Browse entries in the PDBbind-CN Database
HEADER 5JSJ_COMPLEX COMPND 5JSJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 147 SER ARG ARG ASN ILE VAL GLY CYS ARG ILE GLN HIS GLY SEQRES 2 A 147 TRP LYS GLU GLY ASN GLY PRO VAL THR GLN TRP LYS GLY SEQRES 3 A 147 THR VAL LEU ASP GLN VAL PRO VAL ASN PRO SER LEU TYR SEQRES 4 A 147 LEU ILE LYS TYR ASP GLY PHE ASP CYS VAL TYR GLY LEU SEQRES 5 A 147 GLU LEU ASN LYS ASP GLU ARG VAL SER ALA LEU GLU VAL SEQRES 6 A 147 LEU PRO ASP ARG VAL ALA THR SER ARG ILE SER ASP ALA SEQRES 7 A 147 HIS LEU ALA ASP THR MET ILE GLY LYS ALA VAL GLU HIS SEQRES 8 A 147 MET PHE GLU THR GLU ASP GLY SER LYS ASP GLU TRP ARG SEQRES 9 A 147 GLY MET VAL LEU ALA ARG ALA PRO VAL MET ASN THR TRP SEQRES 10 A 147 PHE TYR ILE THR TYR GLU LYS ASP PRO VAL LEU TYR MET SEQRES 11 A 147 TYR GLN LEU LEU ASP ASP TYR LYS GLU GLY ASP LEU ARG SEQRES 12 A 147 ILE MET PRO ASP SEQRES 1 A 48 SER LEU VAL GLY LYS GLN VAL GLU TYR ALA LYS GLU ASP SEQRES 2 A 48 GLY SER LYS ARG THR GLY MET VAL ILE HIS GLN VAL GLU SEQRES 3 A 48 ALA LYS PRO SER VAL TYR PHE ILE LYS PHE ASP ASP ASP SEQRES 4 A 48 PHE HIS ILE TYR VAL TYR ASP LEU VAL HET MG A 1 1 HET UNN A 234 113 ATOM 1 N SER A 49 28.661 -25.663 16.375 1.00 75.35 N ATOM 2 CA SER A 49 27.398 -25.096 15.891 1.00 78.43 C ATOM 3 C SER A 49 27.617 -24.080 14.763 1.00 77.35 C ATOM 4 O SER A 49 27.940 -24.461 13.637 1.00 79.77 O ATOM 5 CB SER A 49 26.615 -24.447 17.044 1.00 78.34 C ATOM 6 OG SER A 49 25.807 -25.398 17.728 1.00 76.77 O ATOM 7 HG SER A 49 25.318 -24.947 18.462 1.00 0.00 H ATOM 8 HN3 SER A 49 29.266 -24.899 16.739 1.00 0.00 H ATOM 9 HN2 SER A 49 29.145 -26.147 15.592 1.00 0.00 H ATOM 10 HN1 SER A 49 28.465 -26.344 17.136 1.00 0.00 H ATOM 11 N ARG A 50 27.444 -22.792 15.055 1.00 76.59 N ATOM 12 CA ARG A 50 27.497 -21.748 14.039 1.00 73.91 C ATOM 13 C ARG A 50 28.703 -20.835 14.247 1.00 73.42 C ATOM 14 O ARG A 50 29.110 -20.567 15.383 1.00 75.74 O ATOM 15 CB ARG A 50 26.204 -20.915 14.026 1.00 72.77 C ATOM 16 CG ARG A 50 25.349 -21.002 15.289 1.00 78.87 C ATOM 17 CD ARG A 50 24.253 -22.071 15.161 1.00 79.66 C ATOM 18 NE ARG A 50 23.123 -21.792 16.051 1.00 82.28 N ATOM 19 CZ ARG A 50 21.920 -22.352 15.944 1.00 77.16 C ATOM 20 NH1 ARG A 50 21.673 -23.229 14.975 1.00 77.62 N ATOM 21 NH2 ARG A 50 20.959 -22.028 16.805 1.00 71.42 N ATOM 22 HE ARG A 50 23.271 -21.108 16.821 1.00 0.00 H ATOM 23 HH12 ARG A 50 20.732 -23.664 14.895 1.00 0.00 H ATOM 24 HH11 ARG A 50 22.421 -23.480 14.297 1.00 0.00 H ATOM 25 HH22 ARG A 50 20.019 -22.464 16.723 1.00 0.00 H ATOM 26 HH21 ARG A 50 21.148 -21.338 17.560 1.00 0.00 H ATOM 27 H ARG A 50 27.265 -22.522 16.043 1.00 0.00 H ATOM 28 N ARG A 51 29.263 -20.351 13.141 1.00 65.71 N ATOM 29 CA ARG A 51 30.383 -19.424 13.188 1.00 67.18 C ATOM 30 C ARG A 51 29.888 -17.992 13.400 1.00 66.11 C ATOM 31 O ARG A 51 28.686 -17.718 13.454 1.00 65.21 O ATOM 32 CB ARG A 51 31.207 -19.529 11.909 1.00 66.62 C ATOM 33 CG ARG A 51 30.364 -19.875 10.697 1.00 72.60 C ATOM 34 CD ARG A 51 31.155 -19.744 9.419 1.00 77.84 C ATOM 35 NE ARG A 51 30.461 -20.357 8.289 1.00 78.52 N ATOM 36 CZ ARG A 51 30.762 -20.136 7.012 1.00 82.81 C ATOM 37 NH1 ARG A 51 31.746 -19.303 6.689 1.00 79.13 N ATOM 38 NH2 ARG A 51 30.072 -20.743 6.054 1.00 79.83 N ATOM 39 HE ARG A 51 29.679 -21.010 8.497 1.00 0.00 H ATOM 40 HH12 ARG A 51 31.977 -19.134 5.689 1.00 0.00 H ATOM 41 HH11 ARG A 51 32.285 -18.820 7.436 1.00 0.00 H ATOM 42 HH22 ARG A 51 30.306 -20.571 5.055 1.00 0.00 H ATOM 43 HH21 ARG A 51 29.297 -21.391 6.302 1.00 0.00 H ATOM 44 H ARG A 51 28.889 -20.644 12.216 1.00 0.00 H ATOM 45 N ASN A 52 30.834 -17.064 13.514 1.00 60.11 N ATOM 46 CA ASN A 52 30.531 -15.669 13.798 1.00 58.21 C ATOM 47 C ASN A 52 30.362 -14.915 12.482 1.00 58.05 C ATOM 48 O ASN A 52 31.314 -14.788 11.707 1.00 63.44 O ATOM 49 CB ASN A 52 31.642 -15.056 14.646 1.00 60.33 C ATOM 50 CG ASN A 52 31.403 -13.594 14.949 1.00 60.49 C ATOM 51 OD1 ASN A 52 30.262 -13.134 15.023 1.00 62.80 O ATOM 52 ND2 ASN A 52 32.485 -12.852 15.121 1.00 65.61 N ATOM 53 HD22 ASN A 52 33.428 -13.284 15.049 1.00 0.00 H ATOM 54 HD21 ASN A 52 32.392 -11.837 15.328 1.00 0.00 H ATOM 55 H ASN A 52 31.828 -17.346 13.396 1.00 0.00 H ATOM 56 N ILE A 53 29.153 -14.426 12.223 1.00 52.75 N ATOM 57 CA ILE A 53 28.824 -13.840 10.932 1.00 49.70 C ATOM 58 C ILE A 53 28.770 -12.314 10.966 1.00 48.37 C ATOM 59 O ILE A 53 28.405 -11.698 9.956 1.00 47.80 O ATOM 60 CB ILE A 53 27.505 -14.419 10.389 1.00 49.55 C ATOM 61 CG1 ILE A 53 26.360 -14.123 11.351 1.00 54.14 C ATOM 62 CG2 ILE A 53 27.607 -15.947 10.181 1.00 52.38 C ATOM 63 CD1 ILE A 53 25.013 -14.627 10.875 1.00 47.17 C ATOM 64 H ILE A 53 28.423 -14.463 12.963 1.00 0.00 H ATOM 65 N VAL A 54 29.140 -11.678 12.077 1.00 47.56 N ATOM 66 CA VAL A 54 29.160 -10.220 12.100 1.00 48.00 C ATOM 67 C VAL A 54 30.285 -9.722 11.209 1.00 43.90 C ATOM 68 O VAL A 54 31.434 -10.159 11.330 1.00 50.59 O ATOM 69 CB VAL A 54 29.306 -9.691 13.533 1.00 49.59 C ATOM 70 CG1 VAL A 54 29.583 -8.187 13.514 1.00 43.36 C ATOM 71 CG2 VAL A 54 28.055 -9.974 14.324 1.00 41.19 C ATOM 72 H VAL A 54 29.413 -12.218 12.923 1.00 0.00 H ATOM 73 N GLY A 55 29.964 -8.792 10.318 1.00 45.01 N ATOM 74 CA GLY A 55 30.909 -8.325 9.331 1.00 39.98 C ATOM 75 C GLY A 55 30.847 -9.059 8.014 1.00 40.82 C ATOM 76 O GLY A 55 31.464 -8.606 7.044 1.00 45.91 O ATOM 77 H GLY A 55 29.006 -8.389 10.331 1.00 0.00 H ATOM 78 N CYS A 56 30.112 -10.165 7.945 1.00 42.46 N ATOM 79 CA CYS A 56 30.006 -10.996 6.756 1.00 43.86 C ATOM 80 C CYS A 56 28.741 -10.683 5.969 1.00 44.11 C ATOM 81 O CYS A 56 27.748 -10.185 6.502 1.00 41.73 O ATOM 82 CB CYS A 56 30.002 -12.489 7.124 1.00 43.40 C ATOM 83 SG CYS A 56 31.427 -13.026 8.088 1.00 58.30 S ATOM 84 H CYS A 56 29.581 -10.453 8.792 1.00 0.00 H ATOM 85 N ARG A 57 28.797 -11.005 4.679 1.00 46.61 N ATOM 86 CA ARG A 57 27.653 -11.009 3.784 1.00 43.26 C ATOM 87 C ARG A 57 26.995 -12.380 3.793 1.00 47.69 C ATOM 88 O ARG A 57 27.639 -13.400 4.056 1.00 50.17 O ATOM 89 CB ARG A 57 28.080 -10.659 2.363 1.00 46.61 C ATOM 90 CG ARG A 57 28.954 -9.416 2.275 1.00 50.67 C ATOM 91 CD ARG A 57 28.264 -8.314 1.534 1.00 45.74 C ATOM 92 NE ARG A 57 27.607 -8.798 0.327 1.00 47.50 N ATOM 93 CZ ARG A 57 26.404 -8.390 -0.051 1.00 46.60 C ATOM 94 NH1 ARG A 57 25.751 -7.508 0.694 1.00 49.12 N ATOM 95 NH2 ARG A 57 25.855 -8.852 -1.159 1.00 44.89 N ATOM 96 HE ARG A 57 28.104 -9.494 -0.264 1.00 0.00 H ATOM 97 HH12 ARG A 57 24.807 -7.182 0.406 1.00 0.00 H ATOM 98 HH11 ARG A 57 26.183 -7.143 1.566 1.00 0.00 H ATOM 99 HH22 ARG A 57 24.910 -8.525 -1.447 1.00 0.00 H ATOM 100 HH21 ARG A 57 26.367 -9.543 -1.744 1.00 0.00 H ATOM 101 H ARG A 57 29.722 -11.272 4.285 1.00 0.00 H ATOM 102 N ILE A 58 25.698 -12.399 3.493 1.00 46.01 N ATOM 103 CA ILE A 58 24.897 -13.610 3.561 1.00 40.71 C ATOM 104 C ILE A 58 23.885 -13.570 2.434 1.00 43.12 C ATOM 105 O ILE A 58 23.587 -12.514 1.874 1.00 43.27 O ATOM 106 CB ILE A 58 24.146 -13.772 4.902 1.00 41.29 C ATOM 107 CG1 ILE A 58 23.120 -12.642 5.049 1.00 46.93 C ATOM 108 CG2 ILE A 58 25.124 -13.822 6.073 1.00 41.24 C ATOM 109 CD1 ILE A 58 22.206 -12.757 6.256 1.00 44.91 C ATOM 110 H ILE A 58 25.240 -11.513 3.199 1.00 0.00 H ATOM 111 N GLN A 59 23.353 -14.747 2.106 1.00 43.14 N ATOM 112 CA GLN A 59 22.125 -14.837 1.337 1.00 47.36 C ATOM 113 C GLN A 59 21.238 -15.894 1.959 1.00 43.82 C ATOM 114 O GLN A 59 21.720 -16.822 2.602 1.00 48.17 O ATOM 115 CB GLN A 59 22.372 -15.143 -0.147 1.00 53.17 C ATOM 116 CG GLN A 59 23.100 -16.426 -0.474 1.00 56.19 C ATOM 117 CD GLN A 59 23.422 -16.533 -1.956 1.00 61.00 C ATOM 118 OE1 GLN A 59 22.814 -15.861 -2.791 1.00 64.73 O ATOM 119 NE2 GLN A 59 24.390 -17.373 -2.288 1.00 73.58 N ATOM 120 HE22 GLN A 59 24.878 -17.921 -1.551 1.00 0.00 H ATOM 121 HE21 GLN A 59 24.662 -17.484 -3.285 1.00 0.00 H ATOM 122 H GLN A 59 23.829 -15.621 2.408 1.00 0.00 H ATOM 123 N HIS A 60 19.932 -15.726 1.792 1.00 46.13 N ATOM 124 CA HIS A 60 18.987 -16.707 2.308 1.00 44.76 C ATOM 125 C HIS A 60 17.657 -16.565 1.586 1.00 46.81 C ATOM 126 O HIS A 60 17.350 -15.518 1.010 1.00 48.68 O ATOM 127 CB HIS A 60 18.790 -16.564 3.818 1.00 43.18 C ATOM 128 CG HIS A 60 18.151 -15.272 4.230 1.00 49.29 C ATOM 129 ND1 HIS A 60 16.785 -15.075 4.217 1.00 44.77 N ATOM 130 CD2 HIS A 60 18.696 -14.111 4.670 1.00 49.03 C ATOM 131 CE1 HIS A 60 16.516 -13.849 4.635 1.00 44.47 C ATOM 132 NE2 HIS A 60 17.658 -13.242 4.911 1.00 44.37 N ATOM 133 H HIS A 60 19.580 -14.887 1.288 1.00 0.00 H ATOM 134 N GLY A 61 16.867 -17.649 1.625 1.00 43.64 N ATOM 135 CA GLY A 61 15.492 -17.574 1.182 1.00 46.22 C ATOM 136 C GLY A 61 14.563 -17.036 2.261 1.00 47.40 C ATOM 137 O GLY A 61 14.852 -17.075 3.456 1.00 51.61 O ATOM 138 H GLY A 61 17.247 -18.551 1.977 1.00 0.00 H ATOM 139 N TRP A 62 13.415 -16.523 1.832 1.00 43.68 N ATOM 140 CA TRP A 62 12.447 -15.957 2.757 1.00 42.77 C ATOM 141 C TRP A 62 11.045 -16.259 2.256 1.00 42.58 C ATOM 142 O TRP A 62 10.773 -16.139 1.058 1.00 45.50 O ATOM 143 CB TRP A 62 12.664 -14.438 2.899 1.00 49.32 C ATOM 144 CG TRP A 62 11.755 -13.742 3.853 1.00 42.42 C ATOM 145 CD1 TRP A 62 10.673 -12.994 3.540 1.00 45.32 C ATOM 146 CD2 TRP A 62 11.856 -13.732 5.285 1.00 44.65 C ATOM 147 NE1 TRP A 62 10.092 -12.510 4.684 1.00 52.70 N ATOM 148 CE2 TRP A 62 10.796 -12.954 5.770 1.00 42.86 C ATOM 149 CE3 TRP A 62 12.743 -14.304 6.199 1.00 43.82 C ATOM 150 CZ2 TRP A 62 10.593 -12.729 7.127 1.00 43.89 C ATOM 151 CZ3 TRP A 62 12.532 -14.086 7.554 1.00 44.61 C ATOM 152 CH2 TRP A 62 11.469 -13.308 8.001 1.00 43.56 C ATOM 153 HE1 TRP A 62 9.249 -11.902 4.720 1.00 0.00 H ATOM 154 H TRP A 62 13.205 -16.526 0.814 1.00 0.00 H ATOM 155 N LYS A 63 10.158 -16.645 3.171 1.00 43.51 N ATOM 156 CA LYS A 63 8.794 -17.039 2.824 1.00 52.48 C ATOM 157 C LYS A 63 7.810 -16.213 3.640 1.00 54.73 C ATOM 158 O LYS A 63 7.655 -16.450 4.842 1.00 57.27 O ATOM 159 CB LYS A 63 8.577 -18.532 3.073 1.00 56.25 C ATOM 160 CG LYS A 63 7.233 -19.028 2.600 1.00 60.13 C ATOM 161 CD LYS A 63 6.969 -20.442 3.035 1.00 63.28 C ATOM 162 CE LYS A 63 5.599 -20.908 2.536 1.00 69.06 C ATOM 163 NZ LYS A 63 5.517 -20.930 1.039 1.00 68.18 N ATOM 164 HZ1 LYS A 63 5.687 -19.973 0.670 1.00 0.00 H ATOM 165 HZ2 LYS A 63 6.236 -21.581 0.663 1.00 0.00 H ATOM 166 HZ3 LYS A 63 4.571 -21.252 0.750 1.00 0.00 H ATOM 167 H LYS A 63 10.447 -16.667 4.170 1.00 0.00 H ATOM 168 N GLU A 64 7.139 -15.258 2.984 1.00 62.01 N ATOM 169 CA GLU A 64 6.130 -14.417 3.624 1.00 67.21 C ATOM 170 C GLU A 64 4.757 -15.041 3.441 1.00 66.18 C ATOM 171 O GLU A 64 4.337 -15.286 2.303 1.00 69.14 O ATOM 172 CB GLU A 64 6.122 -13.009 3.038 1.00 66.59 C ATOM 173 CG GLU A 64 7.329 -12.205 3.383 1.00 70.64 C ATOM 174 CD GLU A 64 7.098 -10.720 3.235 1.00 79.28 C ATOM 175 OE1 GLU A 64 6.072 -10.343 2.621 1.00 83.79 O ATOM 176 OE2 GLU A 64 7.939 -9.938 3.737 1.00 66.01 O ATOM 177 H GLU A 64 7.345 -15.108 1.976 1.00 0.00 H ATOM 178 N GLY A 65 4.048 -15.252 4.549 1.00 68.72 N ATOM 179 CA GLY A 65 2.750 -15.903 4.477 1.00 69.36 C ATOM 180 C GLY A 65 2.852 -17.164 3.661 1.00 69.41 C ATOM 181 O GLY A 65 3.800 -17.944 3.808 1.00 71.50 O ATOM 182 H GLY A 65 4.425 -14.950 5.470 1.00 0.00 H ATOM 183 N ASN A 66 1.889 -17.362 2.763 1.00 75.36 N ATOM 184 CA ASN A 66 1.918 -18.485 1.837 1.00 73.57 C ATOM 185 C ASN A 66 2.415 -18.074 0.459 1.00 69.43 C ATOM 186 O ASN A 66 2.139 -18.760 -0.533 1.00 67.67 O ATOM 187 CB ASN A 66 0.541 -19.130 1.742 1.00 74.14 C ATOM 188 CG ASN A 66 0.243 -20.025 2.921 1.00 91.39 C ATOM 189 OD1 ASN A 66 1.156 -20.568 3.548 1.00 95.85 O ATOM 190 ND2 ASN A 66 -1.037 -20.190 3.232 1.00100.92 N ATOM 191 HD22 ASN A 66 -1.773 -19.712 2.675 1.00 0.00 H ATOM 192 HD21 ASN A 66 -1.303 -20.797 4.033 1.00 0.00 H ATOM 193 H ASN A 66 1.092 -16.695 2.722 1.00 0.00 H ATOM 194 N GLY A 67 3.133 -16.963 0.378 1.00 63.50 N ATOM 195 CA GLY A 67 3.776 -16.574 -0.847 1.00 61.42 C ATOM 196 C GLY A 67 4.991 -17.431 -1.119 1.00 62.81 C ATOM 197 O GLY A 67 5.429 -18.226 -0.281 1.00 60.99 O ATOM 198 H GLY A 67 3.233 -16.360 1.219 1.00 0.00 H ATOM 199 N PRO A 68 5.568 -17.270 -2.300 1.00 60.19 N ATOM 200 CA PRO A 68 6.737 -18.063 -2.675 1.00 49.04 C ATOM 201 C PRO A 68 7.971 -17.637 -1.894 1.00 53.57 C ATOM 202 O PRO A 68 7.984 -16.631 -1.184 1.00 56.72 O ATOM 203 CB PRO A 68 6.898 -17.755 -4.165 1.00 54.82 C ATOM 204 CG PRO A 68 6.343 -16.383 -4.310 1.00 53.26 C ATOM 205 CD PRO A 68 5.225 -16.260 -3.317 1.00 51.77 C ATOM 206 N VAL A 69 9.030 -18.417 -2.064 1.00 54.66 N ATOM 207 CA VAL A 69 10.308 -18.123 -1.432 1.00 48.69 C ATOM 208 C VAL A 69 11.049 -17.096 -2.273 1.00 50.33 C ATOM 209 O VAL A 69 11.257 -17.293 -3.478 1.00 50.05 O ATOM 210 CB VAL A 69 11.150 -19.401 -1.276 1.00 50.92 C ATOM 211 CG1 VAL A 69 12.509 -19.058 -0.656 1.00 48.32 C ATOM 212 CG2 VAL A 69 10.418 -20.453 -0.455 1.00 43.31 C ATOM 213 H VAL A 69 8.945 -19.261 -2.665 1.00 0.00 H ATOM 214 N THR A 70 11.477 -16.009 -1.643 1.00 47.83 N ATOM 215 CA THR A 70 12.282 -15.024 -2.339 1.00 46.17 C ATOM 216 C THR A 70 13.709 -15.073 -1.812 1.00 44.78 C ATOM 217 O THR A 70 13.960 -15.517 -0.689 1.00 46.97 O ATOM 218 CB THR A 70 11.685 -13.616 -2.209 1.00 47.22 C ATOM 219 OG1 THR A 70 11.508 -13.288 -0.830 1.00 46.04 O ATOM 220 CG2 THR A 70 10.333 -13.548 -2.907 1.00 44.27 C ATOM 221 HG1 THR A 70 11.123 -12.379 -0.755 1.00 0.00 H ATOM 222 H THR A 70 11.233 -15.863 -0.643 1.00 0.00 H ATOM 223 N GLN A 71 14.639 -14.636 -2.656 1.00 42.70 N ATOM 224 CA GLN A 71 16.070 -14.681 -2.383 1.00 50.70 C ATOM 225 C GLN A 71 16.597 -13.287 -2.046 1.00 45.21 C ATOM 226 O GLN A 71 16.248 -12.314 -2.707 1.00 47.00 O ATOM 227 CB GLN A 71 16.814 -15.230 -3.598 1.00 50.06 C ATOM 228 CG GLN A 71 18.292 -15.476 -3.372 1.00 52.59 C ATOM 229 CD GLN A 71 18.544 -16.661 -2.474 1.00 56.96 C ATOM 230 OE1 GLN A 71 17.659 -17.492 -2.255 1.00 67.52 O ATOM 231 NE2 GLN A 71 19.759 -16.758 -1.952 1.00 62.68 N ATOM 232 HE22 GLN A 71 20.475 -16.034 -2.163 1.00 0.00 H ATOM 233 HE21 GLN A 71 19.996 -17.558 -1.331 1.00 0.00 H ATOM 234 H GLN A 71 14.327 -14.238 -3.565 1.00 0.00 H ATOM 235 N TRP A 72 17.451 -13.201 -1.029 1.00 44.27 N ATOM 236 CA TRP A 72 17.952 -11.933 -0.522 1.00 42.29 C ATOM 237 C TRP A 72 19.446 -12.030 -0.266 1.00 45.10 C ATOM 238 O TRP A 72 19.973 -13.113 -0.008 1.00 50.30 O ATOM 239 CB TRP A 72 17.233 -11.531 0.773 1.00 44.22 C ATOM 240 CG TRP A 72 15.751 -11.361 0.591 1.00 45.13 C ATOM 241 CD1 TRP A 72 14.811 -12.348 0.609 1.00 44.49 C ATOM 242 CD2 TRP A 72 15.040 -10.140 0.344 1.00 43.67 C ATOM 243 NE1 TRP A 72 13.565 -11.822 0.392 1.00 42.87 N ATOM 244 CE2 TRP A 72 13.674 -10.469 0.223 1.00 46.73 C ATOM 245 CE3 TRP A 72 15.419 -8.806 0.224 1.00 42.23 C ATOM 246 CZ2 TRP A 72 12.685 -9.505 -0.012 1.00 49.49 C ATOM 247 CZ3 TRP A 72 14.436 -7.852 -0.023 1.00 44.92 C ATOM 248 CH2 TRP A 72 13.091 -8.205 -0.132 1.00 43.22 C ATOM 249 HE1 TRP A 72 12.678 -12.364 0.361 1.00 0.00 H ATOM 250 H TRP A 72 17.775 -14.080 -0.576 1.00 0.00 H ATOM 251 N LYS A 73 20.130 -10.889 -0.358 1.00 41.44 N ATOM 252 CA LYS A 73 21.519 -10.745 0.060 1.00 38.95 C ATOM 253 C LYS A 73 21.622 -9.589 1.037 1.00 42.88 C ATOM 254 O LYS A 73 20.932 -8.574 0.893 1.00 44.49 O ATOM 255 CB LYS A 