Browse entries in the PDBbind-CN Database
HEADER 5GGN_COMPLEX COMPND 5GGN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 153 ARG VAL LEU ASP VAL GLU VAL TYR SER SER ARG SER LYS SEQRES 2 A 153 VAL TYR VAL ALA VAL ASP GLY THR THR VAL LEU GLU ASP SEQRES 3 A 153 GLU ALA ARG GLU GLN GLY ARG GLY ILE HIS VAL ILE VAL SEQRES 4 A 153 LEU ASN GLN ALA THR GLY HIS VAL MET ALA LYS ARG VAL SEQRES 5 A 153 PHE ASP THR TYR SER PRO HIS GLU ASP GLU ALA MET VAL SEQRES 6 A 153 LEU PHE LEU ASN MET VAL ALA PRO GLY ARG VAL LEU ILE SEQRES 7 A 153 CYS THR VAL LYS ASP GLU GLY SER PHE HIS LEU LYS ASP SEQRES 8 A 153 THR ALA LYS ALA LEU LEU ARG SER LEU GLY SER GLN ALA SEQRES 9 A 153 GLY PRO ALA LEU GLY TRP ARG ASP THR TRP ALA PHE VAL SEQRES 10 A 153 GLY ARG LYS GLY GLY PRO VAL PHE GLY GLU LYS HIS SER SEQRES 11 A 153 LYS SER PRO ALA LEU SER SER TRP GLY ASP PRO VAL LEU SEQRES 12 A 153 LEU LYS THR ASP VAL PRO LEU SER SER ALA HET LEC A 461 42 ATOM 1 N ARG A 97 -25.812 26.684 -7.556 1.00 32.34 N ATOM 2 CA ARG A 97 -25.036 26.032 -6.491 1.00 24.65 C ATOM 3 C ARG A 97 -25.142 24.542 -6.671 1.00 17.74 C ATOM 4 O ARG A 97 -24.787 23.804 -5.786 1.00 16.08 O ATOM 5 CB ARG A 97 -25.495 26.428 -5.116 1.00 31.40 C ATOM 6 CG ARG A 97 -25.318 27.888 -4.832 1.00 36.76 C ATOM 7 CD ARG A 97 -25.571 28.162 -3.372 1.00 44.26 C ATOM 8 NE ARG A 97 -24.804 29.303 -2.963 1.00 49.86 N ATOM 9 CZ ARG A 97 -25.224 30.173 -2.079 1.00 53.23 C ATOM 10 NH1 ARG A 97 -26.416 30.031 -1.507 1.00 54.13 N ATOM 11 NH2 ARG A 97 -24.459 31.218 -1.767 1.00 55.23 N ATOM 12 HE ARG A 97 -23.867 29.447 -3.390 1.00 0.00 H ATOM 13 HH12 ARG A 97 -26.742 30.726 -0.806 1.00 0.00 H ATOM 14 HH11 ARG A 97 -27.022 29.225 -1.761 1.00 0.00 H ATOM 15 HH22 ARG A 97 -24.788 31.912 -1.066 1.00 0.00 H ATOM 16 HH21 ARG A 97 -23.533 31.340 -2.225 1.00 0.00 H ATOM 17 HN3 ARG A 97 -26.806 26.387 -7.490 1.00 0.00 H ATOM 18 HN2 ARG A 97 -25.427 26.408 -8.482 1.00 0.00 H ATOM 19 HN1 ARG A 97 -25.749 27.716 -7.446 1.00 0.00 H ATOM 20 N VAL A 98 -25.647 24.111 -7.822 1.00 16.46 N ATOM 21 CA VAL A 98 -25.685 22.703 -8.168 1.00 15.81 C ATOM 22 C VAL A 98 -25.288 22.534 -9.623 1.00 14.46 C ATOM 23 O VAL A 98 -25.418 23.457 -10.442 1.00 15.91 O ATOM 24 CB VAL A 98 -27.058 22.016 -7.964 1.00 20.36 C ATOM 25 CG1 VAL A 98 -27.447 21.977 -6.544 1.00 21.81 C ATOM 26 CG2 VAL A 98 -28.132 22.715 -8.782 1.00 23.56 C ATOM 27 H VAL A 98 -26.027 24.805 -8.496 1.00 0.00 H ATOM 28 N LEU A 99 -24.825 21.333 -9.936 1.00 14.48 N ATOM 29 CA LEU A 99 -24.703 20.859 -11.312 1.00 16.03 C ATOM 30 C LEU A 99 -25.777 19.823 -11.555 1.00 15.54 C ATOM 31 O LEU A 99 -25.956 18.912 -10.748 1.00 17.31 O ATOM 32 CB LEU A 99 -23.379 20.132 -11.518 1.00 18.95 C ATOM 33 CG LEU A 99 -22.088 20.898 -11.380 1.00 20.93 C ATOM 34 CD1 LEU A 99 -20.956 19.868 -11.429 1.00 23.27 C ATOM 35 CD2 LEU A 99 -21.927 21.942 -12.513 1.00 21.84 C ATOM 36 H LEU A 99 -24.535 20.698 -9.166 1.00 0.00 H ATOM 37 N ASP A 100 -26.455 19.919 -12.690 1.00 15.33 N ATOM 38 CA ASP A 100 -27.415 18.896 -13.096 1.00 16.02 C ATOM 39 C ASP A 100 -26.658 17.866 -13.928 1.00 15.63 C ATOM 40 O ASP A 100 -26.244 18.168 -15.050 1.00 17.58 O ATOM 41 CB ASP A 100 -28.482 19.625 -13.925 1.00 20.54 C ATOM 42 CG ASP A 100 -29.479 18.721 -14.603 1.00 28.74 C ATOM 43 OD1 ASP A 100 -29.464 17.506 -14.418 1.00 32.32 O ATOM 44 OD2 ASP A 100 -30.313 19.254 -15.362 1.00 34.07 O ATOM 45 H ASP A 100 -26.300 20.742 -13.306 1.00 0.00 H ATOM 46 N VAL A 101 -26.441 16.674 -13.390 1.00 13.94 N ATOM 47 CA VAL A 101 -25.634 15.654 -14.049 1.00 14.14 C ATOM 48 C VAL A 101 -26.543 14.518 -14.508 1.00 14.63 C ATOM 49 O VAL A 101 -27.367 14.016 -13.735 1.00 16.33 O ATOM 50 CB VAL A 101 -24.508 15.148 -13.125 1.00 14.55 C ATOM 51 CG1 VAL A 101 -23.723 14.066 -13.827 1.00 15.35 C ATOM 52 CG2 VAL A 101 -23.605 16.304 -12.709 1.00 15.83 C ATOM 53 H VAL A 101 -26.862 16.458 -12.464 1.00 0.00 H ATOM 54 N GLU A 102 -26.399 14.095 -15.752 1.00 13.23 N ATOM 55 CA GLU A 102 -27.085 12.918 -16.263 1.00 14.51 C ATOM 56 C GLU A 102 -26.038 11.928 -16.740 1.00 12.41 C ATOM 57 O GLU A 102 -25.111 12.313 -17.458 1.00 14.16 O ATOM 58 CB GLU A 102 -28.008 13.273 -17.444 1.00 18.30 C ATOM 59 CG GLU A 102 -29.209 14.120 -17.182 1.00 25.20 C ATOM 60 CD GLU A 102 -30.271 13.981 -18.293 1.00 32.18 C ATOM 61 OE1 GLU A 102 -30.083 13.152 -19.240 1.00 34.50 O ATOM 62 OE2 GLU A 102 -31.266 14.677 -18.165 1.00 37.54 O ATOM 63 H GLU A 102 -25.771 14.624 -16.390 1.00 0.00 H ATOM 64 N VAL A 103 -26.216 10.667 -16.363 1.00 12.67 N ATOM 65 CA VAL A 103 -25.250 9.621 -16.692 1.00 12.71 C ATOM 66 C VAL A 103 -26.024 8.450 -17.249 1.00 13.04 C ATOM 67 O VAL A 103 -26.917 7.950 -16.571 1.00 14.93 O ATOM 68 CB VAL A 103 -24.424 9.199 -15.454 1.00 13.63 C ATOM 69 CG1 VAL A 103 -23.344 8.190 -15.858 1.00 13.51 C ATOM 70 CG2 VAL A 103 -23.820 10.400 -14.771 1.00 13.98 C ATOM 71 H VAL A 103 -27.066 10.417 -15.819 1.00 0.00 H ATOM 72 N TYR A 104 -25.657 7.984 -18.445 1.00 12.99 N ATOM 73 CA TYR A 104 -26.352 6.881 -19.097 1.00 13.65 C ATOM 74 C TYR A 104 -25.370 5.743 -19.354 1.00 12.47 C ATOM 75 O TYR A 104 -24.298 5.981 -19.926 1.00 12.78 O ATOM 76 CB TYR A 104 -26.934 7.412 -20.425 1.00 15.40 C ATOM 77 CG TYR A 104 -27.785 6.429 -21.190 1.00 15.99 C ATOM 78 CD1 TYR A 104 -29.133 6.307 -20.919 1.00 19.07 C ATOM 79 CD2 TYR A 104 -27.246 5.637 -22.229 1.00 16.63 C ATOM 80 CE1 TYR A 104 -29.950 5.450 -21.646 1.00 20.38 C ATOM 81 CE2 TYR A 104 -28.057 4.771 -22.955 1.00 17.95 C ATOM 82 CZ TYR A 104 -29.398 4.680 -22.643 1.00 20.27 C ATOM 83 OH TYR A 104 -30.186 3.817 -23.379 1.00 22.36 O ATOM 84 HH TYR A 104 -31.117 3.857 -23.045 1.00 0.00 H ATOM 85 H TYR A 104 -24.847 8.423 -18.928 1.00 0.00 H ATOM 86 N SER A 105 -25.773 4.535 -18.987 1.00 13.19 N ATOM 87 CA SER A 105 -24.987 3.314 -19.185 1.00 13.20 C ATOM 88 C SER A 105 -25.871 2.285 -19.892 1.00 13.70 C ATOM 89 O SER A 105 -27.022 2.061 -19.471 1.00 15.70 O ATOM 90 CB SER A 105 -24.565 2.754 -17.803 1.00 13.35 C ATOM 91 OG SER A 105 -23.934 1.487 -17.953 1.00 12.95 O ATOM 92 HG SER A 105 -23.129 1.586 -18.521 1.00 0.00 H ATOM 93 H SER A 105 -26.704 4.448 -18.531 1.00 0.00 H ATOM 94 N SER A 106 -25.329 1.622 -20.919 1.00 14.41 N ATOM 95 CA SER A 106 -26.093 0.625 -21.661 1.00 14.97 C ATOM 96 C SER A 106 -25.152 -0.268 -22.460 1.00 15.81 C ATOM 97 O SER A 106 -23.934 -0.025 -22.566 1.00 15.42 O ATOM 98 CB SER A 106 -27.127 1.302 -22.590 1.00 14.63 C ATOM 99 OG SER A 106 -26.487 1.871 -23.709 1.00 16.17 O ATOM 100 HG SER A 106 -25.834 2.550 -23.404 1.00 0.00 H ATOM 101 H SER A 106 -24.346 1.821 -21.194 1.00 0.00 H ATOM 102 N ARG A 107 -25.768 -1.286 -23.074 1.00 16.12 N ATOM 103 CA ARG A 107 -25.041 -2.198 -23.947 1.00 16.76 C ATOM 104 C ARG A 107 -24.282 -1.447 -25.041 1.00 16.92 C ATOM 105 O ARG A 107 -23.117 -1.757 -25.333 1.00 18.17 O ATOM 106 CB ARG A 107 -26.034 -3.176 -24.577 1.00 18.50 C ATOM 107 CG ARG A 107 -25.482 -3.992 -25.709 1.00 20.94 C ATOM 108 CD ARG A 107 -26.583 -4.847 -26.316 1.00 24.22 C ATOM 109 NE ARG A 107 -26.073 -5.663 -27.406 1.00 26.66 N ATOM 110 CZ ARG A 107 -26.798 -6.551 -28.077 1.00 30.37 C ATOM 111 NH1 ARG A 107 -28.076 -6.729 -27.753 1.00 31.09 N ATOM 112 NH2 ARG A 107 -26.248 -7.252 -29.067 1.00 31.18 N ATOM 113 HE ARG A 107 -25.076 -5.544 -27.678 1.00 0.00 H ATOM 114 HH12 ARG A 107 -28.652 -7.422 -28.272 1.00 0.00 H ATOM 115 HH11 ARG A 107 -28.499 -6.175 -26.981 1.00 0.00 H ATOM 116 HH22 ARG A 107 -26.817 -7.947 -29.591 1.00 0.00 H ATOM 117 HH21 ARG A 107 -25.249 -7.105 -29.316 1.00 0.00 H ATOM 118 H ARG A 107 -26.787 -1.429 -22.925 1.00 0.00 H ATOM 119 N SER A 108 -24.959 -0.483 -25.696 1.00 16.38 N ATOM 120 CA SER A 108 -24.458 0.086 -26.941 1.00 18.58 C ATOM 121 C SER A 108 -24.139 1.570 -26.896 1.00 17.46 C ATOM 122 O SER A 108 -23.689 2.124 -27.910 1.00 19.58 O ATOM 123 CB SER A 108 -25.458 -0.168 -28.078 1.00 24.67 C ATOM 124 OG SER A 108 -26.638 0.533 -27.756 1.00 29.85 O ATOM 125 HG SER A 108 -26.995 0.198 -26.895 1.00 0.00 H ATOM 126 H SER A 108 -25.858 -0.138 -25.305 1.00 0.00 H ATOM 127 N LYS A 109 -24.354 2.241 -25.760 1.00 16.06 N ATOM 128 CA LYS A 109 -24.211 3.696 -25.726 1.00 16.81 C ATOM 129 C LYS A 109 -23.937 4.177 -24.308 1.00 14.93 C ATOM 130 O LYS A 109 -24.548 3.692 -23.351 1.00 14.78 O ATOM 131 CB LYS A 109 -25.512 4.335 -26.229 1.00 18.35 C ATOM 132 CG LYS A 109 -25.630 5.810 -26.078 1.00 21.40 C ATOM 133 CD LYS A 109 -26.984 6.229 -26.672 1.00 25.81 C ATOM 134 CE LYS A 109 -27.290 7.636 -26.501 1.00 31.05 C ATOM 135 NZ LYS A 109 -28.630 7.818 -27.179 1.00 32.73 N ATOM 136 HZ1 LYS A 109 -28.548 7.558 -28.183 1.00 0.00 H ATOM 137 HZ2 LYS A 109 -29.336 7.209 -26.719 1.00 0.00 H ATOM 138 HZ3 LYS A 109 -28.925 8.812 -27.100 1.00 0.00 H ATOM 139 H LYS A 109 -24.624 1.727 -24.897 1.00 0.00 H ATOM 140 N VAL A 110 -23.030 5.132 -24.189 1.00 13.72 N ATOM 141 CA VAL A 110 -22.911 5.884 -22.943 1.00 13.28 C ATOM 142 C VAL A 110 -23.008 7.372 -23.271 1.00 12.71 C ATOM 143 O VAL A 110 -22.626 7.815 -24.361 1.00 13.14 O ATOM 144 CB VAL A 110 -21.604 5.600 -22.181 1.00 13.56 C ATOM 145 CG1 VAL A 110 -21.657 4.199 -21.575 1.00 15.01 C ATOM 146 CG2 VAL A 110 -20.363 5.818 -23.086 1.00 13.90 C ATOM 147 H VAL A 110 -22.399 5.348 -24.987 1.00 0.00 H ATOM 148 N TYR A 111 -23.486 8.155 -22.299 1.00 12.30 N ATOM 149 CA TYR A 111 -23.294 9.600 -22.373 1.00 12.42 C ATOM 150 C TYR A 111 -23.295 10.176 -20.966 1.00 12.56 C ATOM 151 O TYR A 111 -23.771 9.539 -20.008 1.00 12.86 O ATOM 152 CB TYR A 111 -24.327 10.339 -23.284 1.00 14.87 C ATOM 153 CG TYR A 111 -25.750 10.335 -22.773 1.00 16.16 C ATOM 154 CD1 TYR A 111 -26.192 11.244 -21.798 1.00 18.01 C ATOM 155 CD2 TYR A 111 -26.696 9.447 -23.303 1.00 17.53 C ATOM 156 CE1 TYR A 111 -27.550 11.253 -21.379 1.00 20.56 C ATOM 157 CE2 TYR A 111 -27.995 9.451 -22.904 1.00 19.24 C ATOM 158 CZ TYR A 111 -28.424 10.321 -21.943 1.00 20.41 C ATOM 159 OH TYR A 111 -29.758 10.217 -21.584 1.00 25.35 O ATOM 160 HH TYR A 111 -30.326 10.381 -22.378 1.00 0.00 H ATOM 161 H TYR A 111 -23.993 7.736 -21.493 1.00 0.00 H ATOM 162 N VAL A 112 -22.714 11.354 -20.857 1.00 11.84 N ATOM 163 CA VAL A 112 -22.753 12.145 -19.634 1.00 11.63 C ATOM 164 C VAL A 112 -23.100 13.550 -20.074 1.00 11.45 C ATOM 165 O VAL A 112 -22.470 14.095 -20.998 1.00 13.11 O ATOM 166 CB VAL A 112 -21.409 12.129 -18.875 1.00 12.95 C ATOM 167 CG1 VAL A 112 -21.472 13.071 -17.668 1.00 13.47 C ATOM 168 CG2 VAL A 112 -21.061 10.692 -18.457 1.00 13.37 C ATOM 169 H VAL A 112 -22.205 11.736 -21.680 1.00 0.00 H ATOM 170 N ALA A 113 -24.089 14.143 -19.406 1.00 12.34 N ATOM 171 CA ALA A 113 -24.448 15.529 -19.625 1.00 13.06 C ATOM 172 C ALA A 113 -24.282 16.299 -18.319 1.00 12.62 C ATOM 173 O ALA A 113 -24.538 15.772 -17.213 1.00 13.42 O ATOM 174 CB ALA A 113 -25.890 15.667 -20.110 1.00 14.28 C ATOM 175 H ALA A 113 -24.621 13.592 -18.703 1.00 0.00 H ATOM 176 N VAL A 114 -23.808 17.538 -18.450 1.00 12.47 N ATOM 177 CA VAL A 114 -23.606 18.430 -17.294 1.00 12.88 C ATOM 178 C VAL A 114 -24.311 19.738 -17.642 1.00 13.52 C ATOM 179 O VAL A 114 -23.999 20.370 -18.663 1.00 14.55 O ATOM 180 CB VAL A 114 -22.110 18.664 -16.992 1.00 14.50 C ATOM 181 CG1 VAL A 114 -21.983 19.671 -15.821 1.00 15.94 C ATOM 182 CG2 VAL A 114 -21.392 17.359 -16.684 1.00 14.68 C ATOM 183 H VAL A 114 -23.573 17.887 -19.401 1.00 0.00 H ATOM 184 N ASP A 115 -25.289 20.118 -16.840 1.00 15.69 N ATOM 185 CA ASP A 115 -26.066 21.324 -17.070 1.00 17.24 C ATOM 186 C ASP A 115 -26.685 21.368 -18.468 1.00 17.55 C ATOM 187 O ASP A 115 -26.789 22.424 -19.093 1.00 19.75 O ATOM 188 CB ASP A 115 -25.246 22.576 -16.763 1.00 19.34 C ATOM 189 CG ASP A 115 -24.996 22.753 -15.257 1.00 21.35 C ATOM 190 OD1 ASP A 115 -25.704 22.108 -14.436 1.00 21.99 O ATOM 191 OD2 ASP A 115 -24.141 23.606 -14.911 1.00 24.89 O ATOM 192 H ASP A 115 -25.512 19.531 -16.011 1.00 0.00 H ATOM 193 N GLY A 116 -27.132 20.216 -18.950 1.00 15.98 N ATOM 194 CA GLY A 116 -27.920 20.168 -20.165 1.00 16.17 C ATOM 195 C GLY A 116 -27.115 20.003 -21.424 1.00 15.49 C ATOM 196 O GLY A 116 -27.703 19.971 -22.516 1.00 17.74 O ATOM 197 H GLY A 116 -26.913 19.332 -18.447 1.00 0.00 H ATOM 198 N THR A 117 -25.792 19.874 -21.330 1.00 14.47 N ATOM 199 CA THR A 117 -24.854 19.792 -22.455 1.00 16.27 C ATOM 200 C THR A 117 -24.122 18.454 -22.344 1.00 12.62 C ATOM 201 O THR A 117 -23.620 18.127 -21.277 1.00 12.69 O ATOM 202 CB THR A 117 -23.777 20.958 -22.206 1.00 19.88 C ATOM 203 OG1 THR A 117 -24.401 22.262 -22.267 1.00 24.52 O ATOM 204 CG2 THR A 117 -22.740 20.900 -23.056 1.00 23.64 C ATOM 205 HG1 THR A 117 -23.718 22.961 -22.111 1.00 0.00 H ATOM 206 H THR A 117 -25.388 19.827 -20.373 1.00 0.00 H ATOM 207 N THR A 118 -23.998 17.725 -23.449 1.00 12.31 N ATOM 208 CA THR A 118 -23.275 16.459 -23.457 1.00 14.18 C ATOM 209 C THR A 118 -21.759 16.685 -23.427 1.00 13.71 C ATOM 210 O THR A 118 -21.219 17.318 -24.334 1.00 15.33 O ATOM 211 CB THR A 118 -23.715 15.730 -24.752 1.00 19.75 C ATOM 212 OG1 THR A 118 -25.170 15.648 -24.717 1.00 20.62 O ATOM 213 CG2 THR A 118 -23.151 14.407 -24.735 1.00 21.35 C ATOM 214 HG1 THR A 118 -25.493 15.186 -25.531 1.00 0.00 H ATOM 215 H THR A 118 -24.429 18.067 -24.332 1.00 0.00 H ATOM 216 N VAL A 119 -21.075 16.142 -22.405 1.00 13.37 N ATOM 217 CA VAL A 119 -19.609 16.199 -22.306 1.00 14.34 C ATOM 218 C VAL A 119 -18.947 14.904 -22.726 1.00 14.99 C ATOM 219 O VAL A 119 -17.730 14.891 -22.935 1.00 16.45 O ATOM 220 CB VAL A 119 -19.119 16.626 -20.908 1.00 16.29 C ATOM 221 CG1 VAL A 119 -19.716 18.001 -20.565 1.00 17.41 C ATOM 222 CG2 VAL A 119 -19.461 15.559 -19.834 1.00 18.04 C ATOM 223 H VAL A 119 -21.606 15.661 -21.651 1.00 0.00 H ATOM 224 N LEU A 120 -19.707 13.810 -22.808 1.00 14.24 N ATOM 225 CA LEU A 120 -19.223 12.510 -23.259 1.00 14.59 C ATOM 226 C LEU A 120 -20.383 11.894 -23.995 1.00 13.51 C ATOM 227 O LEU A 120 -21.520 11.900 -23.481 1.00 13.64 O ATOM 228 CB LEU A 120 -18.878 11.631 -22.051 1.00 16.89 C ATOM 229 CG LEU A 120 -18.442 10.206 -22.366 1.00 21.81 C ATOM 230 CD1 LEU A 120 -19.547 9.228 -22.509 1.00 27.42 C ATOM 231 CD2 LEU A 120 -17.429 9.945 -23.414 1.00 23.51 C ATOM 232 H LEU A 120 -20.707 13.889 -22.533 1.00 0.00 H ATOM 233 N GLU A 121 -20.120 11.370 -25.175 1.00 14.51 N ATOM 234 CA GLU A 121 -21.170 10.682 -25.910 1.00 15.00 C ATOM 235 C GLU A 121 -20.510 9.660 -26.811 1.00 15.65 C ATOM 236 O GLU A 121 -19.726 10.052 -27.679 1.00 18.14 O ATOM 237 CB GLU A 121 -21.916 11.683 -26.779 1.00 18.38 C ATOM 238 CG GLU A 121 -23.218 11.255 -27.346 1.00 21.70 C ATOM 239 CD GLU A 121 -24.011 12.483 -27.842 1.00 25.47 C ATOM 240 OE1 GLU A 121 -23.426 13.576 -28.007 1.00 32.22 O ATOM 241 OE2 GLU A 121 -25.213 12.363 -28.013 1.00 24.67 O ATOM 242 H GLU A 121 -19.165 11.448 -25.579 1.00 0.00 H ATOM 243 N ASP A 122 -20.827 8.376 -26.623 1.00 14.26 N ATOM 244 CA ASP A 122 -20.217 7.313 -27.419 1.00 15.49 C ATOM 245 C ASP A 122 -21.295 6.303 -27.755 1.00 15.41 C ATOM 246 O ASP A 122 -21.660 5.472 -26.919 1.00 15.75 O ATOM 247 CB ASP A 122 -19.046 6.647 -26.694 1.00 16.83 C ATOM 248 CG ASP A 122 -18.329 5.625 -27.584 1.00 18.41 C ATOM 249 OD1 ASP A 122 -18.931 5.136 -28.560 1.00 19.72 O ATOM 250 OD2 ASP A 122 -17.164 5.315 -27.288 1.00 21.21 O ATOM 251 H ASP A 122 -21.524 8.127 -25.893 1.00 0.00 H ATOM 252 N GLU A 123 -21.790 6.391 -28.991 1.00 16.09 N ATOM 253 CA GLU A 123 -22.833 5.535 -29.536 1.00 19.02 C ATOM 254 C GLU A 123 -22.277 4.655 -30.644 1.00 21.42 C ATOM 255 O GLU A 123 -23.048 4.037 -31.370 1.00 24.39 O ATOM 256 CB GLU A 123 -24.050 6.369 -30.030 1.00 19.95 C ATOM 257 CG GLU A 123 -23.751 7.322 -31.231 1.00 21.67 C ATOM 258 CD GLU A 123 -24.934 8.157 -31.710 1.00 22.18 C ATOM 259 OE1 GLU A 123 -25.804 8.484 -30.854 1.00 23.05 O ATOM 260 OE2 GLU A 123 -24.983 8.525 -32.948 1.00 21.72 O ATOM 261 H GLU A 123 -21.400 7.128 -29.613 1.00 0.00 H ATOM 262 N ALA A 124 -20.959 4.594 -30.795 1.00 20.71 N ATOM 263 CA ALA A 124 -20.343 3.892 -31.912 1.00 23.89 C ATOM 264 C ALA A 124 -20.315 2.396 -31.673 1.00 26.09 C ATOM 265 O ALA A 124 -19.940 1.924 -30.597 1.00 27.32 O ATOM 266 CB ALA A 124 -18.928 4.410 -32.149 1.00 24.80 C ATOM 267 H ALA A 124 -20.349 5.062 -30.095 1.00 0.00 H ATOM 268 N ARG A 125 -20.619 1.649 -32.732 1.00 31.69 N ATOM 269 CA ARG A 125 -20.866 0.211 -32.709 1.00 40.44 C ATOM 270 C ARG A 125 -19.900 -0.605 -31.860 1.00 44.39 C ATOM 271 O ARG A 125 -20.281 -1.092 -30.789 1.00 49.98 O ATOM 272 CB ARG A 125 -20.921 -0.318 -34.149 1.00 45.92 C ATOM 273 CG ARG A 125 -21.168 -1.815 -34.285 1.00 51.48 C ATOM 274 CD ARG A 125 -21.054 -2.263 -35.748 1.00 56.11 C ATOM 275 NE ARG A 125 -19.690 -2.128 -36.264 1.00 59.51 N ATOM 276 CZ ARG A 125 -19.391 -1.956 -37.547 1.00 62.65 C ATOM 277 NH1 ARG A 125 -18.124 -1.838 -37.928 1.00 63.89 N ATOM 278 NH2 ARG A 125 -20.362 -1.893 -38.450 1.00 63.79 N ATOM 279 HE ARG A 125 -18.905 -2.169 -35.583 1.00 0.00 H ATOM 280 HH12 ARG A 125 -17.894 -1.703 -38.933 1.00 0.00 H ATOM 281 HH11 ARG A 125 -17.362 -1.880 -37.221 1.00 0.00 H ATOM 282 HH22 ARG A 125 -20.130 -1.758 -39.455 1.00 0.00 H ATOM 283 HH21 ARG A 125 -21.355 -1.978 -38.153 1.00 0.00 H ATOM 284 H ARG A 125 -20.686 2.130 -33.652 1.00 0.00 H ATOM 285 N GLU A 126 -18.651 -0.741 -32.291 1.00 41.83 N ATOM 286 CA GLU A 126 -17.752 -1.667 -31.606 1.00 41.49 C ATOM 287 C GLU A 126 -16.567 -0.916 -31.021 1.00 37.58 C ATOM 288 O GLU A 126 -15.412 -1.322 -31.197 1.00 38.70 O ATOM 289 CB GLU A 126 -17.232 -2.758 -32.555 1.00 46.57 C ATOM 290 CG GLU A 126 -18.270 -3.488 -33.402 1.00 50.97 C ATOM 291 CD GLU A 126 -19.009 -4.584 -32.640 1.00 55.48 C ATOM 292 OE1 GLU A 126 -18.613 -4.927 -31.521 1.00 57.25 O ATOM 293 OE2 GLU A 126 -19.991 -5.114 -33.162 1.00 57.09 O ATOM 294 H GLU A 126 -18.316 -0.193 -33.109 1.00 0.00 H ATOM 295 N GLN A 127 -16.849 0.189 -30.338 1.00 30.36 N ATOM 296 CA GLN A 127 -15.826 1.056 -29.781 1.00 27.30 C ATOM 297 C GLN A 127 -16.248 1.431 -28.375 1.00 22.19 C ATOM 298 O GLN A 127 -17.431 1.359 -28.029 1.00 23.26 O ATOM 299 CB GLN A 127 -15.693 2.364 -30.593 1.00 31.14 C ATOM 300 CG GLN A 127 -15.256 2.147 -32.017 1.00 36.01 C ATOM 301 CD GLN A 127 -15.038 3.453 -32.798 1.00 39.27 C ATOM 302 OE1 GLN A 127 -15.330 4.557 -32.321 1.00 40.60 O ATOM 303 NE2 GLN A 127 -14.516 3.320 -34.010 1.00 41.09 N ATOM 304 HE22 GLN A 127 -14.284 2.374 -34.375 1.00 0.00 H ATOM 305 HE21 GLN A 127 -14.339 4.161 -34.595 1.00 0.00 H ATOM 306 H GLN A 127 -17.847 0.444 -30.196 1.00 0.00 H ATOM 307 N GLY A 128 -15.279 1.871 -27.565 1.00 18.65 N ATOM 308 CA GLY A 128 -15.618 2.451 -26.275 1.00 16.19 C ATOM 309 C GLY A 128 -16.100 1.471 -25.238 1.00 14.09 C ATOM 310 O GLY A 128 -16.716 1.876 -24.248 1.00 14.13 O ATOM 311 H GLY A 128 -14.284 1.798 -27.857 1.00 0.00 H ATOM 312 N ARG A 129 -15.783 0.195 -25.378 1.00 13.98 N ATOM 313 CA ARG A 129 -16.197 -0.764 -24.346 1.00 14.12 C ATOM 314 C ARG A 129 -15.511 -0.471 -23.012 1.00 13.04 C ATOM 315 O ARG A 129 -14.329 -0.108 -22.968 1.00 13.44 O ATOM 316 CB ARG A 129 -15.826 -2.186 -24.781 1.00 14.68 C ATOM 317 CG ARG A 129 -16.226 -3.278 -23.780 1.00 14.30 C ATOM 318 CD ARG A 129 -15.941 -4.661 -24.341 1.00 14.49 C ATOM 319 NE ARG A 129 -14.529 -4.776 -24.705 1.00 14.82 N ATOM 320 CZ ARG A 129 -14.031 -5.474 -25.706 1.00 16.16 C ATOM 321 NH1 ARG A 129 -14.823 -6.230 -26.469 1.00 17.97 N ATOM 322 NH2 ARG A 129 -12.707 -5.443 -25.905 1.00 16.86 N ATOM 323 HE ARG A 129 -13.850 -4.255 -24.115 1.00 0.00 H ATOM 324 HH12 ARG A 129 -14.419 -6.777 -27.256 1.00 0.00 H ATOM 325 HH11 ARG A 129 -15.844 -6.273 -26.276 1.00 0.00 H ATOM 326 HH22 ARG A 129 -12.286 -5.984 -26.687 1.00 0.00 H ATOM 327 HH21 ARG A 129 -12.100 -4.878 -25.277 1.00 0.00 H ATOM 328 H ARG A 129 -15.247 -0.126 -26.209 1.00 0.00 H ATOM 329 N GLY A 130 -16.249 -0.661 -21.912 1.00 12.11 N ATOM 330 CA GLY A 130 -15.635 -0.640 -20.580 1.00 11.69 C ATOM 331 C GLY A 130 -16.184 0.482 -19.712 1.00 11.24 C ATOM 332 O GLY A 130 -17.353 0.883 -19.822 1.00 12.98 O ATOM 333 H GLY A 130 -17.272 -0.826 -22.003 1.00 0.00 H ATOM 334 N ILE A 131 -15.355 0.922 -18.764 1.00 11.09 N ATOM 335 CA ILE A 131 -15.762 1.925 -17.786 1.00 11.20 C ATOM 336 C ILE A 131 -15.240 3.277 -18.247 1.00 10.61 C ATOM 337 O ILE A 131 -14.025 3.494 -18.348 1.00 12.09 O ATOM 338 CB ILE A 131 -15.236 1.599 -16.379 1.00 11.52 C ATOM 339 CG1 ILE A 131 -15.777 0.239 -15.907 1.00 12.10 C ATOM 340 CG2 ILE A 131 -15.647 2.716 -15.397 1.00 13.74 C ATOM 341 CD1 ILE A 131 -15.131 -0.258 -14.601 1.00 12.65 C ATOM 342 H ILE A 131 -14.389 0.538 -18.721 1.00 0.00 H ATOM 343 N HIS A 132 -16.163 4.173 -18.559 1.00 10.77 N ATOM 344 CA HIS A 132 -15.837 5.557 -18.884 1.00 11.04 C ATOM 345 C HIS A 132 -15.762 6.340 -17.575 1.00 11.46 C ATOM 346 O HIS A 132 -16.640 6.186 -16.717 1.00 12.65 O ATOM 347 CB HIS A 132 -16.940 6.153 -19.778 1.00 12.50 C ATOM 348 CG HIS A 132 -16.981 5.517 -21.133 1.00 12.06 C ATOM 349 ND1 HIS A 132 -16.589 6.185 -22.270 1.00 13.70 N ATOM 350 CD2 HIS A 132 -17.285 4.242 -21.506 1.00 12.61 C ATOM 351 CE1 HIS A 132 -16.695 5.370 -23.298 1.00 14.21 C ATOM 352 NE2 HIS A 132 -17.107 4.184 -22.869 1.00 12.77 N ATOM 353 H HIS A 132 -17.160 3.878 -18.573 1.00 0.00 H ATOM 354 N VAL A 133 -14.726 7.179 -17.447 1.00 11.00 N ATOM 355 CA VAL A 133 -14.518 7.982 -16.258 1.00 11.95 C ATOM 356 C VAL A 133 -14.393 9.437 -16.660 1.00 11.63 C ATOM 357 O VAL A 133 -13.591 9.764 -17.549 1.00 13.28 O ATOM 358 CB VAL A 133 -13.261 7.531 -15.495 1.00 13.46 C ATOM 359 CG1 VAL A 133 -13.082 8.380 -14.254 1.00 14.95 C ATOM 360 CG2 VAL A 133 -13.340 6.045 -15.135 1.00 14.17 C ATOM 361 H VAL A 133 -14.045 7.257 -18.230 1.00 0.00 H ATOM 362 N ILE A 134 -15.208 10.291 -16.026 1.00 10.96 N ATOM 363 CA ILE A 134 -15.128 11.728 -16.224 1.00 11.18 C ATOM 364 C ILE A 134 -14.857 12.368 -14.872 1.00 10.58 C ATOM 365 O ILE A 134 -15.481 11.997 -13.864 1.00 11.49 O ATOM 366 CB ILE A 134 -16.459 12.243 -16.778 1.00 14.64 C ATOM 367 CG1 ILE A 134 -16.688 11.709 -18.187 1.00 20.10 C ATOM 368 CG2 ILE A 134 -16.530 13.778 -16.755 1.00 18.42 C ATOM 369 CD1 ILE A 134 -17.826 12.365 -18.829 1.00 27.86 C ATOM 370 H ILE A 134 -15.921 9.913 -15.371 1.00 0.00 H ATOM 371 N VAL A 135 -13.910 13.313 -14.848 1.00 10.37 N ATOM 372 CA VAL A 135 -13.568 14.058 -13.638 1.00 10.42 C ATOM 373 C VAL A 135 -13.960 15.506 -13.863 1.00 10.18 C ATOM 374 O VAL A 135 -13.538 16.104 -14.874 1.00 10.91 O ATOM 375 CB VAL A 135 -12.045 13.950 -13.378 1.00 11.57 C ATOM 376 CG1 VAL A 135 -11.671 14.734 -12.114 1.00 12.04 C ATOM 377 CG2 VAL A 135 -11.614 12.491 -13.257 1.00 12.61 C ATOM 378 H VAL A 135 -13.396 13.526 -15.727 1.00 0.00 H ATOM 379 N LEU A 136 -14.758 16.074 -12.936 1.00 10.01 N ATOM 380 CA LEU A 136 -15.152 17.477 -13.053 1.00 10.28 C ATOM 381 C LEU A 136 -14.540 18.318 -11.939 1.00 10.62 C ATOM 382 O LEU A 136 -14.385 17.863 -10.794 1.00 11.08 O ATOM 383 CB LEU A 136 -16.682 17.688 -12.928 1.00 11.37 C ATOM 384 CG LEU A 136 -17.549 16.817 -13.824 1.00 10.78 C ATOM 385 CD1 LEU A 136 -19.026 17.193 -13.561 1.00 12.53 C ATOM 386 CD2 LEU A 136 -17.189 16.989 -15.274 1.00 12.32 C ATOM 387 H LEU A 136 -15.096 15.509 -12.131 1.00 0.00 H ATOM 388 N ASN A 137 -14.247 19.575 -12.273 1.00 10.88 N ATOM 389 CA ASN A 137 -13.951 20.577 -11.252 1.00 11.05 C ATOM 390 C ASN A 137 -15.200 20.796 -10.393 1.00 11.33 C ATOM 391 O ASN A 137 -16.296 20.979 -10.917 1.00 11.92 O ATOM 392 CB ASN A 137 -13.484 21.870 -11.907 1.00 12.00 C ATOM 393 CG ASN A 137 -13.186 22.935 -10.889 1.00 11.76 C ATOM 394 OD1 ASN A 137 -14.127 23.519 -10.335 1.00 12.44 O ATOM 395 ND2 ASN A 137 -11.919 23.174 -10.580 1.00 12.28 N ATOM 396 HD22 ASN A 137 -11.159 22.661 -11.070 1.00 0.00 H ATOM 397 HD21 ASN A 137 -11.686 23.875 -9.848 1.00 0.00 H ATOM 398 H ASN A 137 -14.229 19.847 -13.277 1.00 0.00 H ATOM 399 N GLN A 138 -15.014 20.777 -9.084 1.00 11.57 N ATOM 400 CA GLN A 138 -16.120 20.761 -8.149 1.00 12.41 C ATOM 401 C GLN A 138 -16.741 22.137 -7.925 1.00 13.36 C ATOM 402 O GLN A 138 -17.803 22.213 -7.290 1.00 15.82 O ATOM 403 CB GLN A 138 -15.640 20.172 -6.823 1.00 14.33 C ATOM 404 CG GLN A 138 -14.457 20.890 -6.136 1.00 15.04 C ATOM 405 CD GLN A 138 -13.077 20.348 -6.529 1.00 15.23 C ATOM 406 OE1 GLN A 138 -12.763 20.060 -7.681 1.00 14.34 O ATOM 407 NE2 GLN A 138 -12.183 20.300 -5.558 1.00 17.31 N ATOM 408 HE22 GLN A 138 -12.458 20.546 -4.586 1.00 0.00 H ATOM 409 HE21 GLN A 138 -11.204 20.017 -5.766 1.00 0.00 H ATOM 410 H GLN A 138 -14.042 20.773 -8.714 1.00 0.00 H ATOM 411 N ALA A 139 -16.145 23.208 -8.435 1.00 13.20 N ATOM 412 CA ALA A 139 -16.713 24.556 -8.359 1.00 14.51 C ATOM 413 C ALA A 139 -17.373 24.980 -9.668 1.00 14.57 C ATOM 414 O ALA A 139 -18.339 25.746 -9.647 1.00 16.78 O ATOM 415 CB ALA A 139 -15.644 25.602 -7.965 1.00 15.61 C ATOM 416 H ALA A 139 -15.229 23.084 -8.912 1.00 0.00 H ATOM 417 N THR A 140 -16.839 24.565 -10.821 1.00 13.93 N ATOM 418 CA THR A 140 -17.337 25.018 -12.115 1.00 14.63 C ATOM 419 C THR A 140 -18.025 23.937 -12.916 1.00 14.09 C ATOM 420 O THR A 140 -18.743 24.273 -13.874 1.00 15.57 O ATOM 421 CB THR A 140 -16.186 25.569 -12.972 1.00 14.85 C ATOM 422 OG1 THR A 140 -15.255 24.506 -13.182 1.00 13.60 O ATOM 423 CG2 THR A 140 -15.490 26.753 -12.302 1.00 16.54 C ATOM 424 HG1 THR A 140 -14.914 24.190 -12.308 1.00 0.00 H ATOM 425 H THR A 140 -16.042 23.897 -10.795 1.00 0.00 H ATOM 426 N GLY A 141 -17.764 22.657 -12.601 1.00 13.18 N ATOM 427 CA GLY A 141 -18.247 21.592 -13.461 1.00 13.21 C ATOM 428 C GLY A 141 -17.449 21.375 -14.730 1.00 12.73 C ATOM 429 O GLY A 141 -17.814 20.501 -15.537 1.00 13.54 O ATOM 430 H GLY A 141 -17.218 22.430 -11.745 1.00 0.00 H ATOM 431 N HIS A 142 -16.352 22.119 -14.941 1.00 12.57 N ATOM 432 CA HIS A 142 -15.550 21.904 -16.149 1.00 12.23 C ATOM 433 C HIS A 142 -14.925 20.513 -16.114 1.00 11.46 C ATOM 434 O HIS A 142 -14.522 20.013 -15.056 1.00 11.51 O ATOM 435 CB HIS A 142 -14.440 22.948 -16.269 1.00 13.27 C ATOM 436 CG HIS A 142 -14.957 24.325 -16.543 1.00 13.87 C ATOM 437 ND1 HIS A 142 -14.137 25.413 -16.635 1.00 16.54 N ATOM 438 CD2 HIS A 142 -16.226 24.784 -16.684 1.00 16.63 C ATOM 439 CE1 HIS A 142 -14.876 26.489 -16.854 1.00 17.66 C ATOM 440 NE2 HIS A 142 -16.143 26.127 -16.891 1.00 18.17 N ATOM 441 H HIS A 142 -16.072 22.845 -14.251 1.00 0.00 H ATOM 442 N VAL A 143 -14.793 19.889 -17.284 1.00 12.08 N ATOM 443 CA VAL A 143 -14.196 18.564 -17.386 1.00 11.41 C ATOM 444 C VAL A 143 -12.687 18.668 -17.248 1.00 10.72 C ATOM 445 O VAL A 143 -12.015 19.283 -18.080 1.00 