Browse entries in the PDBbind-CN Database
HEADER 5WEF_COMPLEX COMPND 5WEF_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 178 MET GLU ASP PHE VAL ARG GLN CYS PHE ASN PRO MET ILE SEQRES 2 A 178 VAL GLU LEU ALA GLU LYS ALA MET LYS GLU TYR GLY GLU SEQRES 3 A 178 ASP PRO LYS ILE GLU THR ASN LYS PHE ALA ALA ILE CYS SEQRES 4 A 178 THR HIS LEU GLU VAL CYS PHE MET TYR SER ASP GLY GLY SEQRES 5 A 178 SER LYS HIS ARG PHE GLU ILE ILE GLU GLY ARG ASP ARG SEQRES 6 A 178 ILE MET ALA TRP THR VAL VAL ASN SER ILE CYS ASN THR SEQRES 7 A 178 THR GLY VAL GLU LYS PRO LYS SER LEU PRO ASP LEU TYR SEQRES 8 A 178 ASP TYR LYS GLU ASN ARG PHE ILE GLU ILE GLY VAL THR SEQRES 9 A 178 ARG ARG GLU VAL HIS ILE TYR TYR LEU GLU LYS ALA ASN SEQRES 10 A 178 LYS ILE LYS SER GLU LYS THR HIS ILE HIS ILE PHE SER SEQRES 11 A 178 PHE THR GLY GLU GLU MET ALA THR LYS ALA ASP TYR THR SEQRES 12 A 178 LEU ASP GLU GLU SER ARG ALA ARG ILE LYS THR ARG LEU SEQRES 13 A 178 PHE THR ILE ARG GLN GLU MET ALA SER ARG SER LEU TRP SEQRES 14 A 178 ASP SER PHE ARG GLN SER GLU ARG ALA HET MN A 1 1 HET MN A 2 1 HET NA A 3 1 HET GY A 6 56 ATOM 1 N MET A 1 -14.428 84.549 -5.048 1.00 59.99 N ATOM 2 CA MET A 1 -14.397 83.939 -3.699 1.00 64.01 C ATOM 3 C MET A 1 -15.053 84.785 -2.599 1.00 61.72 C ATOM 4 O MET A 1 -15.584 84.216 -1.663 1.00 58.41 O ATOM 5 CB MET A 1 -12.976 83.622 -3.206 1.00 64.07 C ATOM 6 CG MET A 1 -12.855 83.014 -1.766 1.00 59.35 C ATOM 7 SD MET A 1 -13.715 81.448 -1.369 1.00 63.60 S ATOM 8 CE MET A 1 -12.217 80.522 -1.201 1.00 68.41 C ATOM 9 HN3 MET A 1 -13.925 85.459 -5.027 1.00 0.00 H ATOM 10 HN2 MET A 1 -15.416 84.703 -5.335 1.00 0.00 H ATOM 11 HN1 MET A 1 -13.965 83.911 -5.726 1.00 0.00 H ATOM 12 N GLU A 2 -15.003 86.122 -2.691 1.00 59.62 N ATOM 13 CA GLU A 2 -15.783 86.931 -1.740 1.00 55.51 C ATOM 14 C GLU A 2 -17.271 86.732 -1.965 1.00 56.24 C ATOM 15 O GLU A 2 -18.037 86.495 -1.014 1.00 52.30 O ATOM 16 CB GLU A 2 -15.442 88.423 -1.853 1.00 57.73 C ATOM 17 CG GLU A 2 -15.851 89.221 -0.598 1.00 58.17 C ATOM 18 CD GLU A 2 -16.078 90.705 -0.915 1.00 63.89 C ATOM 19 OE1 GLU A 2 -15.390 91.209 -1.824 1.00 65.30 O ATOM 20 OE2 GLU A 2 -16.922 91.371 -0.267 1.00 61.39 O ATOM 21 H GLU A 2 -14.423 86.580 -3.422 1.00 0.00 H ATOM 22 N ASP A 3 -17.696 86.812 -3.231 1.00 57.65 N ATOM 23 CA ASP A 3 -19.057 86.454 -3.582 1.00 65.82 C ATOM 24 C ASP A 3 -19.376 85.021 -3.204 1.00 66.55 C ATOM 25 O ASP A 3 -20.495 84.750 -2.754 1.00 66.25 O ATOM 26 CB ASP A 3 -19.267 86.653 -5.077 1.00 79.96 C ATOM 27 CG ASP A 3 -18.656 87.942 -5.553 1.00 91.71 C ATOM 28 OD1 ASP A 3 -17.570 87.886 -6.176 1.00 97.84 O ATOM 29 OD2 ASP A 3 -19.239 89.013 -5.266 1.00 92.40 O ATOM 30 H ASP A 3 -17.042 87.135 -3.973 1.00 0.00 H ATOM 31 N PHE A 4 -18.444 84.083 -3.410 1.00 64.44 N ATOM 32 CA PHE A 4 -18.712 82.727 -2.947 1.00 56.99 C ATOM 33 C PHE A 4 -19.054 82.730 -1.460 1.00 55.19 C ATOM 34 O PHE A 4 -20.046 82.124 -1.043 1.00 57.33 O ATOM 35 CB PHE A 4 -17.544 81.778 -3.191 1.00 59.00 C ATOM 36 CG PHE A 4 -17.767 80.390 -2.552 1.00 62.97 C ATOM 37 CD1 PHE A 4 -18.607 79.440 -3.153 1.00 67.97 C ATOM 38 CD2 PHE A 4 -17.174 80.055 -1.333 1.00 60.82 C ATOM 39 CE1 PHE A 4 -18.828 78.174 -2.549 1.00 64.87 C ATOM 40 CE2 PHE A 4 -17.376 78.827 -0.726 1.00 55.69 C ATOM 41 CZ PHE A 4 -18.227 77.878 -1.321 1.00 60.15 C ATOM 42 H PHE A 4 -17.551 84.316 -3.889 1.00 0.00 H ATOM 43 N VAL A 5 -18.239 83.388 -0.629 1.00 52.50 N ATOM 44 CA VAL A 5 -18.493 83.319 0.816 1.00 48.24 C ATOM 45 C VAL A 5 -19.854 83.912 1.131 1.00 43.21 C ATOM 46 O VAL A 5 -20.640 83.367 1.920 1.00 46.53 O ATOM 47 CB VAL A 5 -17.373 84.030 1.606 1.00 47.84 C ATOM 48 CG1 VAL A 5 -17.830 84.305 3.015 1.00 43.64 C ATOM 49 CG2 VAL A 5 -16.068 83.183 1.620 1.00 46.89 C ATOM 50 H VAL A 5 -17.439 83.939 -1.000 1.00 0.00 H ATOM 51 N ARG A 6 -20.154 85.047 0.527 1.00 50.51 N ATOM 52 CA ARG A 6 -21.379 85.728 0.896 1.00 53.63 C ATOM 53 C ARG A 6 -22.582 84.926 0.450 1.00 53.75 C ATOM 54 O ARG A 6 -23.632 85.022 1.074 1.00 54.82 O ATOM 55 CB ARG A 6 -21.393 87.144 0.316 1.00 54.53 C ATOM 56 CG ARG A 6 -20.272 88.059 0.883 1.00 52.68 C ATOM 57 CD ARG A 6 -20.438 89.564 0.529 1.00 54.23 C ATOM 58 NE ARG A 6 -19.275 90.300 1.011 1.00 49.37 N ATOM 59 CZ ARG A 6 -19.080 90.644 2.279 1.00 48.80 C ATOM 60 NH1 ARG A 6 -20.008 90.402 3.198 1.00 44.52 N ATOM 61 NH2 ARG A 6 -17.957 91.253 2.606 1.00 49.59 N ATOM 62 HE ARG A 6 -18.551 90.573 0.316 1.00 0.00 H ATOM 63 HH12 ARG A 6 -19.844 90.676 4.188 1.00 0.00 H ATOM 64 HH11 ARG A 6 -20.899 89.938 2.928 1.00 0.00 H ATOM 65 HH22 ARG A 6 -17.785 91.531 3.593 1.00 0.00 H ATOM 66 HH21 ARG A 6 -17.244 91.455 1.877 1.00 0.00 H ATOM 67 H ARG A 6 -19.524 85.444 -0.199 1.00 0.00 H ATOM 68 N GLN A 7 -22.438 84.141 -0.624 1.00 57.00 N ATOM 69 CA GLN A 7 -23.511 83.285 -1.121 1.00 60.61 C ATOM 70 C GLN A 7 -23.629 81.998 -0.330 1.00 59.83 C ATOM 71 O GLN A 7 -24.731 81.480 -0.164 1.00 59.60 O ATOM 72 CB GLN A 7 -23.273 82.907 -2.589 1.00 70.00 C ATOM 73 CG GLN A 7 -23.573 84.006 -3.577 1.00 84.49 C ATOM 74 CD GLN A 7 -23.008 83.733 -4.984 1.00 96.39 C ATOM 75 OE1 GLN A 7 -22.498 82.648 -5.259 1.00102.89 O ATOM 76 NE2 GLN A 7 -23.093 84.733 -5.871 1.00 99.41 N ATOM 77 HE22 GLN A 7 -23.532 85.635 -5.597 1.00 0.00 H ATOM 78 HE21 GLN A 7 -22.720 84.607 -6.834 1.00 0.00 H ATOM 79 H GLN A 7 -21.526 84.141 -1.124 1.00 0.00 H ATOM 80 N CYS A 8 -22.517 81.455 0.145 1.00 57.07 N ATOM 81 CA CYS A 8 -22.533 80.102 0.705 1.00 59.70 C ATOM 82 C CYS A 8 -22.937 80.040 2.187 1.00 52.91 C ATOM 83 O CYS A 8 -23.496 79.020 2.628 1.00 51.05 O ATOM 84 CB CYS A 8 -21.154 79.472 0.508 1.00 63.40 C ATOM 85 SG CYS A 8 -20.870 77.875 1.333 1.00 70.76 S ATOM 86 H CYS A 8 -21.627 81.993 0.120 1.00 0.00 H ATOM 87 N PHE A 9 -22.644 81.083 2.961 1.00 44.70 N ATOM 88 CA PHE A 9 -22.765 81.027 4.413 1.00 46.36 C ATOM 89 C PHE A 9 -23.863 81.965 4.910 1.00 46.73 C ATOM 90 O PHE A 9 -24.104 83.034 4.344 1.00 44.60 O ATOM 91 CB PHE A 9 -21.431 81.419 5.105 1.00 44.68 C ATOM 92 CG PHE A 9 -20.321 80.447 4.863 1.00 51.59 C ATOM 93 CD1 PHE A 9 -20.263 79.223 5.573 1.00 48.90 C ATOM 94 CD2 PHE A 9 -19.324 80.725 3.904 1.00 49.34 C ATOM 95 CE1 PHE A 9 -19.218 78.300 5.335 1.00 45.99 C ATOM 96 CE2 PHE A 9 -18.287 79.820 3.666 1.00 49.02 C ATOM 97 CZ PHE A 9 -18.252 78.576 4.384 1.00 47.85 C ATOM 98 H PHE A 9 -22.319 81.965 2.516 1.00 0.00 H ATOM 99 N ASN A 10 -24.478 81.585 6.011 1.00 41.82 N ATOM 100 CA ASN A 10 -25.537 82.380 6.622 1.00 43.61 C ATOM 101 C ASN A 10 -25.020 83.802 6.944 1.00 40.30 C ATOM 102 O ASN A 10 -23.873 83.955 7.327 1.00 40.11 O ATOM 103 CB ASN A 10 -25.936 81.623 7.889 1.00 51.90 C ATOM 104 CG ASN A 10 -27.056 82.246 8.593 1.00 65.19 C ATOM 105 OD1 ASN A 10 -26.858 83.168 9.391 1.00 61.46 O ATOM 106 ND2 ASN A 10 -28.277 81.781 8.302 1.00 71.40 N ATOM 107 HD22 ASN A 10 -28.388 81.002 7.622 1.00 0.00 H ATOM 108 HD21 ASN A 10 -29.114 82.199 8.756 1.00 0.00 H ATOM 109 H ASN A 10 -24.199 80.689 6.459 1.00 0.00 H ATOM 110 N PRO A 11 -25.823 84.862 6.788 1.00 43.67 N ATOM 111 CA PRO A 11 -25.303 86.214 7.114 1.00 40.94 C ATOM 112 C PRO A 11 -24.758 86.396 8.525 1.00 38.79 C ATOM 113 O PRO A 11 -23.932 87.314 8.754 1.00 35.97 O ATOM 114 CB PRO A 11 -26.524 87.129 6.886 1.00 42.22 C ATOM 115 CG PRO A 11 -27.289 86.397 5.746 1.00 46.30 C ATOM 116 CD PRO A 11 -27.117 84.920 6.079 1.00 44.27 C ATOM 117 N MET A 12 -25.242 85.647 9.515 1.00 37.31 N ATOM 118 CA MET A 12 -24.691 85.829 10.877 1.00 39.29 C ATOM 119 C MET A 12 -23.259 85.351 10.932 1.00 37.48 C ATOM 120 O MET A 12 -22.402 85.939 11.611 1.00 36.63 O ATOM 121 CB MET A 12 -25.508 85.018 11.901 1.00 56.31 C ATOM 122 CG MET A 12 -26.887 85.541 12.184 1.00 74.93 C ATOM 123 SD MET A 12 -28.208 85.055 10.991 1.00 85.71 S ATOM 124 CE MET A 12 -29.023 83.613 11.732 1.00 90.66 C ATOM 125 H MET A 12 -25.991 84.949 9.335 1.00 0.00 H ATOM 126 N ILE A 13 -23.006 84.197 10.312 1.00 32.93 N ATOM 127 CA ILE A 13 -21.658 83.664 10.217 1.00 34.14 C ATOM 128 C ILE A 13 -20.764 84.669 9.495 1.00 32.10 C ATOM 129 O ILE A 13 -19.657 84.969 9.975 1.00 31.94 O ATOM 130 CB ILE A 13 -21.676 82.306 9.498 1.00 35.55 C ATOM 131 CG1 ILE A 13 -22.205 81.208 10.449 1.00 37.01 C ATOM 132 CG2 ILE A 13 -20.208 81.922 8.994 1.00 37.31 C ATOM 133 CD1 ILE A 13 -22.572 79.893 9.739 1.00 45.64 C ATOM 134 H ILE A 13 -23.793 83.666 9.887 1.00 0.00 H ATOM 135 N VAL A 14 -21.216 85.169 8.310 1.00 32.22 N ATOM 136 CA VAL A 14 -20.397 86.100 7.541 1.00 31.00 C ATOM 137 C VAL A 14 -20.091 87.370 8.356 1.00 32.00 C ATOM 138 O VAL A 14 -18.942 87.878 8.378 1.00 34.10 O ATOM 139 CB VAL A 14 -21.118 86.472 6.254 1.00 37.72 C ATOM 140 CG1 VAL A 14 -20.383 87.694 5.625 1.00 35.94 C ATOM 141 CG2 VAL A 14 -21.214 85.192 5.318 1.00 36.70 C ATOM 142 H VAL A 14 -22.150 84.885 7.952 1.00 0.00 H ATOM 143 N GLU A 15 -21.075 87.887 9.084 1.00 34.10 N ATOM 144 CA GLU A 15 -20.784 89.080 9.911 1.00 31.54 C ATOM 145 C GLU A 15 -19.764 88.792 11.014 1.00 31.53 C ATOM 146 O GLU A 15 -18.911 89.637 11.295 1.00 32.10 O ATOM 147 CB GLU A 15 -22.067 89.624 10.496 1.00 33.60 C ATOM 148 CG GLU A 15 -21.890 90.781 11.464 1.00 36.90 C ATOM 149 CD GLU A 15 -21.502 92.129 10.752 1.00 44.41 C ATOM 150 OE1 GLU A 15 -21.889 92.319 9.560 1.00 44.45 O ATOM 151 OE2 GLU A 15 -20.779 92.959 11.433 1.00 46.58 O ATOM 152 H GLU A 15 -22.025 87.464 9.073 1.00 0.00 H ATOM 153 N LEU A 16 -19.862 87.640 11.691 1.00 31.90 N ATOM 154 CA LEU A 16 -18.905 87.286 12.745 1.00 31.86 C ATOM 155 C LEU A 16 -17.529 87.146 12.159 1.00 32.40 C ATOM 156 O LEU A 16 -16.517 87.544 12.764 1.00 30.12 O ATOM 157 CB LEU A 16 -19.296 85.921 13.364 1.00 32.51 C ATOM 158 CG LEU A 16 -20.420 86.043 14.410 1.00 35.57 C ATOM 159 CD1 LEU A 16 -20.971 84.631 14.758 1.00 39.94 C ATOM 160 CD2 LEU A 16 -19.965 86.839 15.679 1.00 38.36 C ATOM 161 H LEU A 16 -20.634 86.982 11.464 1.00 0.00 H ATOM 162 N ALA A 17 -17.475 86.589 10.947 1.00 30.00 N ATOM 163 CA ALA A 17 -16.175 86.363 10.300 1.00 31.14 C ATOM 164 C ALA A 17 -15.537 87.691 9.919 1.00 33.80 C ATOM 165 O ALA A 17 -14.337 87.884 10.148 1.00 38.16 O ATOM 166 CB ALA A 17 -16.351 85.473 9.073 1.00 32.57 C ATOM 167 H ALA A 17 -18.353 86.315 10.461 1.00 0.00 H ATOM 168 N GLU A 18 -16.337 88.641 9.398 1.00 30.63 N ATOM 169 CA GLU A 18 -15.785 89.952 9.036 1.00 32.47 C ATOM 170 C GLU A 18 -15.257 90.656 10.279 1.00 30.64 C ATOM 171 O GLU A 18 -14.210 91.323 10.258 1.00 34.24 O ATOM 172 CB GLU A 18 -16.879 90.818 8.421 1.00 36.81 C ATOM 173 CG GLU A 18 -17.242 90.470 6.964 1.00 45.80 C ATOM 174 CD GLU A 18 -18.426 91.326 6.460 1.00 56.69 C ATOM 175 OE1 GLU A 18 -19.044 92.038 7.280 1.00 64.10 O ATOM 176 OE2 GLU A 18 -18.740 91.326 5.268 1.00 62.73 O ATOM 177 H GLU A 18 -17.348 88.445 9.252 1.00 0.00 H ATOM 178 N LYS A 19 -16.010 90.553 11.374 1.00 30.67 N ATOM 179 CA LYS A 19 -15.574 91.215 12.592 1.00 31.14 C ATOM 180 C LYS A 19 -14.251 90.642 13.083 1.00 30.79 C ATOM 181 O LYS A 19 -13.333 91.383 13.421 1.00 36.01 O ATOM 182 CB LYS A 19 -16.676 91.060 13.638 1.00 32.91 C ATOM 183 CG LYS A 19 -16.412 91.750 15.002 1.00 42.57 C ATOM 184 CD LYS A 19 -17.589 91.500 15.996 1.00 51.46 C ATOM 185 CE LYS A 19 -17.430 92.260 17.317 1.00 62.65 C ATOM 186 NZ LYS A 19 -16.555 91.529 18.331 1.00 71.86 N ATOM 187 HZ1 LYS A 19 -16.978 90.604 18.549 1.00 0.00 H ATOM 188 HZ2 LYS A 19 -15.605 91.391 17.931 1.00 0.00 H ATOM 189 HZ3 LYS A 19 -16.488 92.095 19.201 1.00 0.00 H ATOM 190 H LYS A 19 -16.895 90.008 11.357 1.00 0.00 H ATOM 191 N ALA A 20 -14.117 89.305 13.078 1.00 36.98 N ATOM 192 CA ALA A 20 -12.902 88.643 13.545 1.00 34.31 C ATOM 193 C ALA A 20 -11.715 89.097 12.747 1.00 36.51 C ATOM 194 O ALA A 20 -10.660 89.448 13.310 1.00 39.66 O ATOM 195 CB ALA A 20 -13.028 87.114 13.405 1.00 39.80 C ATOM 196 H ALA A 20 -14.905 88.722 12.730 1.00 0.00 H ATOM 197 N MET A 21 -11.891 89.198 11.422 1.00 32.73 N ATOM 198 CA MET A 21 -10.793 89.658 10.601 1.00 38.28 C ATOM 199 C MET A 21 -10.466 91.107 10.893 1.00 37.81 C ATOM 200 O MET A 21 -9.282 91.481 10.981 1.00 42.34 O ATOM 201 CB MET A 21 -11.167 89.464 9.139 1.00 41.16 C ATOM 202 CG MET A 21 -11.171 87.932 8.795 1.00 44.60 C ATOM 203 SD MET A 21 -11.478 87.730 7.057 1.00 44.50 S ATOM 204 CE MET A 21 -9.889 88.071 6.266 1.00 44.69 C ATOM 205 H MET A 21 -12.804 88.949 10.991 1.00 0.00 H ATOM 206 N LYS A 22 -11.492 91.951 11.008 1.00 38.54 N ATOM 207 CA LYS A 22 -11.199 93.374 11.181 1.00 36.56 C ATOM 208 C LYS A 22 -10.490 93.640 12.498 1.00 32.75 C ATOM 209 O LYS A 22 -9.730 94.629 12.617 1.00 35.44 O ATOM 210 CB LYS A 22 -12.516 94.171 11.051 1.00 35.78 C ATOM 211 CG LYS A 22 -12.904 94.283 9.538 1.00 43.97 C ATOM 212 CD LYS A 22 -14.293 94.761 9.344 1.00 47.54 C ATOM 213 CE LYS A 22 -14.370 96.276 9.493 1.00 58.24 C ATOM 214 NZ LYS A 22 -15.756 96.796 9.250 1.00 67.07 N ATOM 215 HZ1 LYS A 22 -16.053 96.549 8.285 1.00 0.00 H ATOM 216 HZ2 LYS A 22 -16.411 96.368 9.936 1.00 0.00 H ATOM 217 HZ3 LYS A 22 -15.762 97.830 9.362 1.00 0.00 H ATOM 218 H LYS A 22 -12.473 91.607 10.976 1.00 0.00 H ATOM 219 N GLU A 23 -10.844 92.891 13.532 1.00 33.19 N ATOM 220 CA GLU A 23 -10.181 93.016 14.841 1.00 34.37 C ATOM 221 C GLU A 23 -8.692 92.718 14.790 1.00 39.57 C ATOM 222 O GLU A 23 -7.945 93.071 15.736 1.00 38.33 O ATOM 223 CB GLU A 23 -10.876 92.073 15.838 1.00 32.95 C ATOM 224 CG GLU A 23 -12.245 92.565 16.249 1.00 35.85 C ATOM 225 CD GLU A 23 -12.953 91.615 17.206 1.00 40.56 C ATOM 226 OE1 GLU A 23 -12.543 90.458 17.343 1.00 44.27 O ATOM 227 OE2 GLU A 23 -13.971 92.032 17.779 1.00 44.51 O ATOM 228 H GLU A 23 -11.610 92.197 13.416 1.00 0.00 H ATOM 229 N TYR A 24 -8.209 92.133 13.701 1.00 39.60 N ATOM 230 CA TYR A 24 -6.780 91.945 13.538 1.00 40.71 C ATOM 231 C TYR A 24 -6.270 92.724 12.336 1.00 44.25 C ATOM 232 O TYR A 24 -5.172 92.480 11.881 1.00 47.00 O ATOM 233 CB TYR A 24 -6.467 90.437 13.472 1.00 50.03 C ATOM 234 CG TYR A 24 -6.616 89.808 14.848 1.00 57.81 C ATOM 235 