Browse entries in the PDBbind-CN Database
HEADER 3LXO_COMPLEX COMPND 3LXO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 124 LYS GLU THR ALA ALA ALA LYS PHE GLU ARG GLN HIS MET SEQRES 2 A 124 ASP SER SER THR SER ALA ALA SER SER SER ASN TYR CYS SEQRES 3 A 124 ASN GLN MET MET LYS SER ARG ASN LEU THR LYS ASP ARG SEQRES 4 A 124 CYS LYS PRO VAL ASN THR PHE VAL HIS GLU SER LEU ALA SEQRES 5 A 124 ASP VAL GLN ALA VAL CYS SER GLN LYS ASN VAL ALA CYS SEQRES 6 A 124 LYS ASN GLY GLN THR ASN CYS TYR GLN SER TYR SER THR SEQRES 7 A 124 MET SER ILE THR ASP CYS ARG GLU THR GLY SER SER LYS SEQRES 8 A 124 TYR PRO ASN CYS ALA TYR LYS THR THR GLN ALA ASN LYS SEQRES 9 A 124 HIS ILE ILE VAL ALA CYS GLU GLY ASN PRO TYR VAL PRO SEQRES 10 A 124 VAL HIS PHE ASP ALA SER VAL HET T A 3P 34 SSBOND 1 CYS A 65 CYS A 72 SSBOND 2 CYS A 26 CYS A 84 SSBOND 3 CYS A 40 CYS A 95 SSBOND 4 CYS A 58 CYS A 110 ATOM 1 N LYS A 1 11.352 -18.131 10.862 1.00 56.32 N ATOM 2 CA LYS A 1 12.016 -19.299 11.416 1.00 49.33 C ATOM 3 C LYS A 1 11.482 -20.571 10.750 1.00 44.44 C ATOM 4 O LYS A 1 12.269 -21.364 10.249 1.00 48.39 O ATOM 5 CB LYS A 1 11.787 -19.370 12.964 1.00 25.26 C ATOM 6 CG LYS A 1 12.460 -20.593 13.756 1.00 20.86 C ATOM 7 HA LYS A 1 13.086 -19.218 11.222 1.00 0.00 H ATOM 8 HB2 LYS A 1 12.176 -18.448 13.395 1.00 0.00 H ATOM 9 HB3 LYS A 1 10.712 -19.423 13.133 1.00 0.00 H ATOM 10 HG2 LYS A 1 12.075 -21.534 13.363 1.00 0.00 H ATOM 11 HG3 LYS A 1 13.542 -20.558 13.625 1.00 0.00 H ATOM 12 HN3 LYS A 1 10.328 -18.203 11.032 1.00 0.00 H ATOM 13 HN2 LYS A 1 11.533 -18.084 9.839 1.00 0.00 H ATOM 14 HN1 LYS A 1 11.721 -17.274 11.320 1.00 0.00 H ATOM 15 N GLU A 2 10.156 -20.744 10.688 1.00 34.39 N ATOM 16 CA GLU A 2 9.544 -21.920 10.099 1.00 25.78 C ATOM 17 C GLU A 2 9.555 -21.884 8.556 1.00 19.95 C ATOM 18 O GLU A 2 9.236 -20.853 7.954 1.00 24.10 O ATOM 19 CB GLU A 2 8.084 -22.022 10.598 1.00 27.64 C ATOM 20 CG GLU A 2 7.468 -23.330 10.567 1.00 28.95 C ATOM 21 CD GLU A 2 6.126 -23.352 11.274 1.00 25.41 C ATOM 22 OE1 GLU A 2 5.418 -22.315 11.300 1.00 24.15 O ATOM 23 OE2 GLU A 2 5.755 -24.411 11.803 1.00 24.78 O ATOM 24 HA GLU A 2 10.127 -22.789 10.405 1.00 0.00 H ATOM 25 HB2 GLU A 2 8.064 -21.674 11.631 1.00 0.00 H ATOM 26 HB3 GLU A 2 7.478 -21.359 9.981 1.00 0.00 H ATOM 27 HG2 GLU A 2 7.322 -23.624 9.528 1.00 0.00 H ATOM 28 HG3 GLU A 2 8.133 -24.043 11.055 1.00 0.00 H ATOM 29 H GLU A 2 9.538 -20.004 11.079 1.00 0.00 H ATOM 30 N THR A 3 9.876 -23.009 7.907 1.00 19.43 N ATOM 31 CA THR A 3 9.818 -23.067 6.451 1.00 22.45 C ATOM 32 C THR A 3 8.360 -23.146 6.023 1.00 18.90 C ATOM 33 O THR A 3 7.488 -23.535 6.808 1.00 17.45 O ATOM 34 CB THR A 3 10.508 -24.292 5.864 1.00 23.55 C ATOM 35 OG1 THR A 3 9.829 -25.468 6.308 1.00 23.06 O ATOM 36 CG2 THR A 3 12.016 -24.347 6.282 1.00 25.77 C ATOM 37 HA THR A 3 10.327 -22.174 6.088 1.00 0.00 H ATOM 38 HB THR A 3 10.469 -24.231 4.776 1.00 0.00 H ATOM 39 HG1 THR A 3 10.274 -26.267 5.929 1.00 0.00 H ATOM 40 HG23 THR A 3 12.520 -23.444 5.937 1.00 0.00 H ATOM 41 HG21 THR A 3 12.089 -24.413 7.368 1.00 0.00 H ATOM 42 HG22 THR A 3 12.485 -25.222 5.831 1.00 0.00 H ATOM 43 H THR A 3 10.169 -23.849 8.445 1.00 0.00 H ATOM 44 N ALA A 4 8.087 -22.823 4.764 1.00 20.96 N ATOM 45 CA ALA A 4 6.716 -22.826 4.284 1.00 18.57 C ATOM 46 C ALA A 4 6.125 -24.238 4.294 1.00 17.21 C ATOM 47 O ALA A 4 4.922 -24.419 4.613 1.00 17.93 O ATOM 48 CB ALA A 4 6.648 -22.226 2.876 1.00 24.09 C ATOM 49 HA ALA A 4 6.120 -22.212 4.960 1.00 0.00 H ATOM 50 HB1 ALA A 4 7.016 -21.200 2.901 1.00 0.00 H ATOM 51 HB2 ALA A 4 7.265 -22.818 2.200 1.00 0.00 H ATOM 52 HB3 ALA A 4 5.615 -22.234 2.528 1.00 0.00 H ATOM 53 H ALA A 4 8.860 -22.566 4.117 1.00 0.00 H ATOM 54 N ALA A 5 6.943 -25.238 3.946 1.00 18.15 N ATOM 55 CA ALA A 5 6.465 -26.624 3.939 1.00 17.42 C ATOM 56 C ALA A 5 6.140 -27.091 5.356 1.00 16.21 C ATOM 57 O ALA A 5 5.124 -27.754 5.573 1.00 17.57 O ATOM 58 CB ALA A 5 7.472 -27.550 3.289 1.00 22.29 C ATOM 59 HA ALA A 5 5.550 -26.657 3.347 1.00 0.00 H ATOM 60 HB1 ALA A 5 7.641 -27.236 2.259 1.00 0.00 H ATOM 61 HB2 ALA A 5 8.411 -27.509 3.841 1.00 0.00 H ATOM 62 HB3 ALA A 5 7.086 -28.569 3.300 1.00 0.00 H ATOM 63 H ALA A 5 7.926 -25.030 3.678 1.00 0.00 H ATOM 64 N ALA A 6 6.972 -26.695 6.321 1.00 15.78 N ATOM 65 CA ALA A 6 6.744 -27.067 7.721 1.00 16.92 C ATOM 66 C ALA A 6 5.504 -26.414 8.282 1.00 15.48 C ATOM 67 O ALA A 6 4.783 -27.020 9.091 1.00 17.09 O ATOM 68 CB ALA A 6 7.946 -26.731 8.586 1.00 19.85 C ATOM 69 HA ALA A 6 6.595 -28.147 7.737 1.00 0.00 H ATOM 70 HB1 ALA A 6 8.818 -27.274 8.221 1.00 0.00 H ATOM 71 HB2 ALA A 6 8.138 -25.659 8.539 1.00 0.00 H ATOM 72 HB3 ALA A 6 7.742 -27.020 9.617 1.00 0.00 H ATOM 73 H ALA A 6 7.797 -26.112 6.076 1.00 0.00 H ATOM 74 N LYS A 7 5.289 -25.169 7.903 1.00 18.06 N ATOM 75 CA LYS A 7 4.111 -24.448 8.346 1.00 18.11 C ATOM 76 C LYS A 7 2.834 -25.112 7.833 1.00 15.00 C ATOM 77 O LYS A 7 1.838 -25.232 8.558 1.00 16.32 O ATOM 78 CB LYS A 7 4.193 -22.996 7.896 1.00 19.50 C ATOM 79 CG LYS A 7 3.056 -22.184 8.413 1.00 26.40 C ATOM 80 CD LYS A 7 3.304 -20.698 8.166 1.00 35.48 C ATOM 81 CE LYS A 7 2.160 -19.883 8.709 1.00 48.79 C ATOM 82 NZ LYS A 7 2.199 -18.430 8.282 1.00 59.21 N ATOM 83 HA LYS A 7 4.076 -24.474 9.435 1.00 0.00 H ATOM 84 HB2 LYS A 7 5.126 -22.567 8.261 1.00 0.00 H ATOM 85 HB3 LYS A 7 4.181 -22.964 6.807 1.00 0.00 H ATOM 86 HG2 LYS A 7 2.140 -22.484 7.904 1.00 0.00 H ATOM 87 HG3 LYS A 7 2.949 -22.357 9.484 1.00 0.00 H ATOM 88 HD2 LYS A 7 4.227 -20.399 8.663 1.00 0.00 H ATOM 89 HD3 LYS A 7 3.396 -20.521 7.094 1.00 0.00 H ATOM 90 HE2 LYS A 7 2.192 -19.924 9.798 1.00 0.00 H ATOM 91 HE3 LYS A 7 1.226 -20.321 8.358 1.00 0.00 H ATOM 92 HZ1 LYS A 7 3.081 -17.994 8.619 1.00 0.00 H ATOM 93 HZ2 LYS A 7 2.158 -18.374 7.244 1.00 0.00 H ATOM 94 HZ3 LYS A 7 1.385 -17.928 8.690 1.00 0.00 H ATOM 95 H LYS A 7 5.974 -24.698 7.278 1.00 0.00 H ATOM 96 N PHE A 8 2.858 -25.563 6.591 1.00 14.26 N ATOM 97 CA PHE A 8 1.714 -26.271 6.028 1.00 13.44 C ATOM 98 C PHE A 8 1.439 -27.535 6.815 1.00 13.46 C ATOM 99 O PHE A 8 0.290 -27.857 7.119 1.00 15.55 O ATOM 100 CB PHE A 8 1.932 -26.596 4.545 1.00 14.62 C ATOM 101 CG PHE A 8 0.820 -27.395 3.946 1.00 15.17 C ATOM 102 CD1 PHE A 8 0.763 -28.764 4.104 1.00 16.35 C ATOM 103 CD2 PHE A 8 -0.202 -26.761 3.234 1.00 17.96 C ATOM 104 CE1 PHE A 8 -0.290 -29.494 3.603 1.00 17.60 C ATOM 105 CE2 PHE A 8 -1.246 -27.486 2.706 1.00 19.50 C ATOM 106 CZ PHE A 8 -1.289 -28.861 2.878 1.00 19.20 C ATOM 107 HA PHE A 8 0.845 -25.617 6.099 1.00 0.00 H ATOM 108 HB2 PHE A 8 2.021 -25.659 3.995 1.00 0.00 H ATOM 109 HB3 PHE A 8 2.858 -27.163 4.447 1.00 0.00 H ATOM 110 HD2 PHE A 8 -0.172 -25.680 3.095 1.00 0.00 H ATOM 111 HE2 PHE A 8 -2.038 -26.980 2.154 1.00 0.00 H ATOM 112 HZ PHE A 8 -2.104 -29.442 2.446 1.00 0.00 H ATOM 113 HE1 PHE A 8 -0.339 -30.569 3.776 1.00 0.00 H ATOM 114 HD1 PHE A 8 1.566 -29.276 4.635 1.00 0.00 H ATOM 115 H PHE A 8 3.705 -25.411 6.007 1.00 0.00 H ATOM 116 N GLU A 9 2.491 -28.269 7.158 1.00 13.28 N ATOM 117 CA GLU A 9 2.304 -29.506 7.925 1.00 13.82 C ATOM 118 C GLU A 9 1.668 -29.206 9.265 1.00 15.22 C ATOM 119 O GLU A 9 0.697 -29.849 9.675 1.00 16.21 O ATOM 120 CB GLU A 9 3.659 -30.187 8.105 1.00 15.86 C ATOM 121 CG GLU A 9 4.198 -30.759 6.760 1.00 15.83 C ATOM 122 CD GLU A 9 5.683 -31.131 6.791 1.00 16.40 C ATOM 123 OE1 GLU A 9 6.123 -31.802 5.835 1.00 19.20 O ATOM 124 OE2 GLU A 9 6.375 -30.773 7.759 1.00 19.10 O ATOM 125 HA GLU A 9 1.635 -30.176 7.384 1.00 0.00 H ATOM 126 HB2 GLU A 9 4.372 -29.459 8.491 1.00 0.00 H ATOM 127 HB3 GLU A 9 3.553 -31.003 8.819 1.00 0.00 H ATOM 128 HG2 GLU A 9 3.626 -31.653 6.514 1.00 0.00 H ATOM 129 HG3 GLU A 9 4.049 -30.008 5.984 1.00 0.00 H ATOM 130 H GLU A 9 3.448 -27.967 6.883 1.00 0.00 H ATOM 131 N ARG A 10 2.191 -28.196 9.948 1.00 14.29 N ATOM 132 CA ARG A 10 1.729 -27.898 11.275 1.00 15.86 C ATOM 133 C ARG A 10 0.279 -27.425 11.240 1.00 14.49 C ATOM 134 O ARG A 10 -0.529 -27.819 12.090 1.00 15.90 O ATOM 135 CB ARG A 10 2.608 -26.840 11.928 1.00 16.45 C ATOM 136 CG ARG A 10 2.075 -26.415 13.297 1.00 18.58 C ATOM 137 CD ARG A 10 3.013 -25.445 13.986 1.00 20.70 C ATOM 138 NE ARG A 10 3.269 -24.240 13.206 1.00 19.86 N ATOM 139 CZ ARG A 10 2.509 -23.143 13.228 1.00 23.41 C ATOM 140 NH1 ARG A 10 1.408 -23.102 13.967 1.00 26.98 N ATOM 141 NH2 ARG A 10 2.846 -22.098 12.506 1.00 26.98 N ATOM 142 HA ARG A 10 1.788 -28.811 11.868 1.00 0.00 H ATOM 143 HB2 ARG A 10 3.613 -27.245 12.052 1.00 0.00 H ATOM 144 HB3 ARG A 10 2.647 -25.965 11.279 1.00 0.00 H ATOM 145 HG2 ARG A 10 1.105 -25.936 13.166 1.00 0.00 H ATOM 146 HG3 ARG A 10 1.960 -27.300 13.922 1.00 0.00 H ATOM 147 HD2 ARG A 10 3.962 -25.950 14.166 1.00 0.00 H ATOM 148 HD3 ARG A 10 2.571 -25.154 14.939 1.00 0.00 H ATOM 149 HE ARG A 10 4.105 -24.235 12.587 1.00 0.00 H ATOM 150 HH12 ARG A 10 0.821 -22.243 13.979 1.00 0.00 H ATOM 151 HH11 ARG A 10 1.132 -23.928 14.535 1.00 0.00 H ATOM 152 HH22 ARG A 10 2.255 -21.242 12.522 1.00 0.00 H ATOM 153 HH21 ARG A 10 3.704 -22.127 11.919 1.00 0.00 H ATOM 154 H ARG A 10 2.941 -27.616 9.520 1.00 0.00 H ATOM 155 N GLN A 11 -0.057 -26.569 10.286 1.00 16.04 N ATOM 156 CA GLN A 11 -1.414 -26.037 10.242 1.00 18.02 C ATOM 157 C GLN A 11 -2.443 -27.009 9.687 1.00 17.45 C ATOM 158 O GLN A 11 -3.601 -26.952 10.063 1.00 18.92 O ATOM 159 CB GLN A 11 -1.462 -24.756 9.409 1.00 20.69 C ATOM 160 CG GLN A 11 -0.618 -23.615 9.943 1.00 20.41 C ATOM 161 CD GLN A 11 -0.868 -22.330 9.171 1.00 23.19 C ATOM 162 OE1 GLN A 11 -1.157 -21.300 9.729 1.00 31.47 O ATOM 163 NE2 GLN A 11 -0.775 -22.416 7.869 1.00 26.39 N ATOM 164 HA GLN A 11 -1.677 -25.841 11.281 1.00 0.00 H ATOM 165 HB2 GLN A 11 -1.115 -24.993 8.403 1.00 0.00 H ATOM 166 HB3 GLN A 11 -2.498 -24.419 9.364 1.00 0.00 H ATOM 167 HG2 GLN A 11 -0.865 -23.452 10.992 1.00 0.00 H ATOM 168 HG3 GLN A 11 0.435 -23.882 9.856 1.00 0.00 H ATOM 169 HE22 GLN A 11 -0.523 -23.322 7.424 1.00 0.00 H ATOM 170 HE21 GLN A 11 -0.953 -21.579 7.279 1.00 0.00 H ATOM 171 H GLN A 11 0.642 -26.278 9.573 1.00 0.00 H ATOM 172 N HIS A 12 -2.064 -27.911 8.792 1.00 14.63 N ATOM 173 CA HIS A 12 -3.086 -28.617 8.042 1.00 14.41 C ATOM 174 C HIS A 12 -3.072 -30.137 8.110 1.00 15.73 C ATOM 175 O HIS A 12 -4.022 -30.745 7.651 1.00 17.95 O ATOM 176 CB HIS A 12 -3.011 -28.186 6.570 1.00 14.88 C ATOM 177 CG HIS A 12 -3.249 -26.729 6.358 1.00 14.74 C ATOM 178 ND1 HIS A 12 -4.456 -26.116 6.636 1.00 17.70 N ATOM 179 CD2 HIS A 12 -2.426 -25.753 5.925 1.00 15.43 C ATOM 180 CE1 HIS A 12 -4.363 -24.826 6.373 1.00 16.01 C ATOM 181 NE2 HIS A 12 -3.151 -24.583 5.921 1.00 17.79 N ATOM 182 HA HIS A 12 -4.019 -28.333 8.528 1.00 0.00 H ATOM 183 HB2 HIS A 12 -2.020 -28.432 6.189 1.00 0.00 H ATOM 184 HB3 HIS A 12 -3.762 -28.743 6.010 1.00 0.00 H ATOM 185 HD2 HIS A 12 -1.382 -25.869 5.633 1.00 0.00 H ATOM 186 HE1 HIS A 12 -5.154 -24.088 6.507 1.00 0.00 H ATOM 187 H HIS A 12 -1.056 -28.108 8.631 1.00 0.00 H ATOM 188 N MET A 13 -2.035 -30.774 8.648 1.00 15.25 N ATOM 189 CA MET A 13 -2.014 -32.236 8.625 1.00 15.14 C ATOM 190 C MET A 13 -2.441 -32.828 9.964 1.00 15.85 C ATOM 191 O MET A 13 -1.874 -32.509 10.999 1.00 17.99 O ATOM 192 CB MET A 13 -0.626 -32.766 8.319 1.00 19.93 C ATOM 193 CG MET A 13 -0.134 -32.465 6.934 1.00 18.61 C ATOM 194 SD MET A 13 -1.161 -33.122 5.600 1.00 19.66 S ATOM 195 CE MET A 13 -1.216 -34.835 6.074 1.00 25.78 C ATOM 196 HA MET A 13 -2.714 -32.532 7.844 1.00 0.00 H ATOM 197 HB2 MET A 13 0.071 -32.325 9.031 1.00 0.00 H ATOM 198 HB3 MET A 13 -0.639 -33.848 8.448 1.00 0.00 H ATOM 199 HG2 MET A 13 0.866 -32.887 6.831 1.00 0.00 H ATOM 200 HG3 MET A 13 -0.084 -31.382 6.821 1.00 0.00 H ATOM 201 HE1 MET A 13 -0.203 -35.238 6.095 1.00 0.00 H ATOM 202 HE2 MET A 13 -1.664 -34.923 7.064 1.00 0.00 H ATOM 203 HE3 MET A 13 -1.815 -35.391 5.353 1.00 0.00 H ATOM 204 H MET A 13 -1.252 -30.241 9.078 1.00 0.00 H ATOM 205 N ASP A 14 -3.390 -33.752 9.933 1.00 17.01 N ATOM 206 CA ASP A 14 -3.676 -34.559 11.083 1.00 20.32 C ATOM 207 C ASP A 14 -3.970 -35.986 10.633 1.00 18.12 C ATOM 208 O ASP A 14 -5.125 -36.380 10.500 1.00 19.95 O ATOM 209 CB ASP A 14 -4.844 -34.002 11.909 1.00 23.02 C ATOM 210 CG ASP A 14 -5.117 -34.851 13.127 1.00 22.70 C ATOM 211 OD1 ASP A 14 -6.167 -34.716 13.786 1.00 23.97 O ATOM 212 OD2 ASP A 14 -4.225 -35.683 13.426 1.00 22.77 O ATOM 213 HA ASP A 14 -2.800 -34.547 11.732 1.00 0.00 H ATOM 214 HB2 ASP A 14 -4.599 -32.990 12.231 1.00 0.00 H ATOM 215 HB3 ASP A 14 -5.738 -33.978 11.286 1.00 0.00 H ATOM 216 H ASP A 14 -3.937 -33.894 9.060 1.00 0.00 H ATOM 217 N SER A 15 -2.917 -36.770 10.436 1.00 17.17 N ATOM 218 CA SER A 15 -3.057 -38.128 9.941 1.00 21.28 C ATOM 219 C SER A 15 -3.335 -39.130 11.061 1.00 22.90 C ATOM 220 O SER A 15 -3.449 -40.330 10.781 1.00 25.67 O ATOM 221 CB SER A 15 -1.726 -38.563 9.295 1.00 20.21 C ATOM 222 OG SER A 15 -1.156 -37.562 8.462 1.00 16.47 O ATOM 223 HA SER A 15 -3.891 -38.125 9.239 1.00 0.00 H ATOM 224 HB2 SER A 15 -1.907 -39.454 8.693 1.00 0.00 H ATOM 225 HB3 SER A 15 -1.017 -38.800 10.088 1.00 0.00 H ATOM 226 HG SER A 15 -1.787 -37.344 7.731 1.00 0.00 H ATOM 227 H SER A 15 -1.966 -36.402 10.642 1.00 0.00 H ATOM 228 N SER A 16 -3.374 -38.664 12.317 1.00 22.13 N ATOM 229 CA SER A 16 -3.515 -39.562 13.480 1.00 26.06 C ATOM 230 C SER A 16 -4.952 -39.994 13.728 1.00 23.94 C ATOM 231 O SER A 16 -5.216 -40.949 14.465 1.00 27.70 O ATOM 232 CB SER A 16 -2.950 -38.897 14.748 1.00 31.04 C ATOM 233 OG SER A 16 -3.830 -37.902 15.276 1.00 34.36 O ATOM 234 HA SER A 16 -2.943 -40.459 13.244 1.00 0.00 H ATOM 235 HB2 SER A 16 -1.997 -38.428 14.504 1.00 0.00 H ATOM 236 HB3 SER A 16 -2.792 -39.664 15.506 1.00 0.00 H ATOM 237 HG SER A 16 -3.974 -37.196 14.597 1.00 0.00 H ATOM 238 H SER A 16 -3.303 -37.639 12.477 1.00 0.00 H ATOM 239 N THR A 17 -5.891 -39.287 13.103 1.00 26.79 N ATOM 240 CA THR A 17 -7.287 -39.654 13.183 1.00 30.08 C ATOM 241 C THR A 17 -7.848 -39.714 11.772 1.00 28.61 C ATOM 242 O THR A 17 -7.394 -38.993 10.895 1.00 28.92 O ATOM 243 CB THR A 17 -8.066 -38.616 13.981 1.00 32.99 C ATOM 244 OG1 THR A 17 -7.923 -37.337 13.356 1.00 26.40 O ATOM 245 CG2 THR A 17 -7.540 -38.535 15.415 1.00 50.03 C ATOM 246 HA THR A 17 -7.379 -40.620 13.679 1.00 0.00 H ATOM 247 HB THR A 17 -9.116 -38.908 14.006 1.00 0.00 H ATOM 248 HG1 THR A 17 -8.277 -37.381 12.432 1.00 0.00 H ATOM 249 HG23 THR A 17 -7.647 -39.508 15.895 1.00 0.00 H ATOM 250 HG21 THR A 17 -6.488 -38.250 15.399 1.00 0.00 H ATOM 251 HG22 THR A 17 -8.111 -37.790 15.969 1.00 0.00 H ATOM 252 H THR A 17 -5.615 -38.454 12.546 1.00 0.00 H ATOM 253 N SER A 18 -8.848 -40.553 11.552 1.00 28.77 N ATOM 254 CA SER A 18 -9.446 -40.669 10.225 1.00 29.50 C ATOM 255 C SER A 18 -10.530 -39.612 10.005 1.00 25.66 C ATOM 256 O SER A 18 -10.920 -39.369 8.880 1.00 25.89 O ATOM 257 CB SER A 18 -10.047 -42.055 10.035 1.00 35.93 C ATOM 258 OG SER A 18 -11.065 -42.252 