Browse entries in the PDBbind-CN Database
HEADER 4TTE_COMPLEX COMPND 4TTE_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 130 SER MET GLN GLU GLU ASP THR PHE ARG GLU LEU ARG ILE SEQRES 2 A 130 PHE LEU ARG ASN VAL THR HIS ARG LEU ALA ILE ASP LYS SEQRES 3 A 130 ARG PHE ARG VAL PHE THR LYS PRO VAL ASP PRO ASP GLU SEQRES 4 A 130 VAL PRO ASP TYR VAL THR VAL ILE LYS GLN PRO MET ASP SEQRES 5 A 130 LEU SER SER VAL ILE SER LYS ILE ASP LEU HIS LYS TYR SEQRES 6 A 130 LEU THR VAL LYS ASP TYR LEU ARG ASP ILE ASP LEU ILE SEQRES 7 A 130 CYS SER ASN ALA LEU GLU TYR ASN PRO ASP ARG ASP PRO SEQRES 8 A 130 GLY ASP ARG LEU ILE ARG HIS ARG ALA CYS ALA LEU ARG SEQRES 9 A 130 ASP THR ALA TYR ALA ILE ILE LYS GLU GLU LEU ASP GLU SEQRES 10 A 130 ASP PHE GLU GLN LEU CYS GLU GLU ILE GLN GLU SER ARG HET UNN A 384 32 ATOM 1 N SER A 979 -52.372 23.141 -3.206 1.00 47.00 N ATOM 2 CA SER A 979 -52.738 22.835 -4.617 1.00 46.54 C ATOM 3 C SER A 979 -51.538 22.319 -5.416 1.00 49.19 C ATOM 4 O SER A 979 -50.412 22.320 -4.917 1.00 42.84 O ATOM 5 CB SER A 979 -53.314 24.073 -5.293 1.00 47.60 C ATOM 6 OG SER A 979 -52.342 25.093 -5.411 1.00 47.67 O ATOM 7 HG SER A 979 -52.745 25.882 -5.853 1.00 0.00 H ATOM 8 HN3 SER A 979 -51.631 23.871 -3.192 1.00 0.00 H ATOM 9 HN2 SER A 979 -52.019 22.278 -2.746 1.00 0.00 H ATOM 10 HN1 SER A 979 -53.211 23.487 -2.699 1.00 0.00 H ATOM 11 N MET A 980 -51.795 21.883 -6.654 1.00 49.12 N ATOM 12 CA MET A 980 -50.728 21.507 -7.597 1.00 48.49 C ATOM 13 C MET A 980 -49.911 22.739 -8.009 1.00 44.21 C ATOM 14 O MET A 980 -48.696 22.641 -8.165 1.00 42.60 O ATOM 15 CB MET A 980 -51.309 20.818 -8.838 1.00 47.15 C ATOM 16 CG MET A 980 -50.277 20.208 -9.779 1.00 47.29 C ATOM 17 SD MET A 980 -49.433 18.756 -9.112 1.00 48.92 S ATOM 18 CE MET A 980 -47.847 19.432 -8.633 1.00 46.94 C ATOM 19 H MET A 980 -52.785 21.807 -6.962 1.00 0.00 H ATOM 20 N GLN A 981 -50.570 23.881 -8.190 1.00 41.42 N ATOM 21 CA GLN A 981 -49.878 25.145 -8.401 1.00 44.70 C ATOM 22 C GLN A 981 -48.879 25.429 -7.278 1.00 39.76 C ATOM 23 O GLN A 981 -47.755 25.854 -7.532 1.00 39.08 O ATOM 24 CB GLN A 981 -50.863 26.307 -8.458 1.00 48.87 C ATOM 25 CG GLN A 981 -51.517 26.516 -9.814 1.00 54.81 C ATOM 26 CD GLN A 981 -52.791 27.337 -9.720 1.00 56.56 C ATOM 27 OE1 GLN A 981 -53.699 27.004 -8.953 1.00 56.52 O ATOM 28 NE2 GLN A 981 -52.870 28.412 -10.502 1.00 58.16 N ATOM 29 HE22 GLN A 981 -52.080 28.655 -11.133 1.00 0.00 H ATOM 30 HE21 GLN A 981 -53.722 29.009 -10.481 1.00 0.00 H ATOM 31 H GLN A 981 -51.610 23.870 -8.180 1.00 0.00 H ATOM 32 N GLU A 982 -49.306 25.222 -6.037 1.00 34.36 N ATOM 33 CA GLU A 982 -48.439 25.493 -4.899 1.00 30.53 C ATOM 34 C GLU A 982 -47.284 24.508 -4.846 1.00 29.20 C ATOM 35 O GLU A 982 -46.160 24.904 -4.546 1.00 25.15 O ATOM 36 CB GLU A 982 -49.236 25.523 -3.596 1.00 31.00 C ATOM 37 CG GLU A 982 -50.163 26.742 -3.514 1.00 30.93 C ATOM 38 CD GLU A 982 -51.108 26.713 -2.317 1.00 33.32 C ATOM 39 OE1 GLU A 982 -51.270 25.621 -1.739 1.00 33.62 O ATOM 40 OE2 GLU A 982 -51.664 27.789 -1.951 1.00 30.80 O ATOM 41 H GLU A 982 -50.269 24.863 -5.877 1.00 0.00 H ATOM 42 N GLU A 983 -47.543 23.230 -5.119 1.00 28.23 N ATOM 43 CA GLU A 983 -46.470 22.240 -5.161 1.00 29.03 C ATOM 44 C GLU A 983 -45.454 22.599 -6.268 1.00 27.72 C ATOM 45 O GLU A 983 -44.244 22.372 -6.092 1.00 24.57 O ATOM 46 CB GLU A 983 -47.020 20.829 -5.431 1.00 34.12 C ATOM 47 CG GLU A 983 -47.845 20.218 -4.310 1.00 39.66 C ATOM 48 CD GLU A 983 -48.733 19.059 -4.777 1.00 42.61 C ATOM 49 OE1 GLU A 983 -48.480 18.483 -5.865 1.00 44.91 O ATOM 50 OE2 GLU A 983 -49.693 18.721 -4.041 1.00 45.63 O ATOM 51 H GLU A 983 -48.522 22.933 -5.305 1.00 0.00 H ATOM 52 N ASP A 984 -45.938 23.105 -7.407 1.00 25.93 N ATOM 53 CA ASP A 984 -45.057 23.551 -8.496 1.00 28.17 C ATOM 54 C ASP A 984 -44.168 24.716 -8.017 1.00 24.91 C ATOM 55 O ASP A 984 -43.003 24.801 -8.413 1.00 22.61 O ATOM 56 CB ASP A 984 -45.830 24.045 -9.735 1.00 30.72 C ATOM 57 CG ASP A 984 -46.545 22.919 -10.526 1.00 33.42 C ATOM 58 OD1 ASP A 984 -46.240 21.723 -10.368 1.00 36.65 O ATOM 59 OD2 ASP A 984 -47.418 23.293 -11.323 1.00 41.07 O ATOM 60 H ASP A 984 -46.968 23.185 -7.526 1.00 0.00 H ATOM 61 N THR A 985 -44.735 25.610 -7.203 1.00 22.62 N ATOM 62 CA THR A 985 -43.982 26.743 -6.650 1.00 22.43 C ATOM 63 C THR A 985 -42.853 26.230 -5.749 1.00 21.03 C ATOM 64 O THR A 985 -41.684 26.618 -5.908 1.00 19.80 O ATOM 65 CB THR A 985 -44.878 27.736 -5.877 1.00 22.70 C ATOM 66 OG1 THR A 985 -45.906 28.247 -6.752 1.00 24.03 O ATOM 67 CG2 THR A 985 -44.052 28.881 -5.350 1.00 22.46 C ATOM 68 HG1 THR A 985 -45.485 28.712 -7.518 1.00 0.00 H ATOM 69 H THR A 985 -45.739 25.501 -6.954 1.00 0.00 H ATOM 70 N PHE A 986 -43.183 25.357 -4.801 1.00 20.33 N ATOM 71 CA PHE A 986 -42.146 24.798 -3.943 1.00 21.41 C ATOM 72 C PHE A 986 -41.144 23.971 -4.724 1.00 20.88 C ATOM 73 O PHE A 986 -39.960 23.942 -4.373 1.00 22.02 O ATOM 74 CB PHE A 986 -42.735 23.998 -2.770 1.00 22.88 C ATOM 75 CG PHE A 986 -43.493 24.839 -1.782 1.00 24.96 C ATOM 76 CD1 PHE A 986 -42.986 26.058 -1.316 1.00 26.33 C ATOM 77 CD2 PHE A 986 -44.715 24.417 -1.305 1.00 26.24 C ATOM 78 CE1 PHE A 986 -43.685 26.828 -0.393 1.00 27.58 C ATOM 79 CE2 PHE A 986 -45.419 25.186 -0.387 1.00 26.05 C ATOM 80 CZ PHE A 986 -44.913 26.384 0.074 1.00 26.36 C ATOM 81 H PHE A 986 -44.176 25.075 -4.673 1.00 0.00 H ATOM 82 N ARG A 987 -41.572 23.259 -5.765 1.00 20.93 N ATOM 83 CA ARG A 987 -40.604 22.536 -6.574 1.00 22.99 C ATOM 84 C ARG A 987 -39.629 23.510 -7.256 1.00 19.70 C ATOM 85 O ARG A 987 -38.416 23.252 -7.291 1.00 17.80 O ATOM 86 CB ARG A 987 -41.283 21.670 -7.615 1.00 24.68 C ATOM 87 CG ARG A 987 -40.314 20.737 -8.270 1.00 28.02 C ATOM 88 CD ARG A 987 -41.019 19.559 -8.902 1.00 29.99 C ATOM 89 NE ARG A 987 -39.994 18.712 -9.499 1.00 35.36 N ATOM 90 CZ ARG A 987 -39.547 18.794 -10.764 1.00 38.04 C ATOM 91 NH1 ARG A 987 -40.045 19.695 -11.657 1.00 39.34 N ATOM 92 NH2 ARG A 987 -38.600 17.938 -11.142 1.00 37.22 N ATOM 93 HE ARG A 987 -39.571 17.980 -8.893 1.00 0.00 H ATOM 94 HH12 ARG A 987 -39.672 19.726 -12.627 1.00 0.00 H ATOM 95 HH11 ARG A 987 -40.798 20.351 -11.368 1.00 0.00 H ATOM 96 HH22 ARG A 987 -38.228 17.969 -12.113 1.00 0.00 H ATOM 97 HH21 ARG A 987 -38.232 17.238 -10.467 1.00 0.00 H ATOM 98 H ARG A 987 -42.585 23.221 -5.996 1.00 0.00 H ATOM 99 N GLU A 988 -40.147 24.610 -7.794 1.00 18.60 N ATOM 100 CA GLU A 988 -39.265 25.612 -8.393 1.00 18.65 C ATOM 101 C GLU A 988 -38.271 26.183 -7.360 1.00 18.53 C ATOM 102 O GLU A 988 -37.063 26.376 -7.687 1.00 18.91 O ATOM 103 CB GLU A 988 -40.044 26.727 -9.072 1.00 20.16 C ATOM 104 CG GLU A 988 -39.140 27.812 -9.619 1.00 21.50 C ATOM 105 CD GLU A 988 -39.780 28.723 -10.652 1.00 25.88 C ATOM 106 OE1 GLU A 988 -39.045 29.640 -11.096 1.00 22.98 O ATOM 107 OE2 GLU A 988 -40.978 28.556 -11.002 1.00 23.13 O ATOM 108 H GLU A 988 -41.176 24.758 -7.789 1.00 0.00 H ATOM 109 N LEU A 989 -38.753 26.455 -6.146 1.00 17.86 N ATOM 110 CA LEU A 989 -37.908 26.912 -5.058 1.00 17.93 C ATOM 111 C LEU A 989 -36.779 25.907 -4.805 1.00 17.99 C ATOM 112 O LEU A 989 -35.620 26.287 -4.722 1.00 17.38 O ATOM 113 CB LEU A 989 -38.704 27.166 -3.782 1.00 20.25 C ATOM 114 CG LEU A 989 -37.826 27.517 -2.567 1.00 19.53 C ATOM 115 CD1 LEU A 989 -37.125 28.852 -2.759 1.00 20.74 C ATOM 116 CD2 LEU A 989 -38.648 27.468 -1.268 1.00 21.39 C ATOM 117 H LEU A 989 -39.771 26.335 -5.973 1.00 0.00 H ATOM 118 N ARG A 990 -37.102 24.619 -4.739 1.00 16.07 N ATOM 119 CA ARG A 990 -36.048 23.594 -4.529 1.00 17.30 C ATOM 120 C ARG A 990 -34.991 23.566 -5.615 1.00 15.84 C ATOM 121 O ARG A 990 -33.769 23.487 -5.341 1.00 15.96 O ATOM 122 CB ARG A 990 -36.672 22.188 -4.351 1.00 18.05 C ATOM 123 CG ARG A 990 -37.522 22.080 -3.101 1.00 19.55 C ATOM 124 CD ARG A 990 -37.871 20.644 -2.734 1.00 19.69 C ATOM 125 NE ARG A 990 -38.690 20.012 -3.755 1.00 19.71 N ATOM 126 CZ ARG A 990 -40.025 20.048 -3.817 1.00 21.64 C ATOM 127 NH1 ARG A 990 -40.746 20.667 -2.903 1.00 21.28 N ATOM 128 NH2 ARG A 990 -40.655 19.414 -4.802 1.00 24.48 N ATOM 129 HE ARG A 990 -38.194 19.486 -4.503 1.00 0.00 H ATOM 130 HH12 ARG A 990 -41.783 20.678 -2.978 1.00 0.00 H ATOM 131 HH11 ARG A 990 -40.278 21.144 -2.107 1.00 0.00 H ATOM 132 HH22 ARG A 990 -41.693 19.438 -4.856 1.00 0.00 H ATOM 133 HH21 ARG A 990 -40.109 18.894 -5.519 1.00 0.00 H ATOM 134 H ARG A 990 -38.096 24.328 -4.835 1.00 0.00 H ATOM 135 N ILE A 991 -35.439 23.640 -6.849 1.00 17.25 N ATOM 136 CA ILE A 991 -34.557 23.691 -8.005 1.00 17.78 C ATOM 137 C ILE A 991 -33.607 24.896 -7.897 1.00 16.65 C ATOM 138 O ILE A 991 -32.378 24.739 -8.059 1.00 15.90 O ATOM 139 CB ILE A 991 -35.379 23.715 -9.309 1.00 19.67 C ATOM 140 CG1 ILE A 991 -36.090 22.347 -9.476 1.00 21.79 C ATOM 141 CG2 ILE A 991 -34.500 23.994 -10.493 1.00 20.94 C ATOM 142 CD1 ILE A 991 -37.158 22.332 -10.531 1.00 22.99 C ATOM 143 H ILE A 991 -36.467 23.663 -7.005 1.00 0.00 H ATOM 144 N PHE A 992 -34.182 26.056 -7.644 1.00 15.61 N ATOM 145 CA PHE A 992 -33.409 27.294 -7.456 1.00 17.42 C ATOM 146 C PHE A 992 -32.384 27.135 -6.331 1.00 16.87 C ATOM 147 O PHE A 992 -31.164 27.412 -6.530 1.00 17.37 O ATOM 148 CB PHE A 992 -34.333 28.465 -7.174 1.00 19.06 C ATOM 149 CG PHE A 992 -33.591 29.736 -6.875 1.00 19.70 C ATOM 150 CD1 PHE A 992 -32.947 30.443 -7.878 1.00 21.53 C ATOM 151 CD2 PHE A 992 -33.541 30.203 -5.579 1.00 21.60 C ATOM 152 CE1 PHE A 992 -32.244 31.615 -7.578 1.00 22.65 C ATOM 153 CE2 PHE A 992 -32.872 31.386 -5.279 1.00 22.36 C ATOM 154 CZ PHE A 992 -32.234 32.083 -6.276 1.00 22.30 C ATOM 155 H PHE A 992 -35.219 26.097 -7.575 1.00 0.00 H ATOM 156 N LEU A 993 -32.820 26.629 -5.180 1.00 16.96 N ATOM 157 CA LEU A 993 -31.909 26.438 -4.046 1.00 17.30 C ATOM 158 C LEU A 993 -30.799 25.414 -4.298 1.00 16.86 C ATOM 159 O LEU A 993 -29.659 25.632 -3.890 1.00 16.73 O ATOM 160 CB LEU A 993 -32.664 26.100 -2.760 1.00 17.72 C ATOM 161 CG LEU A 993 -33.670 27.133 -2.235 1.00 17.88 C ATOM 162 CD1 LEU A 993 -34.355 26.583 -1.005 1.00 19.59 C ATOM 163 CD2 LEU A 993 -32.989 28.484 -1.926 1.00 17.44 C ATOM 164 H LEU A 993 -33.821 26.365 -5.083 1.00 0.00 H ATOM 165 N ARG A 994 -31.109 24.310 -4.952 1.00 16.58 N ATOM 166 CA ARG A 994 -30.085 23.338 -5.335 1.00 18.01 C ATOM 167 C ARG A 994 -29.027 23.931 -6.233 1.00 18.85 C ATOM 168 O ARG A 994 -27.820 23.646 -6.070 1.00 18.52 O ATOM 169 CB ARG A 994 -30.690 22.171 -6.099 1.00 20.80 C ATOM 170 CG ARG A 994 -31.394 21.192 -5.252 1.00 23.09 C ATOM 171 CD ARG A 994 -31.585 19.852 -5.965 1.00 23.94 C ATOM 172 NE ARG A 994 -32.728 19.264 -5.314 1.00 22.95 N ATOM 173 CZ ARG A 994 -33.994 19.411 -5.660 1.00 22.97 C ATOM 174 NH1 ARG A 994 -34.348 20.052 -6.759 1.00 23.11 N ATOM 175 NH2 ARG A 994 -34.926 18.895 -4.875 1.00 24.57 N ATOM 176 HE ARG A 994 -32.537 18.663 -4.487 1.00 0.00 H ATOM 177 HH12 ARG A 994 -35.354 20.150 -7.003 1.00 0.00 H ATOM 178 HH11 ARG A 994 -33.620 20.459 -7.381 1.00 0.00 H ATOM 179 HH22 ARG A 994 -35.931 18.997 -5.124 1.00 0.00 H ATOM 180 HH21 ARG A 994 -34.654 18.388 -4.009 1.00 0.00 H ATOM 181 H ARG A 994 -32.102 24.127 -5.200 1.00 0.00 H ATOM 182 N ASN A 995 -29.458 24.733 -7.200 1.00 18.34 N ATOM 183 CA ASN A 995 -28.499 25.378 -8.137 1.00 19.45 C ATOM 184 C ASN A 995 -27.598 26.318 -7.407 1.00 19.65 C ATOM 185 O ASN A 995 -26.380 26.282 -7.655 1.00 19.22 O ATOM 186 CB ASN A 995 -29.202 26.104 -9.279 1.00 20.11 C ATOM 187 CG ASN A 995 -28.245 26.960 -10.162 1.00 18.25 C ATOM 188 OD1 ASN A 995 -28.119 28.170 -9.982 1.00 13.70 O ATOM 189 ND2 ASN A 995 -27.632 26.321 -11.165 1.00 20.74 N ATOM 190 HD22 ASN A 995 -27.763 25.296 -11.286 1.00 0.00 H ATOM 191 HD21 ASN A 995 -27.025 26.849 -11.824 1.00 0.00 H ATOM 192 H ASN A 995 -30.477 24.912 -7.303 1.00 0.00 H ATOM 193 N VAL A 996 -28.164 27.175 -6.542 1.00 19.41 N ATOM 194 CA VAL A 996 -27.351 28.106 -5.746 1.00 19.91 C ATOM 195 C VAL A 996 -26.357 27.330 -4.859 1.00 18.14 C ATOM 196 O VAL A 996 -25.135 27.623 -4.818 1.00 17.31 O ATOM 197 CB VAL A 996 -28.212 