Browse entries in the PDBbind-CN Database
HEADER 5MKJ_COMPLEX COMPND 5MKJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 15 ASP MET PRO VAL GLU ARG ILE LEU GLU ALA GLU LEU ALA SEQRES 2 A 15 VAL GLU SEQRES 1 A 196 ASP PRO VAL THR ASN ILE CYS GLN ALA ALA ASP LYS GLN SEQRES 2 A 196 LEU PHE THR LEU VAL GLU TRP ALA LYS ARG ILE PRO HIS SEQRES 3 A 196 PHE SER GLU LEU PRO LEU ASP ASP GLN VAL ILE LEU LEU SEQRES 4 A 196 ARG ALA GLY TRP ASN GLU LEU LEU ILE ALA SER PHE SER SEQRES 5 A 196 HIS ARG SER ILE ALA VAL LYS ASP GLY ILE LEU LEU ALA SEQRES 6 A 196 THR GLY LEU HIS VAL HIS ARG ASN SER ALA HIS SER ALA SEQRES 7 A 196 GLY VAL GLY ALA ILE PHE ASP ARG VAL LEU THR GLU LEU SEQRES 8 A 196 VAL SER LYS MET ARG ASP MET GLN MET ASP LYS THR GLU SEQRES 9 A 196 LEU GLY CYS LEU ARG ALA ILE VAL LEU PHE ASN PRO ASP SEQRES 10 A 196 SER LYS GLY LEU SER ASN PRO ALA GLU VAL GLU ALA LEU SEQRES 11 A 196 ARG GLU LYS VAL TYR ALA SER LEU GLU ALA TYR CYS LYS SEQRES 12 A 196 HIS LYS TYR PRO GLU GLN PRO GLY ARG PHE ALA LYS LEU SEQRES 13 A 196 LEU LEU ARG LEU PRO ALA LEU ARG SER ILE GLY LEU LYS SEQRES 14 A 196 CYS LEU GLU HIS LEU PHE PHE PHE LYS LEU ILE GLY ASP SEQRES 15 A 196 THR PRO ILE ASP THR PHE LEU MET GLU MET LEU GLU ALA SEQRES 16 A 196 PRO HET UNN A 280 46 ATOM 1 N ASP A 229 19.583 3.727 15.964 1.00 74.96 N ATOM 2 CA ASP A 229 20.270 3.560 14.689 1.00 73.85 C ATOM 3 C ASP A 229 19.724 2.345 13.942 1.00 68.09 C ATOM 4 O ASP A 229 19.595 1.263 14.512 1.00 66.27 O ATOM 5 CB ASP A 229 21.779 3.417 14.906 1.00 79.94 C ATOM 6 CG ASP A 229 22.593 4.024 13.778 1.00 88.39 C ATOM 7 OD1 ASP A 229 23.487 3.331 13.250 1.00 91.21 O ATOM 8 OD2 ASP A 229 22.345 5.197 13.426 1.00 91.88 O ATOM 9 HN3 ASP A 229 19.727 2.878 16.548 1.00 0.00 H ATOM 10 HN2 ASP A 229 18.566 3.864 15.793 1.00 0.00 H ATOM 11 HN1 ASP A 229 19.968 4.558 16.457 1.00 0.00 H ATOM 12 N MET A 230 19.399 2.532 12.663 1.00 66.16 N ATOM 13 CA MET A 230 18.877 1.471 11.804 1.00 59.45 C ATOM 14 C MET A 230 19.771 1.356 10.572 1.00 58.45 C ATOM 15 O MET A 230 19.378 1.756 9.467 1.00 56.23 O ATOM 16 CB MET A 230 17.429 1.743 11.403 1.00 54.12 C ATOM 17 CG MET A 230 16.744 0.570 10.723 1.00 51.32 C ATOM 18 SD MET A 230 16.483 -0.809 11.855 1.00 50.70 S ATOM 19 CE MET A 230 15.899 -2.080 10.737 1.00 46.33 C ATOM 20 H MET A 230 19.523 3.481 12.256 1.00 0.00 H ATOM 21 N PRO A 231 20.977 0.813 10.727 1.00 60.30 N ATOM 22 CA PRO A 231 21.915 0.764 9.597 1.00 59.77 C ATOM 23 C PRO A 231 21.438 -0.207 8.526 1.00 58.12 C ATOM 24 O PRO A 231 21.106 -1.359 8.813 1.00 56.24 O ATOM 25 CB PRO A 231 23.224 0.295 10.241 1.00 61.36 C ATOM 26 CG PRO A 231 22.784 -0.486 11.435 1.00 61.81 C ATOM 27 CD PRO A 231 21.538 0.194 11.940 1.00 61.51 C ATOM 28 N VAL A 232 21.405 0.274 7.281 1.00 57.53 N ATOM 29 CA VAL A 232 21.031 -0.583 6.163 1.00 52.81 C ATOM 30 C VAL A 232 22.050 -1.691 5.947 1.00 54.11 C ATOM 31 O VAL A 232 21.726 -2.714 5.334 1.00 52.84 O ATOM 32 CB VAL A 232 20.857 0.248 4.877 1.00 53.01 C ATOM 33 CG1 VAL A 232 19.766 1.291 5.061 1.00 41.72 C ATOM 34 CG2 VAL A 232 22.172 0.903 4.489 1.00 54.93 C ATOM 35 H VAL A 232 21.649 1.270 7.107 1.00 0.00 H ATOM 36 N GLU A 233 23.282 -1.515 6.430 1.00 58.02 N ATOM 37 CA GLU A 233 24.287 -2.563 6.283 1.00 61.09 C ATOM 38 C GLU A 233 23.834 -3.851 6.958 1.00 58.37 C ATOM 39 O GLU A 233 23.928 -4.938 6.377 1.00 56.13 O ATOM 40 CB GLU A 233 25.628 -2.096 6.854 1.00 70.27 C ATOM 41 CG GLU A 233 26.323 -1.016 6.034 1.00 79.14 C ATOM 42 CD GLU A 233 25.682 0.350 6.192 1.00 84.39 C ATOM 43 OE1 GLU A 233 24.818 0.501 7.081 1.00 84.66 O ATOM 44 OE2 GLU A 233 26.045 1.270 5.428 1.00 86.89 O ATOM 45 H GLU A 233 23.527 -0.627 6.913 1.00 0.00 H ATOM 46 N ARG A 234 23.330 -3.747 8.190 1.00 59.71 N ATOM 47 CA ARG A 234 22.855 -4.933 8.895 1.00 61.23 C ATOM 48 C ARG A 234 21.603 -5.501 8.240 1.00 56.45 C ATOM 49 O ARG A 234 21.455 -6.724 8.130 1.00 56.79 O ATOM 50 CB ARG A 234 22.595 -4.603 10.365 1.00 67.54 C ATOM 51 CG ARG A 234 23.823 -4.736 11.251 1.00 76.42 C ATOM 52 CD ARG A 234 24.052 -3.489 12.088 1.00 86.01 C ATOM 53 NE ARG A 234 25.136 -3.674 13.050 1.00 95.39 N ATOM 54 CZ ARG A 234 25.555 -2.739 13.897 1.00100.55 C ATOM 55 NH1 ARG A 234 26.546 -3.000 14.739 1.00104.75 N ATOM 56 NH2 ARG A 234 24.983 -1.543 13.904 1.00101.22 N ATOM 57 HE ARG A 234 25.611 -4.599 13.074 1.00 0.00 H ATOM 58 HH12 ARG A 234 26.873 -2.267 15.401 1.00 0.00 H ATOM 59 HH11 ARG A 234 26.997 -3.937 14.737 1.00 0.00 H ATOM 60 HH22 ARG A 234 25.312 -0.813 14.567 1.00 0.00 H ATOM 61 HH21 ARG A 234 24.205 -1.335 13.246 1.00 0.00 H ATOM 62 H ARG A 234 23.276 -2.816 8.650 1.00 0.00 H ATOM 63 N ILE A 235 20.689 -4.632 7.804 1.00 53.57 N ATOM 64 CA ILE A 235 19.505 -5.102 7.091 1.00 49.42 C ATOM 65 C ILE A 235 19.913 -5.899 5.860 1.00 51.06 C ATOM 66 O ILE A 235 19.274 -6.896 5.503 1.00 49.41 O ATOM 67 CB ILE A 235 18.596 -3.915 6.724 1.00 45.38 C ATOM 68 CG1 ILE A 235 18.116 -3.203 7.990 1.00 47.98 C ATOM 69 CG2 ILE A 235 17.419 -4.383 5.885 1.00 39.59 C ATOM 70 CD1 ILE A 235 17.194 -2.037 7.719 1.00 48.65 C ATOM 71 H ILE A 235 20.821 -3.614 7.973 1.00 0.00 H ATOM 72 N LEU A 236 20.986 -5.473 5.191 1.00 51.54 N ATOM 73 CA LEU A 236 21.502 -6.239 4.062 1.00 51.02 C ATOM 74 C LEU A 236 22.058 -7.582 4.517 1.00 52.58 C ATOM 75 O LEU A 236 21.844 -8.605 3.856 1.00 51.67 O ATOM 76 CB LEU A 236 22.573 -5.432 3.329 1.00 51.61 C ATOM 77 CG LEU A 236 23.257 -6.132 2.155 1.00 49.51 C ATOM 78 CD1 LEU A 236 22.234 -6.531 1.104 1.00 41.24 C ATOM 79 CD2 LEU A 236 24.333 -5.238 1.558 1.00 45.56 C ATOM 80 H LEU A 236 21.457 -4.590 5.476 1.00 0.00 H ATOM 81 N GLU A 237 22.777 -7.599 5.643 1.00 51.21 N ATOM 82 CA GLU A 237 23.287 -8.858 6.175 1.00 52.42 C ATOM 83 C GLU A 237 22.154 -9.844 6.433 1.00 48.50 C ATOM 84 O GLU A 237 22.306 -11.050 6.208 1.00 47.14 O ATOM 85 CB GLU A 237 24.080 -8.606 7.458 1.00 59.87 C ATOM 86 CG GLU A 237 25.309 -7.726 7.278 1.00 66.85 C ATOM 87 CD GLU A 237 26.010 -7.423 8.592 1.00 72.20 C ATOM 88 OE1 GLU A 237 25.425 -7.699 9.661 1.00 73.35 O ATOM 89 OE2 GLU A 237 27.148 -6.908 8.555 1.00 73.80 O ATOM 90 H GLU A 237 22.974 -6.709 6.143 1.00 0.00 H ATOM 91 N ALA A 238 21.010 -9.348 6.909 1.00 44.34 N ATOM 92 CA ALA A 238 19.866 -10.223 7.135 1.00 41.78 C ATOM 93 C ALA A 238 19.381 -10.844 5.831 1.00 47.36 C ATOM 94 O ALA A 238 19.096 -12.046 5.774 1.00 52.60 O ATOM 95 CB ALA A 238 18.738 -9.448 7.816 1.00 37.24 C ATOM 96 H ALA A 238 20.934 -8.332 7.120 1.00 0.00 H ATOM 97 N GLU A 239 19.283 -10.040 4.770 1.00 46.27 N ATOM 98 CA GLU A 239 18.849 -10.567 3.481 1.00 46.73 C ATOM 99 C GLU A 239 19.842 -11.591 2.944 1.00 50.70 C ATOM 100 O GLU A 239 19.452 -12.669 2.479 1.00 49.98 O ATOM 101 CB GLU A 239 18.662 -9.424 2.483 1.00 47.63 C ATOM 102 CG GLU A 239 17.402 -8.604 2.696 1.00 49.46 C ATOM 103 CD GLU A 239 16.139 -9.429 2.544 1.00 49.41 C ATOM 104 OE1 GLU A 239 15.271 -9.359 3.438 1.00 52.97 O ATOM 105 OE2 GLU A 239 16.017 -10.153 1.533 1.00 46.03 O ATOM 106 H GLU A 239 19.518 -9.031 4.863 1.00 0.00 H ATOM 107 N LEU A 240 21.136 -11.269 2.997 1.00 55.06 N ATOM 108 CA LEU A 240 22.143 -12.187 2.477 1.00 55.03 C ATOM 109 C LEU A 240 22.256 -13.443 3.330 1.00 56.43 C ATOM 110 O LEU A 240 22.644 -14.502 2.823 1.00 59.20 O ATOM 111 CB LEU A 240 23.498 -11.485 2.387 1.00 52.03 C ATOM 112 CG LEU A 240 23.549 -10.244 1.495 1.00 47.83 C ATOM 113 CD1 LEU A 240 24.946 -9.651 1.475 1.00 46.66 C ATOM 114 CD2 LEU A 240 23.085 -10.580 0.086 1.00 44.28 C ATOM 115 H LEU A 240 21.427 -10.360 3.411 1.00 0.00 H ATOM 116 N ALA A 241 21.920 -13.351 4.618 1.00 56.31 N ATOM 117 CA ALA A 241 22.067 -14.493 5.510 1.00 54.87 C ATOM 118 C ALA A 241 20.999 -15.556 5.284 1.00 57.22 C ATOM 119 O ALA A 241 21.225 -16.722 5.622 1.00 58.53 O ATOM 120 CB ALA A 241 22.036 -14.028 6.966 1.00 51.38 C ATOM 121 H ALA A 241 21.549 -12.453 4.989 1.00 0.00 H ATOM 122 N VAL A 242 19.847 -15.186 4.719 1.00 58.40 N ATOM 123 CA VAL A 242 18.743 -16.124 4.541 1.00 61.94 C ATOM 124 C VAL A 242 18.618 -16.624 3.108 1.00 70.56 C ATOM 125 O VAL A 242 17.669 -17.358 2.801 1.00 71.99 O ATOM 126 CB VAL A 242 17.409 -15.504 5.004 1.00 55.38 C ATOM 127 CG1 VAL A 242 17.403 -15.325 6.516 1.00 52.11 C ATOM 128 CG2 VAL A 242 17.164 -14.175 4.306 1.00 50.93 C ATOM 129 H VAL A 242 19.733 -14.204 4.397 1.00 0.00 H ATOM 130 N GLU A 243 19.540 -16.255 2.223 1.00 78.30 N ATOM 131 CA GLU A 243 19.512 -16.767 0.856 1.00 83.63 C ATOM 132 C GLU A 243 19.819 -18.260 0.830 1.00 86.44 C ATOM 133 O GLU A 243 20.300 -18.787 -0.173 1.00 88.25 O ATOM 134 CB GLU A 243 20.506 -16.017 -0.034 1.00 90.89 C ATOM 135 CG GLU A 243 20.067 -14.622 -0.438 1.00 95.62 C ATOM 136 CD GLU A 243 20.676 -14.189 -1.759 1.00102.19 C ATOM 137 OE1 GLU A 243 20.708 -15.016 -2.696 1.00104.65 O ATOM 138 OE2 GLU A 243 21.129 -13.030 -1.859 1.00104.26 O ATOM 139 H GLU A 243 20.290 -15.594 2.508 1.00 0.00 H TER 140 GLU A 243 ATOM 141 N ASP A 263 2.389 -30.697 -9.455 1.00 71.72 N ATOM 142 CA ASP A 263 1.381 -29.666 -9.238 1.00 69.99 C ATOM 143 C ASP A 263 2.030 -28.370 -8.766 1.00 62.91 C ATOM 144 O ASP A 263 2.662 -28.336 -7.711 1.00 61.29 O ATOM 145 CB ASP A 263 0.334 -30.142 -8.225 1.00 76.53 C ATOM 146 CG ASP A 263 -0.715 -29.084 -7.921 1.00 80.30 C ATOM 147 OD1 ASP A 263 -0.840 -28.117 -8.702 1.00 80.51 O ATOM 148 OD2 ASP A 263 -1.422 -29.225 -6.900 1.00 81.38 O ATOM 149 HN3 ASP A 263 2.895 -30.878 -8.565 1.00 0.00 H ATOM 150 HN2 ASP A 263 3.063 -30.375 -10.179 1.00 0.00 H ATOM 151 HN1 ASP A 263 1.926 -31.571 -9.776 1.00 0.00 H ATOM 152 N PRO A 264 1.879 -27.302 -9.553 1.00 61.14 N ATOM 153 CA PRO A 264 2.497 -26.023 -9.162 1.00 59.64 C ATOM 154 C PRO A 264 2.006 -25.505 -7.822 1.00 58.30 C ATOM 155 O PRO A 264 2.786 -24.908 -7.069 1.00 54.97 O ATOM 156 CB PRO A 264 2.109 -25.082 -10.313 1.00 45.47 C ATOM 157 CG PRO A 264 1.802 -25.986 -11.463 1.00 48.26 C ATOM 158 CD PRO A 264 1.208 -27.221 -10.861 1.00 50.40 C ATOM 159 N VAL A 265 0.728 -25.715 -7.501 1.00 56.19 N ATOM 160 CA VAL A 265 0.194 -25.218 -6.237 1.00 51.44 C ATOM 161 C VAL A 265 0.840 -25.939 -5.062 1.00 51.52 C ATOM 162 O VAL A 265 1.215 -25.313 -4.063 1.00 48.46 O ATOM 163 CB VAL A 265 -1.339 -25.351 -6.215 1.00 52.93 C ATOM 164 CG1 VAL A 265 -1.879 -25.000 -4.838 1.00 53.45 C ATOM 165 CG2 VAL A 265 -1.962 -24.458 -7.275 1.00 50.96 C ATOM 166 H VAL A 265 0.109 -26.236 -8.155 1.00 0.00 H ATOM 167 N THR A 266 0.983 -27.262 -5.158 1.00 56.55 N ATOM 168 CA THR A 266 1.616 -28.014 -4.079 1.00 55.85 C ATOM 169 C THR A 266 3.066 -27.590 -3.885 1.00 55.47 C ATOM 170 O THR A 266 3.539 -27.469 -2.748 1.00 54.53 O ATOM 171 CB THR A 266 1.531 -29.514 -4.361 1.00 58.93 C ATOM 172 OG1 THR A 266 0.176 -29.953 -4.211 1.00 63.12 O ATOM 173 CG2 THR A 266 2.423 -30.286 -3.403 1.00 57.18 C ATOM 174 HG1 THR A 266 -0.401 -29.464 -4.850 1.00 0.00 H ATOM 175 H THR A 266 0.642 -27.760 -6.005 1.00 0.00 H ATOM 176 N ASN A 267 3.792 -27.363 -4.983 1.00 56.53 N ATOM 177 CA ASN A 267 5.179 -26.927 -4.869 1.00 53.39 C ATOM 178 C ASN A 267 5.279 -25.519 -4.300 1.00 49.58 C ATOM 179 O ASN A 267 6.264 -25.191 -3.629 1.00 51.86 O ATOM 180 CB ASN A 267 5.870 -26.997 -6.230 1.00 54.30 C ATOM 181 CG ASN A 267 6.140 -28.420 -6.674 1.00 59.60 C ATOM 182 OD1 ASN A 267 7.187 -28.990 -6.364 1.00 60.21 O ATOM 183 ND2 ASN A 267 5.197 -29.003 -7.404 1.00 63.76 N ATOM 184 HD22 ASN A 267 4.328 -28.483 -7.642 1.00 0.00 H ATOM 185 HD21 ASN A 267 5.327 -29.979 -7.738 1.00 0.00 H ATOM 186 H ASN A 267 3.367 -27.498 -5.922 1.00 0.00 H ATOM 187 N ILE A 268 4.280 -24.675 -4.560 1.00 47.52 N ATOM 188 CA ILE A 268 4.289 -23.327 -4.003 1.00 44.99 C ATOM 189 C ILE A 268 4.077 -23.374 -2.497 1.00 44.40 C ATOM 190 O ILE A 268 4.724 -22.640 -1.740 1.00 39.94 O ATOM 191 CB ILE A 268 3.228 -22.457 -4.701 1.00 45.96 C ATOM 192 CG1 ILE A 268 3.663 -22.141 -6.134 1.00 46.07 C ATOM 193 CG2 ILE A 268 2.975 -21.183 -3.910 1.00 43.00 C ATOM 194 CD1 ILE A 268 2.682 -21.280 -6.898 1.00 45.72 C ATOM 195 H ILE A 268 3.490 -24.980 -5.164 1.00 0.00 H ATOM 196 N CYS A 269 3.173 -24.240 -2.037 1.00 44.49 N ATOM 197 CA CYS A 269 2.922 -24.354 -0.606 1.00 42.51 C ATOM 198 C CYS A 269 4.129 -24.933 0.121 1.00 47.37 C ATOM 199 O CYS A 269 4.464 -24.492 1.227 1.00 49.34 O ATOM 200 CB CYS A 269 1.680 -25.208 -0.360 1.00 43.17 C ATOM 201 SG CYS A 269 0.155 -24.470 -0.981 1.00 42.14 S ATOM 202 H CYS A 269 2.644 -24.838 -2.704 1.00 0.00 H ATOM 203 N GLN A 270 4.795 -25.919 -0.482 1.00 48.34 N ATOM 204 CA GLN A 270 6.002 -26.469 0.124 1.00 43.88 C ATOM 205 C GLN A 270 7.052 -25.385 0.329 1.00 41.95 C ATOM 206 O GLN A 270 7.639 -25.267 1.410 1.00 45.53 O ATOM 207 CB GLN A 270 6.557 -27.602 -0.740 1.00 53.98 C ATOM 208 CG GLN A 270 5.740 -28.880 -0.691 1.00 60.30 C ATOM 209 CD GLN A 270 6.342 -29.986 -1.537 1.00 68.82 C ATOM 210 OE1 GLN A 270 6.952 -29.727 -2.575 1.00 70.29 O ATOM 211 NE2 GLN A 270 6.179 -31.227 -1.092 1.00 72.65 N ATOM 212 HE22 GLN A 270 5.656 -31.399 -0.210 1.00 0.00 H ATOM 213 HE21 GLN A 270 6.574 -32.027 -1.626 1.00 0.00 H ATOM 214 H GLN A 270 4.452 -26.297 -1.388 1.00 0.00 H ATOM 215 N ALA A 271 7.301 -24.576 -0.703 1.00 45.08 N ATOM 216 CA ALA A 271 8.288 -23.510 -0.577 1.00 45.90 C ATOM 217 C ALA A 271 7.869 -22.493 0.477 1.00 45.49 C ATOM 218 O ALA A 271 8.703 -22.016 1.257 1.00 46.33 O ATOM 219 CB ALA A 271 8.504 -22.830 -1.929 1.00 38.23 C ATOM 220 H ALA A 271 6.790 -24.706 -1.599 1.00 0.00 H ATOM 221 N ALA A 272 6.581 -22.147 0.517 1.00 43.77 N ATOM 222 CA ALA A 272 6.106 -21.183 1.505 1.00 41.83 C ATOM 223 C ALA A 272 6.338 -21.695 2.921 1.00 41.83 C ATOM 224 O ALA A 272 6.832 -20.963 3.787 1.00 40.77 O ATOM 225 CB ALA A 272 4.625 -20.879 1.276 1.00 40.21 C ATOM 226 H ALA A 272 5.912 -22.566 -0.160 1.00 0.00 H ATOM 227 N ASP A 273 5.984 -22.956 3.174 1.00 43.45 N ATOM 228 CA ASP A 273 6.211 -23.533 4.494 1.00 43.47 C ATOM 229 C ASP A 273 7.695 -23.561 4.832 1.00 45.39 C ATOM 230 O ASP A 273 8.085 -23.300 5.976 1.00 46.99 O ATOM 231 CB ASP A 273 5.615 -24.940 4.558 1.00 45.61 C ATOM 232 CG ASP A 273 5.680 -25.537 5.949 1.00 48.43 C ATOM 233 OD1 ASP A 273 4.740 -25.307 6.738 1.00 50.32 O ATOM 234 OD2 ASP A 273 6.667 -26.240 6.252 1.00 49.43 O ATOM 235 H ASP A 273 5.544 -23.530 2.427 1.00 0.00 H ATOM 236 N LYS A 274 8.541 -23.872 3.847 1.00 46.14 N ATOM 237 CA LYS A 274 9.977 -23.926 4.098 1.00 48.05 C ATOM 238 C LYS A 274 10.545 -22.553 4.435 1.00 47.58 C ATOM 239 O LYS A 274 11.470 -22.449 5.248 1.00 48.48 O ATOM 240 CB LYS A 274 10.703 -24.512 2.887 1.00 47.10 C ATOM 241 CG LYS A 274 12.216 -24.460 2.997 1.00 48.28 C ATOM 242 CD LYS A 274 12.887 -24.989 1.742 1.00 51.61 C ATOM 243 CE LYS A 274 14.400 -24.937 1.871 1.00 55.75 C ATOM 244 NZ LYS A 274 15.081 -25.469 0.661 1.00 59.88 N ATOM 245 HZ1 LYS A 274 14.801 -26.460 0.514 1.00 0.00 H ATOM 246 HZ2 LYS A 274 14.806 -24.903 -0.167 1.00 0.00 H ATOM 247 HZ3 LYS A 274 16.111 -25.415 0.792 1.00 0.00 H ATOM 248 H LYS A 274 8.174 -24.077 2.896 1.00 0.00 H ATOM 249 N GLN A 275 10.009 -21.494 3.828 1.00 45.22 N ATOM 250 CA GLN A 275 10.539 -20.157 4.060 1.00 43.25 C ATOM 251 C GLN A 275 10.025 -19.530 5.348 1.00 44.69 C ATOM 252 O GLN A 275 10.657 -18.598 5.858 1.00 46.30 O ATOM 253 CB GLN A 275 10.216 -19.249 2.873 1.00 39.71 C ATOM 254 CG GLN A 275 10.957 -19.631 1.607 1.00 42.17 C ATOM 255 CD GLN A 275 12.448 -19.782 1.839 1.00 45.87 C ATOM 256 OE1 GLN A 275 12.972 -20.896 1.878 1.00 50.27 O ATOM 257 NE2 GLN A 275 13.141 -18.660 1.996 1.00 42.41 N ATOM 258 HE22 GLN A 275 12.657 -17.740 1.956 1.00 0.00 H ATOM 259 HE21 GLN A 275 14.167 -18.701 2.159 1.00 0.00 H ATOM 260 H GLN A 275 9.204 -21.624 3.182 1.00 0.00 H ATOM 261 N LEU A 276 8.900 -20.009 5.884 1.00 45.51 N ATOM 262 CA LEU A 276 8.431 -19.496 7.167 1.00 34.08 C ATOM 263 C LEU A 276 9.477 -19.706 8.255 1.00 39.06 C ATOM 264 O LEU A 276 9.735 -18.805 9.062 1.00 37.99 O ATOM 265 CB LEU A 276 7.110 -20.159 7.554 1.00 34.72 C ATOM 266 CG LEU A 276 5.872 -19.683 6.794 1.00 33.51 C ATOM 267 CD1 LEU A 276 4.649 -20.482 7.213 1.00 34.71 C ATOM 268 CD2 LEU A 276 5.650 -18.194 7.020 1.00 31.74 C ATOM 269 H LEU A 276 8.359 -20.746 5.388 1.00 0.00 H ATOM 270 N PHE A 277 10.092 -20.890 8.292 1.00 37.32 N ATOM 271 CA PHE A 277 11.182 -21.118 9.234 1.00 47.95 C ATOM 272 C PHE A 277 12.328 -20.146 8.986 1.00 47.28 C ATOM 273 O PHE A 277 12.880 -19.569 9.930 1.00 50.27 O ATOM 274 CB PHE A 277 11.671 -22.563 9.134 1.00 41.38 C ATOM 275 CG PHE A 277 10.642 -23.580 9.538 1.00 46.22 C ATOM 276 CD1 PHE A 277 9.727 -24.064 8.619 1.00 42.52 C ATOM 277 CD2 PHE A 277 10.592 -24.055 10.838 1.00 44.34 C ATOM 278 CE1 PHE A 277 8.780 -25.001 8.988 1.00 44.05 C ATOM 279 CE2 PHE A 277 9.647 -24.992 11.213 1.00 45.87 C ATOM 280 CZ PHE A 277 8.740 -25.465 10.287 1.00 45.74 C ATOM 281 H PHE A 277 9.794 -21.651 7.649 1.00 0.00 H ATOM 282 N THR A 278 12.698 -19.950 7.718 1.00 45.91 N ATOM 283 CA THR A 278 13.745 -18.990 7.393 1.00 46.68 C ATOM 284 C THR A 278 13.321 -17.564 7.720 1.00 43.80 C ATOM 285 O THR A 278 14.158 -16.746 8.118 1.00 44.15 O ATOM 286 CB THR A 278 14.122 -19.102 5.915 1.00 48.88 C ATOM 287 OG1 THR A 278 14.675 -20.398 5.656 1.00 50.92 O ATOM 288 CG2 THR A 278 15.142 -18.034 5.541 1.00 52.19 C ATOM 289 HG1 THR A 278 14.918 -20.467 4.699 1.00 0.00 H ATOM 290 H THR A 278 12.235 -20.487 6.957 1.00 0.00 H ATOM 291 N LEU A 279 12.032 -17.251 7.564 1.00 39.89 N ATOM 292 CA LEU A 279 11.558 -15.903 7.860 1.00 40.04 C ATOM 293 C LEU A 279 11.801 -15.544 9.319 1.00 43.85 C ATOM 294 O LEU A 279 12.143 -14.399 9.637 1.00 45.70 O ATOM 295 CB LEU A 279 10.074 -15.783 7.512 1.00 35.71 C ATOM 296 CG LEU A 279 9.444 -14.398 7.669 1.00 31.89 C ATOM 297 CD1 LEU A 279 10.142 -13.385 6.774 1.00 29.94 C ATOM 298 CD2 LEU A 279 7.956 -14.452 7.362 1.00 28.86 C ATOM 299 H LEU A 279 11.362 -17.973 7.229 1.00 0.00 H ATOM 300 N VAL A 280 11.629 -16.510 10.224 1.00 45.27 N ATOM 301 CA VAL A 280 11.884 -16.251 11.637 1.00 42.59 C ATOM 302 C VAL A 280 13.343 -15.870 11.852 1.00 42.27 C ATOM 303 O VAL A 280 13.650 -14.915 12.576 1.00 44.28 O ATOM 304 CB VAL A 280 11.483 -17.472 12.486 1.00 44.90 C ATOM 305 CG1 VAL A 280 11.799 -17.228 13.955 1.00 45.89 C ATOM 306 CG2 VAL A 280 10.006 -17.784 12.299 1.00 43.10 C ATOM 307 H VAL A 280 11.311 -17.453 9.920 1.00 0.00 H ATOM 308 N GLU A 281 14.264 -16.604 11.223 1.00 43.64 N ATOM 309 CA GLU A 281 15.681 -16.275 11.356 1.00 47.50 C ATOM 310 C GLU A 281 15.984 -14.898 10.779 1.00 44.05 C ATOM 311 O GLU A 281 16.785 -14.143 11.342 1.00 41.65 O ATOM 312 CB GLU A 281 16.536 -17.341 10.672 1.00 53.50 C ATOM 313 CG GLU A 281 16.591 -18.664 11.414 1.00 61.66 C ATOM 314 CD GLU A 281 17.058 -18.505 12.849 1.00 67.62 C ATOM 315 OE1 GLU A 281 16.218 -18.195 13.720 1.00 67.52 O ATOM 316 OE2 GLU A 281 18.269 -18.678 13.101 1.00 72.15 O ATOM 317 H GLU A 281 13.972 -17.412 10.637 1.00 0.00 H ATOM 318 N TRP A 282 15.359 -14.556 9.652 1.00 44.55 N ATOM 319 CA TRP A 282 15.579 -13.243 9.057 1.00 42.82 C ATOM 320 C TRP A 282 15.147 -12.133 10.007 1.00 42.88 C ATOM 321 O TRP A 282 15.888 -11.169 10.233 1.00 46.75 O ATOM 322 CB TRP A 282 14.832 -13.140 7.728 1.00 40.59 C ATOM 323 CG TRP A 282 14.795 -11.751 7.173 1.00 38.48 C ATOM 324 CD1 TRP A 282 15.768 -11.133 6.442 1.00 37.90 C ATOM 325 CD2 TRP A 282 13.728 -10.804 7.304 1.00 34.77 C ATOM 326 NE1 TRP A 282 15.373 -9.859 6.111 1.00 34.78 N ATOM 327 CE2 TRP A 282 14.125 -9.633 6.628 1.00 33.79 C ATOM 328 CE3 TRP A 282 12.477 -10.832 7.927 1.00 32.78 C ATOM 329 CZ2 TRP A 282 13.314 -8.500 6.557 1.00 32.77 C ATOM 330 CZ3 TRP A 282 11.673 -9.706 7.856 1.00 30.36 C ATOM 331 CH2 TRP A 282 12.095 -8.557 7.177 1.00 29.61 C ATOM 332 HE1 TRP A 282 15.931 -9.177 5.558 1.00 0.00 H ATOM 333 H TRP A 282 14.711 -15.229 9.195 1.00 0.00 H ATOM 334 N ALA A 283 13.946 -12.255 10.577 1.00 39.98 N ATOM 335 CA ALA A 283 13.438 -11.206 11.456 1.00 39.30 C ATOM 336 C ALA A 283 14.358 -10.991 12.651 1.00 40.36 C ATOM 337 O ALA A 283 14.540 -9.856 13.105 1.00 42.42 O ATOM 338 CB ALA A 283 12.022 -11.549 11.919 1.00 32.02 C ATOM 339 H ALA A 283 13.370 -13.101 10.394 1.00 0.00 H ATOM 340 N LYS A 284 14.947 -12.069 13.174 1.00 41.70 N ATOM 341 CA LYS A 284 15.864 -11.936 14.302 1.00 42.79 C ATOM 342 C LYS A 284 17.062 -11.064 13.953 1.00 45.71 C ATOM 343 O LYS A 284 17.623 -10.399 14.832 1.00 45.13 O ATOM 344 CB LYS A 284 16.334 -13.314 14.767 1.00 42.57 C ATOM 345 CG LYS A 284 15.262 -14.148 15.448 1.00 43.56 C ATOM 346 CD LYS A 284 15.846 -15.448 15.977 1.00 47.38 C ATOM 347 CE LYS A 284 14.824 -16.234 16.778 1.00 49.22 C ATOM 348 NZ LYS A 284 15.397 -17.505 17.297 1.00 54.99 N ATOM 349 HZ1 LYS A 284 15.713 -18.093 16.499 1.00 0.00 H ATOM 350 HZ2 LYS A 284 16.206 -17.292 17.914 1.00 0.00 H ATOM 351 HZ3 LYS A 284 14.671 -18.015 17.839 1.00 0.00 H ATOM 352 H LYS A 284 14.751 -13.009 12.775 1.00 0.00 H ATOM 353 N ARG A 285 17.470 -11.055 12.684 1.00 46.88 N ATOM 354 CA ARG A 285 18.615 -10.265 12.256 1.00 47.01 C ATOM 355 C ARG A 285 18.264 -8.812 11.966 1.00 46.29 C ATOM 356 O ARG A 285 19.177 -7.994 11.810 1.00 47.94 O ATOM 357 CB ARG A 285 19.251 -10.903 11.020 1.00 51.55 C ATOM 358 CG ARG A 285 19.848 -12.275 11.284 1.00 57.98 C ATOM 359 CD ARG A 285 20.300 -12.937 9.997 1.00 64.07 C ATOM 360 NE ARG A 285 21.040 -14.168 10.252 1.00 69.70 N ATOM 361 CZ ARG A 285 22.364 -14.236 10.339 1.00 76.78 C ATOM 362 NH1 ARG A 285 23.096 -13.141 10.189 1.00 77.71 N ATOM 363 NH2 ARG A 285 22.956 -15.399 10.575 1.00 81.30 N ATOM 364 HE ARG A 285 20.497 -15.047 10.373 1.00 0.00 H ATOM 365 HH12 ARG A 285 24.132 -13.195 10.257 1.00 0.00 H ATOM 366 HH11 ARG A 285 22.634 -12.228 10.003 1.00 0.00 H ATOM 367 HH22 ARG A 285 23.993 -15.451 10.643 1.00 0.00 H ATOM 368 HH21 ARG A 285 22.384 -16.259 10.692 1.00 0.00 H ATOM 369 H ARG A 285 16.957 -11.627 11.982 1.00 0.00 H ATOM 370 N ILE A 286 16.985 -8.472 11.885 1.00 44.87 N ATOM 371 CA ILE A 286 16.607 -7.065 11.713 1.00 43.12 C ATOM 372 C ILE A 286 16.841 -6.327 13.026 1.00 44.14 C ATOM 373 O ILE A 286 16.354 -6.774 14.080 1.00 45.43 O ATOM 374 CB ILE A 286 15.148 -6.952 11.270 1.00 33.57 C ATOM 375 CG1 ILE A 286 14.945 -7.644 9.921 1.00 37.05 C ATOM 376 CG2 ILE A 286 14.731 -5.492 11.187 1.00 33.37 C ATOM 377 CD1 ILE A 286 15.780 -7.062 8.801 1.00 32.83 C ATOM 378 H ILE A 286 16.249 -9.204 11.943 1.00 0.00 H ATOM 379 N PRO A 287 17.569 -5.212 13.024 1.00 43.14 N ATOM 380 CA PRO A 287 17.908 -4.552 14.291 1.00 40.49 C ATOM 381 C PRO A 287 16.664 -4.201 15.095 1.00 40.84 C ATOM 382 O PRO A 287 15.693 -3.654 14.567 1.00 41.69 O ATOM 383 CB PRO A 287 18.668 -3.298 13.843 1.00 42.14 C ATOM 384 CG PRO A 287 19.204 -3.645 12.489 1.00 41.56 C ATOM 385 CD PRO A 287 18.161 -4.526 11.863 1.00 41.54 C ATOM 386 N HIS A 288 16.700 -4.540 16.383 1.00 42.71 N ATOM 387 CA HIS A 288 15.738 -4.189 17.421 1.00 45.15 C ATOM 388 C HIS A 288 14.483 -5.062 17.394 1.00 45.15 C ATOM 389 O HIS A 288 13.651 -4.934 18.294 1.00 47.66 O ATOM 390 CB HIS A 288 15.316 -2.708 17.371 1.00 44.73 C ATOM 391 CG HIS A 288 16.469 -1.755 17.427 1.00 49.35 C ATOM 392 ND1 HIS A 288 17.257 -1.606 18.548 1.00 54.83 N ATOM 393 CD2 HIS A 288 16.973 -0.910 16.497 1.00 50.73 C ATOM 394 CE1 HIS A 288 18.194 -0.706 18.308 1.00 54.70 C ATOM 395 NE2 HIS A 288 18.044 -0.268 17.071 1.00 54.80 N ATOM 396 H HIS A 288 17.508 -5.122 16.683 1.00 0.00 H ATOM 397 N PHE A 289 14.314 -5.948 16.410 1.00 42.10 N ATOM 398 CA PHE A 289 13.117 -6.783 16.374 1.00 40.95 C ATOM 399 C PHE A 289 13.087 -7.752 17.551 1.00 44.59 C ATOM 400 O PHE A 289 12.057 -7.903 18.219 1.00 44.91 O ATOM 401 CB PHE A 289 13.038 -7.543 15.050 1.00 39.95 C ATOM 402 CG PHE A 289 11.890 -8.511 14.980 1.00 39.82 C ATOM 403 CD1 PHE A 289 10.615 -8.073 14.662 1.00 36.12 C ATOM 404 CD2 PHE A 289 12.083 -9.858 15.239 1.00 41.52 C ATOM 405 CE1 PHE A 289 9.557 -8.958 14.600 1.00 34.85 C ATOM 406 CE2 PHE A 289 11.027 -10.750 15.178 1.00 41.92 C ATOM 407 CZ PHE A 289 9.763 -10.299 14.858 1.00 37.10 C ATOM 408 H PHE A 289 15.036 -6.044 15.668 1.00 0.00 H ATOM 409 N SER A 290 14.210 -8.424 17.817 1.00 45.87 N ATOM 410 CA SER A 290 14.275 -9.353 18.939 1.00 46.32 C ATOM 411 C SER A 290 14.111 -8.654 20.281 1.00 48.67 C ATOM 412 O SER A 290 13.801 -9.317 21.277 1.00 49.89 O ATOM 413 CB SER A 290 15.599 -10.119 18.915 1.00 47.98 C ATOM 414 OG SER A 290 15.712 -10.904 17.741 1.00 48.84 O ATOM 415 HG SER A 290 15.672 -10.315 16.946 1.00 0.00 H ATOM 416 H SER A 290 15.048 -8.283 17.217 1.00 0.00 H ATOM 417 N GLU A 291 14.315 -7.339 20.333 1.00 49.00 N ATOM 418 CA GLU A 291 14.129 -6.589 21.567 1.00 49.25 C ATOM 419 C GLU A 291 12.667 -6.269 21.848 1.00 47.10 C ATOM 420 O GLU A 291 12.350 -5.821 22.955 1.00 47.34 O ATOM 421 CB GLU A 291 14.948 -5.297 21.516 1.00 54.40 C ATOM 422 CG GLU A 291 16.437 -5.525 21.295 1.00 59.59 C ATOM 423 CD GLU A 291 17.193 -4.240 21.016 1.00 65.48 C ATOM 424 OE1 GLU A 291 16.542 -3.181 20.899 1.00 66.73 O ATOM 425 OE2 GLU A 291 18.437 -4.290 20.912 1.00 68.15 O ATOM 426 H GLU A 291 14.614 -6.837 19.473 1.00 0.00 H ATOM 427 N LEU A 292 11.774 -6.487 20.885 1.00 47.30 N ATOM 428 CA LEU A 292 10.358 -6.265 21.108 1.00 46.15 C ATOM 429 C LEU A 292 9.775 -7.371 21.983 1.00 48.97 C ATOM 430 O LEU A 292 10.335 -8.466 22.076 1.00 51.41 O ATOM 431 CB LEU A 292 9.609 -6.212 19.780 1.00 44.68 C ATOM 432 CG LEU A 292 9.880 -5.020 18.864 1.00 42.79 C ATOM 433 CD1 LEU A 292 9.239 -5.246 17.507 1.00 38.48 C ATOM 434 CD2 LEU A 292 9.360 -3.740 19.497 1.00 42.95 C ATOM 435 H LEU A 292 12.098 -6.823 19.955 1.00 0.00 H ATOM 436 N PRO A 293 8.646 -7.105 22.639 1.00 48.03 N ATOM 437 CA PRO A 293 7.980 -8.162 23.407 1.00 47.21 C ATOM 438 C PRO A 293 7.671 -9.362 22.525 1.00 47.30 C ATOM 439 O PRO A 293 7.322 -9.221 21.352 1.00 47.75 O ATOM 440 CB PRO A 293 6.702 -7.484 23.910 1.00 45.65 C ATOM 441 CG PRO A 293 7.029 -6.028 23.921 1.00 44.43 C ATOM 442 CD PRO A 293 7.957 -5.809 22.761 1.00 45.24 C ATOM 443 N LEU A 294 7.803 -10.556 23.108 1.00 48.16 N ATOM 444 CA LEU A 294 7.601 -11.781 22.341 1.00 49.32 C ATOM 445 C LEU A 294 6.229 -11.806 21.678 1.00 47.34 C ATOM 446 O LEU A 294 6.092 -12.257 20.535 1.00 48.67 O ATOM 447 CB LEU A 294 7.782 -13.000 23.244 1.00 55.00 C ATOM 448 CG LEU A 294 7.531 -14.357 22.584 1.00 60.06 C ATOM 449 CD1 LEU A 294 8.428 -14.536 21.369 1.00 60.39 C ATOM 450 CD2 LEU A 294 7.740 -15.485 23.582 1.00 61.66 C ATOM 451 H LEU A 294 8.052 -10.613 24.116 1.00 0.00 H ATOM 452 N ASP A 295 5.198 -11.329 22.379 1.00 46.12 N ATOM 453 CA ASP A 295 3.860 -11.322 21.798 1.00 46.16 C ATOM 454 C ASP A 295 3.770 -10.377 20.608 1.00 45.77 C ATOM 455 O ASP A 295 3.029 -10.650 19.657 1.00 48.47 O ATOM 456 CB ASP A 295 2.824 -10.945 22.857 1.00 54.40 C ATOM 457 CG ASP A 295 2.657 -12.018 23.916 1.00 62.20 C ATOM 458 OD1 ASP A 295 2.823 -13.211 23.585 1.00 65.78 O ATOM 459 OD2 ASP A 295 2.359 -11.669 25.078 1.00 62.95 O ATOM 460 H ASP A 295 5.349 -10.962 23.340 1.00 0.00 H ATOM 461 N ASP A 296 4.507 -9.265 20.640 1.00 42.84 N ATOM 462 CA ASP A 296 4.507 -8.359 19.498 1.00 41.57 C ATOM 463 C ASP A 296 5.284 -8.950 18.328 1.00 38.01 C ATOM 464 O ASP A 296 4.875 -8.806 17.170 1.00 38.55 O ATOM 465 CB ASP A 296 5.080 -7.002 19.901 1.00 44.61 C ATOM 466 CG ASP A 296 4.181 -6.257 20.867 1.00 48.35 C ATOM 467 OD1 ASP A 296 2.958 -6.510 20.855 1.00 49.58 O ATOM 468 OD2 ASP A 296 4.695 -5.420 21.638 1.00 50.86 O ATOM 469 H ASP A 296 5.081 -9.045 21.479 1.00 0.00 H ATOM 470 N GLN A 297 6.405 -9.618 18.609 1.00 38.73 N ATOM 471 CA GLN A 297 7.127 -10.310 17.547 1.00 41.24 C ATOM 472 C GLN A 297 6.227 -11.316 16.845 1.00 40.07 C ATOM 473 O GLN A 297 6.256 -11.437 15.615 1.00 40.41 O ATOM 474 CB GLN A 297 8.361 -11.007 18.115 1.00 36.16 C ATOM 475 CG GLN A 297 9.341 -10.083 18.806 1.00 37.06 C ATOM 476 CD GLN A 297 10.546 -10.829 19.340 1.00 46.37 C ATOM 477 OE1 GLN A 297 10.896 -11.899 18.842 1.00 44.67 O ATOM 478 NE2 GLN A 297 11.183 -10.272 20.364 1.00 40.02 N ATOM 479 HE22 GLN A 297 10.851 -9.366 20.752 1.00 0.00 H ATOM 480 HE21 GLN A 297 12.014 -10.742 20.777 1.00 0.00 H ATOM 481 H GLN A 297 6.764 -9.645 19.585 1.00 0.00 H ATOM 482 N VAL A 298 5.419 -12.046 17.614 1.00 39.83 N ATOM 483 CA VAL A 298 4.487 -13.001 17.020 1.00 40.20 C ATOM 484 C VAL A 298 3.458 -12.272 16.166 1.00 37.82 C ATOM 485 O VAL A 298 3.155 -12.683 15.039 1.00 33.58 O ATOM 486 CB VAL A 298 3.817 -13.846 18.118 1.00 42.46 C ATOM 487 CG1 VAL A 298 2.770 -14.770 17.514 1.00 43.61 C ATOM 488 CG2 VAL A 298 4.863 -14.642 18.884 1.00 38.85 C ATOM 489 H VAL A 298 5.453 -11.934 18.647 1.00 0.00 H ATOM 490 N ILE A 299 2.909 -11.173 16.688 1.00 34.51 N ATOM 491 CA ILE A 299 1.885 -10.429 15.958 1.00 41.51 C ATOM 492 C ILE A 299 2.441 -9.913 14.635 1.00 39.11 C ATOM 493 O ILE A 299 1.788 -10.004 13.589 1.00 36.40 O ATOM 494 CB ILE A 299 1.335 -9.280 16.822 1.00 44.02 C ATOM 495 CG1 ILE A 299 0.498 -9.832 17.979 1.00 36.72 C ATOM 496 CG2 ILE A 299 0.528 -8.311 15.966 1.00 34.07 C ATOM 497 CD1 ILE A 299 -0.091 -8.762 18.865 1.00 38.08 C ATOM 498 H ILE A 299 3.214 -10.842 17.626 1.00 0.00 H ATOM 499 N LEU A 300 3.653 -9.357 14.665 1.00 31.65 N ATOM 500 CA LEU A 300 4.234 -8.792 13.450 1.00 30.31 C ATOM 501 C LEU A 300 4.436 -9.865 12.386 1.00 35.83 C ATOM 502 O LEU A 300 4.092 -9.669 11.214 1.00 39.62 O ATOM 503 CB LEU A 300 5.558 -8.097 13.774 1.00 30.51 C ATOM 504 CG LEU A 300 5.497 -6.844 14.650 1.00 36.36 C ATOM 505 CD1 LEU A 300 6.887 -6.256 14.835 1.00 34.68 C ATOM 506 CD2 LEU A 300 4.553 -5.810 14.056 1.00 37.48 C ATOM 507 H LEU A 300 4.186 -9.326 15.557 1.00 0.00 H ATOM 508 N LEU A 301 4.991 -11.014 12.777 1.00 33.71 N ATOM 509 CA LEU A 301 5.254 -12.067 11.801 1.00 35.39 C ATOM 510 C LEU A 301 3.959 -12.675 11.272 1.00 37.92 C ATOM 511 O LEU A 301 3.822 -12.901 10.064 1.00 41.28 O ATOM 512 CB LEU A 301 6.152 -13.141 12.413 1.00 36.95 C ATOM 513 CG LEU A 301 7.611 -12.716 12.598 1.00 37.55 C ATOM 514 CD1 LEU A 301 8.430 -13.822 13.246 1.00 40.05 C ATOM 515 CD2 LEU A 301 8.219 -12.310 11.265 1.00 35.95 C ATOM 516 H LEU A 301 5.236 -11.159 13.777 1.00 0.00 H ATOM 517 N ARG A 302 2.994 -12.945 12.155 1.00 35.64 N ATOM 518 CA ARG A 302 1.724 -13.498 11.692 1.00 37.56 C ATOM 519 C ARG A 302 1.002 -12.534 10.761 1.00 38.21 C ATOM 520 O ARG A 302 0.248 -12.966 9.880 1.00 38.16 O ATOM 521 CB ARG A 302 0.834 -13.853 12.884 1.00 39.49 C ATOM 522 CG ARG A 302 1.270 -15.098 13.641 1.00 44.65 C ATOM 523 CD ARG A 302 0.264 -15.464 14.722 1.00 51.50 C ATOM 524 NE ARG A 302 -1.086 -15.607 14.181 1.00 52.69 N ATOM 525 CZ ARG A 302 -1.571 -16.734 13.669 1.00 50.23 C ATOM 526 NH1 ARG A 302 -0.817 -17.824 13.625 1.00 52.54 N ATOM 527 NH2 ARG A 302 -2.810 -16.771 13.200 1.00 47.02 N ATOM 528 HE ARG A 302 -1.707 -14.773 14.198 1.00 0.00 H ATOM 529 HH12 ARG A 302 -1.199 -18.704 13.224 1.00 0.00 H ATOM 530 HH11 ARG A 302 0.156 -17.798 13.991 1.00 0.00 H ATOM 531 HH22 ARG A 302 -3.188 -17.653 