Browse entries in the PDBbind-CN Database
HEADER 4OS5_COMPLEX COMPND 4OS5_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 245 ILE ILE GLY GLY GLU PHE THR THR ILE GLU ASN GLN PRO SEQRES 2 A 245 TRP PHE ALA ALA ILE TYR ARG ARG HIS ARG GLY GLY SER SEQRES 3 A 245 VAL THR TYR VAL CYS GLY GLY SER LEU ILE SER PRO CYS SEQRES 4 A 245 TRP VAL ILE SER ALA THR HIS CYS PHE ILE ASP TYR PRO SEQRES 5 A 245 LYS LYS GLU ASP TYR ILE VAL TYR LEU GLY ARG SER ARG SEQRES 6 A 245 LEU ASN SER ASN THR GLN GLY GLU MET LYS PHE GLU VAL SEQRES 7 A 245 GLU ASN LEU ILE LEU HIS LYS ASP TYR SER ALA ASP THR SEQRES 8 A 245 LEU ALA HIS HIS ASN ASP ILE ALA LEU LEU LYS ILE ARG SEQRES 9 A 245 SER LYS GLU GLY ARG CYS ALA GLN PRO SER ARG THR ILE SEQRES 10 A 245 GLN THR ILE ALA LEU PRO SER MET TYR ASN ASP PRO GLN SEQRES 11 A 245 PHE GLY THR SER CYS GLU ILE THR GLY PHE GLY LYS GLU SEQRES 12 A 245 GLN SER THR ASP TYR LEU TYR PRO GLU GLN LEU LYS MET SEQRES 13 A 245 THR VAL VAL LYS LEU ILE SER HIS ARG GLU CYS GLN GLN SEQRES 14 A 245 PRO HIS TYR TYR GLY SER GLU VAL THR THR LYS MET LEU SEQRES 15 A 245 CYS ALA ALA ASP PRO GLN TRP LYS THR ASP SER CYS GLN SEQRES 16 A 245 GLY ASP SER GLY GLY PRO LEU VAL CYS SER LEU GLN GLY SEQRES 17 A 245 ARG MET THR LEU THR GLY ILE VAL SER TRP GLY ARG GLY SEQRES 18 A 245 CYS ALA LEU LYS ASP LYS PRO GLY VAL TYR THR ARG VAL SEQRES 19 A 245 SER HIS PHE LEU PRO TRP ILE ARG SER HIS THR HET GLY A 351 204 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 50 CYS A 111 SSBOND 3 CYS A 168 CYS A 182 SSBOND 4 CYS A 136 CYS A 201 SSBOND 5 CYS A 191 CYS A 220 ATOM 1 N ILE A 16 -0.971 -1.533 -19.465 1.00 16.87 N ATOM 2 CA ILE A 16 -2.046 -0.500 -19.448 1.00 17.42 C ATOM 3 C ILE A 16 -2.993 -0.754 -20.624 1.00 18.63 C ATOM 4 O ILE A 16 -2.579 -0.729 -21.779 1.00 18.78 O ATOM 5 CB ILE A 16 -1.453 0.925 -19.583 1.00 18.15 C ATOM 6 CG1 ILE A 16 -0.461 1.256 -18.449 1.00 19.05 C ATOM 7 CG2 ILE A 16 -2.541 1.976 -19.628 1.00 18.10 C ATOM 8 CD1 ILE A 16 -1.043 1.290 -17.059 1.00 18.74 C ATOM 9 HN3 ILE A 16 -0.446 -1.471 -20.361 1.00 0.00 H ATOM 10 HN2 ILE A 16 -1.398 -2.477 -19.377 1.00 0.00 H ATOM 11 HN1 ILE A 16 -0.322 -1.369 -18.669 1.00 0.00 H ATOM 12 N ILE A 17 -4.265 -0.986 -20.329 1.00 19.95 N ATOM 13 CA ILE A 17 -5.281 -1.094 -21.352 1.00 19.83 C ATOM 14 C ILE A 17 -5.719 0.323 -21.749 1.00 21.29 C ATOM 15 O ILE A 17 -6.068 1.153 -20.892 1.00 19.64 O ATOM 16 CB ILE A 17 -6.513 -1.866 -20.864 1.00 19.99 C ATOM 17 CG1 ILE A 17 -6.135 -3.235 -20.259 1.00 20.86 C ATOM 18 CG2 ILE A 17 -7.529 -2.011 -22.003 1.00 20.49 C ATOM 19 CD1 ILE A 17 -5.431 -4.196 -21.185 1.00 20.39 C ATOM 20 H ILE A 17 -4.540 -1.093 -19.332 1.00 0.00 H ATOM 21 N GLY A 18 -5.736 0.595 -23.055 1.00 22.25 N ATOM 22 CA GLY A 18 -6.039 1.953 -23.517 1.00 22.60 C ATOM 23 C GLY A 18 -4.952 2.909 -23.066 1.00 22.81 C ATOM 24 O GLY A 18 -3.794 2.532 -22.950 1.00 24.34 O ATOM 25 H GLY A 18 -5.534 -0.156 -23.745 1.00 0.00 H ATOM 26 N GLY A 19 -5.324 4.148 -22.811 1.00 23.49 N ATOM 27 CA GLY A 19 -4.378 5.158 -22.364 1.00 23.32 C ATOM 28 C GLY A 19 -3.434 5.620 -23.444 1.00 24.20 C ATOM 29 O GLY A 19 -3.790 5.664 -24.619 1.00 24.87 O ATOM 30 H GLY A 19 -6.323 4.411 -22.933 1.00 0.00 H ATOM 31 N GLU A 20 -2.212 5.968 -23.060 1.00 25.56 N ATOM 32 CA GLU A 20 -1.306 6.625 -24.003 1.00 27.10 C ATOM 33 C GLU A 20 0.109 6.147 -23.844 1.00 26.15 C ATOM 34 O GLU A 20 0.558 5.906 -22.732 1.00 25.10 O ATOM 35 CB GLU A 20 -1.335 8.143 -23.803 1.00 29.70 C ATOM 36 CG GLU A 20 -2.730 8.738 -23.870 1.00 34.53 C ATOM 37 CD GLU A 20 -2.710 10.238 -23.822 1.00 39.57 C ATOM 38 OE1 GLU A 20 -1.964 10.769 -22.985 1.00 45.09 O ATOM 39 OE2 GLU A 20 -3.424 10.884 -24.619 1.00 43.70 O ATOM 40 H GLU A 20 -1.898 5.774 -22.088 1.00 0.00 H ATOM 41 N PHE A 21 0.820 6.038 -24.959 1.00 25.10 N ATOM 42 CA PHE A 21 2.251 5.841 -24.907 1.00 25.30 C ATOM 43 C PHE A 21 2.870 7.089 -24.303 1.00 25.98 C ATOM 44 O PHE A 21 2.354 8.193 -24.498 1.00 28.77 O ATOM 45 CB PHE A 21 2.818 5.553 -26.287 1.00 25.86 C ATOM 46 CG PHE A 21 2.409 4.221 -26.820 1.00 27.62 C ATOM 47 CD1 PHE A 21 2.961 3.058 -26.300 1.00 28.38 C ATOM 48 CD2 PHE A 21 1.450 4.117 -27.800 1.00 29.90 C ATOM 49 CE1 PHE A 21 2.578 1.813 -26.760 1.00 28.70 C ATOM 50 CE2 PHE A 21 1.052 2.868 -28.272 1.00 31.49 C ATOM 51 CZ PHE A 21 1.632 1.714 -27.754 1.00 30.54 C ATOM 52 H PHE A 21 0.342 6.095 -25.881 1.00 0.00 H ATOM 53 N THR A 22 3.952 6.920 -23.548 1.00 24.41 N ATOM 54 CA THR A 22 4.534 8.026 -22.807 1.00 23.27 C ATOM 55 C THR A 22 6.047 7.921 -22.826 1.00 23.49 C ATOM 56 O THR A 22 6.624 6.968 -23.364 1.00 23.95 O ATOM 57 CB THR A 22 3.965 8.074 -21.357 1.00 23.35 C ATOM 58 OG1 THR A 22 4.287 9.326 -20.727 1.00 22.72 O ATOM 59 CG2 THR A 22 4.473 6.894 -20.501 1.00 23.13 C ATOM 60 HG1 THR A 22 3.917 9.337 -19.809 1.00 0.00 H ATOM 61 H THR A 22 4.390 5.979 -23.487 1.00 0.00 H ATOM 62 N THR A 23 6.700 8.914 -22.252 1.00 23.92 N ATOM 63 CA THR A 23 8.141 8.888 -22.106 1.00 23.91 C ATOM 64 C THR A 23 8.509 9.109 -20.640 1.00 23.46 C ATOM 65 O THR A 23 7.736 9.673 -19.879 1.00 23.89 O ATOM 66 CB THR A 23 8.824 9.901 -23.035 1.00 25.62 C ATOM 67 OG1 THR A 23 10.233 9.902 -22.761 1.00 29.26 O ATOM 68 CG2 THR A 23 8.259 11.310 -22.856 1.00 25.90 C ATOM 69 HG1 THR A 23 10.384 10.157 -21.816 1.00 0.00 H ATOM 70 H THR A 23 6.168 9.734 -21.896 1.00 0.00 H ATOM 71 N ILE A 24 9.695 8.647 -20.252 1.00 23.37 N ATOM 72 CA ILE A 24 10.090 8.626 -18.855 1.00 22.51 C ATOM 73 C ILE A 24 10.179 10.021 -18.210 1.00 23.84 C ATOM 74 O ILE A 24 9.936 10.158 -16.997 1.00 21.83 O ATOM 75 CB ILE A 24 11.405 7.829 -18.660 1.00 22.01 C ATOM 76 CG1 ILE A 24 11.633 7.506 -17.176 1.00 21.03 C ATOM 77 CG2 ILE A 24 12.598 8.569 -19.266 1.00 21.99 C ATOM 78 CD1 ILE A 24 10.578 6.611 -16.537 1.00 20.67 C ATOM 79 H ILE A 24 10.358 8.291 -20.970 1.00 0.00 H ATOM 80 N GLU A 25 10.506 11.049 -19.006 1.00 25.42 N ATOM 81 CA GLU A 25 10.491 12.471 -18.526 1.00 27.05 C ATOM 82 C GLU A 25 9.120 12.868 -17.979 1.00 25.05 C ATOM 83 O GLU A 25 9.017 13.750 -17.124 1.00 27.50 O ATOM 84 CB GLU A 25 10.940 13.469 -19.628 1.00 30.93 C ATOM 85 CG GLU A 25 10.026 13.508 -20.848 1.00 35.61 C ATOM 86 CD GLU A 25 10.550 14.343 -22.031 1.00 43.83 C ATOM 87 OE1 GLU A 25 11.723 14.136 -22.446 1.00 42.42 O ATOM 88 OE2 GLU A 25 9.758 15.183 -22.571 1.00 44.96 O ATOM 89 H GLU A 25 10.780 10.854 -19.990 1.00 0.00 H ATOM 90 N ASN A 26 8.066 12.210 -18.444 1.00 22.61 N ATOM 91 CA ASN A 26 6.724 12.524 -17.952 1.00 22.88 C ATOM 92 C ASN A 26 6.426 11.800 -16.620 1.00 22.11 C ATOM 93 O ASN A 26 5.486 12.169 -15.908 1.00 19.37 O ATOM 94 CB ASN A 26 5.654 12.157 -18.982 1.00 22.73 C ATOM 95 CG ASN A 26 5.723 13.002 -20.246 1.00 25.54 C ATOM 96 OD1 ASN A 26 6.615 13.831 -20.422 1.00 26.98 O ATOM 97 ND2 ASN A 26 4.764 12.795 -21.140 1.00 27.47 N ATOM 98 HD22 ASN A 26 4.026 12.085 -20.956 1.00 0.00 H ATOM 99 HD21 ASN A 26 4.750 13.342 -22.024 1.00 0.00 H ATOM 100 H ASN A 26 8.194 11.468 -19.161 1.00 0.00 H ATOM 101 N GLN A 27 7.231 10.778 -16.318 1.00 21.84 N ATOM 102 CA GLN A 27 7.002 9.850 -15.197 1.00 23.25 C ATOM 103 C GLN A 27 8.323 9.517 -14.497 1.00 20.51 C ATOM 104 O GLN A 27 8.615 8.350 -14.274 1.00 21.33 O ATOM 105 CB GLN A 27 6.446 8.517 -15.735 1.00 26.87 C ATOM 106 CG GLN A 27 5.426 8.599 -16.867 1.00 28.86 C ATOM 107 CD GLN A 27 4.096 9.114 -16.422 1.00 30.12 C ATOM 108 OE1 GLN A 27 3.366 9.705 -17.216 1.00 33.22 O ATOM 109 NE2 GLN A 27 3.747 8.875 -15.157 1.00 31.94 N ATOM 110 HE22 GLN A 27 4.400 8.371 -14.524 1.00 0.00 H ATOM 111 HE21 GLN A 27 2.822 9.193 -14.804 1.00 0.00 H ATOM 112 H GLN A 27 8.072 10.628 -16.911 1.00 0.00 H ATOM 113 N PRO A 28 9.135 10.522 -14.159 1.00 18.85 N ATOM 114 CA PRO A 28 10.559 10.220 -13.871 1.00 18.21 C ATOM 115 C PRO A 28 10.830 9.421 -12.581 1.00 17.54 C ATOM 116 O PRO A 28 11.960 9.012 -12.318 1.00 17.70 O ATOM 117 CB PRO A 28 11.215 11.609 -13.818 1.00 18.16 C ATOM 118 CG PRO A 28 10.109 12.560 -13.528 1.00 18.51 C ATOM 119 CD PRO A 28 8.835 11.963 -14.073 1.00 18.68 C ATOM 120 N TRP A 29 9.794 9.168 -11.806 1.00 17.45 N ATOM 121 CA TRP A 29 9.915 8.316 -10.631 1.00 17.94 C ATOM 122 C TRP A 29 9.705 6.856 -10.998 1.00 17.51 C ATOM 123 O TRP A 29 9.863 5.988 -10.145 1.00 16.61 O ATOM 124 CB TRP A 29 8.909 8.746 -9.564 1.00 17.91 C ATOM 125 CG TRP A 29 7.593 8.956 -10.157 1.00 19.16 C ATOM 126 CD1 TRP A 29 6.659 7.995 -10.459 1.00 18.94 C ATOM 127 CD2 TRP A 29 7.062 10.201 -10.617 1.00 19.87 C ATOM 128 NE1 TRP A 29 5.579 8.579 -11.060 1.00 19.85 N ATOM 129 CE2 TRP A 29 5.793 9.934 -11.159 1.00 19.69 C ATOM 130 CE3 TRP A 29 7.532 11.529 -10.597 1.00 21.09 C ATOM 131 CZ2 TRP A 29 4.981 10.938 -11.688 1.00 20.22 C ATOM 132 CZ3 TRP A 29 6.724 12.532 -11.115 1.00 21.32 C ATOM 133 CH2 TRP A 29 5.457 12.225 -11.657 1.00 21.03 C ATOM 134 HE1 TRP A 29 4.730 8.078 -11.390 1.00 0.00 H ATOM 135 H TRP A 29 8.870 9.586 -12.039 1.00 0.00 H ATOM 136 N PHE A 30 9.352 6.577 -12.252 1.00 17.48 N ATOM 137 CA PHE A 30 9.002 5.205 -12.625 1.00 17.33 C ATOM 138 C PHE A 30 10.229 4.299 -12.680 1.00 16.81 C ATOM 139 O PHE A 30 11.218 4.633 -13.309 1.00 17.86 O ATOM 140 CB PHE A 30 8.227 5.111 -13.951 1.00 17.49 C ATOM 141 CG PHE A 30 7.769 3.705 -14.269 1.00 16.66 C ATOM 142 CD1 PHE A 30 6.649 3.169 -13.636 1.00 16.55 C ATOM 143 CD2 PHE A 30 8.486 2.907 -15.155 1.00 16.67 C ATOM 144 CE1 PHE A 30 6.239 1.874 -13.900 1.00 17.27 C ATOM 145 CE2 PHE A 30 8.079 1.596 -15.430 1.00 16.86 C ATOM 146 CZ PHE A 30 6.952 1.082 -14.803 1.00 17.27 C ATOM 147 H PHE A 30 9.325 7.333 -12.965 1.00 0.00 H ATOM 148 N ALA A 31 10.118 3.145 -12.020 1.00 16.09 N ATOM 149 CA ALA A 31 11.154 2.137 -11.984 1.00 16.36 C ATOM 150 C ALA A 31 10.679 0.856 -12.666 1.00 15.76 C ATOM 151 O ALA A 31 9.627 0.333 -12.350 1.00 15.02 O ATOM 152 CB ALA A 31 11.547 1.833 -10.535 1.00 16.91 C ATOM 153 H ALA A 31 9.236 2.960 -11.502 1.00 0.00 H ATOM 154 N ALA A 32 11.502 0.355 -13.574 1.00 15.76 N ATOM 155 CA ALA A 32 11.257 -0.860 -14.343 1.00 15.42 C ATOM 156 C ALA A 32 12.063 -1.990 -13.696 1.00 15.37 C ATOM 157 O ALA A 32 13.298 -1.907 -13.613 1.00 14.34 O ATOM 158 CB ALA A 32 11.741 -0.639 -15.794 1.00 15.55 C ATOM 159 H ALA A 32 12.390 0.866 -13.752 1.00 0.00 H ATOM 160 N ILE A 33 11.382 -3.044 -13.251 1.00 15.43 N ATOM 161 CA ILE A 33 12.025 -4.113 -12.515 1.00 15.39 C ATOM 162 C ILE A 33 11.978 -5.449 -13.265 1.00 16.83 C ATOM 163 O ILE A 33 10.900 -5.934 -13.696 1.00 17.28 O ATOM 164 CB ILE A 33 11.388 -4.279 -11.136 1.00 15.84 C ATOM 165 CG1 ILE A 33 11.305 -2.916 -10.430 1.00 15.21 C ATOM 166 CG2 ILE A 33 12.190 -5.261 -10.306 1.00 16.04 C ATOM 167 CD1 ILE A 33 10.732 -2.985 -9.037 1.00 14.62 C ATOM 168 H ILE A 33 10.360 -3.101 -13.437 1.00 0.00 H ATOM 169 N TYR A 34 13.167 -6.027 -13.421 1.00 17.37 N ATOM 170 CA TYR A 34 13.372 -7.247 -14.169 1.00 18.92 C ATOM 171 C TYR A 34 14.080 -8.301 -13.342 1.00 20.46 C ATOM 172 O TYR A 34 14.757 -8.003 -12.347 1.00 21.97 O ATOM 173 CB TYR A 34 14.261 -7.012 -15.386 1.00 19.20 C ATOM 174 CG TYR A 34 13.863 -5.937 -16.358 1.00 18.82 C ATOM 175 CD1 TYR A 34 14.064 -4.601 -16.058 1.00 18.61 C ATOM 176 CD2 TYR A 34 13.409 -6.259 -17.648 1.00 19.55 C ATOM 177 CE1 TYR A 34 13.754 -3.611 -16.979 1.00 19.01 C ATOM 178 CE2 TYR A 34 13.091 -5.264 -18.567 1.00 18.97 C ATOM 179 CZ TYR A 34 13.267 -3.945 -18.222 1.00 18.90 C ATOM 180 OH TYR A 34 12.966 -2.931 -19.124 1.00 22.26 O ATOM 181 HH TYR A 34 13.523 -3.037 -19.936 1.00 0.00 H ATOM 182 H TYR A 34 13.994 -5.576 -12.980 1.00 0.00 H ATOM 183 N ARG A 35 13.940 -9.536 -13.794 1.00 23.24 N ATOM 184 CA ARG A 35 14.539 -10.673 -13.144 1.00 27.17 C ATOM 185 C ARG A 35 15.412 -11.418 -14.132 1.00 28.78 C ATOM 186 O ARG A 35 14.986 -11.748 -15.240 1.00 25.39 O ATOM 187 CB ARG A 35 13.491 -11.631 -12.564 1.00 29.20 C ATOM 188 CG ARG A 35 14.143 -12.878 -11.955 1.00 32.09 C ATOM 189 CD ARG A 35 13.363 -13.503 -10.813 1.00 33.73 C ATOM 190 NE ARG A 35 12.258 -14.301 -11.328 1.00 35.42 N ATOM 191 CZ ARG A 35 12.370 -15.532 -11.817 1.00 35.96 C ATOM 192 NH1 ARG A 35 11.286 -16.167 -12.259 1.00 36.67 N ATOM 193 NH2 ARG A 35 13.547 -16.138 -11.857 1.00 34.40 N ATOM 194 HE ARG A 35 11.309 -13.875 -11.312 1.00 0.00 H ATOM 195 HH12 ARG A 35 11.368 -17.130 -12.643 1.00 0.00 H ATOM 196 HH11 ARG A 35 10.358 -15.700 -12.221 1.00 0.00 H ATOM 197 HH22 ARG A 35 13.623 -17.101 -12.242 1.00 0.00 H ATOM 198 HH21 ARG A 35 14.395 -15.651 -11.504 1.00 0.00 H ATOM 199 H ARG A 35 13.375 -9.692 -14.653 1.00 0.00 H ATOM 200 N ARG A 36 16.633 -11.684 -13.683 1.00 32.00 N ATOM 201 CA ARG A 36 17.584 -12.517 -14.396 1.00 36.37 C ATOM 202 C ARG A 36 17.275 -13.988 -14.114 1.00 36.82 C ATOM 203 O ARG A 36 16.996 -14.374 -12.970 1.00 35.66 O ATOM 204 CB ARG A 36 18.985 -12.181 -13.911 1.00 39.07 C ATOM 205 CG ARG A 36 20.138 -12.673 -14.769 1.00 42.41 C ATOM 206 CD ARG A 36 21.407 -11.880 -14.429 1.00 45.51 C ATOM 207 NE ARG A 36 21.374 -11.361 -13.041 1.00 47.02 N ATOM 208 CZ ARG A 36 21.619 -10.099 -12.662 1.00 46.47 C ATOM 209 NH1 ARG A 36 21.968 -9.153 -13.537 1.00 46.02 N ATOM 210 NH2 ARG A 36 21.535 -9.780 -11.373 1.00 47.19 N ATOM 211 HE ARG A 36 21.138 -12.041 -12.290 1.00 0.00 H ATOM 212 HH12 ARG A 36 22.151 -8.183 -13.209 1.00 0.00 H ATOM 213 HH11 ARG A 36 22.057 -9.386 -14.547 1.00 0.00 H ATOM 214 HH22 ARG A 36 21.723 -8.804 -11.065 1.00 0.00 H ATOM 215 HH21 ARG A 36 21.282 -10.506 -10.673 1.00 0.00 H ATOM 216 H ARG A 36 16.923 -11.274 -12.772 1.00 0.00 H ATOM 217 N HIS A 37 17.327 -14.793 -15.170 1.00 36.89 N ATOM 218 CA HIS A 37 17.066 -16.227 -15.095 1.00 39.17 C ATOM 219 C HIS A 37 18.341 -17.031 -15.329 1.00 42.08 C ATOM 220 O HIS A 37 19.261 -16.586 -16.040 1.00 39.57 O ATOM 221 CB HIS A 37 16.058 -16.634 -16.172 1.00 38.45 C ATOM 222 CG HIS A 37 14.710 -16.016 -16.004 1.00 38.78 C ATOM 223 ND1 HIS A 37 13.647 -16.696 -15.455 1.00 39.57 N ATOM 224 CD2 HIS A 37 14.249 -14.784 -16.320 1.00 38.28 C ATOM 225 CE1 HIS A 37 12.589 -15.908 -15.431 1.00 39.97 C ATOM 226 NE2 HIS A 37 12.930 -14.741 -15.945 1.00 40.08 N ATOM 227 H HIS A 37 17.565 -14.381 -16.095 1.00 0.00 H ATOM 228 N ARG A 37A 18.381 -18.232 -14.755 1.00 47.21 N ATOM 229 CA ARG A 37A 19.428 -19.188 -15.101 1.00 51.70 C ATOM 230 C ARG A 37A 19.522 -19.321 -16.630 1.00 49.13 C ATOM 231 O ARG A 37A 18.528 -19.608 -17.299 1.00 50.23 O ATOM 232 CB ARG A 37A 19.157 -20.545 -14.455 1.00 57.08 C ATOM 233 CG ARG A 37A 19.949 -20.781 -13.180 1.00 62.83 C ATOM 234 CD ARG A 37A 21.400 -21.132 -13.491 1.00 66.21 C ATOM 235 NE ARG A 37A 22.159 -21.340 -12.262 1.00 71.86 N ATOM 236 CZ ARG A 37A 22.639 -20.364 -11.490 1.00 74.15 C ATOM 237 NH1 ARG A 37A 22.461 -19.084 -11.816 1.00 74.58 N ATOM 238 NH2 ARG A 37A 23.310 -20.673 -10.382 1.00 73.09 N ATOM 239 HE ARG A 37A 22.339 -22.321 -11.967 1.00 0.00 H ATOM 240 HH12 ARG A 37A 22.841 -18.334 -11.204 1.00 0.00 H ATOM 241 HH11 ARG A 37A 21.942 -18.835 -12.682 1.00 0.00 H ATOM 242 HH22 ARG A 37A 23.687 -19.918 -9.775 1.00 0.00 H ATOM 243 HH21 ARG A 37A 23.457 -21.670 -10.124 1.00 0.00 H ATOM 244 H ARG A 37A 17.659 -18.491 -14.053 1.00 0.00 H ATOM 245 N GLY A 37B 20.708 -19.068 -17.170 1.00 44.06 N ATOM 246 CA GLY A 37B 20.930 -19.105 -18.605 1.00 43.32 C ATOM 247 C GLY A 37B 21.053 -17.723 -19.209 1.00 45.28 C ATOM 248 O GLY A 37B 21.265 -17.597 -20.411 1.00 42.29 O ATOM 249 H GLY A 37B 21.505 -18.835 -16.544 1.00 0.00 H ATOM 250 N GLY A 37C 20.878 -16.680 -18.394 1.00 46.07 N ATOM 251 CA GLY A 37C 21.161 -15.305 -18.829 1.00 44.95 C ATOM 252 C GLY A 37C 20.009 -14.494 -19.409 1.00 43.06 C ATOM 253 O GLY A 37C 20.163 -13.287 -19.659 1.00 40.83 O ATOM 254 H GLY A 37C 20.533 -16.845 -17.427 1.00 0.00 H ATOM 255 N SER A 37D 18.860 -15.127 -19.641 1.00 39.56 N ATOM 256 CA SER A 37D 17.682 -14.372 -20.091 1.00 38.88 C ATOM 257 C SER A 37D 17.149 -13.479 -18.954 1.00 36.75 C ATOM 258 O SER A 37D 17.117 -13.889 -17.794 1.00 33.76 O ATOM 259 CB SER A 37D 16.574 -15.300 -20.589 1.00 37.86 C ATOM 260 OG SER A 37D 15.983 -16.002 -19.511 1.00 38.81 O ATOM 261 HG SER A 37D 15.594 -15.355 -18.871 1.00 0.00 H ATOM 262 H SER A 37D 18.797 -16.156 -19.504 1.00 0.00 H ATOM 263 N VAL A 38 16.749 -12.264 -19.314 1.00 35.77 N ATOM 264 CA VAL A 38 16.178 -11.296 -18.380 1.00 34.72 C ATOM 265 C VAL A 38 14.720 -11.101 -18.763 1.00 32.70 C ATOM 266 O VAL A 38 14.428 -10.949 -19.930 1.00 33.95 O ATOM 267 CB VAL A 38 16.954 -9.968 -18.461 1.00 35.74 C ATOM 268 CG1 VAL A 38 16.216 -8.826 -17.757 1.00 37.30 C ATOM 269 CG2 VAL A 38 18.338 -10.157 -17.863 1.00 35.67 C ATOM 270 H VAL A 38 16.847 -11.988 -20.312 1.00 0.00 H ATOM 271 N THR A 39 13.801 -11.145 -17.802 1.00 29.98 N ATOM 272 CA THR A 39 12.395 -10.867 -18.098 1.00 27.95 C ATOM 273 C THR A 39 11.814 -9.757 -17.202 1.00 26.35 C ATOM 274 O THR A 39 12.180 -9.615 -16.034 1.00 26.20 O ATOM 275 CB THR A 39 11.528 -12.121 -17.962 1.00 28.74 C ATOM 276 OG1 THR A 39 11.566 -12.568 -16.608 1.00 28.36 O ATOM 277 CG2 THR A 39 12.028 -13.237 -18.917 1.00 29.40 C ATOM 278 HG1 THR A 39 12.500 -12.779 -16.357 1.00 0.00 H ATOM 279 H THR A 39 14.085 -11.380 -16.829 1.00 0.00 H ATOM 280 N TYR A 40 10.911 -8.968 -17.762 1.00 23.17 N ATOM 281 CA TYR A 40 10.231 -7.914 -16.996 1.00 21.64 C ATOM 282 C TYR A 40 9.355 -8.515 -15.925 1.00 19.86 C ATOM 283 O TYR A 40 8.593 -9.426 -16.198 1.00 19.75 O ATOM 284 CB TYR A 40 9.350 -7.053 -17.896 1.00 19.17 C ATOM 285 CG TYR A 40 8.872 -5.805 -17.218 1.00 18.05 C ATOM 286 CD1 TYR A 40 9.745 -4.756 -16.981 1.00 17.76 C ATOM 287 CD2 TYR A 40 7.552 -5.664 -16.810 1.00 17.21 C ATOM 288 CE1 TYR A 40 9.329 -3.599 -16.339 1.00 17.56 C ATOM 289 CE2 TYR A 40 7.121 -4.503 -16.180 1.00 17.45 C ATOM 290 CZ TYR A 40 8.012 -3.472 -15.931 1.00 17.87 C ATOM 291 OH TYR A 40 7.581 -2.286 -15.344 1.00 17.38 O ATOM 292 HH TYR A 40 6.893 -1.866 -15.918 1.00 0.00 H ATOM 293 H TYR A 40 10.677 -9.097 -18.767 1.00 0.00 H ATOM 294 N VAL A 41 9.428 -7.956 -14.726 1.00 19.17 N ATOM 295 CA VAL A 41 8.648 -8.465 -13.586 1.00 17.76 C ATOM 296 C VAL A 41 7.524 -7.511 -13.241 1.00 17.04 C ATOM 297 O VAL A 41 6.362 -7.886 -13.286 1.00 16.41 O ATOM 298 CB VAL A 41 9.545 -8.670 -12.367 1.00 18.24 C ATOM 299 CG1 VAL A 41 8.751 -8.912 -11.096 1.00 18.94 C ATOM 300 CG2 VAL A 41 10.487 -9.839 -12.613 1.00 19.13 C ATOM 301 H VAL A 41 10.053 -7.136 -14.587 1.00 0.00 H ATOM 302 N CYS A 42 7.865 -6.276 -12.890 1.00 16.61 N ATOM 303 CA CYS A 42 6.869 -5.356 -12.317 1.00 15.71 C ATOM 304 C CYS A 42 7.374 -3.925 -12.339 1.00 14.34 C ATOM 305 O CYS A 42 8.557 -3.667 -12.554 1.00 14.08 O ATOM 306 CB CYS A 42 6.560 -5.758 -10.867 1.00 16.58 C ATOM 307 SG CYS A 42 5.296 -7.028 -10.565 1.00 17.56 S ATOM 308 H CYS A 42 8.846 -5.956 -13.021 1.00 0.00 H ATOM 309 N GLY A 43 6.457 -3.000 -12.116 1.00 13.39 N ATOM 310 CA GLY A 43 6.767 -1.603 -11.990 1.00 13.27 C ATOM 311 C GLY A 43 7.132 -1.254 -10.562 1.00 13.57 C ATOM 312 O GLY A 43 7.011 -2.083 -9.636 1.00 13.42 O ATOM 313 H GLY A 43 5.464 -3.297 -12.028 1.00 0.00 H ATOM 314 N GLY A 44 7.613 -0.025 -10.406 1.00 14.30 N ATOM 315 CA GLY A 44 7.995 0.531 -9.113 1.00 14.62 C ATOM 316 C GLY A 44 8.115 2.046 -9.163 1.00 15.52 C ATOM 317 O GLY A 44 8.119 2.643 -10.245 1.00 15.27 O ATOM 318 H GLY A 44 7.723 0.572 -11.251 1.00 0.00 H ATOM 319 N SER A 45 8.229 2.658 -7.979 1.00 16.41 N ATOM 320 CA SER A 45 8.327 4.100 -7.840 1.00 16.62 C ATOM 321 C SER A 45 9.521 4.500 -6.963 1.00 16.73 C ATOM 322 O SER A 45 9.713 3.958 -5.880 1.00 17.55 O ATOM 323 CB SER A 45 7.064 4.627 -7.187 1.00 17.28 C ATOM 324 OG SER A 45 5.907 4.318 -7.919 1.00 16.59 O ATOM 325 HG SER A 45 5.821 3.335 -7.998 1.00 0.00 H ATOM 326 H SER A 45 8.248 2.074 -7.119 1.00 0.00 H ATOM 327 N LEU A 46 10.304 5.469 -7.422 1.00 17.05 N ATOM 328 CA LEU A 46 11.423 5.978 -6.663 1.00 17.49 C ATOM 329 C LEU A 46 10.904 6.967 -5.618 1.00 17.49 C ATOM 330 O LEU A 46 10.451 8.053 -5.970 1.00 18.28 O ATOM 331 CB LEU A 46 12.406 6.684 -7.598 1.00 17.96 C ATOM 332 CG LEU A 46 13.746 7.078 -6.987 1.00 17.78 C ATOM 333 CD1 LEU A 46 14.592 5.835 -6.748 1.00 18.11 C ATOM 334 CD2 LEU A 46 14.471 8.059 -7.885 1.00 17.97 C ATOM 335 H LEU A 46 10.105 5.875 -8.359 1.00 0.00 H ATOM 336 N ILE A 47 10.964 6.585 -4.351 1.00 18.47 N ATOM 337 CA ILE A 47 10.529 7.456 -3.241 1.00 19.07 C ATOM 338 C ILE A 47 11.680 8.187 -2.559 1.00 19.90 C ATOM 339 O ILE A 47 11.457 9.169 -1.859 1.00 21.19 O ATOM 340 CB ILE A 47 9.706 6.697 -2.181 1.00 19.64 C ATOM 341 CG1 ILE A 47 10.497 5.525 -1.575 1.00 20.11 C ATOM 342 CG2 ILE A 47 8.387 6.217 -2.784 1.00 19.48 C ATOM 343 CD1 ILE A 47 9.866 4.922 -0.341 1.00 20.27 C ATOM 344 H ILE A 47 11.331 5.637 -4.130 1.00 0.00 H ATOM 345 N SER A 48 12.903 7.705 -2.745 1.00 19.76 N ATOM 346 CA SER A 48 14.096 8.437 -2.331 1.00 20.56 C ATOM 347 C SER A 48 15.255 7.873 -3.166 1.00 20.14 C ATOM 348 O SER A 48 15.113 6.827 -3.786 1.00 19.18 O ATOM 349 CB SER A 48 14.356 8.303 -0.801 1.00 21.83 C ATOM 350 OG SER A 48 14.931 7.043 -0.452 1.00 22.32 O ATOM 351 HG SER A 48 15.797 6.936 -0.919 1.00 0.00 H ATOM 352 H SER A 48 13.015 6.777 -3.200 1.00 0.00 H ATOM 353 N PRO A 49 16.402 8.563 -3.196 1.00 20.33 N ATOM 354 CA PRO A 49 17.442 8.133 -4.119 1.00 19.91 C ATOM 355 C PRO A 49 17.811 6.657 -4.021 1.00 19.79 C ATOM 356 O PRO A 49 18.121 6.047 -5.051 1.00 19.38 O ATOM 357 CB PRO A 49 18.630 9.033 -3.738 1.00 20.07 C ATOM 358 CG PRO A 49 17.974 10.283 -3.244 1.00 19.82 C ATOM 359 CD PRO A 49 16.798 9.784 -2.461 1.00 20.39 C ATOM 360 N CYS A 50 17.783 6.101 -2.808 1.00 20.18 N ATOM 361 CA CYS A 50 18.186 4.703 -2.569 1.00 20.96 C ATOM 362 C CYS A 50 17.019 3.724 -2.486 1.00 20.56 C ATOM 363 O CYS A 50 17.250 2.512 -2.419 1.00 20.53 O ATOM 364 CB CYS A 50 19.029 4.574 -1.283 1.00 22.54 C ATOM 365 SG CYS A 50 20.530 5.603 -1.234 1.00 25.64 S ATOM 366 H CYS A 50 17.465 6.675 -2.001 1.00 0.00 H ATOM 367 N TRP A 51 15.777 4.222 -2.504 1.00 20.29 N ATOM 368 CA TRP A 51 14.622 3.361 -2.296 1.00 20.10 C ATOM 369 C TRP A 51 13.536 3.387 -3.390 1.00 18.78 C ATOM 370 O TRP A 51 13.006 4.418 -3.755 1.00 18.09 O ATOM 371 CB TRP A 51 13.981 3.670 -0.964 1.00 21.30 C ATOM 372 CG TRP A 51 14.836 3.315 0.220 1.00 23.08 C ATOM 373 CD1 TRP A 51 15.650 4.161 0.933 1.00 23.86 C ATOM 374 CD2 TRP A 51 14.938 2.030 0.854 1.00 23.53 C ATOM 375 NE1 TRP A 51 16.246 3.476 1.961 1.00 24.53 N ATOM 376 CE2 TRP A 51 15.830 2.170 1.937 1.00 24.29 C ATOM 377 CE3 TRP A 51 14.362 0.777 0.610 1.00 23.81 C ATOM 378 CZ2 TRP A 51 16.169 1.104 2.767 1.00 23.85 C ATOM 379 CZ3 TRP A 51 14.693 -0.283 1.446 1.00 24.62 C ATOM 380 CH2 TRP A 51 15.588 -0.112 2.509 1.00 24.41 C ATOM 381 HE1 TRP A 51 16.909 3.883 2.651 1.00 0.00 H ATOM 382 H TRP A 51 15.635 5.239 -2.669 1.00 0.00 H ATOM 383 N VAL A 52 13.183 2.194 -3.849 1.00 17.65 N ATOM 384 CA VAL A 52 12.072 1.992 -4.761 1.00 17.09 C ATOM 385 C VAL A 52 11.001 1.222 -4.041 1.00 16.58 C ATOM 386 O VAL A 52 11.276 0.248 -3.337 1.00 17.62 O ATOM 387 CB VAL A 52 12.527 1.184 -5.993 1.00 16.90 C ATOM 388 CG1 VAL A 52 11.351 0.769 -6.865 1.00 16.95 C ATOM 389 CG2 VAL A 52 13.527 2.001 -6.787 1.00 17.08 C ATOM 390 H VAL A 52 13.728 1.364 -3.541 1.00 0.00 H ATOM 391 N ILE A 53 9.774 1.665 -4.204 1.00 16.54 N ATOM 392 CA ILE A 53 8.657 1.000 -3.570 1.00 17.25 C ATOM 393 C ILE A 53 7.819 0.293 -4.652 1.00 16.02 C ATOM 394 O ILE A 53 7.620 0.827 -5.746 1.00 16.21 O ATOM 395 CB ILE A 53 7.815 1.986 -2.725 1.00 17.09 C ATOM 396 CG1 ILE A 53 7.002 1.213 -1.685 1.00 18.21 C ATOM 397 CG2 ILE A 53 6.920 2.839 -3.603 1.00 17.31 C ATOM 398 CD1 ILE A 53 6.270 2.089 -0.677 1.00 18.47 C ATOM 399 H ILE A 53 9.605 2.503 -4.796 1.00 0.00 H ATOM 400 N SER A 54 7.360 -0.905 -4.334 1.00 15.40 N ATOM 401 CA SER A 54 6.648 -1.749 -5.291 1.00 15.91 C ATOM 402 C SER A 54 5.672 -2.659 -4.530 1.00 16.00 C ATOM 403 O SER A 54 5.233 -2.316 -3.428 1.00 15.08 O ATOM 404 CB SER A 54 7.653 -2.543 -6.164 1.00 16.02 C ATOM 405 OG SER A 54 6.991 -3.303 -7.166 1.00 15.76 O ATOM 406 HG SER A 54 6.478 -2.695 -7.755 1.00 0.00 H ATOM 407 H SER A 54 7.511 -1.260 -3.368 1.00 0.00 H ATOM 408 N ALA A 55 5.306 -3.792 -5.132 1.00 16.71 N ATOM 409 CA ALA A 55 4.373 -4.734 -4.520 1.00 16.38 C ATOM 410 C ALA A 55 5.051 -6.066 -4.164 1.00 16.58 C ATOM 411 O ALA A 55 5.790 -6.618 -4.978 1.00 17.29 O ATOM 412 CB ALA A 55 3.215 -4.967 -5.460 1.00 16.60 C ATOM 413 H ALA A 55 5.699 -4.012 -6.070 1.00 0.00 H ATOM 414 N THR A 56 4.787 -6.574 -2.956 1.00 15.51 N ATOM 415 CA THR A 56 5.351 -7.830 -2.511 1.00 15.74 C ATOM 416 C THR A 56 4.963 -8.997 -3.410 1.00 15.77 C ATOM 417 O THR A 56 5.765 -9.896 -3.585 1.00 16.18 O ATOM 418 CB THR A 56 4.963 -8.208 -1.036 1.00 15.98 C ATOM 419 OG1 THR A 56 5.718 -7.431 -0.092 1.00 15.76 O ATOM 420 CG2 THR A 56 5.263 -9.684 -0.748 1.00 16.18 C ATOM 421 HG1 THR A 56 5.532 -6.469 -0.234 1.00 0.00 H ATOM 422 H THR A 56 4.157 -6.050 -2.316 1.00 0.00 H ATOM 423 N HIS A 57 3.755 -9.012 -3.975 1.00 16.32 N ATOM 424 CA HIS A 57 3.351 -10.174 -4.801 1.00 16.54 C ATOM 425 C HIS A 57 4.271 -10.385 -5.985 1.00 16.50 C ATOM 426 O HIS A 57 4.399 -11.492 -6.510 1.00 17.75 O ATOM 427 CB HIS A 57 1.875 -10.135 -5.212 1.00 16.15 C ATOM 428 CG HIS A 57 1.573 -9.329 -6.439 1.00 15.72 C ATOM 429 ND1 HIS A 57 0.883 -8.138 -6.387 1.00 15.97 N ATOM 430 CD2 HIS A 57 1.788 -9.580 -7.750 1.00 15.06 C ATOM 431 CE1 HIS A 57 0.730 -7.664 -7.609 1.00 15.59 C ATOM 432 NE2 HIS A 57 1.263 -8.523 -8.454 1.00 15.30 N ATOM 433 H HIS A 57 3.102 -8.215 -3.837 1.00 0.00 H ATOM 434 N CYS A 58 4.946 -9.318 -6.379 1.00 16.50 N ATOM 435 CA CYS A 58 5.848 -9.365 -7.514 1.00 16.14 C ATOM 436 C CYS A 58 7.073 -10.214 -7.228 1.00 16.18 C ATOM 437 O CYS A 58 7.710 -10.685 -8.155 1.00 16.49 O ATOM 438 CB CYS A 58 6.301 -7.948 -7.863 1.00 15.77 C ATOM 439 SG CYS A 58 5.003 -6.901 -8.529 1.00 15.78 S ATOM 440 H CYS A 58 4.827 -8.423 -5.862 1.00 0.00 H ATOM 441 N PHE A 59 7.423 -10.370 -5.954 1.00 17.10 N ATOM 442 CA PHE A 59 8.687 -11.022 -5.562 1.00 18.48 C ATOM 443 C PHE A 59 8.522 -12.247 -4.649 1.00 18.89 C ATOM 444 O PHE A 59 9.487 -12.956 -4.401 1.00 17.40 O ATOM 445 CB PHE A 59 9.596 -9.993 -4.873 1.00 18.79 C ATOM 446 CG PHE A 59 9.618 -8.664 -5.566 1.00 19.46 C ATOM 447 CD1 PHE A 59 10.469 -8.441 -6.623 1.00 19.28 C ATOM 448 CD2 PHE A 59 8.752 -7.644 -5.178 1.00 20.03 C ATOM 449 CE1 PHE A 59 10.468 -7.213 -7.282 1.00 21.28 C ATOM 450 CE2 PHE A 59 8.757 -6.406 -5.823 1.00 20.81 C ATOM 451 CZ PHE A 59 9.611 -6.188 -6.888 1.00 20.00 C ATOM 452 H PHE A 59 6.785 -10.021 -5.210 1.00 0.00 H ATOM 453 N ILE A 60 7.303 -12.482 -4.151 1.00 19.96 N ATOM 454 CA ILE A 60 7.084 -13.447 -3.067 1.00 20.03 C ATOM 455 C ILE A 60 7.530 -14.867 -3.461 1.00 19.65 C ATOM 456 O ILE A 60 8.090 -15.605 -2.624 1.00 18.81 O ATOM 457 CB ILE A 60 5.624 -13.380 -2.541 1.00 19.83 C ATOM 458 CG1 ILE A 60 5.418 -14.265 -1.312 1.00 20.62 C ATOM 459 CG2 ILE A 60 4.627 -13.757 -3.608 1.00 20.38 C ATOM 460 CD1 ILE A 60 6.037 -13.711 -0.034 1.00 21.40 C ATOM 461 H ILE A 60 6.489 -11.967 -4.542 1.00 0.00 H ATOM 462 N ASP A 60A 7.312 -15.254 -4.717 1.00 18.84 N ATOM 463 CA ASP A 60A 7.710 -16.589 -5.141 1.00 19.71 C ATOM 464 C ASP A 60A 9.173 -16.700 -5.499 1.00 20.22 C ATOM 465 O ASP A 60A 9.676 -17.796 -5.585 1.00 18.99 O ATOM 466 CB ASP A 60A 6.861 -17.115 -6.293 1.00 20.98 C ATOM 467 CG ASP A 60A 5.474 -17.503 -5.851 1.00 22.09 C ATOM 468 OD1 ASP A 60A 5.129 -17.290 -4.648 1.00 22.71 O ATOM 469 OD2 ASP A 60A 4.728 -17.992 -6.717 1.00 22.46 O ATOM 470 H ASP A 60A 6.859 -14.605 -5.392 1.00 0.00 H ATOM 471 N TYR A 60B 9.860 -15.581 -5.684 1.00 21.43 N ATOM 472 CA TYR A 60B 11.303 -15.592 -5.947 1.00 22.77 C ATOM 473 C TYR A 60B 11.946 -14.506 -5.104 1.00 23.37 C ATOM 474 O TYR A 60B 12.341 -13.469 -5.630 1.00 24.80 O ATOM 475 CB TYR A 60B 11.576 -15.342 -7.436 1.00 23.76 C ATOM 476 CG TYR A 60B 10.966 -16.402 -8.317 1.00 26.03 C ATOM 477 CD1 TYR A 60B 11.677 -17.564 -8.638 1.00 27.69 C ATOM 478 CD2 TYR A 60B 9.671 -16.261 -8.818 1.00 26.72 C ATOM 479 CE1 TYR A 60B 11.122 -18.549 -9.446 1.00 27.98 C ATOM 480 CE2 TYR A 60B 9.100 -17.247 -9.613 1.00 28.73 C ATOM 481 CZ TYR A 60B 9.836 -18.393 -9.927 1.00 29.48 C ATOM 482 OH TYR A 60B 9.279 -19.376 -10.717 1.00 31.39 O ATOM 483 HH TYR A 60B 9.042 -18.994 -11.599 1.00 0.00 H ATOM 484 H TYR A 60B 9.361 -14.669 -5.641 1.00 0.00 H ATOM 485 N PRO A 60C 12.064 -14.735 -3.788 1.00 22.83 N ATOM 486 CA PRO A 60C 12.479 -13.667 -2.878 1.00 23.70 C ATOM 487 C PRO A 60C 14.007 -13.480 -2.789 1.00 26.09 C ATOM 488 O PRO A 60C 14.526 -13.088 -1.756 1.00 29.90 O ATOM 489 CB PRO A 60C 11.881 -14.106 -1.551 1.00 22.87 C ATOM 490 CG PRO A 60C 11.923 -15.606 -1.619 1.00 23.78 C ATOM 491 CD PRO A 60C 11.742 -15.979 -3.071 1.00 23.08 C ATOM 492 N LYS A 61 14.697 -13.706 -3.902 1.00 27.04 N ATOM 493 CA LYS A 61 16.140 -13.696 -3.964 1.00 26.21 C ATOM 494 C LYS A 61 16.622 -12.398 -4.640 1.00 25.83 C ATOM 495 O LYS A 61 16.543 -12.232 -5.853 1.00 25.48 O ATOM 496 CB LYS A 61 16.578 -14.938 -4.714 1.00 25.71 C ATOM 497 CG LYS A 61 18.063 -15.197 -4.709 1.00 27.49 C ATOM 498 CD LYS A 61 18.372 -16.318 -5.686 1.00 27.66 C ATOM 499 CE LYS A 61 19.858 -16.583 -5.698 1.00 29.39 C ATOM 500 NZ LYS A 61 20.153 -17.663 -6.674 1.00 31.40 N ATOM 501 HZ1 LYS A 61 19.646 -18.527 -6.396 1.00 0.00 H ATOM 502 HZ2 LYS A 61 19.843 -17.367 -7.621 1.00 0.00 H ATOM 503 HZ3 LYS A 61 21.176 -17.849 -6.685 1.00 0.00 H ATOM 504 H LYS A 61 14.169 -13.901 -4.777 1.00 0.00 H ATOM 505 N LYS A 62 17.118 -11.466 -3.841 1.00 26.27 N ATOM 506 CA LYS A 62 17.387 -10.111 -4.351 1.00 26.66 C ATOM 507 C LYS A 62 18.435 -10.046 -5.454 1.00 26.23 C ATOM 508 O LYS A 62 18.411 -9.142 -6.272 1.00 23.69 O ATOM 509 CB LYS A 62 17.796 -9.183 -3.222 1.00 27.72 C ATOM 510 CG LYS A 62 19.172 -9.443 -2.624 1.00 28.72 C ATOM 511 CD LYS A 62 19.269 -8.644 -1.328 1.00 32.19 C ATOM 512 CE LYS A 62 20.523 -8.950 -0.529 1.00 33.57 C ATOM 513 NZ LYS A 62 21.730 -8.637 -1.320 1.00 34.21 N ATOM 514 HZ1 LYS A 62 21.733 -9.211 -2.187 1.00 0.00 H ATOM 515 HZ2 LYS A 62 21.727 -7.628 -1.571 1.00 0.00 H ATOM 516 HZ3 LYS A 62 22.577 -8.853 -0.757 1.00 0.00 H ATOM 517 H LYS A 62 17.319 -11.693 -2.846 1.00 0.00 H ATOM 518 N GLU A 62A 19.359 -11.001 -5.456 1.00 27.16 N ATOM 519 CA GLU A 62A 20.397 -11.088 -6.473 1.00 29.56 C ATOM 520 C GLU A 62A 19.813 -11.261 -7.901 1.00 27.49 C ATOM 521 O GLU A 62A 20.453 -10.907 -8.876 1.00 28.20 O ATOM 522 CB GLU A 62A 21.365 -12.233 -6.085 1.00 33.20 C ATOM 523 CG GLU A 62A 22.382 -12.682 -7.130 1.00 39.40 C ATOM 524 CD GLU A 62A 21.952 -13.949 -7.893 1.00 44.50 C ATOM 525 OE1 GLU A 62A 20.831 -13.975 -8.470 1.00 50.17 O ATOM 526 OE2 GLU A 62A 22.739 -14.928 -7.929 1.00 42.83 O ATOM 527 H GLU A 62A 19.340 -11.715 -4.700 1.00 0.00 H ATOM 528 N ASP A 63 18.595 -11.783 -8.010 1.00 27.30 N ATOM 529 CA ASP A 63 17.965 -12.049 -9.314 1.00 26.70 C ATOM 530 C ASP A 63 17.523 -10.774 -10.017 1.00 25.00 C ATOM 531 O ASP A 63 17.299 -10.786 -11.209 1.00 22.87 O ATOM 532 CB ASP A 63 16.691 -12.876 -9.144 1.00 28.40 C ATOM 533 CG ASP A 63 16.934 -14.328 -8.749 1.00 30.77 C ATOM 534 OD1 ASP A 63 18.057 -14.864 -8.938 1.00 29.23 O ATOM 535 OD2 ASP A 63 15.934 -14.938 -8.263 1.00 33.43 O ATOM 536 H ASP A 63 18.068 -12.012 -7.143 1.00 0.00 H ATOM 537 N TYR A 64 17.338 -9.688 -9.260 1.00 23.61 N ATOM 538 CA TYR A 64 16.604 -8.540 -9.781 1.00 21.42 C ATOM 539 C TYR A 64 17.488 -7.415 -10.288 1.00 20.98 C ATOM 540 O TYR A 64 18.559 -7.129 -9.761 1.00 22.32 O ATOM 541 CB TYR A 64 15.610 -8.024 -8.754 1.00 19.87 C ATOM 542 CG TYR A 64 14.554 -9.043 -8.471 1.00 20.47 C ATOM 543 CD1 TYR A 64 13.413 -9.135 -9.260 1.00 19.72 C ATOM 544 CD2 TYR A 64 14.717 -9.962 -7.432 1.00 20.16 C ATOM 545 CE1 TYR A 64 12.457 -10.112 -9.008 1.00 19.83 C ATOM 546 CE2 TYR A 64 13.769 -10.937 -7.179 1.00 19.73 C ATOM 547 CZ TYR A 64 12.643 -11.013 -7.966 1.00 19.64 C ATOM 548 OH TYR A 64 11.704 -11.987 -7.698 1.00 18.16 O ATOM 549 HH TYR A 64 11.357 -11.865 -6.779 1.00 0.00 H ATOM 550 H TYR A 64 17.720 -9.661 -8.293 1.00 0.00 H ATOM 551 N ILE A 65 17.000 -6.785 -11.339 1.00 21.31 N ATOM 552 CA ILE A 65 17.628 -5.612 -11.920 1.00 21.45 C ATOM 553 C ILE A 65 16.601 -4.488 -11.931 1.00 19.77 C ATOM 554 O ILE A 65 15.451 -4.694 -12.313 1.00 19.22 O ATOM 555 CB ILE A 65 18.067 -5.914 -13.349 1.00 22.41 C ATOM 556 CG1 ILE A 65 19.065 -7.064 -13.333 1.00 24.18 C ATOM 557 CG2 ILE A 65 18.682 -4.688 -14.005 1.00 23.11 C ATOM 558 CD1 ILE A 65 19.210 -7.737 -14.687 1.00 26.41 C ATOM 559 H ILE A 65 16.125 -7.145 -11.771 1.00 0.00 H ATOM 560 N VAL A 66 17.019 -3.303 -11.519 1.00 19.11 N ATOM 561 CA VAL A 66 16.149 -2.124 -11.552 1.00 18.38 C ATOM 562 C VAL A 66 16.730 -1.041 -12.445 1.00 18.76 C ATOM 563 O VAL A 66 17.913 -0.665 -12.303 1.00 19.12 O ATOM 564 CB VAL A 66 15.956 -1.527 -10.144 1.00 17.88 C ATOM 565 CG1 VAL A 66 14.979 -0.357 -10.187 1.00 18.13 C ATOM 566 CG2 VAL A 66 15.462 -2.591 -9.197 1.00 17.13 C ATOM 567 H VAL A 66 17.991 -3.205 -11.162 1.00 0.00 H ATOM 568 N TYR A 67 15.891 -0.542 -13.352 1.00 18.80 N ATOM 569 CA TYR A 67 16.187 0.660 -14.124 1.00 19.47 C ATOM 570 C TYR A 67 15.392 1.879 -13.684 1.00 18.80 C ATOM 571 O TYR A 67 14.204 1.793 -13.377 1.00 18.00 O ATOM 572 CB TYR A 67 15.899 0.450 -15.624 1.00 20.39 C ATOM 573 CG TYR A 67 16.869 -0.468 -16.285 1.00 20.72 C ATOM 574 CD1 TYR A 67 16.633 -1.827 -16.300 1.00 22.34 C ATOM 575 CD2 TYR A 67 18.030 0.009 -16.871 1.00 20.38 C ATOM 576 CE1 TYR A 67 17.515 -2.701 -16.907 1.00 22.98 C ATOM 577 CE2 TYR A 67 18.917 -0.857 -17.494 1.00 21.69 C ATOM 578 CZ TYR A 67 18.644 -2.209 -17.502 1.00 22.66 C ATOM 579 OH TYR A 67 19.495 -3.111 -18.084 1.00 27.06 O ATOM 580 HH TYR A 67 19.124 -4.024 -17.985 1.00 0.00 H ATOM 581 H TYR A 67 14.987 -1.030 -13.516 1.00 0.00 H ATOM 582 N LEU A 68 16.091 3.009 -13.705 1.00 19.31 N ATOM 583 CA LEU A 68 15.528 4.333 -13.604 1.00 19.84 C ATOM 584 C LEU A 68 15.882 5.070 -14.893 1.00 19.91 C ATOM 585 O LEU A 68 16.905 4.784 -15.486 1.00 20.70 O ATOM 586 CB LEU A 68 16.122 5.032 -12.390 1.00 19.65 C ATOM 587 CG LEU A 68 15.772 4.391 -11.038 1.00 20.36 C ATOM 588 CD1 LEU A 68 16.490 5.139 -9.932 1.00 20.81 C ATOM 589 CD2 LEU A 68 14.274 4.387 -10.768 1.00 20.82 C ATOM 590 H LEU A 68 17.124 2.933 -13.802 1.00 0.00 H ATOM 591 N GLY A 69 15.047 6.007 -15.328 1.00 21.01 N ATOM 592 CA GLY A 69 15.303 6.779 -16.564 1.00 21.26 C ATOM 593 C GLY A 69 15.027 6.003 -17.853 1.00 22.08 C ATOM 594 O GLY A 69 15.578 6.325 -18.910 1.00 22.16 O ATOM 595 H GLY A 69 14.184 6.205 -14.782 1.00 0.00 H ATOM 596 N ARG A 70 14.177 4.985 -17.766 1.00 22.13 N ATOM 597 CA ARG A 70 13.961 4.018 -18.863 1.00 23.98 C ATOM 598 C ARG A 70 12.553 4.114 -19.488 1.00 23.12 C ATOM 599 O ARG A 70 11.553 3.936 -18.780 1.00 22.07 O ATOM 600 CB ARG A 70 14.169 2.630 -18.285 1.00 26.06 C ATOM 601 CG ARG A 70 14.014 1.459 -19.232 1.00 28.37 C ATOM 602 CD ARG A 70 15.364 0.807 -19.452 1.00 29.83 C ATOM 603 NE ARG A 70 15.220 -0.480 -20.073 1.00 31.65 N ATOM 604 CZ ARG A 70 16.210 -1.177 -20.609 1.00 32.69 C ATOM 605 NH1 ARG A 70 17.454 -0.709 -20.609 1.00 31.58 N ATOM 606 NH2 ARG A 70 15.931 -2.355 -21.158 1.00 34.91 N ATOM 607 HE ARG A 70 14.267 -0.895 -20.104 1.00 0.00 H ATOM 608 HH12 ARG A 70 18.220 -1.269 -21.034 1.00 0.00 H ATOM 609 HH11 ARG A 70 17.661 0.217 -20.184 1.00 0.00 H ATOM 610 HH22 ARG A 70 16.690 -2.922 -21.586 1.00 0.00 H ATOM 611 HH21 ARG A 70 14.953 -2.709 -21.160 1.00 0.00 H ATOM 612 H ARG A 70 13.639 4.863 -16.885 1.00 0.00 H ATOM 613 N SER A 71 12.480 4.407 -20.792 1.00 21.63 N ATOM 614 CA SER A 71 11.182 4.536 -21.512 1.00 22.67 C ATOM 615 C SER A 71 10.772 3.294 -22.316 1.00 21.54 C ATOM 616 O SER A 71 9.620 3.155 -22.725 1.00 18.74 O ATOM 617 CB SER A 71 11.217 5.720 -22.488 1.00 22.39 C ATOM 618 OG SER A 71 11.488 6.921 -21.819 1.00 23.69 O ATOM 619 HG SER A 71 11.504 7.665 -22.472 1.00 0.00 H ATOM 620 H SER A 71 13.363 4.550 -21.323 1.00 0.00 H ATOM 621 N ARG A 72 11.720 2.395 -22.531 1.00 24.33 N ATOM 622 CA ARG A 72 11.511 1.252 -23.410 1.00 26.30 C ATOM 623 C ARG A 72 11.883 -0.039 -22.728 1.00 23.86 C ATOM 624 O ARG A 72 12.832 -0.092 -21.941 1.00 22.86 O ATOM 625 CB ARG A 72 12.320 1.424 -24.694 1.00 30.11 C ATOM 626 CG ARG A 72 12.023 2.733 -25.389 1.00 35.26 C ATOM 627 CD ARG A 72 12.428 2.721 -26.854 1.00 43.78 C ATOM 628 NE ARG A 72 11.269 2.711 -27.755 1.00 50.22 N ATOM 629 CZ ARG A 72 10.855 1.665 -28.478 1.00 57.09 C ATOM 630 NH1 ARG A 72 9.781 1.788 -29.258 1.00 58.25 N ATOM 631 NH2 ARG A 72 11.500 0.502 -28.443 1.00 63.31 N ATOM 632 HE ARG A 72 10.723 3.593 -27.838 1.00 0.00 H ATOM 633 HH12 ARG A 72 9.453 0.979 -29.823 1.00 0.00 H ATOM 634 HH11 ARG A 72 9.271 2.693 -29.301 1.00 0.00 H ATOM 635 HH22 ARG A 72 11.160 -0.298 -29.014 1.00 0.00 H ATOM 636 HH21 ARG A 72 12.344 0.393 -27.845 1.00 0.00 H ATOM 637 H ARG A 72 12.640 2.508 -22.059 1.00 0.00 H ATOM 638 N LEU A 73 11.142 -1.084 -23.067 1.00 22.52 N ATOM 639 CA LEU A 73 11.224 -2.357 -22.366 1.00 23.73 C ATOM 640 C LEU A 73 12.512 -3.123 -22.609 1.00 25.77 C ATOM 641 O LEU A 73 13.068 -3.721 -21.675 1.00 24.80 O ATOM 642 CB LEU A 73 10.045 -3.241 -22.747 1.00 23.27 C ATOM 643 CG LEU A 73 9.876 -4.493 -21.915 1.00 24.01 C ATOM 644 CD1 LEU A 73 9.478 -4.096 -20.493 1.00 25.02 C ATOM 645 CD2 LEU A 73 8.830 -5.407 -22.544 1.00 24.88 C ATOM 646 H LEU A 73 10.478 -0.991 -23.862 1.00 0.00 H ATOM 647 N ASN A 74 12.969 -3.112 -23.859 1.00 28.37 N ATOM 648 CA ASN A 74 14.112 -3.912 -24.269 1.00 31.55 C ATOM 649 C ASN A 74 15.156 -3.140 -25.028 1.00 33.26 C ATOM 650 O ASN A 74 16.032 -3.748 -25.640 1.00 35.46 O ATOM 651 CB ASN A 74 13.649 -5.097 -25.120 1.00 33.05 C ATOM 652 CG ASN A 74 12.892 -6.118 -24.309 1.00 34.33 C ATOM 653 OD1 ASN A 74 13.456 -6.732 -23.405 1.00 36.34 O ATOM 654 ND2 ASN A 74 11.607 -6.310 -24.622 1.00 34.10 N ATOM 655 HD22 ASN A 74 11.173 -5.767 -25.395 1.00 0.00 H ATOM 656 HD21 ASN A 74 11.041 -7.003 -24.092 1.00 0.00 H ATOM 657 H ASN A 74 12.494 -2.513 -24.564 1.00 0.00 H ATOM 658 N SER A 75 15.089 -1.813 -24.967 1.00 34.95 N ATOM 659 CA SER A 75 16.105 -0.964 -25.579 1.00 35.13 C ATOM 660 C SER A 75 16.540 0.038 -24.530 1.00 36.26 C ATOM 661 O SER A 75 15.786 0.357 -23.608 1.00 34.80 O ATOM 662 CB SER A 75 15.554 -0.184 -26.782 1.00 35.47 C ATOM 663 OG SER A 75 14.732 -0.981 -27.607 1.00 38.16 O ATOM 664 HG SER A 75 14.402 -0.437 -28.366 1.00 0.00 H ATOM 665 H SER A 75 14.291 -1.369 -24.470 1.00 0.00 H ATOM 666 N ASN A 76 17.746 0.559 -24.699 1.00 35.15 N ATOM 667 CA ASN A 76 18.295 1.541 -23.777 1.00 36.15 C ATOM 668 C ASN A 76 17.685 2.899 -24.041 1.00 34.61 C ATOM 669 O ASN A 76 17.298 3.198 -25.163 1.00 36.41 O ATOM 670 CB ASN A 76 19.823 1.599 -23.913 1.00 37.28 C ATOM 671 CG ASN A 76 20.467 0.246 -23.662 1.00 38.17 C ATOM 672 OD1 ASN A 76 21.003 -0.375 -24.569 1.00 39.87 O ATOM 673 ND2 ASN A 76 20.372 -0.235 -22.434 1.00 39.25 N ATOM 674 HD22 ASN A 76 19.908 0.325 -21.691 1.00 0.00 H ATOM 675 HD21 ASN A 76 20.761 -1.173 -22.212 1.00 0.00 H ATOM 676 H ASN A 76 18.317 0.257 -25.514 1.00 0.00 H ATOM 677 N THR A 77 17.570 3.702 -22.987 1.00 32.98 N ATOM 678 CA THR A 77 17.178 5.100 -23.096 1.00 30.24 C ATOM 679 C THR A 77 18.348 5.957 -22.612 1.00 30.44 C ATOM 680 O THR A 77 19.026 5.606 -21.655 1.00 28.98 O ATOM 681 CB THR A 77 15.910 5.372 -22.260 1.00 28.31 C ATOM 682 OG1 THR A 77 14.820 4.612 -22.800 1.00 28.44 O ATOM 683 CG2 THR A 77 15.539 6.854 -22.238 1.00 26.70 C ATOM 684 HG1 THR A 77 14.004 4.783 -22.267 1.00 0.00 H ATOM 685 H THR A 77 17.769 3.314 -22.043 1.00 0.00 H ATOM 686 N GLN A 78 18.569 7.078 -23.283 1.00 32.25 N ATOM 687 CA GLN A 78 19.576 8.062 -22.898 1.00 34.39 C ATOM 688 C GLN A 78 19.265 8.624 -21.510 1.00 32.77 C ATOM 689 O GLN A 78 18.123 8.987 -21.241 1.00 32.93 O ATOM 690 CB GLN A 78 19.565 9.195 -23.923 1.00 39.62 C ATOM 691 CG GLN A 78 20.617 10.277 -23.714 1.00 47.39 C ATOM 692 CD GLN A 78 21.611 10.359 -24.866 1.00 54.99 C ATOM 693 OE1 GLN A 78 21.319 10.942 -25.925 1.00 54.23 O ATOM 694 NE2 GLN A 78 22.790 9.766 -24.670 1.00 58.11 N ATOM 695 HE22 GLN A 78 22.989 9.290 -23.767 1.00 0.00 H ATOM 696 HE21 GLN A 78 23.510 9.779 -25.420 1.00 0.00 H ATOM 697 H GLN A 78 17.994 7.267 -24.129 1.00 0.00 H ATOM 698 N GLY A 79 20.277 8.713 -20.649 1.00 31.38 N ATOM 699 CA GLY A 79 20.099 9.117 -19.242 1.00 31.48 C ATOM 700 C GLY A 79 19.724 7.994 -18.259 1.00 30.95 C ATOM 701 O GLY A 79 19.746 8.193 -17.036 1.00 30.69 O ATOM 702 H GLY A 79 21.235 8.488 -20.984 1.00 0.00 H ATOM 703 N GLU A 80 19.389 6.813 -18.773 1.00 29.35 N ATOM 704 CA GLU A 80 18.967 5.712 -17.910 1.00 29.80 C ATOM 705 C GLU A 80 20.097 5.254 -16.995 1.00 30.68 C ATOM 706 O GLU A 80 21.294 5.467 -17.281 1.00 29.40 O ATOM 707 CB GLU A 80 18.461 4.524 -18.722 1.00 29.66 C ATOM 708 CG GLU A 80 19.557 3.564 -19.153 1.00 29.00 C ATOM 709 CD GLU A 80 19.056 2.477 -20.080 1.00 30.78 C ATOM 710 OE1 GLU A 80 17.889 2.531 -20.500 1.00 30.35 O ATOM 711 OE2 GLU A 80 19.840 1.554 -20.397 1.00 35.17 O ATOM 712 H GLU A 80 19.428 6.672 -19.803 1.00 0.00 H ATOM 713 N MET A 81 19.707 4.621 -15.895 1.00 28.50 N ATOM 714 CA MET A 81 20.662 4.138 -14.935 1.00 29.58 C ATOM 715 C MET A 81 20.209 2.786 -14.432 1.00 28.63 C ATOM 716 O MET A 81 19.014 2.558 -14.196 1.00 25.74 O ATOM 717 CB MET A 81 20.817 5.130 -13.778 1.00 34.14 C ATOM 718 CG MET A 81 21.336 6.523 -14.176 1.00 37.40 C ATOM 719 SD MET A 81 22.937 6.629 -15.039 1.00 47.09 S ATOM 720 CE MET A 81 24.119 6.257 -13.745 1.00 44.48 C ATOM 721 H MET A 81 18.692 4.472 -15.725 1.00 0.00 H ATOM 722 N LYS A 82 21.185 1.896 -14.267 1.00 26.53 N ATOM 