE1 HIS A1110 -7.210 -34.006 14.868 1.00 28.25 C ATOM 1172 NE2 HIS A1110 -8.400 -33.505 14.593 1.00 21.29 N ATOM 1173 H HIS A1110 -7.309 -32.552 10.566 1.00 0.00 H ATOM 1174 N ALA A1111 -5.890 -34.098 8.314 1.00 18.80 N ATOM 1175 CA ALA A1111 -5.695 -34.455 6.916 1.00 15.81 C ATOM 1176 C ALA A1111 -6.938 -35.066 6.287 1.00 17.35 C ATOM 1177 O ALA A1111 -6.833 -35.829 5.320 1.00 20.41 O ATOM 1178 CB ALA A1111 -4.508 -35.403 6.741 1.00 18.23 C ATOM 1179 H ALA A1111 -5.854 -33.089 8.565 1.00 0.00 H ATOM 1180 N ASP A1112 -8.111 -34.765 6.826 1.00 19.20 N ATOM 1181 CA ASP A1112 -9.351 -35.055 6.124 1.00 18.39 C ATOM 1182 C ASP A1112 -9.561 -34.018 5.031 1.00 21.86 C ATOM 1183 O ASP A1112 -9.306 -32.829 5.234 1.00 21.32 O ATOM 1184 CB ASP A1112 -10.530 -35.054 7.097 1.00 19.78 C ATOM 1185 CG ASP A1112 -10.434 -36.162 8.134 1.00 24.20 C ATOM 1186 OD1 ASP A1112 -10.166 -37.313 7.743 1.00 33.16 O ATOM 1187 OD2 ASP A1112 -10.603 -35.871 9.336 1.00 37.66 O ATOM 1188 H ASP A1112 -8.145 -34.316 7.763 1.00 0.00 H ATOM 1189 N VAL A1113 -9.994 -34.474 3.858 1.00 21.93 N ATOM 1190 CA VAL A1113 -10.367 -33.590 2.757 1.00 19.55 C ATOM 1191 C VAL A1113 -11.887 -33.636 2.645 1.00 29.48 C ATOM 1192 O VAL A1113 -12.446 -34.635 2.179 1.00 28.52 O ATOM 1193 CB VAL A1113 -9.698 -33.998 1.439 1.00 23.95 C ATOM 1194 CG1 VAL A1113 -10.083 -33.033 0.329 1.00 28.79 C ATOM 1195 CG2 VAL A1113 -8.185 -34.058 1.590 1.00 25.05 C ATOM 1196 H VAL A1113 -10.070 -35.502 3.720 1.00 0.00 H ATOM 1197 N ILE A1114 -12.549 -32.557 3.049 1.00 21.88 N ATOM 1198 CA ILE A1114 -14.002 -32.514 3.216 1.00 18.91 C ATOM 1199 C ILE A1114 -14.600 -31.748 2.036 1.00 26.10 C ATOM 1200 O ILE A1114 -14.240 -30.579 1.834 1.00 18.80 O ATOM 1201 CB ILE A1114 -14.393 -31.833 4.537 1.00 26.75 C ATOM 1202 CG1 ILE A1114 -13.829 -32.589 5.740 1.00 39.65 C ATOM 1203 CG2 ILE A1114 -15.904 -31.737 4.673 1.00 33.87 C ATOM 1204 CD1 ILE A1114 -13.883 -31.771 7.020 1.00 33.82 C ATOM 1205 H ILE A1114 -12.005 -31.696 3.258 1.00 0.00 H ATOM 1206 N PRO A1115 -15.520 -32.334 1.272 1.00 22.04 N ATOM 1207 CA PRO A1115 -16.188 -31.553 0.222 1.00 22.68 C ATOM 1208 C PRO A1115 -17.056 -30.457 0.815 1.00 14.90 C ATOM 1209 O PRO A1115 -17.809 -30.681 1.766 1.00 17.94 O ATOM 1210 CB PRO A1115 -17.035 -32.596 -0.517 1.00 28.83 C ATOM 1211 CG PRO A1115 -16.401 -33.906 -0.191 1.00 29.39 C ATOM 1212 CD PRO A1115 -15.891 -33.760 1.202 1.00 27.88 C ATOM 1213 N VAL A1116 -16.950 -29.267 0.226 1.00 20.11 N ATOM 1214 CA VAL A1116 -17.674 -28.074 0.655 1.00 18.63 C ATOM 1215 C VAL A1116 -18.260 -27.405 -0.581 1.00 16.07 C ATOM 1216 O VAL A1116 -17.538 -27.142 -1.547 1.00 15.73 O ATOM 1217 CB VAL A1116 -16.758 -27.079 1.401 1.00 15.75 C ATOM 1218 CG1 VAL A1116 -17.487 -25.764 1.686 1.00 15.49 C ATOM 1219 CG2 VAL A1116 -16.235 -27.674 2.686 1.00 14.84 C ATOM 1220 H VAL A1116 -16.312 -29.182 -0.591 1.00 0.00 H ATOM 1221 N ARG A1117 -19.556 -27.119 -0.550 1.00 14.35 N ATOM 1222 CA ARG A1117 -20.191 -26.360 -1.617 1.00 16.18 C ATOM 1223 C ARG A1117 -20.166 -24.885 -1.236 1.00 16.02 C ATOM 1224 O ARG A1117 -20.659 -24.504 -0.169 1.00 14.48 O ATOM 1225 CB ARG A1117 -21.626 -26.840 -1.849 1.00 18.94 C ATOM 1226 CG ARG A1117 -22.421 -26.001 -2.846 1.00 19.54 C ATOM 1227 CD ARG A1117 -21.904 -26.128 -4.277 1.00 19.96 C ATOM 1228 NE ARG A1117 -22.604 -25.197 -5.166 1.00 19.18 N ATOM 1229 CZ ARG A1117 -22.456 -25.144 -6.487 1.00 21.64 C ATOM 1230 NH1 ARG A1117 -21.632 -25.976 -7.110 1.00 19.98 N ATOM 1231 NH2 ARG A1117 -23.147 -24.255 -7.191 1.00 19.85 N ATOM 1232 HE ARG A1117 -23.268 -24.526 -4.730 1.00 0.00 H ATOM 1233 HH12 ARG A1117 -21.525 -25.925 -8.143 1.00 0.00 H ATOM 1234 HH11 ARG A1117 -21.093 -26.679 -6.565 1.00 0.00 H ATOM 1235 HH22 ARG A1117 -23.035 -24.209 -8.224 1.00 0.00 H ATOM 1236 HH21 ARG A1117 -23.800 -23.604 -6.709 1.00 0.00 H ATOM 1237 H ARG A1117 -20.130 -27.444 0.254 1.00 0.00 H ATOM 1238 N ARG A1118 -19.595 -24.055 -2.101 1.00 14.75 N ATOM 1239 CA ARG A1118 -19.528 -22.637 -1.799 1.00 14.96 C ATOM 1240 C ARG A1118 -20.935 -22.058 -1.838 1.00 15.64 C ATOM 1241 O ARG A1118 -21.707 -22.351 -2.755 1.00 14.55 O ATOM 1242 CB ARG A1118 -18.619 -21.915 -2.787 1.00 15.46 C ATOM 1243 CG ARG A1118 -18.220 -20.529 -2.297 1.00 15.40 C ATOM 1244 CD ARG A1118 -17.318 -19.804 -3.254 1.00 15.27 C ATOM 1245 NE ARG A1118 -16.819 -18.567 -2.651 1.00 15.27 N ATOM 1246 CZ ARG A1118 -15.746 -17.909 -3.067 1.00 15.18 C ATOM 1247 NH1 ARG A1118 -15.056 -18.351 -4.107 1.00 18.17 N ATOM 1248 NH2 ARG A1118 -15.365 -16.802 -2.442 1.00 18.09 N ATOM 1249 HE ARG A1118 -17.342 -18.178 -1.841 1.00 0.00 H ATOM 1250 HH12 ARG A1118 -14.215 -17.833 -4.431 1.00 0.00 H ATOM 1251 HH11 ARG A1118 -15.355 -19.217 -4.600 1.00 0.00 H ATOM 1252 HH22 ARG A1118 -14.523 -16.285 -2.767 1.00 0.00 H ATOM 1253 HH21 ARG A1118 -15.908 -16.452 -1.627 1.00 0.00 H ATOM 1254 H ARG A1118 -19.198 -24.419 -2.990 1.00 0.00 H ATOM 1255 N ARG A1119 -21.268 -21.251 -0.827 1.00 12.62 N ATOM 1256 CA ARG A1119 -22.608 -20.695 -0.666 1.00 11.94 C ATOM 1257 C ARG A1119 -22.626 -19.178 -0.647 1.00 17.83 C ATOM 1258 O ARG A1119 -23.713 -18.589 -0.657 1.00 15.88 O ATOM 1259 CB ARG A1119 -23.255 -21.207 0.630 1.00 13.33 C ATOM 1260 CG ARG A1119 -23.501 -22.708 0.664 1.00 17.51 C ATOM 1261 CD ARG A1119 -24.491 -23.132 -0.418 1.00 23.31 C ATOM 1262 NE ARG A1119 -24.873 -24.531 -0.278 1.00 19.92 N ATOM 1263 CZ ARG A1119 -25.592 -25.207 -1.168 1.00 27.41 C ATOM 1264 NH1 ARG A1119 -25.999 -24.621 -2.290 1.00 27.97 N ATOM 1265 NH2 ARG A1119 -25.898 -26.477 -0.938 1.00 22.49 N ATOM 1266 HE ARG A1119 -24.562 -25.035 0.577 1.00 0.00 H ATOM 1267 HH12 ARG A1119 -26.561 -25.156 -2.982 1.00 0.00 H ATOM 1268 HH11 ARG A1119 -25.755 -23.627 -2.476 1.00 0.00 H ATOM 1269 HH22 ARG A1119 -26.460 -27.010 -1.632 1.00 0.00 H ATOM 1270 HH21 ARG A1119 -25.575 -26.940 -0.064 1.00 0.00 H ATOM 1271 H ARG A1119 -20.541 -21.008 -0.124 1.00 0.00 H ATOM 1272 N GLY A1120 -21.467 -18.541 -0.617 1.00 17.81 N ATOM 1273 CA GLY A1120 -21.379 -17.099 -0.647 1.00 16.50 C ATOM 1274 C GLY A1120 -19.929 -16.695 -0.758 1.00 13.73 C ATOM 1275 O GLY A1120 -19.049 -17.531 -0.975 1.00 14.77 O ATOM 1276 H GLY A1120 -20.589 -19.097 -0.570 1.00 0.00 H ATOM 1277 N ASP A1121 -19.671 -15.400 -0.581 1.00 15.38 N ATOM 1278 CA ASP A1121 -18.292 -14.939 -0.694 1.00 11.64 C ATOM 1279 C ASP A1121 -17.408 -15.584 0.367 1.00 15.02 C ATOM 1280 O ASP A1121 -16.239 -15.900 0.102 1.00 17.56 O ATOM 1281 CB ASP A1121 -18.217 -13.411 -0.621 1.00 14.23 C ATOM 1282 CG ASP A1121 -18.957 -12.819 0.571 1.00 20.80 C ATOM 1283 OD1 ASP A1121 -19.541 -13.560 1.383 1.00 20.00 O ATOM 1284 OD2 ASP A1121 -18.947 -11.577 0.687 1.00 27.90 O ATOM 1285 H ASP A1121 -20.438 -14.731 -0.366 1.00 0.00 H ATOM 1286 N SER A1122 -17.956 -15.830 1.561 1.00 12.66 N ATOM 1287 CA SER A1122 -17.151 -16.315 2.679 1.00 13.99 C ATOM 1288 C SER A1122 -17.769 -17.507 3.406 1.00 17.95 C ATOM 1289 O SER A1122 -17.368 -17.800 4.539 1.00 13.73 O ATOM 1290 CB SER A1122 -16.908 -15.179 3.671 1.00 18.61 C ATOM 1291 OG SER A1122 -18.142 -14.657 4.131 1.00 19.27 O ATOM 1292 HG SER A1122 -18.660 -14.310 3.362 1.00 0.00 H ATOM 1293 H SER A1122 -18.975 -15.673 1.697 1.00 0.00 H ATOM 1294 N ARG A1123 -18.710 -18.215 2.782 1.00 15.22 N ATOM 1295 CA ARG A1123 -19.407 -19.332 3.411 1.00 16.01 C ATOM 