12.37 O ATOM 446 CB VAL A 143 -14.584 17.885 -18.713 1.00 12.57 C ATOM 447 CG1 VAL A 143 -13.850 16.561 -18.839 1.00 13.24 C ATOM 448 CG2 VAL A 143 -16.114 17.681 -18.772 1.00 14.38 C ATOM 449 H VAL A 143 -15.126 20.361 -18.149 1.00 0.00 H ATOM 450 N MET A 144 -12.142 18.023 -16.227 1.00 10.32 N ATOM 451 CA MET A 144 -10.694 17.965 -16.002 1.00 10.81 C ATOM 452 C MET A 144 -10.036 16.781 -16.690 1.00 10.92 C ATOM 453 O MET A 144 -8.843 16.843 -16.986 1.00 13.37 O ATOM 454 CB MET A 144 -10.402 17.879 -14.499 1.00 11.82 C ATOM 455 CG MET A 144 -10.902 19.067 -13.690 1.00 12.44 C ATOM 456 SD MET A 144 -10.108 20.642 -14.065 1.00 13.53 S ATOM 457 CE MET A 144 -11.213 21.379 -15.252 1.00 13.59 C ATOM 458 H MET A 144 -12.769 17.536 -15.555 1.00 0.00 H ATOM 459 N ALA A 145 -10.771 15.692 -16.907 1.00 10.63 N ATOM 460 CA ALA A 145 -10.196 14.503 -17.537 1.00 11.27 C ATOM 461 C ALA A 145 -11.355 13.642 -18.017 1.00 10.75 C ATOM 462 O ALA A 145 -12.434 13.608 -17.404 1.00 11.13 O ATOM 463 CB ALA A 145 -9.334 13.702 -16.539 1.00 13.25 C ATOM 464 H ALA A 145 -11.772 15.686 -16.624 1.00 0.00 H ATOM 465 N LYS A 146 -11.107 12.919 -19.107 1.00 11.82 N ATOM 466 CA LYS A 146 -12.056 11.963 -19.665 1.00 14.59 C ATOM 467 C LYS A 146 -11.249 10.739 -20.066 1.00 16.15 C ATOM 468 O LYS A 146 -10.276 10.871 -20.818 1.00 23.47 O ATOM 469 CB LYS A 146 -12.780 12.636 -20.884 1.00 18.46 C ATOM 470 CG LYS A 146 -13.808 11.802 -21.679 1.00 23.49 C ATOM 471 CD LYS A 146 -14.831 12.626 -22.511 1.00 30.37 C ATOM 472 CE LYS A 146 -14.164 13.468 -23.580 1.00 36.79 C ATOM 473 NZ LYS A 146 -15.207 14.036 -24.473 1.00 40.70 N ATOM 474 HZ1 LYS A 146 -15.739 13.262 -24.918 1.00 0.00 H ATOM 475 HZ2 LYS A 146 -15.855 14.628 -23.915 1.00 0.00 H ATOM 476 HZ3 LYS A 146 -14.754 14.615 -25.209 1.00 0.00 H ATOM 477 H LYS A 146 -10.191 13.042 -19.584 1.00 0.00 H ATOM 478 N ARG A 147 -11.597 9.555 -19.587 1.00 12.37 N ATOM 479 CA ARG A 147 -10.872 8.337 -19.913 1.00 12.86 C ATOM 480 C ARG A 147 -11.878 7.230 -20.195 1.00 11.23 C ATOM 481 O ARG A 147 -13.042 7.296 -19.780 1.00 11.65 O ATOM 482 CB ARG A 147 -10.016 7.913 -18.714 1.00 16.26 C ATOM 483 CG ARG A 147 -8.921 8.944 -18.293 1.00 19.01 C ATOM 484 CD ARG A 147 -7.976 9.507 -19.486 1.00 22.51 C ATOM 485 NE ARG A 147 -6.853 10.364 -19.030 1.00 21.65 N ATOM 486 CZ ARG A 147 -5.838 9.779 -18.447 1.00 20.94 C ATOM 487 NH1 ARG A 147 -5.887 8.438 -18.293 1.00 22.67 N ATOM 488 NH2 ARG A 147 -4.819 10.470 -18.009 1.00 18.75 N ATOM 489 HE ARG A 147 -6.872 11.394 -19.169 1.00 0.00 H ATOM 490 HH12 ARG A 147 -5.099 7.938 -17.834 1.00 0.00 H ATOM 491 HH11 ARG A 147 -6.713 7.905 -18.633 1.00 0.00 H ATOM 492 HH22 ARG A 147 -4.022 9.986 -17.548 1.00 0.00 H ATOM 493 HH21 ARG A 147 -4.805 11.504 -18.121 1.00 0.00 H ATOM 494 H ARG A 147 -12.420 9.493 -18.954 1.00 0.00 H ATOM 495 N VAL A 148 -11.405 6.193 -20.863 1.00 11.51 N ATOM 496 CA VAL A 148 -12.153 4.938 -20.918 1.00 12.94 C ATOM 497 C VAL A 148 -11.201 3.803 -20.661 1.00 11.70 C ATOM 498 O VAL A 148 -10.128 3.744 -21.252 1.00 13.45 O ATOM 499 CB VAL A 148 -12.918 4.740 -22.243 1.00 16.77 C ATOM 500 CG1 VAL A 148 -12.032 4.926 -23.442 1.00 20.26 C ATOM 501 CG2 VAL A 148 -13.664 3.422 -22.311 1.00 17.44 C ATOM 502 H VAL A 148 -10.492 6.270 -21.355 1.00 0.00 H ATOM 503 N PHE A 149 -11.589 2.904 -19.766 1.00 11.23 N ATOM 504 CA PHE A 149 -10.773 1.741 -19.400 1.00 11.50 C ATOM 505 C PHE A 149 -11.532 0.484 -19.817 1.00 11.25 C ATOM 506 O PHE A 149 -12.649 0.228 -19.331 1.00 11.38 O ATOM 507 CB PHE A 149 -10.504 1.754 -17.889 1.00 12.14 C ATOM 508 CG PHE A 149 -9.756 2.961 -17.448 1.00 12.07 C ATOM 509 CD1 PHE A 149 -8.378 3.050 -17.694 1.00 12.39 C ATOM 510 CD2 PHE A 149 -10.430 4.040 -16.845 1.00 12.60 C ATOM 511 CE1 PHE A 149 -7.688 4.204 -17.316 1.00 12.87 C ATOM 512 CE2 PHE A 149 -9.732 5.184 -16.496 1.00 13.21 C ATOM 513 CZ PHE A 149 -8.366 5.258 -16.717 1.00 13.65 C ATOM 514 H PHE A 149 -12.512 3.029 -19.304 1.00 0.00 H ATOM 515 N ASP A 150 -10.968 -0.253 -20.791 1.00 11.39 N ATOM 516 CA ASP A 150 -11.644 -1.437 -21.296 1.00 12.39 C ATOM 517 C ASP A 150 -11.437 -2.604 -20.330 1.00 11.43 C ATOM 518 O ASP A 150 -10.635 -3.508 -20.583 1.00 11.87 O ATOM 519 CB ASP A 150 -11.132 -1.801 -22.690 1.00 13.07 C ATOM 520 CG ASP A 150 -11.772 -3.059 -23.228 1.00 14.62 C ATOM 521 OD1 ASP A 150 -12.855 -3.431 -22.737 1.00 13.70 O ATOM 522 OD2 ASP A 150 -11.212 -3.687 -24.161 1.00 17.16 O ATOM 523 H ASP A 150 -10.046 0.025 -21.184 1.00 0.00 H ATOM 524 N THR A 151 -12.179 -2.583 -19.208 1.00 11.19 N ATOM 525 CA THR A 151 -11.978 -3.555 -18.143 1.00 11.52 C ATOM 526 C THR A 151 -12.568 -4.929 -18.451 1.00 12.08 C ATOM 527 O THR A 151 -12.487 -5.821 -17.613 1.00 12.74 O ATOM 528 CB THR A 151 -12.468 -2.962 -16.833 1.00 11.45 C ATOM 529 OG1 THR A 151 -13.753 -2.386 -17.025 1.00 11.90 O ATOM 530 CG2 THR A 151 -11.512 -1.845 -16.341 1.00 12.38 C ATOM 531 HG1 THR A 151 -14.385 -3.085 -17.328 1.00 0.00 H ATOM 532 H THR A 151 -12.914 -1.855 -19.099 1.00 0.00 H ATOM 533 N TYR A 152 -13.138 -5.107 -19.635 1.00 12.16 N ATOM 534 CA TYR A 152 -13.339 -6.448 -20.186 1.00 12.88 C ATOM 535 C TYR A 152 -12.004 -7.145 -20.537 1.00 12.47 C ATOM 536 O TYR A 152 -11.971 -8.375 -20.697 1.00 13.01 O ATOM 537 CB TYR A 152 -14.228 -6.307 -21.430 1.00 14.15 C ATOM 538 CG TYR A 152 -14.363 -7.546 -22.266 1.00 15.26 C ATOM 539 CD1 TYR A 152 -15.325 -8.496 -21.948 1.00 16.69 C ATOM 540 CD2 TYR A 152 -13.605 -7.708 -23.436 1.00 17.41 C ATOM 541 CE1 TYR A 152 -15.507 -9.604 -22.779 1.00 21.78 C ATOM 542 CE2 TYR A 152 -13.795 -8.781 -24.242 1.00 20.72 C ATOM 543 CZ TYR A 152 -14.721 -9.738 -23.910 1.00 25.04 C ATOM 544 OH TYR A 152 -14.914 -10.799 -24.781 1.00 30.01 O ATOM 545 HH TYR A 152 -14.064 -11.295 -24.889 1.00 0.00 H ATOM 546 H TYR A 152 -13.448 -4.279 -20.182 1.00 0.00 H ATOM 547 N SER A 153 -10.919 -6.367 -20.712 1.00 12.87 N ATOM 548 CA SER A 153 -9.640 -6.900 -21.162 1.00 12.66 C ATOM 549 C SER A 153 -8.609 -6.758 -20.042 1.00 12.07 C ATOM 550 O SER A 153 -8.665 -5.808 -19.260 1.00 12.64 O ATOM 551 CB SER A 153 -9.135 -6.089 -22.355 1.00 14.05 C ATOM 552 OG SER A 153 -10.021 -6.194 -23.435 1.00 15.61 O ATOM 553 HG SER A 153 -10.101 -7.144 -23.703 1.00 0.00 H ATOM 554 H SER A 153 -10.997 -5.348 -20.519 1.00 0.00 H ATOM 555 N PRO A 154 -7.620 -7.640 -19.981 1.00 12.48 N ATOM 556 CA PRO A 154 -6.612 -7.534 -18.903 1.00 12.49 C ATOM 557 C PRO A 154 -5.849 -6.214 -18.935 1.00 12.06 C ATOM 558 O PRO A 154 -5.655 -5.589 -19.992 1.00 13.73 O ATOM 559 CB PRO A 154 -5.674 -8.725 -19.151 1.00 14.75 C ATOM 560 CG PRO A 154 -6.405 -9.617 -20.065 1.00 16.89 C ATOM 561 CD PRO A 154 -7.398 -8.824 -20.835 1.00 14.69 C ATOM 562 N HIS A 155 -5.394 -5.803 -17.749 1.00 11.61 N ATOM 563 CA HIS A 155 -4.472 -4.684 -17.520 1.00 11.68 C ATOM 564 C HIS A 155 -5.163 -3.329 -17.474 1.00 11.48 C ATOM 565 O HIS A 155 -4.610 -2.376 -16.925 1.00 13.00 O ATOM 566 CB HIS A 155 -3.301 -4.627 -18.513 1.00 13.25 C ATOM 567 CG HIS A 155 -2.449 -5.856 -18.466 1.00 14.55 C ATOM 568 ND1 HIS A 155 -1.578 -6.123 -17.433 1.00 16.89 N ATOM 569 CD2 HIS A 155 -2.366 -6.919 -19.302 1.00 17.44 C ATOM 570 CE1 HIS A 155 -0.966 -7.273 -17.649 1.00 18.85 C ATOM 571 NE2 HIS A 155 -1.454 -7.798 -18.767 1.00 18.14 N ATOM 572 H HIS A 155 -5.723 -6.323 -16.911 1.00 0.00 H ATOM 573 N GLU A 156 -6.369 -3.212 -18.020 1.00 11.20 N ATOM 574 CA GLU A 156 -7.053 -1.911 -18.029 1.00 11.73 C ATOM 575 C GLU A 156 -7.473 -1.471 -16.622 1.00 10.78 C ATOM 576 O GLU A 156 -7.450 -0.277 -16.310 1.00 11.81 O ATOM 577 CB GLU A 156 -8.243 -1.971 -18.992 1.00 12.48 C ATOM 578 CG GLU A 156 -7.801 -2.092 -20.444 1.00 13.94 C ATOM 579 CD GLU A 156 -7.390 -0.777 -21.046 1.00 17.89 C ATOM 580 OE1 GLU A 156 -8.105 0.224 -20.989 1.00 17.66 O ATOM 581 OE2 GLU A 156 -6.375 -0.755 -21.719 1.00 26.55 O ATOM 582 H GLU A 156 -6.830 -4.043 -18.442 1.00 0.00 H ATOM 583 N ASP A 157 -7.824 -2.429 -15.757 1.00 11.09 N ATOM 584 CA ASP A 157 -8.163 -2.090 -14.383 1.00 11.23 C ATOM 585 C ASP A 157 -6.968 -1.495 -13.643 1.00 10.60 C ATOM 586 O ASP A 157 -7.136 -0.604 -12.800 1.00 11.36 O ATOM 587 CB ASP A 157 -8.752 -3.309 -13.637 1.00 12.12 C ATOM 588 CG ASP A 157 -7.771 -4.475 -13.433 1.00 13.01 C ATOM 589 OD1 ASP A 157 -6.845 -4.634 -14.281 1.00 13.39 O ATOM 590 OD2 ASP A 157 -7.981 -5.242 -12.458 1.00 13.49 O ATOM 591 H ASP A 157 -7.855 -3.421 -16.068 1.00 0.00 H ATOM 592 N GLU A 158 -5.760 -1.993 -13.928 1.00 11.42 N ATOM 593 CA GLU A 158 -4.551 -1.456 -13.283 1.00 12.47 C ATOM 594 C GLU A 158 -4.324 -0.019 -13.720 1.00 11.35 C ATOM 595 O GLU A 158 -3.913 0.832 -12.907 1.00 11.39 O ATOM 596 CB GLU A 158 -3.342 -2.301 -13.702 1.00 15.87 C ATOM 597 CG GLU A 158 -3.337 -3.641 -13.253 1.00 21.46 C ATOM 598 CD GLU A 158 -2.202 -4.497 -13.961 1.00 26.17 C ATOM 599 OE1 GLU A 158 -1.664 -4.263 -15.122 1.00 29.73 O ATOM 600 OE2 GLU A 158 -1.827 -5.442 -13.330 1.00 23.11 O ATOM 601 H GLU A 158 -5.674 -2.770 -14.614 1.00 0.00 H ATOM 602 N ALA A 159 -4.572 0.263 -15.004 1.00 11.66 N ATOM 603 CA ALA A 159 -4.476 1.645 -15.473 1.00 12.88 C ATOM 604 C ALA A 159 -5.529 2.518 -14.790 1.00 11.49 C ATOM 605 O ALA A 159 -5.256 3.665 -14.413 1.00 12.16 O ATOM 606 CB ALA A 159 -4.626 1.695 -17.008 1.00 13.81 C ATOM 607 H ALA A 159 -4.832 -0.497 -15.665 1.00 0.00 H ATOM 608 N MET A 160 -6.734 1.981 -14.622 1.00 10.82 N ATOM 609 CA MET A 160 -7.781 2.747 -13.959 1.00 10.89 C ATOM 610 C MET A 160 -7.403 3.084 -12.512 1.00 10.08 C ATOM 611 O MET A 160 -7.617 4.224 -12.068 1.00 11.13 O ATOM 612 CB MET A 160 -9.091 1.966 -14.043 1.00 11.61 C ATOM 613 CG MET A 160 -10.261 2.760 -13.479 1.00 13.16 C ATOM 614 SD MET A 160 -11.827 1.967 -13.666 1.00 15.32 S ATOM 615 CE MET A 160 -11.718 0.815 -12.383 1.00 18.42 C ATOM 616 H MET A 160 -6.928 1.018 -14.963 1.00 0.00 H ATOM 617 N VAL A 161 -6.807 2.119 -11.791 1.00 10.49 N ATOM 618 CA VAL A 161 -6.384 2.355 -10.412 1.00 10.47 C ATOM 619 C VAL A 161 -5.333 3.466 -10.361 1.00 10.88 C ATOM 620 O VAL A 161 -5.425 4.391 -9.554 1.00 11.10 O ATOM 621 CB VAL A 161 -5.866 1.032 -9.784 1.00 11.82 C ATOM 622 CG1 VAL A 161 -5.043 1.288 -8.514 1.00 13.48 C ATOM 623 CG2 VAL A 161 -7.049 0.105 -9.499 1.00 13.69 C ATOM 624 H VAL A 161 -6.644 1.187 -12.222 1.00 0.00 H ATOM 625 N LEU A 162 -4.321 3.387 -11.234 1.00 11.29 N ATOM 626 CA LEU A 162 -3.266 4.406 -11.231 1.00 11.96 C ATOM 627 C LEU A 162 -3.853 5.786 -11.494 1.00 11.74 C ATOM 628 O LEU A 162 -3.442 6.784 -10.872 1.00 13.10 O ATOM 629 CB LEU A 162 -2.157 4.019 -12.246 1.00 13.66 C ATOM 630 CG LEU A 162 -1.221 2.905 -11.737 1.00 15.59 C ATOM 631 CD1 LEU A 162 -0.525 2.238 -12.953 1.00 17.77 C ATOM 632 CD2 LEU A 162 -0.183 3.473 -10.798 1.00 17.37 C ATOM 633 H LEU A 162 -4.283 2.602 -11.915 1.00 0.00 H ATOM 634 N PHE A 163 -4.791 5.870 -12.455 1.00 11.61 N ATOM 635 CA PHE A 163 -5.387 7.146 -12.805 1.00 11.78 C ATOM 636 C PHE A 163 -6.233 7.681 -11.655 1.00 12.15 C ATOM 637 O PHE A 163 -6.115 8.860 -11.270 1.00 12.91 O ATOM 638 CB PHE A 163 -6.236 6.964 -14.068 1.00 13.00 C ATOM 639 CG PHE A 163 -7.065 8.173 -14.381 1.00 13.51 C ATOM 640 CD1 PHE A 163 -6.455 9.315 -14.930 1.00 16.29 C ATOM 641 CD2 PHE A 163 -8.418 8.215 -14.067 1.00 14.47 C ATOM 642 CE1 PHE A 163 -7.199 10.441 -15.193 1.00 17.98 C ATOM 643 CE2 PHE A 163 -9.170 9.364 -14.307 1.00 15.52 C ATOM 644 CZ PHE A 163 -8.543 10.467 -14.852 1.00 17.11 C ATOM 645 H PHE A 163 -5.093 5.009 -12.954 1.00 0.00 H ATOM 646 N LEU A 164 -7.143 6.844 -11.127 1.00 11.00 N ATOM 647 CA LEU A 164 -8.039 7.326 -10.074 1.00 11.35 C ATOM 648 C LEU A 164 -7.271 7.749 -8.825 1.00 11.72 C ATOM 649 O LEU A 164 -7.667 8.705 -8.143 1.00 12.37 O ATOM 650 CB LEU A 164 -9.059 6.255 -9.700 1.00 12.40 C ATOM 651 CG LEU A 164 -10.138 5.988 -10.742 1.00 13.74 C ATOM 652 CD1 LEU A 164 -11.003 4.806 -10.328 1.00 15.20 C ATOM 653 CD2 LEU A 164 -10.992 7.234 -10.942 1.00 15.84 C ATOM 654 H LEU A 164 -7.210 5.862 -11.464 1.00 0.00 H ATOM 655 N ASN A 165 -6.166 7.066 -8.511 1.00 12.43 N ATOM 656 CA ASN A 165 -5.410 7.442 -7.329 1.00 13.31 C ATOM 657 C ASN A 165 -4.785 8.828 -7.445 1.00 14.11 C ATOM 658 O ASN A 165 -4.499 9.441 -6.405 1.00 16.75 O ATOM 659 CB ASN A 165 -4.404 6.345 -6.964 1.00 14.99 C ATOM 660 CG ASN A 165 -5.060 5.157 -6.245 1.00 15.24 C ATOM 661 OD1 ASN A 165 -6.096 5.308 -5.620 1.00 17.83 O ATOM 662 ND2 ASN A 165 -4.417 4.014 -6.269 1.00 16.88 N ATOM 663 HD22 ASN A 165 -3.536 3.924 -6.814 1.00 0.00 H ATOM 664 HD21 ASN A 165 -4.788 3.197 -5.743 1.00 0.00 H ATOM 665 H ASN A 165 -5.851 6.274 -9.107 1.00 0.00 H ATOM 666 N MET A 166 -4.589 9.337 -8.662 1.00 13.61 N ATOM 667 CA MET A 166 -4.054 10.690 -8.833 1.00 14.64 C ATOM 668 C MET A 166 -5.137 11.763 -8.805 1.00 14.06 C ATOM 669 O MET A 166 -4.808 12.956 -8.786 1.00 16.19 O ATOM 670 CB MET A 166 -3.266 10.807 -10.128 1.00 18.41 C ATOM 671 CG MET A 166 -1.941 10.060 -10.042 1.00 22.68 C ATOM 672 SD MET A 166 -0.797 10.495 -11.363 1.00 26.34 S ATOM 673 CE MET A 166 -1.736 9.734 -12.647 1.00 24.17 C ATOM 674 H MET A 166 -4.819 8.766 -9.500 1.00 0.00 H ATOM 675 N VAL A 167 -6.427 11.401 -8.874 1.00 13.12 N ATOM 676 CA VAL A 167 -7.493 12.406 -8.814 1.00 13.04 C ATOM 677 C VAL A 167 -7.562 13.023 -7.416 1.00 12.87 C