73 22.470 -10.450 -1.100 1.00 45.39 C ATOM 256 CG LYS A 73 22.701 -11.549 -2.089 1.00 49.25 C ATOM 257 CD LYS A 73 23.771 -11.118 -3.092 1.00 44.56 C ATOM 258 CE LYS A 73 24.133 -12.256 -4.046 1.00 60.02 C ATOM 259 NZ LYS A 73 24.948 -11.743 -5.199 1.00 71.57 N ATOM 260 HZ1 LYS A 73 24.399 -11.029 -5.719 1.00 0.00 H ATOM 261 HZ2 LYS A 73 25.824 -11.314 -4.839 1.00 0.00 H ATOM 262 HZ3 LYS A 73 25.183 -12.532 -5.834 1.00 0.00 H ATOM 263 H LYS A 73 19.646 -10.056 -0.750 1.00 0.00 H ATOM 264 N GLY A 74 22.514 -9.725 2.008 1.00 43.31 N ATOM 265 CA GLY A 74 22.658 -8.637 2.957 1.00 43.04 C ATOM 266 C GLY A 74 23.994 -8.694 3.654 1.00 43.46 C ATOM 267 O GLY A 74 24.746 -9.663 3.532 1.00 44.15 O ATOM 268 H GLY A 74 23.093 -10.585 2.087 1.00 0.00 H ATOM 269 N THR A 75 24.271 -7.627 4.395 1.00 40.09 N ATOM 270 CA THR A 75 25.461 -7.509 5.221 1.00 42.68 C ATOM 271 C THR A 75 25.040 -7.547 6.685 1.00 45.20 C ATOM 272 O THR A 75 24.136 -6.816 7.095 1.00 41.65 O ATOM 273 CB THR A 75 26.219 -6.217 4.891 1.00 45.01 C ATOM 274 OG1 THR A 75 26.655 -6.261 3.527 1.00 47.19 O ATOM 275 CG2 THR A 75 27.431 -6.025 5.797 1.00 43.49 C ATOM 276 HG1 THR A 75 27.145 -5.428 3.311 1.00 0.00 H ATOM 277 H THR A 75 23.600 -6.833 4.383 1.00 0.00 H ATOM 278 N VAL A 76 25.662 -8.435 7.453 1.00 44.90 N ATOM 279 CA VAL A 76 25.380 -8.577 8.878 1.00 40.98 C ATOM 280 C VAL A 76 26.145 -7.487 9.619 1.00 43.49 C ATOM 281 O VAL A 76 27.375 -7.497 9.658 1.00 45.27 O ATOM 282 CB VAL A 76 25.765 -9.970 9.388 1.00 41.74 C ATOM 283 CG1 VAL A 76 25.609 -10.032 10.887 1.00 44.46 C ATOM 284 CG2 VAL A 76 24.885 -11.007 8.756 1.00 44.37 C ATOM 285 H VAL A 76 26.378 -9.053 7.022 1.00 0.00 H ATOM 286 N LEU A 77 25.417 -6.550 10.217 1.00 46.99 N ATOM 287 CA LEU A 77 26.022 -5.410 10.895 1.00 43.90 C ATOM 288 C LEU A 77 26.354 -5.703 12.350 1.00 44.00 C ATOM 289 O LEU A 77 27.349 -5.185 12.874 1.00 45.59 O ATOM 290 CB LEU A 77 25.083 -4.201 10.827 1.00 42.78 C ATOM 291 CG LEU A 77 24.618 -3.809 9.423 1.00 41.77 C ATOM 292 CD1 LEU A 77 23.438 -2.845 9.450 1.00 38.19 C ATOM 293 CD2 LEU A 77 25.778 -3.211 8.655 1.00 44.03 C ATOM 294 H LEU A 77 24.380 -6.633 10.201 1.00 0.00 H ATOM 295 N ASP A 78 25.534 -6.511 13.019 1.00 44.37 N ATOM 296 CA ASP A 78 25.722 -6.740 14.442 1.00 45.59 C ATOM 297 C ASP A 78 24.959 -7.981 14.877 1.00 44.72 C ATOM 298 O ASP A 78 24.044 -8.443 14.195 1.00 44.30 O ATOM 299 CB ASP A 78 25.260 -5.535 15.256 1.00 43.14 C ATOM 300 CG ASP A 78 25.862 -5.505 16.644 1.00 54.26 C ATOM 301 OD1 ASP A 78 26.682 -6.392 16.970 1.00 52.89 O ATOM 302 OD2 ASP A 78 25.529 -4.574 17.412 1.00 61.73 O ATOM 303 H ASP A 78 24.753 -6.982 12.519 1.00 0.00 H ATOM 304 N GLN A 79 25.359 -8.503 16.032 1.00 43.19 N ATOM 305 CA GLN A 79 24.674 -9.576 16.737 1.00 47.06 C ATOM 306 C GLN A 79 24.309 -9.019 18.102 1.00 48.89 C ATOM 307 O GLN A 79 25.187 -8.558 18.835 1.00 46.43 O ATOM 308 CB GLN A 79 25.566 -10.822 16.858 1.00 46.06 C ATOM 309 CG GLN A 79 24.937 -12.029 17.556 1.00 49.27 C ATOM 310 CD GLN A 79 25.840 -13.276 17.526 1.00 51.94 C ATOM 311 OE1 GLN A 79 27.042 -13.185 17.275 1.00 59.72 O ATOM 312 NE2 GLN A 79 25.252 -14.440 17.778 1.00 52.11 N ATOM 313 HE22 GLN A 79 24.234 -14.474 17.986 1.00 0.00 H ATOM 314 HE21 GLN A 79 25.810 -15.318 17.768 1.00 0.00 H ATOM 315 H GLN A 79 26.223 -8.117 16.463 1.00 0.00 H ATOM 316 N VAL A 80 23.023 -9.050 18.439 1.00 48.92 N ATOM 317 CA VAL A 80 22.515 -8.325 19.604 1.00 49.61 C ATOM 318 C VAL A 80 22.976 -8.986 20.899 1.00 47.77 C ATOM 319 O VAL A 80 22.549 -10.104 21.213 1.00 53.31 O ATOM 320 CB VAL A 80 20.983 -8.205 19.552 1.00 45.95 C ATOM 321 CG1 VAL A 80 20.448 -7.710 20.880 1.00 47.88 C ATOM 322 CG2 VAL A 80 20.568 -7.289 18.413 1.00 40.13 C ATOM 323 H VAL A 80 22.361 -9.604 17.859 1.00 0.00 H ATOM 324 N PRO A 81 23.817 -8.311 21.689 1.00 52.19 N ATOM 325 CA PRO A 81 24.292 -8.899 22.958 1.00 51.93 C ATOM 326 C PRO A 81 23.216 -9.551 23.825 1.00 57.71 C ATOM 327 O PRO A 81 23.415 -10.671 24.311 1.00 56.75 O ATOM 328 CB PRO A 81 24.920 -7.688 23.662 1.00 54.56 C ATOM 329 CG PRO A 81 25.378 -6.805 22.541 1.00 51.71 C ATOM 330 CD PRO A 81 24.342 -6.948 21.470 1.00 49.62 C ATOM 331 N VAL A 82 22.077 -8.883 24.038 1.00 57.57 N ATOM 332 CA VAL A 82 21.062 -9.409 24.952 1.00 55.92 C ATOM 333 C VAL A 82 20.138 -10.425 24.301 1.00 58.12 C ATOM 334 O VAL A 82 19.207 -10.908 24.959 1.00 59.59 O ATOM 335 CB VAL A 82 20.227 -8.261 25.554 1.00 60.05 C ATOM 336 CG1 VAL A 82 21.137 -7.287 26.277 1.00 60.45 C ATOM 337 CG2 VAL A 82 19.424 -7.541 24.470 1.00 56.02 C ATOM 338 H VAL A 82 21.911 -7.980 23.549 1.00 0.00 H ATOM 339 N ASN A 83 20.348 -10.751 23.029 1.00 54.58 N ATOM 340 CA ASN A 83 19.636 -11.838 22.361 1.00 54.56 C ATOM 341 C ASN A 83 20.495 -12.266 21.182 1.00 58.60 C ATOM 342 O ASN A 83 20.280 -11.810 20.050 1.00 52.92 O ATOM 343 CB ASN A 83 18.237 -11.419 21.911 1.00 53.82 C ATOM 344 CG ASN A 83 17.527 -12.500 21.124 1.00 51.13 C ATOM 345 OD1 ASN A 83 18.087 -13.555 20.851 1.00 52.49 O ATOM 346 ND2 ASN A 83 16.277 -12.240 20.757 1.00 45.80 N ATOM 347 HD22 ASN A 83 15.839 -11.331 21.010 1.00 0.00 H ATOM 348 HD21 ASN A 83 15.736 -12.945 20.217 1.00 0.00 H ATOM 349 H ASN A 83 21.050 -10.209 22.486 1.00 0.00 H ATOM 350 N PRO A 84 21.475 -13.141 21.414 1.00 55.05 N ATOM 351 CA PRO A 84 22.468 -13.441 20.380 1.00 51.26 C ATOM 352 C PRO A 84 21.866 -14.157 19.189 1.00 52.98 C ATOM 353 O PRO A 84 22.547 -14.383 18.188 1.00 49.84 O ATOM 354 CB PRO A 84 23.476 -14.330 21.119 1.00 60.06 C ATOM 355 CG PRO A 84 23.279 -13.998 22.570 1.00 63.00 C ATOM 356 CD PRO A 84 21.808 -13.773 22.699 1.00 56.46 C ATOM 357 N SER A 85 20.601 -14.541 19.288 1.00 49.74 N ATOM 358 CA SER A 85 19.913 -15.076 18.125 1.00 50.92 C ATOM 359 C SER A 85 19.515 -13.991 17.137 1.00 50.29 C ATOM 360 O SER A 85 19.318 -14.292 15.956 1.00 47.72 O ATOM 361 CB SER A 85 18.680 -15.850 18.571 1.00 55.56 C ATOM 362 OG SER A 85 19.052 -16.815 19.544 1.00 65.92 O ATOM 363 HG SER A 85 18.249 -17.317 19.833 1.00 0.00 H ATOM 364 H SER A 85 20.102 -14.460 20.197 1.00 0.00 H ATOM 365 N LEU A 86 19.401 -12.750 17.592 1.00 45.08 N ATOM 366 CA LEU A 86 19.000 -11.634 16.741 1.00 46.87 C ATOM 367 C LEU A 86 20.213 -10.996 16.068 1.00 46.83 C ATOM 368 O LEU A 86 21.168 -10.595 16.742 1.00 43.30 O ATOM 369 CB LEU A 86 18.262 -10.583 17.569 1.00 46.43 C ATOM 370 CG LEU A 86 17.645 -9.386 16.847 1.00 43.75 C ATOM 371 CD1 LEU A 86 16.563 -9.816 15.880 1.00 43.51 C ATOM 372 CD2 LEU A 86 17.079 -8.458 17.873 1.00 39.67 C ATOM 373 H LEU A 86 19.605 -12.565 18.595 1.00 0.00 H ATOM 374 N TYR A 87 20.166 -10.893 14.742 1.00 44.56 N ATOM 375 CA TYR A 87 21.162 -10.154 13.974 1.00 45.22 C ATOM 376 C TYR A 87 20.538 -8.911 13.343 1.00 42.42 C ATOM 377 O TYR A 87 19.381 -8.940 12.914 1.00 41.89 O ATOM 378 CB TYR A 87 21.770 -11.037 12.883 1.00 44.50 C ATOM 379 CG TYR A 87 22.453 -12.263 13.425 1.00 50.44 C ATOM 380 CD1 TYR A 87 23.762 -12.200 13.878 1.00 44.35 C ATOM 381 CD2 TYR A 87 21.784 -13.482 13.504 1.00 49.08 C ATOM 382 CE1 TYR A 87 24.391 -13.306 14.383 1.00 47.74 C ATOM 383 CE2 TYR A 87 22.413 -14.611 14.002 1.00 47.07 C ATOM 384 CZ TYR A 87 23.719 -14.510 14.443 1.00 50.83 C ATOM 385 OH TYR A 87 24.374 -15.605 14.956 1.00 55.61 O ATOM 386 HH TYR A 87 25.293 -15.346 15.218 1.00 0.00 H ATOM 387 H TYR A 87 19.388 -11.358 14.233 1.00 0.00 H ATOM 388 N LEU A 88 21.309 -7.819 13.292 1.00 43.97 N ATOM 389 CA LEU A 88 20.922 -6.619 12.554 1.00 38.70 C ATOM 390 C LEU A 88 21.528 -6.667 11.159 1.00 39.92 C ATOM 391 O LEU A 88 22.741 -6.840 11.013 1.00 43.77 O ATOM 392 CB LEU A 88 21.383 -5.358 13.287 1.00 38.97 C ATOM 393 CG LEU A 88 20.944 -5.233 14.751 1.00 41.38 C ATOM 394 CD1 LEU A 88 21.182 -3.827 15.265 1.00 39.37 C ATOM 395 CD2 LEU A 88 19.487 -5.641 14.923 1.00 37.51 C ATOM 396 H LEU A 88 22.218 -7.824 13.797 1.00 0.00 H ATOM 397 N ILE A 89 20.690 -6.529 10.140 1.00 35.70 N ATOM 398 CA ILE A 89 21.099 -6.766 8.761 1.00 37.57 C ATOM 399 C ILE A 89 20.742 -5.566 7.900 1.00 40.03 C ATOM 400 O ILE A 89 19.674 -4.967 8.063 1.00 39.27 O ATOM 401 CB ILE A 89 20.417 -8.028 8.185 1.00 37.92 C ATOM 402 CG1 ILE A 89 20.557 -9.200 9.146 1.00 39.72 C ATOM 403 CG2 ILE A 89 20.977 -8.390 6.823 1.00 37.57 C ATOM 404 CD1 ILE A 89 19.715 -10.381 8.733 1.00 49.20 C ATOM 405 H ILE A 89 19.709 -6.242 10.331 1.00 0.00 H ATOM 406 N LYS A 90 21.599 -5.259 6.942 1.00 41.28 N ATOM 407 CA LYS A 90 21.271 -4.336 5.868 1.00 38.97 C ATOM 408 C LYS A 90 21.161 -5.144 4.583 1.00 43.50 C ATOM 409 O LYS A 90 22.166 -5.644 4.070 1.00 46.16 O ATOM 410 CB LYS A 90 22.321 -3.236 5.729 1.00 44.50 C ATOM 411 CG LYS A 90 22.027 -2.319 4.571 1.00 42.98 C ATOM 412 CD LYS A 90 23.185 -1.397 4.319 1.00 45.98 C ATOM 413 CE LYS A 90 23.180 -0.908 2.879 1.00 51.85 C ATOM 414 NZ LYS A 90 21.917 -0.221 2.500 1.00 44.42 N ATOM 415 HZ1 LYS A 90 21.119 -0.878 2.613 1.00 0.00 H ATOM 416 HZ2 LYS A 90 21.776 0.606 3.114 1.00 0.00 H ATOM 417 HZ3 LYS A 90 21.976 0.088 1.509 1.00 0.00 H ATOM 418 H LYS A 90 22.544 -5.694 6.957 1.00 0.00 H ATOM 419 N TYR A 91 19.946 -5.268 4.067 1.00 40.46 N ATOM 420 CA TYR A 91 19.733 -5.967 2.811 1.00 41.44 C ATOM 421 C TYR A 91 20.075 -5.055 1.645 1.00 44.78 C ATOM 422 O TYR A 91 19.819 -3.845 1.689 1.00 49.00 O ATOM 423 CB TYR A 91 18.288 -6.456 2.714 1.00 36.58 C ATOM 424 CG TYR A 91 18.034 -7.608 3.645 1.00 41.26 C ATOM 425 CD1 TYR A 91 18.371 -8.921 3.278 1.00 40.46 C ATOM 426 CD2 TYR A 91 17.500 -7.399 4.903 1.00 41.44 C ATOM 427 CE1 TYR A 91 18.154 -9.975 4.135 1.00 39.44 C ATOM 428 CE2 TYR A 91 17.286 -8.454 5.767 1.00 43.80 C ATOM 429 CZ TYR A 91 17.614 -9.737 5.375 1.00 40.81 C ATOM 430 OH TYR A 91 17.390 -10.783 6.232 1.00 43.35 O ATOM 431 HH TYR A 91 17.677 -11.627 5.803 1.00 0.00 H ATOM 432 H TYR A 91 19.133 -4.858 4.569 1.00 0.00 H ATOM 433 N ASP A 92 20.669 -5.643 0.610 1.00 45.13 N ATOM 434 CA ASP A 92 21.120 -4.877 -0.545 1.00 44.87 C ATOM 435 C ASP A 92 19.962 -4.103 -1.168 1.00 46.79 C ATOM 436 O ASP A 92 18.869 -4.634 -1.352 1.00 49.67 O ATOM 437 CB ASP A 92 21.730 -5.812 -1.590 1.00 46.96 C ATOM 438 CG ASP A 92 23.020 -6.502 -1.118 1.00 49.59 C ATOM 439 OD1 ASP A 92 23.504 -6.257 0.015 1.00 46.68 O ATOM 440 OD2 ASP A 92 23.559 -7.297 -1.920 1.00 44.77 O ATOM 441 H ASP A 92 20.815 -6.673 0.625 1.00 0.00 H ATOM 442 N GLY A 93 20.205 -2.849 -1.510 1.00 50.91 N ATOM 443 CA GLY A 93 19.199 -2.033 -2.152 1.00 52.24 C ATOM 444 C GLY A 93 18.232 -1.342 -1.221 1.00 51.66 C ATOM 445 O GLY A 93 17.384 -0.579 -1.701 1.00 54.52 O ATOM 446 H GLY A 93 21.141 -2.441 -1.313 1.00 0.00 H ATOM 447 N PHE A 94 18.313 -1.586 0.087 1.00 47.27 N ATOM 448 CA PHE A 94 17.416 -0.949 1.040 1.00 46.56 C ATOM 449 C PHE A 94 18.222 -0.431 2.217 1.00 47.50 C ATOM 450 O PHE A 94 19.227 -1.028 2.604 1.00 47.43 O ATOM 451 CB PHE A 94 16.347 -1.900 1.525 1.00 46.43 C ATOM 452 CG PHE A 94 15.590 -2.550 0.420 1.00 52.05 C ATOM 453 CD1 PHE A 94 14.524 -1.901 -0.170 1.00 47.20 C ATOM 454 CD2 PHE A 94 15.955 -3.811 -0.036 1.00 47.84 C ATOM 455 CE1 PHE A 94 13.826 -2.492 -1.186 1.00 49.60 C ATOM 456 CE2 PHE A 94 15.269 -4.407 -1.054 1.00 46.57 C ATOM 457 CZ PHE A 94 14.200 -3.753 -1.631 1.00 56.19 C ATOM 458 H PHE A 94 19.035 -2.248 0.435 1.00 0.00 H ATOM 459 N ASP A 95 17.769 0.672 2.800 1.00 42.52 N ATOM 460 CA ASP A 95 18.598 1.420 3.730 1.00 42.94 C ATOM 461 C ASP A 95 18.076 1.371 5.159 1.00 44.31 C ATOM 462 O ASP A 95 18.508 2.161 6.001 1.00 43.07 O ATOM 463 CB ASP A 95 18.731 2.857 3.239 1.00 37.23 C ATOM 464 CG ASP A 95 19.389 2.932 1.871 1.00 43.27 C ATOM 465 OD1 ASP A 95 20.412 2.241 1.654 1.00 44.41 O ATOM 466 OD2 ASP A 95 18.871 3.660 0.999 1.00 46.84 O ATOM 467 H ASP A 95 16.807 1.006 2.588 1.00 0.00 H ATOM 468 N CYS A 96 17.161 0.465 5.461 1.00 35.18 N ATOM 469 CA CYS A 96 16.808 0.258 6.855 1.00 40.56 C ATOM 470 C CYS A 96 17.603 -0.905 7.443 1.00 41.51 C ATOM 471 O CYS A 96 18.144 -1.761 6.729 1.00 44.46 O ATOM 472 CB CYS A 96 15.297 0.037 7.004 1.00 42.82 C ATOM 473 SG CYS A 96 14.379 1.588 6.666 1.00 43.68 S ATOM 474 H CYS A 96 16.701 -0.091 4.712 1.00 0.00 H ATOM 475 N VAL A 97 17.706 -0.900 8.767 1.00 40.52 N ATOM 476 CA VAL A 97 18.382 -1.956 9.502 1.00 39.88 C ATOM 477 C VAL A 97 17.318 -2.899 10.016 1.00 39.66 C ATOM 478 O VAL A 97 16.422 -2.490 10.761 1.00 42.80 O ATOM 479 CB VAL A 97 19.220 -1.395 10.655 1.00 40.25 C ATOM 480 CG1 VAL A 97 19.840 -2.520 11.439 1.00 37.29 C ATOM 481 CG2 VAL A 97 20.283 -0.451 10.126 1.00 39.24 C ATOM 482 H VAL A 97 17.287 -0.110 9.298 1.00 0.00 H ATOM 483 N TYR A 98 17.417 -4.161 9.635 1.00 45.38 N ATOM 484 CA TYR A 98 16.404 -5.149 9.948 1.00 42.65 C ATOM 485 C TYR A 98 16.925 -6.143 10.968 1.00 42.34 C ATOM 486 O TYR A 98 18.109 -6.503 10.959 1.00 39.57 O ATOM 487 CB TYR A 98 15.973 -5.871 8.691 1.00 37.30 C ATOM 488 CG TYR A 98 15.322 -4.949 7.700 1.00 42.08 C ATOM 489 CD1 TYR A 98 13.961 -4.685 7.764 1.00 38.34 C ATOM 490 CD2 TYR A 98 16.058 -4.362 6.688 1.00 37.80 C ATOM 491 CE1 TYR A 98 13.362 -3.873 6.853 1.00 36.09 C ATOM 492 CE2 TYR A 98 15.458 -3.544 5.776 1.00 37.78 C ATOM 493 CZ TYR A 98 14.108 -3.300 5.861 1.00 38.53 C ATOM 494 OH TYR A 98 13.500 -2.468 4.949 1.00 39.89 O ATOM 495 HH TYR A 98 12.534 -2.404 5.155 1.00 0.00 H ATOM 496 H TYR A 98 18.253 -4.456 9.091 1.00 0.00 H ATOM 497 N GLY A 99 16.037 -6.561 11.860 1.00 39.81 N ATOM 498 CA GLY A 99 16.396 -7.506 12.892 1.00 40.77 C ATOM 499 C GLY A 99 15.789 -8.857 12.605 1.00 46.01 C ATOM 500 O GLY A 99 14.562 -8.992 12.557 1.00 48.23 O ATOM 501 H GLY A 99 15.062 -6.201 11.816 1.00 0.00 H ATOM 502 N LEU A 100 16.633 -9.858 12.395 1.00 42.14 N ATOM 503 CA LEU A 100 16.176 -11.212 12.135 1.00 47.87 C ATOM 504 C LEU A 100 16.948 -12.192 12.996 1.00 44.63 C ATOM 505 O LEU A 100 18.166 -12.059 13.164 1.00 40.87 O ATOM 506 CB LEU A 100 16.325 -11.594 10.665 1.00 44.42 C ATOM 507 CG LEU A 100 15.185 -11.143 9.749 1.00 56.20 C ATOM 508 CD1 LEU A 100 15.329 -11.852 8.437 1.00 54.36 C ATOM 509 CD2 LEU A 100 13.804 -11.440 10.350 1.00 49.51 C ATOM 510 H LEU A 100 17.655 -9.667 12.417 1.00 0.00 H ATOM 511 N GLU A 101 16.212 -13.158 13.559 1.00 42.84 N ATOM 512 CA GLU A 101 16.808 -14.329 14.199 1.00 47.67 C ATOM 513 C GLU A 101 17.087 -15.302 13.076 1.00 46.84 C ATOM 514 O GLU A 101 16.267 -16.159 12.744 1.00 49.69 O ATOM 515 CB GLU A 101 15.897 -14.907 15.269 1.00 52.12 C ATOM 516 CG GLU A 101 15.834 -14.021 16.502 1.00 48.86 C ATOM 517 CD GLU A 101 14.872 -14.519 17.556 1.00 58.19 C ATOM 518 OE1 GLU A 101 14.273 -15.595 17.362 1.00 63.01 O ATOM 519 OE2 GLU A 101 14.707 -13.824 18.581 1.00 67.01 O ATOM 520 H GLU A 101 15.176 -13.072 13.540 1.00 0.00 H ATOM 521 N LEU A 102 18.269 -15.137 12.478 1.00 43.84 N ATOM 522 CA LEU A 102 18.618 -15.828 11.244 1.00 48.39 C ATOM 523 C LEU A 102 18.582 -17.349 11.381 1.00 51.06 C ATOM 524 O LEU A 102 18.341 -18.051 10.392 1.00 52.11 O ATOM 525 CB LEU A 102 20.001 -15.370 10.790 1.00 47.22 C ATOM 526 CG LEU A 102 19.992 -14.015 10.092 1.00 51.59 C ATOM 527 CD1 LEU A 102 21.416 -13.488 9.874 1.00 48.34 C ATOM 528 CD2 LEU A 102 19.242 -14.144 8.780 1.00 49.33 C ATOM 529 H LEU A 102 18.964 -14.494 12.908 1.00 0.00 H ATOM 530 N ASN A 