723 CA LYS A 82 20.937 0.500 -13.958 1.00 26.08 C ATOM 724 C LYS A 82 21.397 0.182 -12.527 1.00 24.09 C ATOM 725 O LYS A 82 22.508 0.548 -12.125 1.00 22.46 O ATOM 726 CB LYS A 82 21.689 -0.364 -14.967 1.00 27.33 C ATOM 727 CG LYS A 82 21.511 -1.863 -14.821 1.00 29.81 C ATOM 728 CD LYS A 82 22.513 -2.595 -15.689 1.00 32.65 C ATOM 729 CE LYS A 82 22.265 -4.087 -15.661 1.00 36.61 C ATOM 730 NZ LYS A 82 23.376 -4.856 -16.296 1.00 39.95 N ATOM 731 HZ1 LYS A 82 23.475 -4.563 -17.289 1.00 0.00 H ATOM 732 HZ2 LYS A 82 24.263 -4.666 -15.787 1.00 0.00 H ATOM 733 HZ3 LYS A 82 23.161 -5.873 -16.253 1.00 0.00 H ATOM 734 H LYS A 82 22.170 2.216 -14.364 1.00 0.00 H ATOM 735 N PHE A 83 20.541 -0.511 -11.773 1.00 22.73 N ATOM 736 CA PHE A 83 20.805 -0.817 -10.369 1.00 22.13 C ATOM 737 C PHE A 83 20.607 -2.289 -10.014 1.00 22.74 C ATOM 738 O PHE A 83 19.767 -3.006 -10.605 1.00 20.44 O ATOM 739 CB PHE A 83 19.886 0.024 -9.483 1.00 22.23 C ATOM 740 CG PHE A 83 20.055 1.508 -9.669 1.00 21.83 C ATOM 741 CD1 PHE A 83 19.313 2.182 -10.627 1.00 21.78 C ATOM 742 CD2 PHE A 83 20.964 2.225 -8.881 1.00 20.87 C ATOM 743 CE1 PHE A 83 19.471 3.541 -10.808 1.00 22.53 C ATOM 744 CE2 PHE A 83 21.134 3.575 -9.052 1.00 20.80 C ATOM 745 CZ PHE A 83 20.384 4.242 -10.019 1.00 22.76 C ATOM 746 H PHE A 83 19.654 -0.845 -12.200 1.00 0.00 H ATOM 747 N GLU A 84 21.382 -2.718 -9.020 1.00 24.97 N ATOM 748 CA GLU A 84 21.169 -3.985 -8.310 1.00 27.54 C ATOM 749 C GLU A 84 20.297 -3.695 -7.093 1.00 23.87 C ATOM 750 O GLU A 84 20.174 -2.555 -6.686 1.00 22.56 O ATOM 751 CB GLU A 84 22.480 -4.596 -7.780 1.00 30.95 C ATOM 752 CG GLU A 84 23.663 -4.628 -8.721 1.00 37.26 C ATOM 753 CD GLU A 84 23.555 -5.745 -9.728 1.00 42.42 C ATOM 754 OE1 GLU A 84 24.537 -6.512 -9.895 1.00 45.48 O ATOM 755 OE2 GLU A 84 22.481 -5.847 -10.358 1.00 49.20 O ATOM 756 H GLU A 84 22.183 -2.122 -8.730 1.00 0.00 H ATOM 757 N VAL A 85 19.764 -4.753 -6.492 1.00 21.51 N ATOM 758 CA VAL A 85 19.002 -4.661 -5.256 1.00 21.64 C ATOM 759 C VAL A 85 19.860 -5.046 -4.033 1.00 21.97 C ATOM 760 O VAL A 85 20.218 -6.209 -3.831 1.00 23.39 O ATOM 761 CB VAL A 85 17.734 -5.537 -5.352 1.00 20.98 C ATOM 762 CG1 VAL A 85 16.918 -5.508 -4.065 1.00 20.86 C ATOM 763 CG2 VAL A 85 16.897 -5.058 -6.517 1.00 21.84 C ATOM 764 H VAL A 85 19.897 -5.689 -6.925 1.00 0.00 H ATOM 765 N GLU A 86 20.174 -4.049 -3.233 1.00 22.79 N ATOM 766 CA GLU A 86 20.997 -4.199 -2.038 1.00 24.85 C ATOM 767 C GLU A 86 20.184 -4.829 -0.922 1.00 23.70 C ATOM 768 O GLU A 86 20.695 -5.641 -0.179 1.00 22.45 O ATOM 769 CB GLU A 86 21.521 -2.832 -1.585 1.00 26.89 C ATOM 770 CG GLU A 86 22.357 -2.893 -0.312 1.00 30.57 C ATOM 771 CD GLU A 86 22.928 -1.548 0.114 1.00 32.50 C ATOM 772 OE1 GLU A 86 22.928 -0.590 -0.694 1.00 33.88 O ATOM 773 OE2 GLU A 86 23.399 -1.458 1.270 1.00 35.01 O ATOM 774 H GLU A 86 19.815 -3.101 -3.466 1.00 0.00 H ATOM 775 N ASN A 87 18.908 -4.458 -0.850 1.00 24.56 N ATOM 776 CA ASN A 87 17.950 -4.989 0.113 1.00 24.65 C ATOM 777 C ASN A 87 16.572 -5.142 -0.543 1.00 23.67 C ATOM 778 O ASN A 87 16.092 -4.218 -1.202 1.00 24.15 O ATOM 779 CB ASN A 87 17.863 -4.015 1.290 1.00 27.63 C ATOM 780 CG ASN A 87 17.388 -4.667 2.573 1.00 32.10 C ATOM 781 OD1 ASN A 87 16.981 -5.835 2.597 1.00 35.61 O ATOM 782 ND2 ASN A 87 17.434 -3.903 3.667 1.00 34.55 N ATOM 783 HD22 ASN A 87 17.783 -2.925 3.604 1.00 0.00 H ATOM 784 HD21 ASN A 87 17.121 -4.286 4.582 1.00 0.00 H ATOM 785 H ASN A 87 18.572 -3.742 -1.525 1.00 0.00 H ATOM 786 N LEU A 88 15.957 -6.311 -0.376 1.00 22.42 N ATOM 787 CA LEU A 88 14.599 -6.588 -0.799 1.00 21.64 C ATOM 788 C LEU A 88 13.728 -6.864 0.426 1.00 21.82 C ATOM 789 O LEU A 88 13.903 -7.883 1.084 1.00 22.72 O ATOM 790 CB LEU A 88 14.573 -7.796 -1.726 1.00 20.55 C ATOM 791 CG LEU A 88 13.189 -8.278 -2.160 1.00 20.16 C ATOM 792 CD1 LEU A 88 12.412 -7.203 -2.903 1.00 20.04 C ATOM 793 CD2 LEU A 88 13.294 -9.543 -3.010 1.00 20.34 C ATOM 794 H LEU A 88 16.486 -7.076 0.089 1.00 0.00 H ATOM 795 N ILE A 89 12.792 -5.963 0.715 1.00 21.43 N ATOM 796 CA ILE A 89 11.987 -6.036 1.940 1.00 22.41 C ATOM 797 C ILE A 89 10.524 -6.240 1.571 1.00 22.02 C ATOM 798 O ILE A 89 9.896 -5.366 0.934 1.00 20.61 O ATOM 799 CB ILE A 89 12.111 -4.761 2.819 1.00 23.41 C ATOM 800 CG1 ILE A 89 13.569 -4.483 3.170 1.00 25.08 C ATOM 801 CG2 ILE A 89 11.317 -4.919 4.108 1.00 23.87 C ATOM 802 CD1 ILE A 89 13.818 -3.094 3.730 1.00 25.66 C ATOM 803 H ILE A 89 12.625 -5.181 0.050 1.00 0.00 H ATOM 804 N LEU A 90 10.006 -7.405 1.959 1.00 21.19 N ATOM 805 CA LEU A 90 8.634 -7.800 1.670 1.00 20.80 C ATOM 806 C LEU A 90 7.833 -7.615 2.945 1.00 21.13 C ATOM 807 O LEU A 90 8.385 -7.763 4.013 1.00 22.15 O ATOM 808 CB LEU A 90 8.602 -9.262 1.214 1.00 20.26 C ATOM 809 CG LEU A 90 9.504 -9.601 0.035 1.00 20.57 C ATOM 810 CD1 LEU A 90 9.256 -11.036 -0.381 1.00 20.28 C ATOM 811 CD2 LEU A 90 9.306 -8.656 -1.152 1.00 19.94 C ATOM 812 H LEU A 90 10.609 -8.063 2.493 1.00 0.00 H ATOM 813 N HIS A 91 6.557 -7.258 2.842 1.00 23.12 N ATOM 814 CA HIS A 91 5.710 -7.090 4.035 1.00 25.01 C ATOM 815 C HIS A 91 5.441 -8.472 4.637 1.00 26.93 C ATOM 816 O HIS A 91 5.037 -9.392 3.923 1.00 26.73 O ATOM 817 CB HIS A 91 4.391 -6.383 3.714 1.00 24.65 C ATOM 818 CG HIS A 91 3.745 -5.745 4.912 1.00 25.67 C ATOM 819 ND1 HIS A 91 3.179 -6.477 5.933 1.00 25.21 N ATOM 820 CD2 HIS A 91 3.595 -4.445 5.261 1.00 25.29 C ATOM 821 CE1 HIS A 91 2.707 -5.660 6.856 1.00 24.96 C ATOM 822 NE2 HIS A 91 2.950 -4.420 6.475 1.00 25.25 N ATOM 823 H HIS A 91 6.148 -7.094 1.900 1.00 0.00 H ATOM 824 N LYS A 92 5.669 -8.608 5.943 1.00 30.14 N ATOM 825 CA LYS A 92 5.588 -9.924 6.622 1.00 33.42 C ATOM 826 C LYS A 92 4.175 -10.517 6.748 1.00 31.80 C ATOM 827 O LYS A 92 4.009 -11.739 6.858 1.00 33.73 O ATOM 828 CB LYS A 92 6.286 -9.895 7.995 1.00 37.19 C ATOM 829 CG LYS A 92 5.633 -9.009 9.049 1.00 42.72 C ATOM 830 CD LYS A 92 6.323 -9.166 10.408 1.00 45.15 C ATOM 831 CE LYS A 92 5.466 -8.648 11.555 1.00 46.22 C ATOM 832 NZ LYS A 92 5.056 -7.229 11.360 1.00 47.38 N ATOM 833 HZ1 LYS A 92 5.904 -6.630 11.295 1.00 0.00 H ATOM 834 HZ2 LYS A 92 4.504 -7.146 10.482 1.00 0.00 H ATOM 835 HZ3 LYS A 92 4.475 -6.923 12.167 1.00 0.00 H ATOM 836 H LYS A 92 5.911 -7.766 6.503 1.00 0.00 H ATOM 837 N ASP A 93 3.156 -9.675 6.706 1.00 29.59 N ATOM 838 CA ASP A 93 1.786 -10.168 6.759 1.00 29.35 C ATOM 839 C ASP A 93 1.130 -10.205 5.375 1.00 27.50 C ATOM 840 O ASP A 93 -0.086 -10.173 5.276 1.00 27.78 O ATOM 841 CB ASP A 93 0.942 -9.310 7.710 1.00 32.32 C ATOM 842 CG ASP A 93 1.561 -9.176 9.109 1.00 33.95 C ATOM 843 OD1 ASP A 93 1.857 -10.211 9.725 1.00 33.67 O ATOM 844 OD2 ASP A 93 1.727 -8.027 9.591 1.00 37.77 O ATOM 845 H ASP A 93 3.334 -8.653 6.635 1.00 0.00 H ATOM 846 N TYR A 94 1.923 -10.247 4.309 1.00 26.74 N ATOM 847 CA TYR A 94 1.367 -10.364 2.962 1.00 24.38 C ATOM 848 C TYR A 94 0.583 -11.655 2.869 1.00 25.07 C ATOM 849 O TYR A 94 1.041 -12.699 3.331 1.00 27.53 O ATOM 850 CB TYR A 94 2.468 -10.359 1.889 1.00 22.87 C ATOM 851 CG TYR A 94 1.995 -10.813 0.509 1.00 21.78 C ATOM 852 CD1 TYR A 94 1.330 -9.933 -0.348 1.00 20.86 C ATOM 853 CD2 TYR A 94 2.178 -12.122 0.078 1.00 20.83 C ATOM 854 CE1 TYR A 94 0.893 -10.339 -1.590 1.00 20.22 C ATOM 855 CE2 TYR A 94 1.722 -12.535 -1.170 1.00 20.73 C ATOM 856 CZ TYR A 94 1.088 -11.626 -1.998 1.00 20.05 C ATOM 857 OH TYR A 94 0.633 -12.013 -3.234 1.00 20.66 O ATOM 858 HH TYR A 94 -0.031 -12.739 -3.127 1.00 0.00 H ATOM 859 H TYR A 94 2.954 -10.196 4.435 1.00 0.00 H ATOM 860 N SER A 95 -0.606 -11.586 2.287 1.00 24.43 N ATOM 861 CA SER A 95 -1.282 -12.797 1.819 1.00 24.34 C ATOM 862 C SER A 95 -2.084 -12.518 0.540 1.00 23.83 C ATOM 863 O SER A 95 -2.307 -11.374 0.159 1.00 21.55 O ATOM 864 CB SER A 95 -2.166 -13.407 2.906 1.00 23.23 C ATOM 865 OG SER A 95 -3.180 -12.507 3.282 1.00 24.75 O ATOM 866 HG SER A 95 -3.741 -12.919 3.986 1.00 0.00 H ATOM 867 H SER A 95 -1.064 -10.661 2.161 1.00 0.00 H ATOM 868 N ALA A 96 -2.481 -13.592 -0.122 1.00 24.30 N ATOM 869 CA ALA A 96 -3.260 -13.505 -1.326 1.00 25.48 C ATOM 870 C ALA A 96 -4.459 -14.436 -1.198 1.00 27.16 C ATOM 871 O ALA A 96 -4.329 -15.608 -0.796 1.00 26.32 O ATOM 872 CB ALA A 96 -2.417 -13.888 -2.516 1.00 25.23 C ATOM 873 H ALA A 96 -2.220 -14.531 0.241 1.00 0.00 H ATOM 874 N ASP A 97 -5.623 -13.889 -1.529 1.00 25.89 N ATOM 875 CA ASP A 97 -6.856 -14.638 -1.580 1.00 25.81 C ATOM 876 C ASP A 97 -7.133 -14.953 -3.048 1.00 26.03 C ATOM 877 O ASP A 97 -6.240 -14.839 -3.881 1.00 25.91 O ATOM 878 CB ASP A 97 -7.975 -13.823 -0.926 1.00 25.43 C ATOM 879 CG ASP A 97 -7.971 -13.950 0.586 1.00 26.84 C ATOM 880 OD1 ASP A 97 -8.522 -14.957 1.125 1.00 27.70 O ATOM 881 OD2 ASP A 97 -7.420 -13.038 1.238 1.00 26.40 O ATOM 882 H ASP A 97 -5.647 -12.876 -1.762 1.00 0.00 H ATOM 883 N THR A 97A -8.349 -15.362 -3.363 1.00 25.68 N ATOM 884 CA THR A 97A -8.704 -15.682 -4.736 1.00 28.31 C ATOM 885 C THR A 97A -8.437 -14.509 -5.693 1.00 26.52 C ATOM 886 O THR A 97A -7.925 -14.710 -6.786 1.00 25.89 O ATOM 887 CB THR A 97A -10.165 -16.159 -4.842 1.00 29.71 C ATOM 888 OG1 THR A 97A -10.435 -16.519 -6.200 1.00 33.67 O ATOM 889 CG2 THR A 97A -11.181 -15.073 -4.384 1.00 31.41 C ATOM 890 HG1 THR A 97A -10.296 -15.731 -6.783 1.00 0.00 H ATOM 891 H THR A 97A -9.065 -15.457 -2.615 1.00 0.00 H ATOM 892 N LEU A 97B -8.765 -13.294 -5.247 1.00 25.11 N ATOM 893 CA LEU A 97B -8.524 -12.065 -6.007 1.00 24.34 C ATOM 894 C LEU A 97B -7.654 -11.089 -5.230 1.00 23.46 C ATOM 895 O LEU A 97B -6.645 -10.599 -5.748 1.00 21.56 O ATOM 896 CB LEU A 97B -9.843 -11.371 -6.324 1.00 24.79 C ATOM 897 CG LEU A 97B -10.780 -12.075 -7.300 1.00 24.73 C ATOM 898 CD1 LEU A 97B -12.023 -11.214 -7.483 1.00 25.46 C ATOM 899 CD2 LEU A 97B -10.117 -12.306 -8.633 1.00 25.04 C ATOM 900 H LEU A 97B -9.215 -13.216 -4.312 1.00 0.00 H ATOM 901 N ALA A 98 -8.037 -10.851 -3.973 1.00 21.33 N ATOM 902 CA ALA A 98 -7.440 -9.815 -3.176 1.00 20.17 C ATOM 903 C ALA A 98 -6.061 -10.177 -2.653 1.00 20.22 C ATOM 904 O ALA A 98 -5.803 -11.317 -2.289 1.00 20.25 O ATOM 905 CB ALA A 98 -8.357 -9.435 -2.035 1.00 20.18 C ATOM 906 H ALA A 98 -8.791 -11.434 -3.558 1.00 0.00 H ATOM 907 N HIS A 99 -5.188 -9.172 -2.618 1.00 19.66 N ATOM 908 CA HIS A 99 -3.845 -9.303 -2.113 1.00 19.55 C ATOM 909 C HIS A 99 -3.726 -8.344 -0.967 1.00 19.04 C ATOM 910 O HIS A 99 -4.184 -7.207 -1.059 1.00 22.05 O ATOM 911 CB HIS A 99 -2.848 -8.972 -3.214 1.00 20.05 C ATOM 912 CG HIS A 99 -2.755 -10.028 -4.259 1.00 20.27 C ATOM 913 ND1 HIS A 99 -1.614 -10.774 -4.466 1.00 21.92 N ATOM 914 CD2 HIS A 99 -3.678 -10.502 -5.124 1.00 19.98 C ATOM 915 CE1 HIS A 99 -1.834 -11.650 -5.431 1.00 20.80 C ATOM 916 NE2 HIS A 99 -3.081 -11.506 -5.843 1.00 20.87 N ATOM 917 H HIS A 99 -5.492 -8.243 -2.974 1.00 0.00 H ATOM 918 N HIS A 100 -3.149 -8.806 0.125 1.00 18.01 N ATOM 919 CA HIS A 100 -3.129 -8.054 1.375 1.00 17.98 C ATOM 920 C HIS A 100 -1.718 -7.643 1.756 1.00 18.21 C ATOM 921 O HIS A 100 -0.785 -8.452 1.660 1.00 18.05 O ATOM 922 CB HIS A 100 -3.710 -8.902 2.518 1.00 17.60 C ATOM 923 CG HIS A 100 -5.042 -9.477 2.197 1.00 17.11 C ATOM 924 ND1 HIS A 100 -6.195 -8.722 2.209 1.00 17.37 N ATOM 925 CD2 HIS A 100 -5.403 -10.713 1.808 1.00 16.71 C ATOM 926 CE1 HIS A 100 -7.213 -9.475 1.848 1.00 17.26 C ATOM 927 NE2 HIS A 100 -6.760 -10.691 1.611 1.00 17.63 N ATOM 928 H HIS A 100 -2.692 -9.740 0.094 1.00 0.00 H ATOM 929 N ASN A 101 -1.597 -6.415 2.258 1.00 18.08 N ATOM 930 CA ASN A 101 -0.308 -5.831 2.585 1.00 18.88 C ATOM 931 C ASN A 101 0.660 -5.941 1.402 1.00 18.83 C ATOM 932 O ASN A 101 1.828 -6.264 1.573 1.00 19.61 O ATOM 933 CB ASN A 101 0.264 -6.497 3.832 1.00 19.64 C ATOM 934 CG ASN A 101 -0.652 -6.351 5.039 1.00 19.73 C ATOM 935 OD1 ASN A 101 -0.909 -5.242 5.484 1.00 20.27 O ATOM 936 ND2 ASN A 101 -1.164 -7.463 5.549 1.00 19.55 N ATOM 937 HD22 ASN A 101 -0.917 -8.386 5.138 1.00 0.00 H ATOM 938 HD21 ASN A 101 -1.813 -7.412 6.360 1.00 0.00 H ATOM 939 H ASN A 101 -2.457 -5.854 2.422 1.00 0.00 H ATOM 940 N ASP A 102 0.154 -5.647 0.206 1.00 18.18 N ATOM 941 CA ASP A 102 0.906 -5.840 -1.038 1.00 17.11 C ATOM 942 C ASP A 102 1.811 -4.632 -1.289 1.00 17.35 C ATOM 943 O ASP A 102 1.544 -3.744 -2.109 1.00 17.11 O ATOM 944 CB ASP A 102 -0.063 -6.057 -2.193 1.00 16.31 C ATOM 945 CG ASP A 102 0.567 -6.754 -3.367 1.00 15.90 C ATOM 946 OD1 ASP A 102 1.744 -7.193 -3.264 1.00 15.51 O ATOM 947 OD2 ASP A 102 -0.134 -6.863 -4.406 1.00 15.28 O ATOM 948 H ASP A 102 -0.812 -5.266 0.152 1.00 0.00 H ATOM 949 N ILE A 103 2.920 -4.625 -0.582 1.00 17.34 N ATOM 950 CA ILE A 103 3.793 -3.494 -0.593 1.00 17.27 C ATOM 951 C ILE A 103 5.177 -4.045 -0.338 1.00 17.74 C ATOM 952 O ILE A 103 5.328 -5.026 0.413 1.00 18.49 O ATOM 953 CB ILE A 103 3.324 -2.425 0.420 1.00 18.03 C ATOM 954 CG1 ILE A 103 4.150 -1.145 0.266 1.00 18.31 C ATOM 955 CG2 ILE A 103 3.328 -2.954 1.865 1.00 18.18 C ATOM 956 CD1 ILE A 103 3.610 -0.012 1.095 1.00 18.05 C ATOM 957 H ILE A 103 3.165 -5.456 -0.006 1.00 0.00 H ATOM 958 N ALA A 104 6.166 -3.471 -1.025 1.00 17.91 N ATOM 959 CA ALA A 104 7.558 -3.897 -0.931 1.00 17.40 C ATOM 960 C ALA A 104 8.504 -2.737 -1.159 1.00 17.85 C ATOM 961 O ALA A 104 8.156 -1.780 -1.829 1.00 18.18 O ATOM 962 CB ALA A 104 7.848 -5.003 -1.931 1.00 17.61 C ATOM 963 H ALA A 104 5.933 -2.680 -1.659 1.00 0.00 H ATOM 964 N LEU A 105 9.702 -2.846 -0.595 1.00 18.87 N ATOM 965 CA LEU A 105 10.750 -1.829 -0.707 1.00 18.96 C ATOM 966 C LEU A 105 12.003 -2.469 -1.238 1.00 19.10 C ATOM 967 O LEU A 105 12.369 -3.545 -0.803 1.00 19.22 O ATOM 968 CB LEU A 105 11.085 -1.243 0.659 1.00 19.55 C ATOM 969 CG LEU A 105 10.126 -0.234 1.243 1.00 19.46 C ATOM 970 CD1 LEU A 105 10.381 -0.151 2.751 1.00 19.76 C ATOM 971 CD2 LEU A 105 10.280 1.116 0.560 1.00 18.73 C ATOM 972 H LEU A 105 9.907 -3.703 -0.042 1.00 0.00 H ATOM 973 N LEU A 106 12.636 -1.803 -2.201 1.00 20.75 N ATOM 974 CA LEU A 106 13.858 -2.281 -2.851 1.00 20.95 C ATOM 975 C LEU A 106 14.914 -1.220 -2.661 1.00 21.56 C ATOM 976 O LEU A 106 14.798 -0.106 -3.192 1.00 21.73 O ATOM 977 CB LEU A 106 13.652 -2.511 -4.348 1.00 20.97 C ATOM 978 CG LEU A 106 12.988 -3.826 -4.774 1.00 21.50 C ATOM 979 CD1 LEU A 106 11.505 -3.797 -4.491 1.00 22.16 C ATOM 980 CD2 LEU A 106 13.210 -4.078 -6.252 1.00 21.86 C ATOM 981 H LEU A 106 12.240 -0.892 -2.509 1.00 0.00 H ATOM 982 N LYS A 107 15.938 -1.539 -1.884 1.00 22.60 N ATOM 983 CA LYS A 107 17.038 -0.595 -1.728 1.00 23.03 C ATOM 984 C LYS A 107 17.945 -0.829 -2.898 1.00 21.60 C ATOM 985 O LYS A 107 18.387 -1.958 -3.119 1.00 21.12 O ATOM 986 CB LYS A 107 17.799 -0.803 -0.428 1.00 23.78 C ATOM 987 CG LYS A 107 18.841 0.265 -0.223 1.00 24.82 C ATOM 988 CD LYS A 107 19.502 0.142 1.136 1.00 27.57 C ATOM 989 CE LYS A 107 20.397 1.352 1.377 1.00 29.45 C ATOM 990 NZ LYS A 107 20.928 1.303 2.762 1.00 32.39 N ATOM 991 HZ1 LYS A 107 20.136 1.316 3.436 1.00 0.00 H ATOM 992 HZ2 LYS A 107 21.480 0.431 2.890 1.00 0.00 H ATOM 993 HZ3 LYS A 107 21.539 2.128 2.927 1.00 0.00 H ATOM 994 H LYS A 107 15.957 -2.454 -1.390 1.00 0.00 H ATOM 995 N ILE A 108 18.233 0.221 -3.653 1.00 21.36 N ATOM 996 CA ILE A 108 18.993 0.043 -4.904 1.00 21.58 C ATOM 997 C ILE A 108 20.416 0.595 -4.840 1.00 23.31 C ATOM 998 O ILE A 108 20.678 1.622 -4.186 1.00 21.18 O ATOM 999 CB ILE A 108 18.261 0.664 -6.100 1.00 20.18 C ATOM 1000 CG1 ILE A 108 17.893 2.135 -5.833 1.00 19.98 C ATOM 1001 CG2 ILE A 108 17.027 -0.161 -6.424 1.00 19.96 C ATOM 1002 CD1 ILE A 108 17.530 2.881 -7.102 1.00 20.88 C ATOM 1003 H ILE A 108 17.923 1.171 -3.363 1.00 0.00 H ATOM 1004 N ARG A 109 21.326 -0.072 -5.545 1.00 24.81 N ATOM 1005 CA ARG A 109 22.663 0.487 -5.754 1.00 26.92 C ATOM 1006 C ARG A 109 23.255 0.070 -7.089 1.00 25.11 C ATOM 1007 O ARG A 109 23.053 -1.033 -7.563 1.00 24.95 O ATOM 1008 CB ARG A 109 23.606 0.112 -4.615 1.00 29.12 C ATOM 1009 CG ARG A 109 23.972 -1.349 -4.602 1.00 32.39 C ATOM 1010 CD ARG A 109 24.853 -1.696 -3.419 1.00 36.07 C ATOM 1011 NE ARG A 109 24.844 -3.142 -3.177 1.00 40.73 N ATOM 1012 CZ ARG A 109 25.452 -3.742 -2.155 1.00 43.38 C ATOM 1013 NH1 ARG A 109 26.151 -3.020 -1.269 1.00 41.93 N ATOM 1014 NH2 ARG A 109 25.360 -5.069 -2.024 1.00 43.14 N ATOM 1015 HE ARG A 109 24.326 -3.742 -3.851 1.00 0.00 H ATOM 1016 HH12 ARG A 109 26.625 -3.491 -0.472 1.00 0.00 H ATOM 1017 HH11 ARG A 109 26.220 -1.988 -1.378 1.00 0.00 H ATOM 1018 HH22 ARG A 109 25.831 -5.547 -1.230 1.00 0.00 H ATOM 1019 HH21 ARG A 109 24.817 -5.624 -2.717 1.00 0.00 H ATOM 1020 H ARG A 109 21.086 -0.999 -5.951 1.00 0.00 H ATOM 1021 N SER A 110 23.987 0.981 -7.699 1.00 25.24 N ATOM 1022 CA SER A 110 24.728 0.653 -8.904 1.00 25.81 C ATOM 1023 C SER A 110 25.871 -0.260 -8.516 1.00 25.59 C ATOM 1024 O SER A 110 26.101 -0.512 -7.332 1.00 25.11 O ATOM 1025 CB SER A 110 25.280 1.918 -9.553 1.00 24.48 C ATOM 1026 OG SER A 110 26.125 2.598 -8.648 1.00 24.75 O ATOM 1027 HG SER A 110 25.610 2.845 -7.839 1.00 0.00 H ATOM 1028 H SER A 110 24.034 1.946 -7.313 1.00 0.00 H ATOM 1029 N LYS A 110A 26.588 -0.747 -9.516 1.00 27.36 N ATOM 1030 CA LYS A 110A 27.813 -1.516 -9.293 1.00 29.90 C ATOM 1031 C LYS A 110A 28.934 -0.719 -8.603 1.00 30.80 C ATOM 1032 O LYS A 110A 29.828 -1.300 -7.987 1.00 32.74 O ATOM 1033 CB LYS A 110A 28.291 -2.101 -10.613 1.00 31.27 C ATOM 1034 CG LYS A 110A 27.390 -3.252 -11.029 1.00 33.03 C ATOM 1035 CD LYS A 110A 27.752 -3.843 -12.361 1.00 34.56 C ATOM 1036 CE LYS A 110A 26.911 -5.075 -12.600 1.00 36.63 C ATOM 1037 NZ LYS A 110A 27.197 -5.685 -13.927 1.00 39.34 N ATOM 1038 HZ1 LYS A 110A 26.989 -4.995 -14.677 1.00 0.00 H ATOM 1039 HZ2 LYS A 110A 28.200 -5.957 -13.973 1.00 0.00 H ATOM 1040 HZ3 LYS A 110A 26.601 -6.528 -14.055 1.00 0.00 H ATOM 1041 H LYS A 110A 26.271 -0.578 -10.492 1.00 0.00 H ATOM 1042 N GLU A 110B 28.851 0.605 -8.652 1.00 30.07 N ATOM 1043 CA GLU A 110B 29.792 1.447 -7.929 1.00 29.66 C ATOM 1044 C GLU A 110B 29.347 1.709 -6.492 1.00 29.72 C ATOM 1045 O GLU A 110B 30.059 2.348 -5.726 1.00 29.15 O ATOM 1046 CB GLU A 110B 29.993 2.756 -8.673 1.00 29.13 C ATOM 1047 CG GLU A 110B 30.764 2.585 -9.969 1.00 30.37 C ATOM 1048 CD GLU A 110B 30.014 1.799 -11.021 1.00 31.24 C ATOM 1049 OE1 GLU A 110B 28.813 2.087 -11.212 1.00 33.10 O ATOM 1050 OE2 GLU A 110B 30.617 0.883 -11.641 1.00 30.08 O ATOM 1051 H GLU A 110B 28.099 1.049 -9.218 1.00 0.00 H ATOM 1052 N GLY A 110C 28.185 1.188 -6.115 1.00 30.64 N ATOM 1053 CA GLY A 110C 27.626 1.441 -4.786 1.00 29.38 C ATOM 1054 C GLY A 110C 26.799 2.715 -4.716 1.00 30.73 C ATOM 1055 O GLY A 110C 26.421 3.131 -3.633 1.00 29.36 O ATOM 1056 H GLY A 110C 27.659 0.586 -6.780 1.00 0.00 H ATOM 1057 N ARG A 110D 26.491 3.333 -5.862 1.00 32.52 N ATOM 1058 CA ARG A 110D 25.758 4.600 -5.850 1.00 34.04 C ATOM 1059 C ARG A 110D 24.233 4.428 -5.910 1.00 31.42 C ATOM 1060 O ARG A 110D 23.709 3.467 -6.453 1.00 27.52 O ATOM 1061 CB ARG A 110D 26.266 5.541 -6.956 1.00 38.72 C ATOM 1062 CG ARG A 110D 27.567 6.253 -6.577 1.00 41.82 C ATOM 1063 CD ARG A 110D 27.954 7.340 -7.570 1.00 46.81 C ATOM 1064 NE ARG A 110D 28.479 6.816 -8.847 1.00 50.99 N ATOM 1065 CZ ARG A 110D 29.759 6.509 -9.105 1.00 50.00 C ATOM 1066 NH1 ARG A 110D 30.713 6.639 -8.186 1.00 50.10 N ATOM 1067 NH2 ARG A 110D 30.090 6.053 -10.304 1.00 51.36 N ATOM 1068 HE ARG A 110D 27.794 6.672 -9.616 1.00 0.00 H ATOM 1069 HH12 ARG A 110D 31.696 6.392 -8.419 1.00 0.00 H ATOM 1070 HH11 ARG A 110D 30.475 6.987 -7.235 1.00 0.00 H ATOM 1071 HH22 ARG A 110D 31.080 5.812 -10.514 1.00 0.00 H ATOM 1072 HH21 ARG A 110D 29.360 5.936 -11.036 1.00 0.00 H ATOM 1073 H ARG A 110D 26.775 2.910 -6.769 1.00 0.00 H ATOM 1074 N CYS A 111 23.546 5.374 -5.288 1.00 30.90 N ATOM 1075 CA CYS A 111 22.109 5.475 -5.333 1.00 28.38 C ATOM 1076 C CYS A 111 21.751 6.331 -6.533 1.00 28.17 C ATOM 1077 O CYS A 111 22.652 6.760 -7.271 1.00 26.91 O ATOM 1078 CB CYS A 111 21.598 6.077 -4.027 1.00 28.54 C ATOM 1079 SG CYS A 111 21.723 4.875 -2.679 1.00 28.42 S ATOM 1080 H CYS A 111 24.072 6.082 -4.737 1.00 0.00 H ATOM 1081 N ALA A 112 20.449 6.548 -6.750 1.00 26.66 N ATOM 1082 CA ALA A 112 19.983 7.353 -7.871 1.00 26.74 C ATOM 1083 C ALA A 112 20.505 8.768 -7.795 1.00 27.68 C ATOM 1084 O ALA A 112 20.548 9.367 -6.718 1.00 24.36 O ATOM 1085 CB ALA A 112 18.461 7.382 -7.945 1.00 27.01 C ATOM 1086 H ALA A 112 19.751 6.131 -6.101 1.00 0.00 H ATOM 1087 N GLN A 113 20.866 9.288 -8.970 1.00 30.46 N ATOM 1088 CA GLN A 113 21.207 10.697 -9.170 1.00 32.77 C ATOM 1089 C GLN A 113 20.066 11.410 -9.942 1.00 29.84 C ATOM 1090 O GLN A 113 19.808 11.097 -11.098 1.00 28.27 O ATOM 1091 CB GLN A 113 22.520 10.797 -9.958 1.00 35.47 C ATOM 1092 CG GLN A 113 22.976 12.223 -10.254 1.00 43.10 C ATOM 1093 CD GLN A 113 24.145 12.674 -9.386 1.00 50.64 C ATOM 1094 OE1 GLN A 113 25.127 11.942 -9.209 1.00 54.12 O ATOM 1095 NE2 GLN A 113 24.057 13.889 -8.858 1.00 54.71 N ATOM 1096 