10.977 1.00 42.63 O ATOM 259 HA SER A 18 -8.654 -40.509 9.494 1.00 0.00 H ATOM 260 HB2 SER A 18 -9.273 -42.810 10.172 1.00 0.00 H ATOM 261 HB3 SER A 18 -10.460 -42.138 9.030 1.00 0.00 H ATOM 262 HG SER A 18 -10.688 -42.176 11.889 1.00 0.00 H ATOM 263 H SER A 18 -9.212 -41.136 12.333 1.00 0.00 H ATOM 264 N ALA A 19 -11.003 -38.995 11.085 1.00 27.46 N ATOM 265 CA ALA A 19 -12.047 -37.971 11.017 1.00 32.45 C ATOM 266 C ALA A 19 -12.246 -37.330 12.389 1.00 30.78 C ATOM 267 O ALA A 19 -11.931 -37.938 13.429 1.00 32.35 O ATOM 268 CB ALA A 19 -13.345 -38.600 10.560 1.00 36.91 C ATOM 269 HA ALA A 19 -11.743 -37.202 10.307 1.00 0.00 H ATOM 270 HB1 ALA A 19 -13.205 -39.042 9.574 1.00 0.00 H ATOM 271 HB2 ALA A 19 -13.641 -39.374 11.268 1.00 0.00 H ATOM 272 HB3 ALA A 19 -14.120 -37.835 10.510 1.00 0.00 H ATOM 273 H ALA A 19 -10.615 -39.251 12.015 1.00 0.00 H ATOM 274 N ALA A 20 -12.761 -36.106 12.402 1.00 33.89 N ATOM 275 CA ALA A 20 -13.227 -35.476 13.637 1.00 38.78 C ATOM 276 C ALA A 20 -14.449 -36.213 14.156 1.00 50.16 C ATOM 277 O ALA A 20 -15.438 -36.373 13.445 1.00 52.83 O ATOM 278 CB ALA A 20 -13.554 -33.989 13.397 1.00 39.39 C ATOM 279 HA ALA A 20 -12.435 -35.531 14.384 1.00 0.00 H ATOM 280 HB1 ALA A 20 -12.658 -33.472 13.052 1.00 0.00 H ATOM 281 HB2 ALA A 20 -14.335 -33.907 12.641 1.00 0.00 H ATOM 282 HB3 ALA A 20 -13.899 -33.539 14.328 1.00 0.00 H ATOM 283 H ALA A 20 -12.835 -35.580 11.508 1.00 0.00 H ATOM 284 N SER A 21 -14.383 -36.651 15.406 1.00 59.84 N ATOM 285 CA SER A 21 -15.469 -37.441 15.987 1.00 67.42 C ATOM 286 C SER A 21 -16.143 -36.697 17.131 1.00 60.44 C ATOM 287 O SER A 21 -16.930 -37.273 17.883 1.00 61.60 O ATOM 288 CB SER A 21 -14.937 -38.791 16.484 1.00 78.19 C ATOM 289 OG SER A 21 -14.401 -39.564 15.413 1.00 80.01 O ATOM 290 HA SER A 21 -16.211 -37.612 15.207 1.00 0.00 H ATOM 291 HB2 SER A 21 -15.753 -39.345 16.948 1.00 0.00 H ATOM 292 HB3 SER A 21 -14.154 -38.614 17.221 1.00 0.00 H ATOM 293 HG SER A 21 -13.656 -39.068 14.990 1.00 0.00 H ATOM 294 H SER A 21 -13.546 -36.430 15.982 1.00 0.00 H ATOM 295 N SER A 22 -15.849 -35.407 17.240 1.00 54.07 N ATOM 296 CA SER A 22 -16.238 -34.626 18.403 1.00 44.76 C ATOM 297 C SER A 22 -16.420 -33.172 18.014 1.00 34.23 C ATOM 298 O SER A 22 -15.601 -32.623 17.262 1.00 29.86 O ATOM 299 CB SER A 22 -15.136 -34.739 19.462 1.00 48.99 C ATOM 300 OG SER A 22 -15.134 -33.633 20.341 1.00 48.34 O ATOM 301 HA SER A 22 -17.180 -35.004 18.800 1.00 0.00 H ATOM 302 HB2 SER A 22 -14.170 -34.793 18.961 1.00 0.00 H ATOM 303 HB3 SER A 22 -15.295 -35.649 20.041 1.00 0.00 H ATOM 304 HG SER A 22 -14.410 -33.744 21.007 1.00 0.00 H ATOM 305 H SER A 22 -15.325 -34.942 16.471 1.00 0.00 H ATOM 306 N SER A 23 -17.470 -32.539 18.535 1.00 30.59 N ATOM 307 CA SER A 23 -17.650 -31.099 18.315 1.00 31.12 C ATOM 308 C SER A 23 -16.527 -30.242 18.888 1.00 28.27 C ATOM 309 O SER A 23 -16.389 -29.079 18.509 1.00 27.51 O ATOM 310 CB SER A 23 -18.978 -30.633 18.895 1.00 39.96 C ATOM 311 OG SER A 23 -18.956 -30.737 20.296 1.00 41.20 O ATOM 312 HA SER A 23 -17.634 -30.965 17.233 1.00 0.00 H ATOM 313 HB2 SER A 23 -19.782 -31.254 18.500 1.00 0.00 H ATOM 314 HB3 SER A 23 -19.150 -29.594 18.613 1.00 0.00 H ATOM 315 HG SER A 23 -19.824 -30.432 20.662 1.00 0.00 H ATOM 316 H SER A 23 -18.165 -33.067 19.100 1.00 0.00 H ATOM 317 N ASN A 24 -15.712 -30.815 19.780 1.00 25.58 N ATOM 318 CA ASN A 24 -14.604 -30.069 20.375 1.00 27.47 C ATOM 319 C ASN A 24 -13.271 -30.230 19.656 1.00 24.07 C ATOM 320 O ASN A 24 -12.279 -29.634 20.086 1.00 22.13 O ATOM 321 CB ASN A 24 -14.494 -30.393 21.872 1.00 32.82 C ATOM 322 CG ASN A 24 -15.647 -29.762 22.686 1.00 36.28 C ATOM 323 OD1 ASN A 24 -16.041 -28.617 22.441 1.00 38.72 O ATOM 324 ND2 ASN A 24 -16.189 -30.508 23.631 1.00 40.95 N ATOM 325 HA ASN A 24 -14.845 -29.013 20.253 1.00 0.00 H ATOM 326 HB2 ASN A 24 -14.522 -31.475 22.001 1.00 0.00 H ATOM 327 HB3 ASN A 24 -13.546 -30.008 22.247 1.00 0.00 H ATOM 328 HD22 ASN A 24 -15.829 -31.468 23.807 1.00 0.00 H ATOM 329 HD21 ASN A 24 -16.976 -30.136 24.200 1.00 0.00 H ATOM 330 H ASN A 24 -15.869 -31.806 20.055 1.00 0.00 H ATOM 331 N TYR A 25 -13.249 -31.012 18.570 1.00 22.60 N ATOM 332 CA TYR A 25 -12.015 -31.280 17.826 1.00 19.85 C ATOM 333 C TYR A 25 -11.285 -29.991 17.477 1.00 19.07 C ATOM 334 O TYR A 25 -10.087 -29.862 17.729 1.00 18.70 O ATOM 335 CB TYR A 25 -12.311 -32.083 16.546 1.00 21.55 C ATOM 336 CG TYR A 25 -11.101 -32.291 15.655 1.00 20.44 C ATOM 337 CD1 TYR A 25 -10.825 -31.407 14.623 1.00 19.06 C ATOM 338 CD2 TYR A 25 -10.253 -33.380 15.829 1.00 23.28 C ATOM 339 CE1 TYR A 25 -9.748 -31.581 13.809 1.00 19.83 C ATOM 340 CE2 TYR A 25 -9.157 -33.573 14.996 1.00 21.49 C ATOM 341 CZ TYR A 25 -8.916 -32.675 13.985 1.00 18.13 C ATOM 342 OH TYR A 25 -7.835 -32.805 13.147 1.00 22.13 O ATOM 343 HA TYR A 25 -11.368 -31.873 18.472 1.00 0.00 H ATOM 344 HB3 TYR A 25 -13.070 -31.550 15.974 1.00 0.00 H ATOM 345 HB2 TYR A 25 -12.696 -33.061 16.836 1.00 0.00 H ATOM 346 HD2 TYR A 25 -10.451 -34.092 16.630 1.00 0.00 H ATOM 347 HE2 TYR A 25 -8.496 -34.427 15.143 1.00 0.00 H ATOM 348 HE1 TYR A 25 -9.540 -30.860 13.019 1.00 0.00 H ATOM 349 HD1 TYR A 25 -11.485 -30.555 14.460 1.00 0.00 H ATOM 350 HH TYR A 25 -7.001 -32.773 13.679 1.00 0.00 H ATOM 351 H TYR A 25 -14.137 -31.444 18.243 1.00 0.00 H ATOM 352 N CYS A 26 -11.981 -29.034 16.881 1.00 18.48 N ATOM 353 CA CYS A 26 -11.289 -27.820 16.424 1.00 17.78 C ATOM 354 C CYS A 26 -10.742 -27.022 17.604 1.00 17.55 C ATOM 355 O CYS A 26 -9.632 -26.491 17.534 1.00 20.27 O ATOM 356 CB CYS A 26 -12.187 -26.962 15.536 1.00 15.11 C ATOM 357 SG CYS A 26 -12.454 -27.709 13.903 1.00 16.49 S ATOM 358 HA CYS A 26 -10.441 -28.134 15.815 1.00 0.00 H ATOM 359 HB2 CYS A 26 -11.720 -25.986 15.404 1.00 0.00 H ATOM 360 HB3 CYS A 26 -13.152 -26.838 16.028 1.00 0.00 H ATOM 361 H CYS A 26 -13.006 -29.140 16.738 1.00 0.00 H ATOM 362 N ASN A 27 -11.512 -26.891 18.676 1.00 17.55 N ATOM 363 CA ASN A 27 -10.998 -26.171 19.846 1.00 19.28 C ATOM 364 C ASN A 27 -9.683 -26.768 20.324 1.00 21.07 C ATOM 365 O ASN A 27 -8.734 -26.028 20.568 1.00 24.69 O ATOM 366 CB ASN A 27 -12.020 -26.129 20.964 1.00 23.17 C ATOM 367 CG ASN A 27 -13.215 -25.211 20.637 1.00 24.31 C ATOM 368 OD1 ASN A 27 -13.097 -24.255 19.864 1.00 23.84 O ATOM 369 ND2 ASN A 27 -14.380 -25.539 21.192 1.00 30.45 N ATOM 370 HA ASN A 27 -10.805 -25.143 19.540 1.00 0.00 H ATOM 371 HB2 ASN A 27 -12.392 -27.139 21.137 1.00 0.00 H ATOM 372 HB3 ASN A 27 -11.534 -25.762 21.868 1.00 0.00 H ATOM 373 HD22 ASN A 27 -14.438 -26.352 21.838 1.00 0.00 H ATOM 374 HD21 ASN A 27 -15.232 -24.982 20.979 1.00 0.00 H ATOM 375 H ASN A 27 -12.470 -27.295 18.687 1.00 0.00 H ATOM 376 N GLN A 28 -9.615 -28.097 20.398 1.00 21.33 N ATOM 377 CA GLN A 28 -8.411 -28.794 20.877 1.00 23.01 C ATOM 378 C GLN A 28 -7.254 -28.618 19.896 1.00 21.69 C ATOM 379 O GLN A 28 -6.109 -28.324 20.292 1.00 23.42 O ATOM 380 CB GLN A 28 -8.694 -30.291 21.052 1.00 32.29 C ATOM 381 CG GLN A 28 -9.783 -30.636 22.071 1.00 46.54 C ATOM 382 CD GLN A 28 -10.216 -32.126 22.006 1.00 56.48 C ATOM 383 OE1 GLN A 28 -9.750 -32.897 21.134 1.00 60.57 O ATOM 384 NE2 GLN A 28 -11.100 -32.534 22.934 1.00 65.10 N ATOM 385 HA GLN A 28 -8.135 -28.358 21.837 1.00 0.00 H ATOM 386 HB2 GLN A 28 -8.998 -30.692 20.085 1.00 0.00 H ATOM 387 HB3 GLN A 28 -7.770 -30.774 21.370 1.00 0.00 H ATOM 388 HG2 GLN A 28 -9.404 -30.426 23.071 1.00 0.00 H ATOM 389 HG3 GLN A 28 -10.654 -30.011 21.876 1.00 0.00 H ATOM 390 HE22 GLN A 28 -11.461 -31.861 23.639 1.00 0.00 H ATOM 391 HE21 GLN A 28 -11.422 -33.523 22.946 1.00 0.00 H ATOM 392 H GLN A 28 -10.440 -28.660 20.108 1.00 0.00 H ATOM 393 N MET A 29 -7.542 -28.835 18.612 1.00 19.01 N ATOM 394 CA MET A 29 -6.465 -28.842 17.594 1.00 19.20 C ATOM 395 C MET A 29 -5.899 -27.483 17.282 1.00 18.69 C ATOM 396 O MET A 29 -4.696 -27.325 17.104 1.00 20.04 O ATOM 397 CB MET A 29 -6.903 -29.533 16.308 1.00 20.33 C ATOM 398 CG MET A 29 -7.048 -31.011 16.430 1.00 22.99 C ATOM 399 SD MET A 29 -5.476 -31.881 16.708 1.00 29.06 S ATOM 400 CE MET A 29 -4.698 -31.590 15.185 1.00 31.45 C ATOM 401 HA MET A 29 -5.660 -29.415 18.054 1.00 0.00 H ATOM 402 HB2 MET A 29 -7.865 -29.118 16.007 1.00 0.00 H ATOM 403 HB3 MET A 29 -6.161 -29.324 15.537 1.00 0.00 H ATOM 404 HG2 MET A 29 -7.493 -31.390 15.510 1.00 0.00 H ATOM 405 HG3 MET A 29 -7.712 -31.224 17.268 1.00 0.00 H ATOM 406 HE1 MET A 29 -5.303 -32.013 14.383 1.00 0.00 H ATOM 407 HE2 MET A 29 -4.590 -30.516 15.033 1.00 0.00 H ATOM 408 HE3 MET A 29 -3.714 -32.059 15.186 1.00 0.00 H ATOM 409 H MET A 29 -8.527 -29.000 18.324 1.00 0.00 H ATOM 410 N MET A 30 -6.768 -26.487 17.183 1.00 19.04 N ATOM 411 CA MET A 30 -6.310 -25.148 16.953 1.00 19.55 C ATOM 412 C MET A 30 -5.357 -24.722 18.053 1.00 21.48 C ATOM 413 O MET A 30 -4.372 -24.032 17.799 1.00 22.04 O ATOM 414 CB MET A 30 -7.505 -24.198 16.828 1.00 20.80 C ATOM 415 CG MET A 30 -8.390 -24.486 15.581 1.00 20.00 C ATOM 416 SD MET A 30 -7.522 -24.236 14.008 1.00 19.83 S ATOM 417 CE MET A 30 -7.441 -22.470 13.933 1.00 19.68 C ATOM 418 HA MET A 30 -5.759 -25.110 16.013 1.00 0.00 H ATOM 419 HB2 MET A 30 -8.122 -24.297 17.721 1.00 0.00 H ATOM 420 HB3 MET A 30 -7.130 -23.177 16.759 1.00 0.00 H ATOM 421 HG2 MET A 30 -9.253 -23.821 15.609 1.00 0.00 H ATOM 422 HG3 MET A 30 -8.728 -25.521 15.629 1.00 0.00 H ATOM 423 HE1 MET A 30 -8.451 -22.061 13.940 1.00 0.00 H ATOM 424 HE2 MET A 30 -6.890 -22.096 14.796 1.00 0.00 H ATOM 425 HE3 MET A 30 -6.932 -22.169 13.017 1.00 0.00 H ATOM 426 H MET A 30 -7.786 -26.678 17.273 1.00 0.00 H ATOM 427 N LYS A 31 -5.642 -25.107 19.289 1.00 21.41 N ATOM 428 CA LYS A 31 -4.767 -24.743 20.372 1.00 26.28 C ATOM 429 C LYS A 31 -3.464 -25.545 20.331 1.00 25.12 C ATOM 430 O LYS A 31 -2.368 -24.979 20.515 1.00 27.89 O ATOM 431 CB LYS A 31 -5.520 -24.951 21.695 1.00 33.11 C ATOM 432 CG LYS A 31 -4.706 -24.631 22.933 1.00 48.98 C ATOM 433 CD LYS A 31 -5.587 -24.657 24.192 1.00 60.78 C ATOM 434 CE LYS A 31 -4.769 -24.350 25.463 1.00 70.37 C ATOM 435 NZ LYS A 31 -4.213 -22.959 25.466 1.00 79.28 N ATOM 436 HA LYS A 31 -4.483 -23.695 20.278 1.00 0.00 H ATOM 437 HB2 LYS A 31 -6.402 -24.310 21.691 1.00 0.00 H ATOM 438 HB3 LYS A 31 -5.831 -25.994 21.751 1.00 0.00 H ATOM 439 HG2 LYS A 31 -3.911 -25.369 23.038 1.00 0.00 H ATOM 440 HG3 LYS A 31 -4.267 -23.639 22.825 1.00 0.00 H ATOM 441 HD2 LYS A 31 -6.374 -23.910 24.089 1.00 0.00 H ATOM 442 HD3 LYS A 31 -6.036 -25.645 24.290 1.00 0.00 H ATOM 443 HE2 LYS A 31 -3.942 -25.057 25.526 1.00 0.00 H ATOM 444 HE3 LYS A 31 -5.415 -24.470 26.332 1.00 0.00 H ATOM 445 HZ1 LYS A 31 -3.587 -22.835 24.644 1.00 0.00 H ATOM 446 HZ2 LYS A 31 -4.994 -22.275 25.415 1.00 0.00 H ATOM 447 HZ3 LYS A 31 -3.673 -22.805 26.341 1.00 0.00 H ATOM 448 H LYS A 31 -6.496 -25.671 19.476 1.00 0.00 H ATOM 449 N SER A 32 -3.553 -26.854 20.081 1.00 22.78 N ATOM 450 CA SER A 32 -2.340 -27.683 20.184 1.00 24.41 C ATOM 451 C SER A 32 -1.347 -27.409 19.081 1.00 21.59 C ATOM 452 O SER A 32 -0.139 -27.605 19.280 1.00 24.80 O ATOM 453 CB SER A 32 -2.650 -29.155 20.253 1.00 25.95 C ATOM 454 OG SER A 32 -3.422 -29.534 19.163 1.00 26.73 O ATOM 455 HA SER A 32 -1.876 -27.392 21.127 1.00 0.00 H ATOM 456 HB2 SER A 32 -3.197 -29.365 21.172 1.00 0.00 H ATOM 457 HB3 SER A 32 -1.718 -29.720 20.248 1.00 0.00 H ATOM 458 HG SER A 32 -3.619 -30.503 19.220 1.00 0.00 H ATOM 459 H SER A 32 -4.464 -27.281 19.818 1.00 0.00 H ATOM 460 N ARG A 33 -1.838 -26.989 17.917 1.00 22.22 N ATOM 461 CA ARG A 33 -0.967 -26.654 16.807 1.00 19.35 C ATOM 462 C ARG A 33 -0.553 -25.196 16.837 1.00 20.89 C ATOM 463 O ARG A 33 0.022 -24.680 15.872 1.00 24.56 O ATOM 464 CB ARG A 33 -1.655 -27.009 15.486 1.00 19.76 C ATOM 465 CG ARG A 33 -1.892 -28.493 15.279 1.00 20.21 C ATOM 466 CD ARG A 33 -0.592 -29.252 15.290 1.00 20.76 C ATOM 467 NE ARG A 33 -0.865 -30.661 15.076 1.00 18.63 N ATOM 468 CZ ARG A 33 -0.992 -31.238 13.883 1.00 19.44 C ATOM 469 NH1 ARG A 33 -0.861 -30.523 12.764 1.00 17.62 N ATOM 470 NH2 ARG A 33 -1.255 -32.536 13.825 1.00 19.34 N ATOM 471 HA ARG A 33 -0.053 -27.241 16.898 1.00 0.00 H ATOM 472 HB2 ARG A 33 -2.620 -26.503 15.457 1.00 0.00 H ATOM 473 HB3 ARG A 33 -1.031 -26.646 14.669 1.00 0.00 H ATOM 474 HG2 ARG A 33 -2.531 -28.868 16.079 1.00 0.00 H ATOM 475 HG3 ARG A 33 -2.386 -28.645 14.319 1.00 0.00 H ATOM 476 HD2 ARG A 33 -0.098 -29.117 16.252 1.00 0.00 H ATOM 477 HD3 ARG A 33 0.055 -28.880 14.496 1.00 0.00 H ATOM 478 HE ARG A 33 -0.969 -31.265 15.917 1.00 0.00 H ATOM 479 HH12 ARG A 33 -0.962 -30.984 11.837 1.00 0.00 H ATOM 480 HH11 ARG A 33 -0.658 -29.505 12.818 1.00 0.00 H ATOM 481 HH22 ARG A 33 -1.358 -33.005 12.902 1.00 0.00 H ATOM 482 HH21 ARG A 33 -1.359 -33.085 14.702 1.00 0.00 H ATOM 483 H ARG A 33 -2.868 -26.899 17.801 1.00 0.00 H ATOM 484 N ASN A 34 -0.840 -24.542 17.959 1.00 20.39 N ATOM 485 CA ASN A 34 -0.403 -23.184 18.215 1.00 25.28 C ATOM 486 C ASN A 34 -0.955 -22.158 17.230 1.00 26.86 C ATOM 487 O ASN A 34 -0.256 -21.224 16.854 1.00 27.73 O ATOM 488 CB ASN A 34 1.129 -23.148 18.250 1.00 34.29 C ATOM 489 CG ASN A 34 1.681 -23.872 19.479 1.00 36.87 C ATOM 490 OD1 ASN A 34 1.016 -23.915 20.515 1.00 39.32 O ATOM 491 ND2 ASN A 34 2.866 -24.452 19.366 1.00 41.60 N ATOM 492 HA ASN A 34 -0.810 -22.892 19.183 1.00 0.00 H ATOM 493 HB2 ASN A 34 1.515 -23.630 17.352 1.00 0.00 H ATOM 494 HB3 ASN A 34 1.458 -22.109 18.273 1.00 0.00 H ATOM 495 HD22 ASN A 34 3.392 -24.390 18.471 1.00 0.00 H ATOM 496 HD21 ASN A 34 3.270 -24.970 20.172 1.00 0.00 H ATOM 497 H ASN A 34 -1.404 -25.027 18.686 1.00 0.00 H ATOM 498 N LEU A 35 -2.213 -22.346 16.823 1.00 27.74 N ATOM 499 CA LEU A 35 -2.897 -21.422 15.916 1.00 29.87 C ATOM 500 C LEU A 35 -3.772 -20.422 16.654 1.00 31.05 C ATOM 501 O LEU A 35 -4.478 -19.623 16.032 1.00 33.54 O ATOM 502 CB LEU A 35 -3.747 -22.224 14.918 1.00 29.57 C ATOM 503 CG LEU A 35 -2.875 -23.176 14.107 1.00 32.11 C ATOM 504 CD1 LEU A 35 -3.699 -24.055 13.262 1.00 35.76 C ATOM 505 CD2 LEU A 35 -1.890 -22.349 13.287 1.00 37.24 C ATOM 506 HA LEU A 35 -2.133 -20.850 15.390 1.00 0.00 H ATOM 507 HB2 LEU A 35 -4.493 -22.801 15.466 1.00 0.00 H ATOM 508 HB3 LEU A 35 -4.249 -21.534 14.240 1.00 0.00 H ATOM 509 HG LEU A 35 -2.315 -23.831 14.774 1.00 0.00 H ATOM 510 HD21 LEU A 35 -2.441 -21.687 12.619 1.00 0.00 H ATOM 511 HD22 LEU A 35 -1.269 -21.755 13.958 1.00 0.00 H ATOM 512 HD23 LEU A 35 -1.258 -23.016 12.700 1.00 0.00 H ATOM 513 HD11 LEU A 35 -4.366 -24.642 13.893 1.00 0.00 H ATOM 514 HD12 LEU A 35 -4.288 -23.448 12.575 1.00 0.00 H ATOM 515 HD13 LEU A 35 -3.051 -24.723 12.695 1.00 0.00 H ATOM 516 H LEU A 35 -2.728 -23.183 17.164 1.00 0.00 H ATOM 517 N THR A 36 -3.747 -20.470 17.976 1.00 32.11 N ATOM 518 CA THR A 36 -4.483 -19.485 18.789 1.00 34.83 C ATOM 519 C THR A 36 -3.533 -18.704 19.703 1.00 42.13 C ATOM 520 O THR A 36 -3.977 -17.981 20.596 1.00 41.41 O ATOM 521 CB THR A 36 -5.579 -20.162 19.663 1.00 36.28 C ATOM 522 OG1 THR A 36 -4.959 -20.968 20.662 1.00 34.19 O ATOM 523 CG2 THR A 36 -6.537 -21.052 18.843 1.00 42.11 C ATOM 524 HA THR A 36 -4.962 -18.800 18.089 1.00 0.00 H ATOM 525 HB THR A 36 -6.167 -19.359 20.108 1.00 0.00 H ATOM 526 HG1 THR A 36 -4.406 -21.664 20.226 1.00 0.00 H ATOM 527 HG23 THR A 36 -7.020 -20.450 18.073 1.00 0.00 H ATOM 528 HG21 THR A 36 -5.971 -21.857 18.375 1.00 0.00 H ATOM 529 HG22 THR A 36 -7.294 -21.475 19.504 1.00 0.00 H ATOM 530 H THR A 36 -3.198 -21.216 18.450 1.00 0.00 H ATOM 531 N LYS A 37 -2.227 -18.815 19.475 1.00 49.19 N ATOM 532 CA LYS A 37 -1.271 -18.207 20.403 1.00 55.92 C ATOM 533 C LYS A 37 -1.359 -16.679 20.428 1.00 57.53 C ATOM 534 O LYS A 37 -1.460 -16.087 21.501 1.00 59.18 O ATOM 535 CB LYS A 37 0.177 -18.684 20.165 1.00 57.21 C ATOM 536 CG LYS A 37 0.595 -19.817 21.127 1.00 75.40 C ATOM 537 CD LYS A 37 2.113 -20.069 21.171 1.00 86.57 C ATOM 538 CE LYS A 37 2.451 -21.266 22.087 1.00 92.80 C ATOM 539 NZ LYS A 37 3.911 -21.666 22.103 1.00 75.45 N ATOM 540 HA LYS A 37 -1.564 -18.558 21.392 1.00 0.00 H ATOM 541 HB2 LYS A 37 0.261 -19.047 19.141 1.00 0.00 H ATOM 542 HB3 LYS A 37 0.851 -17.839 20.307 1.00 0.00 H ATOM 543 HG2 LYS A 37 0.261 -19.556 22.131 1.00 0.00 H ATOM 544 HG3 LYS A 37 0.103 -20.736 20.809 1.00 0.00 H ATOM 545 HD2 LYS A 37 2.469 -20.280 20.163 1.00 0.00 H ATOM 546 HD3 LYS A 37 2.611 -19.177 21.551 1.00 0.00 H ATOM 547 HE2 LYS A 37 1.868 -22.124 21.752 1.00 0.00 H ATOM 548 HE3 LYS A 37 2.160 -21.006 23.105 1.00 0.00 H ATOM 549 HZ1 LYS A 37 4.207 -21.932 21.142 1.00 0.00 H ATOM 550 HZ2 LYS A 37 4.485 -20.865 22.434 1.00 0.00 H ATOM 551 HZ3 LYS A 37 4.041 -22.475 22.743 1.00 0.00 H ATOM 552 H LYS A 37 -1.886 -19.332 18.640 1.00 0.00 H ATOM 553 N ASP A 38 -1.337 -16.014 19.283 1.00 62.88 N ATOM 554 CA ASP A 38 -1.325 -14.547 19.334 1.00 69.07 C ATOM 555 C ASP A 38 -2.638 -13.882 18.871 1.00 62.91 C ATOM 556 O ASP A 38 -2.912 -12.724 19.186 1.00 61.22 O ATOM 557 CB ASP A 38 -0.117 -14.025 18.566 1.00 79.21 C ATOM 558 CG ASP A 38 1.184 -14.316 19.292 1.00 77.67 C ATOM 559 OD1 ASP A 38 1.285 -13.951 20.490 1.00 76.70 O ATOM 560 OD2 ASP A 38 2.093 -14.921 18.677 1.00 79.19 O ATOM 561 HA ASP A 38 -1.242 -14.265 20.383 1.00 0.00 H ATOM 562 HB2 ASP A 38 -0.089 -14.502 17.586 1.00 0.00 H ATOM 563 HB3 ASP A 38 -0.218 -12.947 18.441 1.00 0.00 H ATOM 564 H ASP A 38 -1.328 -16.517 18.373 1.00 0.00 H ATOM 565 N ARG A 39 -3.444 -14.632 18.138 1.00 60.26 N ATOM 566 CA ARG A 39 -4.777 -14.206 17.752 1.00 60.33 C ATOM 567 C ARG A 39 -5.554 -15.492 17.503 1.00 49.40 C ATOM 568 O ARG A 39 -4.964 -16.576 17.515 1.00 46.70 O ATOM 569 CB ARG A 39 -4.728 -13.353 16.484 1.00 75.45 C ATOM 570 CG ARG A 39 -4.627 -14.157 15.186 1.00 90.46 C ATOM 571 CD ARG A 39 -4.347 -13.264 13.984 1.00 99.94 C ATOM 572 NE ARG A 39 -4.802 -13.840 12.717 1.00102.38 N ATOM 573 CZ ARG A 39 -4.312 -14.947 12.159 1.00105.03 C ATOM 574 NH1 ARG A 39 -3.357 -15.648 12.757 1.00116.20 N ATOM 575 NH2 ARG A 39 -4.790 -15.364 10.998 1.00115.51 N ATOM 576 HA ARG A 39 -5.243 -13.592 18.522 1.00 0.00 H ATOM 577 HB2 ARG A 39 -5.635 -12.750 16.443 1.00 0.00 H ATOM 578 HB3 ARG A 39 -3.860 -12.697 16.547 1.00 0.00 H ATOM 579 HG2 ARG A 39 -3.819 -14.882 15.282 1.00 0.00 H ATOM 580 HG3 ARG A 39 -5.568 -14.683 15.023 1.00 0.00 H ATOM 581 HD2 ARG A 39 -3.272 -13.095 13.921 1.00 0.00 H ATOM 582 HD3 ARG A 39 -4.856 -12.312 14.134 1.00 0.00 H ATOM 583 HE ARG A 39 -5.567 -13.347 12.213 1.00 0.00 H ATOM 584 HH12 ARG A 39 -2.986 -16.509 12.308 1.00 0.00 H ATOM 585 HH11 ARG A 39 -2.980 -15.336 13.675 1.00 0.00 H ATOM 586 HH22 ARG A 39 -4.410 -16.227 10.559 1.00 0.00 H ATOM 587 HH21 ARG A 39 -5.545 -14.829 10.524 1.00 0.00 H ATOM 588 H ARG A 39 -3.109 -15.566 17.825 1.00 0.00 H ATOM 589 N CYS A 40 -6.863 -15.397 17.281 1.00 42.96 N ATOM 590 CA CYS A 40 -7.606 -16.568 16.847 1.00 35.85 C ATOM 591 C CYS A 40 -7.575 -16.661 15.338 1.00 30.60 C ATOM 592 O CYS A 40 -8.206 -15.847 14.665 1.00 33.15 O ATOM 593 CB CYS A 40 -9.073 -16.500 17.279 1.00 36.88 C ATOM 594 SG CYS A 40 -9.348 -16.289 19.050 1.00 32.06 S ATOM 595 HA CYS A 40 -7.136 -17.437 17.307 1.00 0.00 H ATOM 596 HB2 CYS A 40 -9.558 -17.426 16.971 1.00 0.00 H ATOM 597 HB3 CYS A 40 -9.537 -15.659 16.764 1.00 0.00 H ATOM 598 H CYS A 40 -7.352 -14.489 17.417 1.00 0.00 H ATOM 599 N LYS A 41 -6.879 -17.652 14.791 1.00 26.67 N ATOM 600 CA LYS A 41 -6.907 -17.832 13.336 1.00 24.72 C ATOM 601 C LYS A 41 -8.346 -18.100 12.937 1.00 22.15 C ATOM 602 O LYS A 41 -8.962 -19.020 13.467 1.00 24.11 O ATOM 603 CB LYS A 41 -6.002 -18.967 12.872 1.00 26.77 C ATOM 604 CG LYS A 41 -5.820 -18.942 11.376 1.00 28.64 C ATOM 605 CD LYS A 41 -4.815 -19.959 10.877 1.00 34.94 C ATOM 606 CE LYS A 41 -4.719 -19.894 9.342 1.00 42.23 C ATOM 607 NZ LYS A 41 -4.625 -21.236 8.676 1.00 48.35 N ATOM 608 HA LYS A 41 -6.528 -16.930 12.856 1.00 0.00 H ATOM 609 HB2 LYS A 41 -5.028 -18.864 13.351 1.00 0.00 H ATOM 610 HB3 LYS A 41 -6.448 -19.919 13.160 1.00 0.00 H ATOM 611 HG2 LYS A 41 -6.782 -19.147 10.907 1.00 0.00 H ATOM 612 HG3 LYS A 41 -5.480 -17.948 11.085 1.00 0.00 H ATOM 613 HD2 LYS A 41 -3.838 -19.744 11.310 1.00 0.00 H ATOM 614 HD3 LYS A 41 -5.132 -20.958 11.177 1.00 0.00 H ATOM 615 HE2 LYS A 41 -3.832 -19.318 9.078 1.00 0.00 H ATOM 616 HE3 LYS A 41 -5.606 -19.386 8.965 1.00 0.00 H ATOM 617 HZ1 LYS A 41 -3.776 -21.731 9.016 1.00 0.00 H ATOM 618 HZ2 LYS A 41 -5.470 -21.796 8.907 1.00 0.00 H ATOM 619 HZ3 LYS A 41 -4.564 -21.107 7.646 1.00 0.00 H ATOM 620 H LYS A 41 -6.320 -18.294 15.389 1.00 0.00 H ATOM 621 N PRO A 42 -8.908 -17.292 12.018 1.00 23.10 N ATOM 622 CA PRO A 42 -10.363 -17.406 11.810 1.00 21.79 C ATOM 623 C PRO A 42 -10.832 -18.697 11.138 1.00 21.55 C ATOM 624 O PRO A 42 -11.909 -19.188 11.463 1.00 24.49 O ATOM 625 CB PRO A 42 -10.700 -16.245 10.877 1.00 26.87 C ATOM 626 CG PRO A 42 -9.500 -15.435 10.728 1.00 31.62 C ATOM 627 CD PRO A 42 -8.314 -16.185 11.258 1.00 27.16 C ATOM 628 HA PRO A 42 -10.855 -17.399 12.783 1.00 0.00 H ATOM 629 HD3 PRO A 42 -7.696 -16.561 10.442 1.00 0.00 H ATOM 630 HD2 PRO A 42 -7.710 -15.549 11.906 1.00 0.00 H ATOM 631 HG3 PRO A 42 -9.619 -14.505 11.284 1.00 0.00 H ATOM 632 HG2 PRO A 42 -9.344 -15.209 9.673 1.00 0.00 H ATOM 633 HB2 PRO A 42 -11.013 -16.628 9.906 1.00 0.00 H ATOM 634 HB3 PRO A 42 -11.503 -15.645 11.305 1.00 0.00 H ATOM 635 N VAL A 43 -10.047 -19.222 10.204 1.00 20.48 N ATOM 636 CA VAL A 43 -10.431 -20.416 9.455 1.00 19.45 C ATOM 637 C VAL A 43 -9.227 -21.292 9.239 1.00 17.70 C ATOM 638 O VAL A 43 -8.137 -20.804 8.949 1.00 18.64 O ATOM 639 CB VAL A 43 -10.968 -20.035 8.056 1.00 19.76 C ATOM 640 CG1 VAL A 43 -11.436 -21.257 7.280 1.00 22.10 C ATOM 641 CG2 VAL A 43 -12.077 -18.992 8.176 1.00 26.92 C ATOM 642 HA VAL A 43 -11.199 -20.933 10.030 1.00 0.00 H ATOM 643 HB VAL A 43 -10.147 -19.596 7.490 1.00 0.00 H ATOM 644 HG11 VAL A 43 -10.601 -21.946 7.151 1.00 0.00 H ATOM 645 HG12 VAL A 43 -12.235 -21.752 7.832 1.00 0.00 H ATOM 646 HG13 VAL A 43 -11.806 -20.946 6.303 1.00 0.00 H ATOM 647 HG21 VAL A 43 -12.894 -19.399 8.771 1.00 0.00 H ATOM 648 HG22 VAL A 43 -11.683 -18.099 8.661 1.00 0.00 H ATOM 649 HG23 VAL A 43 -12.443 -18.736 7.182 1.00 0.00 H ATOM 650 H VAL A 43 -9.133 -18.770 10.000 1.00 0.00 H ATOM 651 N ASN A 44 -9.417 -22.591 9.350 1.00 16.67 N ATOM 652 CA ASN A 44 -8.308 -23.530 9.122 1.00 16.11 C ATOM 653 C ASN A 44 -8.858 -24.934 8.846 1.00 14.71 C ATOM 654 O ASN A 44 -9.758 -25.392 9.565 1.00 18.46 O ATOM 655 CB ASN A 44 -7.405 -23.588 10.373 1.00 16.98 C ATOM 656 CG ASN A 44 -6.091 -24.309 10.102 1.00 20.96 C ATOM 657 OD1 ASN A 44 -5.280 -23.863 9.296 1.00 22.91 O ATOM 658 ND2 ASN A 44 -5.897 -25.434 10.756 1.00 23.41 N ATOM 659 HA ASN A 44 -7.731 -23.186 8.264 1.00 0.00 H ATOM 660 HB2 ASN A 44 -7.187 -22.570 10.696 1.00 0.00 H ATOM 661 HB3 ASN A 44 -7.937 -24.114 11.166 1.00 0.00 H ATOM 662 HD22 ASN A 44 -6.612 -25.774 11.430 1.00 0.00 H ATOM 663 HD21 ASN A 44 -5.028 -25.984 10.599 1.00 0.00 H ATOM 664 H ASN A 44 -10.358 -22.955 9.601 1.00 0.00 H ATOM 665 N THR A 45 -8.273 -25.637 7.890 1.00 14.94 N ATOM 666 CA THR A 45 -8.682 -26.971 7.500 1.00 13.85 C ATOM 667 C THR A 45 -7.597 -27.954 7.864 1.00 13.42 C ATOM 668 O THR A 45 -6.400 -27.730 7.596 1.00 16.28 O ATOM 669 CB THR A 45 -8.932 -27.019 5.979 1.00 15.55 C ATOM 670 OG1 THR A 45 -9.891 -26.011 5.632 1.00 19.49 O ATOM 671 CG2 THR A 45 -9.462 -28.398 5.542 1.00 20.19 C ATOM 672 HA THR A 45 -9.603 -27.232 8.022 1.00 0.00 H ATOM 673 HB THR A 45 -7.987 -26.840 5.467 1.00 0.00 H ATOM 674 HG1 THR A 45 -9.539 -25.121 5.885 1.00 0.00 H ATOM 675 HG23 THR A 45 -8.734 -29.166 5.805 1.00 0.00 H ATOM 676 HG21 THR A 45 -10.405 -28.601 6.049 1.00 0.00 H ATOM 677 HG22 THR A 45 -9.620 -28.400 4.464 1.00 0.00 H ATOM 678 H THR A 45 -7.471 -25.206 7.388 1.00 0.00 H ATOM 679 N PHE A 46 -8.004 -29.023 8.522 1.00 13.75 N ATOM 680 CA PHE A 46 -7.116 -30.147 8.786 1.00 15.07 C ATOM 681 C PHE A 46 -7.455 -31.291 7.828 1.00 16.65 C ATOM 682 O PHE A 46 -8.622 -31.567 7.552 1.00 17.55 O ATOM 683 CB PHE A 46 -7.247 -30.639 10.237 1.00 17.88 C ATOM 684 CG PHE A 46 -6.725 -29.685 11.250 1.00 17.94 C ATOM 685 CD1 PHE A 46 -5.380 -29.644 11.521 1.00 18.34 C ATOM 686 CD2 PHE A 46 -7.564 -28.807 11.907 1.00 18.05 C ATOM 687 CE1 PHE A 46 -4.856 -28.771 12.460 1.00 19.07 C ATOM 688 CE2 PHE A 46 -7.038 -27.889 12.838 1.00 18.62 C ATOM 689 CZ PHE A 46 -5.685 -27.895 13.117 1.00 20.64 C ATOM 690 HA PHE A 46 -6.089 -29.815 8.633 1.00 0.00 H ATOM 691 HB2 PHE A 46 -8.302 -30.816 10.445 1.00 0.00 H ATOM 692 HB3 PHE A 46 -6.697 -31.575 10.332 1.00 0.00 H ATOM 693 HD2 PHE A 46 -8.635 -28.824 11.705 1.00 0.00 H ATOM 694 HE2 PHE A 46 -7.696 -27.177 13.336 1.00 0.00 H ATOM 695 HZ PHE A 46 -5.276 -27.206 13.857 1.00 0.00 H ATOM 696 HE1 PHE A 46 -3.788 -28.779 12.677 1.00 0.00 H ATOM 697 HD1 PHE A 46 -4.708 -30.314 10.985 1.00 0.00 H ATOM 698 H PHE A 46 -8.986 -29.064 8.862 1.00 0.00 H ATOM 699 N VAL A 47 -6.425 -31.956 7.321 1.00 13.66 N ATOM 700 CA VAL A 47 -6.575 -33.082 6.393 1.00 13.93 C ATOM 701 C VAL A 47 -6.181 -34.381 7.085 1.00 14.47 C ATOM 702 O VAL A 47 -5.101 -34.475 7.643 1.00 17.18 O ATOM 703 CB VAL A 47 -5.698 -32.877 5.124 1.00 16.65 C ATOM 704 CG1 VAL A 47 -5.866 -34.056 4.131 1.00 18.43 C ATOM 705 CG2 VAL A 47 -6.038 -31.559 4.476 1.00 21.41 C ATOM 706 HA VAL A 47 -7.620 -33.135 6.086 1.00 0.00 H ATOM 707 HB VAL A 47 -4.650 -32.856 5.422 1.00 0.00 H ATOM 708 HG11 VAL A 47 -5.565 -34.984 4.617 1.00 0.00 H ATOM 709 HG12 VAL A 47 -6.910 -34.126 3.826 1.00 0.00 H ATOM 710 HG13 VAL A 47 -5.241 -33.883 3.255 1.00 0.00 H ATOM 711 HG21 VAL A 47 -7.090 -31.556 4.192 1.00 0.00 H ATOM 712 HG22 VAL A 47 -5.848 -30.749 5.181 1.00 0.00 H ATOM 713 HG23 VAL A 47 -5.420 -31.422 3.588 1.00 0.00 H ATOM 714 H VAL A 47 -5.465 -31.665 7.595 1.00 0.00 H ATOM 715 N HIS A 48 -7.074 -35.368 7.057 1.00 16.79 N ATOM 716 CA HIS A 48 -6.875 -36.653 7.715 1.00 16.27 C ATOM 717 C HIS A 48 -6.476 -37.739 6.720 1.00 18.25 C ATOM 718 O HIS A 48 -7.204 -38.734 6.505 1.00 21.93 O ATOM 719 CB HIS A 48 -8.150 -37.090 8.394 1.00 19.11 C ATOM 720 CG HIS A 48 -8.723 -36.061 9.315 1.00 19.44 C ATOM 721 ND1 HIS A 48 -8.202 -35.815 10.557 1.00 25.04 N ATOM 722 CD2 HIS A 48 -9.791 -35.236 9.190 1.00 17.79 C ATOM 723 CE1 HIS A 48 -8.909 -34.873 11.149 1.00 23.31 C ATOM 724 NE2 HIS A 48 -9.868 -34.497 10.340 1.00 18.60 N ATOM 725 HA HIS A 48 -6.074 -36.520 8.442 1.00 0.00 H ATOM 726 HB2 HIS A 48 -8.890 -37.315 7.626 1.00 0.00 H ATOM 727 HB3 HIS A 48 -7.942 -37.991 8.971 1.00 0.00 H ATOM 728 HD2 HIS A 48 -10.463 -35.173 8.334 1.00 0.00 H ATOM 729 HE1 HIS A 48 -8.726 -34.473 12.146 1.00 0.00 H ATOM 730 H HIS A 48 -7.962 -35.214 6.537 1.00 0.00 H ATOM 731 N GLU A 49 -5.360 -37.506 6.063 1.00 16.70 N ATOM 732 CA GLU A 49 -4.797 -38.469 5.136 1.00 19.84 C ATOM 733 C GLU A 49 -3.304 -38.514 5.461 1.00 16.83 C ATOM 734 O GLU A 49 -2.768 -37.640 6.160 1.00 17.58 O ATOM 735 CB GLU A 49 -5.023 -38.045 3.675 1.00 19.71 C ATOM 736 CG GLU A 49 -6.501 -37.856 3.244 1.00 22.06 C ATOM 737 CD GLU A 49 -7.309 -39.119 3.265 1.00 20.51 C ATOM 738 OE1 GLU A 49 -6.739 -40.246 3.261 1.00 21.87 O ATOM 739 OE2 GLU A 49 -8.545 -38.991 3.249 1.00 21.15 O ATOM 740 HA GLU A 49 -5.271 -39.445 5.241 1.00 0.00 H ATOM 741 HB2 GLU A 49 -4.506 -37.099 3.518 1.00 0.00 H ATOM 742 HB3 GLU A 49 -4.583 -38.809 3.034 1.00 0.00 H ATOM 743 HG2 GLU A 49 -6.967 -37.140 3.921 1.00 0.00 H ATOM 744 HG3 GLU A 49 -6.514 -37.457 2.230 1.00 0.00 H ATOM 745 H GLU A 49 -4.866 -36.603 6.213 1.00 0.00 H ATOM 746 N SER A 50 -2.603 -39.483 4.897 1.00 20.34 N ATOM 747 CA SER A 50 -1.178 -39.564 5.134 1.00 19.68 C ATOM 748 C SER A 50 -0.472 -38.345 4.487 1.00 18.74 C ATOM 749 O SER A 50 -0.951 -37.784 3.482 1.00 17.28 O ATOM 750 CB SER A 50 -0.629 -40.870 4.554 1.00 26.54 C ATOM 751 OG SER A 50 -0.652 -40.799 3.141 1.00 24.33 O ATOM 752 HA SER A 50 -0.987 -39.552 6.207 1.00 0.00 H ATOM 753 HB2 SER A 50 -1.246 -41.705 4.887 1.00 0.00 H ATOM 754 HB3 SER A 50 0.396 -41.018 4.895 1.00 0.00 H ATOM 755 HG SER A 50 -0.297 -41.643 2.764 1.00 0.00 H ATOM 756 H SER A 50 -3.073 -40.182 4.287 1.00 0.00 H ATOM 757 N LEU A 51 0.686 -37.967 5.015 1.00 18.66 N ATOM 758 CA LEU A 51 1.460 -36.883 4.438 1.00 18.63 C ATOM 759 C LEU A 51 1.809 -37.197 2.974 1.00 18.84 C ATOM 760 O LEU A 51 1.672 -36.333 2.111 1.00 19.22 O ATOM 761 CB LEU A 51 2.724 -36.621 5.267 1.00 22.41 C ATOM 762 CG LEU A 51 3.590 -35.461 4.808 1.00 26.98 C ATOM 763 CD1 LEU A 51 2.807 -34.147 4.820 1.00 32.29 C ATOM 764 CD2 LEU A 51 4.839 -35.364 5.700 1.00 32.06 C ATOM 765 HA LEU A 51 0.857 -35.975 4.455 1.00 0.00 H ATOM 766 HB2 LEU A 51 2.415 -36.422 6.293 1.00 0.00 H ATOM 767 HB3 LEU A 51 3.334 -37.524 5.241 1.00 0.00 H ATOM 768 HG LEU A 51 3.902 -35.644 3.780 1.00 0.00 H ATOM 769 HD21 LEU A 51 4.534 -35.202 6.734 1.00 0.00 H ATOM 770 HD22 LEU A 51 5.408 -36.291 5.629 1.00 0.00 H ATOM 771 HD23 LEU A 51 5.458 -34.531 5.367 1.00 0.00 H ATOM 772 HD11 LEU A 51 1.951 -34.229 4.150 1.00 0.00 H ATOM 773 HD12 LEU A 51 2.459 -33.942 5.832 1.00 0.00 H ATOM 774 HD13 LEU A 51 3.455 -33.336 4.486 1.00 0.00 H ATOM 775 H LEU A 51 1.046 -38.457 5.859 1.00 0.00 H ATOM 776 N ALA A 52 2.246 -38.423 2.693 1.00 19.29 N ATOM 777 CA ALA A 52 2.492 -38.840 1.302 1.00 22.11 C ATOM 778 C ALA A 52 1.327 -38.603 0.345 1.00 17.13 C ATOM 779 O ALA A 52 1.531 -38.157 -0.792 1.00 18.35 O ATOM 780 CB ALA A 52 2.904 -40.301 1.237 1.00 27.80 C ATOM 781 HA ALA A 52 3.304 -38.196 0.964 1.00 0.00 H ATOM 782 HB1 ALA A 52 3.818 -40.445 1.813 1.00 0.00 H ATOM 783 HB2 ALA A 52 2.109 -40.920 1.653 1.00 0.00 H ATOM 784 HB3 ALA A 52 3.079 -40.582 0.198 1.00 0.00 H ATOM 785 H ALA A 52 2.416 -39.096 3.467 1.00 0.00 H ATOM 786 N ASP A 53 0.113 -38.935 0.755 1.00 17.03 N ATOM 787 CA ASP A 53 -1.052 -38.755 -0.121 1.00 17.30 C