12.800 1.00 0.00 H ATOM 532 HH21 ARG A 302 -3.404 -15.918 13.232 1.00 0.00 H ATOM 533 H ARG A 302 3.146 -12.762 13.167 1.00 0.00 H ATOM 534 N ALA A 303 1.227 -11.231 10.930 1.00 38.18 N ATOM 535 CA ALA A 303 0.565 -10.216 10.122 1.00 36.54 C ATOM 536 C ALA A 303 1.268 -9.944 8.800 1.00 34.74 C ATOM 537 O ALA A 303 0.620 -9.479 7.856 1.00 38.27 O ATOM 538 CB ALA A 303 0.458 -8.906 10.910 1.00 36.87 C ATOM 539 H ALA A 303 1.899 -10.929 11.664 1.00 0.00 H ATOM 540 N GLY A 304 2.567 -10.218 8.702 1.00 35.57 N ATOM 541 CA GLY A 304 3.302 -9.869 7.502 1.00 34.76 C ATOM 542 C GLY A 304 4.070 -11.008 6.866 1.00 35.68 C ATOM 543 O GLY A 304 4.787 -10.797 5.884 1.00 37.41 O ATOM 544 H GLY A 304 3.058 -10.685 9.491 1.00 0.00 H ATOM 545 N TRP A 305 3.933 -12.221 7.408 1.00 36.64 N ATOM 546 CA TRP A 305 4.670 -13.353 6.854 1.00 37.83 C ATOM 547 C TRP A 305 4.400 -13.509 5.362 1.00 37.00 C ATOM 548 O TRP A 305 5.316 -13.795 4.582 1.00 37.14 O ATOM 549 CB TRP A 305 4.311 -14.638 7.603 1.00 28.60 C ATOM 550 CG TRP A 305 2.923 -15.132 7.327 1.00 37.08 C ATOM 551 CD1 TRP A 305 1.798 -14.863 8.050 1.00 36.87 C ATOM 552 CD2 TRP A 305 2.512 -15.981 6.247 1.00 35.67 C ATOM 553 NE1 TRP A 305 0.713 -15.491 7.489 1.00 37.53 N ATOM 554 CE2 TRP A 305 1.124 -16.183 6.380 1.00 29.98 C ATOM 555 CE3 TRP A 305 3.183 -16.587 5.180 1.00 32.85 C ATOM 556 CZ2 TRP A 305 0.395 -16.967 5.488 1.00 30.66 C ATOM 557 CZ3 TRP A 305 2.457 -17.366 4.295 1.00 30.03 C ATOM 558 CH2 TRP A 305 1.078 -17.549 4.455 1.00 30.65 C ATOM 559 HE1 TRP A 305 -0.262 -15.448 7.848 1.00 0.00 H ATOM 560 H TRP A 305 3.302 -12.359 8.223 1.00 0.00 H ATOM 561 N ASN A 306 3.151 -13.307 4.943 1.00 35.30 N ATOM 562 CA ASN A 306 2.795 -13.545 3.550 1.00 35.18 C ATOM 563 C ASN A 306 3.433 -12.508 2.634 1.00 37.06 C ATOM 564 O ASN A 306 4.129 -12.859 1.674 1.00 37.97 O ATOM 565 CB ASN A 306 1.275 -13.553 3.395 1.00 35.68 C ATOM 566 CG ASN A 306 0.837 -14.040 2.035 1.00 41.33 C ATOM 567 OD1 ASN A 306 0.013 -13.412 1.370 1.00 50.43 O ATOM 568 ND2 ASN A 306 1.401 -15.162 1.602 1.00 35.57 N ATOM 569 HD22 ASN A 306 2.093 -15.660 2.198 1.00 0.00 H ATOM 570 HD21 ASN A 306 1.151 -15.543 0.667 1.00 0.00 H ATOM 571 H ASN A 306 2.427 -12.978 5.613 1.00 0.00 H ATOM 572 N GLU A 307 3.211 -11.222 2.914 1.00 35.00 N ATOM 573 CA GLU A 307 3.852 -10.180 2.120 1.00 31.59 C ATOM 574 C GLU A 307 5.369 -10.292 2.178 1.00 34.15 C ATOM 575 O GLU A 307 6.053 -9.963 1.202 1.00 41.17 O ATOM 576 CB GLU A 307 3.402 -8.800 2.598 1.00 29.51 C ATOM 577 CG GLU A 307 1.906 -8.563 2.483 1.00 31.75 C ATOM 578 CD GLU A 307 1.492 -7.182 2.952 1.00 35.94 C ATOM 579 OE1 GLU A 307 0.284 -6.965 3.176 1.00 38.40 O ATOM 580 OE2 GLU A 307 2.375 -6.313 3.100 1.00 38.70 O ATOM 581 H GLU A 307 2.580 -10.963 3.699 1.00 0.00 H ATOM 582 N LEU A 308 5.912 -10.758 3.305 1.00 33.73 N ATOM 583 CA LEU A 308 7.360 -10.888 3.430 1.00 34.31 C ATOM 584 C LEU A 308 7.904 -11.965 2.502 1.00 36.15 C ATOM 585 O LEU A 308 8.959 -11.784 1.883 1.00 37.22 O ATOM 586 CB LEU A 308 7.731 -11.189 4.880 1.00 33.84 C ATOM 587 CG LEU A 308 7.638 -10.000 5.835 1.00 36.03 C ATOM 588 CD1 LEU A 308 7.725 -10.466 7.279 1.00 38.03 C ATOM 589 CD2 LEU A 308 8.739 -9.000 5.523 1.00 26.19 C ATOM 590 H LEU A 308 5.299 -11.030 4.100 1.00 0.00 H ATOM 591 N LEU A 309 7.203 -13.095 2.394 1.00 36.11 N ATOM 592 CA LEU A 309 7.650 -14.153 1.495 1.00 36.33 C ATOM 593 C LEU A 309 7.435 -13.765 0.038 1.00 38.08 C ATOM 594 O LEU A 309 8.291 -14.031 -0.814 1.00 40.59 O ATOM 595 CB LEU A 309 6.922 -15.457 1.812 1.00 37.56 C ATOM 596 CG LEU A 309 7.170 -16.055 3.195 1.00 39.50 C ATOM 597 CD1 LEU A 309 6.481 -17.403 3.314 1.00 43.82 C ATOM 598 CD2 LEU A 309 8.661 -16.184 3.458 1.00 40.72 C ATOM 599 H LEU A 309 6.335 -13.222 2.953 1.00 0.00 H ATOM 600 N ILE A 310 6.297 -13.139 -0.268 1.00 35.34 N ATOM 601 CA ILE A 310 6.020 -12.741 -1.645 1.00 30.46 C ATOM 602 C ILE A 310 7.081 -11.767 -2.140 1.00 32.10 C ATOM 603 O ILE A 310 7.573 -11.882 -3.270 1.00 34.09 O ATOM 604 CB ILE A 310 4.603 -12.149 -1.756 1.00 25.79 C ATOM 605 CG1 ILE A 310 3.559 -13.211 -1.406 1.00 28.30 C ATOM 606 CG2 ILE A 310 4.361 -11.603 -3.153 1.00 25.91 C ATOM 607 CD1 ILE A 310 2.139 -12.688 -1.366 1.00 26.15 C ATOM 608 H ILE A 310 5.603 -12.933 0.479 1.00 0.00 H ATOM 609 N ALA A 311 7.456 -10.797 -1.304 1.00 32.80 N ATOM 610 CA ALA A 311 8.503 -9.860 -1.695 1.00 33.50 C ATOM 611 C ALA A 311 9.828 -10.571 -1.933 1.00 36.66 C ATOM 612 O ALA A 311 10.624 -10.135 -2.772 1.00 41.48 O ATOM 613 CB ALA A 311 8.663 -8.774 -0.631 1.00 25.75 C ATOM 614 H ALA A 311 7.001 -10.709 -0.373 1.00 0.00 H ATOM 615 N SER A 312 10.080 -11.668 -1.217 1.00 33.99 N ATOM 616 CA SER A 312 11.339 -12.387 -1.378 1.00 34.99 C ATOM 617 C SER A 312 11.405 -13.095 -2.727 1.00 36.62 C ATOM 618 O SER A 312 12.334 -12.873 -3.511 1.00 38.20 O ATOM 619 CB SER A 312 11.529 -13.384 -0.233 1.00 34.56 C ATOM 620 OG SER A 312 11.863 -12.716 0.969 1.00 37.72 O ATOM 621 HG SER A 312 12.706 -12.212 0.842 1.00 0.00 H ATOM 622 H SER A 312 9.372 -12.014 -0.538 1.00 0.00 H ATOM 623 N PHE A 313 10.429 -13.961 -3.018 1.00 37.19 N ATOM 624 CA PHE A 313 10.512 -14.732 -4.253 1.00 39.46 C ATOM 625 C PHE A 313 10.296 -13.868 -5.487 1.00 41.36 C ATOM 626 O PHE A 313 10.742 -14.245 -6.576 1.00 46.40 O ATOM 627 CB PHE A 313 9.527 -15.910 -4.231 1.00 38.13 C ATOM 628 CG PHE A 313 8.086 -15.531 -4.471 1.00 38.33 C ATOM 629 CD1 PHE A 313 7.625 -15.252 -5.751 1.00 38.12 C ATOM 630 CD2 PHE A 313 7.181 -15.510 -3.423 1.00 38.30 C ATOM 631 CE1 PHE A 313 6.301 -14.921 -5.973 1.00 38.49 C ATOM 632 CE2 PHE A 313 5.853 -15.185 -3.641 1.00 37.89 C ATOM 633 CZ PHE A 313 5.414 -14.890 -4.917 1.00 38.18 C ATOM 634 H PHE A 313 9.622 -14.083 -2.373 1.00 0.00 H ATOM 635 N SER A 314 9.630 -12.720 -5.348 1.00 37.67 N ATOM 636 CA SER A 314 9.499 -11.809 -6.480 1.00 39.13 C ATOM 637 C SER A 314 10.856 -11.239 -6.876 1.00 37.71 C ATOM 638 O SER A 314 11.282 -11.359 -8.030 1.00 39.52 O ATOM 639 CB SER A 314 8.514 -10.688 -6.144 1.00 38.99 C ATOM 640 OG SER A 314 7.199 -11.193 -5.999 1.00 42.08 O ATOM 641 HG SER A 314 7.182 -11.861 -5.268 1.00 0.00 H ATOM 642 H SER A 314 9.204 -12.474 -4.432 1.00 0.00 H ATOM 643 N HIS A 315 11.554 -10.616 -5.924 1.00 35.32 N ATOM 644 CA HIS A 315 12.878 -10.074 -6.216 1.00 37.92 C ATOM 645 C HIS A 315 13.829 -11.173 -6.670 1.00 39.75 C ATOM 646 O HIS A 315 14.678 -10.952 -7.541 1.00 44.06 O ATOM 647 CB HIS A 315 13.432 -9.355 -4.987 1.00 37.89 C ATOM 648 CG HIS A 315 14.707 -8.615 -5.243 1.00 43.17 C ATOM 649 ND1 HIS A 315 15.949 -9.179 -5.048 1.00 46.00 N ATOM 650 CD2 HIS A 315 14.932 -7.353 -5.682 1.00 45.45 C ATOM 651 CE1 HIS A 315 16.884 -8.297 -5.354 1.00 47.46 C ATOM 652 NE2 HIS A 315 16.293 -7.181 -5.741 1.00 47.07 N ATOM 653 H HIS A 315 11.153 -10.516 -4.970 1.00 0.00 H ATOM 654 N ARG A 316 13.694 -12.368 -6.093 1.00 37.46 N ATOM 655 CA ARG A 316 14.517 -13.501 -6.494 1.00 34.43 C ATOM 656 C ARG A 316 14.286 -13.901 -7.945 1.00 37.91 C ATOM 657 O ARG A 316 15.135 -14.581 -8.532 1.00 41.81 O ATOM 658 CB ARG A 316 14.230 -14.689 -5.577 1.00 34.36 C ATOM 659 CG ARG A 316 15.023 -15.944 -5.885 1.00 36.47 C ATOM 660 CD ARG A 316 14.390 -17.136 -5.192 1.00 41.01 C ATOM 661 NE ARG A 316 14.172 -16.881 -3.771 1.00 41.73 N ATOM 662 CZ ARG A 316 13.138 -17.351 -3.082 1.00 45.25 C ATOM 663 NH1 ARG A 316 12.219 -18.089 -3.688 1.00 44.74 N ATOM 664 NH2 ARG A 316 13.015 -17.074 -1.790 1.00 45.55 N ATOM 665 HE ARG A 316 14.869 -16.296 -3.267 1.00 0.00 H ATOM 666 HH12 ARG A 316 11.409 -18.457 -3.149 1.00 0.00 H ATOM 667 HH11 ARG A 316 12.307 -18.300 -4.703 1.00 0.00 H ATOM 668 HH22 ARG A 316 12.204 -17.444 -1.254 1.00 0.00 H ATOM 669 HH21 ARG A 316 13.729 -16.487 -1.314 1.00 0.00 H ATOM 670 H ARG A 316 12.986 -12.493 -5.341 1.00 0.00 H ATOM 671 N SER A 317 13.163 -13.495 -8.535 1.00 34.44 N ATOM 672 CA SER A 317 12.785 -13.921 -9.875 1.00 42.04 C ATOM 673 C SER A 317 12.955 -12.824 -10.919 1.00 44.01 C ATOM 674 O SER A 317 12.493 -12.990 -12.053 1.00 47.67 O ATOM 675 CB SER A 317 11.338 -14.420 -9.876 1.00 40.60 C ATOM 676 OG SER A 317 11.155 -15.465 -8.939 1.00 34.37 O ATOM 677 HG SER A 317 11.375 -15.135 -8.032 1.00 0.00 H ATOM 678 H SER A 317 12.532 -12.849 -8.019 1.00 0.00 H ATOM 679 N ILE A 318 13.604 -11.710 -10.572 1.00 44.01 N ATOM 680 CA ILE A 318 13.740 -10.617 -11.531 1.00 49.94 C ATOM 681 C ILE A 318 14.493 -11.076 -12.771 1.00 54.04 C ATOM 682 O ILE A 318 14.232 -10.593 -13.880 1.00 57.36 O ATOM 683 CB ILE A 318 14.421 -9.399 -10.874 1.00 51.55 C ATOM 684 CG1 ILE A 318 15.806 -9.771 -10.344 1.00 53.67 C ATOM 685 CG2 ILE A 318 13.554 -8.841 -9.757 1.00 52.12 C ATOM 686 CD1 ILE A 318 16.542 -8.608 -9.712 1.00 53.15 C ATOM 687 H ILE A 318 14.012 -11.621 -9.620 1.00 0.00 H ATOM 688 N ALA A 319 15.427 -12.014 -12.614 1.00 54.95 N ATOM 689 CA ALA A 319 16.176 -12.539 -13.748 1.00 57.35 C ATOM 690 C ALA A 319 15.424 -13.622 -14.508 1.00 56.46 C ATOM 691 O ALA A 319 15.863 -14.009 -15.596 1.00 61.16 O ATOM 692 CB ALA A 319 17.526 -13.088 -13.279 1.00 59.82 C ATOM 693 H ALA A 319 15.625 -12.379 -11.661 1.00 0.00 H ATOM 694 N VAL A 320 14.314 -14.116 -13.970 1.00 53.20 N ATOM 695 CA VAL A 320 13.554 -15.176 -14.619 1.00 50.06 C ATOM 696 C VAL A 320 12.619 -14.570 -15.657 1.00 51.75 C ATOM 697 O VAL A 320 12.098 -13.461 -15.489 1.00 54.68 O ATOM 698 CB VAL A 320 12.780 -16.005 -13.575 1.00 45.85 C ATOM 699 CG1 VAL A 320 11.997 -17.118 -14.253 1.00 43.81 C ATOM 700 CG2 VAL A 320 13.736 -16.571 -12.537 1.00 42.14 C ATOM 701 H VAL A 320 13.979 -13.736 -13.062 1.00 0.00 H ATOM 702 N LYS A 321 12.403 -15.310 -16.742 1.00 54.78 N ATOM 703 CA LYS A 321 11.571 -14.869 -17.857 1.00 54.70 C ATOM 704 C LYS A 321 10.167 -15.440 -17.681 1.00 48.17 C ATOM 705 O LYS A 321 9.956 -16.647 -17.840 1.00 49.71 O ATOM 706 CB LYS A 321 12.186 -15.308 -19.185 1.00 63.89 C ATOM 707 CG LYS A 321 11.258 -15.202 -20.387 1.00 72.24 C ATOM 708 CD LYS A 321 10.851 -13.764 -20.668 1.00 75.78 C ATOM 709 CE LYS A 321 9.994 -13.673 -21.923 1.00 80.37 C ATOM 710 NZ LYS A 321 9.554 -12.278 -22.202 1.00 82.12 N ATOM 711 HZ1 LYS A 321 8.993 -11.926 -21.400 1.00 0.00 H ATOM 712 HZ2 LYS A 321 10.389 -11.672 -22.335 1.00 0.00 H ATOM 713 HZ3 LYS A 321 8.974 -12.265 -23.065 1.00 0.00 H ATOM 714 H LYS A 321 12.849 -16.248 -16.798 1.00 0.00 H ATOM 715 N ASP A 322 9.213 -14.572 -17.350 1.00 44.75 N ATOM 716 CA ASP A 322 7.808 -14.956 -17.207 1.00 44.13 C ATOM 717 C ASP A 322 7.649 -16.146 -16.264 1.00 44.63 C ATOM 718 O ASP A 322 6.927 -17.105 -16.544 1.00 46.72 O ATOM 719 CB ASP A 322 7.187 -15.255 -18.572 1.00 45.72 C ATOM 720 CG ASP A 322 7.024 -14.014 -19.423 1.00 52.38 C ATOM 721 OD1 ASP A 322 7.439 -14.040 -20.601 1.00 48.31 O ATOM 722 OD2 ASP A 322 6.477 -13.012 -18.915 1.00 60.48 O ATOM 723 H ASP A 322 9.477 -13.580 -17.186 1.00 0.00 H ATOM 724 N GLY A 323 8.330 -16.076 -15.124 1.00 41.89 N ATOM 725 CA GLY A 323 8.292 -17.185 -14.189 1.00 42.41 C ATOM 726 C GLY A 323 8.731 -16.767 -12.805 1.00 42.69 C ATOM 727 O GLY A 323 9.250 -15.669 -12.590 1.00 43.12 O ATOM 728 H GLY A 323 8.889 -15.227 -14.903 1.00 0.00 H ATOM 729 N ILE A 324 8.510 -17.677 -11.861 1.00 44.26 N ATOM 730 CA ILE A 324 8.859 -17.481 -10.461 1.00 44.94 C ATOM 731 C ILE A 324 9.891 -18.527 -10.071 1.00 46.57 C ATOM 732 O ILE A 324 9.824 -19.676 -10.522 1.00 52.79 O ATOM 733 CB ILE A 324 7.617 -17.570 -9.549 1.00 47.57 C ATOM 734 CG1 ILE A 324 6.709 -16.361 -9.773 1.00 48.00 C ATOM 735 CG2 ILE A 324 8.029 -17.677 -8.090 1.00 51.28 C ATOM 736 CD1 ILE A 324 7.403 -15.034 -9.563 1.00 47.41 C ATOM 737 H ILE A 324 8.065 -18.575 -12.137 1.00 0.00 H ATOM 738 N LEU A 325 10.848 -18.126 -9.243 1.00 40.07 N ATOM 739 CA LEU A 325 11.879 -19.022 -8.728 1.00 41.14 C ATOM 740 C LEU A 325 11.559 -19.301 -7.265 1.00 42.76 C ATOM 741 O LEU A 325 11.777 -18.449 -6.399 1.00 44.82 O ATOM 742 CB LEU A 325 13.267 -18.414 -8.894 1.00 43.34 C ATOM 743 CG LEU A 325 14.424 -19.247 -8.339 1.00 46.53 C ATOM 744 CD1 LEU A 325 14.420 -20.645 -8.943 1.00 45.16 C ATOM 745 CD2 LEU A 325 15.754 -18.554 -8.591 1.00 49.37 C ATOM 746 H LEU A 325 10.864 -17.129 -8.948 1.00 0.00 H ATOM 747 N LEU A 326 11.035 -20.491 -6.994 1.00 42.03 N ATOM 748 CA LEU A 326 10.669 -20.845 -5.632 1.00 41.63 C ATOM 749 C LEU A 326 11.914 -21.102 -4.790 1.00 43.05 C ATOM 750 O LEU A 326 12.983 -21.444 -5.303 1.00 42.51 O ATOM 751 CB LEU A 326 9.767 -22.078 -5.622 1.00 40.18 C ATOM 752 CG LEU A 326 8.421 -21.925 -6.335 1.00 39.90 C ATOM 753 CD1 LEU A 326 7.607 -23.205 -6.223 1.00 33.04 C ATOM 754 CD2 LEU A 326 7.647 -20.740 -5.779 1.00 30.66 C ATOM 755 H LEU A 326 10.885 -21.175 -7.763 1.00 0.00 H ATOM 756 N ALA A 327 11.764 -20.931 -3.474 1.00 45.32 N ATOM 757 CA ALA A 327 12.881 -21.155 -2.565 1.00 46.93 C ATOM 758 C ALA A 327 13.368 -22.596 -2.600 1.00 48.52 C ATOM 759 O ALA A 327 14.492 -22.871 -2.166 1.00 46.78 O ATOM 760 CB ALA A 327 12.482 -20.770 -1.140 1.00 46.38 C ATOM 761 H ALA A 327 10.842 -20.635 -3.094 1.00 0.00 H ATOM 762 N THR A 328 12.550 -23.517 -3.102 1.00 51.36 N ATOM 763 CA THR A 328 12.931 -24.916 -3.233 1.00 53.36 C ATOM 764 C THR A 328 13.784 -25.186 -4.466 1.00 55.75 C ATOM 765 O THR A 328 14.193 -26.333 -4.677 1.00 58.60 O ATOM 766 CB THR A 328 11.678 -25.795 -3.273 1.00 53.66 C ATOM 767 OG1 THR A 328 10.844 -25.389 -4.366 1.00 51.70 O ATOM 768 CG2 THR A 328 10.896 -25.664 -1.975 1.00 52.05 C ATOM 769 HG1 THR A 328 10.034 -25.958 -4.391 1.00 0.00 H ATOM 770 H THR A 328 11.601 -23.226 -3.413 1.00 0.00 H ATOM 771 N GLY A 329 14.064 -24.167 -5.276 1.00 54.70 N ATOM 772 CA GLY A 329 14.840 -24.336 -6.484 1.00 55.25 C ATOM 773 C GLY A 329 14.035 -24.643 -7.725 1.00 53.84 C ATOM 774 O GLY A 329 14.622 -24.778 -8.806 1.00 55.50 O ATOM 775 H GLY A 329 13.713 -23.219 -5.032 1.00 0.00 H ATOM 776 N LEU A 330 12.715 -24.759 -7.611 1.00 52.24 N ATOM 777 CA LEU A 330 11.864 -25.063 -8.750 1.00 55.74 C ATOM 778 C LEU A 330 11.418 -23.781 -9.439 1.00 53.57 C ATOM 779 O LEU A 330 11.030 -22.810 -8.782 1.00 50.88 O ATOM 780 CB LEU A 330 10.642 -25.869 -8.311 1.00 58.62 C ATOM 781 CG LEU A 330 9.567 -26.059 -9.383 1.00 65.23 C ATOM 782 CD1 LEU A 330 10.117 -26.840 -10.567 1.00 69.90 C ATOM 783 CD2 LEU A 330 8.342 -26.746 -8.800 1.00 67.00 C ATOM 784 H LEU A 330 12.277 -24.628 -6.677 1.00 0.00 H ATOM 785 N HIS A 331 11.475 -23.787 -10.768 1.00 53.02 N ATOM 786 CA HIS A 331 11.011 -22.664 -11.572 1.00 53.29 C ATOM 787 C HIS A 331 9.562 -22.906 -11.978 1.00 54.57 C ATOM 788 O HIS A 331 9.256 -23.908 -12.635 1.00 57.99 O ATOM 789 CB HIS A 331 11.885 -22.477 -12.811 1.00 53.44 C ATOM 790 CG HIS A 331 13.288 -22.056 -12.506 1.00 58.68 C ATOM 791 ND1 HIS A 331 14.269 -22.947 -12.127 1.00 62.93 N ATOM 792 CD2 HIS A 331 13.877 -20.836 -12.531 1.00 58.84 C ATOM 793 CE1 HIS A 331 15.401 -22.295 -11.929 1.00 62.94 C ATOM 794 NE2 HIS A 331 15.190 -21.013 -12.167 1.00 62.09 N ATOM 795 H HIS A 331 11.864 -24.622 -11.250 1.00 0.00 H ATOM 796 N VAL A 332 8.678 -21.995 -11.589 1.00 48.66 N ATOM 797 CA VAL A 332 7.271 -22.051 -11.965 1.00 46.04 C ATOM 798 C VAL A 332 7.050 -21.015 -13.059 1.00 46.44 C ATOM 799 O VAL A 332 7.183 -19.809 -12.824 1.00 44.88 O ATOM 800 CB VAL A 332 6.350 -21.807 -10.764 1.00 44.60 C ATOM 801 CG1 VAL A 332 4.893 -21.823 -11.205 1.00 40.05 C ATOM 802 CG2 VAL A 332 6.601 -22.854 -9.689 1.00 48.99 C ATOM 803 H VAL A 332 9.003 -21.209 -10.991 1.00 0.00 H ATOM 804 N