Browse entries in the PDBbind-CN Database
HEADER 5WQK_COMPLEX COMPND 5WQK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 243 GLN LEU PHE ARG ALA LEU VAL SER ALA GLN TRP VAL ALA SEQRES 2 A 243 GLU ALA LEU LYS ALA PRO ARG SER SER GLN PRO LEU LYS SEQRES 3 A 243 LEU LEU ASP ALA SER TRP TYR LEU PRO LYS LEU GLY ARG SEQRES 4 A 243 ASP ALA ARG ARG GLU PHE GLU GLU ARG HIS ILE PRO GLY SEQRES 5 A 243 ALA ALA PHE PHE ASP ILE ASP ARG SER SER ASP HIS THR SEQRES 6 A 243 SER PRO TYR ASP HIS MET LEU PRO ASN ALA THR HIS PHE SEQRES 7 A 243 ALA ASP TYR ALA GLY SER LEU GLY VAL SER ALA ALA THR SEQRES 8 A 243 HIS VAL VAL ILE TYR ASP GLY SER ASP GLN GLY LEU TYR SEQRES 9 A 243 SER ALA PRO ARG VAL TRP TRP MET PHE ARG ALA PHE GLY SEQRES 10 A 243 HIS HIS SER VAL SER LEU LEU ASP GLY GLY PHE ARG HIS SEQRES 11 A 243 TRP LEU ASN GLN ASN LEU PRO ILE SER SER GLY LYS SER SEQRES 12 A 243 HIS SER GLU PRO ALA GLU PHE SER ALA GLN LEU ASP PRO SEQRES 13 A 243 SER PHE ILE LYS THR HIS GLU ASP ILE LEU GLU ASN LEU SEQRES 14 A 243 ASP ALA ARG ARG PHE GLN VAL VAL ASP ALA ARG ALA ALA SEQRES 15 A 243 GLY ARG PHE GLN GLY THR GLN PRO GLU PRO ARG ASP GLY SEQRES 16 A 243 ILE GLU PRO GLY HIS ILE PRO GLY SER VAL ASN ILE PRO SEQRES 17 A 243 PHE THR GLU PHE LEU THR ASN GLU GLY LEU GLU LYS SER SEQRES 18 A 243 PRO GLU GLU ILE LYS ARG LEU PHE LYS GLU LYS LYS VAL SEQRES 19 A 243 ASP LEU SER LYS PRO LEU VAL ALA THR SEQRES 1 A 49 GLY SER GLY VAL THR ALA SER HIS VAL VAL LEU GLY ALA SEQRES 2 A 49 PHE LEU SER GLY LYS SER ASP VAL PRO VAL TYR ASP GLY SEQRES 3 A 49 SER TRP VAL GLU TRP TYR MET ARG ALA GLN PRO GLU HIS SEQRES 4 A 49 ILE ILE SER GLU GLY ARG GLY LYS THR GLN HET NA A 1 1 HET NA A 2 1 HET UNN A 522 36 ATOM 1 N GLN A 5 19.875 7.233 12.313 1.00 26.69 N ATOM 2 CA GLN A 5 20.254 5.854 11.943 1.00 25.83 C ATOM 3 C GLN A 5 19.023 4.970 11.743 1.00 21.57 C ATOM 4 O GLN A 5 19.033 3.755 11.996 1.00 25.19 O ATOM 5 CB GLN A 5 21.262 5.236 12.936 1.00 31.65 C ATOM 6 CG GLN A 5 22.700 5.805 12.801 1.00 35.61 C ATOM 7 CD GLN A 5 23.298 5.811 11.366 1.00 38.05 C ATOM 8 OE1 GLN A 5 23.015 6.714 10.532 1.00 49.85 O ATOM 9 NE2 GLN A 5 24.173 4.852 11.096 1.00 34.85 N ATOM 10 HE22 GLN A 5 24.382 4.123 11.808 1.00 0.00 H ATOM 11 HE21 GLN A 5 24.650 4.829 10.172 1.00 0.00 H ATOM 12 HN3 GLN A 5 19.333 7.216 13.201 1.00 0.00 H ATOM 13 HN2 GLN A 5 19.292 7.646 11.557 1.00 0.00 H ATOM 14 HN1 GLN A 5 20.734 7.805 12.441 1.00 0.00 H ATOM 15 N LEU A 6 17.981 5.588 11.236 1.00 19.88 N ATOM 16 CA LEU A 6 16.833 4.847 10.744 1.00 19.20 C ATOM 17 C LEU A 6 16.387 5.356 9.406 1.00 15.81 C ATOM 18 O LEU A 6 16.374 6.541 9.139 1.00 15.27 O ATOM 19 CB LEU A 6 15.648 4.964 11.672 1.00 17.94 C ATOM 20 CG LEU A 6 15.831 4.514 13.133 1.00 17.51 C ATOM 21 CD1 LEU A 6 14.815 5.213 14.046 1.00 17.64 C ATOM 22 CD2 LEU A 6 15.795 2.976 13.164 1.00 17.60 C ATOM 23 H LEU A 6 17.978 6.627 11.186 1.00 0.00 H ATOM 24 N PHE A 7 15.936 4.427 8.568 1.00 13.13 N ATOM 25 CA PHE A 7 15.366 4.809 7.310 1.00 11.32 C ATOM 26 C PHE A 7 14.094 5.651 7.545 1.00 10.55 C ATOM 27 O PHE A 7 13.237 5.336 8.386 1.00 10.09 O ATOM 28 CB PHE A 7 15.097 3.566 6.443 1.00 10.20 C ATOM 29 CG PHE A 7 14.647 3.878 5.068 1.00 10.25 C ATOM 30 CD1 PHE A 7 15.577 3.892 4.039 1.00 11.31 C ATOM 31 CD2 PHE A 7 13.313 4.109 4.751 1.00 9.78 C ATOM 32 CE1 PHE A 7 15.218 4.226 2.721 1.00 11.41 C ATOM 33 CE2 PHE A 7 12.948 4.419 3.436 1.00 10.08 C ATOM 34 CZ PHE A 7 13.863 4.438 2.410 1.00 11.86 C ATOM 35 H PHE A 7 15.997 3.421 8.826 1.00 0.00 H ATOM 36 N ARG A 8 13.930 6.728 6.781 1.00 10.51 N ATOM 37 CA ARG A 8 12.822 7.632 7.055 1.00 11.46 C ATOM 38 C ARG A 8 11.473 6.945 7.042 1.00 10.28 C ATOM 39 O ARG A 8 11.115 6.288 6.060 1.00 10.98 O ATOM 40 CB ARG A 8 12.759 8.802 6.112 1.00 13.88 C ATOM 41 CG ARG A 8 12.534 8.547 4.616 1.00 17.89 C ATOM 42 CD ARG A 8 13.172 9.739 3.891 1.00 21.42 C ATOM 43 NE ARG A 8 13.014 9.721 2.452 1.00 22.56 N ATOM 44 CZ ARG A 8 13.771 9.065 1.573 1.00 27.11 C ATOM 45 NH1 ARG A 8 13.476 9.191 0.284 1.00 30.27 N ATOM 46 NH2 ARG A 8 14.769 8.248 1.933 1.00 27.06 N ATOM 47 HE ARG A 8 12.227 10.279 2.063 1.00 0.00 H ATOM 48 HH12 ARG A 8 14.045 8.694 -0.431 1.00 0.00 H ATOM 49 HH11 ARG A 8 12.676 9.787 -0.011 1.00 0.00 H ATOM 50 HH22 ARG A 8 15.330 7.760 1.206 1.00 0.00 H ATOM 51 HH21 ARG A 8 14.984 8.102 2.940 1.00 0.00 H ATOM 52 H ARG A 8 14.586 6.922 5.997 1.00 0.00 H ATOM 53 N ALA A 9 10.665 7.258 8.027 1.00 9.10 N ATOM 54 CA ALA A 9 9.334 6.661 8.108 1.00 8.77 C ATOM 55 C ALA A 9 8.252 7.428 7.401 1.00 8.60 C ATOM 56 O ALA A 9 7.156 6.850 7.140 1.00 7.84 O ATOM 57 CB ALA A 9 8.933 6.405 9.567 1.00 9.22 C ATOM 58 H ALA A 9 10.974 7.935 8.754 1.00 0.00 H ATOM 59 N LEU A 10 8.462 8.712 7.188 1.00 8.58 N ATOM 60 CA LEU A 10 7.488 9.578 6.523 1.00 9.38 C ATOM 61 C LEU A 10 8.084 10.235 5.290 1.00 10.95 C ATOM 62 O LEU A 10 9.231 10.724 5.336 1.00 12.37 O ATOM 63 CB LEU A 10 6.933 10.712 7.454 1.00 9.72 C ATOM 64 CG LEU A 10 6.128 10.284 8.641 1.00 9.47 C ATOM 65 CD1 LEU A 10 5.715 11.460 9.533 1.00 9.80 C ATOM 66 CD2 LEU A 10 4.907 9.537 8.136 1.00 9.38 C ATOM 67 H LEU A 10 9.360 9.128 7.507 1.00 0.00 H ATOM 68 N VAL A 11 7.308 10.243 4.197 1.00 10.92 N ATOM 69 CA VAL A 11 7.585 11.094 3.053 1.00 11.02 C ATOM 70 C VAL A 11 6.331 11.917 2.801 1.00 10.91 C ATOM 71 O VAL A 11 5.192 11.526 3.157 1.00 9.47 O ATOM 72 CB VAL A 11 7.944 10.364 1.785 1.00 10.46 C ATOM 73 CG1 VAL A 11 9.234 9.532 1.943 1.00 10.95 C ATOM 74 CG2 VAL A 11 6.798 9.437 1.427 1.00 10.80 C ATOM 75 H VAL A 11 6.478 9.617 4.167 1.00 0.00 H ATOM 76 N SER A 12 6.512 13.082 2.151 1.00 11.33 N ATOM 77 CA SER A 12 5.419 14.009 1.966 1.00 11.77 C ATOM 78 C SER A 12 4.742 13.774 0.600 1.00 11.03 C ATOM 79 O SER A 12 5.323 13.159 -0.313 1.00 10.68 O ATOM 80 CB SER A 12 5.909 15.463 1.935 1.00 13.02 C ATOM 81 OG SER A 12 6.870 15.600 0.888 1.00 13.77 O ATOM 82 HG SER A 12 6.449 15.368 0.023 1.00 0.00 H ATOM 83 H SER A 12 7.453 13.318 1.776 1.00 0.00 H ATOM 84 N ALA A 13 3.535 14.280 0.425 1.00 11.61 N ATOM 85 CA ALA A 13 2.883 14.171 -0.871 1.00 12.30 C ATOM 86 C ALA A 13 3.751 14.848 -1.989 1.00 13.54 C ATOM 87 O ALA A 13 3.885 14.339 -3.125 1.00 11.43 O ATOM 88 CB ALA A 13 1.528 14.815 -0.803 1.00 13.82 C ATOM 89 H ALA A 13 3.051 14.756 1.213 1.00 0.00 H ATOM 90 N GLN A 14 4.299 16.008 -1.661 1.00 15.66 N ATOM 91 CA GLN A 14 5.224 16.687 -2.575 1.00 18.12 C ATOM 92 C GLN A 14 6.428 15.845 -2.966 1.00 15.65 C ATOM 93 O GLN A 14 6.802 15.823 -4.147 1.00 16.50 O ATOM 94 CB GLN A 14 5.695 18.002 -1.934 1.00 22.99 C ATOM 95 CG GLN A 14 6.305 18.953 -2.919 1.00 29.99 C ATOM 96 CD GLN A 14 7.369 19.832 -2.268 1.00 38.45 C ATOM 97 OE1 GLN A 14 7.132 20.487 -1.218 1.00 42.24 O ATOM 98 NE2 GLN A 14 8.570 19.833 -2.869 1.00 41.15 N ATOM 99 HE22 GLN A 14 8.719 19.276 -3.735 1.00 0.00 H ATOM 100 HE21 GLN A 14 9.351 20.390 -2.469 1.00 0.00 H ATOM 101 H GLN A 14 4.071 16.443 -0.744 1.00 0.00 H ATOM 102 N TRP A 15 7.044 15.181 -1.989 1.00 15.29 N ATOM 103 CA TRP A 15 8.154 14.286 -2.276 1.00 16.02 C ATOM 104 C TRP A 15 7.698 13.198 -3.264 1.00 14.29 C ATOM 105 O TRP A 15 8.441 12.805 -4.220 1.00 16.55 O ATOM 106 CB TRP A 15 8.700 13.621 -0.991 1.00 18.86 C ATOM 107 CG TRP A 15 9.906 12.752 -1.322 1.00 21.62 C ATOM 108 CD1 TRP A 15 11.182 13.168 -1.422 1.00 23.03 C ATOM 109 CD2 TRP A 15 9.907 11.353 -1.637 1.00 21.75 C ATOM 110 NE1 TRP A 15 11.997 12.118 -1.769 1.00 26.25 N ATOM 111 CE2 TRP A 15 11.237 10.987 -1.904 1.00 25.13 C ATOM 112 CE3 TRP A 15 8.920 10.400 -1.779 1.00 20.31 C ATOM 113 CZ2 TRP A 15 11.604 9.691 -2.259 1.00 24.72 C ATOM 114 CZ3 TRP A 15 9.286 9.118 -2.121 1.00 21.10 C ATOM 115 CH2 TRP A 15 10.613 8.776 -2.367 1.00 22.30 C ATOM 116 HE1 TRP A 15 13.026 12.173 -1.907 1.00 0.00 H ATOM 117 H TRP A 15 6.726 15.304 -1.006 1.00 0.00 H ATOM 118 N VAL A 16 6.502 12.648 -3.029 1.00 13.02 N ATOM 119 CA VAL A 16 6.021 11.541 -3.884 1.00 12.99 C ATOM 120 C VAL A 16 5.765 12.012 -5.333 1.00 13.84 C ATOM 121 O VAL A 16 6.160 11.364 -6.277 1.00 12.99 O ATOM 122 CB VAL A 16 4.777 10.830 -3.257 1.00 12.90 C ATOM 123 CG1 VAL A 16 4.096 9.809 -4.206 1.00 13.18 C ATOM 124 CG2 VAL A 16 5.268 10.105 -2.017 1.00 13.30 C ATOM 125 H VAL A 16 5.912 12.998 -2.247 1.00 0.00 H ATOM 126 N ALA A 17 5.037 13.111 -5.472 1.00 13.61 N ATOM 127 CA ALA A 17 4.749 13.697 -6.769 1.00 14.47 C ATOM 128 C ALA A 17 6.069 13.963 -7.555 1.00 17.27 C ATOM 129 O ALA A 17 6.161 13.707 -8.774 1.00 18.18 O ATOM 130 CB ALA A 17 3.923 14.943 -6.562 1.00 14.82 C ATOM 131 H ALA A 17 4.658 13.571 -4.620 1.00 0.00 H ATOM 132 N GLU A 18 7.097 14.369 -6.853 1.00 18.31 N ATOM 133 CA GLU A 18 8.402 14.648 -7.523 1.00 20.54 C ATOM 134 C GLU A 18 9.056 13.390 -7.980 1.00 21.74 C ATOM 135 O GLU A 18 9.547 13.293 -9.128 1.00 20.99 O ATOM 136 CB GLU A 18 9.282 15.478 -6.631 1.00 23.62 C ATOM 137 CG GLU A 18 8.803 16.932 -6.788 1.00 28.64 C ATOM 138 CD GLU A 18 9.394 17.935 -5.794 1.00 34.67 C ATOM 139 OE1 GLU A 18 10.443 17.655 -5.134 1.00 43.01 O ATOM 140 OE2 GLU A 18 8.797 19.034 -5.708 1.00 38.76 O ATOM 141 H GLU A 18 7.004 14.498 -5.825 1.00 0.00 H ATOM 142 N ALA A 19 8.998 12.383 -7.126 1.00 17.69 N ATOM 143 CA ALA A 19 9.547 11.064 -7.483 1.00 18.57 C ATOM 144 C ALA A 19 8.855 10.417 -8.653 1.00 19.96 C ATOM 145 O ALA A 19 9.485 9.777 -9.493 1.00 21.67 O ATOM 146 CB ALA A 19 9.543 10.163 -6.265 1.00 18.49 C ATOM 147 H ALA A 19 8.560 12.523 -6.193 1.00 0.00 H ATOM 148 N LEU A 20 7.564 10.653 -8.795 1.00 19.78 N ATOM 149 CA LEU A 20 6.815 10.090 -9.917 1.00 20.40 C ATOM 150 C LEU A 20 7.325 10.681 -11.239 1.00 24.36 C ATOM 151 O LEU A 20 7.354 9.994 -12.270 1.00 26.02 O ATOM 152 CB LEU A 20 5.322 10.403 -9.722 1.00 21.56 C ATOM 153 CG LEU A 20 4.674 9.579 -8.590 1.00 20.74 C ATOM 154 CD1 LEU A 20 3.208 9.952 -8.425 1.00 21.80 C ATOM 155 CD2 LEU A 20 4.812 8.070 -8.808 1.00 22.81 C ATOM 156 H LEU A 20 7.072 11.248 -8.098 1.00 0.00 H ATOM 157 N LYS A 21 7.726 11.941 -11.183 1.00 24.23 N ATOM 158 CA LYS A 21 8.322 12.644 -12.343 1.00 26.74 C ATOM 159 C LYS A 21 9.847 12.424 -12.534 1.00 28.23 C ATOM 160 O LYS A 21 10.352 12.658 -13.609 1.00 32.89 O ATOM 161 CB LYS A 21 8.019 14.132 -12.232 1.00 26.68 C ATOM 162 CG LYS A 21 6.573 14.461 -12.536 1.00 30.84 C ATOM 163 CD LYS A 21 6.220 15.895 -12.165 1.00 33.85 C ATOM 164 CE LYS A 21 4.758 16.221 -12.489 1.00 36.81 C ATOM 165 NZ LYS A 21 4.524 17.690 -12.665 1.00 40.91 N ATOM 166 HZ1 LYS A 21 4.777 18.188 -11.788 1.00 0.00 H ATOM 167 HZ2 LYS A 21 5.112 18.042 -13.447 1.00 0.00 H ATOM 168 HZ3 LYS A 21 3.521 17.856 -12.882 1.00 0.00 H ATOM 169 H LYS A 21 7.618 12.459 -10.288 1.00 0.00 H ATOM 170 N ALA A 22 10.553 11.933 -11.525 1.00 28.98 N ATOM 171 CA ALA A 22 12.012 11.734 -11.546 1.00 28.45 C ATOM 172 C ALA A 22 12.374 10.354 -10.988 1.00 27.95 C ATOM 173 O ALA A 22 12.992 10.248 -9.918 1.00 27.05 O ATOM 174 CB ALA A 22 12.683 12.794 -10.710 1.00 28.72 C ATOM 175 H ALA A 22 10.041 11.670 -10.659 1.00 0.00 H ATOM 176 N PRO A 23 12.006 9.293 -11.709 1.00 29.98 N ATOM 177 CA PRO A 23 12.146 7.999 -11.045 1.00 30.91 C ATOM 178 C PRO A 23 13.589 7.564 -10.879 1.00 35.56 C ATOM 179 O PRO A 23 14.443 7.967 -11.667 1.00 32.11 O ATOM 180 CB PRO A 23 11.354 7.031 -11.945 1.00 31.77 C ATOM 181 CG PRO A 23 10.703 7.860 -13.027 1.00 29.55 C ATOM 182 CD PRO A 23 11.299 9.216 -13.009 1.00 27.94 C ATOM 183 N ARG A 24 13.865 6.763 -9.847 1.00 32.83 N ATOM 184 CA ARG A 24 15.218 6.430 -9.511 1.00 35.59 C ATOM 185 C ARG A 24 15.460 4.948 -9.774 1.00 33.33 C ATOM 186 O ARG A 24 15.127 4.078 -8.960 1.00 33.87 O ATOM 187 CB ARG A 24 15.500 6.816 -8.048 1.00 43.69 C ATOM 188 CG ARG A 24 16.877 7.390 -7.839 1.00 49.44 C ATOM 189 CD ARG A 24 17.095 7.902 -6.427 1.00 52.14 C ATOM 190 NE ARG A 24 18.510 7.729 -6.148 1.00 55.74 N ATOM 191 CZ ARG A 24 19.049 6.721 -5.463 1.00 57.41 C ATOM 192 NH1 ARG A 24 18.295 5.796 -4.876 1.00 58.55 N ATOM 193 NH2 ARG A 24 20.366 6.657 -5.332 1.00 58.16 N ATOM 194 HE ARG A 24 19.159 8.455 -6.515 1.00 0.00 H ATOM 195 HH12 ARG A 24 18.742 5.020 -4.347 1.00 0.00 H ATOM 196 HH11 ARG A 24 17.259 5.849 -4.946 1.00 0.00 H ATOM 197 HH22 ARG A 24 20.798 5.875 -4.800 1.00 0.00 H ATOM 198 HH21 ARG A 24 20.967 7.389 -5.762 1.00 0.00 H ATOM 199 H ARG A 24 13.086 6.375 -9.278 1.00 0.00 H ATOM 200 N SER A 25 16.083 4.678 -10.909 1.00 31.91 N ATOM 201 CA SER A 25 16.374 3.309 -11.355 1.00 32.17 C ATOM 202 C SER A 25 16.957 2.334 -10.317 1.00 27.79 C ATOM 203 O SER A 25 16.544 1.178 -10.288 1.00 29.46 O ATOM 204 CB SER A 25 17.345 3.350 -12.555 1.00 38.33 C ATOM 205 OG SER A 25 18.213 2.238 -12.486 1.00 45.10 O ATOM 206 HG SER A 25 17.681 1.403 -12.516 1.00 0.00 H ATOM 207 H SER A 25 16.380 5.471 -11.513 1.00 0.00 H ATOM 208 N SER A 26 17.935 2.762 -9.503 1.00 22.33 N ATOM 209 CA SER A 26 18.574 1.845 -8.553 1.00 23.09 C ATOM 210 C SER A 26 17.730 1.626 -7.313 1.00 20.51 C ATOM 211 O SER A 26 17.916 0.660 -6.534 1.00 18.79 O ATOM 212 CB SER A 26 19.983 2.342 -8.121 1.00 22.19 C ATOM 213 OG SER A 26 19.904 3.676 -7.603 1.00 22.00 O ATOM 214 HG SER A 26 19.549 4.280 -8.302 1.00 0.00 H ATOM 215 H SER A 26 18.243 3.754 -9.546 1.00 0.00 H ATOM 216 N GLN A 27 16.812 2.543 -7.096 1.00 19.78 N ATOM 217 CA GLN A 27 15.950 2.412 -5.950 1.00 19.53 C ATOM 218 C GLN A 27 14.575 2.745 -6.420 1.00 16.90 C ATOM 219 O GLN A 27 14.099 3.862 -6.287 1.00 18.59 O ATOM 220 CB GLN A 27 16.373 3.296 -4.784 1.00 19.60 C ATOM 221 CG GLN A 27 15.691 2.837 -3.478 1.00 19.62 C ATOM 222 CD GLN A 27 16.085 3.674 -2.289 1.00 21.23 C ATOM 223 OE1 GLN A 27 15.867 4.858 -2.269 1.00 21.85 O ATOM 224 NE2 GLN A 27 16.669 3.048 -1.299 1.00 22.37 N ATOM 225 HE22 GLN A 27 16.838 2.024 -1.359 1.00 0.00 H ATOM 226 HE21 GLN A 27 16.964 3.575 -0.452 1.00 0.00 H ATOM 227 H GLN A 27 16.710 3.351 -7.743 1.00 0.00 H ATOM 228 N PRO A 28 13.933 1.760 -6.977 1.00 16.05 N ATOM 229 CA PRO A 28 12.605 2.033 -7.483 1.00 14.92 C ATOM 230 C PRO A 28 11.573 2.280 -6.410 1.00 12.78 C ATOM 231 O PRO A 28 11.640 1.734 -5.370 1.00 14.36 O ATOM 232 CB PRO A 28 12.274 0.808 -8.283 1.00 15.75 C ATOM 233 CG PRO A 28 13.102 -0.264 -7.771 1.00 15.97 C ATOM 234 CD PRO A 28 14.295 0.336 -7.060 1.00 16.81 C ATOM 235 N LEU A 29 10.605 3.085 -6.706 1.00 12.51 N ATOM 