ATOM 678 O VAL A 167 -7.518 12.326 -6.409 1.00 14.25 O ATOM 679 CB VAL A 167 -8.831 11.729 -9.206 1.00 12.72 C ATOM 680 CG1 VAL A 167 -9.968 12.731 -9.098 1.00 14.79 C ATOM 681 CG2 VAL A 167 -8.825 11.177 -10.658 1.00 13.53 C ATOM 682 H VAL A 167 -6.674 10.395 -8.971 1.00 0.00 H ATOM 683 N ALA A 168 -7.717 14.330 -7.351 1.00 12.96 N ATOM 684 CA ALA A 168 -7.812 15.016 -6.067 1.00 13.01 C ATOM 685 C ALA A 168 -9.104 14.675 -5.320 1.00 13.65 C ATOM 686 O ALA A 168 -10.150 14.524 -5.951 1.00 14.14 O ATOM 687 CB ALA A 168 -7.749 16.523 -6.257 1.00 14.24 C ATOM 688 H ALA A 168 -7.773 14.882 -8.231 1.00 0.00 H ATOM 689 N PRO A 169 -9.051 14.618 -3.973 1.00 14.51 N ATOM 690 CA PRO A 169 -10.268 14.315 -3.212 1.00 16.76 C ATOM 691 C PRO A 169 -11.446 15.256 -3.477 1.00 18.94 C ATOM 692 O PRO A 169 -12.604 14.834 -3.343 1.00 21.11 O ATOM 693 CB PRO A 169 -9.766 14.333 -1.748 1.00 18.40 C ATOM 694 CG PRO A 169 -8.339 13.962 -1.821 1.00 20.00 C ATOM 695 CD PRO A 169 -7.840 14.556 -3.115 1.00 16.47 C ATOM 696 N GLY A 170 -11.222 16.487 -3.823 1.00 19.79 N ATOM 697 CA GLY A 170 -12.526 17.210 -3.977 1.00 18.80 C ATOM 698 C GLY A 170 -13.275 17.049 -5.309 1.00 16.69 C ATOM 699 O GLY A 170 -14.368 17.611 -5.493 1.00 17.62 O ATOM 700 H GLY A 170 -10.282 16.907 -3.971 1.00 0.00 H ATOM 701 N ARG A 171 -12.682 16.362 -6.275 1.00 13.80 N ATOM 702 CA ARG A 171 -13.273 16.316 -7.607 1.00 12.20 C ATOM 703 C ARG A 171 -14.599 15.563 -7.628 1.00 12.01 C ATOM 704 O ARG A 171 -14.855 14.664 -6.835 1.00 13.82 O ATOM 705 CB ARG A 171 -12.326 15.608 -8.581 1.00 11.63 C ATOM 706 CG ARG A 171 -10.988 16.284 -8.832 1.00 13.47 C ATOM 707 CD ARG A 171 -11.086 17.721 -9.227 1.00 14.18 C ATOM 708 NE ARG A 171 -9.812 18.172 -9.816 1.00 13.87 N ATOM 709 CZ ARG A 171 -9.514 19.448 -9.973 1.00 12.83 C ATOM 710 NH1 ARG A 171 -10.325 20.392 -9.498 1.00 13.25 N ATOM 711 NH2 ARG A 171 -8.395 19.747 -10.642 1.00 13.35 N ATOM 712 HE ARG A 171 -9.121 17.457 -10.120 1.00 0.00 H ATOM 713 HH12 ARG A 171 -10.085 21.396 -9.625 1.00 0.00 H ATOM 714 HH11 ARG A 171 -11.198 20.125 -9.000 1.00 0.00 H ATOM 715 HH22 ARG A 171 -8.126 20.741 -10.787 1.00 0.00 H ATOM 716 HH21 ARG A 171 -7.794 18.985 -11.017 1.00 0.00 H ATOM 717 H ARG A 171 -11.794 15.855 -6.083 1.00 0.00 H ATOM 718 N VAL A 172 -15.435 15.905 -8.606 1.00 11.91 N ATOM 719 CA VAL A 172 -16.604 15.085 -8.909 1.00 12.10 C ATOM 720 C VAL A 172 -16.147 13.965 -9.842 1.00 10.91 C ATOM 721 O VAL A 172 -15.534 14.228 -10.888 1.00 12.23 O ATOM 722 CB VAL A 172 -17.707 15.926 -9.571 1.00 13.60 C ATOM 723 CG1 VAL A 172 -18.934 15.071 -9.836 1.00 13.69 C ATOM 724 CG2 VAL A 172 -18.079 17.121 -8.724 1.00 16.47 C ATOM 725 H VAL A 172 -15.253 16.766 -9.160 1.00 0.00 H ATOM 726 N LEU A 173 -16.433 12.733 -9.466 1.00 11.87 N ATOM 727 CA LEU A 173 -16.081 11.556 -10.252 1.00 11.59 C ATOM 728 C LEU A 173 -17.348 10.935 -10.831 1.00 10.88 C ATOM 729 O LEU A 173 -18.316 10.697 -10.093 1.00 11.94 O ATOM 730 CB LEU A 173 -15.412 10.558 -9.338 1.00 15.21 C ATOM 731 CG LEU A 173 -14.749 9.370 -9.877 1.00 21.90 C ATOM 732 CD1 LEU A 173 -13.687 9.753 -10.921 1.00 22.54 C ATOM 733 CD2 LEU A 173 -14.037 8.762 -8.646 1.00 25.58 C ATOM 734 H LEU A 173 -16.934 12.594 -8.565 1.00 0.00 H ATOM 735 N ILE A 174 -17.328 10.671 -12.129 1.00 10.41 N ATOM 736 CA ILE A 174 -18.452 10.059 -12.818 1.00 10.72 C ATOM 737 C ILE A 174 -17.964 8.813 -13.539 1.00 10.79 C ATOM 738 O ILE A 174 -16.940 8.861 -14.231 1.00 11.76 O ATOM 739 CB ILE A 174 -19.087 11.049 -13.825 1.00 11.78 C ATOM 740 CG1 ILE A 174 -19.632 12.253 -13.087 1.00 12.27 C ATOM 741 CG2 ILE A 174 -20.110 10.352 -14.710 1.00 12.82 C ATOM 742 CD1 ILE A 174 -19.937 13.464 -13.989 1.00 13.56 C ATOM 743 H ILE A 174 -16.476 10.911 -12.675 1.00 0.00 H ATOM 744 N CYS A 175 -18.663 7.697 -13.352 1.00 11.28 N ATOM 745 CA CYS A 175 -18.332 6.468 -14.079 1.00 11.57 C ATOM 746 C CYS A 175 -19.579 5.951 -14.781 1.00 11.08 C ATOM 747 O CYS A 175 -20.684 6.032 -14.231 1.00 12.11 O ATOM 748 CB CYS A 175 -17.814 5.349 -13.105 1.00 12.75 C ATOM 749 SG CYS A 175 -16.366 5.788 -12.161 1.00 13.68 S ATOM 750 H CYS A 175 -19.457 7.696 -12.680 1.00 0.00 H ATOM 751 N THR A 176 -19.402 5.374 -15.972 1.00 10.53 N ATOM 752 CA THR A 176 -20.505 4.746 -16.688 1.00 11.04 C ATOM 753 C THR A 176 -19.979 3.599 -17.542 1.00 10.81 C ATOM 754 O THR A 176 -18.927 3.732 -18.178 1.00 11.65 O ATOM 755 CB THR A 176 -21.309 5.817 -17.471 1.00 12.28 C ATOM 756 OG1 THR A 176 -22.417 5.133 -18.025 1.00 13.69 O ATOM 757 CG2 THR A 176 -20.494 6.528 -18.548 1.00 13.21 C ATOM 758 HG1 THR A 176 -22.972 5.770 -18.541 1.00 0.00 H ATOM 759 H THR A 176 -18.454 5.373 -16.399 1.00 0.00 H ATOM 760 N VAL A 177 -20.729 2.492 -17.587 1.00 11.09 N ATOM 761 CA VAL A 177 -20.290 1.319 -18.352 1.00 11.48 C ATOM 762 C VAL A 177 -20.905 1.262 -19.741 1.00 11.54 C ATOM 763 O VAL A 177 -22.113 1.466 -19.923 1.00 12.42 O ATOM 764 CB VAL A 177 -20.652 0.028 -17.569 1.00 12.22 C ATOM 765 CG1 VAL A 177 -20.424 -1.254 -18.449 1.00 14.39 C ATOM 766 CG2 VAL A 177 -19.825 -0.040 -16.287 1.00 13.62 C ATOM 767 H VAL A 177 -21.633 2.462 -17.074 1.00 0.00 H ATOM 768 N LYS A 178 -20.080 0.938 -20.729 1.00 11.44 N ATOM 769 CA LYS A 178 -20.576 0.558 -22.058 1.00 12.93 C ATOM 770 C LYS A 178 -20.274 -0.920 -22.295 1.00 13.12 C ATOM 771 O LYS A 178 -19.106 -1.335 -22.216 1.00 13.00 O ATOM 772 CB LYS A 178 -19.904 1.383 -23.157 1.00 13.72 C ATOM 773 CG LYS A 178 -20.535 1.172 -24.551 1.00 15.86 C ATOM 774 CD LYS A 178 -19.951 2.115 -25.618 1.00 17.50 C ATOM 775 CE LYS A 178 -20.573 1.868 -26.964 1.00 19.29 C ATOM 776 NZ LYS A 178 -19.908 2.700 -27.962 1.00 19.99 N ATOM 777 HZ1 LYS A 178 -20.018 3.702 -27.705 1.00 0.00 H ATOM 778 HZ2 LYS A 178 -18.897 2.458 -27.995 1.00 0.00 H ATOM 779 HZ3 LYS A 178 -20.337 2.531 -28.894 1.00 0.00 H ATOM 780 H LYS A 178 -19.054 0.954 -20.557 1.00 0.00 H ATOM 781 N ASP A 179 -21.319 -1.727 -22.573 1.00 13.54 N ATOM 782 CA ASP A 179 -21.175 -3.134 -22.989 1.00 14.51 C ATOM 783 C ASP A 179 -20.777 -4.058 -21.845 1.00 13.64 C ATOM 784 O ASP A 179 -21.617 -4.811 -21.327 1.00 15.51 O ATOM 785 CB ASP A 179 -20.261 -3.240 -24.233 1.00 14.67 C ATOM 786 CG ASP A 179 -20.012 -4.662 -24.683 1.00 15.37 C ATOM 787 OD1 ASP A 179 -20.681 -5.592 -24.186 1.00 16.77 O ATOM 788 OD2 ASP A 179 -19.121 -4.838 -25.557 1.00 17.31 O ATOM 789 H ASP A 179 -22.279 -1.335 -22.489 1.00 0.00 H ATOM 790 N GLU A 180 -19.512 -4.019 -21.418 1.00 13.11 N ATOM 791 CA GLU A 180 -19.024 -4.988 -20.417 1.00 12.61 C ATOM 792 C GLU A 180 -17.841 -4.366 -19.703 1.00 11.47 C ATOM 793 O GLU A 180 -16.884 -3.915 -20.372 1.00 13.06 O ATOM 794 CB GLU A 180 -18.603 -6.290 -21.102 1.00 15.19 C ATOM 795 CG GLU A 180 -18.891 -7.545 -20.193 1.00 18.37 C ATOM 796 CD GLU A 180 -18.161 -7.487 -18.796 1.00 28.04 C ATOM 797 OE1 GLU A 180 -18.770 -7.416 -17.702 1.00 38.57 O ATOM 798 OE2 GLU A 180 -16.866 -7.582 -18.888 1.00 19.27 O ATOM 799 H GLU A 180 -18.864 -3.298 -21.795 1.00 0.00 H ATOM 800 N GLY A 181 -17.923 -4.258 -18.383 1.00 11.87 N ATOM 801 CA GLY A 181 -16.849 -3.626 -17.625 1.00 11.80 C ATOM 802 C GLY A 181 -16.268 -4.468 -16.502 1.00 10.83 C ATOM 803 O GLY A 181 -15.507 -3.934 -15.689 1.00 12.01 O ATOM 804 H GLY A 181 -18.759 -4.626 -17.886 1.00 0.00 H ATOM 805 N SER A 182 -16.661 -5.748 -16.402 1.00 11.61 N ATOM 806 CA SER A 182 -16.363 -6.540 -15.218 1.00 11.94 C ATOM 807 C SER A 182 -15.383 -7.694 -15.396 1.00 11.62 C ATOM 808 O SER A 182 -14.799 -8.108 -14.393 1.00 12.29 O ATOM 809 CB SER A 182 -17.640 -7.139 -14.646 1.00 12.88 C ATOM 810 OG SER A 182 -18.088 -8.228 -15.426 1.00 14.02 O ATOM 811 HG SER A 182 -18.269 -7.919 -16.349 1.00 0.00 H ATOM 812 H SER A 182 -17.189 -6.182 -17.186 1.00 0.00 H ATOM 813 N PHE A 183 -15.175 -8.226 -16.599 1.00 12.27 N ATOM 814 CA PHE A 183 -14.436 -9.482 -16.735 1.00 12.21 C ATOM 815 C PHE A 183 -13.078 -9.385 -16.084 1.00 11.54 C ATOM 816 O PHE A 183 -12.671 -10.305 -15.353 1.00 11.64 O ATOM 817 CB PHE A 183 -14.393 -9.871 -18.220 1.00 13.01 C ATOM 818 CG PHE A 183 -13.715 -11.199 -18.509 1.00 13.16 C ATOM 819 CD1 PHE A 183 -13.545 -12.219 -17.546 1.00 13.72 C ATOM 820 CD2 PHE A 183 -13.224 -11.410 -19.799 1.00 14.16 C ATOM 821 CE1 PHE A 183 -12.897 -13.432 -17.904 1.00 14.11 C ATOM 822 CE2 PHE A 183 -12.584 -12.616 -20.140 1.00 14.21 C ATOM 823 CZ PHE A 183 -12.403 -13.605 -19.185 1.00 14.30 C ATOM 824 H PHE A 183 -15.540 -7.746 -17.447 1.00 0.00 H ATOM 825 N HIS A 184 -12.369 -8.276 -16.326 1.00 11.14 N ATOM 826 CA HIS A 184 -11.040 -8.035 -15.783 1.00 11.11 C ATOM 827 C HIS A 184 -11.036 -6.843 -14.823 1.00 11.26 C ATOM 828 O HIS A 184 -10.035 -6.140 -14.676 1.00 11.73 O ATOM 829 CB HIS A 184 -9.990 -7.932 -16.890 1.00 11.65 C ATOM 830 CG HIS A 184 -9.705 -9.250 -17.507 1.00 11.63 C ATOM 831 ND1 HIS A 184 -8.775 -10.129 -16.990 1.00 13.25 N ATOM 832 CD2 HIS A 184 -10.311 -9.887 -18.533 1.00 13.13 C ATOM 833 CE1 HIS A 184 -8.814 -11.244 -17.690 1.00 14.79 C ATOM 834 NE2 HIS A 184 -9.735 -11.128 -18.628 1.00 14.81 N ATOM 835 H HIS A 184 -12.791 -7.546 -16.935 1.00 0.00 H ATOM 836 N LEU A 185 -12.147 -6.624 -14.123 1.00 11.55 N ATOM 837 CA LEU A 185 -12.196 -5.639 -13.033 1.00 11.78 C ATOM 838 C LEU A 185 -11.823 -6.416 -11.779 1.00 12.12 C ATOM 839 O LEU A 185 -12.666 -7.066 -11.154 1.00 12.96 O ATOM 840 CB LEU A 185 -13.592 -5.042 -12.934 1.00 12.24 C ATOM 841 CG LEU A 185 -13.703 -3.899 -11.922 1.00 13.04 C ATOM 842 CD1 LEU A 185 -12.972 -2.662 -12.379 1.00 13.45 C ATOM 843 CD2 LEU A 185 -15.195 -3.613 -11.632 1.00 14.71 C ATOM 844 H LEU A 185 -13.005 -7.165 -14.354 1.00 0.00 H ATOM 845 N LYS A 186 -10.543 -6.392 -11.411 1.00 11.48 N ATOM 846 CA LYS A 186 -10.074 -7.304 -10.371 1.00 11.92 C ATOM 847 C LYS A 186 -10.090 -6.662 -8.982 1.00 11.97 C ATOM 848 O LYS A 186 -10.637 -5.578 -8.775 1.00 12.45 O ATOM 849 CB LYS A 186 -8.752 -7.938 -10.788 1.00 11.93 C ATOM 850 CG LYS A 186 -8.835 -8.658 -12.134 1.00 12.36 C ATOM 851 CD LYS A 186 -10.020 -9.626 -12.200 1.00 12.92 C ATOM 852 CE LYS A 186 -9.791 -10.757 -13.222 1.00 13.03 C ATOM 853 NZ LYS A 186 -10.998 -11.590 -13.388 1.00 13.60 N ATOM 854 HZ1 LYS A 186 -11.251 -12.018 -12.474 1.00 0.00 H ATOM 855 HZ2 LYS A 186 -11.784 -10.997 -13.724 1.00 0.00 H ATOM 856 HZ3 LYS A 186 -10.807 -12.340 -14.083 1.00 0.00 H ATOM 857 H LYS A 186 -9.882 -5.728 -11.862 1.00 0.00 H ATOM 858 N ASP A 187 -9.545 -7.376 -7.994 1.00 13.55 N ATOM 859 CA ASP A 187 -9.854 -7.026 -6.610 1.00 15.37 C ATOM 860 C ASP A 187 -9.307 -5.662 -6.187 1.00 13.84 C ATOM 861 O ASP A 187 -9.965 -4.974 -5.406 1.00 14.47 O ATOM 862 CB ASP A 187 -9.458 -8.139 -5.639 1.00 20.69 C ATOM 863 CG ASP A 187 -10.365 -9.355 -5.769 1.00 24.41 C ATOM 864 OD1 ASP A 187 -11.376 -9.294 -6.522 1.00 27.49 O ATOM 865 OD2 ASP A 187 -10.089 -10.361 -5.139 1.00 26.63 O ATOM 866 H ASP A 187 -8.909 -8.171 -8.207 1.00 0.00 H ATOM 867 N THR A 188 -8.137 -5.245 -6.661 1.00 14.56 N ATOM 868 CA THR A 188 -7.638 -3.926 -6.252 1.00 15.57 C ATOM 869 C THR A 188 -8.519 -2.797 -6.781 1.00 14.29 C ATOM 870 O THR A 188 -8.826 -1.843 -6.056 1.00 15.07 O ATOM 871 CB THR A 188 -6.203 -3.754 -6.715 1.00 17.10 C ATOM 872 OG1 THR A 188 -5.414 -4.809 -6.146 1.00 20.80 O ATOM 873 CG2 THR A 188 -5.641 -2.455 -6.277 1.00 18.65 C ATOM 874 HG1 THR A 188 -5.766 -5.683 -6.449 1.00 0.00 H ATOM 875 H THR A 188 -7.585 -5.842 -7.310 1.00 0.00 H ATOM 876 N ALA A 189 -8.974 -2.911 -8.028 1.00 13.36 N ATOM 877 CA ALA A 189 -9.886 -1.914 -8.577 1.00 12.82 C ATOM 878 C ALA A 189 -11.220 -1.917 -7.846 1.00 12.24 C ATOM 879 O ALA A 189 -11.784 -0.848 -7.574 1.00 12.67 O ATOM 880 CB ALA A 189 -10.069 -2.156 -10.061 1.00 13.51 C ATOM 881 H ALA A 189 -8.677 -3.717 -8.614 1.00 0.00 H ATOM 882 N LYS A 190 -11.755 -3.110 -7.550 1.00 12.16 N ATOM 883 CA LYS A 190 -13.019 -3.174 -6.830 1.00 12.34 C ATOM 884 C LYS A 190 -12.873 -2.556 -5.445 1.00 13.42 C ATOM 885 O LYS A 190 -13.779 -1.838 -4.984 1.00 14.60 O ATOM 886 CB LYS A 190 -13.500 -4.621 -6.778 1.00 13.53 C ATOM 887 CG LYS A 190 -14.048 -5.133 -8.111 1.00 14.43 C ATOM 888 CD LYS A 190 -14.379 -6.594 -8.016 1.00 17.19 C ATOM 889 CE LYS A 190 -15.094 -7.081 -9.223 1.00 19.18 C ATOM 890 NZ LYS A 190 -15.162 -8.605 -9.254 1.00 22.58 N ATOM 891 HZ1 LYS A 190 -14.197 -8.994 -9.262 1.00 0.00 H ATOM 892 HZ2 LYS A 190 -15.667 -8.945 -8.411 1.00 0.00 H ATOM 893 HZ3 LYS A 190 -15.668 -8.911 -10.110 1.00 0.00 H ATOM 894 H LYS A 190 -11.270 -3.985 -7.833 1.00 0.00 H ATOM 895 N ALA A 191 -11.726 -2.789 -4.775 1.00 14.25 N ATOM 896 CA ALA A 191 -11.513 -2.185 -3.463 1.00 15.45 C ATOM 897 C ALA A 191 -11.462 -0.670 -3.578 1.00 14.97 C ATOM 898 O ALA A 191 -11.941 0.046 -2.675 1.00 16.34 O ATOM 899 CB ALA A 191 -10.236 -2.739 -2.825 1.00 17.97 C ATOM 900 H ALA A 191 -10.994 -3.398 -5.193 1.00 0.00 H ATOM 901 N LEU A 192 -10.834 -0.153 -4.648 1.00 14.43 N ATOM 902 CA LEU A 192 -10.788 1.293 -4.821 1.00 14.86 C ATOM 903 C LEU A 192 -12.190 1.866 -5.024 1.00 14.41 C ATOM 904 O LEU A 192 -12.559 2.856 -4.402 1.00 15.54 O ATOM 905 CB LEU A 192 -9.841 1.626 -5.987 1.00 15.57 C ATOM 906 CG LEU A 192 -9.526 3.097 -6.176 1.00 17.98 C ATOM 907 CD1 LEU A 192 -9.104 3.712 -4.872 1.00 24.66 C ATOM 908 CD2 LEU A 192 -8.476 3.259 -7.274 1.00 16.84 