29.030 -4.870 1.00 20.35 C ATOM 198 CG1 VAL A 996 -27.356 29.846 -3.915 1.00 21.26 C ATOM 199 CG2 VAL A 996 -29.093 29.913 -5.738 1.00 21.15 C ATOM 200 H VAL A 996 -29.198 27.180 -6.433 1.00 0.00 H ATOM 201 N THR A 997 -26.847 26.299 -4.176 1.00 16.14 N ATOM 202 CA THR A 997 -26.005 25.517 -3.254 1.00 17.59 C ATOM 203 C THR A 997 -24.860 24.816 -4.008 1.00 17.61 C ATOM 204 O THR A 997 -23.711 24.810 -3.519 1.00 17.50 O ATOM 205 CB THR A 997 -26.868 24.502 -2.476 1.00 17.47 C ATOM 206 OG1 THR A 997 -27.946 25.190 -1.850 1.00 17.10 O ATOM 207 CG2 THR A 997 -26.069 23.777 -1.401 1.00 18.82 C ATOM 208 HG1 THR A 997 -28.497 25.636 -2.541 1.00 0.00 H ATOM 209 H THR A 997 -27.847 26.039 -4.296 1.00 0.00 H ATOM 210 N HIS A 998 -25.153 24.280 -5.192 1.00 18.22 N ATOM 211 CA HIS A 998 -24.123 23.657 -6.040 1.00 19.06 C ATOM 212 C HIS A 998 -23.039 24.684 -6.384 1.00 19.81 C ATOM 213 O HIS A 998 -21.847 24.383 -6.332 1.00 19.36 O ATOM 214 CB HIS A 998 -24.748 23.045 -7.310 1.00 20.23 C ATOM 215 CG HIS A 998 -23.755 22.441 -8.252 1.00 20.75 C ATOM 216 ND1 HIS A 998 -22.945 21.379 -7.901 1.00 19.30 N ATOM 217 CD2 HIS A 998 -23.457 22.729 -9.544 1.00 21.43 C ATOM 218 CE1 HIS A 998 -22.162 21.069 -8.919 1.00 20.38 C ATOM 219 NE2 HIS A 998 -22.448 21.877 -9.927 1.00 22.10 N ATOM 220 H HIS A 998 -26.137 24.302 -5.527 1.00 0.00 H ATOM 221 N ARG A 999 -23.447 25.887 -6.765 1.00 18.24 N ATOM 222 CA ARG A 999 -22.468 26.936 -7.081 1.00 19.35 C ATOM 223 C ARG A 999 -21.589 27.305 -5.890 1.00 19.42 C ATOM 224 O ARG A 999 -20.401 27.614 -6.074 1.00 21.76 O ATOM 225 CB ARG A 999 -23.147 28.139 -7.678 1.00 19.10 C ATOM 226 CG ARG A 999 -23.656 27.836 -9.091 1.00 20.86 C ATOM 227 CD ARG A 999 -24.903 28.641 -9.456 1.00 22.92 C ATOM 228 NE ARG A 999 -24.579 30.035 -9.567 1.00 22.31 N ATOM 229 CZ ARG A 999 -25.492 31.003 -9.657 1.00 21.25 C ATOM 230 NH1 ARG A 999 -26.799 30.737 -9.705 1.00 20.45 N ATOM 231 NH2 ARG A 999 -25.081 32.229 -9.731 1.00 21.97 N ATOM 232 HE ARG A 999 -23.575 30.306 -9.578 1.00 0.00 H ATOM 233 HH12 ARG A 999 -27.486 31.515 -9.775 1.00 0.00 H ATOM 234 HH11 ARG A 999 -27.131 29.752 -9.672 1.00 0.00 H ATOM 235 HH22 ARG A 999 -25.770 33.005 -9.802 1.00 0.00 H ATOM 236 HH21 ARG A 999 -24.062 32.438 -9.719 1.00 0.00 H ATOM 237 H ARG A 999 -24.464 26.089 -6.840 1.00 0.00 H ATOM 238 N LEU A1000 -22.134 27.292 -4.681 1.00 18.36 N ATOM 239 CA LEU A1000 -21.320 27.507 -3.494 1.00 18.28 C ATOM 240 C LEU A1000 -20.403 26.326 -3.279 1.00 19.17 C ATOM 241 O LEU A1000 -19.209 26.497 -2.985 1.00 20.14 O ATOM 242 CB LEU A1000 -22.197 27.722 -2.255 1.00 18.99 C ATOM 243 CG LEU A1000 -23.137 28.941 -2.349 1.00 18.37 C ATOM 244 CD1 LEU A1000 -24.084 29.006 -1.162 1.00 19.58 C ATOM 245 CD2 LEU A1000 -22.373 30.253 -2.482 1.00 19.89 C ATOM 246 H LEU A1000 -23.156 27.126 -4.580 1.00 0.00 H ATOM 247 N ALA A1001 -20.951 25.135 -3.437 1.00 18.00 N ATOM 248 CA ALA A1001 -20.206 23.903 -3.097 1.00 19.89 C ATOM 249 C ALA A1001 -19.020 23.652 -4.017 1.00 21.40 C ATOM 250 O ALA A1001 -18.064 22.987 -3.613 1.00 21.83 O ATOM 251 CB ALA A1001 -21.127 22.700 -3.097 1.00 20.66 C ATOM 252 H ALA A1001 -21.921 25.062 -3.806 1.00 0.00 H ATOM 253 N ILE A1002 -19.075 24.125 -5.245 1.00 21.76 N ATOM 254 CA ILE A1002 -17.945 23.901 -6.160 1.00 23.27 C ATOM 255 C ILE A1002 -16.883 24.994 -6.075 1.00 25.21 C ATOM 256 O ILE A1002 -15.849 24.905 -6.726 1.00 24.91 O ATOM 257 CB ILE A1002 -18.386 23.733 -7.626 1.00 25.10 C ATOM 258 CG1 ILE A1002 -18.941 25.034 -8.203 1.00 25.35 C ATOM 259 CG2 ILE A1002 -19.396 22.600 -7.738 1.00 26.60 C ATOM 260 CD1 ILE A1002 -19.492 24.897 -9.625 1.00 29.63 C ATOM 261 H ILE A1002 -19.912 24.653 -5.566 1.00 0.00 H ATOM 262 N ASP A1003 -17.138 26.033 -5.302 1.00 22.62 N ATOM 263 CA ASP A1003 -16.193 27.120 -5.132 1.00 23.03 C ATOM 264 C ASP A1003 -15.098 26.647 -4.178 1.00 23.28 C ATOM 265 O ASP A1003 -15.357 26.228 -3.043 1.00 21.37 O ATOM 266 CB ASP A1003 -16.909 28.334 -4.560 1.00 23.59 C ATOM 267 CG ASP A1003 -16.067 29.575 -4.573 1.00 23.94 C ATOM 268 OD1 ASP A1003 -14.899 29.522 -4.131 1.00 24.31 O ATOM 269 OD2 ASP A1003 -16.592 30.626 -4.976 1.00 24.47 O ATOM 270 H ASP A1003 -18.047 26.074 -4.798 1.00 0.00 H ATOM 271 N LYS A1004 -13.839 26.695 -4.620 1.00 24.75 N ATOM 272 CA LYS A1004 -12.778 26.117 -3.785 1.00 25.06 C ATOM 273 C LYS A1004 -12.583 26.797 -2.416 1.00 22.87 C ATOM 274 O LYS A1004 -12.123 26.156 -1.469 1.00 22.70 O ATOM 275 CB LYS A1004 -11.455 26.025 -4.566 1.00 27.88 C ATOM 276 CG LYS A1004 -10.885 27.319 -5.073 1.00 29.28 C ATOM 277 CD LYS A1004 -10.090 27.120 -6.374 1.00 32.16 C ATOM 278 CE LYS A1004 -9.263 25.840 -6.392 1.00 33.98 C ATOM 279 NZ LYS A1004 -9.963 24.657 -6.985 1.00 34.91 N ATOM 280 HZ1 LYS A1004 -10.823 24.454 -6.437 1.00 0.00 H ATOM 281 HZ2 LYS A1004 -10.220 24.866 -7.971 1.00 0.00 H ATOM 282 HZ3 LYS A1004 -9.331 23.832 -6.958 1.00 0.00 H ATOM 283 H LYS A1004 -13.614 27.133 -5.536 1.00 0.00 H ATOM 284 N ARG A1005 -12.950 28.062 -2.292 1.00 22.01 N ATOM 285 CA ARG A1005 -12.869 28.748 -0.983 1.00 22.97 C ATOM 286 C ARG A1005 -13.747 28.121 0.079 1.00 22.09 C ATOM 287 O ARG A1005 -13.485 28.269 1.277 1.00 21.27 O ATOM 288 CB ARG A1005 -13.311 30.179 -1.098 1.00 23.06 C ATOM 289 CG ARG A1005 -12.434 31.042 -1.970 1.00 24.51 C ATOM 290 CD ARG A1005 -13.059 32.413 -2.100 1.00 25.30 C ATOM 291 NE ARG A1005 -14.267 32.361 -2.913 1.00 25.69 N ATOM 292 CZ ARG A1005 -15.107 33.376 -3.081 1.00 26.35 C ATOM 293 NH1 ARG A1005 -14.879 34.559 -2.514 1.00 26.91 N ATOM 294 NH2 ARG A1005 -16.183 33.216 -3.825 1.00 26.70 N ATOM 295 HE ARG A1005 -14.487 31.466 -3.396 1.00 0.00 H ATOM 296 HH12 ARG A1005 -15.548 35.342 -2.657 1.00 0.00 H ATOM 297 HH11 ARG A1005 -14.031 34.700 -1.928 1.00 0.00 H ATOM 298 HH22 ARG A1005 -16.844 34.007 -3.960 1.00 0.00 H ATOM 299 HH21 ARG A1005 -16.371 32.298 -4.277 1.00 0.00 H ATOM 300 H ARG A1005 -13.299 28.580 -3.123 1.00 0.00 H ATOM 301 N PHE A1006 -14.805 27.446 -0.365 1.00 20.16 N ATOM 302 CA PHE A1006 -15.846 26.935 0.525 1.00 19.85 C ATOM 303 C PHE A1006 -15.755 25.449 0.747 1.00 21.68 C ATOM 304 O PHE A1006 -16.644 24.863 1.365 1.00 20.08 O ATOM 305 CB PHE A1006 -17.234 27.336 -0.003 1.00 18.33 C ATOM 306 CG PHE A1006 -17.369 28.774 -0.315 1.00 18.81 C ATOM 307 CD1 PHE A1006 -16.707 29.751 0.453 1.00 18.33 C ATOM 308 CD2 PHE A1006 -18.185 29.196 -1.355 1.00 17.25 C ATOM 309 CE1 PHE A1006 -16.859 31.087 0.154 1.00 18.92 C ATOM 310 CE2 PHE A1006 -18.316 30.520 -1.661 1.00 18.61 C ATOM 311 CZ PHE A1006 -17.655 31.484 -0.907 1.00 19.08 C ATOM 312 H PHE A1006 -14.895 27.275 -1.387 1.00 0.00 H ATOM 313 N ARG A1007 -14.621 24.844 0.379 1.00 22.04 N ATOM 314 CA ARG A1007 -14.443 23.407 0.560 1.00 23.57 C ATOM 315 C ARG A1007 -14.641 22.958 1.995 1.00 20.56 C ATOM 316 O ARG A1007 -15.219 21.911 2.244 1.00 22.83 O ATOM 317 CB ARG A1007 -13.060 22.965 0.054 1.00 26.58 C ATOM 318 CG ARG A1007 -12.878 21.459 0.107 1.00 32.10 C ATOM 319 CD ARG A1007 -11.412 21.023 0.016 1.00 39.67 C ATOM 320 NE ARG A1007 -10.550 21.692 1.003 1.00 45.47 N ATOM 321 CZ ARG A1007 -10.528 21.464 2.322 1.00 44.74 C ATOM 322 NH1 ARG A1007 -11.324 20.563 2.900 1.00 46.91 N ATOM 323 NH2 ARG A1007 -9.698 22.165 3.075 1.00 46.81 N ATOM 324 HE ARG A1007 -9.894 22.413 0.641 1.00 0.00 H ATOM 325 HH12 ARG A1007 -11.279 20.413 3.928 1.00 0.00 H ATOM 326 HH11 ARG A1007 -11.990 20.011 2.322 1.00 0.00 H ATOM 327 HH22 ARG A1007 -9.665 22.004 4.102 1.00 0.00 H ATOM 328 HH21 ARG A1007 -9.078 22.878 2.641 1.00 0.00 H ATOM 329 H ARG A1007 -13.854 25.406 -0.043 1.00 0.00 H ATOM 330 N VAL A1008 -14.217 23.771 2.942 1.00 21.85 N ATOM 331 CA VAL A1008 -14.300 23.401 4.336 1.00 24.08 C ATOM 332 C VAL A1008 -15.739 23.312 4.830 1.00 23.53 C ATOM 333 O VAL A1008 -15.978 22.688 5.845 1.00 22.30 O ATOM 334 CB VAL A1008 -13.492 24.329 5.272 1.00 27.25 C ATOM 335 CG1 VAL A1008 -12.008 24.158 4.986 1.00 30.98 C ATOM 336 CG2 VAL A1008 -13.911 25.786 5.167 1.00 27.71 C ATOM 337 H VAL A1008 -13.816 24.694 2.681 1.00 0.00 H ATOM 338 N PHE A1009 -16.656 23.921 4.079 1.00 22.19 N ATOM 339 CA PHE A1009 -18.082 23.954 4.431 1.00 22.05 C ATOM 340 C PHE A1009 -18.908 22.942 3.664 1.00 23.11 C ATOM 341 O PHE A1009 -20.145 22.927 3.784 1.00 23.45 O ATOM 342 CB PHE A1009 -18.633 25.363 4.170 1.00 20.51 C ATOM 343 CG PHE A1009 -17.840 26.458 4.844 1.00 21.14 C ATOM 344 CD1 PHE A1009 -17.645 26.460 6.232 1.00 20.31 C ATOM 345 CD2 PHE A1009 -17.300 27.487 4.100 1.00 21.76 C ATOM 346 CE1 PHE A1009 -16.902 27.454 6.835 1.00 22.50 C ATOM 347 CE2 PHE A1009 -16.567 28.488 4.706 1.00 22.98 C ATOM 348 CZ PHE A1009 -16.359 28.468 6.076 1.00 22.92 C ATOM 349 H PHE A1009 -16.349 24.394 3.205 1.00 0.00 H ATOM 350 N THR A1010 -18.268 22.085 2.880 1.00 23.35 N ATOM 351 CA THR A1010 -18.991 21.162 2.002 1.00 24.77 C ATOM 352 C THR A1010 -19.446 19.879 2.686 1.00 27.44 C ATOM 353 O THR A1010 -20.327 19.189 2.169 1.00 30.81 O ATOM 354 CB THR A1010 -18.192 20.749 0.760 1.00 26.16 C ATOM 355 OG1 THR A1010 -16.930 20.186 1.136 1.00 24.93 O ATOM 356 CG2 THR A1010 -17.978 21.944 -0.167 1.00 25.43 C ATOM 357 HG1 THR A1010 -16.409 20.857 1.644 1.00 0.00 H ATOM 358 H THR A1010 -17.228 22.068 2.889 1.00 0.00 H ATOM 359 N LYS A1011 -18.834 19.560 3.821 1.00 27.29 N ATOM 360 CA LYS A1011 -19.131 18.334 4.555 1.00 32.12 C ATOM 361 C LYS A1011 -19.151 18.667 6.038 1.00 29.89 C ATOM 362 O LYS A1011 -18.549 19.655 6.462 1.00 31.28 O ATOM 363 CB LYS A1011 -18.052 17.276 4.275 1.00 35.76 C ATOM 364 CG LYS A1011 -18.039 16.737 2.847 1.00 42.68 C ATOM 365 CD LYS A1011 -19.337 16.007 2.458 1.00 48.97 C ATOM 366 CE LYS A1011 -19.531 15.961 0.942 1.00 51.10 C ATOM 367 NZ LYS A1011 -20.791 15.278 0.518 1.00 56.67 N ATOM 368 HZ1 LYS A1011 -20.783 14.296 0.860 1.00 0.00 H ATOM 369 HZ2 LYS A1011 -21.608 15.780 0.920 1.00 0.00 H ATOM 370 HZ3 LYS A1011 -20.855 15.285 -0.520 1.00 0.00 H ATOM 371 H LYS A1011 -18.116 20.209 4.201 1.00 0.00 H ATOM 372 N PRO A1012 -19.819 17.831 6.848 1.00 33.09 N ATOM 373 CA PRO A1012 -19.780 18.092 8.285 1.00 34.53 C ATOM 374 C PRO A1012 -18.350 18.006 8.815 1.00 36.79 C ATOM 375 O PRO A1012 -17.520 17.294 8.240 1.00 35.83 O ATOM 376 CB PRO A1012 -20.637 16.973 8.881 1.00 35.80 C ATOM 377 CG PRO A1012 -21.385 16.368 7.748 1.00 35.62 C ATOM 378 CD PRO A1012 -20.541 16.590 6.529 1.00 35.31 C ATOM 379 N VAL A1013 -18.065 18.752 9.875 1.00 40.92 N ATOM 380 CA VAL A1013 -16.762 18.689 10.535 1.00 46.30 C ATOM 381 C VAL A1013 -16.551 17.253 11.028 1.00 50.78 C ATOM 382 O VAL A1013 -17.471 16.649 11.581 1.00 52.35 O ATOM 383 CB VAL A1013 -16.657 19.690 11.710 1.00 44.18 C ATOM 384 CG1 VAL A1013 -15.382 19.445 12.510 1.00 44.55 C ATOM 385 CG2 VAL A1013 -16.695 21.126 11.200 1.00 45.29 C ATOM 386 H VAL A1013 -18.789 19.400 10.247 1.00 0.00 H ATOM 387 N ASP A1014 -15.355 16.707 10.798 1.00 56.60 N ATOM 388 CA ASP A1014 -15.051 15.313 11.146 1.00 64.44 C ATOM 389 C ASP A1014 -14.764 15.197 12.647 1.00 64.25 C ATOM 390 O ASP A1014 -13.827 15.834 13.138 1.00 62.50 O ATOM 391 CB ASP A1014 -13.838 14.824 10.335 1.00 67.18 C ATOM 392 CG ASP A1014 -13.729 13.300 10.276 1.00 69.57 C ATOM 393 OD1 ASP A1014 -14.164 12.601 11.220 1.00 66.99 O ATOM 394 OD2 ASP A1014 -13.191 12.800 9.265 1.00 74.59 O ATOM 395 H ASP A1014 -14.614 17.288 10.358 1.00 0.00 H ATOM 396 N PRO A1015 -15.555 14.377 13.379 1.00 70.87 N ATOM 397 CA PRO A1015 -15.341 14.247 14.832 1.00 74.66 C ATOM 398 C PRO A1015 -13.991 13.615 15.183 1.00 77.67 C ATOM 399 O PRO A1015 -13.409 13.938 16.224 1.00 78.58 O ATOM 400 CB PRO A1015 -16.494 13.343 15.282 1.00 74.28 C ATOM 401 CG PRO A1015 -16.851 12.557 14.069 1.00 71.96 C ATOM 402 CD PRO A1015 -16.634 13.485 12.908 1.00 70.22 C ATOM 403 N ASP A1016 -13.506 12.727 14.313 1.00 79.68 N ATOM 404 CA ASP A1016 -12.161 12.172 14.443 1.00 81.64 C ATOM 405 C ASP A1016 -11.145 13.313 14.474 1.00 83.35 C ATOM 406 O ASP A1016 -10.288 13.370 15.359 1.00 86.71 O ATOM 407 CB ASP A1016 -11.844 11.209 13.288 1.00 80.79 C ATOM 408 CG