1296 C ARG A1123 -19.456 -20.530 2.476 1.00 14.12 C ATOM 1297 O ARG A1123 -19.552 -20.386 1.257 1.00 15.00 O ATOM 1298 CB ARG A1123 -20.845 -18.955 3.792 1.00 19.79 C ATOM 1299 CG ARG A1123 -20.964 -17.944 4.908 1.00 35.82 C ATOM 1300 CD ARG A1123 -20.588 -18.555 6.245 1.00 43.45 C ATOM 1301 NE ARG A1123 -20.834 -17.640 7.356 1.00 40.78 N ATOM 1302 CZ ARG A1123 -21.958 -17.592 8.070 1.00 40.50 C ATOM 1303 NH1 ARG A1123 -22.973 -18.407 7.806 1.00 38.22 N ATOM 1304 NH2 ARG A1123 -22.066 -16.719 9.061 1.00 57.99 N ATOM 1305 HE ARG A1123 -20.075 -16.976 7.609 1.00 0.00 H ATOM 1306 HH12 ARG A1123 -23.843 -18.355 8.374 1.00 0.00 H ATOM 1307 HH11 ARG A1123 -22.898 -19.097 7.031 1.00 0.00 H ATOM 1308 HH22 ARG A1123 -22.940 -16.676 9.623 1.00 0.00 H ATOM 1309 HH21 ARG A1123 -21.277 -16.077 9.277 1.00 0.00 H ATOM 1310 H ARG A1123 -18.958 -17.960 1.805 1.00 0.00 H ATOM 1311 N GLY A1124 -19.396 -21.713 3.069 1.00 12.00 N ATOM 1312 CA GLY A1124 -19.567 -22.953 2.330 1.00 11.44 C ATOM 1313 C GLY A1124 -20.237 -23.973 3.216 1.00 14.57 C ATOM 1314 O GLY A1124 -20.064 -23.963 4.438 1.00 18.41 O ATOM 1315 H GLY A1124 -19.221 -21.756 4.093 1.00 0.00 H ATOM 1316 N SER A1125 -21.016 -24.864 2.601 1.00 16.15 N ATOM 1317 CA SER A1125 -21.758 -25.867 3.350 1.00 15.21 C ATOM 1318 C SER A1125 -21.042 -27.206 3.282 1.00 14.75 C ATOM 1319 O SER A1125 -20.500 -27.582 2.242 1.00 15.18 O ATOM 1320 CB SER A1125 -23.187 -26.013 2.818 1.00 26.59 C ATOM 1321 OG SER A1125 -23.182 -26.311 1.436 1.00 21.33 O ATOM 1322 HG SER A1125 -22.697 -27.161 1.285 1.00 0.00 H ATOM 1323 H SER A1125 -21.095 -24.841 1.564 1.00 0.00 H ATOM 1324 N LEU A1126 -21.026 -27.916 4.403 1.00 16.94 N ATOM 1325 CA LEU A1126 -20.498 -29.270 4.418 1.00 17.97 C ATOM 1326 C LEU A1126 -21.500 -30.204 3.764 1.00 21.14 C ATOM 1327 O LEU A1126 -22.685 -30.180 4.098 1.00 21.38 O ATOM 1328 CB LEU A1126 -20.228 -29.728 5.850 1.00 21.09 C ATOM 1329 CG LEU A1126 -19.196 -28.935 6.655 1.00 23.25 C ATOM 1330 CD1 LEU A1126 -18.960 -29.629 7.994 1.00 33.05 C ATOM 1331 CD2 LEU A1126 -17.901 -28.806 5.899 1.00 26.67 C ATOM 1332 H LEU A1126 -21.396 -27.499 5.281 1.00 0.00 H ATOM 1333 N LEU A1127 -21.031 -31.035 2.837 1.00 17.99 N ATOM 1334 CA LEU A1127 -21.944 -32.006 2.247 1.00 23.97 C ATOM 1335 C LEU A1127 -22.386 -33.030 3.277 1.00 23.11 C ATOM 1336 O LEU A1127 -23.502 -33.549 3.192 1.00 26.06 O ATOM 1337 CB LEU A1127 -21.291 -32.688 1.050 1.00 25.06 C ATOM 1338 CG LEU A1127 -21.475 -31.963 -0.289 1.00 28.51 C ATOM 1339 CD1 LEU A1127 -20.995 -30.522 -0.218 1.00 30.39 C ATOM 1340 CD2 LEU A1127 -20.765 -32.712 -1.421 1.00 34.78 C ATOM 1341 H LEU A1127 -20.035 -30.993 2.540 1.00 0.00 H ATOM 1342 N SER A1128 -21.534 -33.326 4.251 1.00 25.49 N ATOM 1343 CA SER A1128 -21.883 -34.185 5.381 1.00 31.71 C ATOM 1344 C SER A1128 -21.565 -33.424 6.662 1.00 28.83 C ATOM 1345 O SER A1128 -20.373 -33.195 6.955 1.00 32.26 O ATOM 1346 CB SER A1128 -21.108 -35.501 5.332 1.00 31.39 C ATOM 1347 OG SER A1128 -21.132 -36.071 4.033 1.00 35.99 O ATOM 1348 HG SER A1128 -20.721 -35.441 3.390 1.00 0.00 H ATOM 1349 H SER A1128 -20.574 -32.928 4.208 1.00 0.00 H ATOM 1350 N PRO A1129 -22.564 -33.010 7.443 1.00 27.77 N ATOM 1351 CA PRO A1129 -22.273 -32.279 8.684 1.00 30.07 C ATOM 1352 C PRO A1129 -21.404 -33.089 9.637 1.00 25.46 C ATOM 1353 O PRO A1129 -21.375 -34.320 9.599 1.00 23.81 O ATOM 1354 CB PRO A1129 -23.661 -32.024 9.281 1.00 32.66 C ATOM 1355 CG PRO A1129 -24.582 -32.036 8.097 1.00 42.18 C ATOM 1356 CD PRO A1129 -24.011 -33.062 7.163 1.00 36.90 C ATOM 1357 N ARG A1130 -20.704 -32.369 10.513 1.00 25.65 N ATOM 1358 CA ARG A1130 -19.746 -32.936 11.451 1.00 26.85 C ATOM 1359 C ARG A1130 -19.881 -32.234 12.793 1.00 20.96 C ATOM 1360 O ARG A1130 -20.143 -31.025 12.836 1.00 19.85 O ATOM 1361 CB ARG A1130 -18.297 -32.762 10.970 1.00 33.58 C ATOM 1362 CG ARG A1130 -18.026 -33.189 9.549 1.00 34.31 C ATOM 1363 CD ARG A1130 -17.889 -34.680 9.435 1.00 35.43 C ATOM 1364 NE ARG A1130 -17.210 -35.050 8.198 1.00 45.22 N ATOM 1365 CZ ARG A1130 -16.830 -36.285 7.895 1.00 52.40 C ATOM 1366 NH1 ARG A1130 -17.060 -37.281 8.743 1.00 50.23 N ATOM 1367 NH2 ARG A1130 -16.217 -36.521 6.744 1.00 52.46 N ATOM 1368 HE ARG A1130 -17.011 -34.297 7.509 1.00 0.00 H ATOM 1369 HH12 ARG A1130 -16.761 -38.248 8.503 1.00 0.00 H ATOM 1370 HH11 ARG A1130 -17.539 -37.094 9.647 1.00 0.00 H ATOM 1371 HH22 ARG A1130 -15.918 -37.487 6.503 1.00 0.00 H ATOM 1372 HH21 ARG A1130 -16.035 -35.740 6.082 1.00 0.00 H ATOM 1373 H ARG A1130 -20.851 -31.340 10.527 1.00 0.00 H ATOM 1374 N PRO A1131 -19.672 -32.947 13.900 1.00 20.48 N ATOM 1375 CA PRO A1131 -19.568 -32.253 15.187 1.00 17.76 C ATOM 1376 C PRO A1131 -18.416 -31.268 15.132 1.00 15.66 C ATOM 1377 O PRO A1131 -17.428 -31.486 14.430 1.00 19.63 O ATOM 1378 CB PRO A1131 -19.309 -33.382 16.191 1.00 22.75 C ATOM 1379 CG PRO A1131 -18.746 -34.486 15.390 1.00 31.50 C ATOM 1380 CD PRO A1131 -19.365 -34.383 14.026 1.00 23.81 C ATOM 1381 N ILE A1132 -18.557 -30.161 15.864 1.00 18.18 N ATOM 1382 CA ILE A1132 -17.550 -29.107 15.780 1.00 20.63 C ATOM 1383 C ILE A1132 -16.200 -29.601 16.276 1.00 22.85 C ATOM 1384 O ILE A1132 -15.160 -29.048 15.898 1.00 17.44 O ATOM 1385 CB ILE A1132 -17.993 -27.846 16.550 1.00 21.16 C ATOM 1386 CG1 ILE A1132 -18.312 -28.166 18.009 1.00 27.27 C ATOM 1387 CG2 ILE A1132 -19.187 -27.206 15.855 1.00 27.99 C ATOM 1388 CD1 ILE A1132 -18.545 -26.928 18.858 1.00 27.81 C ATOM 1389 H ILE A1132 -19.379 -30.050 16.491 1.00 0.00 H ATOM 1390 N SER A1133 -16.196 -30.637 17.120 1.00 16.89 N ATOM 1391 CA SER A1133 -14.952 -31.283 17.535 1.00 21.31 C ATOM 1392 C SER A1133 -14.073 -31.613 16.338 1.00 21.88 C ATOM 1393 O SER A1133 -12.844 -31.485 16.397 1.00 20.94 O ATOM 1394 CB SER A1133 -15.269 -32.573 18.300 1.00 16.35 C ATOM 1395 OG SER A1133 -16.309 -32.378 19.237 1.00 25.26 O ATOM 1396 HG SER A1133 -16.488 -33.228 19.712 1.00 0.00 H ATOM 1397 H SER A1133 -17.100 -30.993 17.491 1.00 0.00 H ATOM 1398 N TYR A1134 -14.698 -32.073 15.255 1.00 21.15 N ATOM 1399 CA TYR A1134 -13.992 -32.534 14.065 1.00 17.27 C ATOM 1400 C TYR A1134 -13.191 -31.416 13.411 1.00 21.87 C ATOM 1401 O TYR A1134 -12.181 -31.675 12.749 1.00 17.19 O ATOM 1402 CB TYR A1134 -15.032 -33.082 13.097 1.00 20.47 C ATOM 1403 CG TYR A1134 -14.561 -33.945 11.950 1.00 27.48 C ATOM 1404 CD1 TYR A1134 -14.347 -33.405 10.683 1.00 33.00 C ATOM 1405 CD2 TYR A1134 -14.411 -35.315 12.110 1.00 40.92 C ATOM 1406 CE1 TYR A1134 -13.956 -34.210 9.620 1.00 38.20 C ATOM 1407 CE2 TYR A1134 -14.020 -36.122 11.055 1.00 39.15 C ATOM 1408 CZ TYR A1134 -13.798 -35.565 9.812 1.00 35.43 C ATOM 1409 OH TYR A1134 -13.409 -36.359 8.757 1.00 37.60 O ATOM 1410 HH TYR A1134 -12.551 -36.801 8.977 1.00 0.00 H ATOM 1411 H TYR A1134 -15.738 -32.105 15.258 1.00 0.00 H ATOM 1412 N LEU A1135 -13.637 -30.177 13.571 1.00 13.71 N ATOM 1413 CA LEU A1135 -13.027 -29.036 12.903 1.00 12.76 C ATOM 1414 C LEU A1135 -12.146 -28.210 13.823 1.00 18.57 C ATOM 1415 O LEU A1135 -11.355 -27.394 13.332 1.00 14.46 O ATOM 1416 CB LEU A1135 -14.121 -28.136 12.315 1.00 15.84 C ATOM 1417 CG LEU A1135 -15.045 -28.799 11.289 1.00 14.46 C ATOM 1418 CD1 LEU A1135 -16.202 -27.872 10.919 1.00 18.59 C ATOM 1419 CD2 LEU A1135 -14.283 -29.229 10.048 1.00 21.07 C ATOM 1420 H LEU A1135 -14.452 -30.015 14.196 1.00 0.00 H