CD1 TYR A 24 -7.851 89.342 15.293 1.00 61.70 C ATOM 236 CD2 TYR A 24 -5.556 89.782 15.749 1.00 64.34 C ATOM 237 CE1 TYR A 24 -8.018 88.821 16.582 1.00 63.96 C ATOM 238 CE2 TYR A 24 -5.710 89.262 17.030 1.00 64.66 C ATOM 239 CZ TYR A 24 -6.946 88.789 17.445 1.00 68.06 C ATOM 240 OH TYR A 24 -7.139 88.285 18.716 1.00 72.32 O ATOM 241 HH TYR A 24 -8.082 88.001 18.817 1.00 0.00 H ATOM 242 H TYR A 24 -8.860 91.807 12.959 1.00 0.00 H ATOM 243 N GLY A 25 -7.013 93.730 11.867 1.00 42.15 N ATOM 244 CA GLY A 25 -6.508 94.568 10.782 1.00 45.68 C ATOM 245 C GLY A 25 -6.498 93.918 9.413 1.00 45.18 C ATOM 246 O GLY A 25 -5.841 94.427 8.511 1.00 50.21 O ATOM 247 H GLY A 25 -7.951 93.917 12.274 1.00 0.00 H ATOM 248 N GLU A 26 -7.242 92.840 9.213 1.00 43.24 N ATOM 249 CA GLU A 26 -7.321 92.191 7.908 1.00 50.57 C ATOM 250 C GLU A 26 -8.635 92.526 7.220 1.00 46.35 C ATOM 251 O GLU A 26 -9.673 92.575 7.867 1.00 45.06 O ATOM 252 CB GLU A 26 -7.173 90.673 8.057 1.00 51.75 C ATOM 253 CG GLU A 26 -5.850 90.294 8.733 1.00 64.99 C ATOM 254 CD GLU A 26 -5.807 88.878 9.266 1.00 75.07 C ATOM 255 OE1 GLU A 26 -4.706 88.324 9.423 1.00 81.30 O ATOM 256 OE2 GLU A 26 -6.880 88.317 9.545 1.00 80.49 O ATOM 257 H GLU A 26 -7.785 92.445 10.008 1.00 0.00 H ATOM 258 N ASP A 27 -8.599 92.615 5.902 1.00 49.79 N ATOM 259 CA ASP A 27 -9.748 92.972 5.068 1.00 50.76 C ATOM 260 C ASP A 27 -10.351 91.743 4.401 1.00 48.69 C ATOM 261 O ASP A 27 -9.684 91.107 3.549 1.00 52.08 O ATOM 262 CB ASP A 27 -9.300 93.975 3.984 1.00 59.86 C ATOM 263 CG ASP A 27 -10.490 94.641 3.227 1.00 64.74 C ATOM 264 OD1 ASP A 27 -11.669 94.239 3.406 1.00 61.85 O ATOM 265 OD2 ASP A 27 -10.231 95.606 2.447 1.00 69.69 O ATOM 266 H ASP A 27 -7.695 92.419 5.426 1.00 0.00 H ATOM 267 N PRO A 28 -11.627 91.443 4.661 1.00 45.51 N ATOM 268 CA PRO A 28 -12.245 90.237 4.074 1.00 44.21 C ATOM 269 C PRO A 28 -12.339 90.305 2.589 1.00 50.26 C ATOM 270 O PRO A 28 -12.421 89.259 1.944 1.00 52.39 O ATOM 271 CB PRO A 28 -13.657 90.232 4.674 1.00 46.64 C ATOM 272 CG PRO A 28 -13.601 91.117 5.866 1.00 45.26 C ATOM 273 CD PRO A 28 -12.539 92.140 5.589 1.00 45.00 C ATOM 274 N LYS A 29 -12.327 91.506 2.016 1.00 48.19 N ATOM 275 CA LYS A 29 -12.349 91.622 0.569 1.00 50.23 C ATOM 276 C LYS A 29 -11.005 91.308 -0.046 1.00 54.88 C ATOM 277 O LYS A 29 -10.938 91.019 -1.258 1.00 61.58 O ATOM 278 CB LYS A 29 -12.813 93.014 0.176 1.00 58.43 C ATOM 279 CG LYS A 29 -14.197 93.310 0.742 1.00 70.08 C ATOM 280 CD LYS A 29 -14.805 94.618 0.174 1.00 79.08 C ATOM 281 CE LYS A 29 -16.261 94.406 -0.284 1.00 81.55 C ATOM 282 NZ LYS A 29 -16.358 94.318 -1.775 1.00 82.16 N ATOM 283 HZ1 LYS A 29 -16.004 95.200 -2.197 1.00 0.00 H ATOM 284 HZ2 LYS A 29 -15.786 93.517 -2.112 1.00 0.00 H ATOM 285 HZ3 LYS A 29 -17.351 94.175 -2.049 1.00 0.00 H ATOM 286 H LYS A 29 -12.302 92.362 2.605 1.00 0.00 H ATOM 287 N ILE A 30 -9.935 91.273 0.742 1.00 53.96 N ATOM 288 CA ILE A 30 -8.597 90.984 0.231 1.00 59.08 C ATOM 289 C ILE A 30 -8.087 89.624 0.682 1.00 57.71 C ATOM 290 O ILE A 30 -7.616 88.839 -0.130 1.00 62.95 O ATOM 291 CB ILE A 30 -7.598 92.093 0.605 1.00 61.39 C ATOM 292 CG1 ILE A 30 -8.024 93.386 -0.059 1.00 67.00 C ATOM 293 CG2 ILE A 30 -6.249 91.722 0.031 1.00 62.23 C ATOM 294 CD1 ILE A 30 -7.654 94.621 0.752 1.00 71.47 C ATOM 295 H ILE A 30 -10.054 91.458 1.758 1.00 0.00 H ATOM 296 N GLU A 31 -8.147 89.330 1.969 1.00 56.45 N ATOM 297 CA GLU A 31 -7.758 87.998 2.433 1.00 60.76 C ATOM 298 C GLU A 31 -8.955 87.055 2.354 1.00 51.82 C ATOM 299 O GLU A 31 -9.468 86.548 3.345 1.00 46.50 O ATOM 300 CB GLU A 31 -7.178 88.073 3.829 1.00 72.13 C ATOM 301 CG GLU A 31 -6.093 89.139 3.890 1.00 91.80 C ATOM 302 CD GLU A 31 -4.891 88.692 4.679 1.00106.67 C ATOM 303 OE1 GLU A 31 -4.625 89.304 5.745 1.00111.72 O ATOM 304 OE2 GLU A 31 -4.236 87.715 4.243 1.00116.61 O ATOM 305 H GLU A 31 -8.470 90.045 2.652 1.00 0.00 H ATOM 306 N THR A 32 -9.351 86.775 1.119 1.00 47.23 N ATOM 307 CA THR A 32 -10.613 86.081 0.916 1.00 49.86 C ATOM 308 C THR A 32 -10.558 84.603 1.322 1.00 53.32 C ATOM 309 O THR A 32 -11.578 84.067 1.785 1.00 53.17 O ATOM 310 CB THR A 32 -11.084 86.188 -0.538 1.00 56.75 C ATOM 311 OG1 THR A 32 -10.093 85.638 -1.388 1.00 53.95 O ATOM 312 CG2 THR A 32 -11.356 87.674 -0.936 1.00 58.81 C ATOM 313 HG1 THR A 32 -9.247 86.139 -1.274 1.00 0.00 H ATOM 314 H THR A 32 -8.765 87.049 0.305 1.00 0.00 H ATOM 315 N ASN A 33 -9.420 83.917 1.184 1.00 52.97 N ATOM 316 CA ASN A 33 -9.401 82.527 1.632 1.00 53.14 C ATOM 317 C ASN A 33 -9.538 82.452 3.151 1.00 50.73 C ATOM 318 O ASN A 33 -10.189 81.543 3.693 1.00 52.74 O ATOM 319 CB ASN A 33 -8.111 81.819 1.165 1.00 56.03 C ATOM 320 CG ASN A 33 -8.092 81.576 -0.344 1.00 60.78 C ATOM 321 OD1 ASN A 33 -9.125 81.291 -0.942 1.00 58.06 O ATOM 322 ND2 ASN A 33 -6.902 81.712 -0.970 1.00 67.69 N ATOM 323 HD22 ASN A 33 -6.051 81.955 -0.423 1.00 0.00 H ATOM 324 HD21 ASN A 33 -6.837 81.574 -1.999 1.00 0.00 H ATOM 325 H ASN A 33 -8.574 84.359 0.771 1.00 0.00 H ATOM 326 N LYS A 34 -8.859 83.341 3.846 1.00 48.26 N ATOM 327 CA LYS A 34 -9.005 83.417 5.299 1.00 51.67 C ATOM 328 C LYS A 34 -10.451 83.660 5.702 1.00 46.11 C ATOM 329 O LYS A 34 -10.942 83.070 6.672 1.00 46.46 O ATOM 330 CB LYS A 34 -8.105 84.532 5.842 1.00 55.76 C ATOM 331 CG LYS A 34 -7.895 84.538 7.362 1.00 61.91 C ATOM 332 CD LYS A 34 -6.789 85.578 7.833 1.00 62.72 C ATOM 333 CE LYS A 34 -5.458 85.413 7.075 1.00 66.06 C ATOM 334 NZ LYS A 34 -4.293 86.005 7.809 1.00 66.93 N ATOM 335 HZ1 LYS A 34 -4.454 87.023 7.950 1.00 0.00 H ATOM 336 HZ2 LYS A 34 -4.193 85.537 8.733 1.00 0.00 H ATOM 337 HZ3 LYS A 34 -3.426 85.864 7.252 1.00 0.00 H ATOM 338 H LYS A 34 -8.214 83.994 3.358 1.00 0.00 H ATOM 339 N PHE A 35 -11.109 84.583 5.008 1.00 45.07 N ATOM 340 CA PHE A 35 -12.539 84.842 5.148 1.00 42.92 C ATOM 341 C PHE A 35 -13.331 83.540 5.083 1.00 43.29 C ATOM 342 O PHE A 35 -14.080 83.204 6.007 1.00 39.64 O ATOM 343 CB PHE A 35 -12.943 85.797 4.016 1.00 42.92 C ATOM 344 CG PHE A 35 -14.293 86.453 4.162 1.00 42.46 C ATOM 345 CD1 PHE A 35 -14.941 86.503 5.356 1.00 35.90 C ATOM 346 CD2 PHE A 35 -14.906 87.016 3.049 1.00 46.64 C ATOM 347 CE1 PHE A 35 -16.208 87.075 5.475 1.00 37.54 C ATOM 348 CE2 PHE A 35 -16.166 87.599 3.136 1.00 46.01 C ATOM 349 CZ PHE A 35 -16.823 87.648 4.384 1.00 41.91 C ATOM 350 H PHE A 35 -10.573 85.155 4.324 1.00 0.00 H ATOM 351 N ALA A 36 -13.157 82.774 4.001 1.00 41.27 N ATOM 352 CA ALA A 36 -13.852 81.480 3.892 1.00 41.02 C ATOM 353 C ALA A 36 -13.491 80.535 5.043 1.00 41.80 C ATOM 354 O ALA A 36 -14.354 79.840 5.598 1.00 47.86 O ATOM 355 CB ALA A 36 -13.467 80.796 2.557 1.00 45.57 C ATOM 356 H ALA A 36 -12.530 83.092 3.235 1.00 0.00 H ATOM 357 N ALA A 37 -12.211 80.450 5.401 1.00 41.65 N ATOM 358 CA ALA A 37 -11.830 79.444 6.401 1.00 41.71 C ATOM 359 C ALA A 37 -12.477 79.739 7.739 1.00 38.97 C ATOM 360 O ALA A 37 -12.885 78.839 8.478 1.00 40.93 O ATOM 361 CB ALA A 37 -10.283 79.427 6.533 1.00 45.95 C ATOM 362 H ALA A 37 -11.498 81.081 4.982 1.00 0.00 H ATOM 363 N ILE A 38 -12.545 81.002 8.094 1.00 38.90 N ATOM 364 CA ILE A 38 -13.138 81.364 9.373 1.00 35.88 C ATOM 365 C ILE A 38 -14.623 81.105 9.344 1.00 36.08 C ATOM 366 O ILE A 38 -15.216 80.613 10.324 1.00 36.96 O ATOM 367 CB ILE A 38 -12.827 82.847 9.654 1.00 38.90 C ATOM 368 CG1 ILE A 38 -11.317 83.031 9.892 1.00 42.17 C ATOM 369 CG2 ILE A 38 -13.765 83.471 10.790 1.00 38.00 C ATOM 370 CD1 ILE A 38 -10.962 84.591 9.910 1.00 43.06 C ATOM 371 H ILE A 38 -12.176 81.741 7.463 1.00 0.00 H ATOM 372 N CYS A 39 -15.274 81.507 8.260 1.00 36.92 N ATOM 373 CA CYS A 39 -16.672 81.122 8.074 1.00 39.98 C ATOM 374 C CYS A 39 -16.868 79.603 8.259 1.00 38.53 C ATOM 375 O CYS A 39 -17.815 79.167 8.939 1.00 35.85 O ATOM 376 CB CYS A 39 -17.147 81.563 6.687 1.00 40.66 C ATOM 377 SG CYS A 39 -17.514 83.348 6.565 1.00 40.13 S ATOM 378 H CYS A 39 -14.793 82.092 7.547 1.00 0.00 H ATOM 379 N THR A 40 -16.024 78.781 7.620 1.00 40.43 N ATOM 380 CA THR A 40 -16.197 77.323 7.715 1.00 40.60 C ATOM 381 C THR A 40 -16.088 76.819 9.162 1.00 40.03 C ATOM 382 O THR A 40 -16.886 75.964 9.608 1.00 41.09 O ATOM 383 CB THR A 40 -15.169 76.593 6.839 1.00 45.62 C ATOM 384 OG1 THR A 40 -15.343 76.986 5.483 1.00 44.45 O ATOM 385 CG2 THR A 40 -15.461 75.129 6.827 1.00 47.89 C ATOM 386 HG1 THR A 40 -15.211 77.964 5.405 1.00 0.00 H ATOM 387 H THR A 40 -15.245 79.175 7.055 1.00 0.00 H ATOM 388 N HIS A 41 -15.091 77.334 9.907 1.00 38.78 N ATOM 389 CA HIS A 41 -14.874 76.876 11.274 1.00 40.17 C ATOM 390 C HIS A 41 -16.077 77.233 12.124 1.00 38.78 C ATOM 391 O HIS A 41 -16.602 76.383 12.862 1.00 37.53 O ATOM 392 CB HIS A 41 -13.557 77.470 11.824 1.00 44.85 C ATOM 393 CG HIS A 41 -13.343 77.287 13.303 1.00 44.13 C ATOM 394 ND1 HIS A 41 -13.752 78.224 14.229 1.00 39.90 N ATOM 395 CD2 HIS A 41 -12.768 76.282 14.020 1.00 43.02 C ATOM 396 CE1 HIS A 41 -13.451 77.801 15.451 1.00 39.27 C ATOM 397 NE2 HIS A 41 -12.805 76.647 15.350 1.00 38.61 N ATOM 398 H HIS A 41 -14.471 78.065 9.504 1.00 0.00 H ATOM 399 N LEU A 42 -16.606 78.448 11.934 1.00 37.35 N ATOM 400 CA LEU A 42 -17.809 78.875 12.668 1.00 35.86 C ATOM 401 C LEU A 42 -18.985 77.969 12.382 1.00 34.52 C ATOM 402 O LEU A 42 -19.718 77.563 13.304 1.00 33.59 O ATOM 403 CB LEU A 42 -18.159 80.314 12.288 1.00 38.52 C ATOM 404 CG LEU A 42 -17.239 81.399 12.834 1.00 41.63 C ATOM 405 CD1 LEU A 42 -17.799 82.760 12.359 1.00 37.85 C ATOM 406 CD2 LEU A 42 -17.261 81.398 14.344 1.00 49.78 C ATOM 407 H LEU A 42 -16.160 79.100 11.258 1.00 0.00 H ATOM 408 N GLU A 43 -19.258 77.707 11.098 1.00 35.01 N ATOM 409 CA GLU A 43 -20.404 76.868 10.768 1.00 39.09 C ATOM 410 C GLU A 43 -20.249 75.448 11.338 1.00 38.87 C ATOM 411 O GLU A 43 -21.229 74.849 11.826 1.00 37.39 O ATOM 412 CB GLU A 43 -20.613 76.810 9.260 1.00 44.05 C ATOM 413 CG GLU A 43 -21.877 75.980 8.978 1.00 48.85 C ATOM 414 CD GLU A 43 -22.389 76.041 7.544 1.00 57.98 C ATOM 415 OE1 GLU A 43 -21.922 76.862 6.758 1.00 61.16 O ATOM 416 OE2 GLU A 43 -23.281 75.197 7.171 1.00 69.39 O ATOM 417 H GLU A 43 -18.659 78.098 10.343 1.00 0.00 H ATOM 418 N VAL A 44 -19.033 74.895 11.292 1.00 38.99 N ATOM 419 CA VAL A 44 -18.770 73.576 11.904 1.00 39.74 C ATOM 420 C VAL A 44 -19.010 73.630 13.422 1.00 40.17 C ATOM 421 O VAL A 44 -19.606 72.721 13.995 1.00 41.68 O ATOM 422 CB VAL A 44 -17.354 73.090 11.572 1.00 43.69 C ATOM 423 CG1 VAL A 44 -16.964 71.837 12.441 1.00 47.34 C ATOM 424 CG2 VAL A 44 -17.266 72.737 10.095 1.00 43.03 C ATOM 425 H VAL A 44 -18.259 75.402 10.817 1.00 0.00 H ATOM 426 N CYS A 45 -18.564 74.688 14.091 1.00 40.54 N ATOM 427 CA CYS A 45 -18.851 74.795 15.523 1.00 35.85 C ATOM 428 C CYS A 45 -20.341 74.834 15.800 1.00 38.34 C ATOM 429 O CYS A 45 -20.815 74.150 16.723 1.00 40.66 O ATOM 430 CB CYS A 45 -18.200 76.069 16.092 1.00 35.86 C ATOM 431 SG CYS A 45 -16.425 75.902 16.225 1.00 41.95 S ATOM 432 H CYS A 45 -18.019 75.429 13.605 1.00 0.00 H ATOM 433 N PHE A 46 -21.115 75.642 15.034 1.00 36.97 N ATOM 434 CA PHE A 46 -22.583 75.664 15.258 1.00 38.36 C ATOM 435 C PHE A 46 -23.234 74.313 14.930 1.00 43.64 C ATOM 436 O PHE A 46 -24.064 73.817 15.705 1.00 46.64 O ATOM 437 CB PHE A 46 -23.223 76.840 14.482 1.00 39.01 C ATOM 438 CG PHE A 46 -22.686 78.250 14.908 1.00 45.02 C ATOM 439 CD1 PHE A 46 -22.792 79.357 14.056 1.00 52.49 C ATOM 440 CD2 PHE A 46 -22.066 78.462 16.109 1.00 53.59 C ATOM 441 CE1 PHE A 46 -22.325 80.684 14.422 1.00 53.97 C ATOM 442 CE2 PHE A 46 -21.577 79.790 16.486 1.00 52.43 C ATOM 443 CZ PHE A 46 -21.711 80.876 15.632 1.00 49.89 C ATOM 444 H PHE A 46 -20.686 76.239 14.299 1.00 0.00 H ATOM 445 N MET A 47 -22.855 73.649 13.828 1.00 41.07 N ATOM 446 CA MET A 47 -23.456 72.331 13.563 1.00 43.15 C ATOM 447 C MET A 47 -23.139 71.327 14.673 1.00 47.15 C ATOM 448 O MET A 47 -23.972 70.472 15.011 1.00 51.37 O ATOM 449 CB MET A 47 -22.966 71.749 12.235 1.00 43.84 C ATOM 450 CG MET A 47 -23.322 72.556 11.042 1.00 45.92 C ATOM 451 SD MET A 47 -22.712 71.677 9.575 1.00 55.48 S ATOM 452 CE MET A 47 -23.667 70.198 9.617 1.00 58.38 C ATOM 453 H MET A 47 -22.154 74.055 13.176 1.00 0.00 H ATOM 454 N TYR A 48 -21.894 71.337 15.168 1.00 43.80 N ATOM 455 CA TYR A 48 -21.504 70.420 16.242 1.00 47.70 C ATOM 456 C TYR A 48 -22.407 70.608 17.455 1.00 47.66 C ATOM 457 O TYR A 48 -22.892 69.625 18.047 1.00 50.32 O ATOM 458 CB TYR A 48 -20.029 70.673 16.609 1.00 44.66 C ATOM 459 CG TYR A 48 -19.231 69.507 17.267 1.00 46.75 C ATOM 460 CD1 TYR A 48 -19.428 69.172 18.619 1.00 46.59 C ATOM 461 CD2 TYR A 48 -18.277 68.802 16.547 1.00 44.51 C ATOM 462 CE1 TYR A 48 -18.722 68.211 19.211 1.00 49.48 C ATOM 463 CE2 TYR A 48 -17.527 67.836 17.143 1.00 48.96 C ATOM 464 CZ TYR A 48 -17.747 67.552 18.482 1.00 53.12 C ATOM 465 OH TYR A 48 -17.045 66.554 19.099 1.00 57.67 O ATOM 466 HH TYR A 48 -16.077 66.757 19.055 1.00 0.00 H ATOM 467 H TYR A 48 -21.195 72.005 14.785 1.00 0.00 H ATOM 468 N SER A 49 -22.655 71.859 17.828 1.00 47.88 N ATOM 469 CA SER A 49 -23.455 72.119 19.010 1.00 51.24 C ATOM 470 C SER A 49 -24.912 71.703 18.823 1.00 55.95 C ATOM 471 O SER A 49 -25.624 71.578 19.811 1.00 60.10 O ATOM 472 CB SER A 49 -23.347 73.595 19.395 1.00 54.46 C ATOM 473 OG SER A 49 -23.970 74.504 18.475 1.00 56.08 O ATOM 474 HG SER A 49 -23.550 74.409 17.584 1.00 0.00 H ATOM 475 H SER A 49 -22.275 72.652 17.272 1.00 0.00 H ATOM 476 N ASP A 50 -25.372 71.499 17.594 1.00 59.93 N ATOM 477 CA ASP A 50 -26.706 71.000 17.343 1.00 68.86 C ATOM 478 C ASP A 50 -26.722 69.494 17.246 1.00 71.17 C ATOM 479 O ASP A 50 -27.720 68.923 16.822 1.00 72.56 O ATOM 480 CB ASP A 50 -27.264 71.596 16.056 1.00 75.30 C ATOM 481 CG ASP A 50 -27.780 72.989 16.263 1.00 83.23 C ATOM 482 OD1 ASP A 50 -28.277 73.223 17.383 1.00 88.25 O ATOM 483 OD2 ASP A 50 -27.677 73.843 15.344 1.00 81.05 O ATOM 484 H ASP A 50 -24.752 71.705 16.785 1.00 0.00 H ATOM 485 N GLY A 51 -25.631 68.847 17.617 1.00 72.85 N ATOM 486 CA GLY A 51 -25.420 67.486 17.196 1.00 75.52 