103 18.809 -17.884 12.577 1.00 49.31 N ATOM 531 CA ASN A 103 18.864 -19.338 12.718 1.00 56.84 C ATOM 532 C ASN A 103 17.580 -19.954 13.247 1.00 55.28 C ATOM 533 O ASN A 103 17.269 -21.083 12.882 1.00 62.76 O ATOM 534 CB ASN A 103 20.027 -19.743 13.630 1.00 54.47 C ATOM 535 CG ASN A 103 21.366 -19.294 13.089 1.00 54.16 C ATOM 536 OD1 ASN A 103 21.697 -19.566 11.936 1.00 52.51 O ATOM 537 ND2 ASN A 103 22.139 -18.587 13.913 1.00 55.89 N ATOM 538 HD22 ASN A 103 21.817 -18.382 14.880 1.00 0.00 H ATOM 539 HD21 ASN A 103 23.065 -18.241 13.589 1.00 0.00 H ATOM 540 H ASN A 103 18.947 -17.272 13.407 1.00 0.00 H ATOM 541 N LYS A 104 16.827 -19.248 14.089 1.00 56.57 N ATOM 542 CA LYS A 104 15.557 -19.769 14.582 1.00 57.16 C ATOM 543 C LYS A 104 14.436 -19.558 13.575 1.00 61.66 C ATOM 544 O LYS A 104 13.693 -20.494 13.261 1.00 62.38 O ATOM 545 CB LYS A 104 15.176 -19.095 15.898 1.00 55.98 C ATOM 546 CG LYS A 104 16.173 -19.276 17.009 1.00 65.21 C ATOM 547 CD LYS A 104 15.741 -18.448 18.218 1.00 76.47 C ATOM 548 CE LYS A 104 16.633 -18.709 19.424 1.00 81.71 C ATOM 549 NZ LYS A 104 16.369 -17.758 20.550 1.00 74.50 N ATOM 550 HZ1 LYS A 104 16.542 -16.784 20.228 1.00 0.00 H ATOM 551 HZ2 LYS A 104 15.380 -17.852 20.857 1.00 0.00 H ATOM 552 HZ3 LYS A 104 17.002 -17.979 21.345 1.00 0.00 H ATOM 553 H LYS A 104 17.150 -18.310 14.400 1.00 0.00 H ATOM 554 N ASP A 105 14.299 -18.334 13.073 1.00 53.13 N ATOM 555 CA ASP A 105 13.130 -17.937 12.301 1.00 50.02 C ATOM 556 C ASP A 105 12.874 -18.907 11.152 1.00 51.01 C ATOM 557 O ASP A 105 13.669 -19.018 10.214 1.00 48.73 O ATOM 558 CB ASP A 105 13.322 -16.507 11.777 1.00 47.35 C ATOM 559 CG ASP A 105 12.035 -15.887 11.292 1.00 50.18 C ATOM 560 OD1 ASP A 105 11.196 -16.639 10.751 1.00 51.46 O ATOM 561 OD2 ASP A 105 11.857 -14.649 11.452 1.00 51.61 O ATOM 562 H ASP A 105 15.053 -17.637 13.238 1.00 0.00 H ATOM 563 N GLU A 106 11.738 -19.596 11.226 1.00 55.27 N ATOM 564 CA GLU A 106 11.413 -20.646 10.274 1.00 56.21 C ATOM 565 C GLU A 106 11.065 -20.114 8.894 1.00 49.69 C ATOM 566 O GLU A 106 10.973 -20.906 7.946 1.00 43.54 O ATOM 567 CB GLU A 106 10.267 -21.505 10.824 1.00 60.71 C ATOM 568 CG GLU A 106 10.691 -22.361 12.025 1.00 67.48 C ATOM 569 CD GLU A 106 9.656 -23.413 12.422 1.00 89.08 C ATOM 570 OE1 GLU A 106 8.474 -23.269 12.051 1.00 97.49 O ATOM 571 OE2 GLU A 106 10.027 -24.393 13.109 1.00 91.03 O ATOM 572 H GLU A 106 11.063 -19.377 11.987 1.00 0.00 H ATOM 573 N ARG A 107 10.871 -18.803 8.750 1.00 47.17 N ATOM 574 CA ARG A 107 10.689 -18.241 7.422 1.00 43.17 C ATOM 575 C ARG A 107 12.017 -18.083 6.686 1.00 44.88 C ATOM 576 O ARG A 107 12.021 -17.868 5.469 1.00 44.63 O ATOM 577 CB ARG A 107 9.952 -16.899 7.523 1.00 49.19 C ATOM 578 CG ARG A 107 8.566 -16.981 8.174 1.00 43.21 C ATOM 579 CD ARG A 107 7.999 -15.589 8.468 1.00 53.16 C ATOM 580 NE ARG A 107 8.819 -14.898 9.462 1.00 49.33 N ATOM 581 CZ ARG A 107 8.622 -13.658 9.891 1.00 50.70 C ATOM 582 NH1 ARG A 107 7.616 -12.932 9.416 1.00 54.46 N ATOM 583 NH2 ARG A 107 9.446 -13.135 10.796 1.00 49.50 N ATOM 584 HE ARG A 107 9.622 -15.421 9.866 1.00 0.00 H ATOM 585 HH12 ARG A 107 7.469 -11.961 9.758 1.00 0.00 H ATOM 586 HH11 ARG A 107 6.976 -13.335 8.702 1.00 0.00 H ATOM 587 HH22 ARG A 107 9.296 -12.164 11.136 1.00 0.00 H ATOM 588 HH21 ARG A 107 10.240 -13.698 11.163 1.00 0.00 H ATOM 589 H ARG A 107 10.850 -18.184 9.586 1.00 0.00 H ATOM 590 N VAL A 108 13.136 -18.230 7.388 1.00 45.41 N ATOM 591 CA VAL A 108 14.460 -18.244 6.777 1.00 46.89 C ATOM 592 C VAL A 108 14.786 -19.657 6.303 1.00 49.50 C ATOM 593 O VAL A 108 14.623 -20.628 7.051 1.00 48.18 O ATOM 594 CB VAL A 108 15.525 -17.756 7.770 1.00 46.24 C ATOM 595 CG1 VAL A 108 16.901 -17.904 7.161 1.00 46.38 C ATOM 596 CG2 VAL A 108 15.258 -16.319 8.185 1.00 49.23 C ATOM 597 H VAL A 108 13.064 -18.340 8.420 1.00 0.00 H ATOM 598 N SER A 109 15.289 -19.767 5.072 1.00 49.70 N ATOM 599 CA SER A 109 15.722 -21.035 4.508 1.00 49.02 C ATOM 600 C SER A 109 17.007 -20.835 3.714 1.00 50.05 C ATOM 601 O SER A 109 17.292 -19.735 3.228 1.00 52.76 O ATOM 602 CB SER A 109 14.648 -21.633 3.602 1.00 50.75 C ATOM 603 OG SER A 109 14.569 -20.919 2.383 1.00 47.34 O ATOM 604 HG SER A 109 14.341 -19.974 2.570 1.00 0.00 H ATOM 605 H SER A 109 15.375 -18.909 4.491 1.00 0.00 H ATOM 606 N ALA A 110 17.790 -21.910 3.605 1.00 45.51 N ATOM 607 CA ALA A 110 18.959 -21.965 2.726 1.00 43.93 C ATOM 608 C ALA A 110 19.951 -20.852 3.052 1.00 48.70 C ATOM 609 O ALA A 110 20.618 -20.294 2.173 1.00 50.06 O ATOM 610 CB ALA A 110 18.545 -21.915 1.255 1.00 47.70 C ATOM 611 H ALA A 110 17.558 -22.750 4.173 1.00 0.00 H ATOM 612 N LEU A 111 20.048 -20.530 4.333 1.00 45.41 N ATOM 613 CA LEU A 111 21.007 -19.541 4.784 1.00 44.96 C ATOM 614 C LEU A 111 22.418 -19.936 4.392 1.00 48.05 C ATOM 615 O LEU A 111 22.880 -21.036 4.699 1.00 56.43 O ATOM 616 CB LEU A 111 20.904 -19.384 6.289 1.00 43.38 C ATOM 617 CG LEU A 111 21.923 -18.464 6.932 1.00 50.60 C ATOM 618 CD1 LEU A 111 21.835 -17.058 6.340 1.00 44.98 C ATOM 619 CD2 LEU A 111 21.616 -18.458 8.411 1.00 51.12 C ATOM 620 H LEU A 111 19.427 -20.994 5.026 1.00 0.00 H ATOM 621 N GLU A 112 23.106 -19.029 3.720 1.00 52.75 N ATOM 622 CA GLU A 112 24.439 -19.281 3.205 1.00 53.05 C ATOM 623 C GLU A 112 25.299 -18.063 3.499 1.00 58.94 C ATOM 624 O GLU A 112 24.884 -16.924 3.248 1.00 52.78 O ATOM 625 CB GLU A 112 24.376 -19.565 1.701 1.00 62.61 C ATOM 626 CG GLU A 112 25.698 -19.851 1.024 1.00 69.04 C ATOM 627 CD GLU A 112 25.525 -20.689 -0.239 1.00 84.02 C ATOM 628 OE1 GLU A 112 24.383 -20.797 -0.744 1.00 82.61 O ATOM 629 OE2 GLU A 112 26.532 -21.251 -0.722 1.00 91.58 O ATOM 630 H GLU A 112 22.675 -18.097 3.554 1.00 0.00 H ATOM 631 N VAL A 113 26.478 -18.295 4.058 1.00 52.92 N ATOM 632 CA VAL A 113 27.401 -17.201 4.321 1.00 48.32 C ATOM 633 C VAL A 113 28.245 -16.986 3.074 1.00 53.71 C ATOM 634 O VAL A 113 28.896 -17.915 2.589 1.00 58.26 O ATOM 635 CB VAL A 113 28.270 -17.494 5.546 1.00 50.78 C ATOM 636 CG1 VAL A 113 29.240 -16.354 5.787 1.00 53.74 C ATOM 637 CG2 VAL A 113 27.380 -17.688 6.744 1.00 50.01 C ATOM 638 H VAL A 113 26.746 -19.268 4.311 1.00 0.00 H ATOM 639 N LEU A 114 28.192 -15.775 2.521 1.00 52.07 N ATOM 640 CA LEU A 114 28.927 -15.481 1.309 1.00 51.11 C ATOM 641 C LEU A 114 30.410 -15.341 1.632 1.00 52.77 C ATOM 642 O LEU A 114 30.795 -15.251 2.798 1.00 51.50 O ATOM 643 CB LEU A 114 28.399 -14.205 0.663 1.00 52.03 C ATOM 644 CG LEU A 114 26.990 -14.274 0.087 1.00 51.13 C ATOM 645 CD1 LEU A 114 26.515 -12.918 -0.375 1.00 50.72 C ATOM 646 CD2 LEU A 114 26.974 -15.243 -1.062 1.00 62.33 C ATOM 647 H LEU A 114 27.616 -15.032 2.965 1.00 0.00 H ATOM 648 N PRO A 115 31.273 -15.371 0.618 1.00 56.15 N ATOM 649 CA PRO A 115 32.703 -15.146 0.867 1.00 55.24 C ATOM 650 C PRO A 115 33.170 -13.714 0.670 1.00 53.91 C ATOM 651 O PRO A 115 34.300 -13.401 1.064 1.00 54.60 O ATOM 652 CB PRO A 115 33.378 -16.095 -0.141 1.00 53.43 C ATOM 653 CG PRO A 115 32.395 -16.231 -1.252 1.00 53.96 C ATOM 654 CD PRO A 115 31.023 -16.067 -0.660 1.00 54.22 C ATOM 655 N ASP A 116 32.327 -12.846 0.108 1.00 58.19 N ATOM 656 CA ASP A 116 32.669 -11.444 -0.109 1.00 52.32 C ATOM 657 C ASP A 116 33.294 -10.801 1.124 1.00 54.89 C ATOM 658 O ASP A 116 32.850 -11.018 2.253 1.00 55.62 O ATOM 659 CB ASP A 116 31.418 -10.652 -0.478 1.00 56.82 C ATOM 660 CG ASP A 116 30.526 -11.372 -1.456 1.00 58.77 C ATOM 661 OD1 ASP A 116 30.866 -12.508 -1.871 1.00 61.06 O ATOM 662 OD2 ASP A 116 29.470 -10.786 -1.806 1.00 63.72 O ATOM 663 H ASP A 116 31.388 -13.182 -0.187 1.00 0.00 H ATOM 664 N ARG A 117 34.326 -9.996 0.893 1.00 48.69 N ATOM 665 CA ARG A 117 34.882 -9.106 1.898 1.00 50.16 C ATOM 666 C ARG A 117 34.408 -7.690 1.583 1.00 57.21 C ATOM 667 O ARG A 117 34.722 -7.152 0.514 1.00 53.16 O ATOM 668 CB ARG A 117 36.408 -9.162 1.912 1.00 54.63 C ATOM 669 CG ARG A 117 37.000 -10.394 2.564 1.00 66.47 C ATOM 670 CD ARG A 117 38.461 -10.152 2.932 1.00 75.51 C ATOM 671 NE ARG A 117 38.629 -8.973 3.786 1.00 75.05 N ATOM 672 CZ ARG A 117 39.146 -7.812 3.382 1.00 79.49 C ATOM 673 NH1 ARG A 117 39.556 -7.660 2.128 1.00 77.25 N ATOM 674 NH2 ARG A 117 39.259 -6.799 4.235 1.00 78.78 N ATOM 675 HE ARG A 117 38.323 -9.047 4.777 1.00 0.00 H ATOM 676 HH12 ARG A 117 39.958 -6.752 1.819 1.00 0.00 H ATOM 677 HH11 ARG A 117 39.475 -8.449 1.455 1.00 0.00 H ATOM 678 HH22 ARG A 117 39.662 -5.895 3.918 1.00 0.00 H ATOM 679 HH21 ARG A 117 38.944 -6.911 5.220 1.00 0.00 H ATOM 680 H ARG A 117 34.757 -10.003 -0.054 1.00 0.00 H ATOM 681 N VAL A 118 33.642 -7.094 2.497 1.00 54.38 N ATOM 682 CA VAL A 118 33.152 -5.743 2.268 1.00 55.66 C ATOM 683 C VAL A 118 34.336 -4.788 2.259 1.00 55.07 C ATOM 684 O VAL A 118 35.149 -4.773 3.194 1.00 58.97 O ATOM 685 CB VAL A 118 32.109 -5.347 3.325 1.00 51.14 C ATOM 686 CG1 VAL A 118 31.873 -3.860 3.276 1.00 63.54 C ATOM 687 CG2 VAL A 118 30.796 -6.075 3.081 1.00 51.75 C ATOM 688 H VAL A 118 33.394 -7.595 3.374 1.00 0.00 H ATOM 689 N ALA A 119 34.461 -4.022 1.175 1.00 57.56 N ATOM 690 CA ALA A 119 35.538 -3.049 1.065 1.00 62.74 C ATOM 691 C ALA A 119 35.492 -2.102 2.255 1.00 64.49 C ATOM 692 O ALA A 119 34.453 -1.506 2.552 1.00 62.55 O ATOM 693 CB ALA A 119 35.432 -2.273 -0.250 1.00 57.39 C ATOM 694 H ALA A 119 33.779 -4.121 0.396 1.00 0.00 H ATOM 695 N THR A 120 36.613 -2.007 2.964 1.00 72.18 N ATOM 696 CA THR A 120 36.700 -1.188 4.160 1.00 74.56 C ATOM 697 C THR A 120 36.910 0.271 3.766 1.00 77.79 C ATOM 698 O THR A 120 36.931 0.629 2.584 1.00 77.68 O ATOM 699 CB THR A 120 37.831 -1.680 5.061 1.00 77.98 C ATOM 700 OG1 THR A 120 38.054 -3.077 4.824 1.00 77.30 O ATOM 701 CG2 THR A 120 37.486 -1.460 6.542 1.00 81.20 C ATOM 702 HG1 THR A 120 38.787 -3.397 5.408 1.00 0.00 H ATOM 703 H THR A 120 37.453 -2.535 2.652 1.00 0.00 H ATOM 704 N SER A 121 37.074 1.129 4.766 1.00 78.67 N ATOM 705 CA SER A 121 37.242 2.545 4.493 1.00 79.12 C ATOM 706 C SER A 121 37.754 3.243 5.743 1.00 78.79 C ATOM 707 O SER A 121 37.548 2.779 6.869 1.00 75.61 O ATOM 708 CB SER A 121 35.925 3.190 4.029 1.00 79.58 C ATOM 709 OG SER A 121 34.825 2.289 4.134 1.00 78.03 O ATOM 710 HG SER A 121 34.997 1.494 3.570 1.00 0.00 H ATOM 711 H SER A 121 37.082 0.786 5.748 1.00 0.00 H ATOM 712 N ARG A 122 38.452 4.347 5.518 1.00 82.07 N ATOM 713 CA ARG A 122 38.624 5.389 6.513 1.00 79.39 C ATOM 714 C ARG A 122 37.889 6.625 6.013 1.00 84.75 C ATOM 715 O ARG A 122 37.888 6.920 4.813 1.00 81.38 O ATOM 716 CB ARG A 122 40.105 5.666 6.782 1.00 83.35 C ATOM 717 CG ARG A 122 40.778 4.517 7.536 1.00 82.53 C ATOM 718 CD ARG A 122 42.079 4.929 8.216 1.00 79.63 C ATOM 719 NE ARG A 122 43.198 5.072 7.286 1.00 89.92 N ATOM 720 CZ ARG A 122 44.452 5.326 7.656 1.00 94.35 C ATOM 721 NH1 ARG A 122 45.409 5.444 6.741 1.00 91.40 N ATOM 722 NH2 ARG A 122 44.754 5.466 8.942 1.00 95.08 N ATOM 723 HE ARG A 122 43.002 4.969 6.270 1.00 0.00 H ATOM 724 HH12 ARG A 122 46.387 5.642 7.034 1.00 0.00 H ATOM 725 HH11 ARG A 122 45.180 5.338 5.732 1.00 0.00 H ATOM 726 HH22 ARG A 122 45.734 5.664 9.227 1.00 0.00 H ATOM 727 HH21 ARG A 122 44.010 5.377 9.663 1.00 0.00 H ATOM 728 H ARG A 122 38.897 4.472 4.586 1.00 0.00 H ATOM 729 N ILE A 123 37.230 7.322 6.932 1.00 83.61 N ATOM 730 CA ILE A 123 36.131 8.212 6.572 1.00 81.86 C ATOM 731 C ILE A 123 36.629 9.552 6.042 1.00 78.27 C ATOM 732 O ILE A 123 37.820 9.872 6.132 1.00 76.43 O ATOM 733 CB ILE A 123 35.197 8.402 7.775 1.00 79.57 C ATOM 734 CG1 ILE A 123 35.635 9.610 8.598 1.00 76.92 C ATOM 735 CG2 ILE A 123 35.224 7.141 8.626 1.00 83.34 C ATOM 736 CD1 ILE A 123 34.518 10.568 8.832 1.00 70.48 C ATOM 737 H ILE A 123 37.504 7.231 7.931 1.00 0.00 H ATOM 738 N SER A 124 35.705 10.340 5.485 1.00 75.90 N ATOM 739 CA SER A 124 36.033 11.545 4.730 1.00 80.33 C ATOM 740 C SER A 124 36.279 12.770 5.602 1.00 71.14 C ATOM 741 O SER A 124 36.974 13.691 5.158 1.00 74.20 O ATOM 742 CB SER A 124 34.905 11.857 3.741 1.00 79.01 C ATOM 743 OG SER A 124 34.116 10.696 3.531 1.00 88.00 O ATOM 744 HG SER A 124 33.389 10.904 2.892 1.00 0.00 H ATOM 745 H SER A 124 34.703 10.082 5.595 1.00 0.00 H ATOM 746 N ASP A 125 35.732 12.808 6.819 1.00 68.37 N ATOM 747 CA ASP A 125 35.894 13.967 7.684 1.00 61.69 C ATOM 748 C ASP A 125 35.440 13.647 9.104 1.00 56.30 C ATOM 749 O ASP A 125 34.247 13.741 9.419 1.00 56.06 O ATOM 750 CB ASP A 125 35.110 15.143 7.121 1.00 67.58 C ATOM 751 CG ASP A 125 35.289 16.407 7.942 1.00 63.50 C ATOM 752 OD1 ASP A 125 36.167 16.439 8.823 1.00 65.67 O ATOM 753 OD2 ASP A 125 34.536 17.362 7.701 1.00 58.25 O ATOM 754 H ASP A 125 35.179 11.994 7.155 1.00 0.00 H ATOM 755 N ALA A 126 36.387 13.272 9.970 1.00 58.72 N ATOM 756 CA ALA A 126 36.031 12.741 11.283 1.00 59.88 C ATOM 757 C ALA A 126 35.316 13.777 12.135 1.00 63.41 C ATOM 758 O ALA A 126 34.307 13.462 12.779 1.00 61.81 O ATOM 759 CB ALA A 126 37.281 12.237 11.999 1.00 63.26 C ATOM 760 H ALA A 126 37.389 13.359 9.705 1.00 0.00 H ATOM 761 N HIS A 127 35.829 15.019 12.159 1.00 63.11 N ATOM 762 CA HIS A 127 35.246 16.055 13.013 1.00 59.23 C ATOM 763 C HIS A 127 33.786 16.296 12.665 1.00 55.49 C ATOM 764 O HIS A 127 32.935 16.385 13.553 1.00 58.52 O ATOM 765 CB HIS A 127 36.036 17.366 12.900 1.00 62.09 C ATOM 766 CG HIS A 127 35.338 18.536 13.524 1.00 60.34 C ATOM 767 ND1 HIS A 127 34.600 19.441 12.790 1.00 62.07 N ATOM 768 CD2 HIS A 127 35.221 18.920 14.819 1.00 59.67 C ATOM 769 CE1 HIS A 127 34.072 20.341 13.603 1.00 58.30 C ATOM 770 NE2 HIS A 127 34.432 20.047 14.840 1.00 62.64 N ATOM 771 H HIS A 127 36.650 15.247 11.563 1.00 0.00 H ATOM 772 N LEU A 128 33.484 16.445 11.377 1.00 56.67 N ATOM 773 CA LEU A 128 32.097 16.588 10.958 1.00 58.16 C ATOM 774 C LEU A 128 31.264 15.381 11.394 1.00 61.41 C ATOM 775 O LEU A 128 30.158 15.540 11.926 1.00 63.91 O ATOM 776 CB LEU A 128 32.044 16.779 9.444 1.00 55.26 C ATOM 777 CG LEU A 128 30.661 16.769 8.797 1.00 63.25 C ATOM 778 CD1 LEU A 128 29.782 17.846 9.416 1.00 59.82 C ATOM 779 CD2 LEU A 128 30.777 16.932 7.286 1.00 63.21 C ATOM 780 H LEU A 128 34.243 16.459 10.666 1.00 0.00 H ATOM 781 N ALA A 129 31.790 14.168 11.202 1.00 60.14 N ATOM 782 CA ALA A 129 31.080 12.976 11.660 1.00 63.87 C ATOM 783 C ALA A 129 30.867 13.006 13.169 1.00 62.25 C ATOM 784 O ALA A 129 29.755 12.771 13.657 1.00 60.61 O ATOM 785 CB ALA A 129 31.843 11.717 11.256 1.00 59.81 C ATOM 786 H ALA A 129 32.709 14.072 10.724 1.00 0.00 H ATOM 787 N ASP A 130 31.921 13.311 13.925 1.00 63.58 N ATOM 788 CA ASP A 130 31.812 13.310 15.379 1.00 62.83 C ATOM 789 C ASP A 130 30.768 14.302 15.858 1.00 62.28 C ATOM 790 O ASP A 130 29.917 13.967 16.689 1.00 66.08 O ATOM 791 CB ASP A 130 33.167 13.614 16.005 1.00 69.38 C ATOM 792 CG ASP A 130 33.873 12.360 16.465 1.00 77.14 C ATOM 793 OD1 ASP A 130 33.780 11.341 15.747 1.00 80.42 O ATOM 794 OD2 ASP A 130 34.519 12.390 17.535 1.00 82.58 O ATOM 795 H ASP A 130 32.827 13.551 13.475 1.00 0.00 H ATOM 796 N THR A 131 30.806 15.524 15.333 1.00 57.52 N ATOM 797 CA THR A 131 29.896 16.567 15.780 1.00 58.04 C ATOM 798 C THR A 131 28.488 16.389 15.237 1.00 59.27 C ATOM 799 O THR A 131 27.570 17.088 15.679 1.00 59.50 O ATOM 800 CB THR A 131 30.443 17.954 15.387 1.00 64.06 C ATOM 801 OG1 THR A 131 30.813 17.965 13.998 1.00 60.85 