ASP A1016 -12.750 9.977 13.273 1.00 76.66 C ATOM 409 OD1 ASP A1016 -13.255 9.578 14.343 1.00 71.15 O ATOM 410 OD2 ASP A1016 -12.953 9.405 12.183 1.00 74.66 O ATOM 411 H ASP A1016 -14.103 12.421 13.519 1.00 0.00 H ATOM 412 N GLU A1017 -11.266 14.239 13.527 1.00 79.30 N ATOM 413 CA GLU A1017 -10.345 15.371 13.455 1.00 78.82 C ATOM 414 C GLU A1017 -10.613 16.418 14.545 1.00 74.32 C ATOM 415 O GLU A1017 -9.673 16.894 15.187 1.00 73.38 O ATOM 416 CB GLU A1017 -10.393 16.015 12.063 1.00 79.92 C ATOM 417 CG GLU A1017 -10.036 15.072 10.920 1.00 79.47 C ATOM 418 CD GLU A1017 -8.674 14.426 11.089 1.00 79.32 C ATOM 419 OE1 GLU A1017 -7.745 15.111 11.566 1.00 77.57 O ATOM 420 OE2 GLU A1017 -8.534 13.232 10.747 1.00 79.87 O ATOM 421 H GLU A1017 -12.029 14.156 12.826 1.00 0.00 H ATOM 422 N VAL A1018 -11.886 16.767 14.750 1.00 69.67 N ATOM 423 CA VAL A1018 -12.274 17.798 15.724 1.00 65.69 C ATOM 424 C VAL A1018 -13.309 17.220 16.694 1.00 68.04 C ATOM 425 O VAL A1018 -14.517 17.342 16.465 1.00 62.16 O ATOM 426 CB VAL A1018 -12.844 19.064 15.041 1.00 62.97 C ATOM 427 CG1 VAL A1018 -12.744 20.258 15.976 1.00 60.86 C ATOM 428 CG2 VAL A1018 -12.110 19.366 13.740 1.00 63.26 C ATOM 429 H VAL A1018 -12.630 16.292 14.200 1.00 0.00 H ATOM 430 N PRO A1019 -12.838 16.593 17.791 1.00 69.41 N ATOM 431 CA PRO A1019 -13.761 15.884 18.680 1.00 67.49 C ATOM 432 C PRO A1019 -14.625 16.797 19.546 1.00 60.18 C ATOM 433 O PRO A1019 -15.754 16.428 19.864 1.00 63.31 O ATOM 434 CB PRO A1019 -12.832 15.011 19.552 1.00 68.65 C ATOM 435 CG PRO A1019 -11.439 15.239 19.049 1.00 70.02 C ATOM 436 CD PRO A1019 -11.452 16.525 18.287 1.00 69.85 C ATOM 437 N ASP A1020 -14.128 17.975 19.915 1.00 56.68 N ATOM 438 CA ASP A1020 -14.945 18.903 20.697 1.00 58.15 C ATOM 439 C ASP A1020 -15.912 19.744 19.842 1.00 53.90 C ATOM 440 O ASP A1020 -16.615 20.605 20.383 1.00 53.34 O ATOM 441 CB ASP A1020 -14.074 19.848 21.523 1.00 61.51 C ATOM 442 CG ASP A1020 -13.416 20.902 20.681 1.00 65.58 C ATOM 443 OD1 ASP A1020 -12.668 20.507 19.764 1.00 72.97 O ATOM 444 OD2 ASP A1020 -13.660 22.109 20.915 1.00 62.22 O ATOM 445 H ASP A1020 -13.158 18.236 19.647 1.00 0.00 H ATOM 446 N TYR A1021 -15.951 19.526 18.527 1.00 48.07 N ATOM 447 CA TYR A1021 -16.827 20.358 17.695 1.00 42.30 C ATOM 448 C TYR A1021 -18.286 20.190 18.094 1.00 42.27 C ATOM 449 O TYR A1021 -18.964 21.183 18.400 1.00 42.01 O ATOM 450 CB TYR A1021 -16.670 20.065 16.206 1.00 42.10 C ATOM 451 CG TYR A1021 -17.360 21.115 15.360 1.00 37.06 C ATOM 452 CD1 TYR A1021 -16.759 22.352 15.139 1.00 34.60 C ATOM 453 CD2 TYR A1021 -18.635 20.892 14.830 1.00 36.75 C ATOM 454 CE1 TYR A1021 -17.375 23.324 14.372 1.00 34.33 C ATOM 455 CE2 TYR A1021 -19.274 21.866 14.062 1.00 32.43 C ATOM 456 CZ TYR A1021 -18.638 23.072 13.837 1.00 32.41 C ATOM 457 OH TYR A1021 -19.248 24.049 13.115 1.00 29.94 O ATOM 458 HH TYR A1021 -18.650 24.836 13.056 1.00 0.00 H ATOM 459 H TYR A1021 -15.370 18.778 18.098 1.00 0.00 H ATOM 460 N VAL A1022 -18.735 18.931 18.101 1.00 44.79 N ATOM 461 CA VAL A1022 -20.146 18.580 18.332 1.00 48.84 C ATOM 462 C VAL A1022 -20.595 18.948 19.749 1.00 47.89 C ATOM 463 O VAL A1022 -21.785 19.173 19.983 1.00 43.91 O ATOM 464 CB VAL A1022 -20.435 17.093 17.980 1.00 52.18 C ATOM 465 CG1 VAL A1022 -21.806 16.639 18.461 1.00 54.92 C ATOM 466 CG2 VAL A1022 -20.368 16.896 16.473 1.00 54.78 C ATOM 467 H VAL A1022 -18.055 18.162 17.935 1.00 0.00 H ATOM 468 N THR A1023 -19.646 19.067 20.670 1.00 47.84 N ATOM 469 CA THR A1023 -19.950 19.550 22.026 1.00 48.75 C ATOM 470 C THR A1023 -20.055 21.087 22.134 1.00 45.11 C ATOM 471 O THR A1023 -20.807 21.598 22.971 1.00 44.27 O ATOM 472 CB THR A1023 -18.945 18.982 23.070 1.00 51.75 C ATOM 473 OG1 THR A1023 -17.598 19.330 22.716 1.00 54.35 O ATOM 474 CG2 THR A1023 -19.057 17.461 23.149 1.00 54.26 C ATOM 475 HG1 THR A1023 -17.510 20.316 22.688 1.00 0.00 H ATOM 476 H THR A1023 -18.667 18.813 20.428 1.00 0.00 H ATOM 477 N VAL A1024 -19.335 21.825 21.282 1.00 41.44 N ATOM 478 CA VAL A1024 -19.326 23.308 21.334 1.00 38.16 C ATOM 479 C VAL A1024 -20.375 23.946 20.400 1.00 35.65 C ATOM 480 O VAL A1024 -21.014 24.949 20.733 1.00 37.77 O ATOM 481 CB VAL A1024 -17.931 23.863 20.957 1.00 41.21 C ATOM 482 CG1 VAL A1024 -17.938 25.390 20.864 1.00 43.60 C ATOM 483 CG2 VAL A1024 -16.886 23.400 21.960 1.00 43.76 C ATOM 484 H VAL A1024 -18.763 21.344 20.559 1.00 0.00 H ATOM 485 N ILE A1025 -20.513 23.371 19.215 1.00 29.79 N ATOM 486 CA ILE A1025 -21.432 23.884 18.220 1.00 27.13 C ATOM 487 C ILE A1025 -22.703 23.057 18.268 1.00 26.67 C ATOM 488 O ILE A1025 -22.714 21.868 17.902 1.00 28.68 O ATOM 489 CB ILE A1025 -20.775 23.872 16.820 1.00 25.36 C ATOM 490 CG1 ILE A1025 -19.592 24.856 16.752 1.00 25.33 C ATOM 491 CG2 ILE A1025 -21.787 24.180 15.728 1.00 24.80 C ATOM 492 CD1 ILE A1025 -19.884 26.308 17.073 1.00 24.87 C ATOM 493 H ILE A1025 -19.946 22.528 18.993 1.00 0.00 H ATOM 494 N LYS A1026 -23.775 23.696 18.707 1.00 28.88 N ATOM 495 CA LYS A1026 -25.017 22.960 19.031 1.00 30.98 C ATOM 496 C LYS A1026 -25.833 22.568 17.808 1.00 31.86 C ATOM 497 O LYS A1026 -26.522 21.550 17.851 1.00 28.77 O ATOM 498 CB LYS A1026 -25.875 23.777 19.990 1.00 32.36 C ATOM 499 CG LYS A1026 -25.177 24.075 21.309 1.00 33.73 C ATOM 500 CD LYS A1026 -24.630 22.813 21.957 1.00 37.20 C ATOM 501 CE LYS A1026 -24.094 23.086 23.351 1.00 40.02 C ATOM 502 NZ LYS A1026 -23.285 21.927 23.823 1.00 42.13 N ATOM 503 HZ1 LYS A1026 -23.882 21.076 23.846 1.00 0.00 H ATOM 504 HZ2 LYS A1026 -22.487 21.775 23.173 1.00 0.00 H ATOM 505 HZ3 LYS A1026 -22.923 22.124 24.778 1.00 0.00 H ATOM 506 H LYS A1026 -23.744 24.729 18.826 1.00 0.00 H ATOM 507 N GLN A1027 -25.751 23.377 16.747 1.00 29.84 N ATOM 508 CA GLN A1027 -26.379 23.016 15.497 1.00 29.67 C ATOM 509 C GLN A1027 -25.396 23.110 14.337 1.00 27.93 C ATOM 510 O GLN A1027 -25.318 24.106 13.629 1.00 25.85 O ATOM 511 CB GLN A1027 -27.674 23.772 15.228 1.00 29.74 C ATOM 512 CG GLN A1027 -28.545 22.915 14.342 1.00 30.15 C ATOM 513 CD GLN A1027 -29.840 23.542 13.935 1.00 29.74 C ATOM 514 OE1 GLN A1027 -30.532 23.009 13.076 1.00 32.15 O ATOM 515 NE2 GLN A1027 -30.180 24.654 14.539 1.00 31.16 N ATOM 516 HE22 GLN A1027 -29.555 25.065 15.262 1.00 0.00 H ATOM 517 HE21 GLN A1027 -31.074 25.126 14.295 1.00 0.00 H ATOM 518 H GLN A1027 -25.231 24.274 16.822 1.00 0.00 H ATOM 519 N PRO A1028 -24.650 22.025 14.139 1.00 27.92 N ATOM 520 CA PRO A1028 -23.736 21.938 13.000 1.00 27.09 C ATOM 521 C PRO A1028 -24.491 22.074 11.700 1.00 25.95 C ATOM 522 O PRO A1028 -25.621 21.556 11.598 1.00 23.56 O ATOM 523 CB PRO A1028 -23.177 20.519 13.105 1.00 27.76 C ATOM 524 CG PRO A1028 -23.328 20.152 14.545 1.00 29.02 C ATOM 525 CD PRO A1028 -24.587 20.828 14.989 1.00 28.49 C ATOM 526 N MET A1029 -23.897 22.763 10.724 1.00 22.11 N ATOM 527 CA MET A1029 -24.509 22.868 9.412 1.00 22.62 C ATOM 528 C MET A1029 -23.398 22.923 8.378 1.00 21.44 C ATOM 529 O MET A1029 -22.313 23.430 8.665 1.00 21.47 O ATOM 530 CB MET A1029 -25.422 24.101 9.359 1.00 22.89 C ATOM 531 CG MET A1029 -26.323 24.202 8.125 1.00 22.80 C ATOM 532 SD MET A1029 -27.322 22.743 7.745 1.00 24.66 S ATOM 533 CE MET A1029 -28.288 22.619 9.263 1.00 25.57 C ATOM 534 H MET A1029 -22.986 23.230 10.905 1.00 0.00 H ATOM 535 N ASP A1030 -23.670 22.383 7.202 1.00 22.38 N ATOM 536 CA ASP A1030 -22.736 22.370 6.090 1.00 23.89 C ATOM 537 C ASP A1030 -23.549 22.254 4.812 1.00 23.32 C ATOM 538 O ASP A1030 -24.768 21.993 4.843 1.00 22.76 O ATOM 539 CB ASP A1030 -21.781 21.180 6.199 1.00 24.45 C ATOM 540 CG ASP A1030 -22.502 19.861 6.038 1.00 28.35 C ATOM 541 OD1 ASP A1030 -23.081 19.352 7.021 1.00 34.53 O ATOM 542 OD2 ASP A1030 -22.562 19.349 4.916 1.00 30.06 O ATOM 543 H ASP A1030 -24.603 21.944 7.066 1.00 0.00 H ATOM 544 N LEU A1031 -22.881 22.430 3.682 1.00 21.30 N ATOM 545 CA LEU A1031 -23.595 22.440 2.397 1.00 21.53 C ATOM 546 C LEU A1031 -24.189 21.101 1.964 1.00 20.47 C ATOM 547 O LEU A1031 -25.212 21.096 1.267 1.00 20.50 O ATOM 548 CB LEU A1031 -22.729 23.027 1.285 1.00 20.33 C ATOM 549 CG LEU A1031 -22.281 24.471 1.551 1.00 20.40 C ATOM 550 CD1 LEU A1031 -21.201 24.874 0.532 1.00 20.32 C ATOM 551 CD2 LEU A1031 -23.457 25.449 1.515 1.00 20.14 C ATOM 552 H LEU A1031 -21.850 22.561 3.704 1.00 0.00 H ATOM 553 N SER A1032 -23.600 19.979 2.363 1.00 22.12 N ATOM 554 CA SER A1032 -24.172 18.674 2.050 1.00 22.86 C ATOM 555 C SER A1032 -25.483 18.509 2.822 1.00 22.78 C ATOM 556 O SER A1032 -26.462 17.998 2.287 1.00 23.31 O ATOM 557 CB SER A1032 -23.189 17.532 2.371 1.00 23.87 C ATOM 558 OG SER A1032 -22.920 17.451 3.766 1.00 23.60 O ATOM 559 HG SER A1032 -22.522 18.303 4.074 1.00 0.00 H ATOM 560 H SER A1032 -22.716 20.032 2.908 1.00 0.00 H ATOM 561 N SER A1033 -25.495 18.967 4.063 1.00 23.51 N ATOM 562 CA SER A1033 -26.706 18.904 4.891 1.00 25.72 C ATOM 563 C SER A1033 -27.783 19.816 4.321 1.00 22.73 C ATOM 564 O SER A1033 -28.966 19.487 4.309 1.00 20.15 O ATOM 565 CB SER A1033 -26.394 19.281 6.324 1.00 27.82 C ATOM 566 OG SER A1033 -25.547 18.280 6.887 1.00 32.35 O ATOM 567 HG SER A1033 -24.709 18.226 6.363 1.00 0.00 H ATOM 568 H SER A1033 -24.628 19.381 4.461 1.00 0.00 H ATOM 569 N VAL A1034 -27.364 20.966 3.821 1.00 20.21 N ATOM 570 CA VAL A1034 -28.319 21.866 3.171 1.00 19.89 C ATOM 571 C VAL A1034 -28.976 21.188 1.969 1.00 19.58 C ATOM 572 O VAL A1034 -30.200 21.280 1.828 1.00 19.49 O ATOM 573 CB VAL A1034 -27.652 23.189 2.767 1.00 19.11 C ATOM 574 CG1 VAL A1034 -28.526 23.994 1.808 1.00 19.40 C ATOM 575 CG2 VAL A1034 -27.330 24.004 3.995 1.00 19.09 C ATOM 576 H VAL A1034 -26.360 21.230 3.889 1.00 0.00 H ATOM 577 N ILE A1035 -28.200 20.515 1.114 1.00 19.41 N ATOM 578 CA ILE A1035 -28.743 19.772 -0.040 1.00 21.51 C ATOM 579 C ILE A1035 -29.734 18.713 0.444 1.00 20.95 C ATOM 580 O ILE A1035 -30.841 18.606 -0.074 1.00 19.99 O ATOM 581 CB ILE A1035 -27.611 19.090 -0.854 1.00 23.41 C ATOM 582 CG1 ILE A1035 -26.756 20.130 -1.574 1.00 26.01 C ATOM 583 CG2 ILE A1035 -28.158 18.081 -1.851 1.00 24.88 C ATOM 584 CD1 ILE A1035 -27.552 20.911 -2.583 1.00 29.26 C ATOM 585 H ILE A1035 -27.171 20.515 1.268 1.00 0.00 H ATOM 586 N SER A1036 -29.337 17.949 1.449 1.00 22.53 N ATOM 587 CA SER A1036 -30.250 16.947 2.069 1.00 22.33 C ATOM 588 C SER A1036 -31.573 17.582 2.523 1.00 20.82 C ATOM 589 O SER A1036 -32.671 17.033 2.262 1.00 21.12 O ATOM 590 CB SER A1036 -29.555 16.270 3.263 1.00 24.08 C ATOM 591 OG SER A1036 -28.479 15.478 2.777 1.00 27.87 O ATOM 592 HG SER A1036 -28.025 15.038 3.538 1.00 0.00 H ATOM 593 H SER A1036 -28.368 18.050 1.814 1.00 0.00 H ATOM 594 N LYS A1037 -31.493 18.728 3.190 1.00 20.20 N ATOM 595 CA LYS A1037 -32.698 19.437 3.636 1.00 20.91 C ATOM 596 C LYS A1037 -33.593 19.993 2.513 1.00 19.69 C ATOM 597 O LYS A1037 -34.821 19.952 2.605 1.00 19.41 O ATOM 598 CB LYS A1037 -32.355 20.519 4.642 1.00 20.67 C ATOM 599 CG LYS A1037 -31.857 19.970 5.967 1.00 22.25 C ATOM 600 CD LYS A1037 -31.501 21.074 6.937 1.00 22.70 C ATOM 601 CE LYS A1037 -32.740 21.837 7.361 1.00 25.72 C ATOM 602 NZ LYS A1037 -32.510 22.647 8.565 1.00 26.08 N ATOM 603 HZ1 LYS A1037 -32.228 22.026 9.350 1.00 0.00 H ATOM 604 HZ2 LYS A1037 -31.754 23.336 8.378 1.00 0.00 H ATOM 605 HZ3 LYS A1037 -33.385 23.150 8.816 1.00 0.00 H ATOM 606 H LYS A1037 -30.558 19.131 3.400 1.00 0.00 H ATOM 607 N ILE A1038 -32.987 20.475 1.440 1.00 19.94 N ATOM 608 CA ILE A1038 -33.767 20.872 0.272 1.00 19.26 C ATOM 609 C ILE A1038 -34.598 19.685 -0.195 1.00 18.50 C ATOM 610 O ILE A1038 -35.809 19.816 -0.423 1.00 19.21 O ATOM 611 CB ILE A1038 -32.878 21.342 -0.893 1.00 19.36 C ATOM 612 CG1 ILE A1038 -32.166 22.660 -0.534 1.00 19.95 C ATOM 613 CG2 ILE A1038 -33.722 21.506 -2.156 1.00 19.80 C ATOM 614 CD1 ILE A1038 -31.027 22.999 -1.469 1.00 21.18 C ATOM 615 H ILE A1038 -31.952 20.571 1.429 1.00 0.00 H ATOM 616 N ASP A1039 -33.941 18.552 -0.349 1.00 18.68 N ATOM 617 CA ASP A1039 -34.563 17.349 -0.878 1.00 21.23 C ATOM 618 C ASP A1039 -35.631 16.785 0.045 1.00 24.24 C ATOM 619 O ASP A1039 -36.592 