ATOM 1421 N LYS A1136 -12.270 -28.391 15.135 1.00 15.38 N ATOM 1422 CA LYS A1136 -11.482 -27.611 16.072 1.00 15.13 C ATOM 1423 C LYS A1136 -10.003 -27.812 15.783 1.00 13.86 C ATOM 1424 O LYS A1136 -9.538 -28.943 15.608 1.00 13.76 O ATOM 1425 CB LYS A1136 -11.816 -28.024 17.507 1.00 19.55 C ATOM 1426 CG LYS A1136 -11.107 -27.213 18.581 1.00 26.81 C ATOM 1427 CD LYS A1136 -11.606 -27.589 19.971 1.00 30.88 C ATOM 1428 CE LYS A1136 -10.941 -26.759 21.059 1.00 36.48 C ATOM 1429 NZ LYS A1136 -9.482 -27.022 21.142 1.00 45.55 N ATOM 1430 HZ1 LYS A1136 -9.324 -28.027 21.356 1.00 0.00 H ATOM 1431 HZ2 LYS A1136 -9.036 -26.786 20.233 1.00 0.00 H ATOM 1432 HZ3 LYS A1136 -9.068 -26.437 21.895 1.00 0.00 H ATOM 1433 H LYS A1136 -12.940 -29.101 15.494 1.00 0.00 H ATOM 1434 N GLY A1137 -9.267 -26.707 15.704 1.00 16.01 N ATOM 1435 CA GLY A1137 -7.855 -26.765 15.409 1.00 20.26 C ATOM 1436 C GLY A1137 -7.507 -26.711 13.939 1.00 18.03 C ATOM 1437 O GLY A1137 -6.331 -26.853 13.598 1.00 17.14 O ATOM 1438 H GLY A1137 -9.718 -25.782 15.858 1.00 0.00 H ATOM 1439 N SER A1138 -8.485 -26.529 13.057 1.00 13.40 N ATOM 1440 CA SER A1138 -8.236 -26.473 11.625 1.00 11.19 C ATOM 1441 C SER A1138 -8.280 -25.059 11.061 1.00 14.86 C ATOM 1442 O SER A1138 -8.007 -24.880 9.870 1.00 14.42 O ATOM 1443 CB SER A1138 -9.244 -27.359 10.876 1.00 18.53 C ATOM 1444 OG SER A1138 -8.966 -28.745 11.069 1.00 19.63 O ATOM 1445 HG SER A1138 -9.016 -28.959 12.034 1.00 0.00 H ATOM 1446 H SER A1138 -9.460 -26.423 13.402 1.00 0.00 H ATOM 1447 N SER A1139 -8.620 -24.053 11.867 1.00 13.73 N ATOM 1448 CA SER A1139 -8.554 -22.684 11.376 1.00 13.39 C ATOM 1449 C SER A1139 -7.153 -22.412 10.850 1.00 14.80 C ATOM 1450 O SER A1139 -6.164 -22.899 11.400 1.00 13.43 O ATOM 1451 CB SER A1139 -8.919 -21.679 12.475 1.00 17.79 C ATOM 1452 OG SER A1139 -7.991 -21.698 13.548 1.00 19.11 O ATOM 1453 HG SER A1139 -7.973 -22.602 13.951 1.00 0.00 H ATOM 1454 H SER A1139 -8.931 -24.245 12.841 1.00 0.00 H ATOM 1455 N GLY A1140 -7.076 -21.625 9.776 1.00 13.83 N ATOM 1456 CA GLY A1140 -5.840 -21.417 9.059 1.00 14.17 C ATOM 1457 C GLY A1140 -5.618 -22.377 7.913 1.00 14.56 C ATOM 1458 O GLY A1140 -4.728 -22.137 7.087 1.00 15.76 O ATOM 1459 H GLY A1140 -7.936 -21.144 9.443 1.00 0.00 H ATOM 1460 N GLY A1141 -6.379 -23.461 7.843 1.00 12.60 N ATOM 1461 CA GLY A1141 -6.255 -24.394 6.750 1.00 15.67 C ATOM 1462 C GLY A1141 -6.950 -23.892 5.505 1.00 13.90 C ATOM 1463 O GLY A1141 -7.715 -22.918 5.519 1.00 18.08 O ATOM 1464 H GLY A1141 -7.079 -23.642 8.591 1.00 0.00 H ATOM 1465 N PRO A1142 -6.679 -24.559 4.387 1.00 13.89 N ATOM 1466 CA PRO A1142 -7.195 -24.093 3.101 1.00 16.76 C ATOM 1467 C PRO A1142 -8.533 -24.699 2.712 1.00 13.83 C ATOM 1468 O PRO A1142 -8.875 -25.832 3.066 1.00 15.90 O ATOM 1469 CB PRO A1142 -6.107 -24.559 2.125 1.00 15.86 C ATOM 1470 CG PRO A1142 -5.671 -25.860 2.719 1.00 15.65 C ATOM 1471 CD PRO A1142 -5.732 -25.675 4.214 1.00 12.28 C ATOM 1472 N LEU A1143 -9.297 -23.899 1.978 1.00 15.24 N ATOM 1473 CA LEU A1143 -10.320 -24.392 1.071 1.00 16.24 C ATOM 1474 C LEU A1143 -9.752 -24.329 -0.339 1.00 15.70 C ATOM 1475 O LEU A1143 -9.201 -23.298 -0.741 1.00 15.10 O ATOM 1476 CB LEU A1143 -11.602 -23.568 1.170 1.00 19.27 C ATOM 1477 CG LEU A1143 -12.432 -23.831 2.421 1.00 24.01 C ATOM 1478 CD1 LEU A1143 -12.009 -22.907 3.566 1.00 20.35 C ATOM 1479 CD2 LEU A1143 -13.896 -23.691 2.103 1.00 30.94 C ATOM 1480 H LEU A1143 -9.157 -22.871 2.056 1.00 0.00 H ATOM 1481 N LEU A1144 -9.869 -25.436 -1.071 1.00 16.76 N ATOM 1482 CA LEU A1144 -9.273 -25.605 -2.388 1.00 15.75 C ATOM 1483 C LEU A1144 -10.345 -25.849 -3.441 1.00 18.45 C ATOM 1484 O LEU A1144 -11.409 -26.394 -3.142 1.00 18.92 O ATOM 1485 CB LEU A1144 -8.311 -26.786 -2.399 1.00 18.14 C ATOM 1486 CG LEU A1144 -7.248 -26.806 -1.302 1.00 20.51 C ATOM 1487 CD1 LEU A1144 -6.565 -28.154 -1.235 1.00 32.84 C ATOM 1488 CD2 LEU A1144 -6.246 -25.713 -1.552 1.00 19.74 C ATOM 1489 H LEU A1144 -10.419 -26.226 -0.678 1.00 0.00 H ATOM 1490 N CYS A1145 -10.050 -25.460 -4.678 1.00 14.94 N ATOM 1491 CA CYS A1145 -10.904 -25.783 -5.815 1.00 16.05 C ATOM 1492 C CYS A1145 -10.535 -27.154 -6.352 1.00 19.20 C ATOM 1493 O CYS A1145 -9.572 -27.778 -5.896 1.00 17.96 O ATOM 1494 CB CYS A1145 -10.769 -24.707 -6.895 1.00 16.55 C ATOM 1495 SG CYS A1145 -9.299 -24.790 -7.963 1.00 17.82 S ATOM 1496 H CYS A1145 -9.183 -24.908 -4.839 1.00 0.00 H ATOM 1497 N PRO A1146 -11.292 -27.670 -7.326 1.00 19.38 N ATOM 1498 CA PRO A1146 -10.959 -28.999 -7.863 1.00 21.98 C ATOM 1499 C PRO A1146 -9.545 -29.099 -8.396 1.00 20.02 C ATOM 1500 O PRO A1146 -8.946 -30.182 -8.336 1.00 23.89 O ATOM 1501 CB PRO A1146 -12.000 -29.197 -8.976 1.00 24.52 C ATOM 1502 CG PRO A1146 -13.162 -28.339 -8.562 1.00 20.80 C ATOM 1503 CD PRO A1146 -12.523 -27.124 -7.928 1.00 17.36 C ATOM 1504 N ALA A1147 -8.985 -28.008 -8.911 1.00 19.76 N ATOM 1505 CA ALA A1147 -7.643 -28.026 -9.473 1.00 21.76 C ATOM 1506 C ALA A1147 -6.555 -27.765 -8.436 1.00 21.22 C ATOM 1507 O ALA A1147 -5.381 -27.655 -8.803 1.00 23.04 O ATOM 1508 CB ALA A1147 -7.540 -26.999 -10.596 1.00 19.43 C ATOM 1509 H ALA A1147 -9.521 -27.117 -8.912 1.00 0.00 H ATOM 1510 N GLY A1148 -6.910 -27.652 -7.161 1.00 24.43 N ATOM 1511 CA GLY A1148 -5.919 -27.437 -6.127 1.00 26.39 C ATOM 1512 C GLY A1148 -5.501 -26.001 -5.903 1.00 20.95 C ATOM 1513 O GLY A1148 -4.498 -25.771 -5.216 1.00 22.23 O ATOM 1514 H GLY A1148 -7.915 -27.719 -6.901 1.00 0.00 H ATOM 1515 N HIS A1149 -6.216 -25.026 -6.462 1.00 16.27 N ATOM 1516 CA HIS A1149 -5.951 -23.626 -6.153 1.00 18.39 C ATOM 1517 C HIS A1149 -6.527 -23.279 -4.783 1.00 16.42 C ATOM 1518 O HIS A1149 -7.501 -23.885 -4.336 1.00 16.02 O ATOM 1519 CB HIS A1149 -6.583 -22.704 -7.197 1.00 20.27 C ATOM 1520 CG HIS A1149 -6.226 -23.026 -8.614 1.00 25.23 C ATOM 1521 ND1 HIS A1149 -7.152 -22.976 -9.637 1.00 25.46 N ATOM 1522 CD2 HIS A1149 -5.046 -23.353 -9.190 1.00 31.48 C ATOM 1523 CE1 HIS A1149 -6.560 -23.284 -10.777 1.00 30.08 C ATOM 1524 NE2 HIS A1149 -5.281 -23.512 -10.534 1.00 29.89 N ATOM 1525 H HIS A1149 -6.976 -25.267 -7.130 1.00 0.00 H ATOM 1526 N ALA A1150 -5.936 -22.277 -4.128 1.00 15.65 N ATOM 1527 CA ALA A1150 -6.459 -21.781 -2.858 1.00 14.29 C ATOM 1528 C ALA A1150 -7.663 -20.884 -3.117 1.00 13.98 C ATOM 1529 O ALA A1150 -7.574 -19.916 -3.882 1.00 16.04 O ATOM 1530 CB ALA A1150 -5.377 -21.018 -2.091 1.00 19.64 C ATOM 1531 H ALA A1150 -5.083 -21.839 -4.532 1.00 0.00 H ATOM 1532 N VAL A1151 -8.780 -21.188 -2.461 1.00 15.67 N ATOM 1533 CA VAL A1151 -9.997 -20.392 -2.578 1.00 14.13 C ATOM 1534 C VAL A1151 -10.186 -19.577 -1.306 1.00 13.37 C ATOM 1535 O VAL A1151 -10.751 -18.476 -1.336 1.00 15.15 O ATOM 1536 CB VAL A1151 -11.212 -21.298 -2.855 1.00 17.07 C ATOM 1537 CG1 VAL A1151 -12.510 -20.507 -2.828 1.00 17.97 C ATOM 1538 CG2 VAL A1151 -11.029 -21.980 -4.200 1.00 18.26 C ATOM 1539 H VAL A1151 -8.786 -22.024 -1.842 1.00 0.00 H ATOM 1540 N GLY A1152 -9.690 -20.090 -0.185 1.00 15.72 N ATOM 1541 CA GLY A1152 -9.830 -19.362 1.062 1.00 19.12 C ATOM 1542 C GLY A1152 -9.113 -20.038 2.210 1.00 11.45 C ATOM 1543 O GLY A1152 -8.549 -21.128 2.067 1.00 12.62 O ATOM 1544 H GLY A1152 -9.204 -21.009 -0.202 1.00 0.00 H ATOM 1545 N ILE A1153 -9.167 -19.357 3.359 1.00 13.59 N ATOM 1546 CA ILE A1153 -8.577 -19.787 4.628 1.00 12.66 C ATOM 1547 C ILE A1153 -9.715 -20.031 5.619 1.00 15.92 C ATOM 1548 O ILE A1153 -10.479 -19.110 5.932 1.00 13.29 O ATOM 1549 CB ILE A1153 -7.603 -18.730 5.182 1.00 13.26 C ATOM 1550 CG1 ILE A1153 -6.423 -18.486 4.227 1.00 15.69 C ATOM 1551 CG2 ILE A1153 -7.092 -19.119 6.584 1.00 18.61 C ATOM 1552 CD1 ILE A1153 -5.486 -19.659 4.080 1.00 18.11 C ATOM 1553 H ILE A1153 -9.670 -18.447 3.351 1.00 0.00 H ATOM 1554 N PHE A1154 -9.808 -21.261 6.129 1.00 14.27 N ATOM 1555 CA PHE A1154 -10.838 -21.627 7.101 1.00 16.18 C ATOM 1556 C PHE A1154 -10.737 -20.778 8.367 1.00 12.45 C ATOM 1557 O PHE A1154 -9.671 -20.678 8.979 1.00 14.69 O ATOM 1558 CB PHE A1154 -10.690 -23.115 7.431 1.00 16.11 C ATOM 1559 CG PHE A1154 -11.686 -23.638 8.424 1.00 14.34 C ATOM 1560 CD1 PHE A1154 -13.006 -23.223 8.400 1.00 19.01 C ATOM 1561 CD2 PHE A1154 -11.304 -24.588 9.363 1.00 18.51 C ATOM 1562 CE1 PHE A1154 -13.922 -23.729 9.312 1.00 19.14 C ATOM 1563 CE2 PHE A1154 -12.211 -25.099 10.265 1.00 22.35 C ATOM 1564 CZ PHE A1154 -13.523 -24.674 10.238 1.00 18.19 C ATOM 1565 H PHE A1154 -9.125 -21.984 5.825 1.00 0.00 H ATOM 1566 N ARG A1155 -11.859 -20.180 8.777 1.00 12.53 N ATOM 1567 CA ARG A1155 -11.870 -19.230 9.887 1.00 12.50 C ATOM 1568 C ARG A1155 -12.774 -19.638 11.039 1.00 15.37 C ATOM 1569 O ARG A1155 -12.373 -19.524 12.197 1.00 13.10 O ATOM 1570 CB ARG A1155 -12.301 -17.834 9.388 1.00 13.90 C ATOM 1571 CG ARG A1155 -12.448 -16.787 10.474 1.00 19.98 C ATOM 1572 CD ARG A1155 -12.601 -15.399 9.884 1.00 18.58 C ATOM 1573 NE ARG A1155 -13.659 -15.314 8.881 1.00 26.73 N ATOM 1574 CZ ARG A1155 -13.854 -14.263 8.086 1.00 32.12 C ATOM 1575 NH1 ARG A1155 -13.071 -13.193 8.174 1.00 22.53 N ATOM 1576 NH2 ARG A1155 -14.832 -14.277 7.195 1.00 25.12 N ATOM 1577 HE ARG A1155 -14.301 -16.126 8.781 1.00 0.00 H ATOM 1578 HH12 ARG A1155 -13.232 -12.378 7.548 1.00 0.00 H ATOM 1579 HH11 ARG A1155 -12.297 -13.171 8.868 1.00 0.00 H ATOM 1580 HH22 ARG A1155 -14.983 -13.456 6.575 1.00 0.00 H ATOM 1581 HH21 ARG A1155 -15.450 -15.109 7.114 1.00 0.00 H ATOM 1582 H ARG A1155 -12.752 -20.397 8.291 1.00 0.00 H ATOM 1583 N ALA A1156 -13.992 -20.097 10.763 1.00 17.82 N ATOM 1584 CA ALA A1156 -14.937 -20.383 11.833 1.00 15.58 C ATOM 1585 C ALA A1156 -15.922 -21.444 11.367 1.00 18.58 C ATOM 1586 O ALA A1156 -16.223 -21.550 10.175 1.00 15.25 O ATOM 1587 CB ALA A1156 -15.682 -19.112 12.269 1.00 21.78 C ATOM 1588 H ALA A1156 -14.272 -20.253 9.774 1.00 0.00 H ATOM 1589 N ALA A1157 -16.413 -22.237 12.316 1.00 19.99 N ATOM 1590 CA ALA A1157 -17.453 -23.215 12.027 1.00 21.96 C ATOM 1591 C ALA A1157 -18.815 -22.607 12.315 1.00 20.69 C ATOM 1592 O ALA A1157 -18.986 -21.869 13.289 1.00 20.66 O ATOM 1593 CB ALA A1157 -17.267 -24.487 12.856 1.00 21.71 C ATOM 1594 H ALA A1157 -16.046 -22.157 13.286 1.00 0.00 H ATOM 1595 N VAL A1158 -19.783 -22.928 11.466 1.00 18.76 N ATOM 1596 CA VAL A1158 -21.161 -22.502 11.651 1.00 20.47 C ATOM 1597 C VAL A1158 -21.893 -23.704 12.215 1.00 20.39 C ATOM 1598 O VAL A1158 -22.072 -24.707 11.521 1.00 19.17 O ATOM 1599 CB VAL A1158 -21.793 -22.027 10.337 1.00 19.29 C ATOM 1600 CG1 VAL A1158 -23.208 -21.506 10.586 1.00 23.85 C ATOM 1601 CG2 VAL A1158 -20.919 -20.965 9.677 1.00 26.52 C ATOM 1602 H VAL A1158 -19.547 -23.507 10.635 1.00 0.00 H ATOM 1603 N SER A1159 -22.280 -23.638 13.481 1.00 28.03 N ATOM 1604 CA SER A1159 -22.796 -24.818 14.150 1.00 29.21 C ATOM 1605 C SER A1159 -24.117 -24.517 14.839 1.00 25.95 C ATOM 1606 O SER A1159 -24.375 -23.395 15.284 1.00 26.76 O ATOM 1607 CB SER A1159 -21.794 -25.361 15.172 1.00 26.92 C ATOM 1608 OG SER A1159 -21.648 -24.482 16.268 1.00 32.03 O ATOM 1609 HG SER A1159 -22.523 -24.367 16.716 1.00 0.00 H ATOM 1610 H SER A1159 -22.214 -22.737 13.997 1.00 0.00 H ATOM 1611 N THR A1160 -24.950 -25.544 14.914 1.00 26.00 N ATOM 1612 CA THR A1160 -26.175 -25.501 15.695 1.00 39.33 C ATOM 1613 C THR A1160 -26.204 -26.749 16.559 1.00 27.56 C ATOM 1614 O THR A1160 -26.098 -27.868 16.044 1.00 28.45 O ATOM 1615 CB THR A1160 -27.411 -25.418 14.797 1.00 34.06 C ATOM 1616 OG1 THR A1160 -27.453 -26.559 13.935 1.00 49.72 O ATOM 1617 CG2 THR A1160 -27.365 -24.155 13.957 1.00 40.45 C ATOM 1618 HG1 THR A1160 -27.497 -27.383 14.482 1.00 0.00 H ATOM 1619 H THR A1160 -24.719 -26.415 14.394 1.00 0.00 H ATOM 1620 N ARG A1161 -26.318 -26.551 17.870 1.00 29.90 N ATOM 1621 CA ARG A1161 -26.332 -27.655 18.827 1.00 32.06 C ATOM 1622 C ARG A1161 -25.067 -28.499 18.694 1.00 25.65 C ATOM 1623 O ARG A1161 -25.101 -29.725 18.812 1.00 28.99 O ATOM 1624 CB ARG A1161 -27.588 -28.512 18.657 1.00 36.72 C ATOM 1625 CG ARG A1161 -28.849 -27.690 18.398 1.00 51.51 C ATOM 1626 CD ARG A1161 -30.117 -28.399 18.856 1.00 59.84 C ATOM 1627 NE ARG A1161 -30.286 -29.719 18.250 1.00 74.68 N ATOM 1628 CZ ARG A1161 -30.784 -29.936 17.036 1.00 69.85 C ATOM 1629 NH1 ARG A1161 -31.162 -28.920 16.270 1.00 63.10 N ATOM 1630 NH2 ARG A1161 -30.899 -31.177 16.582 1.00 67.01 N ATOM 1631 HE ARG A1161 -29.996 -30.547 18.808 1.00 0.00 H ATOM 1632 HH12 ARG A1161 -31.550 -29.100 15.322 1.00 0.00 H ATOM 1633 HH11 ARG A1161 -31.070 -27.944 16.618 1.00 0.00 H ATOM 1634 HH22 ARG A1161 -31.288 -31.350 15.633 1.00 0.00 H ATOM 1635 HH21 ARG A1161 -30.600 -31.977 17.175 1.00 0.00 H ATOM 1636 H ARG A1161 -26.400 -25.577 18.226 1.00 0.00 H ATOM 1637 N GLY A1162 -23.942 -27.832 18.427 1.00 30.64 N ATOM 1638 CA GLY A1162 -22.652 -28.487 18.351 1.00 23.35 C ATOM 1639 C GLY A1162 -22.342 -29.166 17.036 1.00 25.92 C ATOM 1640 O GLY A1162 -21.278 -29.790 16.918 1.00 22.87 O ATOM 1641 H GLY A1162 -23.993 -26.806 18.268 1.00 0.00 H ATOM 1642 N VAL A1163 -23.229 -29.078 16.048 1.00 22.34 N ATOM 1643 CA VAL A1163 -23.050 -29.739 14.761 1.00 21.57 C ATOM 1644 C VAL A1163 -22.696 -28.678 13.731 1.00 24.25 C ATOM 1645 O VAL A1163 -23.428 -27.694 13.570 1.00 25.72 O ATOM 1646 CB VAL A1163 -24.312 -30.510 14.337 1.00 24.57 C ATOM 1647 CG1 VAL A1163 -24.109 -31.160 12.972 1.00 26.51 C ATOM 1648 CG2 VAL A1163 -24.661 -31.562 15.377 1.00 30.82 C ATOM 1649 H VAL A1163 -24.088 -28.512 16.201 1.00 0.00 H ATOM 1650 N ALA A1164 -21.591 -28.889 13.024 1.00 21.49 N ATOM 1651 CA ALA A1164 -21.145 -27.967 11.984 1.00 21.92 C ATOM 1652 C ALA A1164 -21.822 -28.351 10.672 1.00 19.47 C ATOM 1653 O ALA A1164 -21.584 -29.437 10.137 1.00 25.73 O ATOM 1654 CB ALA A1164 -19.624 -28.008 11.848 1.00 25.82 C ATOM 1655 H ALA A1164 -21.025 -29.740 13.218 1.00 0.00 H ATOM 1656 N LYS A1165 -22.674 -27.465 10.158 1.00 17.01 N ATOM 1657 CA LYS A1165 -23.268 -27.658 8.844 1.00 16.82 C ATOM 1658 C LYS A1165 -22.629 -26.783 7.775 1.00 22.27 C ATOM 1659 O LYS A1165 -22.837 -27.034 6.582 1.00 17.11 O ATOM 1660 CB LYS A1165 -24.775 -27.384 8.901 1.00 26.50 C ATOM 1661 CG LYS A1165 -25.475 -28.033 10.098 1.00 33.82 C ATOM 1662 CD LYS A1165 -26.985 -28.123 9.888 1.00 48.37 C ATOM 1663 CE LYS A1165 -27.374 -29.423 9.200 1.00 56.60 C ATOM 1664 NZ LYS A1165 -28.790 -29.427 8.726 1.00 58.92 N ATOM 1665 HZ1 LYS A1165 -29.426 -29.294 9.538 1.00 0.00 H ATOM 1666 HZ2 LYS A1165 -28.929 -28.653 8.045 1.00 0.00 H ATOM 1667 HZ3 LYS A1165 -28.998 -30.336 8.266 1.00 0.00 H ATOM 1668 H LYS A1165 -22.920 -26.617 10.708 1.00 0.00 H ATOM 1669 N ALA A1166 -21.846 -25.781 8.166 1.00 19.66 N ATOM 1670 CA ALA A1166 -21.226 -24.874 7.211 1.00 15.88 C ATOM 1671 C ALA A1166 -19.921 -24.365 7.804 1.00 17.96 C