C ATOM 909 H LEU A 192 -10.385 -0.779 -5.346 1.00 0.00 H ATOM 910 N LEU A 193 -13.005 1.227 -5.861 1.00 13.79 N ATOM 911 CA LEU A 193 -14.385 1.682 -6.022 1.00 14.31 C ATOM 912 C LEU A 193 -15.139 1.647 -4.696 1.00 14.44 C ATOM 913 O LEU A 193 -15.920 2.568 -4.384 1.00 15.35 O ATOM 914 CB LEU A 193 -15.110 0.862 -7.104 1.00 13.90 C ATOM 915 CG LEU A 193 -14.505 0.951 -8.516 1.00 14.76 C ATOM 916 CD1 LEU A 193 -15.273 0.063 -9.455 1.00 14.66 C ATOM 917 CD2 LEU A 193 -14.462 2.374 -9.035 1.00 16.48 C ATOM 918 H LEU A 193 -12.661 0.406 -6.399 1.00 0.00 H ATOM 919 N ARG A 194 -14.918 0.591 -3.887 1.00 14.41 N ATOM 920 CA ARG A 194 -15.558 0.527 -2.575 1.00 16.50 C ATOM 921 C ARG A 194 -15.130 1.702 -1.711 1.00 17.66 C ATOM 922 O ARG A 194 -15.954 2.271 -0.982 1.00 17.77 O ATOM 923 CB ARG A 194 -15.207 -0.807 -1.927 1.00 18.41 C ATOM 924 CG ARG A 194 -15.883 -1.058 -0.610 1.00 22.35 C ATOM 925 CD ARG A 194 -15.456 -2.417 -0.096 1.00 27.11 C ATOM 926 NE ARG A 194 -15.947 -3.508 -0.936 1.00 32.99 N ATOM 927 CZ ARG A 194 -15.208 -4.338 -1.681 1.00 38.57 C ATOM 928 NH1 ARG A 194 -13.876 -4.264 -1.733 1.00 40.40 N ATOM 929 NH2 ARG A 194 -15.825 -5.288 -2.376 1.00 40.36 N ATOM 930 HE ARG A 194 -16.976 -3.654 -0.957 1.00 0.00 H ATOM 931 HH12 ARG A 194 -13.341 -4.930 -2.326 1.00 0.00 H ATOM 932 HH11 ARG A 194 -13.373 -3.540 -1.181 1.00 0.00 H ATOM 933 HH22 ARG A 194 -15.272 -5.945 -2.963 1.00 0.00 H ATOM 934 HH21 ARG A 194 -16.861 -5.374 -2.333 1.00 0.00 H ATOM 935 H ARG A 194 -14.291 -0.179 -4.197 1.00 0.00 H ATOM 936 N SER A 195 -13.848 2.084 -1.761 1.00 18.39 N ATOM 937 CA SER A 195 -13.341 3.208 -0.964 1.00 19.51 C ATOM 938 C SER A 195 -14.011 4.536 -1.338 1.00 20.88 C ATOM 939 O SER A 195 -14.056 5.461 -0.512 1.00 23.82 O ATOM 940 CB SER A 195 -11.810 3.312 -1.128 1.00 21.49 C ATOM 941 OG SER A 195 -11.433 4.026 -2.323 1.00 23.24 O ATOM 942 HG SER A 195 -11.795 3.555 -3.115 1.00 0.00 H ATOM 943 H SER A 195 -13.192 1.570 -2.383 1.00 0.00 H ATOM 944 N LEU A 196 -14.511 4.665 -2.578 1.00 20.67 N ATOM 945 CA LEU A 196 -15.291 5.839 -2.989 1.00 22.31 C ATOM 946 C LEU A 196 -16.691 5.830 -2.413 1.00 23.27 C ATOM 947 O LEU A 196 -17.382 6.862 -2.452 1.00 26.06 O ATOM 948 CB LEU A 196 -15.474 5.919 -4.491 1.00 24.10 C ATOM 949 CG LEU A 196 -14.194 5.914 -5.288 1.00 26.06 C ATOM 950 CD1 LEU A 196 -14.597 5.860 -6.773 1.00 28.62 C ATOM 951 CD2 LEU A 196 -13.311 7.138 -4.996 1.00 27.15 C ATOM 952 H LEU A 196 -14.340 3.908 -3.270 1.00 0.00 H ATOM 953 N GLY A 197 -17.131 4.709 -1.890 1.00 20.40 N ATOM 954 CA GLY A 197 -18.491 4.599 -1.416 1.00 20.02 C ATOM 955 C GLY A 197 -19.414 3.967 -2.428 1.00 19.15 C ATOM 956 O GLY A 197 -20.600 3.818 -2.148 1.00 20.40 O ATOM 957 H GLY A 197 -16.493 3.891 -1.816 1.00 0.00 H ATOM 958 N SER A 198 -18.886 3.535 -3.576 1.00 17.62 N ATOM 959 CA SER A 198 -19.732 2.892 -4.570 1.00 17.49 C ATOM 960 C SER A 198 -20.269 1.576 -4.035 1.00 17.66 C ATOM 961 O SER A 198 -19.515 0.754 -3.486 1.00 17.69 O ATOM 962 CB SER A 198 -18.955 2.624 -5.858 1.00 16.58 C ATOM 963 OG SER A 198 -19.728 1.837 -6.770 1.00 15.71 O ATOM 964 HG SER A 198 -20.562 2.320 -6.997 1.00 0.00 H ATOM 965 H SER A 198 -17.870 3.658 -3.760 1.00 0.00 H ATOM 966 N GLN A 199 -21.568 1.366 -4.209 1.00 18.90 N ATOM 967 CA GLN A 199 -22.169 0.106 -3.785 1.00 21.61 C ATOM 968 C GLN A 199 -22.174 -0.923 -4.910 1.00 21.65 C ATOM 969 O GLN A 199 -21.997 -2.115 -4.663 1.00 26.82 O ATOM 970 CB GLN A 199 -23.600 0.346 -3.292 1.00 26.39 C ATOM 971 CG GLN A 199 -23.702 1.399 -2.195 1.00 31.74 C ATOM 972 CD GLN A 199 -22.947 0.991 -0.943 1.00 36.40 C ATOM 973 OE1 GLN A 199 -21.938 1.603 -0.575 1.00 37.72 O ATOM 974 NE2 GLN A 199 -23.443 -0.047 -0.272 1.00 38.49 N ATOM 975 HE22 GLN A 199 -24.295 -0.532 -0.620 1.00 0.00 H ATOM 976 HE21 GLN A 199 -22.978 -0.373 0.600 1.00 0.00 H ATOM 977 H GLN A 199 -22.158 2.101 -4.648 1.00 0.00 H ATOM 978 N ALA A 200 -22.384 -0.493 -6.149 1.00 19.41 N ATOM 979 CA ALA A 200 -22.542 -1.408 -7.268 1.00 19.00 C ATOM 980 C ALA A 200 -21.215 -1.705 -7.963 1.00 18.13 C ATOM 981 O ALA A 200 -21.009 -2.816 -8.475 1.00 20.16 O ATOM 982 CB ALA A 200 -23.574 -0.860 -8.256 1.00 20.61 C ATOM 983 H ALA A 200 -22.437 0.531 -6.324 1.00 0.00 H ATOM 984 N GLY A 201 -20.303 -0.741 -7.973 1.00 17.26 N ATOM 985 CA GLY A 201 -19.031 -0.924 -8.653 1.00 17.37 C ATOM 986 C GLY A 201 -18.239 -2.132 -8.155 1.00 16.10 C ATOM 987 O GLY A 201 -17.750 -2.951 -8.942 1.00 16.01 O ATOM 988 H GLY A 201 -20.501 0.157 -7.488 1.00 0.00 H ATOM 989 N PRO A 202 -18.097 -2.274 -6.830 1.00 15.61 N ATOM 990 CA PRO A 202 -17.324 -3.414 -6.317 1.00 16.47 C ATOM 991 C PRO A 202 -17.954 -4.744 -6.616 1.00 18.02 C ATOM 992 O PRO A 202 -17.249 -5.759 -6.583 1.00 22.49 O ATOM 993 CB PRO A 202 -17.261 -3.159 -4.804 1.00 17.52 C ATOM 994 CG PRO A 202 -17.466 -1.713 -4.676 1.00 18.46 C ATOM 995 CD PRO A 202 -18.432 -1.324 -5.750 1.00 17.12 C ATOM 996 N ALA A 203 -19.252 -4.762 -6.936 1.00 18.40 N ATOM 997 CA ALA A 203 -20.033 -5.956 -7.231 1.00 20.69 C ATOM 998 C ALA A 203 -20.316 -6.103 -8.723 1.00 18.38 C ATOM 999 O ALA A 203 -21.119 -6.961 -9.101 1.00 19.80 O ATOM 1000 CB ALA A 203 -21.353 -5.902 -6.443 1.00 25.35 C ATOM 1001 H ALA A 203 -19.745 -3.847 -6.978 1.00 0.00 H ATOM 1002 N LEU A 204 -19.706 -5.295 -9.576 1.00 16.15 N ATOM 1003 CA LEU A 204 -20.073 -5.299 -10.989 1.00 14.76 C ATOM 1004 C LEU A 204 -19.847 -6.674 -11.614 1.00 15.19 C ATOM 1005 O LEU A 204 -18.769 -7.271 -11.453 1.00 15.93 O ATOM 1006 CB LEU A 204 -19.245 -4.249 -11.713 1.00 14.02 C ATOM 1007 CG LEU A 204 -19.712 -3.912 -13.143 1.00 14.10 C ATOM 1008 CD1 LEU A 204 -21.001 -3.049 -13.067 1.00 14.98 C ATOM 1009 CD2 LEU A 204 -18.622 -3.176 -13.921 1.00 14.20 C ATOM 1010 H LEU A 204 -18.961 -4.653 -9.237 1.00 0.00 H ATOM 1011 N GLY A 205 -20.845 -7.169 -12.353 1.00 15.03 N ATOM 1012 CA GLY A 205 -20.767 -8.460 -12.996 1.00 16.55 C ATOM 1013 C GLY A 205 -20.955 -8.359 -14.498 1.00 14.71 C ATOM 1014 O GLY A 205 -21.109 -7.271 -15.066 1.00 14.97 O ATOM 1015 H GLY A 205 -21.710 -6.603 -12.469 1.00 0.00 H ATOM 1016 N TRP A 206 -20.942 -9.540 -15.125 1.00 14.98 N ATOM 1017 CA TRP A 206 -20.876 -9.701 -16.583 1.00 15.42 C ATOM 1018 C TRP A 206 -22.034 -8.975 -17.246 1.00 15.30 C ATOM 1019 O TRP A 206 -23.201 -9.314 -17.016 1.00 17.39 O ATOM 1020 CB TRP A 206 -20.939 -11.193 -16.911 1.00 16.42 C ATOM 1021 CG TRP A 206 -20.917 -11.542 -18.369 1.00 15.89 C ATOM 1022 CD1 TRP A 206 -22.014 -11.927 -19.125 1.00 17.36 C ATOM 1023 CD2 TRP A 206 -19.786 -11.590 -19.259 1.00 16.21 C ATOM 1024 NE1 TRP A 206 -21.626 -12.189 -20.405 1.00 18.62 N ATOM 1025 CE2 TRP A 206 -20.266 -12.022 -20.517 1.00 16.52 C ATOM 1026 CE3 TRP A 206 -18.429 -11.346 -19.112 1.00 15.81 C ATOM 1027 CZ2 TRP A 206 -19.423 -12.186 -21.628 1.00 17.60 C ATOM 1028 CZ3 TRP A 206 -17.586 -11.520 -20.187 1.00 16.76 C ATOM 1029 CH2 TRP A 206 -18.085 -11.949 -21.439 1.00 16.88 C ATOM 1030 HE1 TRP A 206 -22.261 -12.472 -21.178 1.00 0.00 H ATOM 1031 H TRP A 206 -20.981 -10.400 -14.542 1.00 0.00 H ATOM 1032 N ARG A 207 -21.693 -8.010 -18.108 1.00 15.03 N ATOM 1033 CA ARG A 207 -22.644 -7.253 -18.900 1.00 14.98 C ATOM 1034 C ARG A 207 -23.644 -6.437 -18.074 1.00 14.92 C ATOM 1035 O ARG A 207 -24.658 -5.984 -18.619 1.00 15.88 O ATOM 1036 CB ARG A 207 -23.348 -8.126 -19.944 1.00 15.82 C ATOM 1037 CG ARG A 207 -22.380 -8.658 -21.013 1.00 16.14 C ATOM 1038 CD ARG A 207 -23.119 -9.548 -21.975 1.00 16.53 C ATOM 1039 NE ARG A 207 -22.230 -9.872 -23.096 1.00 16.30 N ATOM 1040 CZ ARG A 207 -22.603 -10.597 -24.145 1.00 17.50 C ATOM 1041 NH1 ARG A 207 -21.740 -10.844 -25.128 1.00 19.13 N ATOM 1042 NH2 ARG A 207 -23.841 -11.090 -24.197 1.00 20.59 N ATOM 1043 HE ARG A 207 -21.254 -9.514 -23.068 1.00 0.00 H ATOM 1044 HH12 ARG A 207 -22.034 -11.412 -25.948 1.00 0.00 H ATOM 1045 HH11 ARG A 207 -20.771 -10.469 -25.076 1.00 0.00 H ATOM 1046 HH22 ARG A 207 -24.140 -11.658 -25.015 1.00 0.00 H ATOM 1047 HH21 ARG A 207 -24.507 -10.906 -23.420 1.00 0.00 H ATOM 1048 H ARG A 207 -20.683 -7.789 -18.217 1.00 0.00 H ATOM 1049 N ASP A 208 -23.366 -6.180 -16.797 1.00 15.61 N ATOM 1050 CA ASP A 208 -24.185 -5.287 -16.001 1.00 15.04 C ATOM 1051 C ASP A 208 -23.973 -3.848 -16.481 1.00 14.27 C ATOM 1052 O ASP A 208 -22.883 -3.480 -16.952 1.00 14.85 O ATOM 1053 CB ASP A 208 -23.743 -5.299 -14.525 1.00 15.42 C ATOM 1054 CG ASP A 208 -24.044 -6.558 -13.772 1.00 16.29 C ATOM 1055 OD1 ASP A 208 -24.692 -7.470 -14.317 1.00 17.84 O ATOM 1056 OD2 ASP A 208 -23.612 -6.609 -12.578 1.00 18.04 O ATOM 1057 H ASP A 208 -22.538 -6.632 -16.359 1.00 0.00 H ATOM 1058 N THR A 209 -25.014 -3.019 -16.333 1.00 14.33 N ATOM 1059 CA THR A 209 -24.878 -1.584 -16.579 1.00 14.46 C ATOM 1060 C THR A 209 -24.769 -0.851 -15.241 1.00 14.07 C ATOM 1061 O THR A 209 -25.201 -1.359 -14.197 1.00 14.40 O ATOM 1062 CB THR A 209 -26.080 -1.074 -17.365 1.00 15.76 C ATOM 1063 OG1 THR A 209 -27.247 -1.440 -16.629 1.00 17.21 O ATOM 1064 CG2 THR A 209 -26.102 -1.696 -18.713 1.00 16.96 C ATOM 1065 HG1 THR A 209 -28.052 -1.124 -17.111 1.00 0.00 H ATOM 1066 H THR A 209 -25.935 -3.402 -16.038 1.00 0.00 H ATOM 1067 N TRP A 210 -24.113 0.301 -15.250 1.00 12.80 N ATOM 1068 CA TRP A 210 -23.742 0.977 -14.001 1.00 12.89 C ATOM 1069 C TRP A 210 -23.429 2.434 -14.297 1.00 12.68 C ATOM 1070 O TRP A 210 -22.648 2.738 -15.235 1.00 12.55 O ATOM 1071 CB TRP A 210 -22.513 0.278 -13.380 1.00 13.23 C ATOM 1072 CG TRP A 210 -21.923 0.970 -12.145 1.00 13.89 C ATOM 1073 CD1 TRP A 210 -22.608 1.386 -11.028 1.00 14.66 C ATOM 1074 CD2 TRP A 210 -20.551 1.335 -11.923 1.00 13.04 C ATOM 1075 NE1 TRP A 210 -21.753 1.980 -10.128 1.00 14.86 N ATOM 1076 CE2 TRP A 210 -20.483 1.976 -10.658 1.00 13.34 C ATOM 1077 CE3 TRP A 210 -19.376 1.204 -12.674 1.00 12.88 C ATOM 1078 CZ2 TRP A 210 -19.291 2.479 -10.137 1.00 13.71 C ATOM 1079 CZ3 TRP A 210 -18.190 1.714 -12.142 1.00 13.29 C ATOM 1080 CH2 TRP A 210 -18.157 2.346 -10.892 1.00 13.57 C ATOM 1081 HE1 TRP A 210 -22.022 2.368 -9.201 1.00 0.00 H ATOM 1082 H TRP A 210 -23.856 0.734 -16.160 1.00 0.00 H ATOM 1083 N ALA A 211 -24.038 3.327 -13.506 1.00 13.37 N ATOM 1084 CA ALA A 211 -23.810 4.763 -13.570 1.00 13.57 C ATOM 1085 C ALA A 211 -23.542 5.257 -12.154 1.00 12.88 C ATOM 1086 O ALA A 211 -24.244 4.859 -11.211 1.00 14.64 O ATOM 1087 CB ALA A 211 -25.015 5.496 -14.176 1.00 14.72 C ATOM 1088 H ALA A 211 -24.716 2.972 -12.802 1.00 0.00 H ATOM 1089 N PHE A 212 -22.559 6.141 -12.007 1.00 12.77 N ATOM 1090 CA PHE A 212 -22.081 6.570 -10.696 1.00 13.14 C ATOM 1091 C PHE A 212 -21.680 8.036 -10.742 1.00 12.09 C ATOM 1092 O PHE A 212 -20.983 8.464 -11.683 1.00 12.84 O ATOM 1093 CB PHE A 212 -20.868 5.715 -10.281 1.00 14.59 C ATOM 1094 CG PHE A 212 -20.169 6.192 -9.038 1.00 14.91 C ATOM 1095 CD1 PHE A 212 -20.563 5.709 -7.761 1.00 17.26 C ATOM 1096 CD2 PHE A 212 -19.136 7.148 -9.105 1.00 15.72 C ATOM 1097 CE1 PHE A 212 -19.911 6.161 -6.592 1.00 16.99 C ATOM 1098 CE2 PHE A 212 -18.502 7.611 -7.907 1.00 16.10 C ATOM 1099 CZ PHE A 212 -18.889 7.103 -6.679 1.00 17.65 C ATOM 1100 H PHE A 212 -22.114 6.541 -12.858 1.00 0.00 H ATOM 1101 N VAL A 213 -22.080 8.800 -9.715 1.00 12.62 N ATOM 1102 CA VAL A 213 -21.600 10.169 -9.547 1.00 12.11 C ATOM 1103 C VAL A 213 -21.284 10.376 -8.065 1.00 11.90 C ATOM 1104 O VAL A 213 -22.179 10.200 -7.193 1.00 12.99 O ATOM 1105 CB VAL A 213 -22.644 11.222 -9.959 1.00 15.17 C ATOM 1106 CG1 VAL A 213 -22.068 12.626 -9.806 1.00 16.94 C ATOM 1107 CG2 VAL A 213 -23.174 10.959 -11.328 1.00 16.20 C ATOM 1108 H VAL A 213 -22.748 8.408 -9.021 1.00 0.00 H ATOM 1109 N GLY A 214 -20.043 10.801 -7.737 1.00 12.27 N ATOM 1110 CA GLY A 214 -19.708 11.054 -6.336 1.00 13.76 C ATOM 1111 C GLY A 214 -18.529 11.984 -6.204 1.00 14.59 C ATOM 1112 O GLY A 214 -17.761 12.163 -7.145 1.00 16.42 O ATOM 1113 H GLY A 214 -19.329 10.948 -8.479 1.00 0.00 H ATOM 1114 N ARG A 215 -18.370 12.592 -5.015 1.00 14.34 N ATOM 1115 CA ARG A 215 -17.140 13.344 -4.727 1.00 14.36 C ATOM 1116 C ARG A 215 -16.048 12.360 -4.376 1.00 15.41 C ATOM 1117 O ARG A 215 -16.286 11.448 -3.565 1.00 17.30 O ATOM 1118 CB ARG A 215 -17.376 14.294 -3.534 1.00 16.01 C ATOM 1119 CG ARG A 215 -16.136 15.129 -3.096 1.00 16.62 C ATOM 1120 CD ARG A 215 -16.510 16.104 -1.974 1.00 18.21 C ATOM 1121 NE ARG A 215 -15.290 16.781 -1.477 1.00 20.54 N ATOM 1122 CZ ARG A 215 -14.407 16.250 -0.623 1.00 24.07 C ATOM 1123 NH1 ARG A 215 -14.606 15.026 -0.090 1.00 25.06 N ATOM 1124 NH2 ARG A 215 -13.321 16.949 -0.274 1.00 27.11 N ATOM 1125 HE ARG A 215 -15.105 17.746 -1.819 1.00 0.00 H ATOM 1126 HH12 ARG A 215 -13.910 14.628 0.572 1.00 0.00 H ATOM 1127 HH11 ARG A 215 -15.455 14.481 -0.342 1.00 0.00 H ATOM 1128 HH22 ARG A 215 -12.631 16.542 0.389 1.00 0.00 H ATOM 1129 HH21 ARG A 215 -13.166 17.900 -0.666 1.00 0.00 H ATOM 1130 H ARG A 215 -19.120 12.530 -4.297 1.00 0.00 H ATOM 1131 N LYS A 216 -14.836 12.534 -4.942 1.00 15.57 N ATOM 1132 CA LYS A 216 -13.830 11.491 -4.767 1.00 20.56 C ATOM 1133 C LYS A 216 -13.617 11.191 -3.322 1.00 23.17 C ATOM 1134 O LYS A 216 -13.526 10.010 -2.919 1.00 28.43 O ATOM 1135 CB LYS A 216 -12.470 11.845 -5.367 1.00 21.42 C ATOM 1136 CG LYS A 216 -11.321 10.995 -4.675 1.00 22.24 C ATOM 1137 CD LYS A 216 -10.112 10.808 -5.478 