Browse entries in the PDBbind-CN Database
HEADER 4LBO_COMPLEX COMPND 4LBO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 138 PRO LEU ILE VAL PRO TYR ASN LEU PRO LEU PRO GLY GLY SEQRES 2 A 138 VAL VAL PRO ARG MET LEU ILE THR ILE LEU GLY THR VAL SEQRES 3 A 138 LYS PRO ASN ALA ASN ARG ILE ALA LEU ASP PHE GLN ARG SEQRES 4 A 138 GLY ASN ASP VAL ALA PHE HIS PHE ASN PRO ARG PHE ASN SEQRES 5 A 138 GLU ASN ASN ARG ARG VAL ILE VAL CYS ASN THR LYS LEU SEQRES 6 A 138 ASP ASN ASN TRP GLY ARG GLU GLU ARG GLN SER VAL PHE SEQRES 7 A 138 PRO PHE GLU SER GLY LYS PRO PHE LYS ILE GLN VAL LEU SEQRES 8 A 138 VAL GLU PRO ASP HIS PHE LYS VAL ALA VAL ASN ASP ALA SEQRES 9 A 138 HIS LEU LEU GLN TYR ASN HIS ARG VAL LYS LYS LEU ASN SEQRES 10 A 138 GLU ILE SER LYS LEU GLY ILE SER GLY ASP ILE ASP LEU SEQRES 11 A 138 THR SER ALA SER TYR THR MET ILE HET BGC A 257 81 ATOM 1 N PRO A 113 -6.691 -3.756 10.741 1.00 49.92 N ATOM 2 CA PRO A 113 -5.488 -4.385 10.192 1.00 47.60 C ATOM 3 C PRO A 113 -5.267 -4.058 8.714 1.00 37.87 C ATOM 4 O PRO A 113 -6.232 -3.845 7.977 1.00 36.04 O ATOM 5 CB PRO A 113 -5.754 -5.883 10.381 1.00 46.55 C ATOM 6 CG PRO A 113 -7.235 -6.006 10.466 1.00 55.63 C ATOM 7 CD PRO A 113 -7.713 -4.745 11.122 1.00 56.26 C ATOM 8 HN2 PRO A 113 -7.093 -3.119 10.024 1.00 0.00 H ATOM 9 HN1 PRO A 113 -6.427 -3.206 11.583 1.00 0.00 H ATOM 10 N LEU A 114 -4.000 -4.016 8.305 1.00 29.55 N ATOM 11 CA LEU A 114 -3.616 -3.684 6.936 1.00 23.16 C ATOM 12 C LEU A 114 -3.011 -4.893 6.230 1.00 28.30 C ATOM 13 O LEU A 114 -2.432 -5.764 6.871 1.00 33.63 O ATOM 14 CB LEU A 114 -2.600 -2.545 6.944 1.00 24.19 C ATOM 15 CG LEU A 114 -3.035 -1.262 7.651 1.00 29.19 C ATOM 16 CD1 LEU A 114 -1.920 -0.232 7.604 1.00 29.17 C ATOM 17 CD2 LEU A 114 -4.312 -0.709 7.031 1.00 34.52 C ATOM 18 H LEU A 114 -3.250 -4.230 8.993 1.00 0.00 H ATOM 19 N ILE A 115 -3.146 -4.938 4.907 1.00 22.89 N ATOM 20 CA ILE A 115 -2.608 -6.047 4.115 1.00 25.41 C ATOM 21 C ILE A 115 -1.145 -5.786 3.772 1.00 24.97 C ATOM 22 O ILE A 115 -0.785 -4.679 3.375 1.00 25.69 O ATOM 23 CB ILE A 115 -3.398 -6.241 2.801 1.00 29.82 C ATOM 24 CG1 ILE A 115 -4.880 -6.515 3.090 1.00 37.16 C ATOM 25 CG2 ILE A 115 -2.790 -7.366 1.967 1.00 33.59 C ATOM 26 CD1 ILE A 115 -5.148 -7.755 3.919 1.00 45.69 C ATOM 27 H ILE A 115 -3.646 -4.166 4.422 1.00 0.00 H ATOM 28 N VAL A 116 -0.316 -6.815 3.937 1.00 20.59 N ATOM 29 CA VAL A 116 1.102 -6.773 3.595 1.00 20.06 C ATOM 30 C VAL A 116 1.306 -7.647 2.349 1.00 20.64 C ATOM 31 O VAL A 116 0.751 -8.740 2.282 1.00 22.24 O ATOM 32 CB VAL A 116 1.945 -7.305 4.773 1.00 25.89 C ATOM 33 CG1 VAL A 116 3.419 -7.397 4.412 1.00 29.67 C ATOM 34 CG2 VAL A 116 1.759 -6.411 5.990 1.00 31.68 C ATOM 35 H VAL A 116 -0.700 -7.697 4.331 1.00 0.00 H ATOM 36 N PRO A 117 2.093 -7.180 1.361 1.00 18.94 N ATOM 37 CA PRO A 117 2.849 -5.921 1.289 1.00 17.85 C ATOM 38 C PRO A 117 1.940 -4.708 1.174 1.00 20.19 C ATOM 39 O PRO A 117 0.911 -4.773 0.506 1.00 18.40 O ATOM 40 CB PRO A 117 3.682 -6.066 0.003 1.00 21.48 C ATOM 41 CG PRO A 117 3.573 -7.494 -0.400 1.00 28.56 C ATOM 42 CD PRO A 117 2.259 -7.972 0.130 1.00 23.86 C ATOM 43 N TYR A 118 2.344 -3.617 1.817 1.00 16.21 N ATOM 44 CA TYR A 118 1.561 -2.395 1.907 1.00 16.63 C ATOM 45 C TYR A 118 2.351 -1.244 1.300 1.00 15.93 C ATOM 46 O TYR A 118 3.544 -1.114 1.553 1.00 17.68 O ATOM 47 CB TYR A 118 1.279 -2.088 3.377 1.00 15.14 C ATOM 48 CG TYR A 118 0.326 -0.942 3.595 1.00 16.38 C ATOM 49 CD1 TYR A 118 -1.041 -1.129 3.486 1.00 21.20 C ATOM 50 CD2 TYR A 118 0.793 0.330 3.920 1.00 19.48 C ATOM 51 CE1 TYR A 118 -1.925 -0.086 3.687 1.00 27.73 C ATOM 52 CE2 TYR A 118 -0.086 1.383 4.123 1.00 24.91 C ATOM 53 CZ TYR A 118 -1.444 1.169 3.999 1.00 26.97 C ATOM 54 OH TYR A 118 -2.335 2.199 4.196 1.00 32.30 O ATOM 55 HH TYR A 118 -3.258 1.865 4.067 1.00 0.00 H ATOM 56 H TYR A 118 3.274 -3.639 2.283 1.00 0.00 H ATOM 57 N ASN A 119 1.686 -0.433 0.479 1.00 14.89 N ATOM 58 CA ASN A 119 2.300 0.729 -0.134 1.00 15.92 C ATOM 59 C ASN A 119 1.703 1.988 0.470 1.00 15.46 C ATOM 60 O ASN A 119 0.480 2.191 0.413 1.00 17.67 O ATOM 61 CB ASN A 119 2.059 0.717 -1.643 1.00 22.55 C ATOM 62 CG ASN A 119 2.749 -0.442 -2.335 1.00 32.42 C ATOM 63 OD1 ASN A 119 3.891 -0.775 -2.018 1.00 38.03 O ATOM 64 ND2 ASN A 119 2.067 -1.053 -3.299 1.00 44.49 N ATOM 65 HD22 ASN A 119 1.104 -0.739 -3.534 1.00 0.00 H ATOM 66 HD21 ASN A 119 2.497 -1.845 -3.818 1.00 0.00 H ATOM 67 H ASN A 119 0.689 -0.641 0.270 1.00 0.00 H ATOM 68 N LEU A 120 2.564 2.801 1.080 1.00 14.51 N ATOM 69 CA LEU A 120 2.177 4.072 1.673 1.00 14.95 C ATOM 70 C LEU A 120 2.703 5.211 0.804 1.00 13.02 C ATOM 71 O LEU A 120 3.910 5.446 0.774 1.00 12.40 O ATOM 72 CB LEU A 120 2.741 4.194 3.088 1.00 15.53 C ATOM 73 CG LEU A 120 2.484 5.499 3.856 1.00 18.30 C ATOM 74 CD1 LEU A 120 1.005 5.643 4.169 1.00 21.50 C ATOM 75 CD2 LEU A 120 3.313 5.543 5.128 1.00 22.13 C ATOM 76 H LEU A 120 3.562 2.513 1.135 1.00 0.00 H ATOM 77 N PRO A 121 1.802 5.922 0.102 1.00 13.42 N ATOM 78 CA PRO A 121 2.239 7.082 -0.672 1.00 13.65 C ATOM 79 C PRO A 121 2.751 8.174 0.245 1.00 12.24 C ATOM 80 O PRO A 121 2.219 8.350 1.343 1.00 14.25 O ATOM 81 CB PRO A 121 0.962 7.547 -1.387 1.00 17.16 C ATOM 82 CG PRO A 121 0.019 6.400 -1.305 1.00 22.53 C ATOM 83 CD PRO A 121 0.352 5.690 -0.034 1.00 19.22 C ATOM 84 N LEU A 122 3.797 8.868 -0.198 1.00 10.68 N ATOM 85 CA LEU A 122 4.373 9.997 0.518 1.00 9.97 C ATOM 86 C LEU A 122 4.227 11.189 -0.425 1.00 11.80 C ATOM 87 O LEU A 122 5.104 11.445 -1.242 1.00 12.71 O ATOM 88 CB LEU A 122 5.840 9.722 0.872 1.00 10.27 C ATOM 89 CG LEU A 122 6.102 8.402 1.611 1.00 11.49 C ATOM 90 CD1 LEU A 122 7.595 8.150 1.715 1.00 16.16 C ATOM 91 CD2 LEU A 122 5.454 8.428 2.981 1.00 13.34 C ATOM 92 H LEU A 122 4.225 8.589 -1.104 1.00 0.00 H ATOM 93 N PRO A 123 3.081 11.894 -0.357 1.00 12.52 N ATOM 94 CA PRO A 123 2.787 12.911 -1.371 1.00 12.09 C ATOM 95 C PRO A 123 3.812 14.048 -1.436 1.00 11.60 C ATOM 96 O PRO A 123 4.045 14.742 -0.456 1.00 14.24 O ATOM 97 CB PRO A 123 1.411 13.440 -0.953 1.00 13.37 C ATOM 98 CG PRO A 123 0.817 12.349 -0.141 1.00 14.31 C ATOM 99 CD PRO A 123 1.964 11.730 0.589 1.00 13.51 C ATOM 100 N GLY A 124 4.415 14.230 -2.602 1.00 12.97 N ATOM 101 CA GLY A 124 5.414 15.279 -2.795 1.00 11.61 C ATOM 102 C GLY A 124 6.762 14.936 -2.208 1.00 11.48 C ATOM 103 O GLY A 124 7.635 15.810 -2.116 1.00 13.67 O ATOM 104 H GLY A 124 4.171 13.610 -3.401 1.00 0.00 H ATOM 105 N GLY A 125 6.940 13.666 -1.837 1.00 11.45 N ATOM 106 CA GLY A 125 8.210 13.150 -1.343 1.00 10.81 C ATOM 107 C GLY A 125 8.429 13.404 0.125 1.00 13.11 C ATOM 108 O GLY A 125 7.544 13.893 0.819 1.00 14.82 O ATOM 109 H GLY A 125 6.133 13.013 -1.904 1.00 0.00 H ATOM 110 N VAL A 126 9.621 13.067 0.592 1.00 12.83 N ATOM 111 CA VAL A 126 9.977 13.284 1.985 1.00 11.81 C ATOM 112 C VAL A 126 10.638 14.643 2.155 1.00 12.91 C ATOM 113 O VAL A 126 11.145 15.238 1.192 1.00 15.30 O ATOM 114 CB VAL A 126 10.837 12.143 2.558 1.00 12.97 C ATOM 115 CG1 VAL A 126 10.116 10.807 2.404 1.00 17.81 C ATOM 116 CG2 VAL A 126 12.214 12.092 1.920 1.00 16.32 C ATOM 117 H VAL A 126 10.317 12.638 -0.051 1.00 0.00 H ATOM 118 N VAL A 127 10.644 15.111 3.398 1.00 14.00 N ATOM 119 CA VAL A 127 11.142 16.430 3.752 1.00 14.54 C ATOM 120 C VAL A 127 11.648 16.334 5.183 1.00 12.77 C ATOM 121 O VAL A 127 11.073 15.587 5.977 1.00 12.70 O ATOM 122 CB VAL A 127 10.007 17.473 3.681 1.00 16.17 C ATOM 123 CG1 VAL A 127 8.964 17.209 4.759 1.00 19.40 C ATOM 124 CG2 VAL A 127 10.556 18.883 3.808 1.00 19.43 C ATOM 125 H VAL A 127 10.274 14.503 4.156 1.00 0.00 H ATOM 126 N PRO A 128 12.724 17.074 5.528 1.00 13.38 N ATOM 127 CA PRO A 128 13.146 17.049 6.924 1.00 14.13 C ATOM 128 C PRO A 128 11.991 17.378 7.871 1.00 16.56 C ATOM 129 O PRO A 128 11.122 18.190 7.525 1.00 16.81 O ATOM 130 CB PRO A 128 14.229 18.129 6.989 1.00 17.61 C ATOM 131 CG PRO A 128 14.784 18.167 5.609 1.00 18.64 C ATOM 132 CD PRO A 128 13.602 17.934 4.711 1.00 20.15 C ATOM 133 N ARG A 129 12.009 16.748 9.043 1.00 16.85 N ATOM 134 CA ARG A 129 10.974 16.873 10.079 1.00 17.42 C ATOM 135 C ARG A 129 9.710 16.047 9.814 1.00 16.94 C ATOM 136 O ARG A 129 8.721 16.181 10.536 1.00 20.20 O ATOM 137 CB ARG A 129 10.607 18.338 10.353 1.00 19.32 C ATOM 138 CG ARG A 129 11.809 19.241 10.575 1.00 21.57 C ATOM 139 CD ARG A 129 11.410 20.540 11.256 1.00 20.69 C ATOM 140 NE ARG A 129 10.896 20.294 12.598 1.00 21.03 N ATOM 141 CZ ARG A 129 11.657 19.931 13.624 1.00 27.54 C ATOM 142 NH1 ARG A 129 12.962 19.783 13.456 1.00 33.74 N ATOM 143 NH2 ARG A 129 11.119 19.714 14.816 1.00 33.02 N ATOM 144 HE ARG A 129 9.875 20.409 12.761 1.00 0.00 H ATOM 145 HH12 ARG A 129 13.561 19.499 14.258 1.00 0.00 H ATOM 146 HH11 ARG A 129 13.388 19.951 12.522 1.00 0.00 H ATOM 147 HH22 ARG A 129 11.722 19.430 15.615 1.00 0.00 H ATOM 148 HH21 ARG A 129 10.094 19.828 14.953 1.00 0.00 H ATOM 149 H ARG A 129 12.815 16.121 9.240 1.00 0.00 H ATOM 150 N MET A 130 9.746 15.190 8.795 1.00 14.29 N ATOM 151 CA MET A 130 8.670 14.233 8.557 1.00 11.76 C ATOM 152 C MET A 130 8.969 12.979 9.360 1.00 12.49 C ATOM 153 O MET A 130 10.076 12.444 9.281 1.00 13.95 O ATOM 154 CB MET A 130 8.595 13.883 7.079 1.00 13.86 C ATOM 155 CG MET A 130 7.387 13.069 6.677 1.00 19.64 C ATOM 156 SD MET A 130 7.334 12.920 4.876 1.00 24.52 S ATOM 157 CE MET A 130 5.841 11.954 4.665 1.00 24.76 C ATOM 158 H MET A 130 10.563 15.203 8.152 1.00 0.00 H ATOM 159 N LEU A 131 7.977 12.522 10.119 1.00 12.62 N ATOM 160 CA LEU A 131 8.119 11.373 10.998 1.00 12.18 C ATOM 161 C LEU A 131 7.151 10.298 10.553 1.00 13.34 C ATOM 162 O LEU A 131 5.941 10.521 10.535 1.00 14.82 O ATOM 163 CB LEU A 131 7.814 11.779 12.440 1.00 14.59 C ATOM 164 CG LEU A 131 7.793 10.664 13.489 1.00 17.13 C ATOM 165 CD1 LEU A 131 9.189 10.111 13.675 1.00 17.09 C ATOM 166 CD2 LEU A 131 7.225 11.178 14.804 1.00 23.52 C ATOM 167 H LEU A 131 7.059 13.009 10.082 1.00 0.00 H ATOM 168 N ILE A 132 7.679 9.129 10.213 1.00 11.63 N ATOM 169 CA ILE A 132 6.852 8.012 9.779 1.00 13.21 C ATOM 170 C ILE A 132 6.839 6.965 10.876 1.00 14.36 C ATOM 171 O ILE A 132 7.895 6.565 11.351 1.00 14.10 O ATOM 172 CB ILE A 132 7.390 7.403 8.479 1.00 16.79 C ATOM 173 CG1 ILE A 132 7.319 8.433 7.347 1.00 22.18 C ATOM 174 CG2 ILE A 132 6.595 6.163 8.083 1.00 21.26 C ATOM 175 CD1 ILE A 132 8.311 8.178 6.243 1.00 29.54 C ATOM 176 H ILE A 132 8.711 9.007 10.258 1.00 0.00 H ATOM 177 N THR A 133 5.647 6.528 11.268 1.00 12.30 N ATOM 178 CA THR A 133 5.486 5.576 12.363 1.00 11.68 C ATOM 179 C THR A 133 4.789 4.318 11.860 1.00 13.83 C ATOM 180 O THR A 133 3.719 4.386 11.255 1.00 12.79 O ATOM 181 CB THR A 133 4.680 6.194 13.524 1.00 16.75 C ATOM 182 OG1 THR A 133 5.349 7.370 13.998 1.00 16.54 O ATOM 183 CG2 THR A 133 4.527 5.211 14.674 1.00 17.86 C ATOM 184 HG1 THR A 133 5.422 8.026 13.261 1.00 0.00 H ATOM 185 H THR A 133 4.799 6.876 10.777 1.00 0.00 H ATOM 186 N ILE A 134 5.419 3.176 12.103 1.00 11.80 N ATOM 187 CA ILE A 134 4.902 1.881 11.684 1.00 12.56 C ATOM 188 C ILE A 134 4.720 1.026 12.926 1.00 15.16 C ATOM 189 O ILE A 134 5.664 0.845 13.685 1.00 13.43 O ATOM 190 CB ILE A 134 5.860 1.180 10.705 1.00 16.79 C ATOM 191 CG1 ILE A 134 6.088 2.061 9.467 1.00 21.35 C ATOM 192 CG2 ILE A 134 5.304 -0.171 10.283 1.00 17.10 C ATOM 193 CD1 ILE A 134 7.230 1.608 8.594 1.00 31.56 C ATOM 194 H ILE A 134 6.323 3.207 12.616 1.00 0.00 H ATOM 195 N LEU A 135 3.502 0.534 13.133 1.00 14.93 N ATOM 196 CA LEU A 135 3.175 -0.355 14.239 1.00 13.58 C ATOM 197 C LEU A 135 2.780 -1.721 13.680 1.00 13.74 C ATOM 198 O LEU A 135 2.016 -1.820 12.720 1.00 12.90 O ATOM 199 CB LEU A 135 2.016 0.206 15.054 1.00 21.16 C ATOM 200 CG LEU A 135 2.292 1.467 15.875 1.00 23.56 C ATOM 201 CD1 LEU A 135 0.984 2.041 16.399 1.00 30.70 C ATOM 202 CD2 LEU A 135 3.234 1.139 17.020 1.00 25.08 C ATOM 203 H LEU A 135 2.744 0.798 12.471 1.00 0.00 H ATOM 204 N GLY A 136 3.306 -2.775 14.277 1.00 13.65 N ATOM 205 CA GLY A 136 2.950 -4.119 13.857 1.00 15.22 C ATOM 206 C GLY A 136 3.422 -5.146 14.851 1.00 16.56 C ATOM 207 O GLY A 136 3.862 -4.808 15.956 1.00 14.55 O ATOM 208 H GLY A 136 3.982 -2.641 15.056 1.00 0.00 H ATOM 209 N THR A 137 3.309 -6.406 14.463 1.00 13.49 N ATOM 210 CA THR A 137 3.755 -7.509 15.302 1.00 15.22 C ATOM 211 C THR A 137 4.526 -8.454 14.400 1.00 15.87 C ATOM 212 O THR A 137 4.085 -8.750 13.293 1.00 16.05 O ATOM 213 CB THR A 137 2.565 -8.254 15.946 1.00 19.28 C ATOM 214 OG1 THR A 137 1.829 -7.355 16.783 1.00 21.60 O ATOM 215 CG2 THR A 137 3.047 -9.436 16.781 1.00 18.56 C ATOM 216 HG1 THR A 137 1.068 -7.837 17.193 1.00 0.00 H ATOM 217 H THR A 137 2.890 -6.614 13.534 1.00 0.00 H ATOM 218 N VAL A 138 5.682 -8.915 14.866 1.00 13.83 N ATOM 219 CA VAL A 138 6.479 -9.862 14.097 1.00 15.05 C ATOM 220 C VAL A 138 5.810 -11.231 14.195 1.00 17.38 C ATOM 221 O VAL A 138 5.423 -11.666 15.273 1.00 16.54 O ATOM 222 CB VAL A 138 7.939 -9.946 14.603 1.00 14.36 C ATOM 223 CG1 VAL A 138 8.757 -10.876 13.720 1.00 15.98 C ATOM 224 CG2 VAL A 138 8.577 -8.562 14.641 1.00 15.99 C ATOM 225 H VAL A 138 6.023 -8.595 15.795 1.00 0.00 H ATOM 226 N LYS A 139 5.662 -11.912 13.065 1.00 14.91 N ATOM 227 CA LYS A 139 5.069 -13.253 13.070 1.00 18.18 C ATOM 228 C LYS A 139 5.998 -14.250 13.759 1.00 19.11 C ATOM 229 O LYS A 139 7.206 -14.037 13.812 1.00 19.26 O ATOM 230 CB LYS A 139 4.789 -13.715 11.637 1.00 20.23 C ATOM 231 CG LYS A 139 3.611 -13.009 10.991 1.00 24.61 C ATOM 232 CD LYS A 139 3.459 -13.429 9.540 1.00 32.99 C ATOM 233 CE LYS A 139 2.197 -12.857 8.919 1.00 42.57 C ATOM 234 NZ LYS A 139 1.956 -13.425 7.563 1.00 47.81 N ATOM 235 HZ1 LYS A 139 2.762 -13.198 6.945 1.00 0.00 H ATOM 236 HZ2 LYS A 139 1.852 -14.457 7.634 1.00 0.00 H ATOM 237 HZ3 LYS A 139 1.087 -13.014 7.166 1.00 0.00 H ATOM 238 H LYS A 139 5.970 -11.490 12.166 1.00 0.00 H ATOM 239 N PRO A 140 5.437 -15.347 14.296 1.00 23.22 N ATOM 240 CA PRO A 140 6.307 -16.404 14.815 1.00 28.17 C ATOM 241 C PRO A 140 7.198 -16.964 13.704 1.00 22.12 C ATOM 242 O PRO A 140 6.773 -17.032 12.555 1.00 24.90 O ATOM 243 CB PRO A 140 5.322 -17.465 15.317 1.00 28.89 C ATOM 244 CG PRO A 140 4.037 -16.741 15.539 1.00 28.47 C ATOM 245 CD PRO A 140 4.011 -15.608 14.561 1.00 26.69 C ATOM 246 N ASN A 141 8.432 -17.327 14.035 1.00 30.52 N ATOM 247 CA ASN A 141 9.358 -17.895 13.044 1.00 33.51 C ATOM 248 C ASN A 141 9.553 -16.978 11.829 1.00 27.02 C ATOM 249 O ASN A 141 9.661 -17.435 10.693 1.00 24.96 O ATOM 250 CB ASN A 141 8.879 -19.281 12.585 1.00 40.78 C ATOM 251 CG ASN A 141 8.550 -20.205 13.744 1.00 42.90 C ATOM 252 OD1 ASN A 141 7.467 -20.791 13.796 1.00 57.28 O ATOM 253 ND2 ASN A 141 9.483 -20.340 14.680 1.00 42.34 N ATOM 254 HD22 ASN A 141 10.383 -19.826 14.595 1.00 0.00 H ATOM 255 HD21 ASN A 141 9.313 -20.960 15.498 1.00 0.00 H ATOM 256 H ASN A 141 8.751 -17.207 15.018 1.00 0.00 H ATOM 257 N ALA A 142 9.589 -15.674 12.080 1.00 25.56 N ATOM 258 CA ALA A 142 9.805 -14.697 11.021 1.00 18.41 C ATOM 259 C ALA A 142 11.207 -14.842 10.444 1.00 18.28 C ATOM 260 O ALA A 142 12.136 -15.232 11.148 1.00 18.38 O ATOM 261 CB ALA A 142 9.610 -13.283 11.559 1.00 19.84 C ATOM 262 H ALA A 142 9.460 -15.342 13.057 1.00 0.00 H ATOM 263 N ASN A 143 11.342 -14.533 9.157 1.00 16.89 N ATOM 264 CA ASN A 143 12.630 -14.543 8.464 1.00 17.04 C ATOM 265 C ASN A 143 13.141 -13.137 8.131 1.00 15.79 C ATOM 266 O ASN A 143 14.336 -12.878 8.216 1.00 15.88 O ATOM 267 CB ASN A 143 12.526 -15.359 7.173 1.00 18.97 C ATOM 268 CG ASN A 143 12.561 -16.855 7.423 1.00 21.99 C ATOM 269 OD1 ASN A 143 13.164 -17.318 8.389 1.00 27.97 O ATOM 270 ND2 ASN A 143 11.921 -17.618 6.545 1.00 27.51 N ATOM 271 HD22 ASN A 143 11.424 -17.182 5.742 1.00 0.00 H ATOM 272 HD21 ASN A 143 11.917 -18.652 6.660 1.00 0.00 H ATOM 273 H ASN A 143 10.492 -14.272 8.618 1.00 0.00 H ATOM 274 N ARG A 144 12.242 -12.237 7.745 1.00 16.42 N ATOM 275 CA ARG A 144 12.646 -10.895 7.317 1.00 16.40 C ATOM 276 C ARG A 144 11.555 -9.846 7.475 1.00 14.31 C ATOM 277 O ARG A 144 10.366 -10.156 7.511 1.00 16.47 O ATOM 278 CB ARG A 144 13.097 -10.937 5.856 1.00 19.62 C ATOM 279 CG ARG A 144 11.970 -11.251 4.882 1.00 25.05 C ATOM 280 CD ARG A 144 12.478 -11.475 3.470 1.00 34.04 C ATOM 281 NE ARG A 144 13.049 -10.269 2.867 1.00 31.78 N ATOM 282 CZ ARG A 144 12.353 -9.274 2.313 1.00 34.95 C ATOM 283 NH1 ARG A 144 11.023 -9.289 2.288 1.00 40.59 N ATOM 284 NH2 ARG A 144 12.999 -8.238 1.788 1.00 33.55 N ATOM 285 HE ARG A 144 14.085 -10.180 2.871 1.00 0.00 H ATOM 286 HH12 ARG A 144 10.502 -8.502 1.851 1.00 0.00 H ATOM 287 HH11 ARG A 144 10.504 -10.088 2.706 1.00 0.00 H ATOM 288 HH22 ARG A 144 12.465 -7.458 1.354 1.00 0.00 H ATOM 289 HH21 ARG A 144 14.038 -8.207 1.811 1.00 0.00 H ATOM 290 H ARG A 144 11.233 -12.490 7.747 1.00 0.00 H ATOM 291 N ILE A 145 11.996 -8.599 7.580 1.00 12.69 N ATOM 292 CA ILE A 145 11.139 -7.426 7.467 1.00 12.72 C ATOM 293 C ILE A 145 11.840 -6.513 6.464 1.00 13.09 C ATOM 294 O ILE A 145 13.076 -6.518 6.393 1.00 11.97 O ATOM 295 CB ILE A 145 11.004 -6.694 8.818 1.00 16.37 C ATOM 296 CG1 ILE A 145 10.405 -7.624 9.880 1.00 18.28 C ATOM 297 CG2 ILE A 145 10.153 -5.438 8.665 1.00 19.30 C ATOM 298 CD1 ILE A 145 10.509 -7.082 11.287 1.00 22.59 C ATOM 299 H ILE A 145 13.011 -8.450 7.753 1.00 0.00 H ATOM 300 N ALA A 146 11.078 -5.764 5.669 1.00 11.84 N ATOM 301 CA ALA A 146 11.676 -4.773 4.771 1.00 12.79 C ATOM 302 C ALA A 146 10.834 -3.506 4.677 1.00 13.62 C ATOM 303 O ALA A 146 9.626 -3.578 4.434 1.00 13.48 O ATOM 304 CB ALA A 146 11.896 -5.345 3.382 1.00 14.69 C ATOM 305 H ALA A 146 10.045 -5.884 5.686 1.00 0.00 H ATOM 306 N LEU A 147 11.482 -2.361 4.883 1.00 10.56 N ATOM 307 CA LEU A 147 10.922 -1.056 4.532 1.00 10.19 C ATOM 308 C LEU A 147 11.714 -0.539 3.341 1.00 11.93 C ATOM 309 O LEU A 147 12.950 -0.486 3.389 1.00 11.30 O ATOM 310 CB LEU A 147 11.035 -0.051 5.684 1.00 13.60 C ATOM 311 CG LEU A 147 10.472 -0.388 7.066 1.00 20.70 C ATOM 312 CD1 LEU A 147 10.451 0.876 7.912 1.00 25.16 C ATOM 313 CD2 LEU A 147 9.094 -1.004 6.992 1.00 24.52 C ATOM 314 H LEU A 147 12.428 -2.396 5.313 1.00 0.00 H ATOM 315 N ASP A 148 11.016 -0.182 2.266 1.00 9.57 N ATOM 316 CA ASP A 148 11.658 0.317 1.065 1.00 11.00 C ATOM 317 C ASP A 148 11.124 1.691 0.686 1.00 9.57 C ATOM 318 O ASP A 148 9.990 1.824 0.231 1.00 11.70 O ATOM 319 CB ASP A 148 11.444 -0.652 -0.088 1.00 13.44 C ATOM 320 CG ASP A 148 12.246 -1.918 0.078 1.00 17.15 C ATOM 321 OD1 ASP A 148 13.481 -1.815 0.152 1.00 18.79 O ATOM 322 OD2 ASP A 148 11.649 -3.004 0.157 1.00 23.54 O ATOM 323 H ASP A 148 9.979 -0.263 2.288 1.00 0.00 H ATOM 324 N PHE A 149 11.953 2.704 0.876 1.00 9.59 N ATOM 325 CA PHE A 149 11.633 4.047 0.419 1.00 8.57 C ATOM 326 C PHE A 149 12.044 4.127 -1.043 1.00 9.78 C ATOM 327 O PHE A 149 13.239 4.035 -1.351 1.00 11.93 O ATOM 328 CB PHE A 149 12.389 5.087 1.222 1.00 10.15 C ATOM 329 CG PHE A 149 11.873 5.267 2.613 1.00 10.26 C ATOM 330 CD1 PHE A 149 12.315 4.447 3.642 1.00 12.13 C ATOM 331 CD2 PHE A 149 10.952 6.257 2.897 1.00 13.62 C ATOM 332 CE1 PHE A 149 11.834 4.610 4.933 1.00 14.59 C ATOM 333 CE2 PHE A 149 10.468 6.423 4.179 1.00 16.37 C ATOM 334 CZ PHE A 149 10.913 5.607 5.199 1.00 16.62 C ATOM 335 H PHE A 149 12.856 2.536 1.364 1.00 0.00 H ATOM 336 N GLN A 150 11.061 4.313 -1.924 1.00 9.61 N ATOM 337 CA GLN A 150 11.251 4.240 -3.376 1.00 10.16 C ATOM 338 C GLN A 150 11.288 5.611 -4.051 1.00 10.85 C ATOM 339 O GLN A 150 10.572 6.535 -3.658 1.00 10.58 O ATOM 340 CB GLN A 150 10.113 3.430 -4.007 1.00 11.88 C ATOM 341 CG GLN A 150 9.923 2.047 -3.408 1.00 14.78 C ATOM 342 CD GLN A 150 10.625 0.956 -4.194 1.00 17.34 C ATOM 343 OE1 GLN A 150 11.117 1.181 -5.306 1.00 24.84 O ATOM 344 NE2 GLN A 150 10.661 -0.241 -3.628 1.00 18.70 N ATOM 345 HE22 GLN A 150 10.234 -0.386 -2.691 1.00 0.00 H ATOM 346 HE21 GLN A 150 11.116 -1.036 -4.121 1.00 0.00 H ATOM 347 H GLN A 150 10.108 4.521 -1.562 1.00 0.00 H ATOM 348 N ARG A 151 12.131 5.719 -5.075 1.00 11.38 N ATOM 349 CA ARG A 151 12.127 6.838 -6.003 1.00 11.05 C ATOM 350 C ARG A 151 11.940 6.182 -7.363 1.00 10.68 C ATOM 351 O ARG A 151 12.908 5.715 -7.957 1.00 10.87 O ATOM 352 CB ARG A 151 13.449 7.604 -5.949 1.00 10.33 C ATOM 353 CG ARG A 151 13.567 8.671 -7.031 1.00 12.89 C ATOM 354 CD ARG A 151 14.827 9.529 -6.948 1.00 18.07 C ATOM 355 NE ARG A 151 14.919 10.416 -8.115 1.00 15.47 N ATOM 356 CZ ARG A 151 15.745 10.263 -9.160 1.00 15.92 C ATOM 357 NH1 ARG A 151 16.625 9.265 -9.223 1.00 19.76 N ATOM 358 NH2 ARG A 151 15.687 11.130 -10.167 1.00 18.01 N ATOM 359 HE ARG A 151 14.284 11.240 -8.132 1.00 0.00 H ATOM 360 HH12 ARG A 151 17.251 9.175 -10.048 1.00 0.00 H ATOM 361 HH11 ARG A 151 16.686 8.576 -8.447 1.00 0.00 H ATOM 362 HH22 ARG A 151 16.322 11.022 -10.983 1.00 0.00 H ATOM 363 HH21 ARG A 151 15.006 11.916 -10.138 1.00 0.00 H ATOM 364 H ARG A 151 12.830 4.963 -5.219 1.00 0.00 H ATOM 365 N GLY A 152 10.690 6.078 -7.817 1.00 10.14 N ATOM 366 CA GLY A 152 10.386 5.280 -9.012 1.00 12.39 C ATOM 367 C GLY A 152 10.851 3.847 -8.770 1.00 12.69 C ATOM 368 O GLY A 152 10.566 3.273 -7.718 1.00 14.43 O ATOM 369 H GLY A 152 9.920 6.568 -7.318 1.00 0.00 H ATOM 370 N ASN A 153 11.619 3.291 -9.703 1.00 12.81 N ATOM 371 CA ASN A 153 12.145 1.926 -9.575 1.00 13.62 C ATOM 372 C ASN A 153 13.337 1.819 -8.616 1.00 12.95 C ATOM 373 O ASN A 153 13.693 0.722 -8.183 1.00 14.55 O ATOM 374 CB ASN A 153 12.541 1.373 -10.950 1.00 13.45 C ATOM 375 CG ASN A 153 12.960 -0.087 -10.903 1.00 16.11 C ATOM 376 OD1 ASN A 153 12.179 -0.952 -10.512 1.00 19.07 O ATOM 377 ND2 ASN A 153 14.203 -0.364 -11.282 1.00 16.81 N ATOM 378 HD22 ASN A 153 14.830 0.400 -11.606 1.00 0.00 H ATOM 379 HD21 ASN A 153 14.549 -1.344 -11.255 1.00 0.00 H ATOM 380 H ASN A 153 11.855 3.842 -10.553 1.00 0.00 H ATOM 381 N ASP A 154 13.969 2.946 -8.299 1.00 10.59 N ATOM 382 CA ASP A 154 15.110 2.935 -7.403 1.00 9.32 C ATOM 383 C ASP A 154 14.622 2.833 -5.972 1.00 11.70 C ATOM 384 O ASP A 154 13.533 3.316 -5.650 1.00 13.43 O ATOM 385 CB ASP A 154 15.957 4.197 -7.548 1.00 10.32 C ATOM 386 CG ASP A 154 16.803 4.208 -8.812 1.00 12.20 C ATOM 387 OD1 ASP A 154 16.892 3.176 -9.508 1.00 14.17 O ATOM 388 OD2 ASP A 154 17.382 5.267 -9.102 1.00 14.59 O ATOM 389 H ASP A 154 13.640 3.848 -8.699 1.00 0.00 H ATOM 390 N VAL A 155 15.447 2.227 -5.121 1.00 10.99 N ATOM 391 CA VAL A 155 15.178 2.165 -3.692 1.00 10.25 C ATOM 392 C VAL A 155 16.166 3.073 -2.990 1.00 11.83 C ATOM 393 O VAL A 155 17.348 2.755 -2.884 1.00 12.45 O ATOM 394 CB VAL A 155 15.281 0.736 -3.132 1.00 11.62 C ATOM 395 CG1 VAL A 155 15.096 0.761 -1.621 1.00 10.90 C ATOM 396 CG2 VAL A 155 14.259 -0.180 -3.784 1.00 16.38 C ATOM 397 H VAL A 155 16.312 1.783 -5.489 1.00 0.00 H ATOM 398 N ALA A 156 15.676 4.214 -2.512 1.00 10.84 N ATOM 399 CA ALA A 156 16.524 5.178 -1.824 1.00 10.93 C ATOM 400 C ALA A 156 17.076 4.653 -0.506 1.00 10.40 C ATOM 401 O ALA A 156 18.217 4.922 -0.157 1.00 10.23 O ATOM 402 CB ALA A 156 15.740 6.456 -1.580 1.00 12.39 C ATOM 403 H ALA A 156 14.664 4.422 -2.632 1.00 0.00 H ATOM 404 N PHE A 157 16.244 3.932 0.235 1.00 10.26 N ATOM 405 CA PHE A 157 16.603 3.412 1.552 1.00 10.12 C ATOM 406 C PHE A 157 15.828 2.118 1.770 1.00 8.36 C ATOM 407 O PHE A 157 14.592 2.119 1.834 1.00 9.94 O ATOM 408 CB PHE A 157 16.318 4.463 2.634 1.00 9.92 C ATOM 409 CG PHE A 157 16.570 4.011 4.058 1.00 9.82 C ATOM 410 CD1 PHE A 157 17.664 3.221 4.400 1.00 10.46 C ATOM 411 CD2 PHE A 157 15.719 4.420 5.073 1.00 12.05 C ATOM 412 CE1 PHE A 157 17.880 2.833 5.710 1.00 14.86 C ATOM 413 CE2 PHE A 157 15.944 4.045 6.389 1.00 11.26 C ATOM 414 CZ PHE A 157 17.019 3.246 6.707 1.00 12.76 C ATOM 415 H PHE A 157 15.295 3.728 -0.138 1.00 0.00 H ATOM 416 N HIS A 158 16.590 1.028 1.837 1.00 8.21 N ATOM 417 CA HIS A 158 16.124 -0.333 2.119 1.00 8.22 C ATOM 418 C HIS A 158 16.580 -0.629 3.522 1.00 10.40 C ATOM 419 O HIS A 158 17.783 -0.627 3.786 1.00 12.09 O ATOM 420 CB HIS A 158 16.779 -1.267 1.112 1.00 11.31 C ATOM 421 CG HIS A 158 16.525 -2.740 1.313 1.00 11.00 C ATOM 422 ND1 HIS A 158 15.337 -3.323 1.055 1.00 13.81 N ATOM 423 CD2 HIS A 158 17.408 -3.773 1.600 1.00 13.83 C ATOM 424 CE1 HIS A 158 15.444 -4.654 