16.147 -0.431 1.00 23.83 O ATOM 620 CB ASP A1039 -33.514 16.291 -1.184 1.00 22.51 C ATOM 621 CG ASP A1039 -32.609 16.667 -2.378 1.00 25.39 C ATOM 622 OD1 ASP A1039 -32.957 17.575 -3.138 1.00 27.93 O ATOM 623 OD2 ASP A1039 -31.539 16.040 -2.564 1.00 25.98 O ATOM 624 H ASP A1039 -32.937 18.518 -0.081 1.00 0.00 H ATOM 625 N LEU A1040 -35.496 17.053 1.345 1.00 22.43 N ATOM 626 CA LEU A1040 -36.515 16.681 2.338 1.00 23.22 C ATOM 627 C LEU A1040 -37.615 17.717 2.468 1.00 23.26 C ATOM 628 O LEU A1040 -38.443 17.608 3.368 1.00 24.87 O ATOM 629 CB LEU A1040 -35.851 16.455 3.714 1.00 22.84 C ATOM 630 CG LEU A1040 -34.934 15.238 3.817 1.00 23.17 C ATOM 631 CD1 LEU A1040 -34.085 15.278 5.072 1.00 25.23 C ATOM 632 CD2 LEU A1040 -35.753 13.961 3.788 1.00 25.29 C ATOM 633 H LEU A1040 -34.638 17.543 1.668 1.00 0.00 H ATOM 634 N HIS A1041 -37.647 18.726 1.589 1.00 21.67 N ATOM 635 CA HIS A1041 -38.659 19.777 1.616 1.00 22.50 C ATOM 636 C HIS A1041 -38.686 20.571 2.932 1.00 24.61 C ATOM 637 O HIS A1041 -39.731 21.066 3.372 1.00 24.96 O ATOM 638 CB HIS A1041 -40.066 19.214 1.316 1.00 23.43 C ATOM 639 CG HIS A1041 -40.170 18.465 0.029 1.00 25.47 C ATOM 640 ND1 HIS A1041 -41.385 18.166 -0.539 1.00 28.12 N ATOM 641 CD2 HIS A1041 -39.232 17.965 -0.811 1.00 26.41 C ATOM 642 CE1 HIS A1041 -41.193 17.486 -1.653 1.00 27.38 C ATOM 643 NE2 HIS A1041 -39.898 17.347 -1.841 1.00 28.48 N ATOM 644 H HIS A1041 -36.915 18.763 0.851 1.00 0.00 H ATOM 645 N LYS A1042 -37.519 20.760 3.531 1.00 23.95 N ATOM 646 CA LYS A1042 -37.409 21.504 4.761 1.00 23.66 C ATOM 647 C LYS A1042 -37.394 22.988 4.542 1.00 23.24 C ATOM 648 O LYS A1042 -37.621 23.729 5.487 1.00 24.01 O ATOM 649 CB LYS A1042 -36.153 21.103 5.534 1.00 24.30 C ATOM 650 CG LYS A1042 -36.075 19.634 5.880 1.00 29.32 C ATOM 651 CD LYS A1042 -37.128 19.241 6.876 1.00 31.54 C ATOM 652 CE LYS A1042 -36.893 17.820 7.374 1.00 34.41 C ATOM 653 NZ LYS A1042 -37.802 17.531 8.515 1.00 35.98 N ATOM 654 HZ1 LYS A1042 -37.613 18.203 9.286 1.00 0.00 H ATOM 655 HZ2 LYS A1042 -38.789 17.629 8.203 1.00 0.00 H ATOM 656 HZ3 LYS A1042 -37.637 16.561 8.851 1.00 0.00 H ATOM 657 H LYS A1042 -36.660 20.361 3.102 1.00 0.00 H ATOM 658 N TYR A1043 -37.126 23.455 3.319 1.00 22.78 N ATOM 659 CA TYR A1043 -37.128 24.881 3.054 1.00 21.69 C ATOM 660 C TYR A1043 -38.333 25.256 2.199 1.00 23.45 C ATOM 661 O TYR A1043 -38.401 24.879 1.025 1.00 25.22 O ATOM 662 CB TYR A1043 -35.882 25.303 2.305 1.00 20.20 C ATOM 663 CG TYR A1043 -34.592 24.934 2.998 1.00 20.07 C ATOM 664 CD1 TYR A1043 -34.315 25.363 4.298 1.00 20.19 C ATOM 665 CD2 TYR A1043 -33.658 24.119 2.365 1.00 18.82 C ATOM 666 CE1 TYR A1043 -33.108 25.019 4.920 1.00 21.04 C ATOM 667 CE2 TYR A1043 -32.451 23.803 2.977 1.00 19.48 C ATOM 668 CZ TYR A1043 -32.194 24.224 4.250 1.00 19.77 C ATOM 669 OH TYR A1043 -30.978 23.864 4.854 1.00 19.56 O ATOM 670 HH TYR A1043 -30.941 24.242 5.768 1.00 0.00 H ATOM 671 H TYR A1043 -36.914 22.789 2.549 1.00 0.00 H ATOM 672 N LEU A1044 -39.269 25.992 2.780 1.00 21.80 N ATOM 673 CA LEU A1044 -40.418 26.488 2.004 1.00 23.21 C ATOM 674 C LEU A1044 -40.263 27.942 1.600 1.00 22.92 C ATOM 675 O LEU A1044 -41.107 28.473 0.889 1.00 21.21 O ATOM 676 CB LEU A1044 -41.703 26.316 2.829 1.00 24.95 C ATOM 677 CG LEU A1044 -42.040 24.915 3.329 1.00 29.84 C ATOM 678 CD1 LEU A1044 -43.486 24.916 3.822 1.00 31.49 C ATOM 679 CD2 LEU A1044 -41.847 23.862 2.274 1.00 30.51 C ATOM 680 H LEU A1044 -39.192 26.221 3.792 1.00 0.00 H ATOM 681 N THR A1045 -39.189 28.599 2.046 1.00 22.08 N ATOM 682 CA THR A1045 -38.895 29.952 1.625 1.00 21.63 C ATOM 683 C THR A1045 -37.398 30.130 1.519 1.00 22.17 C ATOM 684 O THR A1045 -36.651 29.333 2.082 1.00 20.69 O ATOM 685 CB THR A1045 -39.418 30.990 2.608 1.00 22.78 C ATOM 686 OG1 THR A1045 -38.707 30.871 3.842 1.00 23.77 O ATOM 687 CG2 THR A1045 -40.912 30.762 2.900 1.00 23.21 C ATOM 688 HG1 THR A1045 -39.046 31.545 4.483 1.00 0.00 H ATOM 689 H THR A1045 -38.547 28.126 2.713 1.00 0.00 H ATOM 690 N VAL A1046 -36.978 31.162 0.808 1.00 21.57 N ATOM 691 CA VAL A1046 -35.550 31.479 0.691 1.00 21.77 C ATOM 692 C VAL A1046 -35.031 31.909 2.067 1.00 23.12 C ATOM 693 O VAL A1046 -33.877 31.665 2.427 1.00 21.38 O ATOM 694 CB VAL A1046 -35.286 32.517 -0.431 1.00 23.28 C ATOM 695 CG1 VAL A1046 -33.822 32.964 -0.438 1.00 23.29 C ATOM 696 CG2 VAL A1046 -35.663 31.917 -1.798 1.00 23.34 C ATOM 697 H VAL A1046 -37.674 31.762 0.321 1.00 0.00 H ATOM 698 N LYS A1047 -35.882 32.569 2.837 1.00 24.86 N ATOM 699 CA LYS A1047 -35.514 32.960 4.181 1.00 27.50 C ATOM 700 C LYS A1047 -35.170 31.756 5.069 1.00 26.09 C ATOM 701 O LYS A1047 -34.186 31.811 5.813 1.00 26.37 O ATOM 702 CB LYS A1047 -36.622 33.852 4.760 1.00 31.60 C ATOM 703 CG LYS A1047 -36.315 34.491 6.080 1.00 39.01 C ATOM 704 CD LYS A1047 -37.565 35.131 6.705 1.00 46.18 C ATOM 705 CE LYS A1047 -38.205 36.173 5.799 1.00 52.88 C ATOM 706 NZ LYS A1047 -37.265 37.248 5.366 1.00 59.47 N ATOM 707 HZ1 LYS A1047 -36.900 37.746 6.203 1.00 0.00 H ATOM 708 HZ2 LYS A1047 -36.473 36.824 4.841 1.00 0.00 H ATOM 709 HZ3 LYS A1047 -37.768 37.921 4.753 1.00 0.00 H ATOM 710 H LYS A1047 -36.826 32.809 2.472 1.00 0.00 H ATOM 711 N ASP A1048 -35.919 30.658 4.966 1.00 22.20 N ATOM 712 CA ASP A1048 -35.613 29.446 5.723 1.00 23.47 C ATOM 713 C ASP A1048 -34.217 28.921 5.301 1.00 22.33 C ATOM 714 O ASP A1048 -33.441 28.447 6.114 1.00 20.88 O ATOM 715 CB ASP A1048 -36.582 28.287 5.414 1.00 27.64 C ATOM 716 CG ASP A1048 -37.987 28.422 6.037 1.00 33.10 C ATOM 717 OD1 ASP A1048 -38.180 29.259 6.940 1.00 32.53 O ATOM 718 OD2 ASP A1048 -38.873 27.598 5.590 1.00 37.81 O ATOM 719 H ASP A1048 -36.742 30.664 4.331 1.00 0.00 H ATOM 720 N TYR A1049 -33.967 28.925 3.999 1.00 20.01 N ATOM 721 CA TYR A1049 -32.670 28.514 3.443 1.00 19.75 C ATOM 722 C TYR A1049 -31.519 29.366 3.951 1.00 20.08 C ATOM 723 O TYR A1049 -30.465 28.843 4.389 1.00 18.83 O ATOM 724 CB TYR A1049 -32.741 28.573 1.906 1.00 18.01 C ATOM 725 CG TYR A1049 -31.445 28.373 1.185 1.00 18.07 C ATOM 726 CD1 TYR A1049 -30.984 27.104 0.916 1.00 17.27 C ATOM 727 CD2 TYR A1049 -30.697 29.462 0.739 1.00 17.96 C ATOM 728 CE1 TYR A1049 -29.801 26.905 0.222 1.00 17.37 C ATOM 729 CE2 TYR A1049 -29.502 29.276 0.037 1.00 18.08 C ATOM 730 CZ TYR A1049 -29.056 28.011 -0.210 1.00 18.01 C ATOM 731 OH TYR A1049 -27.898 27.793 -0.938 1.00 17.14 O ATOM 732 HH TYR A1049 -27.735 26.819 -1.014 1.00 0.00 H ATOM 733 H TYR A1049 -34.717 29.230 3.346 1.00 0.00 H ATOM 734 N LEU A1050 -31.702 30.676 3.894 1.00 19.95 N ATOM 735 CA LEU A1050 -30.642 31.585 4.314 1.00 21.25 C ATOM 736 C LEU A1050 -30.339 31.474 5.805 1.00 22.56 C ATOM 737 O LEU A1050 -29.211 31.743 6.231 1.00 21.40 O ATOM 738 CB LEU A1050 -30.950 33.020 3.934 1.00 20.98 C ATOM 739 CG LEU A1050 -30.853 33.271 2.443 1.00 20.95 C ATOM 740 CD1 LEU A1050 -31.366 34.664 2.139 1.00 22.75 C ATOM 741 CD2 LEU A1050 -29.421 33.116 1.955 1.00 22.67 C ATOM 742 H LEU A1050 -32.605 31.058 3.548 1.00 0.00 H ATOM 743 N ARG A1051 -31.315 31.054 6.605 1.00 21.27 N ATOM 744 CA ARG A1051 -31.062 30.817 8.019 1.00 23.26 C ATOM 745 C ARG A1051 -29.984 29.745 8.216 1.00 22.01 C ATOM 746 O ARG A1051 -29.139 29.868 9.104 1.00 22.71 O ATOM 747 CB ARG A1051 -32.363 30.408 8.726 1.00 28.83 C ATOM 748 CG ARG A1051 -32.343 30.605 10.223 1.00 38.22 C ATOM 749 CD ARG A1051 -33.708 30.298 10.877 1.00 43.08 C ATOM 750 NE ARG A1051 -34.865 30.563 10.008 1.00 49.12 N ATOM 751 CZ ARG A1051 -35.480 31.742 9.858 1.00 55.55 C ATOM 752 NH1 ARG A1051 -35.070 32.832 10.512 1.00 61.47 N ATOM 753 NH2 ARG A1051 -36.523 31.836 9.034 1.00 52.75 N ATOM 754 HE ARG A1051 -35.239 29.762 9.461 1.00 0.00 H ATOM 755 HH12 ARG A1051 -35.566 33.736 10.378 1.00 0.00 H ATOM 756 HH11 ARG A1051 -34.255 32.776 11.156 1.00 0.00 H ATOM 757 HH22 ARG A1051 -37.008 32.748 8.911 1.00 0.00 H ATOM 758 HH21 ARG A1051 -36.852 30.998 8.514 1.00 0.00 H ATOM 759 H ARG A1051 -32.267 30.894 6.217 1.00 0.00 H ATOM 760 N ASP A1052 -29.992 28.729 7.358 1.00 20.62 N ATOM 761 CA ASP A1052 -28.989 27.657 7.430 1.00 19.66 C ATOM 762 C ASP A1052 -27.630 28.107 6.856 1.00 19.79 C ATOM 763 O ASP A1052 -26.569 27.749 7.423 1.00 19.23 O ATOM 764 CB ASP A1052 -29.503 26.366 6.796 1.00 20.72 C ATOM 765 CG ASP A1052 -30.332 25.518 7.769 1.00 22.54 C ATOM 766 OD1 ASP A1052 -30.327 25.858 8.972 1.00 23.35 O ATOM 767 OD2 ASP A1052 -30.929 24.505 7.345 1.00 22.78 O ATOM 768 H ASP A1052 -30.724 28.692 6.620 1.00 0.00 H ATOM 769 N ILE A1053 -27.643 28.874 5.768 1.00 19.29 N ATOM 770 CA ILE A1053 -26.381 29.491 5.262 1.00 19.85 C ATOM 771 C ILE A1053 -25.761 30.345 6.375 1.00 21.58 C ATOM 772 O ILE A1053 -24.555 30.243 6.684 1.00 21.47 O ATOM 773 CB ILE A1053 -26.612 30.331 3.986 1.00 20.24 C ATOM 774 CG1 ILE A1053 -27.191 29.473 2.842 1.00 20.12 C ATOM 775 CG2 ILE A1053 -25.320 31.039 3.579 1.00 20.62 C ATOM 776 CD1 ILE A1053 -26.374 28.244 2.458 1.00 20.17 C ATOM 777 H ILE A1053 -28.538 29.045 5.267 1.00 0.00 H ATOM 778 N ASP A1054 -26.587 31.204 6.984 1.00 19.92 N ATOM 779 CA ASP A1054 -26.138 32.012 8.110 1.00 21.56 C ATOM 780 C ASP A1054 -25.583 31.202 9.279 1.00 21.40 C ATOM 781 O ASP A1054 -24.619 31.649 9.916 1.00 21.88 O ATOM 782 CB ASP A1054 -27.247 32.951 8.586 1.00 23.12 C ATOM 783 CG ASP A1054 -27.385 34.185 7.710 1.00 24.71 C ATOM 784 OD1 ASP A1054 -26.376 34.775 7.278 1.00 25.72 O ATOM 785 OD2 ASP A1054 -28.525 34.638 7.504 1.00 24.85 O ATOM 786 H ASP A1054 -27.567 31.296 6.647 1.00 0.00 H ATOM 787 N LEU A1055 -26.151 30.017 9.549 1.00 19.30 N ATOM 788 CA LEU A1055 -25.694 29.144 10.611 1.00 20.90 C ATOM 789 C LEU A1055 -24.316 28.528 10.257 1.00 20.44 C ATOM 790 O LEU A1055 -23.414 28.449 11.098 1.00 19.77 O ATOM 791 CB LEU A1055 -26.725 28.047 10.818 1.00 23.32 C ATOM 792 CG LEU A1055 -26.553 27.011 11.902 1.00 26.76 C ATOM 793 CD1 LEU A1055 -26.389 27.674 13.268 1.00 26.05 C ATOM 794 CD2 LEU A1055 -27.778 26.088 11.823 1.00 27.67 C ATOM 795 H LEU A1055 -26.958 29.711 8.968 1.00 0.00 H ATOM 796 N ILE A1056 -24.121 28.172 8.994 1.00 19.74 N ATOM 797 CA ILE A1056 -22.797 27.701 8.547 1.00 19.77 C ATOM 798 C ILE A1056 -21.795 28.801 8.893 1.00 19.31 C ATOM 799 O ILE A1056 -20.718 28.537 9.485 1.00 20.50 O ATOM 800 CB ILE A1056 -22.754 27.384 7.024 1.00 19.84 C ATOM 801 CG1 ILE A1056 -23.587 26.141 6.686 1.00 19.63 C ATOM 802 CG2 ILE A1056 -21.296 27.213 6.574 1.00 20.77 C ATOM 803 CD1 ILE A1056 -23.736 25.874 5.201 1.00 19.70 C ATOM 804 H ILE A1056 -24.907 28.225 8.315 1.00 0.00 H ATOM 805 N CYS A1057 -22.112 30.028 8.525 1.00 18.49 N ATOM 806 CA CYS A1057 -21.211 31.146 8.782 1.00 21.37 C ATOM 807 C CYS A1057 -21.018 31.432 10.276 1.00 22.49 C ATOM 808 O CYS A1057 -19.873 31.504 10.765 1.00 20.13 O ATOM 809 CB CYS A1057 -21.668 32.397 8.072 1.00 21.26 C ATOM 810 SG CYS A1057 -20.601 33.828 8.261 1.00 23.67 S ATOM 811 H CYS A1057 -23.018 30.201 8.044 1.00 0.00 H ATOM 812 N SER A1058 -22.114 31.613 11.001 1.00 20.71 N ATOM 813 CA SER A1058 -21.990 31.912 12.442 1.00 22.32 C ATOM 814 C SER A1058 -21.268 30.812 13.233 1.00 21.00 C ATOM 815 O SER A1058 -20.499 31.128 14.152 1.00 22.67 O ATOM 816 CB SER A1058 -23.367 32.237 13.039 1.00 23.75 C ATOM 817 OG SER A1058 -24.210 31.098 12.994 1.00 26.50 O ATOM 818 HG SER A1058 -23.799 30.364 13.515 1.00 0.00 H ATOM 819 H SER A1058 -23.053 31.545 10.558 1.00 0.00 H ATOM 820 N ASN A1059 -21.502 29.544 12.911 1.00 19.73 N ATOM 821 CA ASN A1059 -20.827 28.436 13.546 1.00 20.48 C ATOM 822 C ASN A1059 -19.290 28.619 13.361 1.00 22.13 C ATOM 823 O ASN A1059 -18.521 28.427 14.288 1.00 20.78 O ATOM 824 CB ASN A1059 -21.220 27.082 12.932 1.00 20.85 C ATOM 825 CG ASN A1059 -22.610 26.570 13.386 1.00 22.20 C ATOM 826 OD1 ASN A1059 -23.111 25.557 12.864 1.00 24.32 O ATOM 827 ND2 ASN A1059 -23.195 27.222 14.340 1.00 20.81 N ATOM 828 HD22 ASN A1059 -22.741 28.064 14.749 1.00 0.00 H ATOM 829 HD21 ASN A1059 -24.118 26.904 14.697 1.00 0.00 H ATOM 830 H ASN A1059 -22.202 29.341 12.169 1.00 0.00 H ATOM 831 N ALA A1060 -18.872 28.960 12.139 1.00 