HIS A 333 6.721 -21.483 -14.257 1.00 46.99 N ATOM 805 CA HIS A 333 6.459 -20.604 -15.385 1.00 47.49 C ATOM 806 C HIS A 333 4.987 -20.212 -15.413 1.00 44.10 C ATOM 807 O HIS A 333 4.118 -20.948 -14.937 1.00 40.51 O ATOM 808 CB HIS A 333 6.855 -21.283 -16.698 1.00 49.58 C ATOM 809 CG HIS A 333 6.714 -20.402 -17.900 1.00 50.42 C ATOM 810 ND1 HIS A 333 5.645 -20.490 -18.765 1.00 51.63 N ATOM 811 CD2 HIS A 333 7.506 -19.414 -18.380 1.00 50.48 C ATOM 812 CE1 HIS A 333 5.784 -19.595 -19.726 1.00 51.03 C ATOM 813 NE2 HIS A 333 6.905 -18.929 -19.516 1.00 51.65 N ATOM 814 H HIS A 333 6.648 -22.512 -14.393 1.00 0.00 H ATOM 815 N ARG A 334 4.713 -19.031 -15.974 1.00 44.00 N ATOM 816 CA ARG A 334 3.348 -18.515 -15.969 1.00 46.49 C ATOM 817 C ARG A 334 2.383 -19.458 -16.674 1.00 49.25 C ATOM 818 O ARG A 334 1.195 -19.497 -16.332 1.00 49.96 O ATOM 819 CB ARG A 334 3.303 -17.129 -16.613 1.00 50.82 C ATOM 820 CG ARG A 334 3.763 -17.096 -18.058 1.00 58.19 C ATOM 821 CD ARG A 334 3.410 -15.772 -18.714 1.00 64.32 C ATOM 822 NE ARG A 334 1.972 -15.521 -18.685 1.00 68.16 N ATOM 823 CZ ARG A 334 1.365 -14.568 -19.386 1.00 73.61 C ATOM 824 NH1 ARG A 334 2.071 -13.774 -20.179 1.00 78.84 N ATOM 825 NH2 ARG A 334 0.051 -14.412 -19.298 1.00 73.14 N ATOM 826 HE ARG A 334 1.385 -16.127 -18.077 1.00 0.00 H ATOM 827 HH12 ARG A 334 1.595 -13.029 -20.727 1.00 0.00 H ATOM 828 HH11 ARG A 334 3.101 -13.896 -20.253 1.00 0.00 H ATOM 829 HH22 ARG A 334 -0.422 -13.666 -19.847 1.00 0.00 H ATOM 830 HH21 ARG A 334 -0.506 -15.036 -18.680 1.00 0.00 H ATOM 831 H ARG A 334 5.475 -18.478 -16.416 1.00 0.00 H ATOM 832 N ASN A 335 2.863 -20.222 -17.656 1.00 51.47 N ATOM 833 CA ASN A 335 2.002 -21.207 -18.303 1.00 54.64 C ATOM 834 C ASN A 335 1.614 -22.313 -17.331 1.00 53.83 C ATOM 835 O ASN A 335 0.444 -22.707 -17.258 1.00 54.05 O ATOM 836 CB ASN A 335 2.696 -21.788 -19.535 1.00 58.71 C ATOM 837 CG ASN A 335 2.739 -20.812 -20.689 1.00 66.18 C ATOM 838 OD1 ASN A 335 1.912 -19.904 -20.779 1.00 70.03 O ATOM 839 ND2 ASN A 335 3.703 -20.995 -21.583 1.00 68.84 N ATOM 840 HD22 ASN A 335 4.380 -21.776 -21.466 1.00 0.00 H ATOM 841 HD21 ASN A 335 3.782 -20.357 -22.401 1.00 0.00 H ATOM 842 H ASN A 335 3.852 -20.116 -17.961 1.00 0.00 H ATOM 843 N SER A 336 2.586 -22.827 -16.575 1.00 51.66 N ATOM 844 CA SER A 336 2.280 -23.842 -15.574 1.00 47.29 C ATOM 845 C SER A 336 1.317 -23.301 -14.524 1.00 43.28 C ATOM 846 O SER A 336 0.373 -23.991 -14.121 1.00 41.64 O ATOM 847 CB SER A 336 3.570 -24.339 -14.922 1.00 48.56 C ATOM 848 OG SER A 336 3.304 -25.358 -13.975 1.00 51.57 O ATOM 849 HG SER A 336 4.155 -25.660 -13.569 1.00 0.00 H ATOM 850 H SER A 336 3.566 -22.502 -16.700 1.00 0.00 H ATOM 851 N ALA A 337 1.536 -22.063 -14.074 1.00 38.95 N ATOM 852 CA ALA A 337 0.631 -21.465 -13.099 1.00 39.10 C ATOM 853 C ALA A 337 -0.764 -21.282 -13.682 1.00 42.43 C ATOM 854 O ALA A 337 -1.767 -21.509 -12.997 1.00 45.74 O ATOM 855 CB ALA A 337 1.190 -20.129 -12.612 1.00 37.18 C ATOM 856 H ALA A 337 2.355 -21.523 -14.420 1.00 0.00 H ATOM 857 N HIS A 338 -0.848 -20.867 -14.948 1.00 41.01 N ATOM 858 CA HIS A 338 -2.153 -20.723 -15.584 1.00 40.61 C ATOM 859 C HIS A 338 -2.833 -22.076 -15.751 1.00 40.88 C ATOM 860 O HIS A 338 -4.050 -22.192 -15.569 1.00 41.49 O ATOM 861 CB HIS A 338 -2.004 -20.021 -16.933 1.00 43.49 C ATOM 862 CG HIS A 338 -3.279 -19.935 -17.713 1.00 49.52 C ATOM 863 ND1 HIS A 338 -4.304 -19.078 -17.375 1.00 50.63 N ATOM 864 CD2 HIS A 338 -3.696 -20.604 -18.815 1.00 52.15 C ATOM 865 CE1 HIS A 338 -5.296 -19.221 -18.236 1.00 51.66 C ATOM 866 NE2 HIS A 338 -4.953 -20.141 -19.119 1.00 52.46 N ATOM 867 H HIS A 338 0.017 -20.646 -15.481 1.00 0.00 H ATOM 868 N SER A 339 -2.063 -23.112 -16.092 1.00 41.79 N ATOM 869 CA SER A 339 -2.626 -24.451 -16.220 1.00 46.38 C ATOM 870 C SER A 339 -3.067 -25.023 -14.880 1.00 49.68 C ATOM 871 O SER A 339 -3.800 -26.017 -14.857 1.00 52.65 O ATOM 872 CB SER A 339 -1.612 -25.389 -16.874 1.00 51.19 C ATOM 873 OG SER A 339 -1.241 -24.922 -18.158 1.00 57.56 O ATOM 874 HG SER A 339 -0.835 -24.023 -18.076 1.00 0.00 H ATOM 875 H SER A 339 -1.049 -22.962 -16.269 1.00 0.00 H ATOM 876 N ALA A 340 -2.634 -24.430 -13.771 1.00 45.47 N ATOM 877 CA ALA A 340 -3.035 -24.872 -12.443 1.00 41.82 C ATOM 878 C ALA A 340 -4.233 -24.105 -11.903 1.00 40.87 C ATOM 879 O ALA A 340 -4.713 -24.425 -10.811 1.00 44.08 O ATOM 880 CB ALA A 340 -1.861 -24.746 -11.467 1.00 40.55 C ATOM 881 H ALA A 340 -1.986 -23.621 -13.856 1.00 0.00 H ATOM 882 N GLY A 341 -4.723 -23.108 -12.632 1.00 36.99 N ATOM 883 CA GLY A 341 -5.859 -22.328 -12.193 1.00 36.87 C ATOM 884 C GLY A 341 -5.530 -21.103 -11.372 1.00 36.61 C ATOM 885 O GLY A 341 -6.453 -20.443 -10.883 1.00 38.96 O ATOM 886 H GLY A 341 -4.277 -22.882 -13.544 1.00 0.00 H ATOM 887 N VAL A 342 -4.250 -20.773 -11.206 1.00 31.33 N ATOM 888 CA VAL A 342 -3.851 -19.611 -10.419 1.00 31.03 C ATOM 889 C VAL A 342 -3.119 -18.620 -11.314 1.00 33.55 C ATOM 890 O VAL A 342 -2.171 -17.957 -10.880 1.00 35.15 O ATOM 891 CB VAL A 342 -2.976 -20.023 -9.221 1.00 30.53 C ATOM 892 CG1 VAL A 342 -3.752 -20.938 -8.286 1.00 27.51 C ATOM 893 CG2 VAL A 342 -1.703 -20.700 -9.703 1.00 28.38 C ATOM 894 H VAL A 342 -3.515 -21.360 -11.650 1.00 0.00 H ATOM 895 N GLY A 343 -3.561 -18.506 -12.568 1.00 33.36 N ATOM 896 CA GLY A 343 -2.872 -17.643 -13.511 1.00 33.78 C ATOM 897 C GLY A 343 -3.087 -16.165 -13.257 1.00 36.01 C ATOM 898 O GLY A 343 -2.200 -15.351 -13.532 1.00 37.99 O ATOM 899 H GLY A 343 -4.402 -19.037 -12.871 1.00 0.00 H ATOM 900 N ALA A 344 -4.256 -15.793 -12.733 1.00 36.22 N ATOM 901 CA ALA A 344 -4.555 -14.383 -12.505 1.00 33.95 C ATOM 902 C ALA A 344 -3.606 -13.779 -11.476 1.00 34.30 C ATOM 903 O ALA A 344 -2.921 -12.786 -11.748 1.00 34.98 O ATOM 904 CB ALA A 344 -6.010 -14.220 -12.063 1.00 26.78 C ATOM 905 H ALA A 344 -4.962 -16.515 -12.484 1.00 0.00 H ATOM 906 N ILE A 345 -3.554 -14.367 -10.280 1.00 34.19 N ATOM 907 CA ILE A 345 -2.691 -13.827 -9.235 1.00 34.12 C ATOM 908 C ILE A 345 -1.225 -13.979 -9.621 1.00 34.04 C ATOM 909 O ILE A 345 -0.398 -13.107 -9.329 1.00 32.12 O ATOM 910 CB ILE A 345 -2.999 -14.500 -7.885 1.00 34.05 C ATOM 911 CG1 ILE A 345 -2.156 -13.874 -6.771 1.00 34.07 C ATOM 912 CG2 ILE A 345 -2.758 -16.002 -7.967 1.00 35.02 C ATOM 913 CD1 ILE A 345 -2.385 -12.387 -6.594 1.00 22.68 C ATOM 914 H ILE A 345 -4.130 -15.212 -10.092 1.00 0.00 H ATOM 915 N PHE A 346 -0.879 -15.086 -10.283 1.00 33.93 N ATOM 916 CA PHE A 346 0.490 -15.266 -10.753 1.00 34.23 C ATOM 917 C PHE A 346 0.887 -14.155 -11.717 1.00 36.29 C ATOM 918 O PHE A 346 2.008 -13.636 -11.651 1.00 36.64 O ATOM 919 CB PHE A 346 0.638 -16.637 -11.415 1.00 34.89 C ATOM 920 CG PHE A 346 2.054 -16.991 -11.781 1.00 34.11 C ATOM 921 CD1 PHE A 346 2.622 -16.515 -12.950 1.00 35.80 C ATOM 922 CD2 PHE A 346 2.809 -17.814 -10.963 1.00 36.65 C ATOM 923 CE1 PHE A 346 3.921 -16.843 -13.292 1.00 36.51 C ATOM 924 CE2 PHE A 346 4.109 -18.149 -11.301 1.00 39.36 C ATOM 925 CZ PHE A 346 4.665 -17.662 -12.468 1.00 37.03 C ATOM 926 H PHE A 346 -1.589 -15.824 -10.464 1.00 0.00 H ATOM 927 N ASP A 347 -0.019 -13.776 -12.621 1.00 34.83 N ATOM 928 CA ASP A 347 0.271 -12.671 -13.528 1.00 32.73 C ATOM 929 C ASP A 347 0.431 -11.361 -12.765 1.00 29.68 C ATOM 930 O ASP A 347 1.316 -10.557 -13.080 1.00 33.40 O ATOM 931 CB ASP A 347 -0.826 -12.551 -14.589 1.00 35.06 C ATOM 932 CG ASP A 347 -0.617 -13.502 -15.757 1.00 40.02 C ATOM 933 OD1 ASP A 347 0.537 -13.922 -15.983 1.00 42.47 O ATOM 934 OD2 ASP A 347 -1.604 -13.822 -16.454 1.00 41.57 O ATOM 935 H ASP A 347 -0.933 -14.269 -12.679 1.00 0.00 H ATOM 936 N ARG A 348 -0.417 -11.128 -11.759 1.00 27.77 N ATOM 937 CA ARG A 348 -0.294 -9.915 -10.955 1.00 25.31 C ATOM 938 C ARG A 348 1.085 -9.814 -10.318 1.00 26.91 C ATOM 939 O ARG A 348 1.665 -8.724 -10.243 1.00 27.77 O ATOM 940 CB ARG A 348 -1.377 -9.880 -9.877 1.00 28.06 C ATOM 941 CG ARG A 348 -2.782 -9.614 -10.390 1.00 27.91 C ATOM 942 CD ARG A 348 -3.681 -9.164 -9.251 1.00 28.07 C ATOM 943 NE ARG A 348 -3.157 -7.964 -8.603 1.00 29.29 N ATOM 944 CZ ARG A 348 -3.570 -7.504 -7.427 1.00 28.84 C ATOM 945 NH1 ARG A 348 -4.516 -8.146 -6.754 1.00 28.14 N ATOM 946 NH2 ARG A 348 -3.032 -6.403 -6.919 1.00 26.25 N ATOM 947 HE ARG A 348 -2.410 -7.434 -9.096 1.00 0.00 H ATOM 948 HH12 ARG A 348 -4.837 -7.783 -5.834 1.00 0.00 H ATOM 949 HH11 ARG A 348 -4.937 -9.012 -7.147 1.00 0.00 H ATOM 950 HH22 ARG A 348 -3.355 -6.043 -5.998 1.00 0.00 H ATOM 951 HH21 ARG A 348 -2.287 -5.900 -7.441 1.00 0.00 H ATOM 952 H ARG A 348 -1.169 -11.814 -11.547 1.00 0.00 H ATOM 953 N VAL A 349 1.624 -10.939 -9.844 1.00 26.11 N ATOM 954 CA VAL A 349 2.950 -10.928 -9.234 1.00 27.00 C ATOM 955 C VAL A 349 4.002 -10.525 -10.259 1.00 33.30 C ATOM 956 O VAL A 349 4.920 -9.752 -9.959 1.00 35.68 O ATOM 957 CB VAL A 349 3.262 -12.301 -8.609 1.00 26.16 C ATOM 958 CG1 VAL A 349 4.741 -12.413 -8.287 1.00 30.45 C ATOM 959 CG2 VAL A 349 2.428 -12.512 -7.355 1.00 24.10 C ATOM 960 H VAL A 349 1.094 -11.832 -9.910 1.00 0.00 H ATOM 961 N LEU A 350 3.878 -11.030 -11.488 1.00 35.17 N ATOM 962 CA LEU A 350 4.854 -10.718 -12.527 1.00 33.56 C ATOM 963 C LEU A 350 4.782 -9.251 -12.933 1.00 35.04 C ATOM 964 O LEU A 350 5.801 -8.549 -12.946 1.00 38.76 O ATOM 965 CB LEU A 350 4.633 -11.621 -13.741 1.00 40.60 C ATOM 966 CG LEU A 350 5.011 -13.096 -13.599 1.00 44.54 C ATOM 967 CD1 LEU A 350 4.671 -13.860 -14.872 1.00 41.82 C ATOM 968 CD2 LEU A 350 6.487 -13.232 -13.265 1.00 46.77 C ATOM 969 H LEU A 350 3.076 -11.654 -11.708 1.00 0.00 H ATOM 970 N THR A 351 3.585 -8.769 -13.273 1.00 31.59 N ATOM 971 CA THR A 351 3.460 -7.410 -13.789 1.00 33.81 C ATOM 972 C THR A 351 3.682 -6.374 -12.694 1.00 36.29 C ATOM 973 O THR A 351 4.387 -5.381 -12.905 1.00 40.34 O ATOM 974 CB THR A 351 2.088 -7.214 -14.438 1.00 38.86 C ATOM 975 OG1 THR A 351 1.061 -7.337 -13.446 1.00 40.99 O ATOM 976 CG2 THR A 351 1.861 -8.254 -15.522 1.00 40.31 C ATOM 977 HG1 THR A 351 1.105 -8.237 -13.037 1.00 0.00 H ATOM 978 H THR A 351 2.738 -9.364 -13.170 1.00 0.00 H ATOM 979 N GLU A 352 3.100 -6.590 -11.516 1.00 33.38 N ATOM 980 CA GLU A 352 3.122 -5.579 -10.467 1.00 32.01 C ATOM 981 C GLU A 352 4.345 -5.659 -9.563 1.00 33.87 C ATOM 982 O GLU A 352 4.682 -4.657 -8.920 1.00 36.19 O ATOM 983 CB GLU A 352 1.854 -5.682 -9.615 1.00 30.01 C ATOM 984 CG GLU A 352 0.585 -5.271 -10.347 1.00 32.19 C ATOM 985 CD GLU A 352 -0.670 -5.601 -9.564 1.00 38.45 C ATOM 986 OE1 GLU A 352 -1.552 -6.295 -10.116 1.00 39.68 O ATOM 987 OE2 GLU A 352 -0.772 -5.175 -8.393 1.00 38.14 O ATOM 988 H GLU A 352 2.621 -7.497 -11.342 1.00 0.00 H ATOM 989 N LEU A 353 5.021 -6.807 -9.494 1.00 34.35 N ATOM 990 CA LEU A 353 6.148 -6.965 -8.577 1.00 33.41 C ATOM 991 C LEU A 353 7.432 -7.309 -9.317 1.00 35.96 C ATOM 992 O LEU A 353 8.342 -6.477 -9.374 1.00 35.44 O ATOM 993 CB LEU A 353 5.818 -8.018 -7.519 1.00 30.89 C ATOM 994 CG LEU A 353 4.607 -7.707 -6.636 1.00 27.67 C ATOM 995 CD1 LEU A 353 4.455 -8.758 -5.548 1.00 24.43 C ATOM 996 CD2 LEU A 353 4.716 -6.313 -6.032 1.00 26.91 C ATOM 997 H LEU A 353 4.741 -7.603 -10.103 1.00 0.00 H ATOM 998 N VAL A 354 7.541 -8.513 -9.882 1.00 36.98 N ATOM 999 CA VAL A 354 8.804 -8.954 -10.472 1.00 34.89 C ATOM 1000 C VAL A 354 9.267 -7.969 -11.538 1.00 36.25 C ATOM 1001 O VAL A 354 10.395 -7.464 -11.495 1.00 41.57 O ATOM 1002 CB VAL A 354 8.663 -10.378 -11.040 1.00 37.15 C ATOM 1003 CG1 VAL A 354 9.970 -10.832 -11.675 1.00 40.39 C ATOM 1004 CG2 VAL A 354 8.232 -11.347 -9.947 1.00 31.52 C ATOM 1005 H VAL A 354 6.716 -9.146 -9.903 1.00 0.00 H ATOM 1006 N SER A 355 8.400 -7.675 -12.507 1.00 35.75 N ATOM 1007 CA SER A 355 8.791 -6.794 -13.602 1.00 39.20 C ATOM 1008 C SER A 355 9.152 -5.404 -13.095 1.00 38.77 C ATOM 1009 O SER A 355 10.146 -4.813 -13.535 1.00 34.62 O ATOM 1010 CB SER A 355 7.669 -6.718 -14.635 1.00 42.99 C ATOM 1011 OG SER A 355 7.439 -7.989 -15.217 1.00 51.23 O ATOM 1012 HG SER A 355 7.182 -8.633 -14.510 1.00 0.00 H ATOM 1013 H SER A 355 7.441 -8.076 -12.482 1.00 0.00 H ATOM 1014 N LYS A 356 8.354 -4.862 -12.173 1.00 35.72 N ATOM 1015 CA LYS A 356 8.669 -3.553 -11.611 1.00 37.41 C ATOM 1016 C LYS A 356 10.022 -3.567 -10.912 1.00 38.07 C ATOM 1017 O LYS A 356 10.806 -2.619 -11.039 1.00 36.32 O ATOM 1018 CB LYS A 356 7.564 -3.119 -10.649 1.00 39.56 C ATOM 1019 CG LYS A 356 6.213 -2.915 -11.319 1.00 42.09 C ATOM 1020 CD LYS A 356 6.299 -1.848 -12.399 1.00 46.96 C ATOM 1021 CE LYS A 356 4.942 -1.574 -13.033 1.00 49.00 C ATOM 1022 NZ LYS A 356 3.972 -0.995 -12.059 1.00 45.70 N ATOM 1023 HZ1 LYS A 356 3.833 -1.661 -11.272 1.00 0.00 H ATOM 1024 HZ2 LYS A 356 4.345 -0.096 -11.692 1.00 0.00 H ATOM 1025 HZ3 LYS A 356 3.063 -0.826 -12.536 1.00 0.00 H ATOM 1026 H LYS A 356 7.506 -5.373 -11.855 1.00 0.00 H ATOM 1027 N MET A 357 10.317 -4.638 -10.170 1.00 37.75 N ATOM 1028 CA MET A 357 11.631 -4.763 -9.548 1.00 37.85 C ATOM 1029 C MET A 357 12.729 -4.846 -10.600 1.00 40.27 C ATOM 1030 O MET A 357 13.784 -4.217 -10.460 1.00 43.17 O ATOM 1031 CB MET A 357 11.671 -5.993 -8.640 1.00 33.96 C ATOM 1032 CG MET A 357 10.785 -5.902 -7.410 1.00 34.80 C ATOM 1033 SD MET A 357 10.735 -7.459 -6.496 1.00 36.83 S ATOM 1034 CE MET A 357 9.873 -6.958 -5.010 1.00 28.81 C ATOM 1035 H MET A 357 9.607 -5.386 -10.035 1.00 0.00 H ATOM 1036 N ARG A 358 12.493 -5.619 -11.663 1.00 41.61 N ATOM 1037 CA ARG A 358 13.499 -5.777 -12.708 1.00 46.24 C ATOM 1038 C ARG A 358 13.764 -4.461 -13.429 1.00 45.02 C ATOM 1039 O ARG A 358 14.921 -4.111 -13.693 1.00 47.73 O ATOM 1040 CB ARG A 358 13.050 -6.846 -13.704 1.00 43.75 C ATOM 1041 CG ARG A 358 14.038 -7.098 -14.828 1.00 46.87 C ATOM 1042 CD ARG A 358 13.391 -7.835 -15.992 1.00 46.54 C ATOM 1043 NE ARG A 358 12.420 -7.003 -16.699 1.00 46.97 N ATOM 1044 CZ ARG A 358 11.101 -7.128 -16.588 1.00 45.13 C ATOM 1045 NH1 ARG A 358 10.299 -6.323 -17.271 1.00 39.28 N ATOM 1046 NH2 ARG A 358 10.584 -8.061 -15.800 1.00 44.62 N ATOM 1047 HE ARG A 358 12.785 -6.263 -17.332 1.00 0.00 H ATOM 1048 HH12 ARG A 358 9.267 -6.421 -17.184 1.00 0.00 H ATOM 1049 HH11 ARG A 358 10.702 -5.594 -17.894 1.00 0.00 H ATOM 1050 HH22 ARG A 358 9.552 -8.156 -15.715 1.00 0.00 H ATOM 1051 HH21 ARG A 358 11.211 -8.697 -15.267 1.00 0.00 H ATOM 1052 H ARG A 358 11.582 -6.114 -11.747 1.00 0.00 H ATOM 1053 N ASP A 359 12.704 -3.720 -13.758 1.00 45.39 N ATOM 1054 CA ASP A 359 12.868 -2.491 -14.529 1.00 49.79 C ATOM 1055 C ASP A 359 13.722 -1.471 -13.787 1.00 48.56 C ATOM 1056 O ASP A 359 14.557 -0.792 -14.396 1.00 50.26 O ATOM 1057 CB ASP A 359 11.501 -1.898 -14.872 1.00 54.57 C ATOM 1058 CG ASP A 359 10.713 -2.764 -15.839 1.00 59.57 C ATOM 1059 OD1 ASP A 359 11.339 -3.518 -16.613 1.00 57.92 O ATOM 1060 OD2 ASP A 359 9.466 -2.687 -15.826 1.00 63.32 O ATOM 1061 H ASP A 359 11.753 -4.020 -13.463 1.00 0.00 H ATOM 1062 N MET A 360 13.533 -1.345 -12.476 1.00 45.20 N ATOM 1063 CA MET A 360 14.271 -0.362 -11.693 1.00 43.91 C ATOM 1064 C MET A 360 15.535 -0.928 -11.059 1.00 43.82 C ATOM 1065 O MET A 360 16.252 -0.187 -10.379 1.00 47.32 O ATOM 1066 CB MET A 360 13.371 0.233 -10.603 1.00 39.93 C ATOM 1067 CG MET A 360 12.982 -0.736 -9.501 1.00 41.26 C ATOM 1068 SD MET A 360 11.994 0.060 -8.217 1.00 42.92 S ATOM 1069 CE MET A 360 13.109 1.359 -7.686 1.00 41.81 C ATOM 1070 H MET A 360 12.844 -1.961 -12.000 1.00 0.00 H ATOM 1071 N GLN A 361 15.830 -2.210 -11.266 1.00 40.24 N ATOM 1072 CA GLN A 361 17.014 -2.844 -10.690 1.00 41.24 C ATOM 1073 C GLN A 361 17.060 -2.648 -9.176 1.00 43.64 C ATOM 1074 O GLN A 361 18.067 -2.222 -8.606 1.00 44.51 O ATOM 1075 CB GLN A 361 18.293 -2.322 -11.347 1.00 43.35 C ATOM 1076 CG GLN A 361 18.426 -2.670 -12.819 1.00 53.91 C ATOM 1077 CD GLN A 361 19.786 -2.300 -13.383 1.00 59.77 C ATOM 1078 OE1 GLN A 361 20.820 -2.746 -12.885 1.00 60.94 O ATOM 1079 NE2 GLN A 361 19.790 -1.477 -14.426 1.00 63.17 N ATOM 1080 HE22 GLN A 361 18.892 -1.125 -14.814 1.00 0.00 H ATOM 1081 HE21 GLN A 361 20.691 -1.185 -14.854 1.00 0.00 H ATOM 1082 H GLN A 361 15.195 -2.781 -11.859 1.00 0.00 H ATOM 1083 N MET A 362 15.944 -2.960 -8.524 1.00 40.59 N ATOM 1084 CA MET A 362 15.882 -2.897 -7.070 1.00 40.08 C ATOM 1085 C MET A 362 16.947 -3.804 -6.465 1.00 43.87 C ATOM 1086 O MET A 362 16.952 -5.015 -6.708 1.00 45.53 O ATOM 1087 CB MET A 362 14.489 -3.306 -6.595 1.00 34.05 C ATOM 1088 CG MET A 362 14.326 -3.357 -5.087 1.00 34.81 C ATOM 1089 SD MET A 362 12.740 -4.067 -4.597 1.00 35.22 S ATOM 1090 CE MET A 362 11.598 -2.870 -5.284 1.00 34.10 C ATOM 1091 H MET A 362 15.103 -3.253 -9.060 1.00 0.00 H ATOM 1092 N ASP A 363 17.853 -3.220 -5.683 1.00 46.55 N ATOM 1093 CA ASP A 363 18.929 -3.997 -5.088 1.00 47.11 C ATOM 1094 C ASP A 363 18.452 -4.681 -3.807 1.00 45.28 C ATOM 1095 O ASP A 363 17.346 -4.444 -3.315 1.00 44.22 O ATOM 1096 CB ASP A 363 20.154 -3.114 -4.823 1.00 45.95 C ATOM 1097 CG ASP A 363 19.894 -2.019 -3.797 1.00 43.05 C ATOM 1098 OD1 ASP A 363 19.229 -2.286 -2.777 1.00 41.81 O ATOM 1099 OD2 ASP A 363 20.373 -0.884 -4.008 1.00 42.20 O ATOM 1100 H ASP A 363 17.791 -2.199 -5.496 1.00 0.00 H ATOM 1101 N LYS A 364 19.313 -5.547 -3.263 1.00 47.10 N ATOM 1102 CA LYS A 364 18.932 -6.333 -2.093 1.00 45.55 C ATOM 1103 C LYS A 364 18.835 -5.475 -0.838 1.00 42.64 C ATOM 1104 O LYS A 364 18.089 -5.818 0.087 1.00 43.29 O ATOM 1105 CB LYS A 364 19.923 -7.477 -1.880 1.00 49.40 C ATOM 1106 CG LYS A 364 19.914 -8.513 -2.992 1.00 52.24 C ATOM 1107 CD LYS A 364 20.937 -9.608 -2.742 1.00 58.55 C ATOM 1108 CE LYS A 364 20.905 -10.652 -3.847 1.00 60.59 C ATOM 1109 NZ LYS A 364 21.955 -11.692 -3.665 1.00 63.77 N ATOM 1110 HZ1 LYS A 364 22.892 -11.241 -3.671 1.00 0.00 H ATOM 1111 HZ2 LYS A 364 21.808 -12.176 -2.756 1.00 0.00 H ATOM 1112 HZ3 LYS A 364 21.896 -12.382 -4.441 1.00 0.00 H ATOM 1113 H LYS A 364 20.261 -5.662 -3.676 1.00 0.00 H ATOM 1114 N THR A 365 19.579 -4.369 -0.779 1.00 42.30 N ATOM 1115 CA THR A 365 19.470 -3.473 0.368 1.00 43.37 C ATOM 1116 C THR A 365 18.100 -2.808 0.415 1.00 42.42 C ATOM 1117 O THR A 365 17.503 -2.676 1.490 1.00 42.11 O ATOM 1118 CB THR A 365 20.577 -2.420 0.321 1.00 44.12 C ATOM 1119 OG1 THR A 365 21.854 -3.061 0.443 1.00 44.45 O ATOM 1120 CG2 THR A 365 20.409 -1.417 1.452 1.00 42.98 C ATOM 1121 HG1 THR A 365 22.569 -2.377 0.412 1.00 0.00 H ATOM 1122 H THR A 365 20.238 -4.145 -1.552 1.00 0.00 H ATOM 1123 N GLU A 366 17.586 -2.386 -0.742 1.00 41.29 N ATOM 1124 CA GLU A 366 16.262 -1.775 -0.785 1.00 42.70 C ATOM 1125 C GLU A 366 15.174 -2.805 -0.511 1.00 42.67 C ATOM 1126 O GLU A 366 14.185 -2.507 0.170 1.00 41.81 O ATOM 1127 CB GLU A 366 16.046 -1.098 -2.140 1.00 40.98 C ATOM 1128 CG GLU A 366 17.215 -0.223 -2.578 1.00 44.54 C ATOM 1129 CD GLU A 366 17.057 0.320 -3.986 1.00 46.69 C ATOM 1130 OE1 GLU A 366 16.847 1.542 -4.134 1.00 48.55 O ATOM 1131 OE2 GLU A 366 17.143 -0.476 -4.946 1.00 47.44 O ATOM 1132 H GLU A 366 18.133 -2.494 -1.620 1.00 0.00 H ATOM 1133 N LEU A 367 15.337 -4.023 -1.032 1.00 40.46 N ATOM 1134 CA LEU A 367 14.382 -5.086 -0.736 1.00 37.61 C ATOM 1135 C LEU A 367 14.323 -5.356 0.761 1.00 39.54 C ATOM 1136 O LEU A 367 13.237 -5.463 1.344 1.00 37.77 O ATOM 1137 CB LEU A 367 14.757 -6.356 -1.499 1.00 37.09 C ATOM 1138 CG LEU A 367 13.908 -7.596 -1.206 1.00 34.02 C ATOM 1139 CD1 LEU A 367 12.475 -7.400 -1.684 1.00 30.81 C ATOM 1140 CD2 LEU A 367 14.529 -8.835 -1.836 1.00 33.38 C ATOM 1141 H LEU A 367 16.149 -4.216 -1.652 1.00 0.00 H ATOM 1142 N GLY A 368 15.488 -5.470 1.402 1.00 37.69 N ATOM 1143 CA GLY A 368 15.511 -5.679 2.840 1.00 33.29 C ATOM 1144 C GLY A 368 14.826 -4.560 3.599 1.00 42.70 C ATOM 1145 O GLY A 368 14.078 -4.808 4.548 1.00 42.54 O ATOM 1146 H GLY A 368 16.381 -5.409 0.872 1.00 0.00 H ATOM 1147 N CYS A 369 15.067 -3.313 3.190 1.00 41.12 N ATOM 1148 CA CYS A 369 14.408 -2.188 3.845 1.00 36.52 C ATOM 1149 C CYS A 369 12.897 -2.264 3.683 1.00 33.83 C ATOM 1150 O CYS A 369 12.149 -2.010 4.635 1.00 35.37 O ATOM 1151 CB CYS A 369 14.944 -0.869 3.295 1.00 35.77 C ATOM 1152 SG CYS A 369 16.591 -0.451 3.884 1.00 40.76 S ATOM 1153 H CYS A 369 15.725 -3.143 2.403 1.00 0.00 H ATOM 1154 N LEU A 370 12.424 -2.613 2.485 1.00 33.19 N ATOM 1155 CA LEU A 370 10.985 -2.744 2.285 1.00 34.16 C ATOM 1156 C LEU A 370 10.414 -3.883 3.120 1.00 33.17 C ATOM 1157 O LEU A 370 9.341 -3.741 3.717 1.00 37.75 O ATOM 1158 CB LEU A 370 10.675 -2.947 0.803 1.00 30.65 C ATOM 1159 CG LEU A 370 10.913 -1.726 -0.088 1.00 32.09 C ATOM 1160 CD1 LEU A 370 10.602 -2.056 -1.536 1.00 30.02 C ATOM 1161 CD2 LEU A 370 10.082 -0.541 0.383 1.00 30.71 C ATOM 1162 H LEU A 370 13.079 -2.791 1.697 1.00 0.00 H ATOM 1163 N ARG A 371 11.117 -5.016 3.181 1.00 32.83 N ATOM 1164 CA ARG A 371 10.641 -6.121 4.007 1.00 37.93 C ATOM 1165 C ARG A 371 10.651 -5.745 5.483 1.00 37.04 C ATOM 1166 O ARG A 371 9.769 -6.162 6.241 1.00 37.71 O ATOM 1167 CB ARG A 371 11.483 -7.371 3.752 1.00 40.31 C ATOM 1168 CG ARG A 371 11.408 -7.857 2.314 1.00 38.69 C ATOM 1169 CD ARG A 371 12.217 -9.125 2.078 1.00 38.45 C ATOM 1170 NE ARG A 371 11.583 -10.312 2.646 1.00 35.53 N ATOM 1171 CZ ARG A 371 12.197 -11.175 3.449 1.00 37.67 C ATOM 1172 NH1 ARG A 371 13.469 -10.990 3.773 1.00 39.00 N ATOM 1173 NH2 ARG A 371 11.543 -12.230 3.918 1.00 37.25 N ATOM 1174 HE ARG A 371 10.587 -10.494 2.407 1.00 0.00 H ATOM 1175 HH12 ARG A 371 13.949 -11.665 4.401 1.00 0.00 H ATOM 1176 HH11 ARG A 371 13.987 -10.169 3.399 1.00 0.00 H ATOM 1177 HH22 ARG A 371 12.026 -12.904 4.546 1.00 0.00 H ATOM 1178 HH21 ARG A 371 10.548 -12.383 3.657 1.00 0.00 H ATOM 1179 H ARG A 371 12.001 -5.111 2.642 1.00 0.00 H ATOM 1180 N ALA A 372 11.636 -4.949 5.910 1.00 35.63 N ATOM 1181 CA ALA A 372 11.637 -4.465 7.286 1.00 35.08 C ATOM 1182 C ALA A 372 10.501 -3.482 7.531 1.00 36.95 C ATOM 1183 O ALA A 372 9.947 -3.441 8.635 1.00 43.14 O ATOM 1184 CB ALA A 372 12.982 -3.819 7.618 1.00 33.41 C ATOM 1185 H ALA A 372 12.401 -4.675 5.262 1.00 0.00 H ATOM 1186 N ILE A 373 10.141 -2.687 6.522 1.00 35.50 N ATOM 1187 CA ILE A 373 9.029 -1.752 6.674 1.00 36.00 C ATOM 1188 C ILE A 373 7.724 -2.511 6.885 1.00 36.01 C ATOM 1189 O ILE A 373 6.942 -2.200 7.790 1.00 31.59 O ATOM 1190 CB ILE A 373 8.950 -0.809 5.460 1.00 37.37 C ATOM 1191 CG1 ILE A 373 10.120 0.180 5.477 1.00 37.39 C ATOM 1192 CG2 ILE A 373 7.616 -0.074 5.435 1.00 35.92 C ATOM 1193 CD1 ILE A 373 10.137 1.137 4.301 1.00 33.78 C ATOM 1194 H ILE A 373 10.656 -2.733 5.620 1.00 0.00 H ATOM 1195 N VAL A 374 7.472 -3.524 6.051 1.00 37.88 N ATOM 1196 CA VAL A 374 6.271 -4.336 6.229 1.00 36.82 C ATOM 1197 C VAL A 374 6.341 -5.120 7.533 1.00 33.24 C ATOM 1198 O VAL A 374 5.311 -5.361 8.175 1.00 36.31 O ATOM 1199 CB VAL A 374 6.064 -5.271 5.022 1.00 34.41 C ATOM 1200 CG1 VAL A 374 6.074 -4.476 3.728 1.00 28.36 C ATOM 1201 CG2 VAL A 374 7.125 -6.356 5.001 1.00 39.97 C ATOM 1202 H VAL A 374 8.131 -3.734 5.275 1.00 0.00 H ATOM 1203 N LEU A 375 7.541 -5.532 7.945 1.00 32.72 N ATOM 1204 CA LEU A 375 7.690 -6.224 9.222 1.00 34.48 C ATOM 1205 C LEU A 375 7.266 -5.327 10.377 1.00 33.03 C ATOM 1206 O LEU A 375 6.546 -5.758 11.284 1.00 35.43 O ATOM 1207 CB LEU A 375 9.137 -6.687 9.401 1.00 37.16 C ATOM 1208 CG LEU A 375 9.489 -7.355 10.734 1.00 34.59 C ATOM 1209 CD1 LEU A 375 8.865 -8.740 10.832 1.00 32.94 C ATOM 1210 CD2 LEU A 375 10.997 -7.425 10.923 1.00 34.39 C ATOM 1211 H LEU A 375 8.377 -5.359 7.352 1.00 0.00 H ATOM 1212 N PHE A 376 7.708 -4.071 10.358 1.00 34.29 N ATOM 1213 CA PHE A 376 7.374 -3.102 11.401 1.00 36.95 C ATOM 1214 C PHE A 376 6.057 -2.397 11.071 1.00 37.50 C ATOM 1215 O PHE A 376 5.989 -1.185 10.873 1.00 37.76 O ATOM 1216 CB PHE A 376 8.513 -2.102 11.574 1.00 41.12 C ATOM 1217 CG PHE A 376 9.750 -2.687 12.198 1.00 44.28 C ATOM 1218 CD1 PHE A 376 9.659 -3.515 13.306 1.00 44.71 C ATOM 1219 CD2 PHE A 376 11.003 -2.409 11.675 1.00 44.06 C ATOM 1220 CE1 PHE A 376 10.796 -4.053 13.884 1.00 45.84 C ATOM 1221 CE2 PHE A 376 12.143 -2.944 12.246 1.00 46.56 C ATOM 1222 CZ PHE A 376 12.040 -3.768 13.353 1.00 46.54 C ATOM 1223 H PHE A 376 8.315 -3.767 9.570 1.00 0.00 H ATOM 1224 N ASN A 377 4.996 -3.197 11.009 1.00 36.00 N ATOM 1225 CA ASN A 377 3.667 -2.695 10.693 1.00 32.92 C ATOM 1226 C ASN A 377 2.981 -2.210 11.964 1.00 35.68 C ATOM 1227 O ASN A 377 2.457 -3.024 12.735 1.00 32.98 O ATOM 1228 CB ASN A 377 2.830 -3.782 10.014 1.00 34.06 C ATOM 1229 CG ASN A 377 1.462 -3.285 9.585 1.00 34.01 C ATOM 1230 OD1 ASN A 377 1.004 -2.231 10.025 1.00 35.86 O ATOM 1231 ND2 ASN A 377 0.799 -4.050 8.728 1.00 31.56 N ATOM 1232 HD22 ASN A 377 1.225 -4.933 8.382 1.00 0.00 H ATOM 1233 HD21 ASN A 377 -0.147 -3.766 8.402 1.00 0.00 H ATOM 1234 H ASN A 377 5.120 -4.213 11.192 1.00 0.00 H ATOM 1235 N PRO A 378 2.953 -0.897 12.214 1.00 41.20 N ATOM 1236 CA PRO A 378 2.284 -0.393 13.424 1.00 41.53 C ATOM 1237 C PRO A 378 0.780 -0.601 13.420 1.00 41.05 C ATOM 1238 O PRO A 378 0.151 -0.439 14.473 1.00 36.75 O ATOM 1239 CB PRO A 378 2.636 1.099 13.420 1.00 44.58 C ATOM 1240 CG PRO A 378 2.851 1.421 11.981 1.00 34.92 C ATOM 1241 CD PRO A 378 3.481 0.194 11.378 1.00 41.96 C ATOM 1242 N ASP A 379 0.184 -0.948 12.280 1.00 38.81 N ATOM 1243 CA ASP A 379 -1.250 -1.193 12.219 1.00 40.14 C ATOM 1244 C ASP A 379 -1.631 -2.597 12.672 1.00 40.24 C ATOM 1245 O ASP A 379 -2.826 -2.893 12.769 1.00 39.66 O ATOM 1246 CB ASP A 379 -1.761 -0.950 10.797 1.00 38.38 C ATOM 1247 CG ASP A 379 -1.537 0.476 10.334 1.00 42.22 C ATOM 1248 OD1 ASP A 379 -1.608 1.394 11.178 1.00 46.63 O ATOM 1249 OD2 ASP A 379 -1.287 0.682 9.128 1.00 45.13 O ATOM 1250 H ASP A 379 0.755 -1.046 11.416 1.00 0.00 H ATOM 1251 N SER A 380 -0.654 -3.459 12.949 1.00 37.14 N ATOM 1252 CA SER A 380 -0.951 -4.808 13.409 1.00 33.39 C ATOM 1253 C SER A 380 -1.800 -4.760 14.672 1.00 36.22 C ATOM 1254 O SER A 380 -1.473 -4.057 15.633 1.00 38.24 O ATOM 1255 CB SER A 380 0.344 -5.575 13.671 1.00 35.25 C ATOM 1256 OG SER A 380 1.158 -5.617 12.511 1.00 34.50 O ATOM 1257 HG SER A 380 1.387 -4.694 12.236 1.00 0.00 H ATOM 1258 H SER A 380 0.337 -3.164 12.835 1.00 0.00 H ATOM 1259 N LYS A 381 -2.895 -5.510 14.668 1.00 34.90 N ATOM 1260 CA LYS A 381 -3.797 -5.510 15.809 1.00 44.68 C ATOM 1261 C LYS A 381 -3.199 -6.309 16.962 1.00 45.56 C ATOM 1262 O LYS A 381 -2.608 -7.374 16.762 1.00 45.90 O ATOM 1263 CB LYS A 381 -5.156 -6.087 15.408 1.00 42.26 C ATOM 1264 CG LYS A 381 -5.743 -5.477 14.139 1.00 41.81 C ATOM 1265 CD LYS A 381 -5.897 -3.967 14.256 1.00 46.81 C ATOM 1266 CE LYS A 381 -6.437 -3.364 12.964 1.00 48.26 C ATOM 1267 NZ LYS A 381 -6.593 -1.883 13.045 1.00 46.27 N ATOM 1268 HZ1 LYS A 381 -7.256 -1.647 13.810 1.00 0.00 H ATOM 1269 HZ2 LYS A 381 -5.668 -1.448 13.239 1.00 0.00 H ATOM 1270 HZ3 LYS A 381 -6.963 -1.525 12.141 1.00 0.00 H ATOM 1271 H LYS A 381 -3.110 -6.103 13.841 1.00 0.00 H ATOM 1272 N GLY A 382 -3.345 -5.779 18.176 1.00 47.30 N ATOM 1273 CA GLY A 382 -2.884 -6.445 19.374 1.00 52.29 C ATOM 1274 C GLY A 382 -1.521 -6.012 19.872 1.00 55.98 C ATOM 1275 O GLY A 382 -1.126 -6.426 20.969 1.00 56.40 O ATOM 1276 H GLY A 382 -3.808 -4.852 18.265 1.00 0.00 H ATOM 1277 N LEU A 383 -0.794 -5.200 19.108 1.00 55.48 N ATOM 1278 CA LEU A 383 0.524 -4.752 19.540 1.00 54.34 C ATOM 1279 C LEU A 383 0.443 -4.089 20.909 1.00 57.86 C ATOM 1280 O LEU A 383 -0.385 -3.204 21.137 1.00 61.72 O ATOM 1281 CB LEU A 383 1.115 -3.780 18.521 1.00 48.48 C ATOM 1282 CG LEU A 383 1.595 -4.399 17.211 1.00 41.93 C ATOM 1283 CD1 LEU A 383 2.131 -3.321 16.284 1.00 37.88 C ATOM 1284 CD2 LEU A 383 2.655 -5.454 17.488 1.00 40.48 C ATOM 1285 H LEU A 383 -1.171 -4.882 18.192 1.00 0.00 H ATOM 1286 N SER A 384 1.313 -4.525 21.823 1.00 58.87 N ATOM 1287 CA SER A 384 1.344 -3.924 23.152 1.00 62.74 C ATOM 1288 C SER A 384 1.785 -2.468 23.097 1.00 62.54 C ATOM 1289 O SER A 384 1.375 -1.666 23.943 1.00 67.92 O ATOM 1290 CB SER A 384 2.268 -4.722 24.070 1.00 67.50 C ATOM 1291 OG SER A 384 3.608 -4.667 23.613 1.00 70.85 O ATOM 1292 HG SER A 384 3.660 -5.047 22.700 1.00 0.00 H ATOM 1293 H SER A 384 1.971 -5.295 21.587 1.00 0.00 H ATOM 1294 N ASN A 385 2.616 -2.111 22.120 1.00 59.48 N ATOM 1295 CA ASN A 385 3.090 -0.735 21.961 1.00 59.97 C ATOM 1296 C ASN A 385 3.272 -0.453 20.479 1.00 55.05 C ATOM 1297 O ASN A 385 4.374 -0.575 19.932 1.00 54.83 O ATOM 1298 CB ASN A 385 4.395 -0.503 22.724 1.00 67.17 C ATOM 1299 CG ASN A 385 4.817 0.956 22.731 1.00 72.23 C ATOM 1300 OD1 ASN A 385 4.381 1.747 21.895 1.00 74.09 O ATOM 1301 ND2 ASN A 385 5.675 1.317 23.678 1.00 73.29 N ATOM 1302 HD22 ASN A 385 6.018 0.615 24.364 1.00 0.00 H ATOM 1303 HD21 ASN A 385 6.004 2.302 23.733 1.00 0.00 H ATOM 1304 H ASN A 385 2.940 -2.834 21.447 1.00 0.00 H ATOM 1305 N PRO A 386 2.196 -0.068 19.789 1.00 50.91 N ATOM 1306 CA PRO A 386 2.330 0.242 18.356 1.00 48.75 C ATOM 1307 C PRO A 386 3.262 1.407 18.076 1.00 47.83 C ATOM 1308 O PRO A 386 3.925 1.419 17.031 1.00 48.59 O ATOM 1309 CB PRO A 386 0.887 0.551 17.929 1.00 47.42 C ATOM 1310 CG PRO A 386 0.180 0.916 19.196 1.00 50.30 C ATOM 1311 CD PRO A 386 0.815 0.090 20.270 1.00 49.64 C ATOM 1312 N ALA A 387 3.338 2.388 18.980 1.00 49.21 N ATOM 1313 CA ALA A 387 4.223 3.527 18.757 1.00 53.74 C ATOM 1314 C ALA A 387 5.672 3.081 18.614 1.00 56.24 C ATOM 1315 O ALA A 387 6.401 3.580 17.749 1.00 61.19 O ATOM 1316 CB ALA A 387 4.082 4.534 19.899 1.00 50.27 C ATOM 1317 H ALA A 387 2.764 2.340 19.846 1.00 0.00 H ATOM 1318 N GLU A 388 6.109 2.145 19.458 1.00 56.11 N ATOM 1319 CA GLU A 388 7.468 1.628 19.346 1.00 58.44 C ATOM 1320 C GLU A 388 7.709 1.011 17.974 1.00 55.24 C ATOM 1321 O GLU A 388 8.771 1.210 17.373 1.00 54.63 O ATOM 1322 CB GLU A 388 7.729 0.605 20.451 1.00 65.80 C ATOM 1323 CG GLU A 388 9.072 -0.097 20.351 1.00 76.08 C ATOM 1324 CD GLU A 388 9.310 -1.054 21.503 1.00 87.63 C ATOM 1325 OE1 GLU A 388 10.437 -1.075 22.041 1.00 92.37 O ATOM 1326 OE2 GLU A 388 8.364 -1.780 21.876 1.00 91.37 O ATOM 1327 H GLU A 388 5.477 1.782 20.200 1.00 0.00 H ATOM 1328 N VAL A 389 6.732 0.261 17.461 1.00 50.80 N ATOM 1329 CA VAL A 389 6.885 -0.353 16.147 1.00 45.79 C ATOM 1330 C VAL A 389 6.909 0.711 15.059 1.00 45.03 C ATOM 1331 O VAL A 389 7.673 0.611 14.091 1.00 44.15 O ATOM 1332 CB VAL A 389 5.770 -1.387 15.908 1.00 42.78 C ATOM 1333 CG1 VAL A 389 5.826 -1.905 14.481 1.00 36.75 C ATOM 1334 CG2 VAL A 389 5.897 -2.534 16.897 1.00 40.07 C ATOM 1335 H VAL A 389 5.856 0.113 18.002 1.00 0.00 H ATOM 1336 N GLU A 390 6.078 1.747 15.194 1.00 44.38 N ATOM 1337 CA GLU A 390 6.095 2.827 14.214 1.00 45.64 C ATOM 1338 C GLU A 390 7.424 3.569 14.236 1.00 44.33 C ATOM 1339 O GLU A 390 7.930 3.977 13.184 1.00 40.30 O ATOM 1340 CB GLU A 390 4.942 3.795 14.466 1.00 52.92 C ATOM 1341 CG GLU A 390 4.917 4.961 13.492 1.00 61.67 C ATOM 1342 CD GLU A 390 3.794 5.936 13.770 1.00 71.41 C ATOM 1343 OE1 GLU A 390 3.124 5.794 14.814 1.00 75.80 O ATOM 1344 OE2 GLU A 390 3.582 6.847 12.942 1.00 74.50 O ATOM 1345 H GLU A 390 5.419 1.784 15.998 1.00 0.00 H ATOM 1346 N ALA A 391 8.003 3.757 15.425 1.00 44.99 N ATOM 1347 CA ALA A 391 9.313 