1.235 1.00 13.28 C ATOM 425 NE2 HIS A 158 16.708 -4.928 1.565 1.00 14.57 N ATOM 426 H HIS A 158 17.609 1.154 1.674 1.00 0.00 H ATOM 427 N PHE A 159 15.621 -0.834 4.424 1.00 8.44 N ATOM 428 CA PHE A 159 15.852 -1.188 5.835 1.00 9.52 C ATOM 429 C PHE A 159 15.354 -2.621 6.030 1.00 9.06 C ATOM 430 O PHE A 159 14.153 -2.876 5.925 1.00 10.79 O ATOM 431 CB PHE A 159 15.099 -0.205 6.742 1.00 11.44 C ATOM 432 CG PHE A 159 15.105 -0.561 8.218 1.00 11.18 C ATOM 433 CD1 PHE A 159 16.163 -0.187 9.030 1.00 13.50 C ATOM 434 CD2 PHE A 159 14.029 -1.226 8.792 1.00 11.44 C ATOM 435 CE1 PHE A 159 16.166 -0.490 10.386 1.00 15.03 C ATOM 436 CE2 PHE A 159 14.027 -1.538 10.143 1.00 14.60 C ATOM 437 CZ PHE A 159 15.096 -1.165 10.941 1.00 14.26 C ATOM 438 H PHE A 159 14.635 -0.737 4.108 1.00 0.00 H ATOM 439 N ASN A 160 16.267 -3.541 6.330 1.00 10.26 N ATOM 440 CA ASN A 160 15.991 -4.976 6.164 1.00 11.86 C ATOM 441 C ASN A 160 16.519 -5.828 7.324 1.00 10.84 C ATOM 442 O ASN A 160 17.610 -6.389 7.261 1.00 11.99 O ATOM 443 CB ASN A 160 16.565 -5.411 4.805 1.00 12.24 C ATOM 444 CG ASN A 160 16.416 -6.894 4.499 1.00 15.76 C ATOM 445 OD1 ASN A 160 17.253 -7.449 3.781 1.00 15.81 O ATOM 446 ND2 ASN A 160 15.381 -7.540 5.021 1.00 14.89 N ATOM 447 HD22 ASN A 160 14.700 -7.032 5.621 1.00 0.00 H ATOM 448 HD21 ASN A 160 15.251 -8.554 4.830 1.00 0.00 H ATOM 449 H ASN A 160 17.195 -3.239 6.689 1.00 0.00 H ATOM 450 N PRO A 161 15.737 -5.916 8.407 1.00 11.64 N ATOM 451 CA PRO A 161 16.036 -6.869 9.467 1.00 12.60 C ATOM 452 C PRO A 161 15.949 -8.312 8.966 1.00 11.97 C ATOM 453 O PRO A 161 14.950 -8.703 8.351 1.00 14.12 O ATOM 454 CB PRO A 161 14.966 -6.573 10.517 1.00 12.29 C ATOM 455 CG PRO A 161 14.589 -5.149 10.270 1.00 11.21 C ATOM 456 CD PRO A 161 14.637 -5.008 8.776 1.00 10.25 C ATOM 457 N ARG A 162 17.013 -9.070 9.207 1.00 12.46 N ATOM 458 CA ARG A 162 17.090 -10.479 8.838 1.00 13.24 C ATOM 459 C ARG A 162 17.244 -11.300 10.112 1.00 14.91 C ATOM 460 O ARG A 162 18.151 -11.059 10.906 1.00 15.93 O ATOM 461 CB ARG A 162 18.275 -10.713 7.902 1.00 15.73 C ATOM 462 CG ARG A 162 18.190 -9.898 6.628 1.00 15.23 C ATOM 463 CD ARG A 162 19.377 -10.132 5.720 1.00 17.00 C ATOM 464 NE ARG A 162 19.225 -9.358 4.489 1.00 16.57 N ATOM 465 CZ ARG A 162 20.115 -9.331 3.503 1.00 20.48 C ATOM 466 NH1 ARG A 162 21.237 -10.038 3.588 1.00 21.94 N ATOM 467 NH2 ARG A 162 19.876 -8.592 2.428 1.00 20.52 N ATOM 468 HE ARG A 162 18.361 -8.790 4.378 1.00 0.00 H ATOM 469 HH12 ARG A 162 21.929 -10.011 2.812 1.00 0.00 H ATOM 470 HH11 ARG A 162 21.424 -10.618 4.431 1.00 0.00 H ATOM 471 HH22 ARG A 162 20.567 -8.565 1.651 1.00 0.00 H ATOM 472 HH21 ARG A 162 18.997 -8.040 2.362 1.00 0.00 H ATOM 473 H ARG A 162 17.831 -8.638 9.682 1.00 0.00 H ATOM 474 N PHE A 163 16.346 -12.259 10.310 1.00 16.02 N ATOM 475 CA PHE A 163 16.288 -13.018 11.561 1.00 15.91 C ATOM 476 C PHE A 163 17.216 -14.232 11.560 1.00 16.44 C ATOM 477 O PHE A 163 17.549 -14.766 12.617 1.00 18.87 O ATOM 478 CB PHE A 163 14.849 -13.458 11.838 1.00 16.38 C ATOM 479 CG PHE A 163 13.952 -12.339 12.273 1.00 17.56 C ATOM 480 CD1 PHE A 163 13.487 -11.412 11.355 1.00 16.93 C ATOM 481 CD2 PHE A 163 13.581 -12.204 13.605 1.00 20.55 C ATOM 482 CE1 PHE A 163 12.668 -10.370 11.749 1.00 18.72 C ATOM 483 CE2 PHE A 163 12.757 -11.165 14.006 1.00 19.29 C ATOM 484 CZ PHE A 163 12.304 -10.246 13.077 1.00 20.03 C ATOM 485 H PHE A 163 15.665 -12.477 9.555 1.00 0.00 H ATOM 486 N ASN A 164 17.607 -14.686 10.376 1.00 17.06 N ATOM 487 CA ASN A 164 18.494 -15.837 10.258 1.00 21.25 C ATOM 488 C ASN A 164 19.373 -15.713 9.026 1.00 23.04 C ATOM 489 O ASN A 164 19.089 -16.303 7.980 1.00 29.40 O ATOM 490 CB ASN A 164 17.680 -17.138 10.220 1.00 26.18 C ATOM 491 CG ASN A 164 18.553 -18.390 10.245 1.00 37.79 C ATOM 492 OD1 ASN A 164 19.781 -18.315 10.307 1.00 33.22 O ATOM 493 ND2 ASN A 164 17.913 -19.554 10.188 1.00 47.79 N ATOM 494 HD22 ASN A 164 16.874 -19.574 10.137 1.00 0.00 H ATOM 495 HD21 ASN A 164 18.451 -20.444 10.195 1.00 0.00 H ATOM 496 H ASN A 164 17.273 -14.210 9.513 1.00 0.00 H ATOM 497 N GLU A 165 20.439 -14.933 9.156 1.00 21.45 N ATOM 498 CA GLU A 165 21.485 -14.904 8.147 1.00 25.01 C ATOM 499 C GLU A 165 22.697 -15.613 8.726 1.00 23.81 C ATOM 500 O GLU A 165 23.382 -15.076 9.601 1.00 23.64 O ATOM 501 CB GLU A 165 21.834 -13.474 7.741 1.00 28.55 C ATOM 502 CG GLU A 165 22.614 -13.420 6.437 1.00 34.30 C ATOM 503 CD GLU A 165 23.310 -12.097 6.217 1.00 37.08 C ATOM 504 OE1 GLU A 165 24.076 -11.669 7.103 1.00 37.71 O ATOM 505 OE2 GLU A 165 23.109 -11.487 5.150 1.00 40.06 O ATOM 506 H GLU A 165 20.528 -14.329 9.998 1.00 0.00 H ATOM 507 N ASN A 166 22.935 -16.842 8.265 1.00 25.30 N ATOM 508 CA ASN A 166 23.992 -17.684 8.805 1.00 27.59 C ATOM 509 C ASN A 166 23.867 -17.820 10.325 1.00 24.07 C ATOM 510 O ASN A 166 24.856 -17.741 11.051 1.00 25.61 O ATOM 511 CB ASN A 166 25.369 -17.137 8.411 1.00 35.14 C ATOM 512 CG ASN A 166 25.538 -17.009 6.908 1.00 44.39 C ATOM 513 OD1 ASN A 166 24.966 -17.783 6.138 1.00 56.59 O ATOM 514 ND2 ASN A 166 26.329 -16.029 6.481 1.00 57.35 N ATOM 515 HD22 ASN A 166 26.792 -15.399 7.166 1.00 0.00 H ATOM 516 HD21 ASN A 166 26.484 -15.893 5.462 1.00 0.00 H ATOM 517 H ASN A 166 22.344 -17.211 7.493 1.00 0.00 H ATOM 518 N ASN A 167 22.631 -18.013 10.786 1.00 22.70 N ATOM 519 CA ASN A 167 22.312 -18.171 12.213 1.00 23.60 C ATOM 520 C ASN A 167 22.630 -16.955 13.091 1.00 23.25 C ATOM 521 O ASN A 167 22.844 -17.088 14.301 1.00 24.22 O ATOM 522 CB ASN A 167 22.959 -19.442 12.756 1.00 25.59 C ATOM 523 CG ASN A 167 22.495 -20.674 12.009 1.00 28.93 C ATOM 524 OD1 ASN A 167 21.302 -20.976 11.986 1.00 33.27 O ATOM 525 ND2 ASN A 167 23.422 -21.367 11.370 1.00 29.00 N ATOM 526 HD22 ASN A 167 24.418 -21.072 11.419 1.00 0.00 H ATOM 527 HD21 ASN A 167 23.155 -22.207 10.818 1.00 0.00 H ATOM 528 H ASN A 167 21.851 -18.054 10.100 1.00 0.00 H ATOM 529 N ARG A 168 22.635 -15.782 12.460 1.00 21.53 N ATOM 530 CA ARG A 168 22.832 -14.496 13.122 1.00 22.69 C ATOM 531 C ARG A 168 21.623 -13.617 12.812 1.00 20.99 C ATOM 532 O ARG A 168 20.973 -13.798 11.784 1.00 19.85 O ATOM 533 CB ARG A 168 24.091 -13.803 12.585 1.00 24.79 C ATOM 534 CG ARG A 168 25.355 -14.652 12.582 1.00 27.68 C ATOM 535 CD ARG A 168 26.059 -14.625 13.924 1.00 29.18 C ATOM 536 NE ARG A 168 27.201 -15.542 13.971 1.00 32.75 N ATOM 537 CZ ARG A 168 28.464 -15.231 13.667 1.00 31.72 C ATOM 538 NH1 ARG A 168 28.806 -14.004 13.278 1.00 29.26 N ATOM 539 NH2 ARG A 168 29.405 -16.165 13.758 1.00 32.10 N ATOM 540 HE ARG A 168 27.012 -16.521 14.267 1.00 0.00 H ATOM 541 HH12 ARG A 168 29.797 -13.789 13.047 1.00 0.00 H ATOM 542 HH11 ARG A 168 28.082 -13.261 13.205 1.00 0.00 H ATOM 543 HH22 ARG A 168 30.392 -15.934 13.524 1.00 0.00 H ATOM 544 HH21 ARG A 168 29.155 -17.127 14.063 1.00 0.00 H ATOM 545 H ARG A 168 22.489 -15.782 11.430 1.00 0.00 H ATOM 546 N ARG A 169 21.323 -12.674 13.701 1.00 19.45 N ATOM 547 CA ARG A 169 20.297 -11.660 13.439 1.00 17.62 C ATOM 548 C ARG A 169 21.038 -10.377 13.086 1.00 16.67 C ATOM 549 O ARG A 169 21.953 -9.968 13.803 1.00 18.11 O ATOM 550 CB ARG A 169 19.411 -11.464 14.668 1.00 22.56 C ATOM 551 CG ARG A 169 18.865 -12.773 15.224 1.00 21.15 C ATOM 552 CD ARG A 169 17.676 -12.549 16.138 1.00 29.47 C ATOM 553 NE ARG A 169 18.053 -11.930 17.405 1.00 31.64 N ATOM 554 CZ ARG A 169 17.190 -11.517 18.332 1.00 46.21 C ATOM 555 NH1 ARG A 169 15.877 -11.649 18.147 1.00 39.53 N ATOM 556 NH2 ARG A 169 17.643 -10.963 19.453 1.00 47.74 N ATOM 557 HE ARG A 169 19.067 -11.802 17.598 1.00 0.00 H ATOM 558 HH12 ARG A 169 15.213 -11.323 18.878 1.00 0.00 H ATOM 559 HH11 ARG A 169 15.516 -12.078 17.271 1.00 0.00 H ATOM 560 HH22 ARG A 169 16.974 -10.639 20.180 1.00 0.00 H ATOM 561 HH21 ARG A 169 18.666 -10.854 19.603 1.00 0.00 H ATOM 562 H ARG A 169 21.831 -12.656 14.608 1.00 0.00 H ATOM 563 N VAL A 170 20.674 -9.768 11.962 1.00 14.42 N ATOM 564 CA VAL A 170 21.359 -8.570 11.478 1.00 15.06 C ATOM 565 C VAL A 170 20.377 -7.665 10.752 1.00 16.17 C ATOM 566 O VAL A 170 19.401 -8.136 10.171 1.00 15.17 O ATOM 567 CB VAL A 170 22.532 -8.941 10.538 1.00 17.80 C ATOM 568 CG1 VAL A 170 22.031 -9.640 9.282 1.00 21.46 C ATOM 569 CG2 VAL A 170 23.367 -7.718 10.186 1.00 23.79 C ATOM 570 H VAL A 170 19.880 -10.154 11.412 1.00 0.00 H ATOM 571 N ILE A 171 20.642 -6.364 10.797 1.00 13.92 N ATOM 572 CA ILE A 171 19.895 -5.403 10.002 1.00 14.68 C ATOM 573 C ILE A 171 20.781 -4.940 8.857 1.00 12.63 C ATOM 574 O ILE A 171 21.905 -4.485 9.078 1.00 16.23 O ATOM 575 CB ILE A 171 19.435 -4.214 10.854 1.00 17.85 C ATOM 576 CG1 ILE A 171 18.456 -4.718 11.922 1.00 21.12 C ATOM 577 CG2 ILE A 171 18.782 -3.153 9.979 1.00 17.85 C ATOM 578 CD1 ILE A 171 18.033 -3.679 12.930 1.00 24.28 C ATOM 579 H ILE A 171 21.404 -6.024 11.418 1.00 0.00 H ATOM 580 N VAL A 172 20.273 -5.098 7.639 1.00 12.17 N ATOM 581 CA VAL A 172 20.966 -4.672 6.436 1.00 13.21 C ATOM 582 C VAL A 172 20.290 -3.420 5.903 1.00 13.67 C ATOM 583 O VAL A 172 19.068 -3.387 5.764 1.00 13.40 O ATOM 584 CB VAL A 172 20.942 -5.766 5.349 1.00 15.67 C ATOM 585 CG1 VAL A 172 21.577 -5.262 4.052 1.00 20.10 C ATOM 586 CG2 VAL A 172 21.656 -7.017 5.852 1.00 21.14 C ATOM 587 H VAL A 172 19.339 -5.546 7.543 1.00 0.00 H ATOM 588 N CYS A 173 21.094 -2.400 5.616 1.00 13.40 N ATOM 589 CA CYS A 173 20.621 -1.172 4.975 1.00 13.45 C ATOM 590 C CYS A 173 21.362 -0.954 3.667 1.00 13.44 C ATOM 591 O CYS A 173 22.580 -1.158 3.593 1.00 15.46 O ATOM 592 CB CYS A 173 20.844 0.025 5.886 1.00 14.28 C ATOM 593 SG CYS A 173 19.866 -0.033 7.406 1.00 18.72 S ATOM 594 H CYS A 173 22.103 -2.478 5.858 1.00 0.00 H ATOM 595 N ASN A 174 20.632 -0.538 2.635 1.00 11.77 N ATOM 596 CA ASN A 174 21.211 -0.356 1.317 1.00 12.31 C ATOM 597 C ASN A 174 20.354 0.538 0.421 1.00 11.42 C ATOM 598 O ASN A 174 19.242 0.938 0.790 1.00 11.45 O ATOM 599 CB ASN A 174 21.443 -1.729 0.654 1.00 14.95 C ATOM 600 CG ASN A 174 22.625 -1.742 -0.308 1.00 15.91 C ATOM 601 OD1 ASN A 174 23.171 -0.695 -0.677 1.00 15.26 O ATOM 602 ND2 ASN A 174 23.018 -2.940 -0.735 1.00 15.76 N ATOM 603 HD22 ASN A 174 22.532 -3.796 -0.400 1.00 0.00 H ATOM 604 HD21 ASN A 174 23.811 -3.020 -1.403 1.00 0.00 H ATOM 605 H ASN A 174 19.621 -0.338 2.777 1.00 0.00 H ATOM 606 N THR A 175 20.889 0.845 -0.754 1.00 10.74 N ATOM 607 CA THR A 175 20.224 1.631 -1.781 1.00 11.94 C ATOM 608 C THR A 175 20.338 0.859 -3.088 1.00 13.95 C ATOM 609 O THR A 175 21.384 0.265 -3.371 1.00 13.81 O ATOM 610 CB THR A 175 20.911 3.008 -1.920 1.00 11.68 C ATOM 611 OG1 THR A 175 20.670 3.769 -0.734 1.00 12.32 O ATOM 612 CG2 THR A 175 20.423 3.799 -3.126 1.00 12.69 C ATOM 613 HG1 THR A 175 21.041 3.287 0.047 1.00 0.00 H ATOM 614 H THR A 175 21.849 0.500 -0.954 1.00 0.00 H ATOM 615 N LYS A 176 19.266 0.857 -3.874 1.00 13.12 N ATOM 616 CA LYS A 176 19.272 0.211 -5.188 1.00 12.36 C ATOM 617 C LYS A 176 19.109 1.260 -6.277 1.00 14.91 C ATOM 618 O LYS A 176 18.095 1.965 -6.306 1.00 12.59 O ATOM 619 CB LYS A 176 18.156 -0.831 -5.291 1.00 13.29 C ATOM 620 CG LYS A 176 18.259 -1.708 -6.531 1.00 18.70 C ATOM 621 CD LYS A 176 17.305 -2.893 -6.490 1.00 27.34 C ATOM 622 CE LYS A 176 15.889 -2.506 -6.856 1.00 31.39 C ATOM 623 NZ LYS A 176 15.030 -3.712 -7.046 1.00 38.08 N ATOM 624 HZ1 LYS A 176 15.422 -4.298 -7.810 1.00 0.00 H ATOM 625 HZ2 LYS A 176 15.006 -4.262 -6.163 1.00 0.00 H ATOM 626 HZ3 LYS A 176 14.066 -3.413 -7.296 1.00 0.00 H ATOM 627 H LYS A 176 18.398 1.328 -3.546 1.00 0.00 H ATOM 628 N LEU A 177 20.100 1.357 -7.166 1.00 14.99 N ATOM 629 CA LEU A 177 20.076 2.310 -8.268 1.00 16.68 C ATOM 630 C LEU A 177 20.188 1.584 -9.603 1.00 16.98 C ATOM 631 O LEU A 177 21.095 0.769 -9.803 1.00 17.69 O ATOM 632 CB LEU A 177 21.220 3.322 -8.136 1.00 16.28 C ATOM 633 CG LEU A 177 21.217 4.149 -6.849 1.00 16.29 C ATOM 634 CD1 LEU A 177 22.485 4.982 -6.734 1.00 25.01 C ATOM 635 CD2 LEU A 177 19.985 5.037 -6.780 1.00 20.65 C ATOM 636 H LEU A 177 20.922 0.727 -7.068 1.00 0.00 H ATOM 637 N ASP A 178 19.258 1.868 -10.511 1.00 19.18 N ATOM 638 CA ASP A 178 19.261 1.251 -11.841 