20.63 N ATOM 832 CA ALA A1060 -17.416 29.074 11.852 1.00 20.43 C ATOM 833 C ALA A1060 -16.809 30.256 12.598 1.00 21.46 C ATOM 834 O ALA A1060 -15.673 30.163 13.096 1.00 23.94 O ATOM 835 CB ALA A1060 -17.199 29.169 10.343 1.00 21.17 C ATOM 836 H ALA A1060 -19.565 29.146 11.387 1.00 0.00 H ATOM 837 N LEU A1061 -17.537 31.363 12.698 1.00 22.35 N ATOM 838 CA LEU A1061 -17.058 32.545 13.399 1.00 24.64 C ATOM 839 C LEU A1061 -16.955 32.248 14.895 1.00 27.13 C ATOM 840 O LEU A1061 -16.011 32.676 15.538 1.00 25.65 O ATOM 841 CB LEU A1061 -17.935 33.776 13.175 1.00 25.86 C ATOM 842 CG LEU A1061 -18.255 34.224 11.736 1.00 26.95 C ATOM 843 CD1 LEU A1061 -18.985 35.542 11.673 1.00 30.41 C ATOM 844 CD2 LEU A1061 -17.013 34.297 10.876 1.00 28.14 C ATOM 845 H LEU A1061 -18.480 31.386 12.261 1.00 0.00 H ATOM 846 N GLU A1062 -17.924 31.498 15.424 1.00 25.88 N ATOM 847 CA GLU A1062 -17.972 31.142 16.860 1.00 26.57 C ATOM 848 C GLU A1062 -16.867 30.173 17.234 1.00 25.22 C ATOM 849 O GLU A1062 -16.167 30.364 18.242 1.00 25.93 O ATOM 850 CB GLU A1062 -19.335 30.507 17.227 1.00 27.53 C ATOM 851 CG GLU A1062 -19.521 30.168 18.713 1.00 29.09 C ATOM 852 CD GLU A1062 -20.849 29.455 19.018 1.00 31.40 C ATOM 853 OE1 GLU A1062 -21.835 29.697 18.308 1.00 31.97 O ATOM 854 OE2 GLU A1062 -20.901 28.627 19.952 1.00 32.51 O ATOM 855 H GLU A1062 -18.679 31.148 14.800 1.00 0.00 H ATOM 856 N TYR A1063 -16.710 29.141 16.426 1.00 24.49 N ATOM 857 CA TYR A1063 -15.765 28.095 16.697 1.00 26.12 C ATOM 858 C TYR A1063 -14.316 28.531 16.429 1.00 26.88 C ATOM 859 O TYR A1063 -13.402 27.997 17.040 1.00 26.53 O ATOM 860 CB TYR A1063 -16.064 26.842 15.913 1.00 28.26 C ATOM 861 CG TYR A1063 -15.298 25.660 16.448 1.00 32.74 C ATOM 862 CD1 TYR A1063 -15.678 25.048 17.654 1.00 33.68 C ATOM 863 CD2 TYR A1063 -14.153 25.187 15.808 1.00 35.36 C ATOM 864 CE1 TYR A1063 -14.970 23.980 18.166 1.00 35.78 C ATOM 865 CE2 TYR A1063 -13.444 24.115 16.322 1.00 37.51 C ATOM 866 CZ TYR A1063 -13.851 23.523 17.496 1.00 38.73 C ATOM 867 OH TYR A1063 -13.159 22.462 18.010 1.00 43.28 O ATOM 868 HH TYR A1063 -13.589 22.165 18.851 1.00 0.00 H ATOM 869 H TYR A1063 -17.290 29.084 15.565 1.00 0.00 H ATOM 870 N ASN A1064 -14.119 29.492 15.531 1.00 24.53 N ATOM 871 CA ASN A1064 -12.743 29.912 15.158 1.00 26.09 C ATOM 872 C ASN A1064 -12.528 31.393 15.369 1.00 23.79 C ATOM 873 O ASN A1064 -12.377 32.154 14.413 1.00 25.73 O ATOM 874 CB ASN A1064 -12.467 29.527 13.686 1.00 26.40 C ATOM 875 CG ASN A1064 -12.753 28.086 13.388 1.00 25.95 C ATOM 876 OD1 ASN A1064 -11.930 27.184 13.637 1.00 27.70 O ATOM 877 ND2 ASN A1064 -13.926 27.828 12.831 1.00 26.52 N ATOM 878 HD22 ASN A1064 -14.591 28.604 12.636 1.00 0.00 H ATOM 879 HD21 ASN A1064 -14.183 26.850 12.588 1.00 0.00 H ATOM 880 H ASN A1064 -14.937 29.955 15.085 1.00 0.00 H ATOM 881 N PRO A1065 -12.514 31.855 16.644 1.00 24.07 N ATOM 882 CA PRO A1065 -12.584 33.278 16.933 1.00 25.17 C ATOM 883 C PRO A1065 -11.249 33.988 17.102 1.00 25.74 C ATOM 884 O PRO A1065 -11.229 35.202 17.354 1.00 28.83 O ATOM 885 CB PRO A1065 -13.313 33.301 18.280 1.00 27.01 C ATOM 886 CG PRO A1065 -12.795 32.076 18.942 1.00 26.24 C ATOM 887 CD PRO A1065 -12.634 31.051 17.878 1.00 26.63 C ATOM 888 N ASP A1066 -10.176 33.231 16.948 1.00 28.00 N ATOM 889 CA ASP A1066 -8.830 33.673 17.357 1.00 27.79 C ATOM 890 C ASP A1066 -8.156 34.518 16.290 1.00 28.95 C ATOM 891 O ASP A1066 -8.650 34.625 15.153 1.00 25.03 O ATOM 892 CB ASP A1066 -7.976 32.469 17.753 1.00 30.01 C ATOM 893 CG ASP A1066 -8.500 31.760 19.015 1.00 32.66 C ATOM 894 OD1 ASP A1066 -9.338 32.337 19.723 1.00 33.61 O ATOM 895 OD2 ASP A1066 -8.077 30.620 19.293 1.00 37.71 O ATOM 896 H ASP A1066 -10.285 32.288 16.522 1.00 0.00 H ATOM 897 N ARG A1067 -7.043 35.161 16.683 1.00 27.28 N ATOM 898 CA ARG A1067 -6.285 36.092 15.850 1.00 26.81 C ATOM 899 C ARG A1067 -5.414 35.385 14.823 1.00 26.04 C ATOM 900 O ARG A1067 -4.946 35.983 13.872 1.00 25.80 O ATOM 901 CB ARG A1067 -5.345 36.889 16.744 1.00 26.84 C ATOM 902 CG ARG A1067 -4.309 36.001 17.442 1.00 25.58 C ATOM 903 CD ARG A1067 -2.920 36.601 17.374 1.00 25.59 C ATOM 904 NE ARG A1067 -2.403 36.807 16.020 1.00 25.41 N ATOM 905 CZ ARG A1067 -1.609 35.965 15.340 1.00 24.45 C ATOM 906 NH1 ARG A1067 -1.215 34.783 15.821 1.00 18.57 N ATOM 907 NH2 ARG A1067 -1.221 36.324 14.126 1.00 25.85 N ATOM 908 HE ARG A1067 -2.676 37.688 15.540 1.00 0.00 H ATOM 909 HH12 ARG A1067 -0.599 34.169 15.251 1.00 0.00 H ATOM 910 HH11 ARG A1067 -1.524 34.477 16.765 1.00 0.00 H ATOM 911 HH22 ARG A1067 -0.606 35.697 13.570 1.00 0.00 H ATOM 912 HH21 ARG A1067 -1.532 37.233 13.728 1.00 0.00 H ATOM 913 H ARG A1067 -6.697 34.983 17.648 1.00 0.00 H ATOM 914 N ASP A1068 -5.186 34.110 15.044 1.00 25.03 N ATOM 915 CA ASP A1068 -4.211 33.399 14.260 1.00 28.97 C ATOM 916 C ASP A1068 -4.675 33.227 12.812 1.00 26.81 C ATOM 917 O ASP A1068 -5.888 33.292 12.530 1.00 23.07 O ATOM 918 CB ASP A1068 -3.851 32.064 14.867 1.00 31.66 C ATOM 919 CG ASP A1068 -4.980 31.105 14.866 1.00 34.71 C ATOM 920 OD1 ASP A1068 -5.184 30.423 13.842 1.00 39.21 O ATOM 921 OD2 ASP A1068 -5.674 31.025 15.902 1.00 47.96 O ATOM 922 H ASP A1068 -5.713 33.612 15.790 1.00 0.00 H ATOM 923 N PRO A1069 -3.713 33.049 11.898 1.00 24.44 N ATOM 924 CA PRO A1069 -4.091 33.004 10.485 1.00 22.71 C ATOM 925 C PRO A1069 -5.084 31.902 10.091 1.00 21.79 C ATOM 926 O PRO A1069 -5.909 32.128 9.182 1.00 21.30 O ATOM 927 CB PRO A1069 -2.757 32.772 9.764 1.00 24.24 C ATOM 928 CG PRO A1069 -1.716 33.279 10.697 1.00 25.14 C ATOM 929 CD PRO A1069 -2.239 33.057 12.082 1.00 25.09 C ATOM 930 N GLY A1070 -4.982 30.729 10.711 1.00 20.83 N ATOM 931 CA GLY A1070 -5.896 29.651 10.411 1.00 22.32 C ATOM 932 C GLY A1070 -7.338 30.051 10.714 1.00 23.61 C ATOM 933 O GLY A1070 -8.241 29.822 9.884 1.00 24.53 O ATOM 934 H GLY A1070 -4.235 30.586 11.420 1.00 0.00 H ATOM 935 N ASP A1071 -7.561 30.621 11.901 1.00 23.21 N ATOM 936 CA ASP A1071 -8.907 31.107 12.275 1.00 25.09 C ATOM 937 C ASP A1071 -9.334 32.265 11.388 1.00 24.19 C ATOM 938 O ASP A1071 -10.490 32.345 10.977 1.00 22.10 O ATOM 939 CB ASP A1071 -8.989 31.549 13.737 1.00 24.15 C ATOM 940 CG ASP A1071 -9.040 30.388 14.712 1.00 27.15 C ATOM 941 OD1 ASP A1071 -8.639 29.254 14.355 1.00 27.71 O ATOM 942 OD2 ASP A1071 -9.559 30.615 15.824 1.00 28.81 O ATOM 943 H ASP A1071 -6.775 30.725 12.574 1.00 0.00 H ATOM 944 N ARG A1072 -8.420 33.170 11.083 1.00 20.92 N ATOM 945 CA ARG A1072 -8.802 34.325 10.296 1.00 21.41 C ATOM 946 C ARG A1072 -9.190 33.923 8.859 1.00 20.94 C ATOM 947 O ARG A1072 -10.086 34.531 8.279 1.00 20.05 O ATOM 948 CB ARG A1072 -7.721 35.399 10.330 1.00 22.37 C ATOM 949 CG ARG A1072 -7.747 36.172 11.640 1.00 23.52 C ATOM 950 CD ARG A1072 -6.734 37.285 11.680 1.00 26.71 C ATOM 951 NE ARG A1072 -6.918 38.171 12.832 1.00 25.80 N ATOM 952 CZ ARG A1072 -5.949 38.873 13.416 1.00 28.61 C ATOM 953 NH1 ARG A1072 -4.689 38.778 13.007 1.00 29.36 N ATOM 954 NH2 ARG A1072 -6.234 39.657 14.445 1.00 29.85 N ATOM 955 HE ARG A1072 -7.878 38.258 13.223 1.00 0.00 H ATOM 956 HH12 ARG A1072 -3.947 39.335 13.476 1.00 0.00 H ATOM 957 HH11 ARG A1072 -4.445 38.147 12.217 1.00 0.00 H ATOM 958 HH22 ARG A1072 -5.480 40.207 14.904 1.00 0.00 H ATOM 959 HH21 ARG A1072 -7.212 39.722 14.794 1.00 0.00 H ATOM 960 H ARG A1072 -7.438 33.054 11.404 1.00 0.00 H ATOM 961 N LEU A1073 -8.508 32.921 8.315 1.00 20.24 N ATOM 962 CA LEU A1073 -8.792 32.432 6.972 1.00 19.82 C ATOM 963 C LEU A1073 -10.194 31.802 6.932 1.00 22.13 C ATOM 964 O LEU A1073 -11.019 32.149 6.070 1.00 19.73 O ATOM 965 CB LEU A1073 -7.780 31.426 6.527 1.00 19.90 C ATOM 966 CG LEU A1073 -7.956 30.786 5.155 1.00 20.38 C ATOM 967 CD1 LEU A1073 -8.003 31.852 4.077 1.00 20.53 C ATOM 968 CD2 LEU A1073 -6.857 29.752 4.896 1.00 23.09 C ATOM 969 H LEU A1073 -7.748 32.472 8.865 1.00 0.00 H ATOM 970 N ILE A1074 -10.453 30.885 7.854 1.00 21.10 N ATOM 971 CA ILE A1074 -11.791 30.287 7.913 1.00 23.41 C ATOM 972 C ILE A1074 -12.882 31.336 8.122 1.00 21.76 C ATOM 973 O ILE A1074 -13.952 31.239 7.471 1.00 21.43 O ATOM 974 CB ILE A1074 -11.894 29.098 8.907 1.00 25.67 C ATOM 975 CG1 ILE A1074 -13.239 28.375 8.725 1.00 28.92 C ATOM 976 CG2 ILE A1074 -11.787 29.549 10.318 1.00 29.10 C ATOM 977 CD1 ILE A1074 -13.174 26.887 9.044 1.00 30.92 C ATOM 978 H ILE A1074 -9.716 30.593 8.527 1.00 0.00 H ATOM 979 N ARG A1075 -12.668 32.342 8.976 1.00 20.69 N ATOM 980 CA ARG A1075 -13.714 33.391 9.151 1.00 21.45 C ATOM 981 C ARG A1075 -13.928 34.175 7.876 1.00 23.15 C ATOM 982 O ARG A1075 -15.059 34.495 7.501 1.00 20.17 O ATOM 983 CB ARG A1075 -13.428 34.339 10.297 1.00 22.48 C ATOM 984 CG ARG A1075 -13.415 33.633 11.651 1.00 22.13 C ATOM 985 CD ARG A1075 -13.699 34.619 12.769 1.00 23.50 C ATOM 986 NE ARG A1075 -12.751 35.708 12.880 1.00 26.12 N ATOM 987 CZ ARG A1075 -11.532 35.623 13.421 1.00 25.66 C ATOM 988 NH1 ARG A1075 -11.073 34.495 13.901 1.00 27.31 N ATOM 989 NH2 ARG A1075 -10.770 36.701 13.466 1.00 29.50 N ATOM 990 HE ARG A1075 -13.043 36.634 12.507 1.00 0.00 H ATOM 991 HH12 ARG A1075 -10.121 34.456 14.317 1.00 0.00 H ATOM 992 HH11 ARG A1075 -11.661 33.638 13.867 1.00 0.00 H ATOM 993 HH22 ARG A1075 -9.819 36.649 13.884 1.00 0.00 H ATOM 994 HH21 ARG A1075 -11.121 37.602 13.083 1.00 0.00 H ATOM 995 H ARG A1075 -11.779 32.393 9.514 1.00 0.00 H ATOM 996 N HIS A1076 -12.834 34.515 7.201 1.00 20.54 N ATOM 997 CA HIS A1076 -12.980 35.241 5.939 1.00 20.12 C ATOM 998 C HIS A1076 -13.777 34.433 4.904 1.00 18.03 C ATOM 999 O HIS A1076 -14.646 35.001 4.200 1.00 20.12 O ATOM 1000 CB HIS A1076 -11.599 35.610 5.403 1.00 19.84 C ATOM 1001 CG HIS A1076 -11.632 36.564 4.267 1.00 19.20 C ATOM 1002 ND1 HIS A1076 -11.637 36.146 2.958 1.00 21.43 N ATOM 1003 CD2 HIS A1076 -11.667 37.917 4.236 1.00 20.90 C ATOM 1004 CE1 HIS A1076 -11.688 37.203 2.163 1.00 21.53 C ATOM 1005 NE2 HIS A1076 -11.703 38.290 2.917 1.00 20.91 N ATOM 1006 H HIS A1076 -11.891 34.269 7.564 1.00 0.00 H ATOM 1007 N ARG A1077 -13.501 33.142 4.823 1.00 17.24 N ATOM 1008 CA ARG A1077 -14.181 32.247 3.888 1.00 17.69 C ATOM 1009 C ARG A1077 -15.663 32.103 4.285 1.00 18.48 C ATOM 1010 O ARG A1077 -16.538 32.085 3.418 1.00 18.25 O ATOM 1011 CB ARG A1077 -13.517 30.895 3.875 1.00 18.92 C ATOM 1012 CG ARG A1077 -12.152 30.932 3.198 1.00 18.91 C ATOM 1013 CD ARG A1077 -11.426 29.644 3.381 1.00 19.56 C ATOM 1014 NE ARG A1077 -10.302 29.547 2.458 1.00 21.02 N ATOM 1015 CZ ARG A1077 -9.408 28.573 2.461 1.00 21.13 C ATOM 1016 NH1 ARG A1077 -9.463 27.612 3.360 1.00 23.04 N ATOM 1017 NH2 ARG A1077 -8.454 28.566 1.559 1.00 23.28 N ATOM 1018 HE ARG A1077 -10.196 30.298 1.746 1.00 0.00 H ATOM 1019 HH12 ARG A1077 -8.754 26.851 3.352 1.00 0.00 H ATOM 1020 HH11 ARG A1077 -10.216 27.614 4.078 1.00 0.00 H ATOM 1021 HH22 ARG A1077 -7.747 27.803 1.555 1.00 0.00 H ATOM 1022 HH21 ARG A1077 -8.405 29.324 0.848 1.00 0.00 H ATOM 1023 H ARG A1077 -12.771 32.748 5.450 1.00 0.00 H ATOM 1024 N ALA A1078 -15.911 32.037 5.583 1.00 18.65 N ATOM 1025 CA ALA A1078 -17.288 31.918 6.112 1.00 18.87 C ATOM 1026 C ALA A1078 -18.089 33.146 5.751 1.00 19.80 C ATOM 1027 O ALA A1078 -19.231 33.000 5.288 1.00 20.92 O ATOM 1028 CB ALA A1078 -17.270 31.700 7.627 1.00 19.83 C ATOM 1029 H ALA A1078 -15.115 32.070 6.251 1.00 0.00 H ATOM 1030 N CYS A1079 -17.518 34.340 5.928 1.00 19.19 N ATOM 1031 CA CYS A1079 -18.157 35.595 5.561 1.00 20.89 C ATOM 1032 C CYS A1079 -18.370 35.663 4.059 1.00 21.08 C ATOM 1033 O CYS A1079 -19.394 36.155 3.603 1.00 19.19 O ATOM 1034 CB CYS A1079 -17.350 36.798 6.025 1.00 22.15 C ATOM 1035 SG CYS A1079 -17.414 36.994 7.832 1.00 26.64 S ATOM 1036 H CYS A1079 -16.568 34.375 6.350 1.00 0.00 H ATOM 1037 N ALA A1080 -17.418 35.148 3.305 1.00 17.80 N ATOM 1038 CA ALA A1080 -17.547 35.116 1.828 1.00 19.10 C ATOM 1039 C ALA A1080 -18.661 34.177 1.391 1.00 18.84 C ATOM 1040 O ALA A1080 -19.366 34.463 0.429 1.00 19.20 O ATOM 1041 CB ALA A1080 -16.222 34.756 1.150 1.00 19.07 C ATOM 1042 H ALA A1080 -16.564 34.759 3.753 1.00 0.00 H ATOM 1043 N LEU