4.392 15.514 1.00 46.28 C ATOM 1348 C ALA A 391 10.372 3.562 14.801 1.00 48.36 C ATOM 1349 O ALA A 391 11.291 4.111 14.182 1.00 48.57 O ATOM 1350 CB ALA A 391 9.695 4.611 16.977 1.00 47.31 C ATOM 1351 H ALA A 391 7.517 3.449 16.292 1.00 0.00 H ATOM 1352 N LEU A 392 10.261 2.234 14.878 1.00 42.40 N ATOM 1353 CA LEU A 392 11.201 1.376 14.166 1.00 43.59 C ATOM 1354 C LEU A 392 10.987 1.455 12.659 1.00 44.29 C ATOM 1355 O LEU A 392 11.954 1.456 11.888 1.00 46.77 O ATOM 1356 CB LEU A 392 11.073 -0.065 14.659 1.00 43.61 C ATOM 1357 CG LEU A 392 11.481 -0.312 16.113 1.00 46.83 C ATOM 1358 CD1 LEU A 392 11.221 -1.757 16.508 1.00 48.33 C ATOM 1359 CD2 LEU A 392 12.943 0.049 16.328 1.00 44.94 C ATOM 1360 H LEU A 392 9.501 1.810 15.448 1.00 0.00 H ATOM 1361 N ARG A 393 9.727 1.524 12.220 1.00 40.06 N ATOM 1362 CA ARG A 393 9.456 1.699 10.797 1.00 40.82 C ATOM 1363 C ARG A 393 10.003 3.029 10.292 1.00 42.79 C ATOM 1364 O ARG A 393 10.563 3.100 9.192 1.00 41.42 O ATOM 1365 CB ARG A 393 7.953 1.602 10.523 1.00 40.19 C ATOM 1366 CG ARG A 393 7.546 2.182 9.171 1.00 39.53 C ATOM 1367 CD ARG A 393 6.055 2.039 8.891 1.00 35.48 C ATOM 1368 NE ARG A 393 5.687 0.668 8.553 1.00 37.08 N ATOM 1369 CZ ARG A 393 4.580 0.332 7.898 1.00 35.99 C ATOM 1370 NH1 ARG A 393 3.733 1.271 7.499 1.00 38.16 N ATOM 1371 NH2 ARG A 393 4.325 -0.942 7.634 1.00 31.95 N ATOM 1372 HE ARG A 393 6.332 -0.095 8.843 1.00 0.00 H ATOM 1373 HH12 ARG A 393 2.867 1.007 6.987 1.00 0.00 H ATOM 1374 HH11 ARG A 393 3.934 2.272 7.698 1.00 0.00 H ATOM 1375 HH22 ARG A 393 3.459 -1.204 7.122 1.00 0.00 H ATOM 1376 HH21 ARG A 393 4.991 -1.680 7.939 1.00 0.00 H ATOM 1377 H ARG A 393 8.938 1.453 12.894 1.00 0.00 H ATOM 1378 N GLU A 394 9.852 4.095 11.081 1.00 44.28 N ATOM 1379 CA GLU A 394 10.325 5.404 10.645 1.00 44.49 C ATOM 1380 C GLU A 394 11.839 5.413 10.471 1.00 44.50 C ATOM 1381 O GLU A 394 12.363 6.058 9.554 1.00 43.16 O ATOM 1382 CB GLU A 394 9.889 6.477 11.641 1.00 47.92 C ATOM 1383 CG GLU A 394 8.383 6.569 11.833 1.00 51.89 C ATOM 1384 CD GLU A 394 7.991 7.592 12.882 1.00 59.66 C ATOM 1385 OE1 GLU A 394 6.823 8.037 12.876 1.00 59.47 O ATOM 1386 OE2 GLU A 394 8.854 7.953 13.710 1.00 65.41 O ATOM 1387 H GLU A 394 9.396 3.992 12.010 1.00 0.00 H ATOM 1388 N LYS A 395 12.559 4.707 11.345 1.00 47.69 N ATOM 1389 CA LYS A 395 14.005 4.602 11.198 1.00 50.19 C ATOM 1390 C LYS A 395 14.400 3.751 9.999 1.00 47.28 C ATOM 1391 O LYS A 395 15.510 3.913 9.481 1.00 48.08 O ATOM 1392 CB LYS A 395 14.627 4.034 12.477 1.00 51.97 C ATOM 1393 CG LYS A 395 14.423 4.908 13.702 1.00 55.04 C ATOM 1394 CD LYS A 395 15.104 4.322 14.927 1.00 60.17 C ATOM 1395 CE LYS A 395 14.955 5.236 16.133 1.00 64.34 C ATOM 1396 NZ LYS A 395 15.556 6.576 15.886 1.00 67.06 N ATOM 1397 HZ1 LYS A 395 16.570 6.467 15.680 1.00 0.00 H ATOM 1398 HZ2 LYS A 395 15.082 7.023 15.075 1.00 0.00 H ATOM 1399 HZ3 LYS A 395 15.434 7.170 16.731 1.00 0.00 H ATOM 1400 H LYS A 395 12.085 4.228 12.137 1.00 0.00 H ATOM 1401 N VAL A 396 13.521 2.856 9.543 1.00 44.08 N ATOM 1402 CA VAL A 396 13.833 2.031 8.379 1.00 40.38 C ATOM 1403 C VAL A 396 13.757 2.863 7.105 1.00 42.45 C ATOM 1404 O VAL A 396 14.720 2.936 6.333 1.00 44.52 O ATOM 1405 CB VAL A 396 12.899 0.812 8.308 1.00 36.98 C ATOM 1406 CG1 VAL A 396 13.169 0.033 7.032 1.00 35.08 C ATOM 1407 CG2 VAL A 396 13.092 -0.074 9.524 1.00 39.10 C ATOM 1408 H VAL A 396 12.604 2.745 10.022 1.00 0.00 H ATOM 1409 N TYR A 397 12.610 3.502 6.861 1.00 39.67 N ATOM 1410 CA TYR A 397 12.510 4.311 5.654 1.00 40.58 C ATOM 1411 C TYR A 397 13.264 5.628 5.772 1.00 41.72 C ATOM 1412 O TYR A 397 13.408 6.332 4.767 1.00 44.88 O ATOM 1413 CB TYR A 397 11.040 4.554 5.276 1.00 41.85 C ATOM 1414 CG TYR A 397 10.208 5.388 6.230 1.00 36.39 C ATOM 1415 CD1 TYR A 397 10.388 6.762 6.327 1.00 38.03 C ATOM 1416 CD2 TYR A 397 9.201 4.807 6.991 1.00 47.39 C ATOM 1417 CE1 TYR A 397 9.614 7.526 7.180 1.00 38.95 C ATOM 1418 CE2 TYR A 397 8.420 5.563 7.845 1.00 36.57 C ATOM 1419 CZ TYR A 397 8.631 6.922 7.936 1.00 53.80 C ATOM 1420 OH TYR A 397 7.857 7.678 8.786 1.00 51.83 O ATOM 1421 HH TYR A 397 8.137 8.626 8.730 1.00 0.00 H ATOM 1422 H TYR A 397 11.807 3.424 7.517 1.00 0.00 H ATOM 1423 N ALA A 398 13.757 5.971 6.964 1.00 45.19 N ATOM 1424 CA ALA A 398 14.688 7.088 7.074 1.00 49.27 C ATOM 1425 C ALA A 398 16.064 6.698 6.550 1.00 43.45 C ATOM 1426 O ALA A 398 16.705 7.474 5.831 1.00 44.62 O ATOM 1427 CB ALA A 398 14.774 7.563 8.523 1.00 44.40 C ATOM 1428 H ALA A 398 13.477 5.442 7.814 1.00 0.00 H ATOM 1429 N SER A 399 16.530 5.494 6.894 1.00 43.35 N ATOM 1430 CA SER A 399 17.802 5.011 6.369 1.00 43.76 C ATOM 1431 C SER A 399 17.700 4.661 4.890 1.00 45.78 C ATOM 1432 O SER A 399 18.669 4.840 4.144 1.00 47.32 O ATOM 1433 CB SER A 399 18.274 3.796 7.168 1.00 43.78 C ATOM 1434 OG SER A 399 18.460 4.122 8.535 1.00 51.32 O ATOM 1435 HG SER A 399 18.765 3.318 9.026 1.00 0.00 H ATOM 1436 H SER A 399 15.980 4.895 7.543 1.00 0.00 H ATOM 1437 N LEU A 400 16.542 4.164 4.451 1.00 40.46 N ATOM 1438 CA LEU A 400 16.371 3.805 3.046 1.00 42.13 C ATOM 1439 C LEU A 400 16.472 5.033 2.151 1.00 45.27 C ATOM 1440 O LEU A 400 17.173 5.019 1.132 1.00 47.65 O ATOM 1441 CB LEU A 400 15.028 3.099 2.847 1.00 41.76 C ATOM 1442 CG LEU A 400 14.651 2.726 1.412 1.00 40.83 C ATOM 1443 CD1 LEU A 400 15.699 1.812 0.804 1.00 36.60 C ATOM 1444 CD2 LEU A 400 13.279 2.071 1.371 1.00 34.18 C ATOM 1445 H LEU A 400 15.754 4.031 5.116 1.00 0.00 H ATOM 1446 N GLU A 401 15.778 6.111 2.519 1.00 43.52 N ATOM 1447 CA GLU A 401 15.833 7.331 1.721 1.00 44.20 C ATOM 1448 C GLU A 401 17.265 7.830 1.582 1.00 47.29 C ATOM 1449 O GLU A 401 17.713 8.170 0.481 1.00 53.59 O ATOM 1450 CB GLU A 401 14.944 8.406 2.345 1.00 45.50 C ATOM 1451 CG GLU A 401 14.809 9.659 1.502 1.00 47.79 C ATOM 1452 CD GLU A 401 13.814 10.640 2.083 1.00 50.91 C ATOM 1453 OE1 GLU A 401 13.591 10.600 3.311 1.00 51.34 O ATOM 1454 OE2 GLU A 401 13.248 11.444 1.313 1.00 52.95 O ATOM 1455 H GLU A 401 15.195 6.082 3.379 1.00 0.00 H ATOM 1456 N ALA A 402 18.004 7.878 2.692 1.00 47.84 N ATOM 1457 CA ALA A 402 19.392 8.323 2.629 1.00 50.20 C ATOM 1458 C ALA A 402 20.228 7.392 1.761 1.00 51.07 C ATOM 1459 O ALA A 402 21.123 7.842 1.036 1.00 53.74 O ATOM 1460 CB ALA A 402 19.979 8.420 4.037 1.00 49.21 C ATOM 1461 H ALA A 402 17.590 7.598 3.604 1.00 0.00 H ATOM 1462 N TYR A 403 19.949 6.087 1.817 1.00 50.15 N ATOM 1463 CA TYR A 403 20.680 5.139 0.982 1.00 46.19 C ATOM 1464 C TYR A 403 20.366 5.348 -0.494 1.00 45.88 C ATOM 1465 O TYR A 403 21.268 5.297 -1.339 1.00 47.90 O ATOM 1466 CB TYR A 403 20.353 3.708 1.409 1.00 44.49 C ATOM 1467 CG TYR A 403 20.819 2.645 0.437 1.00 44.31 C ATOM 1468 CD1 TYR A 403 22.109 2.133 0.501 1.00 46.04 C ATOM 1469 CD2 TYR A 403 19.964 2.147 -0.538 1.00 42.64 C ATOM 1470 CE1 TYR A 403 22.536 1.159 -0.384 1.00 46.14 C ATOM 1471 CE2 TYR A 403 20.381 1.174 -1.426 1.00 44.46 C ATOM 1472 CZ TYR A 403 21.667 0.683 -1.345 1.00 49.40 C ATOM 1473 OH TYR A 403 22.083 -0.287 -2.229 1.00 50.77 O ATOM 1474 HH TYR A 403 22.013 0.059 -3.154 1.00 0.00 H ATOM 1475 H TYR A 403 19.206 5.744 2.459 1.00 0.00 H ATOM 1476 N CYS A 404 19.095 5.586 -0.826 1.00 44.23 N ATOM 1477 CA CYS A 404 18.733 5.813 -2.222 1.00 46.75 C ATOM 1478 C CYS A 404 19.346 7.103 -2.750 1.00 52.20 C ATOM 1479 O CYS A 404 19.875 7.133 -3.868 1.00 57.91 O ATOM 1480 CB CYS A 404 17.212 5.840 -2.374 1.00 42.60 C ATOM 1481 SG CYS A 404 16.395 4.284 -1.958 1.00 41.16 S ATOM 1482 H CYS A 404 18.362 5.610 -0.089 1.00 0.00 H ATOM 1483 N LYS A 405 19.290 8.178 -1.963 1.00 51.10 N ATOM 1484 CA LYS A 405 19.840 9.454 -2.405 1.00 55.00 C ATOM 1485 C LYS A 405 21.357 9.424 -2.524 1.00 58.83 C ATOM 1486 O LYS A 405 21.926 10.255 -3.241 1.00 60.58 O ATOM 1487 CB LYS A 405 19.404 10.568 -1.453 1.00 55.70 C ATOM 1488 CG LYS A 405 17.971 11.017 -1.673 1.00 56.37 C ATOM 1489 CD LYS A 405 17.526 12.026 -0.632 1.00 58.61 C ATOM 1490 CE LYS A 405 16.309 12.794 -1.121 1.00 61.05 C ATOM 1491 NZ LYS A 405 15.327 11.898 -1.795 1.00 59.63 N ATOM 1492 HZ1 LYS A 405 15.779 11.444 -2.614 1.00 0.00 H ATOM 1493 HZ2 LYS A 405 15.008 11.169 -1.125 1.00 0.00 H ATOM 1494 HZ3 LYS A 405 14.511 12.458 -2.115 1.00 0.00 H ATOM 1495 H LYS A 405 18.849 8.106 -1.024 1.00 0.00 H ATOM 1496 N HIS A 406 22.023 8.493 -1.843 1.00 59.26 N ATOM 1497 CA HIS A 406 23.470 8.354 -1.953 1.00 59.79 C ATOM 1498 C HIS A 406 23.872 7.337 -3.014 1.00 55.95 C ATOM 1499 O HIS A 406 24.795 7.590 -3.796 1.00 56.39 O ATOM 1500 CB HIS A 406 24.066 7.956 -0.601 1.00 63.53 C ATOM 1501 CG HIS A 406 25.498 7.526 -0.675 1.00 68.96 C ATOM 1502 ND1 HIS A 406 25.871 6.209 -0.838 1.00 69.76 N ATOM 1503 CD2 HIS A 406 26.648 8.237 -0.609 1.00 72.15 C ATOM 1504 CE1 HIS A 406 27.189 6.127 -0.869 1.00 72.31 C ATOM 1505 NE2 HIS A 406 27.685 7.344 -0.732 1.00 73.74 N ATOM 1506 H HIS A 406 21.498 7.849 -1.217 1.00 0.00 H ATOM 1507 N LYS A 407 23.192 6.191 -3.057 1.00 54.08 N ATOM 1508 CA LYS A 407 23.532 5.159 -4.031 1.00 54.51 C ATOM 1509 C LYS A 407 23.089 5.560 -5.433 1.00 54.38 C ATOM 1510 O LYS A 407 23.850 5.425 -6.399 1.00 53.79 O ATOM 1511 CB LYS A 407 22.898 3.830 -3.620 1.00 54.97 C ATOM 1512 CG LYS A 407 23.323 2.644 -4.466 1.00 56.29 C ATOM 1513 CD LYS A 407 24.791 2.314 -4.258 1.00 59.74 C ATOM 1514 CE LYS A 407 25.197 1.092 -5.068 1.00 61.50 C ATOM 1515 NZ LYS A 407 24.301 -0.070 -4.805 1.00 57.57 N ATOM 1516 HZ1 LYS A 407 24.344 -0.318 -3.796 1.00 0.00 H ATOM 1517 HZ2 LYS A 407 23.325 0.182 -5.060 1.00 0.00 H ATOM 1518 HZ3 LYS A 407 24.612 -0.882 -5.376 1.00 0.00 H ATOM 1519 H LYS A 407 22.411 6.031 -2.389 1.00 0.00 H ATOM 1520 N TYR A 408 21.860 6.058 -5.562 1.00 52.09 N ATOM 1521 CA TYR A 408 21.290 6.466 -6.845 1.00 50.55 C ATOM 1522 C TYR A 408 20.948 7.951 -6.808 1.00 53.42 C ATOM 1523 O TYR A 408 19.776 8.335 -6.898 1.00 51.36 O ATOM 1524 CB TYR A 408 20.054 5.634 -7.180 1.00 47.95 C ATOM 1525 CG TYR A 408 20.254 4.144 -7.022 1.00 50.50 C ATOM 1526 CD1 TYR A 408 20.795 3.383 -8.050 1.00 51.40 C ATOM 1527 CD2 TYR A 408 19.898 3.497 -5.845 1.00 49.09 C ATOM 1528 CE1 TYR A 408 20.978 2.020 -7.909 1.00 49.53 C ATOM 1529 CE2 TYR A 408 20.078 2.135 -5.695 1.00 44.28 C ATOM 1530 CZ TYR A 408 20.617 1.402 -6.731 1.00 45.24 C ATOM 1531 OH TYR A 408 20.798 0.046 -6.588 1.00 44.64 O ATOM 1532 HH TYR A 408 21.408 -0.126 -5.828 1.00 0.00 H ATOM 1533 H TYR A 408 21.277 6.162 -4.707 1.00 0.00 H ATOM 1534 N PRO A 409 21.955 8.818 -6.682 1.00 54.07 N ATOM 1535 CA PRO A 409 21.671 10.257 -6.566 1.00 55.25 C ATOM 1536 C PRO A 409 20.975 10.842 -7.780 1.00 63.72 C ATOM 1537 O PRO A 409 20.346 11.901 -7.662 1.00 64.41 O ATOM 1538 CB PRO A 409 23.062 10.873 -6.367 1.00 58.30 C ATOM 1539 CG PRO A 409 23.999 9.884 -6.980 1.00 59.14 C ATOM 1540 CD PRO A 409 23.400 8.537 -6.704 1.00 56.30 C ATOM 1541 N GLU A 410 21.068 10.196 -8.939 1.00 63.64 N ATOM 1542 CA GLU A 410 20.437 10.687 -10.156 1.00 62.96 C ATOM 1543 C GLU A 410 18.990 10.234 -10.298 1.00 53.71 C ATOM 1544 O GLU A 410 18.344 10.582 -11.292 1.00 54.10 O ATOM 1545 CB GLU A 410 21.238 10.239 -11.385 1.00 64.05 C ATOM 1546 CG GLU A 410 21.045 8.774 -11.764 1.00 62.60 C ATOM 1547 CD GLU A 410 21.557 7.812 -10.704 1.00 59.52 C ATOM 1548 OE1 GLU A 410 22.383 8.228 -9.866 1.00 59.93 O ATOM 1549 OE2 GLU A 410 21.131 6.637 -10.709 1.00 53.48 O ATOM 1550 H GLU A 410 21.610 9.309 -8.977 1.00 0.00 H ATOM 1551 N GLN A 411 18.469 9.467 -9.336 1.00 53.04 N ATOM 1552 CA GLN A 411 17.087 8.990 -9.339 1.00 53.77 C ATOM 1553 C GLN A 411 16.396 9.533 -8.094 1.00 54.90 C ATOM 1554 O GLN A 411 16.172 8.794 -7.122 1.00 52.96 O ATOM 1555 CB GLN A 411 17.019 7.464 -9.381 1.00 46.88 C ATOM 1556 CG GLN A 411 17.813 6.829 -10.509 1.00 48.46 C ATOM 1557 CD GLN A 411 17.686 5.318 -10.530 1.00 46.66 C ATOM 1558 OE1 GLN A 411 16.659 4.766 -10.137 1.00 48.79 O ATOM 1559 NE2 GLN A 411 18.733 4.641 -10.984 1.00 52.12 N ATOM 1560 HE22 GLN A 411 19.581 5.149 -11.306 1.00 0.00 H ATOM 1561 HE21 GLN A 411 18.706 3.602 -11.018 1.00 0.00 H ATOM 1562 H GLN A 411 19.081 9.194 -8.541 1.00 0.00 H ATOM 1563 N PRO A 412 16.039 10.819 -8.086 1.00 56.08 N ATOM 1564 CA PRO A 412 15.432 11.400 -6.877 1.00 55.40 C ATOM 1565 C PRO A 412 14.122 10.744 -6.475 1.00 54.43 C ATOM 1566 O PRO A 412 13.812 10.685 -5.277 1.00 52.56 O ATOM 1567 CB PRO A 412 15.233 12.874 -7.260 1.00 53.29 C ATOM 1568 CG PRO A 412 15.204 12.880 -8.754 1.00 50.91 C ATOM 1569 CD PRO A 412 16.153 11.801 -9.177 1.00 50.87 C ATOM 1570 N GLY A 413 13.342 10.252 -7.432 1.00 52.12 N ATOM 1571 CA GLY A 413 12.075 9.614 -7.148 1.00 42.07 C ATOM 1572 C GLY A 413 12.150 8.137 -6.829 1.00 40.20 C ATOM 1573 O GLY A 413 11.105 7.498 -6.668 1.00 38.40 O ATOM 1574 H GLY A 413 13.654 10.328 -8.421 1.00 0.00 H ATOM 1575 N ARG A 414 13.354 7.571 -6.727 1.00 38.25 N ATOM 1576 CA ARG A 414 13.476 6.140 -6.467 1.00 36.52 C ATOM 1577 C ARG A 414 12.911 5.777 -5.100 1.00 39.97 C ATOM 1578 O ARG A 414 12.289 4.720 -4.938 1.00 40.75 O ATOM 1579 CB ARG A 414 14.939 5.710 -6.575 1.00 37.80 C ATOM 1580 CG ARG A 414 15.157 4.210 -6.487 1.00 35.89 C ATOM 1581 CD ARG A 414 16.627 3.864 -6.653 1.00 37.02 C ATOM 1582 NE ARG A 414 16.864 2.423 -6.607 1.00 40.23 N ATOM 1583 CZ ARG A 414 16.847 1.628 -7.673 1.00 37.78 C ATOM 1584 NH1 ARG A 414 16.601 2.132 -8.873 1.00 38.16 N ATOM 1585 NH2 ARG A 414 17.075 0.329 -7.539 1.00 36.44 N ATOM 1586 HE ARG A 414 17.059 1.991 -5.681 1.00 0.00 H ATOM 1587 HH12 ARG A 414 16.588 1.509 -9.706 1.00 0.00 H ATOM 1588 HH11 ARG A 414 16.421 3.150 -8.982 1.00 0.00 H ATOM 1589 HH22 ARG A 414 17.061 -0.290 -8.374 1.00 0.00 H ATOM 1590 HH21 ARG A 414 17.268 -0.071 -6.598 1.00 0.00 H ATOM 1591 H ARG A 414 14.210 8.152 -6.833 1.00 0.00 H ATOM 1592 N PHE A 415 13.117 6.639 -4.102 1.00 40.17 N ATOM 1593 CA PHE A 415 12.614 6.351 -2.763 1.00 39.84 C ATOM 1594 C PHE A 415 11.094 6.234 -2.762 1.00 37.89 C ATOM 1595 O PHE A 415 10.535 5.255 -2.254 1.00 35.69 O ATOM 1596 CB PHE A 415 13.079 7.430 -1.784 1.00 37.42 C ATOM 1597 CG PHE A 415 12.503 7.287 -0.407 1.00 35.08 C ATOM 1598 CD1 PHE A 415 12.782 6.171 0.364 1.00 33.90 C ATOM 1599 CD2 PHE A 415 11.687 8.272 0.122 1.00 37.81 C ATOM 1600 CE1 PHE A 415 12.251 6.039 1.633 1.00 36.51 C ATOM 1601 CE2 PHE A 415 11.155 8.146 1.391 1.00 36.08 C ATOM 1602 CZ PHE A 415 11.437 7.028 2.147 1.00 34.87 C ATOM 1603 H PHE A 415 13.639 7.521 -4.280 1.00 0.00 H ATOM 1604 N ALA A 416 10.407 7.225 -3.331 1.00 39.01 N ATOM 1605 CA ALA A 416 8.952 7.157 -3.407 1.00 43.22 C ATOM 1606 C ALA A 416 8.500 5.974 -4.253 1.00 46.60 C ATOM 1607 O ALA A 416 7.486 5.335 -3.948 1.00 49.90 O ATOM 1608 CB ALA A 416 8.391 8.465 -3.966 1.00 36.59 C ATOM 1609 H ALA A 416 10.909 8.048 -3.721 1.00 0.00 H ATOM 1610 N LYS A 417 9.238 5.668 -5.322 1.00 46.24 N ATOM 1611 CA LYS A 417 8.875 4.534 -6.165 1.00 43.42 C ATOM 1612 C LYS A 417 8.925 3.227 -5.381 1.00 36.87 C ATOM 1613 O LYS A 417 8.066 2.356 -5.556 1.00 33.55 O ATOM 1614 CB LYS A 417 9.797 4.471 -7.384 1.00 46.44 C ATOM 1615 CG LYS A 417 9.586 3.245 -8.262 1.00 48.55 C ATOM 1616 CD LYS A 417 10.594 3.194 -9.401 1.00 51.96 C ATOM 1617 CE LYS A 417 10.217 4.136 -10.535 1.00 54.42 C ATOM 1618 NZ LYS A 417 9.035 3.644 -11.298 1.00 54.33 N ATOM 1619 HZ1 LYS A 417 9.251 2.712 -11.706 1.00 0.00 H ATOM 1620 HZ2 LYS A 417 8.220 3.563 -10.657 1.00 0.00 H ATOM 1621 HZ3 LYS A 417 8.812 4.315 -12.061 1.00 0.00 H ATOM 1622 H LYS A 417 10.075 6.240 -5.555 1.00 0.00 H ATOM 1623 N LEU A 