1.00 20.83 C ATOM 639 C ASP A 178 19.322 -0.280 -11.761 1.00 21.10 C ATOM 640 O ASP A 178 20.051 -0.922 -12.524 1.00 22.35 O ATOM 641 CB ASP A 178 20.421 1.800 -12.688 1.00 23.90 C ATOM 642 CG ASP A 178 20.253 3.272 -13.042 1.00 28.11 C ATOM 643 OD1 ASP A 178 19.101 3.757 -13.101 1.00 30.79 O ATOM 644 OD2 ASP A 178 21.276 3.944 -13.278 1.00 41.48 O ATOM 645 H ASP A 178 18.508 2.547 -10.271 1.00 0.00 H ATOM 646 N ASN A 179 18.555 -0.845 -10.824 1.00 19.23 N ATOM 647 CA ASN A 179 18.470 -2.290 -10.587 1.00 23.34 C ATOM 648 C ASN A 179 19.707 -2.934 -9.930 1.00 22.91 C ATOM 649 O ASN A 179 19.781 -4.155 -9.829 1.00 32.84 O ATOM 650 CB ASN A 179 18.094 -3.042 -11.887 1.00 28.51 C ATOM 651 CG ASN A 179 16.701 -3.654 -11.843 1.00 33.68 C ATOM 652 OD1 ASN A 179 15.796 -3.153 -11.168 1.00 34.21 O ATOM 653 ND2 ASN A 179 16.521 -4.745 -12.583 1.00 34.35 N ATOM 654 HD22 ASN A 179 17.311 -5.134 -13.137 1.00 0.00 H ATOM 655 HD21 ASN A 179 15.590 -5.209 -12.608 1.00 0.00 H ATOM 656 H ASN A 179 17.981 -0.219 -10.224 1.00 0.00 H ATOM 657 N ASN A 180 20.654 -2.118 -9.470 1.00 22.42 N ATOM 658 CA ASN A 180 21.875 -2.607 -8.821 1.00 22.78 C ATOM 659 C ASN A 180 21.963 -2.172 -7.358 1.00 22.52 C ATOM 660 O ASN A 180 21.859 -0.985 -7.055 1.00 18.34 O ATOM 661 CB ASN A 180 23.103 -2.092 -9.568 1.00 29.89 C ATOM 662 CG ASN A 180 23.188 -2.614 -10.992 1.00 36.53 C ATOM 663 OD1 ASN A 180 22.883 -3.777 -11.260 1.00 44.95 O ATOM 664 ND2 ASN A 180 23.614 -1.755 -11.913 1.00 43.03 N ATOM 665 HD22 ASN A 180 23.861 -0.782 -11.642 1.00 0.00 H ATOM 666 HD21 ASN A 180 23.700 -2.056 -12.905 1.00 0.00 H ATOM 667 H ASN A 180 20.522 -1.092 -9.575 1.00 0.00 H ATOM 668 N TRP A 181 22.176 -3.132 -6.460 1.00 19.34 N ATOM 669 CA TRP A 181 22.373 -2.825 -5.038 1.00 19.51 C ATOM 670 C TRP A 181 23.735 -2.237 -4.803 1.00 23.56 C ATOM 671 O TRP A 181 24.703 -2.606 -5.472 1.00 22.56 O ATOM 672 CB TRP A 181 22.181 -4.075 -4.183 1.00 18.45 C ATOM 673 CG TRP A 181 20.734 -4.454 -4.027 1.00 20.35 C ATOM 674 CD1 TRP A 181 20.065 -5.532 -4.605 1.00 25.63 C ATOM 675 CD2 TRP A 181 19.713 -3.741 -3.258 1.00 18.49 C ATOM 676 NE1 TRP A 181 18.741 -5.537 -4.239 1.00 25.64 N ATOM 677 CE2 TRP A 181 18.468 -4.489 -3.430 1.00 21.30 C ATOM 678 CE3 TRP A 181 19.708 -2.598 -2.462 1.00 16.08 C ATOM 679 CZ2 TRP A 181 17.283 -4.089 -2.829 1.00 21.22 C ATOM 680 CZ3 TRP A 181 18.509 -2.214 -1.853 1.00 16.19 C ATOM 681 CH2 TRP A 181 17.329 -2.942 -2.034 1.00 19.06 C ATOM 682 HE1 TRP A 181 18.045 -6.248 -4.542 1.00 0.00 H ATOM 683 H TRP A 181 22.203 -4.123 -6.774 1.00 0.00 H ATOM 684 N GLY A 182 23.817 -1.312 -3.850 1.00 17.75 N ATOM 685 CA GLY A 182 25.073 -0.667 -3.493 1.00 20.99 C ATOM 686 C GLY A 182 25.791 -1.376 -2.360 1.00 18.78 C ATOM 687 O GLY A 182 25.538 -2.555 -2.079 1.00 17.73 O ATOM 688 H GLY A 182 22.952 -1.039 -3.341 1.00 0.00 H ATOM 689 N ARG A 183 26.683 -0.648 -1.699 1.00 20.50 N ATOM 690 CA ARG A 183 27.422 -1.170 -0.553 1.00 24.15 C ATOM 691 C ARG A 183 26.499 -1.250 0.661 1.00 19.78 C ATOM 692 O ARG A 183 25.885 -0.255 1.052 1.00 17.04 O ATOM 693 CB ARG A 183 28.620 -0.264 -0.248 1.00 30.09 C ATOM 694 CG ARG A 183 29.478 -0.700 0.934 1.00 47.78 C ATOM 695 CD ARG A 183 30.558 0.326 1.252 1.00 54.73 C ATOM 696 NE ARG A 183 30.004 1.664 1.472 1.00 55.55 N ATOM 697 CZ ARG A 183 29.377 2.063 2.580 1.00 72.66 C ATOM 698 NH1 ARG A 183 29.207 1.237 3.609 1.00 71.60 N ATOM 699 NH2 ARG A 183 28.912 3.306 2.661 1.00 75.41 N ATOM 700 HE ARG A 183 30.108 2.358 0.704 1.00 0.00 H ATOM 701 HH12 ARG A 183 28.716 1.566 4.464 1.00 0.00 H ATOM 702 HH11 ARG A 183 29.565 0.262 3.558 1.00 0.00 H ATOM 703 HH22 ARG A 183 28.422 3.623 3.522 1.00 0.00 H ATOM 704 HH21 ARG A 183 29.038 3.961 1.863 1.00 0.00 H ATOM 705 H ARG A 183 26.862 0.329 -2.008 1.00 0.00 H ATOM 706 N GLU A 184 26.400 -2.434 1.256 1.00 19.64 N ATOM 707 CA GLU A 184 25.547 -2.626 2.425 1.00 17.30 C ATOM 708 C GLU A 184 26.126 -1.983 3.674 1.00 19.34 C ATOM 709 O GLU A 184 27.345 -1.987 3.893 1.00 20.59 O ATOM 710 CB GLU A 184 25.330 -4.113 2.705 1.00 20.19 C ATOM 711 CG GLU A 184 24.583 -4.835 1.608 1.00 21.06 C ATOM 712 CD GLU A 184 24.325 -6.292 1.934 1.00 24.40 C ATOM 713 OE1 GLU A 184 25.028 -6.857 2.803 1.00 23.45 O ATOM 714 OE2 GLU A 184 23.406 -6.862 1.317 1.00 24.92 O ATOM 715 H GLU A 184 26.941 -3.240 0.882 1.00 0.00 H ATOM 716 N GLU A 185 25.233 -1.442 4.491 1.00 13.96 N ATOM 717 CA GLU A 185 25.550 -1.015 5.838 1.00 15.01 C ATOM 718 C GLU A 185 24.846 -1.969 6.791 1.00 19.40 C ATOM 719 O GLU A 185 23.627 -2.128 6.732 1.00 23.61 O ATOM 720 CB GLU A 185 25.097 0.426 6.057 1.00 16.75 C ATOM 721 CG GLU A 185 25.933 1.425 5.276 1.00 19.50 C ATOM 722 CD GLU A 185 25.453 2.857 5.406 1.00 21.43 C ATOM 723 OE1 GLU A 185 25.043 3.266 6.513 1.00 22.86 O ATOM 724 OE2 GLU A 185 25.528 3.586 4.396 1.00 18.72 O ATOM 725 H GLU A 185 24.259 -1.318 4.148 1.00 0.00 H ATOM 726 N ARG A 186 25.618 -2.614 7.658 1.00 18.05 N ATOM 727 CA ARG A 186 25.074 -3.635 8.546 1.00 16.37 C ATOM 728 C ARG A 186 25.130 -3.182 9.998 1.00 20.96 C ATOM 729 O ARG A 186 26.087 -2.522 10.413 1.00 22.27 O ATOM 730 CB ARG A 186 25.821 -4.951 8.340 1.00 20.56 C ATOM 731 CG ARG A 186 25.430 -5.613 7.036 1.00 22.19 C ATOM 732 CD ARG A 186 26.352 -6.747 6.636 1.00 26.46 C ATOM 733 NE ARG A 186 25.770 -7.480 5.512 1.00 27.95 N ATOM 734 CZ ARG A 186 25.178 -8.671 5.592 1.00 26.14 C ATOM 735 NH1 ARG A 186 25.104 -9.327 6.747 1.00 30.80 N ATOM 736 NH2 ARG A 186 24.679 -9.228 4.493 1.00 25.92 N ATOM 737 HE ARG A 186 25.823 -7.035 4.573 1.00 0.00 H ATOM 738 HH12 ARG A 186 24.638 -10.256 6.789 1.00 0.00 H ATOM 739 HH11 ARG A 186 25.512 -8.911 7.608 1.00 0.00 H ATOM 740 HH22 ARG A 186 24.215 -10.157 4.546 1.00 0.00 H ATOM 741 HH21 ARG A 186 24.752 -8.734 3.581 1.00 0.00 H ATOM 742 H ARG A 186 26.632 -2.386 7.705 1.00 0.00 H ATOM 743 N GLN A 187 24.075 -3.515 10.742 1.00 20.72 N ATOM 744 CA GLN A 187 23.943 -3.194 12.161 1.00 23.10 C ATOM 745 C GLN A 187 23.654 -4.503 12.904 1.00 24.36 C ATOM 746 O GLN A 187 22.739 -5.244 12.531 1.00 22.75 O ATOM 747 CB GLN A 187 22.801 -2.190 12.357 1.00 26.50 C ATOM 748 CG GLN A 187 22.392 -1.925 13.796 1.00 32.24 C ATOM 749 CD GLN A 187 23.490 -1.268 14.603 1.00 35.42 C ATOM 750 OE1 GLN A 187 24.172 -1.925 15.390 1.00 33.62 O ATOM 751 NE2 GLN A 187 23.671 0.033 14.408 1.00 46.78 N ATOM 752 HE22 GLN A 187 23.070 0.546 13.732 1.00 0.00 H ATOM 753 HE21 GLN A 187 24.414 0.539 14.931 1.00 0.00 H ATOM 754 H GLN A 187 23.299 -4.035 10.284 1.00 0.00 H ATOM 755 N SER A 188 24.431 -4.778 13.952 1.00 22.24 N ATOM 756 CA SER A 188 24.254 -5.992 14.751 1.00 24.37 C ATOM 757 C SER A 188 23.261 -5.816 15.909 1.00 21.85 C ATOM 758 O SER A 188 22.789 -6.804 16.468 1.00 23.37 O ATOM 759 CB SER A 188 25.601 -6.465 15.295 1.00 29.64 C ATOM 760 OG SER A 188 26.207 -5.456 16.085 1.00 39.62 O ATOM 761 HG SER A 188 26.352 -4.648 15.532 1.00 0.00 H ATOM 762 H SER A 188 25.185 -4.110 14.210 1.00 0.00 H ATOM 763 N VAL A 189 22.963 -4.575 16.295 1.00 19.97 N ATOM 764 CA VAL A 189 21.942 -4.328 17.315 1.00 19.11 C ATOM 765 C VAL A 189 20.590 -4.686 16.705 1.00 17.38 C ATOM 766 O VAL A 189 20.233 -4.182 15.640 1.00 18.78 O ATOM 767 CB VAL A 189 21.951 -2.871 17.821 1.00 22.67 C ATOM 768 CG1 VAL A 189 20.782 -2.617 18.765 1.00 23.99 C ATOM 769 CG2 VAL A 189 23.264 -2.564 18.521 1.00 24.76 C ATOM 770 H VAL A 189 23.463 -3.771 15.865 1.00 0.00 H ATOM 771 N PHE A 190 19.858 -5.582 17.366 1.00 16.76 N ATOM 772 CA PHE A 190 18.655 -6.175 16.778 1.00 16.05 C ATOM 773 C PHE A 190 17.496 -6.177 17.781 1.00 17.17 C ATOM 774 O PHE A 190 17.362 -7.109 18.584 1.00 20.57 O ATOM 775 CB PHE A 190 18.979 -7.591 16.297 1.00 16.95 C ATOM 776 CG PHE A 190 17.988 -8.142 15.323 1.00 15.79 C ATOM 777 CD1 PHE A 190 16.857 -8.807 15.765 1.00 17.20 C ATOM 778 CD2 PHE A 190 18.176 -7.981 13.961 1.00 15.08 C ATOM 779 CE1 PHE A 190 15.941 -9.317 14.863 1.00 16.81 C ATOM 780 CE2 PHE A 190 17.263 -8.489 13.053 1.00 15.31 C ATOM 781 CZ PHE A 190 16.142 -9.157 13.506 1.00 14.01 C ATOM 782 H PHE A 190 20.148 -5.867 18.323 1.00 0.00 H ATOM 783 N PRO A 191 16.654 -5.125 17.741 1.00 18.53 N ATOM 784 CA PRO A 191 15.611 -4.949 18.748 1.00 19.81 C ATOM 785 C PRO A 191 14.325 -5.761 18.524 1.00 21.71 C ATOM 786 O PRO A 191 13.451 -5.749 19.386 1.00 28.05 O ATOM 787 CB PRO A 191 15.321 -3.445 18.678 1.00 19.63 C ATOM 788 CG PRO A 191 15.625 -3.064 17.274 1.00 22.20 C ATOM 789 CD PRO A 191 16.728 -3.978 16.816 1.00 18.72 C ATOM 790 N PHE A 192 14.213 -6.455 17.392 1.00 16.92 N ATOM 791 CA PHE A 192 13.006 -7.210 17.059 1.00 15.06 C ATOM 792 C PHE A 192 13.055 -8.613 17.642 1.00 17.64 C ATOM 793 O PHE A 192 14.129 -9.192 17.802 1.00 18.24 O ATOM 794 CB PHE A 192 12.840 -7.311 15.546 1.00 16.26 C ATOM 795 CG PHE A 192 12.801 -5.980 14.853 1.00 15.01 C ATOM 796 CD1 PHE A 192 11.634 -5.238 14.834 1.00 14.99 C ATOM 797 CD2 PHE A 192 13.923 -5.474 14.216 1.00 13.66 C ATOM 798 CE1 PHE A 192 11.584 -4.010 14.203 1.00 16.27 C ATOM 799 CE2 PHE A 192 13.880 -4.248 13.581 1.00 13.63 C ATOM 800 CZ PHE A 192 12.706 -3.514 13.572 1.00 14.16 C ATOM 801 H PHE A 192 15.010 -6.460 16.724 1.00 0.00 H ATOM 802 N GLU A 193 11.884 -9.157 17.953 1.00 16.86 N ATOM 803 CA GLU A 193 11.773 -10.535 18.409 1.00 17.23 C ATOM 804 C GLU A 193 10.547 -11.189 17.799 1.00 19.29 C ATOM 805 O GLU A 193 9.462 -10.586 17.763 1.00 15.61 O ATOM 806 CB GLU A 193 11.660 -10.593 19.929 1.00 24.27 C ATOM 807 CG GLU A 193 12.959 -10.341 20.663 1.00 30.82 C ATOM 808 CD GLU A 193 12.858 -10.719 22.125 1.00 37.45 C ATOM 809 OE1 GLU A 193 13.228 -11.863 22.464 1.00 38.33 O ATOM 810 OE2 GLU A 193 12.384 -9.882 22.923 1.00 45.04 O ATOM 811 H GLU A 193 11.022 -8.582 17.868 1.00 0.00 H ATOM 812 N SER A 194 10.708 -12.421 17.321 1.00 17.28 N ATOM 813 CA SER A 194 9.603 -13.163 16.734 1.00 16.56 C ATOM 814 C SER A 194 8.440 -13.245 17.715 1.00 16.60 C ATOM 815 O SER A 194 8.629 -13.561 18.891 1.00 18.96 O ATOM 816 CB SER A 194 10.050 -14.571 16.330 1.00 21.22 C ATOM 817 OG SER A 194 10.795 -14.537 15.125 1.00 20.78 O ATOM 818 HG SER A 194 11.073 -15.456 14.884 1.00 0.00 H ATOM 819 H SER A 194 11.648 -12.864 17.368 1.00 0.00 H ATOM 820 N GLY A 195 7.248 -12.932 17.221 1.00 14.85 N ATOM 821 CA GLY A 195 6.027 -12.992 18.010 1.00 17.86 C ATOM 822 C GLY A 195 5.647 -11.710 18.730 1.00 16.46 C ATOM 823 O GLY A 195 4.536 -11.619 19.231 1.00 18.72 O ATOM 824 H GLY A 195 7.184 -12.631 16.228 1.00 0.00 H ATOM 825 N LYS A 196 6.531 -10.712 18.765 1.00 13.10 N ATOM 826 CA LYS A 196 6.307 -9.529 19.616 1.00 13.90 C ATOM 827 C LYS A 196 5.955 -8.251 18.854 1.00 15.00 C ATOM 828 O LYS A 196 6.418 -8.042 17.726 1.00 13.02 O ATOM 829 CB LYS A 196 7.538 -9.259 20.483 1.00 13.88 C ATOM 830 CG LYS A 196 7.809 -10.310 21.543 1.00 16.24 C ATOM 831 CD LYS A 196 8.772 -9.774 22.593 1.00 18.66 C ATOM 832 CE LYS A 196 9.383 -10.881 23.428 1.00 23.26 C ATOM 833 NZ LYS A 196 10.282 -10.325 24.480 1.00 25.32 N ATOM 834 HZ1 LYS A 196 11.048 -9.785 24.030 1.00 0.00 H ATOM 835 HZ2 LYS A 196 9.736 -9.698 25.105 1.00 0.00 H ATOM 836 HZ3 LYS A 196 10.686 -11.105 25.036 1.00 0.00 H ATOM 837 H LYS A 196 7.391 -10.769 18.183 1.00 0.00 H ATOM 838 N PRO A 197 5.135 -7.384 19.473 1.00 11.81 N ATOM 839 CA PRO A 197 4.786 -6.095 18.872 1.00 13.66 C ATOM 840 C PRO A 197 5.949 -5.110 18.854 1.00 12.00 C ATOM 841 O PRO A 197 6.780 -5.101 19.763 1.00 12.53 O ATOM 842 CB PRO A 197 3.641 -5.583 19.751 1.00 14.25 C ATOM 843 CG PRO A 197 3.806 -6.278 21.051 1.00 15.67 C ATOM 844 CD PRO A 197 4.485 -7.585 20.781 1.00 14.52 C ATOM 845 N PHE A 198 5.989 -4.289 17.814 1.00 12.65 N ATOM 846 CA PHE A 198 7.030 -3.302 17.651 1.00 12.38 C ATOM 847 C PHE A 198 6.479 -1.973 17.164 1.00 11.62 C ATOM 848 O PHE A 198 5.360 -1.878 16.631 1.00 11.94 O ATOM 849 CB PHE A 198 8.072 -3.794 16.645 1.00 11.93 C ATOM 850 CG PHE A 198 7.524 -3.970 15.259 1.00 12.30 C ATOM 851 CD1 PHE A 198 7.416 -2.888 14.399 1.00 13.58 C ATOM 852 CD2 PHE A 198 7.087 -5.211 14.824 1.00 13.73 C ATOM 853 CE1 PHE A 198 6.891 -3.042 