ATOM 788 C ASP A 53 -1.326 -37.267 -0.389 1.00 17.43 C ATOM 789 O ASP A 53 -1.765 -36.883 -1.469 1.00 18.63 O ATOM 790 CB ASP A 53 -2.288 -39.430 0.485 1.00 19.53 C ATOM 791 CG ASP A 53 -2.341 -40.907 0.231 1.00 23.64 C ATOM 792 OD1 ASP A 53 -1.452 -41.461 -0.454 1.00 26.51 O ATOM 793 OD2 ASP A 53 -3.306 -41.522 0.713 1.00 28.62 O ATOM 794 HA ASP A 53 -0.828 -39.229 -1.077 1.00 0.00 H ATOM 795 HB2 ASP A 53 -2.280 -39.264 1.562 1.00 0.00 H ATOM 796 HB3 ASP A 53 -3.179 -38.972 0.054 1.00 0.00 H ATOM 797 H ASP A 53 -0.017 -39.328 1.709 1.00 0.00 H ATOM 798 N VAL A 54 -1.035 -36.411 0.578 1.00 16.78 N ATOM 799 CA VAL A 54 -1.282 -34.990 0.400 1.00 14.65 C ATOM 800 C VAL A 54 -0.181 -34.383 -0.472 1.00 13.09 C ATOM 801 O VAL A 54 -0.458 -33.565 -1.348 1.00 16.88 O ATOM 802 CB VAL A 54 -1.399 -34.293 1.754 1.00 16.54 C ATOM 803 CG1 VAL A 54 -1.480 -32.794 1.591 1.00 20.65 C ATOM 804 CG2 VAL A 54 -2.635 -34.830 2.491 1.00 17.34 C ATOM 805 HA VAL A 54 -2.232 -34.844 -0.113 1.00 0.00 H ATOM 806 HB VAL A 54 -0.506 -34.506 2.342 1.00 0.00 H ATOM 807 HG11 VAL A 54 -0.580 -32.435 1.091 1.00 0.00 H ATOM 808 HG12 VAL A 54 -2.355 -32.542 0.992 1.00 0.00 H ATOM 809 HG13 VAL A 54 -1.563 -32.327 2.572 1.00 0.00 H ATOM 810 HG21 VAL A 54 -3.526 -34.630 1.897 1.00 0.00 H ATOM 811 HG22 VAL A 54 -2.530 -35.905 2.639 1.00 0.00 H ATOM 812 HG23 VAL A 54 -2.723 -34.335 3.458 1.00 0.00 H ATOM 813 H VAL A 54 -0.627 -36.757 1.470 1.00 0.00 H ATOM 814 N GLN A 55 1.073 -34.784 -0.225 1.00 15.56 N ATOM 815 CA GLN A 55 2.169 -34.354 -1.075 1.00 15.27 C ATOM 816 C GLN A 55 1.961 -34.766 -2.530 1.00 15.26 C ATOM 817 O GLN A 55 2.341 -34.017 -3.421 1.00 16.94 O ATOM 818 CB GLN A 55 3.491 -34.932 -0.586 1.00 18.29 C ATOM 819 CG GLN A 55 3.952 -34.326 0.733 1.00 19.78 C ATOM 820 CD GLN A 55 5.183 -35.019 1.298 1.00 22.10 C ATOM 821 OE1 GLN A 55 5.428 -36.203 1.036 1.00 25.75 O ATOM 822 NE2 GLN A 55 5.943 -34.291 2.087 1.00 24.09 N ATOM 823 HA GLN A 55 2.196 -33.266 -1.021 1.00 0.00 H ATOM 824 HB2 GLN A 55 3.372 -36.007 -0.452 1.00 0.00 H ATOM 825 HB3 GLN A 55 4.254 -34.743 -1.341 1.00 0.00 H ATOM 826 HG2 GLN A 55 4.187 -33.274 0.571 1.00 0.00 H ATOM 827 HG3 GLN A 55 3.142 -34.408 1.457 1.00 0.00 H ATOM 828 HE22 GLN A 55 5.695 -33.299 2.277 1.00 0.00 H ATOM 829 HE21 GLN A 55 6.792 -34.707 2.521 1.00 0.00 H ATOM 830 H GLN A 55 1.264 -35.410 0.584 1.00 0.00 H ATOM 831 N ALA A 56 1.316 -35.913 -2.765 1.00 16.25 N ATOM 832 CA ALA A 56 1.093 -36.429 -4.108 1.00 17.61 C ATOM 833 C ALA A 56 0.116 -35.543 -4.899 1.00 16.16 C ATOM 834 O ALA A 56 0.103 -35.583 -6.124 1.00 17.67 O ATOM 835 CB ALA A 56 0.559 -37.862 -4.066 1.00 19.71 C ATOM 836 HA ALA A 56 2.058 -36.422 -4.614 1.00 0.00 H ATOM 837 HB1 ALA A 56 1.282 -38.503 -3.561 1.00 0.00 H ATOM 838 HB2 ALA A 56 -0.386 -37.880 -3.523 1.00 0.00 H ATOM 839 HB3 ALA A 56 0.402 -38.220 -5.084 1.00 0.00 H ATOM 840 H ALA A 56 0.959 -36.459 -1.955 1.00 0.00 H ATOM 841 N VAL A 57 -0.642 -34.685 -4.219 1.00 16.02 N ATOM 842 CA VAL A 57 -1.583 -33.794 -4.894 1.00 16.10 C ATOM 843 C VAL A 57 -0.828 -32.802 -5.812 1.00 13.95 C ATOM 844 O VAL A 57 -1.355 -32.354 -6.841 1.00 17.64 O ATOM 845 CB VAL A 57 -2.461 -33.103 -3.881 1.00 15.88 C ATOM 846 CG1 VAL A 57 -3.412 -32.082 -4.544 1.00 20.14 C ATOM 847 CG2 VAL A 57 -3.289 -34.173 -3.165 1.00 17.24 C ATOM 848 HA VAL A 57 -2.239 -34.378 -5.540 1.00 0.00 H ATOM 849 HB VAL A 57 -1.828 -32.556 -3.183 1.00 0.00 H ATOM 850 HG11 VAL A 57 -2.825 -31.323 -5.062 1.00 0.00 H ATOM 851 HG12 VAL A 57 -4.054 -32.597 -5.259 1.00 0.00 H ATOM 852 HG13 VAL A 57 -4.026 -31.608 -3.778 1.00 0.00 H ATOM 853 HG21 VAL A 57 -3.901 -34.705 -3.894 1.00 0.00 H ATOM 854 HG22 VAL A 57 -2.620 -34.876 -2.668 1.00 0.00 H ATOM 855 HG23 VAL A 57 -3.934 -33.697 -2.426 1.00 0.00 H ATOM 856 H VAL A 57 -0.562 -34.648 -3.183 1.00 0.00 H ATOM 857 N CYS A 58 0.432 -32.526 -5.488 1.00 16.16 N ATOM 858 CA CYS A 58 1.256 -31.644 -6.326 1.00 16.17 C ATOM 859 C CYS A 58 1.573 -32.202 -7.708 1.00 16.82 C ATOM 860 O CYS A 58 2.147 -31.509 -8.530 1.00 20.73 O ATOM 861 CB CYS A 58 2.547 -31.253 -5.624 1.00 17.98 C ATOM 862 SG CYS A 58 2.343 -30.346 -4.100 1.00 20.08 S ATOM 863 HA CYS A 58 0.638 -30.760 -6.482 1.00 0.00 H ATOM 864 HB2 CYS A 58 3.129 -30.636 -6.308 1.00 0.00 H ATOM 865 HB3 CYS A 58 3.099 -32.166 -5.401 1.00 0.00 H ATOM 866 H CYS A 58 0.841 -32.942 -4.627 1.00 0.00 H ATOM 867 N SER A 59 1.206 -33.459 -7.940 1.00 17.44 N ATOM 868 CA SER A 59 1.327 -34.064 -9.257 1.00 19.28 C ATOM 869 C SER A 59 -0.013 -34.398 -9.907 1.00 17.77 C ATOM 870 O SER A 59 -0.059 -35.144 -10.889 1.00 23.19 O ATOM 871 CB SER A 59 2.157 -35.333 -9.149 1.00 24.88 C ATOM 872 OG SER A 59 1.453 -36.310 -8.398 1.00 26.69 O ATOM 873 HA SER A 59 1.809 -33.324 -9.896 1.00 0.00 H ATOM 874 HB2 SER A 59 3.101 -35.107 -8.653 1.00 0.00 H ATOM 875 HB3 SER A 59 2.357 -35.720 -10.148 1.00 0.00 H ATOM 876 HG SER A 59 1.273 -35.960 -7.490 1.00 0.00 H ATOM 877 H SER A 59 0.821 -34.026 -7.157 1.00 0.00 H ATOM 878 N GLN A 60 -1.087 -33.853 -9.362 1.00 17.70 N ATOM 879 CA GLN A 60 -2.441 -34.128 -9.811 1.00 18.35 C ATOM 880 C GLN A 60 -2.987 -32.901 -10.554 1.00 18.20 C ATOM 881 O GLN A 60 -2.204 -32.149 -11.123 1.00 20.40 O ATOM 882 CB GLN A 60 -3.292 -34.517 -8.604 1.00 18.00 C ATOM 883 CG GLN A 60 -2.788 -35.875 -8.082 1.00 16.84 C ATOM 884 CD GLN A 60 -3.494 -36.439 -6.895 1.00 16.92 C ATOM 885 OE1 GLN A 60 -4.593 -36.072 -6.577 1.00 20.02 O ATOM 886 NE2 GLN A 60 -2.813 -37.319 -6.197 1.00 19.87 N ATOM 887 HA GLN A 60 -2.463 -34.963 -10.511 1.00 0.00 H ATOM 888 HB2 GLN A 60 -3.195 -33.762 -7.824 1.00 0.00 H ATOM 889 HB3 GLN A 60 -4.338 -34.599 -8.900 1.00 0.00 H ATOM 890 HG2 GLN A 60 -2.879 -36.596 -8.894 1.00 0.00 H ATOM 891 HG3 GLN A 60 -1.737 -35.758 -7.817 1.00 0.00 H ATOM 892 HE22 GLN A 60 -1.864 -37.608 -6.509 1.00 0.00 H ATOM 893 HE21 GLN A 60 -3.223 -37.726 -5.332 1.00 0.00 H ATOM 894 H GLN A 60 -0.956 -33.192 -8.570 1.00 0.00 H ATOM 895 N LYS A 61 -4.298 -32.697 -10.621 1.00 16.44 N ATOM 896 CA LYS A 61 -4.822 -31.700 -11.541 1.00 18.47 C ATOM 897 C LYS A 61 -4.445 -30.233 -11.331 1.00 16.73 C ATOM 898 O LYS A 61 -4.795 -29.609 -10.311 1.00 19.68 O ATOM 899 CB LYS A 61 -6.312 -31.827 -11.465 1.00 17.44 C ATOM 900 CG LYS A 61 -7.059 -31.068 -12.547 1.00 21.23 C ATOM 901 CD LYS A 61 -6.830 -31.729 -13.918 1.00 24.09 C ATOM 902 CE LYS A 61 -7.810 -31.189 -14.924 1.00 26.05 C ATOM 903 NZ LYS A 61 -7.826 -31.979 -16.185 1.00 25.96 N ATOM 904 HA LYS A 61 -4.366 -31.922 -12.506 1.00 0.00 H ATOM 905 HB2 LYS A 61 -6.570 -32.883 -11.548 1.00 0.00 H ATOM 906 HB3 LYS A 61 -6.638 -31.450 -10.496 1.00 0.00 H ATOM 907 HG2 LYS A 61 -8.125 -31.072 -12.319 1.00 0.00 H ATOM 908 HG3 LYS A 61 -6.699 -30.039 -12.579 1.00 0.00 H ATOM 909 HD2 LYS A 61 -5.815 -31.519 -14.255 1.00 0.00 H ATOM 910 HD3 LYS A 61 -6.965 -32.807 -13.826 1.00 0.00 H ATOM 911 HE2 LYS A 61 -7.539 -30.160 -15.159 1.00 0.00 H ATOM 912 HE3 LYS A 61 -8.808 -31.209 -14.486 1.00 0.00 H ATOM 913 HZ1 LYS A 61 -6.880 -31.960 -16.617 1.00 0.00 H ATOM 914 HZ2 LYS A 61 -8.092 -32.962 -15.974 1.00 0.00 H ATOM 915 HZ3 LYS A 61 -8.517 -31.565 -16.843 1.00 0.00 H ATOM 916 H LYS A 61 -4.945 -33.246 -10.020 1.00 0.00 H ATOM 917 N ASN A 62 -3.731 -29.663 -12.291 1.00 18.83 N ATOM 918 CA ASN A 62 -3.245 -28.299 -12.168 1.00 18.90 C ATOM 919 C ASN A 62 -4.391 -27.314 -12.450 1.00 18.68 C ATOM 920 O ASN A 62 -5.044 -27.415 -13.479 1.00 20.95 O ATOM 921 CB ASN A 62 -2.073 -28.100 -13.123 1.00 21.60 C ATOM 922 CG ASN A 62 -1.468 -26.690 -13.087 1.00 24.97 C ATOM 923 OD1 ASN A 62 -1.159 -26.126 -14.139 1.00 28.86 O ATOM 924 ND2 ASN A 62 -1.279 -26.129 -11.910 1.00 28.31 N ATOM 925 HA ASN A 62 -2.892 -28.109 -11.154 1.00 0.00 H ATOM 926 HB2 ASN A 62 -1.293 -28.814 -12.861 1.00 0.00 H ATOM 927 HB3 ASN A 62 -2.420 -28.298 -14.137 1.00 0.00 H ATOM 928 HD22 ASN A 62 -1.552 -26.635 -11.043 1.00 0.00 H ATOM 929 HD21 ASN A 62 -0.857 -25.181 -11.848 1.00 0.00 H ATOM 930 H ASN A 62 -3.514 -30.204 -13.152 1.00 0.00 H ATOM 931 N VAL A 63 -4.658 -26.409 -11.510 1.00 20.49 N ATOM 932 CA VAL A 63 -5.769 -25.452 -11.615 1.00 19.10 C ATOM 933 C VAL A 63 -5.303 -24.100 -11.086 1.00 18.53 C ATOM 934 O VAL A 63 -4.248 -24.017 -10.427 1.00 21.58 O ATOM 935 CB VAL A 63 -6.991 -25.897 -10.761 1.00 20.94 C ATOM 936 CG1 VAL A 63 -7.613 -27.195 -11.279 1.00 23.09 C ATOM 937 CG2 VAL A 63 -6.563 -26.048 -9.307 1.00 24.57 C ATOM 938 HA VAL A 63 -6.068 -25.398 -12.662 1.00 0.00 H ATOM 939 HB VAL A 63 -7.759 -25.127 -10.839 1.00 0.00 H ATOM 940 HG11 VAL A 63 -7.950 -27.051 -12.305 1.00 0.00 H ATOM 941 HG12 VAL A 63 -6.869 -27.991 -11.248 1.00 0.00 H ATOM 942 HG13 VAL A 63 -8.462 -27.465 -10.651 1.00 0.00 H ATOM 943 HG21 VAL A 63 -5.776 -26.799 -9.237 1.00 0.00 H ATOM 944 HG22 VAL A 63 -6.189 -25.093 -8.939 1.00 0.00 H ATOM 945 HG23 VAL A 63 -7.419 -26.360 -8.708 1.00 0.00 H ATOM 946 H VAL A 63 -4.054 -26.378 -10.664 1.00 0.00 H ATOM 947 N ALA A 64 -6.067 -23.040 -11.350 1.00 22.01 N ATOM 948 CA ALA A 64 -5.760 -21.728 -10.778 1.00 21.09 C ATOM 949 C ALA A 64 -6.097 -21.707 -9.300 1.00 22.06 C ATOM 950 O ALA A 64 -7.087 -22.298 -8.857 1.00 21.30 O ATOM 951 CB ALA A 64 -6.541 -20.636 -11.495 1.00 26.95 C ATOM 952 HA ALA A 64 -4.694 -21.542 -10.906 1.00 0.00 H ATOM 953 HB1 ALA A 64 -6.273 -20.633 -12.551 1.00 0.00 H ATOM 954 HB2 ALA A 64 -7.609 -20.827 -11.391 1.00 0.00 H ATOM 955 HB3 ALA A 64 -6.298 -19.669 -11.055 1.00 0.00 H ATOM 956 H ALA A 64 -6.894 -23.147 -11.972 1.00 0.00 H ATOM 957 N CYS A 65 -5.231 -21.043 -8.549 1.00 23.47 N ATOM 958 CA CYS A 65 -5.523 -20.631 -7.183 1.00 26.26 C ATOM 959 C CYS A 65 -6.517 -19.464 -7.173 1.00 26.11 C ATOM 960 O CYS A 65 -6.716 -18.789 -8.173 1.00 25.49 O ATOM 961 CB CYS A 65 -4.233 -20.211 -6.465 1.00 29.49 C ATOM 962 SG CYS A 65 -2.768 -21.329 -6.640 1.00 28.20 S ATOM 963 HA CYS A 65 -5.966 -21.479 -6.660 1.00 0.00 H ATOM 964 HB2 CYS A 65 -4.460 -20.131 -5.402 1.00 0.00 H ATOM 965 HB3 CYS A 65 -3.947 -19.232 -6.849 1.00 0.00 H ATOM 966 H CYS A 65 -4.302 -20.806 -8.952 1.00 0.00 H ATOM 967 N LYS A 66 -7.147 -19.248 -6.023 1.00 30.84 N ATOM 968 CA LYS A 66 -8.112 -18.166 -5.849 1.00 35.80 C ATOM 969 C LYS A 66 -7.488 -16.829 -6.233 1.00 33.86 C ATOM 970 O LYS A 66 -8.189 -15.907 -6.677 1.00 34.25 O ATOM 971 CB LYS A 66 -8.542 -18.102 -4.377 1.00 45.98 C ATOM 972 CG LYS A 66 -9.992 -18.479 -4.092 1.00 57.63 C ATOM 973 CD LYS A 66 -10.255 -18.544 -2.569 1.00 65.63 C ATOM 974 HA LYS A 66 -8.972 -18.360 -6.489 1.00 0.00 H ATOM 975 HB2 LYS A 66 -7.903 -18.780 -3.812 1.00 0.00 H ATOM 976 HB3 LYS A 66 -8.387 -17.082 -4.027 1.00 0.00 H ATOM 977 HG2 LYS A 66 -10.650 -17.732 -4.537 1.00 0.00 H ATOM 978 HG3 LYS A 66 -10.201 -19.454 -4.533 1.00 0.00 H ATOM 979 HD2 LYS A 66 -9.602 -19.293 -2.121 1.00 0.00 H ATOM 980 HD3 LYS A 66 -10.051 -17.570 -2.124 1.00 0.00 H ATOM 981 H LYS A 66 -6.945 -19.873 -5.217 1.00 0.00 H ATOM 982 N ASN A 67 -6.184 -16.705 -6.010 1.00 33.55 N ATOM 983 CA ASN A 67 -5.474 -15.460 -6.287 1.00 36.90 C ATOM 984 C ASN A 67 -4.947 -15.321 -7.708 1.00 35.69 C ATOM 985 O ASN A 67 -4.290 -14.323 -8.033 1.00 41.33 O ATOM 986 CB ASN A 67 -4.301 -15.268 -5.318 1.00 42.30 C ATOM 987 CG ASN A 67 -3.206 -16.296 -5.510 1.00 42.62 C ATOM 988 OD1 ASN A 67 -3.193 -17.038 -6.487 1.00 39.92 O ATOM 989 ND2 ASN A 67 -2.280 -16.355 -4.557 1.00 50.81 N ATOM 990 HA ASN A 67 -6.232 -14.688 -6.151 1.00 0.00 H ATOM 991 HB2 ASN A 67 -3.879 -14.276 -5.475 1.00 0.00 H ATOM 992 HB3 ASN A 67 -4.676 -15.345 -4.297 1.00 0.00 H ATOM 993 HD22 ASN A 67 -2.328 -15.707 -3.745 1.00 0.00 H ATOM 994 HD21 ASN A 67 -1.508 -17.049 -4.624 1.00 0.00 H ATOM 995 H ASN A 67 -5.656 -17.516 -5.628 1.00 0.00 H ATOM 996 N GLY A 68 -5.246 -16.269 -8.578 1.00 34.84 N ATOM 997 CA GLY A 68 -4.815 -16.163 -9.967 1.00 35.80 C ATOM 998 C GLY A 68 -3.491 -16.862 -10.272 1.00 34.94 C ATOM 999 O GLY A 68 -3.131 -17.040 -11.428 1.00 36.27 O ATOM 1000 HA3 GLY A 68 -4.707 -15.106 -10.211 1.00 0.00 H ATOM 1001 HA2 GLY A 68 -5.587 -16.603 -10.598 1.00 0.00 H ATOM 1002 H GLY A 68 -5.793 -17.098 -8.270 1.00 0.00 H ATOM 1003 N GLN A 69 -2.761 -17.275 -9.246 1.00 35.79 N ATOM 1004 CA GLN A 69 -1.520 -18.014 -9.469 1.00 35.69 C ATOM 1005 C GLN A 69 -1.861 -19.376 -10.067 1.00 33.05 C ATOM 1006 O GLN A 69 -2.991 -19.855 -9.887 1.00 33.71 O ATOM 1007 CB GLN A 69 -0.760 -18.196 -8.151 1.00 36.92 C ATOM 1008 CG GLN A 69 -0.039 -16.956 -7.687 1.00 68.32 C ATOM 1009 CD GLN A 69 0.880 -17.244 -6.518 1.00 73.82 C ATOM 1010 OE1 GLN A 69 1.768 -18.101 -6.595 1.00 96.26 O ATOM 1011 NE2 GLN A 69 0.663 -16.539 -5.419 1.00 73.98 N ATOM 1012 HA GLN A 69 -0.883 -17.455 -10.155 1.00 0.00 H ATOM 1013 HB2 GLN A 69 -1.473 -18.488 -7.380 1.00 0.00 H ATOM 1014 HB3 GLN A 69 -0.026 -18.991 -8.284 1.00 0.00 H ATOM 1015 HG2 GLN A 69 0.553 -16.562 -8.513 1.00 0.00 H ATOM 1016 HG3 GLN A 69 -0.775 -16.212 -7.382 1.00 0.00 H ATOM 1017 HE22 GLN A 69 -0.096 -15.828 -5.399 1.00 0.00 H ATOM 1018 HE21 GLN A 69 1.251 -16.696 -4.576 1.00 0.00 H ATOM 1019 H GLN A 69 -3.073 -17.072 -8.275 1.00 0.00 H ATOM 1020 N THR A 70 -0.911 -19.989 -10.780 1.00 29.46 N ATOM 1021 CA THR A 70 -1.183 -21.265 -11.452 1.00 31.70 C ATOM 1022 C THR A 70 -0.371 -22.432 -10.928 1.00 27.42 C ATOM 1023 O THR A 70 -0.151 -23.427 -11.636 1.00 27.55 O ATOM 1024 CB THR A 70 -0.925 -21.156 -12.945 1.00 41.18 C ATOM 1025 OG1 THR A 70 0.457 -20.852 -13.168 1.00 45.68 O ATOM 1026 CG2 THR A 70 -1.793 -20.063 -13.523 1.00 48.35 C ATOM 1027 HA THR A 70 -2.233 -21.467 -11.241 1.00 0.00 H ATOM 1028 HB THR A 70 -1.166 -22.101 -13.431 1.00 0.00 H ATOM 1029 HG1 THR A 70 1.018 -21.573 -12.787 1.00 0.00 H ATOM 1030 HG23 THR A 70 -2.842 -20.303 -13.348 1.00 0.00 H ATOM 1031 HG21 THR A 70 -1.551 -19.116 -13.041 1.00 0.00 H ATOM 1032 HG22 THR A 70 -1.610 -19.984 -14.595 1.00 0.00 H ATOM 1033 H THR A 70 0.032 -19.557 -10.859 1.00 0.00 H ATOM 1034 N ASN A 71 0.057 -22.339 -9.678 1.00 24.04 N ATOM 1035 CA ASN A 71 0.747 -23.457 -9.049 1.00 23.78 C ATOM 1036 C ASN A 71 -0.182 -24.151 -8.052 1.00 19.45 C ATOM 1037 O ASN A 71 0.269 -24.671 -7.064 1.00 21.59 O ATOM 1038 CB ASN A 71 2.033 -22.980 -8.363 1.00 26.29 C ATOM 1039 CG ASN A 71 1.774 -21.986 -7.221 1.00 25.83 C ATOM 1040 OD1 ASN A 71 0.908 -21.116 -7.318 1.00 28.69 O ATOM 1041 ND2 ASN A 71 2.533 -22.114 -6.139 1.00 29.67 N ATOM 1042 HA ASN A 71 1.027 -24.177 -9.818 1.00 0.00 H ATOM 1043 HB2 ASN A 71 2.552 -23.848 -7.957 1.00 0.00 H ATOM 1044 HB3 ASN A 71 2.665 -22.496 -9.108 1.00 0.00 H ATOM 1045 HD22 ASN A 71 3.254 -22.862 -6.095 1.00 0.00 H ATOM 1046 HD21 ASN A 71 2.406 -21.466 -5.335 1.00 0.00 H ATOM 1047 H ASN A 71 -0.101 -21.462 -9.142 1.00 0.00 H ATOM 1048 N CYS A 72 -1.488 -24.192 -8.324 1.00 20.28 N ATOM 1049 CA CYS A 72 -2.411 -24.966 -7.484 1.00 18.39 C ATOM 1050 C CYS A 72 -2.789 -26.278 -8.154 1.00 17.13 C ATOM 1051 O CYS