418 9.922 3.076 -4.507 1.00 34.74 N ATOM 1624 CA LEU A 418 10.026 1.862 -3.703 1.00 33.04 C ATOM 1625 C LEU A 418 8.815 1.699 -2.792 1.00 34.34 C ATOM 1626 O LEU A 418 8.215 0.620 -2.720 1.00 36.47 O ATOM 1627 CB LEU A 418 11.315 1.887 -2.882 1.00 32.99 C ATOM 1628 CG LEU A 418 12.630 1.815 -3.659 1.00 34.33 C ATOM 1629 CD1 LEU A 418 13.809 2.010 -2.720 1.00 31.67 C ATOM 1630 CD2 LEU A 418 12.742 0.487 -4.392 1.00 34.38 C ATOM 1631 H LEU A 418 10.631 3.829 -4.398 1.00 0.00 H ATOM 1632 N LEU A 419 8.443 2.764 -2.079 1.00 31.50 N ATOM 1633 CA LEU A 419 7.323 2.669 -1.150 1.00 30.62 C ATOM 1634 C LEU A 419 6.008 2.427 -1.877 1.00 31.27 C ATOM 1635 O LEU A 419 5.096 1.807 -1.318 1.00 31.37 O ATOM 1636 CB LEU A 419 7.227 3.940 -0.307 1.00 31.74 C ATOM 1637 CG LEU A 419 8.460 4.319 0.510 1.00 30.85 C ATOM 1638 CD1 LEU A 419 8.189 5.581 1.313 1.00 32.41 C ATOM 1639 CD2 LEU A 419 8.873 3.171 1.419 1.00 30.09 C ATOM 1640 H LEU A 419 8.953 3.664 -2.186 1.00 0.00 H ATOM 1641 N LEU A 420 5.890 2.906 -3.113 1.00 30.01 N ATOM 1642 CA LEU A 420 4.652 2.802 -3.874 1.00 31.50 C ATOM 1643 C LEU A 420 4.435 1.421 -4.478 1.00 33.73 C ATOM 1644 O LEU A 420 3.465 1.233 -5.221 1.00 35.24 O ATOM 1645 CB LEU A 420 4.621 3.867 -4.969 1.00 34.60 C ATOM 1646 CG LEU A 420 4.372 5.284 -4.450 1.00 33.97 C ATOM 1647 CD1 LEU A 420 4.335 6.283 -5.593 1.00 37.22 C ATOM 1648 CD2 LEU A 420 3.079 5.327 -3.651 1.00 33.74 C ATOM 1649 H LEU A 420 6.711 3.371 -3.551 1.00 0.00 H ATOM 1650 N ARG A 421 5.307 0.459 -4.189 1.00 28.66 N ATOM 1651 CA ARG A 421 5.049 -0.934 -4.522 1.00 32.71 C ATOM 1652 C ARG A 421 4.389 -1.696 -3.380 1.00 34.32 C ATOM 1653 O ARG A 421 3.891 -2.805 -3.602 1.00 37.64 O ATOM 1654 CB ARG A 421 6.351 -1.640 -4.921 1.00 30.41 C ATOM 1655 CG ARG A 421 6.867 -1.288 -6.311 1.00 29.04 C ATOM 1656 CD ARG A 421 5.867 -1.679 -7.388 1.00 29.83 C ATOM 1657 NE ARG A 421 4.881 -0.629 -7.625 1.00 37.16 N ATOM 1658 CZ ARG A 421 3.759 -0.800 -8.316 1.00 31.46 C ATOM 1659 NH1 ARG A 421 3.471 -1.986 -8.833 1.00 31.58 N ATOM 1660 NH2 ARG A 421 2.923 0.215 -8.485 1.00 32.47 N ATOM 1661 HE ARG A 421 5.069 0.314 -7.227 1.00 0.00 H ATOM 1662 HH12 ARG A 421 2.592 -2.118 -9.374 1.00 0.00 H ATOM 1663 HH11 ARG A 421 4.124 -2.784 -8.698 1.00 0.00 H ATOM 1664 HH22 ARG A 421 2.045 0.081 -9.026 1.00 0.00 H ATOM 1665 HH21 ARG A 421 3.145 1.145 -8.077 1.00 0.00 H ATOM 1666 H ARG A 421 6.197 0.709 -3.712 1.00 0.00 H ATOM 1667 N LEU A 422 4.367 -1.124 -2.174 1.00 29.38 N ATOM 1668 CA LEU A 422 3.789 -1.759 -0.996 1.00 30.98 C ATOM 1669 C LEU A 422 2.283 -1.942 -1.149 1.00 30.97 C ATOM 1670 O LEU A 422 1.753 -2.999 -0.785 1.00 37.42 O ATOM 1671 CB LEU A 422 4.102 -0.943 0.260 1.00 27.06 C ATOM 1672 CG LEU A 422 5.582 -0.916 0.651 1.00 26.79 C ATOM 1673 CD1 LEU A 422 5.803 -0.098 1.911 1.00 27.48 C ATOM 1674 CD2 LEU A 422 6.110 -2.331 0.829 1.00 26.07 C ATOM 1675 H LEU A 422 4.784 -0.177 -2.070 1.00 0.00 H ATOM 1676 N PRO A 423 1.555 -0.944 -1.660 1.00 30.12 N ATOM 1677 CA PRO A 423 0.121 -1.164 -1.923 1.00 34.92 C ATOM 1678 C PRO A 423 -0.137 -2.388 -2.786 1.00 35.93 C ATOM 1679 O PRO A 423 -1.019 -3.197 -2.469 1.00 36.86 O ATOM 1680 CB PRO A 423 -0.306 0.139 -2.613 1.00 30.37 C ATOM 1681 CG PRO A 423 0.649 1.157 -2.111 1.00 31.89 C ATOM 1682 CD PRO A 423 1.962 0.444 -1.941 1.00 30.03 C ATOM 1683 N ALA A 424 0.617 -2.551 -3.875 1.00 33.76 N ATOM 1684 CA ALA A 424 0.475 -3.754 -4.687 1.00 37.75 C ATOM 1685 C ALA A 424 0.835 -4.998 -3.885 1.00 36.30 C ATOM 1686 O ALA A 424 0.172 -6.036 -3.999 1.00 38.35 O ATOM 1687 CB ALA A 424 1.341 -3.649 -5.942 1.00 35.88 C ATOM 1688 H ALA A 424 1.306 -1.820 -4.145 1.00 0.00 H ATOM 1689 N LEU A 425 1.883 -4.910 -3.063 1.00 32.20 N ATOM 1690 CA LEU A 425 2.254 -6.038 -2.216 1.00 29.36 C ATOM 1691 C LEU A 425 1.138 -6.382 -1.238 1.00 28.05 C ATOM 1692 O LEU A 425 0.888 -7.559 -0.956 1.00 28.66 O ATOM 1693 CB LEU A 425 3.546 -5.721 -1.465 1.00 28.77 C ATOM 1694 CG LEU A 425 4.074 -6.808 -0.529 1.00 28.96 C ATOM 1695 CD1 LEU A 425 4.459 -8.047 -1.316 1.00 29.32 C ATOM 1696 CD2 LEU A 425 5.254 -6.291 0.275 1.00 30.51 C ATOM 1697 H LEU A 425 2.439 -4.032 -3.026 1.00 0.00 H ATOM 1698 N ARG A 426 0.455 -5.364 -0.711 1.00 28.62 N ATOM 1699 CA ARG A 426 -0.618 -5.605 0.247 1.00 29.83 C ATOM 1700 C ARG A 426 -1.772 -6.363 -0.399 1.00 32.64 C ATOM 1701 O ARG A 426 -2.245 -7.371 0.137 1.00 35.58 O ATOM 1702 CB ARG A 426 -1.095 -4.274 0.833 1.00 28.23 C ATOM 1703 CG ARG A 426 -2.324 -4.375 1.723 1.00 29.36 C ATOM 1704 CD ARG A 426 -2.061 -5.220 2.955 1.00 29.22 C ATOM 1705 NE ARG A 426 -0.966 -4.693 3.764 1.00 31.85 N ATOM 1706 CZ ARG A 426 -1.100 -3.726 4.667 1.00 34.08 C ATOM 1707 NH1 ARG A 426 -2.285 -3.167 4.875 1.00 31.30 N ATOM 1708 NH2 ARG A 426 -0.048 -3.313 5.361 1.00 29.75 N ATOM 1709 HE ARG A 426 -0.019 -5.100 3.625 1.00 0.00 H ATOM 1710 HH12 ARG A 426 -2.386 -2.411 5.582 1.00 0.00 H ATOM 1711 HH11 ARG A 426 -3.113 -3.485 4.331 1.00 0.00 H ATOM 1712 HH22 ARG A 426 -0.155 -2.557 6.067 1.00 0.00 H ATOM 1713 HH21 ARG A 426 0.884 -3.746 5.199 1.00 0.00 H ATOM 1714 H ARG A 426 0.690 -4.389 -0.986 1.00 0.00 H ATOM 1715 N SER A 427 -2.235 -5.895 -1.561 1.00 35.97 N ATOM 1716 CA SER A 427 -3.380 -6.533 -2.206 1.00 35.24 C ATOM 1717 C SER A 427 -3.028 -7.925 -2.720 1.00 31.69 C ATOM 1718 O SER A 427 -3.852 -8.845 -2.645 1.00 30.38 O ATOM 1719 CB SER A 427 -3.900 -5.652 -3.342 1.00 39.64 C ATOM 1720 OG SER A 427 -2.867 -5.331 -4.254 1.00 47.80 O ATOM 1721 HG SER A 427 -2.149 -4.843 -3.779 1.00 0.00 H ATOM 1722 H SER A 427 -1.779 -5.074 -2.008 1.00 0.00 H ATOM 1723 N ILE A 428 -1.813 -8.101 -3.243 1.00 32.61 N ATOM 1724 CA ILE A 428 -1.407 -9.415 -3.736 1.00 32.78 C ATOM 1725 C ILE A 428 -1.312 -10.413 -2.589 1.00 31.85 C ATOM 1726 O ILE A 428 -1.659 -11.590 -2.744 1.00 33.80 O ATOM 1727 CB ILE A 428 -0.079 -9.313 -4.508 1.00 33.32 C ATOM 1728 CG1 ILE A 428 -0.281 -8.564 -5.828 1.00 29.64 C ATOM 1729 CG2 ILE A 428 0.499 -10.697 -4.759 1.00 33.21 C ATOM 1730 CD1 ILE A 428 0.993 -8.396 -6.627 1.00 29.70 C ATOM 1731 H ILE A 428 -1.153 -7.300 -3.300 1.00 0.00 H ATOM 1732 N GLY A 429 -0.838 -9.966 -1.425 1.00 31.62 N ATOM 1733 CA GLY A 429 -0.782 -10.855 -0.276 1.00 28.04 C ATOM 1734 C GLY A 429 -2.156 -11.321 0.163 1.00 29.04 C ATOM 1735 O GLY A 429 -2.359 -12.503 0.453 1.00 29.69 O ATOM 1736 H GLY A 429 -0.509 -8.983 -1.340 1.00 0.00 H ATOM 1737 N LEU A 430 -3.120 -10.400 0.217 1.00 33.78 N ATOM 1738 CA LEU A 430 -4.484 -10.778 0.570 1.00 34.64 C ATOM 1739 C LEU A 430 -5.042 -11.806 -0.407 1.00 31.68 C ATOM 1740 O LEU A 430 -5.653 -12.798 0.007 1.00 39.91 O ATOM 1741 CB LEU A 430 -5.373 -9.535 0.617 1.00 31.44 C ATOM 1742 CG LEU A 430 -5.084 -8.547 1.749 1.00 34.08 C ATOM 1743 CD1 LEU A 430 -5.860 -7.253 1.549 1.00 32.17 C ATOM 1744 CD2 LEU A 430 -5.420 -9.176 3.092 1.00 32.00 C ATOM 1745 H LEU A 430 -2.897 -9.406 0.006 1.00 0.00 H ATOM 1746 N LYS A 431 -4.839 -11.591 -1.709 1.00 31.66 N ATOM 1747 CA LYS A 431 -5.345 -12.534 -2.701 1.00 32.88 C ATOM 1748 C LYS A 431 -4.669 -13.892 -2.560 1.00 33.47 C ATOM 1749 O LYS A 431 -5.336 -14.933 -2.557 1.00 35.70 O ATOM 1750 CB LYS A 431 -5.150 -11.970 -4.109 1.00 33.14 C ATOM 1751 CG LYS A 431 -5.597 -12.912 -5.215 1.00 38.45 C ATOM 1752 CD LYS A 431 -7.060 -13.303 -5.065 1.00 38.89 C ATOM 1753 CE LYS A 431 -7.975 -12.097 -5.187 1.00 39.27 C ATOM 1754 NZ LYS A 431 -9.409 -12.487 -5.095 1.00 42.62 N ATOM 1755 HZ1 LYS A 431 -9.636 -13.152 -5.862 1.00 0.00 H ATOM 1756 HZ2 LYS A 431 -9.585 -12.942 -4.177 1.00 0.00 H ATOM 1757 HZ3 LYS A 431 -10.004 -11.639 -5.182 1.00 0.00 H ATOM 1758 H LYS A 431 -4.317 -10.746 -2.018 1.00 0.00 H ATOM 1759 N CYS A 432 -3.338 -13.902 -2.441 1.00 31.83 N ATOM 1760 CA CYS A 432 -2.631 -15.162 -2.238 1.00 32.18 C ATOM 1761 C CYS A 432 -3.147 -15.886 -1.003 1.00 35.09 C ATOM 1762 O CYS A 432 -3.259 -17.118 -0.995 1.00 33.92 O ATOM 1763 CB CYS A 432 -1.128 -14.914 -2.118 1.00 31.08 C ATOM 1764 SG CYS A 432 -0.302 -14.527 -3.672 1.00 31.17 S ATOM 1765 H CYS A 432 -2.805 -13.010 -2.493 1.00 0.00 H ATOM 1766 N LEU A 433 -3.471 -15.136 0.051 1.00 36.20 N ATOM 1767 CA LEU A 433 -3.972 -15.759 1.271 1.00 32.98 C ATOM 1768 C LEU A 433 -5.328 -16.413 1.037 1.00 35.07 C ATOM 1769 O LEU A 433 -5.593 -17.506 1.552 1.00 35.89 O ATOM 1770 CB LEU A 433 -4.049 -14.722 2.390 1.00 32.42 C ATOM 1771 CG LEU A 433 -4.146 -15.272 3.813 1.00 39.73 C ATOM 1772 CD1 LEU A 433 -3.011 -16.247 4.078 1.00 40.72 C ATOM 1773 CD2 LEU A 433 -4.123 -14.136 4.819 1.00 36.29 C ATOM 1774 H LEU A 433 -3.366 -14.102 0.003 1.00 0.00 H ATOM 1775 N GLU A 434 -6.199 -15.765 0.258 1.00 35.00 N ATOM 1776 CA GLU A 434 -7.476 -16.380 -0.091 1.00 36.87 C ATOM 1777 C GLU A 434 -7.261 -17.723 -0.776 1.00 37.93 C ATOM 1778 O GLU A 434 -7.919 -18.716 -0.443 1.00 39.56 O ATOM 1779 CB GLU A 434 -8.289 -15.444 -0.986 1.00 43.41 C ATOM 1780 CG GLU A 434 -8.641 -14.109 -0.356 1.00 47.27 C ATOM 1781 CD GLU A 434 -9.538 -13.270 -1.247 1.00 54.35 C ATOM 1782 OE1 GLU A 434 -10.417 -13.845 -1.927 1.00 53.95 O ATOM 1783 OE2 GLU A 434 -9.359 -12.034 -1.275 1.00 59.66 O ATOM 1784 H GLU A 434 -5.966 -14.817 -0.102 1.00 0.00 H ATOM 1785 N HIS A 435 -6.346 -17.769 -1.749 1.00 37.32 N ATOM 1786 CA HIS A 435 -6.023 -19.037 -2.394 1.00 38.63 C ATOM 1787 C HIS A 435 -5.584 -20.072 -1.368 1.00 39.08 C ATOM 1788 O HIS A 435 -5.983 -21.240 -1.439 1.00 40.97 O ATOM 1789 CB HIS A 435 -4.931 -18.840 -3.449 1.00 42.05 C ATOM 1790 CG HIS A 435 -5.410 -18.189 -4.712 1.00 42.85 C ATOM 1791 ND1 HIS A 435 -5.401 -16.824 -4.897 1.00 44.05 N ATOM 1792 CD2 HIS A 435 -5.902 -18.720 -5.857 1.00 45.18 C ATOM 1793 CE1 HIS A 435 -5.871 -16.540 -6.098 1.00 45.55 C ATOM 1794 NE2 HIS A 435 -6.183 -17.674 -6.702 1.00 40.39 N ATOM 1795 H HIS A 435 -5.863 -16.898 -2.047 1.00 0.00 H ATOM 1796 N LEU A 436 -4.766 -19.657 -0.398 1.00 44.60 N ATOM 1797 CA LEU A 436 -4.319 -20.579 0.639 1.00 43.05 C ATOM 1798 C LEU A 436 -5.500 -21.166 1.402 1.00 42.46 C ATOM 1799 O LEU A 436 -5.518 -22.364 1.708 1.00 43.29 O ATOM 1800 CB LEU A 436 -3.365 -19.866 1.596 1.00 44.98 C ATOM 1801 CG LEU A 436 -2.136 -20.662 2.035 1.00 50.11 C ATOM 1802 CD1 LEU A 436 -1.509 -20.038 3.274 1.00 51.99 C ATOM 1803 CD2 LEU A 436 -2.488 -22.122 2.273 1.00 52.82 C ATOM 1804 H LEU A 436 -4.445 -18.668 -0.382 1.00 0.00 H ATOM 1805 N PHE A 437 -6.498 -20.338 1.719 1.00 39.79 N ATOM 1806 CA PHE A 437 -7.665 -20.840 2.436 1.00 45.31 C ATOM 1807 C PHE A 437 -8.497 -21.765 1.559 1.00 45.87 C ATOM 1808 O PHE A 437 -9.031 -22.771 2.042 1.00 48.25 O ATOM 1809 CB PHE A 437 -8.513 -19.679 2.951 1.00 45.98 C ATOM 1810 CG PHE A 437 -7.989 -19.067 4.217 1.00 46.50 C ATOM 1811 CD1 PHE A 437 -8.107 -19.735 5.425 1.00 48.30 C ATOM 1812 CD2 PHE A 437 -7.377 -17.826 4.201 1.00 44.49 C ATOM 1813 CE1 PHE A 437 -7.625 -19.177 6.593 1.00 45.91 C ATOM 1814 CE2 PHE A 437 -6.893 -17.262 5.366 1.00 44.42 C ATOM 1815 CZ PHE A 437 -7.017 -17.938 6.563 1.00 44.38 C ATOM 1816 H PHE A 437 -6.443 -19.334 1.454 1.00 0.00 H ATOM 1817 N PHE A 438 -8.624 -21.444 0.270 1.00 46.47 N ATOM 1818 CA PHE A 438 -9.342 -22.338 -0.631 1.00 49.58 C ATOM 1819 C PHE A 438 -8.612 -23.667 -0.774 1.00 48.27 C ATOM 1820 O PHE A 438 -9.245 -24.728 -0.807 1.00 49.23 O ATOM 1821 CB PHE A 438 -9.537 -21.675 -1.994 1.00 53.89 C ATOM 1822 CG PHE A 438 -10.387 -22.478 -2.941 1.00 62.23 C ATOM 1823 CD1 PHE A 438 -11.747 -22.624 -2.716 1.00 66.43 C ATOM 1824 CD2 PHE A 438 -9.830 -23.083 -4.055 1.00 63.27 C ATOM 1825 CE1 PHE A 438 -12.533 -23.362 -3.583 1.00 68.30 C ATOM 1826 CE2 PHE A 438 -10.611 -23.821 -4.925 1.00 65.10 C ATOM 1827 CZ PHE A 438 -11.965 -23.960 -4.689 1.00 67.60 C ATOM 1828 H PHE A 438 -8.212 -20.560 -0.091 1.00 0.00 H ATOM 1829 N PHE A 439 -7.279 -23.631 -0.852 1.00 45.46 N ATOM 1830 CA PHE A 439 -6.506 -24.869 -0.893 1.00 46.84 C ATOM 1831 C PHE A 439 -6.771 -25.712 0.348 1.00 50.64 C ATOM 1832 O PHE A 439 -7.005 -26.922 0.255 1.00 53.48 O ATOM 1833 CB PHE A 439 -5.015 -24.556 -1.018 1.00 45.27 C ATOM 1834 CG PHE A 439 -4.664 -23.728 -2.221 1.00 44.09 C ATOM 1835 CD1 PHE A 439 -5.444 -23.772 -3.365 1.00 45.36 C ATOM 1836 CD2 PHE A 439 -3.552 -22.901 -2.205 1.00 42.05 C ATOM 1837 CE1 PHE A 439 -5.120 -23.007 -4.470 1.00 46.77 C ATOM 1838 CE2 PHE A 439 -3.222 -22.135 -3.307 1.00 42.79 C ATOM 1839 CZ PHE A 439 -4.007 -22.188 -4.442 1.00 44.10 C ATOM 1840 H PHE A 439 -6.788 -22.715 -0.884 1.00 0.00 H ATOM 1841 N LYS A 440 -6.735 -25.084 1.524 1.00 49.22 N ATOM 1842 CA LYS A 440 -7.031 -25.802 2.759 1.00 52.46 C ATOM 1843 C LYS A 440 -8.474 -26.290 2.772 1.00 55.28 C ATOM 1844 O LYS A 440 -8.745 -27.462 3.061 1.00 53.26 O ATOM 1845 CB LYS A 440 -6.754 -24.904 3.965 1.00 51.89 C ATOM 1846 CG LYS A 440 -7.225 -25.481 5.291 1.00 54.06 C ATOM 1847 CD LYS A 440 -7.177 -24.440 6.398 1.00 55.16 C ATOM 1848 CE LYS A 440 -7.750 -24.990 7.696 1.00 60.67 C ATOM 1849 NZ LYS A 440 -7.795 -23.958 8.769 1.00 60.97 N ATOM 1850 HZ1 LYS A 440 -6.832 -23.615 8.959 1.00 0.00 H ATOM 1851 HZ2 LYS A 440 -8.393 -23.165 8.460 1.00 0.00 H ATOM 1852 HZ3 LYS A 440 -8.192 -24.376 9.634 1.00 0.00 H ATOM 1853 H LYS A 440 -6.494 -24.073 1.561 1.00 0.00 H ATOM 1854 N LEU A 441 -9.418 -25.400 2.457 1.00 55.86 N ATOM 1855 CA LEU A 441 -10.828 -25.771 2.498 1.00 60.61 C ATOM 1856 C LEU A 441 -11.127 -26.919 1.543 1.00 68.01 C ATOM 1857 O LEU A 441 -11.843 -27.862 1.901 1.00 70.93 O ATOM 1858 CB LEU A 441 -11.700 -24.559 2.174 1.00 59.12 C ATOM 1859 CG LEU A 441 -13.207 -24.820 2.169 1.00 63.74 C ATOM 1860 CD1 LEU A 441 -13.660 -25.356 3.518 1.00 65.67 C ATOM 1861 CD2 LEU A 441 -13.969 -23.557 1.806 1.00 63.97 C ATOM 1862 H LEU A 441 -9.146 -24.435 2.180 1.00 0.00 H ATOM 1863 N ILE A 442 -10.587 -26.862 0.322 1.00 73.66 N ATOM 1864 CA ILE A 442 -10.812 -27.942 -0.632 1.00 83.93 C ATOM 1865 C ILE A 442 -10.120 -29.224 -0.195 1.00 90.42 C ATOM 1866 O ILE A 442 -10.438 -30.301 -0.711 1.00 95.24 O ATOM 1867 CB ILE A 442 -10.347 -27.536 -2.044 1.00 85.98 C ATOM 1868 CG1 ILE A 442 -8.832 -27.306 -2.064 1.00 88.61 C ATOM 1869 CG2 ILE A 442 -11.081 -26.296 -2.511 1.00 83.96 C ATOM 1870 CD1 ILE A 442 -8.314 -26.811 -3.399 1.00 89.72 C ATOM 1871 H ILE A 442 -10.004 -26.044 0.051 1.00 0.00 H ATOM 1872 N GLY A 443 -9.174 -29.139 0.738 1.00 93.90 N ATOM 1873 CA GLY A 443 -8.479 -30.307 1.233 1.00 98.41 C ATOM 1874 C GLY A 443 -7.678 -31.071 0.203 1.00101.61 C ATOM 1875 O GLY A 443 -7.142 -32.138 0.530 1.00105.13 O ATOM 1876 H GLY A 443 -8.927 -28.205 1.122 1.00 0.00 H ATOM 1877 N ASP A 444 -7.576 -30.574 -1.032 1.00 99.85 N ATOM 1878 CA ASP A 444 -6.839 -31.301 -2.057 1.00100.21 C ATOM 1879 C ASP A 444 -5.341 -31.065 -1.975 1.00 92.88 C ATOM 1880 O ASP A 444 -4.572 -31.881 -2.493 1.00 96.19 O ATOM 1881 CB ASP A 444 -7.324 -30.915 -3.458 1.00105.82 C ATOM 1882 CG ASP A 444 -6.322 -30.042 -4.205 1.00107.33 C ATOM 1883 OD1 ASP A 444 -5.556 -30.567 -5.044 1.00109.22 O ATOM 1884 OD2 ASP A 444 -6.302 -28.821 -3.952 1.00105.50 O ATOM 1885 H ASP A 444 -8.024 -29.665 -1.263 1.00 0.00 H ATOM 1886 N THR A 445 -4.911 -29.971 -1.338 1.00 81.87 N ATOM 1887 CA THR A 445 -3.505 -29.612 -1.335 1.00 74.33 C ATOM 1888 C THR A 445 -2.874 -29.878 0.026 1.00 72.27 C ATOM 1889 O THR A 445 -3.478 -29.567 1.059 1.00 67.68 O ATOM 1890 CB THR A 445 -3.321 -28.133 -1.693 1.00 68.35 C ATOM 1891 OG1 THR A 445 -4.031 -27.846 -2.905 1.00 69.28 O ATOM 1892 CG2 THR A 445 -1.847 -27.809 -1.884 1.00 66.63 C ATOM 1893 HG1 THR A 