13.129 1.00 17.01 C ATOM 854 CE2 PHE A 198 6.567 -5.377 13.555 1.00 15.99 C ATOM 855 CZ PHE A 198 6.469 -4.295 12.705 1.00 17.61 C ATOM 856 H PHE A 198 5.245 -4.358 17.091 1.00 0.00 H ATOM 857 N LYS A 199 7.304 -0.954 17.336 1.00 11.50 N ATOM 858 CA LYS A 199 7.076 0.356 16.746 1.00 12.75 C ATOM 859 C LYS A 199 8.369 0.767 16.065 1.00 10.86 C ATOM 860 O LYS A 199 9.416 0.779 16.699 1.00 14.29 O ATOM 861 CB LYS A 199 6.713 1.373 17.821 1.00 14.83 C ATOM 862 CG LYS A 199 6.591 2.799 17.293 1.00 16.66 C ATOM 863 CD LYS A 199 5.915 3.709 18.295 1.00 17.34 C ATOM 864 CE LYS A 199 6.760 3.934 19.531 1.00 19.72 C ATOM 865 NZ LYS A 199 6.106 4.891 20.466 1.00 25.20 N ATOM 866 HZ1 LYS A 199 5.970 5.804 19.987 1.00 0.00 H ATOM 867 HZ2 LYS A 199 5.183 4.511 20.760 1.00 0.00 H ATOM 868 HZ3 LYS A 199 6.710 5.024 21.302 1.00 0.00 H ATOM 869 H LYS A 199 8.154 -1.095 17.919 1.00 0.00 H ATOM 870 N ILE A 200 8.293 1.064 14.769 1.00 9.45 N ATOM 871 CA ILE A 200 9.409 1.641 14.037 1.00 9.86 C ATOM 872 C ILE A 200 9.065 3.098 13.763 1.00 12.86 C ATOM 873 O ILE A 200 7.959 3.407 13.306 1.00 13.03 O ATOM 874 CB ILE A 200 9.648 0.927 12.695 1.00 10.40 C ATOM 875 CG1 ILE A 200 9.983 -0.549 12.907 1.00 12.86 C ATOM 876 CG2 ILE A 200 10.776 1.607 11.933 1.00 13.42 C ATOM 877 CD1 ILE A 200 9.931 -1.378 11.648 1.00 14.84 C ATOM 878 H ILE A 200 7.404 0.877 14.263 1.00 0.00 H ATOM 879 N GLN A 201 10.005 3.992 14.032 1.00 11.04 N ATOM 880 CA GLN A 201 9.834 5.392 13.669 1.00 10.36 C ATOM 881 C GLN A 201 10.992 5.796 12.799 1.00 12.31 C ATOM 882 O GLN A 201 12.131 5.540 13.149 1.00 12.97 O ATOM 883 CB GLN A 201 9.753 6.267 14.902 1.00 15.26 C ATOM 884 CG GLN A 201 8.443 6.095 15.627 1.00 18.47 C ATOM 885 CD GLN A 201 8.415 6.852 16.930 1.00 25.39 C ATOM 886 OE1 GLN A 201 9.301 6.693 17.770 1.00 29.98 O ATOM 887 NE2 GLN A 201 7.397 7.681 17.107 1.00 28.72 N ATOM 888 HE22 GLN A 201 6.673 7.781 16.367 1.00 0.00 H ATOM 889 HE21 GLN A 201 7.322 8.232 17.986 1.00 0.00 H ATOM 890 H GLN A 201 10.878 3.690 14.509 1.00 0.00 H ATOM 891 N VAL A 202 10.689 6.364 11.633 1.00 10.64 N ATOM 892 CA VAL A 202 11.702 6.881 10.731 1.00 10.09 C ATOM 893 C VAL A 202 11.544 8.393 10.667 1.00 11.08 C ATOM 894 O VAL A 202 10.507 8.904 10.224 1.00 12.07 O ATOM 895 CB VAL A 202 11.561 6.310 9.309 1.00 10.82 C ATOM 896 CG1 VAL A 202 12.664 6.852 8.408 1.00 13.93 C ATOM 897 CG2 VAL A 202 11.594 4.789 9.337 1.00 12.39 C ATOM 898 H VAL A 202 9.689 6.440 11.358 1.00 0.00 H ATOM 899 N LEU A 203 12.568 9.092 11.129 1.00 10.09 N ATOM 900 CA LEU A 203 12.587 10.548 11.114 1.00 10.88 C ATOM 901 C LEU A 203 13.504 10.993 9.994 1.00 12.29 C ATOM 902 O LEU A 203 14.677 10.613 9.947 1.00 14.07 O ATOM 903 CB LEU A 203 13.086 11.100 12.452 1.00 14.55 C ATOM 904 CG LEU A 203 13.212 12.629 12.524 1.00 18.40 C ATOM 905 CD1 LEU A 203 11.890 13.307 12.203 1.00 19.71 C ATOM 906 CD2 LEU A 203 13.717 13.068 13.891 1.00 23.53 C ATOM 907 H LEU A 203 13.388 8.584 11.517 1.00 0.00 H ATOM 908 N VAL A 204 12.973 11.806 9.090 1.00 11.96 N ATOM 909 CA VAL A 204 13.771 12.337 7.997 1.00 12.08 C ATOM 910 C VAL A 204 14.474 13.597 8.510 1.00 10.92 C ATOM 911 O VAL A 204 13.822 14.536 8.966 1.00 14.28 O ATOM 912 CB VAL A 204 12.892 12.650 6.768 1.00 13.38 C ATOM 913 CG1 VAL A 204 13.736 13.110 5.586 1.00 14.77 C ATOM 914 CG2 VAL A 204 12.096 11.422 6.371 1.00 13.42 C ATOM 915 H VAL A 204 11.969 12.068 9.165 1.00 0.00 H ATOM 916 N GLU A 205 15.805 13.578 8.486 1.00 11.64 N ATOM 917 CA GLU A 205 16.616 14.746 8.820 1.00 13.18 C ATOM 918 C GLU A 205 17.342 15.253 7.558 1.00 12.73 C ATOM 919 O GLU A 205 17.332 14.588 6.509 1.00 12.18 O ATOM 920 CB GLU A 205 17.572 14.407 9.970 1.00 15.73 C ATOM 921 CG GLU A 205 16.809 14.017 11.230 1.00 18.86 C ATOM 922 CD GLU A 205 17.631 14.035 12.502 1.00 34.61 C ATOM 923 OE1 GLU A 205 18.847 13.788 12.442 1.00 38.48 O ATOM 924 OE2 GLU A 205 17.045 14.282 13.578 1.00 32.85 O ATOM 925 H GLU A 205 16.287 12.696 8.219 1.00 0.00 H ATOM 926 N PRO A 206 17.953 16.447 7.635 1.00 13.84 N ATOM 927 CA PRO A 206 18.548 17.011 6.422 1.00 13.94 C ATOM 928 C PRO A 206 19.583 16.118 5.745 1.00 13.37 C ATOM 929 O PRO A 206 19.617 16.055 4.511 1.00 15.56 O ATOM 930 CB PRO A 206 19.185 18.308 6.924 1.00 18.80 C ATOM 931 CG PRO A 206 18.294 18.715 8.044 1.00 20.83 C ATOM 932 CD PRO A 206 17.958 17.426 8.739 1.00 17.18 C ATOM 933 N ASP A 207 20.398 15.422 6.530 1.00 13.18 N ATOM 934 CA ASP A 207 21.458 14.593 5.966 1.00 12.68 C ATOM 935 C ASP A 207 21.317 13.078 6.133 1.00 11.40 C ATOM 936 O ASP A 207 22.111 12.334 5.558 1.00 12.09 O ATOM 937 CB ASP A 207 22.807 15.071 6.488 1.00 14.76 C ATOM 938 CG ASP A 207 23.140 16.481 6.006 1.00 17.50 C ATOM 939 OD1 ASP A 207 22.940 16.756 4.809 1.00 16.36 O ATOM 940 OD2 ASP A 207 23.586 17.311 6.818 1.00 24.32 O ATOM 941 H ASP A 207 20.279 15.469 7.562 1.00 0.00 H ATOM 942 N HIS A 208 20.296 12.627 6.848 1.00 11.81 N ATOM 943 CA HIS A 208 20.084 11.198 6.987 1.00 11.70 C ATOM 944 C HIS A 208 18.712 10.849 7.450 1.00 10.42 C ATOM 945 O HIS A 208 17.987 11.686 7.992 1.00 9.63 O ATOM 946 CB HIS A 208 21.103 10.607 7.953 1.00 11.92 C ATOM 947 CG HIS A 208 21.313 11.432 9.193 1.00 14.25 C ATOM 948 ND1 HIS A 208 20.474 11.391 10.242 1.00 20.59 N ATOM 949 CD2 HIS A 208 22.322 12.325 9.531 1.00 14.93 C ATOM 950 CE1 HIS A 208 20.915 12.227 11.197 1.00 19.69 C ATOM 951 NE2 HIS A 208 22.044 12.800 10.759 1.00 17.63 N ATOM 952 H HIS A 208 19.647 13.297 7.309 1.00 0.00 H ATOM 953 N PHE A 209 18.361 9.583 7.243 1.00 9.88 N ATOM 954 CA PHE A 209 17.174 8.993 7.850 1.00 10.75 C ATOM 955 C PHE A 209 17.630 8.551 9.236 1.00 11.22 C ATOM 956 O PHE A 209 18.736 8.007 9.375 1.00 13.26 O ATOM 957 CB PHE A 209 16.716 7.740 7.102 1.00 10.87 C ATOM 958 CG PHE A 209 16.154 7.999 5.752 1.00 10.12 C ATOM 959 CD1 PHE A 209 14.823 8.355 5.606 1.00 12.49 C ATOM 960 CD2 PHE A 209 16.946 7.878 4.623 1.00 14.15 C ATOM 961 CE1 PHE A 209 14.291 8.584 4.347 1.00 16.51 C ATOM 962 CE2 PHE A 209 16.420 8.102 3.374 1.00 13.55 C ATOM 963 CZ PHE A 209 15.094 8.451 3.232 1.00 13.83 C ATOM 964 H PHE A 209 18.955 8.993 6.626 1.00 0.00 H ATOM 965 N LYS A 210 16.809 8.785 10.256 1.00 9.63 N ATOM 966 CA LYS A 210 17.111 8.356 11.620 1.00 12.18 C ATOM 967 C LYS A 210 16.050 7.335 12.003 1.00 13.19 C ATOM 968 O LYS A 210 14.860 7.618 11.873 1.00 14.71 O ATOM 969 CB LYS A 210 17.069 9.546 12.570 1.00 15.44 C ATOM 970 CG LYS A 210 17.579 9.257 13.969 1.00 26.23 C ATOM 971 CD LYS A 210 17.791 10.534 14.772 1.00 32.87 C ATOM 972 CE LYS A 210 16.478 11.128 15.260 1.00 30.57 C ATOM 973 NZ LYS A 210 16.650 12.515 15.791 1.00 36.22 N ATOM 974 HZ1 LYS A 210 17.315 12.499 16.590 1.00 0.00 H ATOM 975 HZ2 LYS A 210 17.024 13.129 15.039 1.00 0.00 H ATOM 976 HZ3 LYS A 210 15.730 12.879 16.112 1.00 0.00 H ATOM 977 H LYS A 210 15.919 9.292 10.076 1.00 0.00 H ATOM 978 N VAL A 211 16.467 6.153 12.446 1.00 10.89 N ATOM 979 CA VAL A 211 15.518 5.090 12.798 1.00 10.73 C ATOM 980 C VAL A 211 15.561 4.772 14.293 1.00 10.31 C ATOM 981 O VAL A 211 16.632 4.567 14.868 1.00 13.51 O ATOM 982 CB VAL A 211 15.757 3.800 11.987 1.00 11.61 C ATOM 983 CG1 VAL A 211 14.708 2.752 12.331 1.00 13.97 C ATOM 984 CG2 VAL A 211 15.742 4.107 10.496 1.00 13.28 C ATOM 985 H VAL A 211 17.487 5.978 12.545 1.00 0.00 H ATOM 986 N ALA A 212 14.377 4.752 14.907 1.00 11.36 N ATOM 987 CA ALA A 212 14.197 4.316 16.290 1.00 11.89 C ATOM 988 C ALA A 212 13.200 3.157 16.318 1.00 11.52 C ATOM 989 O ALA A 212 12.210 3.153 15.578 1.00 14.26 O ATOM 990 CB ALA A 212 13.699 5.461 17.160 1.00 15.46 C ATOM 991 H ALA A 212 13.539 5.062 14.374 1.00 0.00 H ATOM 992 N VAL A 213 13.459 2.175 17.177 1.00 10.41 N ATOM 993 CA VAL A 213 12.546 1.047 17.342 1.00 9.41 C ATOM 994 C VAL A 213 12.188 0.968 18.813 1.00 11.17 C ATOM 995 O VAL A 213 13.079 0.997 19.665 1.00 12.92 O ATOM 996 CB VAL A 213 13.184 -0.274 16.884 1.00 12.65 C ATOM 997 CG1 VAL A 213 12.242 -1.443 17.155 1.00 14.37 C ATOM 998 CG2 VAL A 213 13.551 -0.189 15.406 1.00 13.92 C ATOM 999 H VAL A 213 14.330 2.211 17.743 1.00 0.00 H ATOM 1000 N ASN A 214 10.891 0.883 19.104 1.00 10.09 N ATOM 1001 CA ASN A 214 10.406 0.830 20.485 1.00 12.11 C ATOM 1002 C ASN A 214 10.986 1.960 21.343 1.00 15.57 C ATOM 1003 O ASN A 214 11.374 1.753 22.512 1.00 16.44 O ATOM 1004 CB ASN A 214 10.687 -0.542 21.094 1.00 13.83 C ATOM 1005 CG ASN A 214 10.051 -1.676 20.313 1.00 12.94 C ATOM 1006 OD1 ASN A 214 9.144 -1.467 19.504 1.00 13.29 O ATOM 1007 ND2 ASN A 214 10.532 -2.896 20.548 1.00 15.11 N ATOM 1008 HD22 ASN A 214 11.298 -3.029 21.239 1.00 0.00 H ATOM 1009 HD21 ASN A 214 10.142 -3.716 20.041 1.00 0.00 H ATOM 1010 H ASN A 214 10.201 0.853 18.326 1.00 0.00 H ATOM 1011 N ASP A 215 11.026 3.149 20.744 1.00 15.80 N ATOM 1012 CA ASP A 215 11.434 4.396 21.397 1.00 18.18 C ATOM 1013 C ASP A 215 12.932 4.505 21.703 1.00 19.57 C ATOM 1014 O ASP A 215 13.347 5.415 22.421 1.00 24.28 O ATOM 1015 CB ASP A 215 10.610 4.649 22.670 1.00 19.49 C ATOM 1016 CG ASP A 215 9.143 4.879 22.376 1.00 23.87 C ATOM 1017 OD1 ASP A 215 8.841 5.688 21.476 1.00 29.70 O ATOM 1018 OD2 ASP A 215 8.295 4.263 23.052 1.00 29.97 O ATOM 1019 H ASP A 215 10.748 3.196 19.743 1.00 0.00 H ATOM 1020 N ALA A 216 13.736 3.596 21.157 1.00 17.99 N ATOM 1021 CA ALA A 216 15.185 3.634 21.336 1.00 19.75 C ATOM 1022 C ALA A 216 15.858 3.855 19.991 1.00 18.16 C ATOM 1023 O ALA A 216 15.491 3.227 18.989 1.00 16.93 O ATOM 1024 CB ALA A 216 15.677 2.345 21.968 1.00 24.88 C ATOM 1025 H ALA A 216 13.319 2.834 20.585 1.00 0.00 H ATOM 1026 N HIS A 217 16.840 4.753 19.969 1.00 20.47 N ATOM 1027 CA HIS A 217 17.601 5.027 18.759 1.00 18.62 C ATOM 1028 C HIS A 217 18.291 3.776 18.283 1.00 16.10 C ATOM 1029 O HIS A 217 18.867 3.040 19.074 1.00 18.10 O ATOM 1030 CB HIS A 217 18.619 6.144 18.998 1.00 20.84 C ATOM 1031 CG HIS A 217 19.533 6.382 17.827 1.00 24.04 C ATOM 1032 ND1 HIS A 217 19.123 7.014 16.713 1.00 28.83 N ATOM 1033 CD2 HIS A 217 20.855 6.011 17.605 1.00 29.24 C ATOM 1034 CE1 HIS A 217 20.133 7.062 15.830 1.00 26.81 C ATOM 1035 NE2 HIS A 217 21.192 6.446 16.374 1.00 25.36 N ATOM 1036 H HIS A 217 17.070 5.273 20.840 1.00 0.00 H ATOM 1037 N LEU A 218 18.222 3.512 16.980 1.00 12.74 N ATOM 1038 CA LEU A 218 18.826 2.313 16.412 1.00 13.30 C ATOM 1039 C LEU A 218 19.978 2.646 15.467 1.00 13.63 C ATOM 1040 O LEU A 218 21.093 2.155 15.651 1.00 15.77 O ATOM 1041 CB LEU A 218 17.783 1.474 15.678 1.00 13.80 C ATOM 1042 CG LEU A 218 18.302 0.193 15.019 1.00 17.07 C ATOM 1043 CD1 LEU A 218 18.905 -0.746 16.055 1.00 18.97 C ATOM 1044 CD2 LEU A 218 17.180 -0.486 14.256 1.00 18.54 C ATOM 1045 H LEU A 218 17.726 4.177 16.353 1.00 0.00 H ATOM 1046 N LEU A 219 19.704 3.445 14.442 1.00 15.60 N ATOM 1047 CA LEU A 219 20.722 3.749 13.427 1.00 13.72 C ATOM 1048 C LEU A 219 20.376 4.993 12.627 1.00 12.97 C ATOM 1049 O LEU A 219 19.258 5.507 12.709 1.00 12.95 O ATOM 1050 CB LEU A 219 20.911 2.553 12.476 1.00 14.32 C ATOM 1051 CG LEU A 219 19.691 2.077 11.674 1.00 15.26 C ATOM 1052 CD1 LEU A 219 19.455 2.935 10.438 1.00 16.65 C ATOM 1053 CD2 LEU A 219 19.880 0.613 11.291 1.00 20.27 C ATOM 1054 H LEU A 219 18.755 3.862 14.357 1.00 0.00 H ATOM 1055 N GLN A 220 21.350 5.479 11.864 1.00 14.75 N ATOM 1056 CA GLN A 220 21.125 6.557 10.910 1.00 14.25 C ATOM 1057 C GLN A 220 21.775 6.190 9.582 1.00 14.56 C ATOM 1058 O GLN A 220 22.853 5.588 9.558 1.00 16.57 O ATOM 1059 CB GLN A 220 21.685 7.883 11.433 1.00 16.32 C ATOM 1060 CG GLN A 220 23.201 7.921 11.538 1.00 20.24 C ATOM 1061 CD GLN A 220 23.729 9.301 11.885 1.00 29.17 C ATOM 1062 OE1 GLN A 220 22.972 10.193 12.274 1.00 37.21 O ATOM 1063 NE2 GLN A 220 25.036 9.484 11.748 1.00 34.13 N ATOM 1064 HE22 GLN A 220 25.638 8.704 11.417 1.00 0.00 H ATOM 1065 HE21 GLN A 220 25.458 10.408 11.972 1.00 0.00 H ATOM 1066 H GLN A 220 22.305 5.076 11.951 1.00 0.00 H ATOM 1067 N TYR A 221 21.125 6.588 8.491 1.00 13.75 N ATOM 1068 CA TYR A 221 21.525 6.216 7.136 1.00 11.77 C ATOM 1069 C TYR A 221 21.672 7.499 6.339 1.00 11.83 C ATOM 1070 O TYR A 221 20.694 8.212 6.114 1.00 