O ATOM 802 CG2 THR A 131 31.657 18.331 16.254 1.00 60.45 C ATOM 803 HG1 THR A 131 31.512 17.283 13.839 1.00 0.00 H ATOM 804 H THR A 131 31.500 15.738 14.588 1.00 0.00 H ATOM 805 N MET A 132 28.296 15.472 14.298 1.00 58.38 N ATOM 806 CA MET A 132 26.966 15.232 13.754 1.00 60.91 C ATOM 807 C MET A 132 26.163 14.245 14.594 1.00 55.30 C ATOM 808 O MET A 132 24.930 14.306 14.610 1.00 54.50 O ATOM 809 CB MET A 132 27.092 14.708 12.332 1.00 59.94 C ATOM 810 CG MET A 132 25.905 14.961 11.457 1.00 58.22 C ATOM 811 SD MET A 132 26.052 13.964 9.963 1.00 75.47 S ATOM 812 CE MET A 132 27.824 13.969 9.678 1.00 60.57 C ATOM 813 H MET A 132 29.103 14.919 13.946 1.00 0.00 H ATOM 814 N ILE A 133 26.841 13.347 15.304 1.00 56.30 N ATOM 815 CA ILE A 133 26.161 12.278 16.018 1.00 50.93 C ATOM 816 C ILE A 133 25.455 12.843 17.241 1.00 51.80 C ATOM 817 O ILE A 133 25.982 13.715 17.943 1.00 57.87 O ATOM 818 CB ILE A 133 27.176 11.179 16.374 1.00 54.60 C ATOM 819 CG1 ILE A 133 27.580 10.455 15.081 1.00 51.00 C ATOM 820 CG2 ILE A 133 26.604 10.202 17.398 1.00 49.23 C ATOM 821 CD1 ILE A 133 28.716 9.495 15.204 1.00 49.77 C ATOM 822 H ILE A 133 27.878 13.411 15.349 1.00 0.00 H ATOM 823 N GLY A 134 24.236 12.377 17.482 1.00 49.58 N ATOM 824 CA GLY A 134 23.412 12.926 18.528 1.00 46.99 C ATOM 825 C GLY A 134 22.664 14.195 18.170 1.00 47.43 C ATOM 826 O GLY A 134 21.968 14.744 19.033 1.00 50.99 O ATOM 827 H GLY A 134 23.867 11.597 16.902 1.00 0.00 H ATOM 828 N LYS A 135 22.771 14.691 16.942 1.00 46.31 N ATOM 829 CA LYS A 135 22.123 15.953 16.608 1.00 53.10 C ATOM 830 C LYS A 135 20.848 15.718 15.816 1.00 50.12 C ATOM 831 O LYS A 135 20.763 14.799 14.995 1.00 47.75 O ATOM 832 CB LYS A 135 23.038 16.876 15.796 1.00 50.16 C ATOM 833 CG LYS A 135 24.374 17.172 16.424 1.00 54.27 C ATOM 834 CD LYS A 135 24.257 18.207 17.520 1.00 56.29 C ATOM 835 CE LYS A 135 25.617 18.528 18.116 1.00 60.19 C ATOM 836 NZ LYS A 135 25.459 19.390 19.316 1.00 70.89 N ATOM 837 HZ1 LYS A 135 24.987 20.276 19.045 1.00 0.00 H ATOM 838 HZ2 LYS A 135 24.884 18.892 20.025 1.00 0.00 H ATOM 839 HZ3 LYS A 135 26.396 19.603 19.714 1.00 0.00 H ATOM 840 H LYS A 135 23.317 14.179 16.220 1.00 0.00 H ATOM 841 N ALA A 136 19.860 16.573 16.072 1.00 45.82 N ATOM 842 CA ALA A 136 18.695 16.667 15.207 1.00 46.10 C ATOM 843 C ALA A 136 19.113 17.239 13.859 1.00 49.78 C ATOM 844 O ALA A 136 20.036 18.056 13.776 1.00 52.78 O ATOM 845 CB ALA A 136 17.621 17.548 15.854 1.00 42.92 C ATOM 846 H ALA A 136 19.923 17.187 16.909 1.00 0.00 H ATOM 847 N VAL A 137 18.448 16.793 12.792 1.00 46.63 N ATOM 848 CA VAL A 137 18.830 17.127 11.427 1.00 44.36 C ATOM 849 C VAL A 137 17.585 17.272 10.565 1.00 46.34 C ATOM 850 O VAL A 137 16.490 16.832 10.920 1.00 47.19 O ATOM 851 CB VAL A 137 19.755 16.072 10.787 1.00 47.13 C ATOM 852 CG1 VAL A 137 21.081 15.958 11.511 1.00 48.40 C ATOM 853 CG2 VAL A 137 19.052 14.709 10.747 1.00 46.25 C ATOM 854 H VAL A 137 17.621 16.180 12.941 1.00 0.00 H ATOM 855 N GLU A 138 17.791 17.861 9.392 1.00 45.03 N ATOM 856 CA GLU A 138 16.798 17.925 8.330 1.00 50.81 C ATOM 857 C GLU A 138 17.420 17.270 7.113 1.00 47.99 C ATOM 858 O GLU A 138 18.449 17.739 6.618 1.00 49.70 O ATOM 859 CB GLU A 138 16.393 19.372 8.013 1.00 55.77 C ATOM 860 CG GLU A 138 15.571 20.052 9.098 1.00 56.67 C ATOM 861 CD GLU A 138 14.082 19.733 9.011 1.00 57.39 C ATOM 862 OE1 GLU A 138 13.716 18.784 8.294 1.00 49.75 O ATOM 863 OE2 GLU A 138 13.269 20.454 9.639 1.00 67.92 O ATOM 864 H GLU A 138 18.717 18.303 9.223 1.00 0.00 H ATOM 865 N HIS A 139 16.805 16.188 6.641 1.00 48.99 N ATOM 866 CA HIS A 139 17.365 15.366 5.578 1.00 45.16 C ATOM 867 C HIS A 139 16.505 15.497 4.334 1.00 43.57 C ATOM 868 O HIS A 139 15.318 15.156 4.354 1.00 45.57 O ATOM 869 CB HIS A 139 17.458 13.909 6.019 1.00 44.22 C ATOM 870 CG HIS A 139 18.303 13.058 5.126 1.00 46.88 C ATOM 871 ND1 HIS A 139 18.438 11.699 5.308 1.00 45.01 N ATOM 872 CD2 HIS A 139 19.065 13.374 4.053 1.00 46.58 C ATOM 873 CE1 HIS A 139 19.237 11.210 4.375 1.00 48.76 C ATOM 874 NE2 HIS A 139 19.642 12.208 3.610 1.00 54.90 N ATOM 875 H HIS A 139 15.887 15.919 7.048 1.00 0.00 H ATOM 876 N MET A 140 17.110 15.953 3.253 1.00 42.77 N ATOM 877 CA MET A 140 16.407 16.196 2.006 1.00 53.50 C ATOM 878 C MET A 140 16.717 15.092 1.011 1.00 54.53 C ATOM 879 O MET A 140 17.867 14.670 0.875 1.00 59.33 O ATOM 880 CB MET A 140 16.806 17.558 1.419 1.00 59.02 C ATOM 881 CG MET A 140 16.165 17.861 0.076 1.00 64.35 C ATOM 882 SD MET A 140 14.891 19.130 0.192 1.00 81.12 S ATOM 883 CE MET A 140 15.919 20.596 0.338 1.00 58.57 C ATOM 884 H MET A 140 18.131 16.146 3.296 1.00 0.00 H ATOM 885 N PHE A 141 15.688 14.619 0.318 1.00 58.25 N ATOM 886 CA PHE A 141 15.863 13.480 -0.564 1.00 58.74 C ATOM 887 C PHE A 141 14.859 13.556 -1.701 1.00 66.44 C ATOM 888 O PHE A 141 13.824 14.219 -1.602 1.00 66.01 O ATOM 889 CB PHE A 141 15.722 12.160 0.205 1.00 63.55 C ATOM 890 CG PHE A 141 14.380 11.969 0.870 1.00 60.60 C ATOM 891 CD1 PHE A 141 14.121 12.507 2.126 1.00 56.79 C ATOM 892 CD2 PHE A 141 13.383 11.213 0.254 1.00 60.21 C ATOM 893 CE1 PHE A 141 12.877 12.309 2.752 1.00 58.67 C ATOM 894 CE2 PHE A 141 12.138 11.020 0.870 1.00 55.38 C ATOM 895 CZ PHE A 141 11.888 11.566 2.119 1.00 52.93 C ATOM 896 H PHE A 141 14.753 15.066 0.408 1.00 0.00 H ATOM 897 N GLU A 142 15.179 12.858 -2.788 1.00 74.39 N ATOM 898 CA GLU A 142 14.327 12.809 -3.968 1.00 76.79 C ATOM 899 C GLU A 142 13.407 11.603 -3.882 1.00 75.25 C ATOM 900 O GLU A 142 13.869 10.483 -3.644 1.00 76.54 O ATOM 901 CB GLU A 142 15.163 12.732 -5.242 1.00 78.21 C ATOM 902 CG GLU A 142 15.854 14.029 -5.604 1.00 85.18 C ATOM 903 CD GLU A 142 16.677 13.897 -6.869 1.00 93.33 C ATOM 904 OE1 GLU A 142 16.467 12.912 -7.614 1.00 95.49 O ATOM 905 OE2 GLU A 142 17.533 14.772 -7.118 1.00 94.72 O ATOM 906 H GLU A 142 16.073 12.327 -2.795 1.00 0.00 H ATOM 907 N THR A 143 12.111 11.830 -4.080 1.00 78.75 N ATOM 908 CA THR A 143 11.150 10.740 -3.994 1.00 82.22 C ATOM 909 C THR A 143 11.194 9.876 -5.253 1.00 82.40 C ATOM 910 O THR A 143 11.950 10.134 -6.198 1.00 84.99 O ATOM 911 CB THR A 143 9.735 11.273 -3.790 1.00 81.65 C ATOM 912 OG1 THR A 143 8.839 10.162 -3.655 1.00 87.82 O ATOM 913 CG2 THR A 143 9.312 12.090 -4.993 1.00 81.36 C ATOM 914 HG1 THR A 143 7.917 10.497 -3.522 1.00 0.00 H ATOM 915 H THR A 143 11.782 12.792 -4.298 1.00 0.00 H ATOM 916 N GLU A 144 10.356 8.832 -5.262 1.00 85.50 N ATOM 917 CA GLU A 144 10.179 8.020 -6.463 1.00 87.72 C ATOM 918 C GLU A 144 9.570 8.845 -7.586 1.00 87.10 C ATOM 919 O GLU A 144 9.971 8.722 -8.750 1.00 86.58 O ATOM 920 CB GLU A 144 9.283 6.818 -6.167 1.00 88.06 C ATOM 921 CG GLU A 144 9.779 5.902 -5.069 1.00 92.39 C ATOM 922 CD GLU A 144 8.806 4.775 -4.789 1.00 94.83 C ATOM 923 OE1 GLU A 144 7.600 4.956 -5.056 1.00 96.33 O ATOM 924 OE2 GLU A 144 9.246 3.707 -4.308 1.00 92.78 O ATOM 925 H GLU A 144 9.823 8.596 -4.401 1.00 0.00 H ATOM 926 N ASP A 145 8.580 9.677 -7.252 1.00 88.95 N ATOM 927 CA ASP A 145 7.973 10.585 -8.219 1.00 91.39 C ATOM 928 C ASP A 145 8.986 11.549 -8.832 1.00 89.60 C ATOM 929 O ASP A 145 8.780 12.023 -9.956 1.00 95.76 O ATOM 930 CB ASP A 145 6.842 11.360 -7.538 1.00 92.63 C ATOM 931 CG ASP A 145 6.309 12.488 -8.388 1.00 95.11 C ATOM 932 OD1 ASP A 145 5.942 12.226 -9.551 1.00100.00 O ATOM 933 OD2 ASP A 145 6.259 13.631 -7.897 1.00 96.47 O ATOM 934 H ASP A 145 8.231 9.678 -6.272 1.00 0.00 H ATOM 935 N GLY A 146 10.090 11.829 -8.135 1.00 87.82 N ATOM 936 CA GLY A 146 11.099 12.761 -8.588 1.00 89.67 C ATOM 937 C GLY A 146 11.113 14.062 -7.806 1.00 86.01 C ATOM 938 O GLY A 146 12.159 14.721 -7.736 1.00 87.41 O ATOM 939 H GLY A 146 10.231 11.353 -7.221 1.00 0.00 H ATOM 940 N SER A 147 9.979 14.443 -7.215 1.00 88.34 N ATOM 941 CA SER A 147 9.939 15.641 -6.390 1.00 81.57 C ATOM 942 C SER A 147 10.846 15.478 -5.169 1.00 79.06 C ATOM 943 O SER A 147 11.358 14.393 -4.868 1.00 79.29 O ATOM 944 CB SER A 147 8.505 15.947 -5.957 1.00 85.43 C ATOM 945 OG SER A 147 7.859 14.786 -5.467 1.00 85.92 O ATOM 946 HG SER A 147 7.835 14.098 -6.179 1.00 0.00 H ATOM 947 H SER A 147 9.115 13.878 -7.345 1.00 0.00 H ATOM 948 N LYS A 148 11.042 16.575 -4.454 1.00 78.15 N ATOM 949 CA LYS A 148 11.897 16.555 -3.280 1.00 75.33 C ATOM 950 C LYS A 148 11.051 16.560 -2.015 1.00 69.73 C ATOM 951 O LYS A 148 9.970 17.154 -1.976 1.00 80.94 O ATOM 952 CB LYS A 148 12.873 17.730 -3.292 1.00 71.77 C ATOM 953 CG LYS A 148 13.921 17.597 -4.391 1.00 73.48 C ATOM 954 CD LYS A 148 14.803 18.824 -4.484 1.00 79.19 C ATOM 955 CE LYS A 148 15.846 18.865 -3.372 1.00 78.45 C ATOM 956 NZ LYS A 148 16.502 20.216 -3.272 1.00 81.85 N ATOM 957 HZ1 LYS A 148 16.974 20.438 -4.172 1.00 0.00 H ATOM 958 HZ2 LYS A 148 15.780 20.937 -3.070 1.00 0.00 H ATOM 959 HZ3 LYS A 148 17.204 20.203 -2.505 1.00 0.00 H ATOM 960 H LYS A 148 10.578 17.462 -4.736 1.00 0.00 H ATOM 961 N ASP A 149 11.540 15.859 -0.998 1.00 62.62 N ATOM 962 CA ASP A 149 10.922 15.788 0.314 1.00 59.92 C ATOM 963 C ASP A 149 12.012 16.020 1.355 1.00 57.01 C ATOM 964 O ASP A 149 13.196 15.786 1.102 1.00 55.56 O ATOM 965 CB ASP A 149 10.231 14.431 0.529 1.00 58.65 C ATOM 966 CG ASP A 149 9.195 14.468 1.635 1.00 66.95 C ATOM 967 OD1 ASP A 149 9.271 15.370 2.503 1.00 69.15 O ATOM 968 OD2 ASP A 149 8.300 13.594 1.641 1.00 68.79 O ATOM 969 H ASP A 149 12.421 15.328 -1.151 1.00 0.00 H ATOM 970 N GLU A 150 11.615 16.509 2.528 1.00 55.49 N ATOM 971 CA GLU A 150 12.558 16.767 3.611 1.00 57.29 C ATOM 972 C GLU A 150 11.976 16.218 4.902 1.00 54.45 C ATOM 973 O GLU A 150 10.837 16.534 5.254 1.00 51.07 O ATOM 974 CB GLU A 150 12.875 18.261 3.752 1.00 54.99 C ATOM 975 CG GLU A 150 13.690 18.596 4.998 1.00 54.49 C ATOM 976 CD GLU A 150 14.161 20.055 5.044 1.00 63.76 C ATOM 977 OE1 GLU A 150 15.353 20.307 4.758 1.00 61.86 O ATOM 978 OE2 GLU A 150 13.344 20.951 5.363 1.00 59.49 O ATOM 979 H GLU A 150 10.606 16.712 2.676 1.00 0.00 H ATOM 980 N TRP A 151 12.750 15.384 5.591 1.00 49.33 N ATOM 981 CA TRP A 151 12.318 14.750 6.825 1.00 52.27 C ATOM 982 C TRP A 151 13.195 15.207 7.978 1.00 42.21 C ATOM 983 O TRP A 151 14.406 15.358 7.828 1.00 50.31 O ATOM 984 CB TRP A 151 12.380 13.219 6.729 1.00 52.53 C ATOM 985 CG TRP A 151 11.311 12.571 5.902 1.00 54.05 C ATOM 986 CD1 TRP A 151 10.436 13.181 5.057 1.00 60.47 C ATOM 987 CD2 TRP A 151 11.007 11.170 5.849 1.00 52.41 C ATOM 988 NE1 TRP A 151 9.602 12.243 4.477 1.00 59.04 N ATOM 989 CE2 TRP A 151 9.932 11.006 4.953 1.00 58.27 C ATOM 990 CE3 TRP A 151 11.544 10.033 6.475 1.00 55.97 C ATOM 991 CZ2 TRP A 151 9.383 9.749 4.658 1.00 62.88 C ATOM 992 CZ3 TRP A 151 10.995 8.782 6.180 1.00 51.48 C ATOM 993 CH2 TRP A 151 9.927 8.656 5.282 1.00 52.90 C ATOM 994 HE1 TRP A 151 8.847 12.446 3.791 1.00 0.00 H ATOM 995 H TRP A 151 13.704 15.177 5.232 1.00 0.00 H ATOM 996 N ARG A 152 12.577 15.399 9.125 1.00 42.66 N ATOM 997 CA ARG A 152 13.270 15.667 10.369 1.00 46.47 C ATOM 998 C ARG A 152 13.685 14.350 11.009 1.00 49.28 C ATOM 999 O ARG A 152 12.904 13.393 11.059 1.00 45.54 O ATOM 1000 CB ARG A 152 12.352 16.439 11.317 1.00 53.66 C ATOM 1001 CG ARG A 152 13.043 17.290 12.358 1.00 63.18 C ATOM 1002 CD ARG A 152 12.837 18.779 12.047 1.00 68.81 C ATOM 1003 NE ARG A 152 13.016 19.636 13.213 1.00 75.82 N ATOM 1004 CZ ARG A 152 12.025 20.264 13.839 1.00 77.32 C ATOM 1005 NH1 ARG A 152 10.783 20.157 13.398 1.00 76.60 N ATOM 1006 NH2 ARG A 152 12.278 21.007 14.904 1.00 80.11 N ATOM 1007 HE ARG A 152 13.981 19.764 13.579 1.00 0.00 H ATOM 1008 HH12 ARG A 152 10.012 20.650 13.891 1.00 0.00 H ATOM 1009 HH11 ARG A 152 10.577 19.580 12.558 1.00 0.00 H ATOM 1010 HH22 ARG A 152 11.502 21.497 15.392 1.00 0.00 H ATOM 1011 HH21 ARG A 152 13.253 21.101 15.253 1.00 0.00 H ATOM 1012 H ARG A 152 11.538 15.356 9.139 1.00 0.00 H ATOM 1013 N GLY A 153 14.908 14.307 11.506 1.00 47.81 N ATOM 1014 CA GLY A 153 15.375 13.129 12.189 1.00 41.48 C ATOM 1015 C GLY A 153 16.493 13.432 13.152 1.00 44.33 C ATOM 1016 O GLY A 153 16.790 14.592 13.447 1.00 45.35 O ATOM 1017 H GLY A 153 15.537 15.129 11.403 1.00 0.00 H ATOM 1018 N MET A 154 17.114 12.360 13.638 1.00 44.86 N ATOM 1019 CA MET A 154 18.221 12.433 14.577 1.00 43.48 C ATOM 1020 C MET A 154 19.295 11.445 14.163 1.00 46.13 C ATOM 1021 O MET A 154 18.992 10.272 13.922 1.00 43.50 O ATOM 1022 CB MET A 154 17.749 12.117 15.993 1.00 48.43 C ATOM 1023 CG MET A 154 18.865 11.996 16.997 1.00 56.27 C ATOM 1024 SD MET A 154 18.192 11.950 18.665 1.00 79.99 S ATOM 1025 CE MET A 154 17.180 10.474 18.583 1.00 64.70 C ATOM 1026 H MET A 154 16.790 11.421 13.330 1.00 0.00 H ATOM 1027 N VAL A 155 20.542 11.912 14.095 1.00 45.78 N ATOM 1028 CA VAL A 155 21.672 11.032 13.820 1.00 44.28 C ATOM 1029 C VAL A 155 22.054 10.315 15.103 1.00 45.42 C ATOM 1030 O VAL A 155 22.283 10.952 16.136 1.00 49.14 O ATOM 1031 CB VAL A 155 22.862 11.822 13.263 1.00 46.38 C ATOM 1032 CG1 VAL A 155 24.007 10.885 13.003 1.00 45.11 C ATOM 1033 CG2 VAL A 155 22.473 12.536 12.002 1.00 47.53 C ATOM 1034 H VAL A 155 20.713 12.927 14.241 1.00 0.00 H ATOM 1035 N LEU A 156 22.155 8.991 15.030 1.00 44.50 N ATOM 1036 CA LEU A 156 22.284 8.130 16.199 1.00 47.51 C ATOM 1037 C LEU A 156 23.719 7.695 16.473 1.00 46.67 C ATOM 1038 O LEU A 156 24.203 7.805 17.602 1.00 47.26 O ATOM 1039 CB LEU A 156 21.392 6.890 16.018 1.00 47.43 C ATOM 1040 CG LEU A 156 19.902 7.205 15.872 1.00 42.55 C ATOM 1041 CD1 LEU A 156 19.082 5.954 15.617 1.00 45.98 C ATOM 1042 CD2 LEU A 156 19.437 7.902 17.124 1.00 45.18 C ATOM 1043 H LEU A 156 22.141 8.547 14.090 1.00 0.00 H ATOM 1044 N ALA A 157 24.409 7.179 15.474 1.00 43.53 N ATOM 1045 CA ALA A 157 25.761 6.680 15.676 1.00 44.81 C ATOM 1046 C ALA A 157 26.366 6.421 14.311 1.00 43.61 C ATOM 1047 O ALA A 157 25.687 6.492 13.283 1.00 45.55 O ATOM 1048 CB ALA A 157 25.784 5.408 16.525 1.00 39.77 C ATOM 1049 H ALA A 157 23.980 7.128 14.528 1.00 0.00 H ATOM 1050 N ARG A 158 27.664 6.154 14.312 1.00 45.26 N ATOM 1051 CA ARG A 158 28.320 5.582 13.156 1.00 46.46 C ATOM 1052 C ARG A 158 27.861 4.132 13.023 1.00 46.31 C ATOM 1053 O ARG A 158 27.743 3.413 14.017 1.00 52.09 O ATOM 1054 CB ARG A 158 29.839 5.668 13.326 1.00 49.86 C ATOM 1055 CG ARG A 158 30.636 5.127 12.160 1.00 52.47 C ATOM 1056 CD ARG A 158 31.145 6.243 11.305 1.00 60.03 C ATOM 1057 NE ARG A 158 32.112 7.066 12.019 1.00 62.05 N ATOM 1058 CZ ARG A 158 32.858 7.987 11.434 1.00 68.11 C ATOM 1059 NH1 ARG A 158 32.744 8.181 10.128 1.00 69.63 N ATOM 1060 NH2 ARG A 158 33.707 8.713 12.151 1.00 77.86 N ATOM 1061 HE ARG A 158 32.221 6.921 13.043 1.00 0.00 H ATOM 1062 HH12 ARG A 158 33.326 8.903 9.657 1.00 0.00 H ATOM 1063 HH11 ARG A 158 32.073 7.611 9.574 1.00 0.00 H ATOM 1064 HH22 ARG A 158 34.292 9.437 11.687 1.00 0.00 H ATOM 1065 HH21 ARG A 158 33.787 8.558 13.176 1.00 0.00 H ATOM 1066 H ARG A 158 28.224 6.360 15.164 1.00 0.00 H ATOM 1067 N ALA A 159 27.553 3.705 11.807 1.00 43.62 N ATOM 1068 CA ALA A 159 27.162 2.312 11.658 1.00 45.11 C ATOM 1069 C ALA A 159 28.388 1.419 11.834 1.00 46.14 C ATOM 1070 O ALA A 159 29.516 1.841 11.553 1.00 49.85 O ATOM 1071 CB ALA A 159 26.508 2.048 10.302 1.00 38.40 C ATOM 1072 H ALA A 159 27.590 4.344 10.987 1.00 0.00 H ATOM 1073 N PRO A 160 28.195 0.202 12.337 1.00 50.17 