A1081 -18.818 33.063 2.086 1.00 19.28 N ATOM 1044 CA LEU A1081 -19.878 32.109 1.741 1.00 19.36 C ATOM 1045 C LEU A1081 -21.229 32.808 1.918 1.00 19.57 C ATOM 1046 O LEU A1081 -22.123 32.770 1.020 1.00 17.75 O ATOM 1047 CB LEU A1081 -19.791 30.867 2.619 1.00 20.18 C ATOM 1048 CG LEU A1081 -20.973 29.885 2.483 1.00 23.03 C ATOM 1049 CD1 LEU A1081 -20.912 29.209 1.145 1.00 24.86 C ATOM 1050 CD2 LEU A1081 -20.990 28.861 3.594 1.00 25.53 C ATOM 1051 H LEU A1081 -18.184 32.861 2.885 1.00 0.00 H ATOM 1052 N ARG A1082 -21.383 33.416 3.084 1.00 19.03 N ATOM 1053 CA ARG A1082 -22.629 34.137 3.432 1.00 20.97 C ATOM 1054 C ARG A1082 -22.898 35.265 2.450 1.00 20.93 C ATOM 1055 O ARG A1082 -24.006 35.368 1.888 1.00 19.29 O ATOM 1056 CB ARG A1082 -22.509 34.683 4.845 1.00 22.43 C ATOM 1057 CG ARG A1082 -23.647 35.572 5.356 1.00 25.60 C ATOM 1058 CD ARG A1082 -23.169 36.436 6.540 1.00 27.51 C ATOM 1059 NE ARG A1082 -22.135 37.398 6.084 1.00 28.31 N ATOM 1060 CZ ARG A1082 -21.178 37.950 6.838 1.00 31.12 C ATOM 1061 NH1 ARG A1082 -20.324 38.800 6.275 1.00 30.00 N ATOM 1062 NH2 ARG A1082 -21.072 37.688 8.149 1.00 31.50 N ATOM 1063 HE ARG A1082 -22.157 37.669 5.080 1.00 0.00 H ATOM 1064 HH12 ARG A1082 -19.574 39.238 6.846 1.00 0.00 H ATOM 1065 HH11 ARG A1082 -20.406 39.026 5.263 1.00 0.00 H ATOM 1066 HH22 ARG A1082 -20.317 38.133 8.709 1.00 0.00 H ATOM 1067 HH21 ARG A1082 -21.745 37.040 8.606 1.00 0.00 H ATOM 1068 H ARG A1082 -20.607 33.386 3.775 1.00 0.00 H ATOM 1069 N ASP A1083 -21.884 36.101 2.201 1.00 19.44 N ATOM 1070 CA ASP A1083 -22.055 37.222 1.292 1.00 20.02 C ATOM 1071 C ASP A1083 -22.330 36.794 -0.144 1.00 18.90 C ATOM 1072 O ASP A1083 -23.200 37.406 -0.801 1.00 18.54 O ATOM 1073 CB ASP A1083 -20.859 38.165 1.317 1.00 21.95 C ATOM 1074 CG ASP A1083 -20.677 38.873 2.670 1.00 26.26 C ATOM 1075 OD1 ASP A1083 -21.585 38.866 3.535 1.00 25.90 O ATOM 1076 OD2 ASP A1083 -19.567 39.427 2.841 1.00 26.89 O ATOM 1077 H ASP A1083 -20.965 35.947 2.662 1.00 0.00 H ATOM 1078 N THR A1084 -21.672 35.719 -0.596 1.00 17.05 N ATOM 1079 CA THR A1084 -21.892 35.217 -1.929 1.00 17.89 C ATOM 1080 C THR A1084 -23.321 34.694 -2.110 1.00 17.02 C ATOM 1081 O THR A1084 -23.962 34.981 -3.135 1.00 17.11 O ATOM 1082 CB THR A1084 -20.876 34.143 -2.310 1.00 17.71 C ATOM 1083 OG1 THR A1084 -19.562 34.744 -2.295 1.00 18.75 O ATOM 1084 CG2 THR A1084 -21.146 33.634 -3.714 1.00 19.51 C ATOM 1085 HG1 THR A1084 -19.369 35.091 -1.388 1.00 0.00 H ATOM 1086 H THR A1084 -20.991 35.238 0.025 1.00 0.00 H ATOM 1087 N ALA A1085 -23.798 33.938 -1.131 1.00 16.06 N ATOM 1088 CA ALA A1085 -25.183 33.418 -1.166 1.00 17.28 C ATOM 1089 C ALA A1085 -26.203 34.551 -1.209 1.00 18.32 C ATOM 1090 O ALA A1085 -27.094 34.568 -2.079 1.00 17.23 O ATOM 1091 CB ALA A1085 -25.442 32.531 0.024 1.00 17.32 C ATOM 1092 H ALA A1085 -23.187 33.706 -0.322 1.00 0.00 H ATOM 1093 N TYR A1086 -26.031 35.523 -0.328 1.00 18.28 N ATOM 1094 CA TYR A1086 -26.918 36.690 -0.336 1.00 19.41 C ATOM 1095 C TYR A1086 -26.882 37.469 -1.644 1.00 19.48 C ATOM 1096 O TYR A1086 -27.932 37.925 -2.107 1.00 20.53 O ATOM 1097 CB TYR A1086 -26.644 37.583 0.867 1.00 20.28 C ATOM 1098 CG TYR A1086 -27.377 37.185 2.141 1.00 20.47 C ATOM 1099 CD1 TYR A1086 -26.844 36.250 3.038 1.00 20.78 C ATOM 1100 CD2 TYR A1086 -28.611 37.767 2.474 1.00 23.16 C ATOM 1101 CE1 TYR A1086 -27.493 35.907 4.208 1.00 19.81 C ATOM 1102 CE2 TYR A1086 -29.253 37.435 3.651 1.00 23.19 C ATOM 1103 CZ TYR A1086 -28.708 36.500 4.513 1.00 22.57 C ATOM 1104 OH TYR A1086 -29.383 36.188 5.681 1.00 23.13 O ATOM 1105 HH TYR A1086 -28.869 35.509 6.186 1.00 0.00 H ATOM 1106 H TYR A1086 -25.265 35.459 0.372 1.00 0.00 H ATOM 1107 N ALA A1087 -25.701 37.624 -2.242 1.00 18.01 N ATOM 1108 CA ALA A1087 -25.552 38.365 -3.492 1.00 19.61 C ATOM 1109 C ALA A1087 -26.186 37.610 -4.675 1.00 19.35 C ATOM 1110 O ALA A1087 -26.841 38.246 -5.524 1.00 18.87 O ATOM 1111 CB ALA A1087 -24.091 38.672 -3.756 1.00 21.13 C ATOM 1112 H ALA A1087 -24.857 37.203 -1.804 1.00 0.00 H ATOM 1113 N ILE A1088 -26.052 36.273 -4.706 1.00 19.02 N ATOM 1114 CA ILE A1088 -26.707 35.478 -5.751 1.00 18.76 C ATOM 1115 C ILE A1088 -28.222 35.664 -5.642 1.00 18.97 C ATOM 1116 O ILE A1088 -28.898 35.931 -6.641 1.00 19.15 O ATOM 1117 CB ILE A1088 -26.318 33.967 -5.685 1.00 18.73 C ATOM 1118 CG1 ILE A1088 -24.871 33.792 -6.122 1.00 19.51 C ATOM 1119 CG2 ILE A1088 -27.215 33.134 -6.572 1.00 19.23 C ATOM 1120 CD1 ILE A1088 -24.295 32.430 -5.910 1.00 19.32 C ATOM 1121 H ILE A1088 -25.478 35.797 -3.981 1.00 0.00 H ATOM 1122 N ILE A1089 -28.737 35.534 -4.436 1.00 19.27 N ATOM 1123 CA ILE A1089 -30.178 35.669 -4.194 1.00 19.87 C ATOM 1124 C ILE A1089 -30.649 37.077 -4.560 1.00 21.20 C ATOM 1125 O ILE A1089 -31.683 37.257 -5.202 1.00 21.06 O ATOM 1126 CB ILE A1089 -30.545 35.259 -2.741 1.00 19.30 C ATOM 1127 CG1 ILE A1089 -30.785 33.749 -2.733 1.00 19.54 C ATOM 1128 CG2 ILE A1089 -31.763 36.024 -2.204 1.00 19.59 C ATOM 1129 CD1 ILE A1089 -30.399 33.018 -1.458 1.00 19.42 C ATOM 1130 H ILE A1089 -28.106 35.330 -3.635 1.00 0.00 H ATOM 1131 N LYS A1090 -29.895 38.084 -4.157 1.00 21.84 N ATOM 1132 CA LYS A1090 -30.284 39.461 -4.494 1.00 24.58 C ATOM 1133 C LYS A1090 -30.417 39.658 -6.021 1.00 24.22 C ATOM 1134 O LYS A1090 -31.380 40.301 -6.495 1.00 25.85 O ATOM 1135 CB LYS A1090 -29.278 40.451 -3.915 1.00 26.95 C ATOM 1136 CG LYS A1090 -29.641 41.918 -4.177 1.00 32.83 C ATOM 1137 CD LYS A1090 -28.764 42.851 -3.364 1.00 39.20 C ATOM 1138 CE LYS A1090 -29.323 44.271 -3.338 1.00 45.97 C ATOM 1139 NZ LYS A1090 -28.926 44.975 -4.584 1.00 50.86 N ATOM 1140 HZ1 LYS A1090 -27.888 45.009 -4.646 1.00 0.00 H ATOM 1141 HZ2 LYS A1090 -29.307 44.464 -5.406 1.00 0.00 H ATOM 1142 HZ3 LYS A1090 -29.305 45.943 -4.570 1.00 0.00 H ATOM 1143 H LYS A1090 -29.032 37.904 -3.605 1.00 0.00 H ATOM 1144 N GLU A1091 -29.467 39.118 -6.775 1.00 23.18 N ATOM 1145 CA GLU A1091 -29.432 39.264 -8.232 1.00 23.58 C ATOM 1146 C GLU A1091 -30.434 38.380 -8.947 1.00 23.12 C ATOM 1147 O GLU A1091 -30.925 38.778 -9.997 1.00 24.10 O ATOM 1148 CB GLU A1091 -28.054 38.940 -8.839 1.00 29.02 C ATOM 1149 CG GLU A1091 -27.038 40.078 -8.842 1.00 38.32 C ATOM 1150 CD GLU A1091 -26.081 40.041 -10.054 1.00 45.99 C ATOM 1151 OE1 GLU A1091 -25.597 38.938 -10.447 1.00 47.34 O ATOM 1152 OE2 GLU A1091 -25.802 41.129 -10.620 1.00 51.47 O ATOM 1153 H GLU A1091 -28.716 38.568 -6.311 1.00 0.00 H ATOM 1154 N GLU A1092 -30.731 37.195 -8.414 1.00 19.49 N ATOM 1155 CA GLU A1092 -31.406 36.165 -9.214 1.00 19.01 C ATOM 1156 C GLU A1092 -32.783 35.711 -8.710 1.00 19.03 C ATOM 1157 O GLU A1092 -33.492 35.030 -9.434 1.00 22.13 O ATOM 1158 CB GLU A1092 -30.521 34.918 -9.342 1.00 19.01 C ATOM 1159 CG GLU A1092 -29.165 35.223 -9.970 1.00 19.65 C ATOM 1160 CD GLU A1092 -28.226 34.053 -10.045 1.00 21.00 C ATOM 1161 OE1 GLU A1092 -28.663 32.900 -10.069 1.00 20.66 O ATOM 1162 OE2 GLU A1092 -27.008 34.297 -10.091 1.00 20.47 O ATOM 1163 H GLU A1092 -30.483 36.998 -7.423 1.00 0.00 H ATOM 1164 N LEU A1093 -33.131 36.051 -7.484 1.00 19.70 N ATOM 1165 CA LEU A1093 -34.450 35.729 -6.936 1.00 21.50 C ATOM 1166 C LEU A1093 -35.404 36.906 -7.109 1.00 22.88 C ATOM 1167 O LEU A1093 -35.132 38.002 -6.638 1.00 24.05 O ATOM 1168 CB LEU A1093 -34.356 35.399 -5.448 1.00 23.07 C ATOM 1169 CG LEU A1093 -35.692 35.195 -4.712 1.00 25.89 C ATOM 1170 CD1 LEU A1093 -36.237 33.873 -5.128 1.00 25.40 C ATOM 1171 CD2 LEU A1093 -35.454 35.248 -3.221 1.00 29.06 C ATOM 1172 H LEU A1093 -32.448 36.563 -6.889 1.00 0.00 H ATOM 1173 N ASP A1094 -36.534 36.668 -7.776 1.00 22.34 N ATOM 1174 CA ASP A1094 -37.567 37.692 -7.902 1.00 23.29 C ATOM 1175 C ASP A1094 -38.244 37.789 -6.580 1.00 20.83 C ATOM 1176 O ASP A1094 -38.712 36.771 -6.049 1.00 20.72 O ATOM 1177 CB ASP A1094 -38.559 37.255 -8.964 1.00 24.28 C ATOM 1178 CG ASP A1094 -39.508 38.343 -9.371 1.00 27.82 C ATOM 1179 OD1 ASP A1094 -40.168 38.950 -8.505 1.00 27.40 O ATOM 1180 OD2 ASP A1094 -39.618 38.550 -10.602 1.00 28.33 O ATOM 1181 H ASP A1094 -36.682 35.736 -8.214 1.00 0.00 H ATOM 1182 N GLU A1095 -38.328 39.000 -6.043 1.00 20.75 N ATOM 1183 CA GLU A1095 -38.959 39.217 -4.741 1.00 23.42 C ATOM 1184 C GLU A1095 -40.422 38.765 -4.703 1.00 21.19 C ATOM 1185 O GLU A1095 -40.912 38.369 -3.655 1.00 20.26 O ATOM 1186 CB GLU A1095 -38.863 40.684 -4.316 1.00 26.75 C ATOM 1187 CG GLU A1095 -39.631 41.677 -5.149 1.00 28.59 C ATOM 1188 CD GLU A1095 -39.604 43.072 -4.552 1.00 32.76 C ATOM 1189 OE1 GLU A1095 -38.743 43.359 -3.683 1.00 34.47 O ATOM 1190 OE2 GLU A1095 -40.457 43.878 -4.955 1.00 35.51 O ATOM 1191 H GLU A1095 -37.936 39.813 -6.560 1.00 0.00 H ATOM 1192 N ASP A1096 -41.095 38.782 -5.847 1.00 21.44 N ATOM 1193 CA ASP A1096 -42.491 38.288 -5.886 1.00 21.64 C ATOM 1194 C ASP A1096 -42.578 36.781 -5.778 1.00 19.66 C ATOM 1195 O ASP A1096 -43.591 36.241 -5.314 1.00 19.09 O ATOM 1196 CB ASP A1096 -43.205 38.779 -7.152 1.00 23.84 C ATOM 1197 CG ASP A1096 -43.493 40.282 -7.119 1.00 25.45 C ATOM 1198 OD1 ASP A1096 -43.521 40.876 -6.048 1.00 27.60 O ATOM 1199 OD2 ASP A1096 -43.652 40.848 -8.194 1.00 30.83 O ATOM 1200 H ASP A1096 -40.644 39.141 -6.713 1.00 0.00 H ATOM 1201 N PHE A1097 -41.525 36.080 -6.203 1.00 19.14 N ATOM 1202 CA PHE A1097 -41.458 34.639 -6.065 1.00 19.36 C ATOM 1203 C PHE A1097 -41.265 34.295 -4.585 1.00 20.62 C ATOM 1204 O PHE A1097 -41.999 33.423 -4.054 1.00 20.33 O ATOM 1205 CB PHE A1097 -40.358 34.010 -6.952 1.00 19.38 C ATOM 1206 CG PHE A1097 -40.283 32.506 -6.838 1.00 19.08 C ATOM 1207 CD1 PHE A1097 -41.102 31.695 -7.622 1.00 20.19 C ATOM 1208 CD2 PHE A1097 -39.505 31.913 -5.864 1.00 19.57 C ATOM 1209 CE1 PHE A1097 -41.092 30.323 -7.487 1.00 19.79 C ATOM 1210 CE2 PHE A1097 -39.464 30.535 -5.739 1.00 19.61 C ATOM 1211 CZ PHE A1097 -40.268 29.740 -6.544 1.00 19.51 C ATOM 1212 H PHE A1097 -40.729 36.582 -6.646 1.00 0.00 H ATOM 1213 N GLU A1098 -40.318 34.965 -3.923 1.00 19.57 N ATOM 1214 CA GLU A1098 -40.142 34.769 -2.483 1.00 21.51 C ATOM 1215 C GLU A1098 -41.448 35.099 -1.730 1.00 21.76 C ATOM 1216 O GLU A1098 -41.853 34.367 -0.836 1.00 21.50 O ATOM 1217 CB GLU A1098 -38.982 35.608 -1.952 1.00 22.68 C ATOM 1218 CG GLU A1098 -38.779 35.556 -0.432 1.00 23.99 C ATOM 1219 CD GLU A1098 -38.526 34.171 0.188 1.00 27.80 C ATOM 1220 OE1 GLU A1098 -38.469 33.143 -0.549 1.00 30.06 O ATOM 1221 OE2 GLU A1098 -38.333 34.091 1.469 1.00 30.34 O ATOM 1222 H GLU A1098 -39.702 35.630 -4.433 1.00 0.00 H ATOM 1223 N GLN A1099 -42.110 36.192 -2.119 1.00 19.99 N ATOM 1224 CA GLN A1099 -43.326 36.610 -1.432 1.00 22.32 C ATOM 1225 C GLN A1099 -44.399 35.533 -1.571 1.00 20.96 C ATOM 1226 O GLN A1099 -45.069 35.188 -0.595 1.00 23.09 O ATOM 1227 CB GLN A1099 -43.805 37.955 -1.964 1.00 23.01 C ATOM 1228 CG GLN A1099 -44.981 38.553 -1.188 1.00 25.47 C ATOM 1229 CD GLN A1099 -44.689 38.741 0.268 1.00 27.84 C ATOM 1230 OE1 GLN A1099 -43.581 39.149 0.640 1.00 32.01 O ATOM 1231 NE2 GLN A1099 -45.660 38.446 1.110 1.00 27.96 N ATOM 1232 HE22 GLN A1099 -46.575 38.106 0.750 1.00 0.00 H ATOM 1233 HE21 GLN A1099 -45.511 38.553 2.134 1.00 0.00 H ATOM 1234 H GLN A1099 -41.754 36.751 -2.921 1.00 0.00 H ATOM 1235 N LEU A1100 -44.575 34.993 -2.778 1.00 19.68 N ATOM 1236 CA LEU A1100 -45.506 33.884 -2.978 1.00 19.56 C ATOM 1237 C LEU A1100 -45.208 32.684 -2.059 1.00 20.81 C ATOM 1238 O LEU A1100 -46.122 32.105 -1.438 1.00 19.51 O ATOM 1239 CB LEU A1100 -45.542 33.456 -4.461 1.00 19.70 C ATOM 1240 CG LEU A1100 -46.377 32.237 -4.829 1.00 20.94 C ATOM 1241 CD1 LEU A1100 -47.834 32.465 -4.417 1.00 22.71 C ATOM 1242 CD2 LEU A1100 -46.252 31.951 -6.312 1.00 21.87 C ATOM 1243 H LEU A1100 -44.042 35.367 -3.589 1.00 0.00 H ATOM 1244 N CYS A1101 -43.936 32.279 -1.971 1.00 19.68 N ATOM 1245 CA CYS A1101 -43.556 31.161 -1.091 1.00 20.16 C ATOM 1246 C CYS A1101 -43.954 31.446 0.359 1.00 20.36 C ATOM 1247 O CYS A1101 -44.520 30.573 1.027 1.00 22.84 O ATOM 1248 CB CYS A1101 -42.025 30.880 -1.203 1.00 18.24 C ATOM 1249 SG CYS A1101 -41.508 30.202 -2.774 1.00 20.18 