C ATOM 487 C GLY A 51 -25.984 66.488 18.164 1.00 80.67 C ATOM 488 O GLY A 51 -26.155 65.314 17.827 1.00 85.04 O ATOM 489 H GLY A 51 -24.924 69.321 18.214 1.00 0.00 H ATOM 490 N GLY A 52 -26.278 66.916 19.375 1.00 80.92 N ATOM 491 CA GLY A 52 -26.719 65.891 20.307 1.00 82.53 C ATOM 492 C GLY A 52 -28.120 66.119 20.830 1.00 78.90 C ATOM 493 O GLY A 52 -29.016 66.579 20.115 1.00 74.66 O ATOM 494 H GLY A 52 -26.200 67.917 19.645 1.00 0.00 H ATOM 495 N SER A 53 -28.314 65.808 22.097 1.00 80.50 N ATOM 496 CA SER A 53 -29.567 66.183 22.717 1.00 81.99 C ATOM 497 C SER A 53 -29.653 67.706 22.838 1.00 77.85 C ATOM 498 O SER A 53 -28.650 68.435 22.735 1.00 74.17 O ATOM 499 CB SER A 53 -29.683 65.550 24.090 1.00 81.26 C ATOM 500 OG SER A 53 -29.018 66.413 24.988 1.00 79.74 O ATOM 501 HG SER A 53 -29.451 67.303 24.971 1.00 0.00 H ATOM 502 H SER A 53 -27.583 65.304 22.639 1.00 0.00 H ATOM 503 N LYS A 73 -30.879 68.192 23.025 1.00 77.47 N ATOM 504 CA LYS A 73 -31.047 69.606 23.298 1.00 80.13 C ATOM 505 C LYS A 73 -30.360 69.884 24.616 1.00 80.68 C ATOM 506 O LYS A 73 -30.377 69.043 25.515 1.00 88.38 O ATOM 507 CB LYS A 73 -32.526 69.985 23.367 1.00 84.53 C ATOM 508 H LYS A 73 -31.707 67.564 22.976 1.00 0.00 H ATOM 509 N HIS A 74 -29.695 71.016 24.709 1.00 77.45 N ATOM 510 CA HIS A 74 -28.959 71.393 25.909 1.00 79.66 C ATOM 511 C HIS A 74 -27.701 70.567 26.165 1.00 69.06 C ATOM 512 O HIS A 74 -27.107 70.708 27.230 1.00 64.15 O ATOM 513 CB HIS A 74 -29.828 71.323 27.172 1.00 88.17 C ATOM 514 CG HIS A 74 -31.079 72.126 27.085 1.00 96.18 C ATOM 515 ND1 HIS A 74 -32.274 71.595 26.651 1.00 99.29 N ATOM 516 CD2 HIS A 74 -31.320 73.427 27.362 1.00 96.26 C ATOM 517 CE1 HIS A 74 -33.203 72.531 26.678 1.00 99.62 C ATOM 518 NE2 HIS A 74 -32.651 73.650 27.109 1.00 98.40 N ATOM 519 H HIS A 74 -29.695 71.665 23.896 1.00 0.00 H ATOM 520 N ARG A 75 -27.268 69.702 25.246 1.00 60.74 N ATOM 521 CA ARG A 75 -26.033 68.989 25.547 1.00 56.26 C ATOM 522 C ARG A 75 -24.800 69.912 25.511 1.00 54.23 C ATOM 523 O ARG A 75 -23.855 69.720 26.297 1.00 53.71 O ATOM 524 CB ARG A 75 -25.833 67.810 24.601 1.00 58.10 C ATOM 525 CG ARG A 75 -24.477 67.207 24.872 1.00 62.63 C ATOM 526 CD ARG A 75 -24.166 65.997 24.101 1.00 68.82 C ATOM 527 NE ARG A 75 -22.810 65.552 24.412 1.00 67.66 N ATOM 528 CZ ARG A 75 -22.329 64.364 24.066 1.00 61.74 C ATOM 529 NH1 ARG A 75 -23.096 63.499 23.412 1.00 61.11 N ATOM 530 NH2 ARG A 75 -21.070 64.053 24.373 1.00 61.96 N ATOM 531 HE ARG A 75 -22.187 66.202 24.933 1.00 0.00 H ATOM 532 HH12 ARG A 75 -22.717 62.569 23.142 1.00 0.00 H ATOM 533 HH11 ARG A 75 -24.075 63.752 23.170 1.00 0.00 H ATOM 534 HH22 ARG A 75 -20.684 63.125 24.106 1.00 0.00 H ATOM 535 HH21 ARG A 75 -20.474 64.738 24.879 1.00 0.00 H ATOM 536 H ARG A 75 -27.786 69.544 24.358 1.00 0.00 H ATOM 537 N PHE A 76 -24.765 70.921 24.613 1.00 47.43 N ATOM 538 CA PHE A 76 -23.552 71.722 24.445 1.00 46.14 C ATOM 539 C PHE A 76 -23.786 73.189 24.810 1.00 48.28 C ATOM 540 O PHE A 76 -24.904 73.707 24.718 1.00 53.09 O ATOM 541 CB PHE A 76 -23.025 71.673 23.014 1.00 44.49 C ATOM 542 CG PHE A 76 -22.597 70.326 22.592 1.00 44.49 C ATOM 543 CD1 PHE A 76 -21.439 69.772 23.093 1.00 45.43 C ATOM 544 CD2 PHE A 76 -23.362 69.603 21.710 1.00 48.50 C ATOM 545 CE1 PHE A 76 -21.047 68.482 22.754 1.00 52.84 C ATOM 546 CE2 PHE A 76 -22.973 68.311 21.321 1.00 52.58 C ATOM 547 CZ PHE A 76 -21.806 67.745 21.860 1.00 53.72 C ATOM 548 H PHE A 76 -25.606 71.130 24.037 1.00 0.00 H ATOM 549 N GLU A 77 -22.697 73.852 25.196 1.00 44.67 N ATOM 550 CA GLU A 77 -22.657 75.306 25.321 1.00 44.19 C ATOM 551 C GLU A 77 -21.680 75.795 24.251 1.00 44.21 C ATOM 552 O GLU A 77 -20.568 75.262 24.144 1.00 42.89 O ATOM 553 CB GLU A 77 -22.205 75.738 26.722 1.00 41.63 C ATOM 554 CG GLU A 77 -22.503 77.219 27.024 1.00 49.49 C ATOM 555 CD GLU A 77 -23.960 77.552 26.829 1.00 59.60 C ATOM 556 OE1 GLU A 77 -24.793 77.056 27.631 1.00 60.33 O ATOM 557 OE2 GLU A 77 -24.246 78.257 25.818 1.00 64.48 O ATOM 558 H GLU A 77 -21.838 73.310 25.418 1.00 0.00 H ATOM 559 N ILE A 78 -22.110 76.789 23.465 1.00 40.90 N ATOM 560 CA ILE A 78 -21.283 77.388 22.421 1.00 41.96 C ATOM 561 C ILE A 78 -20.450 78.499 23.055 1.00 41.69 C ATOM 562 O ILE A 78 -21.001 79.394 23.700 1.00 41.06 O ATOM 563 CB ILE A 78 -22.137 77.980 21.277 1.00 53.73 C ATOM 564 CG1 ILE A 78 -23.260 77.049 20.849 1.00 66.71 C ATOM 565 CG2 ILE A 78 -21.221 78.277 20.022 1.00 54.56 C ATOM 566 CD1 ILE A 78 -24.048 77.505 19.618 1.00 68.43 C ATOM 567 H ILE A 78 -23.075 77.151 23.604 1.00 0.00 H ATOM 568 N ILE A 79 -19.141 78.474 22.844 1.00 36.60 N ATOM 569 CA ILE A 79 -18.265 79.537 23.283 1.00 34.52 C ATOM 570 C ILE A 79 -17.733 80.338 22.094 1.00 36.65 C ATOM 571 O ILE A 79 -17.588 81.568 22.155 1.00 34.98 O ATOM 572 CB ILE A 79 -17.119 78.923 24.102 1.00 33.37 C ATOM 573 CG1 ILE A 79 -17.690 78.196 25.366 1.00 34.48 C ATOM 574 CG2 ILE A 79 -16.124 80.035 24.572 1.00 35.41 C ATOM 575 CD1 ILE A 79 -16.617 77.284 25.962 1.00 42.69 C ATOM 576 H ILE A 79 -18.730 77.660 22.344 1.00 0.00 H ATOM 577 N GLU A 80 -17.398 79.645 21.012 1.00 36.95 N ATOM 578 CA GLU A 80 -16.895 80.340 19.830 1.00 41.06 C ATOM 579 C GLU A 80 -18.014 81.258 19.324 1.00 38.46 C ATOM 580 O GLU A 80 -19.205 80.977 19.510 1.00 37.55 O ATOM 581 CB GLU A 80 -16.465 79.288 18.761 1.00 37.37 C ATOM 582 CG GLU A 80 -15.964 79.817 17.484 1.00 39.62 C ATOM 583 CD GLU A 80 -14.678 80.647 17.666 1.00 41.86 C ATOM 584 OE1 GLU A 80 -13.544 80.068 17.696 1.00 39.29 O ATOM 585 OE2 GLU A 80 -14.853 81.894 17.782 1.00 44.68 O ATOM 586 H GLU A 80 -17.494 78.609 21.006 1.00 0.00 H ATOM 587 N GLY A 81 -17.641 82.351 18.683 1.00 37.83 N ATOM 588 CA GLY A 81 -18.681 83.141 18.057 1.00 35.73 C ATOM 589 C GLY A 81 -19.287 84.190 19.005 1.00 42.99 C ATOM 590 O GLY A 81 -20.236 84.868 18.617 1.00 46.40 O ATOM 591 H GLY A 81 -16.641 82.633 18.630 1.00 0.00 H ATOM 592 N ARG A 82 -18.834 84.253 20.264 1.00 36.77 N ATOM 593 CA ARG A 82 -19.243 85.255 21.245 1.00 35.53 C ATOM 594 C ARG A 82 -18.151 86.286 21.347 1.00 35.05 C ATOM 595 O ARG A 82 -16.945 85.979 21.166 1.00 35.24 O ATOM 596 CB ARG A 82 -19.441 84.621 22.630 1.00 31.69 C ATOM 597 CG ARG A 82 -20.527 83.476 22.597 1.00 30.71 C ATOM 598 CD ARG A 82 -20.815 83.015 24.046 1.00 34.06 C ATOM 599 NE ARG A 82 -21.756 81.902 24.108 1.00 35.57 N ATOM 600 CZ ARG A 82 -23.064 82.082 24.247 1.00 41.77 C ATOM 601 NH1 ARG A 82 -23.590 83.336 24.303 1.00 42.40 N ATOM 602 NH2 ARG A 82 -23.833 80.995 24.297 1.00 45.92 N ATOM 603 HE ARG A 82 -21.389 80.931 24.041 1.00 0.00 H ATOM 604 HH12 ARG A 82 -24.616 83.465 24.412 1.00 0.00 H ATOM 605 HH11 ARG A 82 -22.966 84.165 24.237 1.00 0.00 H ATOM 606 HH22 ARG A 82 -24.863 81.091 24.405 1.00 0.00 H ATOM 607 HH21 ARG A 82 -23.403 80.050 24.228 1.00 0.00 H ATOM 608 H ARG A 82 -18.142 83.537 20.564 1.00 0.00 H ATOM 609 N ASP A 83 -18.536 87.455 21.790 1.00 29.50 N ATOM 610 CA ASP A 83 -17.500 88.454 22.040 1.00 33.09 C ATOM 611 C ASP A 83 -16.684 88.016 23.224 1.00 32.82 C ATOM 612 O ASP A 83 -17.086 87.109 23.994 1.00 33.86 O ATOM 613 CB ASP A 83 -18.120 89.856 22.279 1.00 38.38 C ATOM 614 CG ASP A 83 -18.862 89.983 23.669 1.00 50.67 C ATOM 615 OD1 ASP A 83 -18.292 89.983 24.772 1.00 52.81 O ATOM 616 OD2 ASP A 83 -20.090 90.132 23.651 1.00 58.22 O ATOM 617 H ASP A 83 -19.541 87.665 21.958 1.00 0.00 H ATOM 618 N ARG A 84 -15.505 88.579 23.353 1.00 30.43 N ATOM 619 CA ARG A 84 -14.572 88.008 24.316 1.00 36.56 C ATOM 620 C ARG A 84 -15.110 88.029 25.744 1.00 35.02 C ATOM 621 O ARG A 84 -14.879 87.078 26.521 1.00 33.11 O ATOM 622 CB ARG A 84 -13.271 88.762 24.299 1.00 37.29 C ATOM 623 CG ARG A 84 -12.468 88.524 23.036 1.00 37.26 C ATOM 624 CD ARG A 84 -11.390 89.592 22.899 1.00 37.52 C ATOM 625 NE ARG A 84 -10.556 89.316 21.716 1.00 42.47 N ATOM 626 CZ ARG A 84 -10.964 89.581 20.463 1.00 45.17 C ATOM 627 NH1 ARG A 84 -12.177 90.111 20.265 1.00 39.12 N ATOM 628 NH2 ARG A 84 -10.195 89.254 19.403 1.00 46.49 N ATOM 629 HE ARG A 84 -9.614 88.899 21.856 1.00 0.00 H ATOM 630 HH12 ARG A 84 -12.502 90.320 19.299 1.00 0.00 H ATOM 631 HH11 ARG A 84 -12.795 90.314 21.077 1.00 0.00 H ATOM 632 HH22 ARG A 84 -10.522 89.464 18.439 1.00 0.00 H ATOM 633 HH21 ARG A 84 -9.275 88.792 19.551 1.00 0.00 H ATOM 634 H ARG A 84 -15.244 89.409 22.784 1.00 0.00 H ATOM 635 N ILE A 85 -15.680 89.169 26.158 1.00 30.36 N ATOM 636 CA ILE A 85 -16.165 89.243 27.557 1.00 35.65 C ATOM 637 C ILE A 85 -17.232 88.157 27.836 1.00 29.12 C ATOM 638 O ILE A 85 -17.181 87.470 28.867 1.00 28.58 O ATOM 639 CB ILE A 85 -16.728 90.642 27.851 1.00 31.32 C ATOM 640 CG1 ILE A 85 -15.542 91.596 28.004 1.00 29.56 C ATOM 641 CG2 ILE A 85 -17.563 90.599 29.200 1.00 33.14 C ATOM 642 CD1 ILE A 85 -15.963 93.136 28.206 1.00 36.96 C ATOM 643 H ILE A 85 -15.779 89.980 25.515 1.00 0.00 H ATOM 644 N MET A 86 -18.174 87.973 26.926 1.00 28.58 N ATOM 645 CA MET A 86 -19.246 86.943 27.148 1.00 29.13 C ATOM 646 C MET A 86 -18.679 85.529 27.065 1.00 31.85 C ATOM 647 O MET A 86 -19.036 84.646 27.882 1.00 33.28 O ATOM 648 CB MET A 86 -20.337 87.123 26.121 1.00 28.33 C ATOM 649 CG MET A 86 -21.153 88.438 26.325 1.00 40.55 C ATOM 650 SD MET A 86 -22.075 88.342 27.976 1.00 50.94 S ATOM 651 CE MET A 86 -22.545 86.573 28.028 1.00 43.77 C ATOM 652 H MET A 86 -18.173 88.542 26.055 1.00 0.00 H ATOM 653 N ALA A 87 -17.751 85.274 26.112 1.00 27.70 N ATOM 654 CA ALA A 87 -17.107 83.955 26.058 1.00 32.87 C ATOM 655 C ALA A 87 -16.452 83.563 27.386 1.00 33.28 C ATOM 656 O ALA A 87 -16.624 82.430 27.849 1.00 33.71 O ATOM 657 CB ALA A 87 -16.061 83.944 24.941 1.00 39.98 C ATOM 658 H ALA A 87 -17.496 86.009 25.422 1.00 0.00 H ATOM 659 N TRP A 88 -15.653 84.463 27.996 1.00 31.61 N ATOM 660 CA TRP A 88 -15.009 84.121 29.283 1.00 33.69 C ATOM 661 C TRP A 88 -16.015 84.053 30.435 1.00 34.33 C ATOM 662 O TRP A 88 -15.760 83.344 31.412 1.00 40.54 O ATOM 663 CB TRP A 88 -13.895 85.155 29.663 1.00 32.09 C ATOM 664 CG TRP A 88 -12.587 84.834 28.942 1.00 36.49 C ATOM 665 CD1 TRP A 88 -12.023 85.537 27.885 1.00 37.50 C ATOM 666 CD2 TRP A 88 -11.717 83.707 29.181 1.00 38.18 C ATOM 667 NE1 TRP A 88 -10.825 84.903 27.472 1.00 37.75 N ATOM 668 CE2 TRP A 88 -10.642 83.779 28.241 1.00 37.64 C ATOM 669 CE3 TRP A 88 -11.754 82.643 30.076 1.00 40.50 C ATOM 670 CZ2 TRP A 88 -9.623 82.850 28.211 1.00 43.89 C ATOM 671 CZ3 TRP A 88 -10.751 81.721 30.038 1.00 49.03 C ATOM 672 CH2 TRP A 88 -9.683 81.835 29.122 1.00 48.53 C ATOM 673 HE1 TRP A 88 -10.192 85.232 26.716 1.00 0.00 H ATOM 674 H TRP A 88 -15.490 85.394 27.563 1.00 0.00 H ATOM 675 N THR A 89 -17.080 84.855 30.400 1.00 36.12 N ATOM 676 CA THR A 89 -18.132 84.757 31.409 1.00 38.66 C ATOM 677 C THR A 89 -18.749 83.362 31.376 1.00 43.15 C ATOM 678 O THR A 89 -18.965 82.742 32.429 1.00 43.68 O ATOM 679 CB THR A 89 -19.206 85.804 31.164 1.00 37.31 C ATOM 680 OG1 THR A 89 -18.624 87.114 31.228 1.00 34.27 O ATOM 681 CG2 THR A 89 -20.278 85.738 32.234 1.00 33.50 C ATOM 682 HG1 THR A 89 -17.920 87.195 30.536 1.00 0.00 H ATOM 683 H THR A 89 -17.163 85.562 29.642 1.00 0.00 H ATOM 684 N VAL A 90 -18.977 82.832 30.168 1.00 37.35 N ATOM 685 CA VAL A 90 -19.476 81.451 30.054 1.00 39.56 C ATOM 686 C VAL A 90 -18.468 80.471 30.622 1.00 38.71 C ATOM 687 O VAL A 90 -18.809 79.609 31.450 1.00 39.33 O ATOM 688 CB VAL A 90 -19.790 81.116 28.591 1.00 39.28 C ATOM 689 CG1 VAL A 90 -20.075 79.592 28.430 1.00 43.85 C ATOM 690 CG2 VAL A 90 -20.892 81.976 28.131 1.00 34.94 C ATOM 691 H VAL A 90 -18.802 83.395 29.311 1.00 0.00 H ATOM 692 N VAL A 91 -17.202 80.570 30.180 1.00 35.75 N ATOM 693 CA VAL A 91 -16.205 79.598 30.619 1.00 38.62 C ATOM 694 C VAL A 91 -16.073 79.627 32.143 1.00 46.98 C ATOM 695 O VAL A 91 -16.047 78.575 32.806 1.00 49.13 O ATOM 696 CB VAL A 91 -14.843 79.886 29.948 1.00 43.26 C ATOM 697 CG1 VAL A 91 -13.693 79.080 30.642 1.00 42.79 C ATOM 698 CG2 VAL A 91 -14.891 79.601 28.466 1.00 38.44 C ATOM 699 H VAL A 91 -16.934 81.335 29.529 1.00 0.00 H ATOM 700 N ASN A 92 -15.952 80.845 32.716 1.00 43.55 N ATOM 701 CA ASN A 92 -15.669 80.956 34.148 1.00 47.00 C ATOM 702 C ASN A 92 -16.870 80.460 34.934 1.00 45.40 C ATOM 703 O ASN A 92 -16.719 79.814 35.977 1.00 51.70 O ATOM 704 CB ASN A 92 -15.328 82.431 34.525 1.00 47.54 C ATOM 705 CG ASN A 92 -13.902 82.866 34.149 1.00 48.36 C ATOM 706 OD1 ASN A 92 -12.962 82.057 34.174 1.00 51.50 O ATOM 707 ND2 ASN A 92 -13.724 84.186 33.825 1.00 46.76 N ATOM 708 HD22 ASN A 92 -14.538 84.833 33.815 1.00 0.00 H ATOM 709 HD21 ASN A 92 -12.775 84.540 33.589 1.00 0.00 H ATOM 710 H ASN A 92 -16.060 81.704 32.139 1.00 0.00 H ATOM 711 N SER A 93 -18.083 80.724 34.407 1.00 46.14 N ATOM 712 CA SER A 93 -19.325 80.208 34.994 1.00 48.58 C ATOM 713 C SER A 93 -19.318 78.686 35.049 1.00 53.10 C ATOM 714 O SER A 93 -19.651 78.068 36.083 1.00 54.94 O ATOM 715 CB SER A 93 -20.514 80.695 34.169 1.00 52.77 C ATOM 716 OG SER A 93 -21.736 80.213 34.731 1.00 59.24 O ATOM 717 HG SER A 93 -21.826 80.548 35.658 1.00 0.00 H ATOM 718 H SER A 93 -18.140 81.315 33.553 1.00 0.00 H ATOM 719 N ILE A 94 -18.961 78.055 33.932 1.00 52.62 N ATOM 720 CA ILE A 94 -18.943 76.595 33.888 1.00 53.15 C ATOM 721 C ILE A 94 -17.904 76.056 34.858 1.00 55.27 C ATOM 722 O ILE A 94 -18.146 75.058 35.560 1.00 54.91 O ATOM 723 CB ILE A 94 -18.700 76.117 32.436 1.00 50.23 C ATOM 724 CG1 ILE A 94 -19.934 76.419 31.565 1.00 46.32 C ATOM 725 CG2 ILE A 94 -18.468 74.628 32.417 1.00 52.69 C ATOM 726 CD1 ILE A 94 -19.615 76.403 30.042 1.00 43.11 C ATOM 727 H ILE A 94 -18.694 78.603 33.089 1.00 0.00 H ATOM 728 N CYS A 95 -16.744 76.712 34.950 1.00 54.02 N ATOM 729 CA CYS A 95 -15.732 76.205 35.869 1.00 59.65 C ATOM 730 C CYS A 95 -16.227 76.260 37.298 1.00 70.76 C ATOM 731 O CYS A 95 -15.899 75.381 38.113 1.00 73.79 O ATOM 732 CB CYS A 95 -14.440 76.982 35.730 1.00 62.26 C ATOM 733 SG CYS A 95 -13.645 76.777 34.126 1.00 61.39 S ATOM 734 H CYS A 95 -16.567 77.564 34.380 1.00 0.00 H ATOM 