ATOM 1672 O ALA A1166 -19.634 -24.566 8.985 1.00 16.13 O ATOM 1673 CB ALA A1166 -22.160 -23.713 6.864 1.00 19.08 C ATOM 1674 H ALA A1166 -21.672 -25.642 9.182 1.00 0.00 H ATOM 1675 N VAL A1167 -19.127 -23.705 6.965 1.00 13.14 N ATOM 1676 CA VAL A1167 -17.878 -23.095 7.397 1.00 13.45 C ATOM 1677 C VAL A1167 -17.806 -21.674 6.866 1.00 15.23 C ATOM 1678 O VAL A1167 -18.297 -21.366 5.777 1.00 15.76 O ATOM 1679 CB VAL A1167 -16.642 -23.887 6.938 1.00 15.31 C ATOM 1680 CG1 VAL A1167 -16.611 -25.273 7.613 1.00 18.98 C ATOM 1681 CG2 VAL A1167 -16.602 -24.014 5.423 1.00 16.07 C ATOM 1682 H VAL A1167 -19.408 -23.622 5.967 1.00 0.00 H ATOM 1683 N ASP A1168 -17.191 -20.810 7.660 1.00 14.02 N ATOM 1684 CA ASP A1168 -16.855 -19.453 7.269 1.00 13.55 C ATOM 1685 C ASP A1168 -15.363 -19.395 6.965 1.00 17.70 C ATOM 1686 O ASP A1168 -14.556 -19.993 7.681 1.00 12.47 O ATOM 1687 CB ASP A1168 -17.227 -18.483 8.390 1.00 16.50 C ATOM 1688 CG ASP A1168 -16.686 -17.090 8.170 1.00 33.02 C ATOM 1689 OD1 ASP A1168 -17.297 -16.333 7.392 1.00 32.98 O ATOM 1690 OD2 ASP A1168 -15.655 -16.753 8.787 1.00 43.80 O ATOM 1691 H ASP A1168 -16.934 -21.122 8.618 1.00 0.00 H ATOM 1692 N PHE A1169 -14.999 -18.708 5.887 1.00 15.55 N ATOM 1693 CA PHE A1169 -13.605 -18.644 5.485 1.00 14.51 C ATOM 1694 C PHE A1169 -13.255 -17.253 4.976 1.00 16.82 C ATOM 1695 O PHE A1169 -14.119 -16.455 4.611 1.00 12.39 O ATOM 1696 CB PHE A1169 -13.263 -19.703 4.424 1.00 11.54 C ATOM 1697 CG PHE A1169 -14.039 -19.579 3.140 1.00 13.88 C ATOM 1698 CD1 PHE A1169 -13.555 -18.809 2.090 1.00 14.49 C ATOM 1699 CD2 PHE A1169 -15.238 -20.257 2.971 1.00 13.91 C ATOM 1700 CE1 PHE A1169 -14.258 -18.706 0.905 1.00 14.25 C ATOM 1701 CE2 PHE A1169 -15.941 -20.160 1.783 1.00 14.94 C ATOM 1702 CZ PHE A1169 -15.453 -19.386 0.751 1.00 19.16 C ATOM 1703 H PHE A1169 -15.720 -18.211 5.326 1.00 0.00 H ATOM 1704 N ILE A1170 -11.956 -16.973 4.989 1.00 14.33 N ATOM 1705 CA ILE A1170 -11.417 -15.727 4.443 1.00 14.29 C ATOM 1706 C ILE A1170 -11.156 -15.966 2.953 1.00 17.25 C ATOM 1707 O ILE A1170 -10.278 -16.775 2.615 1.00 13.47 O ATOM 1708 CB ILE A1170 -10.130 -15.313 5.167 1.00 10.15 C ATOM 1709 CG1 ILE A1170 -10.380 -15.229 6.679 1.00 14.61 C ATOM 1710 CG2 ILE A1170 -9.627 -13.972 4.639 1.00 14.40 C ATOM 1711 CD1 ILE A1170 -9.168 -15.512 7.523 1.00 18.64 C ATOM 1712 H ILE A1170 -11.298 -17.665 5.402 1.00 0.00 H ATOM 1713 N PRO A1171 -11.884 -15.299 2.054 1.00 14.68 N ATOM 1714 CA PRO A1171 -11.672 -15.542 0.617 1.00 16.45 C ATOM 1715 C PRO A1171 -10.276 -15.128 0.181 1.00 13.99 C ATOM 1716 O PRO A1171 -9.715 -14.145 0.670 1.00 13.75 O ATOM 1717 CB PRO A1171 -12.737 -14.665 -0.061 1.00 15.35 C ATOM 1718 CG PRO A1171 -13.595 -14.120 1.014 1.00 19.56 C ATOM 1719 CD PRO A1171 -12.855 -14.226 2.304 1.00 17.73 C ATOM 1720 N VAL A1172 -9.727 -15.865 -0.789 1.00 15.48 N ATOM 1721 CA VAL A1172 -8.376 -15.555 -1.249 1.00 16.22 C ATOM 1722 C VAL A1172 -8.305 -14.141 -1.809 1.00 18.86 C ATOM 1723 O VAL A1172 -7.260 -13.490 -1.728 1.00 18.67 O ATOM 1724 CB VAL A1172 -7.899 -16.603 -2.279 1.00 20.02 C ATOM 1725 CG1 VAL A1172 -8.609 -16.427 -3.604 1.00 20.82 C ATOM 1726 CG2 VAL A1172 -6.386 -16.546 -2.453 1.00 24.01 C ATOM 1727 H VAL A1172 -10.257 -16.653 -1.213 1.00 0.00 H ATOM 1728 N GLU A1173 -9.404 -13.631 -2.370 1.00 19.53 N ATOM 1729 CA GLU A1173 -9.379 -12.258 -2.873 1.00 23.83 C ATOM 1730 C GLU A1173 -9.169 -11.260 -1.746 1.00 23.41 C ATOM 1731 O GLU A1173 -8.561 -10.202 -1.952 1.00 26.02 O ATOM 1732 CB GLU A1173 -10.670 -11.930 -3.617 1.00 24.11 C ATOM 1733 CG GLU A1173 -10.887 -12.744 -4.879 1.00 22.92 C ATOM 1734 CD GLU A1173 -11.492 -14.098 -4.605 1.00 32.13 C ATOM 1735 OE1 GLU A1173 -11.940 -14.337 -3.461 1.00 22.09 O ATOM 1736 OE2 GLU A1173 -11.517 -14.925 -5.539 1.00 32.97 O ATOM 1737 H GLU A1173 -10.268 -14.204 -2.448 1.00 0.00 H ATOM 1738 N SER A1174 -9.679 -11.568 -0.555 1.00 18.44 N ATOM 1739 CA SER A1174 -9.420 -10.719 0.596 1.00 19.32 C ATOM 1740 C SER A1174 -7.941 -10.744 0.959 1.00 22.26 C ATOM 1741 O SER A1174 -7.358 -9.708 1.300 1.00 21.64 O ATOM 1742 CB SER A1174 -10.296 -11.168 1.768 1.00 18.77 C ATOM 1743 OG SER A1174 -10.160 -10.289 2.859 1.00 27.32 O ATOM 1744 HG SER A1174 -10.734 -10.598 3.604 1.00 0.00 H ATOM 1745 H SER A1174 -10.265 -12.420 -0.448 1.00 0.00 H ATOM 1746 N LEU A1175 -7.312 -11.918 0.871 1.00 21.74 N ATOM 1747 CA LEU A1175 -5.863 -12.007 1.027 1.00 19.02 C ATOM 1748 C LEU A1175 -5.151 -11.165 -0.022 1.00 26.21 C ATOM 1749 O LEU A1175 -4.214 -10.422 0.292 1.00 23.35 O ATOM 1750 CB LEU A1175 -5.415 -13.462 0.916 1.00 17.73 C ATOM 1751 CG LEU A1175 -5.452 -14.334 2.166 1.00 17.72 C ATOM 1752 CD1 LEU A1175 -6.811 -14.309 2.813 1.00 23.10 C ATOM 1753 CD2 LEU A1175 -5.032 -15.746 1.790 1.00 19.15 C ATOM 1754 H LEU A1175 -7.862 -12.782 0.689 1.00 0.00 H ATOM 1755 N GLU A1176 -5.576 -11.285 -1.283 1.00 25.04 N ATOM 1756 CA GLU A1176 -4.903 -10.575 -2.364 1.00 26.01 C ATOM 1757 C GLU A1176 -5.057 -9.068 -2.213 1.00 26.80 C ATOM 1758 O GLU A1176 -4.150 -8.316 -2.588 1.00 38.05 O ATOM 1759 CB GLU A1176 -5.431 -11.060 -3.723 1.00 29.33 C ATOM 1760 CG GLU A1176 -5.105 -12.533 -4.012 1.00 32.43 C ATOM 1761 CD GLU A1176 -5.707 -13.058 -5.313 1.00 36.60 C ATOM 1762 OE1 GLU A1176 -5.015 -13.014 -6.350 1.00 45.52 O ATOM 1763 OE2 GLU A1176 -6.868 -13.529 -5.300 1.00 38.19 O ATOM 1764 H GLU A1176 -6.394 -11.890 -1.495 1.00 0.00 H ATOM 1765 N THR A1177 -6.178 -8.608 -1.646 1.00 29.54 N ATOM 1766 CA THR A1177 -6.337 -7.188 -1.349 1.00 31.24 C ATOM 1767 C THR A1177 -5.433 -6.770 -0.197 1.00 39.44 C ATOM 1768 O THR A1177 -4.753 -5.739 -0.272 1.00 35.02 O ATOM 1769 CB THR A1177 -7.798 -6.868 -1.016 1.00 27.89 C ATOM 1770 OG1 THR A1177 -8.611 -7.034 -2.187 1.00 32.64 O ATOM 1771 CG2 THR A1177 -7.942 -5.432 -0.510 1.00 42.91 C ATOM 1772 HG1 THR A1177 -8.544 -7.970 -2.504 1.00 0.00 H ATOM 1773 H THR A1177 -6.945 -9.270 -1.414 1.00 0.00 H ATOM 1774 N THR A1178 -5.436 -7.545 0.892 1.00 33.27 N ATOM 1775 CA THR A1178 -4.529 -7.270 2.001 1.00 29.00 C ATOM 1776 C THR A1178 -3.095 -7.132 1.508 1.00 28.58 C ATOM 1777 O THR A1178 -2.334 -6.303 2.018 1.00 31.01 O ATOM 1778 CB THR A1178 -4.636 -8.374 3.060 1.00 26.54 C ATOM 1779 OG1 THR A1178 -5.859 -8.225 3.793 1.00 31.40 O ATOM 1780 CG2 THR A1178 -3.467 -8.329 4.046 1.00 26.54 C ATOM 1781 HG1 THR A1178 -5.870 -7.341 4.238 1.00 0.00 H ATOM 1782 H THR A1178 -6.091 -8.351 0.949 1.00 0.00 H ATOM 1783 N MET A1179 -2.709 -7.922 0.506 1.00 28.78 N ATOM 1784 CA MET A1179 -1.358 -7.820 -0.041 1.00 23.30 C ATOM 1785 C MET A1179 -1.125 -6.511 -0.823 1.00 43.87 C ATOM 1786 O MET A1179 -0.025 -6.398 -1.392 1.00 42.01 O ATOM 1787 CB MET A1179 -1.062 -9.025 -0.938 1.00 35.41 C ATOM 1788 CG MET A1179 -0.984 -10.353 -0.180 1.00 29.28 C ATOM 1789 SD MET A1179 -0.706 -11.797 -1.230 1.00 29.08 S ATOM 1790 CE MET A1179 1.078 -11.800 -1.373 1.00 43.18 C ATOM 1791 H MET A1179 -3.375 -8.616 0.111 1.00 0.00 H ATOM 1792 N ARG A1180 -2.098 -5.593 -0.803 1.00 45.42 N ATOM 1793 CA ARG A1180 -2.093 -4.349 -1.588 1.00 41.50 C ATOM 1794 C ARG A1180 -1.091 -4.367 -2.740 1.00 52.83 C ATOM 1795 O ARG A1180 -1.315 -5.037 -3.750 1.00 60.61 O ATOM 1796 CB ARG A1180 -1.818 -3.147 -0.679 1.00 43.20 C ATOM 1797 CG ARG A1180 -2.806 -3.015 0.471 1.00 43.28 C ATOM 1798 CD ARG A1180 -2.518 -1.791 1.322 1.00 