N ATOM 1074 CA PRO A 160 29.271 -0.792 12.336 1.00 44.11 C ATOM 1075 C PRO A 160 29.542 -1.304 10.933 1.00 46.69 C ATOM 1076 O PRO A 160 28.719 -1.167 10.026 1.00 45.45 O ATOM 1077 CB PRO A 160 28.719 -1.927 13.210 1.00 49.20 C ATOM 1078 CG PRO A 160 27.435 -1.405 13.814 1.00 48.18 C ATOM 1079 CD PRO A 160 26.949 -0.333 12.912 1.00 46.96 C ATOM 1080 N VAL A 161 30.721 -1.915 10.772 1.00 48.54 N ATOM 1081 CA VAL A 161 31.055 -2.689 9.579 1.00 47.24 C ATOM 1082 C VAL A 161 31.184 -1.764 8.380 1.00 48.45 C ATOM 1083 O VAL A 161 32.244 -1.690 7.754 1.00 54.18 O ATOM 1084 CB VAL A 161 30.003 -3.790 9.320 1.00 46.57 C ATOM 1085 CG1 VAL A 161 30.339 -4.590 8.071 1.00 43.31 C ATOM 1086 CG2 VAL A 161 29.851 -4.690 10.538 1.00 44.16 C ATOM 1087 H VAL A 161 31.430 -1.836 11.529 1.00 0.00 H ATOM 1088 N MET A 162 30.106 -1.058 8.051 1.00 47.96 N ATOM 1089 CA MET A 162 30.093 -0.122 6.934 1.00 51.60 C ATOM 1090 C MET A 162 30.414 1.272 7.483 1.00 55.29 C ATOM 1091 O MET A 162 29.528 1.988 7.962 1.00 54.36 O ATOM 1092 CB MET A 162 28.749 -0.211 6.219 1.00 49.68 C ATOM 1093 CG MET A 162 28.393 -1.656 5.905 1.00 47.80 C ATOM 1094 SD MET A 162 26.863 -1.934 4.978 1.00 54.80 S ATOM 1095 CE MET A 162 26.892 -0.492 3.915 1.00 53.86 C ATOM 1096 H MET A 162 29.239 -1.178 8.612 1.00 0.00 H ATOM 1097 N ASN A 163 31.703 1.647 7.416 1.00 57.24 N ATOM 1098 CA ASN A 163 32.239 2.806 8.141 1.00 58.37 C ATOM 1099 C ASN A 163 31.691 4.139 7.648 1.00 56.13 C ATOM 1100 O ASN A 163 31.599 5.097 8.426 1.00 57.50 O ATOM 1101 CB ASN A 163 33.766 2.844 8.031 1.00 58.74 C ATOM 1102 CG ASN A 163 34.443 2.181 9.194 1.00 66.44 C ATOM 1103 OD1 ASN A 163 33.854 2.041 10.269 1.00 71.44 O ATOM 1104 ND2 ASN A 163 35.685 1.761 8.995 1.00 76.16 N ATOM 1105 HD22 ASN A 163 36.140 1.902 8.070 1.00 0.00 H ATOM 1106 HD21 ASN A 163 36.204 1.291 9.764 1.00 0.00 H ATOM 1107 H ASN A 163 32.351 1.090 6.823 1.00 0.00 H ATOM 1108 N THR A 164 31.393 4.259 6.367 1.00 51.30 N ATOM 1109 CA THR A 164 30.948 5.553 5.879 1.00 48.50 C ATOM 1110 C THR A 164 29.449 5.759 6.029 1.00 52.11 C ATOM 1111 O THR A 164 28.920 6.688 5.414 1.00 53.07 O ATOM 1112 CB THR A 164 31.338 5.716 4.413 1.00 56.01 C ATOM 1113 OG1 THR A 164 30.624 4.760 3.623 1.00 53.96 O ATOM 1114 CG2 THR A 164 32.840 5.496 4.231 1.00 53.47 C ATOM 1115 HG1 THR A 164 30.852 3.846 3.927 1.00 0.00 H ATOM 1116 H THR A 164 31.475 3.447 5.723 1.00 0.00 H ATOM 1117 N TRP A 165 28.757 4.924 6.811 1.00 44.74 N ATOM 1118 CA TRP A 165 27.311 4.983 6.963 1.00 42.49 C ATOM 1119 C TRP A 165 26.952 5.326 8.400 1.00 43.69 C ATOM 1120 O TRP A 165 27.720 5.055 9.328 1.00 43.63 O ATOM 1121 CB TRP A 165 26.645 3.652 6.586 1.00 47.03 C ATOM 1122 CG TRP A 165 26.733 3.328 5.137 1.00 45.23 C ATOM 1123 CD1 TRP A 165 27.856 3.015 4.433 1.00 46.42 C ATOM 1124 CD2 TRP A 165 25.650 3.281 4.210 1.00 41.15 C ATOM 1125 NE1 TRP A 165 27.537 2.776 3.118 1.00 47.57 N ATOM 1126 CE2 TRP A 165 26.187 2.925 2.958 1.00 41.45 C ATOM 1127 CE3 TRP A 165 24.276 3.503 4.317 1.00 40.58 C ATOM 1128 CZ2 TRP A 165 25.406 2.801 1.821 1.00 42.41 C ATOM 1129 CZ3 TRP A 165 23.493 3.370 3.187 1.00 39.91 C ATOM 1130 CH2 TRP A 165 24.059 3.018 1.954 1.00 44.92 C ATOM 1131 HE1 TRP A 165 28.211 2.523 2.368 1.00 0.00 H ATOM 1132 H TRP A 165 29.279 4.195 7.338 1.00 0.00 H ATOM 1133 N PHE A 166 25.767 5.908 8.581 1.00 39.34 N ATOM 1134 CA PHE A 166 25.344 6.424 9.873 1.00 42.92 C ATOM 1135 C PHE A 166 23.949 5.927 10.211 1.00 44.92 C ATOM 1136 O PHE A 166 23.040 5.962 9.374 1.00 39.84 O ATOM 1137 CB PHE A 166 25.342 7.977 9.903 1.00 44.68 C ATOM 1138 CG PHE A 166 26.716 8.600 9.871 1.00 46.96 C ATOM 1139 CD1 PHE A 166 27.467 8.587 8.704 1.00 43.29 C ATOM 1140 CD2 PHE A 166 27.241 9.219 10.999 1.00 43.99 C ATOM 1141 CE1 PHE A 166 28.722 9.150 8.667 1.00 49.38 C ATOM 1142 CE2 PHE A 166 28.496 9.785 10.966 1.00 46.97 C ATOM 1143 CZ PHE A 166 29.235 9.753 9.797 1.00 50.61 C ATOM 1144 H PHE A 166 25.122 5.996 7.770 1.00 0.00 H ATOM 1145 N TYR A 167 23.785 5.486 11.453 1.00 43.73 N ATOM 1146 CA TYR A 167 22.460 5.248 11.995 1.00 38.57 C ATOM 1147 C TYR A 167 21.715 6.573 12.135 1.00 42.13 C ATOM 1148 O TYR A 167 22.263 7.557 12.634 1.00 41.16 O ATOM 1149 CB TYR A 167 22.559 4.557 13.352 1.00 40.56 C ATOM 1150 CG TYR A 167 22.903 3.086 13.308 1.00 44.24 C ATOM 1151 CD1 TYR A 167 22.852 2.371 12.118 1.00 42.07 C ATOM 1152 CD2 TYR A 167 23.280 2.408 14.466 1.00 45.77 C ATOM 1153 CE1 TYR A 167 23.174 1.028 12.085 1.00 39.81 C ATOM 1154 CE2 TYR A 167 23.596 1.063 14.435 1.00 43.53 C ATOM 1155 CZ TYR A 167 23.543 0.377 13.246 1.00 42.22 C ATOM 1156 OH TYR A 167 23.857 -0.974 13.217 1.00 43.60 O ATOM 1157 HH TYR A 167 23.769 -1.312 12.291 1.00 0.00 H ATOM 1158 H TYR A 167 24.620 5.308 12.047 1.00 0.00 H ATOM 1159 N ILE A 168 20.462 6.589 11.698 1.00 38.89 N ATOM 1160 CA ILE A 168 19.606 7.761 11.786 1.00 35.21 C ATOM 1161 C ILE A 168 18.162 7.281 11.808 1.00 41.60 C ATOM 1162 O ILE A 168 17.814 6.283 11.176 1.00 41.61 O ATOM 1163 CB ILE A 168 19.865 8.734 10.615 1.00 39.70 C ATOM 1164 CG1 ILE A 168 19.089 10.047 10.808 1.00 44.16 C ATOM 1165 CG2 ILE A 168 19.530 8.098 9.293 1.00 36.88 C ATOM 1166 CD1 ILE A 168 19.253 11.038 9.682 1.00 39.72 C ATOM 1167 H ILE A 168 20.074 5.723 11.273 1.00 0.00 H ATOM 1168 N THR A 169 17.327 7.969 12.563 1.00 41.36 N ATOM 1169 CA THR A 169 15.902 7.710 12.581 1.00 42.43 C ATOM 1170 C THR A 169 15.163 9.019 12.330 1.00 44.92 C ATOM 1171 O THR A 169 15.758 10.093 12.350 1.00 43.67 O ATOM 1172 CB THR A 169 15.479 7.107 13.913 1.00 42.91 C ATOM 1173 OG1 THR A 169 14.104 6.717 13.829 1.00 48.77 O ATOM 1174 CG2 THR A 169 15.655 8.132 15.012 1.00 44.41 C ATOM 1175 HG1 THR A 169 13.996 6.047 13.108 1.00 0.00 H ATOM 1176 H THR A 169 17.706 8.725 13.168 1.00 0.00 H ATOM 1177 N TYR A 170 13.851 8.927 12.115 1.00 40.97 N ATOM 1178 CA TYR A 170 13.053 10.041 11.618 1.00 43.63 C ATOM 1179 C TYR A 170 11.738 10.150 12.371 1.00 42.41 C ATOM 1180 O TYR A 170 11.209 9.159 12.868 1.00 47.03 O ATOM 1181 CB TYR A 170 12.756 9.884 10.137 1.00 44.30 C ATOM 1182 CG TYR A 170 14.003 9.859 9.318 1.00 46.71 C ATOM 1183 CD1 TYR A 170 14.668 11.047 9.018 1.00 43.87 C ATOM 1184 CD2 TYR A 170 14.535 8.656 8.853 1.00 42.94 C ATOM 1185 CE1 TYR A 170 15.816 11.048 8.279 1.00 41.25 C ATOM 1186 CE2 TYR A 170 15.697 8.652 8.099 1.00 43.78 C ATOM 1187 CZ TYR A 170 16.333 9.861 7.824 1.00 44.29 C ATOM 1188 OH TYR A 170 17.486 9.900 7.079 1.00 48.24 O ATOM 1189 HH TYR A 170 17.788 10.838 6.990 1.00 0.00 H ATOM 1190 H TYR A 170 13.377 8.022 12.310 1.00 0.00 H ATOM 1191 N GLU A 171 11.208 11.370 12.434 1.00 47.08 N ATOM 1192 CA GLU A 171 9.923 11.582 13.096 1.00 49.01 C ATOM 1193 C GLU A 171 8.781 10.920 12.341 1.00 41.14 C ATOM 1194 O GLU A 171 7.858 10.390 12.959 1.00 43.55 O ATOM 1195 CB GLU A 171 9.638 13.071 13.235 1.00 48.74 C ATOM 1196 CG GLU A 171 10.401 13.744 14.340 1.00 60.52 C ATOM 1197 CD GLU A 171 9.729 15.038 14.769 1.00 64.32 C ATOM 1198 OE1 GLU A 171 8.513 15.206 14.493 1.00 61.18 O ATOM 1199 OE2 GLU A 171 10.422 15.874 15.386 1.00 62.14 O ATOM 1200 H GLU A 171 11.711 12.175 12.010 1.00 0.00 H ATOM 1201 N LYS A 172 8.803 10.978 11.010 1.00 42.42 N ATOM 1202 CA LYS A 172 7.745 10.371 10.217 1.00 46.54 C ATOM 1203 C LYS A 172 7.827 8.853 10.201 1.00 47.75 C ATOM 1204 O LYS A 172 6.866 8.204 9.789 1.00 45.88 O ATOM 1205 CB LYS A 172 7.777 10.892 8.774 1.00 56.63 C ATOM 1206 CG LYS A 172 7.086 12.257 8.568 1.00 54.57 C ATOM 1207 CD LYS A 172 7.145 12.719 7.102 1.00 57.24 C ATOM 1208 CE LYS A 172 6.676 14.174 6.961 1.00 67.40 C ATOM 1209 NZ LYS A 172 7.143 14.853 5.709 1.00 68.60 N ATOM 1210 HZ1 LYS A 172 8.183 14.864 5.689 1.00 0.00 H ATOM 1211 HZ2 LYS A 172 6.785 14.335 4.881 1.00 0.00 H ATOM 1212 HZ3 LYS A 172 6.784 15.829 5.691 1.00 0.00 H ATOM 1213 H LYS A 172 9.588 11.464 10.531 1.00 0.00 H ATOM 1214 N ASP A 173 8.952 8.274 10.633 1.00 47.27 N ATOM 1215 CA ASP A 173 9.150 6.829 10.579 1.00 44.92 C ATOM 1216 C ASP A 173 10.184 6.424 11.615 1.00 41.56 C ATOM 1217 O ASP A 173 11.368 6.277 11.308 1.00 40.04 O ATOM 1218 CB ASP A 173 9.592 6.368 9.193 1.00 48.35 C ATOM 1219 CG ASP A 173 9.464 4.867 9.022 1.00 43.59 C ATOM 1220 OD1 ASP A 173 9.029 4.214 9.992 1.00 41.05 O ATOM 1221 OD2 ASP A 173 9.794 4.364 7.932 1.00 43.31 O ATOM 1222 H ASP A 173 9.710 8.872 11.020 1.00 0.00 H ATOM 1223 N PRO A 174 9.768 6.221 12.837 1.00 41.95 N ATOM 1224 CA PRO A 174 10.746 6.082 13.919 1.00 41.25 C ATOM 1225 C PRO A 174 11.420 4.728 13.962 1.00 43.57 C ATOM 1226 O PRO A 174 11.411 4.053 15.000 1.00 45.97 O ATOM 1227 CB PRO A 174 9.903 6.321 15.174 1.00 46.31 C ATOM 1228 CG PRO A 174 8.534 5.952 14.781 1.00 40.73 C ATOM 1229 CD PRO A 174 8.391 6.309 13.340 1.00 44.18 C ATOM 1230 N VAL A 175 12.027 4.320 12.848 1.00 43.72 N ATOM 1231 CA VAL A 175 12.795 3.084 12.848 1.00 44.65 C ATOM 1232 C VAL A 175 14.215 3.401 12.412 1.00 42.51 C ATOM 1233 O VAL A 175 14.555 4.561 12.156 1.00 42.39 O ATOM 1234 CB VAL A 175 12.143 2.008 11.966 1.00 39.78 C ATOM 1235 CG1 VAL A 175 10.704 1.812 12.387 1.00 39.85 C ATOM 1236 CG2 VAL A 175 12.248 2.365 10.489 1.00 41.64 C ATOM 1237 H VAL A 175 11.952 4.885 11.978 1.00 0.00 H ATOM 1238 N LEU A 176 15.052 2.375 12.337 1.00 40.11 N ATOM 1239 CA LEU A 176 16.487 2.558 12.185 1.00 40.30 C ATOM 1240 C LEU A 176 16.829 2.522 10.704 1.00 37.82 C ATOM 1241 O LEU A 176 16.700 1.480 10.057 1.00 41.89 O ATOM 1242 CB LEU A 176 17.241 1.484 12.966 1.00 40.86 C ATOM 1243 CG LEU A 176 18.767 1.558 12.916 1.00 43.58 C ATOM 1244 CD1 LEU A 176 19.277 2.860 13.498 1.00 41.64 C ATOM 1245 CD2 LEU A 176 19.353 0.373 13.663 1.00 41.95 C ATOM 1246 H LEU A 176 14.670 1.409 12.388 1.00 0.00 H ATOM 1247 N TYR A 177 17.232 3.662 10.165 1.00 35.74 N ATOM 1248 CA TYR A 177 17.777 3.765 8.823 1.00 36.96 C ATOM 1249 C TYR A 177 19.286 3.899 8.879 1.00 38.10 C ATOM 1250 O TYR A 177 19.885 4.104 9.938 1.00 39.26 O ATOM 1251 CB TYR A 177 17.249 4.990 8.098 1.00 39.22 C ATOM 1252 CG TYR A 177 15.823 4.952 7.710 1.00 36.38 C ATOM 1253 CD1 TYR A 177 14.820 5.039 8.657 1.00 37.29 C ATOM 1254 CD2 TYR A 177 15.473 4.879 6.380 1.00 39.44 C ATOM 1255 CE1 TYR A 177 13.494 5.035 8.279 1.00 38.92 C ATOM 1256 CE2 TYR A 177 14.165 4.864 5.996 1.00 44.16 C ATOM 1257 CZ TYR A 177 13.187 4.950 6.938 1.00 39.68 C ATOM 1258 OH TYR A 177 11.905 4.932 6.498 1.00 48.03 O ATOM 1259 HH TYR A 177 11.291 5.000 7.271 1.00 0.00 H ATOM 1260 H TYR A 177 17.154 4.530 10.733 1.00 0.00 H ATOM 1261 N MET A 178 19.896 3.868 7.701 1.00 37.83 N ATOM 1262 CA MET A 178 21.316 4.158 7.611 1.00 39.70 C ATOM 1263 C MET A 178 21.609 4.732 6.237 1.00 37.38 C ATOM 1264 O MET A 178 21.099 4.238 5.228 1.00 36.87 O ATOM 1265 CB MET A 178 22.183 2.919 7.921 1.00 40.05 C ATOM 1266 CG MET A 178 22.023 1.714 7.002 1.00 40.33 C ATOM 1267 SD MET A 178 22.937 0.258 7.578 1.00 48.70 S ATOM 1268 CE MET A 178 24.643 0.727 7.338 1.00 39.61 C ATOM 1269 H MET A 178 19.357 3.636 6.842 1.00 0.00 H ATOM 1270 N TYR A 179 22.389 5.815 6.227 1.00 42.07 N ATOM 1271 CA TYR A 179 22.716 6.574 5.029 1.00 39.92 C ATOM 1272 C TYR A 179 24.147 7.071 5.139 1.00 42.49 C ATOM 1273 O TYR A 179 24.677 7.228 6.242 1.00 42.23 O ATOM 1274 CB TYR A 179 21.783 7.773 4.823 1.00 38.44 C ATOM 1275 CG TYR A 179 20.393 7.389 4.409 1.00 37.51 C ATOM 1276 CD1 TYR A 179 20.127 6.948 3.114 1.00 32.48 C ATOM 1277 CD2 TYR A 179 19.339 7.454 5.316 1.00 35.33 C ATOM 1278 CE1 TYR A 179 18.842 6.585 2.735 1.00 35.29 C ATOM 1279 CE2 TYR A 179 18.054 7.077 4.947 1.00 36.25 C ATOM 1280 CZ TYR A 179 17.812 6.648 3.659 1.00 37.59 C ATOM 1281 OH TYR A 179 16.536 6.279 3.285 1.00 40.42 O ATOM 1282 HH TYR A 179 16.540 6.000 2.335 1.00 0.00 H ATOM 1283 H TYR A 179 22.788 6.137 7.132 1.00 0.00 H ATOM 1284 N GLN A 180 24.771 7.308 3.987 1.00 42.05 N ATOM 1285 CA GLN A 180 26.091 7.939 3.942 1.00 48.68 C ATOM 1286 C GLN A 180 25.895 9.445 4.100 1.00 49.48 C ATOM 1287 O GLN A 180 25.804 10.198 3.130 1.00 49.85 O ATOM 1288 CB GLN A 180 26.809 7.577 2.650 1.00 51.98 C ATOM 1289 CG GLN A 180 26.943 6.064 2.463 1.00 50.07 C ATOM 1290 CD GLN A 180 27.742 5.684 1.231 1.00 54.25 C ATOM 1291 OE1 GLN A 180 28.939 5.406 1.311 1.00 56.22 O ATOM 1292 NE2 GLN A 180 27.078 5.656 0.086 1.00 52.91 N ATOM 1293 HE22 GLN A 180 26.067 5.899 0.065 1.00 0.00 H ATOM 1294 HE21 GLN A 180 27.567 5.391 -0.793 1.00 0.00 H ATOM 1295 H GLN A 180 24.308 7.038 3.096 1.00 0.00 H ATOM 1296 N LEU A 181 25.819 9.886 5.356 1.00 47.05 N ATOM 1297 CA LEU A 181 25.368 11.239 5.623 1.00 49.01 C ATOM 1298 C LEU A 181 26.421 12.282 5.265 1.00 52.10 C ATOM 1299 O LEU A 181 26.062 13.407 4.885 1.00 50.32 O ATOM 1300 CB LEU A 181 24.952 11.359 7.088 1.00 49.12 C ATOM 1301 CG LEU A 181 23.651 10.641 7.439 1.00 43.34 C ATOM 1302 CD1 LEU A 181 23.212 10.999 8.841 1.00 45.92 C ATOM 1303 CD2 LEU A 181 22.553 10.962 6.432 1.00 48.94 C ATOM 1304 H LEU A 181 26.083 9.261 6.144 1.00 0.00 H ATOM 1305 N LEU A 182 27.712 11.941 5.371 1.00 51.33 N ATOM 1306 CA LEU A 182 28.747 12.915 5.023 1.00 53.48 C ATOM 1307 C LEU A 182 28.586 13.404 3.594 1.00 52.09 C ATOM 1308 O LEU A 182 28.814 14.581 3.314 1.00 57.52 O ATOM 1309 CB LEU A 182 30.138 12.315 5.213 1.00 52.74 C ATOM 1310 CG LEU A 182 30.396 11.792 6.622 1.00 58.66 C ATOM 1311 CD1 LEU A 182 31.521 10.760 6.632 1.00 64.66 C ATOM 1312 CD2 LEU A 182 30.704 12.950 7.538 1.00 63.75 C ATOM 1313 H LEU A 182 27.977 10.990 5.699 1.00 0.00 H ATOM 1314 N ASP A 183 28.175 12.528 2.682 1.00 54.08 N ATOM 1315 CA ASP A 183 27.980 12.939 1.298 1.00 54.54 C ATOM 1316 C ASP A 183 26.733 13.801 1.133 1.00 57.87 C ATOM 1317 O ASP A 183 26.783 14.842 0.465 1.00 61.18 O ATOM 1318 CB ASP A 183 27.918 11.704 0.399 1.00 55.37 C ATOM 1319 CG ASP A 183 29.234 10.969 0.350 1.00 59.70 C ATOM 1320 OD1 ASP A 183 30.236 11.561 -0.105 1.00 66.63 O ATOM 1321 OD2 ASP A 183 29.282 9.802 0.794 1.00 68.44 O ATOM 1322 H ASP A 183 27.991 11.542 2.959 1.00 0.00 H ATOM 1323 N ASP A 184 25.613 13.400 1.739 1.00 54.69 N ATOM 1324 CA ASP A 184 24.423 14.246 1.707 1.00 55.46 C ATOM 1325 C ASP A 184 24.692 15.605 2.336 1.00 53.65 C ATOM 1326 O ASP A 184 24.125 16.617 1.906 1.00 51.47 O ATOM 1327 CB ASP A 184 23.265 13.559 2.422 1.00 51.45 C ATOM 1328 CG ASP A 184 22.929 12.212 1.819 1.00 56.87 C ATOM 1329 OD1 ASP A 184 23.297 11.941 0.654 1.00 59.25 O ATOM 1330 OD2 ASP A 184 22.294 11.409 2.524 1.00 57.84 O ATOM 1331 H ASP A 184 25.588 12.486 2.234 1.00 0.00 H ATOM 1332 N TYR A 185 25.543 15.643 3.361 1.00 53.29 N ATOM 1333 CA TYR A 185 25.941 16.917 3.939 1.00 51.55 C ATOM 1334 C TYR A 185 26.654 17.776 2.906 1.00 55.38 C ATOM 1335 O TYR A 185 26.261 18.922 2.655 1.00 53.11 O ATOM 1336 CB TYR A 185 26.835 16.692 5.153 1.00 47.78 C ATOM 1337 CG TYR A 185 27.137 17.964 5.915 1.00 57.73 C ATOM 1338 CD1 TYR A 185 28.241 18.750 5.594 1.00 62.65 C ATOM 1339 CD2 TYR A 185 26.314 18.387 6.952 1.00 56.57 C ATOM 1340 CE1 TYR A 185 28.517 19.917 6.290 1.00 65.37 C ATOM 1341 CE2 TYR A 185 26.586 19.551 7.655 1.00 60.43 C ATOM 1342 CZ TYR A 185 27.686 20.310 7.316 1.00 67.96 C ATOM 1343 OH TYR A 185 27.962 21.465 8.006 1.00 74.25 O ATOM 1344 HH TYR A 185 28.780 21.882 7.635 1.00 0.00 H ATOM 1345 H TYR A 185 25.925 