HE22 GLN A 113 23.213 14.472 -9.032 1.00 0.00 H ATOM 1097 HE21 GLN A 113 24.832 14.258 -8.270 1.00 0.00 H ATOM 1098 H GLN A 113 20.907 8.654 -9.793 1.00 0.00 H ATOM 1099 N PRO A 114 19.405 12.401 -9.319 1.00 28.79 N ATOM 1100 CA PRO A 114 18.327 13.079 -10.038 1.00 27.99 C ATOM 1101 C PRO A 114 18.778 13.772 -11.334 1.00 27.72 C ATOM 1102 O PRO A 114 19.898 14.246 -11.430 1.00 26.65 O ATOM 1103 CB PRO A 114 17.821 14.123 -9.041 1.00 26.86 C ATOM 1104 CG PRO A 114 18.310 13.649 -7.722 1.00 29.03 C ATOM 1105 CD PRO A 114 19.626 12.990 -7.991 1.00 28.63 C ATOM 1106 N SER A 115 17.881 13.794 -12.306 1.00 26.60 N ATOM 1107 CA SER A 115 18.113 14.372 -13.616 1.00 26.97 C ATOM 1108 C SER A 115 16.731 14.695 -14.169 1.00 28.53 C ATOM 1109 O SER A 115 15.728 14.627 -13.442 1.00 29.85 O ATOM 1110 CB SER A 115 18.851 13.383 -14.531 1.00 26.75 C ATOM 1111 OG SER A 115 18.043 12.270 -14.931 1.00 25.46 O ATOM 1112 HG SER A 115 18.573 11.672 -15.516 1.00 0.00 H ATOM 1113 H SER A 115 16.950 13.370 -12.119 1.00 0.00 H ATOM 1114 N ARG A 116 16.673 15.034 -15.447 1.00 29.14 N ATOM 1115 CA ARG A 116 15.418 15.365 -16.092 1.00 29.20 C ATOM 1116 C ARG A 116 14.535 14.133 -16.210 1.00 27.52 C ATOM 1117 O ARG A 116 13.312 14.242 -16.165 1.00 27.14 O ATOM 1118 CB ARG A 116 15.693 15.949 -17.478 1.00 33.48 C ATOM 1119 CG ARG A 116 14.563 16.814 -18.026 1.00 37.03 C ATOM 1120 CD ARG A 116 15.035 17.591 -19.250 1.00 38.68 C ATOM 1121 NE ARG A 116 15.682 16.691 -20.200 1.00 39.73 N ATOM 1122 CZ ARG A 116 15.034 15.862 -21.021 1.00 41.74 C ATOM 1123 NH1 ARG A 116 13.702 15.808 -21.039 1.00 42.72 N ATOM 1124 NH2 ARG A 116 15.722 15.081 -21.845 1.00 43.54 N ATOM 1125 HE ARG A 116 16.721 16.696 -20.240 1.00 0.00 H ATOM 1126 HH12 ARG A 116 13.217 15.155 -21.687 1.00 0.00 H ATOM 1127 HH11 ARG A 116 13.148 16.419 -20.405 1.00 0.00 H ATOM 1128 HH22 ARG A 116 15.222 14.433 -22.487 1.00 0.00 H ATOM 1129 HH21 ARG A 116 16.761 15.117 -21.849 1.00 0.00 H ATOM 1130 H ARG A 116 17.551 15.064 -16.003 1.00 0.00 H ATOM 1131 N THR A 117 15.164 12.964 -16.326 1.00 25.43 N ATOM 1132 CA THR A 117 14.449 11.695 -16.494 1.00 24.09 C ATOM 1133 C THR A 117 14.371 10.812 -15.237 1.00 23.72 C ATOM 1134 O THR A 117 13.813 9.721 -15.292 1.00 25.06 O ATOM 1135 CB THR A 117 15.121 10.872 -17.600 1.00 23.77 C ATOM 1136 OG1 THR A 117 16.515 10.727 -17.305 1.00 23.31 O ATOM 1137 CG2 THR A 117 14.958 11.574 -18.952 1.00 23.43 C ATOM 1138 HG1 THR A 117 16.949 10.196 -18.019 1.00 0.00 H ATOM 1139 H THR A 117 16.203 12.951 -16.296 1.00 0.00 H ATOM 1140 N ILE A 118 14.922 11.276 -14.116 1.00 22.72 N ATOM 1141 CA ILE A 118 14.945 10.503 -12.878 1.00 21.91 C ATOM 1142 C ILE A 118 14.729 11.417 -11.689 1.00 22.26 C ATOM 1143 O ILE A 118 15.587 12.255 -11.378 1.00 23.05 O ATOM 1144 CB ILE A 118 16.286 9.753 -12.649 1.00 21.75 C ATOM 1145 CG1 ILE A 118 16.599 8.791 -13.802 1.00 20.45 C ATOM 1146 CG2 ILE A 118 16.217 8.976 -11.322 1.00 21.19 C ATOM 1147 CD1 ILE A 118 17.979 8.152 -13.733 1.00 19.81 C ATOM 1148 H ILE A 118 15.351 12.223 -14.123 1.00 0.00 H ATOM 1149 N GLN A 119 13.585 11.250 -11.031 1.00 22.41 N ATOM 1150 CA GLN A 119 13.179 12.081 -9.892 1.00 22.35 C ATOM 1151 C GLN A 119 12.420 11.213 -8.891 1.00 20.15 C ATOM 1152 O GLN A 119 11.831 10.223 -9.283 1.00 18.95 O ATOM 1153 CB GLN A 119 12.255 13.208 -10.360 1.00 23.81 C ATOM 1154 CG GLN A 119 12.884 14.249 -11.255 1.00 25.49 C ATOM 1155 CD GLN A 119 13.727 15.238 -10.474 1.00 29.33 C ATOM 1156 OE1 GLN A 119 13.343 15.667 -9.367 1.00 33.15 O ATOM 1157 NE2 GLN A 119 14.882 15.618 -11.036 1.00 29.37 N ATOM 1158 HE22 GLN A 119 15.161 15.234 -11.961 1.00 0.00 H ATOM 1159 HE21 GLN A 119 15.499 16.297 -10.547 1.00 0.00 H ATOM 1160 H GLN A 119 12.945 10.491 -11.340 1.00 0.00 H ATOM 1161 N THR A 120 12.415 11.607 -7.615 1.00 19.15 N ATOM 1162 CA THR A 120 11.599 10.938 -6.588 1.00 18.48 C ATOM 1163 C THR A 120 10.144 11.400 -6.645 1.00 18.31 C ATOM 1164 O THR A 120 9.861 12.488 -7.124 1.00 18.17 O ATOM 1165 CB THR A 120 12.141 11.181 -5.158 1.00 19.13 C ATOM 1166 OG1 THR A 120 12.084 12.576 -4.849 1.00 19.40 O ATOM 1167 CG2 THR A 120 13.585 10.688 -5.020 1.00 19.25 C ATOM 1168 HG1 THR A 120 12.636 13.080 -5.499 1.00 0.00 H ATOM 1169 H THR A 120 13.008 12.415 -7.337 1.00 0.00 H ATOM 1170 N ILE A 121 9.219 10.547 -6.210 1.00 18.83 N ATOM 1171 CA ILE A 121 7.802 10.929 -6.055 1.00 19.53 C ATOM 1172 C ILE A 121 7.539 11.117 -4.557 1.00 20.43 C ATOM 1173 O ILE A 121 8.091 10.381 -3.735 1.00 19.34 O ATOM 1174 CB ILE A 121 6.840 9.857 -6.655 1.00 20.52 C ATOM 1175 CG1 ILE A 121 5.364 10.277 -6.572 1.00 20.40 C ATOM 1176 CG2 ILE A 121 7.012 8.493 -5.981 1.00 20.10 C ATOM 1177 CD1 ILE A 121 4.972 11.433 -7.480 1.00 20.66 C ATOM 1178 H ILE A 121 9.505 9.576 -5.971 1.00 0.00 H ATOM 1179 N ALA A 122 6.715 12.109 -4.213 1.00 21.50 N ATOM 1180 CA ALA A 122 6.346 12.387 -2.818 1.00 22.01 C ATOM 1181 C ALA A 122 5.406 11.331 -2.237 1.00 23.43 C ATOM 1182 O ALA A 122 4.444 10.887 -2.885 1.00 21.42 O ATOM 1183 CB ALA A 122 5.696 13.764 -2.709 1.00 22.21 C ATOM 1184 H ALA A 122 6.318 12.710 -4.963 1.00 0.00 H ATOM 1185 N LEU A 123 5.685 10.941 -0.993 1.00 24.45 N ATOM 1186 CA LEU A 123 4.762 10.133 -0.238 1.00 24.49 C ATOM 1187 C LEU A 123 3.592 10.985 0.227 1.00 24.77 C ATOM 1188 O LEU A 123 3.725 12.182 0.405 1.00 25.44 O ATOM 1189 CB LEU A 123 5.453 9.517 0.971 1.00 26.02 C ATOM 1190 CG LEU A 123 6.476 8.428 0.668 1.00 26.27 C ATOM 1191 CD1 LEU A 123 7.083 7.978 1.972 1.00 26.73 C ATOM 1192 CD2 LEU A 123 5.858 7.244 -0.040 1.00 26.60 C ATOM 1193 H LEU A 123 6.586 11.226 -0.559 1.00 0.00 H ATOM 1194 N PRO A 124 2.424 10.363 0.425 1.00 25.72 N ATOM 1195 CA PRO A 124 1.324 11.083 1.019 1.00 26.72 C ATOM 1196 C PRO A 124 1.540 11.246 2.521 1.00 30.14 C ATOM 1197 O PRO A 124 2.395 10.557 3.112 1.00 29.73 O ATOM 1198 CB PRO A 124 0.132 10.176 0.741 1.00 26.39 C ATOM 1199 CG PRO A 124 0.703 8.805 0.668 1.00 25.91 C ATOM 1200 CD PRO A 124 2.135 8.927 0.281 1.00 25.46 C ATOM 1201 N SER A 125 0.784 12.161 3.123 1.00 33.21 N ATOM 1202 CA SER A 125 0.810 12.344 4.572 1.00 36.31 C ATOM 1203 C SER A 125 -0.195 11.396 5.179 1.00 36.55 C ATOM 1204 O SER A 125 -1.011 10.811 4.468 1.00 35.19 O ATOM 1205 CB SER A 125 0.490 13.789 4.958 1.00 38.72 C ATOM 1206 OG SER A 125 -0.801 14.160 4.494 1.00 41.34 O ATOM 1207 HG SER A 125 -0.987 15.097 4.754 1.00 0.00 H ATOM 1208 H SER A 125 0.159 12.761 2.547 1.00 0.00 H ATOM 1209 N MET A 126 -0.156 11.237 6.494 1.00 40.91 N ATOM 1210 CA MET A 126 -0.946 10.178 7.114 1.00 45.26 C ATOM 1211 C MET A 126 -2.451 10.403 6.933 1.00 46.50 C ATOM 1212 O MET A 126 -2.950 11.528 7.044 1.00 42.53 O ATOM 1213 CB MET A 126 -0.565 9.973 8.584 1.00 51.01 C ATOM 1214 CG MET A 126 -0.898 8.582 9.100 1.00 57.75 C ATOM 1215 SD MET A 126 0.472 7.859 10.017 1.00 73.39 S ATOM 1216 CE MET A 126 -0.232 6.278 10.479 1.00 71.12 C ATOM 1217 H MET A 126 0.433 11.862 7.080 1.00 0.00 H ATOM 1218 N TYR A 127 -3.149 9.320 6.596 1.00 49.92 N ATOM 1219 CA TYR A 127 -4.576 9.357 6.270 1.00 54.22 C ATOM 1220 C TYR A 127 -4.990 10.598 5.471 1.00 53.73 C ATOM 1221 O TYR A 127 -5.990 11.247 5.786 1.00 58.14 O ATOM 1222 CB TYR A 127 -5.412 9.195 7.552 1.00 58.29 C ATOM 1223 CG TYR A 127 -5.101 7.906 8.295 1.00 60.86 C ATOM 1224 CD1 TYR A 127 -4.832 6.726 7.590 1.00 61.64 C ATOM 1225 CD2 TYR A 127 -5.080 7.857 9.690 1.00 63.37 C ATOM 1226 CE1 TYR A 127 -4.553 5.536 8.240 1.00 62.84 C ATOM 1227 CE2 TYR A 127 -4.797 6.667 10.355 1.00 67.69 C ATOM 1228 CZ TYR A 127 -4.534 5.508 9.618 1.00 67.37 C ATOM 1229 OH TYR A 127 -4.253 4.317 10.246 1.00 65.26 O ATOM 1230 HH TYR A 127 -4.096 3.615 9.565 1.00 0.00 H ATOM 1231 H TYR A 127 -2.657 8.404 6.563 1.00 0.00 H ATOM 1232 N ASN A 128 -4.215 10.913 4.433 1.00 50.73 N ATOM 1233 CA ASN A 128 -4.548 12.016 3.544 1.00 49.09 C ATOM 1234 C ASN A 128 -4.557 11.575 2.086 1.00 45.73 C ATOM 1235 O ASN A 128 -3.541 11.618 1.382 1.00 45.54 O ATOM 1236 CB ASN A 128 -3.613 13.193 3.770 1.00 50.86 C ATOM 1237 CG ASN A 128 -4.341 14.507 3.685 1.00 53.34 C ATOM 1238 OD1 ASN A 128 -4.651 14.978 2.587 1.00 55.91 O ATOM 1239 ND2 ASN A 128 -4.661 15.093 4.847 1.00 52.24 N ATOM 1240 HD22 ASN A 128 -4.376 14.655 5.746 1.00 0.00 H ATOM 1241 HD21 ASN A 128 -5.194 15.986 4.850 1.00 0.00 H ATOM 1242 H ASN A 128 -3.354 10.358 4.255 1.00 0.00 H ATOM 1243 N ASP A 129 -5.728 11.117 1.669 1.00 41.25 N ATOM 1244 CA ASP A 129 -5.967 10.679 0.314 1.00 41.83 C ATOM 1245 C ASP A 129 -6.889 11.645 -0.385 1.00 39.23 C ATOM 1246 O ASP A 129 -7.611 12.380 0.269 1.00 41.94 O ATOM 1247 CB ASP A 129 -6.594 9.294 0.338 1.00 42.58 C ATOM 1248 CG ASP A 129 -5.671 8.266 0.936 1.00 43.46 C ATOM 1249 OD1 ASP A 129 -4.452 8.311 0.631 1.00 46.71 O ATOM 1250 OD2 ASP A 129 -6.152 7.433 1.721 1.00 43.73 O ATOM 1251 H ASP A 129 -6.513 11.071 2.350 1.00 0.00 H ATOM 1252 N PRO A 130 -6.870 11.657 -1.723 1.00 38.75 N ATOM 1253 CA PRO A 130 -7.802 12.542 -2.435 1.00 35.82 C ATOM 1254 C PRO A 130 -9.263 12.080 -2.308 1.00 35.73 C ATOM 1255 O PRO A 130 -9.512 10.949 -1.920 1.00 32.04 O ATOM 1256 CB PRO A 130 -7.320 12.471 -3.902 1.00 36.06 C ATOM 1257 CG PRO A 130 -6.026 11.708 -3.905 1.00 36.08 C ATOM 1258 CD PRO A 130 -5.987 10.905 -2.640 1.00 38.43 C ATOM 1259 N GLN A 131 -10.219 12.947 -2.643 1.00 37.95 N ATOM 1260 CA GLN A 131 -11.643 12.576 -2.573 1.00 40.45 C ATOM 1261 C GLN A 131 -11.967 11.592 -3.702 1.00 37.71 C ATOM 1262 O GLN A 131 -11.365 11.640 -4.781 1.00 35.41 O ATOM 1263 CB GLN A 131 -12.598 13.790 -2.706 1.00 45.24 C ATOM 1264 CG GLN A 131 -12.203 15.109 -2.031 1.00 49.96 C ATOM 1265 CD GLN A 131 -11.964 14.999 -0.529 1.00 53.99 C ATOM 1266 OE1 GLN A 131 -12.910 14.975 0.276 1.00 52.27 O ATOM 1267 NE2 GLN A 131 -10.688 14.967 -0.138 1.00 56.51 N ATOM 1268 HE22 GLN A 131 -9.926 14.989 -0.846 1.00 0.00 H ATOM 1269 HE21 GLN A 131 -10.455 14.920 0.875 1.00 0.00 H ATOM 1270 H GLN A 131 -9.955 13.902 -2.959 1.00 0.00 H ATOM 1271 N PHE A 132 -12.940 10.717 -3.474 1.00 35.94 N ATOM 1272 CA PHE A 132 -13.377 9.822 -4.537 1.00 34.91 C ATOM 1273 C PHE A 132 -13.838 10.692 -5.690 1.00 30.92 C ATOM 1274 O PHE A 132 -14.331 11.808 -5.467 1.00 28.28 O ATOM 1275 CB PHE A 132 -14.442 8.803 -4.076 1.00 37.97 C ATOM 1276 CG PHE A 132 -15.813 9.383 -3.801 1.00 41.25 C ATOM 1277 CD1 PHE A 132 -16.674 9.732 -4.848 1.00 42.16 C ATOM 1278 CD2 PHE A 132 -16.269 9.518 -2.493 1.00 43.52 C ATOM 1279 CE1 PHE A 132 -17.938 10.239 -4.594 1.00 44.31 C ATOM 1280 CE2 PHE A 132 -17.538 10.020 -2.237 1.00 45.02 C ATOM 1281 CZ PHE A 132 -18.374 10.376 -3.287 1.00 45.11 C ATOM 1282 H PHE A 132 -13.389 10.671 -2.537 1.00 0.00 H ATOM 1283 N GLY A 133 -13.613 10.207 -6.909 1.00 26.81 N ATOM 1284 CA GLY A 133 -13.858 10.992 -8.109 1.00 26.79 C ATOM 1285 C GLY A 133 -12.638 11.749 -8.612 1.00 26.69 C ATOM 1286 O GLY A 133 -12.614 12.167 -9.774 1.00 27.91 O ATOM 1287 H GLY A 133 -13.251 9.237 -7.007 1.00 0.00 H ATOM 1288 N THR A 134 -11.636 11.954 -7.747 1.00 25.86 N ATOM 1289 CA THR A 134 -10.357 12.531 -8.188 1.00 25.47 C ATOM 1290 C THR A 134 -9.775 11.686 -9.314 1.00 24.80 C ATOM 1291 O THR A 134 -9.804 10.456 -9.251 1.00 25.26 O ATOM 1292 CB THR A 134 -9.313 12.545 -7.073 1.00 25.49 C ATOM 1293 OG1 THR A 134 -9.870 13.121 -5.896 1.00 27.65 O ATOM 1294 CG2 THR A 134 -8.073 13.349 -7.478 1.00 25.83 C ATOM 1295 HG1 THR A 134 -10.651 12.586 -5.606 1.00 0.00 H ATOM 1296 H THR A 134 -11.765 11.701 -6.747 1.00 0.00 H ATOM 1297 N SER A 135 -9.251 12.360 -10.326 1.00 23.00 N ATOM 1298 CA SER A 135 -8.490 11.735 -11.394 1.00 23.08 C ATOM 1299 C SER A 135 -7.018 11.566 -11.007 1.00 22.04 C ATOM 1300 O SER A 135 -6.391 12.513 -10.545 1.00 22.87 O ATOM 1301 CB SER A 135 -8.595 12.571 -12.662 1.00 22.77 C ATOM 1302 OG SER A 135 -9.906 12.480 -13.160 1.00 23.88 O ATOM 1303 HG SER A 135 -9.983 13.021 -13.985 1.00 0.00 H ATOM 1304 H SER A 135 -9.391 13.390 -10.358 1.00 0.00 H ATOM 1305 N CYS A 136 -6.496 10.348 -11.186 1.00 20.82 N ATOM 1306 CA CYS A 136 -5.109 10.005 -10.899 1.00 20.54 C ATOM 1307 C CYS A 136 -4.522 9.263 -12.063 1.00 20.31 C ATOM 1308 O CYS A 136 -5.242 8.772 -12.918 1.00 20.27 O ATOM 1309 CB CYS A 136 -5.011 9.139 -9.655 1.00 21.19 C ATOM 1310 SG CYS A 136 -5.695 9.990 -8.224 1.00 22.52 S ATOM 1311 H CYS A 136 -7.118 9.599 -11.553 1.00 0.00 H ATOM 1312 N GLU A 137 -3.203 9.174 -12.099 1.00 21.35 N ATOM 1313 CA GLU A 137 -2.551 8.528 -13.217 1.00 22.25 C ATOM 1314 C GLU A 137 -1.845 7.241 -12.788 1.00 21.49 C ATOM 1315 O GLU A 137 -1.394 7.120 -11.646 1.00 19.17 O ATOM 1316 CB GLU A 137 -1.585 9.483 -13.922 1.00 22.57 C ATOM 1317 CG GLU A 137 -0.246 9.619 -13.269 1.00 24.15 C ATOM 1318 CD GLU A 137 0.741 10.428 -14.081 1.00 25.79 C ATOM 1319 OE1 GLU A 137 1.640 11.006 -13.460 1.00 26.36 O ATOM 1320 OE2 GLU A 137 0.640 10.480 -15.328 1.00 28.74 O ATOM 1321 H GLU A 137 -2.634 9.569 -11.323 1.00 0.00 H ATOM 1322 N ILE A 138 -1.777 6.297 -13.725 1.00 20.74 N ATOM 1323 CA ILE A 138 -1.019 5.063 -13.550 1.00 21.37 C ATOM 1324 C ILE A 138 -0.035 4.926 -14.696 1.00 20.61 C ATOM 1325 O ILE A 138 -0.235 5.500 -15.775 1.00 19.94 O ATOM 1326 CB ILE A 138 -1.926 3.820 -13.424 1.00 22.78 C ATOM 1327 CG1 ILE A 138 -2.946 3.766 -14.565 1.00 24.12 C ATOM 1328 CG2 ILE A 138 -2.636 3.854 -12.065 1.00 23.50 C ATOM 1329 CD1 ILE A 138 -3.916 2.592 -14.504 1.00 24.20 C ATOM 1330 H ILE A 138 -2.286 6.446 -14.620 1.00 0.00 H ATOM 1331 N THR A 139 1.043 4.197 -14.447 1.00 19.53 N ATOM 1332 CA THR A 139 2.120 4.065 -15.421 1.00 19.41 C ATOM 1333 C THR A 139 2.632 2.635 -15.380 1.00 18.38 C ATOM 1334 O THR A 139 2.747 2.025 -14.289 1.00 17.57 O ATOM 1335 CB THR A 139 3.287 5.052 -15.112 1.00 20.81 C ATOM 1336 OG1 THR A 139 2.780 6.396 -14.969 1.00 22.70 O ATOM 1337 CG2 THR A 139 4.323 5.057 -16.231 1.00 20.98 C ATOM 1338 HG1 THR A 139 2.127 6.424 -14.226 1.00 0.00 H ATOM 1339 H THR A 139 1.123 3.706 -13.533 1.00 0.00 H ATOM 1340 N GLY A 140 2.964 2.097 -16.548 1.00 17.10 N ATOM 1341 CA GLY A 140 3.523 0.769 -16.597 1.00 17.44 C ATOM 1342 C GLY A 140 3.808 0.191 -17.966 1.00 18.12 C ATOM 1343 O GLY A 140 3.376 0.732 -18.973 1.00 17.69 O ATOM 1344 H GLY A 140 2.821 2.634 -17.427 1.00 0.00 H ATOM 1345 N PHE A 141 4.511 -0.950 -17.959 1.00 17.97 N ATOM 1346 CA PHE A 141 4.854 -1.724 -19.157 1.00 17.94 C ATOM 1347 C PHE A 141 3.937 -2.958 -19.305 1.00 18.61 C ATOM 1348 O PHE A 141 4.270 -3.913 -20.020 1.00 19.18 O ATOM 1349 CB PHE A 141 6.320 -2.212 -19.053 1.00 17.37 C ATOM 1350 CG PHE A 141 7.349 -1.200 -19.461 1.00 17.60 C ATOM 1351 CD1 PHE A 141 7.445 -0.770 -20.798 1.00 16.88 C ATOM 1352 CD2 PHE A 141 8.275 -0.706 -18.533 1.00 17.13 C ATOM 1353 CE1 PHE A 141 8.410 0.143 -21.166 1.00 16.36 C ATOM 1354 CE2 PHE A 141 9.258 0.200 -18.914 1.00 16.67 C ATOM 1355 CZ PHE A 141 9.318 0.633 -20.227 1.00 16.54 C ATOM 1356 H PHE A 141 4.836 -1.312 -17.040 1.00 0.00 H ATOM 1357 N GLY A 142 2.800 -2.962 -18.621 1.00 19.83 N ATOM 1358 CA GLY A 142 1.923 -4.137 -18.584 1.00 20.30 C ATOM 1359 C GLY A 142 1.164 -4.325 -19.885 1.00 20.63 C ATOM 1360 O GLY A 142 1.215 -3.469 -20.760 1.00 20.34 O ATOM 1361 H GLY A 142 2.523 -2.108 -18.096 1.00 0.00 H ATOM 1362 N LYS A 143 0.413 -5.419 -19.980 1.00 21.16 N ATOM 1363 CA LYS A 143 -0.327 -5.768 -21.201 1.00 21.76 C ATOM 1364 C LYS A 143 -1.260 -4.656 -21.678 1.00 21.28 C ATOM 1365 O LYS A 143 -1.872 -3.971 -20.877 1.00 18.85 O ATOM 1366 CB LYS A 143 -1.223 -6.971 -20.956 1.00 22.62 C ATOM 1367 CG LYS A 143 -0.556 -8.305 -20.721 1.00 24.52 C ATOM 1368 CD LYS A 143 -1.684 -9.328 -20.663 1.00 26.61 C ATOM 1369 CE LYS A 143 -1.224 -10.757 -20.513 1.00 28.27 C ATOM 1370 NZ LYS A 143 -2.441 -11.620 -20.546 1.00 28.84 N ATOM 1371 HZ1 LYS A 143 -3.073 -11.355 -19.764 1.00 0.00 H ATOM 1372 HZ2 LYS A 143 -2.934 -11.488 -21.452 1.00 0.00 H ATOM 1373 HZ3 LYS A 143 -2.161 -12.616 -20.445 1.00 0.00 H ATOM 1374 H LYS A 143 0.347 -6.052 -19.158 1.00 0.00 H ATOM 1375 N GLU A 144 -1.398 -4.533 -22.998 1.00 22.78 N ATOM 1376 CA GLU A 144 -2.314 -3.568 -23.602 1.00 22.04 C ATOM 1377 C GLU A 144 -3.662 -4.193 -23.874 1.00 22.59 C ATOM 1378 O GLU A 144 -4.651 -3.482 -24.025 1.00 21.62 O ATOM 1379 CB GLU A 144 -1.777 -3.113 -24.929 1.00 23.46 C ATOM 1380 CG GLU A 144 -0.415 -2.491 -24.854 1.00 24.02 C ATOM 1381 CD GLU A 144 -0.083 -1.769 -26.132 1.00 23.54 C ATOM 1382 OE1 GLU A 144 -0.539 -0.632 -26.307 1.00 23.55 O ATOM 1383 OE2 GLU A 144 0.633 -2.342 -26.945 1.00 23.97 O ATOM 1384 H GLU A 144 -0.833 -5.146 -23.620 1.00 0.00 H ATOM 1385 N GLN A 145 -3.692 -5.518 -23.972 1.00 23.10 N ATOM 1386 CA GLN A 145 -4.927 -6.262 -24.222 1.00 25.80 C ATOM 1387 C GLN A 145 -4.808 -7.555 -23.491 1.00 24.81 C ATOM 1388 O GLN A 145 -3.712 -8.064 -23.321 1.00 21.97 O ATOM 1389 CB GLN A 145 -5.102 -6.585 -25.715 1.00 28.60 C ATOM 1390 CG GLN A 145 -5.320 -5.389 -26.618 1.00 31.12 C ATOM 1391 CD GLN A 145 -6.534 -4.582 -26.199 1.00 37.88 C ATOM 1392 OE1 GLN A 145 -7.515 -5.137 -25.681 1.00 41.63 O ATOM 1393 NE2 GLN A 145 -6.475 -3.254 -26.400 1.00 40.34 N ATOM 1394 HE22 GLN A 145 -5.632 -2.831 -26.838 1.00 0.00 H ATOM 1395 HE21 GLN A 145 -7.273 -2.649 -26.117 1.00 0.00 H ATOM 1396 H GLN A 145 -2.803 -6.047 -23.867 1.00 0.00 H ATOM 1397 N SER A 146 -5.929 -8.127 -23.079 1.00 26.79 N ATOM 1398 CA SER A 146 -5.828 -9.375 -22.343 1.00 29.15 C ATOM 1399 C SER A 146 -5.325 -10.528 -23.220 1.00 26.64 C ATOM 1400 O SER A 146 -4.800 -11.488 -22.694 1.00 25.56 O ATOM 1401 CB SER A 146 -7.124 -9.698 -21.589 1.00 32.39 C ATOM 1402 OG SER A 146 -8.238 -9.647 -22.438 1.00 36.18 O ATOM 1403 HG SER A 146 -8.317 -8.738 -22.823 1.00 0.00 H ATOM 1404 H SER A 146 -6.854 -7.695 -23.277 1.00 0.00 H ATOM 1405 N THR A 147 -5.429 -10.408 -24.544 1.00 25.99 N ATOM 1406 CA THR A 147 -4.908 -11.427 -25.467 1.00 25.79 C ATOM 1407 C THR A 147 -3.404 -11.326 -25.758 1.00 25.17 C ATOM 1408 O THR A 147 -2.844 -12.203 -26.413 1.00 22.41 O ATOM 1409 CB THR A 147 -5.631 -11.380 -26.841 1.00 27.87 C ATOM 1410 OG1 THR A 147 -5.545 -10.059 -27.395 1.00 30.60 O ATOM 1411 CG2 THR A 147 -7.084 -11.752 -26.706 1.00 28.21 C ATOM 1412 HG1 THR A 147 -4.593 -9.815 -27.518 1.00 0.00 H ATOM 1413 H THR A 147 -5.894 -9.565 -24.937 1.00 0.00 H ATOM 1414 N ASP A 148 -2.753 -10.254 -25.305 1.00 24.72 N ATOM 1415 CA ASP A 148 -1.327 -10.075 -25.543 1.00 25.00 C ATOM 1416 C ASP A 148 -0.539 -11.081 -24.710 1.00 24.53 C ATOM 1417 O ASP A 148 -0.880 -11.349 -23.574 1.00 24.80 O ATOM 1418 CB ASP A 148 -0.865 -8.667 -25.142 1.00 28.40 C ATOM 1419 CG ASP A 148 -1.341 -7.575 -26.092 1.00 30.11 C ATOM 1420 OD1 ASP A 148 -1.504 -7.803 -27.300 1.00 31.50 O ATOM 1421 OD2 ASP A 148 -1.522 -6.444 -25.611 1.00 37.56 O ATOM 1422 H ASP A 148 -3.274 -9.530 -24.770 1.00 0.00 H ATOM 1423 N TYR A 149 0.522 -11.627 -25.280 1.00 22.75 N ATOM 1424 CA TYR A 149 1.384 -12.541 -24.577 1.00 22.27 C ATOM 1425 C TYR A 149 2.774 -11.925 -24.418 1.00 21.90 C ATOM 1426 O TYR A 149 3.627 -12.533 -23.840 1.00 20.39 O ATOM 1427 CB TYR A 149 1.474 -13.881 -25.326 1.00 22.85 C ATOM 1428 CG TYR A 149 2.085 -13.816 -26.708 1.00 22.93 C ATOM 1429 CD1 TYR A 149 1.296 -13.609 -27.844 1.00 22.57 C ATOM 1430 CD2 TYR A 149 3.444 -14.003 -26.884 1.00 22.79 C ATOM 1431 CE1 TYR A 149 1.861 -13.551 -29.114 1.00 22.69 C ATOM 1432 CE2 TYR A 149 4.008 -13.974 -28.142 1.00 23.71 C ATOM 1433 CZ TYR A 149 3.214 -13.737 -29.254 1.00 23.62 C ATOM 1434 OH TYR A 149 3.808 -13.702 -30.497 1.00 25.00 O ATOM 1435 HH TYR A 149 3.119 -13.525 -31.186 1.00 0.00 H ATOM 1436 H TYR A 149 0.741 -11.388 -26.268 1.00 0.00 H ATOM 1437 N LEU A 150 2.972 -10.742 -24.993 1.00 21.78 N ATOM 1438 CA LEU A 150 4.170 -9.928 -24.847 1.00 22.64 C ATOM 1439 C LEU A 150 3.770 -8.566 -24.305 1.00 21.28 C ATOM 1440 O LEU A 150 2.678 -8.078 -24.569 1.00 21.19 O ATOM 1441 CB LEU A 150 4.799 -9.680 -26.228 1.00 23.62 C ATOM 1442 CG LEU A 150 5.946 -10.522 -26.774 1.00 24.01 C ATOM 1443 CD1 LEU A 150 6.150 -11.805 -26.010 1.00 25.33 C ATOM 1444 CD2 LEU A 150 5.742 -10.774 -28.259 1.00 24.90 C ATOM 1445 H LEU A 150 2.210 -10.369 -25.595 1.00 0.00 H ATOM 1446 N TYR A 151 4.683 -7.939 -23.586 1.00 22.49 N ATOM 1447 CA TYR A 151 4.487 -6.569 -23.111 1.00 22.67 C ATOM 1448 C TYR A 151 4.850 -5.530 -24.183 1.00 22.54 C ATOM 1449 O TYR A 151 5.744 -5.765 -24.977 1.00 22.84 O ATOM 1450 CB TYR A 151 5.332 -6.317 -21.873 1.00 21.19 C ATOM 1451 CG TYR A 151 4.945 -7.131 -20.672 1.00 20.99 C ATOM 1452 CD1 TYR A 151 3.622 -7.371 -20.370 1.00 20.93 C ATOM 1453 CD2 TYR A 151 5.914 -7.643 -19.807 1.00 21.31 C ATOM 1454 CE1 TYR A 151 3.264 -8.111 -19.260 1.00 20.71 C ATOM 1455 CE2 TYR A 151 5.557 -8.406 -18.697 1.00 20.74 C ATOM 1456 CZ TYR A 151 4.227 -8.616 -18.426 1.00 20.30 C ATOM 1457 OH TYR A 151 3.830 -9.349 -17.337 1.00 19.38 O ATOM 1458 HH TYR A 151 4.167 -8.919 -16.511 1.00 