55.70 C ATOM 1799 NE ARG A1180 -1.303 -1.944 2.121 1.00 52.97 N ATOM 1800 CZ ARG A1180 -0.845 -1.035 2.978 1.00 65.21 C ATOM 1801 NH1 ARG A1180 0.267 -1.268 3.662 1.00 67.13 N ATOM 1802 NH2 ARG A1180 -1.502 0.105 3.163 1.00 60.15 N ATOM 1803 HE ARG A1180 -0.759 -2.824 2.012 1.00 0.00 H ATOM 1804 HH12 ARG A1180 0.624 -0.557 4.332 1.00 0.00 H ATOM 1805 HH11 ARG A1180 0.782 -2.162 3.529 1.00 0.00 H ATOM 1806 HH22 ARG A1180 -1.139 0.811 3.834 1.00 0.00 H ATOM 1807 HH21 ARG A1180 -2.379 0.291 2.637 1.00 0.00 H ATOM 1808 H ARG A1180 -2.917 -5.772 -0.188 1.00 0.00 H TER 1809 ARG A1180 HETATM 1810 ZN ZN A 1 -9.254 -22.896 -9.169 1.00 22.62 ZN HETATM 1811 O HOH 2 -12.960 -16.718 -5.531 1.00 33.86 O HETATM 1812 O HOH 3 -4.847 -39.483 6.108 1.00 32.61 O HETATM 1813 O HOH 4 -2.546 -19.018 20.968 1.00 27.22 O HETATM 1814 O HOH 5 9.694 -26.539 14.488 1.00 23.81 O HETATM 1815 O HOH 6 -10.597 -3.165 8.685 1.00 28.35 O HETATM 1816 O HOH 7 -13.203 -32.471 -8.199 1.00 35.02 O HETATM 1817 O HOH 8 -0.147 -6.812 -5.113 1.00 44.80 O HETATM 1818 O HOH 9 10.102 -15.982 20.256 1.00 20.18 O HETATM 1819 O HOH 10 -19.334 -20.648 -9.106 1.00 22.26 O HETATM 1820 O HOH 11 -4.665 -4.659 8.575 1.00 26.89 O HETATM 1821 O HOH 12 0.655 -36.836 0.304 1.00 29.66 O HETATM 1822 O HOH 13 8.947 -38.567 10.376 1.00 41.14 O HETATM 1823 O HOH 14 -16.088 -19.678 -6.341 1.00 27.93 O HETATM 1824 O HOH 15 -20.417 -12.680 3.657 1.00 29.29 O HETATM 1825 O HOH 16 -24.405 -28.827 5.561 1.00 33.40 O HETATM 1826 O HOH 17 -7.408 -37.670 3.588 1.00 32.84 O HETATM 1827 O HOH 18 0.796 -22.959 -6.501 1.00 35.33 O HETATM 1828 O HOH 19 9.693 -28.859 12.401 1.00 33.60 O HETATM 1829 O HOH 20 0.814 -29.214 2.401 1.00 28.33 O HETATM 1830 O HOH 21 -12.489 -1.661 11.081 1.00 27.85 O HETATM 1831 O HOH 22 9.376 -19.887 10.002 1.00 34.32 O HETATM 1832 O HOH 23 -3.717 -24.214 -12.523 1.00 36.92 O HETATM 1833 O HOH 24 -17.971 -33.654 5.988 1.00 35.02 O HETATM 1834 O HOH 25 -23.429 -20.195 5.925 1.00 38.83 O HETATM 1835 O HOH 26 4.278 -38.788 1.081 1.00 43.04 O HETATM 1836 O HOH 27 8.532 -22.373 13.343 1.00 13.95 O HETATM 1837 O HOH 28 -27.899 -29.689 15.333 1.00 47.27 O HETATM 1838 O HOH 29 8.959 -13.914 21.839 1.00 41.75 O HETATM 1839 O HOH 30 3.511 -23.762 3.880 1.00 17.55 O HETATM 1840 O HOH 31 -20.629 -9.688 1.555 1.00 29.31 O HETATM 1841 O HOH 32 7.916 -8.269 16.359 1.00 34.21 O HETATM 1842 O HOH 33 -17.443 -10.063 -0.955 1.00 19.43 O HETATM 1843 O HOH 34 5.869 -20.933 0.066 1.00 21.26 O HETATM 1844 O HOH 35 -17.928 -27.931 -10.761 1.00 34.77 O HETATM 1845 O HOH 36 -12.146 -2.757 14.334 1.00 31.26 O HETATM 1846 O HOH 37 3.931 -12.112 -1.956 1.00 31.32 O HETATM 1847 O HOH 38 -9.820 -30.320 13.102 1.00 17.44 O HETATM 1848 O HOH 39 14.712 -12.014 14.702 1.00 25.74 O HETATM 1849 O HOH 40 -23.835 -32.121 18.986 1.00 40.38 O HETATM 1850 O HOH 41 -23.221 -25.214 18.523 1.00 35.66 O HETATM 1851 O HOH 42 13.393 -25.335 5.313 1.00 29.31 O HETATM 1852 O HOH 43 9.103 -17.163 7.744 1.00 27.41 O HETATM 1853 O HOH 44 -11.466 -38.072 5.466 1.00 38.61 O HETATM 1854 O HOH 45 -3.892 -16.714 -9.330 1.00 25.10 O HETATM 1855 O HOH 46 12.978 -16.599 2.796 1.00 44.35 O HETATM 1856 O HOH 47 7.023 -11.653 7.556 1.00 15.79 O HETATM 1857 O HOH 48 -2.500 -13.221 -7.409 1.00 43.04 O HETATM 1858 O HOH 49 1.621 -6.747 10.306 1.00 20.48 O HETATM 1859 O HOH 50 7.153 -28.320 7.538 1.00 18.51 O HETATM 1860 O HOH 51 -10.659 -33.606 10.880 1.00 28.11 O HETATM 1861 O HOH 52 -13.330 -21.040 -7.530 1.00 37.45 O HETATM 1862 O HOH 53 -12.362 -17.032 -3.129 1.00 27.30 O HETATM 1863 O HOH 54 7.801 -36.357 10.458 1.00 22.76 O HETATM 1864 O HOH 55 5.660 -42.864 10.681 1.00 20.58 O HETATM 1865 O HOH 56 11.175 -9.863 13.612 1.00 27.72 O HETATM 1866 O HOH 57 8.889 -12.549 19.646 1.00 33.41 O HETATM 1867 O HOH 58 -24.073 -23.063 -4.011 1.00 19.56 O HETATM 1868 O HOH 59 4.008 -8.719 18.435 1.00 26.52 O HETATM 1869 O HOH 60 -10.269 -32.610 -8.035 1.00 32.10 O HETATM 1870 O HOH 61 15.660 -23.026 19.953 1.00 32.21 O HETATM 1871 O HOH 62 0.927 -4.960 6.334 1.00 31.18 O HETATM 1872 O HOH 63 -10.363 -37.729 11.398 1.00 46.16 O HETATM 1873 O HOH 64 12.391 -23.428 10.257 1.00 25.57 O HETATM 1874 O HOH 65 7.795 -28.156 -0.152 1.00 28.86 O HETATM 1875 O HOH 66 1.624 -11.365 20.547 1.00 24.50 O HETATM 1876 O HOH 67 -5.246 -14.424 -8.755 1.00 41.54 O HETATM 1877 O HOH 68 2.239 -28.697 19.522 1.00 29.30 O HETATM 1878 O HOH 69 -10.015 -31.803 16.136 1.00 30.04 O HETATM 1879 O HOH 70 -8.172 -25.916 23.379 1.00 45.42 O HETATM 1880 O HOH 71 -2.598 -33.411 13.348 1.00 30.34 O HETATM 1881 O HOH 72 -15.556 -27.038 -10.872 1.00 25.11 O HETATM 1882 O HOH 73 5.557 -5.628 9.841 1.00 23.14 O HETATM 1883 O HOH 74 -12.511 -17.081 -9.515 1.00 27.98 O HETATM 1884 O HOH 75 -19.782 -29.035 -3.774 1.00 21.82 O HETATM 1885 O HOH 76 -4.170 -35.706 13.352 1.00 22.96 O HETATM 1886 O HOH 77 -17.078 -30.191 -3.366 1.00 20.92 O HETATM 1887 O HOH 78 10.750 -15.772 3.805 1.00 27.52 O HETATM 1888 O HOH 79 5.901 -22.383 -4.145 1.00 25.82 O HETATM 1889 O HOH 80 -5.694 -5.797 5.265 1.00 26.61 O HETATM 1890 O HOH 81 -7.830 -25.952 18.967 1.00 33.73 O HETATM 1891 O HOH 82 0.969 -7.171 14.384 1.00 30.99 O HETATM 1892 O HOH 83 2.094 -39.698 9.963 1.00 18.08 O HETATM 1893 O HOH 84 -21.508 -29.282 -9.497 1.00 30.03 O HETATM 1894 O HOH 85 4.505 -9.922 14.668 1.00 16.67 O HETATM 1895 O HOH 86 -11.926 -23.466 18.455 1.00 30.47 O HETATM 1896 O HOH 87 12.646 -19.932 6.583 1.00 28.06 O HETATM 1897 O HOH 88 4.333 -30.584 19.232 1.00 25.75 O HETATM 1898 O HOH 89 10.120 -21.560 -0.183 1.00 29.20 O HETATM 1899 O HOH 90 -2.246 -24.188 -6.079 1.00 20.79 O HETATM 1900 O HOH 91 -1.416 -5.662 7.825 1.00 22.47 O HETATM 1901 O HOH 92 -8.880 -25.634 7.229 1.00 35.74 O HETATM 1902 O HOH 93 1.996 -25.639 -4.667 1.00 42.87 O HETATM 1903 O HOH 94 -18.581 -32.839 3.540 1.00 21.29 O HETATM 1904 O HOH 95 2.475 -31.370 0.956 1.00 26.11 O HETATM 1905 O HOH 96 14.770 -25.007 18.778 1.00 33.51 O HETATM 1906 O HOH 97 -10.346 -37.359 3.495 1.00 30.11 O HETATM 1907 O HOH 98 11.455 -31.055 9.726 1.00 42.14 O HETATM 1908 O HOH 99 14.783 -30.752 9.832 1.00 35.93 O HETATM 1909 O HOH 100 -10.227 -4.817 6.836 1.00 34.12 O HETATM 1910 O HOH 101 1.404 -31.596 16.677 1.00 29.84 O HETATM 1911 O HOH 102 -19.041 -35.229 2.076 1.00 30.92 O HETATM 1912 O HOH 103 8.474 -35.171 8.125 1.00 30.60 O HETATM 1913 O HOH 104 -3.473 -37.986 9.083 1.00 22.52 O HETATM 1914 O HOH 105 7.557 -36.117 3.940 1.00 39.62 O HETATM 1915 O HOH 106 12.223 -15.995 6.378 1.00 32.94 O HETATM 1916 O HOH 107 0.010 -41.970 -2.408 1.00 52.25 O HETATM 1917 O HOH 108 -1.222 -34.543 -5.196 1.00 38.10 O HETATM 1918 O HOH 109 -5.693 -19.850 -10.843 1.00 31.06 O HETATM 1919 O HOH 110 -19.233 -24.165 -9.922 1.00 23.24 O HETATM 1920 O HOH 111 -2.829 -28.234 -4.596 1.00 34.26 O HETATM 1921 O HOH 112 -5.988 -25.004 20.309 1.00 30.94 O HETATM 1922 O HOH 113 5.429 -13.065 19.747 1.00 27.27 O HETATM 1923 O HOH 114 -3.718 -15.219 20.919 1.00 34.13 O HETATM 1924 O HOH 115 16.908 -12.484 15.402 1.00 35.77 O HETATM 1925 O HOH 116 -6.569 -27.859 18.160 1.00 44.73 O HETATM 1926 O HOH 117 9.616 -5.852 12.688 1.00 28.82 O HETATM 1927 O HOH 118 8.689 -28.327 9.855 1.00 30.28 O HETATM 1928 O HOH 119 14.676 -13.619 11.656 1.00 30.21 O HETATM 1929 O HOH 120 13.711 -11.260 7.206 1.00 36.80 