12.16 O ATOM 1071 CB TYR A 221 20.465 5.316 6.506 1.00 11.28 C ATOM 1072 CG TYR A 221 20.852 4.695 5.174 1.00 12.58 C ATOM 1073 CD1 TYR A 221 21.627 3.537 5.130 1.00 12.16 C ATOM 1074 CD2 TYR A 221 20.432 5.240 3.971 1.00 11.75 C ATOM 1075 CE1 TYR A 221 21.970 2.952 3.933 1.00 12.67 C ATOM 1076 CE2 TYR A 221 20.761 4.652 2.761 1.00 11.02 C ATOM 1077 CZ TYR A 221 21.540 3.506 2.751 1.00 11.97 C ATOM 1078 OH TYR A 221 21.890 2.910 1.563 1.00 12.29 O ATOM 1079 HH TYR A 221 21.071 2.642 1.076 1.00 0.00 H ATOM 1080 H TYR A 221 20.289 7.195 8.609 1.00 0.00 H ATOM 1081 N ASN A 222 22.898 7.797 5.926 1.00 12.71 N ATOM 1082 CA ASN A 222 23.169 8.984 5.128 1.00 12.84 C ATOM 1083 C ASN A 222 22.405 8.929 3.815 1.00 12.57 C ATOM 1084 O ASN A 222 22.273 7.862 3.215 1.00 13.20 O ATOM 1085 CB ASN A 222 24.666 9.099 4.847 1.00 14.27 C ATOM 1086 CG ASN A 222 25.467 9.413 6.091 1.00 16.64 C ATOM 1087 OD1 ASN A 222 24.904 9.718 7.142 1.00 18.49 O ATOM 1088 ND2 ASN A 222 26.788 9.342 5.979 1.00 20.11 N ATOM 1089 HD22 ASN A 222 27.219 9.080 5.070 1.00 0.00 H ATOM 1090 HD21 ASN A 222 27.391 9.549 6.801 1.00 0.00 H ATOM 1091 H ASN A 222 23.685 7.166 6.179 1.00 0.00 H ATOM 1092 N HIS A 223 21.881 10.073 3.384 1.00 10.96 N ATOM 1093 CA HIS A 223 21.196 10.157 2.083 1.00 10.51 C ATOM 1094 C HIS A 223 22.112 9.917 0.924 1.00 12.72 C ATOM 1095 O HIS A 223 23.019 10.721 0.665 1.00 15.34 O ATOM 1096 CB HIS A 223 20.532 11.526 1.891 1.00 10.82 C ATOM 1097 CG HIS A 223 19.394 11.797 2.857 1.00 11.52 C ATOM 1098 ND1 HIS A 223 18.356 10.948 3.021 1.00 12.76 N ATOM 1099 CD2 HIS A 223 19.168 12.862 3.721 1.00 13.54 C ATOM 1100 CE1 HIS A 223 17.515 11.441 3.942 1.00 13.39 C ATOM 1101 NE2 HIS A 223 18.007 12.618 4.367 1.00 13.63 N ATOM 1102 H HIS A 223 21.956 10.924 3.977 1.00 0.00 H ATOM 1103 N ARG A 224 21.883 8.819 0.211 1.00 11.29 N ATOM 1104 CA ARG A 224 22.575 8.543 -1.054 1.00 11.89 C ATOM 1105 C ARG A 224 21.798 9.092 -2.242 1.00 12.55 C ATOM 1106 O ARG A 224 22.388 9.606 -3.200 1.00 14.26 O ATOM 1107 CB ARG A 224 22.784 7.041 -1.235 1.00 11.57 C ATOM 1108 CG ARG A 224 23.577 6.403 -0.116 1.00 12.57 C ATOM 1109 CD ARG A 224 23.986 4.985 -0.466 1.00 13.48 C ATOM 1110 NE ARG A 224 24.485 4.258 0.698 1.00 16.72 N ATOM 1111 CZ ARG A 224 24.769 2.951 0.719 1.00 19.08 C ATOM 1112 NH1 ARG A 224 24.606 2.195 -0.362 1.00 17.29 N ATOM 1113 NH2 ARG A 224 25.200 2.392 1.839 1.00 19.27 N ATOM 1114 HE ARG A 224 24.630 4.796 1.576 1.00 0.00 H ATOM 1115 HH12 ARG A 224 24.832 1.181 -0.326 1.00 0.00 H ATOM 1116 HH11 ARG A 224 24.252 2.618 -1.244 1.00 0.00 H ATOM 1117 HH22 ARG A 224 25.422 1.376 1.861 1.00 0.00 H ATOM 1118 HH21 ARG A 224 25.316 2.969 2.697 1.00 0.00 H ATOM 1119 H ARG A 224 21.188 8.130 0.562 1.00 0.00 H ATOM 1120 N VAL A 225 20.476 8.968 -2.178 1.00 11.21 N ATOM 1121 CA VAL A 225 19.566 9.574 -3.141 1.00 10.78 C ATOM 1122 C VAL A 225 19.251 10.971 -2.618 1.00 12.21 C ATOM 1123 O VAL A 225 18.736 11.127 -1.506 1.00 15.10 O ATOM 1124 CB VAL A 225 18.284 8.733 -3.303 1.00 12.03 C ATOM 1125 CG1 VAL A 225 17.248 9.469 -4.140 1.00 14.64 C ATOM 1126 CG2 VAL A 225 18.625 7.381 -3.907 1.00 14.92 C ATOM 1127 H VAL A 225 20.070 8.409 -1.400 1.00 0.00 H ATOM 1128 N LYS A 226 19.606 11.987 -3.395 1.00 11.68 N ATOM 1129 CA LYS A 226 19.560 13.362 -2.902 1.00 11.45 C ATOM 1130 C LYS A 226 18.327 14.168 -3.297 1.00 14.10 C ATOM 1131 O LYS A 226 18.091 15.237 -2.738 1.00 14.17 O ATOM 1132 CB LYS A 226 20.858 14.074 -3.273 1.00 16.38 C ATOM 1133 CG LYS A 226 22.028 13.255 -2.738 1.00 17.65 C ATOM 1134 CD LYS A 226 23.374 13.909 -2.803 1.00 20.52 C ATOM 1135 CE LYS A 226 24.420 12.928 -2.292 1.00 15.39 C ATOM 1136 NZ LYS A 226 24.489 12.817 -0.813 1.00 13.62 N ATOM 1137 HZ1 LYS A 226 24.721 13.746 -0.407 1.00 0.00 H ATOM 1138 HZ2 LYS A 226 23.569 12.497 -0.447 1.00 0.00 H ATOM 1139 HZ3 LYS A 226 25.225 12.130 -0.552 1.00 0.00 H ATOM 1140 H LYS A 226 19.921 11.802 -4.369 1.00 0.00 H ATOM 1141 N LYS A 227 17.523 13.647 -4.224 1.00 12.24 N ATOM 1142 CA LYS A 227 16.276 14.291 -4.611 1.00 14.96 C ATOM 1143 C LYS A 227 15.165 13.776 -3.692 1.00 12.25 C ATOM 1144 O LYS A 227 14.384 12.881 -4.055 1.00 12.69 O ATOM 1145 CB LYS A 227 15.974 14.021 -6.085 1.00 14.13 C ATOM 1146 CG LYS A 227 16.977 14.681 -7.029 1.00 18.18 C ATOM 1147 CD LYS A 227 16.809 14.222 -8.469 1.00 23.15 C ATOM 1148 CE LYS A 227 17.799 14.912 -9.400 1.00 29.36 C ATOM 1149 NZ LYS A 227 17.850 14.267 -10.746 1.00 30.46 N ATOM 1150 HZ1 LYS A 227 18.141 13.274 -10.642 1.00 0.00 H ATOM 1151 HZ2 LYS A 227 16.908 14.310 -11.185 1.00 0.00 H ATOM 1152 HZ3 LYS A 227 18.536 14.770 -11.344 1.00 0.00 H ATOM 1153 H LYS A 227 17.794 12.755 -4.684 1.00 0.00 H ATOM 1154 N LEU A 228 15.131 14.323 -2.481 1.00 12.24 N ATOM 1155 CA LEU A 228 14.220 13.860 -1.437 1.00 12.53 C ATOM 1156 C LEU A 228 12.762 14.011 -1.839 1.00 10.19 C ATOM 1157 O LEU A 228 11.921 13.197 -1.445 1.00 12.85 O ATOM 1158 CB LEU A 228 14.454 14.622 -0.129 1.00 17.76 C ATOM 1159 CG LEU A 228 15.841 14.541 0.520 1.00 21.49 C ATOM 1160 CD1 LEU A 228 15.800 15.226 1.872 1.00 19.17 C ATOM 1161 CD2 LEU A 228 16.314 13.106 0.645 1.00 18.94 C ATOM 1162 H LEU A 228 15.777 15.110 -2.269 1.00 0.00 H ATOM 1163 N ASN A 229 12.465 15.048 -2.624 1.00 12.32 N ATOM 1164 CA ASN A 229 11.100 15.301 -3.082 1.00 15.45 C ATOM 1165 C ASN A 229 10.574 14.235 -4.050 1.00 14.89 C ATOM 1166 O ASN A 229 9.380 14.190 -4.335 1.00 17.67 O ATOM 1167 CB ASN A 229 11.010 16.679 -3.746 1.00 18.28 C ATOM 1168 CG ASN A 229 11.814 16.763 -5.037 1.00 17.20 C ATOM 1169 OD1 ASN A 229 13.025 16.522 -5.052 1.00 28.67 O ATOM 1170 ND2 ASN A 229 11.143 17.112 -6.130 1.00 39.67 N ATOM 1171 HD22 ASN A 229 10.123 17.307 -6.074 1.00 0.00 H ATOM 1172 HD21 ASN A 229 11.638 17.191 -7.041 1.00 0.00 H ATOM 1173 H ASN A 229 13.225 15.694 -2.918 1.00 0.00 H ATOM 1174 N GLU A 230 11.466 13.393 -4.562 1.00 11.93 N ATOM 1175 CA GLU A 230 11.096 12.341 -5.497 1.00 13.12 C ATOM 1176 C GLU A 230 10.968 10.966 -4.835 1.00 10.87 C ATOM 1177 O GLU A 230 10.634 9.996 -5.510 1.00 13.77 O ATOM 1178 CB GLU A 230 12.104 12.300 -6.660 1.00 14.27 C ATOM 1179 CG GLU A 230 12.108 13.601 -7.460 1.00 14.61 C ATOM 1180 CD GLU A 230 12.934 13.568 -8.727 1.00 19.16 C ATOM 1181 OE1 GLU A 230 13.549 12.537 -9.037 1.00 18.95 O ATOM 1182 OE2 GLU A 230 12.973 14.604 -9.416 1.00 20.40 O ATOM 1183 H GLU A 230 12.464 13.489 -4.285 1.00 0.00 H ATOM 1184 N ILE A 231 11.220 10.886 -3.525 1.00 9.39 N ATOM 1185 CA ILE A 231 11.066 9.643 -2.778 1.00 10.14 C ATOM 1186 C ILE A 231 9.621 9.651 -2.304 1.00 11.24 C ATOM 1187 O ILE A 231 9.330 10.165 -1.216 1.00 12.72 O ATOM 1188 CB ILE A 231 12.051 9.555 -1.592 1.00 11.23 C ATOM 1189 CG1 ILE A 231 13.503 9.639 -2.088 1.00 11.23 C ATOM 1190 CG2 ILE A 231 11.823 8.266 -0.818 1.00 11.67 C ATOM 1191 CD1 ILE A 231 14.522 9.827 -0.975 1.00 12.15 C ATOM 1192 H ILE A 231 11.537 11.739 -3.021 1.00 0.00 H ATOM 1193 N SER A 232 8.715 9.104 -3.112 1.00 10.55 N ATOM 1194 CA SER A 232 7.278 9.351 -2.919 1.00 11.24 C ATOM 1195 C SER A 232 6.442 8.111 -2.604 1.00 11.00 C ATOM 1196 O SER A 232 5.208 8.149 -2.693 1.00 9.97 O ATOM 1197 CB SER A 232 6.701 10.078 -4.142 1.00 13.86 C ATOM 1198 OG SER A 232 6.809 9.298 -5.319 1.00 15.76 O ATOM 1199 HG SER A 232 7.763 9.101 -5.496 1.00 0.00 H ATOM 1200 H SER A 232 9.029 8.492 -3.892 1.00 0.00 H ATOM 1201 N LYS A 233 7.098 7.024 -2.217 1.00 9.84 N ATOM 1202 CA LYS A 233 6.389 5.801 -1.836 1.00 13.75 C ATOM 1203 C LYS A 233 7.210 4.965 -0.860 1.00 11.84 C ATOM 1204 O LYS A 233 8.415 4.799 -1.036 1.00 11.95 O ATOM 1205 CB LYS A 233 6.048 4.974 -3.078 1.00 16.46 C ATOM 1206 CG LYS A 233 5.801 3.501 -2.801 1.00 20.64 C ATOM 1207 CD LYS A 233 5.297 2.773 -4.039 1.00 26.67 C ATOM 1208 CE LYS A 233 5.668 1.300 -3.987 1.00 27.59 C ATOM 1209 NZ LYS A 233 5.741 0.812 -2.583 1.00 25.29 N ATOM 1210 HZ1 LYS A 233 6.462 1.355 -2.066 1.00 0.00 H ATOM 1211 HZ2 LYS A 233 4.816 0.938 -2.125 1.00 0.00 H ATOM 1212 HZ3 LYS A 233 5.996 -0.196 -2.581 1.00 0.00 H ATOM 1213 H LYS A 233 8.137 7.041 -2.184 1.00 0.00 H ATOM 1214 N LEU A 234 6.544 4.443 0.169 1.00 12.05 N ATOM 1215 CA LEU A 234 7.167 3.531 1.122 1.00 10.42 C ATOM 1216 C LEU A 234 6.481 2.186 1.002 1.00 11.88 C ATOM 1217 O LEU A 234 5.267 2.097 1.172 1.00 13.21 O ATOM 1218 CB LEU A 234 7.051 4.047 2.555 1.00 12.65 C ATOM 1219 CG LEU A 234 7.454 3.064 3.666 1.00 13.52 C ATOM 1220 CD1 LEU A 234 8.920 2.680 3.581 1.00 15.56 C ATOM 1221 CD2 LEU A 234 7.133 3.675 5.018 1.00 18.59 C ATOM 1222 H LEU A 234 5.543 4.695 0.298 1.00 0.00 H ATOM 1223 N GLY A 235 7.262 1.157 0.684 1.00 10.71 N ATOM 1224 CA GLY A 235 6.800 -0.217 0.674 1.00 11.36 C ATOM 1225 C GLY A 235 7.151 -0.913 1.971 1.00 12.97 C ATOM 1226 O GLY A 235 8.283 -0.810 2.455 1.00 12.82 O ATOM 1227 H GLY A 235 8.252 1.348 0.430 1.00 0.00 H ATOM 1228 N ILE A 236 6.168 -1.604 2.543 1.00 12.85 N ATOM 1229 CA ILE A 236 6.348 -2.352 3.780 1.00 11.95 C ATOM 1230 C ILE A 236 6.026 -3.816 3.506 1.00 13.95 C ATOM 1231 O ILE A 236 4.915 -4.140 3.060 1.00 15.68 O ATOM 1232 CB ILE A 236 5.412 -1.828 4.887 1.00 12.87 C ATOM 1233 CG1 ILE A 236 5.607 -0.318 5.063 1.00 17.04 C ATOM 1234 CG2 ILE A 236 5.682 -2.563 6.199 1.00 18.07 C ATOM 1235 CD1 ILE A 236 4.571 0.359 5.932 1.00 22.36 C ATOM 1236 H ILE A 236 5.233 -1.610 2.088 1.00 0.00 H ATOM 1237 N SER A 237 6.985 -4.697 3.768 1.00 11.82 N ATOM 1238 CA SER A 237 6.806 -6.107 3.482 1.00 12.79 C ATOM 1239 C SER A 237 7.519 -6.988 4.495 1.00 16.03 C ATOM 1240 O SER A 237 8.275 -6.508 5.350 1.00 15.06 O ATOM 1241 CB SER A 237 7.283 -6.430 2.062 1.00 17.73 C ATOM 1242 OG SER A 237 8.695 -6.331 1.960 1.00 19.29 O ATOM 1243 HG SER A 237 8.977 -5.410 2.187 1.00 0.00 H ATOM 1244 H SER A 237 7.880 -4.370 4.185 1.00 0.00 H ATOM 1245 N GLY A 238 7.262 -8.285 4.394 1.00 17.06 N ATOM 1246 CA GLY A 238 7.898 -9.260 5.268 1.00 18.41 C ATOM 1247 C GLY A 238 6.950 -9.955 6.218 1.00 18.12 C ATOM 1248 O GLY A 238 5.720 -9.913 6.057 1.00 16.93 O ATOM 1249 H GLY A 238 6.589 -8.614 3.672 1.00 0.00 H ATOM 1250 N ASP A 239 7.544 -10.592 7.223 1.00 15.85 N ATOM 1251 CA ASP A 239 6.840 -11.520 8.089 1.00 16.83 C ATOM 1252 C ASP A 239 6.263 -10.802 9.310 1.00 18.57 C ATOM 1253 O ASP A 239 6.660 -11.042 10.452 1.00 17.04 O ATOM 1254 CB ASP A 239 7.778 -12.661 8.477 1.00 19.60 C ATOM 1255 CG ASP A 239 8.334 -13.383 7.264 1.00 22.23 C ATOM 1256 OD1 ASP A 239 7.553 -13.662 6.329 1.00 23.34 O ATOM 1257 OD2 ASP A 239 9.549 -13.655 7.237 1.00 20.22 O ATOM 1258 H ASP A 239 8.555 -10.418 7.396 1.00 0.00 H ATOM 1259 N ILE A 240 5.312 -9.913 9.034 1.00 17.84 N ATOM 1260 CA ILE A 240 4.668 -9.106 10.053 1.00 16.26 C ATOM 1261 C ILE A 240 3.158 -9.030 9.855 1.00 18.25 C ATOM 1262 O ILE A 240 2.646 -9.169 8.739 1.00 19.00 O ATOM 1263 CB ILE A 240 5.208 -7.661 10.068 1.00 18.06 C ATOM 1264 CG1 ILE A 240 4.961 -6.961 8.726 1.00 17.23 C ATOM 1265 CG2 ILE A 240 6.691 -7.656 10.388 1.00 17.69 C ATOM 1266 CD1 ILE A 240 5.229 -5.477 8.754 1.00 20.37 C ATOM 1267 H ILE A 240 5.017 -9.791 8.044 1.00 0.00 H ATOM 1268 N ASP A 241 2.464 -8.796 10.958 1.00 17.38 N ATOM 1269 CA ASP A 241 1.093 -8.300 10.943 1.00 18.60 C ATOM 1270 C ASP A 241 1.212 -6.787 11.083 1.00 18.78 C ATOM 1271 O ASP A 241 1.831 -6.304 12.032 1.00 19.43 O ATOM 1272 CB ASP A 241 0.305 -8.860 12.121 1.00 21.43 C ATOM 1273 CG ASP A 241 0.110 -10.366 12.045 1.00 30.21 C ATOM 1274 OD1 ASP A 241 -0.057 -10.900 10.928 1.00 41.36 O ATOM 1275 OD2 ASP A 241 0.108 -11.014 13.111 1.00 41.35 O ATOM 1276 H ASP A 241 2.917 -8.974 11.877 1.00 0.00 H ATOM 1277 N LEU A 242 0.642 -6.039 10.144 1.00 15.86 N ATOM 1278 CA LEU A 242 0.773 -4.587 10.137 1.00 15.02 C ATOM 1279 C LEU A 242 -0.477 -3.952 10.728 1.00 18.21 C ATOM 1280 O LEU A 242 -1.585 -4.198 10.254 1.00 18.92 O ATOM 1281 CB LEU A 242 1.005 -4.092 8.711 1.00 18.12 C ATOM 1282 CG LEU A 242 1.215 -2.594 8.495 1.00 17.25 C ATOM 1283 CD1 LEU A 242 2.451 -2.061 9.192 1.00 17.82 C ATOM 1284 CD2 LEU A 242 1.299 -2.318 7.002 1.00 18.07 C ATOM 1285 H LEU A 242 0.088 -6.501 9.395 