0.00 H ATOM 1459 H TYR A 151 5.567 -8.433 -23.350 1.00 0.00 H ATOM 1460 N PRO A 152 4.165 -4.368 -24.187 1.00 22.64 N ATOM 1461 CA PRO A 152 4.551 -3.302 -25.111 1.00 22.01 C ATOM 1462 C PRO A 152 5.997 -2.897 -24.938 1.00 22.37 C ATOM 1463 O PRO A 152 6.532 -2.964 -23.806 1.00 21.30 O ATOM 1464 CB PRO A 152 3.661 -2.116 -24.694 1.00 22.08 C ATOM 1465 CG PRO A 152 3.315 -2.396 -23.279 1.00 22.53 C ATOM 1466 CD PRO A 152 3.169 -3.893 -23.208 1.00 22.53 C ATOM 1467 N GLU A 153 6.607 -2.437 -26.027 1.00 21.39 N ATOM 1468 CA GLU A 153 7.993 -1.963 -25.987 1.00 24.31 C ATOM 1469 C GLU A 153 8.120 -0.548 -25.385 1.00 22.80 C ATOM 1470 O GLU A 153 9.162 -0.157 -24.877 1.00 21.19 O ATOM 1471 CB GLU A 153 8.604 -1.986 -27.403 1.00 26.90 C ATOM 1472 CG GLU A 153 9.281 -3.298 -27.748 1.00 30.81 C ATOM 1473 CD GLU A 153 10.480 -3.583 -26.846 1.00 32.59 C ATOM 1474 OE1 GLU A 153 11.222 -2.630 -26.457 1.00 34.29 O ATOM 1475 OE2 GLU A 153 10.646 -4.770 -26.503 1.00 34.96 O ATOM 1476 H GLU A 153 6.088 -2.413 -26.928 1.00 0.00 H ATOM 1477 N GLN A 154 7.062 0.232 -25.469 1.00 22.51 N ATOM 1478 CA GLN A 154 7.119 1.599 -25.000 1.00 22.88 C ATOM 1479 C GLN A 154 6.270 1.722 -23.754 1.00 20.25 C ATOM 1480 O GLN A 154 5.199 1.144 -23.657 1.00 19.03 O ATOM 1481 CB GLN A 154 6.617 2.527 -26.101 1.00 25.39 C ATOM 1482 CG GLN A 154 6.643 4.020 -25.788 1.00 28.72 C ATOM 1483 CD GLN A 154 8.016 4.653 -25.870 1.00 31.23 C ATOM 1484 OE1 GLN A 154 8.306 5.609 -25.153 1.00 34.26 O ATOM 1485 NE2 GLN A 154 8.870 4.135 -26.735 1.00 34.26 N ATOM 1486 HE22 GLN A 154 8.587 3.326 -27.324 1.00 0.00 H ATOM 1487 HE21 GLN A 154 9.825 4.536 -26.827 1.00 0.00 H ATOM 1488 H GLN A 154 6.179 -0.138 -25.876 1.00 0.00 H ATOM 1489 N LEU A 155 6.757 2.513 -22.810 1.00 19.46 N ATOM 1490 CA LEU A 155 6.042 2.792 -21.574 1.00 18.30 C ATOM 1491 C LEU A 155 4.684 3.437 -21.866 1.00 17.86 C ATOM 1492 O LEU A 155 4.553 4.222 -22.807 1.00 17.71 O ATOM 1493 CB LEU A 155 6.896 3.731 -20.700 1.00 18.48 C ATOM 1494 CG LEU A 155 6.485 3.990 -19.242 1.00 18.32 C ATOM 1495 CD1 LEU A 155 6.496 2.714 -18.418 1.00 17.62 C ATOM 1496 CD2 LEU A 155 7.424 5.034 -18.636 1.00 18.18 C ATOM 1497 H LEU A 155 7.688 2.952 -22.958 1.00 0.00 H ATOM 1498 N LYS A 156 3.689 3.107 -21.048 1.00 17.68 N ATOM 1499 CA LYS A 156 2.338 3.660 -21.169 1.00 17.97 C ATOM 1500 C LYS A 156 1.871 4.335 -19.887 1.00 18.10 C ATOM 1501 O LYS A 156 2.399 4.085 -18.808 1.00 16.85 O ATOM 1502 CB LYS A 156 1.347 2.567 -21.558 1.00 18.64 C ATOM 1503 CG LYS A 156 1.547 2.091 -22.992 1.00 19.38 C ATOM 1504 CD LYS A 156 0.451 1.143 -23.444 1.00 19.87 C ATOM 1505 CE LYS A 156 -0.795 1.913 -23.844 1.00 19.75 C ATOM 1506 NZ LYS A 156 -1.835 0.992 -24.360 1.00 19.75 N ATOM 1507 HZ1 LYS A 156 -1.468 0.488 -25.193 1.00 0.00 H ATOM 1508 HZ2 LYS A 156 -2.086 0.305 -23.620 1.00 0.00 H ATOM 1509 HZ3 LYS A 156 -2.678 1.538 -24.628 1.00 0.00 H ATOM 1510 H LYS A 156 3.879 2.424 -20.287 1.00 0.00 H ATOM 1511 N MET A 157 0.888 5.216 -20.029 1.00 18.88 N ATOM 1512 CA MET A 157 0.153 5.747 -18.888 1.00 19.32 C ATOM 1513 C MET A 157 -1.338 5.850 -19.203 1.00 18.05 C ATOM 1514 O MET A 157 -1.746 5.766 -20.346 1.00 18.20 O ATOM 1515 CB MET A 157 0.684 7.115 -18.476 1.00 21.16 C ATOM 1516 CG MET A 157 0.655 8.191 -19.563 1.00 23.63 C ATOM 1517 SD MET A 157 -0.910 9.079 -19.604 1.00 27.61 S ATOM 1518 CE MET A 157 -0.891 9.915 -18.006 1.00 27.55 C ATOM 1519 H MET A 157 0.634 5.537 -20.985 1.00 0.00 H ATOM 1520 N THR A 158 -2.138 6.014 -18.164 1.00 16.79 N ATOM 1521 CA THR A 158 -3.506 6.401 -18.339 1.00 16.73 C ATOM 1522 C THR A 158 -4.004 7.158 -17.124 1.00 16.39 C ATOM 1523 O THR A 158 -3.254 7.381 -16.148 1.00 16.11 O ATOM 1524 CB THR A 158 -4.417 5.198 -18.706 1.00 17.07 C ATOM 1525 OG1 THR A 158 -5.623 5.697 -19.319 1.00 15.77 O ATOM 1526 CG2 THR A 158 -4.713 4.326 -17.479 1.00 16.22 C ATOM 1527 HG1 THR A 158 -6.210 4.936 -19.556 1.00 0.00 H ATOM 1528 H THR A 158 -1.769 5.860 -17.204 1.00 0.00 H ATOM 1529 N VAL A 159 -5.241 7.625 -17.239 1.00 15.97 N ATOM 1530 CA VAL A 159 -5.879 8.404 -16.204 1.00 16.58 C ATOM 1531 C VAL A 159 -7.121 7.643 -15.819 1.00 17.63 C ATOM 1532 O VAL A 159 -7.897 7.260 -16.683 1.00 18.40 O ATOM 1533 CB VAL A 159 -6.200 9.844 -16.672 1.00 17.00 C ATOM 1534 CG1 VAL A 159 -6.942 10.634 -15.600 1.00 17.29 C ATOM 1535 CG2 VAL A 159 -4.914 10.583 -17.025 1.00 16.76 C ATOM 1536 H VAL A 159 -5.772 7.422 -18.110 1.00 0.00 H ATOM 1537 N VAL A 160 -7.264 7.378 -14.519 1.00 18.86 N ATOM 1538 CA VAL A 160 -8.435 6.715 -13.963 1.00 20.00 C ATOM 1539 C VAL A 160 -8.996 7.566 -12.815 1.00 20.64 C ATOM 1540 O VAL A 160 -8.326 8.488 -12.319 1.00 21.58 O ATOM 1541 CB VAL A 160 -8.116 5.263 -13.474 1.00 20.71 C ATOM 1542 CG1 VAL A 160 -7.748 4.365 -14.644 1.00 20.13 C ATOM 1543 CG2 VAL A 160 -6.989 5.235 -12.454 1.00 20.75 C ATOM 1544 H VAL A 160 -6.501 7.659 -13.871 1.00 0.00 H ATOM 1545 N LYS A 161 -10.224 7.260 -12.400 1.00 20.03 N ATOM 1546 CA LYS A 161 -10.863 7.983 -11.301 1.00 20.29 C ATOM 1547 C LYS A 161 -10.922 7.123 -10.046 1.00 19.79 C ATOM 1548 O LYS A 161 -11.176 5.920 -10.121 1.00 18.07 O ATOM 1549 CB LYS A 161 -12.273 8.447 -11.701 1.00 22.23 C ATOM 1550 CG LYS A 161 -12.251 9.658 -12.608 1.00 25.64 C ATOM 1551 CD LYS A 161 -13.627 10.266 -12.799 1.00 29.57 C ATOM 1552 CE LYS A 161 -13.633 11.160 -14.034 1.00 31.57 C ATOM 1553 NZ LYS A 161 -14.677 12.213 -13.912 1.00 33.88 N ATOM 1554 HZ1 LYS A 161 -15.610 11.765 -13.815 1.00 0.00 H ATOM 1555 HZ2 LYS A 161 -14.483 12.797 -13.073 1.00 0.00 H ATOM 1556 HZ3 LYS A 161 -14.665 12.811 -14.763 1.00 0.00 H ATOM 1557 H LYS A 161 -10.741 6.489 -12.869 1.00 0.00 H ATOM 1558 N LEU A 162 -10.667 7.751 -8.901 1.00 20.19 N ATOM 1559 CA LEU A 162 -10.739 7.066 -7.620 1.00 21.76 C ATOM 1560 C LEU A 162 -12.181 6.789 -7.270 1.00 23.40 C ATOM 1561 O LEU A 162 -13.039 7.666 -7.397 1.00 26.19 O ATOM 1562 CB LEU A 162 -10.125 7.907 -6.510 1.00 22.03 C ATOM 1563 CG LEU A 162 -8.625 8.169 -6.549 1.00 22.42 C ATOM 1564 CD1 LEU A 162 -8.227 8.880 -5.273 1.00 23.24 C ATOM 1565 CD2 LEU A 162 -7.806 6.898 -6.688 1.00 22.72 C ATOM 1566 H LEU A 162 -10.409 8.758 -8.923 1.00 0.00 H ATOM 1567 N ILE A 163 -12.432 5.572 -6.813 1.00 24.32 N ATOM 1568 CA ILE A 163 -13.771 5.081 -6.516 1.00 23.95 C ATOM 1569 C ILE A 163 -13.881 4.855 -5.026 1.00 23.80 C ATOM 1570 O ILE A 163 -12.975 4.315 -4.419 1.00 24.40 O ATOM 1571 CB ILE A 163 -14.025 3.766 -7.298 1.00 25.45 C ATOM 1572 CG1 ILE A 163 -14.320 4.112 -8.757 1.00 26.82 C ATOM 1573 CG2 ILE A 163 -15.165 2.946 -6.690 1.00 25.76 C ATOM 1574 CD1 ILE A 163 -14.268 2.921 -9.694 1.00 29.25 C ATOM 1575 H ILE A 163 -11.628 4.931 -6.657 1.00 0.00 H ATOM 1576 N SER A 164 -14.996 5.256 -4.434 1.00 24.05 N ATOM 1577 CA SER A 164 -15.186 5.098 -2.992 1.00 23.87 C ATOM 1578 C SER A 164 -15.218 3.620 -2.555 1.00 24.93 C ATOM 1579 O SER A 164 -15.543 2.714 -3.333 1.00 23.04 O ATOM 1580 CB SER A 164 -16.488 5.773 -2.541 1.00 22.93 C ATOM 1581 OG SER A 164 -17.593 5.062 -3.024 1.00 22.46 O ATOM 1582 HG SER A 164 -17.568 4.137 -2.672 1.00 0.00 H ATOM 1583 H SER A 164 -15.749 5.691 -5.004 1.00 0.00 H ATOM 1584 N HIS A 165 -14.901 3.408 -1.284 1.00 27.15 N ATOM 1585 CA HIS A 165 -14.978 2.093 -0.670 1.00 28.88 C ATOM 1586 C HIS A 165 -16.422 1.564 -0.730 1.00 28.94 C ATOM 1587 O HIS A 165 -16.648 0.397 -1.066 1.00 26.24 O ATOM 1588 CB HIS A 165 -14.415 2.150 0.760 1.00 31.04 C ATOM 1589 CG HIS A 165 -14.246 0.806 1.391 1.00 36.29 C ATOM 1590 ND1 HIS A 165 -14.870 0.452 2.572 1.00 39.34 N ATOM 1591 CD2 HIS A 165 -13.564 -0.290 0.982 1.00 37.24 C ATOM 1592 CE1 HIS A 165 -14.562 -0.797 2.875 1.00 40.56 C ATOM 1593 NE2 HIS A 165 -13.776 -1.272 1.922 1.00 42.63 N ATOM 1594 H HIS A 165 -14.586 4.213 -0.706 1.00 0.00 H ATOM 1595 N ARG A 166 -17.391 2.452 -0.508 1.00 30.30 N ATOM 1596 CA ARG A 166 -18.811 2.080 -0.541 1.00 31.54 C ATOM 1597 C ARG A 166 -19.159 1.496 -1.913 1.00 27.67 C ATOM 1598 O ARG A 166 -19.781 0.437 -2.014 1.00 24.75 O ATOM 1599 CB ARG A 166 -19.739 3.277 -0.272 1.00 34.95 C ATOM 1600 CG ARG A 166 -19.619 3.964 1.087 1.00 40.04 C ATOM 1601 CD ARG A 166 -18.190 4.273 1.574 1.00 44.82 C ATOM 1602 NE ARG A 166 -17.520 5.418 0.927 1.00 44.94 N ATOM 1603 CZ ARG A 166 -16.333 5.896 1.296 1.00 43.00 C ATOM 1604 NH1 ARG A 166 -15.668 5.339 2.290 1.00 44.41 N ATOM 1605 NH2 ARG A 166 -15.807 6.936 0.675 1.00 45.60 N ATOM 1606 HE ARG A 166 -18.006 5.881 0.132 1.00 0.00 H ATOM 1607 HH12 ARG A 166 -14.742 5.718 2.573 1.00 0.00 H ATOM 1608 HH11 ARG A 166 -16.070 4.521 2.791 1.00 0.00 H ATOM 1609 HH22 ARG A 166 -14.880 7.303 0.969 1.00 0.00 H ATOM 1610 HH21 ARG A 166 -16.320 7.388 -0.109 1.00 0.00 H ATOM 1611 H ARG A 166 -17.133 3.439 -0.305 1.00 0.00 H ATOM 1612 N GLU A 167 -18.749 2.181 -2.977 1.00 25.39 N ATOM 1613 CA GLU A 167 -19.032 1.681 -4.325 1.00 23.10 C ATOM 1614 C GLU A 167 -18.285 0.378 -4.615 1.00 22.65 C ATOM 1615 O GLU A 167 -18.845 -0.560 -5.198 1.00 20.59 O ATOM 1616 CB GLU A 167 -18.696 2.741 -5.374 1.00 22.80 C ATOM 1617 CG GLU A 167 -18.816 2.238 -6.816 1.00 22.29 C ATOM 1618 CD GLU A 167 -18.712 3.345 -7.851 1.00 22.68 C ATOM 1619 OE1 GLU A 167 -18.879 4.521 -7.480 1.00 23.35 O ATOM 1620 OE2 GLU A 167 -18.505 3.037 -9.048 1.00 22.72 O ATOM 1621 H GLU A 167 -18.227 3.072 -2.852 1.00 0.00 H ATOM 1622 N CYS A 168 -17.024 0.319 -4.191 1.00 23.20 N ATOM 1623 CA CYS A 168 -16.155 -0.813 -4.533 1.00 24.66 C ATOM 1624 C CYS A 168 -16.564 -2.110 -3.812 1.00 24.81 C ATOM 1625 O CYS A 168 -16.356 -3.208 -4.334 1.00 23.98 O ATOM 1626 CB CYS A 168 -14.669 -0.470 -4.275 1.00 25.50 C ATOM 1627 SG CYS A 168 -13.647 -1.288 -5.510 1.00 28.48 S ATOM 1628 H CYS A 168 -16.647 1.091 -3.605 1.00 0.00 H ATOM 1629 N GLN A 169 -17.174 -1.954 -2.634 1.00 27.05 N ATOM 1630 CA GLN A 169 -17.718 -3.049 -1.830 1.00 28.15 C ATOM 1631 C GLN A 169 -19.084 -3.558 -2.298 1.00 28.04 C ATOM 1632 O GLN A 169 -19.610 -4.485 -1.713 1.00 26.20 O ATOM 1633 CB GLN A 169 -17.885 -2.606 -0.368 1.00 32.25 C ATOM 1634 CG GLN A 169 -16.637 -2.715 0.479 1.00 36.46 C ATOM 1635 CD GLN A 169 -16.944 -2.772 1.974 1.00 43.94 C ATOM 1636 OE1 GLN A 169 -16.199 -3.385 2.756 1.00 46.00 O ATOM 1637 NE2 GLN A 169 -18.053 -2.144 2.382 1.00 45.92 N ATOM 1638 HE22 GLN A 169 -18.649 -1.642 1.694 1.00 0.00 H ATOM 1639 HE21 GLN A 169 -18.318 -2.158 3.387 1.00 0.00 H ATOM 1640 H GLN A 169 -17.269 -0.987 -2.262 1.00 0.00 H ATOM 1641 N GLN A 170 -19.670 -2.961 -3.333 1.00 27.35 N ATOM 1642 CA GLN A 170 -20.978 -3.407 -3.809 1.00 27.00 C ATOM 1643 C GLN A 170 -20.848 -4.842 -4.264 1.00 28.45 C ATOM 1644 O GLN A 170 -19.744 -5.279 -4.612 1.00 28.02 O ATOM 1645 CB GLN A 170 -21.487 -2.525 -4.958 1.00 26.27 C ATOM 1646 CG GLN A 170 -21.801 -1.093 -4.551 1.00 25.43 C ATOM 1647 CD GLN A 170 -22.893 -0.984 -3.500 1.00 25.72 C ATOM 1648 OE1 GLN A 170 -22.700 -0.346 -2.464 1.00 26.01 O ATOM 1649 NE2 GLN A 170 -24.048 -1.584 -3.766 1.00 25.21 N ATOM 1650 HE22 GLN A 170 -24.167 -2.112 -4.654 1.00 0.00 H ATOM 1651 HE21 GLN A 170 -24.833 -1.525 -3.086 1.00 0.00 H ATOM 1652 H GLN A 170 -19.192 -2.169 -3.808 1.00 0.00 H ATOM 1653 N PRO A 170A -21.969 -5.590 -4.249 1.00 29.24 N ATOM 1654 CA PRO A 170A -21.958 -7.010 -4.599 1.00 29.23 C ATOM 1655 C PRO A 170A -21.381 -7.277 -5.976 1.00 30.33 C ATOM 1656 O PRO A 170A -20.587 -8.183 -6.128 1.00 28.76 O ATOM 1657 CB PRO A 170A -23.443 -7.418 -4.574 1.00 30.77 C ATOM 1658 CG PRO A 170A -24.222 -6.215 -4.134 1.00 31.11 C ATOM 1659 CD PRO A 170A -23.259 -5.156 -3.687 1.00 30.79 C ATOM 1660 N HIS A 170B -21.783 -6.501 -6.980 1.00 32.67 N ATOM 1661 CA HIS A 170B -21.277 -6.716 -8.340 1.00 34.35 C ATOM 1662 C HIS A 170B -19.867 -6.174 -8.559 1.00 30.30 C ATOM 1663 O HIS A 170B -19.256 -6.444 -9.593 1.00 30.04 O ATOM 1664 CB HIS A 170B -22.226 -6.123 -9.376 1.00 38.86 C ATOM 1665 CG HIS A 170B -23.451 -6.942 -9.586 1.00 43.43 C ATOM 1666 ND1 HIS A 170B -24.399 -7.122 -8.602 1.00 46.31 N ATOM 1667 CD2 HIS A 170B -23.880 -7.640 -10.660 1.00 47.74 C ATOM 1668 CE1 HIS A 170B -25.360 -7.901 -9.058 1.00 48.53 C ATOM 1669 NE2 HIS A 170B -25.075 -8.221 -10.309 1.00 52.50 N ATOM 1670 H HIS A 170B -22.462 -5.735 -6.798 1.00 0.00 H ATOM 1671 N TYR A 171 -19.357 -5.411 -7.598 1.00 27.21 N ATOM 1672 CA TYR A 171 -17.965 -4.986 -7.653 1.00 26.51 C ATOM 1673 C TYR A 171 -17.115 -6.037 -6.940 1.00 23.96 C ATOM 1674 O TYR A 171 -16.959 -7.136 -7.463 1.00 22.39 O ATOM 1675 CB TYR A 171 -17.796 -3.564 -7.098 1.00 27.45 C ATOM 1676 CG TYR A 171 -18.175 -2.482 -8.106 1.00 27.68 C ATOM 1677 CD1 TYR A 171 -19.484 -2.348 -8.587 1.00 27.92 C ATOM 1678 CD2 TYR A 171 -17.216 -1.593 -8.575 1.00 27.70 C ATOM 1679 CE1 TYR A 171 -19.805 -1.360 -9.515 1.00 27.63 C ATOM 1680 CE2 TYR A 171 -17.525 -0.613 -9.496 1.00 27.66 C ATOM 1681 CZ TYR A 171 -18.812 -0.495 -9.966 1.00 28.08 C ATOM 1682 OH TYR A 171 -19.075 0.508 -10.868 1.00 28.43 O ATOM 1683 HH TYR A 171 -18.868 1.384 -10.456 1.00 0.00 H ATOM 1684 H TYR A 171 -19.956 -5.115 -6.801 1.00 0.00 H ATOM 1685 N TYR A 172 -16.591 -5.733 -5.757 1.00 23.24 N ATOM 1686 CA TYR A 172 -15.730 -6.690 -5.041 1.00 22.15 C ATOM 1687 C TYR A 172 -16.249 -7.148 -3.696 1.00 22.26 C ATOM 1688 O TYR A 172 -15.604 -7.942 -3.039 1.00 26.14 O ATOM 1689 CB TYR A 172 -14.322 -6.125 -4.875 1.00 20.46 C ATOM 1690 CG TYR A 172 -13.577 -6.031 -6.172 1.00 20.23 C ATOM 1691 CD1 TYR A 172 -13.490 -7.124 -7.022 1.00 19.50 C ATOM 1692 CD2 TYR A 172 -12.935 -4.859 -6.545 1.00 19.40 C ATOM 1693 CE1 TYR A 172 -12.809 -7.041 -8.208 1.00 18.37 C ATOM 1694 CE2 TYR A 172 -12.248 -4.778 -7.737 1.00 18.80 C ATOM 1695 CZ TYR A 172 -12.202 -5.873 -8.555 1.00 17.93 C ATOM 1696 OH TYR A 172 -11.524 -5.813 -9.721 1.00 17.35 O ATOM 1697 HH TYR A 172 -11.912 -5.102 -10.291 1.00 0.00 H ATOM 1698 H TYR A 172 -16.792 -4.806 -5.331 1.00 0.00 H ATOM 1699 N GLY A 173 -17.405 -6.674 -3.268 1.00 22.48 N ATOM 1700 CA GLY A 173 -17.958 -7.135 -2.004 1.00 21.10 C ATOM 1701 C GLY A 173 -17.006 -6.755 -0.904 1.00 21.90 C ATOM 1702 O GLY A 173 -16.311 -5.737 -1.000 1.00 20.73 O ATOM 1703 H GLY A 173 -17.920 -5.971 -3.835 1.00 0.00 H ATOM 1704 N SER A 174 -16.928 -7.601 0.127 1.00 22.29 N ATOM 1705 CA SER A 174 -16.045 -7.340 1.246 1.00 21.58 C ATOM 1706 C SER A 174 -14.611 -7.743 0.952 1.00 21.10 C ATOM 1707 O SER A 174 -13.774 -7.689 1.825 1.00 19.77 O ATOM 1708 CB SER A 174 -16.564 -8.049 2.489 1.00 21.65 C ATOM 1709 OG SER A 174 -17.774 -7.458 2.917 1.00 22.03 O ATOM 1710 HG SER A 174 -18.101 -7.927 3.725 1.00 0.00 H ATOM 1711 H SER A 174 -17.511 -8.462 0.127 1.00 0.00 H ATOM 1712 N GLU A 175 -14.318 -8.150 -0.280 1.00 23.50 N ATOM 1713 CA GLU A 175 -12.960 -8.565 -0.630 1.00 24.10 C ATOM 1714 C GLU A 175 -11.991 -7.367 -0.675 1.00 24.85 C ATOM 1715 O GLU A 175 -10.794 -7.503 -0.403 1.00 24.17 O ATOM 1716 CB GLU A 175 -12.975 -9.321 -1.950 1.00 27.49 C ATOM 1717 CG GLU A 175 -13.838 -10.582 -1.952 1.00 28.59 C ATOM 1718 CD GLU A 175 -13.824 -11.295 -3.299 1.00 30.90 C ATOM 1719 OE1 GLU A 175 -14.847 -11.892 -3.717 1.00 33.46 O ATOM 1720 OE2 GLU A 175 -12.786 -11.268 -3.954 1.00 33.85 O ATOM 1721 H GLU A 175 -15.064 -8.173 -1.004 1.00 0.00 H ATOM 1722 N VAL A 176 -12.526 -6.187 -0.977 1.00 24.67 N ATOM 1723 CA VAL A 176 -11.742 -4.963 -0.953 1.00 25.06 C ATOM 1724 C VAL A 176 -11.864 -4.363 0.454 1.00 24.57 C ATOM 1725 O VAL A 176 -12.949 -4.359 1.014 1.00 24.58 O ATOM 1726 CB VAL A 176 -12.191 -3.987 -2.079 1.00 25.73 C ATOM 1727 CG1 VAL A 176 -13.609 -3.466 -1.855 1.00 26.82 C ATOM 1728 CG2 VAL A 176 -11.252 -2.811 -2.174 1.00 27.02 C ATOM 1729 H VAL A 176 -13.532 -6.139 -1.237 1.00 0.00 H ATOM 1730 N THR A 177 -10.748 -3.898 1.027 1.00 22.92 N ATOM 1731 CA THR A 177 -10.708 -3.384 2.408 1.00 22.65 C ATOM 1732 C THR A 177 -10.307 -1.900 2.427 1.00 23.74 C ATOM 1733 O THR A 177 -10.003 -1.313 1.375 1.00 22.75 O ATOM 1734 CB THR A 177 -9.691 -4.143 3.283 1.00 21.65 C ATOM 1735 OG1 THR A 177 -8.351 -3.791 2.902 1.00 21.35 O ATOM 1736 CG2 THR A 177 -9.868 -5.628 3.148 1.00 21.55 C ATOM 1737 HG1 THR A 177 -7.707 -4.284 3.470 1.00 0.00 H ATOM 1738 H THR A 177 -9.868 -3.899 0.473 1.00 0.00 H ATOM 1739 N THR A 178 -10.299 -1.299 3.618 1.00 23.88 N ATOM 1740 CA THR A 178 -10.006 0.131 3.752 1.00 24.70 C ATOM 1741 C THR A 178 -8.525 0.415 3.674 1.00 24.17 C ATOM 1742 O THR A 178 -8.133 1.574 3.725 1.00 26.41 O ATOM 1743 CB THR A 178 -10.576 0.733 5.054 1.00 26.27 C ATOM 1744 OG1 THR A 178 -10.017 0.053 6.174 1.00 27.23 O ATOM 1745 CG2 THR A 178 -12.118 0.585 5.076 1.00 27.64 C ATOM 1746 HG1 THR A 178 -10.383 0.439 7.009 1.00 0.00 H ATOM 1747 H THR A 178 -10.505 -1.858 4.471 1.00 0.00 H ATOM 1748 N LYS A 179 -7.699 -0.624 3.550 1.00 23.04 N ATOM 1749 CA LYS A 179 -6.292 -0.440 3.186 1.00 23.22 C ATOM 1750 C LYS A 179 -6.037 -0.542 1.659 1.00 22.07 C ATOM 1751 O LYS A 179 -4.896 -0.579 1.218 1.00 21.17 O ATOM 1752 CB LYS A 179 -5.416 -1.420 3.952 1.00 23.46 C ATOM 1753 CG LYS A 179 -5.423 -1.162 5.444 1.00 24.42 C ATOM 1754 CD LYS A 179 -5.003 -2.384 6.232 1.00 25.94 C ATOM 1755 CE LYS A 179 -3.619 -2.866 5.847 1.00 26.08 C ATOM 1756 NZ LYS A 179 -3.412 -4.249 6.315 1.00 26.44 N ATOM 1757 HZ1 LYS A 179 -3.508 -4.282 7.350 1.00 0.00 H ATOM 1758 HZ2 LYS A 179 -4.123 -4.871 5.880 1.00 0.00 H ATOM 1759 HZ3 LYS A 179 -2.459 -4.566 6.044 1.00 0.00 H ATOM 1760 H LYS A 179 -8.061 -1.585 3.715 1.00 0.00 H ATOM 1761 N MET A 180 -7.105 -0.584 0.871 1.00 21.59 N ATOM 1762 CA MET A 180 -7.008 -0.601 -0.581 1.00 21.23 C ATOM 1763 C MET A 180 -7.778 0.551 -1.165 1.00 21.44 C ATOM 1764 O MET A 180 -8.703 1.047 -0.546 1.00 20.58 O ATOM 1765 CB MET A 180 -7.576 -1.905 -1.111 1.00 20.90 C ATOM 1766 CG MET A 180 -6.882 -3.142 -0.550 1.00 20.19 C ATOM 1767 SD MET A 180 -7.824 -4.636 -0.881 1.00 20.16 S ATOM 1768 CE MET A 180 -6.945 -5.755 0.193 1.00 20.57 C ATOM 1769 H MET A 180 -8.048 -0.606 1.309 1.00 0.00 H ATOM 1770 N LEU A 181 -7.375 0.994 -2.350 1.00 23.30 N ATOM 1771 CA LEU A 181 -8.146 1.991 -3.106 1.00 23.69 C ATOM 1772 C LEU A 181 -8.500 1.377 -4.438 1.00 22.23 C ATOM 1773 O LEU A 181 -7.671 0.738 -5.063 1.00 19.69 O ATOM 1774 CB LEU A 181 -7.352 3.254 -3.399 1.00 24.79 C ATOM 1775 CG LEU A 181 -6.696 4.034 -2.286 1.00 29.02 C ATOM 1776 CD1 LEU A 181 -5.991 5.220 -2.926 1.00 30.45 C ATOM 1777 CD2 LEU A 181 -7.699 4.515 -1.232 1.00 31.05 C ATOM 1778 H LEU A 181 -6.490 0.626 -2.754 1.00 0.00 H ATOM 1779 N CYS A 182 -9.731 1.601 -4.870 1.00 21.18 N ATOM 1780 CA CYS A 182 -10.140 1.237 -6.190 1.00 21.59 C ATOM 1781 C CYS A 182 -10.074 2.437 -7.095 1.00 20.11 C ATOM 1782 O CYS A 182 -10.293 3.569 -6.675 1.00 22.41 O ATOM 1783 CB CYS A 182 -11.559 0.709 -6.157 1.00 23.09 C ATOM 1784 SG CYS A 182 -11.706 -0.758 -5.134 1.00 24.04 S ATOM 1785 H CYS A 182 -10.418 2.053 -4.233 1.00 0.00 H ATOM 1786 N ALA A 183 -9.770 2.186 -8.345 1.00 18.80 N ATOM 1787 CA ALA A 183 -9.723 3.239 -9.323 1.00 19.20 C ATOM 1788 C ALA A 183 -10.068 2.611 -10.651 1.00 18.94 C ATOM 1789 O ALA A 183 -9.693 1.484 -10.909 1.00 18.68 O ATOM 1790 CB ALA A 183 -8.341 3.889 -9.352 1.00 19.38 C ATOM 1791 H ALA A 183 -9.559 1.209 -8.634 1.00 0.00 H ATOM 1792 N ALA A 184 -10.838 3.325 -11.463 1.00 20.53 N ATOM 1793 CA ALA A 184 -11.233 2.825 -12.776 1.00 21.95 C ATOM 1794 C ALA A 184 -11.693 3.956 -13.663 1.00 22.32 C ATOM 1795 O ALA A 184 -11.790 5.107 -13.240 1.00 21.23 O ATOM 1796 CB ALA A 184 -12.335 1.780 -12.644 1.00 22.03 C ATOM 1797 H ALA A 184 -11.167 4.263 -11.156 1.00 0.00 H ATOM 1798 N ASP A 185 -11.935 3.597 -14.913 1.00 24.62 N ATOM 1799 CA ASP A 185 -12.502 4.484 -15.911 1.00 24.86 C ATOM 1800 C ASP A 185 -14.026 4.327 -15.871 1.00 24.47 C ATOM 1801 O ASP A 185 -14.535 3.203 -15.919 1.00 23.79 O ATOM 1802 CB ASP A 185 -11.965 4.072 -17.287 1.00 26.77 C ATOM 1803 CG ASP A 185 -12.674 4.785 -18.434 1.00 28.41 C ATOM 1804 OD1 ASP A 185 -12.836 6.009 -18.382 1.00 31.35 O ATOM 1805 OD2 ASP A 185 -13.098 4.120 -19.379 1.00 33.10 O ATOM 1806 H ASP A 185 -11.706 2.623 -15.196 1.00 0.00 H ATOM 1807 N PRO A 185A -14.768 5.447 -15.805 1.00 26.02 N ATOM 1808 CA PRO A 185A -16.237 5.357 -15.841 1.00 26.50 C ATOM 1809 C PRO A 185A -16.810 4.549 -17.001 1.00 26.28 C ATOM 1810 O PRO A 185A -17.890 4.033 -16.889 1.00 29.50 O ATOM 1811 CB PRO A 185A -16.687 6.821 -15.934 1.00 25.70 C ATOM 1812 CG PRO A 185A -15.540 7.628 -15.437 1.00 25.70 C ATOM 1813 CD PRO A 185A -14.292 6.833 -15.622 1.00 25.66 C ATOM 1814 N GLN A 185B -16.080 4.424 -18.090 1.00 29.35 N ATOM 1815 CA GLN A 185B -16.532 3.699 -19.278 1.00 30.44 C ATOM 1816 C GLN A 185B -15.888 2.308 -19.383 1.00 28.60 C ATOM 1817 O GLN A 185B -16.153 1.585 -20.331 1.00 27.61 O ATOM 1818 CB GLN A 185B -16.154 4.522 -20.522 1.00 35.28 C ATOM 1819 CG GLN A 185B -17.312 4.943 -21.410 1.00 39.16 C ATOM 1820 CD GLN A 185B -18.477 5.508 -20.624 1.00 42.94 C ATOM 1821 OE1 GLN A 185B -19.614 5.085 -20.816 1.00 45.97 O ATOM 1822 NE2 GLN A 185B -18.201 6.441 -19.713 1.00 44.08 N ATOM 1823 HE22 GLN A 185B -17.223 6.769 -19.585 1.00 0.00 H ATOM 1824 HE21 GLN A 185B -18.964 6.841 -19.130 1.00 0.00 H ATOM 1825 H GLN A 185B -15.137 4.862 -18.106 1.00 0.00 H ATOM 1826 N TRP A 186 -15.021 1.959 -18.425 1.00 26.53 N ATOM 1827 CA TRP A 186 -14.343 0.664 -18.387 1.00 25.94 C ATOM 1828 C TRP A 186 -13.522 0.431 -19.624 1.00 26.73 C ATOM 1829 O TRP A 186 -13.416 -0.707 -20.086 1.00 26.50 O ATOM 1830 CB TRP A 186 -15.354 -0.483 -18.211 1.00 26.10 C ATOM 1831 CG TRP A 186 -16.337 -0.190 -17.148 1.00 25.36 C ATOM 1832 CD1 TRP A 186 -17.626 0.245 -17.311 1.00 26.25 C ATOM 1833 CD2 TRP A 186 -16.106 -0.237 -15.741 1.00 25.70 C ATOM 1834 NE1 TRP A 186 -18.215 0.452 -16.086 1.00 25.51 N ATOM 1835 CE2 TRP A 186 -17.305 0.164 -15.106 1.00 25.52 C ATOM 1836 CE3 TRP A 186 -15.008 -0.599 -14.948 1.00 26.05 C ATOM 1837 CZ2 TRP A 186 -17.437 0.201 -13.731 1.00 25.31 C ATOM 1838 CZ3 TRP A 186 -15.135 -0.545 -13.580 1.00 25.24 C ATOM 1839 CH2 TRP A 186 -16.338 -0.148 -12.981 1.00 25.38 C ATOM 1840 HE1 TRP A 186 -19.191 0.774 -15.930 1.00 0.00 H ATOM 1841 H TRP A 186 -14.819 2.644 -17.669 1.00 0.00 H ATOM 1842 N LYS A 187 -12.941 1.506 -20.156 1.00 26.98 N ATOM 1843 CA LYS A 187 -12.176 1.437 -21.405 1.00 29.35 C ATOM 1844 C LYS A 187 -10.678 1.430 -21.169 1.00 26.15 C ATOM 1845 O LYS A 187 -9.924 1.024 -22.044 1.00 26.10 O ATOM 1846 CB LYS A 187 -12.555 2.598 -22.356 1.00 32.84 C ATOM 1847 CG LYS A 187 -13.866 2.374 -23.101 1.00 37.98 C ATOM 1848 CD LYS A 187 -13.672 1.336 -24.208 1.00 44.79 C ATOM 1849 CE LYS A 187 -14.902 0.467 -24.469 1.00 49.20 C ATOM 1850 NZ LYS A 187 -15.820 1.035 -25.500 1.00 49.06 N ATOM 1851 HZ1 LYS A 187 -16.156 1.968 -25.187 1.00 0.00 H ATOM 1852 HZ2 LYS A 187 -15.309 1.134 -26.401 1.00 0.00 H ATOM 1853 HZ3 LYS A 187 -16.632 0.398 -25.628 1.00 0.00 H ATOM 1854 H LYS A 187 -13.033 2.421 -19.671 1.00 0.00 H ATOM 1855 N THR A 188 -10.250 1.875 -19.990 1.00 23.61 N ATOM 1856 CA THR A 188 -8.824 1.948 -19.673 1.00 21.39 C ATOM 1857 C THR A 188 -8.562 1.490 -18.227 1.00 20.47 C ATOM 1858 O THR A 188 -9.425 1.612 -17.346 1.00 19.52 O ATOM 1859 CB THR A 188 -8.273 3.373 -19.984 1.00 21.51 C ATOM 1860 OG1 THR A 188 -6.870 3.427 -19.740 1.00 20.55 O ATOM 1861 CG2 THR A 188 -8.965 4.449 -19.170 1.00 21.69 C ATOM 1862 HG1 THR A 188 -6.536 4.337 -19.942 1.00 0.00 H ATOM 1863 H THR A 188 -10.945 2.178 -19.278 1.00 0.00 H ATOM 1864 N ASP A 189 -7.378 0.923 -17.990 1.00 19.38 N ATOM 1865 CA ASP A 189 -7.101 0.233 -16.724 1.00 18.44 C ATOM 1866 C ASP A 189 -5.673 -0.238 -16.729 1.00 17.47 C ATOM 1867 O ASP A 189 -5.063 -0.395 -17.800 1.00 16.67 O ATOM 1868 CB ASP A 189 -8.010 -1.022 -16.570 1.00 18.97 C ATOM 1869 CG ASP A 189 -8.204 -1.467 -15.107 1.00 18.66 C ATOM 1870 OD1 ASP A 189 -7.642 -0.849 -14.177 1.00 17.61 O ATOM 1871 OD2 ASP A 189 -8.971 -2.442 -14.890 1.00 19.89 O ATOM 1872 H ASP A 189 -6.636 0.971 -18.717 1.00 0.00 H ATOM 1873 N SER A 190 -5.158 -0.521 -15.536 1.00 16.95 N ATOM 1874 CA SER A 190 -3.896 -1.249 -15.408 1.00 17.21 C ATOM 1875 C SER A 190 -4.167 -2.728 -15.739 1.00 16.68 C ATOM 1876 O SER A 190 -5.308 -3.173 -15.729 1.00 15.73 O ATOM 1877 CB SER A 190 -3.296 -1.074 -13.997 1.00 17.42 C ATOM 1878 OG SER A 190 -4.224 -1.447 -12.971 1.00 18.12 O ATOM 1879 HG SER A 190 -5.033 -0.880 -13.037 1.00 0.00 H ATOM 1880 H SER A 190 -5.662 -0.219 -14.678 1.00 0.00 H ATOM 1881 N CYS A 191 -3.127 -3.463 -16.101 1.00 17.60 N ATOM 1882 CA CYS A 191 -3.257 -4.887 -16.368 1.00 19.31 C ATOM 1883 C CYS A 191 -2.014 -5.627 -15.897 1.00 19.65 C ATOM 1884 O CYS A 191 -1.070 -5.024 -15.356 1.00 18.63 O ATOM 1885 CB CYS A 191 -3.504 -5.167 -17.862 1.00 21.06 C ATOM 1886 SG CYS A 191 -4.284 -6.780 -18.179 1.00 24.73 S ATOM 1887 H CYS A 191 -2.195 -3.012 -16.197 1.00 0.00 H ATOM 1888 N GLN A 192 -2.013 -6.940 -16.110 1.00 19.81 N ATOM 1889 CA GLN A 192 -0.883 -7.767 -15.692 1.00 20.21 C ATOM 1890 C GLN A 192 0.417 -7.183 -16.231 1.00 18.36 C ATOM 1891 O GLN A 192 0.502 -6.804 -17.409 1.00 19.86 O ATOM 1892 CB GLN A 192 -1.055 -9.237 -16.128 1.00 21.38 C ATOM 1893 CG GLN A 192 -0.034 -10.157 -15.464 1.00 22.99 C ATOM 1894 CD GLN A 192 -0.424 -11.632 -15.444 1.00 25.25 C ATOM 1895 OE1 GLN A 192 -1.604 -11.999 -15.578 1.00 27.22 O ATOM 1896 NE2 GLN A 192 0.578 -12.493 -15.264 1.00 27.13 N ATOM 1897 HE22 GLN A 192 1.551 -12.143 -15.156 1.00 0.00 H ATOM 1898 HE21 GLN A 192 0.386 -13.515 -15.231 1.00 0.00 H ATOM 1899 H GLN A 192 -2.827 -7.384 -16.580 1.00 0.00 H ATOM 1900 N GLY A 193 1.417 -7.100 -15.356 1.00 15.92 N ATOM 1901 CA GLY A 193 2.703 -6.473 -15.666 1.00 14.48 C ATOM 1902 C GLY A 193 2.816 -5.040 -15.147 1.00 13.81 C ATOM 1903 O GLY A 193 3.926 -4.505 -15.021 1.00 12.91 O ATOM 1904 H GLY A 193 1.278 -7.500 -14.406 1.00 0.00 H ATOM 1905 N ASP A 194 1.668 -4.412 -14.886 1.00 12.73 N ATOM 1906 CA ASP A 194 1.612 -3.063 -14.341 1.00 12.91 C ATOM 1907 C ASP A 194 1.717 -3.073 -12.801 1.00 13.08 C ATOM 1908 O ASP A 194 1.925 -2.015 -12.194 1.00 13.13 O ATOM 1909 CB ASP A 194 0.311 -2.371 -14.750 1.00 12.92 C ATOM 1910 CG ASP A 194 0.291 -1.994 -16.213 1.00 13.43 C ATOM 1911 OD1 ASP A 194 1.351 -1.562 -16.720 1.00 13.15 O ATOM 1912 OD2 ASP A 194 -0.783 -2.146 -16.851 1.00 13.31 O ATOM 1913 H ASP A 194 0.775 -4.908 -15.080 1.00 0.00 H ATOM 1914 N SER A 195 1.578 -4.250 -12.192 1.00 12.52 N ATOM 1915 CA SER A 195 1.681 -4.378 -10.741 1.00 13.23 C ATOM 1916 C SER A 195 2.930 -3.751 -10.189 1.00 13.75 C ATOM 1917 O SER A 195 3.994 -3.773 -10.812 1.00 13.25 O ATOM 1918 CB SER A 195 1.634 -5.839 -10.305 1.00 13.15 C ATOM 1919 OG SER A 195 0.326 -6.355 -10.454 1.00 13.83 O ATOM 1920 HG SER A 195 0.312 -7.303 -10.167 1.00 0.00 H ATOM 1921 H SER A 195 1.392 -5.098 -12.764 1.00 0.00 H ATOM 1922 N GLY A 196 2.791 -3.193 -8.990 1.00 14.64 N ATOM 1923 CA GLY A 196 3.904 -2.560 -8.299 1.00 14.76 C ATOM 1924 C GLY A 196 4.093 -1.115 -8.677 1.00 15.19 C ATOM 1925 O GLY A 196 4.728 -0.358 -7.957 1.00 15.20 O ATOM 1926 H GLY A 196 1.857 -3.210 -8.532 1.00 0.00 H ATOM 1927 N GLY A 197 3.535 -0.729 -9.816 1.00 15.61 N ATOM 1928 CA GLY A 197 3.740 0.590 -10.347 1.00 15.40 C ATOM 1929 C GLY A 197 2.885 1.585 -9.613 1.00 15.63 C ATOM 1930 O GLY A 197 2.070 1.200 -8.795 1.00 14.45 O ATOM 1931 H GLY A 197 2.934 -1.398 -10.338 1.00 0.00 H ATOM 1932 N PRO A 198 3.075 2.877 -9.924 1.00 15.88 N ATOM 1933 CA PRO A 198 2.471 3.994 -9.220 1.00 16.09 C ATOM 1934 C PRO A 198 1.041 4.357 -9.626 1.00 16.46 C ATOM 1935 O PRO A 198 0.718 4.349 -10.809 1.00 15.68 O ATOM 1936 CB PRO A 198 3.376 5.158 -9.610 1.00 16.10 C ATOM 1937 CG PRO A 198 3.791 4.801 -11.026 1.00 16.61 C ATOM 1938 CD PRO A 198 3.998 3.320 -10.987 1.00 15.86 C ATOM 1939 N LEU A 199 0.215 4.695 -8.628 1.00 16.99 N ATOM 1940 CA LEU A 199 -1.007 5.490 -8.832 1.00 17.20 C ATOM 1941 C LEU A 199 -0.712 6.883 -8.269 1.00 18.29 C ATOM 1942 O LEU A 199 -0.571 7.069 -7.033 1.00 17.72 O ATOM 1943 CB LEU A 199 -2.198 4.858 -8.132 1.00 16.77 C ATOM 1944 CG LEU A 199 -3.541 5.622 -8.177 1.00 16.92 C ATOM 1945 CD1 LEU A 199 -4.176 5.574 -9.552 1.00 16.27 C ATOM 1946 CD2 LEU A 199 -4.506 5.048 -7.154 1.00 16.44 C ATOM 1947 H LEU A 199 0.447 4.381 -7.664 1.00 0.00 H ATOM 1948 N VAL A 200 -0.549 7.845 -9.169 1.00 19.30 N ATOM 1949 CA VAL A 200 -0.129 9.195 -8.787 1.00 19.68 C ATOM 1950 C VAL A 200 -1.312 10.141 -8.849 1.00 21.29 C ATOM 1951 O VAL A 200 -2.013 10.193 -9.859 1.00 20.47 O ATOM 1952 CB VAL A 200 1.008 9.719 -9.659 1.00 19.77 C ATOM 1953 CG1 VAL A 200 1.304 11.189 -9.356 1.00 20.09 C ATOM 1954 CG2 VAL A 200 2.265 8.901 -9.430 1.00 20.18 C ATOM 1955 H VAL A 200 -0.724 7.634 -10.172 1.00 0.00 H ATOM 1956 N CYS A 201 -1.538 10.875 -7.753 1.00 22.37 N ATOM 1957 CA CYS A 201 -2.593 11.884 -7.705 1.00 23.95 C ATOM 1958 C CYS A 201 -1.983 13.237 -7.357 1.00 25.90 C ATOM 1959 O CYS A 201 -1.083 13.324 -6.509 1.00 26.40 O ATOM 1960 CB CYS A 201 -3.655 11.524 -6.671 1.00 24.41 C ATOM 1961 SG CYS A 201 -4.290 9.837 -6.818 1.00 24.18 S ATOM 1962 H CYS A 201 -0.946 10.723 -6.912 1.00 0.00 H ATOM 1963 N SER A 202 -2.443 14.275 -8.050 1.00 27.94 N ATOM 1964 CA SER A 202 -2.095 15.651 -7.723 1.00 31.65 C ATOM 1965 C SER A 202 -2.892 16.006 -6.490 1.00 33.06 C ATOM 1966 O SER A 202 -4.114 16.101 -6.540 1.00 33.63 O ATOM 1967 CB SER A 202 -2.417 16.614 -8.862 1.00 31.87 C ATOM 1968 OG SER A 202 -1.670 17.803 -8.687 1.00 34.16 O ATOM 1969 HG SER A 202 -1.875 18.432 -9.424 1.00 0.00 H ATOM 1970 H SER A 202 -3.075 14.097 -8.856 1.00 0.00 H ATOM 1971 N LEU A 203 -2.188 16.124 -5.374 1.00 35.15 N ATOM 1972 CA LEU A 203 -2.814 16.253 -4.074 1.00 38.30 C ATOM 1973 C LEU A 203 -2.261 17.527 -3.462 1.00 41.25 C ATOM 1974 O LEU A 203 -1.093 17.590 -3.092 1.00 37.50 O ATOM 1975 CB LEU A 203 -2.498 15.030 -3.214 1.00 39.94 C ATOM 1976 CG LEU A 203 -3.198 14.893 -1.864 1.00 40.70 C ATOM 1977 CD1 LEU A 203 -4.700 15.128 -1.969 1.00 40.85 C ATOM 1978 CD2 LEU A 203 -2.917 13.519 -1.267 1.00 41.45 C ATOM 1979 H LEU A 203 -1.150 16.124 -5.433 1.00 0.00 H ATOM 1980 N GLN A 204 -3.104 18.561 -3.450 1.00 45.71 N ATOM 1981 CA GLN A 204 -2.782 19.851 -2.858 1.00 48.75 C ATOM 1982 C GLN A 204 -1.535 20.407 -3.503 1.00 51.20 C ATOM 1983 O GLN A 204 -0.567 20.735 -2.818 1.00 53.86 O ATOM 1984 CB GLN A 204 -2.631 19.712 -1.340 1.00 50.77 C ATOM 1985 CG GLN A 204 -3.818 18.989 -0.719 1.00 50.63 C ATOM 1986 CD GLN A 204 -3.588 18.540 0.711 1.00 52.19 C ATOM 1987 OE1 GLN A 204 -2.711 19.057 1.413 1.00 56.34 O ATOM 1988 NE2 GLN A 204 -4.387 17.570 1.156 1.00 50.09 N ATOM 1989 HE22 GLN A 204 -5.111 17.165 0.529 1.00 0.00 H ATOM 1990 HE21 GLN A 204 -4.286 17.219 2.130 1.00 0.00 H ATOM 1991 H GLN A 204 -4.040 18.439 -3.886 1.00 0.00 H ATOM 1992 N GLY A 205 -1.571 20.482 -4.837 1.00 52.43 N ATOM 1993 CA GLY A 205 -0.472 21.016 -5.634 1.00 50.26 C ATOM 1994 C GLY A 205 0.596 20.007 -6.035 1.00 51.94 C ATOM 1995 O GLY A 205 1.195 20.130 -7.117 1.00 52.66 O ATOM 1996 H GLY A 205 -2.422 20.144 -5.330 1.00 0.00 H ATOM 1997 N ARG A 206 0.825 19.004 -5.182 1.00 46.51 N ATOM 1998 CA ARG A 206 2.004 18.143 -5.288 1.00 42.14 C ATOM 1999 C ARG A 206 1.681 16.731 -5.794 1.00 36.91 C ATOM 2000 O ARG A 206 0.788 16.062 -5.261 1.00 34.96 O ATOM 2001 CB ARG A 206 2.674 18.040 -3.919 1.00 44.83 C ATOM 2002 CG ARG A 206 4.138 17.653 -3.984 1.00 47.13 C ATOM 2003 CD ARG A 206 4.749 17.389 -2.609 1.00 51.29 C ATOM 2004 NE ARG A 206 4.817 18.568 -1.745 1.00 52.26 N ATOM 2005 CZ ARG A 206 5.645 18.708 -0.705 1.00 57.81 C ATOM 2006 NH1 ARG A 206 6.500 17.750 -0.392 1.00 64.64 N ATOM 2007 NH2 ARG A 206 5.631 19.817 0.030 1.00 58.08 N ATOM 2008 HE ARG A 206 4.173 19.356 -1.956 1.00 0.00 H ATOM 2009 HH12 ARG A 206 7.140 17.869 0.419 1.00 0.00 H ATOM 2010 HH11 ARG A 206 6.533 16.877 -0.957 1.00 0.00 H ATOM 2011 HH22 ARG A 206 6.280 19.914 0.837 1.00 0.00 H ATOM 2012 HH21 ARG A 206 4.971 20.586 -0.202 1.00 0.00 H ATOM 2013 H ARG A 206 0.142 18.829 -4.417 1.00 0.00 H ATOM 2014 N MET A 207 2.435 16.282 -6.797 1.00 31.36 N ATOM 2015 CA MET A 207 2.317 14.923 -7.316 1.00 30.03 C ATOM 2016 C MET A 207 2.642 13.924 -6.211 1.00 26.33 C ATOM 2017 O MET A 207 3.742 13.926 -5.669 1.00 26.57 O ATOM 2018 CB MET A 207 3.264 14.712 -8.511 1.00 31.40 C ATOM 2019 CG MET A 207 2.914 15.519 -9.758 1.00 33.94 C ATOM 2020 SD MET A 207 1.426 14.862 -10.537 1.00 40.19 S ATOM 2021 CE MET A 207 0.711 16.310 -11.296 1.00 43.07 C ATOM 2022 H MET A 207 3.133 16.923 -7.225 1.00 0.00 H ATOM 2023 N THR A 208 1.683 13.076 -5.869 1.00 24.08 N ATOM 2024 CA THR A 208 1.819 12.195 -4.704 1.00 22.24 C ATOM 2025 C THR A 208 1.592 10.745 -5.075 1.00 20.34 C ATOM 2026 O THR A 208 0.719 10.442 -5.877 1.00 21.19 O ATOM 2027 CB THR A 208 0.816 12.601 -3.595 1.00 22.52 C ATOM 2028 OG1 THR A 208 0.955 14.002 -3.338 1.00 23.61 O ATOM 2029 CG2 THR A 208 1.063 11.831 -2.306 1.00 21.87 C ATOM 2030 HG1 THR A 208 0.763 14.509 -4.166 1.00 0.00 H ATOM 2031 H THR A 208 0.814 13.034 -6.439 1.00 0.00 H ATOM 2032 N LEU A 209 2.379 9.851 -4.487 1.00 19.07 N ATOM 2033 CA LEU A 209 2.162 8.410 -4.638 1.00 18.24 C ATOM 2034 C LEU A 209 1.030 7.928 -3.741 1.00 18.28 C ATOM 2035 O LEU A 209 1.204 7.658 -2.537 1.00 18.56 O ATOM 2036 CB LEU A 209 3.440 7.623 -4.356 1.00 18.22 C ATOM 2037 CG LEU A 209 3.357 6.131 -4.690 1.00 18.06 C ATOM 2038 CD1 LEU A 209 3.386 5.911 -6.208 1.00 17.68 C ATOM 2039 CD2 LEU A 209 4.515 5.432 -4.016 1.00 18.05 C ATOM 2040 H LEU A 209 3.172 10.184 -3.902 1.00 0.00 H ATOM 2041 N THR A 210 -0.149 7.840 -4.328 1.00 17.72 N ATOM 2042 CA THR A 210 -1.330 7.513 -3.566 1.00 18.18 C ATOM 2043 C THR A 210 -1.588 6.005 -3.512 1.00 18.16 C ATOM 2044 O THR A 210 -2.024 5.478 -2.485 1.00 17.16 O ATOM 2045 CB THR A 210 -2.499 8.282 -4.150 1.00 18.49 C ATOM 2046 OG1 THR A 210 -2.289 9.671 -3.878 1.00 17.58 O ATOM 2047 CG2 THR A 210 -3.838 7.826 -3.580 1.00 18.79 C ATOM 2048 HG1 THR A 210 -2.240 9.811 -2.899 1.00 0.00 H ATOM 2049 H THR A 210 -0.228 8.008 -5.351 1.00 0.00 H ATOM 2050 N GLY A 211 -1.310 5.313 -4.613 1.00 17.27 N ATOM 2051 CA GLY A 211 -1.525 3.863 -4.663 1.00 16.98 C ATOM 2052 C GLY A 211 -0.366 3.129 -5.298 1.00 15.91 C ATOM 2053 O GLY A 211 0.494 3.747 -5.940 1.00 15.20 O ATOM 2054 H GLY A 211 -0.936 5.806 -5.449 1.00 0.00 H ATOM 2055 N ILE A 212 -0.353 1.817 -5.095 1.00 15.08 N ATOM 2056 CA ILE A 212 0.557 0.907 -5.791 1.00 14.91 C ATOM 2057 C ILE A 212 -0.332 -0.124 -6.449 1.00 14.17 C ATOM 2058 O ILE A 212 -1.160 -0.728 -5.763 1.00 13.78 O ATOM 2059 CB ILE A 212 1.498 0.158 -4.836 1.00 15.60 C ATOM 2060 CG1 ILE A 212 2.459 1.107 -4.130 1.00 15.85 C ATOM 2061 CG2 ILE A 212 2.312 -0.903 -5.576 1.00 15.98 C ATOM 2062 CD1 ILE A 212 3.006 0.484 -2.864 1.00 16.78 C ATOM 2063 H ILE A 212 -1.023 1.416 -4.407 1.00 0.00 H ATOM 2064 N VAL A 213 -0.161 -0.314 -7.759 1.00 13.17 N ATOM 2065 CA VAL A 213 -0.898 -1.336 -8.505 1.00 13.41 C ATOM 2066 C VAL A 213 -0.793 -2.690 -7.807 1.00 13.27 C ATOM 2067 O VAL A 213 0.314 -3.195 -7.587 1.00 12.64 O ATOM 2068 CB VAL A 213 -0.403 -1.501 -9.963 1.00 13.30 C ATOM 2069 CG1 VAL A 213 -1.300 -2.478 -10.723 1.00 13.22 C ATOM 2070 CG2 VAL A 213 -0.377 -0.174 -10.701 1.00 13.26 C ATOM 2071 H VAL A 213 0.520 0.285 -8.268 1.00 0.00 H ATOM 2072 N SER A 214 -1.947 -3.289 -7.484 1.00 13.66 N ATOM 2073 CA SER A 214 -1.967 -4.533 -6.686 1.00 13.97 C ATOM 2074 C SER A 214 -2.786 -5.681 -7.293 1.00 14.54 C ATOM 2075 O SER A 214 -2.248 -6.767 -7.520 1.00 15.20 O ATOM 2076 CB SER A 214 -2.432 -4.249 -5.241 1.00 13.72 C ATOM 2077 OG SER A 214 -2.464 -5.457 -4.491 1.00 13.93 O ATOM 2078 HG SER A 214 -1.558 -5.854 -4.469 1.00 0.00 H ATOM 2079 H SER A 214 -2.845 -2.871 -7.801 1.00 0.00 H ATOM 2080 N TRP A 215 -4.076 -5.474 -7.533 1.00 15.34 N ATOM 2081 CA TRP A 215 -4.916 -6.563 -8.069 1.00 16.04 C ATOM 2082 C TRP A 215 -6.186 -6.085 -8.770 1.00 16.64 C ATOM 2083 O TRP A 215 -6.436 -4.896 -8.853 1.00 16.16 O ATOM 2084 CB TRP A 215 -5.275 -7.576 -6.982 1.00 15.97 C ATOM 2085 CG TRP A 215 -6.097 -7.055 -5.825 1.00 16.03 C ATOM 2086 CD1 TRP A 215 -5.622 -6.429 -4.703 1.00 15.92 C ATOM 2087 CD2 TRP A 215 -7.508 -7.175 -5.645 1.00 15.34 C ATOM 2088 NE1 TRP A 215 -6.655 -6.143 -3.847 1.00 15.43 N ATOM 2089 CE2 TRP A 215 -7.822 -6.605 -4.395 1.00 15.84 C ATOM 2090 CE3 TRP A 215 -8.540 -7.722 -6.409 1.00 16.18 C ATOM 2091 CZ2 TRP A 215 -9.145 -6.529 -3.908 1.00 15.89 C ATOM 2092 CZ3 TRP A 215 -9.857 -7.655 -5.922 1.00 15.82 C ATOM 2093 CH2 TRP A 215 -10.141 -7.060 -4.687 1.00 15.72 C ATOM 2094 HE1 TRP A 215 -6.567 -5.656 -2.933 1.00 0.00 H ATOM 2095 H TRP A 215 -4.496 -4.542 -7.343 1.00 0.00 H ATOM 2096 N GLY A 216 -6.945 -7.040 -9.300 1.00 17.13 N ATOM 2097 CA GLY A 216 -8.221 -6.774 -9.926 1.00 19.20 C ATOM 2098 C GLY A 216 -8.672 -7.989 -10.730 1.00 20.87 C ATOM 2099 O GLY A 216 -7.846 -8.777 -11.188 1.00 21.11 O ATOM 2100 H GLY A 216 -6.605 -8.022 -9.262 1.00 0.00 H ATOM 2101 N ARG A 217 -9.986 -8.138 -10.890 1.00 23.25 N ATOM 2102 CA ARG A 217 -10.566 -9.183 -11.728 1.00 25.53 C ATOM 2103 C ARG A 217 -10.440 -8.736 -13.176 1.00 25.13 C ATOM 2104 O ARG A 217 -11.043 -7.738 -13.555 1.00 25.77 O ATOM 2105 CB ARG A 217 -12.032 -9.396 -11.352 1.00 28.72 C ATOM 2106 CG ARG A 217 -12.822 -10.318 -12.273 1.00 32.49 C ATOM 2107 CD ARG A 217 -12.351 -11.746 -12.181 1.00 37.21 C ATOM 2108 NE ARG A 217 -13.320 -12.663 -12.776 1.00 44.81 N ATOM 2109 CZ ARG A 217 -13.257 -13.995 -12.702 1.00 49.91 C ATOM 2110 NH1 ARG A 217 -12.258 -14.603 -12.062 1.00 51.08 N ATOM 2111 NH2 ARG A 217 -14.206 -14.730 -13.279 1.00 53.86 N ATOM 2112 HE ARG A 217 -14.119 -12.247 -13.296 1.00 0.00 H ATOM 2113 HH12 ARG A 217 -12.226 -15.641 -12.015 1.00 0.00 H ATOM 2114 HH11 ARG A 217 -11.511 -14.039 -11.610 1.00 0.00 H ATOM 2115 HH22 ARG A 217 -14.164 -15.768 -13.226 1.00 0.00 H ATOM 2116 HH21 ARG A 217 -14.989 -14.266 -13.783 1.00 0.00 H ATOM 2117 H ARG A 217 -10.625 -7.482 -10.397 1.00 0.00 H ATOM 2118 N GLY A 218 -9.648 -9.461 -13.974 1.00 23.68 N ATOM 2119 CA GLY A 218 -9.402 -9.109 -15.373 1.00 22.30 C ATOM 2120 C GLY A 218 -8.802 -7.718 -15.489 1.00 23.02 C ATOM 2121 O GLY A 218 -8.220 -7.209 -14.549 1.00 21.99 O ATOM 2122 H GLY A 218 -9.189 -10.309 -13.584 1.00 0.00 H ATOM 2123 N CYS A 220 -8.960 -7.102 -16.656 1.00 24.05 N ATOM 2124 CA CYS A 220 -8.454 -5.753 -16.933 1.00 24.95 C ATOM 2125 C CYS A 220 -9.515 -4.975 -17.715 1.00 25.04 C ATOM 2126 O CYS A 220 -9.992 -5.463 -18.729 1.00 24.90 O ATOM 2127 CB CYS A 220 -7.180 -5.855 -17.763 1.00 25.12 C ATOM 2128 SG CYS A 220 -5.909 -6.848 -16.944 1.00 25.64 S ATOM 2129 H CYS A 220 -9.469 -7.602 -17.412 1.00 0.00 H ATOM 2130 N ALA A 221 -9.878 -3.781 -17.241 1.00 24.26 N ATOM 2131 CA ALA A 221 -10.881 -2.951 -17.907 1.00 24.78 C ATOM 2132 C ALA A 221 -12.214 -3.704 -18.074 1.00 24.27 C ATOM 2133 O ALA A 221 -12.882 -3.571 -19.091 1.00 23.45 O ATOM 2134 CB ALA A 221 -10.368 -2.451 -19.263 1.00 24.29 C ATOM 2135 H ALA A 221 -9.433 -3.429 -16.369 1.00 0.00 H ATOM 2136 N LEU A 222 -12.558 -4.516 -17.081 1.00 25.22 N ATOM 2137 CA LEU A 222 -13.793 -5.303 -17.074 1.00 25.47 C ATOM 2138 C LEU A 222 -14.834 -4.511 -16.341 1.00 24.36 C ATOM 2139 O LEU A 222 -14.562 -3.958 -15.277 1.00 23.49 O ATOM 2140 CB LEU A 222 -13.616 -6.651 -16.353 1.00 26.16 C ATOM 2141 CG LEU A 222 -12.857 -7.788 -17.057 1.00 29.59 C ATOM 2142 CD1 LEU A 222 -13.041 -9.103 -16.298 1.00 29.23 C ATOM 2143 CD2 LEU A 222 -13.328 -7.941 -18.501 1.00 31.10 C ATOM 2144 H LEU A 222 -11.917 -4.597 -16.266 1.00 0.00 H ATOM 2145 N LYS A 223 -16.038 -4.474 -16.891 1.00 25.39 N ATOM 2146 CA LYS A 223 -17.144 -3.728 -16.264 1.00 25.91 C ATOM 2147 C LYS A 223 -17.355 -4.124 -14.782 1.00 25.10 C ATOM 2148 O LYS A 223 -17.438 -5.302 -14.431 1.00 24.14 O ATOM 2149 CB LYS A 223 -18.434 -3.940 -17.052 1.00 26.52 C ATOM 2150 CG LYS A 223 -19.585 -3.043 -16.624 1.00 28.36 C ATOM 2151 CD LYS A 223 -20.907 -3.497 -17.240 1.00 30.69 C ATOM 2152 CE LYS A 223 -21.953 -2.387 -17.178 1.00 34.31 C ATOM 2153 NZ LYS A 223 -23.228 -2.802 -17.846 1.00 36.97 N ATOM 2154 HZ1 LYS A 223 -23.039 -3.023 -18.844 1.00 0.00 H ATOM 2155 HZ2 LYS A 223 -23.610 -3.644 -17.369 1.00 0.00 H ATOM 2156 HZ3 LYS A 223 -23.918 -2.026 -17.787 1.00 0.00 H ATOM 2157 H LYS A 223 -16.207 -4.981 -17.783 1.00 0.00 H ATOM 2158 N ASP A 223A -17.428 -3.113 -13.930 1.00 23.82 N ATOM 2159 CA ASP A 223A -17.688 -3.279 -12.516 1.00 24.58 C ATOM 2160 C ASP A 223A -16.563 -3.979 -11.766 1.00 24.19 C ATOM 2161 O ASP A 223A -16.787 -4.546 -10.679 1.00 24.13 O ATOM 2162 CB ASP A 223A -19.015 -4.003 -12.286 1.00 26.22 C ATOM 2163 CG ASP A 223A -20.202 -3.191 -12.752 1.00 27.14 C ATOM 2164 OD1 ASP A 223A -20.058 -1.971 -12.922 1.00 27.94 O ATOM 2165 OD2 ASP A 223A -21.278 -3.775 -12.930 1.00 28.04 O ATOM 2166 H ASP A 223A -17.291 -2.149 -14.296 1.00 0.00 H ATOM 2167 N LYS A 224 -15.352 -3.914 -12.333 1.00 23.06 N ATOM 2168 CA LYS A 224 -14.176 -4.578 -11.752 1.00 21.12 C ATOM 2169 C LYS A 224 -13.015 -3.609 -11.819 1.00 19.69 C ATOM 2170 O LYS A 224 -12.152 -3.711 -12.702 1.00 20.34 O ATOM 2171 CB LYS A 224 -13.861 -5.895 -12.482 1.00 21.16 C ATOM 2172 CG LYS A 224 -15.009 -6.905 -12.498 1.00 22.27 C ATOM 2173 CD LYS A 224 -15.426 -7.315 -11.089 1.00 22.11 C ATOM 2174 CE LYS A 224 -16.641 -8.255 -11.104 1.00 22.48 C ATOM 2175 NZ LYS A 224 -17.187 -8.469 -9.738 1.00 21.55 N ATOM 2176 HZ1 LYS A 224 -16.453 -8.892 -9.135 1.00 0.00 H ATOM 2177 HZ2 LYS A 224 -17.483 -7.556 -9.338 1.00 0.00 H ATOM 2178 HZ3 LYS A 224 -18.006 -9.109 -9.789 1.00 0.00 H ATOM 2179 H LYS A 224 -15.239 -3.375 -13.215 1.00 0.00 H ATOM 2180 N PRO A 225 -12.983 -2.658 -10.879 1.00 18.65 N ATOM 2181 CA PRO A 225 -11.893 -1.695 -10.840 1.00 17.67 C ATOM 