14.757 3.750 1.00 0.00 H ATOM 1346 N LYS A 186 27.701 17.230 2.282 1.00 57.09 N ATOM 1347 CA LYS A 186 28.457 18.018 1.315 1.00 57.98 C ATOM 1348 C LYS A 186 27.607 18.385 0.109 1.00 56.38 C ATOM 1349 O LYS A 186 27.777 19.467 -0.458 1.00 64.68 O ATOM 1350 CB LYS A 186 29.710 17.264 0.889 1.00 56.01 C ATOM 1351 CG LYS A 186 30.642 16.983 2.054 1.00 57.45 C ATOM 1352 CD LYS A 186 31.750 16.023 1.675 1.00 62.22 C ATOM 1353 CE LYS A 186 32.485 15.571 2.918 1.00 66.18 C ATOM 1354 NZ LYS A 186 33.545 14.585 2.599 1.00 72.22 N ATOM 1355 HZ1 LYS A 186 33.117 13.751 2.149 1.00 0.00 H ATOM 1356 HZ2 LYS A 186 34.233 15.016 1.949 1.00 0.00 H ATOM 1357 HZ3 LYS A 186 34.026 14.299 3.476 1.00 0.00 H ATOM 1358 H LYS A 186 27.976 16.248 2.485 1.00 0.00 H ATOM 1359 N GLU A 187 26.674 17.527 -0.281 1.00 60.44 N ATOM 1360 CA GLU A 187 25.766 17.899 -1.359 1.00 59.94 C ATOM 1361 C GLU A 187 24.752 18.966 -0.945 1.00 54.85 C ATOM 1362 O GLU A 187 23.992 19.431 -1.798 1.00 52.02 O ATOM 1363 CB GLU A 187 25.048 16.650 -1.878 1.00 56.83 C ATOM 1364 CG GLU A 187 25.985 15.600 -2.466 1.00 62.33 C ATOM 1365 CD GLU A 187 25.251 14.336 -2.921 1.00 77.37 C ATOM 1366 OE1 GLU A 187 25.354 13.978 -4.118 1.00 82.76 O ATOM 1367 OE2 GLU A 187 24.567 13.703 -2.081 1.00 71.40 O ATOM 1368 H GLU A 187 26.591 16.597 0.178 1.00 0.00 H ATOM 1369 N GLY A 188 24.720 19.366 0.325 1.00 53.59 N ATOM 1370 CA GLY A 188 23.728 20.310 0.790 1.00 48.93 C ATOM 1371 C GLY A 188 22.354 19.730 1.053 1.00 59.75 C ATOM 1372 O GLY A 188 21.366 20.474 1.072 1.00 57.68 O ATOM 1373 H GLY A 188 25.422 18.992 0.995 1.00 0.00 H ATOM 1374 N ASP A 189 22.252 18.423 1.271 1.00 57.13 N ATOM 1375 CA ASP A 189 20.966 17.785 1.506 1.00 57.80 C ATOM 1376 C ASP A 189 20.757 17.426 2.967 1.00 53.18 C ATOM 1377 O ASP A 189 19.774 16.768 3.302 1.00 54.63 O ATOM 1378 CB ASP A 189 20.826 16.549 0.618 1.00 56.94 C ATOM 1379 CG ASP A 189 20.695 16.912 -0.842 1.00 60.25 C ATOM 1380 OD1 ASP A 189 20.066 17.956 -1.126 1.00 71.36 O ATOM 1381 OD2 ASP A 189 21.222 16.174 -1.698 1.00 66.94 O ATOM 1382 H ASP A 189 23.114 17.841 1.274 1.00 0.00 H ATOM 1383 N LEU A 190 21.645 17.863 3.846 1.00 49.94 N ATOM 1384 CA LEU A 190 21.515 17.598 5.268 1.00 51.18 C ATOM 1385 C LEU A 190 21.927 18.839 6.039 1.00 50.96 C ATOM 1386 O LEU A 190 22.986 19.417 5.775 1.00 52.50 O ATOM 1387 CB LEU A 190 22.386 16.413 5.687 1.00 48.22 C ATOM 1388 CG LEU A 190 22.339 16.115 7.180 1.00 50.50 C ATOM 1389 CD1 LEU A 190 21.048 15.366 7.522 1.00 50.08 C ATOM 1390 CD2 LEU A 190 23.554 15.315 7.575 1.00 52.93 C ATOM 1391 H LEU A 190 22.461 18.413 3.508 1.00 0.00 H ATOM 1392 N ARG A 191 21.110 19.234 6.995 1.00 47.26 N ATOM 1393 CA ARG A 191 21.423 20.385 7.814 1.00 56.51 C ATOM 1394 C ARG A 191 21.320 19.991 9.273 1.00 52.30 C ATOM 1395 O ARG A 191 20.381 19.307 9.674 1.00 53.88 O ATOM 1396 CB ARG A 191 20.478 21.568 7.521 1.00 62.97 C ATOM 1397 CG ARG A 191 20.254 21.845 6.038 1.00 64.88 C ATOM 1398 CD ARG A 191 19.514 23.171 5.829 1.00 63.23 C ATOM 1399 NE ARG A 191 18.374 23.337 6.728 1.00 65.66 N ATOM 1400 CZ ARG A 191 17.101 23.271 6.344 1.00 75.47 C ATOM 1401 NH1 ARG A 191 16.804 23.044 5.068 1.00 72.44 N ATOM 1402 NH2 ARG A 191 16.123 23.436 7.234 1.00 75.11 N ATOM 1403 HE ARG A 191 18.570 23.518 7.733 1.00 0.00 H ATOM 1404 HH12 ARG A 191 15.810 22.992 4.767 1.00 0.00 H ATOM 1405 HH11 ARG A 191 17.566 22.918 4.371 1.00 0.00 H ATOM 1406 HH22 ARG A 191 15.130 23.384 6.931 1.00 0.00 H ATOM 1407 HH21 ARG A 191 16.353 23.617 8.232 1.00 0.00 H ATOM 1408 H ARG A 191 20.227 18.711 7.163 1.00 0.00 H ATOM 1409 N ILE A 192 22.273 20.429 10.053 1.00 59.00 N ATOM 1410 CA ILE A 192 22.273 20.213 11.491 1.00 58.62 C ATOM 1411 C ILE A 192 21.452 21.310 12.153 1.00 60.39 C ATOM 1412 O ILE A 192 21.484 22.468 11.724 1.00 70.37 O ATOM 1413 CB ILE A 192 23.722 20.169 12.009 1.00 57.71 C ATOM 1414 CG1 ILE A 192 24.502 19.142 11.182 1.00 62.53 C ATOM 1415 CG2 ILE A 192 23.763 19.833 13.491 1.00 61.90 C ATOM 1416 CD1 ILE A 192 25.756 18.595 11.836 1.00 62.13 C ATOM 1417 H ILE A 192 23.064 20.954 9.628 1.00 0.00 H ATOM 1418 N MET A 193 20.660 20.935 13.200 1.00 63.26 N ATOM 1419 CA MET A 193 19.779 21.837 13.927 1.00 68.57 C ATOM 1420 C MET A 193 20.396 22.242 15.261 1.00 76.09 C ATOM 1421 O MET A 193 21.175 21.480 15.845 1.00 76.97 O ATOM 1422 CB MET A 193 18.420 21.180 14.193 1.00 67.30 C ATOM 1423 CG MET A 193 17.575 20.876 12.960 1.00 68.95 C ATOM 1424 SD MET A 193 17.008 22.331 12.044 1.00 88.01 S ATOM 1425 CE MET A 193 18.133 22.297 10.640 1.00 66.83 C ATOM 1426 H MET A 193 20.688 19.939 13.498 1.00 0.00 H ATOM 1427 N PRO A 194 20.062 23.432 15.770 1.00 74.65 N ATOM 1428 CA PRO A 194 20.554 23.830 17.095 1.00 74.10 C ATOM 1429 C PRO A 194 19.926 22.992 18.199 1.00 79.88 C ATOM 1430 O PRO A 194 18.759 22.597 18.130 1.00 80.31 O ATOM 1431 CB PRO A 194 20.147 25.303 17.207 1.00 81.29 C ATOM 1432 CG PRO A 194 19.044 25.478 16.214 1.00 84.66 C ATOM 1433 CD PRO A 194 19.313 24.509 15.102 1.00 78.01 C ATOM 1434 N ASP A 195 20.726 22.723 19.226 1.00 86.54 N ATOM 1435 CA ASP A 195 20.351 21.811 20.298 1.00 80.65 C ATOM 1436 C ASP A 195 19.212 22.376 21.142 1.00 88.65 C ATOM 1437 O ASP A 195 18.474 21.630 21.791 1.00 89.29 O ATOM 1438 CB ASP A 195 21.571 21.520 21.176 1.00 85.28 C ATOM 1439 CG ASP A 195 21.517 20.141 21.816 1.00 93.05 C ATOM 1440 OD1 ASP A 195 20.399 19.651 22.069 1.00 98.60 O ATOM 1441 OD2 ASP A 195 22.585 19.546 22.065 1.00 86.52 O ATOM 1442 H ASP A 195 21.658 23.183 19.266 1.00 0.00 H TER 1443 ASP A 195 ATOM 1444 N SER A 212 20.653 0.940 31.221 1.00 76.76 N ATOM 1445 CA SER A 212 20.129 0.037 32.238 1.00 75.05 C ATOM 1446 C SER A 212 18.887 -0.686 31.750 1.00 71.19 C ATOM 1447 O SER A 212 18.624 -1.813 32.164 1.00 71.94 O ATOM 1448 CB SER A 212 19.812 0.805 33.526 1.00 74.47 C ATOM 1449 OG SER A 212 20.988 1.354 34.093 1.00 80.70 O ATOM 1450 HG SER A 212 20.756 1.844 34.922 1.00 0.00 H ATOM 1451 HN3 SER A 212 19.930 1.649 30.983 1.00 0.00 H ATOM 1452 HN2 SER A 212 20.900 0.396 30.370 1.00 0.00 H ATOM 1453 HN1 SER A 212 21.501 1.418 31.587 1.00 0.00 H ATOM 1454 N LEU A 213 18.118 -0.037 30.871 1.00 69.23 N ATOM 1455 CA LEU A 213 16.900 -0.645 30.338 1.00 64.69 C ATOM 1456 C LEU A 213 17.164 -1.777 29.355 1.00 63.71 C ATOM 1457 O LEU A 213 16.234 -2.529 29.043 1.00 64.62 O ATOM 1458 CB LEU A 213 16.047 0.407 29.643 1.00 65.31 C ATOM 1459 CG LEU A 213 15.064 1.147 30.528 1.00 69.73 C ATOM 1460 CD1 LEU A 213 14.406 2.254 29.729 1.00 66.38 C ATOM 1461 CD2 LEU A 213 14.041 0.155 31.048 1.00 73.01 C ATOM 1462 H LEU A 213 18.391 0.917 30.561 1.00 0.00 H ATOM 1463 N VAL A 214 18.387 -1.909 28.844 1.00 59.33 N ATOM 1464 CA VAL A 214 18.639 -2.921 27.829 1.00 62.74 C ATOM 1465 C VAL A 214 18.367 -4.309 28.401 1.00 62.15 C ATOM 1466 O VAL A 214 18.695 -4.607 29.556 1.00 63.19 O ATOM 1467 CB VAL A 214 20.076 -2.804 27.292 1.00 63.65 C ATOM 1468 CG1 VAL A 214 20.282 -3.758 26.134 1.00 63.39 C ATOM 1469 CG2 VAL A 214 20.342 -1.404 26.844 1.00 56.29 C ATOM 1470 H VAL A 214 19.158 -1.292 29.169 1.00 0.00 H ATOM 1471 N GLY A 215 17.737 -5.161 27.588 1.00 61.23 N ATOM 1472 CA GLY A 215 17.373 -6.502 27.986 1.00 64.24 C ATOM 1473 C GLY A 215 15.993 -6.642 28.591 1.00 66.95 C ATOM 1474 O GLY A 215 15.516 -7.772 28.741 1.00 70.30 O ATOM 1475 H GLY A 215 17.498 -4.846 26.626 1.00 0.00 H ATOM 1476 N LYS A 216 15.338 -5.537 28.935 1.00 62.95 N ATOM 1477 CA LYS A 216 14.062 -5.588 29.625 1.00 60.47 C ATOM 1478 C LYS A 216 12.914 -5.736 28.636 1.00 63.45 C ATOM 1479 O LYS A 216 12.944 -5.188 27.530 1.00 62.61 O ATOM 1480 CB LYS A 216 13.855 -4.326 30.469 1.00 66.12 C ATOM 1481 CG LYS A 216 14.508 -4.372 31.847 1.00 69.11 C ATOM 1482 CD LYS A 216 16.030 -4.206 31.779 1.00 67.39 C ATOM 1483 CE LYS A 216 16.674 -4.435 33.145 1.00 67.60 C ATOM 1484 NZ LYS A 216 16.330 -5.806 33.660 1.00 71.91 N ATOM 1485 HZ1 LYS A 216 15.298 -5.892 33.752 1.00 0.00 H ATOM 1486 HZ2 LYS A 216 16.681 -6.523 32.994 1.00 0.00 H ATOM 1487 HZ3 LYS A 216 16.775 -5.948 34.589 1.00 0.00 H ATOM 1488 H LYS A 216 15.751 -4.611 28.703 1.00 0.00 H ATOM 1489 N GLN A 217 11.897 -6.481 29.047 1.00 67.23 N ATOM 1490 CA GLN A 217 10.697 -6.612 28.243 1.00 60.53 C ATOM 1491 C GLN A 217 9.860 -5.356 28.387 1.00 60.18 C ATOM 1492 O GLN A 217 9.859 -4.702 29.432 1.00 65.11 O ATOM 1493 CB GLN A 217 9.897 -7.837 28.675 1.00 63.50 C ATOM 1494 CG GLN A 217 10.643 -9.140 28.442 1.00 71.73 C ATOM 1495 CD GLN A 217 10.764 -9.473 26.967 1.00 73.65 C ATOM 1496 OE1 GLN A 217 9.765 -9.494 26.242 1.00 72.72 O ATOM 1497 NE2 GLN A 217 11.988 -9.727 26.512 1.00 74.27 N ATOM 1498 HE22 GLN A 217 12.800 -9.698 27.161 1.00 0.00 H ATOM 1499 HE21 GLN A 217 12.133 -9.955 25.508 1.00 0.00 H ATOM 1500 H GLN A 217 11.961 -6.978 29.958 1.00 0.00 H ATOM 1501 N VAL A 218 9.134 -5.018 27.327 1.00 51.65 N ATOM 1502 CA VAL A 218 8.410 -3.760 27.295 1.00 55.23 C ATOM 1503 C VAL A 218 7.238 -3.925 26.343 1.00 54.82 C ATOM 1504 O VAL A 218 7.257 -4.785 25.462 1.00 56.03 O ATOM 1505 CB VAL A 218 9.373 -2.611 26.887 1.00 58.48 C ATOM 1506 CG1 VAL A 218 10.011 -2.907 25.533 1.00 58.35 C ATOM 1507 CG2 VAL A 218 8.687 -1.276 26.881 1.00 62.08 C ATOM 1508 H VAL A 218 9.084 -5.661 26.511 1.00 0.00 H ATOM 1509 N GLU A 219 6.202 -3.112 26.531 1.00 59.46 N ATOM 1510 CA GLU A 219 5.082 -3.124 25.603 1.00 65.64 C ATOM 1511 C GLU A 219 4.603 -1.705 25.337 1.00 66.95 C ATOM 1512 O GLU A 219 4.630 -0.837 26.216 1.00 70.08 O ATOM 1513 CB GLU A 219 3.926 -4.000 26.104 1.00 60.70 C ATOM 1514 CG GLU A 219 3.353 -3.618 27.444 1.00 66.28 C ATOM 1515 CD GLU A 219 2.267 -4.588 27.905 1.00 70.85 C ATOM 1516 OE1 GLU A 219 2.455 -5.816 27.719 1.00 62.44 O ATOM 1517 OE2 GLU A 219 1.229 -4.121 28.442 1.00 69.09 O ATOM 1518 H GLU A 219 6.193 -2.465 27.345 1.00 0.00 H ATOM 1519 N TYR A 220 4.164 -1.484 24.103 1.00 66.96 N ATOM 1520 CA TYR A 220 3.788 -0.163 23.616 1.00 71.41 C ATOM 1521 C TYR A 220 2.293 -0.203 23.337 1.00 72.65 C ATOM 1522 O TYR A 220 1.848 -0.874 22.397 1.00 71.95 O ATOM 1523 CB TYR A 220 4.603 0.195 22.369 1.00 73.79 C ATOM 1524 CG TYR A 220 4.333 1.546 21.741 1.00 67.70 C ATOM 1525 CD1 TYR A 220 4.847 2.713 22.292 1.00 72.35 C ATOM 1526 CD2 TYR A 220 3.596 1.646 20.568 1.00 74.30 C ATOM 1527 CE1 TYR A 220 4.607 3.959 21.702 1.00 70.05 C ATOM 1528 CE2 TYR A 220 3.350 2.876 19.975 1.00 77.06 C ATOM 1529 CZ TYR A 220 3.857 4.027 20.542 1.00 74.81 C ATOM 1530 OH TYR A 220 3.607 5.237 19.936 1.00 76.00 O ATOM 1531 HH TYR A 220 4.034 5.961 20.459 1.00 0.00 H ATOM 1532 H TYR A 220 4.085 -2.292 23.453 1.00 0.00 H ATOM 1533 N ALA A 221 1.520 0.489 24.173 1.00 75.61 N ATOM 1534 CA ALA A 221 0.072 0.555 24.012 1.00 82.86 C ATOM 1535 C ALA A 221 -0.246 1.513 22.873 1.00 82.75 C ATOM 1536 O ALA A 221 -0.019 2.722 22.992 1.00 82.08 O ATOM 1537 CB ALA A 221 -0.588 1.005 25.312 1.00 86.67 C ATOM 1538 H ALA A 221 1.963 0.998 24.965 1.00 0.00 H ATOM 1539 N LYS A 222 -0.762 0.981 21.764 1.00 85.97 N ATOM 1540 CA LYS A 222 -1.085 1.790 20.589 1.00 88.06 C ATOM 1541 C LYS A 222 -2.562 1.606 20.238 1.00 93.97 C ATOM 1542 O LYS A 222 -2.938 0.638 19.567 1.00 96.84 O ATOM 1543 CB LYS A 222 -0.192 1.431 19.408 1.00 83.21 C ATOM 1544 CG LYS A 222 -0.346 2.377 18.235 1.00 88.29 C ATOM 1545 CD LYS A 222 0.006 3.811 18.645 1.00 89.12 C ATOM 1546 CE LYS A 222 -0.149 4.777 17.480 1.00 83.22 C ATOM 1547 NZ LYS A 222 0.169 6.186 17.860 1.00 81.62 N ATOM 1548 HZ1 LYS A 222 -0.473 6.492 18.619 1.00 0.00 H ATOM 1549 HZ2 LYS A 222 1.153 6.240 18.193 1.00 0.00 H ATOM 1550 HZ3 LYS A 222 0.048 6.803 17.032 1.00 0.00 H ATOM 1551 H LYS A 222 -0.941 -0.043 21.734 1.00 0.00 H ATOM 1552 N GLU A 223 -3.394 2.540 20.693 1.00 95.70 N ATOM 1553 CA GLU A 223 -4.781 2.596 20.260 1.00 97.31 C ATOM 1554 C GLU A 223 -4.841 3.049 18.799 1.00 98.61 C ATOM 1555 O GLU A 223 -3.914 3.694 18.294 1.00 95.28 O ATOM 1556 CB GLU A 223 -5.566 3.545 21.170 1.00 92.84 C ATOM 1557 CG GLU A 223 -4.906 4.889 21.367 1.00 94.65 C ATOM 1558 CD GLU A 223 -4.991 5.349 22.801 1.00 99.77 C ATOM 1559 OE1 GLU A 223 -5.211 4.481 23.676 1.00101.64 O ATOM 1560 OE2 GLU A 223 -4.844 6.565 23.053 1.00 92.61 O ATOM 1561 H GLU A 223 -3.044 3.245 21.373 1.00 0.00 H ATOM 1562 N ASP A 224 -5.926 2.696 18.102 1.00 97.30 N ATOM 1563 CA ASP A 224 -7.053 1.932 18.637 1.00 97.33 C ATOM 1564 C ASP A 224 -6.791 0.438 18.693 1.00 98.58 C ATOM 1565 O ASP A 224 -6.192 -0.144 17.785 1.00 96.31 O ATOM 1566 CB ASP A 224 -8.319 2.184 17.799 1.00101.35 C ATOM 1567 CG ASP A 224 -9.134 3.367 18.295 1.00110.00 C ATOM 1568 OD1 ASP A 224 -8.556 4.282 18.919 1.00111.98 O ATOM 1569 OD2 ASP A 224 -10.363 3.377 18.062 1.00111.46 O ATOM 1570 H ASP A 224 -5.972 2.986 17.104 1.00 0.00 H ATOM 1571 N GLY A 225 -7.250 -0.184 19.772 1.00 98.63 N ATOM 1572 CA GLY A 225 -7.179 -1.625 19.875 1.00 92.62 C ATOM 1573 C GLY A 225 -6.019 -2.143 20.693 1.00 95.49 C ATOM 1574 O GLY A 225 -5.937 -1.900 21.901 1.00 93.80 O ATOM 1575 H GLY A 225 -7.664 0.369 20.549 1.00 0.00 H ATOM 1576 N SER A 226 -5.104 -2.843 20.035 1.00 98.30 N ATOM 1577 CA SER A 226 -4.160 -3.706 20.727 1.00 93.51 C ATOM 1578 C SER A 226 -2.837 -2.979 20.996 1.00 92.99 C ATOM 1579 O SER A 226 -2.710 -1.755 20.860 1.00 83.65 O ATOM 1580 CB SER A 226 -3.928 -4.989 19.923 1.00 89.31 C ATOM 1581 OG SER A 226 -5.120 -5.767 19.827 1.00 93.14 O ATOM 1582 HG SER A 226 -4.936 -6.587 19.303 1.00 0.00 H ATOM 1583 H SER A 226 -5.061 -2.773 18.998 1.00 0.00 H ATOM 1584 N LYS A 227 -1.832 -3.752 21.404 1.00 88.92 N ATOM 1585 CA LYS A 227 -0.510 -3.266 21.756 1.00 80.73 C ATOM 1586 C LYS A 227 0.517 -4.143 21.059 1.00 72.72 C ATOM 1587 O LYS A 227 0.184 -5.164 20.451 1.00 77.00 O ATOM 1588 CB LYS A 227 -0.297 -3.308 23.271 1.00 74.37 C ATOM 1589 CG LYS A 227 -0.582 -4.667 23.835 1.00 72.30 C ATOM 1590 CD LYS A 227 -0.341 -4.752 25.318 1.00 73.56 C ATOM 1591 CE LYS A 227 -0.635 -6.166 25.782 1.00 64.47 C ATOM 1592 NZ LYS A 227 -0.164 -6.451 27.167 1.00 63.92 N ATOM 1593 HZ1 LYS A 227 0.866 -6.316 27.216 1.00 0.00 H ATOM 1594 HZ2 LYS A 227 -0.632 -5.802 27.831 1.00 0.00 H ATOM 1595 HZ3 LYS A 227 -0.398 -7.433 27.416 1.00 0.00 H ATOM 1596 H LYS A 227 -2.006 -4.775 21.475 1.00 0.00 H ATOM 1597 N ARG A 228 1.775 -3.732 21.150 1.00 67.61 N ATOM 1598 CA ARG A 228 2.906 -4.523 20.693 1.00 58.49 C ATOM 1599 C ARG A 228 3.840 -4.776 21.864 1.00 56.85 C ATOM 1600 O ARG A 228 4.041 -3.901 22.707 1.00 65.57 O ATOM 1601 CB ARG A 228 3.679 -3.815 19.583 1.00 64.91 C ATOM 1602 CG ARG A 228 2.808 -3.257 18.480 1.00 67.16 C ATOM 1603 CD ARG A 228 3.411 -1.963 17.995 1.00 70.32 C ATOM 1604 NE ARG A 228 3.980 -2.034 16.653 1.00 64.98 N ATOM 1605 CZ ARG A 228 4.501 -0.984 16.025 1.00 69.49 C ATOM 1606 NH1 ARG A 228 4.540 0.207 16.626 1.00 63.79 N ATOM 1607 NH2 ARG A 228 4.988 -1.121 14.801 1.00 68.73 N ATOM 1608 HE ARG A 228 3.978 -2.952 16.163 1.00 0.00 H ATOM 1609 HH12 ARG A 228 4.948 1.026 16.132 1.00 0.00 H ATOM 1610 HH11 ARG A 228 4.162 0.316 17.589 1.00 0.00 H ATOM 1611 HH22 ARG A 228 5.396 -0.301 14.309 1.00 0.00 H ATOM 1612 HH21 ARG A 228 4.963 -2.049 14.332 1.00 0.00 H ATOM 1613 H ARG A 228 1.961 -2.798 21.569 1.00 0.00 H ATOM 1614 N THR A 229 4.399 -5.977 21.922 