735 N ASN A 96 -17.062 77.243 37.605 1.00 77.14 N ATOM 736 CA ASN A 96 -17.590 77.382 38.955 1.00 87.97 C ATOM 737 C ASN A 96 -18.708 76.393 39.262 1.00 88.65 C ATOM 738 O ASN A 96 -18.783 75.892 40.388 1.00 93.29 O ATOM 739 CB ASN A 96 -18.062 78.818 39.168 1.00 90.48 C ATOM 740 CG ASN A 96 -16.912 79.743 39.415 1.00 96.57 C ATOM 741 OD1 ASN A 96 -16.075 79.465 40.271 1.00102.03 O ATOM 742 ND2 ASN A 96 -16.833 80.830 38.657 1.00 97.43 N ATOM 743 HD22 ASN A 96 -17.567 81.022 37.945 1.00 0.00 H ATOM 744 HD21 ASN A 96 -16.037 81.489 38.775 1.00 0.00 H ATOM 745 H ASN A 96 -17.344 77.924 36.871 1.00 0.00 H ATOM 746 N THR A 97 -19.580 76.096 38.302 1.00 81.45 N ATOM 747 CA THR A 97 -20.685 75.210 38.621 1.00 82.40 C ATOM 748 C THR A 97 -20.322 73.730 38.482 1.00 85.53 C ATOM 749 O THR A 97 -21.019 72.884 39.056 1.00 87.12 O ATOM 750 CB THR A 97 -21.926 75.550 37.774 1.00 77.60 C ATOM 751 OG1 THR A 97 -21.675 75.292 36.390 1.00 81.43 O ATOM 752 CG2 THR A 97 -22.292 76.987 37.910 1.00 66.08 C ATOM 753 HG1 THR A 97 -20.915 75.848 36.084 1.00 0.00 H ATOM 754 H THR A 97 -19.473 76.489 37.345 1.00 0.00 H ATOM 755 N THR A 98 -19.241 73.387 37.767 1.00 81.67 N ATOM 756 CA THR A 98 -18.846 71.996 37.611 1.00 76.88 C ATOM 757 C THR A 98 -17.475 71.675 38.171 1.00 77.44 C ATOM 758 O THR A 98 -17.113 70.495 38.211 1.00 81.92 O ATOM 759 CB THR A 98 -18.831 71.584 36.130 1.00 75.19 C ATOM 760 OG1 THR A 98 -17.760 72.266 35.475 1.00 74.01 O ATOM 761 CG2 THR A 98 -20.162 71.891 35.420 1.00 72.27 C ATOM 762 HG1 THR A 98 -17.897 73.243 35.551 1.00 0.00 H ATOM 763 H THR A 98 -18.673 74.131 37.314 1.00 0.00 H ATOM 764 N GLY A 99 -16.687 72.672 38.552 1.00 76.25 N ATOM 765 CA GLY A 99 -15.349 72.432 39.026 1.00 74.86 C ATOM 766 C GLY A 99 -14.300 72.059 37.993 1.00 79.46 C ATOM 767 O GLY A 99 -13.158 71.810 38.386 1.00 84.61 O ATOM 768 H GLY A 99 -17.044 73.648 38.507 1.00 0.00 H ATOM 769 N VAL A 100 -14.611 72.028 36.689 1.00 79.86 N ATOM 770 CA VAL A 100 -13.585 71.689 35.692 1.00 82.63 C ATOM 771 C VAL A 100 -12.471 72.746 35.701 1.00 79.45 C ATOM 772 O VAL A 100 -12.679 73.892 36.133 1.00 83.71 O ATOM 773 CB VAL A 100 -14.228 71.555 34.296 1.00 83.89 C ATOM 774 CG1 VAL A 100 -13.191 71.177 33.229 1.00 85.93 C ATOM 775 CG2 VAL A 100 -15.348 70.525 34.322 1.00 82.98 C ATOM 776 H VAL A 100 -15.581 72.244 36.382 1.00 0.00 H ATOM 777 N GLU A 101 -11.274 72.369 35.230 1.00 71.81 N ATOM 778 CA GLU A 101 -10.167 73.319 35.203 1.00 74.29 C ATOM 779 C GLU A 101 -10.414 74.434 34.171 1.00 74.96 C ATOM 780 O GLU A 101 -10.980 74.208 33.091 1.00 71.26 O ATOM 781 CB GLU A 101 -8.844 72.611 34.913 1.00 76.70 C ATOM 782 H GLU A 101 -11.134 71.398 34.883 1.00 0.00 H ATOM 783 N LYS A 102 -9.980 75.641 34.512 1.00 68.90 N ATOM 784 CA LYS A 102 -10.120 76.787 33.616 1.00 66.78 C ATOM 785 C LYS A 102 -9.075 76.712 32.497 1.00 70.54 C ATOM 786 O LYS A 102 -7.886 76.577 32.776 1.00 71.85 O ATOM 787 CB LYS A 102 -9.975 78.076 34.419 1.00 64.99 C ATOM 788 CG LYS A 102 -9.973 79.355 33.598 1.00 65.12 C ATOM 789 CD LYS A 102 -9.852 80.628 34.485 1.00 63.36 C ATOM 790 CE LYS A 102 -9.107 81.785 33.721 1.00 61.80 C ATOM 791 NZ LYS A 102 -9.877 83.081 33.810 1.00 53.93 N ATOM 792 HZ1 LYS A 102 -10.818 82.954 33.385 1.00 0.00 H ATOM 793 HZ2 LYS A 102 -9.980 83.354 34.808 1.00 0.00 H ATOM 794 HZ3 LYS A 102 -9.362 83.825 33.297 1.00 0.00 H ATOM 795 H LYS A 102 -9.529 75.775 35.440 1.00 0.00 H ATOM 796 N PRO A 103 -9.470 76.757 31.229 1.00 67.19 N ATOM 797 CA PRO A 103 -8.471 76.702 30.148 1.00 63.87 C ATOM 798 C PRO A 103 -7.670 77.995 30.078 1.00 56.67 C ATOM 799 O PRO A 103 -8.142 79.050 30.474 1.00 53.85 O ATOM 800 CB PRO A 103 -9.319 76.525 28.884 1.00 61.85 C ATOM 801 CG PRO A 103 -10.657 77.056 29.279 1.00 61.73 C ATOM 802 CD PRO A 103 -10.847 76.672 30.722 1.00 63.18 C ATOM 803 N LYS A 104 -6.418 77.885 29.600 1.00 60.35 N ATOM 804 CA LYS A 104 -5.590 79.069 29.341 1.00 61.46 C ATOM 805 C LYS A 104 -6.134 79.912 28.179 1.00 63.37 C ATOM 806 O LYS A 104 -5.961 81.141 28.178 1.00 65.34 O ATOM 807 CB LYS A 104 -4.138 78.658 29.074 1.00 65.72 C ATOM 808 H LYS A 104 -6.028 76.940 29.410 1.00 0.00 H ATOM 809 N SER A 105 -6.788 79.301 27.189 1.00 57.77 N ATOM 810 CA SER A 105 -7.333 80.073 26.067 1.00 59.36 C ATOM 811 C SER A 105 -8.754 79.604 25.747 1.00 51.82 C ATOM 812 O SER A 105 -9.131 78.471 26.061 1.00 56.43 O ATOM 813 CB SER A 105 -6.431 79.972 24.821 1.00 65.31 C ATOM 814 OG SER A 105 -6.259 78.628 24.388 1.00 67.49 O ATOM 815 HG SER A 105 -5.675 78.612 23.589 1.00 0.00 H ATOM 816 H SER A 105 -6.912 78.269 27.213 1.00 0.00 H ATOM 817 N LEU A 106 -9.526 80.477 25.115 1.00 42.03 N ATOM 818 CA LEU A 106 -10.932 80.236 24.867 1.00 40.68 C ATOM 819 C LEU A 106 -11.119 78.975 24.033 1.00 42.83 C ATOM 820 O LEU A 106 -10.496 78.876 22.970 1.00 45.59 O ATOM 821 CB LEU A 106 -11.540 81.438 24.131 1.00 38.92 C ATOM 822 CG LEU A 106 -12.006 82.565 25.023 1.00 42.59 C ATOM 823 CD1 LEU A 106 -12.596 83.745 24.159 1.00 32.47 C ATOM 824 CD2 LEU A 106 -13.015 82.113 26.113 1.00 36.88 C ATOM 825 H LEU A 106 -9.106 81.369 24.785 1.00 0.00 H ATOM 826 N PRO A 107 -11.895 77.955 24.506 1.00 43.15 N ATOM 827 CA PRO A 107 -12.198 76.781 23.665 1.00 42.78 C ATOM 828 C PRO A 107 -13.379 77.082 22.771 1.00 38.66 C ATOM 829 O PRO A 107 -13.896 78.196 22.831 1.00 37.74 O ATOM 830 CB PRO A 107 -12.552 75.684 24.681 1.00 48.37 C ATOM 831 CG PRO A 107 -12.224 76.201 26.023 1.00 51.13 C ATOM 832 CD PRO A 107 -12.351 77.733 25.875 1.00 48.83 C ATOM 833 N ASP A 108 -13.915 76.106 22.047 1.00 36.31 N ATOM 834 CA ASP A 108 -15.061 76.342 21.162 1.00 35.61 C ATOM 835 C ASP A 108 -16.438 76.001 21.747 1.00 35.77 C ATOM 836 O ASP A 108 -17.436 76.687 21.419 1.00 35.92 O ATOM 837 CB ASP A 108 -14.858 75.533 19.903 1.00 38.19 C ATOM 838 CG ASP A 108 -13.659 76.070 19.110 1.00 41.75 C ATOM 839 OD1 ASP A 108 -13.466 77.278 19.155 1.00 38.28 O ATOM 840 OD2 ASP A 108 -12.987 75.298 18.465 1.00 39.49 O ATOM 841 H ASP A 108 -13.512 75.149 22.109 1.00 0.00 H ATOM 842 N LEU A 109 -16.520 74.923 22.525 1.00 36.10 N ATOM 843 CA LEU A 109 -17.761 74.383 23.098 1.00 44.31 C ATOM 844 C LEU A 109 -17.439 73.871 24.485 1.00 43.17 C ATOM 845 O LEU A 109 -16.271 73.557 24.770 1.00 43.33 O ATOM 846 CB LEU A 109 -18.322 73.158 22.309 1.00 41.65 C ATOM 847 CG LEU A 109 -18.740 73.468 20.860 1.00 47.70 C ATOM 848 CD1 LEU A 109 -18.940 72.223 20.030 1.00 50.64 C ATOM 849 CD2 LEU A 109 -19.979 74.313 20.831 1.00 46.93 C ATOM 850 H LEU A 109 -15.635 74.423 22.745 1.00 0.00 H ATOM 851 N TYR A 110 -18.472 73.791 25.327 1.00 41.65 N ATOM 852 CA TYR A 110 -18.441 72.895 26.500 1.00 44.87 C ATOM 853 C TYR A 110 -19.451 71.754 26.364 1.00 47.47 C ATOM 854 O TYR A 110 -20.592 71.979 25.940 1.00 49.64 O ATOM 855 CB TYR A 110 -18.730 73.700 27.767 1.00 47.23 C ATOM 856 CG TYR A 110 -18.626 72.848 29.021 1.00 51.68 C ATOM 857 CD1 TYR A 110 -17.394 72.517 29.540 1.00 52.40 C ATOM 858 CD2 TYR A 110 -19.764 72.393 29.677 1.00 52.25 C ATOM 859 CE1 TYR A 110 -17.279 71.716 30.712 1.00 59.05 C ATOM 860 CE2 TYR A 110 -19.678 71.630 30.833 1.00 58.53 C ATOM 861 CZ TYR A 110 -18.430 71.287 31.349 1.00 60.38 C ATOM 862 OH TYR A 110 -18.311 70.533 32.497 1.00 62.68 O ATOM 863 HH TYR A 110 -17.352 70.395 32.702 1.00 0.00 H ATOM 864 H TYR A 110 -19.317 74.372 25.153 1.00 0.00 H ATOM 865 N ASP A 111 -19.045 70.507 26.728 1.00 51.78 N ATOM 866 CA ASP A 111 -19.898 69.322 26.626 1.00 48.25 C ATOM 867 C ASP A 111 -20.388 68.985 28.049 1.00 53.30 C ATOM 868 O ASP A 111 -19.596 68.535 28.883 1.00 52.90 O ATOM 869 CB ASP A 111 -19.109 68.158 25.998 1.00 46.12 C ATOM 870 CG ASP A 111 -19.928 66.870 25.846 1.00 54.51 C ATOM 871 OD1 ASP A 111 -21.068 66.797 26.382 1.00 55.26 O ATOM 872 OD2 ASP A 111 -19.420 65.914 25.192 1.00 50.22 O ATOM 873 H ASP A 111 -18.080 70.390 27.097 1.00 0.00 H ATOM 874 N TYR A 112 -21.681 69.238 28.331 1.00 54.15 N ATOM 875 CA TYR A 112 -22.223 68.990 29.677 1.00 58.31 C ATOM 876 C TYR A 112 -22.326 67.532 29.989 1.00 64.39 C ATOM 877 O TYR A 112 -22.295 67.151 31.173 1.00 70.12 O ATOM 878 CB TYR A 112 -23.614 69.589 29.845 1.00 59.27 C ATOM 879 CG TYR A 112 -23.610 71.086 29.934 1.00 57.67 C ATOM 880 CD1 TYR A 112 -23.195 71.740 31.091 1.00 57.98 C ATOM 881 CD2 TYR A 112 -24.062 71.844 28.880 1.00 59.98 C ATOM 882 CE1 TYR A 112 -23.186 73.164 31.167 1.00 55.45 C ATOM 883 CE2 TYR A 112 -24.046 73.271 28.939 1.00 60.24 C ATOM 884 CZ TYR A 112 -23.632 73.903 30.102 1.00 57.26 C ATOM 885 OH TYR A 112 -23.655 75.271 30.115 1.00 58.62 O ATOM 886 HH TYR A 112 -23.339 75.597 30.995 1.00 0.00 H ATOM 887 H TYR A 112 -22.304 69.613 27.588 1.00 0.00 H ATOM 888 N LYS A 113 -22.522 66.705 28.955 1.00 64.58 N ATOM 889 CA LYS A 113 -22.605 65.273 29.151 1.00 64.62 C ATOM 890 C LYS A 113 -21.262 64.722 29.601 1.00 67.89 C ATOM 891 O LYS A 113 -21.195 64.041 30.625 1.00 77.11 O ATOM 892 CB LYS A 113 -23.092 64.595 27.872 1.00 63.84 C ATOM 893 H LYS A 113 -22.616 67.097 27.996 1.00 0.00 H ATOM 894 N GLU A 114 -20.180 64.982 28.854 1.00 64.21 N ATOM 895 CA GLU A 114 -18.867 64.477 29.244 1.00 62.64 C ATOM 896 C GLU A 114 -18.151 65.375 30.233 1.00 68.47 C ATOM 897 O GLU A 114 -17.087 64.989 30.723 1.00 72.99 O ATOM 898 CB GLU A 114 -17.943 64.307 28.049 1.00 61.52 C ATOM 899 CG GLU A 114 -18.319 63.238 27.058 1.00 66.72 C ATOM 900 CD GLU A 114 -18.282 61.779 27.639 1.00 75.97 C ATOM 901 OE1 GLU A 114 -19.039 60.941 27.111 1.00 78.03 O ATOM 902 OE2 GLU A 114 -17.516 61.477 28.594 1.00 77.44 O ATOM 903 H GLU A 114 -20.277 65.549 27.988 1.00 0.00 H ATOM 904 N ASN A 115 -18.664 66.580 30.492 1.00 68.08 N ATOM 905 CA ASN A 115 -18.040 67.551 31.408 1.00 72.76 C ATOM 906 C ASN A 115 -16.604 67.930 30.996 1.00 66.68 C ATOM 907 O ASN A 115 -15.650 67.784 31.763 1.00 63.97 O ATOM 908 CB ASN A 115 -18.096 67.027 32.854 1.00 82.84 C ATOM 909 CG ASN A 115 -19.387 67.436 33.545 1.00 88.03 C ATOM 910 OD1 ASN A 115 -20.143 66.590 34.013 1.00 95.60 O ATOM 911 ND2 ASN A 115 -19.680 68.753 33.544 1.00 79.27 N ATOM 912 HD22 ASN A 115 -19.009 69.435 33.136 1.00 0.00 H ATOM 913 HD21 ASN A 115 -20.577 69.086 33.951 1.00 0.00 H ATOM 914 H ASN A 115 -19.552 66.848 30.022 1.00 0.00 H ATOM 915 N ARG A 116 -16.468 68.473 29.777 1.00 61.38 N ATOM 916 CA ARG A 116 -15.154 68.839 29.253 1.00 53.08 C ATOM 917 C ARG A 116 -15.337 69.887 28.185 1.00 52.62 C ATOM 918 O ARG A 116 -16.362 69.899 27.480 1.00 47.85 O ATOM 919 CB ARG A 116 -14.419 67.656 28.640 1.00 54.95 C ATOM 920 CG ARG A 116 -15.091 66.981 27.453 1.00 51.47 C ATOM 921 CD ARG A 116 -14.511 65.505 27.284 1.00 58.48 C ATOM 922 NE ARG A 116 -15.101 64.913 26.087 1.00 62.02 N ATOM 923 CZ ARG A 116 -15.058 63.627 25.742 1.00 60.96 C ATOM 924 NH1 ARG A 116 -14.414 62.744 26.516 1.00 57.53 N ATOM 925 NH2 ARG A 116 -15.669 63.258 24.610 1.00 58.00 N ATOM 926 HE ARG A 116 -15.603 65.557 25.442 1.00 0.00 H ATOM 927 HH12 ARG A 116 -14.382 61.741 26.244 1.00 0.00 H ATOM 928 HH11 ARG A 116 -13.946 63.062 27.389 1.00 0.00 H ATOM 929 HH22 ARG A 116 -15.654 62.262 24.312 1.00 0.00 H ATOM 930 HH21 ARG A 116 -16.159 63.968 24.028 1.00 0.00 H ATOM 931 H ARG A 116 -17.314 68.637 29.194 1.00 0.00 H ATOM 932 N PHE A 117 -14.331 70.761 28.076 1.00 56.08 N ATOM 933 CA PHE A 117 -14.256 71.711 26.967 1.00 55.29 C ATOM 934 C PHE A 117 -13.793 70.988 25.707 1.00 55.58 C ATOM 935 O PHE A 117 -13.137 69.949 25.766 1.00 54.83 O ATOM 936 CB PHE A 117 -13.312 72.860 27.304 1.00 48.14 C ATOM 937 CG PHE A 117 -13.876 73.768 28.322 1.00 48.86 C ATOM 938 CD1 PHE A 117 -14.883 74.665 27.986 1.00 44.97 C ATOM 939 CD2 PHE A 117 -13.458 73.687 29.648 1.00 58.89 C ATOM 940 CE1 PHE A 117 -15.450 75.520 28.950 1.00 44.78 C ATOM 941 CE2 PHE A 117 -14.012 74.556 30.620 1.00 55.36 C ATOM 942 CZ PHE A 117 -15.016 75.458 30.274 1.00 46.97 C ATOM 943 H PHE A 117 -13.583 70.765 28.798 1.00 0.00 H ATOM 944 N ILE A 118 -14.148 71.562 24.558 1.00 51.95 N ATOM 945 CA ILE A 118 -13.867 70.997 23.246 1.00 51.49 C ATOM 946 C ILE A 118 -13.245 72.085 22.398 1.00 47.44 C ATOM 947 O ILE A 118 -13.797 73.189 22.296 1.00 45.28 O ATOM 948 CB ILE A 118 -15.140 70.480 22.534 1.00 55.28 C ATOM 949 CG1 ILE A 118 -15.871 69.392 23.333 1.00 57.33 C ATOM 950 CG2 ILE A 118 -14.817 69.933 21.169 1.00 56.85 C ATOM 951 CD1 ILE A 118 -17.188 68.885 22.674 1.00 55.83 C ATOM 952 H ILE A 118 -14.656 72.468 24.601 1.00 0.00 H ATOM 953 N GLU A 119 -12.137 71.764 21.763 1.00 46.14 N ATOM 954 CA GLU A 119 -11.533 72.609 20.747 1.00 48.73 C ATOM 955 C GLU A 119 -11.849 72.010 19.379 1.00 49.75 C ATOM 956 O GLU A 119 -11.551 70.849 19.143 1.00 51.11 O ATOM 957 CB GLU A 119 -10.022 72.717 20.972 1.00 46.74 C ATOM 958 CG GLU A 119 -9.266 73.426 19.823 1.00 51.66 C ATOM 959 CD GLU A 119 -9.849 74.825 19.493 1.00 54.21 C ATOM 960 OE1 GLU A 119 -9.968 75.169 18.282 1.00 55.82 O ATOM 961 OE2 GLU A 119 -10.164 75.579 20.441 1.00 53.96 O ATOM 962 H GLU A 119 -11.673 70.864 22.000 1.00 0.00 H ATOM 963 N ILE A 120 -12.484 72.764 18.495 1.00 47.73 N ATOM 964 CA ILE A 120 -12.824 72.240 17.176 1.00 50.96 C ATOM 965 C ILE A 120 -11.781 72.748 16.186 1.00 53.75 C ATOM 966 O ILE A 120 -11.418 73.925 16.220 1.00 53.30 O ATOM 967 CB ILE A 120 -14.231 72.675 16.721 1.00 49.89 C ATOM 968 CG1 ILE A 120 -15.360 72.097 17.586 1.00 50.59 C ATOM 969 CG2 ILE A 120 -14.383 72.380 15.242 1.00 46.83 C ATOM 970 CD1 ILE A 120 -15.381 70.567 17.557 1.00 58.50 C ATOM 971 H ILE A 120 -12.743 73.740 18.743 1.00 0.00 H ATOM 972 N GLY A 121 -11.283 71.865 15.312 1.00 52.46 N ATOM 973 CA GLY A 121 -10.389 72.287 14.224 1.00 51.98 C ATOM 974 C GLY A 121 -10.937 71.888 12.874 1.00 52.42 C ATOM 975 O GLY A 121 -11.537 70.832 12.723 1.00 52.37 O ATOM 976 H GLY A 121 -11.534 70.860 15.405 1.00 0.00 H ATOM 977 N VAL A 122 -10.750 72.753 11.878 1.00 52.65 N ATOM 978 CA VAL A 122 -11.093 72.423 10.483 1.00 51.42 C ATOM 979 C VAL A 122 -9.861 72.725 9.628 1.00 51.15 C ATOM 980 