2182 C PRO A 225 -10.532 -2.312 -10.619 1.00 16.52 C ATOM 2183 O PRO A 225 -10.415 -3.471 -10.252 1.00 15.94 O ATOM 2184 CB PRO A 225 -12.236 -0.823 -9.625 1.00 17.97 C ATOM 2185 CG PRO A 225 -13.710 -0.976 -9.446 1.00 18.12 C ATOM 2186 CD PRO A 225 -14.018 -2.372 -9.861 1.00 18.49 C ATOM 2187 N GLY A 226 -9.499 -1.520 -10.842 1.00 16.10 N ATOM 2188 CA GLY A 226 -8.151 -1.895 -10.424 1.00 15.48 C ATOM 2189 C GLY A 226 -8.126 -1.607 -8.939 1.00 15.51 C ATOM 2190 O GLY A 226 -8.792 -0.665 -8.482 1.00 15.42 O ATOM 2191 H GLY A 226 -9.649 -0.611 -11.325 1.00 0.00 H ATOM 2192 N VAL A 227 -7.413 -2.429 -8.179 1.00 14.87 N ATOM 2193 CA VAL A 227 -7.281 -2.210 -6.748 1.00 15.17 C ATOM 2194 C VAL A 227 -5.808 -1.903 -6.439 1.00 16.07 C ATOM 2195 O VAL A 227 -4.896 -2.550 -6.981 1.00 15.48 O ATOM 2196 CB VAL A 227 -7.789 -3.417 -5.949 1.00 15.28 C ATOM 2197 CG1 VAL A 227 -7.880 -3.083 -4.467 1.00 15.69 C ATOM 2198 CG2 VAL A 227 -9.140 -3.881 -6.465 1.00 15.13 C ATOM 2199 H VAL A 227 -6.940 -3.246 -8.616 1.00 0.00 H ATOM 2200 N TYR A 228 -5.602 -0.926 -5.554 1.00 16.10 N ATOM 2201 CA TYR A 228 -4.309 -0.333 -5.295 1.00 16.72 C ATOM 2202 C TYR A 228 -4.016 -0.365 -3.797 1.00 17.97 C ATOM 2203 O TYR A 228 -4.909 -0.178 -2.973 1.00 18.65 O ATOM 2204 CB TYR A 228 -4.290 1.119 -5.809 1.00 17.08 C ATOM 2205 CG TYR A 228 -4.494 1.173 -7.303 1.00 16.94 C ATOM 2206 CD1 TYR A 228 -5.761 1.062 -7.858 1.00 16.95 C ATOM 2207 CD2 TYR A 228 -3.417 1.259 -8.154 1.00 17.19 C ATOM 2208 CE1 TYR A 228 -5.946 1.060 -9.227 1.00 17.31 C ATOM 2209 CE2 TYR A 228 -3.588 1.268 -9.527 1.00 17.87 C ATOM 2210 CZ TYR A 228 -4.855 1.162 -10.060 1.00 17.51 C ATOM 2211 OH TYR A 228 -5.003 1.152 -11.429 1.00 18.94 O ATOM 2212 HH TYR A 228 -5.963 1.071 -11.655 1.00 0.00 H ATOM 2213 H TYR A 228 -6.420 -0.570 -5.019 1.00 0.00 H ATOM 2214 N THR A 229 -2.761 -0.620 -3.452 1.00 18.17 N ATOM 2215 CA THR A 229 -2.324 -0.535 -2.078 1.00 18.68 C ATOM 2216 C THR A 229 -2.418 0.935 -1.647 1.00 20.04 C ATOM 2217 O THR A 229 -1.964 1.834 -2.366 1.00 19.17 O ATOM 2218 CB THR A 229 -0.917 -1.131 -1.928 1.00 18.25 C ATOM 2219 OG1 THR A 229 -0.988 -2.523 -2.265 1.00 17.53 O ATOM 2220 CG2 THR A 229 -0.382 -0.981 -0.509 1.00 18.21 C ATOM 2221 HG1 THR A 229 -0.090 -2.929 -2.175 1.00 0.00 H ATOM 2222 H THR A 229 -2.076 -0.887 -4.188 1.00 0.00 H ATOM 2223 N ARG A 230 -3.072 1.169 -0.506 1.00 20.97 N ATOM 2224 CA ARG A 230 -3.319 2.514 -0.028 1.00 23.05 C ATOM 2225 C ARG A 230 -2.078 2.978 0.720 1.00 23.22 C ATOM 2226 O ARG A 230 -1.881 2.654 1.884 1.00 22.39 O ATOM 2227 CB ARG A 230 -4.583 2.580 0.844 1.00 25.32 C ATOM 2228 CG ARG A 230 -4.918 3.974 1.364 1.00 29.01 C ATOM 2229 CD ARG A 230 -6.311 4.097 1.984 1.00 29.82 C ATOM 2230 NE ARG A 230 -6.398 3.481 3.314 1.00 35.21 N ATOM 2231 CZ ARG A 230 -5.881 3.968 4.463 1.00 37.23 C ATOM 2232 NH1 ARG A 230 -5.170 5.099 4.484 1.00 38.80 N ATOM 2233 NH2 ARG A 230 -6.039 3.294 5.609 1.00 34.51 N ATOM 2234 HE ARG A 230 -6.910 2.578 3.378 1.00 0.00 H ATOM 2235 HH12 ARG A 230 -4.783 5.453 5.382 1.00 0.00 H ATOM 2236 HH11 ARG A 230 -5.004 5.625 3.602 1.00 0.00 H ATOM 2237 HH22 ARG A 230 -5.640 3.670 6.493 1.00 0.00 H ATOM 2238 HH21 ARG A 230 -6.560 2.394 5.615 1.00 0.00 H ATOM 2239 H ARG A 230 -3.414 0.363 0.055 1.00 0.00 H ATOM 2240 N VAL A 231 -1.234 3.747 0.042 1.00 24.21 N ATOM 2241 CA VAL A 231 0.104 4.045 0.594 1.00 24.26 C ATOM 2242 C VAL A 231 0.020 4.788 1.943 1.00 24.54 C ATOM 2243 O VAL A 231 0.816 4.539 2.842 1.00 22.95 O ATOM 2244 CB VAL A 231 0.982 4.833 -0.397 1.00 22.62 C ATOM 2245 CG1 VAL A 231 2.341 5.174 0.225 1.00 22.70 C ATOM 2246 CG2 VAL A 231 1.194 4.035 -1.670 1.00 23.43 C ATOM 2247 H VAL A 231 -1.515 4.140 -0.879 1.00 0.00 H ATOM 2248 N SER A 232 -0.964 5.669 2.074 1.00 27.23 N ATOM 2249 CA SER A 232 -1.125 6.491 3.281 1.00 29.95 C ATOM 2250 C SER A 232 -1.360 5.685 4.561 1.00 32.11 C ATOM 2251 O SER A 232 -1.165 6.209 5.676 1.00 37.74 O ATOM 2252 CB SER A 232 -2.239 7.528 3.088 1.00 28.62 C ATOM 2253 OG SER A 232 -3.509 6.925 2.935 1.00 30.19 O ATOM 2254 HG SER A 232 -4.195 7.629 2.814 1.00 0.00 H ATOM 2255 H SER A 232 -1.644 5.781 1.296 1.00 0.00 H ATOM 2256 N HIS A 233 -1.766 4.425 4.412 1.00 32.07 N ATOM 2257 CA HIS A 233 -1.858 3.514 5.547 1.00 34.37 C ATOM 2258 C HIS A 233 -0.533 2.851 5.896 1.00 31.73 C ATOM 2259 O HIS A 233 -0.405 2.336 6.992 1.00 33.27 O ATOM 2260 CB HIS A 233 -2.915 2.411 5.325 1.00 39.93 C ATOM 2261 CG HIS A 233 -3.075 1.493 6.505 1.00 46.27 C ATOM 2262 ND1 HIS A 233 -2.290 0.372 6.693 1.00 48.78 N ATOM 2263 CD2 HIS A 233 -3.898 1.556 7.581 1.00 50.90 C ATOM 2264 CE1 HIS A 233 -2.630 -0.223 7.823 1.00 50.73 C ATOM 2265 NE2 HIS A 233 -3.607 0.474 8.380 1.00 53.58 N ATOM 2266 H HIS A 233 -2.023 4.083 3.464 1.00 0.00 H ATOM 2267 N PHE A 234 0.448 2.837 4.993 1.00 28.00 N ATOM 2268 CA PHE A 234 1.662 2.051 5.241 1.00 25.67 C ATOM 2269 C PHE A 234 2.855 2.915 5.605 1.00 24.21 C ATOM 2270 O PHE A 234 3.981 2.440 5.616 1.00 24.52 O ATOM 2271 CB PHE A 234 1.959 1.107 4.057 1.00 25.36 C ATOM 2272 CG PHE A 234 0.936 0.012 3.906 1.00 24.99 C ATOM 2273 CD1 PHE A 234 -0.256 0.252 3.229 1.00 25.66 C ATOM 2274 CD2 PHE A 234 1.125 -1.231 4.492 1.00 24.82 C ATOM 2275 CE1 PHE A 234 -1.220 -0.739 3.106 1.00 26.48 C ATOM 2276 CE2 PHE A 234 0.161 -2.223 4.377 1.00 25.35 C ATOM 2277 CZ PHE A 234 -1.019 -1.978 3.688 1.00 25.24 C ATOM 2278 H PHE A 234 0.353 3.383 4.113 1.00 0.00 H ATOM 2279 N LEU A 235 2.607 4.167 5.968 1.00 24.30 N ATOM 2280 CA LEU A 235 3.695 5.102 6.277 1.00 24.58 C ATOM 2281 C LEU A 235 4.563 4.664 7.438 1.00 26.06 C ATOM 2282 O LEU A 235 5.783 4.800 7.348 1.00 27.97 O ATOM 2283 CB LEU A 235 3.171 6.504 6.538 1.00 23.84 C ATOM 2284 CG LEU A 235 2.479 7.138 5.349 1.00 24.56 C ATOM 2285 CD1 LEU A 235 1.864 8.462 5.784 1.00 26.01 C ATOM 2286 CD2 LEU A 235 3.445 7.350 4.200 1.00 23.62 C ATOM 2287 H LEU A 235 1.621 4.492 6.035 1.00 0.00 H ATOM 2288 N PRO A 236 3.957 4.143 8.528 1.00 26.48 N ATOM 2289 CA PRO A 236 4.835 3.673 9.615 1.00 26.53 C ATOM 2290 C PRO A 236 5.686 2.478 9.189 1.00 25.32 C ATOM 2291 O PRO A 236 6.870 2.425 9.494 1.00 23.38 O ATOM 2292 CB PRO A 236 3.853 3.277 10.738 1.00 25.17 C ATOM 2293 CG PRO A 236 2.621 4.053 10.463 1.00 26.31 C ATOM 2294 CD PRO A 236 2.541 4.181 8.952 1.00 26.89 C ATOM 2295 N TRP A 237 5.069 1.519 8.501 1.00 26.14 N ATOM 2296 CA TRP A 237 5.824 0.422 7.881 1.00 25.27 C ATOM 2297 C TRP A 237 6.967 0.937 6.999 1.00 25.63 C ATOM 2298 O TRP A 237 8.105 0.463 7.111 1.00 25.89 O ATOM 2299 CB TRP A 237 4.914 -0.472 7.044 1.00 24.15 C ATOM 2300 CG TRP A 237 5.615 -1.678 6.548 1.00 24.51 C ATOM 2301 CD1 TRP A 237 5.818 -2.846 7.233 1.00 24.35 C ATOM 2302 CD2 TRP A 237 6.238 -1.850 5.264 1.00 24.17 C ATOM 2303 NE1 TRP A 237 6.527 -3.739 6.448 1.00 24.96 N ATOM 2304 CE2 TRP A 237 6.787 -3.154 5.233 1.00 24.68 C ATOM 2305 CE3 TRP A 237 6.370 -1.039 4.135 1.00 25.24 C ATOM 2306 CZ2 TRP A 237 7.466 -3.658 4.114 1.00 24.91 C ATOM 2307 CZ3 TRP A 237 7.050 -1.547 3.012 1.00 24.43 C ATOM 2308 CH2 TRP A 237 7.576 -2.842 3.014 1.00 24.77 C ATOM 2309 HE1 TRP A 237 6.816 -4.697 6.732 1.00 0.00 H ATOM 2310 H TRP A 237 4.034 1.547 8.401 1.00 0.00 H ATOM 2311 N ILE A 238 6.663 1.908 6.135 1.00 26.32 N ATOM 2312 CA ILE A 238 7.651 2.456 5.203 1.00 27.13 C ATOM 2313 C ILE A 238 8.768 3.190 5.944 1.00 29.26 C ATOM 2314 O ILE A 238 9.954 2.987 5.631 1.00 26.76 O ATOM 2315 CB ILE A 238 7.016 3.438 4.164 1.00 26.20 C ATOM 2316 CG1 ILE A 238 6.122 2.691 3.181 1.00 25.80 C ATOM 2317 CG2 ILE A 238 8.092 4.162 3.359 1.00 25.83 C ATOM 2318 CD1 ILE A 238 5.186 3.601 2.417 1.00 26.30 C ATOM 2319 H ILE A 238 5.695 2.287 6.123 1.00 0.00 H ATOM 2320 N ARG A 239 8.396 4.067 6.886 1.00 32.37 N ATOM 2321 CA ARG A 239 9.399 4.780 7.717 1.00 35.15 C ATOM 2322 C ARG A 239 10.354 3.846 8.486 1.00 33.88 C ATOM 2323 O ARG A 239 11.549 4.069 8.524 1.00 31.54 O ATOM 2324 CB ARG A 239 8.733 5.725 8.722 1.00 39.59 C ATOM 2325 CG ARG A 239 7.945 6.866 8.090 1.00 46.62 C ATOM 2326 CD ARG A 239 7.779 8.054 9.029 1.00 51.96 C ATOM 2327 NE ARG A 239 6.379 8.474 9.194 1.00 57.57 N ATOM 2328 CZ ARG A 239 5.646 9.136 8.292 1.00 56.00 C ATOM 2329 NH1 ARG A 239 6.141 9.456 7.096 1.00 57.74 N ATOM 2330 NH2 ARG A 239 4.394 9.474 8.590 1.00 52.13 N ATOM 2331 HE ARG A 239 5.917 8.234 10.094 1.00 0.00 H ATOM 2332 HH12 ARG A 239 5.552 9.971 6.411 1.00 0.00 H ATOM 2333 HH11 ARG A 239 7.116 9.191 6.849 1.00 0.00 H ATOM 2334 HH22 ARG A 239 3.815 9.989 7.896 1.00 0.00 H ATOM 2335 HH21 ARG A 239 3.994 9.223 9.517 1.00 0.00 H ATOM 2336 H ARG A 239 7.384 4.252 7.038 1.00 0.00 H ATOM 2337 N SER A 240 9.838 2.800 9.111 1.00 36.10 N ATOM 2338 CA SER A 240 10.719 1.929 9.904 1.00 37.93 C ATOM 2339 C SER A 240 11.656 1.088 9.028 1.00 38.77 C ATOM 2340 O SER A 240 12.780 0.808 9.432 1.00 39.36 O ATOM 2341 CB SER A 240 9.914 1.035 10.826 1.00 37.32 C ATOM 2342 OG SER A 240 8.723 0.638 10.193 1.00 41.82 O ATOM 2343 HG SER A 240 8.188 1.440 9.967 1.00 0.00 H ATOM 2344 H SER A 240 8.821 2.596 9.042 1.00 0.00 H ATOM 2345 N HIS A 241 11.209 0.699 7.834 1.00 36.53 N ATOM 2346 CA HIS A 241 12.023 -0.159 6.969 1.00 35.85 C ATOM 2347 C HIS A 241 12.974 0.569 6.045 1.00 37.43 C ATOM 2348 O HIS A 241 13.761 -0.080 5.381 1.00 42.58 O ATOM 2349 CB HIS A 241 11.131 -1.066 6.140 1.00 35.30 C ATOM 2350 CG HIS A 241 10.488 -2.146 6.938 1.00 33.90 C ATOM 2351 ND1 HIS A 241 9.251 -1.999 7.525 1.00 35.20 N ATOM 2352 CD2 HIS A 241 10.918 -3.384 7.264 1.00 32.44 C ATOM 2353 CE1 HIS A 241 8.935 -3.116 8.161 1.00 34.92 C ATOM 2354 NE2 HIS A 241 9.933 -3.968 8.023 1.00 33.36 N ATOM 2355 H HIS A 241 10.270 1.009 7.512 1.00 0.00 H ATOM 2356 N THR A 242 12.904 1.898 5.981 1.00 38.40 N ATOM 2357 CA THR A 242 13.810 2.665 5.135 1.00 39.16 C ATOM 2358 C THR A 242 15.036 3.122 5.910 1.00 43.68 C ATOM 2359 O THR A 242 15.937 3.753 5.355 1.00 45.07 O ATOM 2360 CB THR A 242 13.115 3.891 4.512 1.00 37.83 C ATOM 2361 OG1 THR A 242 12.224 4.474 5.467 1.00 36.67 O ATOM 2362 CG2 THR A 242 12.332 3.486 3.258 1.00 36.03 C ATOM 2363 OXT THR A 242 15.162 2.866 7.106 1.00 49.74 O ATOM 2364 HG1 THR A 242 11.542 3.807 5.730 1.00 0.00 H ATOM 2365 H THR A 242 12.188 2.398 6.546 1.00 0.00 H TER 2366 THR A 242 HETATM 2367 O HOH 1 -3.668 -4.677 2.804 1.00 23.66 O HETATM 2368 O HOH 2 -3.235 -11.428 -18.077 1.00 31.51 O HETATM 2369 O HOH 3 3.706 -0.366 -13.416 1.00 12.96 O HETATM 2370 O HOH 4 17.146 1.468 8.479 1.00 48.23 O HETATM 2371 O HOH 5 -11.650 -9.041 3.139 1.00 20.77 O HETATM 2372 O HOH 6 19.778 10.388 -15.775 1.00 18.44 O HETATM 2373 O HOH 7 13.526 -11.626 0.945 1.00 56.65 O HETATM 2374 O HOH 8 9.215 10.563 -1.444 1.00 21.61 O HETATM 2375 O HOH 9 -11.536 0.712 -15.843 1.00 20.56 O HETATM 2376 O HOH 10 21.269 7.505 -11.479 1.00 22.01 O HETATM 2377 O HOH 11 2.060 -2.410 8.007 1.00 25.44 O HETATM 2378 O HOH 12 17.383 7.195 0.254 1.00 28.11 O HETATM 2379 O HOH 13 11.693 -9.535 3.386 1.00 33.59 O HETATM 2380 O HOH 14 17.541 -8.292 1.645 1.00 34.34 O HETATM 2381 O HOH 15 -7.358 1.159 -12.497 1.00 18.47 O HETATM 2382 O HOH 16 -10.766 -5.176 -14.609 1.00 20.56 O HETATM 2383 O HOH 17 -10.417 -12.232 -2.922 1.00 15.42 O HETATM 2384 O HOH 18 19.974 -7.326 -7.443 1.00 20.14 O HETATM 2385 O HOH 19 -8.283 -11.523 -12.789 1.00 33.48 O HETATM 2386 O HOH 20 12.867 6.613 -13.628 1.00 16.70 O HETATM 2387 O HOH 21 -16.293 -5.087 -19.455 1.00 27.54 O HETATM 2388 O HOH 22 -4.691 -0.796 -25.210 1.00 29.15 O HETATM 2389 O HOH 23 2.696 -17.413 -3.682 1.00 30.54 O HETATM 2390 O HOH 24 6.144 -11.731 2.960 1.00 33.20 O HETATM 2391 O HOH 25 -14.422 5.520 -12.575 1.00 23.32 O HETATM 2392 O HOH 26 24.768 -0.918 -11.823 1.00 38.30 O HETATM 2393 O HOH 27 -17.547 -7.759 -15.672 1.00 29.43 O HETATM 2394 O HOH 28 -11.509 -1.603 -14.793 1.00 28.70 O HETATM 2395 O HOH 29 17.879 12.853 -17.920 1.00 33.42 O HETATM 2396 O HOH 30 -15.143 -10.453 -9.132 1.00 27.38 O HETATM 2397 O HOH 31 6.009 -9.608 -15.515 1.00 24.90 O HETATM 2398 O HOH 32 7.705 4.005 12.187 1.00 51.17 O HETATM 2399 O HOH 33 5.287 2.074 -6.723 1.00 14.43 O HETATM 2400 O HOH 34 4.882 10.817 4.451 1.00 35.55 O HETATM 2401 O HOH 35 1.526 -0.822 -20.684 1.00 15.97 O HETATM 2402 O HOH 36 -3.406 -8.984 -28.513 1.00 38.99 O HETATM 2403 O HOH 37 -2.620 10.164 -1.002 1.00 32.79 O HETATM 2404 O HOH 38 -15.636 3.107 -13.272 1.00 26.19 O HETATM 2405 O HOH 39 -10.071 -16.336 -0.930 1.00 30.78 O HETATM 2406 O HOH 40 -18.114 2.824 -12.012 1.00 30.79 O HETATM 2407 O HOH 41 -2.463 6.605 0.008 1.00 19.51 O HETATM 2408 O HOH 42 22.119 -7.827 -5.198 1.00 31.64 O HETATM 2409 O HOH 43 -17.929 -10.445 0.180 1.00 26.95 O HETATM 2410 O HOH 44 25.375 -7.674 -14.856 1.00 45.98 O HETATM 2411 O HOH 45 -11.654 2.605 -2.896 1.00 22.03 O HETATM 2412 O HOH 46 6.367 6.537 11.285 1.00 46.17 O HETATM 2413 O HOH 47 18.692 -17.658 -8.927 1.00 30.14 O HETATM 2414 O HOH 48 15.488 -14.993 0.092 1.00 27.16 O HETATM 2415 O HOH 49 -12.489 -3.222 -21.955 1.00 46.16 O HETATM 2416 O HOH 50 -20.929 1.084 -15.522 1.00 30.22 O HETATM 2417 O HOH 51 -20.247 -9.742 -1.066 1.00 37.39 O HETATM 2418 O HOH 52 12.481 3.464 -15.666 1.00 16.78 O HETATM 2419 O HOH 53 21.969 1.786 -1.659 1.00 30.08 O HETATM 2420 O HOH 54 -8.002 5.105 -23.082 1.00 34.71 O HETATM 2421 O HOH 55 18.890 16.308 -16.106 1.00 39.22 O HETATM 2422 O HOH 56 3.339 -3.211 10.211 1.00 41.32 O HETATM 2423 O HOH 57 12.002 11.202 -21.757 1.00 37.43 O HETATM 2424 O HOH 58 8.080 11.533 0.903 1.00 39.79 O HETATM 2425 O HOH 59 28.956 -4.010 -7.247 1.00 42.00 O HETATM 2426 O HOH 60 -15.191 -1.851 -22.132 1.00 50.31 O HETATM 2427 O HOH 61 -9.899 -8.928 -18.713 1.00 25.55 O HETATM 2428 O HOH 62 -0.669 -15.816 0.757 1.00 46.89 O HETATM 2429 O HOH 63 -6.154 -8.162 -13.012 1.00 28.02 O HETATM 2430 O HOH 64 16.646 8.692 -18.953 1.00 22.31 O HETATM 2431 O HOH 65 1.930 14.885 -0.879 1.00 37.14 O HETATM 2432 O HOH 66 -22.097 -0.591 -13.680 1.00 31.91 O HETATM 2433 O HOH 67 -9.252 15.410 -3.042 1.00 34.54 O HETATM 2434 O HOH 68 7.999 -6.795 -25.741 1.00 36.82 O HETATM 2435 O HOH 69 2.906 7.549 -12.390 1.00 28.09 O HETATM 2436 O HOH 70 -15.528 -10.817 -6.737 1.00 29.42 O HETATM 2437 O HOH 71 7.111 -6.313 7.341 1.00 32.41 O HETATM 2438 O HOH 72 18.390 -1.225 4.632 1.00 45.92 O HETATM 2439 O HOH 73 18.717 1.640 5.591 1.00 50.22 O HETATM 2440 O HOH 74 -10.461 -5.647 -21.671 1.00 38.73 O HETATM 2441 O HOH 75 -2.551 -4.391 -0.329 1.00 31.73 O HETATM 2442 O HOH 76 4.987 -2.002 -15.173 1.00 19.60 O HETATM 2443 O HOH 77 15.167 3.297 9.539 1.00 50.88 O HETATM 2444 O HOH 78 23.887 2.519 -15.253 1.00 39.71 O HETATM 2445 O HOH 79 14.248 14.026 -7.131 1.00 36.10 O HETATM 2446 O HOH 80 23.421 -23.261 -9.216 1.00 45.35 O HETATM 2447 O HOH 81 7.266 -9.112 -23.052 1.00 38.12 O HETATM 2448 O HOH 82 2.230 0.588 8.406 1.00 32.40 O HETATM 2449 O HOH 83 0.815 -14.312 -4.092 1.00 28.85 O HETATM 2450 O HOH 84 6.392 14.498 -5.788 1.00 32.99 O HETATM 2451 O HOH 85 5.280 -0.439 -28.096 1.00 39.88 O HETATM 2452 O HOH 86 22.875 6.646 -19.116 1.00 38.97 O HETATM 2453 O HOH 87 -5.801 -14.025 3.263 1.00 33.30 O HETATM 2454 O HOH 88 -9.076 4.483 2.698 1.00 39.78 O HETATM 2455 O HOH 89 1.468 -9.905 -27.773 1.00 34.55 O HETATM 2456 O HOH 90 8.241 -18.656 -12.680 1.00 42.98 O HETATM 2457 O HOH 91 -3.348 2.468 -26.078 1.00 35.83 O HETATM 2458 O HOH 92 7.933 -11.044 -18.780 1.00 38.40 O HETATM 2459 O HOH 93 23.867 3.289 -12.408 1.00 38.32 O HETATM 2460 O HOH 94 5.675 -11.630 -20.208 1.00 42.76 O HETATM 2461 O HOH 95 -20.245 -8.423 -11.965 1.00 36.03 O HETATM 2462 O HOH 96 26.796 -2.810 -5.801 1.00 37.42 O HETATM 2463 O HOH 97 3.453 12.298 -14.493 1.00 35.04 O HETATM 2464 O HOH 98 -8.250 -6.558 -23.393 1.00 42.54 O HETATM 2465 O HOH 99 0.874 -5.942 -24.721 1.00 35.96 O HETATM 2466 O HOH 100 -6.758 -10.058 -8.472 1.00 34.00 O HETATM 2467 O HOH 101 -5.950 -12.822 -8.585 1.00 38.71 O HETATM 2468 O HOH 102 6.285 -13.484 -6.990 1.00 13.95 O HETATM 2469 O HOH 103 3.272 -15.782 -12.976 1.00 29.12 O HETATM 2470 O HOH 104 -5.870 -11.492 -10.838 1.00 47.27 O HETATM 2471 O HOH 105 5.435 -13.056 -15.130 1.00 37.25 O HETATM 2472 N GLY A 106 3.728 -19.758 -14.107 1.00 0.24 N HETATM 2473 CA GLY A 106 2.972 -18.574 -13.610 1.00 0.05 C HETATM 2474 C GLY A 106 1.467 -18.697 -13.767 1.00 0.22 C HETATM 2475 O GLY A 106 0.955 -19.786 -14.056 1.00 -0.39 O HETATM 2476 N GLY A 106 0.758 -17.592 -13.514 1.00 -0.26 N HETATM 2477 CA GLY A 106 -0.702 -17.501 -13.766 1.00 0.13 C HETATM 2478 CB GLY A 106 -1.665 -17.101 -12.681 1.00 0.00 C HETATM 2479 CG GLY A 106 -1.160 -16.824 -11.287 1.00 0.03 C HETATM 2480 CD1 GLY A 106 -1.165 -18.027 -10.366 1.00 0.02 C HETATM 2481 SE GLY A 106 -0.983 -19.495 -11.120 1.00 -0.09 S HETATM 2482 SG GLY A 106 0.998 -19.689 -10.678 1.00 -0.09 S HETATM 2483 CB GLY A 106 1.525 -21.189 -11.545 1.00 0.04 C HETATM 2484 CA GLY A 106 2.440 -22.067 -10.712 1.00 0.14 C HETATM 2485 N GLY A 106 3.779 -21.473 -10.635 1.00 -0.26 N HETATM 2486 C GLY A 106 4.200 -20.947 -9.494 1.00 0.20 C HETATM 2487 CA GLY A 106 5.516 -20.195 -9.518 1.00 0.13 C HETATM 2488 N GLY A 106 5.185 -18.804 -9.254 1.00 -0.26 N HETATM 2489 C GLY A 106 5.123 -17.898 -10.222 1.00 0.21 C HETATM 2490 CA GLY A 106 4.684 -16.511 -9.777 1.00 0.14 C HETATM 2491 N GLY A 106 5.149 -15.496 -10.708 1.00 -0.26 N HETATM 2492 C GLY A 106 6.151 -14.667 -10.410 1.00 0.21 C HETATM 2493 CA GLY A 106 6.513 -13.635 -11.500 1.00 0.15 C HETATM 2494 N GLY A 106 5.295 -13.029 -12.086 1.00 -0.26 N HETATM 2495 C GLY A 106 4.432 -12.336 -11.350 1.00 0.20 C HETATM 2496 CA GLY A 106 3.365 -11.528 -12.104 1.00 0.13 C HETATM 2497 N GLY A 106 2.046 -11.739 -11.506 1.00 -0.26 N HETATM 2498 C GLY A 106 1.530 -12.962 -11.429 1.00 0.20 C HETATM 2499 CA GLY A 106 0.123 -13.105 -10.878 1.00 0.14 C HETATM 2500 N GLY A 106 -0.445 -11.874 -10.327 1.00 -0.26 N HETATM 2501 C GLY A 106 -0.565 -11.619 -9.023 1.00 0.20 C HETATM 2502 CA GLY A 106 -1.351 -10.375 -8.661 1.00 0.12 C HETATM 2503 N GLY A 106 -1.519 -9.476 -9.802 1.00 -0.27 N HETATM 2504 C GLY A 106 -2.718 -9.151 -10.269 1.00 0.20 C HETATM 2505 CA GLY A 106 -2.731 -8.317 -11.569 1.00 0.13 C HETATM 2506 N GLY A 106 -3.594 -8.980 -12.547 1.00 -0.26 N HETATM 2507 C GLY A 106 -3.366 -10.225 -12.933 1.00 0.20 C HETATM 2508 CA GLY A 106 -4.434 -10.830 -13.834 1.00 0.12 C HETATM 2509 N GLY A 106 -4.292 -12.270 -14.082 1.00 -0.27 N HETATM 2510 C GLY A 106 -5.323 -13.018 -14.486 1.00 0.20 C HETATM 2511 CA GLY A 106 -5.042 -14.494 -14.794 1.00 0.13 C HETATM 2512 N GLY A 106 -3.632 -14.756 -15.103 1.00 -0.26 N HETATM 2513 C GLY A 106 -3.123 -14.647 -16.328 1.00 0.20 C HETATM 2514 CA GLY A 106 -1.724 -15.228 -16.525 1.00 0.13 C HETATM 2515 N GLY A 106 -1.560 -16.406 -15.647 1.00 -0.26 N HETATM 2516 C GLY A 106 -0.645 -16.434 -14.672 1.00 0.20 C HETATM 2517 O GLY A 106 0.241 -15.562 -14.579 1.00 -0.39 O HETATM 2518 H GLY A 106 -2.148 -17.203 -15.786 1.00 0.19 H HETATM 2519 CB GLY A 106 -1.474 -15.590 -17.995 1.00 -0.02 C HETATM 2520 H GLY A 106 -1.603 -14.694 -18.620 1.00 0.03 H HETATM 2521 H GLY A 106 -2.191 -16.363 -18.309 1.00 0.03 H HETATM 2522 H GLY A 106 -0.449 -15.972 -18.109 1.00 0.03 H HETATM 2523 H GLY A 106 -0.986 -14.468 -16.230 1.00 0.08 H HETATM 2524 O GLY A 106 -3.704 -14.089 -17.245 1.00 -0.39 O HETATM 2525 H GLY A 106 -3.024 -15.030 -14.357 1.00 0.19 H HETATM 2526 CB GLY A 106 -5.499 -15.381 -13.623 1.00 -0.01 C HETATM 2527 CG GLY A 106 -5.246 -16.887 -13.803 1.00 -0.04 C HETATM 2528 CD1 GLY A 106 -5.674 -17.682 -12.584 1.00 -0.06 C HETATM 2529 H GLY A 106 -5.476 -18.750 -12.755 1.00 0.02 H HETATM 2530 H GLY A 106 -6.749 -17.532 -12.408 1.00 0.02 H HETATM 2531 H GLY A 106 -5.107 -17.340 -11.706 1.00 0.02 H HETATM 2532 CD2 GLY A 106 -5.947 -17.416 -15.045 1.00 -0.06 C HETATM 2533 H GLY A 106 -5.629 -16.833 -15.922 1.00 0.02 H HETATM 2534 H GLY A 106 -7.036 -17.324 -14.919 1.00 0.02 H HETATM 2535 H GLY A 106 -5.683 -18.474 -15.193 1.00 0.02 H HETATM 2536 H GLY A 106 -4.163 -17.030 -13.936 1.00 0.03 H HETATM 2537 H GLY A 106 -6.580 -15.232 -13.485 1.00 0.03 H HETATM 2538 H GLY A 106 -4.965 -15.052 -12.719 1.00 0.03 H HETATM 2539 H GLY A 106 -5.633 -14.766 -15.681 1.00 0.08 H HETATM 2540 O GLY A 106 -6.462 -12.572 -14.630 1.00 -0.39 O HETATM 2541 H GLY A 106 -3.401 -12.702 -13.945 1.00 0.19 H HETATM 2542 H GLY A 106 -5.414 -10.659 -13.364 1.00 0.08 H HETATM 2543 H GLY A 106 -4.397 -10.311 -14.803 1.00 0.08 H HETATM 2544 O GLY A 106 -2.371 -10.859 -12.583 1.00 -0.39 O HETATM 2545 H GLY A 106 -4.372 -8.482 -12.931 1.00 0.19 H HETATM 2546 CB GLY A 106 -3.202 -6.887 -11.329 1.00 -0.01 C HETATM 2547 CG GLY A 106 -3.130 -5.986 -12.559 1.00 -0.02 C HETATM 2548 CD GLY A 106 -4.137 -4.839 -12.464 1.00 0.06 C HETATM 2549 NE GLY A 106 -5.523 -5.226 -12.787 1.00 -0.27 N HETATM 2550 CZ GLY A 106 -6.528 -4.363 -12.968 