1.00 59.15 N ATOM 1615 CA THR A 229 5.373 -6.345 22.935 1.00 57.06 C ATOM 1616 C THR A 229 6.734 -6.552 22.281 1.00 53.65 C ATOM 1617 O THR A 229 6.828 -6.807 21.077 1.00 54.27 O ATOM 1618 CB THR A 229 4.942 -7.620 23.663 1.00 58.47 C ATOM 1619 OG1 THR A 229 4.663 -8.632 22.698 1.00 60.87 O ATOM 1620 CG2 THR A 229 3.687 -7.371 24.476 1.00 64.19 C ATOM 1621 HG1 THR A 229 5.477 -8.810 22.164 1.00 0.00 H ATOM 1622 H THR A 229 4.128 -6.686 21.211 1.00 0.00 H ATOM 1623 N GLY A 230 7.787 -6.430 23.079 1.00 53.48 N ATOM 1624 CA GLY A 230 9.126 -6.573 22.547 1.00 52.90 C ATOM 1625 C GLY A 230 10.178 -6.360 23.612 1.00 55.14 C ATOM 1626 O GLY A 230 9.880 -6.303 24.807 1.00 58.71 O ATOM 1627 H GLY A 230 7.650 -6.231 24.091 1.00 0.00 H ATOM 1628 N MET A 231 11.425 -6.228 23.155 1.00 51.59 N ATOM 1629 CA MET A 231 12.571 -6.080 24.042 1.00 55.81 C ATOM 1630 C MET A 231 13.409 -4.859 23.672 1.00 52.84 C ATOM 1631 O MET A 231 13.588 -4.546 22.491 1.00 54.35 O ATOM 1632 CB MET A 231 13.450 -7.321 24.001 1.00 53.91 C ATOM 1633 CG MET A 231 14.652 -7.243 24.916 1.00 59.53 C ATOM 1634 SD MET A 231 15.501 -8.820 24.992 1.00 75.41 S ATOM 1635 CE MET A 231 15.970 -9.001 23.272 1.00 64.84 C ATOM 1636 H MET A 231 11.584 -6.231 22.127 1.00 0.00 H ATOM 1637 N VAL A 232 13.928 -4.181 24.691 1.00 52.69 N ATOM 1638 CA VAL A 232 14.921 -3.129 24.496 1.00 50.39 C ATOM 1639 C VAL A 232 16.273 -3.779 24.261 1.00 56.63 C ATOM 1640 O VAL A 232 16.738 -4.576 25.085 1.00 55.55 O ATOM 1641 CB VAL A 232 14.976 -2.201 25.714 1.00 54.82 C ATOM 1642 CG1 VAL A 232 16.010 -1.119 25.483 1.00 59.83 C ATOM 1643 CG2 VAL A 232 13.612 -1.588 25.983 1.00 52.62 C ATOM 1644 H VAL A 232 13.617 -4.407 25.657 1.00 0.00 H ATOM 1645 N ILE A 233 16.911 -3.460 23.138 1.00 52.57 N ATOM 1646 CA ILE A 233 18.122 -4.178 22.758 1.00 53.95 C ATOM 1647 C ILE A 233 19.370 -3.318 22.786 1.00 50.93 C ATOM 1648 O ILE A 233 20.475 -3.875 22.840 1.00 58.45 O ATOM 1649 CB ILE A 233 17.984 -4.857 21.377 1.00 46.67 C ATOM 1650 CG1 ILE A 233 17.733 -3.829 20.275 1.00 52.84 C ATOM 1651 CG2 ILE A 233 16.876 -5.860 21.398 1.00 52.76 C ATOM 1652 CD1 ILE A 233 17.971 -4.375 18.882 1.00 43.30 C ATOM 1653 H ILE A 233 16.546 -2.698 22.531 1.00 0.00 H ATOM 1654 N HIS A 234 19.266 -1.994 22.764 1.00 55.61 N ATOM 1655 CA HIS A 234 20.459 -1.171 22.659 1.00 54.63 C ATOM 1656 C HIS A 234 20.174 0.217 23.207 1.00 56.34 C ATOM 1657 O HIS A 234 19.085 0.770 23.009 1.00 56.98 O ATOM 1658 CB HIS A 234 20.930 -1.079 21.201 1.00 55.89 C ATOM 1659 CG HIS A 234 22.176 -0.273 21.011 1.00 53.94 C ATOM 1660 ND1 HIS A 234 23.434 -0.782 21.260 1.00 54.53 N ATOM 1661 CD2 HIS A 234 22.361 0.997 20.575 1.00 51.16 C ATOM 1662 CE1 HIS A 234 24.340 0.144 20.991 1.00 52.90 C ATOM 1663 NE2 HIS A 234 23.715 1.233 20.578 1.00 49.92 N ATOM 1664 H HIS A 234 18.329 -1.546 22.822 1.00 0.00 H ATOM 1665 N GLN A 235 21.162 0.773 23.905 1.00 55.67 N ATOM 1666 CA GLN A 235 21.115 2.155 24.361 1.00 58.52 C ATOM 1667 C GLN A 235 22.071 2.989 23.524 1.00 52.08 C ATOM 1668 O GLN A 235 23.257 2.657 23.409 1.00 49.29 O ATOM 1669 CB GLN A 235 21.488 2.274 25.835 1.00 61.51 C ATOM 1670 CG GLN A 235 21.446 3.694 26.362 1.00 59.57 C ATOM 1671 CD GLN A 235 21.924 3.776 27.792 1.00 59.84 C ATOM 1672 OE1 GLN A 235 21.126 3.740 28.728 1.00 64.57 O ATOM 1673 NE2 GLN A 235 23.236 3.862 27.971 1.00 59.47 N ATOM 1674 HE22 GLN A 235 23.872 3.890 27.149 1.00 0.00 H ATOM 1675 HE21 GLN A 235 23.628 3.902 28.933 1.00 0.00 H ATOM 1676 H GLN A 235 21.999 0.199 24.133 1.00 0.00 H ATOM 1677 N VAL A 236 21.550 4.066 22.941 1.00 52.39 N ATOM 1678 CA VAL A 236 22.372 4.966 22.137 1.00 59.16 C ATOM 1679 C VAL A 236 23.300 5.748 23.059 1.00 55.81 C ATOM 1680 O VAL A 236 22.841 6.473 23.947 1.00 61.06 O ATOM 1681 CB VAL A 236 21.495 5.903 21.301 1.00 57.54 C ATOM 1682 CG1 VAL A 236 22.361 6.929 20.593 1.00 50.99 C ATOM 1683 CG2 VAL A 236 20.681 5.082 20.311 1.00 53.67 C ATOM 1684 H VAL A 236 20.537 4.271 23.060 1.00 0.00 H ATOM 1685 N GLU A 237 24.612 5.592 22.854 1.00 54.81 N ATOM 1686 CA GLU A 237 25.584 6.237 23.734 1.00 60.02 C ATOM 1687 C GLU A 237 25.520 7.751 23.632 1.00 61.47 C ATOM 1688 O GLU A 237 25.642 8.447 24.645 1.00 67.15 O ATOM 1689 CB GLU A 237 26.996 5.757 23.411 1.00 60.55 C ATOM 1690 CG GLU A 237 27.327 4.425 24.012 1.00 71.51 C ATOM 1691 CD GLU A 237 28.812 4.122 23.968 1.00 85.98 C ATOM 1692 OE1 GLU A 237 29.588 4.976 23.490 1.00 83.72 O ATOM 1693 OE2 GLU A 237 29.205 3.028 24.421 1.00 95.42 O ATOM 1694 H GLU A 237 24.944 5.006 22.061 1.00 0.00 H ATOM 1695 N ALA A 238 25.320 8.279 22.422 1.00 59.12 N ATOM 1696 CA ALA A 238 25.295 9.728 22.228 1.00 56.20 C ATOM 1697 C ALA A 238 24.068 10.385 22.854 1.00 61.63 C ATOM 1698 O ALA A 238 24.091 11.583 23.153 1.00 64.04 O ATOM 1699 CB ALA A 238 25.353 10.043 20.738 1.00 57.13 C ATOM 1700 H ALA A 238 25.180 7.650 21.605 1.00 0.00 H ATOM 1701 N LYS A 239 22.979 9.643 23.035 1.00 64.42 N ATOM 1702 CA LYS A 239 21.805 10.156 23.744 1.00 64.46 C ATOM 1703 C LYS A 239 21.249 9.008 24.570 1.00 63.98 C ATOM 1704 O LYS A 239 20.377 8.254 24.114 1.00 62.92 O ATOM 1705 CB LYS A 239 20.748 10.723 22.791 1.00 58.12 C ATOM 1706 CG LYS A 239 21.074 12.091 22.240 1.00 65.62 C ATOM 1707 CD LYS A 239 19.808 12.914 21.925 1.00 69.03 C ATOM 1708 CE LYS A 239 18.940 13.130 23.169 1.00 70.14 C ATOM 1709 NZ LYS A 239 17.939 14.235 22.997 1.00 70.24 N ATOM 1710 HZ1 LYS A 239 18.438 15.126 22.799 1.00 0.00 H ATOM 1711 HZ2 LYS A 239 17.306 14.007 22.204 1.00 0.00 H ATOM 1712 HZ3 LYS A 239 17.381 14.335 23.869 1.00 0.00 H ATOM 1713 H LYS A 239 22.961 8.672 22.663 1.00 0.00 H ATOM 1714 N PRO A 240 21.730 8.850 25.808 1.00 65.77 N ATOM 1715 CA PRO A 240 21.431 7.628 26.574 1.00 62.69 C ATOM 1716 C PRO A 240 19.957 7.421 26.870 1.00 63.91 C ATOM 1717 O PRO A 240 19.584 6.324 27.307 1.00 66.02 O ATOM 1718 CB PRO A 240 22.236 7.823 27.865 1.00 63.74 C ATOM 1719 CG PRO A 240 23.328 8.790 27.477 1.00 66.38 C ATOM 1720 CD PRO A 240 22.654 9.738 26.532 1.00 64.80 C ATOM 1721 N SER A 241 19.109 8.420 26.646 1.00 62.18 N ATOM 1722 CA SER A 241 17.680 8.239 26.854 1.00 66.40 C ATOM 1723 C SER A 241 16.991 7.556 25.679 1.00 63.03 C ATOM 1724 O SER A 241 15.797 7.257 25.775 1.00 63.27 O ATOM 1725 CB SER A 241 17.020 9.595 27.113 1.00 59.69 C ATOM 1726 OG SER A 241 17.028 10.366 25.932 1.00 63.97 O ATOM 1727 HG SER A 241 16.527 9.888 25.224 1.00 0.00 H ATOM 1728 H SER A 241 19.470 9.339 26.319 1.00 0.00 H ATOM 1729 N VAL A 242 17.700 7.319 24.577 1.00 61.71 N ATOM 1730 CA VAL A 242 17.132 6.730 23.369 1.00 59.93 C ATOM 1731 C VAL A 242 17.534 5.265 23.283 1.00 59.74 C ATOM 1732 O VAL A 242 18.680 4.901 23.578 1.00 58.95 O ATOM 1733 CB VAL A 242 17.595 7.496 22.118 1.00 64.28 C ATOM 1734 CG1 VAL A 242 16.889 6.963 20.905 1.00 57.25 C ATOM 1735 CG2 VAL A 242 17.333 8.991 22.281 1.00 65.45 C ATOM 1736 H VAL A 242 18.710 7.566 24.577 1.00 0.00 H ATOM 1737 N TYR A 243 16.602 4.420 22.858 1.00 57.06 N ATOM 1738 CA TYR A 243 16.851 2.988 22.816 1.00 57.10 C ATOM 1739 C TYR A 243 16.344 2.389 21.520 1.00 51.74 C ATOM 1740 O TYR A 243 15.387 2.877 20.916 1.00 50.53 O ATOM 1741 CB TYR A 243 16.173 2.252 23.971 1.00 55.57 C ATOM 1742 CG TYR A 243 16.730 2.593 25.321 1.00 58.34 C ATOM 1743 CD1 TYR A 243 16.240 3.685 26.037 1.00 62.43 C ATOM 1744 CD2 TYR A 243 17.749 1.836 25.884 1.00 56.68 C ATOM 1745 CE1 TYR A 243 16.741 4.004 27.279 1.00 60.53 C ATOM 1746 CE2 TYR A 243 18.254 2.147 27.135 1.00 60.64 C ATOM 1747 CZ TYR A 243 17.745 3.233 27.824 1.00 66.36 C ATOM 1748 OH TYR A 243 18.239 3.558 29.065 1.00 74.98 O ATOM 1749 HH TYR A 243 19.207 3.754 28.993 1.00 0.00 H ATOM 1750 H TYR A 243 15.679 4.788 22.550 1.00 0.00 H ATOM 1751 N PHE A 244 16.990 1.308 21.116 1.00 50.37 N ATOM 1752 CA PHE A 244 16.476 0.468 20.053 1.00 51.71 C ATOM 1753 C PHE A 244 15.518 -0.546 20.665 1.00 48.98 C ATOM 1754 O PHE A 244 15.729 -1.016 21.784 1.00 50.01 O ATOM 1755 CB PHE A 244 17.614 -0.241 19.320 1.00 52.27 C ATOM 1756 CG PHE A 244 18.557 0.692 18.613 1.00 48.61 C ATOM 1757 CD1 PHE A 244 18.232 2.024 18.425 1.00 48.76 C ATOM 1758 CD2 PHE A 244 19.764 0.234 18.117 1.00 50.06 C ATOM 1759 CE1 PHE A 244 19.097 2.888 17.772 1.00 47.56 C ATOM 1760 CE2 PHE A 244 20.628 1.091 17.460 1.00 50.93 C ATOM 1761 CZ PHE A 244 20.287 2.426 17.284 1.00 46.50 C ATOM 1762 H PHE A 244 17.889 1.054 21.573 1.00 0.00 H ATOM 1763 N ILE A 245 14.443 -0.851 19.951 1.00 43.86 N ATOM 1764 CA ILE A 245 13.456 -1.804 20.438 1.00 51.30 C ATOM 1765 C ILE A 245 13.116 -2.792 19.326 1.00 46.14 C ATOM 1766 O ILE A 245 12.787 -2.387 18.205 1.00 46.61 O ATOM 1767 CB ILE A 245 12.203 -1.085 20.972 1.00 47.49 C ATOM 1768 CG1 ILE A 245 12.580 -0.309 22.239 1.00 49.75 C ATOM 1769 CG2 ILE A 245 11.110 -2.087 21.298 1.00 53.76 C ATOM 1770 CD1 ILE A 245 11.620 0.780 22.632 1.00 54.22 C ATOM 1771 H ILE A 245 14.302 -0.400 19.024 1.00 0.00 H ATOM 1772 N LYS A 246 13.247 -4.084 19.624 1.00 48.78 N ATOM 1773 CA LYS A 246 12.777 -5.153 18.741 1.00 48.32 C ATOM 1774 C LYS A 246 11.405 -5.619 19.220 1.00 49.52 C ATOM 1775 O LYS A 246 11.281 -6.155 20.327 1.00 49.35 O ATOM 1776 CB LYS A 246 13.752 -6.328 18.713 1.00 46.58 C ATOM 1777 CG LYS A 246 13.292 -7.514 17.832 1.00 43.25 C ATOM 1778 CD LYS A 246 13.300 -7.161 16.344 1.00 43.58 C ATOM 1779 CE LYS A 246 13.033 -8.369 15.443 1.00 46.11 C ATOM 1780 NZ LYS A 246 11.700 -9.042 15.650 1.00 42.28 N ATOM 1781 HZ1 LYS A 246 11.634 -9.383 16.630 1.00 0.00 H ATOM 1782 HZ2 LYS A 246 10.937 -8.360 15.466 1.00 0.00 H ATOM 1783 HZ3 LYS A 246 11.614 -9.846 14.996 1.00 0.00 H ATOM 1784 H LYS A 246 13.702 -4.344 20.522 1.00 0.00 H ATOM 1785 N PHE A 247 10.378 -5.403 18.393 1.00 49.29 N ATOM 1786 CA PHE A 247 9.033 -5.917 18.646 1.00 52.77 C ATOM 1787 C PHE A 247 8.820 -7.251 17.948 1.00 50.58 C ATOM 1788 O PHE A 247 9.322 -7.481 16.843 1.00 51.85 O ATOM 1789 CB PHE A 247 7.950 -4.962 18.140 1.00 51.03 C ATOM 1790 CG PHE A 247 7.839 -3.679 18.900 1.00 50.99 C ATOM 1791 CD1 PHE A 247 7.377 -3.658 20.205 1.00 56.27 C ATOM 1792 CD2 PHE A 247 8.139 -2.478 18.281 1.00 53.04 C ATOM 1793 CE1 PHE A 247 7.259 -2.455 20.892 1.00 61.19 C ATOM 1794 CE2 PHE A 247 8.023 -1.281 18.961 1.00 51.30 C ATOM 1795 CZ PHE A 247 7.579 -1.268 20.266 1.00 54.89 C ATOM 1796 H PHE A 247 10.543 -4.845 17.531 1.00 0.00 H ATOM 1797 N ASP A 248 8.025 -8.113 18.589 1.00 60.04 N ATOM 1798 CA ASP A 248 7.664 -9.404 18.010 1.00 53.04 C ATOM 1799 C ASP A 248 6.768 -9.215 16.797 1.00 53.49 C ATOM 1800 O ASP A 248 5.913 -8.325 16.763 1.00 57.54 O ATOM 1801 CB ASP A 248 6.950 -10.269 19.041 1.00 58.16 C ATOM 1802 CG ASP A 248 7.762 -10.454 20.301 1.00 59.04 C ATOM 1803 OD1 ASP A 248 8.988 -10.675 20.199 1.00 62.79 O ATOM 1804 OD2 ASP A 248 7.179 -10.353 21.396 1.00 65.31 O ATOM 1805 H ASP A 248 7.653 -7.857 19.526 1.00 0.00 H ATOM 1806 N ASP A 249 6.977 -10.055 15.790 1.00 52.74 N ATOM 1807 CA ASP A 249 6.230 -9.990 14.533 1.00 58.41 C ATOM 1808 C ASP A 249 6.472 -8.680 13.782 1.00 55.59 C ATOM 1809 O ASP A 249 5.603 -8.202 13.052 1.00 58.75 O ATOM 1810 CB ASP A 249 4.730 -10.199 14.763 1.00 69.65 C ATOM 1811 CG ASP A 249 4.431 -11.432 15.603 1.00 78.22 C ATOM 1812 OD1 ASP A 249 5.227 -12.397 15.560 1.00 79.58 O ATOM 1813 OD2 ASP A 249 3.398 -11.432 16.308 1.00 86.48 O ATOM 1814 H ASP A 249 7.703 -10.791 15.899 1.00 0.00 H ATOM 1815 N ASP A 250 7.652 -8.089 13.947 1.00 50.70 N ATOM 1816 CA ASP A 250 8.069 -6.961 13.121 1.00 49.44 C ATOM 1817 C ASP A 250 9.587 -6.991 13.081 1.00 43.35 C ATOM 1818 O ASP A 250 10.228 -7.132 14.127 1.00 42.30 O ATOM 1819 CB ASP A 250 7.554 -5.629 13.683 1.00 50.50 C ATOM 1820 CG ASP A 250 7.611 -4.488 12.669 1.00 51.97 C ATOM 1821 OD1 ASP A 250 8.602 -4.391 11.911 1.00 51.92 O ATOM 1822 OD2 ASP A 250 6.667 -3.665 12.644 1.00 61.08 O ATOM 1823 H ASP A 250 8.295 -8.441 14.685 1.00 0.00 H ATOM 1824 N PHE A 251 10.157 -6.886 11.883 1.00 43.42 N ATOM 1825 CA PHE A 251 11.601 -6.983 11.726 1.00 44.60 C ATOM 1826 C PHE A 251 12.297 -5.626 11.607 1.00 42.42 C ATOM 1827 O PHE A 251 13.517 -5.589 11.430 1.00 42.90 O ATOM 1828 CB PHE A 251 11.957 -7.880 10.527 1.00 37.99 C ATOM 1829 CG PHE A 251 11.101 -7.674 9.305 1.00 39.38 C ATOM 1830 CD1 PHE A 251 10.877 -6.410 8.787 1.00 38.92 C ATOM 1831 CD2 PHE A 251 10.548 -8.759 8.652 1.00 39.75 C ATOM 1832 CE1 PHE A 251 10.115 -6.239 7.647 1.00 37.27 C ATOM 1833 CE2 PHE A 251 9.790 -8.594 7.508 1.00 37.66 C ATOM 1834 CZ PHE A 251 9.576 -7.336 7.006 1.00 42.35 C ATOM 1835 H PHE A 251 9.561 -6.732 11.045 1.00 0.00 H ATOM 1836 N HIS A 252 11.575 -4.517 11.732 1.00 39.32 N ATOM 1837 CA HIS A 252 12.277 -3.251 11.862 1.00 42.53 C ATOM 1838 C HIS A 252 12.863 -3.120 13.265 1.00 43.36 C ATOM 1839 O HIS A 252 12.465 -3.818 14.199 1.00 41.05 O ATOM 1840 CB HIS A 252 11.346 -2.069 11.583 1.00 41.19 C ATOM 1841 CG HIS A 252 10.856 -2.003 10.172 1.00 39.02 C ATOM 1842 ND1 HIS A 252 9.612 -2.459 9.796 1.00 44.33 N ATOM 1843 CD2 HIS A 252 11.444 -1.540 9.044 1.00 42.01 C ATOM 1844 CE1 HIS A 252 9.452 -2.275 8.497 1.00 43.52 C ATOM 1845 NE2 HIS A 252 10.549 -1.720 8.016 1.00 42.45 N ATOM 1846 H HIS A 252 10.536 -4.554 11.737 1.00 0.00 H ATOM 1847 N ILE A 253 13.830 -2.215 13.402 1.00 41.35 N ATOM 1848 CA ILE A 253 14.350 -1.795 14.698 1.00 39.51 C ATOM 1849 C ILE A 253 13.738 -0.434 15.005 1.00 43.73 C ATOM 1850 O ILE A 253 13.958 0.530 14.262 1.00 45.13 O ATOM 1851 CB ILE A 253 15.886 -1.723 14.711 1.00 38.26 C ATOM 1852 CG1 ILE A 253 16.511 -3.072 14.330 1.00 40.28 C ATOM 1853 CG2 ILE A 253 16.389 -1.274 16.081 1.00 36.69 C ATOM 1854 CD1 ILE A 253 15.928 -4.283 15.111 1.00 40.49 C ATOM 1855 H ILE A 253 14.234 -1.787 12.544 1.00 0.00 H ATOM 1856 N TYR A 254 12.977 -0.353 16.092 1.00 40.77 N ATOM 1857 CA TYR A 254 12.336 0.889 16.491 1.00 46.49 C ATOM 1858 C TYR A 254 13.241 1.685 17.414 1.00 45.09 C ATOM 1859 O TYR A 254 14.013 1.128 18.198 1.00 42.60 O ATOM 1860 CB TYR A 254 10.994 0.623 17.173 1.00 48.12 C ATOM 1861 CG TYR A 254 9.954 0.211 16.176 1.00 50.26 C ATOM 1862 CD1 TYR A 254 9.947 -1.077 15.654 1.00 44.05 C ATOM 1863 CD2 TYR A 254 9.000 1.110 15.726 1.00 46.59 C ATOM 1864 CE1 TYR A 254 9.015 -1.465 14.727 1.00 45.17 C ATOM 1865 CE2 TYR A 254 8.056 0.720 14.788 1.00 53.09 C ATOM 1866 CZ TYR A 254 8.075 -0.574 14.294 1.00 47.20 C ATOM 1867 OH TYR A 254 7.151 -0.984 13.362 1.00 50.62 O ATOM 1868 HH TYR A 254 7.318 -1.931 13.128 1.00 0.00 H ATOM 1869 H TYR A 254 12.836 -1.203 16.674 1.00 0.00 H ATOM 1870 N VAL A 255 13.142 3.010 17.299 1.00 44.91 N ATOM 1871 CA VAL A 255 14.001 3.930 18.035 1.00 45.25 C ATOM 1872 C VAL A 255 13.092 4.868 18.810 1.00 44.55 C ATOM 1873 O VAL A 255 12.388 5.687 18.209 1.00 47.98 O ATOM 1874 CB VAL A 255 14.937 4.724 17.112 1.00 41.68 C ATOM 1875 CG1 VAL A 255 15.950 5.485 17.931 1.00 45.31 C ATOM 1876 CG2 VAL A 255 15.645 3.818 16.138 1.00 42.81 C ATOM 1877 H VAL A 255 12.423 3.403 16.658 1.00 0.00 H ATOM 1878 N TYR A 256 13.118 4.772 20.132 1.00 47.48 N ATOM 1879 CA TYR A 256 12.265 5.599 20.974 1.00 51.67 C ATOM 1880 C TYR A 256 13.094 6.266 22.059 1.00 57.72 C ATOM 1881 O TYR A 256 14.097 5.720 22.526 1.00 58.91 O ATOM 1882 CB TYR A 256 11.141 4.786 21.633 1.00 52.32 C