O VAL A 122 -9.369 73.858 9.636 1.00 47.32 O ATOM 981 CB VAL A 122 -12.294 73.247 9.958 1.00 50.33 C ATOM 982 CG1 VAL A 122 -12.582 72.894 8.514 1.00 52.39 C ATOM 983 CG2 VAL A 122 -13.555 73.015 10.809 1.00 49.23 C ATOM 984 H VAL A 122 -10.350 73.689 12.091 1.00 0.00 H ATOM 985 N THR A 123 -9.388 71.760 8.863 1.00 55.10 N ATOM 986 CA THR A 123 -8.066 71.894 8.258 1.00 61.62 C ATOM 987 C THR A 123 -8.120 71.664 6.750 1.00 65.09 C ATOM 988 O THR A 123 -8.855 70.792 6.273 1.00 59.52 O ATOM 989 CB THR A 123 -7.055 70.898 8.910 1.00 70.36 C ATOM 990 OG1 THR A 123 -5.777 70.934 8.234 1.00 76.69 O ATOM 991 CG2 THR A 123 -7.578 69.423 8.860 1.00 66.38 C ATOM 992 HG1 THR A 123 -5.401 71.848 8.289 1.00 0.00 H ATOM 993 H THR A 123 -9.956 70.906 8.691 1.00 0.00 H ATOM 994 N ARG A 124 -7.315 72.456 6.015 1.00 65.00 N ATOM 995 CA ARG A 124 -7.067 72.271 4.591 1.00 64.65 C ATOM 996 C ARG A 124 -5.829 71.415 4.322 1.00 67.58 C ATOM 997 O ARG A 124 -5.551 71.108 3.156 1.00 67.42 O ATOM 998 CB ARG A 124 -6.891 73.649 3.890 1.00 68.76 C ATOM 999 CG ARG A 124 -8.130 74.638 3.970 1.00 64.22 C ATOM 1000 CD ARG A 124 -7.718 76.130 4.045 1.00 66.21 C ATOM 1001 NE ARG A 124 -7.751 76.600 5.435 1.00 69.40 N ATOM 1002 CZ ARG A 124 -7.222 77.741 5.877 1.00 72.78 C ATOM 1003 NH1 ARG A 124 -6.633 78.585 5.035 1.00 74.88 N ATOM 1004 NH2 ARG A 124 -7.272 78.052 7.177 1.00 72.80 N ATOM 1005 HE ARG A 124 -8.226 75.993 6.133 1.00 0.00 H ATOM 1006 HH12 ARG A 124 -6.223 79.473 5.390 1.00 0.00 H ATOM 1007 HH11 ARG A 124 -6.582 78.358 4.021 1.00 0.00 H ATOM 1008 HH22 ARG A 124 -6.857 78.944 7.515 1.00 0.00 H ATOM 1009 HH21 ARG A 124 -7.726 77.402 7.850 1.00 0.00 H ATOM 1010 H ARG A 124 -6.841 73.248 6.494 1.00 0.00 H ATOM 1011 N ARG A 125 -5.070 71.030 5.354 1.00 71.09 N ATOM 1012 CA ARG A 125 -3.953 70.105 5.153 1.00 79.75 C ATOM 1013 C ARG A 125 -4.426 68.675 5.466 1.00 86.56 C ATOM 1014 O ARG A 125 -5.203 68.121 4.686 1.00 93.14 O ATOM 1015 CB ARG A 125 -2.736 70.568 5.960 1.00 77.41 C ATOM 1016 CG ARG A 125 -2.329 72.056 5.691 1.00 77.68 C ATOM 1017 CD ARG A 125 -1.159 72.491 6.567 1.00 78.24 C ATOM 1018 NE ARG A 125 -1.648 72.993 7.857 1.00 76.24 N ATOM 1019 CZ ARG A 125 -0.909 73.130 8.956 1.00 78.18 C ATOM 1020 NH1 ARG A 125 0.375 72.784 8.949 1.00 81.78 N ATOM 1021 NH2 ARG A 125 -1.470 73.590 10.078 1.00 78.68 N ATOM 1022 HE ARG A 125 -2.651 73.263 7.917 1.00 0.00 H ATOM 1023 HH12 ARG A 125 0.948 72.893 9.810 1.00 0.00 H ATOM 1024 HH11 ARG A 125 0.807 72.404 8.082 1.00 0.00 H ATOM 1025 HH22 ARG A 125 -0.897 73.699 10.939 1.00 0.00 H ATOM 1026 HH21 ARG A 125 -2.480 73.839 10.090 1.00 0.00 H ATOM 1027 H ARG A 125 -5.275 71.391 6.308 1.00 0.00 H ATOM 1028 N GLU A 126 -4.000 68.043 6.558 1.00 85.52 N ATOM 1029 CA GLU A 126 -4.607 66.770 6.947 1.00 87.30 C ATOM 1030 C GLU A 126 -4.668 66.716 8.461 1.00 81.20 C ATOM 1031 O GLU A 126 -4.010 67.497 9.156 1.00 78.06 O ATOM 1032 CB GLU A 126 -3.881 65.549 6.362 1.00 99.57 C ATOM 1033 CG GLU A 126 -2.523 65.272 6.969 1.00107.68 C ATOM 1034 CD GLU A 126 -2.545 64.226 8.079 1.00111.57 C ATOM 1035 OE1 GLU A 126 -3.155 63.137 7.915 1.00111.29 O ATOM 1036 OE2 GLU A 126 -1.947 64.527 9.134 1.00113.32 O ATOM 1037 H GLU A 126 -3.237 68.454 7.133 1.00 0.00 H ATOM 1038 N VAL A 127 -5.490 65.797 8.977 1.00 75.99 N ATOM 1039 CA VAL A 127 -5.992 65.980 10.340 1.00 68.72 C ATOM 1040 C VAL A 127 -4.874 65.809 11.388 1.00 73.24 C ATOM 1041 O VAL A 127 -4.862 66.530 12.398 1.00 69.97 O ATOM 1042 CB VAL A 127 -7.186 65.028 10.593 1.00 65.94 C ATOM 1043 CG1 VAL A 127 -8.406 65.455 9.748 1.00 62.41 C ATOM 1044 CG2 VAL A 127 -6.780 63.576 10.271 1.00 64.83 C ATOM 1045 H VAL A 127 -5.769 64.965 8.419 1.00 0.00 H ATOM 1046 N HIS A 128 -3.902 64.870 11.170 1.00 73.71 N ATOM 1047 CA HIS A 128 -2.907 64.574 12.205 1.00 76.17 C ATOM 1048 C HIS A 128 -1.912 65.700 12.429 1.00 77.63 C ATOM 1049 O HIS A 128 -1.576 65.997 13.580 1.00 74.53 O ATOM 1050 CB HIS A 128 -2.172 63.276 11.865 1.00 87.05 C ATOM 1051 CG HIS A 128 -3.115 62.190 11.493 1.00 95.06 C ATOM 1052 ND1 HIS A 128 -3.482 61.938 10.188 1.00 96.91 N ATOM 1053 CD2 HIS A 128 -3.857 61.363 12.264 1.00 97.39 C ATOM 1054 CE1 HIS A 128 -4.373 60.961 10.172 1.00 98.13 C ATOM 1055 NE2 HIS A 128 -4.612 60.589 11.419 1.00 98.06 N ATOM 1056 H HIS A 128 -3.869 64.363 10.263 1.00 0.00 H ATOM 1057 N ILE A 129 -1.408 66.322 11.370 1.00 81.08 N ATOM 1058 CA ILE A 129 -0.562 67.489 11.583 1.00 85.05 C ATOM 1059 C ILE A 129 -1.334 68.589 12.328 1.00 76.89 C ATOM 1060 O ILE A 129 -0.825 69.178 13.295 1.00 72.45 O ATOM 1061 CB ILE A 129 0.026 67.979 10.244 1.00 94.15 C ATOM 1062 CG1 ILE A 129 0.726 69.329 10.414 1.00 95.61 C ATOM 1063 CG2 ILE A 129 -1.026 68.053 9.176 1.00 96.74 C ATOM 1064 CD1 ILE A 129 2.076 69.216 11.064 1.00101.19 C ATOM 1065 H ILE A 129 -1.613 65.983 10.408 1.00 0.00 H ATOM 1066 N TYR A 130 -2.587 68.844 11.947 1.00 74.32 N ATOM 1067 CA TYR A 130 -3.343 69.869 12.656 1.00 70.72 C ATOM 1068 C TYR A 130 -3.620 69.465 14.105 1.00 72.18 C ATOM 1069 O TYR A 130 -3.647 70.331 14.995 1.00 71.55 O ATOM 1070 CB TYR A 130 -4.663 70.175 11.920 1.00 72.43 C ATOM 1071 CG TYR A 130 -5.351 71.517 12.256 1.00 70.14 C ATOM 1072 CD1 TYR A 130 -5.172 72.633 11.454 1.00 71.68 C ATOM 1073 CD2 TYR A 130 -6.197 71.650 13.346 1.00 69.70 C ATOM 1074 CE1 TYR A 130 -5.806 73.858 11.735 1.00 69.63 C ATOM 1075 CE2 TYR A 130 -6.815 72.872 13.645 1.00 72.65 C ATOM 1076 CZ TYR A 130 -6.611 73.992 12.846 1.00 72.16 C ATOM 1077 OH TYR A 130 -7.245 75.225 13.128 1.00 73.35 O ATOM 1078 HH TYR A 130 -8.227 75.103 13.102 1.00 0.00 H ATOM 1079 H TYR A 130 -3.017 68.321 11.158 1.00 0.00 H ATOM 1080 N TYR A 131 -3.911 68.186 14.360 1.00 74.11 N ATOM 1081 CA TYR A 131 -4.196 67.755 15.730 1.00 75.98 C ATOM 1082 C TYR A 131 -3.014 68.045 16.640 1.00 80.00 C ATOM 1083 O TYR A 131 -3.175 68.606 17.735 1.00 80.05 O ATOM 1084 CB TYR A 131 -4.518 66.258 15.782 1.00 81.87 C ATOM 1085 CG TYR A 131 -4.875 65.766 17.180 1.00 82.90 C ATOM 1086 CD1 TYR A 131 -3.902 65.384 18.087 1.00 82.18 C ATOM 1087 CD2 TYR A 131 -6.211 65.754 17.605 1.00 80.70 C ATOM 1088 CE1 TYR A 131 -4.248 64.958 19.358 1.00 86.83 C ATOM 1089 CE2 TYR A 131 -6.567 65.320 18.865 1.00 79.72 C ATOM 1090 CZ TYR A 131 -5.592 64.929 19.744 1.00 85.85 C ATOM 1091 OH TYR A 131 -5.973 64.491 21.001 1.00 86.96 O ATOM 1092 HH TYR A 131 -6.460 65.216 21.468 1.00 0.00 H ATOM 1093 H TYR A 131 -3.935 67.495 13.583 1.00 0.00 H ATOM 1094 N LEU A 132 -1.817 67.638 16.205 1.00 80.80 N ATOM 1095 CA LEU A 132 -0.599 67.896 16.955 1.00 82.63 C ATOM 1096 C LEU A 132 -0.410 69.386 17.181 1.00 84.90 C ATOM 1097 O LEU A 132 -0.181 69.826 18.314 1.00 86.95 O ATOM 1098 CB LEU A 132 0.590 67.299 16.205 1.00 82.98 C ATOM 1099 CG LEU A 132 0.908 65.866 16.583 1.00 85.95 C ATOM 1100 CD1 LEU A 132 2.085 65.408 15.809 1.00 88.89 C ATOM 1101 CD2 LEU A 132 1.169 65.790 18.077 1.00 87.38 C ATOM 1102 H LEU A 132 -1.756 67.122 15.304 1.00 0.00 H ATOM 1103 N GLU A 133 -0.558 70.188 16.126 1.00 85.58 N ATOM 1104 CA GLU A 133 -0.384 71.625 16.281 1.00 86.43 C ATOM 1105 C GLU A 133 -1.298 72.176 17.361 1.00 85.09 C ATOM 1106 O GLU A 133 -0.832 72.850 18.278 1.00 89.15 O ATOM 1107 CB GLU A 133 -0.603 72.333 14.952 1.00 87.84 C ATOM 1108 CG GLU A 133 0.691 72.312 14.135 1.00 95.64 C ATOM 1109 CD GLU A 133 0.597 73.049 12.815 1.00 98.23 C ATOM 1110 OE1 GLU A 133 1.527 72.899 11.995 1.00101.65 O ATOM 1111 OE2 GLU A 133 -0.386 73.794 12.611 1.00 97.64 O ATOM 1112 H GLU A 133 -0.797 69.788 15.196 1.00 0.00 H ATOM 1113 N LYS A 134 -2.594 71.862 17.308 1.00 81.40 N ATOM 1114 CA LYS A 134 -3.489 72.344 18.356 1.00 77.75 C ATOM 1115 C LYS A 134 -3.202 71.687 19.704 1.00 83.72 C ATOM 1116 O LYS A 134 -3.469 72.284 20.746 1.00 85.78 O ATOM 1117 CB LYS A 134 -4.955 72.151 17.942 1.00 78.35 C ATOM 1118 CG LYS A 134 -5.815 73.391 18.310 1.00 78.97 C ATOM 1119 CD LYS A 134 -6.975 73.668 17.332 1.00 78.16 C ATOM 1120 CE LYS A 134 -7.354 75.171 17.219 1.00 73.09 C ATOM 1121 NZ LYS A 134 -6.675 75.856 16.103 1.00 72.93 N ATOM 1122 HZ1 LYS A 134 -5.645 75.799 16.238 1.00 0.00 H ATOM 1123 HZ2 LYS A 134 -6.934 75.397 15.207 1.00 0.00 H ATOM 1124 HZ3 LYS A 134 -6.968 76.854 16.080 1.00 0.00 H ATOM 1125 H LYS A 134 -2.962 71.280 16.529 1.00 0.00 H ATOM 1126 N ALA A 135 -2.627 70.484 19.723 1.00 91.23 N ATOM 1127 CA ALA A 135 -2.185 69.924 20.998 1.00 96.89 C ATOM 1128 C ALA A 135 -1.056 70.758 21.598 1.00104.68 C ATOM 1129 O ALA A 135 -1.030 70.997 22.810 1.00109.37 O ATOM 1130 CB ALA A 135 -1.743 68.470 20.823 1.00 98.35 C ATOM 1131 H ALA A 135 -2.495 69.950 18.840 1.00 0.00 H ATOM 1132 N ASN A 136 -0.112 71.208 20.767 1.00106.52 N ATOM 1133 CA ASN A 136 0.951 72.060 21.277 1.00109.35 C ATOM 1134 C ASN A 136 0.434 73.462 21.532 1.00111.78 C ATOM 1135 O ASN A 136 0.794 74.078 22.537 1.00115.21 O ATOM 1136 CB ASN A 136 2.129 72.092 20.303 1.00112.07 C ATOM 1137 H ASN A 136 -0.137 70.950 19.760 1.00 0.00 H ATOM 1138 N LYS A 137 -0.429 73.969 20.641 1.00111.23 N ATOM 1139 CA LYS A 137 -0.929 75.334 20.767 1.00108.79 C ATOM 1140 C LYS A 137 -1.751 75.492 22.034 1.00109.09 C ATOM 1141 O LYS A 137 -1.527 76.416 22.821 1.00110.86 O ATOM 1142 CB LYS A 137 -1.758 75.719 19.537 1.00104.34 C ATOM 1143 H LYS A 137 -0.748 73.379 19.846 1.00 0.00 H ATOM 1144 N ILE A 138 -2.706 74.590 22.254 1.00107.20 N ATOM 1145 CA ILE A 138 -3.559 74.657 23.436 1.00104.88 C ATOM 1146 C ILE A 138 -2.756 74.146 24.622 1.00104.26 C ATOM 1147 O ILE A 138 -2.439 74.910 25.540 1.00103.01 O ATOM 1148 CB ILE A 138 -4.860 73.853 23.254 1.00100.35 C ATOM 1149 H ILE A 138 -2.847 73.821 21.568 1.00 0.00 H ATOM 1150 N LYS A 139 -2.432 72.847 24.603 1.00106.02 N ATOM 1151 CA LYS A 139 -1.660 72.155 25.640 1.00111.55 C ATOM 1152 C LYS A 139 -2.371 72.100 26.988 1.00115.59 C ATOM 1153 O LYS A 139 -1.896 71.418 27.909 1.00118.49 O ATOM 1154 CB LYS A 139 -0.273 72.786 25.819 1.00112.39 C ATOM 1155 H LYS A 139 -2.753 72.285 23.789 1.00 0.00 H ATOM 1156 N SER A 140 -3.488 72.827 27.123 1.00114.74 N ATOM 1157 CA SER A 140 -4.366 72.673 28.275 1.00112.45 C ATOM 1158 C SER A 140 -4.807 71.219 28.344 1.00109.90 C ATOM 1159 O SER A 140 -5.694 70.806 27.595 1.00110.87 O ATOM 1160 CB SER A 140 -5.575 73.607 28.175 1.00110.24 C ATOM 1161 OG SER A 140 -6.421 73.437 29.291 1.00110.31 O ATOM 1162 HG SER A 140 -7.197 74.047 29.212 1.00 0.00 H ATOM 1163 H SER A 140 -3.735 73.519 26.387 1.00 0.00 H ATOM 1164 N GLU A 141 -4.186 70.435 29.223 1.00105.29 N ATOM 1165 CA GLU A 141 -4.351 68.989 29.160 1.00103.03 C ATOM 1166 C GLU A 141 -5.816 68.565 29.208 1.00100.80 C ATOM 1167 O GLU A 141 -6.156 67.469 28.747 1.00101.37 O ATOM 1168 CB GLU A 141 -3.575 68.329 30.293 1.00102.88 C ATOM 1169 H GLU A 141 -3.581 70.856 29.957 1.00 0.00 H ATOM 1170 N LYS A 142 -6.704 69.400 29.737 1.00 94.74 N ATOM 1171 CA LYS A 142 -8.054 68.888 29.947 1.00 95.10 C ATOM 1172 C LYS A 142 -8.944 69.032 28.712 1.00 90.01 C ATOM 1173 O LYS A 142 -9.873 68.242 28.540 1.00 94.20 O ATOM 1174 CB LYS A 142 -8.695 69.570 31.158 1.00 95.13 C ATOM 1175 H LYS A 142 -6.448 70.376 29.990 1.00 0.00 H ATOM 1176 N THR A 143 -8.672 69.995 27.835 1.00 85.06 N ATOM 1177 CA THR A 143 -9.554 70.264 26.698 1.00 74.20 C ATOM 1178 C THR A 143 -9.473 69.149 25.650 1.00 72.26 C ATOM 1179 O THR A 143 -8.382 68.728 25.258 1.00 74.82 O ATOM 1180 CB THR A 143 -9.193 71.593 26.067 1.00 66.24 C ATOM 1181 OG1 THR A 143 -9.234 72.604 27.077 1.00 72.35 O ATOM 1182 CG2 THR A 143 -10.201 71.967 24.918 1.00 59.23 C ATOM 1183 HG1 THR A 143 -9.000 73.479 26.677 1.00 0.00 H ATOM 1184 H THR A 143 -7.814 70.569 27.960 1.00 0.00 H ATOM 1185 N HIS A 144 -10.642 68.684 25.200 1.00 66.55 N ATOM 1186 CA HIS A 144 -10.762 67.665 24.161 1.00 62.65 C ATOM 1187 C HIS A 144 -10.617 68.301 22.775 1.00 64.74 C ATOM 1188 O HIS A 144 -11.094 69.415 22.550 1.00 60.86 O ATOM 1189 CB HIS A 144 -12.120 66.981 24.302 1.00 59.09 C ATOM 1190 CG HIS A 144 -12.144 65.554 23.863 1.00 61.41 C ATOM 1191 ND1 HIS A 144 -11.715 64.509 24.665 1.00 65.58 N ATOM 1192 CD2 HIS A 144 -12.589 64.988 22.713 1.00 62.02 C ATOM 1193 CE1 HIS A 144 -11.881 63.366 24.014 1.00 66.41 C ATOM 1194 NE2 HIS A 144 -12.404 63.630 22.829 1.00 63.83 N ATOM 1195 H HIS A 144 -11.515 69.069 25.613 1.00 0.00 H ATOM 1196 N ILE A 145 -9.927 67.620 21.841 1.00 68.48 N ATOM 1197 CA ILE A 145 -9.668 68.186 20.503 1.00 66.58 C ATOM 1198 C ILE A 145 -10.361 67.320 19.450 1.00 61.00 C ATOM 1199 O ILE A 145 -10.196 66.103 19.447 1.00 59.26 O ATOM 1200 CB ILE A 145 -8.156 68.295 20.224 1.00 64.70 C ATOM 1201 CG1 ILE A 145 -7.529 69.226 21.245 1.00 67.83 C ATOM 1202 CG2 ILE A 145 -7.875 68.811 18.844 1.00 57.58 C ATOM 1203 CD1 ILE A 145 -6.023 69.177 21.261 1.00 70.77 C ATOM 1204 H ILE A 145 -9.567 66.671 22.068 1.00 0.00 H ATOM 1205 N HIS A 146 -11.111 67.943 18.540 1.00 54.63 N ATOM 1206 CA HIS A 146 -11.776 67.201 17.466 1.00 56.84 C ATOM 1207 C HIS A 146 -11.497 67.905 16.147 1.00 56.07 C ATOM 1208 O HIS A 146 -11.862 69.072 16.008 1.00 54.56 O ATOM 1209 CB HIS A 146 -13.284 67.133 17.730 1.00 55.50 C ATOM 1210 CG HIS A 146 -14.013 66.126 16.902 1.00 54.89 C ATOM 1211 ND1 HIS A 146 -15.150 65.472 17.355 1.00 54.10 N ATOM 1212 CD2 HIS A 146 -13.780 65.666 15.648 1.00 54.62 C ATOM 1213 CE1 HIS A 146 -15.560 64.622 16.422 1.00 60.90 C ATOM 1214 NE2 HIS A 146 -14.764 64.739 15.368 1.00 58.44 N ATOM 1215 H HIS A 146 -11.226 68.975 18.594 1.00 0.00 H ATOM 1216 N ILE A 147 -10.893 67.219 15.155 1.00 56.69 N ATOM 1217 CA ILE A 147 -10.493 67.892 13.906 1.00 57.31 C ATOM 1218 C ILE A 147 -11.295 67.303 12.750 1.00 57.59 C ATOM 1219 O ILE A 147 -11.474 66.078 12.675 1.00 58.28 O ATOM 1220 CB ILE A 147 -8.974 67.732 13.621 1.00 59.43 C ATOM 1221 CG1 ILE A 147 -8.157 68.045 14.875 1.00 63.35 C ATOM 1222 CG2 ILE A 147 -8.496 68.576 12.418 1.00 54.88 C ATOM 1223 CD1 ILE A 147 -8.430 69.409 15.365 1.00 48.29 C ATOM 1224 H ILE A 147 -10.707 66.203 15.273 1.00 0.00 H