236 CA LEU A 29 9.589 3.408 -5.761 1.00 13.14 C ATOM 237 C LEU A 29 8.403 2.498 -6.033 1.00 11.93 C ATOM 238 O LEU A 29 7.943 2.359 -7.177 1.00 13.42 O ATOM 239 CB LEU A 29 9.204 4.891 -5.939 1.00 14.58 C ATOM 240 CG LEU A 29 7.914 5.254 -5.271 1.00 16.70 C ATOM 241 CD1 LEU A 29 8.104 5.470 -3.742 1.00 18.79 C ATOM 242 CD2 LEU A 29 7.331 6.471 -5.959 1.00 19.99 C ATOM 243 H LEU A 29 10.567 3.506 -7.656 1.00 0.00 H ATOM 244 N LYS A 30 7.937 1.771 -5.034 1.00 10.93 N ATOM 245 CA LYS A 30 6.643 1.123 -5.146 1.00 9.50 C ATOM 246 C LYS A 30 5.673 1.783 -4.169 1.00 8.79 C ATOM 247 O LYS A 30 5.902 1.708 -2.961 1.00 8.81 O ATOM 248 CB LYS A 30 6.728 -0.335 -4.771 1.00 11.06 C ATOM 249 CG LYS A 30 5.378 -1.052 -4.843 1.00 12.47 C ATOM 250 CD LYS A 30 4.732 -1.329 -6.218 1.00 14.26 C ATOM 251 CE LYS A 30 5.674 -2.000 -7.190 1.00 15.33 C ATOM 252 NZ LYS A 30 4.776 -2.483 -8.323 1.00 17.30 N ATOM 253 HZ1 LYS A 30 4.071 -3.147 -7.945 1.00 0.00 H ATOM 254 HZ2 LYS A 30 4.292 -1.668 -8.752 1.00 0.00 H ATOM 255 HZ3 LYS A 30 5.355 -2.962 -9.042 1.00 0.00 H ATOM 256 H LYS A 30 8.498 1.662 -4.165 1.00 0.00 H ATOM 257 N LEU A 31 4.614 2.413 -4.691 1.00 8.07 N ATOM 258 CA LEU A 31 3.519 2.940 -3.890 1.00 7.75 C ATOM 259 C LEU A 31 2.540 1.778 -3.661 1.00 7.41 C ATOM 260 O LEU A 31 2.229 1.018 -4.589 1.00 6.82 O ATOM 261 CB LEU A 31 2.766 4.069 -4.612 1.00 8.02 C ATOM 262 CG LEU A 31 3.119 5.557 -4.351 1.00 8.25 C ATOM 263 CD1 LEU A 31 2.986 5.988 -2.903 1.00 8.29 C ATOM 264 CD2 LEU A 31 4.538 5.842 -4.815 1.00 8.51 C ATOM 265 H LEU A 31 4.571 2.532 -5.723 1.00 0.00 H ATOM 266 N LEU A 32 2.051 1.665 -2.426 1.00 6.94 N ATOM 267 CA LEU A 32 1.003 0.655 -2.058 1.00 7.21 C ATOM 268 C LEU A 32 -0.138 1.329 -1.338 1.00 6.69 C ATOM 269 O LEU A 32 0.073 2.087 -0.389 1.00 6.85 O ATOM 270 CB LEU A 32 1.566 -0.433 -1.164 1.00 7.13 C ATOM 271 CG LEU A 32 2.688 -1.272 -1.731 1.00 7.38 C ATOM 272 CD1 LEU A 32 3.315 -2.182 -0.670 1.00 7.71 C ATOM 273 CD2 LEU A 32 2.231 -2.047 -2.977 1.00 7.79 C ATOM 274 H LEU A 32 2.410 2.303 -1.687 1.00 0.00 H ATOM 275 N ASP A 33 -1.355 1.058 -1.799 1.00 6.48 N ATOM 276 CA ASP A 33 -2.528 1.488 -1.086 1.00 6.09 C ATOM 277 C ASP A 33 -2.890 0.348 -0.115 1.00 5.88 C ATOM 278 O ASP A 33 -3.282 -0.748 -0.649 1.00 6.73 O ATOM 279 CB ASP A 33 -3.623 1.778 -2.098 1.00 6.37 C ATOM 280 CG ASP A 33 -4.964 2.118 -1.444 1.00 6.76 C ATOM 281 OD1 ASP A 33 -5.120 2.060 -0.201 1.00 7.25 O ATOM 282 OD2 ASP A 33 -5.967 2.360 -2.170 1.00 6.67 O ATOM 283 H ASP A 33 -1.461 0.528 -2.687 1.00 0.00 H ATOM 284 N ALA A 34 -2.841 0.540 1.204 1.00 5.16 N ATOM 285 CA ALA A 34 -3.180 -0.549 2.184 1.00 5.49 C ATOM 286 C ALA A 34 -4.427 -0.222 2.907 1.00 5.90 C ATOM 287 O ALA A 34 -4.513 -0.494 4.092 1.00 7.46 O ATOM 288 CB ALA A 34 -2.009 -0.750 3.200 1.00 5.49 C ATOM 289 H ALA A 34 -2.559 1.473 1.566 1.00 0.00 H ATOM 290 N SER A 35 -5.374 0.437 2.263 1.00 6.69 N ATOM 291 CA SER A 35 -6.651 0.794 2.900 1.00 7.05 C ATOM 292 C SER A 35 -7.386 -0.484 3.316 1.00 7.35 C ATOM 293 O SER A 35 -7.415 -1.521 2.630 1.00 6.43 O ATOM 294 CB SER A 35 -7.536 1.625 1.981 1.00 7.89 C ATOM 295 OG SER A 35 -6.950 2.822 1.494 1.00 9.47 O ATOM 296 HG SER A 35 -6.135 2.602 0.977 1.00 0.00 H ATOM 297 H SER A 35 -5.211 0.712 1.273 1.00 0.00 H ATOM 298 N TRP A 36 -7.937 -0.384 4.509 1.00 8.07 N ATOM 299 CA TRP A 36 -8.806 -1.464 5.120 1.00 8.38 C ATOM 300 C TRP A 36 -9.733 -0.772 6.094 1.00 9.02 C ATOM 301 O TRP A 36 -9.283 0.136 6.765 1.00 8.86 O ATOM 302 CB TRP A 36 -7.929 -2.530 5.839 1.00 8.98 C ATOM 303 CG TRP A 36 -8.723 -3.742 6.266 1.00 10.06 C ATOM 304 CD1 TRP A 36 -8.858 -4.901 5.590 1.00 11.99 C ATOM 305 CD2 TRP A 36 -9.500 -3.898 7.467 1.00 10.70 C ATOM 306 NE1 TRP A 36 -9.705 -5.762 6.241 1.00 11.90 N ATOM 307 CE2 TRP A 36 -10.127 -5.157 7.392 1.00 10.32 C ATOM 308 CE3 TRP A 36 -9.778 -3.063 8.545 1.00 10.10 C ATOM 309 CZ2 TRP A 36 -10.946 -5.643 8.416 1.00 11.25 C ATOM 310 CZ3 TRP A 36 -10.615 -3.570 9.579 1.00 10.56 C ATOM 311 CH2 TRP A 36 -11.153 -4.834 9.484 1.00 10.09 C ATOM 312 HE1 TRP A 36 -9.979 -6.711 5.915 1.00 0.00 H ATOM 313 H TRP A 36 -7.766 0.482 5.060 1.00 0.00 H ATOM 314 N TYR A 37 -11.047 -1.117 6.099 1.00 7.67 N ATOM 315 CA TYR A 37 -11.983 -0.405 6.903 1.00 8.23 C ATOM 316 C TYR A 37 -12.833 -1.433 7.682 1.00 8.24 C ATOM 317 O TYR A 37 -13.073 -2.510 7.170 1.00 8.95 O ATOM 318 CB TYR A 37 -12.915 0.435 6.055 1.00 8.56 C ATOM 319 CG TYR A 37 -12.109 1.453 5.248 1.00 8.40 C ATOM 320 CD1 TYR A 37 -11.398 2.462 5.893 1.00 9.02 C ATOM 321 CD2 TYR A 37 -12.033 1.368 3.855 1.00 8.61 C ATOM 322 CE1 TYR A 37 -10.574 3.331 5.137 1.00 9.10 C ATOM 323 CE2 TYR A 37 -11.239 2.224 3.128 1.00 8.29 C ATOM 324 CZ TYR A 37 -10.542 3.217 3.767 1.00 8.58 C ATOM 325 OH TYR A 37 -9.761 4.073 3.008 1.00 9.44 O ATOM 326 HH TYR A 37 -10.333 4.547 2.354 1.00 0.00 H ATOM 327 H TYR A 37 -11.373 -1.909 5.510 1.00 0.00 H ATOM 328 N LEU A 38 -13.242 -1.100 8.878 1.00 9.14 N ATOM 329 CA LEU A 38 -14.115 -1.998 9.629 1.00 10.10 C ATOM 330 C LEU A 38 -15.470 -2.020 8.874 1.00 11.19 C ATOM 331 O LEU A 38 -15.849 -1.014 8.218 1.00 9.56 O ATOM 332 CB LEU A 38 -14.275 -1.391 11.007 1.00 10.81 C ATOM 333 CG LEU A 38 -13.077 -1.606 11.969 1.00 10.62 C ATOM 334 CD1 LEU A 38 -13.225 -0.727 13.165 1.00 11.52 C ATOM 335 CD2 LEU A 38 -12.939 -3.047 12.322 1.00 10.58 C ATOM 336 H LEU A 38 -12.945 -0.195 9.295 1.00 0.00 H ATOM 337 N PRO A 39 -16.167 -3.161 8.932 1.00 11.16 N ATOM 338 CA PRO A 39 -17.392 -3.327 8.112 1.00 12.25 C ATOM 339 C PRO A 39 -18.413 -2.237 8.302 1.00 11.57 C ATOM 340 O PRO A 39 -19.033 -1.822 7.344 1.00 11.60 O ATOM 341 CB PRO A 39 -17.949 -4.705 8.567 1.00 12.69 C ATOM 342 CG PRO A 39 -16.759 -5.440 9.202 1.00 13.54 C ATOM 343 CD PRO A 39 -15.725 -4.431 9.593 1.00 11.88 C ATOM 344 N LYS A 40 -18.593 -1.739 9.526 1.00 11.60 N ATOM 345 CA LYS A 40 -19.630 -0.715 9.774 1.00 11.82 C ATOM 346 C LYS A 40 -19.418 0.623 9.084 1.00 13.42 C ATOM 347 O LYS A 40 -20.331 1.383 8.918 1.00 11.56 O ATOM 348 CB LYS A 40 -19.913 -0.530 11.218 1.00 14.05 C ATOM 349 CG LYS A 40 -20.597 -1.814 11.837 1.00 16.71 C ATOM 350 CD LYS A 40 -21.038 -1.523 13.250 1.00 18.32 C ATOM 351 CE LYS A 40 -22.026 -2.545 13.811 1.00 20.00 C ATOM 352 NZ LYS A 40 -21.232 -3.788 14.122 1.00 21.19 N ATOM 353 HZ1 LYS A 40 -20.788 -4.141 13.250 1.00 0.00 H ATOM 354 HZ2 LYS A 40 -20.496 -3.562 14.821 1.00 0.00 H ATOM 355 HZ3 LYS A 40 -21.867 -4.516 14.509 1.00 0.00 H ATOM 356 H LYS A 40 -17.999 -2.073 10.312 1.00 0.00 H ATOM 357 N LEU A 41 -18.212 0.883 8.589 1.00 13.34 N ATOM 358 CA LEU A 41 -18.031 2.070 7.785 1.00 13.48 C ATOM 359 C LEU A 41 -18.657 1.951 6.384 1.00 12.60 C ATOM 360 O LEU A 41 -18.797 2.998 5.697 1.00 10.04 O ATOM 361 CB LEU A 41 -16.538 2.371 7.611 1.00 14.84 C ATOM 362 CG LEU A 41 -15.859 3.358 8.519 1.00 19.44 C ATOM 363 CD1 LEU A 41 -14.380 3.445 8.100 1.00 18.70 C ATOM 364 CD2 LEU A 41 -16.508 4.729 8.427 1.00 21.11 C ATOM 365 H LEU A 41 -17.413 0.244 8.777 1.00 0.00 H ATOM 366 N GLY A 42 -18.957 0.712 5.948 1.00 11.30 N ATOM 367 CA GLY A 42 -19.588 0.458 4.656 1.00 13.02 C ATOM 368 C GLY A 42 -18.799 0.942 3.438 1.00 12.98 C ATOM 369 O GLY A 42 -19.387 1.388 2.417 1.00 12.99 O ATOM 370 H GLY A 42 -18.729 -0.099 6.558 1.00 0.00 H ATOM 371 N ARG A 43 -17.473 0.808 3.553 1.00 10.68 N ATOM 372 CA ARG A 43 -16.533 1.134 2.499 1.00 11.64 C ATOM 373 C ARG A 43 -15.872 -0.106 1.884 1.00 11.95 C ATOM 374 O ARG A 43 -15.733 -1.110 2.545 1.00 14.81 O ATOM 375 CB ARG A 43 -15.484 2.094 3.051 1.00 12.46 C ATOM 376 CG ARG A 43 -16.076 3.474 3.285 1.00 13.67 C ATOM 377 CD ARG A 43 -15.132 4.521 3.767 1.00 15.08 C ATOM 378 NE ARG A 43 -14.115 4.791 2.761 1.00 13.42 N ATOM 379 CZ ARG A 43 -13.115 5.646 2.979 1.00 13.54 C ATOM 380 NH1 ARG A 43 -13.014 6.235 4.139 1.00 13.93 N ATOM 381 NH2 ARG A 43 -12.245 5.915 2.030 1.00 11.33 N ATOM 382 HE ARG A 43 -14.170 4.302 1.845 1.00 0.00 H ATOM 383 HH12 ARG A 43 -12.237 6.903 4.317 1.00 0.00 H ATOM 384 HH11 ARG A 43 -13.710 6.036 4.885 1.00 0.00 H ATOM 385 HH22 ARG A 43 -11.469 6.583 2.210 1.00 0.00 H ATOM 386 HH21 ARG A 43 -12.333 5.459 1.099 1.00 0.00 H ATOM 387 H ARG A 43 -17.094 0.448 4.452 1.00 0.00 H ATOM 388 N ASP A 44 -15.545 -0.053 0.593 1.00 12.06 N ATOM 389 CA ASP A 44 -14.867 -1.126 -0.120 1.00 13.06 C ATOM 390 C ASP A 44 -13.534 -0.623 -0.590 1.00 10.97 C ATOM 391 O ASP A 44 -13.468 0.091 -1.619 1.00 10.70 O ATOM 392 CB ASP A 44 -15.684 -1.585 -1.386 1.00 15.89 C ATOM 393 CG ASP A 44 -15.055 -2.808 -2.067 1.00 18.72 C ATOM 394 OD1 ASP A 44 -15.789 -3.612 -2.687 1.00 23.84 O ATOM 395 OD2 ASP A 44 -13.847 -3.025 -1.991 1.00 17.30 O ATOM 396 H ASP A 44 -15.789 0.808 0.063 1.00 0.00 H ATOM 397 N ALA A 45 -12.481 -0.910 0.213 1.00 9.49 N ATOM 398 CA ALA A 45 -11.157 -0.346 -0.095 1.00 9.76 C ATOM 399 C ALA A 45 -10.645 -0.683 -1.495 1.00 9.05 C ATOM 400 O ALA A 45 -10.096 0.165 -2.152 1.00 9.20 O ATOM 401 CB ALA A 45 -10.154 -0.778 0.959 1.00 8.79 C ATOM 402 H ALA A 45 -12.608 -1.525 1.042 1.00 0.00 H ATOM 403 N ARG A 46 -10.862 -1.931 -1.926 1.00 10.52 N ATOM 404 CA ARG A 46 -10.319 -2.436 -3.178 1.00 11.01 C ATOM 405 C ARG A 46 -11.045 -1.698 -4.323 1.00 11.13 C ATOM 406 O ARG A 46 -10.445 -1.231 -5.303 1.00 11.23 O ATOM 407 CB ARG A 46 -10.533 -3.946 -3.307 1.00 12.78 C ATOM 408 CG ARG A 46 -9.920 -4.441 -4.608 1.00 15.34 C ATOM 409 CD ARG A 46 -9.885 -5.960 -4.680 1.00 16.65 C ATOM 410 NE ARG A 46 -8.930 -6.624 -3.785 1.00 17.14 N ATOM 411 CZ ARG A 46 -7.613 -6.804 -3.998 1.00 17.29 C ATOM 412 NH1 ARG A 46 -6.957 -6.260 -5.065 1.00 19.55 N ATOM 413 NH2 ARG A 46 -6.892 -7.469 -3.081 1.00 14.51 N ATOM 414 HE ARG A 46 -9.311 -6.995 -2.891 1.00 0.00 H ATOM 415 HH12 ARG A 46 -5.938 -6.426 -5.189 1.00 0.00 H ATOM 416 HH11 ARG A 46 -7.477 -5.679 -5.754 1.00 0.00 H ATOM 417 HH22 ARG A 46 -5.873 -7.618 -3.228 1.00 0.00 H ATOM 418 HH21 ARG A 46 -7.352 -7.835 -2.223 1.00 0.00 H ATOM 419 H ARG A 46 -11.443 -2.566 -1.342 1.00 0.00 H ATOM 420 N ARG A 47 -12.340 -1.634 -4.165 1.00 12.20 N ATOM 421 CA ARG A 47 -13.122 -0.899 -5.199 1.00 12.37 C ATOM 422 C ARG A 47 -12.776 0.558 -5.288 1.00 12.17 C ATOM 423 O ARG A 47 -12.669 1.102 -6.370 1.00 11.63 O ATOM 424 CB ARG A 47 -14.619 -1.061 -5.029 1.00 14.15 C ATOM 425 CG ARG A 47 -15.364 -0.725 -6.316 1.00 16.01 C ATOM 426 CD ARG A 47 -14.872 -1.438 -7.582 1.00 19.02 C ATOM 427 NE ARG A 47 -15.255 -0.652 -8.750 1.00 22.60 N ATOM 428 CZ ARG A 47 -16.341 -0.850 -9.481 1.00 25.67 C ATOM 429 NH1 ARG A 47 -17.191 -1.855 -9.224 1.00 26.01 N ATOM 430 NH2 ARG A 47 -16.556 -0.012 -10.511 1.00 28.66 N ATOM 431 HE ARG A 47 -14.625 0.126 -9.031 1.00 0.00 H ATOM 432 HH12 ARG A 47 -18.036 -1.985 -9.816 1.00 0.00 H ATOM 433 HH11 ARG A 47 -17.005 -2.504 -8.433 1.00 0.00 H ATOM 434 HH22 ARG A 47 -17.397 -0.131 -11.111 1.00 0.00 H ATOM 435 HH21 ARG A 47 -15.881 0.755 -10.707 1.00 0.00 H ATOM 436 H ARG A 47 -12.807 -2.079 -3.349 1.00 0.00 H ATOM 437 N GLU A 48 -12.547 1.198 -4.139 1.00 11.04 N ATOM 438 CA GLU A 48 -12.115 2.571 -4.144 1.00 11.44 C ATOM 439 C GLU A 48 -10.800 2.732 -4.856 1.00 10.91 C ATOM 440 O GLU A 48 -10.601 3.755 -5.525 1.00 10.55 O ATOM 441 CB GLU A 48 -12.039 3.159 -2.747 1.00 11.83 C ATOM 442 CG GLU A 48 -13.402 3.341 -2.138 1.00 13.42 C ATOM 443 CD GLU A 48 -13.414 3.870 -0.728 1.00 14.36 C ATOM 444 OE1 GLU A 48 -12.360 4.285 -0.255 1.00 15.59 O ATOM 445 OE2 GLU A 48 -14.475 3.868 -0.076 1.00 14.28 O ATOM 446 H GLU A 48 -12.682 0.702 -3.235 1.00 0.00 H ATOM 447 N PHE A 49 -9.894 1.748 -4.715 1.00 10.19 N ATOM 448 CA PHE A 49 -8.614 1.833 -5.360 1.00 10.12 C ATOM 449 C PHE A 49 -8.838 1.826 -6.869 1.00 10.59 C ATOM 450 O PHE A 49 -8.225 2.617 -7.607 1.00 9.92 O ATOM 451 CB PHE A 49 -7.751 0.635 -4.948 1.00 9.94 C ATOM 452 CG PHE A 49 -6.482 0.567 -5.671 1.00 9.61 C ATOM 453 CD1 PHE A 49 -5.333 1.175 -5.181 1.00 9.15 C ATOM 454 CD2 PHE A 49 -6.426 -0.105 -6.909 1.00 9.39 C ATOM 455 CE1 PHE A 49 -4.114 1.048 -5.893 1.00 9.69 C ATOM 456 CE2 PHE A 49 -5.234 -0.218 -7.600 1.00 9.15 C ATOM 457 CZ PHE A 49 -4.093 0.365 -7.127 1.00 9.09 C ATOM 458 H PHE A 49 -10.123 0.917 -4.133 1.00 0.00 H ATOM 459 N GLU A 50 -9.709 0.928 -7.305 1.00 10.41 N ATOM 460 CA GLU A 50 -9.971 0.746 -8.729 1.00 12.22 C ATOM 461 C GLU A 50 -10.449 2.065 -9.279 1.00 13.45 C ATOM 462 O GLU A 50 -10.076 2.447 -10.388 1.00 14.71 O ATOM 463 CB GLU A 50 -10.948 -0.410 -8.949 1.00 12.33 C ATOM 464 CG GLU A 50 -11.218 -0.653 -10.444 1.00 12.80 C ATOM 465 CD GLU A 50 -12.264 -1.693 -10.674 1.00 13.75 C ATOM 466 OE1 GLU A 50 -12.636 -2.429 -9.690 1.00 15.79 O ATOM 467 OE2 GLU A 50 -12.646 -1.801 -11.883 1.00 12.90 O ATOM 468 H GLU A 50 -10.218 0.339 -6.616 1.00 0.00 H ATOM 469 N GLU A 51 -11.202 2.817 -8.473 1.00 13.49 N ATOM 470 CA GLU A 51 -11.714 4.131 -8.981 1.00 14.94 C ATOM 471 C GLU A 51 -10.651 5.208 -8.998 1.00 13.29 C ATOM 472 O GLU A 51 -10.493 5.984 -10.002 1.00 12.66 O ATOM 473 CB GLU A 51 -12.982 4.522 -8.208 1.00 16.25 C ATOM 474 CG GLU A 51 -14.217 3.643 -8.455 1.00 20.27 C ATOM 475 CD GLU A 51 -14.324 3.207 -9.948 1.00 23.97 C ATOM 476 OE1 GLU A 51 -14.220 2.004 -10.272 1.00 26.21 O ATOM 477 OE2 GLU A 51 -14.482 4.088 -10.798 1.00 26.36 O ATOM 478 H GLU A 51 -11.429 2.497 -7.510 1.00 0.00 H ATOM 479 N ARG A 52 -9.871 5.308 -7.929 1.00 12.21 N ATOM 480 CA ARG A 52 -8.825 6.339 -7.835 1.00 12.06 C ATOM 481 C ARG A 52 -7.644 5.848 -7.003 1.00 11.30 C ATOM 482 O ARG A 52 -7.853 5.408 -5.889 1.00 11.79 O ATOM 483 CB ARG A 52 -9.358 7.594 -7.092 1.00 13.32 C ATOM 484 CG ARG A 52 -10.649 8.124 -7.598 1.00 14.46 C ATOM 485 CD ARG A 52 -11.059 9.309 -6.725 1.00 16.66 C ATOM 486 NE ARG A 52 -11.403 8.947 -5.374 1.00 16.02 N ATOM 487 CZ ARG A 52 -11.843 9.861 -4.493 1.00 18.18 C ATOM 488 NH1 ARG A 52 -11.805 11.158 -4.801 1.00 16.21 N ATOM 489 NH2 ARG A 52 -12.210 9.516 -3.277 1.00 20.41 N ATOM 490 HE ARG A 52 -11.309 7.956 -5.074 1.00 0.00 H ATOM 491 HH12 ARG A 52 -12.146 11.865 -4.118 1.00 0.00 H ATOM 492 HH11 ARG A 52 -11.435 11.463 -5.724 1.00 0.00 H ATOM 493 HH22 ARG A 52 -12.548 10.240 -2.611 1.00 0.00 H ATOM 494 HH21 ARG A 52 -12.162 8.520 -2.982 1.00 0.00 H ATOM 495 H ARG A 52 -10.002 4.643 -7.140 1.00 0.00 H ATOM 496 N HIS A 53 -6.445 6.052 -7.499 1.00 11.45 N ATOM 497 CA HIS A 53 -5.266 5.789 -6.705 1.00 10.75 C ATOM 498 C HIS A 53 -4.080 6.584 -7.199 1.00 11.09 C ATOM 499 O HIS A 53 -4.119 7.202 -8.265 1.00 13.12 O ATOM 500 CB HIS A 53 -4.979 4.266 -6.719 1.00 10.93 C ATOM 501 CG HIS A 53 -4.776 3.701 -8.086 1.00 11.33 C ATOM 502 ND1 HIS A 53 -5.757 2.994 -8.752 1.00 11.86 N ATOM 503 CD2 HIS A 53 -3.692 3.673 -8.884 1.00 11.11 C ATOM 504 CE1 HIS A 53 -5.310 2.607 -9.930 1.00 11.01 C ATOM 505 NE2 HIS A 53 -4.036 2.935 -10.006 1.00 11.69 N ATOM 506 H HIS A 53 -6.343 6.406 -8.472 1.00 0.00 H ATOM 507 N ILE A 54 -3.000 6.620 -6.416 1.00 10.75 N ATOM 508 CA ILE A 54 -1.811 7.315 -6.836 1.00 11.10 C ATOM 509 C ILE A 54 -1.217 6.628 -8.030 1.00 11.84 C ATOM 510 O ILE A 54 -1.090 5.406 -8.061 1.00 11.84 O ATOM 511 CB ILE A 54 -0.809 7.467 -5.687 1.00 11.67 C ATOM 512 CG1 ILE A 54 -1.514 8.282 -4.576 1.00 12.07 C ATOM 513 CG2 ILE A 54 0.467 8.158 -6.109 1.00 12.49 C ATOM 514 CD1 ILE A 54 -0.720 8.566 -3.332 1.00 11.14 C ATOM 515 H ILE A 54 -3.017 6.141 -5.493 1.00 0.00 H ATOM 516 N PRO A 55 -0.773 7.387 -9.018 1.00 12.42 N ATOM 517 CA PRO A 55 -0.363 6.747 -10.262 1.00 12.96 C ATOM 518 C PRO A 55 0.781 5.725 -10.070 1.00 12.66 C ATOM 519 O PRO A 55 1.790 5.987 -9.367 1.00 13.33 O ATOM 520 CB PRO A 55 0.048 7.988 -11.165 1.00 12.85 C ATOM 521 CG PRO A 55 -0.676 9.101 -10.580 1.00 13.82 C ATOM 522 CD PRO A 55 -0.719 8.862 -9.100 1.00 13.17 C ATOM 523 N GLY A 56 0.590 4.527 -10.646 1.00 12.38 N ATOM 524 CA GLY A 56 1.518 3.452 -10.586 1.00 12.23 C ATOM 525 C GLY A 56 1.413 2.616 -9.284 1.00 12.46 C ATOM 526 O GLY A 56 2.144 1.583 -9.112 1.00 12.39 O ATOM 527 H GLY A 56 -0.295 4.376 -11.171 1.00 0.00 H ATOM 528 N ALA A 57 0.591 3.057 -8.335 1.00 11.24 N ATOM 529 CA ALA A 57 0.329 2.295 -7.104 1.00 10.43 C ATOM 530 C ALA A 57 -0.232 0.911 -7.362 1.00 10.86 C ATOM 531 O ALA A 57 -0.944 0.701 -8.363 1.00 11.20 O ATOM 532 CB ALA A 57 -0.649 3.037 -6.182 1.00 10.30 C ATOM 533 H ALA A 57 0.117 3.973 -8.468 1.00 0.00 H ATOM 534 N ALA A 58 0.108 -0.019 -6.462 1.00 9.97 N ATOM 535 CA ALA A 58 -0.571 -1.287 -6.276 1.00 9.41 C ATOM 536 C ALA A 58 -1.389 -1.313 -4.995 1.00 8.52 C ATOM 537 O ALA A 58 -1.223 -0.458 -4.079 1.00 8.60 O ATOM 538 CB ALA A 58 0.411 -2.446 -6.311 1.00 9.29 C ATOM 539 H ALA A 58 0.923 0.183 -5.848 1.00 0.00 H ATOM 540 N PHE A 59 -2.321 -2.262 -4.960 1.00 7.72 N ATOM 541 CA PHE A 59 -3.216 -2.446 -3.793 1.00 7.75 C ATOM 542 C PHE A 59 -2.680 -3.583 -2.893 1.00 8.04 C ATOM 543 O PHE A 59 -2.460 -4.718 -3.311 1.00 7.30 O ATOM 544 CB PHE A 59 -4.675 -2.634 -4.170 1.00 7.99 C ATOM 545 CG PHE A 59 -5.630 -2.694 -2.962 1.00 7.81 C ATOM 546 CD1 PHE A 59 -6.034 -1.559 -2.302 1.00 8.07 C ATOM 547 CD2 PHE A 59 -6.066 -3.874 -2.512 1.00 7.84 C ATOM 548 CE1 PHE A 59 -6.839 -1.623 -1.180 1.00 8.66 C ATOM 549 CE2 PHE A 59 -6.912 -3.949 -1.415 1.00 8.75 C ATOM 550 CZ PHE A 59 -7.296 -2.822 -0.744 1.00 8.39 C ATOM 551 H PHE A 59 -2.425 -2.895 -5.778 1.00 0.00 H ATOM 552 N PHE A 60 -2.373 -3.218 -1.649 1.00 7.70 N ATOM 553 CA PHE A 60 -1.855 -4.155 -0.674 1.00 6.79 C ATOM 554 C PHE A 60 -3.071 -4.488 0.222 1.00 7.52 C ATOM 555 O PHE A 60 -3.487 -3.664 1.026 1.00 6.54 O ATOM 556 CB PHE A 60 -0.661 -3.577 0.125 1.00 6.66 C ATOM 557 CG PHE A 60 -0.026 -4.561 1.073 1.00 6.24 C ATOM 558 CD1 PHE A 60 -0.733 -4.945 2.186 1.00 5.70 C ATOM 559 CD2 PHE A 60 1.196 -5.198 0.821 1.00 5.86 C ATOM 560 CE1 PHE A 60 -0.254 -5.894 3.101 1.00 5.92 C ATOM 561 CE2 PHE A 60 1.689 -6.182 1.698 1.00 5.71 C ATOM 562 CZ PHE A 60 0.955 -6.512 2.840 1.00 5.55 C ATOM 563 H PHE A 60 -2.510 -2.226 -1.369 1.00 0.00 H ATOM 564 N ASP A 61 -3.571 -5.726 0.109 1.00 7.83 N ATOM 565 CA ASP A 61 -4.716 -6.183 0.843 1.00 8.69 C ATOM 566 C ASP A 61 -4.246 -6.866 2.118 1.00 9.07 C ATOM 567 O ASP A 61 -3.714 -7.974 2.066 1.00 8.81 O ATOM 568 CB ASP A 61 -5.419 -7.215 -0.040 1.00 9.96 C ATOM 569 CG ASP A 61 -6.723 -7.727 0.515 1.00 11.48 C ATOM 570 OD1 ASP A 61 -6.984 -7.589 1.709 1.00 11.77 O ATOM 571 OD2 ASP A 61 -7.503 -8.321 -0.350 1.00 13.56 O ATOM 572 H ASP A 61 -3.106 -6.389 -0.543 1.00 0.00 H ATOM 573 N ILE A 62 -4.510 -6.250 3.239 1.00 9.61 N ATOM 574 CA ILE A 62 -4.017 -6.800 4.526 1.00 11.56 C ATOM 575 C ILE A 62 -4.712 -8.114 4.895 1.00 11.92 C ATOM 576 O ILE A 62 -4.146 -8.904 5.593 1.00 10.79 O ATOM 577 CB ILE A 62 -4.042 -5.799 5.683 1.00 12.79 C ATOM 578 CG1 ILE A 62 -5.426 -5.378 6.074 1.00 14.03 C ATOM 579 CG2 ILE A 62 -3.263 -4.567 5.291 1.00 13.35 C ATOM 580 CD1 ILE A 62 -5.490 -4.773 7.424 1.00 13.11 C ATOM 581 H ILE A 62 -5.067 -5.372 3.230 1.00 0.00 H ATOM 582 N ASP A 63 -5.888 -8.398 4.334 1.00 12.66 N ATOM 583 CA ASP A 63 -6.431 -9.798 4.360 1.00 13.59 C ATOM 584 C ASP A 63 -5.729 -10.901 3.527 1.00 15.20 C ATOM 585 O ASP A 63 -6.009 -12.064 3.749 1.00 18.57 O ATOM 586 CB ASP A 63 -7.914 -9.775 4.051 1.00 14.57 C ATOM 587 CG ASP A 63 -8.701 -9.012 5.080 1.00 14.80 C ATOM 588 OD1 ASP A 63 -8.381 -9.089 6.289 1.00 17.00 O ATOM 589 OD2 ASP A 63 -9.671 -8.374 4.672 1.00 15.10 O ATOM 590 H ASP A 63 -6.435 -7.642 3.874 1.00 0.00 H ATOM 591 N ARG A 64 -4.828 -10.551 2.609 1.00 14.70 N ATOM 592 CA ARG A 64 -3.926 -11.534 1.983 1.00 15.47 C ATOM 593 C ARG A 64 -2.537 -11.585 2.634 1.00 15.04 C ATOM 594 O ARG A 64 -1.618 -12.267 2.148 1.00 15.60 O ATOM 595 CB ARG A 64 -3.747 -11.269 0.466 1.00 16.26 C ATOM 596 CG ARG A 64 -4.671 -12.118 -0.408 1.00 16.15 C ATOM 597 CD ARG A 64 -4.177 -12.330 -1.856 1.00 16.80 C ATOM 598 NE ARG A 64 -3.117 -13.329 -1.945 1.00 16.23 N ATOM 599 CZ ARG A 64 -2.404 -13.588 -3.029 1.00 15.89 C ATOM 600 NH1 ARG A 64 -1.504 -14.520 -2.994 1.00 17.10 N ATOM 601 NH2 ARG A 64 -2.587 -12.933 -4.146 1.00 15.73 N ATOM 602 HE ARG A 64 -2.905 -13.881 -1.089 1.00 0.00 H ATOM 603 HH12 ARG A 64 -0.939 -14.730 -3.842 1.00 0.00 H ATOM 604 HH11 ARG A 64 -1.346 -15.058 -2.118 1.00 0.00 H ATOM 605 HH22 ARG A 64 -2.011 -13.159 -4.982 1.00 0.00 H ATOM 606 HH21 ARG A 64 -3.309 -12.186 -4.199 1.00 0.00 H ATOM 607 H ARG A 64 -4.759 -9.553 2.326 1.00 0.00 H ATOM 608 N SER A 65 -2.345 -10.823 3.691 1.00 13.37 N ATOM 609 CA SER A 65 -1.053 -10.799 4.343 1.00 12.97 C ATOM 610 C SER A 65 -1.370 -11.043 5.838 1.00 10.58 C ATOM 611 O SER A 65 -0.872 -10.301 6.764 1.00 10.43 O ATOM 612 CB SER A 65 -0.389 -9.450 4.153 1.00 12.98 C ATOM 613 OG SER A 65 0.941 -9.558 4.667 1.00 14.40 O ATOM 614 HG SER A 65 0.904 -9.797 5.627 1.00 0.00 H ATOM 615 H SER A 65 -3.123 -10.238 4.058 1.00 0.00 H ATOM 616 N SER A 66 -2.235 -12.035 6.075 1.00 10.21 N ATOM 617 CA SER A 66 -2.574 -12.432 7.460 1.00 9.16 C ATOM 618 C SER A 66 -2.713 -13.925 7.600 1.00 8.91 C ATOM 619 O SER A 66 -3.107 -14.620 6.645 1.00 8.49 O ATOM 620 CB SER A 66 -3.851 -11.818 7.937 1.00 9.19 C ATOM 621 OG SER A 66 -4.954 -12.304 7.192 1.00 9.76 O ATOM 622 HG SER A 66 -5.786 -11.884 7.525 1.00 0.00 H ATOM 623 H SER A 66 -2.675 -12.534 5.276 1.00 0.00 H ATOM 624 N ASP A 67 -2.443 -14.420 8.803 1.00 8.43 N ATOM 625 CA ASP A 67 -2.584 -15.863 9.066 1.00 8.60 C ATOM 626 C ASP A 67 -4.077 -16.236 9.272 1.00 8.98 C ATOM 627 O ASP A 67 -4.647 -15.981 10.371 1.00 9.38 O ATOM 628 CB ASP A 67 -1.767 -16.222 10.304 1.00 8.83 C ATOM 629 CG ASP A 67 -1.865 -17.629 10.675 1.00 9.51 C ATOM 630 OD1 ASP A 67 -2.379 -18.410 9.863 1.00 8.82 O ATOM 631 OD2 ASP A 67 -1.449 -18.004 11.780 1.00 11.18 O ATOM 632 H ASP A 67 -2.130 -13.785 9.564 1.00 0.00 H ATOM 633 N HIS A 68 -4.715 -16.750 8.223 1.00 9.68 N ATOM 634 CA HIS A 68 -6.100 -17.171 8.339 1.00 11.79 C ATOM 635 C HIS A 68 -6.379 -18.399 9.168 1.00 11.33 C ATOM 636 O HIS A 68 -7.563 -18.684 9.445 1.00 10.40 O ATOM 637 CB HIS A 68 -6.742 -17.263 6.968 1.00 15.41 C ATOM 638 CG HIS A 68 -6.832 -15.920 6.294 1.00 17.81 C ATOM 639 ND1 HIS A 68 -7.270 -14.785 6.959 1.00 24.78 N ATOM 640 CD2 HIS A 68 -6.473 -15.516 5.066 1.00 22.27 C ATOM 641 CE1 HIS A 68 -7.190 -13.750 6.146 1.00 22.90 C ATOM 642 NE2 HIS A 68 -6.710 -14.169 4.997 1.00 20.58 N ATOM 643 H HIS A 68 -4.219 -16.851 7.315 1.00 0.00 H ATOM 644 N THR A 69 -5.308 -19.079 9.620 1.00 8.94 N ATOM 645 CA THR A 69 -5.512 -20.303 10.488 1.00 8.39 C ATOM 646 C THR A 69 -5.690 -19.847 11.938 1.00 8.60 C ATOM 647 O THR A 69 -6.038 -20.606 12.819 1.00 8.83 O ATOM 648 CB THR A 69 -4.307 -21.250 10.412 1.00 8.46 C ATOM 649 OG1 THR A 69 -3.155 -20.709 11.118 1.00 7.78 O ATOM 650 CG2 THR A 69 -3.959 -21.567 8.989 1.00 8.84 C ATOM 651 HG1 THR A 69 -2.898 -19.843 10.713 1.00 0.00 H ATOM 652 H THR A 69 -4.347 -18.766 9.375 1.00 0.00 H ATOM 653 N SER A 70 -5.431 -18.572 12.226 1.00 7.77 N ATOM 654 CA SER A 70 -5.660 -18.065 13.594 1.00 7.02 C ATOM 655 C SER A 70 -7.142 -17.750 13.815 1.00 6.91 C ATOM 656 O SER A 70 -7.795 -17.227 12.901 1.00 6.79 O ATOM 657 CB SER A 70 -4.811 -16.848 13.876 1.00 6.94 C ATOM 658 OG SER A 70 -5.103 -16.304 15.160 1.00 6.56 O ATOM 659 HG SER A 70 -4.534 -15.510 15.318 1.00 0.00 H ATOM 660 H SER A 70 -5.068 -17.935 11.488 1.00 0.00 H ATOM 661 N PRO A 71 -7.678 -18.060 14.994 1.00 7.50 N ATOM 662 CA PRO A 71 -9.033 -17.578 15.359 1.00 7.09 C ATOM 663 C PRO A 71 -9.084 -16.072 15.679 1.00 7.19 C ATOM 664 O PRO A 71 -10.182 -15.547 15.805 1.00 7.07 O ATOM 665 CB PRO A 71 -9.359 -18.404 16.584 1.00 7.74 C ATOM 666 CG PRO A 71 -8.031 -18.590 17.252 1.00 8.32 C ATOM 667 CD PRO A 71 -7.031 -18.783 16.125 1.00 8.13 C ATOM 668 N TYR A 72 -7.911 -15.436 15.789 1.00 6.45 N ATOM 669 CA TYR A 72 -7.834 -13.992 16.099 1.00 6.76 C ATOM 670 C TYR A 72 -7.748 -13.218 14.824 1.00 6.83 C ATOM 671 O TYR A 72 -7.700 -13.794 13.740 1.00 7.98 O ATOM 672 CB TYR A 72 -6.680 -13.747 17.081 1.00 7.20 C ATOM 673 CG TYR A 72 -6.699 -14.754 18.191 1.00 7.10 C ATOM 674 CD1 TYR A 72 -5.591 -15.594 18.402 1.00 7.58 C ATOM 675 CD2 TYR A 72 -7.809 -14.896 19.024 1.00 7.61 C ATOM 676 CE1 TYR A 72 -5.668 -16.595 19.365 1.00 7.39 C ATOM 677 CE2 TYR A 72 -7.886 -15.914 19.973 1.00 7.42 C ATOM 678 CZ TYR A 72 -6.772 -16.739 20.148 1.00 7.81 C ATOM 679 OH TYR A 72 -6.752 -17.806 21.115 1.00 7.83 O ATOM 680 HH TYR A 72 -5.876 -18.266 21.079 1.00 0.00 H ATOM 681 H TYR A 72 -7.030 -15.972 15.653 1.00 0.00 H ATOM 682 N ASP A 73 -7.757 -11.904 14.929 1.00 6.52 N ATOM 683 CA ASP A 73 -7.807 -11.050 13.768 1.00 7.07 C ATOM 684 C ASP A 73 -6.468 -10.431 13.391 1.00 6.85 C ATOM 685 O ASP A 73 -5.552 -10.196 14.232 1.00 7.04 O ATOM 686 CB ASP A 73 -8.858 -9.990 13.999 1.00 8.00 C ATOM 687 CG ASP A 73 -10.278 -10.555 14.010 1.00 9.55 C ATOM 688 OD1 ASP A 73 -10.585 -11.309 13.109 1.00 11.60 O ATOM 689 OD2 ASP A 73 -11.068 -10.043 14.811 1.00 11.72 O ATOM 690 H ASP A 73 -7.727 -11.472 15.874 1.00 0.00 H ATOM 691 N HIS A 74 -6.293 -10.275 12.074 1.00 6.78 N ATOM 692 CA HIS A 74 -5.113 -9.596 11.528 1.00 6.63 C ATOM 693 C HIS A 74 -3.784 -10.051 12.113 1.00 5.84 C ATOM 694 O HIS A 74 -2.983 -9.209 12.562 1.00 5.74 O ATOM 695 CB HIS A 74 -5.241 -8.078 11.622 1.00 7.28 C ATOM 696 CG HIS A 74 -6.387 -7.525 10.847 1.00 7.33 C ATOM 697 ND1 HIS A 74 -6.573 -7.830 9.521 1.00 8.00 N ATOM 698 CD2 HIS A 74 -7.390 -6.701 11.186 1.00 7.43 C ATOM 699 CE1 HIS A 74 -7.655 -7.263 9.074 1.00 7.40 C ATOM 700 NE2 HIS A 74 -8.176 -6.552 10.049 1.00 7.92 N ATOM 701 H HIS A 74 -7.012 -10.645 11.420 1.00 0.00 H ATOM 702 N MET A 75 -3.546 -11.372 12.148 1.00 5.98 N ATOM 703 CA MET A 75 -2.344 -11.938 12.651 1.00 5.98 C ATOM 704 C MET A 75 -1.321 -12.011 11.541 1.00 6.01 C ATOM 705 O MET A 75 -1.651 -12.297 10.400 1.00 5.55 O ATOM 706 CB MET A 75 -2.614 -13.339 13.220 1.00 5.76 C ATOM 707 CG MET A 75 -3.595 -13.275 14.383 1.00 5.81 C ATOM 708 SD MET A 75 -3.215 -12.177 15.794 1.00 6.08 S ATOM 709 CE MET A 75 -1.788 -13.084 16.401 1.00 6.49 C ATOM 710 H MET A 75 -4.280 -12.015 11.788 1.00 0.00 H ATOM 711 N LEU A 76 -0.054 -11.722 11.893 1.00 6.19 N ATOM 712 CA LEU A 76 1.036 -11.836 10.942 1.00 6.65 C ATOM 713 C LEU A 76 1.024 -13.167 10.264 1.00 6.44 C ATOM 714 O LEU A 76 0.860 -14.221 10.924 1.00 6.16 O ATOM 715 CB LEU A 76 2.422 -11.749 11.612 1.00 7.73 C ATOM 716 CG LEU A 76 2.961 -10.416 11.998 1.00 9.17 C ATOM 717 CD1 LEU A 76 4.361 -10.562 12.588 1.00 10.71 C ATOM 718 CD2 LEU A 76 3.066 -9.484 10.800 1.00 9.54 C ATOM 719 H LEU A 76 0.147 -11.411 12.865 1.00 0.00 H ATOM 720 N PRO A 77 1.237 -13.130 8.916 1.00 6.83 N ATOM 721 CA PRO A 77 1.453 -14.434 8.235 1.00 7.37 C ATOM 722 C PRO A 77 2.857 -14.926 8.474 1.00 7.83 C ATOM 723 O PRO A 77 3.649 -14.276 9.140 1.00 9.27 O ATOM 724 CB PRO A 77 1.305 -14.042 6.760 1.00 7.39 C ATOM 725 CG PRO A 77 1.854 -12.675 6.664 1.00 7.53 C ATOM 726 CD PRO A 77 1.510 -11.985 8.021 1.00 6.94 C ATOM 727 N ASN A 78 3.190 -16.121 8.038 1.00 8.66 N ATOM 728 CA ASN A 78 4.530 -16.556 8.093 1.00 9.51 C ATOM 729 C ASN A 78 5.321 -15.838 7.011 1.00 8.12 C ATOM 730 O ASN A 78 4.772 -15.278 6.082 1.00 8.74 O ATOM 731 CB ASN A 78 4.686 -18.086 8.003 1.00 11.12 C ATOM 732 CG ASN A 78 4.123 -18.683 6.725 1.00 13.29 C ATOM 733 OD1 ASN A 78 4.497 -18.373 5.616 1.00 11.81 O ATOM 734 ND2 ASN A 78 3.236 -19.581 6.896 1.00 15.58 N ATOM 735 HD22 ASN A 78 2.929 -19.832 7.857 1.00 0.00 H ATOM 736 HD21 ASN A 78 2.819 -20.063 6.074 1.00 0.00 H ATOM 737 H ASN A 78 2.459 -16.750 7.649 1.00 0.00 H ATOM 738 N ALA A 79 6.608 -15.968 7.073 1.00 8.50 N ATOM 739 CA ALA A 79 7.448 -15.201 6.186 1.00 9.05 C ATOM 740 C ALA A 79 7.342 -15.626 4.726 1.00 9.47 C ATOM 741 O ALA A 79 7.436 -14.810 3.864 1.00 9.07 O ATOM 742 CB ALA A 79 8.862 -15.343 6.668 1.00 9.30 C ATOM 743 H ALA A 79 7.034 -16.623 7.760 1.00 0.00 H ATOM 744 N THR A 80 7.253 -16.922 4.458 1.00 10.45 N ATOM 745 CA THR A 80 7.061 -17.383 3.084 1.00 11.87 C ATOM 746 C THR A 80 5.817 -16.797 2.438 1.00 11.32 C ATOM 747 O THR A 80 5.882 -16.296 1.283 1.00 9.68 O ATOM 748 CB THR A 80 7.010 -18.924 2.979 1.00 13.28 C ATOM 749 OG1 THR A 80 8.202 -19.430 3.552 1.00 15.29 O ATOM 750 CG2 THR A 80 6.999 -19.280 1.480 1.00 15.47 C ATOM 751 HG1 THR A 80 8.256 -19.149 4.500 1.00 0.00 H ATOM 752 H THR A 80 7.320 -17.615 5.231 1.00 0.00 H ATOM 753 N HIS A 81 4.716 -16.780 3.224 1.00 10.30 N ATOM 754 CA HIS A 81 3.489 -16.219 2.755 1.00 10.74 C ATOM 755 C HIS A 81 3.659 -14.699 2.459 1.00 9.79 C ATOM 756 O HIS A 81 3.205 -14.232 1.416 1.00 9.03 O ATOM 757 CB HIS A 81 2.467 -16.513 3.852 