ATOM 1883 CG TYR A 256 10.075 4.279 20.683 1.00 54.76 C ATOM 1884 CD1 TYR A 256 9.233 5.155 20.010 1.00 58.53 C ATOM 1885 CD2 TYR A 256 9.898 2.925 20.481 1.00 49.66 C ATOM 1886 CE1 TYR A 256 8.251 4.685 19.144 1.00 59.95 C ATOM 1887 CE2 TYR A 256 8.918 2.454 19.630 1.00 57.33 C ATOM 1888 CZ TYR A 256 8.098 3.332 18.960 1.00 60.11 C ATOM 1889 OH TYR A 256 7.123 2.847 18.112 1.00 61.99 O ATOM 1890 HH TYR A 256 6.626 3.605 17.714 1.00 0.00 H ATOM 1891 H TYR A 256 13.763 4.089 20.579 1.00 0.00 H ATOM 1892 N ASP A 257 12.660 7.455 22.455 1.00 61.48 N ATOM 1893 CA ASP A 257 13.221 8.176 23.593 1.00 63.96 C ATOM 1894 C ASP A 257 12.366 7.824 24.804 1.00 63.42 C ATOM 1895 O ASP A 257 11.175 8.145 24.840 1.00 65.82 O ATOM 1896 CB ASP A 257 13.227 9.683 23.335 1.00 61.14 C ATOM 1897 CG ASP A 257 14.055 10.455 24.353 1.00 70.21 C ATOM 1898 OD1 ASP A 257 14.198 9.984 25.498 1.00 69.73 O ATOM 1899 OD2 ASP A 257 14.563 11.545 24.009 1.00 72.91 O ATOM 1900 H ASP A 257 11.880 7.896 21.927 1.00 0.00 H ATOM 1901 N LEU A 258 12.964 7.156 25.789 1.00 60.45 N ATOM 1902 CA LEU A 258 12.206 6.619 26.909 1.00 66.49 C ATOM 1903 C LEU A 258 12.269 7.505 28.148 1.00 74.20 C ATOM 1904 O LEU A 258 12.102 6.999 29.263 1.00 74.34 O ATOM 1905 CB LEU A 258 12.688 5.205 27.237 1.00 64.90 C ATOM 1906 CG LEU A 258 12.314 4.147 26.190 1.00 62.94 C ATOM 1907 CD1 LEU A 258 12.686 2.753 26.665 1.00 61.32 C ATOM 1908 CD2 LEU A 258 10.829 4.220 25.831 1.00 65.05 C ATOM 1909 H LEU A 258 13.994 7.015 25.757 1.00 0.00 H ATOM 1910 N VAL A 259 12.468 8.814 27.963 1.00 73.15 N ATOM 1911 CA VAL A 259 12.538 9.832 29.027 1.00 76.38 C ATOM 1912 C VAL A 259 13.076 9.309 30.357 1.00 76.99 C ATOM 1913 O VAL A 259 14.246 8.935 30.453 1.00 79.38 O ATOM 1914 CB VAL A 259 11.156 10.497 29.243 1.00 78.02 C ATOM 1915 CG1 VAL A 259 10.660 11.119 27.940 1.00 72.75 C ATOM 1916 CG2 VAL A 259 10.144 9.493 29.820 1.00 73.75 C ATOM 1917 H VAL A 259 12.583 9.143 26.983 1.00 0.00 H TER 1918 VAL A 259 HETATM 1919 MG MG A 1 9.770 19.776 7.622 1.00 59.16 MG HETATM 1920 O HOH 2 21.428 1.487 -0.333 1.00 51.00 O HETATM 1921 O HOH 3 23.697 10.264 -1.066 1.00 73.76 O HETATM 1922 O HOH 4 16.649 4.727 0.819 1.00 49.89 O HETATM 1923 O HOH 5 17.698 19.498 4.669 1.00 54.70 O HETATM 1924 O HOH 6 10.953 20.897 8.816 1.00 63.61 O HETATM 1925 O HOH 7 23.687 6.622 1.835 1.00 47.31 O HETATM 1926 O HOH 8 11.258 18.269 7.836 1.00 61.50 O HETATM 1927 O HOH 9 23.793 -4.734 2.051 1.00 46.61 O HETATM 1928 O HOH 10 10.475 -4.723 15.927 1.00 42.74 O HETATM 1929 O HOH 11 4.628 -6.453 15.578 1.00 53.14 O HETATM 1930 O HOH 12 29.257 6.404 16.400 1.00 54.21 O HETATM 1931 O HOH 13 14.314 -10.638 -3.385 1.00 49.88 O HETATM 1932 O HOH 14 10.719 12.738 9.705 1.00 46.43 O HETATM 1933 O HOH 15 13.216 -13.237 13.271 1.00 49.47 O HETATM 1934 O HOH 16 24.056 -3.246 22.103 1.00 59.22 O HETATM 1935 O HOH 17 19.066 -16.807 15.015 1.00 49.35 O HETATM 1936 O HOH 18 10.712 -9.044 3.225 1.00 43.72 O HETATM 1937 O HOH 19 18.162 -3.048 4.340 1.00 42.98 O HETATM 1938 O HOH 20 10.791 -2.302 5.110 1.00 37.06 O HETATM 1939 O HOH 21 38.161 15.967 10.620 1.00 58.31 O HETATM 1940 O HOH 22 31.860 9.143 3.484 1.00 64.17 O HETATM 1941 O HOH 23 14.528 -0.511 10.678 1.00 39.88 O HETATM 1942 O HOH 24 10.853 21.028 6.509 1.00 60.92 O HETATM 1943 O HOH 25 12.797 7.843 15.969 1.00 54.17 O HETATM 1944 O HOH 26 12.191 -19.396 3.161 1.00 53.50 O HETATM 1945 O HOH 27 18.071 -20.619 9.372 1.00 56.23 O HETATM 1946 O HOH 28 29.015 9.371 4.660 1.00 51.37 O HETATM 1947 O HOH 29 29.063 -4.993 15.070 1.00 58.77 O HETATM 1948 O HOH 30 31.350 2.174 4.392 1.00 47.81 O HETATM 1949 O HOH 31 11.322 -10.499 18.517 1.00 57.09 O HETATM 1950 O HOH 32 15.410 1.944 1.394 1.00 42.23 O HETATM 1951 O HOH 33 11.969 -10.492 12.951 1.00 45.66 O HETATM 1952 O HOH 34 9.244 -10.480 12.241 1.00 43.34 O HETATM 1953 O HOH 35 5.421 -13.389 7.237 1.00 62.07 O HETATM 1954 O HOH 36 -0.051 -15.141 1.597 1.00 68.11 O HETATM 1955 O HOH 37 25.457 3.931 20.279 1.00 39.18 O HETATM 1956 O HOH 38 11.765 -14.077 15.271 1.00 54.99 O HETATM 1957 C13 UNN A 39 12.791 -6.216 3.275 1.00 -0.03 C HETATM 1958 C12 UNN A 39 11.361 -5.948 3.782 1.00 -0.03 C HETATM 1959 C11 UNN A 39 10.406 -5.661 2.596 1.00 0.03 C HETATM 1960 N10 UNN A 39 10.878 -4.482 1.853 1.00 -0.27 N HETATM 1961 C15 UNN A 39 12.250 -4.612 1.384 1.00 0.03 C HETATM 1962 C14 UNN A 39 13.245 -5.045 2.449 1.00 -0.03 C HETATM 1963 H20 UNN A 39 14.187 -5.318 1.951 1.00 0.03 H HETATM 1964 H21 UNN A 39 13.421 -4.194 3.124 1.00 0.03 H HETATM 1965 H2 UNN A 39 12.572 -3.637 0.990 1.00 0.05 H HETATM 1966 H3 UNN A 39 12.267 -5.358 0.575 1.00 0.05 H HETATM 1967 C09 UNN A 39 10.045 -3.396 1.670 1.00 0.21 C HETATM 1968 C06 UNN A 39 10.473 -2.118 0.972 1.00 0.04 C HETATM 1969 C05 UNN A 39 11.383 -1.318 1.615 1.00 -0.01 C HETATM 1970 C04 UNN A 39 11.935 -0.083 1.102 1.00 0.08 C HETATM 1971 C03 UNN A 39 11.503 0.359 -0.151 1.00 0.07 C HETATM 1972 C02 UNN A 39 11.968 1.598 -0.817 1.00 0.20 C HETATM 1973 O01 UNN A 39 12.678 1.489 -1.815 1.00 -0.39 O HETATM 1974 N38 UNN A 39 11.715 2.912 -0.395 1.00 -0.27 N HETATM 1975 C39 UNN A 39 12.254 4.070 -1.107 1.00 0.03 C HETATM 1976 C40 UNN A 39 13.248 4.823 -0.222 1.00 -0.03 C HETATM 1977 C41 UNN A 39 12.794 5.045 1.233 1.00 -0.03 C HETATM 1978 C42 UNN A 39 11.339 4.627 1.436 1.00 -0.03 C HETATM 1979 C43 UNN A 39 10.931 3.320 0.754 1.00 0.03 C HETATM 1980 H49 UNN A 39 10.997 2.518 1.504 1.00 0.05 H HETATM 1981 H50 UNN A 39 9.887 3.428 0.424 1.00 0.05 H HETATM 1982 H47 UNN A 39 10.697 5.429 1.043 1.00 0.03 H HETATM 1983 H48 UNN A 39 11.166 4.514 2.516 1.00 0.03 H HETATM 1984 C44 UNN A 39 12.895 6.473 1.645 1.00 -0.01 C HETATM 1985 C45 UNN A 39 13.094 6.619 3.140 1.00 -0.03 C HETATM 1986 N46 UNN A 39 14.181 7.668 3.393 1.00 0.24 N HETATM 1987 C47 UNN A 39 14.659 8.446 2.225 1.00 -0.03 C HETATM 1988 C48 UNN A 39 15.564 9.539 2.836 1.00 -0.01 C HETATM 1989 C49 UNN A 39 15.008 9.751 4.248 1.00 -0.01 C HETATM 1990 C50 UNN A 39 13.904 8.678 4.442 1.00 -0.03 C HETATM 1991 H62 UNN A 39 13.971 8.227 5.443 1.00 0.08 H HETATM 1992 H63 UNN A 39 12.905 9.118 4.304 1.00 0.08 H HETATM 1993 H60 UNN A 39 14.580 10.760 4.342 1.00 0.03 H HETATM 1994 H61 UNN A 39 15.804 9.619 4.995 1.00 0.03 H HETATM 1995 H58 UNN A 39 15.502 10.468 2.250 1.00 0.03 H HETATM 1996 H59 UNN A 39 16.610 9.200 2.877 1.00 0.03 H HETATM 1997 H56 UNN A 39 13.813 8.898 1.685 1.00 0.08 H HETATM 1998 H57 UNN A 39 15.232 7.805 1.538 1.00 0.08 H HETATM 1999 H55 UNN A 39 14.970 7.130 3.717 1.00 0.20 H HETATM 2000 H53 UNN A 39 13.405 5.654 3.568 1.00 0.08 H HETATM 2001 H54 UNN A 39 12.153 6.942 3.608 1.00 0.08 H HETATM 2002 H51 UNN A 39 11.969 6.992 1.358 1.00 0.03 H HETATM 2003 H52 UNN A 39 13.749 6.933 1.126 1.00 0.03 H HETATM 2004 H46 UNN A 39 13.438 4.438 1.887 1.00 0.03 H HETATM 2005 H44 UNN A 39 13.429 5.809 -0.676 1.00 0.03 H HETATM 2006 H45 UNN A 39 14.187 4.250 -0.202 1.00 0.03 H HETATM 2007 H42 UNN A 39 11.429 4.744 -1.380 1.00 0.05 H HETATM 2008 H43 UNN A 39 12.766 3.729 -2.019 1.00 0.05 H HETATM 2009 C08 UNN A 39 10.593 -0.472 -0.803 1.00 -0.05 C HETATM 2010 C07 UNN A 39 10.074 -1.674 -0.288 1.00 -0.05 C HETATM 2011 H14 UNN A 39 9.366 -2.253 -0.869 1.00 0.06 H HETATM 2012 H15 UNN A 39 10.258 -0.167 -1.788 1.00 0.06 H HETATM 2013 N24 UNN A 39 12.825 0.637 1.905 1.00 -0.28 N HETATM 2014 C25 UNN A 39 12.468 0.956 3.177 1.00 0.05 C HETATM 2015 C26 UNN A 39 12.408 0.015 4.139 1.00 -0.05 C HETATM 2016 C27 UNN A 39 11.953 0.231 5.387 1.00 -0.04 C HETATM 2017 C28 UNN A 39 11.559 1.412 5.710 1.00 0.08 C HETATM 2018 C29 UNN A 39 11.598 2.375 4.764 1.00 -0.04 C HETATM 2019 C30 UNN A 39 12.024 2.124 3.510 1.00 -0.05 C HETATM 2020 H30 UNN A 39 11.994 2.914 2.768 1.00 0.05 H HETATM 2021 H29 UNN A 39 11.278 3.378 5.020 1.00 0.05 H HETATM 2022 O31 UNN A 39 11.118 1.603 6.929 1.00 -0.28 O HETATM 2023 C32 UNN A 39 9.636 1.342 6.871 1.00 0.09 C HETATM 2024 N33 UNN A 39 8.815 2.705 6.644 1.00 0.26 N HETATM 2025 C34 UNN A 39 8.732 3.237 5.230 1.00 -0.03 C HETATM 2026 C35 UNN A 39 7.688 4.380 5.252 1.00 -0.01 C HETATM 2027 C36 UNN A 39 6.688 3.901 6.308 1.00 -0.01 C HETATM 2028 C37 UNN A 39 7.363 2.672 7.015 1.00 -0.03 C HETATM 2029 H40 UNN A 39 7.249 2.753 8.106 1.00 0.08 H HETATM 2030 H41 UNN A 39 6.904 1.735 6.666 1.00 0.08 H HETATM 2031 H38 UNN A 39 5.744 3.597 5.831 1.00 0.03 H HETATM 2032 H39 UNN A 39 6.490 4.700 7.037 1.00 0.03 H HETATM 2033 H36 UNN A 39 7.204 4.495 4.271 1.00 0.03 H HETATM 2034 H37 UNN A 39 8.150 5.334 5.547 1.00 0.03 H HETATM 2035 H34 UNN A 39 8.410 2.441 4.543 1.00 0.08 H HETATM 2036 H35 UNN A 39 9.711 3.623 4.911 1.00 0.08 H HETATM 2037 H33 UNN A 39 9.277 3.395 7.216 1.00 0.21 H HETATM 2038 H31 UNN A 39 9.315 0.883 7.818 1.00 0.12 H HETATM 2039 H32 UNN A 39 9.425 0.653 6.040 1.00 0.12 H HETATM 2040 H28 UNN A 39 11.919 -0.577 6.108 1.00 0.05 H HETATM 2041 H12 UNN A 39 12.749 -0.984 3.891 1.00 0.05 H HETATM 2042 H27 UNN A 39 13.743 0.923 1.536 1.00 0.21 H HETATM 2043 H13 UNN A 39 11.718 -1.640 2.594 1.00 0.06 H HETATM 2044 O23 UNN A 39 8.933 -3.498 2.176 1.00 -0.38 O HETATM 2045 H16 UNN A 39 10.385 -6.532 1.925 1.00 0.05 H HETATM 2046 H17 UNN A 39 9.393 -5.470 2.980 1.00 0.05 H HETATM 2047 H18 UNN A 39 11.373 -5.078 4.455 1.00 0.03 H HETATM 2048 H19 UNN A 39 11.001 -6.831 4.331 1.00 0.03 H HETATM 2049 C16 UNN A 39 13.803 -6.551 4.394 1.00 -0.01 C HETATM 2050 C17 UNN A 39 13.181 -7.571 5.328 1.00 -0.03 C HETATM 2051 N18 UNN A 39 13.044 -8.885 4.569 1.00 0.24 N HETATM 2052 C22 UNN A 39 12.758 -9.985 5.514 1.00 -0.03 C HETATM 2053 C21 UNN A 39 13.822 -11.082 5.362 1.00 -0.01 C HETATM 2054 C20 UNN A 39 14.593 -10.738 4.117 1.00 -0.01 C HETATM 2055 C19 UNN A 39 14.283 -9.281 3.818 1.00 -0.03 C HETATM 2056 H25 UNN A 39 14.117 -9.152 2.738 1.00 0.08 H HETATM 2057 H26 UNN A 39 15.126 -8.651 4.137 1.00 0.08 H HETATM 2058 H6 UNN A 39 14.272 -11.376 3.280 1.00 0.03 H HETATM 2059 H7 UNN A 39 15.672 -10.872 4.287 1.00 0.03 H HETATM 2060 H8 UNN A 39 14.490 -11.091 6.236 1.00 0.03 H HETATM 2061 H9 UNN A 39 13.344 -12.067 5.256 1.00 0.03 H HETATM 2062 H10 UNN A 39 12.776 -9.598 6.543 1.00 0.08 H HETATM 2063 H11 UNN A 39 11.765 -10.405 5.297 1.00 0.08 H HETATM 2064 H24 UNN A 39 12.282 -8.793 3.915 1.00 0.20 H HETATM 2065 H4 UNN A 39 12.190 -7.223 5.653 1.00 0.08 H HETATM 2066 H5 UNN A 39 13.826 -7.714 6.207 1.00 0.08 H HETATM 2067 H22 UNN A 39 14.049 -5.638 4.955 1.00 0.03 H HETATM 2068 H23 UNN A 39 14.720 -6.967 3.951 1.00 0.03 H HETATM 2069 H1 UNN A 39 12.745 -7.095 2.615 1.00 0.03 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1444 1445 1451 1452 1453 CONECT 1451 1444 CONECT 1452 1444 CONECT 1453 1444 CONECT 1957 1958 1962 2049 2069 CONECT 1958 1957 1959 2047 2048 CONECT 1959 1958 1960 2045 2046 CONECT 1960 1959 1961 1967 CONECT 1961 1960 1962 1965 1966 CONECT 1962 1957 1961 1963 1964 CONECT 1963 1962 CONECT 1964 1962 CONECT 1965 1961 CONECT 1966 1961 CONECT 1967 1960 1968 2044 CONECT 1968 1967 1969 2010 CONECT 1969 1968 1970 2043 CONECT 1970 1969 1971 2013 CONECT 1971 1970 1972 2009 CONECT 1972 1971 1973 1974 CONECT 1973 1972 CONECT 1974 1972 1975 1979 CONECT 1975 1974 1976 2007 2008 CONECT 1976 1975 1977 2005 2006 CONECT 1977 1976 1978 1984 2004 CONECT 1978 1977 1979 1982 1983 CONECT 1979 1974 1978 1980 1981 CONECT 1980 1979 CONECT 1981 1979 CONECT 1982 1978 CONECT 1983 1978 CONECT 1984 1977 1985 2002 2003 CONECT 1985 1984 1986 2000 2001 CONECT 1986 1985 1987 1990 1999 CONECT 1987 1986 1988 1997 1998 CONECT 1988 1987 1989 1995 1996 CONECT 1989 1988 1990 1993 1994 CONECT 1990 1986 1989 1991 1992 CONECT 1991 1990 CONECT 1992 1990 CONECT 1993 1989 CONECT 1994 1989 CONECT 1995 1988 CONECT 1996 1988 CONECT 1997 1987 CONECT 1998 1987 CONECT 1999 1986 CONECT 2000 1985 CONECT 2001 1985 CONECT 2002 1984 CONECT 2003 1984 CONECT 2004 1977 CONECT 2005 1976 CONECT 2006 1976 CONECT 2007 1975 CONECT 2008 1975 CONECT 2009 1971 2010 2012 CONECT 2010 1968 2009 2011 CONECT 2011 2010 CONECT 2012 2009 CONECT 2013 1970 2014 2042 CONECT 2014 2013 2015 2019 CONECT 2015 2014 2016 2041 CONECT 2016 2015 2017 2040 CONECT 2017 2016 2018 2022 CONECT 2018 2017 2019 2021 CONECT 2019 2014 2018 2020 CONECT 2020 2019 CONECT 2021 2018 CONECT 2022 2017 2023 CONECT 2023 2022 2024 2038 2039 CONECT 2024 2023 2025 2028 2037 CONECT 2025 2024 2026 2035 2036 CONECT 2026 2025 2027 2033 2034 CONECT 2027 2026 2028 2031 2032 CONECT 2028 2024 2027 2029 2030 CONECT 2029 2028 CONECT 2030 2028 CONECT 2031 2027 CONECT 2032 2027 CONECT 2033 2026 CONECT 2034 2026 CONECT 2035 2025 CONECT 2036 2025 CONECT 2037 2024 CONECT 2038 2023 CONECT 2039 2023 CONECT 2040 2016 CONECT 2041 2015 CONECT 2042 2013 CONECT 2043 1969 CONECT 2044 1967 CONECT 2045 1959 CONECT 2046 1959 CONECT 2047 1958 CONECT 2048 1958 CONECT 2049 1957 2050 2067 2068 CONECT 2050 2049 2051 2065 2066 CONECT 2051 2050 2052 2055 2064 CONECT 2052 2051 2053 2062 2063 CONECT 2053 2052 2054 2060 2061 CONECT 2054 2053 2055 2058 2059 CONECT 2055 2051 2054 2056 2057 CONECT 2056 2055 CONECT 2057 2055 CONECT 2058 2054 CONECT 2059 2054 CONECT 2060 2053 CONECT 2061 2053 CONECT 2062 2052 CONECT 2063 2052 CONECT 2064 2051 CONECT 2065 2050 CONECT 2066 2050 CONECT 2067 2049 CONECT 2068 2049 CONECT 2069 1957 MASTER 0 0 0 0 0 0 0 0 2067 2 121 16 END
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Structure:
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Protein
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Related entries of code: 5jsj
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4h75
RCSB PDB
PDBbind
238aa, >4H75_1|Chain... *
4mzf
RCSB PDB
PDBbind
224aa, >4MZF_2|Chain... at 95%
4mzh
RCSB PDB
PDBbind
224aa, >4MZH_1|Chain... at 95%
5jsg
RCSB PDB
PDBbind
222aa, >5JSG_1|Chains... at 95%
6qpl
RCSB PDB
PDBbind
222aa, >6QPL_1|Chain... at 96%
6i8y
RCSB PDB
PDBbind
222aa, >6I8Y_1|Chain... at 96%
6i8l
RCSB PDB
PDBbind
222aa, >6I8L_1|Chain... at 96%
6i8b
RCSB PDB
PDBbind
222aa, >6I8B_1|Chains... at 96%
5y5w
RCSB PDB
PDBbind
235aa, >5Y5W_1|Chains... at 91%
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
5jsj
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Spindlin-1
Ligand Name
6PD
EC.Number
E.C.-.-.-.-
Resolution
2.35(Å)
Affinity (Kd/Ki/IC50)
Kd=4uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Nat. Chem. Biol. Vol. 13: pp. 750-756
Ligand Properties
Formula
C
4
1
H
6
3
N
6
O
3
Molecular Weight
687.977
Exact Mass
687.496
No. of atoms
113
No. of bonds
119
Polar Surface Area
75.2
LOGP Value
6.78 (
Computed with XLOGP3
)
6.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 15
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 7
Canonical SMILES
O=C(c1ccc(c(c1)Nc1ccc(cc1)OC[NH+]1CCCC1)C(=O)N1CCC(CC1)CC[NH+]1CCCC1)N1CCC(CC1)CC[NH+]1CCCC1
InChI String
InChI=1S/C41H60N6O3/c48-40(46-27-15-33(16-28-46)13-25-43-19-1-2-20-43)35-7-12-38(41(49)47-29-17-34(18-30-47)14-26-44-21-3-4-22-44)39(31-35)42-36-8-10-37(11-9-36)50-32-45-23-5-6-24-45/h7-12,31,33-34,42H,1-6,13-30,32H2/p+3
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):
Q9Y657
Entrez Gene ID
NCBI Entrez Gene ID:
10927
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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