1.00 21.21 C ATOM 1138 CE LYS A 216 -9.028 10.050 -4.665 1.00 21.48 C ATOM 1139 NZ LYS A 216 -7.917 9.743 -5.505 1.00 20.90 N ATOM 1140 HZ1 LYS A 216 -8.235 9.145 -6.294 1.00 0.00 H ATOM 1141 HZ2 LYS A 216 -7.512 10.625 -5.878 1.00 0.00 H ATOM 1142 HZ3 LYS A 216 -7.196 9.236 -4.953 1.00 0.00 H ATOM 1143 H LYS A 216 -14.623 13.392 -5.490 1.00 0.00 H ATOM 1144 N GLY A 217 -13.409 12.240 -2.529 1.00 20.80 N ATOM 1145 CA GLY A 217 -13.276 11.957 -1.091 1.00 23.89 C ATOM 1146 C GLY A 217 -14.553 11.707 -0.283 1.00 24.29 C ATOM 1147 O GLY A 217 -14.491 11.657 0.952 1.00 25.41 O ATOM 1148 H GLY A 217 -13.344 13.207 -2.905 1.00 0.00 H ATOM 1149 N GLY A 218 -15.709 11.545 -0.940 1.00 23.53 N ATOM 1150 CA GLY A 218 -17.005 11.243 -0.318 1.00 20.77 C ATOM 1151 C GLY A 218 -17.770 12.527 -0.144 1.00 19.26 C ATOM 1152 O GLY A 218 -17.151 13.617 -0.019 1.00 21.17 O ATOM 1153 H GLY A 218 -15.687 11.641 -1.975 1.00 0.00 H ATOM 1154 N PRO A 219 -19.114 12.464 -0.144 1.00 16.97 N ATOM 1155 CA PRO A 219 -19.991 11.293 -0.286 1.00 16.42 C ATOM 1156 C PRO A 219 -20.315 10.962 -1.766 1.00 15.60 C ATOM 1157 O PRO A 219 -20.043 11.759 -2.688 1.00 15.53 O ATOM 1158 CB PRO A 219 -21.258 11.752 0.419 1.00 18.79 C ATOM 1159 CG PRO A 219 -21.329 13.151 0.035 1.00 18.67 C ATOM 1160 CD PRO A 219 -19.899 13.691 0.100 1.00 18.10 C ATOM 1161 N VAL A 220 -20.971 9.827 -1.964 1.00 16.22 N ATOM 1162 CA VAL A 220 -21.606 9.500 -3.255 1.00 16.37 C ATOM 1163 C VAL A 220 -22.853 10.358 -3.402 1.00 15.90 C ATOM 1164 O VAL A 220 -23.612 10.545 -2.433 1.00 18.02 O ATOM 1165 CB VAL A 220 -21.964 8.003 -3.281 1.00 17.46 C ATOM 1166 CG1 VAL A 220 -22.782 7.610 -4.566 1.00 17.80 C ATOM 1167 CG2 VAL A 220 -20.719 7.154 -3.121 1.00 18.05 C ATOM 1168 H VAL A 220 -21.040 9.144 -1.183 1.00 0.00 H ATOM 1169 N PHE A 221 -23.087 10.869 -4.607 1.00 15.26 N ATOM 1170 CA PHE A 221 -24.282 11.661 -4.873 1.00 15.34 C ATOM 1171 C PHE A 221 -25.383 10.853 -5.545 1.00 15.78 C ATOM 1172 O PHE A 221 -26.544 11.073 -5.246 1.00 17.97 O ATOM 1173 CB PHE A 221 -23.933 12.903 -5.702 1.00 14.94 C ATOM 1174 CG PHE A 221 -22.925 13.821 -5.019 1.00 14.23 C ATOM 1175 CD1 PHE A 221 -23.144 14.290 -3.708 1.00 14.73 C ATOM 1176 CD2 PHE A 221 -21.741 14.171 -5.670 1.00 14.37 C ATOM 1177 CE1 PHE A 221 -22.228 15.154 -3.128 1.00 15.92 C ATOM 1178 CE2 PHE A 221 -20.814 15.012 -5.060 1.00 15.44 C ATOM 1179 CZ PHE A 221 -21.051 15.495 -3.793 1.00 16.52 C ATOM 1180 H PHE A 221 -22.405 10.701 -5.374 1.00 0.00 H ATOM 1181 N GLY A 222 -25.057 9.955 -6.474 1.00 14.57 N ATOM 1182 CA GLY A 222 -26.061 9.122 -7.112 1.00 15.12 C ATOM 1183 C GLY A 222 -25.419 7.866 -7.676 1.00 14.80 C ATOM 1184 O GLY A 222 -24.226 7.855 -8.011 1.00 14.53 O ATOM 1185 H GLY A 222 -24.060 9.848 -6.749 1.00 0.00 H ATOM 1186 N GLU A 223 -26.212 6.799 -7.799 1.00 14.92 N ATOM 1187 CA GLU A 223 -25.709 5.543 -8.341 1.00 15.71 C ATOM 1188 C GLU A 223 -26.897 4.721 -8.818 1.00 16.06 C ATOM 1189 O GLU A 223 -27.926 4.664 -8.131 1.00 18.28 O ATOM 1190 CB GLU A 223 -24.924 4.773 -7.270 1.00 16.88 C ATOM 1191 CG GLU A 223 -24.245 3.538 -7.798 1.00 17.83 C ATOM 1192 CD GLU A 223 -23.169 3.027 -6.868 1.00 18.73 C ATOM 1193 OE1 GLU A 223 -23.212 3.275 -5.649 1.00 20.94 O ATOM 1194 OE2 GLU A 223 -22.267 2.334 -7.333 1.00 18.07 O ATOM 1195 H GLU A 223 -27.207 6.865 -7.503 1.00 0.00 H ATOM 1196 N LYS A 224 -26.748 4.058 -9.976 1.00 15.97 N ATOM 1197 CA LYS A 224 -27.731 3.112 -10.494 1.00 16.93 C ATOM 1198 C LYS A 224 -27.003 1.923 -11.107 1.00 16.77 C ATOM 1199 O LYS A 224 -25.901 2.066 -11.637 1.00 17.96 O ATOM 1200 CB LYS A 224 -28.630 3.732 -11.570 1.00 19.70 C ATOM 1201 CG LYS A 224 -29.764 4.556 -11.046 1.00 22.82 C ATOM 1202 CD LYS A 224 -30.735 4.911 -12.163 1.00 25.04 C ATOM 1203 CE LYS A 224 -31.938 5.627 -11.599 1.00 26.89 C ATOM 1204 NZ LYS A 224 -32.804 6.113 -12.699 1.00 26.90 N ATOM 1205 HZ1 LYS A 224 -32.265 6.770 -13.298 1.00 0.00 H ATOM 1206 HZ2 LYS A 224 -33.124 5.305 -13.270 1.00 0.00 H ATOM 1207 HZ3 LYS A 224 -33.629 6.604 -12.298 1.00 0.00 H ATOM 1208 H LYS A 224 -25.886 4.228 -10.533 1.00 0.00 H ATOM 1209 N HIS A 225 -27.658 0.762 -11.103 1.00 17.41 N ATOM 1210 CA HIS A 225 -27.039 -0.478 -11.564 1.00 19.53 C ATOM 1211 C HIS A 225 -28.158 -1.378 -12.055 1.00 21.13 C ATOM 1212 O HIS A 225 -29.213 -1.460 -11.408 1.00 26.02 O ATOM 1213 CB HIS A 225 -26.322 -1.129 -10.359 1.00 22.53 C ATOM 1214 CG HIS A 225 -25.757 -2.503 -10.596 1.00 24.86 C ATOM 1215 ND1 HIS A 225 -25.987 -3.533 -9.715 1.00 30.04 N ATOM 1216 CD2 HIS A 225 -24.944 -3.012 -11.556 1.00 24.95 C ATOM 1217 CE1 HIS A 225 -25.361 -4.620 -10.131 1.00 29.18 C ATOM 1218 NE2 HIS A 225 -24.699 -4.325 -11.237 1.00 25.65 N ATOM 1219 H HIS A 225 -28.640 0.738 -10.761 1.00 0.00 H ATOM 1220 N SER A 226 -27.950 -2.066 -13.175 1.00 18.72 N ATOM 1221 CA SER A 226 -28.877 -3.101 -13.620 1.00 19.87 C ATOM 1222 C SER A 226 -28.093 -4.376 -13.886 1.00 18.49 C ATOM 1223 O SER A 226 -27.156 -4.379 -14.701 1.00 18.08 O ATOM 1224 CB SER A 226 -29.639 -2.683 -14.884 1.00 21.87 C ATOM 1225 OG SER A 226 -30.477 -3.737 -15.340 1.00 24.02 O ATOM 1226 HG SER A 226 -30.958 -3.446 -16.155 1.00 0.00 H ATOM 1227 H SER A 226 -27.106 -1.861 -13.747 1.00 0.00 H ATOM 1228 N LYS A 227 -28.520 -5.462 -13.259 1.00 19.71 N ATOM 1229 CA LYS A 227 -27.845 -6.734 -13.437 1.00 21.36 C ATOM 1230 C LYS A 227 -28.250 -7.392 -14.753 1.00 21.71 C ATOM 1231 O LYS A 227 -29.442 -7.510 -15.061 1.00 22.90 O ATOM 1232 CB LYS A 227 -28.186 -7.637 -12.253 1.00 25.48 C ATOM 1233 CG LYS A 227 -27.460 -7.237 -10.984 1.00 33.05 C ATOM 1234 CD LYS A 227 -27.781 -8.188 -9.847 1.00 39.20 C ATOM 1235 CE LYS A 227 -27.106 -7.767 -8.549 1.00 43.75 C ATOM 1236 NZ LYS A 227 -25.773 -8.408 -8.337 1.00 46.57 N ATOM 1237 HZ1 LYS A 227 -25.887 -9.441 -8.309 1.00 0.00 H ATOM 1238 HZ2 LYS A 227 -25.137 -8.149 -9.118 1.00 0.00 H ATOM 1239 HZ3 LYS A 227 -25.370 -8.078 -7.437 1.00 0.00 H ATOM 1240 H LYS A 227 -29.348 -5.402 -12.632 1.00 0.00 H ATOM 1241 N SER A 228 -27.276 -7.862 -15.510 1.00 20.02 N ATOM 1242 CA SER A 228 -27.603 -8.725 -16.639 1.00 20.81 C ATOM 1243 C SER A 228 -28.364 -9.960 -16.154 1.00 21.66 C ATOM 1244 O SER A 228 -27.937 -10.604 -15.182 1.00 22.39 O ATOM 1245 CB SER A 228 -26.336 -9.176 -17.361 1.00 20.13 C ATOM 1246 OG SER A 228 -26.679 -10.243 -18.230 1.00 21.93 O ATOM 1247 HG SER A 228 -25.869 -10.551 -18.709 1.00 0.00 H ATOM 1248 H SER A 228 -26.286 -7.619 -15.303 1.00 0.00 H ATOM 1249 N PRO A 229 -29.455 -10.353 -16.822 1.00 22.02 N ATOM 1250 CA PRO A 229 -30.216 -11.519 -16.368 1.00 24.08 C ATOM 1251 C PRO A 229 -29.720 -12.847 -16.908 1.00 25.21 C ATOM 1252 O PRO A 229 -30.246 -13.879 -16.498 1.00 29.00 O ATOM 1253 CB PRO A 229 -31.639 -11.209 -16.897 1.00 24.34 C ATOM 1254 CG PRO A 229 -31.410 -10.458 -18.168 1.00 25.18 C ATOM 1255 CD PRO A 229 -30.148 -9.632 -17.917 1.00 23.46 C ATOM 1256 N ALA A 230 -28.768 -12.864 -17.828 1.00 24.30 N ATOM 1257 CA ALA A 230 -28.300 -14.103 -18.435 1.00 25.03 C ATOM 1258 C ALA A 230 -26.993 -13.802 -19.140 1.00 23.13 C ATOM 1259 O ALA A 230 -26.756 -12.669 -19.561 1.00 22.02 O ATOM 1260 CB ALA A 230 -29.314 -14.641 -19.452 1.00 26.87 C ATOM 1261 H ALA A 230 -28.341 -11.964 -18.127 1.00 0.00 H ATOM 1262 N LEU A 231 -26.145 -14.826 -19.295 1.00 22.19 N ATOM 1263 CA LEU A 231 -24.841 -14.558 -19.901 1.00 22.00 C ATOM 1264 C LEU A 231 -24.967 -13.993 -21.308 1.00 21.85 C ATOM 1265 O LEU A 231 -24.076 -13.258 -21.771 1.00 20.86 O ATOM 1266 CB LEU A 231 -23.964 -15.816 -19.908 1.00 21.18 C ATOM 1267 CG LEU A 231 -23.563 -16.322 -18.526 1.00 21.61 C ATOM 1268 CD1 LEU A 231 -22.671 -17.534 -18.693 1.00 23.58 C ATOM 1269 CD2 LEU A 231 -22.812 -15.210 -17.741 1.00 21.70 C ATOM 1270 H LEU A 231 -26.406 -15.786 -18.993 1.00 0.00 H ATOM 1271 N SER A 232 -26.030 -14.358 -22.017 1.00 23.16 N ATOM 1272 CA SER A 232 -26.231 -13.899 -23.376 1.00 25.21 C ATOM 1273 C SER A 232 -26.944 -12.540 -23.448 1.00 24.92 C ATOM 1274 O SER A 232 -27.250 -12.079 -24.550 1.00 27.24 O ATOM 1275 CB SER A 232 -27.036 -14.944 -24.143 1.00 28.14 C ATOM 1276 OG SER A 232 -28.191 -15.324 -23.408 1.00 31.25 O ATOM 1277 HG SER A 232 -27.916 -15.706 -22.537 1.00 0.00 H ATOM 1278 H SER A 232 -26.735 -14.989 -21.585 1.00 0.00 H ATOM 1279 N SER A 233 -27.194 -11.882 -22.310 1.00 22.79 N ATOM 1280 CA SER A 233 -27.967 -10.634 -22.219 1.00 22.54 C ATOM 1281 C SER A 233 -27.175 -9.563 -21.477 1.00 19.78 C ATOM 1282 O SER A 233 -26.138 -9.850 -20.846 1.00 21.07 O ATOM 1283 CB SER A 233 -29.272 -10.881 -21.450 1.00 25.26 C ATOM 1284 OG SER A 233 -30.052 -11.838 -22.110 1.00 28.34 O ATOM 1285 HG SER A 233 -30.889 -11.986 -21.603 1.00 0.00 H ATOM 1286 H SER A 233 -26.815 -12.281 -21.428 1.00 0.00 H ATOM 1287 N TRP A 234 -27.672 -8.320 -21.562 1.00 18.75 N ATOM 1288 CA TRP A 234 -27.088 -7.174 -20.876 1.00 17.93 C ATOM 1289 C TRP A 234 -28.064 -6.642 -19.829 1.00 17.92 C ATOM 1290 O TRP A 234 -29.278 -6.868 -19.897 1.00 19.29 O ATOM 1291 CB TRP A 234 -26.761 -6.054 -21.862 1.00 18.93 C ATOM 1292 CG TRP A 234 -25.567 -6.320 -22.688 1.00 18.34 C ATOM 1293 CD1 TRP A 234 -24.329 -5.787 -22.465 1.00 17.75 C ATOM 1294 CD2 TRP A 234 -25.454 -7.137 -23.876 1.00 18.57 C ATOM 1295 NE1 TRP A 234 -23.437 -6.231 -23.432 1.00 18.16 N ATOM 1296 CE2 TRP A 234 -24.101 -7.068 -24.295 1.00 18.50 C ATOM 1297 CE3 TRP A 234 -26.342 -7.943 -24.609 1.00 20.76 C ATOM 1298 CZ2 TRP A 234 -23.626 -7.763 -25.408 1.00 20.26 C ATOM 1299 CZ3 TRP A 234 -25.861 -8.636 -25.720 1.00 20.81 C ATOM 1300 CH2 TRP A 234 -24.529 -8.526 -26.125 1.00 21.39 C ATOM 1301 HE1 TRP A 234 -22.432 -5.972 -23.493 1.00 0.00 H ATOM 1302 H TRP A 234 -28.518 -8.166 -22.148 1.00 0.00 H ATOM 1303 N GLY A 235 -27.526 -5.910 -18.845 1.00 18.06 N ATOM 1304 CA GLY A 235 -28.383 -5.120 -17.982 1.00 18.54 C ATOM 1305 C GLY A 235 -29.239 -4.163 -18.788 1.00 17.53 C ATOM 1306 O GLY A 235 -28.903 -3.801 -19.933 1.00 19.48 O ATOM 1307 H GLY A 235 -26.496 -5.908 -18.700 1.00 0.00 H ATOM 1308 N ASP A 236 -30.353 -3.720 -18.196 1.00 19.14 N ATOM 1309 CA ASP A 236 -31.149 -2.707 -18.867 1.00 19.75 C ATOM 1310 C ASP A 236 -30.389 -1.385 -18.889 1.00 18.40 C ATOM 1311 O ASP A 236 -29.601 -1.099 -17.984 1.00 19.06 O ATOM 1312 CB ASP A 236 -32.409 -2.451 -18.071 1.00 23.49 C ATOM 1313 CG ASP A 236 -33.369 -3.624 -18.094 1.00 28.74 C ATOM 1314 OD1 ASP A 236 -33.364 -4.444 -19.052 1.00 29.34 O ATOM 1315 OD2 ASP A 236 -34.179 -3.704 -17.150 1.00 32.80 O ATOM 1316 H ASP A 236 -30.645 -4.094 -17.271 1.00 0.00 H ATOM 1317 N PRO A 237 -30.665 -0.513 -19.868 1.00 19.10 N ATOM 1318 CA PRO A 237 -30.081 0.831 -19.804 1.00 19.44 C ATOM 1319 C PRO A 237 -30.445 1.507 -18.488 1.00 18.65 C ATOM 1320 O PRO A 237 -31.580 1.396 -18.015 1.00 21.46 O ATOM 1321 CB PRO A 237 -30.695 1.558 -21.003 1.00 20.99 C ATOM 1322 CG PRO A 237 -31.029 0.466 -21.944 1.00 21.98 C ATOM 1323 CD PRO A 237 -31.493 -0.684 -21.070 1.00 20.17 C ATOM 1324 N VAL A 238 -29.495 2.224 -17.905 1.00 17.73 N ATOM 1325 CA VAL A 238 -29.760 3.048 -16.730 1.00 17.74 C ATOM 1326 C VAL A 238 -29.438 4.500 -17.030 1.00 16.56 C ATOM 1327 O VAL A 238 -28.421 4.829 -17.654 1.00 16.76 O ATOM 1328 CB VAL A 238 -29.073 2.577 -15.423 1.00 20.80 C ATOM 1329 CG1 VAL A 238 -29.643 1.202 -14.971 1.00 22.52 C ATOM 1330 CG2 VAL A 238 -27.605 2.545 -15.566 1.00 19.90 C ATOM 1331 H VAL A 238 -28.532 2.199 -18.297 1.00 0.00 H ATOM 1332 N LEU A 239 -30.350 5.366 -16.621 1.00 17.09 N ATOM 1333 CA LEU A 239 -30.221 6.808 -16.768 1.00 16.48 C ATOM 1334 C LEU A 239 -30.295 7.401 -15.374 1.00 16.50 C ATOM 1335 O LEU A 239 -31.356 7.424 -14.745 1.00 18.62 O ATOM 1336 CB LEU A 239 -31.316 7.378 -17.657 1.00 18.93 C ATOM 1337 CG LEU A 239 -31.255 8.901 -17.898 1.00 21.43 C ATOM 1338 CD1 LEU A 239 -29.901 9.376 -18.394 1.00 23.63 C ATOM 1339 CD2 LEU A 239 -32.371 9.284 -18.892 1.00 25.09 C ATOM 1340 H LEU A 239 -31.209 4.995 -16.168 1.00 0.00 H ATOM 1341 N LEU A 240 -29.165 7.855 -14.873 1.00 16.34 N ATOM 1342 CA LEU A 240 -29.067 8.447 -13.547 1.00 16.48 C ATOM 1343 C LEU A 240 -29.072 9.965 -13.663 1.00 15.60 C ATOM 1344 O LEU A 240 -28.310 10.535 -14.458 1.00 16.41 O ATOM 1345 CB LEU A 240 -27.740 7.988 -12.924 1.00 16.69 C ATOM 1346 CG LEU A 240 -27.309 8.632 -11.601 1.00 16.50 C ATOM 1347 CD1 LEU A 240 -28.298 8.289 -10.491 1.00 17.37 C ATOM 1348 CD2 LEU A 240 -25.902 8.161 -11.204 1.00 16.52 C ATOM 1349 H LEU A 240 -28.303 7.787 -15.451 1.00 0.00 H ATOM 1350 N LYS A 241 -29.952 10.621 -12.904 1.00 17.13 N ATOM 1351 CA LYS A 241 -30.033 12.076 -12.879 1.00 18.51 C ATOM 1352 C LYS A 241 -29.757 12.517 -11.462 1.00 19.40 C ATOM 1353 O LYS A 241 -30.468 12.090 -10.549 1.00 23.25 O ATOM 1354 CB LYS A 241 -31.417 12.555 -13.280 1.00 22.23 C ATOM 1355 CG LYS A 241 -31.763 12.236 -14.656 1.00 27.94 C ATOM 1356 CD LYS A 241 -33.192 12.725 -14.889 1.00 34.59 C ATOM 1357 CE LYS A 241 -33.861 11.903 -15.958 1.00 38.96 C ATOM 1358 NZ LYS A 241 -35.294 12.262 -16.149 1.00 41.45 N ATOM 1359 HZ1 LYS A 241 -35.810 12.108 -15.259 1.00 0.00 H ATOM 1360 HZ2 LYS A 241 -35.366 13.262 -16.425 1.00 0.00 H ATOM 1361 HZ3 LYS A 241 -35.703 11.665 -16.896 1.00 0.00 H ATOM 1362 H LYS A 241 -30.605 10.073 -12.308 1.00 0.00 H ATOM 1363 N THR A 242 -28.724 13.340 -11.268 1.00 16.83 N ATOM 1364 CA THR A 242 -28.284 13.714 -9.934 1.00 17.94 C ATOM 1365 C THR A 242 -27.962 15.202 -9.906 1.00 16.65 C ATOM 1366 O THR A 242 -27.246 15.704 -10.775 1.00 16.84 O ATOM 1367 CB THR A 242 -26.991 12.916 -9.629 1.00 21.10 C ATOM 1368 OG1 THR A 242 -27.218 11.505 -9.748 1.00 23.08 O ATOM 1369 CG2 THR A 242 -26.512 13.193 -8.217 1.00 23.99 C ATOM 1370 HG1 THR A 242 -27.920 11.230 -9.107 1.00 0.00 H ATOM 1371 H THR A 242 -28.221 13.724 -12.093 1.00 0.00 H ATOM 1372 N ASP A 243 -28.416 15.898 -8.853 1.00 17.24 N ATOM 1373 CA ASP A 243 -28.020 17.272 -8.598 1.00 17.89 C ATOM 1374 C ASP A 243 -26.793 17.243 -7.697 1.00 17.16 C ATOM 1375 O ASP A 243 -26.890 16.877 -6.527 1.00 21.35 O ATOM 1376 CB ASP A 243 -29.162 18.046 -7.919 1.00 20.91 C ATOM 1377 CG ASP A 243 -30.272 18.418 -8.877 1.00 25.89 C ATOM 1378 OD1 ASP A 243 -30.038 18.509 -10.091 1.00 26.92 O ATOM 1379 OD2 ASP A 243 -31.386 18.687 -8.397 1.00 30.47 O ATOM 1380 H ASP A 243 -29.076 15.437 -8.195 1.00 0.00 H ATOM 1381 N VAL A 244 -25.671 17.707 -8.195 1.00 14.52 N ATOM 1382 CA VAL A 244 -24.405 17.647 -7.469 1.00 14.02 C ATOM 1383 C VAL A 244 -24.163 19.007 -6.837 1.00 13.43 C ATOM 1384 O VAL A 244 -24.175 20.029 -7.556 1.00 13.64 O ATOM 1385 CB VAL A 244 -23.259 17.303 -8.441 1.00 15.06 C ATOM 1386 CG1 VAL A 244 -21.886 17.448 -7.771 1.00 16.31 C ATOM 1387 CG2 VAL A 244 -23.494 15.896 -9.010 1.00 16.43 C ATOM 1388 H VAL A 244 -25.684 18.134 -9.143 1.00 0.00 H ATOM 1389 N PRO A 245 -23.943 19.073 -5.534 1.00 13.71 N ATOM 1390 CA PRO A 245 -23.664 20.374 -4.916 1.00 14.05 C ATOM 1391 C PRO A 245 -22.318 20.922 -5.384 1.00 15.16 C ATOM 1392 O PRO A 245 -21.348 20.188 -5.500 1.00 17.21 O ATOM 1393 CB PRO A 245 -23.603 20.021 -3.417 1.00 15.43 C ATOM 1394 CG PRO A 245 -23.141 18.596 -3.392 1.00 16.59 C ATOM 1395 CD PRO A 245 -23.798 17.953 -4.559 1.00 14.48 C ATOM 1396 N LEU A 246 -22.251 22.225 -5.659 1.00 15.39 N ATOM 1397 CA LEU A 246 -20.995 22.855 -6.046 1.00 16.86 C ATOM 1398 C LEU A 246 -20.269 23.431 -4.853 1.00 17.29 C ATOM 1399 O LEU A 246 -20.896 23.874 -3.885 1.00 19.68 O ATOM 1400 CB LEU A 246 -21.258 23.949 -7.064 1.00 20.47 C ATOM 1401 CG LEU A 246 -21.583 23.407 -8.469 1.00 22.48 C ATOM 1402 CD1 LEU A 246 -22.043 24.540 -9.336 1.00 24.57 C ATOM 1403 CD2 LEU A 246 -20.381 22.697 -9.079 1.00 22.90 C ATOM 1404 H LEU A 246 -23.113 22.804 -5.596 1.00 0.00 H ATOM 1405 N SER A 247 -18.933 23.421 -4.891 1.00 16.20 N ATOM 1406 CA SER A 247 -18.154 24.124 -3.887 1.00 19.47 C ATOM 1407 C SER A 247 -17.932 25.560 -4.376 1.00 22.31 C ATOM 1408 O SER A 247 -18.056 25.860 -5.568 1.00 23.84 O ATOM 1409 CB SER A 247 -16.842 23.398 -3.695 1.00 23.84 C ATOM 1410 OG SER A 247 -16.093 23.650 -4.826 1.00 26.43 O ATOM 1411 HG SER A 247 -16.575 23.311 -5.622 1.00 0.00 H ATOM 1412 H SER A 247 -18.445 22.903 -5.649 1.00 0.00 H ATOM 1413 N SER A 248 -17.584 26.449 -3.460 1.00 24.54 N ATOM 1414 CA SER A 248 -17.238 27.808 -3.875 1.00 26.48 C ATOM 1415 C SER A 248 -16.340 28.434 -2.828 1.00 27.72 C ATOM 1416 O SER A 248 -16.079 27.838 -1.791 1.00 27.66 O ATOM 1417 CB SER A 248 -18.472 28.663 -4.097 1.00 30.00 C ATOM 1418 OG SER A 248 -19.098 28.918 -2.854 1.00 31.88 O ATOM 1419 HG SER A 248 -19.361 28.060 -2.436 1.00 0.00 H ATOM 1420 H SER A 248 -17.557 26.184 -2.455 1.00 0.00 H ATOM 1421 N ALA A 249 -15.840 29.633 -3.158 1.00 30.46 N ATOM 1422 CA ALA A 249 -15.249 30.662 -2.257 1.00 37.82 C ATOM 1423 C ALA A 249 -13.933 31.161 -2.792 1.00 41.26 C ATOM 1424 O ALA A 249 -13.855 31.581 -3.939 1.00 43.97 O ATOM 1425 CB ALA A 249 -15.115 30.242 -0.790 1.00 40.20 C ATOM 1426 H ALA A 249 -15.868 29.875 -4.169 1.00 0.00 H TER 1427 ALA A 249 HETATM 1428 O HOH 1 -24.397 23.341 -20.681 1.00 36.11 O HETATM 1429 O HOH 2 -29.869 15.661 -13.846 1.00 43.10 O HETATM 1430 O HOH 3 -24.106 27.631 -8.429 1.00 36.62 O HETATM 1431 O HOH 4 -2.996 -5.858 -11.517 1.00 36.35 O HETATM 1432 O HOH 5 -31.405 -14.154 -14.513 1.00 74.20 O HETATM 1433 O HOH 6 -4.841 6.341 -18.015 1.00 33.88 O HETATM 1434 O HOH 7 -25.240 22.514 -24.465 1.00 36.03 O HETATM 1435 O HOH 8 -26.640 15.090 -4.928 1.00 26.80 O HETATM 1436 O HOH 9 -14.206 -13.083 -24.470 1.00 26.51 O HETATM 1437 O HOH 10 -22.438 1.088 -29.696 1.00 51.85 O HETATM 1438 O HOH 11 -0.014 -7.003 -13.688 1.00 23.00 O HETATM 1439 O HOH 12 -8.991 -3.289 -25.173 1.00 31.41 O HETATM 1440 O HOH 13 -22.462 24.504 -16.495 1.00 41.99 O HETATM 1441 O HOH 14 -36.395 11.137 -14.224 1.00 58.94 O HETATM 1442 O HOH 15 -26.097 10.098 -28.576 1.00 30.24 O HETATM 1443 O HOH 16 -27.740 -16.923 -21.498 1.00 40.84 O HETATM 1444 O HOH 17 -27.996 -0.102 -25.708 1.00 26.68 O HETATM 1445 O HOH 18 -35.546 9.734 -16.153 1.00 46.45 O HETATM 1446 O HOH 19 -19.466 27.033 -1.183 1.00 67.13 O HETATM 1447 O HOH 20 -32.281 -12.830 -21.372 1.00 43.38 O HETATM 1448 O HOH 21 -26.498 14.404 -27.149 1.00 35.39 O HETATM 1449 O HOH 22 -21.738 26.240 -3.330 1.00 48.72 O HETATM 1450 O HOH 23 -23.752 -5.731 -28.516 1.00 42.80 O HETATM 1451 O HOH 24 -28.272 -3.376 -8.536 1.00 45.73 O HETATM 1452 O HOH 25 -35.882 -5.637 -16.979 1.00 42.91 O HETATM 1453 O HOH 26 -29.798 21.418 -16.709 1.00 44.28 O HETATM 1454 O HOH 27 -17.120 -9.292 -11.375 1.00 31.43 O HETATM 1455 O HOH 28 -2.087 -1.636 -16.967 1.00 36.04 O HETATM 1456 O HOH 29 -24.504 24.867 -12.631 1.00 19.38 O HETATM 1457 O HOH 30 -29.549 2.118 -25.291 1.00 35.28 O HETATM 1458 O HOH 31 -28.845 10.382 -26.585 1.00 55.23 O HETATM 1459 O HOH 32 -26.959 26.508 -9.930 1.00 43.05 O HETATM 1460 O HOH 33 -20.771 -3.707 -2.945 1.00 51.41 O HETATM 1461 O HOH 34 -15.244 6.747 -26.154 1.00 26.41 O HETATM 1462 O HOH 35 -19.058 27.360 -7.516 1.00 23.36 O HETATM 1463 O HOH 36 -30.632 16.564 -11.817 1.00 32.82 O HETATM 1464 O HOH 37 -17.009 -5.548 -29.366 1.00 34.15 O HETATM 1465 O HOH 38 -18.946 19.726 -6.580 1.00 26.92 O HETATM 1466 O HOH 39 -5.586 -5.322 -22.652 1.00 31.28 O HETATM 1467 O HOH 40 -17.667 -10.734 -14.585 1.00 27.50 O HETATM 1468 O HOH 41 -22.901 8.024 -34.556 1.00 42.63 O HETATM 1469 O HOH 42 -5.994 -6.979 -15.270 1.00 13.27 O HETATM 1470 O HOH 43 -17.906 -3.501 -27.544 1.00 22.86 O HETATM 1471 O HOH 44 -25.441 -12.352 -26.519 1.00 46.38 O HETATM 1472 O HOH 45 -20.767 -9.627 -9.306 1.00 49.44 O HETATM 1473 O HOH 46 -32.855 3.947 -22.941 1.00 30.31 O HETATM 1474 O HOH 47 -7.576 -4.595 -9.858 1.00 14.44 O HETATM 1475 O HOH 48 -22.263 -11.555 -28.038 1.00 34.38 O HETATM 1476 O HOH 49 -8.954 -4.724 -16.790 1.00 11.88 O HETATM 1477 O HOH 50 -9.947 -8.683 -24.523 1.00 19.00 O HETATM 1478 O HOH 51 -34.189 1.334 -18.786 1.00 37.31 O HETATM 1479 O HOH 52 -23.909 -11.089 -15.074 1.00 30.14 O HETATM 1480 O HOH 53 -4.252 -2.186 -20.758 1.00 47.14 O HETATM 1481 O HOH 54 -21.939 5.255 -0.244 1.00 27.10 O HETATM 1482 O HOH 55 -12.746 20.945 -20.141 1.00 21.72 O HETATM 1483 O HOH 56 -31.903 -6.785 -19.089 1.00 31.31 O HETATM 1484 O HOH 57 -18.945 20.573 -18.044 1.00 30.73 O HETATM 1485 O HOH 58 -16.007 5.602 -29.856 1.00 27.97 O HETATM 1486 O HOH 59 -12.499 0.903 -24.776 1.00 18.30 O HETATM 1487 O HOH 60 -1.365 6.572 -9.058 1.00 20.62 O HETATM 1488 O HOH 61 -22.016 -14.042 -23.449 1.00 23.30 O HETATM 1489 O HOH 62 -11.795 -0.633 0.008 1.00 28.03 O HETATM 1490 O HOH 63 -3.344 5.003 -15.912 1.00 19.36 O HETATM 1491 O HOH 64 -35.290 6.792 -11.672 1.00 42.05 O HETATM 1492 O HOH 65 -30.350 20.693 -22.937 1.00 31.62 O HETATM 1493 O HOH 66 -12.166 -12.010 -10.902 1.00 15.36 O HETATM 1494 O HOH 67 -12.586 -9.669 -9.284 1.00 18.65 O HETATM 1495 O HOH 68 -4.054 14.765 -10.769 1.00 20.96 O HETATM 1496 O HOH 69 -17.383 9.767 -29.164 1.00 35.79 O HETATM 1497 O HOH 70 -28.887 -17.912 -22.633 1.00 52.10 O HETATM 1498 O HOH 71 -11.733 -6.037 -3.526 1.00 21.95 O HETATM 1499 O HOH 72 -6.624 -9.576 -15.295 1.00 12.75 O HETATM 1500 O HOH 73 -31.148 20.637 -11.528 1.00 46.15 O HETATM 1501 O HOH 74 -15.466 18.967 -3.305 1.00 23.42 O HETATM 1502 O HOH 75 -28.315 -1.991 -21.986 1.00 17.68 O HETATM 1503 O HOH 76 -21.318 -1.599 -27.474 1.00 36.71 O HETATM 1504 O HOH 77 -24.931 4.549 -3.841 1.00 28.81 O HETATM 1505 O HOH 78 -7.425 2.936 -21.233 1.00 19.79 O HETATM 1506 O HOH 79 -0.782 -10.480 -19.259 1.00 19.59 O HETATM 1507 O HOH 80 -30.548 14.897 -7.310 1.00 49.36 O HETATM 1508 O HOH 81 -28.148 7.234 -29.919 1.00 30.51 O HETATM 1509 O HOH 82 -27.625 27.519 -1.084 1.00 34.73 O HETATM 1510 O HOH 83 -6.161 8.777 -3.519 1.00 35.29 O HETATM 1511 O HOH 84 -4.880 12.013 -5.300 1.00 29.73 O HETATM 1512 O HOH 85 -25.328 -10.047 -13.345 1.00 45.54 O HETATM 1513 O HOH 86 -10.894 -10.304 -22.464 1.00 15.76 O HETATM 1514 O HOH 87 -12.560 19.444 -1.371 1.00 32.79 O HETATM 1515 O HOH 88 -28.347 23.898 -20.945 1.00 45.95 O HETATM 1516 O HOH 89 -7.268 -0.464 -4.122 1.00 20.92 O HETATM 1517 O HOH 90 -16.036 -17.097 -25.786 1.00 32.69 O HETATM 1518 O HOH 91 -14.012 -10.286 -27.436 1.00 37.53 O HETATM 1519 O HOH 92 -20.539 23.321 -15.881 1.00 36.18 O HETATM 1520 O HOH 93 -18.004 9.182 -3.999 1.00 18.76 O HETATM 1521 O HOH 94 -9.347 19.973 -5.682 1.00 18.47 O HETATM 1522 O HOH 95 -31.798 8.691 -22.879 1.00 44.81 O HETATM 1523 O HOH 96 -11.564 24.392 -17.354 1.00 16.10 O HETATM 1524 O HOH 97 -27.354 17.663 -17.680 1.00 17.28 O HETATM 1525 O HOH 98 -18.969 26.802 -15.197 1.00 38.70 O HETATM 1526 O HOH 99 -20.337 -4.788 -16.878 1.00 12.92 O HETATM 1527 O HOH 100 -2.621 9.129 -16.750 1.00 29.77 O HETATM 1528 O HOH 101 -29.614 10.770 -8.145 1.00 44.90 O HETATM 1529 O HOH 102 -23.433 -2.987 -20.049 1.00 38.99 O HETATM 1530 O HOH 103 -12.680 10.202 2.647 1.00 51.25 O HETATM 1531 O HOH 104 -8.482 6.911 -5.523 1.00 32.25 O HETATM 1532 O HOH 105 -21.697 -13.543 -31.091 1.00 43.47 O HETATM 1533 O HOH 106 -25.865 -1.428 -0.998 1.00 55.22 O HETATM 1534 O HOH 107 -33.184 -4.214 -21.920 1.00 39.14 O HETATM 1535 O HOH 108 -16.144 21.057 -19.551 1.00 27.87 O HETATM 1536 O HOH 109 -33.961 8.583 -15.192 1.00 36.53 O HETATM 1537 O HOH 110 -12.078 -3.314 0.328 1.00 39.05 O HETATM 1538 O HOH 111 -18.751 -1.081 -27.182 1.00 45.91 O HETATM 1539 O HOH 112 -31.980 9.088 -11.506 1.00 23.75 O HETATM 1540 O HOH 113 -18.850 -3.424 -1.045 1.00 45.24 O HETATM 1541 O HOH 114 -8.845 6.720 -22.137 1.00 16.47 O HETATM 1542 O HOH 115 -2.477 -0.491 -10.752 1.00 15.60 O HETATM 1543 O HOH 116 -31.689 -2.914 -10.946 1.00 50.22 O HETATM 1544 O HOH 117 -23.726 16.381 -28.723 1.00 20.48 O HETATM 1545 O HOH 118 -15.572 16.756 -22.347 1.00 35.14 O HETATM 1546 O HOH 119 -14.890 8.518 -21.673 1.00 17.30 O HETATM 1547 O HOH 120 -14.355 -1.110 -27.558 1.00 26.06 O HETATM 1548 O HOH 121 -30.797 -5.362 -11.439 1.00 28.94 O HETATM 1549 O HOH 122 -30.047 -7.844 -23.187 1.00 30.42 O HETATM 1550 O HOH 123 -1.762 4.251 -7.462 1.00 20.28 O HETATM 1551 O HOH 124 -24.059 4.264 -34.101 1.00 39.92 O HETATM 1552 O HOH 125 -32.821 4.447 -15.363 1.00 31.28 O HETATM 1553 O HOH 126 -5.577 -6.818 -11.937 1.00 16.97 O HETATM 1554 O HOH 127 -18.701 1.280 -0.722 1.00 33.00 O HETATM 1555 O HOH 128 -14.284 -7.511 -29.052 1.00 39.48 O HETATM 1556 O HOH 129 -8.915 18.258 -3.437 1.00 21.59 O HETATM 1557 O HOH 130 -27.030 -17.380 -18.152 1.00 31.59 O HETATM 1558 O HOH 131 -12.929 13.874 2.086 1.00 45.63 O HETATM 1559 O HOH 132 -8.001 11.372 -22.618 1.00 36.96 O HETATM 1560 O HOH 133 -19.425 -1.411 -1.492 1.00 46.68 O HETATM 1561 O HOH 134 -10.053 1.913 -23.559 1.00 32.24 O HETATM 1562 O HOH 135 -21.267 21.245 -19.341 1.00 22.93 O HETATM 1563 O HOH 136 -35.850 -6.032 -18.772 1.00 47.68 O HETATM 1564 O HOH 137 -18.461 8.040 0.044 1.00 36.63 O HETATM 1565 O HOH 138 -28.753 7.268 -6.347 1.00 38.24 O HETATM 1566 O HOH 139 -26.933 30.641 -4.535 1.00 53.70 O HETATM 1567 O HOH 140 -17.432 12.026 -26.252 1.00 27.14 O HETATM 1568 O HOH 141 -28.776 26.736 -7.253 1.00 47.75 O HETATM 1569 O HOH 142 -14.593 7.328 -33.146 1.00 50.80 O HETATM 1570 O HOH 143 -6.107 -6.642 -8.398 1.00 17.17 O HETATM 1571 O HOH 144 -15.324 -11.274 -29.270 1.00 48.24 O HETATM 1572 O HOH 145 -17.363 -8.799 -7.242 1.00 47.86 O HETATM 1573 O HOH 146 -9.836 6.513 -2.787 1.00 36.87 O HETATM 1574 O HOH 147 -30.498 -5.068 -22.126 1.00 38.18 O HETATM 1575 O HOH 148 -30.070 0.897 -9.328 1.00 38.77 O HETATM 1576 O HOH 149 -6.448 6.307 -20.331 1.00 37.11 O HETATM 1577 O HOH 150 -19.622 -8.243 -31.558 1.00 48.96 O HETATM 1578 O HOH 151 -28.781 2.228 -6.576 1.00 71.55 O HETATM 1579 O HOH 152 -35.537 10.911 -18.844 1.00 69.13 O HETATM 1580 O HOH 153 -10.792 -6.745 -27.858 1.00 36.84 O HETATM 1581 O HOH 154 -5.683 11.685 -12.279 1.00 24.37 O HETATM 1582 O HOH 155 -19.869 -11.774 -13.380 1.00 19.77 O HETATM 1583 O HOH 156 -11.172 8.617 -1.611 1.00 29.57 O HETATM 1584 O HOH 157 -19.502 20.744 -3.159 1.00 36.99 O HETATM 1585 O HOH 158 -15.524 30.237 -6.121 1.00 33.84 O HETATM 1586 O HOH 159 -30.692 5.906 -7.869 1.00 48.21 O HETATM 1587 O HOH 160 -21.398 2.824 -35.430 1.00 40.39 O HETATM 1588 O HOH 161 -25.330 -12.564 -16.792 1.00 33.46 O HETATM 1589 O HOH 162 -20.191 27.622 -11.196 1.00 51.17 O HETATM 1590 O HOH 163 -3.825 8.449 -3.590 1.00 42.20 O HETATM 1591 O HOH 164 -10.149 17.719 -19.941 1.00 31.20 O HETATM 1592 O HOH 165 -7.196 16.076 -14.496 1.00 18.58 O HETATM 1593 O HOH 166 -33.563 12.106 -10.579 1.00 77.41 O HETATM 1594 O HOH 167 -11.471 14.984 1.265 1.00 42.67 O