1.00 0.00 H ATOM 1286 N THR A 243 -0.292 -3.144 11.770 1.00 16.63 N ATOM 1287 CA THR A 243 -1.401 -2.519 12.485 1.00 17.00 C ATOM 1288 C THR A 243 -1.693 -1.100 12.014 1.00 17.78 C ATOM 1289 O THR A 243 -2.855 -0.721 11.847 1.00 20.19 O ATOM 1290 CB THR A 243 -1.109 -2.504 14.001 1.00 19.22 C ATOM 1291 OG1 THR A 243 -0.918 -3.855 14.443 1.00 28.79 O ATOM 1292 CG2 THR A 243 -2.259 -1.890 14.775 1.00 27.03 C ATOM 1293 HG1 THR A 243 -0.730 -3.860 15.415 1.00 0.00 H ATOM 1294 H THR A 243 0.680 -2.951 12.087 1.00 0.00 H ATOM 1295 N SER A 244 -0.636 -0.321 11.811 1.00 14.36 N ATOM 1296 CA SER A 244 -0.757 1.089 11.446 1.00 16.51 C ATOM 1297 C SER A 244 0.482 1.553 10.690 1.00 15.21 C ATOM 1298 O SER A 244 1.594 1.125 10.990 1.00 13.63 O ATOM 1299 CB SER A 244 -0.928 1.937 12.714 1.00 19.57 C ATOM 1300 OG SER A 244 -1.151 3.298 12.396 1.00 33.46 O ATOM 1301 HG SER A 244 -0.378 3.647 11.885 1.00 0.00 H ATOM 1302 H SER A 244 0.314 -0.730 11.916 1.00 0.00 H ATOM 1303 N ALA A 245 0.290 2.419 9.700 1.00 13.93 N ATOM 1304 CA ALA A 245 1.405 3.061 9.006 1.00 14.72 C ATOM 1305 C ALA A 245 0.967 4.468 8.666 1.00 17.82 C ATOM 1306 O ALA A 245 0.002 4.659 7.928 1.00 18.35 O ATOM 1307 CB ALA A 245 1.776 2.293 7.747 1.00 17.12 C ATOM 1308 H ALA A 245 -0.683 2.647 9.410 1.00 0.00 H ATOM 1309 N SER A 246 1.651 5.453 9.234 1.00 16.08 N ATOM 1310 CA SER A 246 1.252 6.851 9.067 1.00 15.86 C ATOM 1311 C SER A 246 2.444 7.779 9.174 1.00 14.14 C ATOM 1312 O SER A 246 3.551 7.353 9.498 1.00 15.60 O ATOM 1313 CB SER A 246 0.195 7.234 10.100 1.00 22.49 C ATOM 1314 OG SER A 246 0.698 7.139 11.420 1.00 23.82 O ATOM 1315 HG SER A 246 0.985 6.208 11.596 1.00 0.00 H ATOM 1316 H SER A 246 2.487 5.227 9.809 1.00 0.00 H ATOM 1317 N TYR A 247 2.205 9.051 8.882 1.00 15.68 N ATOM 1318 CA TYR A 247 3.244 10.063 8.969 1.00 14.48 C ATOM 1319 C TYR A 247 2.667 11.343 9.532 1.00 17.91 C ATOM 1320 O TYR A 247 1.454 11.586 9.478 1.00 15.07 O ATOM 1321 CB TYR A 247 3.892 10.326 7.601 1.00 16.74 C ATOM 1322 CG TYR A 247 2.918 10.571 6.470 1.00 15.86 C ATOM 1323 CD1 TYR A 247 2.240 11.788 6.347 1.00 17.11 C ATOM 1324 CD2 TYR A 247 2.659 9.586 5.528 1.00 20.07 C ATOM 1325 CE1 TYR A 247 1.340 12.002 5.317 1.00 19.83 C ATOM 1326 CE2 TYR A 247 1.766 9.793 4.497 1.00 22.30 C ATOM 1327 CZ TYR A 247 1.102 11.000 4.396 1.00 23.14 C ATOM 1328 OH TYR A 247 0.208 11.197 3.369 1.00 23.13 O ATOM 1329 HH TYR A 247 -0.516 10.524 3.429 1.00 0.00 H ATOM 1330 H TYR A 247 1.249 9.331 8.583 1.00 0.00 H ATOM 1331 N THR A 248 3.554 12.159 10.072 1.00 16.99 N ATOM 1332 CA THR A 248 3.201 13.488 10.518 1.00 18.98 C ATOM 1333 C THR A 248 4.436 14.377 10.431 1.00 19.89 C ATOM 1334 O THR A 248 5.534 13.903 10.133 1.00 19.07 O ATOM 1335 CB THR A 248 2.650 13.462 11.956 1.00 23.24 C ATOM 1336 OG1 THR A 248 2.080 14.739 12.284 1.00 26.50 O ATOM 1337 CG2 THR A 248 3.745 13.115 12.957 1.00 22.12 C ATOM 1338 HG1 THR A 248 1.728 14.714 13.209 1.00 0.00 H ATOM 1339 H THR A 248 4.537 11.836 10.180 1.00 0.00 H ATOM 1340 N MET A 249 4.234 15.670 10.667 1.00 20.19 N ATOM 1341 CA MET A 249 5.325 16.630 10.750 1.00 21.60 C ATOM 1342 C MET A 249 5.570 16.957 12.212 1.00 24.66 C ATOM 1343 O MET A 249 4.621 17.184 12.967 1.00 26.06 O ATOM 1344 CB MET A 249 4.964 17.910 10.004 1.00 24.25 C ATOM 1345 CG MET A 249 4.612 17.692 8.548 1.00 26.25 C ATOM 1346 SD MET A 249 5.955 16.904 7.644 1.00 31.04 S ATOM 1347 CE MET A 249 5.307 16.954 5.977 1.00 31.67 C ATOM 1348 H MET A 249 3.259 16.008 10.797 1.00 0.00 H ATOM 1349 N ILE A 250 6.835 16.960 12.616 1.00 20.65 N ATOM 1350 CA ILE A 250 7.207 17.391 13.966 1.00 23.33 C ATOM 1351 C ILE A 250 7.933 18.732 13.910 1.00 30.64 C ATOM 1352 O ILE A 250 8.203 19.265 12.829 1.00 28.34 O ATOM 1353 CB ILE A 250 8.052 16.337 14.709 1.00 29.63 C ATOM 1354 CG1 ILE A 250 9.349 16.020 13.959 1.00 32.52 C ATOM 1355 CG2 ILE A 250 7.232 15.070 14.913 1.00 30.75 C ATOM 1356 CD1 ILE A 250 10.410 15.403 14.842 1.00 43.17 C ATOM 1357 OXT ILE A 250 8.255 19.319 14.944 1.00 31.41 O ATOM 1358 H ILE A 250 7.579 16.649 11.959 1.00 0.00 H TER 1359 ILE A 250 HETATM 1360 O HOH 1 19.333 7.414 0.147 1.00 12.29 O HETATM 1361 O HOH 2 24.383 5.836 3.181 1.00 14.40 O HETATM 1362 O HOH 3 17.763 9.514 0.643 1.00 13.11 O HETATM 1363 O HOH 4 8.305 6.989 -6.225 1.00 19.51 O HETATM 1364 O HOH 5 25.049 6.066 6.561 1.00 18.36 O HETATM 1365 O HOH 6 10.257 3.922 18.024 1.00 15.29 O HETATM 1366 O HOH 7 16.824 0.324 -9.027 1.00 18.61 O HETATM 1367 O HOH 8 9.596 -7.341 17.588 1.00 14.58 O HETATM 1368 O HOH 9 24.340 3.105 -3.358 1.00 18.87 O HETATM 1369 O HOH 10 3.186 9.740 -3.826 1.00 20.54 O HETATM 1370 O HOH 11 4.287 9.425 12.580 1.00 21.58 O HETATM 1371 O HOH 12 9.682 -5.445 19.645 1.00 22.92 O HETATM 1372 O HOH 13 9.201 -3.591 1.161 1.00 18.27 O HETATM 1373 O HOH 14 15.878 1.968 -11.692 1.00 18.94 O HETATM 1374 O HOH 15 24.084 4.293 12.458 1.00 27.03 O HETATM 1375 O HOH 16 16.897 -14.072 7.594 1.00 24.46 O HETATM 1376 O HOH 17 17.523 7.404 -7.347 1.00 19.23 O HETATM 1377 O HOH 18 -5.140 -2.896 3.775 1.00 28.17 O HETATM 1378 O HOH 19 1.144 4.613 12.787 1.00 24.07 O HETATM 1379 O HOH 20 19.188 18.498 3.185 1.00 19.31 O HETATM 1380 O HOH 21 -0.554 8.740 2.085 1.00 25.11 O HETATM 1381 O HOH 22 18.884 5.794 -11.181 1.00 27.37 O HETATM 1382 O HOH 23 2.438 -2.731 17.672 1.00 24.58 O HETATM 1383 O HOH 24 20.063 8.881 -7.258 1.00 26.21 O HETATM 1384 O HOH 25 23.384 2.667 8.513 1.00 28.37 O HETATM 1385 O HOH 26 1.533 9.604 12.605 1.00 31.97 O HETATM 1386 O HOH 27 -1.102 -7.532 8.262 1.00 27.95 O HETATM 1387 O HOH 28 5.554 -9.464 2.227 1.00 25.74 O HETATM 1388 O HOH 29 23.231 1.523 -5.404 1.00 25.59 O HETATM 1389 O HOH 30 27.178 2.192 -2.810 1.00 32.43 O HETATM 1390 O HOH 31 15.684 -10.519 3.662 1.00 26.24 O HETATM 1391 O HOH 32 -1.029 -1.063 -0.231 1.00 28.01 O HETATM 1392 O HOH 33 -2.564 3.109 9.199 1.00 26.75 O HETATM 1393 O HOH 34 11.324 -6.839 21.552 1.00 39.39 O HETATM 1394 O HOH 35 12.462 17.625 0.154 1.00 34.81 O HETATM 1395 O HOH 36 16.265 7.864 16.595 1.00 29.10 O HETATM 1396 O HOH 37 28.533 -1.721 7.759 1.00 34.28 O HETATM 1397 O HOH 38 26.420 7.647 1.994 1.00 32.36 O HETATM 1398 O HOH 39 23.050 -12.633 15.874 1.00 32.19 O HETATM 1399 O HOH 40 13.822 8.308 14.815 1.00 32.50 O HETATM 1400 O HOH 41 28.116 -4.709 0.402 1.00 33.29 O HETATM 1401 O HOH 42 25.291 5.658 -4.036 1.00 36.06 O HETATM 1402 O HOH 43 29.212 -4.030 3.319 1.00 38.10 O HETATM 1403 O HOH 44 20.903 8.119 -9.952 1.00 35.73 O HETATM 1404 O HOH 45 19.762 12.305 -9.832 1.00 40.35 O HETATM 1405 O HOH 46 14.871 14.253 -11.453 1.00 25.54 O HETATM 1406 O HOH 47 -0.549 9.654 7.450 1.00 34.85 O HETATM 1407 O HOH 48 11.121 20.928 6.689 1.00 34.79 O HETATM 1408 O HOH 49 25.841 10.345 -0.356 1.00 30.21 O HETATM 1409 O HOH 50 25.145 9.307 -3.532 1.00 34.50 O HETATM 1410 O HOH 51 7.991 3.785 -6.672 1.00 37.25 O HETATM 1411 O HOH 52 12.795 -1.779 -7.143 1.00 38.81 O HETATM 1412 O HOH 53 10.090 -1.357 -8.732 1.00 40.65 O HETATM 1413 O HOH 54 14.608 -1.186 21.115 1.00 39.38 O HETATM 1414 O HOH 55 16.240 0.224 19.025 1.00 37.78 O HETATM 1415 O HOH 56 20.040 -22.407 9.755 1.00 34.36 O HETATM 1416 O HOH 57 14.614 19.645 15.365 1.00 31.89 O HETATM 1417 O HOH 58 12.891 -15.866 14.001 1.00 43.78 O HETATM 1418 O HOH 59 3.298 -11.433 5.480 1.00 41.51 O HETATM 1419 O HOH 60 25.570 7.530 9.013 1.00 44.85 O HETATM 1420 O HOH 61 23.491 6.130 15.201 1.00 40.95 O HETATM 1421 O HOH 62 22.718 -0.375 8.970 1.00 38.01 O HETATM 1422 O HOH 63 26.192 13.550 6.028 1.00 36.77 O HETATM 1423 O HOH 64 12.394 -5.543 -0.196 1.00 25.31 O HETATM 1424 O HOH 65 -1.344 -9.208 5.261 1.00 37.23 O HETATM 1425 O HOH 66 -4.568 1.334 10.589 1.00 43.76 O HETATM 1426 O HOH 67 0.484 -4.845 16.445 1.00 33.34 O HETATM 1427 O HOH 68 26.850 -8.889 9.475 1.00 32.78 O HETATM 1428 O HOH 69 18.001 12.462 17.979 1.00 31.31 O HETATM 1429 O HOH 70 15.593 -8.559 1.488 1.00 46.25 O HETATM 1430 O HOH 71 23.529 -6.358 -2.071 1.00 36.84 O HETATM 1431 O HOH 72 24.891 -10.189 13.644 1.00 44.77 O HETATM 1432 O HOH 73 15.111 16.266 13.801 1.00 37.40 O HETATM 1433 O HOH 74 20.518 -10.431 18.626 1.00 49.38 O HETATM 1434 O HOH 75 15.464 19.460 10.552 1.00 46.06 O HETATM 1435 O HOH 76 20.919 -6.706 19.986 1.00 45.55 O HETATM 1436 O HOH 77 14.699 21.446 8.479 1.00 50.49 O HETATM 1437 O HOH 78 16.112 -8.926 20.604 1.00 56.92 O HETATM 1438 O HOH 79 22.685 20.029 6.837 1.00 39.91 O HETATM 1439 O HOH 80 26.834 14.338 8.735 1.00 48.50 O HETATM 1440 O HOH 81 7.740 12.940 -6.633 1.00 39.44 O HETATM 1441 O HOH 82 4.397 7.074 19.228 1.00 35.51 O HETATM 1442 O HOH 83 -0.873 10.976 11.428 1.00 39.13 O HETATM 1443 O HOH 84 20.796 13.928 -7.631 1.00 39.57 O HETATM 1444 O HOH 85 22.504 8.254 -5.806 1.00 40.14 O HETATM 1445 O HOH 86 29.798 -0.697 5.277 1.00 42.47 O HETATM 1446 O HOH 87 27.663 -3.541 14.194 1.00 56.22 O HETATM 1447 O HOH 88 25.089 1.131 -7.492 1.00 55.51 O HETATM 1448 O HOH 89 22.575 -5.870 -7.406 1.00 35.01 O HETATM 1449 O HOH 90 26.188 -4.865 -4.007 1.00 50.32 O HETATM 1450 O HOH 91 23.814 1.284 -10.443 1.00 42.32 O HETATM 1451 O HOH 92 0.553 -8.067 19.109 1.00 41.98 O HETATM 1452 O HOH 93 -1.296 2.734 -2.259 1.00 48.66 O HETATM 1453 O HOH 94 -1.987 -3.753 0.694 1.00 44.18 O HETATM 1454 O HOH 95 -2.096 11.571 1.705 1.00 32.33 O HETATM 1455 O HOH 96 7.627 -3.474 -1.193 1.00 41.41 O HETATM 1456 O HOH 97 8.787 -10.865 2.344 1.00 37.39 O HETATM 1457 O HOH 98 6.771 -16.039 9.651 1.00 46.54 O HETATM 1458 O HOH 99 13.965 16.378 11.428 1.00 33.64 O HETATM 1459 O HOH 100 7.519 -16.674 18.922 1.00 49.50 O HETATM 1460 O HOH 101 0.521 -10.233 7.288 1.00 42.20 O HETATM 1461 O HOH 102 -0.671 -6.258 -1.260 1.00 42.22 O HETATM 1462 O HOH 103 4.836 -3.137 -0.910 1.00 55.31 O HETATM 1463 O HOH 104 13.715 -3.618 -2.807 1.00 39.80 O HETATM 1464 O HOH 105 28.568 9.025 3.247 1.00 45.18 O HETATM 1465 O HOH 106 13.268 -0.044 23.786 1.00 45.87 O HETATM 1466 O HOH 107 10.536 8.109 20.868 1.00 40.33 O HETATM 1467 O HOH 108 19.837 3.604 21.694 1.00 44.61 O HETATM 1468 O HOH 109 9.677 17.211 -0.672 1.00 46.05 O HETATM 1469 O HOH 110 25.355 -20.205 15.423 1.00 44.42 O HETATM 1470 O HOH 111 22.083 -1.039 -14.664 1.00 54.63 O HETATM 1471 O HOH 112 28.336 0.873 -5.722 1.00 61.62 O HETATM 1472 O HOH 113 3.187 10.619 15.417 1.00 51.63 O HETATM 1473 O HOH 114 13.893 17.796 -2.558 1.00 44.42 O HETATM 1474 O HOH 115 16.614 19.604 2.553 1.00 45.06 O HETATM 1475 O HOH 116 26.878 0.433 9.815 1.00 52.87 O HETATM 1476 O HOH 117 32.830 -1.917 1.133 1.00 48.60 O HETATM 1477 O HOH 118 25.436 -13.242 9.088 1.00 39.33 O HETATM 1478 C2 BGC A 119 24.840 -10.106 0.329 1.00 0.13 C HETATM 1479 C3 BGC A 119 23.326 -10.177 0.497 1.00 0.11 C HETATM 1480 C4 BGC A 119 22.604 -9.838 -0.806 1.00 0.12 C HETATM 1481 C5 BGC A 119 23.165 -10.693 -1.945 1.00 0.11 C HETATM 1482 C6 BGC A 119 22.527 -10.399 -3.300 1.00 0.07 C HETATM 1483 O6 BGC A 119 22.741 -9.030 -3.666 1.00 -0.39 O HETATM 1484 H BGC A 119 23.674 -8.860 -3.719 1.00 0.21 H HETATM 1485 H BGC A 119 21.446 -10.594 -3.242 1.00 0.06 H HETATM 1486 H BGC A 119 22.977 -11.053 -4.062 1.00 0.06 H HETATM 1487 O5 BGC A 119 24.568 -10.461 -2.043 1.00 -0.34 O HETATM 1488 C1 BGC A 119 25.286 -10.905 -0.890 1.00 0.19 C HETATM 1489 O1 BGC A 119 26.690 -10.715 -1.101 1.00 -0.36 O HETATM 1490 H BGC A 119 27.167 -11.010 -0.334 1.00 0.21 H HETATM 1491 H BGC A 119 25.083 -11.973 -0.721 1.00 0.09 H HETATM 1492 H BGC A 119 22.988 -11.751 -1.702 1.00 0.06 H HETATM 1493 O4 BGC A 119 21.203 -10.100 -0.648 1.00 -0.34 O HETATM 1494 C1 BGC A 119 20.382 -9.016 -1.111 1.00 0.19 C HETATM 1495 C2 BGC A 119 18.932 -9.489 -1.072 1.00 0.13 C HETATM 1496 C3 BGC A 119 17.970 -8.365 -1.435 1.00 0.12 C HETATM 1497 C4 BGC A 119 18.296 -7.098 -0.655 1.00 0.11 C HETATM 1498 C5 BGC A 119 19.788 -6.758 -0.739 1.00 0.11 C HETATM 1499 C6 BGC A 119 20.185 -5.546 0.109 1.00 0.07 C HETATM 1500 O6 BGC A 119 21.584 -5.341 0.007 1.00 -0.39 O HETATM 1501 H BGC A 119 22.040 -6.113 0.321 1.00 0.21 H HETATM 1502 H BGC A 119 19.916 -5.729 1.160 1.00 0.06 H HETATM 1503 H