A 72 -2.710 -26.399 -9.378 1.00 18.34 O ATOM 1052 CB CYS A 72 -3.668 -24.168 -7.149 1.00 19.30 C ATOM 1053 SG CYS A 72 -3.453 -22.992 -5.778 1.00 26.39 S ATOM 1054 HA CYS A 72 -1.890 -25.186 -6.552 1.00 0.00 H ATOM 1055 HB2 CYS A 72 -4.458 -24.869 -6.879 1.00 0.00 H ATOM 1056 HB3 CYS A 72 -3.967 -23.610 -8.036 1.00 0.00 H ATOM 1057 H CYS A 72 -1.857 -23.668 -9.143 1.00 0.00 H ATOM 1058 N TYR A 73 -3.191 -27.253 -7.331 1.00 17.30 N ATOM 1059 CA TYR A 73 -3.478 -28.625 -7.737 1.00 17.65 C ATOM 1060 C TYR A 73 -4.670 -29.117 -6.945 1.00 15.37 C ATOM 1061 O TYR A 73 -4.773 -28.874 -5.738 1.00 17.98 O ATOM 1062 CB TYR A 73 -2.267 -29.520 -7.480 1.00 16.70 C ATOM 1063 CG TYR A 73 -1.094 -29.094 -8.343 1.00 17.71 C ATOM 1064 CD1 TYR A 73 -0.259 -28.072 -7.936 1.00 19.22 C ATOM 1065 CD2 TYR A 73 -0.885 -29.647 -9.603 1.00 19.99 C ATOM 1066 CE1 TYR A 73 0.773 -27.647 -8.711 1.00 23.65 C ATOM 1067 CE2 TYR A 73 0.153 -29.213 -10.408 1.00 21.84 C ATOM 1068 CZ TYR A 73 0.988 -28.210 -9.946 1.00 23.17 C ATOM 1069 OH TYR A 73 2.044 -27.745 -10.694 1.00 30.85 O ATOM 1070 HA TYR A 73 -3.700 -28.657 -8.804 1.00 0.00 H ATOM 1071 HB3 TYR A 73 -2.528 -30.552 -7.714 1.00 0.00 H ATOM 1072 HB2 TYR A 73 -1.984 -29.447 -6.430 1.00 0.00 H ATOM 1073 HD2 TYR A 73 -1.549 -30.434 -9.961 1.00 0.00 H ATOM 1074 HE2 TYR A 73 0.311 -29.654 -11.392 1.00 0.00 H ATOM 1075 HE1 TYR A 73 1.432 -26.857 -8.352 1.00 0.00 H ATOM 1076 HD1 TYR A 73 -0.432 -27.595 -6.971 1.00 0.00 H ATOM 1077 HH TYR A 73 2.515 -27.034 -10.192 1.00 0.00 H ATOM 1078 H TYR A 73 -3.308 -27.015 -6.325 1.00 0.00 H ATOM 1079 N GLN A 74 -5.592 -29.747 -7.643 1.00 16.62 N ATOM 1080 CA GLN A 74 -6.783 -30.267 -7.034 1.00 16.30 C ATOM 1081 C GLN A 74 -6.612 -31.773 -6.988 1.00 15.73 C ATOM 1082 O GLN A 74 -6.242 -32.409 -7.994 1.00 18.70 O ATOM 1083 CB GLN A 74 -8.036 -29.851 -7.843 1.00 17.30 C ATOM 1084 CG GLN A 74 -9.357 -30.440 -7.355 1.00 21.91 C ATOM 1085 CD GLN A 74 -10.558 -29.682 -7.885 1.00 25.95 C ATOM 1086 OE1 GLN A 74 -10.504 -28.466 -8.091 1.00 28.95 O ATOM 1087 NE2 GLN A 74 -11.633 -30.379 -8.094 1.00 28.32 N ATOM 1088 HA GLN A 74 -6.929 -29.870 -6.029 1.00 0.00 H ATOM 1089 HB2 GLN A 74 -8.117 -28.765 -7.803 1.00 0.00 H ATOM 1090 HB3 GLN A 74 -7.889 -30.165 -8.876 1.00 0.00 H ATOM 1091 HG2 GLN A 74 -9.422 -31.476 -7.687 1.00 0.00 H ATOM 1092 HG3 GLN A 74 -9.374 -30.407 -6.266 1.00 0.00 H ATOM 1093 HE22 GLN A 74 -11.634 -31.402 -7.907 1.00 0.00 H ATOM 1094 HE21 GLN A 74 -12.493 -29.914 -8.449 1.00 0.00 H ATOM 1095 H GLN A 74 -5.453 -29.871 -8.666 1.00 0.00 H ATOM 1096 N SER A 75 -6.936 -32.367 -5.841 1.00 16.61 N ATOM 1097 CA SER A 75 -6.807 -33.818 -5.698 1.00 17.93 C ATOM 1098 C SER A 75 -7.823 -34.501 -6.587 1.00 15.78 C ATOM 1099 O SER A 75 -8.965 -34.040 -6.728 1.00 16.82 O ATOM 1100 CB SER A 75 -7.005 -34.274 -4.243 1.00 14.64 C ATOM 1101 OG SER A 75 -8.293 -33.924 -3.754 1.00 16.61 O ATOM 1102 HA SER A 75 -5.796 -34.095 -5.995 1.00 0.00 H ATOM 1103 HB2 SER A 75 -6.248 -33.800 -3.618 1.00 0.00 H ATOM 1104 HB3 SER A 75 -6.890 -35.357 -4.193 1.00 0.00 H ATOM 1105 HG SER A 75 -8.986 -34.356 -4.314 1.00 0.00 H ATOM 1106 H SER A 75 -7.282 -31.797 -5.043 1.00 0.00 H ATOM 1107 N TYR A 76 -7.400 -35.602 -7.188 1.00 17.00 N ATOM 1108 CA TYR A 76 -8.283 -36.399 -8.046 1.00 14.99 C ATOM 1109 C TYR A 76 -9.410 -37.047 -7.240 1.00 14.26 C ATOM 1110 O TYR A 76 -10.524 -37.210 -7.739 1.00 19.05 O ATOM 1111 CB TYR A 76 -7.502 -37.520 -8.695 1.00 15.78 C ATOM 1112 CG TYR A 76 -6.477 -37.098 -9.736 1.00 17.29 C ATOM 1113 CD1 TYR A 76 -6.736 -36.062 -10.607 1.00 19.37 C ATOM 1114 CD2 TYR A 76 -5.270 -37.770 -9.874 1.00 18.73 C ATOM 1115 CE1 TYR A 76 -5.839 -35.728 -11.621 1.00 20.16 C ATOM 1116 CE2 TYR A 76 -4.353 -37.423 -10.869 1.00 21.19 C ATOM 1117 CZ TYR A 76 -4.646 -36.394 -11.726 1.00 19.94 C ATOM 1118 OH TYR A 76 -3.748 -36.033 -12.694 1.00 22.85 O ATOM 1119 HA TYR A 76 -8.699 -35.721 -8.791 1.00 0.00 H ATOM 1120 HB3 TYR A 76 -8.215 -38.188 -9.179 1.00 0.00 H ATOM 1121 HB2 TYR A 76 -6.976 -38.061 -7.908 1.00 0.00 H ATOM 1122 HD2 TYR A 76 -5.033 -38.586 -9.191 1.00 0.00 H ATOM 1123 HE2 TYR A 76 -3.412 -37.966 -10.963 1.00 0.00 H ATOM 1124 HE1 TYR A 76 -6.087 -34.938 -12.330 1.00 0.00 H ATOM 1125 HD1 TYR A 76 -7.660 -35.493 -10.501 1.00 0.00 H ATOM 1126 HH TYR A 76 -4.116 -35.279 -13.219 1.00 0.00 H ATOM 1127 H TYR A 76 -6.416 -35.910 -7.048 1.00 0.00 H ATOM 1128 N SER A 77 -9.105 -37.435 -6.004 1.00 18.78 N ATOM 1129 CA SER A 77 -10.072 -38.138 -5.175 1.00 18.85 C ATOM 1130 C SER A 77 -10.466 -37.232 -4.004 1.00 17.12 C ATOM 1131 O SER A 77 -9.794 -36.249 -3.725 1.00 19.06 O ATOM 1132 CB SER A 77 -9.465 -39.429 -4.645 1.00 23.79 C ATOM 1133 OG SER A 77 -8.535 -39.140 -3.622 1.00 28.38 O ATOM 1134 HA SER A 77 -10.953 -38.385 -5.768 1.00 0.00 H ATOM 1135 HB2 SER A 77 -8.959 -39.950 -5.457 1.00 0.00 H ATOM 1136 HB3 SER A 77 -10.256 -40.063 -4.245 1.00 0.00 H ATOM 1137 HG SER A 77 -7.815 -38.565 -3.985 1.00 0.00 H ATOM 1138 H SER A 77 -8.158 -37.232 -5.624 1.00 0.00 H ATOM 1139 N THR A 78 -11.568 -37.559 -3.335 1.00 17.52 N ATOM 1140 CA THR A 78 -11.938 -36.828 -2.142 1.00 16.46 C ATOM 1141 C THR A 78 -11.039 -37.302 -0.990 1.00 17.46 C ATOM 1142 O THR A 78 -10.497 -38.409 -1.011 1.00 20.96 O ATOM 1143 CB THR A 78 -13.383 -37.048 -1.760 1.00 20.47 C ATOM 1144 OG1 THR A 78 -13.614 -38.434 -1.581 1.00 23.32 O ATOM 1145 CG2 THR A 78 -14.337 -36.535 -2.850 1.00 24.72 C ATOM 1146 HA THR A 78 -11.810 -35.764 -2.340 1.00 0.00 H ATOM 1147 HB THR A 78 -13.573 -36.498 -0.838 1.00 0.00 H ATOM 1148 HG1 THR A 78 -13.025 -38.775 -0.862 1.00 0.00 H ATOM 1149 HG23 THR A 78 -14.173 -35.468 -3.002 1.00 0.00 H ATOM 1150 HG21 THR A 78 -14.144 -37.069 -3.780 1.00 0.00 H ATOM 1151 HG22 THR A 78 -15.368 -36.705 -2.538 1.00 0.00 H ATOM 1152 H THR A 78 -12.165 -38.342 -3.670 1.00 0.00 H ATOM 1153 N MET A 79 -10.918 -36.450 0.015 1.00 16.20 N ATOM 1154 CA MET A 79 -10.135 -36.719 1.192 1.00 15.62 C ATOM 1155 C MET A 79 -10.952 -36.360 2.424 1.00 14.42 C ATOM 1156 O MET A 79 -11.857 -35.499 2.386 1.00 17.28 O ATOM 1157 CB MET A 79 -8.847 -35.901 1.161 1.00 17.03 C ATOM 1158 CG MET A 79 -7.866 -36.401 0.103 1.00 21.14 C ATOM 1159 SD MET A 79 -6.332 -35.469 0.205 1.00 24.03 S ATOM 1160 CE MET A 79 -5.388 -36.351 -1.022 1.00 30.01 C ATOM 1161 HA MET A 79 -9.873 -37.777 1.223 1.00 0.00 H ATOM 1162 HB2 MET A 79 -9.097 -34.862 0.945 1.00 0.00 H ATOM 1163 HB3 MET A 79 -8.369 -35.962 2.139 1.00 0.00 H ATOM 1164 HG2 MET A 79 -8.304 -36.271 -0.887 1.00 0.00 H ATOM 1165 HG3 MET A 79 -7.659 -37.458 0.271 1.00 0.00 H ATOM 1166 HE1 MET A 79 -5.301 -37.397 -0.729 1.00 0.00 H ATOM 1167 HE2 MET A 79 -5.894 -36.284 -1.985 1.00 0.00 H ATOM 1168 HE3 MET A 79 -4.394 -35.910 -1.100 1.00 0.00 H ATOM 1169 H MET A 79 -11.415 -35.538 -0.049 1.00 0.00 H ATOM 1170 N SER A 80 -10.622 -37.005 3.528 1.00 15.35 N ATOM 1171 CA SER A 80 -11.256 -36.671 4.805 1.00 17.60 C ATOM 1172 C SER A 80 -10.686 -35.366 5.345 1.00 16.27 C ATOM 1173 O SER A 80 -9.475 -35.258 5.580 1.00 16.61 O ATOM 1174 CB SER A 80 -11.033 -37.792 5.782 1.00 21.77 C ATOM 1175 OG SER A 80 -11.558 -37.409 7.044 1.00 19.23 O ATOM 1176 HA SER A 80 -12.328 -36.540 4.657 1.00 0.00 H ATOM 1177 HB2 SER A 80 -9.965 -37.991 5.874 1.00 0.00 H ATOM 1178 HB3 SER A 80 -11.540 -38.691 5.431 1.00 0.00 H ATOM 1179 HG SER A 80 -11.416 -38.141 7.695 1.00 0.00 H ATOM 1180 H SER A 80 -9.905 -37.757 3.490 1.00 0.00 H ATOM 1181 N ILE A 81 -11.529 -34.359 5.536 1.00 14.28 N ATOM 1182 CA ILE A 81 -11.046 -33.087 6.051 1.00 15.81 C ATOM 1183 C ILE A 81 -11.937 -32.612 7.198 1.00 15.44 C ATOM 1184 O ILE A 81 -13.062 -33.072 7.347 1.00 17.61 O ATOM 1185 CB ILE A 81 -10.969 -31.973 4.977 1.00 20.10 C ATOM 1186 CG1 ILE A 81 -12.370 -31.614 4.515 1.00 25.45 C ATOM 1187 CG2 ILE A 81 -10.081 -32.376 3.758 1.00 22.89 C ATOM 1188 CD1 ILE A 81 -12.487 -30.219 4.030 1.00 37.88 C ATOM 1189 HA ILE A 81 -10.029 -33.270 6.399 1.00 0.00 H ATOM 1190 HB ILE A 81 -10.496 -31.105 5.436 1.00 0.00 H ATOM 1191 HG12 ILE A 81 -12.651 -32.287 3.705 1.00 0.00 H ATOM 1192 HG13 ILE A 81 -13.056 -31.749 5.352 1.00 0.00 H ATOM 1193 HD11 ILE A 81 -12.219 -29.533 4.833 1.00 0.00 H ATOM 1194 HD12 ILE A 81 -11.814 -30.072 3.185 1.00 0.00 H ATOM 1195 HD13 ILE A 81 -13.513 -30.030 3.716 1.00 0.00 H ATOM 1196 HG21 ILE A 81 -9.067 -32.582 4.101 1.00 0.00 H ATOM 1197 HG22 ILE A 81 -10.495 -33.268 3.288 1.00 0.00 H ATOM 1198 HG23 ILE A 81 -10.063 -31.558 3.037 1.00 0.00 H ATOM 1199 H ILE A 81 -12.538 -34.480 5.317 1.00 0.00 H ATOM 1200 N THR A 82 -11.425 -31.686 7.997 1.00 14.83 N ATOM 1201 CA THR A 82 -12.201 -31.010 9.019 1.00 14.78 C ATOM 1202 C THR A 82 -11.970 -29.521 8.857 1.00 13.74 C ATOM 1203 O THR A 82 -10.839 -29.033 8.967 1.00 17.03 O ATOM 1204 CB THR A 82 -11.779 -31.418 10.435 1.00 15.95 C ATOM 1205 OG1 THR A 82 -11.925 -32.818 10.584 1.00 17.27 O ATOM 1206 CG2 THR A 82 -12.663 -30.733 11.446 1.00 20.30 C ATOM 1207 HA THR A 82 -13.249 -31.282 8.897 1.00 0.00 H ATOM 1208 HB THR A 82 -10.740 -31.129 10.594 1.00 0.00 H ATOM 1209 HG1 THR A 82 -11.353 -33.281 9.922 1.00 0.00 H ATOM 1210 HG23 THR A 82 -12.561 -29.653 11.343 1.00 0.00 H ATOM 1211 HG21 THR A 82 -13.700 -31.019 11.273 1.00 0.00 H ATOM 1212 HG22 THR A 82 -12.365 -31.033 12.450 1.00 0.00 H ATOM 1213 H THR A 82 -10.422 -31.433 7.886 1.00 0.00 H ATOM 1214 N ASP A 83 -13.048 -28.794 8.612 1.00 15.05 N ATOM 1215 CA ASP A 83 -13.001 -27.345 8.584 1.00 16.66 C ATOM 1216 C ASP A 83 -13.243 -26.814 9.996 1.00 13.30 C ATOM 1217 O ASP A 83 -14.146 -27.285 10.726 1.00 15.41 O ATOM 1218 CB ASP A 83 -14.098 -26.829 7.623 1.00 19.74 C ATOM 1219 CG ASP A 83 -14.293 -25.323 7.691 1.00 21.57 C ATOM 1220 OD1 ASP A 83 -14.990 -24.826 8.596 1.00 27.37 O ATOM 1221 OD2 ASP A 83 -13.751 -24.623 6.841 1.00 23.40 O ATOM 1222 HA ASP A 83 -12.027 -27.001 8.235 1.00 0.00 H ATOM 1223 HB2 ASP A 83 -13.820 -27.097 6.604 1.00 0.00 H ATOM 1224 HB3 ASP A 83 -15.040 -27.313 7.881 1.00 0.00 H ATOM 1225 H ASP A 83 -13.953 -29.275 8.435 1.00 0.00 H ATOM 1226 N CYS A 84 -12.403 -25.862 10.412 1.00 14.37 N ATOM 1227 CA CYS A 84 -12.531 -25.224 11.707 1.00 11.71 C ATOM 1228 C CYS A 84 -12.717 -23.728 11.426 1.00 14.33 C ATOM 1229 O CYS A 84 -11.882 -23.095 10.773 1.00 18.91 O ATOM 1230 CB CYS A 84 -11.251 -25.377 12.565 1.00 16.57 C ATOM 1231 SG CYS A 84 -10.813 -27.081 12.904 1.00 17.10 S ATOM 1232 HA CYS A 84 -13.358 -25.679 12.252 1.00 0.00 H ATOM 1233 HB2 CYS A 84 -11.410 -24.866 13.515 1.00 0.00 H ATOM 1234 HB3 CYS A 84 -10.423 -24.907 12.035 1.00 0.00 H ATOM 1235 H CYS A 84 -11.629 -25.568 9.783 1.00 0.00 H ATOM 1236 N ARG A 85 -13.803 -23.174 11.942 1.00 16.97 N ATOM 1237 CA ARG A 85 -14.146 -21.794 11.687 1.00 19.10 C ATOM 1238 C ARG A 85 -14.564 -21.155 12.983 1.00 16.70 C ATOM 1239 O ARG A 85 -15.354 -21.718 13.737 1.00 18.94 O ATOM 1240 CB ARG A 85 -15.285 -21.757 10.688 1.00 27.50 C ATOM 1241 CG ARG A 85 -15.409 -20.455 10.041 1.00 34.58 C ATOM 1242 CD ARG A 85 -16.199 -20.559 8.766 1.00 36.21 C ATOM 1243 NE ARG A 85 -15.512 -21.084 7.580 1.00 33.82 N ATOM 1244 CZ ARG A 85 -15.111 -20.345 6.546 1.00 35.04 C ATOM 1245 NH1 ARG A 85 -15.223 -19.034 6.588 1.00 34.18 N ATOM 1246 NH2 ARG A 85 -14.558 -20.924 5.474 1.00 41.71 N ATOM 1247 HA ARG A 85 -13.294 -21.250 11.279 1.00 0.00 H ATOM 1248 HB2 ARG A 85 -15.107 -22.513 9.924 1.00 0.00 H ATOM 1249 HB3 ARG A 85 -16.216 -21.981 11.209 1.00 0.00 H ATOM 1250 HG2 ARG A 85 -15.914 -19.767 10.719 1.00 0.00 H ATOM 1251 HG3 ARG A 85 -14.414 -20.074 9.814 1.00 0.00 H ATOM 1252 HD2 ARG A 85 -16.555 -19.558 8.520 1.00 0.00 H ATOM 1253 HD3 ARG A 85 -17.052 -21.208 8.963 1.00 0.00 H ATOM 1254 HE ARG A 85 -15.325 -22.106 7.544 1.00 0.00 H ATOM 1255 HH12 ARG A 85 -14.909 -18.459 5.780 1.00 0.00 H ATOM 1256 HH11 ARG A 85 -15.625 -18.573 7.429 1.00 0.00 H ATOM 1257 HH22 ARG A 85 -14.247 -20.341 4.671 1.00 0.00 H ATOM 1258 HH21 ARG A 85 -14.439 -21.957 5.444 1.00 0.00 H ATOM 1259 H ARG A 85 -14.425 -23.747 12.547 1.00 0.00 H ATOM 1260 N GLU A 86 -14.046 -19.972 13.259 1.00 19.06 N ATOM 1261 CA GLU A 86 -14.407 -19.268 14.482 1.00 20.73 C ATOM 1262 C GLU A 86 -15.894 -19.006 14.520 1.00 21.75 C ATOM 1263 O GLU A 86 -16.494 -18.674 13.514 1.00 22.29 O ATOM 1264 CB GLU A 86 -13.716 -17.914 14.539 1.00 26.84 C ATOM 1265 CG GLU A 86 -12.534 -17.818 15.385 1.00 30.54 C ATOM 1266 CD GLU A 86 -12.128 -16.362 15.523 1.00 28.14 C ATOM 1267 OE1 GLU A 86 -12.051 -15.873 16.648 1.00 26.47 O ATOM 1268 OE2 GLU A 86 -11.946 -15.680 14.493 1.00 32.87 O ATOM 1269 HA GLU A 86 -14.102 -19.894 15.321 1.00 0.00 H ATOM 1270 HB2 GLU A 86 -13.418 -17.652 13.524 1.00 0.00 H ATOM 1271 HB3 GLU A 86 -14.442 -17.187 14.902 1.00 0.00 H ATOM 1272 HG2 GLU A 86 -12.757 -18.228 16.370 1.00 0.00 H ATOM 1273 HG3 GLU A 86 -11.717 -18.382 14.934 1.00 0.00 H ATOM 1274 H GLU A 86 -13.373 -19.538 12.596 1.00 0.00 H ATOM 1275 N THR A 87 -16.493 -19.098 15.695 1.00 24.68 N ATOM 1276 CA THR A 87 -17.909 -18.812 15.783 1.00 28.49 C ATOM 1277 C THR A 87 -18.060 -17.327 16.017 1.00 34.65 C ATOM 1278 O THR A 87 -17.100 -16.644 16.392 1.00 34.09 O ATOM 1279 CB THR A 87 -18.564 -19.576 16.917 1.00 33.32 C ATOM 1280 OG1 THR A 87 -17.975 -19.142 18.134 1.00 35.53 O ATOM 1281 CG2 THR A 87 -18.341 -21.077 16.758 1.00 35.94 C ATOM 1282 HA THR A 87 -18.399 -19.121 14.859 1.00 0.00 H ATOM 1283 HB THR A 87 -19.638 -19.388 16.912 1.00 0.00 H ATOM 1284 HG1 THR A 87 -18.388 -19.628 18.891 1.00 0.00 H ATOM 1285 HG23 THR A 87 -18.792 -21.413 15.824 1.00 0.00 H ATOM 1286 HG21 THR A 87 -17.271 -21.284 16.741 1.00 0.00 H ATOM 1287 HG22 THR A 87 -18.801 -21.602 17.595 1.00 0.00 H ATOM 1288 H THR A 87 -15.955 -19.371 16.542 1.00 0.00 H ATOM 1289 N GLY A 88 -19.270 -16.826 15.797 1.00 39.34 N ATOM 1290 CA GLY A 88 -19.536 -15.410 15.980 1.00 47.13 C ATOM 1291 C GLY A 88 -19.224 -14.904 17.374 1.00 49.08 C ATOM 1292 O GLY A 88 -18.987 -13.711 17.551 1.00 50.59 O ATOM 1293 HA3 GLY A 88 -20.592 -15.229 15.777 1.00 0.00 H ATOM 1294 HA2 GLY A 88 -18.929 -14.851 15.267 1.00 0.00 H ATOM 1295 H GLY A 88 -20.038 -17.456 15.489 1.00 0.00 H ATOM 1296 N SER A 89 -19.225 -15.790 18.367 1.00 55.21 N ATOM 1297 CA SER A 89 -19.013 -15.385 19.765 1.00 58.92 C ATOM 1298 C SER A 89 -17.537 -15.412 20.182 1.00 54.99 C ATOM 1299 O SER A 89 -17.169 -14.881 21.225 1.00 56.58 O ATOM 1300 CB SER A 89 -19.805 -16.303 20.706 1.00 67.41 C ATOM 1301 OG SER A 89 -19.257 -17.617 20.727 1.00 68.57 O ATOM 1302 HA SER A 89 -19.362 -14.355 19.841 1.00 0.00 H ATOM 1303 HB2 SER A 89 -20.839 -16.354 20.365 1.00 0.00 H ATOM 1304 HB3 SER A 89 -19.776 -15.889 21.714 1.00 0.00 H ATOM 1305 HG SER A 89 -19.285 -18.000 19.814 1.00 0.00 H ATOM 1306 H SER A 89 -19.380 -16.795 18.149 1.00 0.00 H ATOM 1307 N SER A 90 -16.697 -16.050 19.376 1.00 51.03 N ATOM 1308 CA SER A 90 -15.285 -16.216 19.713 1.00 47.36 C ATOM 