O HETATM 1930 O HOH 121 -21.672 -20.798 14.752 1.00 30.66 O HETATM 1931 O HOH 122 12.783 -22.216 7.027 1.00 36.64 O HETATM 1932 O HOH 123 9.578 -26.563 11.244 1.00 37.37 O HETATM 1933 O HOH 124 -4.320 -5.284 -5.030 1.00 54.24 O HETATM 1934 O HOH 125 2.858 -18.058 23.568 1.00 38.76 O HETATM 1935 O HOH 126 3.381 -34.582 23.800 1.00 43.85 O HETATM 1936 O HOH 127 -3.120 -16.503 24.151 1.00 51.59 O HETATM 1937 O HOH 128 -26.399 -23.605 19.511 1.00 40.11 O HETATM 1938 O HOH 129 6.645 -9.448 18.685 1.00 32.85 O HETATM 1939 O HOH 130 -17.202 -32.514 -4.485 1.00 40.50 O HETATM 1940 O HOH 131 -1.310 -14.950 -8.242 1.00 40.22 O HETATM 1941 O HOH 132 -4.992 -26.633 22.348 1.00 41.06 O HETATM 1942 O HOH 133 15.310 -27.515 19.880 1.00 46.10 O HETATM 1943 O HOH 134 -1.485 -8.314 -4.901 1.00 46.11 O HETATM 1944 O HOH 135 -22.780 -27.093 -10.253 1.00 31.88 O HETATM 1945 O HOH 136 -4.367 -17.644 23.201 1.00 38.48 O HETATM 1946 O HOH 137 0.405 -32.831 15.569 1.00 46.35 O HETATM 1947 O HOH 138 -0.607 -12.316 21.266 1.00 25.79 O HETATM 1948 O HOH 139 -24.239 -29.585 -1.984 1.00 41.97 O HETATM 1949 O HOH 140 3.215 -17.858 25.589 1.00 34.55 O HETATM 1950 O HOH 141 -25.330 -21.232 7.060 1.00 43.26 O HETATM 1951 O HOH 142 -3.935 -33.383 17.299 1.00 25.34 O HETATM 1952 O HOH 143 -2.041 -27.103 22.113 1.00 41.16 O HETATM 1953 O HOH 144 5.096 -31.893 1.509 1.00 35.71 O HETATM 1954 O HOH 145 1.098 -11.997 -5.380 1.00 48.49 O HETATM 1955 O HOH 146 -3.837 -20.361 -12.322 1.00 39.76 O HETATM 1956 O HOH 147 3.464 -7.380 14.380 1.00 25.52 O HETATM 1957 O HOH 148 3.807 -11.060 21.476 1.00 39.21 O HETATM 1958 O HOH 149 11.734 -9.250 16.511 1.00 36.81 O HETATM 1959 O HOH 150 -14.233 -34.581 -9.159 1.00 38.22 O HETATM 1960 O HOH 151 -22.325 -30.150 -4.032 1.00 26.35 O HETATM 1961 O HOH 152 0.159 -26.168 -5.753 1.00 39.79 O HETATM 1962 O HOH 153 11.136 -21.748 9.086 1.00 41.94 O HETATM 1963 O HOH 154 -24.606 -18.723 3.958 1.00 43.69 O HETATM 1964 O HOH 155 -26.151 -35.875 5.497 1.00 45.62 O HETATM 1965 O HOH 156 -10.959 -39.889 11.227 1.00 38.75 O HETATM 1966 O HOH 157 14.938 -18.687 6.940 1.00 40.95 O HETATM 1967 O HOH 158 -0.047 -34.197 14.084 1.00 30.45 O HETATM 1968 C10 UNN A 159 -13.105 -14.159 14.973 1.00 0.09 C HETATM 1969 C09 UNN A 159 -13.959 -14.254 13.696 1.00 0.07 C HETATM 1970 C08 UNN A 159 -14.166 -13.158 12.748 1.00 -0.08 C HETATM 1971 C52 UNN A 159 -15.125 -13.707 11.577 1.00 -0.09 C HETATM 1972 C54 UNN A 159 -15.457 -15.100 11.861 1.00 -0.02 C HETATM 1973 S53 UNN A 159 -14.746 -15.499 13.196 1.00 -0.04 S HETATM 1974 H51 UNN A 159 -16.087 -15.746 11.252 1.00 0.06 H HETATM 1975 H50 UNN A 159 -15.469 -13.135 10.717 1.00 0.04 H HETATM 1976 H20 UNN A 159 -13.748 -12.155 12.821 1.00 0.03 H HETATM 1977 C11 UNN A 159 -13.174 -15.231 16.102 1.00 0.14 C HETATM 1978 N44 UNN A 159 -12.343 -15.066 17.289 1.00 0.26 N HETATM 1979 C45 UNN A 159 -11.445 -13.898 17.418 1.00 0.02 C HETATM 1980 C46 UNN A 159 -10.556 -13.741 18.692 1.00 -0.00 C HETATM 1981 C47 UNN A 159 -9.619 -12.531 18.818 1.00 -0.05 C HETATM 1982 C48 UNN A 159 -9.561 -11.482 17.690 1.00 -0.05 C HETATM 1983 C49 UNN A 159 -10.432 -11.640 16.436 1.00 -0.00 C HETATM 1984 C50 UNN A 159 -11.381 -12.866 16.310 1.00 0.02 C HETATM 1985 N51 UNN A 159 -12.215 -13.014 15.097 1.00 0.26 N HETATM 1986 H57 UNN A 159 -12.790 -12.188 15.034 1.00 0.20 H HETATM 1987 H58 UNN A 159 -11.585 -13.046 14.311 1.00 0.20 H HETATM 1988 H49 UNN A 159 -12.186 -12.296 16.797 1.00 0.09 H HETATM 1989 H47 UNN A 159 -9.749 -11.675 15.575 1.00 0.03 H HETATM 1990 H48 UNN A 159 -11.061 -10.740 16.369 1.00 0.03 H HETATM 1991 H45 UNN A 159 -8.517 -11.446 17.346 1.00 0.03 H HETATM 1992 H46 UNN A 159 -9.832 -10.517 18.143 1.00 0.03 H HETATM 1993 H43 UNN A 159 -8.600 -12.929 18.935 1.00 0.03 H HETATM 1994 H44 UNN A 159 -9.911 -11.997 19.734 1.00 0.03 H HETATM 1995 H41 UNN A 159 -9.926 -14.641 18.755 1.00 0.03 H HETATM 1996 H42 UNN A 159 -11.237 -13.709 19.555 1.00 0.03 H HETATM 1997 H40 UNN A 159 -12.250 -13.328 17.905 1.00 0.09 H HETATM 1998 H55 UNN A 159 -11.761 -15.886 17.351 1.00 0.20 H HETATM 1999 H56 UNN A 159 -12.969 -15.038 18.079 1.00 0.20 H HETATM 2000 O12 UNN A 159 -14.049 -16.348 15.978 1.00 -0.32 O HETATM 2001 C13 UNN A 159 -13.901 -17.279 17.024 1.00 0.09 C HETATM 2002 C01 UNN A 159 -15.061 -17.973 17.163 1.00 0.06 C HETATM 2003 N16 UNN A 159 -14.907 -19.161 16.137 1.00 -0.25 N HETATM 2004 C15 UNN A 159 -13.362 -19.139 15.646 1.00 0.14 C HETATM 2005 C14 UNN A 159 -12.744 -18.419 16.580 1.00 0.02 C HETATM 2006 H22 UNN A 159 -12.461 -19.047 17.438 1.00 0.03 H HETATM 2007 H23 UNN A 159 -11.847 -17.931 16.171 1.00 0.03 H HETATM 2008 C25 UNN A 159 -12.999 -20.636 15.641 1.00 0.20 C HETATM 2009 N24 UNN A 159 -12.504 -21.201 14.384 1.00 -0.27 N HETATM 2010 C23 UNN A 159 -12.164 -22.651 14.192 1.00 0.15 C HETATM 2011 C06 UNN A 159 -13.387 -23.469 14.637 1.00 0.01 C HETATM 2012 C05 UNN A 159 -13.729 -24.951 14.978 1.00 -0.09 C HETATM 2013 C22 UNN A 159 -14.795 -25.308 15.745 1.00 -0.10 C HETATM 2014 C21 UNN A 159 -15.787 -24.274 16.350 1.00 -0.04 C HETATM 2015 C04 UNN A 159 -15.594 -24.222 17.887 1.00 -0.05 C HETATM 2016 C20 UNN A 159 -16.687 -23.295 18.501 1.00 -0.05 C HETATM 2017 C03 UNN A 159 -16.466 -21.842 17.975 1.00 -0.05 C HETATM 2018 C19 UNN A 159 -17.580 -21.482 16.923 1.00 -0.01 C HETATM 2019 C02 UNN A 159 -17.332 -20.126 16.242 1.00 0.13 C HETATM 2020 C17 UNN A 159 -15.914 -20.160 15.672 1.00 0.21 C HETATM 2021 O18 UNN A 159 -15.594 -20.999 14.887 1.00 -0.39 O HETATM 2022 N36 UNN A 159 -18.302 -19.946 15.181 1.00 -0.24 N HETATM 2023 C37 UNN A 159 -18.558 -18.602 14.637 1.00 0.32 C HETATM 2024 O38 UNN A 159 -18.057 -17.650 15.150 1.00 -0.38 O HETATM 2025 O39 UNN A 159 -19.387 -18.497 13.484 1.00 -0.26 O HETATM 2026 C40 UNN A 159 -19.958 -17.225 13.170 1.00 0.09 C HETATM 2027 C41 UNN A 159 -20.549 -16.553 14.438 1.00 -0.03 C HETATM 2028 H31 UNN A 159 -20.981 -15.578 14.169 1.00 0.03 H HETATM 2029 H32 UNN A 159 -19.752 -16.408 15.182 1.00 0.03 H HETATM 2030 H33 UNN A 159 -21.333 -17.197 14.862 1.00 0.03 H HETATM 2031 C42 UNN A 159 -21.118 -17.489 12.173 1.00 -0.03 C HETATM 2032 H34 UNN A 159 -20.720 -17.966 11.265 1.00 0.03 H HETATM 2033 H35 UNN A 159 -21.596 -16.535 11.906 1.00 0.03 H HETATM 2034 H36 UNN A 159 -21.860 -18.153 12.641 1.00 0.03 H HETATM 2035 C43 UNN A 159 -18.901 -16.305 12.498 1.00 -0.03 C HETATM 2036 H37 UNN A 159 -18.078 -16.116 13.203 1.00 0.03 H HETATM 2037 H38 UNN A 159 -19.370 -15.350 12.219 1.00 0.03 H HETATM 2038 H39 UNN A 159 -18.506 -16.797 11.597 1.00 0.03 H HETATM 2039 H54 UNN A 159 -18.798 -20.735 14.818 1.00 0.19 H HETATM 2040 H11 UNN A 159 -17.425 -19.308 16.972 1.00 0.08 H HETATM 2041 H24 UNN A 159 -17.602 -22.265 16.151 1.00 0.03 H HETATM 2042 H25 UNN A 159 -18.552 -21.446 17.437 1.00 0.03 H HETATM 2043 H12 UNN A 159 -15.477 -21.772 17.498 1.00 0.03 H HETATM 2044 H13 UNN A 159 -16.517 -21.137 18.817 1.00 0.03 H HETATM 2045 H4 UNN A 159 -17.684 -23.649 18.201 1.00 0.03 H HETATM 2046 H5 UNN A 159 -16.609 -23.307 19.598 1.00 0.03 H HETATM 2047 H14 UNN A 159 -15.690 -25.235 18.306 1.00 0.03 H HETATM 2048 H15 UNN A 159 -14.596 -23.822 18.121 1.00 0.03 H HETATM 2049 H6 UNN A 159 -16.819 -24.576 16.119 1.00 0.04 H HETATM 2050 H7 UNN A 159 -15.590 -23.280 15.921 1.00 0.04 H HETATM 2051 H8 UNN A 