1.00 13.14 C ATOM 758 CG HIS A 81 1.109 -15.925 3.667 1.00 15.38 C ATOM 759 ND1 HIS A 81 -0.008 -16.536 4.200 1.00 19.35 N ATOM 760 CD2 HIS A 81 0.682 -14.742 3.167 1.00 17.78 C ATOM 761 CE1 HIS A 81 -1.077 -15.785 3.981 1.00 19.94 C ATOM 762 NE2 HIS A 81 -0.690 -14.706 3.313 1.00 19.68 N ATOM 763 H HIS A 81 4.764 -17.181 4.183 1.00 0.00 H ATOM 764 N PHE A 82 4.322 -13.979 3.353 1.00 8.41 N ATOM 765 CA PHE A 82 4.491 -12.556 3.160 1.00 7.95 C ATOM 766 C PHE A 82 5.361 -12.281 1.929 1.00 8.51 C ATOM 767 O PHE A 82 5.066 -11.414 1.150 1.00 8.93 O ATOM 768 CB PHE A 82 5.120 -11.899 4.394 1.00 7.67 C ATOM 769 CG PHE A 82 5.298 -10.422 4.241 1.00 7.02 C ATOM 770 CD1 PHE A 82 4.241 -9.589 4.395 1.00 7.57 C ATOM 771 CD2 PHE A 82 6.516 -9.869 3.880 1.00 7.74 C ATOM 772 CE1 PHE A 82 4.374 -8.225 4.251 1.00 7.40 C ATOM 773 CE2 PHE A 82 6.675 -8.518 3.719 1.00 7.54 C ATOM 774 CZ PHE A 82 5.575 -7.669 3.890 1.00 7.98 C ATOM 775 H PHE A 82 4.722 -14.439 4.196 1.00 0.00 H ATOM 776 N ALA A 83 6.435 -13.041 1.786 1.00 8.94 N ATOM 777 CA ALA A 83 7.358 -12.807 0.679 1.00 8.64 C ATOM 778 C ALA A 83 6.717 -13.079 -0.628 1.00 8.44 C ATOM 779 O ALA A 83 6.993 -12.388 -1.615 1.00 8.75 O ATOM 780 CB ALA A 83 8.591 -13.656 0.881 1.00 8.66 C ATOM 781 H ALA A 83 6.622 -13.807 2.464 1.00 0.00 H ATOM 782 N ASP A 84 5.929 -14.162 -0.720 1.00 9.13 N ATOM 783 CA ASP A 84 5.194 -14.490 -1.935 1.00 9.87 C ATOM 784 C ASP A 84 4.267 -13.327 -2.314 1.00 9.27 C ATOM 785 O ASP A 84 4.177 -12.886 -3.483 1.00 7.91 O ATOM 786 CB ASP A 84 4.391 -15.743 -1.730 1.00 11.11 C ATOM 787 CG ASP A 84 5.239 -17.038 -1.831 1.00 14.17 C ATOM 788 OD1 ASP A 84 6.450 -16.958 -2.096 1.00 16.40 O ATOM 789 OD2 ASP A 84 4.679 -18.123 -1.527 1.00 20.42 O ATOM 790 H ASP A 84 5.840 -14.789 0.105 1.00 0.00 H ATOM 791 N TYR A 85 3.609 -12.761 -1.318 1.00 8.18 N ATOM 792 CA TYR A 85 2.651 -11.747 -1.559 1.00 7.88 C ATOM 793 C TYR A 85 3.299 -10.405 -1.935 1.00 7.29 C ATOM 794 O TYR A 85 2.887 -9.795 -2.888 1.00 7.04 O ATOM 795 CB TYR A 85 1.706 -11.486 -0.342 1.00 7.90 C ATOM 796 CG TYR A 85 0.617 -10.472 -0.667 1.00 8.06 C ATOM 797 CD1 TYR A 85 -0.281 -10.726 -1.726 1.00 8.55 C ATOM 798 CD2 TYR A 85 0.400 -9.318 0.111 1.00 7.75 C ATOM 799 CE1 TYR A 85 -1.281 -9.843 -2.038 1.00 8.25 C ATOM 800 CE2 TYR A 85 -0.660 -8.463 -0.173 1.00 7.69 C ATOM 801 CZ TYR A 85 -1.443 -8.689 -1.260 1.00 7.62 C ATOM 802 OH TYR A 85 -2.471 -7.795 -1.524 1.00 8.03 O ATOM 803 HH TYR A 85 -2.955 -8.081 -2.339 1.00 0.00 H ATOM 804 H TYR A 85 3.798 -13.065 -0.342 1.00 0.00 H ATOM 805 N ALA A 86 4.333 -9.985 -1.180 1.00 7.39 N ATOM 806 CA ALA A 86 5.058 -8.768 -1.498 1.00 7.65 C ATOM 807 C ALA A 86 5.717 -8.889 -2.880 1.00 7.73 C ATOM 808 O ALA A 86 5.659 -7.935 -3.663 1.00 7.44 O ATOM 809 CB ALA A 86 6.139 -8.444 -0.454 1.00 8.19 C ATOM 810 H ALA A 86 4.618 -10.545 -0.351 1.00 0.00 H ATOM 811 N GLY A 87 6.290 -10.040 -3.205 1.00 7.72 N ATOM 812 CA GLY A 87 6.912 -10.217 -4.581 1.00 8.36 C ATOM 813 C GLY A 87 5.879 -10.144 -5.670 1.00 8.07 C ATOM 814 O GLY A 87 6.070 -9.517 -6.748 1.00 8.55 O ATOM 815 H GLY A 87 6.314 -10.821 -2.519 1.00 0.00 H ATOM 816 N SER A 88 4.677 -10.653 -5.417 1.00 8.72 N ATOM 817 CA SER A 88 3.617 -10.544 -6.398 1.00 8.12 C ATOM 818 C SER A 88 3.160 -9.088 -6.656 1.00 9.06 C ATOM 819 O SER A 88 2.546 -8.826 -7.672 1.00 8.73 O ATOM 820 CB SER A 88 2.392 -11.368 -5.998 1.00 8.83 C ATOM 821 OG SER A 88 1.462 -10.714 -5.140 1.00 9.27 O ATOM 822 HG SER A 88 1.915 -10.461 -4.297 1.00 0.00 H ATOM 823 H SER A 88 4.497 -11.131 -4.511 1.00 0.00 H ATOM 824 N LEU A 89 3.401 -8.190 -5.687 1.00 7.98 N ATOM 825 CA LEU A 89 3.131 -6.752 -5.878 1.00 8.48 C ATOM 826 C LEU A 89 4.286 -6.007 -6.507 1.00 7.91 C ATOM 827 O LEU A 89 4.277 -4.740 -6.607 1.00 9.88 O ATOM 828 CB LEU A 89 2.725 -6.171 -4.529 1.00 8.19 C ATOM 829 CG LEU A 89 1.444 -6.743 -3.976 1.00 8.34 C ATOM 830 CD1 LEU A 89 1.219 -6.115 -2.639 1.00 9.32 C ATOM 831 CD2 LEU A 89 0.254 -6.566 -4.900 1.00 8.58 C ATOM 832 H LEU A 89 3.788 -8.517 -4.779 1.00 0.00 H ATOM 833 N GLY A 90 5.311 -6.748 -6.947 1.00 8.34 N ATOM 834 CA GLY A 90 6.466 -6.092 -7.548 1.00 7.87 C ATOM 835 C GLY A 90 7.525 -5.540 -6.611 1.00 9.10 C ATOM 836 O GLY A 90 8.339 -4.700 -7.031 1.00 9.87 O ATOM 837 H GLY A 90 5.283 -7.784 -6.861 1.00 0.00 H ATOM 838 N VAL A 91 7.565 -6.020 -5.372 1.00 9.33 N ATOM 839 CA VAL A 91 8.520 -5.443 -4.389 1.00 8.94 C ATOM 840 C VAL A 91 9.739 -6.338 -4.346 1.00 10.05 C ATOM 841 O VAL A 91 9.622 -7.525 -4.247 1.00 10.14 O ATOM 842 CB VAL A 91 7.896 -5.347 -2.990 1.00 8.75 C ATOM 843 CG1 VAL A 91 8.904 -4.810 -1.987 1.00 9.25 C ATOM 844 CG2 VAL A 91 6.632 -4.469 -3.106 1.00 8.75 C ATOM 845 H VAL A 91 6.931 -6.795 -5.091 1.00 0.00 H ATOM 846 N SER A 92 10.923 -5.758 -4.495 1.00 10.72 N ATOM 847 CA SER A 92 12.183 -6.508 -4.294 1.00 11.92 C ATOM 848 C SER A 92 13.006 -5.865 -3.179 1.00 11.24 C ATOM 849 O SER A 92 12.611 -4.855 -2.608 1.00 11.43 O ATOM 850 CB SER A 92 13.013 -6.532 -5.569 1.00 13.32 C ATOM 851 OG SER A 92 13.688 -5.300 -5.666 1.00 14.94 O ATOM 852 HG SER A 92 14.237 -5.290 -6.490 1.00 0.00 H ATOM 853 H SER A 92 10.967 -4.753 -4.759 1.00 0.00 H ATOM 854 N ALA A 93 14.170 -6.424 -2.847 1.00 12.40 N ATOM 855 CA ALA A 93 14.958 -5.831 -1.806 1.00 13.58 C ATOM 856 C ALA A 93 15.445 -4.431 -2.166 1.00 13.60 C ATOM 857 O ALA A 93 15.689 -3.667 -1.277 1.00 17.56 O ATOM 858 CB ALA A 93 16.102 -6.742 -1.419 1.00 13.11 C ATOM 859 H ALA A 93 14.502 -7.279 -3.337 1.00 0.00 H ATOM 860 N ALA A 94 15.487 -4.077 -3.439 1.00 13.32 N ATOM 861 CA ALA A 94 15.952 -2.769 -3.910 1.00 13.83 C ATOM 862 C ALA A 94 14.881 -1.681 -3.689 1.00 13.41 C ATOM 863 O ALA A 94 15.177 -0.471 -3.758 1.00 13.37 O ATOM 864 CB ALA A 94 16.259 -2.845 -5.397 1.00 15.19 C ATOM 865 H ALA A 94 15.171 -4.768 -4.149 1.00 0.00 H ATOM 866 N THR A 95 13.624 -2.098 -3.482 1.00 10.65 N ATOM 867 CA THR A 95 12.516 -1.164 -3.500 1.00 9.84 C ATOM 868 C THR A 95 12.384 -0.263 -2.318 1.00 9.09 C ATOM 869 O THR A 95 12.432 -0.725 -1.215 1.00 8.26 O ATOM 870 CB THR A 95 11.252 -1.963 -3.731 1.00 9.12 C ATOM 871 OG1 THR A 95 11.441 -2.913 -4.825 1.00 9.41 O ATOM 872 CG2 THR A 95 10.043 -1.084 -3.944 1.00 9.14 C ATOM 873 HG1 THR A 95 11.667 -2.420 -5.653 1.00 0.00 H ATOM 874 H THR A 95 13.441 -3.107 -3.306 1.00 0.00 H ATOM 875 N HIS A 96 12.125 1.019 -2.572 1.00 8.81 N ATOM 876 CA HIS A 96 11.661 1.959 -1.568 1.00 8.79 C ATOM 877 C HIS A 96 10.137 1.868 -1.604 1.00 8.65 C ATOM 878 O HIS A 96 9.460 2.338 -2.536 1.00 8.89 O ATOM 879 CB HIS A 96 12.072 3.407 -1.876 1.00 8.96 C ATOM 880 CG HIS A 96 11.663 4.387 -0.828 1.00 9.21 C ATOM 881 ND1 HIS A 96 11.969 5.726 -0.901 1.00 8.72 N ATOM 882 CD2 HIS A 96 10.982 4.220 0.320 1.00 8.84 C ATOM 883 CE1 HIS A 96 11.457 6.346 0.143 1.00 9.42 C ATOM 884 NE2 HIS A 96 10.832 5.460 0.888 1.00 9.33 N ATOM 885 H HIS A 96 12.263 1.365 -3.543 1.00 0.00 H ATOM 886 N VAL A 97 9.565 1.228 -0.612 1.00 7.71 N ATOM 887 CA VAL A 97 8.132 1.052 -0.603 1.00 7.46 C ATOM 888 C VAL A 97 7.539 2.245 0.141 1.00 7.35 C ATOM 889 O VAL A 97 7.995 2.631 1.202 1.00 7.23 O ATOM 890 CB VAL A 97 7.789 -0.253 0.165 1.00 7.94 C ATOM 891 CG1 VAL A 97 6.339 -0.401 0.379 1.00 8.51 C ATOM 892 CG2 VAL A 97 8.340 -1.473 -0.558 1.00 8.80 C ATOM 893 H VAL A 97 10.142 0.849 0.166 1.00 0.00 H ATOM 894 N VAL A 98 6.493 2.846 -0.422 1.00 6.68 N ATOM 895 CA VAL A 98 5.807 3.912 0.233 1.00 6.77 C ATOM 896 C VAL A 98 4.347 3.460 0.341 1.00 6.89 C ATOM 897 O VAL A 98 3.692 3.228 -0.661 1.00 7.14 O ATOM 898 CB VAL A 98 5.941 5.203 -0.573 1.00 6.60 C ATOM 899 CG1 VAL A 98 5.048 6.318 -0.007 1.00 6.59 C ATOM 900 CG2 VAL A 98 7.417 5.621 -0.584 1.00 6.88 C ATOM 901 H VAL A 98 6.169 2.532 -1.359 1.00 0.00 H ATOM 902 N ILE A 99 3.837 3.442 1.563 1.00 7.06 N ATOM 903 CA ILE A 99 2.489 3.020 1.763 1.00 6.62 C ATOM 904 C ILE A 99 1.532 4.169 2.166 1.00 7.01 C ATOM 905 O ILE A 99 1.863 5.036 2.971 1.00 5.99 O ATOM 906 CB ILE A 99 2.465 1.916 2.863 1.00 7.17 C ATOM 907 CG1 ILE A 99 3.473 0.816 2.607 1.00 7.77 C ATOM 908 CG2 ILE A 99 1.108 1.284 3.030 1.00 7.36 C ATOM 909 CD1 ILE A 99 3.960 0.283 3.861 1.00 7.58 C ATOM 910 H ILE A 99 4.418 3.735 2.375 1.00 0.00 H ATOM 911 N TYR A 100 0.309 4.094 1.665 1.00 6.03 N ATOM 912 CA TYR A 100 -0.776 5.022 2.077 1.00 6.44 C ATOM 913 C TYR A 100 -2.082 4.313 2.244 1.00 6.52 C ATOM 914 O TYR A 100 -2.182 3.121 1.989 1.00 7.07 O ATOM 915 CB TYR A 100 -0.930 6.174 1.045 1.00 6.41 C ATOM 916 CG TYR A 100 -1.565 5.800 -0.318 1.00 6.62 C ATOM 917 CD1 TYR A 100 -2.916 6.040 -0.536 1.00 6.78 C ATOM 918 CD2 TYR A 100 -0.817 5.213 -1.333 1.00 6.64 C ATOM 919 CE1 TYR A 100 -3.496 5.774 -1.775 1.00 7.15 C ATOM 920 CE2 TYR A 100 -1.386 4.843 -2.533 1.00 6.85 C ATOM 921 CZ TYR A 100 -2.712 5.190 -2.751 1.00 6.96 C ATOM 922 OH TYR A 100 -3.325 4.893 -3.867 1.00 8.19 O ATOM 923 HH TYR A 100 -4.257 5.224 -3.828 1.00 0.00 H ATOM 924 H TYR A 100 0.100 3.360 0.958 1.00 0.00 H ATOM 925 N ASP A 101 -3.101 5.025 2.754 1.00 6.91 N ATOM 926 CA ASP A 101 -4.457 4.557 2.637 1.00 6.84 C ATOM 927 C ASP A 101 -5.341 5.740 2.424 1.00 7.42 C ATOM 928 O ASP A 101 -4.893 6.886 2.401 1.00 6.28 O ATOM 929 CB ASP A 101 -4.847 3.727 3.912 1.00 7.07 C ATOM 930 CG ASP A 101 -4.800 4.538 5.201 1.00 7.31 C ATOM 931 OD1 ASP A 101 -5.441 5.644 5.300 1.00 6.98 O ATOM 932 OD2 ASP A 101 -4.140 4.072 6.178 1.00 7.38 O ATOM 933 H ASP A 101 -2.908 5.925 3.239 1.00 0.00 H ATOM 934 N GLY A 102 -6.628 5.464 2.285 1.00 7.63 N ATOM 935 CA GLY A 102 -7.579 6.556 1.971 1.00 8.52 C ATOM 936 C GLY A 102 -8.475 6.898 3.122 1.00 8.84 C ATOM 937 O GLY A 102 -9.595 7.342 2.907 1.00 9.94 O ATOM 938 H GLY A 102 -6.969 4.488 2.395 1.00 0.00 H ATOM 939 N SER A 103 -8.038 6.651 4.330 1.00 8.95 N ATOM 940 CA SER A 103 -8.882 6.917 5.465 1.00 10.10 C ATOM 941 C SER A 103 -9.173 8.413 5.688 1.00 10.95 C ATOM 942 O SER A 103 -8.439 9.311 5.251 1.00 11.46 O ATOM 943 CB SER A 103 -8.256 6.268 6.715 1.00 10.03 C ATOM 944 OG SER A 103 -7.042 6.953 7.017 1.00 9.66 O ATOM 945 HG SER A 103 -6.422 6.878 6.249 1.00 0.00 H ATOM 946 H SER A 103 -7.083 6.263 4.470 1.00 0.00 H ATOM 947 N ASP A 104 -10.322 8.642 6.298 1.00 15.53 N ATOM 948 CA ASP A 104 -10.724 9.899 6.889 1.00 18.05 C ATOM 949 C ASP A 104 -9.697 10.452 7.850 1.00 19.57 C ATOM 950 O ASP A 104 -9.512 11.651 7.898 1.00 20.54 O ATOM 951 CB ASP A 104 -12.034 9.700 7.679 1.00 23.31 C ATOM 952 CG ASP A 104 -13.271 9.326 6.779 1.00 25.74 C ATOM 953 OD1 ASP A 104 -13.308 9.637 5.553 1.00 31.98 O ATOM 954 OD2 ASP A 104 -14.219 8.712 7.329 1.00 29.44 O ATOM 955 H ASP A 104 -10.995 7.851 6.358 1.00 0.00 H ATOM 956 N GLN A 105 -9.050 9.574 8.633 1.00 20.23 N ATOM 957 CA GLN A 105 -8.028 10.013 9.611 1.00 22.24 C ATOM 958 C GLN A 105 -6.702 10.487 8.982 1.00 21.13 C ATOM 959 O GLN A 105 -5.877 11.024 9.692 1.00 25.59 O ATOM 960 CB GLN A 105 -7.746 8.856 10.614 1.00 23.63 C ATOM 961 CG GLN A 105 -8.976 8.414 11.439 1.00 22.43 C ATOM 962 CD GLN A 105 -9.783 7.292 10.838 1.00 22.86 C ATOM 963 OE1 GLN A 105 -9.607 6.909 9.682 1.00 20.04 O ATOM 964 NE2 GLN A 105 -10.707 6.741 11.645 1.00 27.97 N ATOM 965 HE22 GLN A 105 -10.825 7.093 12.616 1.00 0.00 H ATOM 966 HE21 GLN A 105 -11.303 5.963 11.298 1.00 0.00 H ATOM 967 H GLN A 105 -9.272 8.561 8.551 1.00 0.00 H ATOM 968 N GLY A 106 -6.452 10.164 7.716 1.00 17.18 N ATOM 969 CA GLY A 106 -5.209 10.419 7.044 1.00 15.59 C ATOM 970 C GLY A 106 -4.427 9.128 6.819 1.00 14.30 C ATOM 971 O GLY A 106 -4.281 8.662 5.666 1.00 14.53 O ATOM 972 H GLY A 106 -7.208 9.695 7.177 1.00 0.00 H ATOM 973 N LEU A 107 -3.950 8.537 7.934 1.00 11.67 N ATOM 974 CA LEU A 107 -3.445 7.177 7.900 1.00 10.80 C ATOM 975 C LEU A 107 -4.116 6.396 8.980 1.00 8.99 C ATOM 976 O LEU A 107 -4.379 6.924 10.106 1.00 7.67 O ATOM 977 CB LEU A 107 -1.913 7.145 8.032 1.00 10.78 C ATOM 978 CG LEU A 107 -1.206 7.707 6.776 1.00 10.91 C ATOM 979 CD1 LEU A 107 0.268 7.719 7.161 1.00 12.60 C ATOM 980 CD2 LEU A 107 -1.522 6.969 5.456 1.00 11.06 C ATOM 981 H LEU A 107 -3.944 9.064 8.831 1.00 0.00 H ATOM 982 N TYR A 108 -4.416 5.141 8.637 1.00 8.07 N ATOM 983 CA TYR A 108 -5.183 4.307 9.493 1.00 8.31 C ATOM 984 C TYR A 108 -4.616 2.902 9.577 1.00 7.87 C ATOM 985 O TYR A 108 -4.144 2.446 10.609 1.00 7.71 O ATOM 986 CB TYR A 108 -6.635 4.298 9.020 1.00 8.67 C ATOM 987 CG TYR A 108 -7.546 3.331 9.794 1.00 8.79 C ATOM 988 CD1 TYR A 108 -8.046 3.668 11.045 1.00 9.09 C ATOM 989 CD2 TYR A 108 -7.957 2.139 9.209 1.00 10.24 C ATOM 990 CE1 TYR A 108 -8.912 2.814 11.772 1.00 9.25 C ATOM 991 CE2 TYR A 108 -8.791 1.271 9.912 1.00 10.07 C ATOM 992 CZ TYR A 108 -9.255 1.603 11.186 1.00 9.68 C ATOM 993 OH TYR A 108 -10.163 0.755 11.834 1.00 11.34 O ATOM 994 HH TYR A 108 -10.390 1.132 12.721 1.00 0.00 H ATOM 995 H TYR A 108 -4.082 4.767 7.726 1.00 0.00 H ATOM 996 N SER A 109 -4.685 2.224 8.455 1.00 7.24 N ATOM 997 CA SER A 109 -4.160 0.837 8.328 1.00 6.92 C ATOM 998 C SER A 109 -2.775 0.785 7.672 1.00 6.33 C ATOM 999 O SER A 109 -2.043 -0.215 7.810 1.00 6.40 O ATOM 1000 CB SER A 109 -5.184 0.067 7.507 1.00 6.56 C ATOM 1001 OG SER A 109 -5.407 0.683 6.253 1.00 6.32 O ATOM 1002 HG SER A 109 -4.557 0.715 5.747 1.00 0.00 H ATOM 1003 H SER A 109 -5.122 2.672 7.625 1.00 0.00 H ATOM 1004 N ALA A 110 -2.364 1.852 6.982 1.00 5.95 N ATOM 1005 CA ALA A 110 -1.033 1.877 6.351 1.00 5.61 C ATOM 1006 C ALA A 110 0.116 1.668 7.358 1.00 5.32 C ATOM 1007 O ALA A 110 1.020 0.916 7.038 1.00 5.12 O ATOM 1008 CB ALA A 110 -0.819 3.168 5.531 1.00 5.59 C ATOM 1009 H ALA A 110 -2.992 2.676 6.889 1.00 0.00 H ATOM 1010 N PRO A 111 0.085 2.277 8.550 1.00 5.55 N ATOM 1011 CA PRO A 111 1.191 2.031 9.497 1.00 5.28 C ATOM 1012 C PRO A 111 1.447 0.544 9.794 1.00 5.77 C ATOM 1013 O PRO A 111 2.646 0.120 9.988 1.00 6.06 O ATOM 1014 CB PRO A 111 0.795 2.854 10.712 1.00 5.56 C ATOM 1015 CG PRO A 111 0.046 4.046 10.094 1.00 5.67 C ATOM 1016 CD PRO A 111 -0.774 3.382 9.012 1.00 5.75 C ATOM 1017 N ARG A 112 0.379 -0.276 9.832 1.00 5.51 N ATOM 1018 CA ARG A 112 0.501 -1.719 10.042 1.00 5.47 C ATOM 1019 C ARG A 112 1.413 -2.337 8.982 1.00 5.53 C ATOM 1020 O ARG A 112 2.234 -3.209 9.283 1.00 5.68 O ATOM 1021 CB ARG A 112 -0.878 -2.349 10.019 1.00 5.78 C ATOM 1022 CG ARG A 