S ATOM 1250 H CYS A1101 -43.205 32.761 -2.532 1.00 0.00 H ATOM 1251 N GLU A1102 -43.710 32.670 0.806 1.00 21.72 N ATOM 1252 CA GLU A1102 -44.004 33.094 2.172 1.00 26.40 C ATOM 1253 C GLU A1102 -45.511 32.980 2.420 1.00 27.11 C ATOM 1254 O GLU A1102 -45.977 32.453 3.448 1.00 26.87 O ATOM 1255 CB GLU A1102 -43.557 34.533 2.416 1.00 29.68 C ATOM 1256 CG GLU A1102 -42.095 34.723 2.800 1.00 39.19 C ATOM 1257 CD GLU A1102 -41.814 34.401 4.274 1.00 47.27 C ATOM 1258 OE1 GLU A1102 -42.763 34.031 5.028 1.00 54.43 O ATOM 1259 OE2 GLU A1102 -40.636 34.522 4.689 1.00 52.47 O ATOM 1260 H GLU A1102 -43.289 33.361 0.153 1.00 0.00 H ATOM 1261 N GLU A1103 -46.279 33.439 1.442 1.00 26.32 N ATOM 1262 CA GLU A1103 -47.753 33.399 1.577 1.00 26.01 C ATOM 1263 C GLU A1103 -48.336 31.988 1.554 1.00 26.66 C ATOM 1264 O GLU A1103 -49.254 31.710 2.325 1.00 32.12 O ATOM 1265 CB GLU A1103 -48.427 34.405 0.610 1.00 24.85 C ATOM 1266 CG GLU A1103 -48.128 35.840 1.021 1.00 25.10 C ATOM 1267 CD GLU A1103 -48.718 36.944 0.137 1.00 23.13 C ATOM 1268 OE1 GLU A1103 -49.537 36.672 -0.757 1.00 22.57 O ATOM 1269 OE2 GLU A1103 -48.327 38.117 0.315 1.00 24.61 O ATOM 1270 H GLU A1103 -45.846 33.827 0.580 1.00 0.00 H ATOM 1271 N ILE A1104 -47.797 31.079 0.747 1.00 25.55 N ATOM 1272 CA ILE A1104 -48.204 29.705 0.782 1.00 28.12 C ATOM 1273 C ILE A1104 -47.822 29.123 2.151 1.00 32.15 C ATOM 1274 O ILE A1104 -48.650 28.533 2.817 1.00 35.54 O ATOM 1275 CB ILE A1104 -47.579 28.873 -0.342 1.00 25.29 C ATOM 1276 CG1 ILE A1104 -47.900 29.472 -1.727 1.00 24.70 C ATOM 1277 CG2 ILE A1104 -48.059 27.419 -0.246 1.00 26.72 C ATOM 1278 CD1 ILE A1104 -47.102 28.888 -2.870 1.00 25.54 C ATOM 1279 H ILE A1104 -47.061 31.372 0.073 1.00 0.00 H ATOM 1280 N GLN A1105 -46.570 29.312 2.574 1.00 34.30 N ATOM 1281 CA GLN A1105 -46.081 28.772 3.870 1.00 35.16 C ATOM 1282 C GLN A1105 -47.000 29.243 5.010 1.00 35.36 C ATOM 1283 O GLN A1105 -47.484 28.432 5.809 1.00 35.42 O ATOM 1284 CB GLN A1105 -44.633 29.224 4.143 1.00 34.32 C ATOM 1285 CG GLN A1105 -44.032 28.732 5.467 1.00 38.29 C ATOM 1286 CD GLN A1105 -42.711 29.412 5.811 1.00 43.36 C ATOM 1287 OE1 GLN A1105 -42.617 30.639 5.818 1.00 51.47 O ATOM 1288 NE2 GLN A1105 -41.683 28.616 6.107 1.00 43.81 N ATOM 1289 HE22 GLN A1105 -41.803 27.583 6.090 1.00 0.00 H ATOM 1290 HE21 GLN A1105 -40.761 29.028 6.355 1.00 0.00 H ATOM 1291 H GLN A1105 -45.915 29.855 1.977 1.00 0.00 H ATOM 1292 N GLU A1106 -47.234 30.550 5.066 1.00 37.19 N ATOM 1293 CA GLU A1106 -48.075 31.173 6.096 1.00 40.87 C ATOM 1294 C GLU A1106 -49.505 30.626 6.100 1.00 43.16 C ATOM 1295 O GLU A1106 -50.168 30.606 7.147 1.00 47.95 O ATOM 1296 CB GLU A1106 -48.103 32.696 5.901 1.00 40.45 C ATOM 1297 CG GLU A1106 -48.972 33.465 6.886 1.00 42.91 C ATOM 1298 CD GLU A1106 -48.676 33.113 8.331 1.00 43.32 C ATOM 1299 OE1 GLU A1106 -49.637 32.899 9.093 1.00 46.15 O ATOM 1300 OE2 GLU A1106 -47.487 33.047 8.703 1.00 44.16 O ATOM 1301 H GLU A1106 -46.800 31.161 4.345 1.00 0.00 H ATOM 1302 N SER A1107 -49.986 30.195 4.931 1.00 44.68 N ATOM 1303 CA SER A1107 -51.329 29.606 4.786 1.00 48.78 C ATOM 1304 C SER A1107 -51.440 28.162 5.308 1.00 52.67 C ATOM 1305 O SER A1107 -52.543 27.621 5.352 1.00 54.59 O ATOM 1306 CB SER A1107 -51.779 29.609 3.312 1.00 45.65 C ATOM 1307 OG SER A1107 -51.326 28.435 2.633 1.00 41.22 O ATOM 1308 HG SER A1107 -51.628 28.463 1.691 1.00 0.00 H ATOM 1309 H SER A1107 -49.386 30.279 4.086 1.00 0.00 H ATOM 1310 N ARG A1108 -50.321 27.530 5.662 1.00 54.86 N ATOM 1311 CA ARG A1108 -50.343 26.129 6.107 1.00 61.93 C ATOM 1312 C ARG A1108 -50.284 26.001 7.634 1.00 66.39 C ATOM 1313 O ARG A1108 -50.083 26.978 8.375 1.00 65.86 O ATOM 1314 CB ARG A1108 -49.212 25.340 5.437 1.00 60.66 C ATOM 1315 CG ARG A1108 -49.167 25.592 3.937 1.00 62.82 C ATOM 1316 CD ARG A1108 -48.552 24.462 3.123 1.00 61.75 C ATOM 1317 NE ARG A1108 -49.085 24.443 1.755 1.00 60.12 N ATOM 1318 CZ ARG A1108 -48.632 23.672 0.764 1.00 59.09 C ATOM 1319 NH1 ARG A1108 -49.198 23.739 -0.440 1.00 57.33 N ATOM 1320 NH2 ARG A1108 -47.615 22.836 0.958 1.00 59.95 N ATOM 1321 OXT ARG A1108 -50.463 24.900 8.158 1.00 69.76 O ATOM 1322 HE ARG A1108 -49.878 25.081 1.541 1.00 0.00 H ATOM 1323 HH12 ARG A1108 -48.847 23.139 -1.214 1.00 0.00 H ATOM 1324 HH11 ARG A1108 -49.991 24.391 -0.606 1.00 0.00 H ATOM 1325 HH22 ARG A1108 -47.274 22.242 0.176 1.00 0.00 H ATOM 1326 HH21 ARG A1108 -47.161 22.777 1.892 1.00 0.00 H ATOM 1327 H ARG A1108 -49.414 28.038 5.623 1.00 0.00 H TER 1328 ARG A1108 HETATM 1329 O HOH 1 -9.796 34.471 20.560 1.00 46.40 O HETATM 1330 O HOH 2 -52.093 28.893 0.326 1.00 40.08 O HETATM 1331 O HOH 3 -1.465 33.938 18.159 1.00 39.79 O HETATM 1332 O HOH 4 -37.051 17.361 -13.069 1.00 34.33 O HETATM 1333 O HOH 5 -51.028 33.278 3.267 1.00 32.46 O HETATM 1334 O HOH 6 -25.437 36.298 -9.721 1.00 32.95 O HETATM 1335 O HOH 7 -9.643 28.898 17.736 1.00 37.87 O HETATM 1336 O HOH 8 -21.351 25.982 23.083 1.00 48.07 O HETATM 1337 O HOH 9 -31.225 24.324 10.939 1.00 41.25 O HETATM 1338 O HOH 10 -25.451 25.295 -10.168 1.00 39.20 O HETATM 1339 O HOH 11 -30.700 14.304 -0.804 1.00 29.27 O HETATM 1340 O HOH 12 -5.147 34.028 7.540 1.00 25.93 O HETATM 1341 O HOH 13 -23.862 19.425 18.389 1.00 38.34 O HETATM 1342 O HOH 14 -53.036 27.575 -5.966 1.00 49.92 O HETATM 1343 O HOH 15 -51.780 28.002 -12.869 1.00 69.50 O HETATM 1344 O HOH 16 -30.538 28.917 -9.164 1.00 33.78 O HETATM 1345 O HOH 17 -49.214 39.799 2.212 1.00 37.21 O HETATM 1346 O HOH 18 -19.301 28.591 -8.327 1.00 35.38 O HETATM 1347 O HOH 19 -8.108 27.776 8.115 1.00 38.48 O HETATM 1348 O HOH 20 -30.997 41.150 -11.325 1.00 42.31 O HETATM 1349 O HOH 21 -33.126 32.669 -10.933 1.00 35.58 O HETATM 1350 O HOH 22 -40.430 31.986 -11.375 1.00 21.97 O HETATM 1351 O HOH 23 -31.375 27.351 11.015 1.00 56.10 O HETATM 1352 O HOH 24 -23.538 19.387 22.089 1.00 50.95 O HETATM 1353 O HOH 25 -27.719 19.408 16.598 1.00 39.50 O HETATM 1354 O HOH 26 -4.543 32.469 17.959 1.00 45.53 O HETATM 1355 O HOH 27 -10.726 37.211 8.432 1.00 32.46 O HETATM 1356 O HOH 28 -35.089 23.463 9.153 1.00 47.94 O HETATM 1357 O HOH 29 -15.028 37.578 3.261 1.00 24.15 O HETATM 1358 O HOH 30 -51.546 34.812 -1.217 1.00 24.02 O HETATM 1359 O HOH 31 -49.864 35.333 4.379 1.00 37.19 O HETATM 1360 O HOH 32 -45.048 29.690 -8.964 1.00 33.46 O HETATM 1361 O HOH 33 -31.039 22.793 -9.537 1.00 26.25 O HETATM 1362 O HOH 34 -17.277 38.511 1.523 1.00 39.94 O HETATM 1363 O HOH 35 -22.404 32.969 -9.378 1.00 41.72 O HETATM 1364 O HOH 36 -43.915 41.082 -3.266 1.00 34.85 O HETATM 1365 O HOH 37 -38.643 37.060 -12.788 1.00 41.36 O HETATM 1366 O HOH 38 -38.055 30.045 -13.706 1.00 22.91 O HETATM 1367 O HOH 39 -34.174 29.906 -11.331 1.00 35.53 O HETATM 1368 O HOH 40 -33.631 39.852 -8.164 1.00 48.21 O HETATM 1369 O HOH 41 -15.961 37.163 -2.222 1.00 40.04 O HETATM 1370 O HOH 42 -2.840 29.704 12.276 1.00 38.44 O HETATM 1371 O HOH 43 -3.458 36.294 11.468 1.00 22.36 O HETATM 1372 O HOH 44 -31.582 20.781 10.525 1.00 37.54 O HETATM 1373 O HOH 45 -32.335 14.273 1.554 1.00 28.29 O HETATM 1374 O HOH 46 -12.778 35.538 -0.791 1.00 25.57 O HETATM 1375 O HOH 47 -8.896 38.445 14.943 1.00 36.47 O HETATM 1376 O HOH 48 -41.871 40.390 -10.459 1.00 40.96 O HETATM 1377 O HOH 49 -54.389 26.767 -2.222 1.00 53.76 O HETATM 1378 O HOH 50 -25.785 20.933 24.975 1.00 37.88 O HETATM 1379 O HOH 51 -12.585 27.594 19.824 1.00 57.40 O HETATM 1380 O HOH 52 -40.460 15.793 -4.290 1.00 45.17 O HETATM 1381 O HOH 53 -15.264 25.886 -9.454 1.00 59.99 O HETATM 1382 O HOH 54 -17.233 21.619 24.562 1.00 67.94 O HETATM 1383 O HOH 55 -18.108 40.329 7.543 1.00 59.74 O HETATM 1384 O HOH 56 -45.825 42.654 -6.713 1.00 53.18 O HETATM 1385 O HOH 57 -26.218 19.728 20.198 1.00 37.52 O HETATM 1386 O HOH 58 -41.787 16.173 -7.445 1.00 64.75 O HETATM 1387 O HOH 59 -37.353 16.645 -3.547 1.00 41.72 O HETATM 1388 O HOH 60 -48.827 28.937 -6.382 1.00 32.45 O HETATM 1389 O HOH 61 -10.617 29.870 20.939 1.00 50.50 O HETATM 1390 O HOH 62 -33.026 34.438 -12.373 1.00 40.79 O HETATM 1391 O HOH 63 -54.500 30.909 -11.132 1.00 39.79 O HETATM 1392 O HOH 64 -21.601 30.743 -9.673 1.00 38.78 O HETATM 1393 O HOH 65 -36.259 14.161 -2.777 1.00 36.28 O HETATM 1394 O HOH 66 -7.386 27.245 12.342 1.00 53.11 O HETATM 1395 O HOH 67 1.123 34.451 13.312 1.00 44.97 O HETATM 1396 O HOH 68 -7.687 25.221 4.310 1.00 55.99 O HETATM 1397 O HOH 69 -6.667 35.532 19.797 1.00 28.09 O HETATM 1398 O HOH 70 -35.170 36.262 -11.833 1.00 41.36 O HETATM 1399 O HOH 71 -47.918 26.466 -11.761 1.00 55.96 O HETATM 1400 O HOH 72 -53.000 30.770 -8.062 1.00 39.31 O HETATM 1401 O HOH 73 -28.389 22.098 -9.060 1.00 33.58 O HETATM 1402 O HOH 74 -47.418 28.628 -9.775 1.00 43.12 O HETATM 1403 O HOH 75 -20.059 19.102 -9.934 1.00 60.54 O HETATM 1404 O HOH 76 -23.474 19.600 -12.495 1.00 39.25 O HETATM 1405 O HOH 77 -31.161 27.828 18.759 1.00 59.42 O HETATM 1406 O HOH 78 -31.881 20.166 14.674 1.00 42.01 O HETATM 1407 O HOH 79 -13.219 36.136 -5.228 1.00 47.78 O HETATM 1408 O HOH 80 -8.282 25.600 10.425 1.00 60.24 O HETATM 1409 O HOH 81 -54.730 30.521 4.669 1.00 64.89 O HETATM 1410 O HOH 82 -1.656 29.557 14.939 1.00 58.75 O HETATM 1411 O HOH 83 -34.467 13.102 0.374 1.00 29.89 O HETATM 1412 O HOH 84 -29.029 42.887 -11.630 1.00 53.32 O HETATM 1413 O HOH 85 -56.558 29.677 -10.741 1.00 56.48 O HETATM 1414 O HOH 86 -16.459 28.242 -8.665 1.00 69.24 O HETATM 1415 O HOH 87 -14.160 37.644 -0.192 1.00 29.11 O HETATM 1416 O HOH 88 -11.755 34.041 22.345 1.00 43.82 O HETATM 1417 O HOH 89 -8.223 26.740 -1.954 1.00 44.42 O HETATM 1418 O HOH 90 -19.383 27.711 23.577 1.00 48.40 O HETATM 1419 O HOH 91 -6.923 25.655 -4.413 1.00 59.60 O HETATM 1420 O HOH 92 2.316 34.009 17.806 1.00 40.20 O HETATM 1421 O HOH 93 -25.157 17.779 16.885 1.00 40.35 O HETATM 1422 O HOH 94 -16.371 37.516 13.824 1.00 48.93 O HETATM 1423 O HOH 95 -49.805 38.439 4.741 1.00 42.32 O HETATM 1424 O HOH 96 -27.687 14.956 -4.066 1.00 47.82 O HETATM 1425 O HOH 97 -23.684 17.699 24.347 1.00 60.30 O HETATM 1426 O HOH 98 2.972 34.085 15.002 1.00 56.13 O HETATM 1427 O HOH 99 -4.574 36.381 8.963 1.00 29.20 O HETATM 1428 O HOH 100 -22.498 29.826 24.603 1.00 71.57 O HETATM 1429 O HOH 101 -36.841 22.380 0.591 1.00 20.01 O HETATM 1430 O HOH 102 -29.072 31.179 11.371 1.00 20.88 O HETATM 1431 O HOH 103 -23.954 39.951 -0.133 1.00 22.40 O HETATM 1432 O HOH 104 -40.064 22.185 -0.456 1.00 23.92 O HETATM 1433 O HOH 105 -19.354 26.204 9.753 1.00 24.19 O HETATM 1434 O HOH 106 -24.860 26.178 16.363 1.00 25.50 O HETATM 1435 O HOH 107 -19.741 23.963 8.083 1.00 26.00 O HETATM 1436 O HOH 108 -33.145 33.976 7.118 1.00 25.75 O HETATM 1437 O HOH 109 -15.617 23.618 -2.470 1.00 27.10 O HETATM 1438 O HOH 110 -26.042 41.124 -1.255 1.00 26.31 O HETATM 1439 O HOH 111 -23.856 29.698 15.311 1.00 26.67 O HETATM 1440 O HOH 112 -17.772 25.793 11.994 1.00 26.23 O HETATM 1441 O HOH 113 -21.202 23.560 11.266 1.00 28.70 O HETATM 1442 O HOH 114 -12.284 25.920 2.234 1.00 26.07 O HETATM 1443 O HOH 115 -26.773 32.019 12.461 1.00 27.28 O HETATM 1444 O HOH 116 -26.087 15.914 0.491 1.00 28.25 O HETATM 1445 O HOH 117 -30.178 38.767 -0.586 1.00 28.23 O HETATM 1446 O HOH 118 -30.897 34.249 8.554 1.00 26.55 O HETATM 1447 O HOH 119 -21.289 19.928 -0.405 1.00 30.38 O HETATM 1448 O HOH 120 -32.336 36.100 5.549 1.00 30.32 O HETATM 1449 O HOH 121 -42.685 21.385 0.034 1.00 31.44 O HETATM 1450 O HOH 122 -22.759 19.754 9.561 1.00 29.44 O HETATM 1451 O HOH 123 -30.420 33.527 11.151 1.00 31.20 O HETATM 1452 O HOH 124 -26.251 40.939 -5.746 1.00 34.75 O HETATM 1453 O HOH 125 -24.330 34.490 9.604 1.00 31.60 O HETATM 1454 O HOH 126 -17.884 20.288 -3.811 1.00 31.72 O HETATM 1455 O HOH 127 -19.467 30.619 -5.376 1.00 30.41 O HETATM 1456 O HOH 128 -13.343 27.618 -7.304 1.00 32.60 O HETATM 1457 O HOH 129 -34.120 26.904 8.180 1.00 35.19 O HETATM 1458 O HOH 130 -17.990 35.293 -4.315 1.00 33.15 O HETATM 1459 O HOH 131 -16.362 32.190 20.191 1.00 34.71 O HETATM 1460 O HOH 132 -23.594 26.606 18.942 1.00 35.21 O HETATM 1461 O HOH 133 -40.024 39.178 -1.145 