159 -14.961 -26.366 15.944 1.00 0.04 H HETATM 2052 H16 UNN A 159 -13.086 -25.737 14.585 1.00 0.05 H HETATM 2053 C07 UNN A 159 -12.677 -23.787 13.313 1.00 -0.01 C HETATM 2054 H18 UNN A 159 -13.171 -23.561 12.357 1.00 0.03 H HETATM 2055 H19 UNN A 159 -12.090 -24.712 13.213 1.00 0.03 H HETATM 2056 H17 UNN A 159 -14.285 -22.854 14.794 1.00 0.04 H HETATM 2057 C27 UNN A 159 -10.923 -23.123 14.977 1.00 0.25 C HETATM 2058 N29 UNN A 159 -10.316 -22.360 15.795 1.00 -0.15 N HETATM 2059 S30 UNN A 159 -8.971 -23.129 16.504 1.00 0.06 S HETATM 2060 C33 UNN A 159 -8.094 -21.892 17.547 1.00 0.10 C HETATM 2061 C34 UNN A 159 -6.835 -21.294 16.921 1.00 -0.03 C HETATM 2062 C35 UNN A 159 -6.716 -22.321 18.056 1.00 -0.03 C HETATM 2063 H29 UNN A 159 -6.342 -23.334 17.845 1.00 0.03 H HETATM 2064 H30 UNN A 159 -6.374 -22.004 19.052 1.00 0.03 H HETATM 2065 H27 UNN A 159 -6.577 -20.240 17.103 1.00 0.03 H HETATM 2066 H28 UNN A 159 -6.545 -21.570 15.896 1.00 0.03 H HETATM 2067 H26 UNN A 159 -8.786 -21.296 18.160 1.00 0.06 H HETATM 2068 O31 UNN A 159 -8.103 -23.730 15.483 1.00 -0.15 O HETATM 2069 O32 UNN A 159 -9.424 -24.269 17.318 1.00 -0.15 O HETATM 2070 H53 UNN A 159 -10.595 -21.421 15.997 1.00 0.21 H HETATM 2071 O28 UNN A 159 -10.417 -24.391 14.768 1.00 -0.34 O HETATM 2072 H52 UNN A 159 -12.385 -20.584 13.606 1.00 0.18 H HETATM 2073 O26 UNN A 159 -13.150 -21.313 16.606 1.00 -0.39 O HETATM 2074 H3 UNN A 159 -13.224 -18.693 14.650 1.00 0.08 H HETATM 2075 H9 UNN A 159 -15.928 -17.345 16.909 1.00 0.06 H HETATM 2076 H10 UNN A 159 -15.171 -18.352 18.190 1.00 0.06 H HETATM 2077 H2 UNN A 159 -13.624 -16.771 17.959 1.00 0.06 H HETATM 2078 H21 UNN A 159 -12.372 -15.805 15.615 1.00 0.13 H HETATM 2079 H1 UNN A 159 -12.307 -14.738 14.485 1.00 0.11 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1049 1048 1810 CONECT 1065 1064 1810 CONECT 1495 1494 1810 CONECT 1521 1520 1523 1810 CONECT 1810 1049 1065 1495 1521 CONECT 1968 1969 1977 1985 2079 CONECT 1969 1968 1970 1973 CONECT 1970 1969 1971 1976 CONECT 1971 1970 1972 1975 CONECT 1972 1971 1973 1974 CONECT 1973 1969 1972 CONECT 1974 1972 CONECT 1975 1971 CONECT 1976 1970 CONECT 1977 1968 1978 2000 2078 CONECT 1978 1977 1979 1998 1999 CONECT 1979 1978 1980 1984 1997 CONECT 1980 1979 1981 1995 1996 CONECT 1981 1980 1982 1993 1994 CONECT 1982 1981 1983 1991 1992 CONECT 1983 1982 1984 1989 1990 CONECT 1984 1979 1983 1985 1988 CONECT 1985 1968 1984 1986 1987 CONECT 1986 1985 CONECT 1987 1985 CONECT 1988 1984 CONECT 1989 1983 CONECT 1990 1983 CONECT 1991 1982 CONECT 1992 1982 CONECT 1993 1981 CONECT 1994 1981 CONECT 1995 1980 CONECT 1996 1980 CONECT 1997 1979 CONECT 1998 1978 CONECT 1999 1978 CONECT 2000 1977 2001 CONECT 2001 2000 2002 2005 2077 CONECT 2002 2001 2003 2075 2076 CONECT 2003 2002 2004 2020 CONECT 2004 2003 2005 2008 2074 CONECT 2005 2001 2004 2006 2007 CONECT 2006 2005 CONECT 2007 2005 CONECT 2008 2004 2009 2073 CONECT 2009 2008 2010 2072 CONECT 2010 2009 2011 2053 2057 CONECT 2011 2010 2012 2053 2056 CONECT 2012 2011 2013 2052 CONECT 2013 2012 2014 2051 CONECT 2014 2013 2015 2049 2050 CONECT 2015 2014 2016 2047 2048 CONECT 2016 2015 2017 2045 2046 CONECT 2017 2016 2018 2043 2044 CONECT 2018 2017 2019 2041 2042 CONECT 2019 2018 2020 2022 2040 CONECT 2020 2003 2019 2021 CONECT 2021 2020 CONECT 2022 2019 2023 2039 CONECT 2023 2022 2024 2025 CONECT 2024 2023 CONECT 2025 2023 2026 CONECT 2026 2025 2027 2031 2035 CONECT 2027 2026 2028 2029 2030 CONECT 2028 2027 CONECT 2029 2027 CONECT 2030 2027 CONECT 2031 2026 2032 2033 2034 CONECT 2032 2031 CONECT 2033 2031 CONECT 2034 2031 CONECT 2035 2026 2036 2037 2038 CONECT 2036 2035 CONECT 2037 2035 CONECT 2038 2035 CONECT 2039 2022 CONECT 2040 2019 CONECT 2041 2018 CONECT 2042 2018 CONECT 2043 2017 CONECT 2044 2017 CONECT 2045 2016 CONECT 2046 2016 CONECT 2047 2015 CONECT 2048 2015 CONECT 2049 2014 CONECT 2050 2014 CONECT 2051 2013 CONECT 2052 2012 CONECT 2053 2010 2011 2054 2055 CONECT 2054 2053 CONECT 2055 2053 CONECT 2056 2011 CONECT 2057 2010 2058 2071 CONECT 2058 2057 2059 2070 CONECT 2059 2058 2060 2068 2069 CONECT 2060 2059 2061 2062 2067 CONECT 2061 2060 2062 2065 2066 CONECT 2062 2060 2061 2063 2064 CONECT 2063 2062 CONECT 2064 2062 CONECT 2065 2061 CONECT 2066 2061 CONECT 2067 2060 CONECT 2068 2059 CONECT 2069 2059 CONECT 2070 2058 CONECT 2071 2057 CONECT 2072 2009 CONECT 2073 2008 CONECT 2074 2004 CONECT 2075 2002 CONECT 2076 2002 CONECT 2077 2001 CONECT 2078 1977 CONECT 2079 1968 MASTER 0 0 0 0 0 0 0 0 2078 1 121 16 END
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Structure:
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Related entries of code: 5vp9
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Protein Sequence Similarity
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3su6
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203aa, >3SUF_1|Chains... at 96%
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3sv7
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3sv8
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203aa, >3SV8_1|Chain... at 96%
3sv9
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5epn
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5epy
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5eqq
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190aa, >5EQQ_1|Chain... at 99%
5etx
RCSB PDB
PDBbind
194aa, >5ETX_1|Chains... at 98%
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203aa, >5VOJ_1|Chain... at 96%
6bqj
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PDBbind
219aa, >6BQJ_1|Chains... at 100%
6bqk
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PDBbind
219aa, >6BQK_1|Chains... at 100%
6cvw
RCSB PDB
PDBbind
201aa, >6CVW_1|Chain... at 97%
6cvx
RCSB PDB
PDBbind
201aa, >6CVX_1|Chain... at 97%
6cvy
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6nzt
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203aa, >6NZT_1|Chain... at 96%
6nzv
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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
5vp9
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
NS4A cofactor -- NS3 protein chimera
Ligand Name
9H7
EC.Number
E.C.-.-.-.-
Resolution
1.86(Å)
Affinity (Kd/Ki/IC50)
Ki=1.03nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 5699-5716
Ligand Properties
Formula
C
3
8
H
5
8
N
6
O
8
S
2
Molecular Weight
791.033
Exact Mass
790.376
No. of atoms
112
No. of bonds
118
Polar Surface Area
230.05
LOGP Value
3.78 (
Computed with XLOGP3
)
6.72 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 14
No. of Rings: 7
Canonical SMILES
O=C(OC(C)(C)C)N[C@H]1CCCCC/C=C\[C@H]2[C@](NC(=O)[C@H]3N(C1=O)C[C@@H](C3)O[C@@H]1[NH2+][C@H]3CCCC[C@H]3[NH2+][C@@H]1c1cccs1)(C2)C(=O)NS(=O)(=O)C1CC1
InChI String
InChI=1S/C38H56N6O8S2/c1-37(2,3)52-36(48)41-28-15-8-6-4-5-7-12-23-21-38(23,35(47)43-54(49,50)25-17-18-25)42-32(45)29-20-24(22-44(29)34(28)46)51-33-31(30-16-11-19-53-30)39-26-13-9-10-14-27(26)40-33/h7,11-12,16,19,23-29,31,33,39-40H,4-6,8-10,13-15,17-18,20-22H2,1-3H3,(H,41,48)(H,42,45)(H,43,47)/p+2/b12-7-/t23-,24-,26-,27+,28+,29+,31-,33+,38-/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
No matched UniProt accession number (AC) found!
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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