112 -0.887 -3.862 9.934 1.00 6.12 C ATOM 1023 CD ARG A 112 -0.367 -4.581 11.181 1.00 6.19 C ATOM 1024 NE ARG A 112 -0.424 -6.053 10.991 1.00 6.97 N ATOM 1025 CZ ARG A 112 -0.574 -6.955 11.961 1.00 7.62 C ATOM 1026 NH1 ARG A 112 -0.560 -6.604 13.196 1.00 7.61 N ATOM 1027 NH2 ARG A 112 -0.569 -8.268 11.662 1.00 8.01 N ATOM 1028 HE ARG A 112 -0.340 -6.411 10.018 1.00 0.00 H ATOM 1029 HH12 ARG A 112 -0.678 -7.320 13.941 1.00 0.00 H ATOM 1030 HH11 ARG A 112 -0.430 -5.604 13.451 1.00 0.00 H ATOM 1031 HH22 ARG A 112 -0.686 -8.974 12.417 1.00 0.00 H ATOM 1032 HH21 ARG A 112 -0.448 -8.576 10.676 1.00 0.00 H ATOM 1033 H ARG A 112 -0.569 0.132 9.707 1.00 0.00 H ATOM 1034 N VAL A 113 1.249 -1.871 7.731 1.00 5.34 N ATOM 1035 CA VAL A 113 2.021 -2.473 6.609 1.00 5.30 C ATOM 1036 C VAL A 113 3.461 -1.993 6.648 1.00 5.43 C ATOM 1037 O VAL A 113 4.389 -2.780 6.410 1.00 6.06 O ATOM 1038 CB VAL A 113 1.304 -2.224 5.301 1.00 5.45 C ATOM 1039 CG1 VAL A 113 1.968 -2.972 4.159 1.00 5.69 C ATOM 1040 CG2 VAL A 113 -0.115 -2.749 5.482 1.00 5.76 C ATOM 1041 H VAL A 113 0.585 -1.092 7.548 1.00 0.00 H ATOM 1042 N TRP A 114 3.677 -0.741 7.064 1.00 5.66 N ATOM 1043 CA TRP A 114 5.054 -0.209 7.238 1.00 5.87 C ATOM 1044 C TRP A 114 5.739 -1.098 8.278 1.00 5.89 C ATOM 1045 O TRP A 114 6.869 -1.593 8.062 1.00 5.53 O ATOM 1046 CB TRP A 114 4.974 1.260 7.680 1.00 5.98 C ATOM 1047 CG TRP A 114 6.157 1.854 8.328 1.00 6.13 C ATOM 1048 CD1 TRP A 114 7.274 2.390 7.720 1.00 6.31 C ATOM 1049 CD2 TRP A 114 6.349 2.034 9.733 1.00 6.46 C ATOM 1050 NE1 TRP A 114 8.118 2.868 8.667 1.00 6.72 N ATOM 1051 CE2 TRP A 114 7.577 2.659 9.913 1.00 6.41 C ATOM 1052 CE3 TRP A 114 5.564 1.749 10.841 1.00 6.55 C ATOM 1053 CZ2 TRP A 114 8.055 2.979 11.181 1.00 6.51 C ATOM 1054 CZ3 TRP A 114 6.053 2.022 12.076 1.00 6.71 C ATOM 1055 CH2 TRP A 114 7.283 2.629 12.238 1.00 6.52 C ATOM 1056 HE1 TRP A 114 9.034 3.323 8.479 1.00 0.00 H ATOM 1057 H TRP A 114 2.864 -0.126 7.270 1.00 0.00 H ATOM 1058 N TRP A 115 5.065 -1.299 9.411 1.00 5.25 N ATOM 1059 CA TRP A 115 5.575 -2.159 10.469 1.00 5.73 C ATOM 1060 C TRP A 115 5.863 -3.595 9.983 1.00 6.03 C ATOM 1061 O TRP A 115 6.983 -4.185 10.257 1.00 5.98 O ATOM 1062 CB TRP A 115 4.667 -2.071 11.709 1.00 5.24 C ATOM 1063 CG TRP A 115 4.903 -3.083 12.778 1.00 5.38 C ATOM 1064 CD1 TRP A 115 5.842 -3.030 13.735 1.00 5.58 C ATOM 1065 CD2 TRP A 115 4.293 -4.383 12.899 1.00 5.40 C ATOM 1066 NE1 TRP A 115 5.839 -4.189 14.496 1.00 5.21 N ATOM 1067 CE2 TRP A 115 4.856 -5.014 14.012 1.00 5.46 C ATOM 1068 CE3 TRP A 115 3.273 -5.057 12.199 1.00 6.14 C ATOM 1069 CZ2 TRP A 115 4.468 -6.292 14.420 1.00 5.71 C ATOM 1070 CZ3 TRP A 115 2.879 -6.302 12.604 1.00 6.18 C ATOM 1071 CH2 TRP A 115 3.482 -6.920 13.706 1.00 6.09 C ATOM 1072 HE1 TRP A 115 6.472 -4.397 15.295 1.00 0.00 H ATOM 1073 H TRP A 115 4.148 -0.827 9.543 1.00 0.00 H ATOM 1074 N MET A 116 4.914 -4.147 9.239 1.00 6.03 N ATOM 1075 CA MET A 116 5.003 -5.521 8.734 1.00 6.60 C ATOM 1076 C MET A 116 6.235 -5.741 7.788 1.00 6.43 C ATOM 1077 O MET A 116 6.930 -6.763 7.883 1.00 6.48 O ATOM 1078 CB MET A 116 3.667 -5.877 8.084 1.00 7.25 C ATOM 1079 CG MET A 116 3.413 -7.326 7.802 1.00 7.83 C ATOM 1080 SD MET A 116 1.671 -7.834 7.938 1.00 8.86 S ATOM 1081 CE MET A 116 0.954 -6.807 6.637 1.00 8.95 C ATOM 1082 H MET A 116 4.073 -3.583 9.004 1.00 0.00 H ATOM 1083 N PHE A 117 6.504 -4.786 6.898 1.00 6.31 N ATOM 1084 CA PHE A 117 7.673 -4.867 5.973 1.00 6.36 C ATOM 1085 C PHE A 117 8.959 -4.854 6.800 1.00 6.29 C ATOM 1086 O PHE A 117 9.818 -5.695 6.614 1.00 5.95 O ATOM 1087 CB PHE A 117 7.629 -3.693 4.967 1.00 6.09 C ATOM 1088 CG PHE A 117 6.925 -4.047 3.695 1.00 6.04 C ATOM 1089 CD1 PHE A 117 7.592 -4.764 2.680 1.00 5.79 C ATOM 1090 CD2 PHE A 117 5.633 -3.688 3.484 1.00 6.15 C ATOM 1091 CE1 PHE A 117 6.948 -5.080 1.506 1.00 5.65 C ATOM 1092 CE2 PHE A 117 4.978 -4.029 2.289 1.00 6.18 C ATOM 1093 CZ PHE A 117 5.635 -4.760 1.337 1.00 6.10 C ATOM 1094 H PHE A 117 5.879 -3.957 6.846 1.00 0.00 H ATOM 1095 N ARG A 118 8.998 -4.002 7.817 1.00 6.86 N ATOM 1096 CA ARG A 118 10.177 -3.894 8.666 1.00 7.35 C ATOM 1097 C ARG A 118 10.370 -5.169 9.447 1.00 6.95 C ATOM 1098 O ARG A 118 11.492 -5.681 9.592 1.00 7.31 O ATOM 1099 CB ARG A 118 10.056 -2.653 9.580 1.00 7.26 C ATOM 1100 CG ARG A 118 10.019 -1.341 8.778 1.00 8.31 C ATOM 1101 CD ARG A 118 9.713 -0.134 9.725 1.00 8.65 C ATOM 1102 NE ARG A 118 10.613 -0.193 10.859 1.00 9.09 N ATOM 1103 CZ ARG A 118 10.256 -0.326 12.117 1.00 10.55 C ATOM 1104 NH1 ARG A 118 8.955 -0.201 12.500 1.00 11.03 N ATOM 1105 NH2 ARG A 118 11.200 -0.497 13.008 1.00 11.09 N ATOM 1106 HE ARG A 118 11.631 -0.124 10.660 1.00 0.00 H ATOM 1107 HH12 ARG A 118 8.695 -0.310 13.501 1.00 0.00 H ATOM 1108 HH11 ARG A 118 8.222 0.004 11.791 1.00 0.00 H ATOM 1109 HH22 ARG A 118 10.953 -0.606 14.012 1.00 0.00 H ATOM 1110 HH21 ARG A 118 12.196 -0.524 12.711 1.00 0.00 H ATOM 1111 H ARG A 118 8.172 -3.401 8.011 1.00 0.00 H ATOM 1112 N ALA A 119 9.271 -5.707 9.963 1.00 6.54 N ATOM 1113 CA ALA A 119 9.311 -6.925 10.710 1.00 6.81 C ATOM 1114 C ALA A 119 9.888 -8.071 9.911 1.00 6.70 C ATOM 1115 O ALA A 119 10.549 -8.926 10.472 1.00 7.52 O ATOM 1116 CB ALA A 119 7.925 -7.261 11.298 1.00 6.93 C ATOM 1117 H ALA A 119 8.358 -5.230 9.820 1.00 0.00 H ATOM 1118 N PHE A 120 9.675 -8.059 8.624 1.00 6.66 N ATOM 1119 CA PHE A 120 10.088 -9.152 7.755 1.00 7.10 C ATOM 1120 C PHE A 120 11.350 -8.823 7.086 1.00 7.21 C ATOM 1121 O PHE A 120 11.707 -9.503 6.164 1.00 7.56 O ATOM 1122 CB PHE A 120 8.986 -9.458 6.754 1.00 7.00 C ATOM 1123 CG PHE A 120 7.861 -10.315 7.332 1.00 6.95 C ATOM 1124 CD1 PHE A 120 8.107 -11.597 7.812 1.00 7.24 C ATOM 1125 CD2 PHE A 120 6.564 -9.842 7.360 1.00 7.50 C ATOM 1126 CE1 PHE A 120 7.042 -12.342 8.313 1.00 7.43 C ATOM 1127 CE2 PHE A 120 5.504 -10.634 7.827 1.00 7.08 C ATOM 1128 CZ PHE A 120 5.783 -11.841 8.334 1.00 7.33 C ATOM 1129 H PHE A 120 9.193 -7.239 8.203 1.00 0.00 H ATOM 1130 N GLY A 121 12.021 -7.776 7.561 1.00 7.59 N ATOM 1131 CA GLY A 121 13.425 -7.507 7.155 1.00 8.21 C ATOM 1132 C GLY A 121 13.634 -6.542 5.980 1.00 7.89 C ATOM 1133 O GLY A 121 14.735 -6.389 5.447 1.00 7.50 O ATOM 1134 H GLY A 121 11.553 -7.133 8.231 1.00 0.00 H ATOM 1135 N HIS A 122 12.566 -5.832 5.583 1.00 7.86 N ATOM 1136 CA HIS A 122 12.603 -4.818 4.546 1.00 8.06 C ATOM 1137 C HIS A 122 12.443 -3.424 5.116 1.00 8.20 C ATOM 1138 O HIS A 122 11.318 -2.999 5.409 1.00 8.58 O ATOM 1139 CB HIS A 122 11.473 -5.042 3.559 1.00 7.57 C ATOM 1140 CG HIS A 122 11.596 -4.173 2.356 1.00 8.20 C ATOM 1141 ND1 HIS A 122 12.199 -4.588 1.200 1.00 8.71 N ATOM 1142 CD2 HIS A 122 11.206 -2.908 2.142 1.00 8.68 C ATOM 1143 CE1 HIS A 122 12.213 -3.587 0.333 1.00 8.80 C ATOM 1144 NE2 HIS A 122 11.589 -2.561 0.879 1.00 8.86 N ATOM 1145 H HIS A 122 11.655 -6.021 6.048 1.00 0.00 H ATOM 1146 N HIS A 123 13.563 -2.721 5.279 1.00 7.32 N ATOM 1147 CA HIS A 123 13.623 -1.499 6.096 1.00 7.73 C ATOM 1148 C HIS A 123 13.508 -0.267 5.249 1.00 7.55 C ATOM 1149 O HIS A 123 13.280 0.813 5.767 1.00 8.42 O ATOM 1150 CB HIS A 123 14.920 -1.486 6.975 1.00 8.24 C ATOM 1151 CG HIS A 123 14.963 -2.631 7.913 1.00 8.64 C ATOM 1152 ND1 HIS A 123 14.216 -2.656 9.084 1.00 9.55 N ATOM 1153 CD2 HIS A 123 15.542 -3.833 7.798 1.00 8.81 C ATOM 1154 CE1 HIS A 123 14.371 -3.828 9.676 1.00 9.31 C ATOM 1155 NE2 HIS A 123 15.158 -4.565 8.907 1.00 9.60 N ATOM 1156 H HIS A 123 14.431 -3.050 4.809 1.00 0.00 H ATOM 1157 N SER A 124 13.641 -0.406 3.948 1.00 7.48 N ATOM 1158 CA SER A 124 13.414 0.753 3.099 1.00 7.58 C ATOM 1159 C SER A 124 11.945 0.921 2.735 1.00 7.05 C ATOM 1160 O SER A 124 11.529 0.676 1.577 1.00 6.90 O ATOM 1161 CB SER A 124 14.284 0.722 1.812 1.00 8.54 C ATOM 1162 OG SER A 124 14.093 -0.462 1.079 1.00 10.41 O ATOM 1163 HG SER A 124 13.142 -0.534 0.813 1.00 0.00 H ATOM 1164 H SER A 124 13.903 -1.324 3.535 1.00 0.00 H ATOM 1165 N VAL A 125 11.218 1.443 3.723 1.00 6.56 N ATOM 1166 CA VAL A 125 9.796 1.570 3.627 1.00 6.12 C ATOM 1167 C VAL A 125 9.407 2.822 4.394 1.00 6.04 C ATOM 1168 O VAL A 125 9.934 3.109 5.435 1.00 6.57 O ATOM 1169 CB VAL A 125 9.071 0.281 4.190 1.00 5.81 C ATOM 1170 CG1 VAL A 125 9.484 -0.068 5.598 1.00 5.58 C ATOM 1171 CG2 VAL A 125 7.575 0.413 4.033 1.00 5.85 C ATOM 1172 H VAL A 125 11.698 1.767 4.587 1.00 0.00 H ATOM 1173 N SER A 126 8.411 3.555 3.885 1.00 5.88 N ATOM 1174 CA SER A 126 7.935 4.767 4.475 1.00 6.01 C ATOM 1175 C SER A 126 6.459 4.838 4.334 1.00 5.79 C ATOM 1176 O SER A 126 5.866 4.043 3.592 1.00 5.56 O ATOM 1177 CB SER A 126 8.512 5.987 3.692 1.00 6.72 C ATOM 1178 OG SER A 126 9.954 5.942 3.589 1.00 6.85 O ATOM 1179 HG SER A 126 10.349 5.946 4.497 1.00 0.00 H ATOM 1180 H SER A 126 7.957 3.224 3.010 1.00 0.00 H ATOM 1181 N LEU A 127 5.891 5.874 4.899 1.00 5.96 N ATOM 1182 CA LEU A 127 4.469 6.139 4.781 1.00 6.19 C ATOM 1183 C LEU A 127 4.264 7.553 4.223 1.00 6.89 C ATOM 1184 O LEU A 127 4.993 8.487 4.581 1.00 6.50 O ATOM 1185 CB LEU A 127 3.908 6.098 6.174 1.00 6.02 C ATOM 1186 CG LEU A 127 3.821 4.747 6.901 1.00 6.07 C ATOM 1187 CD1 LEU A 127 3.895 4.866 8.431 1.00 6.15 C ATOM 1188 CD2 LEU A 127 2.520 4.071 6.457 1.00 6.27 C ATOM 1189 H LEU A 127 6.480 6.530 5.452 1.00 0.00 H ATOM 1190 N LEU A 128 3.207 7.691 3.446 1.00 7.31 N ATOM 1191 CA LEU A 128 2.797 8.980 2.893 1.00 7.79 C ATOM 1192 C LEU A 128 1.992 9.730 3.937 1.00 8.52 C ATOM 1193 O LEU A 128 0.819 9.449 4.242 1.00 7.38 O ATOM 1194 CB LEU A 128 1.987 8.794 1.657 1.00 8.30 C ATOM 1195 CG LEU A 128 1.395 10.014 0.966 1.00 9.65 C ATOM 1196 CD1 LEU A 128 2.502 10.881 0.538 1.00 10.57 C ATOM 1197 CD2 LEU A 128 0.672 9.541 -0.304 1.00 10.76 C ATOM 1198 H LEU A 128 2.642 6.848 3.218 1.00 0.00 H ATOM 1199 N ASP A 129 2.596 10.792 4.408 1.00 8.66 N ATOM 1200 CA ASP A 129 2.013 11.558 5.472 1.00 9.27 C ATOM 1201 C ASP A 129 0.750 12.228 4.960 1.00 9.21 C ATOM 1202 O ASP A 129 0.758 12.842 3.925 1.00 10.01 O ATOM 1203 CB ASP A 129 3.022 12.629 5.903 1.00 10.15 C ATOM 1204 CG ASP A 129 2.630 13.363 7.174 1.00 10.67 C ATOM 1205 OD1 ASP A 129 1.856 12.816 8.061 1.00 11.21 O ATOM 1206 OD2 ASP A 129 3.246 14.462 7.302 1.00 13.25 O ATOM 1207 H ASP A 129 3.510 11.084 4.006 1.00 0.00 H ATOM 1208 N GLY A 130 -0.354 11.979 5.633 1.00 8.93 N ATOM 1209 CA GLY A 130 -1.633 12.490 5.270 1.00 8.66 C ATOM 1210 C GLY A 130 -2.454 11.642 4.350 1.00 8.82 C ATOM 1211 O GLY A 130 -3.661 11.948 4.098 1.00 9.32 O ATOM 1212 H GLY A 130 -0.288 11.375 6.477 1.00 0.00 H ATOM 1213 N GLY A 131 -1.842 10.578 3.831 1.00 8.52 N ATOM 1214 CA GLY A 131 -2.485 9.605 2.959 1.00 8.77 C ATOM 1215 C GLY A 131 -3.189 10.165 1.780 1.00 8.84 C ATOM 1216 O GLY A 131 -2.820 11.219 1.286 1.00 8.82 O ATOM 1217 H GLY A 131 -0.839 10.433 4.064 1.00 0.00 H ATOM 1218 N PHE A 132 -4.165 9.409 1.294 1.00 9.45 N ATOM 1219 CA PHE A 132 -4.880 9.861 0.116 1.00 9.87 C ATOM 1220 C PHE A 132 -5.663 11.109 0.392 1.00 10.69 C ATOM 1221 O PHE A 132 -5.869 11.925 -0.489 1.00 11.98 O ATOM 1222 CB PHE A 132 -5.772 8.727 -0.406 1.00 9.96 C ATOM 1223 CG PHE A 132 -6.019 8.762 -1.907 1.00 10.16 C ATOM 1224 CD1 PHE A 132 -4.984 8.903 -2.840 1.00 9.86 C ATOM 1225 CD2 PHE A 132 -7.320 8.552 -2.390 1.00 10.89 C ATOM 1226 CE1 PHE A 132 -5.240 8.862 -4.243 1.00 9.37 C ATOM 1227 CE2 PHE A 132 -7.565 8.541 -3.781 1.00 10.44 C ATOM 1228 CZ PHE A 132 -6.544 8.728 -4.689 1.00 9.84 C ATOM 1229 H PHE A 132 -4.413 8.508 1.750 1.00 0.00 H ATOM 1230 N ARG A 133 -6.141 11.268 1.601 1.00 11.02 N ATOM 1231 CA ARG A 133 -6.870 12.466 1.898 1.00 12.81 C ATOM 1232 C ARG A 133 -6.096 13.719 1.518 1.00 12.74 C ATOM 1233 O ARG A 133 -6.615 14.602 0.890 1.00 12.32 O ATOM 1234 CB ARG A 133 -7.184 12.495 3.378 1.00 13.56 C ATOM 1235 CG ARG A 133 -7.756 13.827 3.749 1.00 14.70 C ATOM 1236 CD ARG A 133 -8.104 13.782 5.233 1.00 16.17 C ATOM 1237 NE ARG A 133 -8.476 15.155 5.611 1.00 17.26 N ATOM 1238 CZ ARG A 133 -9.028 15.501 6.772 1.00 17.24 C ATOM 1239 NH1 ARG A 133 -9.320 14.583 7.703 1.00 17.99 N ATOM 1240 NH2 ARG A 133 -9.324 16.799 6.934 1.00 18.13 N ATOM 1241 HE ARG A 133 -8.294 15.911 4.920 1.00 0.00 H ATOM 1242 HH12 ARG A 133 -9.751 14.874 8.603 1.00 0.00 H ATOM 1243 HH11 ARG A 133 -9.116 13.579 7.525 1.00 0.00 H ATOM 1244 HH22 ARG A 133 -9.757 17.127 7.821 1.00 0.00 H ATOM 1245 HH21 ARG A 133 -9.121 17.478 6.173 1.00 0.00 H ATOM 1246 H ARG A 133 -5.995 10.541 2.330 1.00 0.00 H ATOM 1247 N HIS A 134 -4.826 13.757 1.910 1.00 13.61 N ATOM 1248 CA HIS A 134 -3.988 14.892 1.593 1.00 16.15 C ATOM 1249 C HIS A 134 -3.594 14.924 0.130 1.00 13.58 C ATOM 1250 O HIS A 134 -3.593 15.975 -0.498 1.00 17.15 O ATOM 1251 CB HIS A 134 -2.749 14.864 2.464 1.00 17.23 C ATOM 1252 CG HIS A 134 -2.059 16.185 2.532 1.00 22.22 C ATOM 1253 ND1 HIS A 134 -0.791 16.393 2.018 1.00 24.43 N ATOM 1254 CD2 HIS A 134 -2.487 17.389 2.995 1.00 22.53 C ATOM 1255 CE1 HIS A 134 -0.459 17.668 2.182 1.00 22.44 C ATOM 1256 NE2 HIS A 134 -1.463 18.288 2.784 1.00 21.97 N ATOM 1257 H HIS A 134 -4.431 12.961 2.451 1.00 0.00 H ATOM 1258 N TRP A 135 -3.298 13.781 -0.449 1.00 11.77 N ATOM 1259 CA TRP A 135 -2.991 13.728 -1.880 1.00 11.62 C ATOM 1260 C TRP A 135 -4.152 14.421 -2.646 1.00 11.64 C ATOM 1261 O TRP A 135 -3.910 15.310 -3.468 1.00 14.04 O ATOM 1262 CB TRP A 135 -2.786 12.276 -2.311 1.00 10.38 C ATOM 1263 CG TRP A 135 -2.347 12.091 -3.704 1.00 10.43 C ATOM 1264 CD1 TRP A 135 -3.114 11.876 -4.795 1.00 9.90 C ATOM 1265 CD2 TRP A 135 -1.004 12.109 -4.171 1.00 9.07 C ATOM 1266 NE1 TRP A 135 -2.349 11.778 -5.914 1.00 10.27 N ATOM 1267 CE2 TRP A 135 -1.041 11.919 -5.560 1.00 9.31 C ATOM 1268 CE3 TRP A 135 0.206 12.278 -3.550 1.00 9.17 C ATOM 1269 CZ2 TRP A 135 0.102 11.895 -6.340 1.00 9.30 C ATOM 1270 CZ3 TRP A 135 1.301 12.288 -4.292 1.00 9.34 C ATOM 1271 CH2 TRP A 135 1.270 12.077 -5.696 1.00 9.70 C ATOM 1272 HE1 TRP A 135 -2.703 11.622 -6.879 1.00 0.00 H ATOM 1273 H TRP A 135 -3.282 12.907 0.114 1.00 0.00 H ATOM 1274 N LEU A 136 -5.383 14.044 -2.366 1.00 12.48 N ATOM 1275 CA LEU A 136 -6.504 14.635 -3.093 1.00 13.96 C ATOM 1276 C LEU A 136 -6.663 16.118 -2.817 1.00 15.98 C ATOM 1277 O LEU A 136 -6.878 16.939 -3.731 1.00 16.05 O ATOM 1278 CB LEU A 136 -7.742 13.900 -2.648 1.00 14.21 C ATOM 1279 CG LEU A 136 -7.884 12.478 -3.157 