HETATM 1595 O HOH 168 -16.649 6.289 0.992 1.00 55.16 O HETATM 1596 O HOH 169 -7.651 0.790 -24.115 1.00 38.89 O HETATM 1597 O HOH 170 -32.917 -10.588 -21.982 1.00 43.22 O HETATM 1598 O HOH 171 -29.382 16.845 -19.438 1.00 50.08 O HETATM 1599 O HOH 172 -5.053 1.256 -4.897 1.00 19.10 O HETATM 1600 O HOH 173 -26.999 11.212 -25.689 1.00 54.23 O HETATM 1601 O HOH 174 -12.309 2.601 -26.756 1.00 41.40 O HETATM 1602 O HOH 175 -17.529 17.305 -5.456 1.00 36.99 O HETATM 1603 O HOH 176 -0.982 -7.367 -10.945 1.00 34.54 O HETATM 1604 O HOH 177 -28.503 5.171 -5.020 1.00 56.51 O HETATM 1605 O HOH 178 -18.092 -18.098 -27.405 1.00 42.63 O HETATM 1606 O HOH 179 -24.330 25.464 -22.640 1.00 49.39 O HETATM 1607 O HOH 180 -25.317 -3.711 -6.564 1.00 51.09 O HETATM 1608 O HOH 181 -9.242 9.119 -23.348 1.00 26.88 O HETATM 1609 O HOH 182 -29.777 -5.717 -25.173 1.00 43.43 O HETATM 1610 O HOH 183 -13.592 -7.913 -4.571 1.00 36.97 O HETATM 1611 O HOH 184 -14.931 11.009 -25.693 1.00 41.56 O HETATM 1612 O HOH 185 -6.737 -3.238 -23.831 1.00 31.95 O HETATM 1613 O HOH 186 -25.341 27.124 -0.375 1.00 48.60 O HETATM 1614 O HOH 187 0.814 -5.709 -19.965 1.00 52.52 O HETATM 1615 O HOH 188 -15.676 -3.171 -28.421 1.00 49.74 O HETATM 1616 O HOH 189 -10.776 12.536 -23.680 1.00 43.95 O HETATM 1617 O HOH 190 -1.380 8.180 -6.542 1.00 35.20 O HETATM 1618 O HOH 191 -10.923 15.828 -20.808 1.00 41.64 O HETATM 1619 O HOH 192 -1.289 0.515 -15.775 1.00 27.24 O HETATM 1620 O HOH 193 -28.951 14.412 -5.416 1.00 39.94 O HETATM 1621 O HOH 194 -6.669 -4.938 -2.983 1.00 47.34 O HETATM 1622 O HOH 195 -26.435 6.836 -4.394 1.00 41.03 O HETATM 1623 O HOH 196 -21.859 -7.796 -28.943 1.00 50.28 O HETATM 1624 O HOH 197 -23.244 -13.847 -26.199 1.00 42.81 O HETATM 1625 O HOH 198 -8.923 4.869 -24.311 1.00 46.62 O HETATM 1626 O HOH 199 -22.036 -4.875 -27.450 1.00 43.60 O HETATM 1627 O HOH 200 1.337 -3.269 -16.612 1.00 29.21 O HETATM 1628 O HOH 201 -2.425 7.255 -14.759 1.00 20.55 O HETATM 1629 O HOH 202 -8.419 1.451 -2.497 1.00 32.37 O HETATM 1630 O HOH 203 -13.464 0.836 1.646 1.00 37.00 O HETATM 1631 O HOH 204 -3.405 -5.363 -9.248 1.00 51.67 O HETATM 1632 O HOH 205 -1.048 4.850 -4.846 1.00 38.34 O HETATM 1633 O HOH 206 0.775 -3.785 -19.218 1.00 45.52 O HETATM 1634 O HOH 207 -22.424 -12.104 -32.894 1.00 54.96 O HETATM 1635 O HOH 208 -19.494 -6.083 -2.931 1.00 65.60 O HETATM 1636 O HOH 209 -11.800 -12.737 -23.797 1.00 32.41 O HETATM 1637 O HOH 210 -2.390 7.557 -19.512 1.00 39.69 O HETATM 1638 O HOH 211 -32.305 -8.347 -21.707 1.00 46.48 O HETATM 1639 O HOH 212 -26.240 0.999 -6.210 1.00 54.27 O HETATM 1640 O HOH 213 -5.313 10.464 -22.535 1.00 36.62 O HETATM 1641 O HOH 214 -26.181 -14.394 -15.446 1.00 51.44 O HETATM 1642 O HOH 215 -26.122 -1.199 -5.567 1.00 50.82 O HETATM 1643 O HOH 216 -26.719 2.641 -4.187 1.00 41.53 O HETATM 1644 O HOH 217 -4.611 7.873 -21.900 1.00 38.83 O HETATM 1645 O HOH 218 -0.805 10.849 -6.353 1.00 35.16 O HETATM 1646 O HOH 219 -17.526 19.580 -3.259 1.00 51.20 O HETATM 1647 O HOH 220 -33.146 -13.746 -19.278 1.00 50.51 O HETATM 1648 O HOH 221 -14.443 21.375 -1.943 1.00 31.99 O HETATM 1649 O HOH 222 -12.595 16.315 -22.424 1.00 59.20 O HETATM 1650 O HOH 223 -9.403 -6.686 -1.780 1.00 38.82 O HETATM 1651 O HOH 224 -22.125 23.942 -19.122 1.00 45.33 O HETATM 1652 O HOH 225 -20.562 20.968 -21.996 1.00 32.68 O HETATM 1653 O HOH 226 -9.250 0.049 0.369 1.00 40.96 O HETATM 1654 O HOH 227 -4.476 2.528 -2.486 1.00 45.26 O HETATM 1655 O HOH 228 -2.572 0.400 -6.022 1.00 33.27 O HETATM 1656 O HOH 229 -24.416 27.543 -11.314 1.00 51.82 O HETATM 1657 O HOH 230 -6.001 13.668 -12.648 1.00 42.56 O HETATM 1658 O HOH 231 -3.294 -8.428 -22.392 1.00 34.54 O HETATM 1659 O HOH 232 -7.892 6.460 -2.101 1.00 51.69 O HETATM 1660 O HOH 233 -9.793 10.747 -1.237 1.00 34.86 O HETATM 1661 O HOH 234 -18.217 20.014 -23.456 1.00 33.25 O HETATM 1662 O HOH 235 -11.114 -9.106 -26.992 1.00 47.57 O HETATM 1663 O HOH 236 -22.048 27.172 -15.243 1.00 47.76 O HETATM 1664 O HOH 237 -8.860 -5.019 -27.514 1.00 45.49 O HETATM 1665 O HOH 238 -2.760 -3.576 -22.261 1.00 41.52 O HETATM 1666 O HOH 239 -0.502 -7.906 -22.863 1.00 48.46 O HETATM 1667 O HOH 240 -1.564 7.133 -4.467 1.00 69.69 O HETATM 1668 O HOH 241 -32.297 1.043 -25.751 1.00 48.89 O HETATM 1669 O HOH 242 -14.009 8.975 -24.124 1.00 31.54 O HETATM 1670 O HOH 243 -20.862 -15.582 -30.072 1.00 50.33 O HETATM 1671 O HOH 244 -24.634 25.263 -1.614 1.00 34.03 O HETATM 1672 O HOH 245 -7.244 -9.156 -24.738 1.00 28.08 O HETATM 1673 O HOH 246 -17.618 29.555 -7.699 1.00 44.05 O HETATM 1674 O HOH 247 -12.850 5.367 -26.976 1.00 30.24 O HETATM 1675 O HOH 248 -14.961 8.929 -28.053 1.00 49.50 O HETATM 1676 O HOH 249 -34.051 2.351 -24.583 1.00 41.69 O HETATM 1677 O HOH 250 -2.334 -7.743 -6.929 1.00 42.40 O HETATM 1678 O HOH 251 -31.200 18.594 -20.374 1.00 54.20 O HETATM 1679 O HOH 252 -32.596 16.861 -4.666 1.00 39.81 O HETATM 1680 O HOH 253 -6.944 10.278 -1.322 1.00 50.47 O HETATM 1681 O HOH 254 -33.124 -14.761 -23.113 1.00 43.47 O HETATM 1682 O HOH 255 -14.399 -14.779 -26.519 1.00 51.39 O HETATM 1683 O HOH 256 -27.184 4.332 -29.923 1.00 48.00 O HETATM 1684 O HOH 257 -29.947 -2.994 -24.123 1.00 33.82 O HETATM 1685 O HOH 258 -34.374 10.375 -11.883 1.00 42.13 O HETATM 1686 O HOH 259 -6.329 -2.357 -2.375 1.00 32.27 O HETATM 1687 O HOH 260 -10.050 12.213 1.109 1.00 37.77 O HETATM 1688 O HOH 261 -27.076 27.391 -11.804 1.00 42.48 O HETATM 1689 O HOH 262 -25.797 -19.286 -19.561 1.00 36.05 O HETATM 1690 O HOH 263 -1.950 -2.025 -6.755 1.00 38.28 O HETATM 1691 O HOH 264 -23.247 25.478 -18.893 1.00 49.61 O HETATM 1692 O HOH 265 -11.457 8.885 -24.703 1.00 39.19 O HETATM 1693 O HOH 266 -0.728 1.828 -7.708 1.00 25.00 O HETATM 1694 O HOH 267 -30.877 7.841 -31.109 1.00 42.21 O HETATM 1695 O HOH 268 -17.995 -15.527 -29.493 1.00 51.97 O HETATM 1696 O HOH 269 -8.848 -0.549 -26.478 1.00 51.37 O HETATM 1697 O HOH 270 -5.327 4.210 -19.919 1.00 28.52 O HETATM 1698 O HOH 271 -0.145 -3.995 -21.220 1.00 61.57 O HETATM 1699 O HOH 272 -1.663 -6.361 -8.836 1.00 54.57 O HETATM 1700 O HOH 273 -5.462 -7.373 -24.218 1.00 42.22 O HETATM 1701 O HOH 274 -22.385 -13.779 -14.095 1.00 52.37 O HETATM 1702 O HOH 275 -28.310 30.193 -5.928 1.00 55.08 O HETATM 1703 O HOH 276 -12.191 2.851 2.830 1.00 51.02 O HETATM 1704 O HOH 277 -6.041 3.542 -23.596 1.00 40.96 O HETATM 1705 O HOH 278 -7.815 13.873 -12.653 1.00 23.05 O HETATM 1706 O HOH 279 -32.847 4.021 -8.407 1.00 52.99 O HETATM 1707 O HOH 280 -15.806 29.745 -10.290 1.00 31.27 O HETATM 1708 O HOH 281 -16.210 19.314 -21.866 1.00 25.70 O HETATM 1709 O HOH 282 -3.492 2.914 -20.584 1.00 47.79 O HETATM 1710 O HOH 283 -9.526 -4.537 0.343 1.00 43.46 O HETATM 1711 O HOH 284 -13.547 28.318 -9.667 1.00 21.19 O HETATM 1712 O HOH 285 -35.742 9.978 -20.484 1.00 79.24 O HETATM 1713 O HOH 286 -32.897 -2.971 -23.771 1.00 75.23 O HETATM 1714 O HOH 287 -37.327 7.735 -16.708 1.00 44.72 O HETATM 1715 O HOH 288 -8.372 12.596 -25.173 1.00 58.08 O HETATM 1716 O HOH 289 -24.676 -13.131 -31.623 1.00 57.49 O HETATM 1717 O HOH 290 0.000 0.000 -9.625 1.00 19.63 O HETATM 1718 O HOH 291 -1.777 1.216 -19.362 1.00 54.49 O HETATM 1719 O HOH 292 -1.797 8.053 -21.460 1.00 48.71 O HETATM 1720 O HOH 293 -5.173 -9.531 -11.470 1.00 18.21 O HETATM 1721 O HOH 294 -32.594 -1.340 -24.759 1.00 55.94 O HETATM 1722 O HOH 295 -10.327 6.486 -26.138 1.00 45.28 O HETATM 1723 O HOH 296 -4.008 -11.154 -22.324 1.00 21.43 O HETATM 1724 O HOH 297 -22.920 29.256 -15.494 1.00 57.55 O HETATM 1725 O HOH 298 -8.088 -3.383 0.088 1.00 51.68 O HETATM 1726 O HOH 299 -19.305 30.962 -15.695 1.00 58.09 O HETATM 1727 O HOH 300 -9.687 -13.783 -24.870 1.00 39.24 O HETATM 1728 O HOH 301 -7.413 9.000 -25.910 1.00 51.91 O HETATM 1729 O HOH 302 -21.538 -18.387 -30.014 1.00 56.65 O HETATM 1730 O HOH 303 -7.186 -10.106 -27.547 1.00 43.66 O HETATM 1731 O HOH 304 0.000 0.000 -21.006 1.00 47.32 O HETATM 1732 O HOH 305 -20.572 30.699 -14.152 1.00 77.75 O HETATM 1733 O HOH 306 -4.541 0.423 -0.353 1.00 54.16 O HETATM 1734 O HOH 307 -8.725 -13.246 -27.003 1.00 49.59 O HETATM 1735 C8 LEC A 308 -18.389 -11.902 -31.310 1.00 0.03 C HETATM 1736 C7 LEC A 308 -19.053 -11.300 -30.068 1.00 0.17 C HETATM 1737 O7 LEC A 308 -20.267 -11.369 -29.862 1.00 -0.40 O HETATM 1738 N2 LEC A 308 -18.237 -10.625 -29.179 1.00 -0.28 N HETATM 1739 C2 LEC A 308 -18.723 -9.996 -27.955 1.00 0.13 C HETATM 1740 C3 LEC A 308 -18.060 -8.682 -27.732 1.00 0.11 C HETATM 1741 O3 LEC A 308 -18.404 -7.767 -28.848 1.00 -0.39 O HETATM 1742 H7 LEC A 308 -17.982 -6.927 -28.709 1.00 0.21 H HETATM 1743 C4 LEC A 308 -18.454 -8.089 -26.448 1.00 0.11 C HETATM 1744 O4 LEC A 308 -17.700 -6.841 -26.254 1.00 -0.39 O HETATM 1745 H9 LEC A 308 -17.948 -6.448 -25.425 1.00 0.21 H HETATM 1746 C5 LEC A 308 -18.166 -9.013 -25.308 1.00 0.11 C HETATM 1747 C6 LEC A 308 -18.627 -8.477 -23.979 1.00 0.07 C HETATM 1748 O6 LEC A 308 -20.066 -8.237 -23.936 1.00 -0.39 O HETATM 1749 H13 LEC A 308 -20.300 -7.602 -24.603 1.00 0.21 H HETATM 1750 H11 LEC A 308 -18.106 -7.528 -23.782 1.00 0.06 H HETATM 1751 H12 LEC A 308 -18.369 -9.206 -23.197 1.00 0.06 H HETATM 1752 O5 LEC A 308 -18.901 -10.254 -25.543 1.00 -0.34 O HETATM 1753 C1 LEC A 308 -18.473 -10.965 -26.774 1.00 0.21 C HETATM 1754 O1 LEC A 308 -19.295 -12.001 -26.926 1.00 -0.28 O HETATM 1755 C1' LEC A 308 -19.003 -13.154 -26.186 1.00 0.10 C HETATM 1756 C2' LEC A 308 -18.071 -13.188 -25.163 1.00 -0.02 C HETATM 1757 C3' LEC A 308 -17.838 -14.388 -24.483 1.00 -0.03 C HETATM 1758 C4' LEC A 308 -18.556 -15.517 -24.825 1.00 0.19 C HETATM 1759 N1' LEC A 308 -18.317 -16.748 -24.124 1.00 0.31 N HETATM 1760 O2' LEC A 308 -17.304 -16.779 -23.210 1.00 0.17 O HETATM 1761 O1' LEC A 308 -18.988 -17.726 -24.346 1.00 0.17 O HETATM 1762 C5' LEC A 308 -19.502 -15.465 -25.860 1.00 -0.03 C HETATM 1763 C6' LEC A 308 -19.725 -14.271 -26.533 1.00 -0.02 C HETATM 1764 H18 LEC A 308 -20.463 -14.220 -27.326 1.00 0.06 H HETATM 1765 H17 LEC A 308 -20.057 -16.355 -26.134 1.00 0.07 H HETATM 1766 H16 LEC A 308 -17.098 -14.431 -23.692 1.00 0.07 H HETATM 1767 H15 LEC A 308 -17.526 -12.291 -24.891 1.00 0.06 H HETATM 1768 H14 LEC A 308 -17.421 -11.283 -26.721 1.00 0.10 H HETATM 1769 H10 LEC A 308 -17.084 -9.209 -25.266 1.00 0.06 H HETATM 1770 H8 LEC A 308 -19.532 -7.870 -26.468 1.00 0.06 H HETATM 1771 H6 LEC A 308 -16.971 -8.836 -27.722 1.00 0.06 H HETATM 1772 H5 LEC A 308 -19.805 -9.825 -28.049 1.00 0.06 H HETATM 1773 H4 LEC A 308 -17.261 -10.565 -29.386 1.00 0.19 H HETATM 1774 H1 LEC A 308 -17.305 -11.716 -31.273 1.00 0.05 H HETATM 1775 H2 LEC A 308 -18.811 -11.437 -32.213 1.00 0.05 H HETATM 1776 H3 LEC A 308 -18.574 -12.986 -31.335 1.00 0.05 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 1735 1736 1774 1775 1776 CONECT 1736 1735 1737 1738 CONECT 1737 1736 CONECT 1738 1736 1739 1773 CONECT 1739 1738 1740 1753 1772 CONECT 1740 1739 1741 1743 1771 CONECT 1741 1740 1742 CONECT 1742 1741 CONECT 1743 1740 1744 1746 1770 CONECT 1744 1743 1745 CONECT 1745 1744 CONECT 1746 1743 1747 1752 1769 CONECT 1747 1746 1748 1750 1751 CONECT 1748 1747 1749 CONECT 1749 1748 CONECT 1750 1747 CONECT 1751 1747 CONECT 1752 1746 1753 CONECT 1753 1739 1752 1754 1768 CONECT 1754 1753 1755 CONECT 1755 1754 1756 1763 CONECT 1756 1755 1757 1767 CONECT 1757 1756 1758 1766 CONECT 1758 1757 1759 1762 CONECT 1759 1758 1760 1761 CONECT 1760 1759 CONECT 1761 1759 CONECT 1762 1758 1763 1765 CONECT 1763 1755 1762 1764 CONECT 1764 1763 CONECT 1765 1762 CONECT 1766 1757 CONECT 1767 1756 CONECT 1768 1753 CONECT 1769 1746 CONECT 1770 1743 CONECT 1771 1740 CONECT 1772 1739 CONECT 1773 1738 CONECT 1774 1735 CONECT 1775 1735 CONECT 1776 1735 MASTER 0 0 0 0 0 0 0 0 1775 1 46 12 END
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Structure:
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Related entries of code: 5ggn
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5ggj
RCSB PDB
PDBbind
164aa, >5GGJ_1|Chains... *
5ggk
RCSB PDB
PDBbind
164aa, >5GGK_1|Chains... at 100%
5ggl
RCSB PDB
PDBbind
164aa, >5GGL_1|Chains... at 100%
5ggo
RCSB PDB
PDBbind
164aa, >5GGO_1|Chains... at 100%
5ggp
RCSB PDB
PDBbind
164aa, >5GGP_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3lm1
RCSB PDB
PDBbind
LEC
Entry Information
PDB ID
5ggn
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
N-terminal domain of human protein O-mannose beta-1,2-N-acetylglucosaminyltransferase
Ligand Name
LEC
EC.Number
E.C.2.4.1
Resolution
1.21(Å)
Affinity (Kd/Ki/IC50)
Kd=0.22mM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Proc.Natl.Acad.Sci.USA Vol.113 : pp. 9280-9285
Ligand Properties
Formula
C
1
4
H
1
8
N
2
O
8
Molecular Weight
342.301
Exact Mass
342.106
No. of atoms
42
No. of bonds
43
Polar Surface Area
154.07
LOGP Value
-0.41 (
Computed with XLOGP3
)
-0.17 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@@H](Oc2ccc(cc2)N(=O)=O)[C@@H]([C@H]([C@@H]1O)O)NC(=O)C
InChI String
InChI=1S/C14H18N2O8/c1-7(18)15-11-13(20)12(19)10(6-17)24-14(11)23-9-4-2-8(3-5-9)16(21)22/h2-5,10-14,17,19-20H,6H2,1H3,(H,15,18)/t10-,11-,12-,13-,14-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q8WZA1
Entrez Gene ID
NCBI Entrez Gene ID:
55624
ASD
Information of known allosteric effects of PDB entries
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