1.00 34.03 O HETATM 1462 O HOH 134 -37.251 41.215 -7.516 1.00 36.09 O HETATM 1463 O HOH 135 -36.716 11.843 1.115 1.00 36.13 O HETATM 1464 O HOH 136 -26.534 37.473 7.313 1.00 36.50 O HETATM 1465 O HOH 137 -39.874 32.113 5.993 1.00 32.39 O HETATM 1466 O HOH 138 -15.517 35.342 15.841 1.00 34.45 O HETATM 1467 O HOH 139 -20.357 38.774 -2.214 1.00 36.34 O HETATM 1468 O HOH 140 -25.353 42.201 -3.568 1.00 36.68 O HETATM 1469 O HOH 141 -20.369 20.564 10.723 1.00 35.14 O HETATM 1470 O HOH 142 -43.502 20.453 -4.238 1.00 35.22 O HETATM 1471 O HOH 143 -13.660 22.138 -3.758 1.00 36.77 O HETATM 1472 O HOH 144 -18.061 21.995 7.722 1.00 37.11 O HETATM 1473 O HOH 145 -18.095 37.332 -1.030 1.00 36.48 O HETATM 1474 O HOH 146 -9.982 24.782 -1.018 1.00 37.19 O HETATM 1475 O HOH 147 -21.283 34.694 -7.299 1.00 37.24 O HETATM 1476 O HOH 148 -27.889 14.383 -0.719 1.00 36.17 O HETATM 1477 O HOH 149 -27.333 27.007 17.027 1.00 37.78 O HETATM 1478 O HOH 150 -22.392 36.259 -5.449 1.00 34.68 O HETATM 1479 O HOH 151 -23.779 20.288 -1.410 1.00 37.70 O HETATM 1480 O HOH 152 -28.688 41.027 0.114 1.00 35.84 O HETATM 1481 O HOH 153 -20.479 32.240 -7.273 1.00 41.64 O HETATM 1482 O HOH 154 -20.681 38.037 -4.781 1.00 39.12 O HETATM 1483 O HOH 155 -20.406 18.556 12.615 1.00 36.99 O HETATM 1484 O HOH 156 -9.572 37.422 17.315 1.00 36.75 O HETATM 1485 O HOH 157 -26.430 29.748 16.406 1.00 38.77 O HETATM 1486 O HOH 158 -21.634 41.021 -1.242 1.00 39.03 O HETATM 1487 O HOH 159 -30.437 29.365 13.097 1.00 41.76 O HETATM 1488 O HOH 160 -13.391 36.774 16.715 1.00 37.66 O HETATM 1489 O HOH 161 -26.824 21.360 -5.164 1.00 37.93 O HETATM 1490 O HOH 162 -23.943 37.478 -7.331 1.00 37.41 O HETATM 1491 O HOH 163 -9.825 24.536 1.692 1.00 40.12 O HETATM 1492 O HOH 164 -32.756 39.314 -1.864 1.00 40.41 O HETATM 1493 O HOH 165 -24.246 20.715 -4.336 1.00 40.96 O HETATM 1494 O HOH 166 -38.502 14.298 0.447 1.00 41.92 O HETATM 1495 O HOH 167 -19.814 18.819 -2.296 1.00 42.34 O HETATM 1496 O HOH 168 -34.031 38.985 -4.333 1.00 44.47 O HETATM 1497 O HOH 169 -28.139 27.329 19.428 1.00 39.94 O HETATM 1498 O HOH 170 -12.840 30.360 -5.833 1.00 41.24 O HETATM 1499 O HOH 171 -26.591 14.974 4.566 1.00 40.46 O HETATM 1500 O HOH 172 -36.319 25.085 7.621 1.00 42.14 O HETATM 1501 O HOH 173 -22.489 42.081 -3.502 1.00 42.84 O HETATM 1502 O HOH 174 -22.580 36.285 10.242 1.00 42.96 O HETATM 1503 O HOH 175 -26.356 34.817 11.962 1.00 40.38 O HETATM 1504 O HOH 176 -22.175 35.692 13.324 1.00 47.08 O HETATM 1505 O HOH 177 -27.958 42.724 -7.099 1.00 43.21 O HETATM 1506 O HOH 178 -10.831 27.314 5.797 1.00 42.43 O HETATM 1507 O HOH 179 -21.510 40.641 -5.621 1.00 43.35 O HETATM 1508 O HOH 180 -27.563 20.432 13.224 1.00 51.78 O HETATM 1509 O HOH 181 -24.279 17.064 -1.344 1.00 46.37 O HETATM 1510 O HOH 182 -14.394 22.465 -6.412 1.00 45.45 O HETATM 1511 O HOH 183 -41.880 41.438 -1.610 1.00 45.04 O HETATM 1512 O HOH 184 -26.060 39.346 4.878 1.00 45.68 O HETATM 1513 O HOH 185 -24.209 15.683 5.450 1.00 48.10 O HETATM 1514 O HOH 186 -19.493 39.036 10.251 1.00 42.04 O HETATM 1515 O HOH 187 -43.136 18.279 -5.932 1.00 49.37 O HETATM 1516 O HOH 188 -24.119 40.367 -7.529 1.00 45.59 O HETATM 1517 O HOH 189 -36.777 38.590 -2.145 1.00 47.51 O HETATM 1518 O HOH 190 -24.770 38.530 9.374 1.00 45.54 O HETATM 1519 O HOH 191 -9.340 25.616 6.674 1.00 47.50 O HETATM 1520 O HOH 192 -43.939 18.172 1.415 1.00 52.66 O HETATM 1521 O HOH 193 -24.847 35.663 14.247 1.00 52.50 O HETATM 1522 O HOH 194 -17.212 14.754 7.722 1.00 48.42 O HETATM 1523 O HOH 195 -22.344 16.924 12.702 1.00 47.20 O HETATM 1524 O HOH 196 -45.170 20.789 -1.863 1.00 44.95 O HETATM 1525 O HOH 197 -24.431 39.716 2.792 1.00 49.57 O HETATM 1526 O HOH 198 -21.081 33.926 15.124 1.00 47.30 O HETATM 1527 O HOH 199 -42.006 21.179 4.884 1.00 54.42 O HETATM 1528 O HOH 200 -34.391 37.716 0.123 1.00 51.82 O HETATM 1529 O HOH 201 -29.108 29.448 15.533 1.00 51.64 O HETATM 1530 O HOH 202 -25.228 33.339 16.522 1.00 51.60 O HETATM 1531 O HOH 203 -40.606 15.196 1.734 1.00 56.42 O HETATM 1532 O HOH 204 -23.854 16.630 14.865 1.00 56.85 O HETATM 1533 O HOH 205 -54.788 21.347 -7.371 1.00 48.96 O HETATM 1534 O HOH 206 -23.838 17.355 10.470 1.00 56.02 O HETATM 1535 O HOH 207 -34.925 35.004 8.892 1.00 50.94 O HETATM 1536 O HOH 208 -19.048 35.323 16.467 1.00 57.19 O HETATM 1537 O HOH 209 -15.340 19.269 -2.519 1.00 52.09 O HETATM 1538 O HOH 210 -16.254 17.983 -0.046 1.00 52.03 O HETATM 1539 O HOH 211 -13.013 18.170 9.833 1.00 50.77 O HETATM 1540 O HOH 212 -39.191 22.802 7.752 1.00 48.01 O HETATM 1541 O HOH 213 -29.306 19.138 9.380 1.00 54.79 O HETATM 1542 O HOH 214 -50.545 20.826 -2.191 1.00 57.27 O HETATM 1543 O HOH 215 -17.955 37.803 -5.552 1.00 59.99 O HETATM 1544 O HOH 216 -18.950 31.244 21.591 1.00 54.12 O HETATM 1545 O HOH 217 -38.255 26.674 9.117 1.00 54.47 O HETATM 1546 O HOH 218 -35.692 36.203 1.620 1.00 64.29 O HETATM 1547 O HOH 219 -33.737 37.256 2.995 1.00 55.87 O HETATM 1548 O HOH 220 -43.304 16.208 -3.909 1.00 56.34 O HETATM 1549 O HOH 221 -16.976 34.937 18.287 1.00 57.49 O HETATM 1550 O HOH 222 -47.507 21.552 -1.829 1.00 55.88 O HETATM 1551 O HOH 223 -26.685 19.593 10.051 1.00 51.79 O HETATM 1552 O HOH 224 -40.642 19.123 7.437 1.00 55.27 O HETATM 1553 O HOH 225 -45.553 37.337 4.437 1.00 58.43 O HETATM 1554 O HOH 226 -20.716 14.449 11.540 1.00 65.02 O HETATM 1555 O HOH 227 -29.030 38.183 8.198 1.00 54.24 O HETATM 1556 O HOH 228 -32.474 42.003 -1.211 1.00 58.32 O HETATM 1557 O HOH 229 -53.291 24.102 -8.838 1.00 58.63 O HETATM 1558 O HOH 230 -17.752 39.998 4.711 1.00 61.11 O HETATM 1559 O HOH 231 -17.063 16.832 16.982 1.00 59.46 O HETATM 1560 O HOH 232 -10.432 19.844 18.563 1.00 72.95 O HETATM 1561 O HOH 233 -40.220 41.742 -8.312 1.00 56.73 O HETATM 1562 O HOH 234 -51.524 25.649 1.246 1.00 66.29 O HETATM 1563 O HOH 235 -45.612 26.209 6.582 1.00 63.35 O HETATM 1564 O HOH 236 -43.701 20.653 2.633 1.00 53.38 O HETATM 1565 O HOH 237 -30.779 43.457 -7.570 1.00 56.17 O HETATM 1566 O HOH 238 -52.407 29.174 8.285 1.00 62.32 O HETATM 1567 O HOH 239 -30.303 43.657 -0.563 1.00 63.10 O HETATM 1568 O HOH 240 -46.305 23.568 5.611 1.00 54.17 O HETATM 1569 O HOH 241 -32.511 44.181 -4.979 1.00 65.16 O HETATM 1570 O HOH 242 -28.511 36.021 11.109 1.00 59.86 O HETATM 1571 O HOH 243 -36.250 28.770 9.265 1.00 56.75 O HETATM 1572 O HOH 244 -40.371 30.391 8.785 1.00 72.00 O HETATM 1573 O HOH 245 -33.232 33.470 12.592 1.00 59.29 O HETATM 1574 O HOH 246 -18.307 16.766 -1.541 1.00 62.64 O HETATM 1575 O HOH 247 -19.994 42.413 0.552 1.00 62.65 O HETATM 1576 O HOH 248 -45.425 30.893 8.555 1.00 59.86 O HETATM 1577 O HOH 249 -25.508 27.542 20.803 1.00 58.03 O HETATM 1578 O HOH 250 -33.905 41.664 -5.093 1.00 71.86 O HETATM 1579 O HOH 251 -55.210 22.987 -1.714 1.00 65.42 O HETATM 1580 O HOH 252 -41.920 25.804 6.711 1.00 68.09 O HETATM 1581 O HOH 253 -44.770 16.290 -0.463 1.00 71.03 O HETATM 1582 CAF UNN A 254 -12.150 23.804 12.560 1.00 0.01 C HETATM 1583 CAE UNN A 254 -13.411 24.159 11.758 1.00 0.15 C HETATM 1584 OAA UNN A 254 -14.470 24.911 12.262 1.00 -0.17 O HETATM 1585 NAB UNN A 254 -15.283 25.030 11.402 1.00 -0.17 N HETATM 1586 CAC UNN A 254 -14.891 24.403 10.305 1.00 0.02 C HETATM 1587 CAG UNN A 254 -15.722 24.360 9.005 1.00 -0.03 C HETATM 1588 H UNN A 254 -15.181 23.779 8.243 1.00 0.04 H HETATM 1589 H UNN A 254 -15.883 25.385 8.639 1.00 0.04 H HETATM 1590 H UNN A 254 -16.694 23.885 9.206 1.00 0.04 H HETATM 1591 CAD UNN A 254 -13.715 23.835 10.509 1.00 0.02 C HETATM 1592 CAH UNN A 254 -13.004 23.166 9.586 1.00 -0.05 C HETATM 1593 CAM UNN A 254 -13.596 22.195 8.770 1.00 -0.06 C HETATM 1594 CAL UNN A 254 -12.847 21.537 7.783 1.00 0.04 C HETATM 1595 CAK UNN A 254 -11.495 21.872 7.599 1.00 -0.03 C HETATM 1596 CAJ UNN A 254 -10.907 22.850 8.395 1.00 0.03 C HETATM 1597 CAI UNN A 254 -11.657 23.500 9.375 1.00 -0.04 C HETATM 1598 H UNN A 254 -11.195 24.271 9.980 1.00 0.05 H HETATM 1599 NAR UNN A 254 -9.632 23.167 8.219 1.00 -0.34 N HETATM 1600 H UNN A 254 -9.077 22.688 7.496 1.00 0.17 H HETATM 1601 H UNN A 254 -9.196 23.893 8.806 1.00 0.17 H HETATM 1602 H UNN A 254 -10.910 21.369 6.837 1.00 0.05 H HETATM 1603 CAN UNN A 254 -13.440 20.565 6.964 1.00 0.26 C HETATM 1604 OAO UNN A 254 -12.784 20.043 6.056 1.00 -0.36 O HETATM 1605 OAP UNN A 254 -14.781 20.345 7.184 1.00 -0.28 O HETATM 1606 CAQ UNN A 254 -15.289 19.065 6.783 1.00 0.06 C HETATM 1607 H UNN A 254 -16.364 19.010 7.009 1.00 0.06 H HETATM 1608 H UNN A 254 -14.759 18.272 7.331 1.00 0.06 H HETATM 1609 H UNN A 254 -15.134 18.931 5.702 1.00 0.06 H HETATM 1610 H UNN A 254 -14.643 21.949 8.902 1.00 0.05 H HETATM 1611 H UNN A 254 -11.473 23.206 11.933 1.00 0.05 H HETATM 1612 H UNN A 254 -12.433 23.224 13.451 1.00 0.05 H HETATM 1613 H UNN A 254 -11.641 24.728 12.871 1.00 0.05 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1582 1583 1611 1612 1613 CONECT 1583 1582 1584 1591 CONECT 1584 1583 1585 CONECT 1585 1584 1586 CONECT 1586 1585 1587 1591 CONECT 1587 1586 1588 1589 1590 CONECT 1588 1587 CONECT 1589 1587 CONECT 1590 1587 CONECT 1591 1583 1586 1592 CONECT 1592 1591 1593 1597 CONECT 1593 1592 1594 1610 CONECT 1594 1593 1595 1603 CONECT 1595 1594 1596 1602 CONECT 1596 1595 1597 1599 CONECT 1597 1592 1596 1598 CONECT 1598 1597 CONECT 1599 1596 1600 1601 CONECT 1600 1599 CONECT 1601 1599 CONECT 1602 1595 CONECT 1603 1594 1604 1605 CONECT 1604 1603 CONECT 1605 1603 1606 CONECT 1606 1605 1607 1608 1609 CONECT 1607 1606 CONECT 1608 1606 CONECT 1609 1606 CONECT 1610 1593 CONECT 1611 1582 CONECT 1612 1582 CONECT 1613 1582 MASTER 0 0 0 0 0 0 0 0 1612 1 36 10 END
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Related entries of code: 4tte
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Protein Sequence Similarity
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130aa, >4QSX_1|Chain... at 100%
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130aa, >4TT2_1|Chain... at 100%
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130aa, >4TU4_1|Chain... at 100%
4tyl
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130aa, >4TYL_1|Chain... at 100%
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130aa, >4TZ2_1|Chain... at 100%
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PDBbind
130aa, >4TZ8_1|Chain... at 100%
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PDBbind
130aa, >5A5O_1|Chain... at 100%
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RCSB PDB
PDBbind
130aa, >5A5P_1|Chain... at 100%
5a5q
RCSB PDB
PDBbind
130aa, >5A5Q_1|Chain... at 100%
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PDBbind
130aa, >5A5R_1|Chain... at 100%
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RCSB PDB
PDBbind
130aa, >5A81_1|Chain... at 100%
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PDBbind
130aa, >5A82_1|Chain... at 100%
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RCSB PDB
PDBbind
130aa, >5A83_1|Chain... at 100%
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RCSB PDB
PDBbind
130aa, >5LJ0_1|Chain... at 100%
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4tte
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
ATPase family AAA domain-containing protein 2 ATAD2A bromodomain
Ligand Name
36Z
EC.Number
E.C.3.6.1.3
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Kd=202uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Biochem.J.Vol.466: pp.337-346
Ligand Properties
Formula
C
1
3
H
1
4
N
2
O
3
Molecular Weight
246.262
Exact Mass
246.100
No. of atoms
32
No. of bonds
33
Polar Surface Area
78.35
LOGP Value
1.97 (
Computed with XLOGP3
)
2.91 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
Canonical SMILES
COC(=O)c1cc(N)cc(c1)c1c(C)noc1C
InChI String
InChI=1S/C13H14N2O3/c1-7-12(8(2)18-15-7)9-4-10(13(16)17-3)6-11(14)5-9/h4-6H,14H2,1-3H3
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q6PL18
Entrez Gene ID
NCBI Entrez Gene ID:
29028
ASD
Information of known allosteric effects of PDB entries
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