1.00 13.93 C ATOM 1280 CD1 LEU A 136 -9.027 11.787 -2.423 1.00 16.33 C ATOM 1281 CD2 LEU A 136 -8.099 12.436 -4.646 1.00 13.77 C ATOM 1282 H LEU A 136 -5.556 13.329 -1.631 1.00 0.00 H ATOM 1283 N ASN A 137 -6.488 16.467 -1.551 1.00 16.07 N ATOM 1284 CA ASN A 137 -6.556 17.881 -1.123 1.00 17.42 C ATOM 1285 C ASN A 137 -5.552 18.749 -1.858 1.00 17.38 C ATOM 1286 O ASN A 137 -5.810 19.936 -2.074 1.00 19.48 O ATOM 1287 CB ASN A 137 -6.341 17.933 0.382 1.00 19.41 C ATOM 1288 CG ASN A 137 -5.919 19.316 0.894 1.00 23.99 C ATOM 1289 OD1 ASN A 137 -4.723 19.680 0.969 1.00 25.06 O ATOM 1290 ND2 ASN A 137 -6.891 20.031 1.362 1.00 25.11 N ATOM 1291 HD22 ASN A 137 -7.871 19.693 1.280 1.00 0.00 H ATOM 1292 HD21 ASN A 137 -6.692 20.943 1.820 1.00 0.00 H ATOM 1293 H ASN A 137 -6.299 15.730 -0.842 1.00 0.00 H ATOM 1294 N GLN A 138 -4.412 18.197 -2.232 1.00 16.67 N ATOM 1295 CA GLN A 138 -3.403 18.910 -2.994 1.00 18.27 C ATOM 1296 C GLN A 138 -3.654 18.876 -4.501 1.00 18.16 C ATOM 1297 O GLN A 138 -2.858 19.372 -5.258 1.00 19.22 O ATOM 1298 CB GLN A 138 -2.014 18.369 -2.695 1.00 21.76 C ATOM 1299 CG GLN A 138 -1.579 18.434 -1.209 1.00 25.48 C ATOM 1300 CD GLN A 138 -1.270 19.876 -0.808 1.00 27.01 C ATOM 1301 OE1 GLN A 138 -0.270 20.478 -1.270 1.00 27.81 O ATOM 1302 NE2 GLN A 138 -2.148 20.457 -0.011 1.00 28.62 N ATOM 1303 HE22 GLN A 138 -2.962 19.918 0.347 1.00 0.00 H ATOM 1304 HE21 GLN A 138 -2.026 21.454 0.258 1.00 0.00 H ATOM 1305 H GLN A 138 -4.229 17.208 -1.969 1.00 0.00 H ATOM 1306 N ASN A 139 -4.729 18.251 -4.922 1.00 18.67 N ATOM 1307 CA ASN A 139 -5.078 18.075 -6.348 1.00 18.72 C ATOM 1308 C ASN A 139 -4.030 17.431 -7.164 1.00 20.97 C ATOM 1309 O ASN A 139 -3.880 17.758 -8.371 1.00 15.04 O ATOM 1310 CB ASN A 139 -5.452 19.402 -6.967 1.00 22.24 C ATOM 1311 CG ASN A 139 -6.535 20.083 -6.204 1.00 23.83 C ATOM 1312 OD1 ASN A 139 -6.362 21.188 -5.699 1.00 31.72 O ATOM 1313 ND2 ASN A 139 -7.679 19.443 -6.151 1.00 25.25 N ATOM 1314 HD22 ASN A 139 -7.773 18.508 -6.596 1.00 0.00 H ATOM 1315 HD21 ASN A 139 -8.492 19.871 -5.664 1.00 0.00 H ATOM 1316 H ASN A 139 -5.375 17.856 -4.209 1.00 0.00 H ATOM 1317 N LEU A 140 -3.319 16.458 -6.548 1.00 17.47 N ATOM 1318 CA LEU A 140 -2.264 15.784 -7.221 1.00 17.87 C ATOM 1319 C LEU A 140 -2.858 14.674 -8.129 1.00 17.44 C ATOM 1320 O LEU A 140 -4.011 14.325 -8.011 1.00 18.49 O ATOM 1321 CB LEU A 140 -1.263 15.200 -6.222 1.00 17.28 C ATOM 1322 CG LEU A 140 -0.514 16.320 -5.518 1.00 19.26 C ATOM 1323 CD1 LEU A 140 0.239 15.774 -4.327 1.00 19.83 C ATOM 1324 CD2 LEU A 140 0.456 17.032 -6.470 1.00 19.29 C ATOM 1325 H LEU A 140 -3.548 16.199 -5.567 1.00 0.00 H ATOM 1326 N PRO A 141 -2.084 14.229 -9.082 1.00 21.67 N ATOM 1327 CA PRO A 141 -2.670 13.397 -10.142 1.00 22.95 C ATOM 1328 C PRO A 141 -3.110 12.051 -9.611 1.00 21.08 C ATOM 1329 O PRO A 141 -2.458 11.503 -8.751 1.00 18.53 O ATOM 1330 CB PRO A 141 -1.494 13.118 -11.086 1.00 25.06 C ATOM 1331 CG PRO A 141 -0.303 13.809 -10.551 1.00 23.55 C ATOM 1332 CD PRO A 141 -0.721 14.685 -9.409 1.00 22.51 C ATOM 1333 N ILE A 142 -4.189 11.536 -10.193 1.00 21.18 N ATOM 1334 CA ILE A 142 -4.674 10.217 -9.868 1.00 18.90 C ATOM 1335 C ILE A 142 -4.889 9.332 -11.076 1.00 16.18 C ATOM 1336 O ILE A 142 -5.076 9.785 -12.140 1.00 15.08 O ATOM 1337 CB ILE A 142 -5.933 10.323 -9.019 1.00 18.69 C ATOM 1338 CG1 ILE A 142 -7.060 11.028 -9.741 1.00 22.03 C ATOM 1339 CG2 ILE A 142 -5.593 11.053 -7.733 1.00 20.67 C ATOM 1340 CD1 ILE A 142 -8.254 11.271 -8.878 1.00 21.73 C ATOM 1341 H ILE A 142 -4.698 12.100 -10.903 1.00 0.00 H ATOM 1342 N SER A 143 -4.919 8.042 -10.847 1.00 14.77 N ATOM 1343 CA SER A 143 -5.134 7.012 -11.871 1.00 14.29 C ATOM 1344 C SER A 143 -6.269 6.117 -11.453 1.00 13.96 C ATOM 1345 O SER A 143 -6.665 6.060 -10.269 1.00 10.63 O ATOM 1346 CB SER A 143 -3.858 6.225 -12.048 1.00 14.88 C ATOM 1347 OG SER A 143 -2.798 7.066 -12.552 1.00 16.28 O ATOM 1348 HG SER A 143 -1.974 6.528 -12.659 1.00 0.00 H ATOM 1349 H SER A 143 -4.780 7.724 -9.867 1.00 0.00 H ATOM 1350 N SER A 144 -6.847 5.440 -12.442 1.00 12.55 N ATOM 1351 CA SER A 144 -7.884 4.477 -12.174 1.00 14.46 C ATOM 1352 C SER A 144 -7.470 3.122 -12.766 1.00 12.99 C ATOM 1353 O SER A 144 -6.629 3.042 -13.586 1.00 15.97 O ATOM 1354 CB SER A 144 -9.194 4.897 -12.794 1.00 17.10 C ATOM 1355 OG SER A 144 -8.994 4.922 -14.185 1.00 19.44 O ATOM 1356 HG SER A 144 -8.730 4.020 -14.496 1.00 0.00 H ATOM 1357 H SER A 144 -6.546 5.609 -13.423 1.00 0.00 H ATOM 1358 N GLY A 145 -8.132 2.084 -12.363 1.00 13.90 N ATOM 1359 CA GLY A 145 -7.830 0.715 -12.839 1.00 13.34 C ATOM 1360 C GLY A 145 -7.531 -0.240 -11.741 1.00 12.89 C ATOM 1361 O GLY A 145 -7.023 0.167 -10.685 1.00 12.35 O ATOM 1362 H GLY A 145 -8.904 2.217 -11.680 1.00 0.00 H ATOM 1363 N LYS A 146 -7.811 -1.533 -11.967 1.00 11.04 N ATOM 1364 CA LYS A 146 -7.394 -2.569 -11.015 1.00 11.60 C ATOM 1365 C LYS A 146 -5.906 -2.656 -10.818 1.00 10.48 C ATOM 1366 O LYS A 146 -5.050 -2.144 -11.630 1.00 9.29 O ATOM 1367 CB LYS A 146 -7.924 -3.953 -11.385 1.00 10.98 C ATOM 1368 CG LYS A 146 -9.458 -4.049 -11.455 1.00 12.44 C ATOM 1369 CD LYS A 146 -9.917 -5.431 -11.102 1.00 13.46 C ATOM 1370 CE LYS A 146 -11.414 -5.527 -11.258 1.00 14.32 C ATOM 1371 NZ LYS A 146 -11.833 -6.835 -10.857 1.00 14.42 N ATOM 1372 HZ1 LYS A 146 -11.368 -7.546 -11.457 1.00 0.00 H ATOM 1373 HZ2 LYS A 146 -11.570 -6.993 -9.863 1.00 0.00 H ATOM 1374 HZ3 LYS A 146 -12.865 -6.914 -10.960 1.00 0.00 H ATOM 1375 H LYS A 146 -8.330 -1.804 -12.827 1.00 0.00 H ATOM 1376 N SER A 147 -5.578 -3.176 -9.626 1.00 9.32 N ATOM 1377 CA SER A 147 -4.163 -3.323 -9.268 1.00 9.72 C ATOM 1378 C SER A 147 -3.492 -4.389 -10.150 1.00 9.25 C ATOM 1379 O SER A 147 -4.064 -5.444 -10.473 1.00 9.17 O ATOM 1380 CB SER A 147 -4.042 -3.708 -7.777 1.00 9.00 C ATOM 1381 OG SER A 147 -2.682 -3.815 -7.371 1.00 8.75 O ATOM 1382 HG SER A 147 -2.231 -4.511 -7.911 1.00 0.00 H ATOM 1383 H SER A 147 -6.321 -3.473 -8.961 1.00 0.00 H ATOM 1384 N HIS A 148 -2.255 -4.113 -10.518 1.00 11.12 N ATOM 1385 CA HIS A 148 -1.424 -5.077 -11.198 1.00 12.05 C ATOM 1386 C HIS A 148 0.042 -4.738 -11.093 1.00 11.97 C ATOM 1387 O HIS A 148 0.479 -3.560 -10.969 1.00 10.34 O ATOM 1388 CB HIS A 148 -1.785 -5.204 -12.680 1.00 14.08 C ATOM 1389 CG HIS A 148 -1.434 -3.970 -13.473 1.00 17.19 C ATOM 1390 ND1 HIS A 148 -0.265 -3.859 -14.193 1.00 20.78 N ATOM 1391 CD2 HIS A 148 -2.088 -2.788 -13.632 1.00 21.89 C ATOM 1392 CE1 HIS A 148 -0.199 -2.661 -14.737 1.00 23.11 C ATOM 1393 NE2 HIS A 148 -1.311 -2.006 -14.447 1.00 21.37 N ATOM 1394 H HIS A 148 -1.867 -3.171 -10.311 1.00 0.00 H ATOM 1395 N SER A 149 0.846 -5.756 -11.290 1.00 10.60 N ATOM 1396 CA SER A 149 2.275 -5.547 -11.329 1.00 10.84 C ATOM 1397 C SER A 149 2.903 -6.743 -11.896 1.00 9.84 C ATOM 1398 O SER A 149 2.405 -7.853 -11.755 1.00 10.53 O ATOM 1399 CB SER A 149 2.839 -5.438 -9.892 1.00 10.82 C ATOM 1400 OG SER A 149 4.215 -4.976 -9.815 1.00 11.01 O ATOM 1401 HG SER A 149 4.801 -5.604 -10.307 1.00 0.00 H ATOM 1402 H SER A 149 0.455 -6.711 -11.418 1.00 0.00 H ATOM 1403 N GLU A 150 4.081 -6.550 -12.462 1.00 10.24 N ATOM 1404 CA GLU A 150 4.974 -7.663 -12.676 1.00 11.04 C ATOM 1405 C GLU A 150 5.491 -8.187 -11.343 1.00 10.28 C ATOM 1406 O GLU A 150 5.686 -7.412 -10.394 1.00 9.62 O ATOM 1407 CB GLU A 150 6.121 -7.309 -13.639 1.00 11.96 C ATOM 1408 CG GLU A 150 7.357 -6.786 -12.975 1.00 13.19 C ATOM 1409 CD GLU A 150 7.210 -5.374 -12.471 1.00 13.48 C ATOM 1410 OE1 GLU A 150 8.096 -4.904 -11.780 1.00 14.32 O ATOM 1411 OE2 GLU A 150 6.223 -4.717 -12.799 1.00 16.07 O ATOM 1412 H GLU A 150 4.365 -5.593 -12.754 1.00 0.00 H ATOM 1413 N PRO A 151 5.746 -9.486 -11.266 1.00 10.94 N ATOM 1414 CA PRO A 151 6.312 -9.987 -10.029 1.00 11.42 C ATOM 1415 C PRO A 151 7.801 -9.687 -9.896 1.00 11.04 C ATOM 1416 O PRO A 151 8.513 -9.417 -10.872 1.00 10.86 O ATOM 1417 CB PRO A 151 6.058 -11.499 -10.090 1.00 11.62 C ATOM 1418 CG PRO A 151 6.151 -11.724 -11.592 1.00 11.71 C ATOM 1419 CD PRO A 151 5.347 -10.579 -12.152 1.00 11.96 C ATOM 1420 N ALA A 152 8.240 -9.581 -8.674 1.00 11.23 N ATOM 1421 CA ALA A 152 9.667 -9.416 -8.301 1.00 11.73 C ATOM 1422 C ALA A 152 10.126 -10.455 -7.270 1.00 13.32 C ATOM 1423 O ALA A 152 9.299 -11.040 -6.596 1.00 14.18 O ATOM 1424 CB ALA A 152 9.844 -8.011 -7.779 1.00 12.17 C ATOM 1425 H ALA A 152 7.541 -9.614 -7.905 1.00 0.00 H ATOM 1426 N GLU A 153 11.436 -10.708 -7.164 1.00 14.50 N ATOM 1427 CA GLU A 153 12.029 -11.629 -6.178 1.00 16.47 C ATOM 1428 C GLU A 153 12.074 -10.874 -4.852 1.00 14.05 C ATOM 1429 O GLU A 153 12.493 -9.724 -4.788 1.00 13.22 O ATOM 1430 CB GLU A 153 13.496 -11.982 -6.548 1.00 21.03 C ATOM 1431 CG GLU A 153 13.907 -13.448 -6.207 1.00 31.18 C ATOM 1432 CD GLU A 153 14.853 -13.656 -4.998 1.00 39.32 C ATOM 1433 OE1 GLU A 153 15.988 -13.089 -4.963 1.00 41.88 O ATOM 1434 OE2 GLU A 153 14.485 -14.447 -4.072 1.00 46.73 O ATOM 1435 H GLU A 153 12.079 -10.222 -7.822 1.00 0.00 H ATOM 1436 N PHE A 154 11.572 -11.528 -3.821 1.00 12.66 N ATOM 1437 CA PHE A 154 11.442 -10.975 -2.465 1.00 11.67 C ATOM 1438 C PHE A 154 11.670 -12.090 -1.499 1.00 10.71 C ATOM 1439 O PHE A 154 11.090 -13.182 -1.686 1.00 10.69 O ATOM 1440 CB PHE A 154 10.054 -10.384 -2.174 1.00 12.71 C ATOM 1441 CG PHE A 154 10.017 -9.589 -0.874 1.00 11.94 C ATOM 1442 CD1 PHE A 154 9.812 -10.193 0.368 1.00 13.76 C ATOM 1443 CD2 PHE A 154 10.207 -8.243 -0.898 1.00 13.20 C ATOM 1444 CE1 PHE A 154 9.773 -9.445 1.573 1.00 12.64 C ATOM 1445 CE2 PHE A 154 10.123 -7.485 0.269 1.00 12.05 C ATOM 1446 CZ PHE A 154 9.959 -8.082 1.519 1.00 11.80 C ATOM 1447 H PHE A 154 11.246 -12.503 -3.979 1.00 0.00 H ATOM 1448 N SER A 155 12.501 -11.812 -0.505 1.00 10.68 N ATOM 1449 CA SER A 155 12.808 -12.707 0.572 1.00 10.64 C ATOM 1450 C SER A 155 12.321 -12.039 1.878 1.00 9.88 C ATOM 1451 O SER A 155 12.370 -10.793 1.986 1.00 10.22 O ATOM 1452 CB SER A 155 14.311 -12.920 0.626 1.00 11.09 C ATOM 1453 OG SER A 155 14.768 -13.706 -0.476 1.00 12.08 O ATOM 1454 HG SER A 155 15.749 -13.825 -0.410 1.00 0.00 H ATOM 1455 H SER A 155 12.962 -10.880 -0.506 1.00 0.00 H ATOM 1456 N ALA A 156 11.836 -12.848 2.822 1.00 9.00 N ATOM 1457 CA ALA A 156 11.462 -12.365 4.141 1.00 9.38 C ATOM 1458 C ALA A 156 11.947 -13.263 5.249 1.00 10.72 C ATOM 1459 O ALA A 156 12.007 -14.507 5.111 1.00 10.18 O ATOM 1460 CB ALA A 156 9.955 -12.278 4.265 1.00 10.06 C ATOM 1461 H ALA A 156 11.722 -13.859 2.607 1.00 0.00 H ATOM 1462 N GLN A 157 12.187 -12.625 6.386 1.00 12.35 N ATOM 1463 CA GLN A 157 12.555 -13.299 7.635 1.00 14.55 C ATOM 1464 C GLN A 157 11.998 -12.477 8.795 1.00 11.84 C ATOM 1465 O GLN A 157 12.248 -11.284 8.873 1.00 11.38 O ATOM 1466 CB GLN A 157 14.053 -13.348 7.778 1.00 17.04 C ATOM 1467 CG GLN A 157 14.388 -14.088 9.074 1.00 22.25 C ATOM 1468 CD GLN A 157 15.835 -14.521 9.210 1.00 31.23 C ATOM 1469 OE1 GLN A 157 16.561 -14.656 8.211 1.00 33.21 O ATOM 1470 NE2 GLN A 157 16.253 -14.794 10.454 1.00 32.18 N ATOM 1471 HE22 GLN A 157 15.608 -14.665 11.259 1.00 0.00 H ATOM 1472 HE21 GLN A 157 17.223 -15.135 10.614 1.00 0.00 H ATOM 1473 H GLN A 157 12.110 -11.588 6.392 1.00 0.00 H ATOM 1474 N LEU A 158 11.242 -13.102 9.673 1.00 11.95 N ATOM 1475 CA LEU A 158 10.594 -12.337 10.714 1.00 12.59 C ATOM 1476 C LEU A 158 11.639 -12.117 11.833 1.00 13.28 C ATOM 1477 O LEU A 158 12.200 -13.089 12.384 1.00 13.17 O ATOM 1478 CB LEU A 158 9.350 -13.114 11.252 1.00 14.71 C ATOM 1479 CG LEU A 158 8.658 -12.494 12.451 1.00 15.00 C ATOM 1480 CD1 LEU A 158 8.177 -11.085 12.101 1.00 13.83 C ATOM 1481 CD2 LEU A 158 7.470 -13.342 13.020 1.00 16.82 C ATOM 1482 H LEU A 158 11.113 -14.132 9.618 1.00 0.00 H ATOM 1483 N ASP A 159 11.867 -10.877 12.211 1.00 11.13 N ATOM 1484 CA ASP A 159 12.527 -10.605 13.473 1.00 12.08 C ATOM 1485 C ASP A 159 11.499 -10.623 14.660 1.00 12.30 C ATOM 1486 O ASP A 159 10.604 -9.763 14.718 1.00 10.87 O ATOM 1487 CB ASP A 159 13.174 -9.219 13.351 1.00 12.57 C ATOM 1488 CG ASP A 159 13.894 -8.776 14.631 1.00 14.39 C ATOM 1489 OD1 ASP A 159 13.710 -9.376 15.712 1.00 13.49 O ATOM 1490 OD2 ASP A 159 14.622 -7.752 14.516 1.00 16.44 O ATOM 1491 H ASP A 159 11.572 -10.088 11.601 1.00 0.00 H ATOM 1492 N PRO A 160 11.571 -11.626 15.551 1.00 12.87 N ATOM 1493 CA PRO A 160 10.549 -11.788 16.590 1.00 14.13 C ATOM 1494 C PRO A 160 10.529 -10.653 17.585 1.00 13.82 C ATOM 1495 O PRO A 160 9.566 -10.512 18.313 1.00 15.26 O ATOM 1496 CB PRO A 160 10.929 -13.076 17.301 1.00 15.64 C ATOM 1497 CG PRO A 160 12.317 -13.418 16.896 1.00 15.04 C ATOM 1498 CD PRO A 160 12.629 -12.656 15.628 1.00 15.14 C ATOM 1499 N SER A 161 11.556 -9.833 17.642 1.00 12.49 N ATOM 1500 CA SER A 161 11.529 -8.695 18.526 1.00 12.67 C ATOM 1501 C SER A 161 10.401 -7.678 18.144 1.00 10.90 C ATOM 1502 O SER A 161 10.098 -6.784 18.938 1.00 12.04 O ATOM 1503 CB SER A 161 12.895 -8.018 18.620 1.00 14.29 C ATOM 1504 OG SER A 161 13.186 -7.318 17.450 1.00 17.23 O ATOM 1505 HG SER A 161 13.194 -7.946 16.685 1.00 0.00 H ATOM 1506 H SER A 161 12.391 -10.007 17.047 1.00 0.00 H ATOM 1507 N PHE A 162 9.777 -7.816 16.961 1.00 9.24 N ATOM 1508 CA PHE A 162 8.695 -6.883 16.564 1.00 8.88 C ATOM 1509 C PHE A 162 7.353 -7.250 17.202 1.00 9.19 C ATOM 1510 O PHE A 162 6.407 -6.450 17.049 1.00 7.06 O ATOM 1511 CB PHE A 162 8.544 -6.852 15.006 1.00 8.83 C ATOM 1512 CG PHE A 162 9.562 -6.003 14.310 1.00 8.80 C ATOM 1513 CD1 PHE A 162 10.936 -6.314 14.358 1.00 9.43 C ATOM 1514 CD2 PHE A 162 9.184 -4.844 13.660 1.00 8.25 C ATOM 1515 CE1 PHE A 162 11.866 -5.506 13.749 1.00 8.87 C ATOM 1516 CE2 PHE A 162 10.142 -4.066 13.009 1.00 8.58 C ATOM 1517 CZ PHE A 162 11.490 -4.397 13.104 1.00 8.62 C ATOM 1518 H PHE A 162 10.056 -8.585 16.318 1.00 0.00 H ATOM 1519 N ILE A 163 7.257 -8.413 17.853 1.00 9.24 N ATOM 1520 CA ILE A 163 5.985 -8.975 18.343 1.00 11.56 C ATOM 1521 C ILE A 163 6.079 -9.260 19.812 1.00 10.34 C ATOM 1522 O ILE A 163 7.136 -9.661 20.308 1.00 9.52 O ATOM 1523 CB ILE A 163 5.703 -10.281 17.607 1.00 13.75 C ATOM 1524 CG1 ILE A 163 5.298 -9.929 16.201 1.00 16.21 C ATOM 1525 CG2 ILE A 163 4.694 -11.245 18.274 1.00 16.62 C ATOM 1526 CD1 ILE A 163 3.878 -9.540 16.037 1.00 17.21 C ATOM 1527 H ILE A 163 8.129 -8.953 18.024 1.00 0.00 H ATOM 1528 N LYS A 164 