ATOM 1225 N PHE A 148 -11.727 68.155 11.818 1.00 55.52 N ATOM 1226 CA PHE A 148 -12.320 67.706 10.554 1.00 57.27 C ATOM 1227 C PHE A 148 -11.474 68.186 9.366 1.00 61.81 C ATOM 1228 O PHE A 148 -10.825 69.225 9.427 1.00 55.35 O ATOM 1229 CB PHE A 148 -13.764 68.214 10.383 1.00 51.12 C ATOM 1230 CG PHE A 148 -14.703 67.741 11.452 1.00 51.76 C ATOM 1231 CD1 PHE A 148 -14.898 68.496 12.598 1.00 51.89 C ATOM 1232 CD2 PHE A 148 -15.393 66.588 11.320 1.00 54.86 C ATOM 1233 CE1 PHE A 148 -15.770 68.085 13.602 1.00 51.36 C ATOM 1234 CE2 PHE A 148 -16.274 66.150 12.337 1.00 58.46 C ATOM 1235 CZ PHE A 148 -16.455 66.926 13.492 1.00 51.15 C ATOM 1236 H PHE A 148 -11.640 69.176 11.995 1.00 0.00 H ATOM 1237 N SER A 149 -11.463 67.421 8.285 1.00 63.82 N ATOM 1238 CA SER A 149 -10.863 67.886 7.023 1.00 62.64 C ATOM 1239 C SER A 149 -11.959 68.194 5.984 1.00 61.20 C ATOM 1240 O SER A 149 -13.143 67.970 6.196 1.00 63.17 O ATOM 1241 CB SER A 149 -9.914 66.827 6.479 1.00 63.11 C ATOM 1242 OG SER A 149 -10.697 65.896 5.790 1.00 64.08 O ATOM 1243 HG SER A 149 -10.114 65.187 5.419 1.00 0.00 H ATOM 1244 H SER A 149 -11.887 66.472 8.328 1.00 0.00 H ATOM 1245 N PHE A 150 -11.573 68.723 4.834 1.00 59.20 N ATOM 1246 CA PHE A 150 -12.550 68.837 3.756 1.00 63.47 C ATOM 1247 C PHE A 150 -12.704 67.557 2.939 1.00 68.03 C ATOM 1248 O PHE A 150 -13.578 67.484 2.065 1.00 70.06 O ATOM 1249 CB PHE A 150 -12.186 69.992 2.818 1.00 59.34 C ATOM 1250 CG PHE A 150 -12.469 71.315 3.415 1.00 58.41 C ATOM 1251 CD1 PHE A 150 -11.487 71.942 4.161 1.00 60.38 C ATOM 1252 CD2 PHE A 150 -13.681 71.959 3.221 1.00 55.09 C ATOM 1253 CE1 PHE A 150 -11.703 73.162 4.740 1.00 54.24 C ATOM 1254 CE2 PHE A 150 -13.924 73.170 3.798 1.00 56.72 C ATOM 1255 CZ PHE A 150 -12.949 73.810 4.546 1.00 55.72 C ATOM 1256 H PHE A 150 -10.595 69.050 4.701 1.00 0.00 H ATOM 1257 N THR A 151 -11.898 66.540 3.179 1.00 69.36 N ATOM 1258 CA THR A 151 -12.018 65.373 2.343 1.00 73.92 C ATOM 1259 C THR A 151 -12.626 64.215 3.113 1.00 80.78 C ATOM 1260 O THR A 151 -12.703 63.098 2.591 1.00 88.10 O ATOM 1261 CB THR A 151 -10.643 65.029 1.712 1.00 76.88 C ATOM 1262 OG1 THR A 151 -9.588 65.074 2.689 1.00 77.92 O ATOM 1263 CG2 THR A 151 -10.293 66.029 0.589 1.00 72.13 C ATOM 1264 HG1 THR A 151 -9.776 64.419 3.407 1.00 0.00 H ATOM 1265 H THR A 151 -11.198 66.580 3.947 1.00 0.00 H ATOM 1266 N GLY A 152 -13.072 64.456 4.343 1.00 75.53 N ATOM 1267 CA GLY A 152 -13.857 63.486 5.071 1.00 73.28 C ATOM 1268 C GLY A 152 -13.159 62.814 6.225 1.00 80.30 C ATOM 1269 O GLY A 152 -13.797 62.005 6.901 1.00 79.04 O ATOM 1270 H GLY A 152 -12.850 65.367 4.792 1.00 0.00 H ATOM 1271 N GLU A 153 -11.879 63.098 6.478 1.00 85.32 N ATOM 1272 CA GLU A 153 -11.222 62.517 7.640 1.00 87.05 C ATOM 1273 C GLU A 153 -11.599 63.310 8.871 1.00 76.72 C ATOM 1274 O GLU A 153 -11.841 64.526 8.815 1.00 71.93 O ATOM 1275 CB GLU A 153 -9.688 62.506 7.550 1.00 98.70 C ATOM 1276 CG GLU A 153 -9.038 62.239 6.215 1.00111.85 C ATOM 1277 CD GLU A 153 -9.028 63.484 5.361 1.00120.38 C ATOM 1278 OE1 GLU A 153 -10.103 63.807 4.815 1.00122.98 O ATOM 1279 OE2 GLU A 153 -7.981 64.168 5.274 1.00121.09 O ATOM 1280 H GLU A 153 -11.352 63.734 5.846 1.00 0.00 H ATOM 1281 N GLU A 154 -11.631 62.615 9.997 1.00 72.81 N ATOM 1282 CA GLU A 154 -11.681 63.280 11.290 1.00 68.72 C ATOM 1283 C GLU A 154 -10.684 62.602 12.219 1.00 71.90 C ATOM 1284 O GLU A 154 -10.154 61.496 11.942 1.00 75.91 O ATOM 1285 CB GLU A 154 -13.113 63.303 11.874 1.00 71.15 C ATOM 1286 CG GLU A 154 -13.678 61.928 12.198 1.00 80.97 C ATOM 1287 CD GLU A 154 -15.165 61.947 12.556 1.00 80.72 C ATOM 1288 OE1 GLU A 154 -15.888 61.058 12.030 1.00 85.85 O ATOM 1289 OE2 GLU A 154 -15.580 62.812 13.368 1.00 70.75 O ATOM 1290 H GLU A 154 -11.620 61.576 9.957 1.00 0.00 H ATOM 1291 N MET A 155 -10.382 63.308 13.296 1.00 69.25 N ATOM 1292 CA MET A 155 -9.446 62.833 14.306 1.00 74.95 C ATOM 1293 C MET A 155 -9.865 63.471 15.621 1.00 70.99 C ATOM 1294 O MET A 155 -10.168 64.661 15.640 1.00 66.56 O ATOM 1295 CB MET A 155 -8.013 63.230 13.924 1.00 80.30 C ATOM 1296 CG MET A 155 -7.051 63.319 15.081 1.00 86.46 C ATOM 1297 SD MET A 155 -6.215 61.785 15.494 1.00 97.19 S ATOM 1298 CE MET A 155 -6.195 61.940 17.290 1.00 99.58 C ATOM 1299 H MET A 155 -10.830 64.238 13.427 1.00 0.00 H ATOM 1300 N ALA A 156 -9.885 62.709 16.705 1.00 71.08 N ATOM 1301 CA ALA A 156 -10.321 63.260 17.974 1.00 70.34 C ATOM 1302 C ALA A 156 -9.481 62.689 19.104 1.00 74.63 C ATOM 1303 O ALA A 156 -8.782 61.681 18.945 1.00 75.67 O ATOM 1304 CB ALA A 156 -11.814 63.003 18.209 1.00 68.43 C ATOM 1305 H ALA A 156 -9.588 61.714 16.646 1.00 0.00 H ATOM 1306 N THR A 157 -9.537 63.362 20.251 1.00 74.93 N ATOM 1307 CA THR A 157 -8.725 62.930 21.384 1.00 77.22 C ATOM 1308 C THR A 157 -9.111 61.525 21.811 1.00 79.45 C ATOM 1309 O THR A 157 -10.300 61.190 21.865 1.00 74.91 O ATOM 1310 CB THR A 157 -8.904 63.886 22.550 1.00 75.58 C ATOM 1311 OG1 THR A 157 -8.283 65.116 22.216 1.00 72.58 O ATOM 1312 CG2 THR A 157 -8.235 63.328 23.787 1.00 77.97 C ATOM 1313 HG1 THR A 157 -7.320 64.963 22.047 1.00 0.00 H ATOM 1314 H THR A 157 -10.157 64.192 20.339 1.00 0.00 H ATOM 1315 N LYS A 158 -8.090 60.688 22.074 1.00 82.76 N ATOM 1316 CA LYS A 158 -8.278 59.342 22.599 1.00 85.50 C ATOM 1317 C LYS A 158 -9.306 58.567 21.767 1.00 86.07 C ATOM 1318 O LYS A 158 -9.995 57.686 22.285 1.00 83.05 O ATOM 1319 CB LYS A 158 -8.663 59.383 24.089 1.00 78.16 C ATOM 1320 H LYS A 158 -7.120 61.018 21.894 1.00 0.00 H ATOM 1321 N ALA A 159 -9.432 58.935 20.478 1.00 83.22 N ATOM 1322 CA ALA A 159 -10.374 58.327 19.534 1.00 80.76 C ATOM 1323 C ALA A 159 -11.829 58.424 20.018 1.00 78.75 C ATOM 1324 O ALA A 159 -12.672 57.584 19.663 1.00 78.99 O ATOM 1325 CB ALA A 159 -9.994 56.870 19.239 1.00 88.44 C ATOM 1326 H ALA A 159 -8.821 59.701 20.129 1.00 0.00 H ATOM 1327 N ASP A 160 -12.131 59.451 20.845 1.00 71.44 N ATOM 1328 CA ASP A 160 -13.455 59.668 21.425 1.00 72.58 C ATOM 1329 C ASP A 160 -14.089 60.807 20.623 1.00 72.92 C ATOM 1330 O ASP A 160 -13.596 61.943 20.660 1.00 70.87 O ATOM 1331 CB ASP A 160 -13.334 60.000 22.920 1.00 74.24 C ATOM 1332 CG ASP A 160 -14.689 60.286 23.609 1.00 75.64 C ATOM 1333 OD1 ASP A 160 -15.735 60.386 22.933 1.00 74.43 O ATOM 1334 OD2 ASP A 160 -14.702 60.409 24.856 1.00 77.96 O ATOM 1335 H ASP A 160 -11.376 60.126 21.082 1.00 0.00 H ATOM 1336 N TYR A 161 -15.168 60.497 19.887 1.00 71.49 N ATOM 1337 CA TYR A 161 -15.696 61.381 18.854 1.00 70.35 C ATOM 1338 C TYR A 161 -16.968 62.116 19.284 1.00 66.49 C ATOM 1339 O TYR A 161 -17.554 62.849 18.483 1.00 63.39 O ATOM 1340 CB TYR A 161 -15.911 60.578 17.560 1.00 70.34 C ATOM 1341 CG TYR A 161 -14.578 60.164 16.902 1.00 76.82 C ATOM 1342 CD1 TYR A 161 -13.872 61.050 16.111 1.00 76.17 C ATOM 1343 CD2 TYR A 161 -14.036 58.874 17.074 1.00 87.71 C ATOM 1344 CE1 TYR A 161 -12.654 60.713 15.507 1.00 77.56 C ATOM 1345 CE2 TYR A 161 -12.788 58.499 16.446 1.00 92.80 C ATOM 1346 CZ TYR A 161 -12.108 59.454 15.666 1.00 89.96 C ATOM 1347 OH TYR A 161 -10.899 59.180 15.037 1.00 90.28 O ATOM 1348 HH TYR A 161 -10.595 59.983 14.544 1.00 0.00 H ATOM 1349 H TYR A 161 -15.647 59.590 20.060 1.00 0.00 H ATOM 1350 N THR A 162 -17.417 61.906 20.520 1.00 66.35 N ATOM 1351 CA THR A 162 -18.423 62.742 21.165 1.00 66.53 C ATOM 1352 C THR A 162 -19.809 62.549 20.558 1.00 68.79 C ATOM 1353 O THR A 162 -20.715 62.133 21.272 1.00 69.80 O ATOM 1354 CB THR A 162 -17.982 64.221 21.128 1.00 59.37 C ATOM 1355 OG1 THR A 162 -16.792 64.327 21.906 1.00 58.93 O ATOM 1356 CG2 THR A 162 -19.013 65.195 21.742 1.00 56.69 C ATOM 1357 HG1 THR A 162 -16.092 63.745 21.517 1.00 0.00 H ATOM 1358 H THR A 162 -17.029 61.102 21.054 1.00 0.00 H ATOM 1359 N LEU A 163 -20.003 62.913 19.286 1.00 63.11 N ATOM 1360 CA LEU A 163 -21.300 62.813 18.634 1.00 59.62 C ATOM 1361 C LEU A 163 -21.491 61.422 18.013 1.00 65.81 C ATOM 1362 O LEU A 163 -20.541 60.647 17.859 1.00 64.79 O ATOM 1363 CB LEU A 163 -21.419 63.866 17.556 1.00 56.73 C ATOM 1364 CG LEU A 163 -20.942 65.268 17.925 1.00 56.86 C ATOM 1365 CD1 LEU A 163 -20.756 66.056 16.649 1.00 52.37 C ATOM 1366 CD2 LEU A 163 -21.961 65.946 18.821 1.00 57.48 C ATOM 1367 H LEU A 163 -19.197 63.281 18.742 1.00 0.00 H ATOM 1368 N ASP A 164 -22.728 61.124 17.615 1.00 66.76 N ATOM 1369 CA ASP A 164 -22.923 59.843 16.935 1.00 72.73 C ATOM 1370 C ASP A 164 -22.517 59.961 15.460 1.00 70.35 C ATOM 1371 O ASP A 164 -22.242 61.049 14.944 1.00 67.02 O ATOM 1372 CB ASP A 164 -24.373 59.373 17.088 1.00 78.38 C ATOM 1373 CG ASP A 164 -25.369 60.349 16.488 1.00 84.51 C ATOM 1374 OD1 ASP A 164 -24.948 61.262 15.769 1.00 87.59 O ATOM 1375 OD2 ASP A 164 -26.574 60.250 16.757 1.00 87.70 O ATOM 1376 H ASP A 164 -23.522 61.775 17.781 1.00 0.00 H ATOM 1377 N GLU A 165 -22.481 58.818 14.779 1.00 70.73 N ATOM 1378 CA GLU A 165 -22.045 58.782 13.379 1.00 75.49 C ATOM 1379 C GLU A 165 -22.924 59.658 12.485 1.00 75.02 C ATOM 1380 O GLU A 165 -22.408 60.326 11.576 1.00 77.48 O ATOM 1381 CB GLU A 165 -22.034 57.338 12.850 1.00 78.80 C ATOM 1382 CG GLU A 165 -20.947 56.455 13.419 1.00 87.62 C ATOM 1383 CD GLU A 165 -20.990 55.063 12.810 1.00 99.01 C ATOM 1384 OE1 GLU A 165 -21.634 54.926 11.745 1.00 99.30 O ATOM 1385 OE2 GLU A 165 -20.407 54.101 13.381 1.00104.83 O ATOM 1386 H GLU A 165 -22.767 57.935 15.248 1.00 0.00 H ATOM 1387 N GLU A 166 -24.254 59.654 12.711 1.00 74.87 N ATOM 1388 CA GLU A 166 -25.155 60.514 11.936 1.00 74.15 C ATOM 1389 C GLU A 166 -24.721 61.976 11.995 1.00 72.84 C ATOM 1390 O GLU A 166 -24.617 62.642 10.959 1.00 71.10 O ATOM 1391 CB GLU A 166 -26.591 60.387 12.435 1.00 73.27 C ATOM 1392 H GLU A 166 -24.647 59.032 13.446 1.00 0.00 H ATOM 1393 N SER A 167 -24.516 62.508 13.206 1.00 71.32 N ATOM 1394 CA SER A 167 -24.134 63.908 13.349 1.00 70.26 C ATOM 1395 C SER A 167 -22.812 64.187 12.660 1.00 65.12 C ATOM 1396 O SER A 167 -22.687 65.172 11.929 1.00 63.08 O ATOM 1397 CB SER A 167 -24.054 64.309 14.821 1.00 69.86 C ATOM 1398 OG SER A 167 -25.362 64.363 15.369 1.00 77.06 O ATOM 1399 HG SER A 167 -25.308 64.623 16.323 1.00 0.00 H ATOM 1400 H SER A 167 -24.630 61.917 14.054 1.00 0.00 H ATOM 1401 N ARG A 168 -21.815 63.342 12.894 1.00 63.90 N ATOM 1402 CA ARG A 168 -20.519 63.584 12.283 1.00 68.21 C ATOM 1403 C ARG A 168 -20.609 63.501 10.757 1.00 66.78 C ATOM 1404 O ARG A 168 -20.048 64.341 10.046 1.00 62.80 O ATOM 1405 CB ARG A 168 -19.510 62.592 12.860 1.00 71.25 C ATOM 1406 CG ARG A 168 -19.072 62.961 14.272 1.00 67.55 C ATOM 1407 CD ARG A 168 -18.921 61.763 15.181 1.00 72.08 C ATOM 1408 NE ARG A 168 -17.964 60.813 14.632 1.00 77.48 N ATOM 1409 CZ ARG A 168 -17.909 59.521 14.958 1.00 82.34 C ATOM 1410 NH1 ARG A 168 -18.757 58.994 15.850 1.00 83.69 N ATOM 1411 NH2 ARG A 168 -16.994 58.764 14.385 1.00 80.19 N ATOM 1412 HE ARG A 168 -17.275 61.166 13.937 1.00 0.00 H ATOM 1413 HH12 ARG A 168 -18.697 57.984 16.090 1.00 0.00 H ATOM 1414 HH11 ARG A 168 -19.475 59.595 16.303 1.00 0.00 H ATOM 1415 HH22 ARG A 168 -16.932 57.754 14.623 1.00 0.00 H ATOM 1416 HH21 ARG A 168 -16.335 59.177 13.695 1.00 0.00 H ATOM 1417 H ARG A 168 -21.960 62.515 13.508 1.00 0.00 H ATOM 1418 N ALA A 169 -21.305 62.478 10.239 1.00 62.19 N ATOM 1419 CA ALA A 169 -21.600 62.395 8.808 1.00 59.33 C ATOM 1420 C ALA A 169 -22.171 63.721 8.261 1.00 60.96 C ATOM 1421 O ALA A 169 -21.766 64.183 7.188 1.00 60.64 O ATOM 1422 CB ALA A 169 -22.566 61.213 8.570 1.00 58.45 C ATOM 1423 H ALA A 169 -21.644 61.724 10.871 1.00 0.00 H ATOM 1424 N ARG A 170 -23.113 64.353 8.974 1.00 61.89 N ATOM 1425 CA ARG A 170 -23.671 65.628 8.478 1.00 66.66 C ATOM 1426 C ARG A 170 -22.608 66.732 8.362 1.00 59.27 C ATOM 1427 O ARG A 170 -22.629 67.537 7.417 1.00 56.85 O ATOM 1428 CB ARG A 170 -24.804 66.121 9.381 1.00 75.04 C ATOM 1429 CG ARG A 170 -26.165 65.466 9.109 1.00 84.96 C ATOM 1430 CD ARG A 170 -27.271 66.009 10.068 1.00 88.55 C ATOM 1431 NE ARG A 170 -27.720 64.977 11.009 1.00 92.66 N ATOM 1432 CZ ARG A 170 -28.643 64.053 10.738 1.00100.42 C ATOM 1433 NH1 ARG A 170 -29.227 64.019 9.543 1.00103.66 N ATOM 1434 NH2 ARG A 170 -28.974 63.143 11.657 1.00105.13 N ATOM 1435 HE ARG A 170 -27.288 64.965 11.955 1.00 0.00 H ATOM 1436 HH12 ARG A 170 -29.946 63.297 9.336 1.00 0.00 H ATOM 1437 HH11 ARG A 170 -28.964 64.715 8.816 1.00 0.00 H ATOM 1438 HH22 ARG A 170 -29.694 62.424 11.441 1.00 0.00 H ATOM 1439 HH21 ARG A 170 -28.512 63.153 12.589 1.00 0.00 H ATOM 1440 H ARG A 170 -23.449 63.949 9.871 1.00 0.00 H ATOM 1441 N ILE A 171 -21.715 66.829 9.343 1.00 59.80 N ATOM 1442 CA ILE A 171 -20.623 67.801 9.274 1.00 57.08 C ATOM 1443 C ILE A 171 -19.707 67.503 8.088 1.00 59.85 C ATOM 1444 O ILE A 171 -19.373 68.400 7.293 1.00 53.14 O ATOM 1445 CB ILE A 171 -19.844 67.785 10.586 1.00 57.89 C ATOM 1446 CG1 ILE A 171 -20.753 68.391 11.681 1.00 58.68 C ATOM 1447 CG2 ILE A 171 -18.510 68.548 10.396 1.00 53.79 C ATOM 1448 CD1 ILE A 171 -20.169 68.398 13.056 1.00 59.03 C ATOM 1449 H ILE A 171 -21.794 66.205 10.171 1.00 0.00 H ATOM 1450 N LYS A 172 -19.266 66.230 7.974 1.00 66.06 N ATOM 1451 CA LYS A 172 -18.329 65.853 6.921 1.00 64.05 C ATOM 1452 C LYS A 172 -18.948 66.082 5.550 1.00 62.58 C ATOM 1453 O LYS A 172 -18.271 66.579 4.639 1.00 59.57 O ATOM 1454 CB LYS A 172 -17.849 64.389 7.096 1.00 64.47 C ATOM 1455 CG LYS A 172 -17.035 64.138 8.386 1.00 59.88 C ATOM 1456 CD LYS A 172 -16.432 62.731 8.434 1.00 66.82 C ATOM 1457 CE LYS A 172 -17.230 61.872 9.372 1.00 68.02 C ATOM 1458 NZ LYS A 172 -16.512 60.662 9.863 1.00 71.26 N ATOM 1459 HZ1 LYS A 172 -16.249 60.064 9.054 1.00 0.00 H ATOM 1460 HZ2 LYS A 172 -15.654 60.953 10.374 1.00 0.00 H ATOM 1461 HZ3 LYS A 172 -17.134 60.127 10.503 1.00 0.00 H ATOM 1462 H LYS A 172 -19.599 65.510 8.646 1.00 0.00 H ATOM 1463 N THR A 173 -20.247 65.795 5.409 1.00 60.90 N ATOM 1464 CA THR A 173 -20.917 66.051 4.136 1.00 65.98 C ATOM 1465 C THR A 173 -20.950 67.534 3.837 1.00 62.47 C ATOM 1466 O THR A 173 -20.792 67.949 