BGC A 119 19.655 -4.653 -0.255 1.00 0.06 H HETATM 1504 O5 BGC A 119 20.557 -7.864 -0.311 1.00 -0.34 O HETATM 1505 H BGC A 119 20.028 -6.539 -1.790 1.00 0.06 H HETATM 1506 O4 BGC A 119 17.891 -7.332 0.674 1.00 -0.39 O HETATM 1507 H BGC A 119 16.964 -7.539 0.690 1.00 0.21 H HETATM 1508 H BGC A 119 17.723 -6.255 -1.069 1.00 0.06 H HETATM 1509 O3 BGC A 119 16.614 -8.736 -1.192 1.00 -0.34 O HETATM 1510 C2 BGC A 119 15.940 -8.886 -2.463 1.00 0.22 C HETATM 1511 C1 BGC A 119 15.676 -7.552 -3.143 1.00 0.10 C HETATM 1512 O1A BGC A 119 16.263 -7.290 -4.216 1.00 -0.54 O HETATM 1513 O1B BGC A 119 14.884 -6.747 -2.602 1.00 -0.54 O HETATM 1514 C3 BGC A 119 14.686 -9.369 -1.727 1.00 0.04 C HETATM 1515 C4 BGC A 119 13.574 -9.731 -2.706 1.00 0.09 C HETATM 1516 C5 BGC A 119 14.067 -10.722 -3.753 1.00 0.10 C HETATM 1517 C6 BGC A 119 15.404 -10.299 -4.373 1.00 0.11 C HETATM 1518 C7 BGC A 119 16.012 -11.429 -5.209 1.00 0.11 C HETATM 1519 C8 BGC A 119 17.351 -11.018 -5.837 1.00 0.11 C HETATM 1520 C9 BGC A 119 18.527 -11.878 -5.372 1.00 0.07 C HETATM 1521 O9 BGC A 119 18.361 -13.228 -5.822 1.00 -0.39 O HETATM 1522 H BGC A 119 17.555 -13.583 -5.465 1.00 0.21 H HETATM 1523 H BGC A 119 18.575 -11.865 -4.273 1.00 0.06 H HETATM 1524 H BGC A 119 19.461 -11.470 -5.785 1.00 0.06 H HETATM 1525 O8 BGC A 119 17.250 -11.106 -7.264 1.00 -0.39 O HETATM 1526 H BGC A 119 17.107 -12.011 -7.515 1.00 0.21 H HETATM 1527 H BGC A 119 17.555 -9.975 -5.555 1.00 0.06 H HETATM 1528 O7 BGC A 119 16.174 -12.599 -4.395 1.00 -0.39 O HETATM 1529 H BGC A 119 16.495 -13.314 -4.931 1.00 0.21 H HETATM 1530 H BGC A 119 15.313 -11.667 -6.024 1.00 0.06 H HETATM 1531 O6 BGC A 119 16.360 -9.904 -3.376 1.00 -0.34 O HETATM 1532 H BGC A 119 15.214 -9.439 -5.032 1.00 0.06 H HETATM 1533 N5 BGC A 119 13.058 -10.853 -4.793 1.00 -0.28 N HETATM 1534 C10 BGC A 119 12.136 -11.819 -4.802 1.00 0.17 C HETATM 1535 C11 BGC A 119 11.184 -11.780 -5.962 1.00 0.03 C HETATM 1536 H BGC A 119 10.469 -12.612 -5.878 1.00 0.05 H HETATM 1537 H BGC A 119 11.747 -11.875 -6.902 1.00 0.05 H HETATM 1538 H BGC A 119 10.638 -10.825 -5.956 1.00 0.05 H HETATM 1539 O10 BGC A 119 12.057 -12.680 -3.940 1.00 -0.40 O HETATM 1540 H BGC A 119 13.055 -10.186 -5.538 1.00 0.19 H HETATM 1541 H BGC A 119 14.207 -11.699 -3.268 1.00 0.06 H HETATM 1542 O4 BGC A 119 12.476 -10.306 -1.986 1.00 -0.39 O HETATM 1543 H BGC A 119 11.772 -10.505 -2.591 1.00 0.21 H HETATM 1544 H BGC A 119 13.235 -8.816 -3.214 1.00 0.06 H HETATM 1545 H BGC A 119 14.331 -8.569 -1.061 1.00 0.03 H HETATM 1546 H BGC A 119 14.941 -10.257 -1.130 1.00 0.03 H HETATM 1547 H BGC A 119 18.084 -8.152 -2.508 1.00 0.07 H HETATM 1548 O2 BGC A 119 18.777 -10.556 -1.984 1.00 -0.38 O HETATM 1549 H BGC A 119 17.884 -10.878 -1.944 1.00 0.21 H HETATM 1550 H BGC A 119 18.698 -9.841 -0.057 1.00 0.07 H HETATM 1551 H BGC A 119 20.657 -8.769 -2.147 1.00 0.09 H HETATM 1552 H BGC A 119 22.753 -8.774 -1.042 1.00 0.07 H HETATM 1553 O3 BGC A 119 22.929 -9.286 1.550 1.00 -0.39 O HETATM 1554 H BGC A 119 23.143 -8.393 1.305 1.00 0.21 H HETATM 1555 H BGC A 119 23.053 -11.204 0.783 1.00 0.06 H HETATM 1556 O2 BGC A 119 25.483 -10.630 1.499 1.00 -0.38 O HETATM 1557 H BGC A 119 26.425 -10.560 1.399 1.00 0.21 H HETATM 1558 H BGC A 119 25.134 -9.055 0.195 1.00 0.07 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 1478 1479 1488 1556 1558 CONECT 1479 1478 1480 1553 1555 CONECT 1480 1479 1481 1493 1552 CONECT 1481 1480 1482 1487 1492 CONECT 1482 1481 1483 1485 1486 CONECT 1483 1482 1484 CONECT 1484 1483 CONECT 1485 1482 CONECT 1486 1482 CONECT 1487 1481 1488 CONECT 1488 1478 1487 1489 1491 CONECT 1489 1488 1490 CONECT 1490 1489 CONECT 1491 1488 CONECT 1492 1481 CONECT 1493 1480 1494 CONECT 1494 1493 1495 1504 1551 CONECT 1495 1494 1496 1548 1550 CONECT 1496 1495 1497 1509 1547 CONECT 1497 1496 1498 1506 1508 CONECT 1498 1497 1499 1504 1505 CONECT 1499 1498 1500 1502 1503 CONECT 1500 1499 1501 CONECT 1501 1500 CONECT 1502 1499 CONECT 1503 1499 CONECT 1504 1494 1498 CONECT 1505 1498 CONECT 1506 1497 1507 CONECT 1507 1506 CONECT 1508 1497 CONECT 1509 1496 1510 CONECT 1510 1509 1511 1514 1531 CONECT 1511 1510 1512 1513 CONECT 1512 1511 CONECT 1513 1511 CONECT 1514 1510 1515 1545 1546 CONECT 1515 1514 1516 1542 1544 CONECT 1516 1515 1517 1533 1541 CONECT 1517 1516 1518 1531 1532 CONECT 1518 1517 1519 1528 1530 CONECT 1519 1518 1520 1525 1527 CONECT 1520 1519 1521 1523 1524 CONECT 1521 1520 1522 CONECT 1522 1521 CONECT 1523 1520 CONECT 1524 1520 CONECT 1525 1519 1526 CONECT 1526 1525 CONECT 1527 1519 CONECT 1528 1518 1529 CONECT 1529 1528 CONECT 1530 1518 CONECT 1531 1510 1517 CONECT 1532 1517 CONECT 1533 1516 1534 1540 CONECT 1534 1533 1535 1539 CONECT 1535 1534 1536 1537 1538 CONECT 1536 1535 CONECT 1537 1535 CONECT 1538 1535 CONECT 1539 1534 CONECT 1540 1533 CONECT 1541 1516 CONECT 1542 1515 1543 CONECT 1543 1542 CONECT 1544 1515 CONECT 1545 1514 CONECT 1546 1514 CONECT 1547 1496 CONECT 1548 1495 1549 CONECT 1549 1548 CONECT 1550 1495 CONECT 1551 1494 CONECT 1552 1480 CONECT 1553 1479 1554 CONECT 1554 1553 CONECT 1555 1479 CONECT 1556 1478 1557 CONECT 1557 1556 CONECT 1558 1478 MASTER 0 0 0 0 0 0 0 0 1557 1 84 11 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 4lbo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1kjr
RCSB PDB
PDBbind
146aa, >1KJR_1|Chain... at 99%
2nn8
RCSB PDB
PDBbind
138aa, >2NN8_1|Chain... at 100%
2xg3
RCSB PDB
PDBbind
138aa, >2XG3_1|Chain... at 99%
3aya
RCSB PDB
PDBbind
135aa, >3AYA_1|Chains... at 99%
3ayc
RCSB PDB
PDBbind
135aa, >3AYC_1|Chains... at 99%
3ayd
RCSB PDB
PDBbind
135aa, >3AYD_1|Chain... at 99%
3t1l
RCSB PDB
PDBbind
143aa, >3T1L_1|Chain... at 100%
3t1m
RCSB PDB
PDBbind
143aa, >3T1M_1|Chain... at 100%
4jc1
RCSB PDB
PDBbind
143aa, >4JC1_1|Chain... at 100%
4jck
RCSB PDB
PDBbind
143aa, >4JCK_1|Chain... at 100%
4lbl
RCSB PDB
PDBbind
138aa, >4LBL_1|Chain... at 98%
5e88
RCSB PDB
PDBbind
139aa, >5E88_1|Chain... at 100%
5e89
RCSB PDB
PDBbind
139aa, >5E89_1|Chain... at 100%
5e8a
RCSB PDB
PDBbind
139aa, >5E8A_1|Chain... at 100%
5nf9
RCSB PDB
PDBbind
147aa, >5NF9_1|Chain... at 100%
5nfa
RCSB PDB
PDBbind
147aa, >5NFA_1|Chain... at 100%
5nfb
RCSB PDB
PDBbind
176aa, >5NFB_1|Chain... *
5oax
RCSB PDB
PDBbind
138aa, >5OAX_1|Chain... at 99%
5ody
RCSB PDB
PDBbind
138aa, >5ODY_1|Chain... at 100%
6eog
RCSB PDB
PDBbind
138aa, >6EOG_1|Chain... at 99%
6eol
RCSB PDB
PDBbind
138aa, >6EOL_1|Chain... at 99%
6g0v
RCSB PDB
PDBbind
138aa, >6G0V_1|Chain... at 99%
6qlu
RCSB PDB
PDBbind
138aa, >6QLU_1|Chain... at 100%
6qlt
RCSB PDB
PDBbind
138aa, >6QLT_1|Chain... at 100%
6qls
RCSB PDB
PDBbind
138aa, >6QLS_1|Chain... at 100%
6qlr
RCSB PDB
PDBbind
138aa, >6QLR_1|Chain... at 100%
6qlq
RCSB PDB
PDBbind
138aa, >6QLQ_1|Chain... at 100%
6qlp
RCSB PDB
PDBbind
138aa, >6QLP_1|Chain... at 100%
6qlo
RCSB PDB
PDBbind
138aa, >6QLO_1|Chain... at 100%
6qln
RCSB PDB
PDBbind
138aa, >6QLN_1|Chain... at 100%
6qge
RCSB PDB
PDBbind
138aa, >6QGE_1|Chain... at 100%
6qgf
RCSB PDB
PDBbind
138aa, >6QGF_1|Chain... at 100%
6i78
RCSB PDB
PDBbind
138aa, >6I78_1|Chain... at 100%
6i77
RCSB PDB
PDBbind
138aa, >6I77_1|Chain... at 100%
6i76
RCSB PDB
PDBbind
138aa, >6I76_1|Chain... at 100%
6i75
RCSB PDB
PDBbind
138aa, >6I75_1|Chain... at 100%
6i74
RCSB PDB
PDBbind
138aa, >6I74_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a1b
RCSB PDB
PDBbind
3-mer
1a1c
RCSB PDB
PDBbind
3-mer
1a30
RCSB PDB
PDBbind
3-mer
1at5
RCSB PDB
PDBbind
3-mer
1at6
RCSB PDB
PDBbind
3-mer
1b05
RCSB PDB
PDBbind
3-mer
1b0h
RCSB PDB
PDBbind
3-mer
1b1h
RCSB PDB
PDBbind
3-mer
1b2h
RCSB PDB
PDBbind
3-mer
1b32
RCSB PDB
PDBbind
3-mer
1b3f
RCSB PDB
PDBbind
3-mer
1b3g
RCSB PDB
PDBbind
3-mer
1b3h
RCSB PDB
PDBbind
3-mer
1b3l
RCSB PDB
PDBbind
3-mer
1b40
RCSB PDB
PDBbind
3-mer
1b46
RCSB PDB
PDBbind
3-mer
1b4h
RCSB PDB
PDBbind
3-mer
1b4z
RCSB PDB
PDBbind
3-mer
1b51
RCSB PDB
PDBbind
3-mer
1b52
RCSB PDB
PDBbind
3-mer
1b58
RCSB PDB
PDBbind
3-mer
1b5h
RCSB PDB
PDBbind
3-mer
1b5i
RCSB PDB
PDBbind
3-mer
1b5j
RCSB PDB
PDBbind
3-mer
1b6h
RCSB PDB
PDBbind
3-mer
1b7h
RCSB PDB
PDBbind
3-mer
1b9j
RCSB PDB
PDBbind
3-mer
1bm6
RCSB PDB
PDBbind
3-mer
1eub
RCSB PDB
PDBbind
3-mer
1fwu
RCSB PDB
PDBbind
3-mer
1fwv
RCSB PDB
PDBbind
3-mer
1gmy
RCSB PDB
PDBbind
3-mer
1hkj
RCSB PDB
PDBbind
3-mer
1hkk
RCSB PDB
PDBbind
3-mer
1hkm
RCSB PDB
PDBbind
3-mer
1jet
RCSB PDB
PDBbind
3-mer
1jeu
RCSB PDB
PDBbind
3-mer
1jev
RCSB PDB
PDBbind
3-mer
1jlx
RCSB PDB
PDBbind
3-mer
1jrs
RCSB PDB
PDBbind
3-mer
1kjr
RCSB PDB
PDBbind
3-mer
1kug
RCSB PDB
PDBbind
3-mer
1kui
RCSB PDB
PDBbind
3-mer
1kuk
RCSB PDB
PDBbind
3-mer
1ll4
RCSB PDB
PDBbind
3-mer
1m7d
RCSB PDB
PDBbind
3-mer
1mfa
RCSB PDB
PDBbind
3-mer
1mfd
RCSB PDB
PDBbind
3-mer
1nu8
RCSB PDB
PDBbind
3-mer
1ogg
RCSB PDB
PDBbind
3-mer
1qka
RCSB PDB
PDBbind
3-mer
1qkb
RCSB PDB
PDBbind
3-mer
1ule
RCSB PDB
PDBbind
3-mer
1ur9
RCSB PDB
PDBbind
3-mer
1ux7
RCSB PDB
PDBbind
3-mer
1uz8
RCSB PDB
PDBbind
3-mer
1w3l
RCSB PDB
PDBbind
3-mer
1y3g
RCSB PDB
PDBbind
3-mer
2euk
RCSB PDB
PDBbind
3-mer
2eum
RCSB PDB
PDBbind
3-mer
2evl
RCSB PDB
PDBbind
3-mer
2jdh
RCSB PDB
PDBbind
3-mer
2jdk
RCSB PDB
PDBbind
3-mer
2liq
RCSB PDB
PDBbind
3-mer
2olb
RCSB PDB
PDBbind
3-mer
2r2b
RCSB PDB
PDBbind
3-mer
2vxj
RCSB PDB
PDBbind
3-mer
2w68
RCSB PDB
PDBbind
3-mer
2w7y
RCSB PDB
PDBbind
3-mer
2wk2
RCSB PDB
PDBbind
3-mer
2wm0
RCSB PDB
PDBbind
3-mer
2xdw
RCSB PDB
PDBbind
3-mer
2xg3
RCSB PDB
PDBbind
3-mer
2yjq
RCSB PDB
PDBbind
3-mer
3afk
RCSB PDB
PDBbind
3-mer
3ap7
RCSB PDB
PDBbind
3-mer
3aya
RCSB PDB
PDBbind
3-mer
3ayd
RCSB PDB
PDBbind
3-mer
3g19
RCSB PDB
PDBbind
3-mer
3gxy
RCSB PDB
PDBbind
3-mer
3m3c
RCSB PDB
PDBbind
3-mer
3m3e
RCSB PDB
PDBbind
3-mer
3m3o
RCSB PDB
PDBbind
3-mer
3mbp
RCSB PDB
PDBbind
3-mer
3rse
RCSB PDB
PDBbind
3-mer
3tcg
RCSB PDB
PDBbind
3-mer
4bgy
RCSB PDB
PDBbind
3-mer
4bh3
RCSB PDB
PDBbind
3-mer
4bh4
RCSB PDB
PDBbind
3-mer
4c1u
RCSB PDB
PDBbind
3-mer
4d2d
RCSB PDB
PDBbind
3-mer
4dj7
RCSB PDB
PDBbind
3-mer
4g0a
RCSB PDB
PDBbind
3-mer
4g68
RCSB PDB
PDBbind
3-mer
4gzw
RCSB PDB
PDBbind
3-mer
4hpi
RCSB PDB
PDBbind
3-mer
4hxj
RCSB PDB
PDBbind
3-mer
4igq
RCSB PDB
PDBbind
3-mer
4je8
RCSB PDB
PDBbind
3-mer
4k64
RCSB PDB
PDBbind
3-mer
4k67
RCSB PDB
PDBbind
3-mer
4lbl
RCSB PDB
PDBbind
3-mer
4lkg
RCSB PDB
PDBbind
3-mer
4lkj
RCSB PDB
PDBbind
3-mer
4m7j
RCSB PDB
PDBbind
3-mer
5glu
RCSB PDB
PDBbind
3-mer
5mxo
RCSB PDB
PDBbind
3-mer
5t54
RCSB PDB
PDBbind
3-mer
5tpb
RCSB PDB
PDBbind
3-mer
5ufc
RCSB PDB
PDBbind
3-mer
5xhs
RCSB PDB
PDBbind
3-mer
6df1
RCSB PDB
PDBbind
3-mer
6df2
RCSB PDB
PDBbind
3-mer
6fhu
RCSB PDB
PDBbind
3-mer
6m9c
RCSB PDB
PDBbind
3-mer
6m9d
RCSB PDB
PDBbind
3-mer
6phx
RCSB PDB
PDBbind
3-mer
6p7p
RCSB PDB
PDBbind
3-mer
6k2n
RCSB PDB
PDBbind
3-mer
6iht
RCSB PDB
PDBbind
3-mer
6idz
RCSB PDB
PDBbind
3-mer
6idb
RCSB PDB
PDBbind
3-mer
Entry Information
PDB ID
4lbo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
wildtype Human galectin-3 CRD
Ligand Name
3-mer
EC.Number
E.C.-.-.-.-
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
Kd=1.7uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J.Mol.Biol. Vol. 426: pp. 1439-1451
Ligand Properties
Formula
C
2
3
H
3
9
NO
1
9
Molecular Weight
633.551
Exact Mass
633.212
No. of atoms
82
No. of bonds
84
Polar Surface Area
335.08
LOGP Value
-6.32 (
Computed with XLOGP3
)
-7.83 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 12
No. of Hydrogen Bond Acceptors: 14
No. of Rotatable Bonds: 22
No. of Nitrogen and Oxygen Atoms: 20
No. of Rings: 3
Canonical SMILES
OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@H]([C@H]1O)O[C@@]1(C[C@H](O)[C@H]([C@@H](O1)[C@@H]([C@@H](CO)O)O)NC(=O)C)C(=O)O)O
InChI String
InChI=1S/C23H39NO19/c1-6(28)24-11-7(29)2-23(22(37)38,42-18(11)12(31)8(30)3-25)43-19-13(32)9(4-26)40-21(16(19)35)41-17-10(5-27)39-20(36)15(34)14(17)33/h7-21,25-27,29-36H,2-5H2,1H3,(H,24,28)(H,37,38)/t7-,8+,9+,10+,11+,12+,13-,14+,15+,16+,17+,18+,19-,20+,21-,23-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P17931
Entrez Gene ID
NCBI Entrez Gene ID:
3958
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com