4.974 -9.032 20.523 1.00 8.58 N ATOM 1529 CA LYS A 164 4.754 -9.700 21.794 1.00 8.12 C ATOM 1530 C LYS A 164 3.586 -10.643 21.711 1.00 7.29 C ATOM 1531 O LYS A 164 2.640 -10.424 20.909 1.00 7.45 O ATOM 1532 CB LYS A 164 4.504 -8.721 22.923 1.00 8.46 C ATOM 1533 CG LYS A 164 5.713 -7.893 23.233 1.00 9.63 C ATOM 1534 CD LYS A 164 6.771 -8.647 24.049 1.00 10.37 C ATOM 1535 CE LYS A 164 7.866 -7.717 24.493 1.00 12.49 C ATOM 1536 NZ LYS A 164 8.887 -8.500 25.236 1.00 13.10 N ATOM 1537 HZ1 LYS A 164 8.445 -8.946 26.065 1.00 0.00 H ATOM 1538 HZ2 LYS A 164 9.279 -9.235 24.613 1.00 0.00 H ATOM 1539 HZ3 LYS A 164 9.650 -7.865 25.548 1.00 0.00 H ATOM 1540 H LYS A 164 4.260 -8.367 20.163 1.00 0.00 H ATOM 1541 N THR A 165 3.615 -11.624 22.590 1.00 6.81 N ATOM 1542 CA THR A 165 2.602 -12.670 22.609 1.00 7.14 C ATOM 1543 C THR A 165 1.660 -12.526 23.797 1.00 6.83 C ATOM 1544 O THR A 165 1.973 -11.827 24.793 1.00 6.90 O ATOM 1545 CB THR A 165 3.225 -14.076 22.668 1.00 7.75 C ATOM 1546 OG1 THR A 165 3.830 -14.232 23.953 1.00 7.45 O ATOM 1547 CG2 THR A 165 4.260 -14.238 21.654 1.00 8.85 C ATOM 1548 HG1 THR A 165 4.239 -15.131 24.017 1.00 0.00 H ATOM 1549 H THR A 165 4.383 -11.652 23.290 1.00 0.00 H ATOM 1550 N HIS A 166 0.511 -13.184 23.719 1.00 6.58 N ATOM 1551 CA HIS A 166 -0.361 -13.271 24.883 1.00 6.97 C ATOM 1552 C HIS A 166 0.433 -13.628 26.187 1.00 6.35 C ATOM 1553 O HIS A 166 0.244 -12.996 27.266 1.00 5.91 O ATOM 1554 CB HIS A 166 -1.450 -14.325 24.675 1.00 7.14 C ATOM 1555 CG HIS A 166 -2.465 -14.344 25.786 1.00 6.68 C ATOM 1556 ND1 HIS A 166 -2.401 -15.186 26.850 1.00 6.56 N ATOM 1557 CD2 HIS A 166 -3.559 -13.585 25.988 1.00 6.68 C ATOM 1558 CE1 HIS A 166 -3.428 -14.967 27.655 1.00 6.99 C ATOM 1559 NE2 HIS A 166 -4.123 -13.967 27.165 1.00 6.83 N ATOM 1560 H HIS A 166 0.232 -13.638 22.826 1.00 0.00 H ATOM 1561 N GLU A 167 1.236 -14.710 26.091 1.00 7.13 N ATOM 1562 CA GLU A 167 2.009 -15.158 27.247 1.00 7.59 C ATOM 1563 C GLU A 167 2.833 -13.977 27.802 1.00 6.77 C ATOM 1564 O GLU A 167 2.985 -13.818 29.008 1.00 6.63 O ATOM 1565 CB GLU A 167 2.957 -16.275 26.805 1.00 8.40 C ATOM 1566 CG GLU A 167 2.225 -17.609 26.433 1.00 10.00 C ATOM 1567 CD GLU A 167 1.360 -17.614 25.129 1.00 10.91 C ATOM 1568 OE1 GLU A 167 1.548 -16.678 24.259 1.00 8.88 O ATOM 1569 OE2 GLU A 167 0.515 -18.626 24.985 1.00 12.03 O ATOM 1570 H GLU A 167 1.304 -15.226 25.191 1.00 0.00 H ATOM 1571 N ASP A 168 3.487 -13.210 26.930 1.00 6.88 N ATOM 1572 CA ASP A 168 4.243 -12.044 27.370 1.00 7.30 C ATOM 1573 C ASP A 168 3.363 -11.003 28.089 1.00 6.56 C ATOM 1574 O ASP A 168 3.795 -10.396 29.094 1.00 6.23 O ATOM 1575 CB ASP A 168 4.910 -11.286 26.181 1.00 8.44 C ATOM 1576 CG ASP A 168 5.881 -12.122 25.382 1.00 9.61 C ATOM 1577 OD1 ASP A 168 6.639 -12.938 25.969 1.00 13.13 O ATOM 1578 OD2 ASP A 168 5.930 -11.975 24.144 1.00 10.21 O ATOM 1579 H ASP A 168 3.457 -13.448 25.918 1.00 0.00 H ATOM 1580 N ILE A 169 2.190 -10.675 27.548 1.00 6.32 N ATOM 1581 CA ILE A 169 1.287 -9.674 28.133 1.00 6.14 C ATOM 1582 C ILE A 169 0.835 -10.139 29.502 1.00 6.20 C ATOM 1583 O ILE A 169 0.791 -9.327 30.437 1.00 5.71 O ATOM 1584 CB ILE A 169 0.103 -9.378 27.218 1.00 6.24 C ATOM 1585 CG1 ILE A 169 0.561 -8.872 25.830 1.00 6.24 C ATOM 1586 CG2 ILE A 169 -0.846 -8.366 27.844 1.00 6.41 C ATOM 1587 CD1 ILE A 169 1.484 -7.700 25.854 1.00 6.44 C ATOM 1588 H ILE A 169 1.900 -11.150 26.670 1.00 0.00 H ATOM 1589 N LEU A 170 0.494 -11.426 29.586 1.00 6.53 N ATOM 1590 CA LEU A 170 0.045 -12.023 30.848 1.00 7.81 C ATOM 1591 C LEU A 170 1.145 -11.966 31.922 1.00 7.95 C ATOM 1592 O LEU A 170 0.860 -11.558 33.097 1.00 8.44 O ATOM 1593 CB LEU A 170 -0.455 -13.484 30.614 1.00 8.38 C ATOM 1594 CG LEU A 170 -0.992 -14.250 31.852 1.00 8.95 C ATOM 1595 CD1 LEU A 170 -2.170 -13.515 32.436 1.00 9.80 C ATOM 1596 CD2 LEU A 170 -1.429 -15.602 31.381 1.00 8.90 C ATOM 1597 H LEU A 170 0.548 -12.021 28.735 1.00 0.00 H ATOM 1598 N GLU A 171 2.357 -12.366 31.563 1.00 8.24 N ATOM 1599 CA GLU A 171 3.475 -12.365 32.513 1.00 9.26 C ATOM 1600 C GLU A 171 3.696 -10.962 32.976 1.00 8.92 C ATOM 1601 O GLU A 171 4.036 -10.721 34.127 1.00 9.07 O ATOM 1602 CB GLU A 171 4.760 -12.940 31.917 1.00 10.77 C ATOM 1603 CG GLU A 171 5.892 -13.181 32.963 1.00 11.99 C ATOM 1604 CD GLU A 171 6.863 -12.014 33.116 1.00 14.78 C ATOM 1605 OE1 GLU A 171 7.673 -12.031 34.089 1.00 16.11 O ATOM 1606 OE2 GLU A 171 6.809 -11.045 32.328 1.00 14.57 O ATOM 1607 H GLU A 171 2.519 -12.687 30.587 1.00 0.00 H ATOM 1608 N ASN A 172 3.507 -10.006 32.067 1.00 8.69 N ATOM 1609 CA ASN A 172 3.756 -8.580 32.395 1.00 9.35 C ATOM 1610 C ASN A 172 2.764 -7.940 33.340 1.00 9.43 C ATOM 1611 O ASN A 172 3.020 -6.870 33.884 1.00 10.24 O ATOM 1612 CB ASN A 172 3.793 -7.739 31.077 1.00 9.39 C ATOM 1613 CG ASN A 172 4.302 -6.327 31.280 1.00 9.76 C ATOM 1614 OD1 ASN A 172 5.432 -6.095 31.646 1.00 10.94 O ATOM 1615 ND2 ASN A 172 3.473 -5.388 30.980 1.00 10.26 N ATOM 1616 HD22 ASN A 172 2.509 -5.625 30.669 1.00 0.00 H ATOM 1617 HD21 ASN A 172 3.767 -4.393 31.049 1.00 0.00 H ATOM 1618 H ASN A 172 3.180 -10.263 31.114 1.00 0.00 H ATOM 1619 N LEU A 173 1.631 -8.557 33.616 1.00 9.88 N ATOM 1620 CA LEU A 173 0.688 -7.959 34.583 1.00 10.33 C ATOM 1621 C LEU A 173 1.333 -7.838 35.931 1.00 12.33 C ATOM 1622 O LEU A 173 1.142 -6.795 36.558 1.00 12.52 O ATOM 1623 CB LEU A 173 -0.579 -8.742 34.719 1.00 9.85 C ATOM 1624 CG LEU A 173 -1.364 -8.838 33.399 1.00 9.73 C ATOM 1625 CD1 LEU A 173 -2.633 -9.655 33.580 1.00 9.26 C ATOM 1626 CD2 LEU A 173 -1.688 -7.504 32.701 1.00 9.70 C ATOM 1627 H LEU A 173 1.403 -9.461 33.155 1.00 0.00 H ATOM 1628 N ASP A 174 2.102 -8.834 36.326 1.00 14.15 N ATOM 1629 CA ASP A 174 2.775 -8.782 37.642 1.00 18.77 C ATOM 1630 C ASP A 174 4.176 -8.244 37.485 1.00 16.21 C ATOM 1631 O ASP A 174 4.612 -7.453 38.323 1.00 18.29 O ATOM 1632 CB ASP A 174 2.822 -10.149 38.322 1.00 23.67 C ATOM 1633 CG ASP A 174 1.517 -10.504 38.993 1.00 30.32 C ATOM 1634 OD1 ASP A 174 0.812 -9.589 39.494 1.00 38.54 O ATOM 1635 OD2 ASP A 174 1.208 -11.705 39.011 1.00 32.39 O ATOM 1636 H ASP A 174 2.236 -9.660 35.709 1.00 0.00 H ATOM 1637 N ALA A 175 4.872 -8.604 36.398 1.00 14.99 N ATOM 1638 CA ALA A 175 6.266 -8.223 36.226 1.00 13.73 C ATOM 1639 C ALA A 175 6.448 -6.730 35.867 1.00 13.13 C ATOM 1640 O ALA A 175 7.447 -6.149 36.286 1.00 12.70 O ATOM 1641 CB ALA A 175 6.991 -9.148 35.232 1.00 13.92 C ATOM 1642 H ALA A 175 4.405 -9.169 35.660 1.00 0.00 H ATOM 1643 N ARG A 176 5.473 -6.077 35.185 1.00 11.48 N ATOM 1644 CA ARG A 176 5.529 -4.687 34.769 1.00 11.39 C ATOM 1645 C ARG A 176 6.910 -4.322 34.180 1.00 10.55 C ATOM 1646 O ARG A 176 7.440 -3.277 34.480 1.00 13.08 O ATOM 1647 CB ARG A 176 5.132 -3.781 35.930 1.00 11.56 C ATOM 1648 CG ARG A 176 3.793 -4.183 36.462 1.00 12.68 C ATOM 1649 CD ARG A 176 3.283 -3.154 37.446 1.00 14.96 C ATOM 1650 NE ARG A 176 3.907 -3.365 38.728 1.00 16.51 N ATOM 1651 CZ ARG A 176 3.503 -4.258 39.638 1.00 18.11 C ATOM 1652 NH1 ARG A 176 4.150 -4.343 40.764 1.00 18.02 N ATOM 1653 NH2 ARG A 176 2.488 -5.070 39.419 1.00 20.03 N ATOM 1654 HE ARG A 176 4.733 -2.779 38.963 1.00 0.00 H ATOM 1655 HH12 ARG A 176 3.852 -5.031 41.485 1.00 0.00 H ATOM 1656 HH11 ARG A 176 4.965 -3.723 40.943 1.00 0.00 H ATOM 1657 HH22 ARG A 176 2.201 -5.752 40.149 1.00 0.00 H ATOM 1658 HH21 ARG A 176 1.974 -5.028 38.516 1.00 0.00 H ATOM 1659 H ARG A 176 4.617 -6.615 34.941 1.00 0.00 H ATOM 1660 N ARG A 177 7.439 -5.218 33.356 1.00 10.73 N ATOM 1661 CA ARG A 177 8.651 -4.980 32.641 1.00 10.32 C ATOM 1662 C ARG A 177 8.495 -4.113 31.390 1.00 8.90 C ATOM 1663 O ARG A 177 9.456 -3.562 30.918 1.00 9.79 O ATOM 1664 CB ARG A 177 9.382 -6.284 32.369 1.00 12.25 C ATOM 1665 CG ARG A 177 8.611 -7.208 31.435 1.00 13.02 C ATOM 1666 CD ARG A 177 9.304 -8.558 31.196 1.00 13.62 C ATOM 1667 NE ARG A 177 9.336 -9.418 32.392 1.00 15.14 N ATOM 1668 CZ ARG A 177 10.346 -9.529 33.241 1.00 16.29 C ATOM 1669 NH1 ARG A 177 11.475 -8.840 33.070 1.00 16.28 N ATOM 1670 NH2 ARG A 177 10.224 -10.358 34.264 1.00 17.12 N ATOM 1671 HE ARG A 177 8.489 -9.989 32.587 1.00 0.00 H ATOM 1672 HH12 ARG A 177 12.255 -8.943 33.750 1.00 0.00 H ATOM 1673 HH11 ARG A 177 11.575 -8.200 32.257 1.00 0.00 H ATOM 1674 HH22 ARG A 177 11.004 -10.463 34.944 1.00 0.00 H ATOM 1675 HH21 ARG A 177 9.349 -10.905 34.388 1.00 0.00 H ATOM 1676 H ARG A 177 6.952 -6.128 33.226 1.00 0.00 H ATOM 1677 N PHE A 178 7.302 -4.018 30.837 1.00 8.44 N ATOM 1678 CA PHE A 178 7.034 -3.031 29.827 1.00 8.61 C ATOM 1679 C PHE A 178 5.715 -2.363 30.051 1.00 9.07 C ATOM 1680 O PHE A 178 4.843 -2.937 30.731 1.00 8.47 O ATOM 1681 CB PHE A 178 7.129 -3.602 28.370 1.00 8.11 C ATOM 1682 CG PHE A 178 6.337 -4.878 28.162 1.00 7.42 C ATOM 1683 CD1 PHE A 178 4.946 -4.846 28.039 1.00 6.91 C ATOM 1684 CD2 PHE A 178 6.975 -6.115 28.164 1.00 7.50 C ATOM 1685 CE1 PHE A 178 4.234 -6.009 27.838 1.00 7.10 C ATOM 1686 CE2 PHE A 178 6.217 -7.310 27.958 1.00 7.59 C ATOM 1687 CZ PHE A 178 4.863 -7.235 27.786 1.00 7.14 C ATOM 1688 H PHE A 178 6.545 -4.666 31.135 1.00 0.00 H ATOM 1689 N GLN A 179 5.621 -1.126 29.520 1.00 8.78 N ATOM 1690 CA GLN A 179 4.385 -0.325 29.481 1.00 9.90 C ATOM 1691 C GLN A 179 3.522 -0.724 28.257 1.00 9.45 C ATOM 1692 O GLN A 179 4.052 -0.887 27.155 1.00 12.21 O ATOM 1693 CB GLN A 179 4.692 1.181 29.386 1.00 10.59 C ATOM 1694 CG GLN A 179 5.772 1.668 30.357 1.00 12.18 C ATOM 1695 CD GLN A 179 6.461 2.963 29.907 1.00 12.45 C ATOM 1696 OE1 GLN A 179 6.095 4.061 30.409 1.00 13.35 O ATOM 1697 NE2 GLN A 179 7.329 2.873 28.831 1.00 12.96 N ATOM 1698 HE22 GLN A 179 7.598 1.941 28.456 1.00 0.00 H ATOM 1699 HE21 GLN A 179 7.712 3.738 28.398 1.00 0.00 H ATOM 1700 H GLN A 179 6.481 -0.709 29.110 1.00 0.00 H ATOM 1701 N VAL A 180 2.282 -1.059 28.482 1.00 8.56 N ATOM 1702 CA VAL A 180 1.385 -1.336 27.415 1.00 8.76 C ATOM 1703 C VAL A 180 0.569 -0.115 27.072 1.00 8.01 C ATOM 1704 O VAL A 180 -0.110 0.433 27.936 1.00 7.40 O ATOM 1705 CB VAL A 180 0.489 -2.497 27.784 1.00 9.38 C ATOM 1706 CG1 VAL A 180 -0.525 -2.859 26.683 1.00 9.44 C ATOM 1707 CG2 VAL A 180 1.368 -3.685 28.184 1.00 9.73 C ATOM 1708 H VAL A 180 1.942 -1.125 29.463 1.00 0.00 H ATOM 1709 N VAL A 181 0.607 0.269 25.804 1.00 8.41 N ATOM 1710 CA VAL A 181 -0.139 1.448 25.308 1.00 8.47 C ATOM 1711 C VAL A 181 -1.170 0.952 24.292 1.00 8.19 C ATOM 1712 O VAL A 181 -0.788 0.336 23.304 1.00 7.66 O ATOM 1713 CB VAL A 181 0.756 2.542 24.686 1.00 9.06 C ATOM 1714 CG1 VAL A 181 -0.085 3.621 24.042 1.00 9.14 C ATOM 1715 CG2 VAL A 181 1.706 3.117 25.757 1.00 10.78 C ATOM 1716 H VAL A 181 1.182 -0.278 25.132 1.00 0.00 H ATOM 1717 N ASP A 182 -2.433 1.266 24.528 1.00 7.62 N ATOM 1718 CA ASP A 182 -3.564 0.781 23.732 1.00 8.12 C ATOM 1719 C ASP A 182 -4.149 1.901 22.861 1.00 8.67 C ATOM 1720 O ASP A 182 -4.511 2.992 23.382 1.00 9.64 O ATOM 1721 CB ASP A 182 -4.612 0.218 24.647 1.00 8.30 C ATOM 1722 CG ASP A 182 -5.672 -0.603 23.955 1.00 7.76 C ATOM 1723 OD1 ASP A 182 -6.203 -0.187 22.883 1.00 7.39 O ATOM 1724 OD2 ASP A 182 -6.016 -1.689 24.494 1.00 8.46 O ATOM 1725 H ASP A 182 -2.636 1.897 25.329 1.00 0.00 H ATOM 1726 N ALA A 183 -4.125 1.684 21.545 1.00 7.83 N ATOM 1727 CA ALA A 183 -4.518 2.693 20.589 1.00 7.77 C ATOM 1728 C ALA A 183 -6.008 2.732 20.269 1.00 7.55 C ATOM 1729 O ALA A 183 -6.384 3.553 19.402 1.00 7.59 O ATOM 1730 CB ALA A 183 -3.753 2.636 19.264 1.00 7.86 C ATOM 1731 H ALA A 183 -3.812 0.756 21.195 1.00 0.00 H ATOM 1732 N ARG A 184 -6.857 1.911 20.916 1.00 7.39 N ATOM 1733 CA ARG A 184 -8.281 1.989 20.629 1.00 7.51 C ATOM 1734 C ARG A 184 -8.868 3.343 21.118 1.00 8.91 C ATOM 1735 O ARG A 184 -8.306 4.015 21.992 1.00 7.93 O ATOM 1736 CB ARG A 184 -8.990 0.829 21.313 1.00 7.72 C ATOM 1737 CG ARG A 184 -8.747 -0.427 20.584 1.00 7.92 C ATOM 1738 CD ARG A 184 -9.352 -1.642 21.329 1.00 7.56 C ATOM 1739 NE ARG A 184 -8.821 -1.723 22.672 1.00 7.06 N ATOM 1740 CZ ARG A 184 -9.487 -2.025 23.798 1.00 7.16 C ATOM 1741 NH1 ARG A 184 -10.758 -2.328 23.758 1.00 8.00 N ATOM 1742 NH2 ARG A 184 -8.876 -2.044 24.951 1.00 6.92 N ATOM 1743 HE ARG A 184 -7.806 -1.524 22.778 1.00 0.00 H ATOM 1744 HH12 ARG A 184 -11.265 -2.560 24.636 1.00 0.00 H ATOM 1745 HH11 ARG A 184 -11.262 -2.337 22.848 1.00 0.00 H ATOM 1746 HH22 ARG A 184 -9.404 -2.280 25.815 1.00 0.00 H ATOM 1747 HH21 ARG A 184 -7.861 -1.824 25.005 1.00 0.00 H ATOM 1748 H ARG A 184 -6.498 1.228 21.614 1.00 0.00 H ATOM 1749 N ALA A 185 -10.005 3.706 20.543 1.00 9.36 N ATOM 1750 CA ALA A 185 -10.824 4.808 21.086 1.00 10.21 C ATOM 1751 C ALA A 185 -11.076 4.651 22.545 1.00 11.19 C ATOM 1752 O ALA A 185 -11.264 3.531 23.054 1.00 10.69 O ATOM 1753 CB ALA A 185 -12.160 4.858 20.349 1.00 11.08 C ATOM 1754 H ALA A 185 -10.327 3.204 19.691 1.00 0.00 H ATOM 1755 N ALA A 186 -11.128 5.789 23.235 1.00 11.45 N ATOM 1756 CA ALA A 186 -11.286 5.830 24.670 1.00 11.68 C ATOM 1757 C ALA A 186 -12.479 5.065 25.175 1.00 10.69 C ATOM 1758 O ALA A 186 -12.385 4.358 26.171 1.00 10.87 O ATOM 1759 CB ALA A 186 -11.380 7.274 25.121 1.00 12.78 C ATOM 1760 H ALA A 186 -11.051 6.688 22.718 1.00 0.00 H ATOM 1761 N GLY A 187 -13.623 5.147 24.475 1.00 12.51 N ATOM 1762 CA GLY A 187 -14.762 4.433 25.021 1.00 12.24 C ATOM 1763 C GLY A 187 -14.639 2.912 24.943 1.00 11.60 C ATOM 1764 O GLY A 187 -15.149 2.195 25.812 1.00 14.39 O ATOM 1765 H GLY A 187 -13.688 5.692 23.591 1.00 0.00 H ATOM 1766 N ARG A 188 -14.033 2.402 23.887 1.00 10.64 N ATOM 1767 CA ARG A 188 -13.705 0.956 23.857 1.00 10.19 C ATOM 1768 C ARG A 188 -12.714 0.555 24.958 1.00 9.90 C ATOM 1769 O ARG A 188 -12.892 -0.441 25.748 1.00 11.04 O ATOM 1770 CB ARG A 188 -13.202 0.588 22.479 1.00 9.10 C ATOM 1771 CG ARG A 188 -14.247 0.585 21.403 1.00 9.13 C ATOM 1772 CD ARG A 188 -13.634 0.470 20.022 1.00 9.25 C ATOM 1773 NE ARG A 188 -12.931 -0.804 19.804 1.00 9.68 N ATOM 1774 CZ ARG A 188 -12.143 -1.045 18.769 1.00 10.27 C ATOM 1775 NH1 ARG A 188 -12.042 -0.162 17.771 1.00 10.52 N ATOM 1776 NH2 ARG A 188 -11.545 -2.235 18.681 1.00 9.25 N ATOM 1777 HE ARG A 188 -13.061 -1.560 20.506 1.00 0.00 H ATOM 1778 HH12 ARG A 188 -11.420 -0.361 16.962 1.00 0.00 H ATOM 1779 HH11 ARG A 188 -12.586 0.724 17.804 1.00 0.00 H ATOM 1780 HH22 ARG A 188 -10.921 -2.445 17.876 1.00 