1309 C SER A 90 -14.545 -14.885 19.909 1.00 46.81 C ATOM 1310 O SER A 90 -14.647 -13.976 19.094 1.00 48.02 O ATOM 1311 CB SER A 90 -14.611 -17.057 18.619 1.00 39.71 C ATOM 1312 OG SER A 90 -13.210 -17.081 18.798 1.00 35.18 O ATOM 1313 HA SER A 90 -15.231 -16.726 20.675 1.00 0.00 H ATOM 1314 HB2 SER A 90 -14.840 -16.626 17.644 1.00 0.00 H ATOM 1315 HB3 SER A 90 -14.995 -18.076 18.664 1.00 0.00 H ATOM 1316 HG SER A 90 -12.857 -16.157 18.755 1.00 0.00 H ATOM 1317 H SER A 90 -17.053 -16.442 18.481 1.00 0.00 H ATOM 1318 N LYS A 91 -13.805 -14.750 21.000 1.00 48.86 N ATOM 1319 CA LYS A 91 -12.944 -13.585 21.140 1.00 54.21 C ATOM 1320 C LYS A 91 -11.660 -13.929 21.883 1.00 52.82 C ATOM 1321 O LYS A 91 -11.701 -14.488 22.988 1.00 51.12 O ATOM 1322 CB LYS A 91 -13.675 -12.447 21.857 1.00 56.83 C ATOM 1323 CG LYS A 91 -13.320 -11.053 21.314 1.00 75.76 C ATOM 1324 CD LYS A 91 -13.903 -9.921 22.180 1.00 82.68 C ATOM 1325 CE LYS A 91 -13.126 -9.765 23.494 1.00102.10 C ATOM 1326 NZ LYS A 91 -13.649 -8.679 24.380 1.00 76.24 N ATOM 1327 HA LYS A 91 -12.680 -13.254 20.135 1.00 0.00 H ATOM 1328 HB2 LYS A 91 -14.748 -12.599 21.742 1.00 0.00 H ATOM 1329 HB3 LYS A 91 -13.415 -12.482 22.915 1.00 0.00 H ATOM 1330 HG2 LYS A 91 -12.235 -10.952 21.289 1.00 0.00 H ATOM 1331 HG3 LYS A 91 -13.715 -10.960 20.303 1.00 0.00 H ATOM 1332 HD2 LYS A 91 -13.851 -8.985 21.623 1.00 0.00 H ATOM 1333 HD3 LYS A 91 -14.944 -10.149 22.408 1.00 0.00 H ATOM 1334 HE2 LYS A 91 -12.086 -9.542 23.254 1.00 0.00 H ATOM 1335 HE3 LYS A 91 -13.178 -10.708 24.038 1.00 0.00 H ATOM 1336 HZ1 LYS A 91 -13.596 -7.769 23.879 1.00 0.00 H ATOM 1337 HZ2 LYS A 91 -14.638 -8.882 24.628 1.00 0.00 H ATOM 1338 HZ3 LYS A 91 -13.075 -8.634 25.246 1.00 0.00 H ATOM 1339 H LYS A 91 -13.839 -15.470 21.750 1.00 0.00 H ATOM 1340 N TYR A 92 -10.532 -13.583 21.263 1.00 55.01 N ATOM 1341 CA TYR A 92 -9.218 -13.848 21.834 1.00 56.67 C ATOM 1342 C TYR A 92 -9.123 -13.293 23.249 1.00 55.80 C ATOM 1343 O TYR A 92 -9.547 -12.167 23.493 1.00 55.79 O ATOM 1344 CB TYR A 92 -8.136 -13.215 20.953 1.00 62.17 C ATOM 1345 CG TYR A 92 -6.736 -13.463 21.474 1.00 59.09 C ATOM 1346 CD1 TYR A 92 -6.085 -14.670 21.223 1.00 61.77 C ATOM 1347 CD2 TYR A 92 -6.084 -12.516 22.234 1.00 61.38 C ATOM 1348 CE1 TYR A 92 -4.809 -14.917 21.703 1.00 60.80 C ATOM 1349 CE2 TYR A 92 -4.797 -12.749 22.725 1.00 62.75 C ATOM 1350 CZ TYR A 92 -4.168 -13.955 22.461 1.00 61.18 C ATOM 1351 OH TYR A 92 -2.897 -14.195 22.949 1.00 64.90 O ATOM 1352 HA TYR A 92 -9.068 -14.927 21.876 1.00 0.00 H ATOM 1353 HB3 TYR A 92 -8.307 -12.139 20.910 1.00 0.00 H ATOM 1354 HB2 TYR A 92 -8.214 -13.634 19.950 1.00 0.00 H ATOM 1355 HD2 TYR A 92 -6.580 -11.571 22.455 1.00 0.00 H ATOM 1356 HE2 TYR A 92 -4.290 -11.985 23.314 1.00 0.00 H ATOM 1357 HE1 TYR A 92 -4.314 -15.863 21.484 1.00 0.00 H ATOM 1358 HD1 TYR A 92 -6.591 -15.436 20.636 1.00 0.00 H ATOM 1359 HH TYR A 92 -2.602 -15.097 22.669 1.00 0.00 H ATOM 1360 H TYR A 92 -10.592 -13.108 20.340 1.00 0.00 H ATOM 1361 N PRO A 93 -8.521 -14.050 24.188 1.00 55.65 N ATOM 1362 CA PRO A 93 -7.840 -15.352 24.116 1.00 56.26 C ATOM 1363 C PRO A 93 -8.744 -16.581 24.199 1.00 51.66 C ATOM 1364 O PRO A 93 -8.241 -17.702 24.086 1.00 52.35 O ATOM 1365 CB PRO A 93 -6.900 -15.318 25.328 1.00 61.85 C ATOM 1366 CG PRO A 93 -7.554 -14.413 26.288 1.00 62.64 C ATOM 1367 CD PRO A 93 -8.338 -13.413 25.503 1.00 61.73 C ATOM 1368 HA PRO A 93 -7.359 -15.464 23.144 1.00 0.00 H ATOM 1369 HD3 PRO A 93 -9.301 -13.218 25.976 1.00 0.00 H ATOM 1370 HD2 PRO A 93 -7.786 -12.478 25.407 1.00 0.00 H ATOM 1371 HG3 PRO A 93 -6.802 -13.905 26.892 1.00 0.00 H ATOM 1372 HG2 PRO A 93 -8.220 -14.979 26.939 1.00 0.00 H ATOM 1373 HB2 PRO A 93 -6.788 -16.315 25.755 1.00 0.00 H ATOM 1374 HB3 PRO A 93 -5.921 -14.933 25.044 1.00 0.00 H ATOM 1375 N ASN A 94 -10.049 -16.396 24.373 1.00 51.79 N ATOM 1376 CA ASN A 94 -10.950 -17.551 24.400 1.00 52.30 C ATOM 1377 C ASN A 94 -11.507 -17.875 23.017 1.00 45.42 C ATOM 1378 O ASN A 94 -12.685 -17.630 22.740 1.00 45.21 O ATOM 1379 CB ASN A 94 -12.091 -17.323 25.395 1.00 60.43 C ATOM 1380 CG ASN A 94 -11.585 -16.940 26.782 1.00 61.45 C ATOM 1381 OD1 ASN A 94 -11.846 -15.836 27.263 1.00 61.07 O ATOM 1382 ND2 ASN A 94 -10.839 -17.847 27.418 1.00 69.09 N ATOM 1383 HA ASN A 94 -10.363 -18.410 24.726 1.00 0.00 H ATOM 1384 HB2 ASN A 94 -12.727 -16.521 25.021 1.00 0.00 H ATOM 1385 HB3 ASN A 94 -12.674 -18.240 25.476 1.00 0.00 H ATOM 1386 HD22 ASN A 94 -10.645 -18.766 26.972 1.00 0.00 H ATOM 1387 HD21 ASN A 94 -10.452 -17.634 28.359 1.00 0.00 H ATOM 1388 H ASN A 94 -10.429 -15.435 24.490 1.00 0.00 H ATOM 1389 N CYS A 95 -10.657 -18.430 22.156 1.00 38.89 N ATOM 1390 CA CYS A 95 -11.044 -18.745 20.786 1.00 36.99 C ATOM 1391 C CYS A 95 -12.000 -19.919 20.799 1.00 33.43 C ATOM 1392 O CYS A 95 -11.809 -20.864 21.564 1.00 38.21 O ATOM 1393 CB CYS A 95 -9.812 -19.103 19.952 1.00 36.21 C ATOM 1394 SG CYS A 95 -8.551 -17.851 20.034 1.00 32.10 S ATOM 1395 HA CYS A 95 -11.526 -17.874 20.343 1.00 0.00 H ATOM 1396 HB2 CYS A 95 -10.116 -19.226 18.913 1.00 0.00 H ATOM 1397 HB3 CYS A 95 -9.399 -20.041 20.322 1.00 0.00 H ATOM 1398 H CYS A 95 -9.689 -18.645 22.470 1.00 0.00 H ATOM 1399 N ALA A 96 -13.021 -19.866 19.953 1.00 28.98 N ATOM 1400 CA ALA A 96 -14.048 -20.898 19.916 1.00 27.76 C ATOM 1401 C ALA A 96 -14.324 -21.197 18.460 1.00 21.50 C ATOM 1402 O ALA A 96 -14.493 -20.280 17.677 1.00 23.49 O ATOM 1403 CB ALA A 96 -15.310 -20.406 20.590 1.00 33.40 C ATOM 1404 HA ALA A 96 -13.715 -21.792 20.443 1.00 0.00 H ATOM 1405 HB1 ALA A 96 -15.092 -20.156 21.628 1.00 0.00 H ATOM 1406 HB2 ALA A 96 -15.676 -19.520 20.071 1.00 0.00 H ATOM 1407 HB3 ALA A 96 -16.068 -21.188 20.554 1.00 0.00 H ATOM 1408 H ALA A 96 -13.090 -19.063 19.296 1.00 0.00 H ATOM 1409 N TYR A 97 -14.419 -22.478 18.120 1.00 18.61 N ATOM 1410 CA TYR A 97 -14.491 -22.941 16.752 1.00 18.93 C ATOM 1411 C TYR A 97 -15.643 -23.897 16.562 1.00 17.47 C ATOM 1412 O TYR A 97 -15.937 -24.727 17.434 1.00 21.81 O ATOM 1413 CB TYR A 97 -13.196 -23.661 16.377 1.00 18.15 C ATOM 1414 CG TYR A 97 -12.046 -22.710 16.244 1.00 16.34 C ATOM 1415 CD1 TYR A 97 -11.781 -22.069 15.043 1.00 17.91 C ATOM 1416 CD2 TYR A 97 -11.233 -22.428 17.311 1.00 19.40 C ATOM 1417 CE1 TYR A 97 -10.763 -21.172 14.920 1.00 19.10 C ATOM 1418 CE2 TYR A 97 -10.200 -21.506 17.210 1.00 18.94 C ATOM 1419 CZ TYR A 97 -9.956 -20.886 16.012 1.00 17.32 C ATOM 1420 OH TYR A 97 -8.933 -19.975 15.942 1.00 22.57 O ATOM 1421 HA TYR A 97 -14.639 -22.070 16.114 1.00 0.00 H ATOM 1422 HB3 TYR A 97 -13.341 -24.175 15.427 1.00 0.00 H ATOM 1423 HB2 TYR A 97 -12.962 -24.392 17.151 1.00 0.00 H ATOM 1424 HD2 TYR A 97 -11.401 -22.939 18.259 1.00 0.00 H ATOM 1425 HE2 TYR A 97 -9.585 -21.276 18.080 1.00 0.00 H ATOM 1426 HE1 TYR A 97 -10.583 -20.679 13.965 1.00 0.00 H ATOM 1427 HD1 TYR A 97 -12.403 -22.289 14.175 1.00 0.00 H ATOM 1428 HH TYR A 97 -8.877 -19.613 15.022 1.00 0.00 H ATOM 1429 H TYR A 97 -14.443 -23.187 18.880 1.00 0.00 H ATOM 1430 N LYS A 98 -16.276 -23.786 15.391 1.00 17.29 N ATOM 1431 CA LYS A 98 -17.183 -24.795 14.906 1.00 16.90 C ATOM 1432 C LYS A 98 -16.385 -25.832 14.113 1.00 16.30 C ATOM 1433 O LYS A 98 -15.536 -25.481 13.276 1.00 19.05 O ATOM 1434 CB LYS A 98 -18.227 -24.144 13.986 1.00 17.69 C ATOM 1435 CG LYS A 98 -19.225 -25.107 13.354 1.00 22.20 C ATOM 1436 CD LYS A 98 -20.208 -24.289 12.525 1.00 25.44 C ATOM 1437 CE LYS A 98 -21.018 -25.079 11.534 1.00 32.21 C ATOM 1438 NZ LYS A 98 -21.570 -26.333 12.028 1.00 32.36 N ATOM 1439 HA LYS A 98 -17.689 -25.274 15.744 1.00 0.00 H ATOM 1440 HB2 LYS A 98 -18.786 -23.415 14.573 1.00 0.00 H ATOM 1441 HB3 LYS A 98 -17.697 -23.632 13.183 1.00 0.00 H ATOM 1442 HG2 LYS A 98 -18.701 -25.816 12.713 1.00 0.00 H ATOM 1443 HG3 LYS A 98 -19.760 -25.650 14.133 1.00 0.00 H ATOM 1444 HD2 LYS A 98 -20.898 -23.796 13.209 1.00 0.00 H ATOM 1445 HD3 LYS A 98 -19.643 -23.536 11.976 1.00 0.00 H ATOM 1446 HE2 LYS A 98 -20.377 -25.307 10.683 1.00 0.00 H ATOM 1447 HE3 LYS A 98 -21.848 -24.454 11.205 1.00 0.00 H ATOM 1448 HZ1 LYS A 98 -20.795 -26.955 12.334 1.00 0.00 H ATOM 1449 HZ2 LYS A 98 -22.200 -26.140 12.833 1.00 0.00 H ATOM 1450 HZ3 LYS A 98 -22.108 -26.796 11.268 1.00 0.00 H ATOM 1451 H LYS A 98 -16.108 -22.941 14.808 1.00 0.00 H ATOM 1452 N THR A 99 -16.688 -27.093 14.357 1.00 16.90 N ATOM 1453 CA THR A 99 -16.071 -28.246 13.681 1.00 15.97 C ATOM 1454 C THR A 99 -16.994 -28.819 12.641 1.00 16.27 C ATOM 1455 O THR A 99 -18.104 -29.235 12.945 1.00 19.50 O ATOM 1456 CB THR A 99 -15.787 -29.361 14.710 1.00 16.35 C ATOM 1457 OG1 THR A 99 -14.837 -28.887 15.653 1.00 20.03 O ATOM 1458 CG2 THR A 99 -15.239 -30.611 14.056 1.00 18.41 C ATOM 1459 HA THR A 99 -15.151 -27.899 13.210 1.00 0.00 H ATOM 1460 HB THR A 99 -16.730 -29.617 15.194 1.00 0.00 H ATOM 1461 HG1 THR A 99 -14.000 -28.644 15.183 1.00 0.00 H ATOM 1462 HG23 THR A 99 -15.960 -30.985 13.329 1.00 0.00 H ATOM 1463 HG21 THR A 99 -14.302 -30.375 13.552 1.00 0.00 H ATOM 1464 HG22 THR A 99 -15.062 -31.370 14.818 1.00 0.00 H ATOM 1465 H THR A 99 -17.413 -27.286 15.077 1.00 0.00 H ATOM 1466 N THR A 100 -16.550 -28.809 11.390 1.00 14.82 N ATOM 1467 CA THR A 100 -17.316 -29.436 10.322 1.00 19.16 C ATOM 1468 C THR A 100 -16.491 -30.474 9.594 1.00 15.94 C ATOM 1469 O THR A 100 -15.486 -30.152 8.962 1.00 20.22 O ATOM 1470 CB THR A 100 -17.864 -28.404 9.316 1.00 20.10 C ATOM 1471 OG1 THR A 100 -18.586 -27.386 10.022 1.00 22.48 O ATOM 1472 CG2 THR A 100 -18.794 -29.099 8.358 1.00 25.56 C ATOM 1473 HA THR A 100 -18.166 -29.927 10.797 1.00 0.00 H ATOM 1474 HB THR A 100 -17.038 -27.950 8.768 1.00 0.00 H ATOM 1475 HG1 THR A 100 -17.979 -26.935 10.661 1.00 0.00 H ATOM 1476 HG23 THR A 100 -18.247 -29.873 7.820 1.00 0.00 H ATOM 1477 HG21 THR A 100 -19.615 -29.552 8.914 1.00 0.00 H ATOM 1478 HG22 THR A 100 -19.191 -28.373 7.648 1.00 0.00 H ATOM 1479 H THR A 100 -15.644 -28.348 11.170 1.00 0.00 H ATOM 1480 N GLN A 101 -16.926 -31.727 9.696 1.00 17.15 N ATOM 1481 CA GLN A 101 -16.253 -32.859 9.045 1.00 17.14 C ATOM 1482 C GLN A 101 -16.870 -33.084 7.679 1.00 15.60 C ATOM 1483 O GLN A 101 -18.098 -33.041 7.531 1.00 20.84 O ATOM 1484 CB GLN A 101 -16.412 -34.106 9.941 1.00 22.23 C ATOM 1485 CG GLN A 101 -15.933 -35.453 9.375 1.00 25.90 C ATOM 1486 CD GLN A 101 -14.429 -35.489 9.068 1.00 24.43 C ATOM 1487 OE1 GLN A 101 -13.612 -34.963 9.832 1.00 21.74 O ATOM 1488 NE2 GLN A 101 -14.067 -36.106 7.930 1.00 25.86 N ATOM 1489 HA GLN A 101 -15.191 -32.655 8.911 1.00 0.00 H ATOM 1490 HB2 GLN A 101 -15.855 -33.921 10.860 1.00 0.00 H ATOM 1491 HB3 GLN A 101 -17.472 -34.208 10.174 1.00 0.00 H ATOM 1492 HG2 GLN A 101 -16.155 -36.232 10.104 1.00 0.00 H ATOM 1493 HG3 GLN A 101 -16.478 -35.654 8.453 1.00 0.00 H ATOM 1494 HE22 GLN A 101 -14.790 -36.535 7.318 1.00 0.00 H ATOM 1495 HE21 GLN A 101 -13.063 -36.155 7.661 1.00 0.00 H ATOM 1496 H GLN A 101 -17.779 -31.913 10.261 1.00 0.00 H ATOM 1497 N ALA A 102 -16.023 -33.273 6.669 1.00 16.99 N ATOM 1498 CA ALA A 102 -16.494 -33.560 5.320 1.00 20.09 C ATOM 1499 C ALA A 102 -15.492 -34.388 4.530 1.00 20.18 C ATOM 1500 O ALA A 102 -14.347 -34.606 4.949 1.00 20.03 O ATOM 1501 CB ALA A 102 -16.781 -32.261 4.587 1.00 25.73 C ATOM 1502 HA ALA A 102 -17.409 -34.146 5.408 1.00 0.00 H ATOM 1503 HB1 ALA A 102 -17.547 -31.703 5.125 1.00 0.00 H ATOM 1504 HB2 ALA A 102 -15.869 -31.667 4.532 1.00 0.00 H ATOM 1505 HB3 ALA A 102 -17.133 -32.484 3.580 1.00 0.00 H ATOM 1506 H ALA A 102 -15.000 -33.214 6.847 1.00 0.00 H ATOM 1507 N ASN A 103 -15.952 -34.891 3.406 1.00 22.71 N ATOM 1508 CA ASN A 103 -15.112 -35.635 2.485 1.00 27.40 C ATOM 1509 C ASN A 103 -15.124 -34.876 1.189 1.00 26.20 C ATOM 1510 O ASN A 103 -16.161 -34.820 0.510 1.00 29.08 O ATOM 1511 CB ASN A 103 -15.652 -37.044 2.259 1.00 34.31 C ATOM 1512 CG ASN A 103 -15.263 -37.996 3.350 1.00 38.69 C ATOM 1513 OD1 ASN A 103 -14.106 -38.372 3.491 1.00 41.62 O ATOM 1514 ND2 ASN A 103 -16.246 -38.419 4.124 1.00 48.21 N ATOM 1515 HA ASN A 103 -14.104 -35.736 2.888 1.00 0.00 H ATOM 1516 HB2 ASN A 103 -16.740 -36.997 2.209 1.00 0.00 H ATOM 1517 HB3 ASN A 103 -15.262 -37.419 1.313 1.00 0.00 H ATOM 1518 HD22 ASN A 103 -17.215 -38.074 3.969 1.00 0.00 H ATOM 1519 HD21 ASN A 103 -16.051 -39.097 4.888 1.00 0.00 H ATOM 1520 H ASN A 103 -16.955 -34.751 3.168 1.00 0.00 H ATOM 1521 N LYS A 104 -14.014 -34.237 0.846 1.00 21.86 N ATOM 1522 CA LYS A 104 -13.995 -33.466 -0.371 1.00 24.06 C ATOM 1523 C LYS A 104 -12.629 -33.379 -1.009 1.00 18.44 C ATOM 1524 O LYS A 104 -11.658 -33.777 -0.415 1.00 18.16 O ATOM 1525 CB LYS A 104 -14.516 -32.087 -0.114 1.00 34.51 C ATOM 1526 CG LYS A 104 -14.008 -31.489 1.070 1.00 43.32 C ATOM 1527 CD LYS A 104 -15.097 -30.576 1.593 1.00 48.47 C ATOM 1528 CE LYS A 104 -15.357 -29.465 0.634 1.00 57.70 C ATOM 1529 NZ LYS A 104 -15.777 -28.299 1.385 1.00 65.03 N ATOM 1530 HA LYS A 104 -14.639 -33.993 -1.075 1.00 0.00 H ATOM 1531 HB2 LYS A 104 -14.247 -31.455 -0.960 1.00 0.00 H ATOM 1532 HB3 LYS A 104 -15.602 -32.140 -0.033 1.00 0.00 H ATOM 1533 HG2 LYS A 104 -13.772 -32.256 1.808 1.00 0.00 H ATOM 1534 HG3 LYS A 104 -13.110 -30.914 0.846 1.00 0.00 H ATOM 1535 HD2 LYS A 104 -16.012 -31.152 1.731 1.00 0.00 H ATOM 1536 HD3 LYS A 104 -14.785 -30.158 2.550 1.00 0.00 H ATOM 1537 HE2 LYS A 104 -16.143 -29.757 -0.063 1.00 0.00 H ATOM 1538 HE3 LYS A 104 -14.447 -29.237 0.079 1.00 0.00 H ATOM 1539 HZ1 LYS A 104 -16.644 -28.523 1.914 1.00 0.00 H ATOM 1540 HZ2 LYS A 104 -15.025 -28.027 2.049 1.00 0.00 H ATOM 1541 HZ3 LYS A 104 -15.963 -27.514 0.729 1.00 0.00 H ATOM 1542 H LYS A 104 -13.168 -34.292 1.448 1.00 0.00 H ATOM 1543 N HIS A 105 -12.579 -32.880 -2.244 1.00 17.94 N ATOM 1544 CA HIS A 105 -11.317 -32.669 -2.937 1.00 19.56 C ATOM 1545 C HIS A 105 -10.633 -31.484 -2.285 1.00 20.33 C ATOM 1546 O HIS A 105 -11.306 -30.523 -1.859 1.00 25.10 O ATOM 1547 CB HIS A 105 -11.536 -32.341 -4.435 1.00 18.65 C ATOM 1548 CG HIS A 105 -12.306 -33.389 -5.182 1.00 19.50 C ATOM 1549 ND1 HIS A 105 -13.684 -33.408 -5.272 1.00 22.67 N ATOM 1550 CD2 HIS A 105 -11.879 -34.478 -5.862 1.00 19.73 C ATOM 1551 CE1 HIS A 105 -14.062 -34.465 -5.968 1.00 22.74 C ATOM 1552 NE2 HIS A 105 -12.985 -35.138 -6.321 1.00 24.33 N ATOM 1553 HA HIS A 105 -10.720 -33.578 -2.872 1.00 0.00 H ATOM 1554 HB2 HIS A 105 -12.082 -31.400 -4.504 1.00 0.00 H ATOM 1555 HB3 HIS A 105 -10.560 -32.230 -4.908 1.00 0.00 H ATOM 1556 HD2 HIS A 105 -10.842 -34.775 -6.016 1.00 0.00 H ATOM 1557 HE1 HIS A 105 -15.090 -34.735 -6.209 1.00 0.00 H ATOM 1558 H HIS A 105 -13.467 -32.634 -2.726 1.00 0.00 H ATOM 1559 N ILE A 106 -9.312 -31.533 -2.213 1.00 16.52 N ATOM 1560 CA ILE A 106 -8.557 -30.421 -1.701 1.00 16.10 C ATOM 1561 C ILE A 106 -7.780 -29.764 -2.817 1.00 15.15 C ATOM 1562 O ILE A 106 -7.426 -30.400 -3.813 1.00 17.17 O ATOM 1563 CB ILE A 106 -7.589 -30.846 -0.529 1.00 17.56 C ATOM 1564 CG1 ILE A 106 -6.470 -31.768 -1.023 1.00 21.31 C ATOM 1565 CG2 ILE A 106 -8.373 -31.488 0.580 1.00 21.35 C ATOM 1566 CD1 ILE A 106 -5.313 -31.925 -0.023 1.00 25.14 C ATOM 1567 HA ILE A 106 -9.267 -29.706 -1.286 1.00 0.00 H ATOM 1568 HB ILE A 106 -7.110 -29.946 -0.142 1.00 0.00 H ATOM 1569 HG12 ILE A 106 -6.895 -32.753 -1.216 1.00 0.00 H ATOM 1570 HG13 ILE A 106 -6.070 -31.358 -1.951 1.00 0.00 H ATOM 1571 HD11 ILE A 106 -4.868 -30.949 0.172 1.00 0.00 H ATOM 1572 HD12 ILE A 106 -5.694 -32.345 0.908 1.00 0.00 H ATOM 1573 HD13 ILE A 106 -4.560 -32.592 -0.443 1.00 0.00 H ATOM 1574 HG21 ILE A 106 -9.108 -30.779 0.961 1.00 0.00 H ATOM 1575 HG22 ILE A 106 -8.883 -32.372 0.198 1.00 0.00 H ATOM 1576 HG23 ILE A 106 -7.695 -31.777 1.383 1.00 0.00 H ATOM 1577 H ILE A 106 -8.813 -32.388 -2.531 1.00 0.00 H ATOM 1578 N ILE A 107 -7.546 -28.471 -2.645 1.00 14.94 N ATOM 1579 CA ILE A 107 -6.722 -27.692 -3.546 1.00 14.47 C ATOM 1580 C ILE A 107 -5.615 -27.029 -2.783 1.00 18.16 C ATOM 1581 O ILE A 107 -5.876 -26.308 -1.840 1.00 18.49 O ATOM 1582 CB ILE A 107 -7.564 -26.634 -4.269 1.00 18.30 C ATOM 1583 CG1 ILE A 107 -8.736 -27.357 -4.971 1.00 21.53 C ATOM 1584 CG2 ILE A 107 -6.648 -25.837 -5.204 1.00 18.25 C ATOM 1585 CD1 ILE A 107 -9.817 -26.531 -5.416 1.00 26.13 C ATOM 1586 HA ILE A 107 -6.293 -28.363 -4.291 1.00 0.00 H ATOM 1587 HB ILE A 107 -8.008 -25.905 -3.591 1.00 0.00 H ATOM 1588 HG12 ILE A 107 -8.333 -27.875 -5.842 1.00 0.00 H ATOM 1589 HG13 ILE A 107 -9.142 -28.088 -4.271 1.00 0.00 H ATOM 1590 HD11 ILE A 107 -10.253 -26.013 -4.561 1.00 0.00 H ATOM 1591 HD12 ILE A 107 -9.443 -25.800 -6.133 1.00 0.00 H ATOM 1592 HD13 ILE A 107 -10.576 -27.153 -5.891 1.00 0.00 H ATOM 1593 HG21 ILE A 107 -5.866 -25.354 -4.619 1.00 0.00 H ATOM 1594 HG22 ILE A 107 -6.196 -26.512 -5.930 1.00 0.00 H ATOM 1595 HG23 ILE A 107 -7.233 -25.080 -5.726 1.00 0.00 H ATOM 1596 H ILE A 107 -7.974 -27.994 -1.826 1.00 0.00 H ATOM 1597 N VAL A 108 -4.370 -27.326 -3.173 1.00 17.24 N ATOM 1598 CA VAL A 108 -3.200 -26.769 -2.510 1.00 17.00 C ATOM 1599 C VAL A 108 -2.284 -26.106 -3.507 1.00 19.25 C ATOM 1600 O VAL A 108 -2.307 -26.463 -4.680 1.00 21.32 O ATOM 1601 CB VAL A 108 -2.417 -27.885 -1.760 1.00 20.00 C ATOM 1602 CG1 VAL A 108 -3.281 -28.457 -0.674 1.00 24.75 C ATOM 1603 CG2 VAL A 108 -1.990 -29.002 -2.725 1.00 24.12 C ATOM 1604 HA VAL A 108 -3.546 -26.024 -1.794 1.00 0.00 H ATOM 1605 HB VAL A 108 -1.518 -27.447 -1.326 1.00 0.00 H ATOM 1606 HG11 VAL A 108 -3.551 -27.667 0.027 1.00 0.00 H ATOM 1607 HG12 VAL A 108 -4.184 -28.879 -1.114 1.00 0.00 H ATOM 1608 HG13 VAL A 108 -2.732 -29.239 -0.149 1.00 0.00 H ATOM 1609 HG21 VAL A 108 -2.875 -29.443 -3.183 1.00 0.00 H ATOM 1610 HG22 VAL A 108 -1.348 -28.585 -3.501 1.00 0.00 H ATOM 1611 HG23 VAL A 108 -1.445 -29.768 -2.174 1.00 0.00 H ATOM 1612 H VAL A 108 -4.234 -27.975 -3.974 1.00 0.00 H ATOM 1613 N ALA A 109 -1.524 -25.109 -3.052 1.00 18.94 N ATOM 1614 CA ALA A 109 -0.451 -24.521 -3.846 1.00 19.71 C ATOM 1615 C ALA A 109 0.839 -25.234 -3.498 1.00 17.64 C ATOM 1616 O ALA A 109 1.125 -25.521 -2.339 1.00 19.96 O ATOM 1617 CB ALA A 109 -0.312 -23.032 -3.555 1.00 24.56 C ATOM 1618 HA ALA A 109 -0.679 -24.635 -4.906 1.00 0.00 H ATOM 1619 HB1 ALA A 109 -1.246 -22.527 -3.799 1.00 0.00 H ATOM 1620 HB2 ALA A 109 -0.085 -22.889 -2.498 1.00 0.00 H ATOM 1621 HB3 ALA A 109 0.495 -22.619 -4.160 1.00 0.00 H ATOM 1622 H ALA A 109 -1.703 -24.738 -2.097 1.00 0.00 H ATOM 1623 N CYS A 110 1.614 -25.541 -4.515 1.00 17.72 N ATOM 1624 CA CYS A 110 2.875 -26.242 -4.349 1.00 17.58 C ATOM 1625 C CYS A 110 4.066 -25.396 -4.816 1.00 19.34 C ATOM 1626 O CYS A 110 3.951 -24.563 -5.726 1.00 21.67 O ATOM 1627 CB CYS A 110 2.842 -27.564 -5.136 1.00 19.33 C ATOM 1628 SG CYS A 110 1.495 -28.631 -4.645 1.00 20.48 S ATOM 1629 HA CYS A 110 3.004 -26.442 -3.285 1.00 0.00 H ATOM 1630 HB2 CYS A 110 3.782 -28.091 -4.971 1.00 0.00 H ATOM 1631 HB3 CYS A 110 2.736 -27.335 -6.197 1.00 0.00 H ATOM 1632 H CYS A 110 1.313 -25.272 -5.473 1.00 0.00 H ATOM 1633 N GLU A 111 5.216 -25.612 -4.171 1.00 21.74 N ATOM 1634 CA GLU A 111 6.408 -24.829 -4.449 1.00 25.81 C ATOM 1635 C GLU A 111 7.600 -25.599 -3.962 1.00 26.83 C ATOM 1636 O GLU A 111 7.484 -26.401 -3.039 1.00 24.71 O ATOM 1637 CB GLU A 111 6.396 -23.501 -3.682 1.00 32.70 C ATOM 1638 CG GLU A 111 5.514 -22.407 -4.257 1.00 37.76 C ATOM 1639 CD GLU A 111 5.520 -21.157 -3.385 1.00 37.27 C ATOM 1640 OE1 GLU A 111 6.197 -21.165 -2.329 1.00 39.19 O ATOM 1641 OE2 GLU A 111 4.853 -20.171 -3.749 1.00 37.33 O ATOM 1642 HA GLU A 111 6.444 -24.633 -5.521 1.00 0.00 H ATOM 1643 HB2 GLU A 111 6.055 -23.705 -2.667 1.00 0.00 H ATOM 1644 HB3 GLU A 111 7.418 -23.124 -3.652 1.00 0.00 H ATOM 1645 HG2 GLU A 111 5.878 -22.146 -5.251 1.00 0.00 H ATOM 1646 HG3 GLU A 111 4.493 -22.780 -4.332 1.00 0.00 H ATOM 1647 H GLU A 111 5.259 -26.361 -3.451 1.00 0.00 H ATOM 1648 N GLY A 112 8.749 -25.302 -4.559 1.00 30.19 N ATOM 1649 CA GLY A 112 10.030 -25.733 -4.046 1.00 35.19 C ATOM 1650 C GLY A 112 10.578 -27.011 -4.649 1.00 34.04 C ATOM 1651 O GLY A 112 10.018 -27.580 -5.589 1.00 32.45 O ATOM 1652 HA3 GLY A 112 9.928 -25.885 -2.972 1.00 0.00 H ATOM 1653 HA2 GLY A 112 10.751 -24.937 -4.232 1.00 0.00 H ATOM 1654 H GLY A 112 8.726 -24.736 -5.431 1.00 0.00 H ATOM 1655 N ASN A 113 11.692 -27.446 -4.069 1.00 37.42 N ATOM 1656 CA ASN A 113 12.323 -28.719 -4.370 1.00 44.28 C ATOM 1657 C ASN A 113 12.749 -29.378 -3.048 1.00 43.31 C ATOM 1658 O ASN A 113 13.663 -28.881 -2.373 1.00 43.81 O ATOM 1659 CB ASN A 113 13.554 -28.482 -5.255 1.00 53.47 C ATOM 1660 CG ASN A 113 14.063 -29.762 -5.887 1.00 56.03 C ATOM 1661 OD1 ASN A 113 13.739 -30.866 -5.437 1.00 55.90 O ATOM 1662 ND2 ASN A 113 14.860 -29.627 -6.935 1.00 65.53 N ATOM 1663 HA ASN A 113 11.627 -29.369 -4.900 1.00 0.00 H ATOM 1664 HB2 ASN A 113 13.287 -27.782 -6.047 1.00 0.00 H ATOM 1665 HB3 ASN A 113 14.348 -28.053 -4.644 1.00 0.00 H ATOM 1666 HD22 ASN A 113 15.108 -28.678 -7.281 1.00 0.00 H ATOM 1667 HD21 ASN A 113 15.239 -30.470 -7.412 1.00 0.00 H ATOM 1668 H ASN A 113 12.140 -26.837 -3.355 1.00 0.00 H ATOM 1669 N PRO A 114 12.071 -30.473 -2.653 1.00 40.95 N ATOM 1670 CA PRO A 114 10.984 -31.120 -3.395 1.00 38.29 C ATOM 1671 C PRO A 114 9.765 -30.209 -3.546 1.00 31.09 C ATOM 1672 O PRO A 114 9.599 -29.254 -2.796 1.00 31.37 O ATOM 1673 CB PRO A 114 10.626 -32.340 -2.534 1.00 42.66 C ATOM 1674 CG PRO A 114 11.532 -32.289 -1.326 1.00 46.92 C ATOM 1675 CD PRO A 114 12.174 -30.968 -1.273 1.00 45.33 C ATOM 1676 HA PRO A 114 11.287 -31.374 -4.411 1.00 0.00 H ATOM 1677 HD3 PRO A 114 11.649 -30.308 -0.583 1.00 0.00 H ATOM 1678 HD2 PRO A 114 13.217 -31.055 -0.968 1.00 0.00 H ATOM 1679 HG3 PRO A 114 12.294 -33.064 -1.406 1.00 0.00 H ATOM 1680 HG2 PRO A 114 10.946 -32.449 -0.421 1.00 0.00 H ATOM 1681 HB2 PRO A 114 9.582 -32.291 -2.225 1.00 0.00 H ATOM 1682 HB3 PRO A 114 10.795 -33.260 -3.094 1.00 0.00 H ATOM 1683 N TYR A 115 8.931 -30.519 -4.523 1.00 28.96 N ATOM 1684 CA TYR A 115 7.749 -29.720 -4.849 1.00 25.21 C ATOM 1685 C TYR A 115 6.621 -30.207 -3.959 1.00 21.82 C ATOM 1686 O TYR A 115 6.029 -31.251 -4.225 1.00 22.55 O ATOM 1687 CB TYR A 115 7.406 -29.986 -6.302 1.00 26.78 C ATOM 1688 CG TYR A 115 6.473 -29.002 -6.974 1.00 21.85 C ATOM 1689 CD1 TYR A 115 6.768 -27.639 -7.031 1.00 26.28 C ATOM 1690 CD2 TYR A 115 5.322 -29.454 -7.624 1.00 24.63 C ATOM 1691 CE1 TYR A 115 5.910 -26.744 -7.686 1.00 27.68 C ATOM 1692 CE2 TYR A 115 4.473 -28.571 -8.283 1.00 26.35 C ATOM 1693 CZ TYR A 115 4.768 -27.224 -8.314 1.00 26.06 C ATOM 1694 OH TYR A 115 3.927 -26.348 -8.989 1.00 27.91 O ATOM 1695 HA TYR A 115 7.915 -28.653 -4.697 1.00 0.00 H ATOM 1696 HB3 TYR A 115 6.942 -30.971 -6.357 1.00 0.00 H ATOM 1697 HB2 TYR A 115 8.339 -29.994 -6.865 1.00 0.00 H ATOM 1698 HD2 TYR A 115 5.085 -30.518 -7.615 1.00 0.00 H ATOM 1699 HE2 TYR A 115 3.575 -28.944 -8.775 1.00 0.00 H ATOM 1700 HE1 TYR A 115 6.138 -25.678 -7.702 1.00 0.00 H ATOM 1701 HD1 TYR A 115 7.677 -27.265 -6.560 1.00 0.00 H ATOM 1702 HH TYR A 115 4.282 -25.427 -8.913 1.00 0.00 H ATOM 1703 H TYR A 115 9.124 -31.371 -5.087 1.00 0.00 H ATOM 1704 N VAL A 116 6.316 -29.434 -2.916 1.00 20.32 N ATOM 1705 CA VAL A 116 5.395 -29.881 -1.889 1.00 20.51 C ATOM 1706 C VAL A 116 4.380 -28.795 -1.549 1.00 17.50 C ATOM 1707 O VAL A 116 4.563 -27.641 -1.951 1.00 18.80 O ATOM 1708 CB VAL A 116 6.163 -30.255 -0.607 1.00 23.74 C ATOM 1709 CG1 VAL A 116 7.034 -31.490 -0.859 1.00 31.21 C ATOM 1710 CG2 VAL A 116 6.999 -29.077 -0.158 1.00 28.67 C ATOM 1711 HA VAL A 116 4.870 -30.753 -2.278 1.00 0.00 H ATOM 1712 HB VAL A 116 5.457 -30.499 0.187 1.00 0.00 H ATOM 1713 HG11 VAL A 116 6.400 -32.326 -1.155 1.00 0.00 H ATOM 1714 HG12 VAL A 116 7.747 -31.274 -1.655 1.00 0.00 H ATOM 1715 HG13 VAL A 116 7.572 -31.746 0.054 1.00 0.00 H ATOM 1716 HG21 VAL A 116 7.708 -28.816 -0.944 1.00 0.00 H ATOM 1717 HG22 VAL A 116 6.348 -28.226 0.043 1.00 0.00 H ATOM 1718 HG23 VAL A 116 7.542 -29.343 0.749 1.00 0.00 H ATOM 1719 H VAL A 116 6.748 -28.491 -2.838 1.00 0.00 H ATOM 1720 N PRO A 117 3.307 -29.158 -0.812 1.00 18.27 N ATOM 1721 CA PRO A 117 2.273 -28.166 -0.506 1.00 17.31 C ATOM 1722 C PRO A 117 2.765 -27.073 0.453 1.00 15.65 C ATOM 1723 O PRO A 117 3.482 -27.344 1.420 1.00 16.48 O ATOM 1724 CB PRO A 117 1.154 -28.998 0.144 1.00 18.46 C ATOM 1725 CG PRO A 117 1.362 -30.383 -0.328 1.00 22.87 C ATOM 1726 CD PRO A 117 2.841 -30.529 -0.526 1.00 18.63 C ATOM 1727 HA PRO A 117 1.955 -27.627 -1.399 1.00 0.00 H ATOM 1728 HD3 PRO A 117 3.315 -30.918 0.375 1.00 0.00 H ATOM 1729 HD2 PRO A 117 3.055 -31.193 -1.364 1.00 0.00 H ATOM 1730 HG3 PRO A 117 0.835 -30.547 -1.268 1.00 0.00 H ATOM 1731 HG2 PRO A 117 1.006 -31.095 0.416 1.00 0.00 H ATOM 1732 HB2 PRO A 117 1.227 -28.951 1.231 1.00 0.00 H ATOM 1733 HB3 PRO A 117 0.176 -28.632 -0.169 1.00 0.00 H ATOM 1734 N VAL A 118 2.409 -25.824 0.164 1.00 15.71 N ATOM 1735 CA VAL A 118 2.799 -24.722 1.025 1.00 17.33 C ATOM 1736 C VAL A 118 1.635 -23.830 1.413 1.00 17.34 C ATOM 1737 O VAL A 118 1.794 -22.960 2.266 1.00 21.77 O ATOM 1738 CB VAL A 118 3.935 -23.859 0.410 1.00 20.46 C ATOM 1739 CG1 VAL A 118 5.200 -24.693 0.176 1.00 22.20 C ATOM 1740 CG2 VAL A 118 3.488 -23.176 -0.871 1.00 25.41 C ATOM 1741 HA VAL A 118 3.176 -25.197 1.931 1.00 0.00 H ATOM 1742 HB VAL A 118 4.176 -23.078 1.131 1.00 0.00 H ATOM 1743 HG11 VAL A 118 5.547 -25.099 1.126 1.00 0.00 H ATOM 1744 HG12 VAL A 118 4.973 -25.510 -0.509 1.00 0.00 H ATOM 1745 HG13 VAL A 118 5.976 -24.060 -0.255 1.00 0.00 H ATOM 1746 HG21 VAL A 118 3.195 -23.931 -1.601 1.00 0.00 H ATOM 1747 HG22 VAL A 118 2.639 -22.527 -0.658 1.00 0.00 H ATOM 1748 HG23 VAL A 118 4.310 -22.582 -1.271 1.00 0.00 H ATOM 1749 H VAL A 118 1.845 -25.635 -0.689 1.00 0.00 H ATOM 1750 N HIS A 119 0.483 -24.017 0.767 1.00 18.89 N ATOM 1751 CA HIS A 119 -0.725 -23.232 1.082 1.00 20.97 C ATOM 1752 C HIS A 119 -1.924 -24.110 0.817 1.00 17.90 C ATOM 1753 O HIS A 119 -1.931 -24.884 -0.135 1.00 20.28 O ATOM 1754 CB HIS A 119 -0.721 -21.943 0.245 1.00 26.90 C ATOM 1755 CG HIS A 119 -2.068 -21.324 0.023 1.00 27.45 C ATOM 1756 ND1 HIS A 119 -2.700 -20.561 0.978 1.00 27.77 N ATOM 1757 CD2 HIS A 119 -2.875 -21.306 -1.066 1.00 28.74 C ATOM 1758 CE1 HIS A 119 -3.850 -20.125 0.506 1.00 27.12 C ATOM 1759 NE2 HIS A 119 -3.983 -20.567 -0.734 1.00 28.29 N ATOM 1760 HA HIS A 119 -0.756 -22.924 2.127 1.00 0.00 H ATOM 1761 HB2 HIS A 119 -0.093 -21.212 0.754 1.00 0.00 H ATOM 1762 HB3 HIS A 119 -0.291 -22.174 -0.729 1.00 0.00 H ATOM 1763 HD2 HIS A 119 -2.681 -21.787 -2.024 1.00 0.00 H ATOM 1764 HE1 HIS A 119 -4.568 -19.507 1.044 1.00 0.00 H ATOM 1765 H HIS A 119 0.435 -24.738 0.019 1.00 0.00 H ATOM 1766 N PHE A 120 -2.931 -24.003 1.674 1.00 18.33 N ATOM 1767 CA PHE A 120 -4.202 -24.683 1.480 1.00 19.72 C ATOM 1768 C PHE A 120 -5.160 -23.680 0.862 1.00 18.90 C ATOM 1769 O PHE A 120 -5.482 -22.687 1.484 1.00 23.45 O ATOM 1770 CB PHE A 120 -4.770 -25.173 2.813 1.00 20.80 C ATOM 1771 CG PHE A 120 -5.935 -26.115 2.658 1.00 20.02 C ATOM 1772 CD1 PHE A 120 -7.228 -25.641 2.495 1.00 21.84 C ATOM 1773 CD2 PHE A 120 -5.718 -27.485 2.611 1.00 23.62 C ATOM 1774 CE1 PHE A 120 -8.280 -26.521 2.325 1.00 25.32 C ATOM 1775 CE2 PHE A 120 -6.759 -28.352 2.443 1.00 24.21 C ATOM 1776 CZ PHE A 120 -8.047 -27.866 2.309 1.00 25.25 C ATOM 1777 HA PHE A 120 -4.064 -25.552 0.837 1.00 0.00 H ATOM 1778 HB2 PHE A 120 -3.979 -25.689 3.357 1.00 0.00 H ATOM 1779 HB3 PHE A 120 -5.100 -24.307 3.387 1.00 0.00 H ATOM 1780 HD2 PHE A 120 -4.704 -27.873 2.709 1.00 0.00 H ATOM 1781 HE2 PHE A 120 -6.575 -29.426 2.414 1.00 0.00 H ATOM 1782 HZ PHE A 120 -8.879 -28.560 2.190 1.00 0.00 H ATOM 1783 HE1 PHE A 120 -9.295 -26.142 2.204 1.00 0.00 H ATOM 1784 HD1 PHE A 120 -7.416 -24.567 2.501 1.00 0.00 H ATOM 1785 H PHE A 120 -2.807 -23.409 2.519 1.00 0.00 H ATOM 1786 N ASP A 121 -5.601 -23.907 -0.361 1.00 20.16 N ATOM 1787 CA ASP A 121 -6.430 -22.913 -1.040 1.00 21.47 C ATOM 1788 C ASP A 121 -7.944 -23.055 -0.781 1.00 21.42 C ATOM 1789 O ASP A 121 -8.646 -22.073 -0.494 1.00 26.86 O ATOM 1790 CB ASP A 121 -6.144 -22.950 -2.551 1.00 23.82 C ATOM 1791 CG ASP A 121 -6.519 -21.679 -3.215 1.00 27.03 C ATOM 1792 OD1 ASP A 121 -5.988 -20.644 -2.773 1.00 31.22 O ATOM 1793 OD2 ASP A 121 -7.349 -21.696 -4.135 1.00 28.23 O ATOM 1794 HA ASP A 121 -6.153 -21.948 -0.616 1.00 0.00 H ATOM 1795 HB2 ASP A 121 -5.080 -23.128 -2.704 1.00 0.00 H ATOM 1796 HB3 ASP A 121 -6.715 -23.764 -2.998 1.00 0.00 H ATOM 1797 H ASP A 121 -5.358 -24.796 -0.843 1.00 0.00 H ATOM 1798 N ALA A 122 -8.441 -24.280 -0.848 1.00 20.31 N ATOM 1799 CA ALA A 122 -9.871 -24.530 -0.743 1.00 22.11 C ATOM 1800 C ALA A 122 -10.117 -26.017 -0.781 1.00 21.16 C ATOM 1801 O ALA A 122 -9.220 -26.804 -1.001 1.00 22.27 O ATOM 1802 CB ALA A 122 -10.645 -23.858 -1.939 1.00 28.84 C ATOM 1803 HA ALA A 122 -10.230 -24.105 0.195 1.00 0.00 H ATOM 1804 HB1 ALA A 122 -10.473 -22.782 -1.922 1.00 0.00 H ATOM 1805 HB2 ALA A 122 -10.284 -24.270 -2.881 1.00 0.00 H ATOM 1806 HB3 ALA A 122 -11.712 -24.059 -1.838 1.00 0.00 H ATOM 1807 H ALA A 122 -7.794 -25.084 -0.979 1.00 0.00 H ATOM 1808 N SER A 123 -11.363 -26.384 -0.559 1.00 26.41 N ATOM 1809 CA SER A 123 -11.797 -27.724 -0.762 1.00 24.75 C ATOM 1810 C SER A 123 -13.058 -27.602 -1.601 1.00 20.93 C ATOM 1811 O SER A 123 -13.774 -26.576 -1.547 1.00 25.76 O ATOM 1812 CB SER A 123 -12.077 -28.394 0.570 1.00 30.08 C ATOM 1813 OG SER A 123 -13.224 -27.827 1.174 1.00 36.14 O ATOM 1814 HA SER A 123 -11.046 -28.338 -1.258 1.00 0.00 H ATOM 1815 HB2 SER A 123 -11.219 -28.258 1.229 1.00 0.00 H ATOM 1816 HB3 SER A 123 -12.244 -29.459 0.409 1.00 0.00 H ATOM 1817 HG SER A 123 -13.073 -26.860 1.324 1.00 0.00 H ATOM 1818 H SER A 123 -12.048 -25.675 -0.226 1.00 0.00 H ATOM 1819 N VAL A 124 -13.340 -28.655 -2.362 1.00 18.68 N ATOM 1820 CA VAL A 124 -14.556 -28.737 -3.152 1.00 24.15 C ATOM 1821 C VAL A 124 -15.168 -30.132 -3.030 1.00 25.65 C ATOM 1822 O VAL A 124 -16.279 -30.340 -2.485 1.00 28.65 O ATOM 1823 CB VAL A 124 -14.346 -28.268 -4.619 1.00 27.44 C ATOM 1824 CG1 VAL A 124 -13.080 -28.843 -5.224 1.00 28.65 C ATOM 1825 CG2 VAL A 124 -15.604 -28.556 -5.452 1.00 33.74 C ATOM 1826 HA VAL A 124 -15.282 -28.033 -2.746 1.00 0.00 H ATOM 1827 OXT VAL A 124 -14.547 -31.106 -3.444 1.00 24.86 O ATOM 1828 HB VAL A 124 -14.198 -27.188 -4.622 1.00 0.00 H ATOM 1829 HG11 VAL A 124 -12.220 -28.521 -4.637 1.00 0.00 H ATOM 1830 HG12 VAL A 124 -13.138 -29.931 -5.219 1.00 0.00 H ATOM 1831 HG13 VAL A 124 -12.975 -28.488 -6.249 1.00 0.00 H ATOM 1832 HG21 VAL A 124 -15.806 -29.627 -5.444 1.00 0.00 H ATOM 1833 HG22 VAL A 124 -16.452 -28.022 -5.024 1.00 0.00 H ATOM 1834 HG23 VAL A 124 -15.443 -28.223 -6.477 1.00 0.00 H ATOM 1835 H VAL A 124 -12.667 -29.447 -2.393 1.00 0.00 H TER 1836 VAL A 124 HETATM 1837 O HOH 1 9.324 -23.112 -0.807 1.00 59.53 O HETATM 1838 O HOH 2 0.970 -36.410 9.198 1.00 28.35 O HETATM 1839 O HOH 3 -22.296 -32.010 7.960 1.00 57.74 O HETATM 1840 O HOH 4 -13.529 -39.726 -4.965 1.00 16.55 O HETATM 1841 O HOH 5 -15.998 -37.902 6.755 1.00 40.42 O HETATM 1842 O HOH 6 -16.932 -23.969 7.742 1.00 42.83 O HETATM 1843 O HOH 7 10.829 -28.222 5.447 1.00 18.24 O HETATM 1844 O HOH 8 -18.368 -27.640 16.662 1.00 22.06 O HETATM 1845 O HOH 9 4.231 -29.331 3.159 1.00 18.58 O HETATM 1846 O HOH 10 -16.764 -25.438 10.538 1.00 22.92 O HETATM 1847 O HOH 11 10.869 -25.201 9.821 1.00 23.54 O HETATM 1848 O HOH 12 -14.500 -27.111 18.173 1.00 21.89 O HETATM 1849 O HOH 13 -4.157 -41.336 3.310 1.00 24.77 O HETATM 1850 O HOH 14 -5.258 -30.898 -17.543 1.00 26.00 O HETATM 1851 O HOH 15 -6.267 -37.855 -5.058 1.00 22.88 O HETATM 1852 O HOH 16 -3.256 -38.353 -3.293 1.00 21.66 O HETATM 1853 O HOH 17 6.181 -28.240 10.939 1.00 39.30 O HETATM 1854 O HOH 18 3.100 -40.581 4.744 1.00 30.00 O HETATM 1855 O HOH 19 -9.910 -13.757 14.461 1.00 38.14 O HETATM 1856 O HOH 20 0.085 -23.348 5.456 1.00 28.55 O HETATM 1857 O HOH 21 6.919 -26.511 12.364 1.00 30.28 O HETATM 1858 O HOH 22 1.645 -39.483 7.511 1.00 30.66 O HETATM 1859 O HOH 23 9.062 -30.296 7.304 1.00 31.40 O HETATM 1860 O HOH 24 0.492 -20.005 13.125 1.00 38.63 O HETATM 1861 O HOH 25 8.766 -25.734 -0.479 1.00 32.77 O HETATM 1862 O HOH 26 2.963 -22.423 4.451 1.00 33.01 O HETATM 1863 O HOH 27 -0.246 -35.925 11.254 1.00 31.11 O HETATM 1864 O HOH 28 -9.182 -32.772 -18.869 1.00 31.82 O HETATM 1865 O HOH 29 -2.960 -30.952 -14.915 1.00 33.60 O HETATM 1866 O HOH 30 3.829 -38.712 -2.371 1.00 40.23 O HETATM 1867 O HOH 31 -2.344 -22.021 20.534 1.00 33.66 O HETATM 1868 O HOH 32 -8.560 -40.327 -0.819 1.00 41.09 O HETATM 1869 O HOH 33 9.620 -33.092 -5.965 1.00 47.00 O HETATM 1870 O HOH 34 -20.231 -31.763 5.979 1.00 43.80 O HETATM 1871 O HOH 35 -5.196 -28.191 -15.988 1.00 37.09 O HETATM 1872 O HOH 36 10.574 -27.972 -0.523 1.00 38.50 O HETATM 1873 O HOH 37 -6.082 -35.235 16.583 1.00 44.13 O HETATM 1874 O HOH 38 -0.598 -38.594 -8.236 1.00 37.73 O HETATM 1875 O HOH 39 4.021 -35.027 -5.893 1.00 39.14 O HETATM 1876 O HOH 40 -5.477 -28.824 23.030 1.00 41.31 O HETATM 1877 O HOH 41 -5.915 -40.135 -0.117 1.00 37.46 O HETATM 1878 O HOH 42 6.567 -38.137 2.709 1.00 49.67 O HETATM 1879 O HOH 43 -24.931 -25.679 11.774 1.00 29.76 O HETATM 1880 O HOH 44 8.482 -23.680 -7.267 1.00 39.56 O HETATM 1881 O HOH 45 2.558 -20.205 -3.681 1.00 39.58 O HETATM 1882 O HOH 46 -5.824 -39.635 -2.916 1.00 33.66 O HETATM 1883 O HOH 47 0.128 -43.403 2.224 1.00 47.17 O HETATM 1884 O HOH 48 4.968 -19.447 0.567 1.00 50.88 O HETATM 1885 O HOH 49 -12.713 -39.698 0.935 1.00 38.93 O HETATM 1886 O HOH 50 -10.517 -40.827 2.731 1.00 71.29 O HETATM 1887 O HOH 51 2.089 -18.605 -11.194 1.00 55.33 O HETATM 1888 O HOH 52 5.695 -31.597 3.178 1.00 23.72 O HETATM 1889 O HOH 53 9.411 -24.878 2.284 1.00 29.50 O HETATM 1890 O HOH 54 -16.668 -33.052 -3.347 1.00 36.50 O HETATM 1891 O HOH 55 6.016 -39.736 4.673 1.00 63.27 O HETATM 1892 O HOH 56 14.657 -22.245 8.220 1.00 51.58 O HETATM 1893 O HOH 57 -0.005 -25.787 22.825 1.00 58.26 O HETATM 1894 O HOH 58 10.465 -21.451 3.367 1.00 33.40 O HETATM 1895 O HOH 59 -1.588 -31.442 17.812 1.00 38.46 O HETATM 1896 O HOH 60 -20.611 -28.403 13.466 1.00 24.82 O HETATM 1897 O HOH 61 -9.088 -23.108 20.756 1.00 45.37 O HETATM 1898 O HOH 62 -8.414 -12.708 17.285 1.00 40.83 O HETATM 1899 O HOH 63 9.921 -25.600 12.215 1.00 34.35 O HETATM 1900 O HOH 64 -3.000 -42.057 7.627 1.00 58.23 O HETATM 1901 O HOH 65 -4.902 -31.962 20.354 1.00 50.70 O HETATM 1902 O HOH 66 5.075 -37.132 -4.126 1.00 55.98 O HETATM 1903 O HOH 67 0.923 -41.809 -1.999 1.00 55.15 O HETATM 1904 O HOH 68 -12.562 -35.727 17.562 1.00 40.76 O HETATM 1905 O HOH 69 -8.949 -32.914 -9.857 1.00 34.78 O HETATM 1906 O HOH 70 -4.818 -18.253 -3.587 1.00 36.88 O HETATM 1907 O HOH 71 -9.745 -42.411 14.178 1.00 43.38 O HETATM 1908 O HOH 72 3.670 -31.089 -10.989 1.00 46.75 O HETATM 1909 O HOH 73 10.461 -29.556 2.063 1.00 38.53 O HETATM 1910 O HOH 74 0.106 -41.760 8.279 1.00 43.60 O HETATM 1911 O HOH 75 -10.579 -30.201 -16.819 1.00 47.89 O HETATM 1912 O HOH 76 -19.132 -21.835 20.394 1.00 51.15 O HETATM 1913 O HOH 77 -4.825 -38.215 17.958 1.00 50.55 O HETATM 1914 O HOH 78 -1.187 -27.391 -16.909 1.00 51.03 O HETATM 1915 O HOH 79 -17.352 -24.537 19.756 1.00 56.24 O HETATM 1916 O HOH 80 16.468 -30.090 -2.550 1.00 54.89 O HETATM 1917 O HOH 81 13.158 -23.635 10.355 1.00 33.36 O HETATM 1918 O HOH 82 -1.482 -33.544 16.931 1.00 34.36 O HETATM 1919 O HOH 83 -22.858 -28.102 9.745 1.00 39.02 O HETATM 1920 O HOH 84 -0.219 -32.538 -13.202 1.00 45.46 O HETATM 1921 O HOH 85 8.513 -18.364 11.411 1.00 45.46 O HETATM 1922 O HOH 86 5.135 -24.069 -9.993 1.00 39.72 O HETATM 1923 O HOH 87 -2.041 -34.948 15.228 1.00 35.75 O HETATM 1924 O HOH 88 -7.598 -42.070 1.693 1.00 46.57 O HETATM 1925 O HOH 89 7.043 -34.921 -2.699 1.00 54.24 O HETATM 1926 O HOH 90 6.004 -33.459 -6.577 1.00 64.03 O HETATM 1927 O HOH 91 4.915 -33.531 -3.428 1.00 55.17 O HETATM 1928 O HOH 92 -5.851 -42.828 10.655 1.00 55.87 O HETATM 1929 O HOH 93 -1.905 -19.383 -3.377 1.00 48.61 O HETATM 1930 O HOH 94 -10.922 -33.061 -8.577 1.00 46.95 O HETATM 1931 O HOH 95 -18.969 -34.686 2.835 1.00 39.07 O HETATM 1932 O HOH 96 -14.218 -37.619 -7.119 1.00 30.78 O HETATM 1933 O HOH 97 -5.315 -41.016 8.171 1.00 65.95 O HETATM 1934 O HOH 98 -8.803 -40.954 6.511 1.00 53.86 O HETATM 1935 O HOH 99 -6.641 -44.428 2.291 1.00 54.05 O HETATM 1936 O HOH 100 -4.827 -43.150 5.412 1.00 63.15 O HETATM 1937 O HOH 101 -16.723 -23.618 21.891 1.00 59.70 O HETATM 1938 O HOH 102 -5.692 -16.101 8.665 1.00 49.07 O HETATM 1939 O HOH 103 0.029 -19.434 -5.029 1.00 44.25 O HETATM 1940 O HOH 104 -16.533 -39.081 -1.046 1.00 53.36 O HETATM 1941 O HOH 105 -12.140 -26.593 3.371 1.00 41.13 O HETATM 1942 O HOH 106 -12.599 -23.800 0.895 1.00 49.17 O HETATM 1943 O HOH 107 -15.523 -14.055 16.275 1.00 53.35 O HETATM 1944 O HOH 108 -15.843 -17.898 23.374 1.00 62.45 O HETATM 1945 O HOH 109 6.757 -19.396 7.630 1.00 66.15 O HETATM 1946 O HOH 110 -8.500 -36.150 17.977 1.00 58.27 O HETATM 1947 O HOH 111 -1.897 -18.326 13.350 1.00 61.10 O HETATM 1948 O HOH 112 -7.846 -17.839 8.161 1.00 42.50 O HETATM 1949 O HOH 113 -4.457 -16.898 1.420 1.00 54.82 O HETATM 1950 O HOH 114 -13.778 -25.155 2.412 1.00 60.30 O HETATM 1951 O HOH 115 -19.591 -30.366 23.529 1.00 57.51 O HETATM 1952 O HOH 116 -15.342 -29.837 26.979 1.00 58.06 O HETATM 1953 O HOH 117 -1.318 -23.558 23.720 1.00 70.18 O HETATM 1954 O HOH 118 -1.396 -17.696 16.494 1.00 63.23 O HETATM 1955 O HOH 119 -6.441 -30.750 -22.471 1.00 55.34 O HETATM 1956 O HOH 120 7.526 -28.876 -11.144 1.00 51.86 O HETATM 1957 O HOH 121 2.392 -28.739 -13.243 1.00 60.78 O HETATM 1958 O HOH 122 0.349 -19.435 -1.930 1.00 55.67 O HETATM 1959 O HOH 123 -7.455 -21.185 22.409 1.00 66.97 O HETATM 1960 O HOH 124 -18.870 -32.683 0.000 1.00 42.84 O HETATM 1961 O HOH 125 11.244 -23.069 1.562 1.00 57.92 O HETATM 1962 O HOH 126 12.778 -21.391 1.657 1.00 55.21 O HETATM 1963 O HOH 127 11.206 -27.313 3.006 1.00 59.37 O HETATM 1964 O HOH 128 -7.740 -30.487 -19.663 1.00 54.99 O HETATM 1965 O HOH 129 -11.362 -13.419 17.510 1.00 55.70 O HETATM 1966 P T A 3 -2.291 -20.977 4.644 1.00 0.20 P HETATM 1967 OP1 T A 3 -1.968 -20.120 3.458 1.00 -0.55 O HETATM 1968 OP2 T A 3 -2.411 -22.407 4.193 1.00 -0.55 O HETATM 1969 OP3 T A 3 -1.109 -20.812 5.630 1.00 -0.55 O HETATM 1970 O3' T A 3 -3.560 -20.483 5.390 1.00 -0.27 O HETATM 1971 C3' T A 3 -4.689 -20.124 4.711 1.00 0.12 C HETATM 1972 C4' T A 3 -5.677 -19.022 5.060 1.00 0.12 C HETATM 1973 C5' T A 3 -5.474 -17.575 4.772 1.00 0.07 C HETATM 1974 O5' T A 3 -4.215 -17.068 5.034 1.00 -0.39 O HETATM 1975 H1 T A 3 -4.196 -16.143 4.816 1.00 0.21 H HETATM 1976 H2 T A 3 -5.685 -17.413 3.705 1.00 0.06 H HETATM 1977 H3 T A 3 -6.196 -17.008 5.378 1.00 0.06 H HETATM 1978 O4' T A 3 -6.952 -19.676 5.351 1.00 -0.34 O HETATM 1979 C1' T A 3 -6.823 -21.025 4.797 1.00 0.18 C HETATM 1980 C2' T A 3 -5.559 -21.066 3.954 1.00 0.04 C HETATM 1981 H6 T A 3 -5.128 -22.077 3.920 1.00 0.03 H HETATM 1982 H7 T A 3 -5.744 -20.712 2.929 1.00 0.03 H HETATM 1983 N1 T A 3 -8.035 -21.710 4.495 1.00 -0.17 N HETATM 1984 C2 T A 3 -8.198 -23.012 5.002 1.00 0.33 C HETATM 1985 O2 T A 3 -7.305 -23.513 5.702 1.00 -0.38 O HETATM 1986 N3 T A 3 -9.351 -23.704 4.632 1.00 -0.19 N HETATM 1987 C4 T A 3 -10.242 -23.142 3.824 1.00 0.19 C HETATM 1988 O4 T A 3 -11.385 -23.803 3.443 1.00 -0.41 O HETATM 1989 C5 T A 3 -10.052 -21.793 3.307 1.00 0.02 C HETATM 1990 C5M T A 3 -11.090 -21.181 2.405 1.00 -0.04 C HETATM 1991 H10 T A 3 -10.775 -20.167 2.119 1.00 0.03 H HETATM 1992 H11 T A 3 -12.052 -21.130 2.935 1.00 0.03 H HETATM 1993 H12 T A 3 -11.201 -21.799 1.502 1.00 0.03 H HETATM 1994 C6 T A 3 -8.935 -21.124 3.659 1.00 0.05 C HETATM 1995 H13 T A 3 -8.754 -20.121 3.276 1.00 0.10 H HETATM 1996 H9 T A 3 -9.508 -24.629 4.978 1.00 0.23 H HETATM 1997 H8 T A 3 -6.505 -21.611 5.672 1.00 0.10 H HETATM 1998 H4 T A 3 -5.365 -18.908 6.109 1.00 0.06 H HETATM 1999 H5 T A 3 -4.158 -19.637 3.880 1.00 0.07 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 357 356 1231 CONECT 594 593 1394 CONECT 862 861 1628 CONECT 962 961 1053 CONECT 1053 962 1052 CONECT 1231 357 1230 CONECT 1394 594 1393 CONECT 1628 862 1627 CONECT 1966 1967 1968 1969 1970 CONECT 1967 1966 CONECT 1968 1966 CONECT 1969 1966 CONECT 1970 1966 1971 CONECT 1971 1970 1972 1980 1999 CONECT 1972 1971 1973 1978 1998 CONECT 1973 1972 1974 1976 1977 CONECT 1974 1973 1975 CONECT 1975 1974 CONECT 1976 1973 CONECT 1977 1973 CONECT 1978 1972 1979 CONECT 1979 1978 1980 1983 1997 CONECT 1980 1971 1979 1981 1982 CONECT 1981 1980 CONECT 1982 1980 CONECT 1983 1979 1984 1994 CONECT 1984 1983 1985 1986 CONECT 1985 1984 CONECT 1986 1984 1987 1996 CONECT 1987 1986 1988 1989 CONECT 1988 1987 CONECT 1989 1987 1990 1994 CONECT 1990 1989 1991 1992 1993 CONECT 1991 1990 CONECT 1992 1990 CONECT 1993 1990 CONECT 1994 1983 1989 1995 CONECT 1995 1994 CONECT 1996 1986 CONECT 1997 1979 CONECT 1998 1972 CONECT 1999 1971 MASTER 0 0 0 0 0 0 0 0 1998 1 46 10 END
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Related entries of code: 3lxo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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RCSB PDB
PDBbind
124aa, >1AFK_1|Chains... at 99%
1afl
RCSB PDB
PDBbind
124aa, >1AFL_1|Chains... at 99%
1dfj
RCSB PDB
PDBbind
124aa, >1DFJ_1|Chain... at 99%
1j7z
RCSB PDB
PDBbind
104aa, >1J7Z_2|Chain... at 99%
1j80
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PDBbind
104aa, >1J80_2|Chain... at 99%
1j81
RCSB PDB
PDBbind
104aa, >1J81_2|Chain... at 99%
1jn4
RCSB PDB
PDBbind
124aa, >1JN4_1|Chains... at 99%
1jvu
RCSB PDB
PDBbind
124aa, >1JVU_1|Chains... at 99%
1o0f
RCSB PDB
PDBbind
124aa, >1O0F_1|Chains... at 99%
1o0h
RCSB PDB
PDBbind
124aa, >1O0H_1|Chains... at 99%
1o0m
RCSB PDB
PDBbind
124aa, >1O0M_1|Chains... at 99%
1o0n
RCSB PDB
PDBbind
124aa, >1O0N_1|Chains... at 99%
1o0o
RCSB PDB
PDBbind
124aa, >1O0O_1|Chains... at 99%
1qhc
RCSB PDB
PDBbind
124aa, >1QHC_1|Chains... at 99%
1rnm
RCSB PDB
PDBbind
124aa, >1RNM_1|Chain... at 99%
1rpf
RCSB PDB
PDBbind
124aa, >1RPF_1|Chain... at 99%
1u1b
RCSB PDB
PDBbind
124aa, >1U1B_1|Chains... at 99%
1w4o
RCSB PDB
PDBbind
124aa, >1W4O_1|Chains... at 99%
1w4p
RCSB PDB
PDBbind
124aa, >1W4P_1|Chains... at 99%
1w4q
RCSB PDB
PDBbind
124aa, >1W4Q_1|Chains... at 99%
1z6d
RCSB PDB
PDBbind
124aa, >1Z6D_1|Chains... at 99%
1z6s
RCSB PDB
PDBbind
124aa, >1Z6S_1|Chains... at 99%
2g8r
RCSB PDB
PDBbind
124aa, >2G8R_1|Chains... at 99%
2w5g
RCSB PDB
PDBbind
124aa, >2W5G_1|Chains... at 99%
2w5i
RCSB PDB
PDBbind
124aa, >2W5I_1|Chains... at 99%
2xog
RCSB PDB
PDBbind
124aa, >2XOG_1|Chains... at 99%
2xoi
RCSB PDB
PDBbind
124aa, >2XOI_1|Chains... at 99%
3d6o
RCSB PDB
PDBbind
124aa, >3D6O_1|Chains... at 99%
3d6p
RCSB PDB
PDBbind
124aa, >3D6P_1|Chains... at 99%
3d6q
RCSB PDB
PDBbind
124aa, >3D6Q_1|Chains... at 99%
3d7b
RCSB PDB
PDBbind
124aa, >3D7B_1|Chains... at 99%
3d8y
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PDBbind
124aa, >3D8Y_1|Chains... at 99%
3d8z
RCSB PDB
PDBbind
124aa, >3D8Z_1|Chains... at 99%
3dxg
RCSB PDB
PDBbind
124aa, >3DXG_1|Chains... at 99%
3dxh
RCSB PDB
PDBbind
124aa, >3DXH_1|Chains... at 99%
4g8v
RCSB PDB
PDBbind
124aa, >4G8V_1|Chains... at 99%
4g8y
RCSB PDB
PDBbind
124aa, >4G8Y_1|Chains... at 99%
4g90
RCSB PDB
PDBbind
124aa, >4G90_1|Chains... at 99%
4peq
RCSB PDB
PDBbind
124aa, >4PEQ_1|Chains... at 99%
4rsk
RCSB PDB
PDBbind
124aa, >4RSK_1|Chain... at 96%
4wyp
RCSB PDB
PDBbind
125aa, >4WYP_1|Chains... *
4wyz
RCSB PDB
PDBbind
125aa, >4WYZ_1|Chains... at 100%
6rsa
RCSB PDB
PDBbind
124aa, >6RSA_1|Chain... at 99%
6pvx
RCSB PDB
PDBbind
124aa, >6PVX_1|Chains... at 99%
6pvw
RCSB PDB
PDBbind
124aa, >6PVW_1|Chains... at 99%
6pvv
RCSB PDB
PDBbind
124aa, >6PVV_1|Chains... at 99%
6pvu
RCSB PDB
PDBbind
124aa, >6PVU_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3lxo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ribonuclease RNase A
Ligand Name
T3P
EC.Number
E.C.3.1.27.5
Resolution
1.55(Å)
Affinity (Kd/Ki/IC50)
Kd=15uM
Release Year
2010
Protein/NA Sequence
Check fasta file
Primary Reference
(2010) Proteins Vol. 78: pp. 2459-2468
Ligand Properties
Formula
C
1
0
H
1
6
N
2
O
8
P
Molecular Weight
323.216
Exact Mass
323.064
No. of atoms
37
No. of bonds
38
Polar Surface Area
167.83
LOGP Value
-2.76 (
Computed with XLOGP3
)
-1.84 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@H](C[C@@H]1OP(O)(O)O)n1cc(C)c(=O)[nH]c1=O
InChI String
InChI=1S/C10H17N2O8P/c1-5-3-12(10(15)11-9(5)14)8-2-6(7(4-13)19-8)20-21(16,17)18/h3,6-8,13,16-18,21H,2,4H2,1H3,(H,11,14,15)/t6-,7+,8+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P61823
Entrez Gene ID
NCBI Entrez Gene ID:
282340
ASD
Information of known allosteric effects of PDB entries
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