445 -4.993 -28.039 -2.776 1.00 0.00 H ATOM 1894 H THR A 445 -5.595 -29.368 -0.837 1.00 0.00 H ATOM 1895 N PRO A 446 -1.669 -30.447 0.061 1.00 72.81 N ATOM 1896 CA PRO A 446 -0.985 -30.666 1.346 1.00 70.71 C ATOM 1897 C PRO A 446 -0.509 -29.346 1.933 1.00 63.38 C ATOM 1898 O PRO A 446 0.245 -28.605 1.298 1.00 62.14 O ATOM 1899 CB PRO A 446 0.193 -31.577 0.973 1.00 57.97 C ATOM 1900 CG PRO A 446 -0.125 -32.102 -0.399 1.00 59.78 C ATOM 1901 CD PRO A 446 -0.924 -31.030 -1.064 1.00 57.37 C ATOM 1902 N ILE A 447 -0.959 -29.051 3.149 1.00 62.43 N ATOM 1903 CA ILE A 447 -0.546 -27.860 3.884 1.00 60.39 C ATOM 1904 C ILE A 447 0.253 -28.322 5.095 1.00 63.47 C ATOM 1905 O ILE A 447 -0.275 -29.028 5.963 1.00 67.33 O ATOM 1906 CB ILE A 447 -1.751 -27.005 4.306 1.00 59.42 C ATOM 1907 CG1 ILE A 447 -2.671 -26.753 3.109 1.00 59.70 C ATOM 1908 CG2 ILE A 447 -1.285 -25.687 4.904 1.00 57.00 C ATOM 1909 CD1 ILE A 447 -2.002 -26.027 1.965 1.00 59.92 C ATOM 1910 H ILE A 447 -1.637 -29.700 3.597 1.00 0.00 H ATOM 1911 N ASP A 448 1.523 -27.927 5.152 1.00 64.59 N ATOM 1912 CA ASP A 448 2.418 -28.388 6.202 1.00 68.20 C ATOM 1913 C ASP A 448 2.148 -27.644 7.510 1.00 64.61 C ATOM 1914 O ASP A 448 1.307 -26.744 7.589 1.00 61.71 O ATOM 1915 CB ASP A 448 3.872 -28.236 5.761 1.00 74.65 C ATOM 1916 CG ASP A 448 4.296 -29.310 4.776 1.00 83.27 C ATOM 1917 OD1 ASP A 448 4.953 -30.283 5.204 1.00 86.77 O ATOM 1918 OD2 ASP A 448 3.967 -29.186 3.577 1.00 85.55 O ATOM 1919 H ASP A 448 1.884 -27.273 4.428 1.00 0.00 H ATOM 1920 N THR A 449 2.893 -28.024 8.552 1.00 62.70 N ATOM 1921 CA THR A 449 2.583 -27.579 9.908 1.00 58.48 C ATOM 1922 C THR A 449 2.682 -26.063 10.040 1.00 52.95 C ATOM 1923 O THR A 449 1.726 -25.399 10.457 1.00 50.39 O ATOM 1924 CB THR A 449 3.517 -28.263 10.909 1.00 60.52 C ATOM 1925 OG1 THR A 449 4.869 -27.862 10.655 1.00 61.43 O ATOM 1926 CG2 THR A 449 3.412 -29.772 10.785 1.00 57.81 C ATOM 1927 HG1 THR A 449 5.471 -28.306 11.304 1.00 0.00 H ATOM 1928 H THR A 449 3.709 -28.649 8.394 1.00 0.00 H ATOM 1929 N PHE A 450 3.844 -25.497 9.707 1.00 47.82 N ATOM 1930 CA PHE A 450 4.051 -24.068 9.925 1.00 47.93 C ATOM 1931 C PHE A 450 3.080 -23.241 9.090 1.00 45.50 C ATOM 1932 O PHE A 450 2.477 -22.282 9.585 1.00 42.12 O ATOM 1933 CB PHE A 450 5.499 -23.691 9.611 1.00 44.85 C ATOM 1934 CG PHE A 450 5.986 -22.481 10.361 1.00 49.29 C ATOM 1935 CD1 PHE A 450 5.094 -21.653 11.023 1.00 42.92 C ATOM 1936 CD2 PHE A 450 7.335 -22.176 10.407 1.00 43.80 C ATOM 1937 CE1 PHE A 450 5.539 -20.542 11.713 1.00 42.25 C ATOM 1938 CE2 PHE A 450 7.785 -21.065 11.097 1.00 43.04 C ATOM 1939 CZ PHE A 450 6.885 -20.248 11.750 1.00 42.28 C ATOM 1940 H PHE A 450 4.603 -26.074 9.292 1.00 0.00 H ATOM 1941 N LEU A 451 2.916 -23.597 7.814 1.00 46.36 N ATOM 1942 CA LEU A 451 1.956 -22.885 6.978 1.00 46.55 C ATOM 1943 C LEU A 451 0.540 -23.046 7.515 1.00 47.30 C ATOM 1944 O LEU A 451 -0.254 -22.098 7.489 1.00 47.68 O ATOM 1945 CB LEU A 451 2.047 -23.378 5.534 1.00 49.69 C ATOM 1946 CG LEU A 451 1.184 -22.640 4.510 1.00 47.11 C ATOM 1947 CD1 LEU A 451 1.572 -21.169 4.434 1.00 43.16 C ATOM 1948 CD2 LEU A 451 1.294 -23.299 3.146 1.00 48.49 C ATOM 1949 H LEU A 451 3.472 -24.381 7.417 1.00 0.00 H ATOM 1950 N MET A 452 0.205 -24.242 8.008 1.00 50.04 N ATOM 1951 CA MET A 452 -1.095 -24.446 8.640 1.00 50.52 C ATOM 1952 C MET A 452 -1.275 -23.529 9.842 1.00 47.64 C ATOM 1953 O MET A 452 -2.362 -22.982 10.061 1.00 45.00 O ATOM 1954 CB MET A 452 -1.251 -25.907 9.063 1.00 52.39 C ATOM 1955 CG MET A 452 -2.001 -26.773 8.072 1.00 56.40 C ATOM 1956 SD MET A 452 -3.750 -26.354 7.997 1.00 62.08 S ATOM 1957 CE MET A 452 -4.369 -27.682 6.967 1.00 64.61 C ATOM 1958 H MET A 452 0.876 -25.034 7.941 1.00 0.00 H ATOM 1959 N GLU A 453 -0.218 -23.352 10.637 1.00 47.52 N ATOM 1960 CA GLU A 453 -0.318 -22.500 11.817 1.00 49.92 C ATOM 1961 C GLU A 453 -0.645 -21.063 11.434 1.00 49.11 C ATOM 1962 O GLU A 453 -1.366 -20.366 12.158 1.00 48.95 O ATOM 1963 CB GLU A 453 0.981 -22.561 12.617 1.00 49.53 C ATOM 1964 CG GLU A 453 0.866 -22.022 14.030 1.00 49.42 C ATOM 1965 CD GLU A 453 2.182 -22.093 14.772 1.00 51.18 C ATOM 1966 OE1 GLU A 453 2.953 -21.111 14.718 1.00 51.48 O ATOM 1967 OE2 GLU A 453 2.453 -23.140 15.396 1.00 51.24 O ATOM 1968 H GLU A 453 0.682 -23.824 10.414 1.00 0.00 H ATOM 1969 N MET A 454 -0.120 -20.600 10.298 1.00 47.23 N ATOM 1970 CA MET A 454 -0.430 -19.249 9.847 1.00 45.86 C ATOM 1971 C MET A 454 -1.875 -19.131 9.381 1.00 49.09 C ATOM 1972 O MET A 454 -2.479 -18.059 9.502 1.00 47.37 O ATOM 1973 CB MET A 454 0.532 -18.833 8.734 1.00 43.31 C ATOM 1974 CG MET A 454 1.977 -18.702 9.190 1.00 42.32 C ATOM 1975 SD MET A 454 2.137 -17.601 10.608 1.00 46.07 S ATOM 1976 CE MET A 454 3.907 -17.338 10.641 1.00 48.10 C ATOM 1977 H MET A 454 0.511 -21.204 9.734 1.00 0.00 H ATOM 1978 N LEU A 455 -2.449 -20.217 8.860 1.00 55.03 N ATOM 1979 CA LEU A 455 -3.841 -20.210 8.425 1.00 56.71 C ATOM 1980 C LEU A 455 -4.827 -20.230 9.584 1.00 61.04 C ATOM 1981 O LEU A 455 -6.027 -20.049 9.355 1.00 63.48 O ATOM 1982 CB LEU A 455 -4.116 -21.409 7.517 1.00 58.27 C ATOM 1983 CG LEU A 455 -3.470 -21.396 6.134 1.00 59.54 C ATOM 1984 CD1 LEU A 455 -3.797 -22.681 5.391 1.00 62.34 C ATOM 1985 CD2 LEU A 455 -3.935 -20.183 5.347 1.00 60.06 C ATOM 1986 H LEU A 455 -1.891 -21.089 8.762 1.00 0.00 H ATOM 1987 N GLU A 456 -4.360 -20.451 10.807 1.00 66.63 N ATOM 1988 CA GLU A 456 -5.234 -20.594 11.961 1.00 72.08 C ATOM 1989 C GLU A 456 -5.352 -19.269 12.707 1.00 70.18 C ATOM 1990 O GLU A 456 -4.428 -18.453 12.715 1.00 66.44 O ATOM 1991 CB GLU A 456 -4.719 -21.696 12.889 1.00 77.97 C ATOM 1992 CG GLU A 456 -4.757 -23.081 12.246 1.00 84.28 C ATOM 1993 CD GLU A 456 -4.249 -24.181 13.159 1.00 90.93 C ATOM 1994 OE1 GLU A 456 -3.399 -23.894 14.027 1.00 92.01 O ATOM 1995 OE2 GLU A 456 -4.704 -25.335 13.006 1.00 94.04 O ATOM 1996 H GLU A 456 -3.332 -20.525 10.945 1.00 0.00 H ATOM 1997 N ALA A 457 -6.510 -19.063 13.330 1.00 74.93 N ATOM 1998 CA ALA A 457 -6.833 -17.767 13.901 1.00 79.15 C ATOM 1999 C ALA A 457 -6.032 -17.506 15.174 1.00 82.91 C ATOM 2000 O ALA A 457 -5.502 -18.432 15.791 1.00 85.74 O ATOM 2001 CB ALA A 457 -8.328 -17.674 14.197 1.00 83.63 C ATOM 2002 H ALA A 457 -7.194 -19.842 13.409 1.00 0.00 H ATOM 2003 N PRO A 458 -5.926 -16.233 15.583 1.00 83.38 N ATOM 2004 CA PRO A 458 -5.239 -15.811 16.807 1.00 86.55 C ATOM 2005 C PRO A 458 -6.038 -16.149 18.063 1.00 93.80 C ATOM 2006 O PRO A 458 -5.624 -15.775 19.160 1.00 96.67 O ATOM 2007 CB PRO A 458 -5.115 -14.295 16.630 1.00 82.90 C ATOM 2008 CG PRO A 458 -6.271 -13.933 15.766 1.00 81.88 C ATOM 2009 CD PRO A 458 -6.445 -15.085 14.818 1.00 80.93 C TER 2010 PRO A 458 HETATM 2011 O HOH 1 13.330 11.018 -1.398 1.00 48.53 O HETATM 2012 O HOH 2 -8.807 -9.872 -1.570 1.00 40.59 O HETATM 2013 O HOH 3 -10.187 -18.411 -0.025 1.00 45.56 O HETATM 2014 O HOH 4 0.022 -30.301 7.906 1.00 48.98 O HETATM 2015 O HOH 5 -5.894 -12.174 -9.070 1.00 28.85 O HETATM 2016 O HOH 6 -1.544 -8.491 2.803 1.00 55.28 O HETATM 2017 O HOH 7 10.123 -16.269 0.000 1.00 33.87 O HETATM 2018 O HOH 8 1.302 0.222 -5.799 1.00 44.05 O HETATM 2019 O HOH 9 6.344 1.953 -7.332 1.00 20.73 O HETATM 2020 O HOH 10 -8.960 -1.802 14.016 1.00 32.68 O HETATM 2021 O HOH 11 8.409 -10.985 -15.425 1.00 41.04 O HETATM 2022 O HOH 12 16.553 -8.361 16.086 1.00 35.06 O HETATM 2023 O HOH 13 14.238 -11.801 0.488 1.00 43.24 O HETATM 2024 O HOH 14 -3.583 -4.660 -10.321 1.00 50.17 O HETATM 2025 O HOH 15 11.942 -16.260 1.691 1.00 34.86 O HETATM 2026 O HOH 16 -4.534 -0.538 14.204 1.00 36.50 O HETATM 2027 O HOH 17 0.240 -26.639 12.380 1.00 47.02 O HETATM 2028 O HOH 18 1.724 -6.512 7.996 1.00 43.67 O HETATM 2029 O HOH 19 11.449 10.094 -4.036 1.00 37.37 O HETATM 2030 O HOH 20 16.774 -11.372 -3.616 1.00 40.48 O HETATM 2031 O HOH 21 -0.927 -10.477 13.651 1.00 38.88 O HETATM 2032 O HOH 22 24.978 -11.639 6.617 1.00 39.90 O HETATM 2033 O HOH 23 4.088 -7.176 9.882 1.00 31.56 O HETATM 2034 O HOH 24 15.353 8.849 -3.836 1.00 47.25 O HETATM 2035 O HOH 25 14.828 -12.645 -2.236 1.00 28.36 O HETATM 2036 O HOH 26 9.525 -13.144 -14.391 1.00 37.58 O HETATM 2037 O HOH 27 2.820 2.820 0.000 1.00 20.21 O HETATM 2038 O HOH 28 16.756 10.294 5.765 1.00 39.18 O HETATM 2039 O HOH 29 -1.751 -2.680 -7.482 1.00 36.30 O HETATM 2040 O HOH 30 18.816 -5.833 -8.676 1.00 43.27 O HETATM 2041 O HOH 31 2.359 -3.593 2.277 1.00 33.36 O HETATM 2042 O HOH 32 8.360 10.118 10.266 1.00 46.97 O HETATM 2043 O HOH 33 3.253 3.889 8.659 1.00 24.70 O HETATM 2044 O HOH 34 -3.795 -10.502 -13.369 1.00 39.30 O HETATM 2045 O HOH 35 20.986 4.711 10.871 1.00 53.41 O HETATM 2046 O HOH 36 1.199 -10.604 4.985 1.00 49.65 O HETATM 2047 O HOH 37 -5.616 -19.616 -14.414 1.00 37.98 O HETATM 2048 O HOH 38 22.307 3.112 7.236 1.00 46.48 O HETATM 2049 O HOH 39 2.610 -4.605 5.776 1.00 30.16 O HETATM 2050 O HOH 40 11.991 -16.373 4.356 1.00 38.16 O HETATM 2051 O HOH 41 -6.714 -17.485 -12.425 1.00 52.58 O HETATM 2052 O HOH 42 2.186 -0.245 5.413 1.00 40.85 O HETATM 2053 O HOH 43 -5.571 -16.546 -9.720 1.00 37.43 O HETATM 2054 O HOH 44 0.893 -25.729 15.530 1.00 43.74 O HETATM 2055 O HOH 45 -2.376 -16.842 -16.644 1.00 39.56 O HETATM 2056 O HOH 46 -7.493 -12.462 2.412 1.00 41.24 O HETATM 2057 O HOH 47 1.888 4.836 11.339 1.00 33.63 O HETATM 2058 O HOH 48 -0.856 -7.281 6.264 1.00 44.35 O HETATM 2059 O HOH 49 13.737 -14.371 4.389 1.00 40.19 O HETATM 2060 O HOH 50 -2.285 -4.031 8.270 1.00 41.14 O HETATM 2061 O HOH 51 23.913 4.640 -9.484 1.00 48.60 O HETATM 2062 O HOH 52 -1.200 -18.393 16.738 1.00 43.29 O HETATM 2063 O HOH 53 21.111 0.585 -16.469 1.00 49.28 O HETATM 2064 O HOH 54 12.275 -10.101 24.172 1.00 35.51 O HETATM 2065 O HOH 55 22.000 -9.130 10.466 1.00 43.05 O HETATM 2066 O HOH 56 -8.214 -8.306 -5.471 1.00 46.20 O HETATM 2067 O HOH 57 -4.753 -12.513 -15.909 1.00 42.63 O HETATM 2068 O HOH 58 10.751 1.030 -12.795 1.00 66.82 O HETATM 2069 O HOH 59 -0.689 -22.458 -20.556 1.00 50.07 O HETATM 2070 O HOH 60 -2.517 -11.458 11.555 1.00 35.47 O HETATM 2071 O HOH 61 16.399 -18.440 -1.108 1.00 50.83 O HETATM 2072 O HOH 62 -5.651 -1.338 16.881 1.00 40.18 O HETATM 2073 O HOH 63 -6.035 -14.375 -16.180 1.00 38.14 O HETATM 2074 O HOH 64 21.934 8.629 11.076 1.00 51.24 O HETATM 2075 O HOH 65 17.064 -15.879 20.474 1.00 44.73 O HETATM 2076 O HOH 66 12.485 -23.029 22.296 1.00 42.80 O HETATM 2077 O HOH 67 17.373 -16.241 22.649 1.00 45.16 O HETATM 2078 O HOH 68 1.098 -18.373 16.799 1.00 53.03 O HETATM 2079 C12 UNN A 69 2.947 -17.894 -2.397 1.00 0.01 C HETATM 2080 C11 UNN A 69 4.191 -18.480 -2.593 1.00 -0.05 C HETATM 2081 C05 UNN A 69 5.191 -18.334 -1.641 1.00 -0.03 C HETATM 2082 C04 UNN A 69 4.948 -17.602 -0.491 1.00 -0.06 C HETATM 2083 C03 UNN A 69 3.711 -17.014 -0.294 1.00 -0.03 C HETATM 2084 C02 UNN A 69 2.715 -17.157 -1.244 1.00 0.10 C HETATM 2085 O01 UNN A 69 1.468 -16.558 -1.028 1.00 -0.33 O HETATM 2086 H5 UNN A 69 0.795 -17.228 -1.009 1.00 0.25 H HETATM 2087 H6 UNN A 69 3.522 -16.440 0.606 1.00 0.06 H HETATM 2088 H7 UNN A 69 5.727 -17.490 0.255 1.00 0.06 H HETATM 2089 C06 UNN A 69 6.564 -18.977 -1.846 1.00 -0.05 C HETATM 2090 C07 UNN A 69 7.656 -18.284 -1.588 1.00 -0.03 C HETATM 2091 C08 UNN A 69 9.039 -18.902 -1.785 1.00 0.05 C HETATM 2092 O09 UNN A 69 9.162 -20.023 -2.342 1.00 -0.57 O HETATM 2093 O10 UNN A 69 10.062 -18.281 -1.394 1.00 -0.57 O HETATM 2094 H9 UNN A 69 7.571 -17.259 -1.230 1.00 0.06 H HETATM 2095 H8 UNN A 69 6.639 -20.003 -2.204 1.00 0.07 H HETATM 2096 H1 UNN A 69 4.382 -19.054 -3.493 1.00 0.06 H HETATM 2097 C13 UNN A 69 1.840 -18.050 -3.447 1.00 0.00 C HETATM 2098 C14 UNN A 69 2.109 -17.812 -4.787 1.00 -0.06 C HETATM 2099 C15 UNN A 69 1.105 -17.949 -5.734 1.00 -0.04 C HETATM 2100 C16 UNN A 69 1.402 -17.692 -7.209 1.00 0.00 C HETATM 2101 C17 UNN A 69 1.946 -16.287 -7.459 1.00 -0.08 C HETATM 2102 C18 UNN A 69 3.055 -16.120 -8.147 1.00 -0.12 C HETATM 2103 H12 UNN A 69 3.440 -15.117 -8.324 1.00 0.03 H HETATM 2104 H13 UNN A 69 3.587 -16.985 -8.540 1.00 0.03 H HETATM 2105 H3 UNN A 69 1.415 -15.421 -7.067 1.00 0.07 H HETATM 2106 H10 UNN A 69 0.472 -17.818 -7.783 1.00 0.06 H HETATM 2107 H11 UNN A 69 2.147 -18.425 -7.552 1.00 0.06 H HETATM 2108 C19 UNN A 69 -0.171 -18.325 -5.348 1.00 -0.07 C HETATM 2109 C20 UNN A 69 -0.445 -18.561 -4.012 1.00 -0.04 C HETATM 2110 C21 UNN A 69 0.559 -18.427 -3.063 1.00 0.09 C HETATM 2111 O22 UNN A 69 0.282 -18.663 -1.709 1.00 -0.32 O HETATM 2112 C23 UNN A 69 -0.216 -19.937 -1.410 1.00 0.07 C HETATM 2113 C24 UNN A 69 0.635 -20.513 -0.281 1.00 -0.03 C HETATM 2114 C25 UNN A 69 0.846 -19.509 0.849 1.00 -0.06 C HETATM 2115 H19 UNN A 69 1.462 -19.967 1.636 1.00 0.02 H HETATM 2116 H20 UNN A 69 -0.129 -19.219 1.269 1.00 0.02 H HETATM 2117 H21 UNN A 69 1.356 -18.617 0.457 1.00 0.02 H HETATM 2118 H17 UNN A 69 1.616 -20.801 -0.688 1.00 0.03 H HETATM 2119 H18 UNN A 69 0.131 -21.403 0.125 1.00 0.03 H HETATM 2120 H15 UNN A 69 -0.149 -20.584 -2.297 1.00 0.06 H HETATM 2121 H16 UNN A 69 -1.265 -19.863 -1.088 1.00 0.06 H HETATM 2122 H4 UNN A 69 -1.444 -18.851 -3.707 1.00 0.05 H HETATM 2123 H14 UNN A 69 -0.953 -18.434 -6.090 1.00 0.05 H HETATM 2124 H2 UNN A 69 3.106 -17.518 -5.095 1.00 0.05 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 141 142 149 150 151 CONECT 149 141 CONECT 150 141 CONECT 151 141 CONECT 2079 2080 2084 2097 CONECT 2080 2079 2081 2096 CONECT 2081 2080 2082 2089 CONECT 2082 2081 2083 2088 CONECT 2083 2082 2084 2087 CONECT 2084 2079 2083 2085 CONECT 2085 2084 2086 CONECT 2086 2085 CONECT 2087 2083 CONECT 2088 2082 CONECT 2089 2081 2090 2095 CONECT 2090 2089 2091 2094 CONECT 2091 2090 2092 2093 CONECT 2092 2091 CONECT 2093 2091 CONECT 2094 2090 CONECT 2095 2089 CONECT 2096 2080 CONECT 2097 2079 2098 2110 CONECT 2098 2097 2099 2124 CONECT 2099 2098 2100 2108 CONECT 2100 2099 2101 2106 2107 CONECT 2101 2100 2102 2105 CONECT 2102 2101 2103 2104 CONECT 2103 2102 CONECT 2104 2102 CONECT 2105 2101 CONECT 2106 2100 CONECT 2107 2100 CONECT 2108 2099 2109 2123 CONECT 2109 2108 2110 2122 CONECT 2110 2097 2109 2111 CONECT 2111 2110 2112 CONECT 2112 2111 2113 2120 2121 CONECT 2113 2112 2114 2118 2119 CONECT 2114 2113 2115 2116 2117 CONECT 2115 2114 CONECT 2116 2114 CONECT 2117 2114 CONECT 2118 2113 CONECT 2119 2113 CONECT 2120 2112 CONECT 2121 2112 CONECT 2122 2109 CONECT 2123 2108 CONECT 2124 2098 MASTER 0 0 0 0 0 0 0 0 2122 2 54 18 END
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Related entries of code: 5mkj
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5mkj
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Retinoic acid receptor RXR-alpha
Ligand Name
4CU
EC.Number
E.C.-.-.-.-
Resolution
2.5(Å)
Affinity (Kd/Ki/IC50)
IC50=48.5uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) ACS Chem Neurosci Vol. 8: pp. 2065-2077
Ligand Properties
Formula
C
2
1
H
2
2
O
4
Molecular Weight
338.397
Exact Mass
338.152
No. of atoms
47
No. of bonds
48
Polar Surface Area
66.76
LOGP Value
6.38 (
Computed with XLOGP3
)
4.67 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 2
Canonical SMILES
CCCOc1ccc(cc1c1cc(/C=C/C(=O)O)ccc1O)CC=C
InChI String
InChI=1S/C21H22O4/c1-3-5-15-7-10-20(25-12-4-2)18(14-15)17-13-16(6-9-19(17)22)8-11-21(23)24/h3,6-11,13-14,22H,1,4-5,12H2,2H3,(H,23,24)/b11-8+
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):
P19793
Entrez Gene ID
NCBI Entrez Gene ID:
6256
ASD
Information of known allosteric effects of PDB entries
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