1.00 0.29 C HETATM 2551 NH1 GLY A 106 -6.324 -3.061 -12.857 1.00 -0.28 N HETATM 2552 H GLY A 106 -7.104 -2.404 -12.998 1.00 0.26 H HETATM 2553 H GLY A 106 -5.385 -2.704 -12.629 1.00 0.26 H HETATM 2554 NH2 GLY A 106 -7.743 -4.794 -13.259 1.00 -0.28 N HETATM 2555 H GLY A 106 -7.923 -5.804 -13.350 1.00 0.26 H HETATM 2556 H GLY A 106 -8.510 -4.120 -13.395 1.00 0.26 H HETATM 2557 H GLY A 106 -5.731 -6.231 -12.880 1.00 0.26 H HETATM 2558 H GLY A 106 -3.827 -4.049 -13.163 1.00 0.07 H HETATM 2559 H GLY A 106 -4.118 -4.447 -11.436 1.00 0.07 H HETATM 2560 H GLY A 106 -3.351 -6.584 -13.455 1.00 0.03 H HETATM 2561 H GLY A 106 -2.116 -5.567 -12.638 1.00 0.03 H HETATM 2562 H GLY A 106 -2.574 -6.445 -10.541 1.00 0.03 H HETATM 2563 H GLY A 106 -4.247 -6.921 -10.988 1.00 0.03 H HETATM 2564 H GLY A 106 -1.707 -8.278 -11.968 1.00 0.08 H HETATM 2565 O GLY A 106 -3.768 -9.523 -9.734 1.00 -0.39 O HETATM 2566 H GLY A 106 -0.707 -9.095 -10.243 1.00 0.19 H HETATM 2567 H GLY A 106 -2.345 -10.677 -8.299 1.00 0.08 H HETATM 2568 H GLY A 106 -0.817 -9.838 -7.863 1.00 0.08 H HETATM 2569 O GLY A 106 -0.044 -12.294 -8.143 1.00 -0.39 O HETATM 2570 H GLY A 106 -0.764 -11.178 -10.970 1.00 0.19 H HETATM 2571 CB GLY A 106 -0.751 -13.612 -12.029 1.00 0.04 C HETATM 2572 SG GLY A 106 -2.404 -14.163 -11.544 1.00 -0.09 S HETATM 2573 SD2 GLY A 106 -2.092 -15.776 -10.360 1.00 -0.09 S HETATM 2574 H GLY A 106 -0.234 -14.459 -12.503 1.00 0.04 H HETATM 2575 H GLY A 106 -0.863 -12.796 -12.758 1.00 0.04 H HETATM 2576 H GLY A 106 0.140 -13.856 -10.075 1.00 0.08 H HETATM 2577 O GLY A 106 2.146 -13.963 -11.800 1.00 -0.39 O HETATM 2578 H GLY A 106 1.530 -10.959 -11.153 1.00 0.19 H HETATM 2579 CB GLY A 106 3.728 -10.046 -12.090 1.00 -0.00 C HETATM 2580 CG GLY A 106 2.808 -9.178 -12.934 1.00 0.00 C HETATM 2581 CD GLY A 106 1.657 -8.601 -12.170 1.00 0.04 C HETATM 2582 OE1 GLY A 106 1.342 -9.090 -11.056 1.00 -0.57 O HETATM 2583 OE2 GLY A 106 1.091 -7.621 -12.673 1.00 -0.57 O HETATM 2584 H GLY A 106 2.408 -9.792 -13.754 1.00 0.04 H HETATM 2585 H GLY A 106 3.399 -8.349 -13.351 1.00 0.04 H HETATM 2586 H GLY A 106 4.754 -9.937 -12.472 1.00 0.03 H HETATM 2587 H GLY A 106 3.684 -9.688 -11.051 1.00 0.03 H HETATM 2588 H GLY A 106 3.335 -11.873 -13.148 1.00 0.08 H HETATM 2589 O GLY A 106 4.446 -12.346 -10.120 1.00 -0.39 O HETATM 2590 H GLY A 106 5.117 -13.145 -13.063 1.00 0.19 H HETATM 2591 CB GLY A 106 7.417 -12.516 -10.918 1.00 0.08 C HETATM 2592 CG GLY A 106 8.852 -12.970 -10.648 1.00 0.18 C HETATM 2593 OD1 GLY A 106 9.433 -13.698 -11.441 1.00 -0.40 O HETATM 2594 ND2 GLY A 106 9.436 -12.509 -9.529 1.00 -0.30 N HETATM 2595 H GLY A 106 10.374 -12.777 -9.308 1.00 0.18 H HETATM 2596 H GLY A 106 8.933 -11.898 -8.918 1.00 0.18 H HETATM 2597 H GLY A 106 6.977 -12.170 -9.971 1.00 0.06 H HETATM 2598 H GLY A 106 7.445 -11.682 -11.635 1.00 0.06 H HETATM 2599 H GLY A 106 7.065 -14.154 -12.298 1.00 0.08 H HETATM 2600 O GLY A 106 6.742 -14.684 -9.316 1.00 -0.39 O HETATM 2601 H GLY A 106 4.704 -15.417 -11.600 1.00 0.19 H HETATM 2602 CB GLY A 106 3.163 -16.449 -9.611 1.00 0.01 C HETATM 2603 CG GLY A 106 2.721 -15.624 -8.446 1.00 -0.00 C HETATM 2604 ND1 GLY A 106 2.957 -14.266 -8.360 1.00 -0.33 N HETATM 2605 CE1 GLY A 106 2.472 -13.809 -7.218 1.00 0.09 C HETATM 2606 NE2 GLY A 106 1.929 -14.817 -6.560 1.00 -0.28 N HETATM 2607 CD2 GLY A 106 2.081 -15.966 -7.304 1.00 0.03 C HETATM 2608 H GLY A 106 1.748 -16.965 -7.025 1.00 0.07 H HETATM 2609 H GLY A 106 1.468 -14.754 -5.641 1.00 0.24 H HETATM 2610 H GLY A 106 2.513 -12.775 -6.877 1.00 0.12 H HETATM 2611 H GLY A 106 2.786 -17.473 -9.475 1.00 0.04 H HETATM 2612 H GLY A 106 2.731 -16.018 -10.526 1.00 0.04 H HETATM 2613 H GLY A 106 5.141 -16.308 -8.797 1.00 0.08 H HETATM 2614 O GLY A 106 5.416 -18.130 -11.393 1.00 -0.39 O HETATM 2615 H GLY A 106 4.998 -18.521 -8.313 1.00 0.19 H HETATM 2616 CB GLY A 106 6.454 -20.740 -8.446 1.00 -0.01 C HETATM 2617 CG GLY A 106 7.371 -21.850 -8.938 1.00 -0.02 C HETATM 2618 CD GLY A 106 7.950 -22.672 -7.790 1.00 0.06 C HETATM 2619 NE GLY A 106 8.014 -21.905 -6.559 1.00 -0.27 N HETATM 2620 CZ GLY A 106 8.878 -20.924 -6.314 1.00 0.29 C HETATM 2621 NH1 GLY A 106 9.789 -20.554 -7.216 1.00 -0.28 N HETATM 2622 H GLY A 106 10.447 -19.791 -7.001 1.00 0.26 H HETATM 2623 H GLY A 106 9.835 -21.031 -8.127 1.00 0.26 H HETATM 2624 NH2 GLY A 106 8.825 -20.298 -5.151 1.00 -0.28 N HETATM 2625 H GLY A 106 8.126 -20.576 -4.448 1.00 0.26 H HETATM 2626 H GLY A 106 9.483 -19.532 -4.948 1.00 0.26 H HETATM 2627 H GLY A 106 7.338 -22.139 -5.818 1.00 0.26 H HETATM 2628 H GLY A 106 8.966 -22.997 -8.061 1.00 0.07 H HETATM 2629 H GLY A 106 7.314 -23.555 -7.627 1.00 0.07 H HETATM 2630 H GLY A 106 8.200 -21.400 -9.504 1.00 0.03 H HETATM 2631 H GLY A 106 6.797 -22.518 -9.597 1.00 0.03 H HETATM 2632 H GLY A 106 5.844 -21.135 -7.620 1.00 0.03 H HETATM 2633 H GLY A 106 7.078 -19.912 -8.078 1.00 0.03 H HETATM 2634 H GLY A 106 5.994 -20.292 -10.504 1.00 0.08 H HETATM 2635 O GLY A 106 3.553 -21.030 -8.451 1.00 -0.39 O HETATM 2636 H GLY A 106 4.372 -21.465 -11.440 1.00 0.19 H HETATM 2637 C GLY A 106 2.475 -23.482 -11.248 1.00 0.20 C HETATM 2638 O GLY A 106 2.446 -23.718 -12.459 1.00 -0.39 O HETATM 2639 N GLY A 106 2.497 -24.417 -10.310 1.00 -0.26 N HETATM 2640 CA GLY A 106 2.778 -25.809 -10.598 1.00 0.13 C HETATM 2641 C GLY A 106 1.446 -26.467 -10.923 1.00 0.20 C HETATM 2642 O GLY A 106 1.257 -27.014 -12.005 1.00 -0.39 O HETATM 2643 N GLY A 106 0.490 -26.369 -9.962 1.00 -0.30 N HETATM 2644 H GLY A 106 -0.410 -26.779 -10.109 1.00 0.18 H HETATM 2645 H GLY A 106 0.687 -25.887 -9.108 1.00 0.18 H HETATM 2646 CB GLY A 106 3.442 -26.491 -9.388 1.00 -0.01 C HETATM 2647 CG GLY A 106 4.421 -25.715 -8.479 1.00 -0.04 C HETATM 2648 CD1 GLY A 106 5.444 -24.944 -9.304 1.00 -0.06 C HETATM 2649 H GLY A 106 6.125 -24.403 -8.631 1.00 0.02 H HETATM 2650 H GLY A 106 4.924 -24.225 -9.954 1.00 0.02 H HETATM 2651 H GLY A 106 6.021 -25.647 -9.922 1.00 0.02 H HETATM 2652 CD2 GLY A 106 3.732 -24.801 -7.460 1.00 -0.06 C HETATM 2653 H GLY A 106 3.001 -25.384 -6.880 1.00 0.02 H HETATM 2654 H GLY A 106 3.216 -23.986 -7.989 1.00 0.02 H HETATM 2655 H GLY A 106 4.485 -24.377 -6.779 1.00 0.02 H HETATM 2656 H GLY A 106 4.974 -26.469 -7.900 1.00 0.03 H HETATM 2657 H GLY A 106 3.998 -27.355 -9.781 1.00 0.03 H HETATM 2658 H GLY A 106 2.626 -26.844 -8.740 1.00 0.03 H HETATM 2659 H GLY A 106 3.451 -25.882 -11.465 1.00 0.08 H HETATM 2660 H GLY A 106 2.312 -24.151 -9.364 1.00 0.19 H HETATM 2661 H GLY A 106 2.032 -22.109 -9.691 1.00 0.08 H HETATM 2662 H GLY A 106 0.631 -21.771 -11.814 1.00 0.04 H HETATM 2663 H GLY A 106 2.060 -20.895 -12.460 1.00 0.04 H HETATM 2664 H GLY A 106 -2.123 -18.038 -9.826 1.00 0.04 H HETATM 2665 H GLY A 106 -0.341 -17.909 -9.647 1.00 0.04 H HETATM 2666 H GLY A 106 -0.139 -16.427 -11.388 1.00 0.04 H HETATM 2667 H GLY A 106 -2.402 -17.913 -12.596 1.00 0.03 H HETATM 2668 H GLY A 106 -2.167 -16.184 -13.024 1.00 0.03 H HETATM 2669 H GLY A 106 -1.065 -18.436 -14.219 1.00 0.08 H HETATM 2670 H GLY A 106 1.231 -16.794 -13.140 1.00 0.19 H HETATM 2671 H GLY A 106 3.308 -17.689 -14.170 1.00 0.11 H HETATM 2672 H GLY A 106 3.199 -18.441 -12.542 1.00 0.11 H HETATM 2673 H GLY A 106 4.715 -19.607 -13.972 1.00 0.20 H HETATM 2674 H GLY A 106 3.540 -19.889 -15.088 1.00 0.20 H HETATM 2675 H GLY A 106 3.440 -20.579 -13.597 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 307 306 439 CONECT 365 364 1079 CONECT 439 307 438 CONECT 1079 365 1078 CONECT 1310 1309 1961 CONECT 1627 1626 1784 CONECT 1784 1627 1783 CONECT 1886 1885 2128 CONECT 1961 1310 1960 CONECT 2128 1886 2127 CONECT 2472 2473 2673 2674 2675 CONECT 2473 2472 2474 2671 2672 CONECT 2474 2473 2475 2476 CONECT 2475 2474 CONECT 2476 2474 2477 2670 CONECT 2477 2476 2478 2516 2669 CONECT 2478 2477 2479 2667 2668 CONECT 2479 2478 2480 2573 2666 CONECT 2480 2479 2481 2664 2665 CONECT 2481 2480 2482 CONECT 2482 2481 2483 CONECT 2483 2482 2484 2662 2663 CONECT 2484 2483 2485 2637 2661 CONECT 2485 2484 2486 2636 CONECT 2486 2485 2487 2635 CONECT 2487 2486 2488 2616 2634 CONECT 2488 2487 2489 2615 CONECT 2489 2488 2490 2614 CONECT 2490 2489 2491 2602 2613 CONECT 2491 2490 2492 2601 CONECT 2492 2491 2493 2600 CONECT 2493 2492 2494 2591 2599 CONECT 2494 2493 2495 2590 CONECT 2495 2494 2496 2589 CONECT 2496 2495 2497 2579 2588 CONECT 2497 2496 2498 2578 CONECT 2498 2497 2499 2577 CONECT 2499 2498 2500 2571 2576 CONECT 2500 2499 2501 2570 CONECT 2501 2500 2502 2569 CONECT 2502 2501 2503 2567 2568 CONECT 2503 2502 2504 2566 CONECT 2504 2503 2505 2565 CONECT 2505 2504 2506 2546 2564 CONECT 2506 2505 2507 2545 CONECT 2507 2506 2508 2544 CONECT 2508 2507 2509 2542 2543 CONECT 2509 2508 2510 2541 CONECT 2510 2509 2511 2540 CONECT 2511 2510 2512 2526 2539 CONECT 2512 2511 2513 2525 CONECT 2513 2512 2514 2524 CONECT 2514 2513 2515 2519 2523 CONECT 2515 2514 2516 2518 CONECT 2516 2477 2515 2517 CONECT 2517 2516 CONECT 2518 2515 CONECT 2519 2514 2520 2521 2522 CONECT 2520 2519 CONECT 2521 2519 CONECT 2522 2519 CONECT 2523 2514 CONECT 2524 2513 CONECT 2525 2512 CONECT 2526 2511 2527 2537 2538 CONECT 2527 2526 2528 2532 2536 CONECT 2528 2527 2529 2530 2531 CONECT 2529 2528 CONECT 2530 2528 CONECT 2531 2528 CONECT 2532 2527 2533 2534 2535 CONECT 2533 2532 CONECT 2534 2532 CONECT 2535 2532 CONECT 2536 2527 CONECT 2537 2526 CONECT 2538 2526 CONECT 2539 2511 CONECT 2540 2510 CONECT 2541 2509 CONECT 2542 2508 CONECT 2543 2508 CONECT 2544 2507 CONECT 2545 2506 CONECT 2546 2505 2547 2562 2563 CONECT 2547 2546 2548 2560 2561 CONECT 2548 2547 2549 2558 2559 CONECT 2549 2548 2550 2557 CONECT 2550 2549 2551 2554 CONECT 2551 2550 2552 2553 CONECT 2552 2551 CONECT 2553 2551 CONECT 2554 2550 2555 2556 CONECT 2555 2554 CONECT 2556 2554 CONECT 2557 2549 CONECT 2558 2548 CONECT 2559 2548 CONECT 2560 2547 CONECT 2561 2547 CONECT 2562 2546 CONECT 2563 2546 CONECT 2564 2505 CONECT 2565 2504 CONECT 2566 2503 CONECT 2567 2502 CONECT 2568 2502 CONECT 2569 2501 CONECT 2570 2500 CONECT 2571 2499 2572 2574 2575 CONECT 2572 2571 2573 CONECT 2573 2479 2572 CONECT 2574 2571 CONECT 2575 2571 CONECT 2576 2499 CONECT 2577 2498 CONECT 2578 2497 CONECT 2579 2496 2580 2586 2587 CONECT 2580 2579 2581 2584 2585 CONECT 2581 2580 2582 2583 CONECT 2582 2581 CONECT 2583 2581 CONECT 2584 2580 CONECT 2585 2580 CONECT 2586 2579 CONECT 2587 2579 CONECT 2588 2496 CONECT 2589 2495 CONECT 2590 2494 CONECT 2591 2493 2592 2597 2598 CONECT 2592 2591 2593 2594 CONECT 2593 2592 CONECT 2594 2592 2595 2596 CONECT 2595 2594 CONECT 2596 2594 CONECT 2597 2591 CONECT 2598 2591 CONECT 2599 2493 CONECT 2600 2492 CONECT 2601 2491 CONECT 2602 2490 2603 2611 2612 CONECT 2603 2602 2604 2607 CONECT 2604 2603 2605 CONECT 2605 2604 2606 2610 CONECT 2606 2605 2607 2609 CONECT 2607 2603 2606 2608 CONECT 2608 2607 CONECT 2609 2606 CONECT 2610 2605 CONECT 2611 2602 CONECT 2612 2602 CONECT 2613 2490 CONECT 2614 2489 CONECT 2615 2488 CONECT 2616 2487 2617 2632 2633 CONECT 2617 2616 2618 2630 2631 CONECT 2618 2617 2619 2628 2629 CONECT 2619 2618 2620 2627 CONECT 2620 2619 2621 2624 CONECT 2621 2620 2622 2623 CONECT 2622 2621 CONECT 2623 2621 CONECT 2624 2620 2625 2626 CONECT 2625 2624 CONECT 2626 2624 CONECT 2627 2619 CONECT 2628 2618 CONECT 2629 2618 CONECT 2630 2617 CONECT 2631 2617 CONECT 2632 2616 CONECT 2633 2616 CONECT 2634 2487 CONECT 2635 2486 CONECT 2636 2485 CONECT 2637 2484 2638 2639 CONECT 2638 2637 CONECT 2639 2637 2640 2660 CONECT 2640 2639 2641 2646 2659 CONECT 2641 2640 2642 2643 CONECT 2642 2641 CONECT 2643 2641 2644 2645 CONECT 2644 2643 CONECT 2645 2643 CONECT 2646 2640 2647 2657 2658 CONECT 2647 2646 2648 2652 2656 CONECT 2648 2647 2649 2650 2651 CONECT 2649 2648 CONECT 2650 2648 CONECT 2651 2648 CONECT 2652 2647 2653 2654 2655 CONECT 2653 2652 CONECT 2654 2652 CONECT 2655 2652 CONECT 2656 2647 CONECT 2657 2646 CONECT 2658 2646 CONECT 2659 2640 CONECT 2660 2639 CONECT 2661 2484 CONECT 2662 2483 CONECT 2663 2483 CONECT 2664 2480 CONECT 2665 2480 CONECT 2666 2479 CONECT 2667 2478 CONECT 2668 2478 CONECT 2669 2477 CONECT 2670 2476 CONECT 2671 2473 CONECT 2672 2473 CONECT 2673 2472 CONECT 2674 2472 CONECT 2675 2472 MASTER 0 0 0 0 0 0 0 0 2674 1 218 19 END
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Related entries of code: 4os5
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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RCSB PDB
PDBbind
15aa, >4OS1_2|Chain... *
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PDBbind
15aa, >4OS4_2|Chain... at 100%
4os7
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PDBbind
15aa, >4OS7_2|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a37
RCSB PDB
PDBbind
15-mer
1eol
RCSB PDB
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15-mer
1j7z
RCSB PDB
PDBbind
15-mer
1j80
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PDBbind
15-mer
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RCSB PDB
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RCSB PDB
PDBbind
15-mer
1kc5
RCSB PDB
PDBbind
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1kcs
RCSB PDB
PDBbind
15-mer
1klg
RCSB PDB
PDBbind
15-mer
1klu
RCSB PDB
PDBbind
15-mer
1kna
RCSB PDB
PDBbind
15-mer
1kne
RCSB PDB
PDBbind
15-mer
1om9
RCSB PDB
PDBbind
15-mer
1t08
RCSB PDB
PDBbind
15-mer
1t79
RCSB PDB
PDBbind
15-mer
1t7f
RCSB PDB
PDBbind
15-mer
1t7r
RCSB PDB
PDBbind
15-mer
1tet
RCSB PDB
PDBbind
15-mer
1w70
RCSB PDB
PDBbind
15-mer
1xhm
RCSB PDB
PDBbind
15-mer
2aq9
RCSB PDB
PDBbind
15-mer
2auc
RCSB PDB
PDBbind
15-mer
2bba
RCSB PDB
PDBbind
15-mer
2co0
RCSB PDB
PDBbind
15-mer
2d1x
RCSB PDB
PDBbind
15-mer
2f6j
RCSB PDB
PDBbind
15-mer
2fsa
RCSB PDB
PDBbind
15-mer
2fuu
RCSB PDB
PDBbind
15-mer
2jk9
RCSB PDB
PDBbind
15-mer
2k00
RCSB PDB
PDBbind
15-mer
2ksp
RCSB PDB
PDBbind
15-mer
2kwn
RCSB PDB
PDBbind
15-mer
2l11
RCSB PDB
PDBbind
15-mer
2l12
RCSB PDB
PDBbind
15-mer
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RCSB PDB
PDBbind
15-mer
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RCSB PDB
PDBbind
15-mer
2lgf
RCSB PDB
PDBbind
15-mer
2ltx
RCSB PDB
PDBbind
15-mer
2lty
RCSB PDB
PDBbind
15-mer
2ltz
RCSB PDB
PDBbind
15-mer
2m41
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PDBbind
15-mer
2mwo
RCSB PDB
PDBbind
15-mer
2mwy
RCSB PDB
PDBbind
15-mer
2n9e
RCSB PDB
PDBbind
15-mer
2pmc
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PDBbind
15-mer
2rnw
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PDBbind
15-mer
2rny
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PDBbind
15-mer
2vwf
RCSB PDB
PDBbind
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2w0p
RCSB PDB
PDBbind
15-mer
2xxn
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PDBbind
15-mer
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PDBbind
15-mer
2z5t
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PDBbind
15-mer
3b95
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PDBbind
15-mer
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RCSB PDB
PDBbind
15-mer
3bu6
RCSB PDB
PDBbind
15-mer
3cfs
RCSB PDB
PDBbind
15-mer
3dab
RCSB PDB
PDBbind
15-mer
3fdt
RCSB PDB
PDBbind
15-mer
3ghe
RCSB PDB
PDBbind
15-mer
3gv6
RCSB PDB
PDBbind
15-mer
3h1z
RCSB PDB
PDBbind
15-mer
3h91
RCSB PDB
PDBbind
15-mer
3hqh
RCSB PDB
PDBbind
15-mer
3jpx
RCSB PDB
PDBbind
15-mer
3l3q
RCSB PDB
PDBbind
15-mer
3l6f
RCSB PDB
PDBbind
15-mer
3m17
RCSB PDB
PDBbind
15-mer
3o6l
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
15-mer
3qlc
RCSB PDB
PDBbind
15-mer
3qo2
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PDBbind
15-mer
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PDBbind
15-mer
3r93
RCSB PDB
PDBbind
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PDBbind
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RCSB PDB
PDBbind
15-mer
3uij
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15-mer
3wp0
RCSB PDB
PDBbind
15-mer
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RCSB PDB
PDBbind
15-mer
4b4n
RCSB PDB
PDBbind
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PDBbind
15-mer
4cy1
RCSB PDB
PDBbind
15-mer
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RCSB PDB
PDBbind
15-mer
4dx9
RCSB PDB
PDBbind
15-mer
4ezo
RCSB PDB
PDBbind
15-mer
4ft2
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PDBbind
15-mer
4gnf
RCSB PDB
PDBbind
15-mer
4gng
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PDBbind
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4hfz
RCSB PDB
PDBbind
15-mer
4iur
RCSB PDB
PDBbind
15-mer
4iut
RCSB PDB
PDBbind
15-mer
4iuu
RCSB PDB
PDBbind
15-mer
4iuv
RCSB PDB
PDBbind
15-mer
4j8s
RCSB PDB
PDBbind
15-mer
4k0u
RCSB PDB
PDBbind
15-mer
4n3w
RCSB PDB
PDBbind
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PDBbind
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4nb3
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PDBbind
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PDBbind
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PDBbind
15-mer
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PDBbind
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4o37
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15-mer
4o3u
RCSB PDB
PDBbind
15-mer
4o42
RCSB PDB
PDBbind
15-mer
4o45
RCSB PDB
PDBbind
15-mer
4os1
RCSB PDB
PDBbind
15-mer
4os4
RCSB PDB
PDBbind
15-mer
4os7
RCSB PDB
PDBbind
15-mer
4psx
RCSB PDB
PDBbind
15-mer
4r1e
RCSB PDB
PDBbind
15-mer
4r3s
RCSB PDB
PDBbind
15-mer
4rrv
RCSB PDB
PDBbind
15-mer
4u0a
RCSB PDB
PDBbind
15-mer
4u0b
RCSB PDB
PDBbind
15-mer
4u6x
RCSB PDB
PDBbind
15-mer
4u6y
RCSB PDB
PDBbind
15-mer
4xyn
RCSB PDB
PDBbind
15-mer
5cfa
RCSB PDB
PDBbind
15-mer
5cin
RCSB PDB
PDBbind
15-mer
5cqx
RCSB PDB
PDBbind
15-mer
5dif
RCSB PDB
PDBbind
15-mer
5epp
RCSB PDB
PDBbind
15-mer
5etf
RCSB PDB
PDBbind
15-mer
5fb0
RCSB PDB
PDBbind
15-mer
5fb1
RCSB PDB
PDBbind
15-mer
5h5q
RCSB PDB
PDBbind
15-mer
5h5r
RCSB PDB
PDBbind
15-mer
5ix1
RCSB PDB
PDBbind
15-mer
5izu
RCSB PDB
PDBbind
15-mer
5j19
RCSB PDB
PDBbind
15-mer
5j9k
RCSB PDB
PDBbind
15-mer
5jlz
RCSB PDB
PDBbind
15-mer
5ksu
RCSB PDB
PDBbind
15-mer
5ksv
RCSB PDB
PDBbind
15-mer
5kzp
RCSB PDB
PDBbind
15-mer
5lax
RCSB PDB
PDBbind
15-mer
5mlo
RCSB PDB
PDBbind
15-mer
5o45
RCSB PDB
PDBbind
15-mer
5svz
RCSB PDB
PDBbind
15-mer
5t1i
RCSB PDB
PDBbind
15-mer
5twg
RCSB PDB
PDBbind
15-mer
5u66
RCSB PDB
PDBbind
15-mer
5ul6
RCSB PDB
PDBbind
15-mer
5uwj
RCSB PDB
PDBbind
15-mer
5v4b
RCSB PDB
PDBbind
15-mer
5vb9
RCSB PDB
PDBbind
15-mer
5vzy
RCSB PDB
PDBbind
15-mer
5wir
RCSB PDB
PDBbind
15-mer
5ypo
RCSB PDB
PDBbind
15-mer
5znp
RCSB PDB
PDBbind
15-mer
5zuj
RCSB PDB
PDBbind
15-mer
6atv
RCSB PDB
PDBbind
15-mer
6b5m
RCSB PDB
PDBbind
15-mer
6b5o
RCSB PDB
PDBbind
15-mer
6b5r
RCSB PDB
PDBbind
15-mer
6b5t
RCSB PDB
PDBbind
15-mer
6biz
RCSB PDB
PDBbind
15-mer
6f0y
RCSB PDB
PDBbind
15-mer
6rmm
RCSB PDB
PDBbind
15-mer
6rml
RCSB PDB
PDBbind
15-mer
6q9t
RCSB PDB
PDBbind
15-mer
6hol
RCSB PDB
PDBbind
15-mer
6e5x
RCSB PDB
PDBbind
15-mer
6bnt
RCSB PDB
PDBbind
15-mer
5zk9
RCSB PDB
PDBbind
15-mer
5zjz
RCSB PDB
PDBbind
15-mer
5vtb
RCSB PDB
PDBbind
15-mer
6a5e
RCSB PDB
PDBbind
15-mer
Entry Information
PDB ID
4os5
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Urokinase-type plasminogen activator
Ligand Name
15-mer
EC.Number
E.C.3.4.21.73
Resolution
2.26(Å)
Affinity (Kd/Ki/IC50)
Ki=23.7uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Nat Chem Vol. 6: pp. 1009-1016
Ligand Properties
Formula
C
5
9
H
1
0
1
N
2
4
O
1
7
S
4
Molecular Weight
1546.840
Exact Mass
1545.670
No. of atoms
205
No. of bonds
207
Polar Surface Area
791.32
LOGP Value
-4.27 (
Computed with XLOGP3
)
-4.49 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 17
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 25
No. of Nitrogen and Oxygen Atoms: 41
No. of Rings: 3
Canonical SMILES
[NH3+]CC(=O)N[C@H]1C[C@@H]2CSSC[C@H](NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CSS2)NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)O)CC(=O)N)C(=O)N[C@H](C(=O)N)CC(C)C
InChI String
InChI=1S/C59H98N24O17S4/c1-27(2)14-35(47(62)90)79-57(100)41-24-102-101-23-31-17-38(75-43(85)19-60)53(96)73-29(5)48(91)80-36(15-28(3)4)50(93)71-21-44(86)74-32(8-6-12-68-58(63)64)49(92)70-22-45(87)76-40(25-103-104-31)56(99)78-34(10-11-46(88)89)52(95)82-39(18-42(61)84)55(98)81-37(16-30-20-67-26-72-30)54(97)77-33(51(94)83-41)9-7-13-69-59(65)66/h20,26-29,31-41H,6-19,21-25,60H2,1-5H3,(H2,61,84)(H2,62,90)(H,67,72)(H,70,92)(H,71,93)(H,73,96)(H,74,86)(H,75,85)(H,76,87)(H,77,97)(H,78,99)(H,79,100)(H,80,91)(H,81,98)(H,82,95)(H,83,94)(H,88,89)(H4,63,64,68)(H4,65,66,69)/p+3/t29-,31+,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00749
Entrez Gene ID
NCBI Entrez Gene ID:
5328
ASD
Information of known allosteric effects of PDB entries
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