2.686 1.00 62.87 O ATOM 1467 CB THR A 173 -22.342 65.508 4.115 1.00 71.50 C ATOM 1468 OG1 THR A 173 -22.302 64.088 4.094 1.00 75.60 O ATOM 1469 CG2 THR A 173 -23.043 65.934 2.836 1.00 73.92 C ATOM 1470 HG1 THR A 173 -21.833 63.760 4.902 1.00 0.00 H ATOM 1471 H THR A 173 -20.780 65.390 6.205 1.00 0.00 H ATOM 1472 N ARG A 174 -21.117 68.365 4.856 1.00 56.58 N ATOM 1473 CA ARG A 174 -21.196 69.774 4.545 1.00 49.07 C ATOM 1474 C ARG A 174 -19.831 70.309 4.039 1.00 50.93 C ATOM 1475 O ARG A 174 -19.781 71.112 3.092 1.00 54.16 O ATOM 1476 CB ARG A 174 -21.720 70.514 5.776 1.00 49.88 C ATOM 1477 CG ARG A 174 -21.681 72.015 5.655 1.00 49.06 C ATOM 1478 CD ARG A 174 -22.519 72.603 4.532 1.00 48.86 C ATOM 1479 NE ARG A 174 -22.434 74.061 4.674 1.00 50.93 N ATOM 1480 CZ ARG A 174 -22.697 74.938 3.695 1.00 59.41 C ATOM 1481 NH1 ARG A 174 -23.100 74.530 2.482 1.00 60.55 N ATOM 1482 NH2 ARG A 174 -22.549 76.225 3.914 1.00 55.58 N ATOM 1483 HE ARG A 174 -22.150 74.441 5.600 1.00 0.00 H ATOM 1484 HH12 ARG A 174 -23.298 75.229 1.738 1.00 0.00 H ATOM 1485 HH11 ARG A 174 -23.214 73.515 2.286 1.00 0.00 H ATOM 1486 HH22 ARG A 174 -22.752 76.908 3.157 1.00 0.00 H ATOM 1487 HH21 ARG A 174 -22.229 76.561 4.845 1.00 0.00 H ATOM 1488 H ARG A 174 -21.188 68.019 5.834 1.00 0.00 H ATOM 1489 N LEU A 175 -18.712 69.886 4.666 1.00 50.51 N ATOM 1490 CA LEU A 175 -17.372 70.337 4.245 1.00 52.87 C ATOM 1491 C LEU A 175 -17.062 69.865 2.830 1.00 54.76 C ATOM 1492 O LEU A 175 -16.452 70.593 2.027 1.00 53.97 O ATOM 1493 CB LEU A 175 -16.308 69.818 5.228 1.00 48.15 C ATOM 1494 CG LEU A 175 -16.481 70.398 6.615 1.00 46.57 C ATOM 1495 CD1 LEU A 175 -15.878 69.518 7.666 1.00 52.24 C ATOM 1496 CD2 LEU A 175 -15.877 71.848 6.664 1.00 48.51 C ATOM 1497 H LEU A 175 -18.797 69.226 5.465 1.00 0.00 H ATOM 1498 N PHE A 176 -17.503 68.655 2.508 1.00 56.41 N ATOM 1499 CA PHE A 176 -17.297 68.122 1.170 1.00 64.02 C ATOM 1500 C PHE A 176 -18.003 68.971 0.119 1.00 63.41 C ATOM 1501 O PHE A 176 -17.429 69.305 -0.929 1.00 63.81 O ATOM 1502 CB PHE A 176 -17.804 66.679 1.138 1.00 66.07 C ATOM 1503 CG PHE A 176 -17.679 66.052 -0.171 1.00 75.28 C ATOM 1504 CD1 PHE A 176 -16.424 65.795 -0.700 1.00 78.24 C ATOM 1505 CD2 PHE A 176 -18.814 65.676 -0.882 1.00 75.95 C ATOM 1506 CE1 PHE A 176 -16.312 65.160 -1.938 1.00 79.73 C ATOM 1507 CE2 PHE A 176 -18.701 65.082 -2.093 1.00 78.62 C ATOM 1508 CZ PHE A 176 -17.449 64.826 -2.627 1.00 79.48 C ATOM 1509 H PHE A 176 -18.001 68.082 3.219 1.00 0.00 H ATOM 1510 N THR A 177 -19.271 69.290 0.378 1.00 61.21 N ATOM 1511 CA THR A 177 -20.050 70.197 -0.457 1.00 63.04 C ATOM 1512 C THR A 177 -19.332 71.527 -0.669 1.00 60.62 C ATOM 1513 O THR A 177 -19.254 72.045 -1.789 1.00 62.31 O ATOM 1514 CB THR A 177 -21.394 70.418 0.230 1.00 65.76 C ATOM 1515 OG1 THR A 177 -21.983 69.122 0.452 1.00 73.89 O ATOM 1516 CG2 THR A 177 -22.310 71.289 -0.602 1.00 62.97 C ATOM 1517 HG1 THR A 177 -21.384 68.583 1.027 1.00 0.00 H ATOM 1518 H THR A 177 -19.726 68.873 1.215 1.00 0.00 H ATOM 1519 N ILE A 178 -18.826 72.120 0.402 1.00 56.44 N ATOM 1520 CA ILE A 178 -18.109 73.378 0.235 1.00 49.50 C ATOM 1521 C ILE A 178 -16.909 73.202 -0.704 1.00 55.86 C ATOM 1522 O ILE A 178 -16.709 74.007 -1.636 1.00 53.95 O ATOM 1523 CB ILE A 178 -17.698 73.902 1.614 1.00 48.39 C ATOM 1524 CG1 ILE A 178 -18.974 74.236 2.430 1.00 44.78 C ATOM 1525 CG2 ILE A 178 -16.822 75.148 1.406 1.00 53.63 C ATOM 1526 CD1 ILE A 178 -18.708 74.856 3.917 1.00 41.95 C ATOM 1527 H ILE A 178 -18.938 71.696 1.345 1.00 0.00 H ATOM 1528 N ARG A 179 -16.124 72.117 -0.503 1.00 54.13 N ATOM 1529 CA ARG A 179 -14.970 71.833 -1.349 1.00 62.80 C ATOM 1530 C ARG A 179 -15.389 71.715 -2.806 1.00 68.04 C ATOM 1531 O ARG A 179 -14.840 72.408 -3.686 1.00 71.50 O ATOM 1532 CB ARG A 179 -14.294 70.540 -0.899 1.00 63.88 C ATOM 1533 CG ARG A 179 -13.097 70.086 -1.794 1.00 69.05 C ATOM 1534 CD ARG A 179 -13.211 68.628 -2.254 1.00 77.78 C ATOM 1535 NE ARG A 179 -11.992 68.116 -2.921 1.00 82.40 N ATOM 1536 CZ ARG A 179 -11.605 68.465 -4.153 1.00 89.28 C ATOM 1537 NH1 ARG A 179 -12.343 69.298 -4.876 1.00 90.29 N ATOM 1538 NH2 ARG A 179 -10.483 67.980 -4.678 1.00 91.71 N ATOM 1539 HE ARG A 179 -11.398 67.441 -2.398 1.00 0.00 H ATOM 1540 HH12 ARG A 179 -12.038 69.566 -5.833 1.00 0.00 H ATOM 1541 HH11 ARG A 179 -13.227 69.683 -4.485 1.00 0.00 H ATOM 1542 HH22 ARG A 179 -10.194 68.260 -5.637 1.00 0.00 H ATOM 1543 HH21 ARG A 179 -9.895 67.321 -4.129 1.00 0.00 H ATOM 1544 H ARG A 179 -16.350 71.467 0.277 1.00 0.00 H ATOM 1545 N GLN A 180 -16.363 70.830 -3.078 1.00 65.48 N ATOM 1546 CA GLN A 180 -16.921 70.698 -4.429 1.00 70.50 C ATOM 1547 C GLN A 180 -17.381 72.043 -4.990 1.00 71.15 C ATOM 1548 O GLN A 180 -17.168 72.333 -6.172 1.00 73.36 O ATOM 1549 CB GLN A 180 -18.094 69.696 -4.447 1.00 75.36 C ATOM 1550 CG GLN A 180 -17.783 68.303 -3.908 1.00 73.04 C ATOM 1551 CD GLN A 180 -16.940 67.535 -4.880 1.00 83.78 C ATOM 1552 OE1 GLN A 180 -15.798 67.923 -5.184 1.00 85.84 O ATOM 1553 NE2 GLN A 180 -17.498 66.437 -5.412 1.00 87.88 N ATOM 1554 HE22 GLN A 180 -18.456 66.151 -5.127 1.00 0.00 H ATOM 1555 HE21 GLN A 180 -16.972 65.872 -6.109 1.00 0.00 H ATOM 1556 H GLN A 180 -16.729 70.226 -2.315 1.00 0.00 H ATOM 1557 N GLU A 181 -18.002 72.880 -4.161 1.00 64.98 N ATOM 1558 CA GLU A 181 -18.523 74.142 -4.681 1.00 70.55 C ATOM 1559 C GLU A 181 -17.403 75.122 -5.017 1.00 68.89 C ATOM 1560 O GLU A 181 -17.435 75.784 -6.070 1.00 64.96 O ATOM 1561 CB GLU A 181 -19.489 74.762 -3.678 1.00 70.97 C ATOM 1562 CG GLU A 181 -20.928 74.673 -4.146 1.00 81.25 C ATOM 1563 CD GLU A 181 -21.072 75.115 -5.607 1.00 92.08 C ATOM 1564 OE1 GLU A 181 -20.547 76.206 -5.977 1.00 92.27 O ATOM 1565 OE2 GLU A 181 -21.706 74.362 -6.382 1.00 99.17 O ATOM 1566 H GLU A 181 -18.115 72.638 -3.156 1.00 0.00 H ATOM 1567 N MET A 182 -16.413 75.233 -4.127 1.00 58.77 N ATOM 1568 CA MET A 182 -15.206 75.966 -4.467 1.00 59.01 C ATOM 1569 C MET A 182 -14.575 75.467 -5.780 1.00 63.93 C ATOM 1570 O MET A 182 -14.224 76.264 -6.658 1.00 62.45 O ATOM 1571 CB MET A 182 -14.217 75.859 -3.324 1.00 55.47 C ATOM 1572 CG MET A 182 -14.689 76.606 -2.033 1.00 54.02 C ATOM 1573 SD MET A 182 -13.429 76.313 -0.794 1.00 60.43 S ATOM 1574 CE MET A 182 -12.335 77.388 -1.576 1.00 62.71 C ATOM 1575 H MET A 182 -16.507 74.794 -3.189 1.00 0.00 H ATOM 1576 N ALA A 183 -14.379 74.165 -5.911 1.00 65.85 N ATOM 1577 CA ALA A 183 -13.727 73.679 -7.124 1.00 74.92 C ATOM 1578 C ALA A 183 -14.560 73.975 -8.377 1.00 78.23 C ATOM 1579 O ALA A 183 -14.005 74.343 -9.423 1.00 79.83 O ATOM 1580 CB ALA A 183 -13.430 72.194 -6.975 1.00 68.26 C ATOM 1581 H ALA A 183 -14.682 73.504 -5.168 1.00 0.00 H ATOM 1582 N SER A 184 -15.893 73.867 -8.281 1.00 75.57 N ATOM 1583 CA SER A 184 -16.762 74.181 -9.418 1.00 80.63 C ATOM 1584 C SER A 184 -16.589 75.619 -9.872 1.00 81.97 C ATOM 1585 O SER A 184 -16.824 75.935 -11.045 1.00 84.17 O ATOM 1586 CB SER A 184 -18.234 73.964 -9.056 1.00 85.68 C ATOM 1587 OG SER A 184 -19.094 74.587 -10.013 1.00 90.84 O ATOM 1588 HG SER A 184 -18.912 75.560 -10.035 1.00 0.00 H ATOM 1589 H SER A 184 -16.317 73.555 -7.384 1.00 0.00 H ATOM 1590 N ARG A 185 -16.249 76.506 -8.942 1.00 74.90 N ATOM 1591 CA ARG A 185 -15.915 77.884 -9.229 1.00 75.47 C ATOM 1592 C ARG A 185 -14.419 78.093 -9.455 1.00 75.36 C ATOM 1593 O ARG A 185 -13.998 79.223 -9.702 1.00 74.11 O ATOM 1594 CB ARG A 185 -16.420 78.765 -8.080 1.00 70.19 C ATOM 1595 CG ARG A 185 -17.920 78.571 -7.826 1.00 72.15 C ATOM 1596 CD ARG A 185 -18.454 79.334 -6.608 1.00 76.31 C ATOM 1597 NE ARG A 185 -19.807 79.832 -6.878 1.00 85.06 N ATOM 1598 CZ ARG A 185 -20.186 81.116 -6.761 1.00 91.10 C ATOM 1599 NH1 ARG A 185 -19.334 82.047 -6.340 1.00 89.62 N ATOM 1600 NH2 ARG A 185 -21.434 81.486 -7.041 1.00 92.59 N ATOM 1601 HE ARG A 185 -20.524 79.142 -7.182 1.00 0.00 H ATOM 1602 HH12 ARG A 185 -19.644 83.036 -6.255 1.00 0.00 H ATOM 1603 HH11 ARG A 185 -18.357 81.786 -6.095 1.00 0.00 H ATOM 1604 HH22 ARG A 185 -21.714 82.483 -6.946 1.00 0.00 H ATOM 1605 HH21 ARG A 185 -22.128 80.778 -7.354 1.00 0.00 H ATOM 1606 H ARG A 185 -16.222 76.191 -7.951 1.00 0.00 H ATOM 1607 N SER A 186 -13.611 77.036 -9.338 1.00 75.32 N ATOM 1608 CA SER A 186 -12.155 77.069 -9.534 1.00 79.87 C ATOM 1609 C SER A 186 -11.438 77.903 -8.464 1.00 78.09 C ATOM 1610 O SER A 186 -10.455 78.601 -8.742 1.00 74.86 O ATOM 1611 CB SER A 186 -11.807 77.545 -10.956 1.00 87.12 C ATOM 1612 OG SER A 186 -10.430 77.826 -11.091 1.00 89.20 O ATOM 1613 HG SER A 186 -10.176 78.539 -10.453 1.00 0.00 H ATOM 1614 H SER A 186 -14.044 76.123 -9.090 1.00 0.00 H ATOM 1615 N LEU A 187 -11.938 77.847 -7.221 1.00 76.65 N ATOM 1616 CA LEU A 187 -11.326 78.510 -6.071 1.00 68.54 C ATOM 1617 C LEU A 187 -10.590 77.537 -5.154 1.00 72.74 C ATOM 1618 O LEU A 187 -9.869 77.972 -4.241 1.00 72.39 O ATOM 1619 CB LEU A 187 -12.408 79.241 -5.276 1.00 62.50 C ATOM 1620 CG LEU A 187 -13.199 80.238 -6.122 1.00 62.71 C ATOM 1621 CD1 LEU A 187 -14.630 80.470 -5.563 1.00 58.82 C ATOM 1622 CD2 LEU A 187 -12.424 81.566 -6.254 1.00 63.97 C ATOM 1623 H LEU A 187 -12.810 77.301 -7.067 1.00 0.00 H ATOM 1624 N TRP A 188 -10.744 76.227 -5.382 1.00 70.37 N ATOM 1625 CA TRP A 188 -10.364 75.265 -4.358 1.00 68.52 C ATOM 1626 C TRP A 188 -8.860 75.179 -4.196 1.00 73.36 C ATOM 1627 O TRP A 188 -8.365 75.002 -3.073 1.00 67.41 O ATOM 1628 CB TRP A 188 -10.906 73.884 -4.703 1.00 73.13 C ATOM 1629 CG TRP A 188 -10.293 72.802 -3.815 1.00 77.21 C ATOM 1630 CD1 TRP A 188 -9.384 71.811 -4.179 1.00 80.17 C ATOM 1631 CD2 TRP A 188 -10.506 72.650 -2.407 1.00 74.08 C ATOM 1632 NE1 TRP A 188 -9.053 71.043 -3.070 1.00 77.82 N ATOM 1633 CE2 TRP A 188 -9.737 71.531 -1.979 1.00 76.23 C ATOM 1634 CE3 TRP A 188 -11.321 73.319 -1.470 1.00 66.66 C ATOM 1635 CZ2 TRP A 188 -9.747 71.097 -0.650 1.00 73.35 C ATOM 1636 CZ3 TRP A 188 -11.314 72.897 -0.159 1.00 63.70 C ATOM 1637 CH2 TRP A 188 -10.538 71.808 0.246 1.00 67.46 C ATOM 1638 HE1 TRP A 188 -8.398 70.235 -3.065 1.00 0.00 H ATOM 1639 H TRP A 188 -11.134 75.898 -6.288 1.00 0.00 H ATOM 1640 N ASP A 189 -8.122 75.262 -5.312 1.00 67.00 N ATOM 1641 CA ASP A 189 -6.691 74.987 -5.262 1.00 74.29 C ATOM 1642 C ASP A 189 -5.954 76.032 -4.431 1.00 76.91 C ATOM 1643 O ASP A 189 -5.064 75.686 -3.640 1.00 80.91 O ATOM 1644 CB ASP A 189 -6.106 74.916 -6.675 1.00 76.25 C ATOM 1645 H ASP A 189 -8.570 75.523 -6.214 1.00 0.00 H ATOM 1646 N SER A 190 -6.297 77.319 -4.611 1.00 74.05 N ATOM 1647 CA SER A 190 -5.717 78.384 -3.796 1.00 69.61 C ATOM 1648 C SER A 190 -6.156 78.250 -2.335 1.00 69.59 C ATOM 1649 O SER A 190 -5.349 78.404 -1.406 1.00 69.84 O ATOM 1650 CB SER A 190 -6.129 79.743 -4.372 1.00 69.64 C ATOM 1651 OG SER A 190 -5.815 80.794 -3.469 1.00 68.24 O ATOM 1652 HG SER A 190 -6.090 81.659 -3.863 1.00 0.00 H ATOM 1653 H SER A 190 -6.991 77.562 -5.347 1.00 0.00 H ATOM 1654 N PHE A 191 -7.427 77.939 -2.109 1.00 68.11 N ATOM 1655 CA PHE A 191 -7.885 77.750 -0.735 1.00 63.42 C ATOM 1656 C PHE A 191 -7.140 76.624 -0.042 1.00 62.84 C ATOM 1657 O PHE A 191 -6.668 76.786 1.093 1.00 58.76 O ATOM 1658 CB PHE A 191 -9.370 77.450 -0.719 1.00 56.27 C ATOM 1659 CG PHE A 191 -9.965 77.335 0.679 1.00 53.51 C ATOM 1660 CD1 PHE A 191 -10.141 78.459 1.481 1.00 51.39 C ATOM 1661 CD2 PHE A 191 -10.420 76.107 1.151 1.00 60.62 C ATOM 1662 CE1 PHE A 191 -10.740 78.371 2.755 1.00 53.55 C ATOM 1663 CE2 PHE A 191 -11.000 76.007 2.409 1.00 57.42 C ATOM 1664 CZ PHE A 191 -11.147 77.143 3.217 1.00 54.21 C ATOM 1665 H PHE A 191 -8.090 77.831 -2.903 1.00 0.00 H ATOM 1666 N ARG A 192 -7.039 75.473 -0.704 1.00 67.28 N ATOM 1667 CA ARG A 192 -6.384 74.308 -0.114 1.00 79.18 C ATOM 1668 C ARG A 192 -4.935 74.602 0.272 1.00 87.91 C ATOM 1669 O ARG A 192 -4.415 74.037 1.244 1.00 99.84 O ATOM 1670 CB ARG A 192 -6.451 73.123 -1.089 1.00 82.10 C ATOM 1671 CG ARG A 192 -5.698 71.901 -0.620 1.00 85.59 C ATOM 1672 CD ARG A 192 -5.491 70.935 -1.727 1.00 88.94 C ATOM 1673 NE ARG A 192 -4.476 71.368 -2.696 1.00 95.32 N ATOM 1674 CZ ARG A 192 -3.156 71.284 -2.506 1.00 97.92 C ATOM 1675 NH1 ARG A 192 -2.667 70.805 -1.370 1.00 97.47 N ATOM 1676 NH2 ARG A 192 -2.309 71.676 -3.455 1.00100.98 N ATOM 1677 HE ARG A 192 -4.809 71.769 -3.596 1.00 0.00 H ATOM 1678 HH12 ARG A 192 -1.638 70.744 -1.232 1.00 0.00 H ATOM 1679 HH11 ARG A 192 -3.312 70.491 -0.618 1.00 0.00 H ATOM 1680 HH22 ARG A 192 -1.283 71.607 -3.298 1.00 0.00 H ATOM 1681 HH21 ARG A 192 -2.673 72.052 -4.354 1.00 0.00 H ATOM 1682 H ARG A 192 -7.435 75.402 -1.663 1.00 0.00 H ATOM 1683 N GLN A 193 -4.279 75.508 -0.443 1.00 83.63 N ATOM 1684 CA GLN A 193 -2.876 75.782 -0.186 1.00 80.22 C ATOM 1685 C GLN A 193 -2.644 76.953 0.748 1.00 74.37 C ATOM 1686 O GLN A 193 -1.494 77.350 0.940 1.00 74.09 O ATOM 1687 CB GLN A 193 -2.175 76.018 -1.492 1.00 80.04 C ATOM 1688 CG GLN A 193 -2.095 74.729 -2.228 1.00 85.30 C ATOM 1689 CD GLN A 193 -0.922 74.720 -3.143 1.00 90.16 C ATOM 1690 OE1 GLN A 193 -1.043 75.150 -4.290 1.00 91.49 O ATOM 1691 NE2 GLN A 193 0.231 74.235 -2.655 1.00 91.12 N ATOM 1692 HE22 GLN A 193 0.275 73.884 -1.677 1.00 0.00 H ATOM 1693 HE21 GLN A 193 1.080 74.210 -3.255 1.00 0.00 H ATOM 1694 H GLN A 193 -4.775 76.027 -1.195 1.00 0.00 H ATOM 1695 N SER A 194 -3.691 77.517 1.331 1.00 69.14 N ATOM 1696 CA SER A 194 -3.538 78.789 2.006 1.00 72.31 C ATOM 1697 C SER A 194 -3.372 78.641 3.516 1.00 73.66 C ATOM 1698 O SER A 194 -3.233 79.658 4.221 1.00 73.79 O ATOM 1699 CB SER A 194 -4.733 79.694 1.673 1.00 73.73 C ATOM 1700 OG SER A 194 -5.950 79.157 2.192 1.00 76.42 O ATOM 1701 HG SER A 194 -6.110 78.264 1.796 1.00 0.00 H ATOM 1702 H SER A 194 -4.619 77.048 1.304 1.00 0.00 H ATOM 1703 N GLU A 195 -3.406 77.419 4.043 1.00 69.20 N ATOM 1704 CA GLU A 195 -3.358 77.216 5.488 1.00 69.64 C ATOM 1705 C GLU A 195 -1.907 77.071 5.941 1.00 76.54 C ATOM 1706 O GLU A 195 -1.137 76.316 5.326 1.00 80.28 O ATOM 1707 CB GLU A 195 -4.181 75.983 5.891 1.00 69.86 C ATOM 1708 CG GLU A 195 -4.147 75.723 7.379 1.00 70.85 C ATOM 1709 CD GLU A 195 -4.971 74.519 7.753 1.00 70.80 C ATOM 1710 OE1 GLU A 195 -6.214 74.625 7.589 1.00 72.58 O ATOM 1711 OE2 GLU A 195 -4.377 73.487 8.192 1.00 66.10 O ATOM 1712 H GLU A 195 -3.468 76.593 3.414 1.00 0.00 H ATOM 1713 N ARG A 196 -1.543 77.767 7.026 1.00 77.92 N ATOM 1714 CA ARG A 196 -0.158 77.860 7.487 1.00 92.15 C ATOM 1715 C ARG A 196 0.019 77.289 8.896 1.00 96.40 C ATOM 1716 O ARG A 196 -0.885 77.345 9.739 1.00 93.57 O ATOM 1717 CB ARG A 196 0.343 79.318 7.455 1.00 93.86 C ATOM 1718 CG ARG A 196 0.647 79.889 6.045 1.00 97.36 C ATOM 1719 CD ARG A 196 1.832 79.174 5.328 1.00102.13 C ATOM 1720 NE ARG A 196 2.069 79.648 3.950 1.00105.47 N ATOM 1721 CZ ARG A 196 1.356 79.280 2.877 1.00104.75 C ATOM 1722 NH1 ARG A 196 0.337 78.446 3.009 1.00101.98 N ATOM 1723 NH2 ARG A 196 1.647 79.752 1.666 1.00106.16 N ATOM 1724 HE ARG A 196 2.849 80.319 3.801 1.00 0.00 H ATOM 1725 HH12 ARG A 196 -0.214 78.162 2.174 1.00 0.00 H ATOM 1726 HH11 ARG A 196 0.088 78.074 3.948 1.00 0.00 H ATOM 1727 HH22 ARG A 196 1.084 79.456 0.843 1.00 0.00 H ATOM 1728 HH21 ARG A 196 2.438 80.416 1.543 1.00 0.00 H ATOM 1729 H ARG A 196 -2.280 78.265 7.566 1.00 0.00 H ATOM 1730 N ALA A 197 1.210 76.750 9.144 1.00102.00 N ATOM 1731 CA ALA A 197 1.563 76.144 10.427 1.00100.70 C ATOM 1732 C ALA A 197 1.815 77.191 11.521 1.00 97.48 C ATOM 1733 O ALA A 197 1.856 76.869 12.712 1.00 94.08 O ATOM 1734 CB ALA A 197 2.793 75.248 10.249 1.00105.27 C ATOM 1735 H ALA A 197 1.925 76.760 8.388 1.00 0.00 H TER 1736 ALA A 197 HETATM 1737 MN MN A 1 -11.528 76.027 16.978 1.00 46.38 MN HETATM 1738 MN MN A 2 -12.292 78.985 18.929 1.00 37.09 MN HETATM 1739 NA NA A 3 -7.419 78.751 19.670 1.00 78.30 NA HETATM 1740 O HOH 4 -17.802 58.942 27.087 1.00 84.89 O HETATM 1741 O HOH 5 -24.337 85.540 3.406 1.00 44.73 O HETATM 1742 O HOH 6 -24.621 68.080 5.906 1.00 62.88 O HETATM 1743 O HOH 7 -22.545 89.958 2.797 1.00 51.33 O HETATM 1744 O HOH 8 -18.556 88.591 33.385 1.00 45.60 O HETATM 1745 O HOH 9 -24.531 62.497 18.922 1.00 75.75 O HETATM 1746 O HOH 10 -15.824 83.382 21.436 1.00 40.71 O HETATM 1747 O HOH 11 -10.530 59.553 10.199 1.00 81.90 O HETATM 1748 O HOH 12 -7.794 77.956 -6.711 1.00 70.14 O HETATM 1749 O HOH 13 -9.818 75.571 12.548 1.00 48.28 O HETATM 1750 O HOH 14 -13.881 88.167 17.141 1.00 61.61 O HETATM 1751 O HOH 15 -14.666 64.446 20.296 1.00 54.91 O HETATM 1752 O HOH 16 -10.953 78.136 20.324 1.00 42.68 O HETATM 1753 O HOH 17 -9.283 75.271 7.357 1.00 53.54 O HETATM 1754 O HOH 18 -20.197 92.848 14.071 1.00 41.57 O HETATM 1755 O HOH 19 -20.387 76.770 -10.958 1.00 98.47 O HETATM 1756 O HOH 20 -13.130 90.409 -3.084 1.00 64.24 O HETATM 1757 O HOH 21 -10.067 97.075 11.467 1.00 38.74 O HETATM 1758 O HOH 22 -23.585 89.155 6.748 1.00 41.95 O HETATM 1759 O HOH 23 -19.590 92.115 25.966 1.00 58.07 O HETATM 1760 O HOH 24 -18.692 84.037 34.884 1.00 43.62 O HETATM 1761 O HOH 25 -21.630 91.213 6.634 1.00 54.33 O HETATM 1762 O HOH 26 -13.079 80.021 20.640 1.00 40.16 O HETATM 1763 O HOH 27 -14.540 90.696 21.795 1.00 38.08 O HETATM 1764 O HOH 28 -22.077 80.147 37.518 1.00 66.15 O HETATM 1765 O HOH 29 -8.726 75.739 25.450 1.00 66.13 O HETATM 1766 O HOH 30 -7.344 76.181 9.683 1.00 67.82 O HETATM 1767 O HOH 31 -16.197 87.615 15.589 1.00 43.76 O HETATM 1768 O HOH 32 -26.709 71.482 22.607 1.00 55.64 O HETATM 1769 O HOH 33 -16.853 58.146 19.820 1.00 85.94 O HETATM 1770 O HOH 34 -27.054 74.133 26.613 1.00 67.05 O HETATM 1771 O HOH 35 -13.289 87.988 -4.166 1.00 67.21 O HETATM 1772 O HOH 36 -10.599 64.397 27.386 1.00 69.43 O HETATM 1773 O HOH 37 -22.880 86.115 23.624 1.00 30.88 O HETATM 1774 O HOH 38 -5.500 93.101 17.399 1.00 54.92 O HETATM 1775 O HOH 39 -30.454 81.062 6.422 1.00 75.79 O HETATM 1776 O HOH 40 -8.701 75.910 23.019 1.00 60.08 O HETATM 1777 O HOH 41 -13.899 80.963 12.990 1.00 49.22 O HETATM 1778 O HOH 42 -13.436 82.629 20.317 1.00 43.23 O HETATM 1779 O HOH 43 -8.560 82.833 23.485 1.00 53.62 O HETATM 1780 O HOH 44 -12.102 70.483 30.109 1.00 66.21 O HETATM 1781 O HOH 45 -21.516 87.837 22.212 1.00 45.02 O HETATM 1782 O HOH 46 -5.815 92.040 4.758 1.00 60.53 O HETATM 1783 O HOH 47 -26.438 63.519 22.980 1.00 67.94 O HETATM 1784 O HOH 48 -19.508 59.630 10.658 1.00 77.24 O HETATM 1785 O HOH 49 -6.526 84.898 2.456 1.00 57.11 O HETATM 1786 O HOH 50 -18.798 82.990 37.410 1.00 69.98 O HETATM 1787 O HOH 51 -12.524 68.394 31.722 1.00 86.68 O HETATM 1788 O HOH 52 -9.784 74.732 -8.045 1.00 71.75 O HETATM 1789 O HOH 53 -25.535 68.407 12.982 1.00 87.15 O HETATM 1790 O HOH 54 -6.830 85.436 -1.904 1.00 77.34 O HETATM 1791 O HOH 55 -17.408 87.996 18.191 1.00 61.73 O HETATM 1792 O HOH 56 -11.693 86.134 17.850 1.00 82.42 O HETATM 1793 O HOH 57 -9.805 85.634 22.366 1.00 49.03 O HETATM 1794 O HOH 58 -20.636 90.165 14.945 1.00 61.12 O HETATM 1795 O HOH 59 -18.829 87.276 35.429 1.00 64.07 O HETATM 1796 O HOH 60 -9.729 72.295 -8.185 1.00 80.12 O HETATM 1797 O HOH 61 -24.226 88.223 4.218 1.00 57.98 O HETATM 1798 O HOH 62 -12.346 85.174 20.550 1.00 49.93 O HETATM 1799 O HOH 63 -2.838 91.664 15.922 1.00 75.22 O HETATM 1800 C01 GY A 6 -8.480 79.710 14.923 1.00 0.16 C HETATM 1801 C27 GY A 6 -7.485 80.285 13.927 1.00 0.13 C HETATM 1802 C24 GY A 6 -6.030 80.046 14.363 1.00 -0.01 C HETATM 1803 C21 GY A 6 -5.747 81.250 15.248 1.00 -0.03 C HETATM 1804 C30 GY A 6 -6.357 82.395 14.448 1.00 0.04 C HETATM 1805 N29 GY A 6 -7.529 81.772 13.805 1.00 -0.25 N HETATM 1806 C33 GY A 6 -8.557 82.410 13.213 1.00 0.21 C HETATM 1807 C41 GY A 6 -8.488 83.906 13.042 1.00 0.08 C HETATM 1808 C39 GY A 6 -9.250 84.821 13.782 1.00 0.06 C HETATM 1809 C37 GY A 6 -9.152 86.185 13.566 1.00 -0.04 C HETATM 1810 C35 GY A 6 -8.302 86.667 12.599 1.00 -0.06 C HETATM 1811 C44 GY A 6 -7.546 85.803 11.846 1.00 -0.04 C HETATM 1812 C42 GY A 6 -7.639 84.440 12.071 1.00 0.06 C HETATM 1813 CL GY A 6 -6.659 83.391 11.091 1.00 -0.06 CL HETATM 1814 H14 GY A 6 -6.881 86.185 11.080 1.00 0.06 H HETATM 1815 H12 GY A 6 -8.228 87.735 12.430 1.00 0.07 H HETATM 1816 H13 GY A 6 -9.745 86.872 14.159 1.00 0.06 H HETATM 1817 CL2 GY A 6 -10.349 84.296 15.025 1.00 -0.06 CL HETATM 1818 O34 GY A 6 -9.567 81.799 12.847 1.00 -0.38 O HETATM 1819 H10 GY A 6 -5.648 82.772 13.696 1.00 0.05 H HETATM 1820 H11 GY A 6 -6.662 83.219 15.109 1.00 0.05 H HETATM 1821 H5 GY A 6 -4.666 81.395 15.389 1.00 0.03 H HETATM 1822 H6 GY A 6 -6.234 81.146 16.229 1.00 0.03 H HETATM 1823 H7 GY A 6 -5.934 79.107 14.928 1.00 0.03 H HETATM 1824 H8 GY A 6 -5.354 80.023 13.495 1.00 0.03 H HETATM 1825 H9 GY A 6 -7.675 79.821 12.948 1.00 0.08 H HETATM 1826 N02 GY A 6 -8.961 80.488 15.915 1.00 -0.30 N HETATM 1827 C03 GY A 6 -9.842 79.984 16.809 1.00 0.11 C HETATM 1828 C04 GY A 6 -10.250 78.678 16.752 1.00 0.18 C HETATM 1829 C07 GY A 6 -9.698 77.835 15.763 1.00 0.26 C HETATM 1830 N09 GY A 6 -8.817 78.398 14.866 1.00 -0.19 N HETATM 1831 H20 GY A 6 -8.415 77.823 14.153 1.00 0.25 H HETATM 1832 O08 GY A 6 -10.010 76.651 15.615 1.00 -0.40 O HETATM 1833 O05 GY A 6 -11.097 78.091 17.622 1.00 -0.33 O HETATM 1834 H22 GY A 6 -11.411 78.738 18.242 1.00 0.25 H HETATM 1835 C11 GY A 6 -10.298 80.925 17.900 1.00 0.20 C HETATM 1836 N13 GY A 6 -9.755 82.151 17.866 1.00 -0.29 N HETATM 1837 C14 GY A 6 -9.917 83.067 18.997 1.00 0.04 C HETATM 1838 C17 GY A 6 -9.211 84.390 18.814 1.00 0.00 C HETATM 1839 C52 GY A 6 -7.770 84.210 18.410 1.00 -0.04 C HETATM 1840 C50 GY A 6 -7.194 85.028 17.448 1.00 -0.06 C HETATM 1841 C48 GY A 6 -5.876 84.828 17.062 1.00 -0.07 C HETATM 1842 C46 GY A 6 -5.126 83.822 17.631 1.00 -0.07 C HETATM 1843 C55 GY A 6 -5.683 83.008 18.587 1.00 -0.07 C HETATM 1844 C53 GY A 6 -7.002 83.196 18.967 1.00 -0.06 C HETATM 1845 H18 GY A 6 -7.441 82.541 19.711 1.00 0.06 H HETATM 1846 H19 GY A 6 -5.093 82.221 19.043 1.00 0.06 H HETATM 1847 H15 GY A 6 -4.097 83.673 17.324 1.00 0.06 H HETATM 1848 H16 GY A 6 -5.433 85.468 16.307 1.00 0.06 H HETATM 1849 H17 GY A 6 -7.775 85.825 16.997 1.00 0.06 H HETATM 1850 H3 GY A 6 -9.247 84.946 19.762 1.00 0.04 H HETATM 1851 H4 GY A 6 -9.730 84.964 18.032 1.00 0.04 H HETATM 1852 H1 GY A 6 -10.991 83.263 19.134 1.00 0.05 H HETATM 1853 H2 GY A 6 -9.515 82.581 19.898 1.00 0.05 H HETATM 1854 H21 GY A 6 -9.236 82.442 17.062 1.00 0.18 H HETATM 1855 O12 GY A 6 -11.007 80.528 18.829 1.00 -0.39 O CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 397 395 396 1737 CONECT 584 583 1738 CONECT 839 838 1738 CONECT 840 838 1737 CONECT 960 959 1737 CONECT 966 965 1737 CONECT 1737 397 840 960 966 CONECT 1738 584 839 CONECT 1800 1801 1826 1830 CONECT 1801 1800 1802 1805 1825 CONECT 1802 1801 1803 1823 1824 CONECT 1803 1802 1804 1821 1822 CONECT 1804 1803 1805 1819 1820 CONECT 1805 1801 1804 1806 CONECT 1806 1805 1807 1818 CONECT 1807 1806 1808 1812 CONECT 1808 1807 1809 1817 CONECT 1809 1808 1810 1816 CONECT 1810 1809 1811 1815 CONECT 1811 1810 1812 1814 CONECT 1812 1807 1811 1813 CONECT 1813 1812 CONECT 1814 1811 CONECT 1815 1810 CONECT 1816 1809 CONECT 1817 1808 CONECT 1818 1806 CONECT 1819 1804 CONECT 1820 1804 CONECT 1821 1803 CONECT 1822 1803 CONECT 1823 1802 CONECT 1824 1802 CONECT 1825 1801 CONECT 1826 1800 1827 CONECT 1827 1826 1828 1835 CONECT 1828 1827 1829 1833 CONECT 1829 1828 1830 1832 CONECT 1830 1800 1829 1831 CONECT 1831 1830 CONECT 1832 1829 CONECT 1833 1828 1834 CONECT 1834 1833 CONECT 1835 1827 1836 1855 CONECT 1836 1835 1837 1854 CONECT 1837 1836 1838 1852 1853 CONECT 1838 1837 1839 1850 1851 CONECT 1839 1838 1840 1844 CONECT 1840 1839 1841 1849 CONECT 1841 1840 1842 1848 CONECT 1842 1841 1843 1847 CONECT 1843 1842 1844 1846 CONECT 1844 1839 1843 1845 CONECT 1845 1844 CONECT 1846 1843 CONECT 1847 1842 CONECT 1848 1841 CONECT 1849 1840 CONECT 1850 1838 CONECT 1851 1838 CONECT 1852 1837 CONECT 1853 1837 CONECT 1854 1836 CONECT 1855 1835 MASTER 0 0 0 0 0 0 0 0 1854 1 68 14 END
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Pocket-Ligand
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Related entries of code: 5wef
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4avg
RCSB PDB
PDBbind
204aa, >4AVG_1|Chains... at 97%
4awf
RCSB PDB
PDBbind
204aa, >4AWF_1|Chains... at 97%
4awg
RCSB PDB
PDBbind
204aa, >4AWG_1|Chains... at 97%
4awm
RCSB PDB
PDBbind
192aa, >4AWM_1|Chain... at 96%
4e5f
RCSB PDB
PDBbind
187aa, >4E5F_1|Chains... at 91%
4e5g
RCSB PDB
PDBbind
187aa, >4E5G_1|Chains... at 91%
4e5h
RCSB PDB
PDBbind
187aa, >4E5H_1|Chains... at 91%
4e5i
RCSB PDB
PDBbind
187aa, >4E5I_1|Chains... at 91%
4e5j
RCSB PDB
PDBbind
187aa, >4E5J_1|Chains... at 91%
4kil
RCSB PDB
PDBbind
213aa, >4KIL_1|Chain... at 98%
4ln7
RCSB PDB
PDBbind
209aa, >4LN7_1|Chain... at 100%
4m4q
RCSB PDB
PDBbind
241aa, >4M4Q_1|Chain... *
4m5o
RCSB PDB
PDBbind
241aa, >4M5O_1|Chain... at 100%
4m5r
RCSB PDB
PDBbind
241aa, >4M5R_1|Chain... at 100%
4m5u
RCSB PDB
PDBbind
241aa, >4M5U_1|Chain... at 100%
4mk1
RCSB PDB
PDBbind
241aa, >4MK1_1|Chain... at 100%
4mk2
RCSB PDB
PDBbind
241aa, >4MK2_1|Chain... at 100%
4mk5
RCSB PDB
PDBbind
241aa, >4MK5_1|Chain... at 100%
4w9s
RCSB PDB
PDBbind
241aa, >4W9S_1|Chain... at 100%
5cgv
RCSB PDB
PDBbind
187aa, >5CGV_1|Chain... at 94%
5ega
RCSB PDB
PDBbind
187aa, >5EGA_1|Chain... at 94%
5w44
RCSB PDB
PDBbind
178aa, >5W44_1|Chain... at 98%
5w73
RCSB PDB
PDBbind
197aa, >5W73_1|Chain... at 93%
5w7u
RCSB PDB
PDBbind
197aa, >5W7U_1|Chain... at 93%
5w92
RCSB PDB
PDBbind
197aa, >5W92_1|Chain... at 93%
5w9g
RCSB PDB
PDBbind
197aa, >5W9G_1|Chain... at 93%
5wa7
RCSB PDB
PDBbind
197aa, >5WA7_1|Chain... at 93%
5wap
RCSB PDB
PDBbind
197aa, >5WAP_1|Chain... at 93%
5wb3
RCSB PDB
PDBbind
197aa, >5WB3_1|Chain... at 93%
5wdc
RCSB PDB
PDBbind
197aa, >5WDC_1|Chain... at 93%
5wdw
RCSB PDB
PDBbind
197aa, >5WDW_1|Chain... at 93%
5we9
RCSB PDB
PDBbind
187aa, >5WE9_1|Chain... at 94%
5web
RCSB PDB
PDBbind
197aa, >5WEB_1|Chain... at 93%
5wei
RCSB PDB
PDBbind
197aa, >5WEI_1|Chain... at 92%
5wf3
RCSB PDB
PDBbind
197aa, >5WF3_1|Chain... at 92%
5wfm
RCSB PDB
PDBbind
197aa, >5WFM_1|Chain... at 92%
5wfw
RCSB PDB
PDBbind
197aa, >5WFW_1|Chain... at 92%
5wfz
RCSB PDB
PDBbind
197aa, >5WFZ_1|Chain... at 92%
5wg9
RCSB PDB
PDBbind
197aa, >5WG9_1|Chain... at 92%
6dcy
RCSB PDB
PDBbind
192aa, >6DCY_1|Chain... at 96%
6dcz
RCSB PDB
PDBbind
192aa, >6DCZ_1|Chain... at 96%
6dzq
RCSB PDB
PDBbind
192aa, >6DZQ_1|Chain... at 96%
6e0q
RCSB PDB
PDBbind
192aa, >6E0Q_1|Chain... at 96%
6nem
RCSB PDB
PDBbind
241aa, >6NEM_1|Chain... at 100%
6nel
RCSB PDB
PDBbind
241aa, >6NEL_1|Chain... at 100%
6e6w
RCSB PDB
PDBbind
192aa, >6E6W_1|Chain... at 96%
6e6v
RCSB PDB
PDBbind
192aa, >6E6V_1|Chain... at 96%
6e4c
RCSB PDB
PDBbind
192aa, >6E4C_1|Chain... at 96%
6e3p
RCSB PDB
PDBbind
192aa, >6E3P_1|Chain... at 96%
6e3n
RCSB PDB
PDBbind
192aa, >6E3N_1|Chain... at 96%
6e3o
RCSB PDB
PDBbind
192aa, >6E3O_1|Chain... at 96%
6e3m
RCSB PDB
PDBbind
192aa, >6E3M_1|Chain... at 96%
5wa6
RCSB PDB
PDBbind
197aa, >5WA6_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5w44
RCSB PDB
PDBbind
GY6
5wdc
RCSB PDB
PDBbind
GY6
5wei
RCSB PDB
PDBbind
GY6
Entry Information
PDB ID
5wef
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Polymerase acidic protein
Ligand Name
GY6
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Ki=0.36uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Sci Rep Vol. 7: pp. 17139-17139
Ligand Properties
Formula
C
2
4
H
2
2
Cl
2
N
4
O
4
Molecular Weight
501.362
Exact Mass
500.102
No. of atoms
56
No. of bonds
59
Polar Surface Area
115.39
LOGP Value
4.09 (
Computed with XLOGP3
)
4.06 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
O=C(c1nc([nH]c(=O)c1O)[C@@H]1CCCN1C(=O)c1c(Cl)cccc1Cl)NCCc1ccccc1
InChI String
InChI=1S/C24H22Cl2N4O4/c25-15-8-4-9-16(26)18(15)24(34)30-13-5-10-17(30)21-28-19(20(31)23(33)29-21)22(32)27-12-11-14-6-2-1-3-7-14/h1-4,6-9,17,31H,5,10-13H2,(H,27,32)(H,28,29,33)/t17-/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):
C3W5S0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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