0.00 H ATOM 1781 HH21 ARG A 188 -11.703 -2.952 19.418 1.00 0.00 H ATOM 1782 H ARG A 188 -13.787 3.011 23.081 1.00 0.00 H ATOM 1783 N PHE A 189 -11.666 1.324 25.089 1.00 9.83 N ATOM 1784 CA PHE A 189 -10.776 1.170 26.192 1.00 10.19 C ATOM 1785 C PHE A 189 -11.482 1.150 27.574 1.00 11.40 C ATOM 1786 O PHE A 189 -11.274 0.228 28.358 1.00 9.68 O ATOM 1787 CB PHE A 189 -9.680 2.233 26.161 1.00 10.22 C ATOM 1788 CG PHE A 189 -8.630 2.015 27.179 1.00 9.62 C ATOM 1789 CD1 PHE A 189 -8.805 2.426 28.472 1.00 9.42 C ATOM 1790 CD2 PHE A 189 -7.431 1.354 26.818 1.00 9.37 C ATOM 1791 CE1 PHE A 189 -7.789 2.293 29.383 1.00 9.95 C ATOM 1792 CE2 PHE A 189 -6.422 1.178 27.719 1.00 9.43 C ATOM 1793 CZ PHE A 189 -6.603 1.620 29.033 1.00 9.37 C ATOM 1794 H PHE A 189 -11.478 2.059 24.378 1.00 0.00 H ATOM 1795 N GLN A 190 -12.324 2.147 27.847 1.00 11.80 N ATOM 1796 CA GLN A 190 -13.009 2.231 29.153 1.00 13.34 C ATOM 1797 C GLN A 190 -14.088 1.200 29.386 1.00 13.68 C ATOM 1798 O GLN A 190 -14.398 0.903 30.526 1.00 14.83 O ATOM 1799 CB GLN A 190 -13.661 3.609 29.293 1.00 13.35 C ATOM 1800 CG GLN A 190 -12.670 4.732 29.509 1.00 13.64 C ATOM 1801 CD GLN A 190 -11.798 4.523 30.732 1.00 13.81 C ATOM 1802 OE1 GLN A 190 -10.586 4.550 30.631 1.00 13.29 O ATOM 1803 NE2 GLN A 190 -12.422 4.253 31.887 1.00 14.13 N ATOM 1804 HE22 GLN A 190 -13.461 4.241 31.926 1.00 0.00 H ATOM 1805 HE21 GLN A 190 -11.867 4.056 32.744 1.00 0.00 H ATOM 1806 H GLN A 190 -12.501 2.878 27.129 1.00 0.00 H ATOM 1807 N GLY A 191 -14.686 0.702 28.308 1.00 14.50 N ATOM 1808 CA GLY A 191 -15.738 -0.296 28.390 1.00 14.90 C ATOM 1809 C GLY A 191 -17.150 0.217 28.182 1.00 16.89 C ATOM 1810 O GLY A 191 -18.101 -0.538 28.417 1.00 16.38 O ATOM 1811 H GLY A 191 -14.389 1.040 27.370 1.00 0.00 H ATOM 1812 N THR A 192 -17.274 1.415 27.621 1.00 16.40 N ATOM 1813 CA THR A 192 -18.553 2.068 27.341 1.00 18.68 C ATOM 1814 C THR A 192 -19.017 2.177 25.881 1.00 20.60 C ATOM 1815 O THR A 192 -20.097 2.712 25.637 1.00 21.27 O ATOM 1816 CB THR A 192 -18.529 3.473 27.945 1.00 19.86 C ATOM 1817 OG1 THR A 192 -17.468 4.238 27.387 1.00 23.49 O ATOM 1818 CG2 THR A 192 -18.287 3.379 29.411 1.00 20.75 C ATOM 1819 HG1 THR A 192 -17.468 5.143 27.789 1.00 0.00 H ATOM 1820 H THR A 192 -16.404 1.923 27.364 1.00 0.00 H ATOM 1821 N GLN A 193 -18.199 1.749 24.908 1.00 16.61 N ATOM 1822 CA GLN A 193 -18.588 1.740 23.516 1.00 16.26 C ATOM 1823 C GLN A 193 -18.220 0.372 22.971 1.00 14.97 C ATOM 1824 O GLN A 193 -17.228 -0.205 23.453 1.00 13.96 O ATOM 1825 CB GLN A 193 -17.896 2.878 22.735 1.00 16.87 C ATOM 1826 CG GLN A 193 -18.667 4.202 22.749 1.00 17.77 C ATOM 1827 CD GLN A 193 -17.914 5.349 22.073 1.00 18.48 C ATOM 1828 OE1 GLN A 193 -16.718 5.302 21.900 1.00 18.03 O ATOM 1829 NE2 GLN A 193 -18.624 6.394 21.726 1.00 19.23 N ATOM 1830 HE22 GLN A 193 -19.651 6.402 21.889 1.00 0.00 H ATOM 1831 HE21 GLN A 193 -18.160 7.215 21.288 1.00 0.00 H ATOM 1832 H GLN A 193 -17.250 1.411 25.165 1.00 0.00 H ATOM 1833 N PRO A 194 -18.988 -0.140 21.982 1.00 14.51 N ATOM 1834 CA PRO A 194 -18.885 -1.545 21.541 1.00 12.86 C ATOM 1835 C PRO A 194 -17.578 -1.884 20.788 1.00 12.05 C ATOM 1836 O PRO A 194 -17.024 -1.054 20.088 1.00 11.85 O ATOM 1837 CB PRO A 194 -20.117 -1.711 20.590 1.00 13.89 C ATOM 1838 CG PRO A 194 -20.384 -0.349 20.074 1.00 13.26 C ATOM 1839 CD PRO A 194 -20.093 0.538 21.245 1.00 13.52 C ATOM 1840 N GLU A 195 -17.137 -3.102 20.928 1.00 11.33 N ATOM 1841 CA GLU A 195 -16.122 -3.629 20.065 1.00 10.77 C ATOM 1842 C GLU A 195 -16.753 -4.070 18.734 1.00 11.75 C ATOM 1843 O GLU A 195 -17.813 -4.683 18.715 1.00 10.65 O ATOM 1844 CB GLU A 195 -15.431 -4.844 20.721 1.00 9.98 C ATOM 1845 CG GLU A 195 -14.477 -4.491 21.836 1.00 9.78 C ATOM 1846 CD GLU A 195 -13.222 -3.813 21.285 1.00 10.18 C ATOM 1847 OE1 GLU A 195 -12.623 -4.323 20.292 1.00 10.84 O ATOM 1848 OE2 GLU A 195 -12.878 -2.819 21.880 1.00 9.61 O ATOM 1849 H GLU A 195 -17.529 -3.703 21.681 1.00 0.00 H ATOM 1850 N PRO A 196 -16.026 -3.870 17.620 1.00 12.53 N ATOM 1851 CA PRO A 196 -16.564 -4.224 16.302 1.00 13.84 C ATOM 1852 C PRO A 196 -16.807 -5.698 16.056 1.00 14.42 C ATOM 1853 O PRO A 196 -17.768 -6.065 15.328 1.00 11.59 O ATOM 1854 CB PRO A 196 -15.549 -3.641 15.302 1.00 13.59 C ATOM 1855 CG PRO A 196 -14.342 -3.318 16.146 1.00 13.51 C ATOM 1856 CD PRO A 196 -14.808 -3.071 17.530 1.00 12.54 C ATOM 1857 N ARG A 197 -15.998 -6.566 16.689 1.00 14.94 N ATOM 1858 CA ARG A 197 -16.165 -8.014 16.518 1.00 15.17 C ATOM 1859 C ARG A 197 -17.323 -8.525 17.407 1.00 14.65 C ATOM 1860 O ARG A 197 -17.394 -8.208 18.617 1.00 12.59 O ATOM 1861 CB ARG A 197 -14.816 -8.666 16.832 1.00 19.22 C ATOM 1862 CG ARG A 197 -14.687 -10.154 16.621 1.00 23.17 C ATOM 1863 CD ARG A 197 -14.993 -10.451 15.191 1.00 22.60 C ATOM 1864 NE ARG A 197 -13.869 -10.505 14.270 1.00 20.45 N ATOM 1865 CZ ARG A 197 -14.043 -10.994 13.054 1.00 21.19 C ATOM 1866 NH1 ARG A 197 -15.287 -11.389 12.710 1.00 23.06 N ATOM 1867 NH2 ARG A 197 -13.048 -11.149 12.208 1.00 19.43 N ATOM 1868 HE ARG A 197 -12.933 -10.161 14.566 1.00 0.00 H ATOM 1869 HH12 ARG A 197 -15.465 -11.779 11.763 1.00 0.00 H ATOM 1870 HH11 ARG A 197 -16.067 -11.303 13.392 1.00 0.00 H ATOM 1871 HH22 ARG A 197 -13.227 -11.537 11.260 1.00 0.00 H ATOM 1872 HH21 ARG A 197 -12.082 -10.883 12.487 1.00 0.00 H ATOM 1873 H ARG A 197 -15.244 -6.206 17.308 1.00 0.00 H ATOM 1874 N ASP A 198 -18.263 -9.257 16.804 1.00 14.28 N ATOM 1875 CA ASP A 198 -19.325 -9.840 17.583 1.00 17.01 C ATOM 1876 C ASP A 198 -18.726 -10.893 18.504 1.00 17.14 C ATOM 1877 O ASP A 198 -17.877 -11.662 18.084 1.00 18.85 O ATOM 1878 CB ASP A 198 -20.386 -10.495 16.744 1.00 19.35 C ATOM 1879 CG ASP A 198 -21.471 -11.131 17.611 1.00 20.36 C ATOM 1880 OD1 ASP A 198 -21.731 -12.331 17.400 1.00 25.58 O ATOM 1881 OD2 ASP A 198 -22.027 -10.436 18.511 1.00 21.71 O ATOM 1882 H ASP A 198 -18.228 -9.406 15.775 1.00 0.00 H ATOM 1883 N GLY A 199 -19.203 -10.932 19.743 1.00 17.98 N ATOM 1884 CA GLY A 199 -18.646 -11.818 20.780 1.00 16.46 C ATOM 1885 C GLY A 199 -17.450 -11.258 21.541 1.00 16.45 C ATOM 1886 O GLY A 199 -16.880 -11.966 22.396 1.00 17.94 O ATOM 1887 H GLY A 199 -20.001 -10.313 19.991 1.00 0.00 H ATOM 1888 N ILE A 200 -16.981 -10.056 21.219 1.00 13.67 N ATOM 1889 CA ILE A 200 -15.938 -9.407 21.995 1.00 11.88 C ATOM 1890 C ILE A 200 -16.583 -8.213 22.731 1.00 12.50 C ATOM 1891 O ILE A 200 -17.340 -7.458 22.089 1.00 13.82 O ATOM 1892 CB ILE A 200 -14.767 -8.894 21.068 1.00 11.01 C ATOM 1893 CG1 ILE A 200 -14.151 -10.005 20.174 1.00 10.41 C ATOM 1894 CG2 ILE A 200 -13.681 -8.214 21.845 1.00 10.20 C ATOM 1895 CD1 ILE A 200 -13.653 -11.274 20.859 1.00 11.56 C ATOM 1896 H ILE A 200 -17.372 -9.567 20.389 1.00 0.00 H ATOM 1897 N GLU A 201 -16.352 -8.123 24.058 1.00 12.01 N ATOM 1898 CA GLU A 201 -16.808 -7.043 24.956 1.00 11.73 C ATOM 1899 C GLU A 201 -15.644 -6.002 25.036 1.00 11.49 C ATOM 1900 O GLU A 201 -14.464 -6.374 24.887 1.00 10.33 O ATOM 1901 CB GLU A 201 -17.118 -7.543 26.423 1.00 11.56 C ATOM 1902 CG GLU A 201 -18.256 -8.581 26.678 1.00 11.80 C ATOM 1903 CD GLU A 201 -18.461 -8.945 28.174 1.00 12.26 C ATOM 1904 OE1 GLU A 201 -19.409 -8.435 28.805 1.00 13.10 O ATOM 1905 OE2 GLU A 201 -17.676 -9.684 28.781 1.00 11.71 O ATOM 1906 H GLU A 201 -15.798 -8.890 24.491 1.00 0.00 H ATOM 1907 N PRO A 202 -15.947 -4.708 25.250 1.00 12.16 N ATOM 1908 CA PRO A 202 -14.912 -3.716 25.427 1.00 11.33 C ATOM 1909 C PRO A 202 -14.329 -3.772 26.826 1.00 10.47 C ATOM 1910 O PRO A 202 -14.675 -4.631 27.622 1.00 12.89 O ATOM 1911 CB PRO A 202 -15.634 -2.397 25.183 1.00 12.33 C ATOM 1912 CG PRO A 202 -17.038 -2.712 25.641 1.00 12.55 C ATOM 1913 CD PRO A 202 -17.278 -4.069 25.086 1.00 12.12 C ATOM 1914 N GLY A 203 -13.418 -2.867 27.074 1.00 9.98 N ATOM 1915 CA GLY A 203 -12.616 -2.876 28.301 1.00 10.87 C ATOM 1916 C GLY A 203 -11.156 -2.841 27.936 1.00 10.38 C ATOM 1917 O GLY A 203 -10.801 -2.667 26.792 1.00 10.36 O ATOM 1918 H GLY A 203 -13.257 -2.114 26.375 1.00 0.00 H ATOM 1919 N HIS A 204 -10.323 -3.011 28.930 1.00 9.87 N ATOM 1920 CA HIS A 204 -8.884 -2.935 28.716 1.00 9.38 C ATOM 1921 C HIS A 204 -8.090 -3.898 29.549 1.00 8.46 C ATOM 1922 O HIS A 204 -8.586 -4.459 30.572 1.00 9.61 O ATOM 1923 CB HIS A 204 -8.385 -1.507 28.878 1.00 9.35 C ATOM 1924 CG HIS A 204 -8.523 -0.943 30.261 1.00 9.74 C ATOM 1925 ND1 HIS A 204 -9.655 -0.276 30.690 1.00 10.02 N ATOM 1926 CD2 HIS A 204 -7.635 -0.860 31.291 1.00 10.11 C ATOM 1927 CE1 HIS A 204 -9.493 0.140 31.935 1.00 9.73 C ATOM 1928 NE2 HIS A 204 -8.274 -0.184 32.324 1.00 10.33 N ATOM 1929 H HIS A 204 -10.692 -3.202 29.883 1.00 0.00 H ATOM 1930 N ILE A 205 -6.798 -4.056 29.166 1.00 7.61 N ATOM 1931 CA ILE A 205 -5.826 -4.910 29.834 1.00 7.64 C ATOM 1932 C ILE A 205 -5.405 -4.204 31.114 1.00 7.90 C ATOM 1933 O ILE A 205 -5.050 -2.976 31.055 1.00 7.42 O ATOM 1934 CB ILE A 205 -4.552 -5.189 28.970 1.00 7.12 C ATOM 1935 CG1 ILE A 205 -5.008 -5.860 27.637 1.00 6.78 C ATOM 1936 CG2 ILE A 205 -3.521 -6.062 29.694 1.00 6.64 C ATOM 1937 CD1 ILE A 205 -3.883 -5.763 26.648 1.00 7.29 C ATOM 1938 H ILE A 205 -6.477 -3.526 28.331 1.00 0.00 H ATOM 1939 N PRO A 206 -5.347 -4.975 32.236 1.00 8.20 N ATOM 1940 CA PRO A 206 -5.004 -4.285 33.513 1.00 9.08 C ATOM 1941 C PRO A 206 -3.597 -3.666 33.368 1.00 9.54 C ATOM 1942 O PRO A 206 -2.705 -4.306 32.886 1.00 9.44 O ATOM 1943 CB PRO A 206 -5.033 -5.412 34.547 1.00 9.80 C ATOM 1944 CG PRO A 206 -5.885 -6.481 33.998 1.00 9.32 C ATOM 1945 CD PRO A 206 -5.726 -6.390 32.475 1.00 9.07 C ATOM 1946 N GLY A 207 -3.428 -2.446 33.867 1.00 9.34 N ATOM 1947 CA GLY A 207 -2.134 -1.745 33.890 1.00 9.71 C ATOM 1948 C GLY A 207 -1.798 -1.005 32.567 1.00 9.33 C ATOM 1949 O GLY A 207 -0.796 -0.304 32.507 1.00 9.39 O ATOM 1950 H GLY A 207 -4.257 -1.959 34.264 1.00 0.00 H ATOM 1951 N SER A 208 -2.622 -1.167 31.533 1.00 8.51 N ATOM 1952 CA SER A 208 -2.323 -0.506 30.250 1.00 8.73 C ATOM 1953 C SER A 208 -2.747 0.944 30.302 1.00 9.70 C ATOM 1954 O SER A 208 -3.484 1.342 31.226 1.00 9.69 O ATOM 1955 CB SER A 208 -2.992 -1.278 29.142 1.00 8.28 C ATOM 1956 OG SER A 208 -4.433 -1.294 29.211 1.00 7.61 O ATOM 1957 HG SER A 208 -4.793 -1.818 28.452 1.00 0.00 H ATOM 1958 H SER A 208 -3.473 -1.757 31.631 1.00 0.00 H ATOM 1959 N VAL A 209 -2.224 1.724 29.345 1.00 10.34 N ATOM 1960 CA VAL A 209 -2.489 3.174 29.196 1.00 11.32 C ATOM 1961 C VAL A 209 -3.143 3.399 27.801 1.00 11.45 C ATOM 1962 O VAL A 209 -2.785 2.741 26.817 1.00 12.70 O ATOM 1963 CB VAL A 209 -1.161 3.980 29.318 1.00 12.94 C ATOM 1964 CG1 VAL A 209 -1.309 5.474 28.927 1.00 15.59 C ATOM 1965 CG2 VAL A 209 -0.606 3.832 30.728 1.00 13.79 C ATOM 1966 H VAL A 209 -1.585 1.278 28.656 1.00 0.00 H ATOM 1967 N ASN A 210 -4.177 4.197 27.732 1.00 10.40 N ATOM 1968 CA ASN A 210 -4.872 4.447 26.475 1.00 10.21 C ATOM 1969 C ASN A 210 -4.298 5.708 25.801 1.00 10.79 C ATOM 1970 O ASN A 210 -4.352 6.824 26.404 1.00 10.27 O ATOM 1971 CB ASN A 210 -6.332 4.712 26.761 1.00 10.22 C ATOM 1972 CG ASN A 210 -7.221 4.804 25.563 1.00 10.74 C ATOM 1973 OD1 ASN A 210 -8.311 5.438 25.650 1.00 11.81 O ATOM 1974 ND2 ASN A 210 -6.914 4.066 24.496 1.00 9.78 N ATOM 1975 HD22 ASN A 210 -6.008 3.558 24.459 1.00 0.00 H ATOM 1976 HD21 ASN A 210 -7.581 3.999 23.701 1.00 0.00 H ATOM 1977 H ASN A 210 -4.513 4.666 28.597 1.00 0.00 H ATOM 1978 N ILE A 211 -3.764 5.548 24.584 1.00 9.51 N ATOM 1979 CA ILE A 211 -3.433 6.676 23.712 1.00 9.25 C ATOM 1980 C ILE A 211 -4.099 6.344 22.366 1.00 9.00 C ATOM 1981 O ILE A 211 -3.507 5.631 21.518 1.00 9.65 O ATOM 1982 CB ILE A 211 -1.924 6.965 23.493 1.00 9.92 C ATOM 1983 CG1 ILE A 211 -1.185 7.044 24.832 1.00 11.16 C ATOM 1984 CG2 ILE A 211 -1.779 8.240 22.692 1.00 9.96 C ATOM 1985 CD1 ILE A 211 0.313 7.317 24.721 1.00 12.01 C ATOM 1986 H ILE A 211 -3.577 4.583 24.244 1.00 0.00 H ATOM 1987 N PRO A 212 -5.383 6.754 22.190 1.00 8.39 N ATOM 1988 CA PRO A 212 -6.065 6.529 20.938 1.00 8.84 C ATOM 1989 C PRO A 212 -5.224 6.977 19.747 1.00 8.90 C ATOM 1990 O PRO A 212 -4.530 8.049 19.778 1.00 9.82 O ATOM 1991 CB PRO A 212 -7.339 7.353 21.066 1.00 8.89 C ATOM 1992 CG PRO A 212 -7.623 7.324 22.561 1.00 8.43 C ATOM 1993 CD PRO A 212 -6.263 7.407 23.161 1.00 8.74 C ATOM 1994 N PHE A 213 -5.230 6.167 18.685 1.00 9.37 N ATOM 1995 CA PHE A 213 -4.325 6.419 17.551 1.00 9.42 C ATOM 1996 C PHE A 213 -4.512 7.784 16.939 1.00 10.37 C ATOM 1997 O PHE A 213 -3.565 8.369 16.455 1.00 9.82 O ATOM 1998 CB PHE A 213 -4.417 5.356 16.472 1.00 9.32 C ATOM 1999 CG PHE A 213 -5.690 5.395 15.650 1.00 9.14 C ATOM 2000 CD1 PHE A 213 -6.815 4.704 16.085 1.00 9.70 C ATOM 2001 CD2 PHE A 213 -5.771 6.144 14.517 1.00 8.91 C ATOM 2002 CE1 PHE A 213 -7.967 4.708 15.325 1.00 9.36 C ATOM 2003 CE2 PHE A 213 -6.892 6.143 13.759 1.00 9.45 C ATOM 2004 CZ PHE A 213 -8.008 5.445 14.191 1.00 9.47 C ATOM 2005 H PHE A 213 -5.878 5.354 18.659 1.00 0.00 H ATOM 2006 N THR A 214 -5.752 8.292 16.968 1.00 10.59 N ATOM 2007 CA THR A 214 -6.050 9.654 16.488 1.00 11.36 C ATOM 2008 C THR A 214 -5.224 10.766 17.173 1.00 11.00 C ATOM 2009 O THR A 214 -4.945 11.797 16.574 1.00 9.92 O ATOM 2010 CB THR A 214 -7.568 9.874 16.579 1.00 12.13 C ATOM 2011 OG1 THR A 214 -7.975 9.675 17.970 1.00 14.21 O ATOM 2012 CG2 THR A 214 -8.313 8.969 15.616 1.00 13.26 C ATOM 2013 HG1 THR A 214 -7.501 10.325 18.547 1.00 0.00 H ATOM 2014 H THR A 214 -6.528 7.708 17.340 1.00 0.00 H ATOM 2015 N GLU A 215 -4.755 10.539 18.388 1.00 11.12 N ATOM 2016 CA GLU A 215 -4.011 11.585 19.094 1.00 11.75 C ATOM 2017 C GLU A 215 -2.576 11.717 18.564 1.00 10.86 C ATOM 2018 O GLU A 215 -1.859 12.661 18.915 1.00 10.98 O ATOM 2019 CB GLU A 215 -4.074 11.327 20.612 1.00 12.84 C ATOM 2020 CG GLU A 215 -5.511 11.183 21.141 1.00 13.93 C ATOM 2021 CD GLU A 215 -5.684 11.514 22.613 1.00 15.31 C ATOM 2022 OE1 GLU A 215 -6.657 10.990 23.239 1.00 14.63 O ATOM 2023 OE2 GLU A 215 -4.857 12.309 23.140 1.00 15.34 O ATOM 2024 H GLU A 215 -4.914 9.617 18.843 1.00 0.00 H ATOM 2025 N PHE A 216 -2.142 10.795 17.699 1.00 10.13 N ATOM 2026 CA PHE A 216 -0.795 10.971 17.018 1.00 10.66 C ATOM 2027 C PHE A 216 -0.811 11.879 15.787 1.00 12.06 C ATOM 2028 O PHE A 216 0.257 12.214 15.215 1.00 12.45 O ATOM 2029 CB PHE A 216 -0.207 9.605 16.668 1.00 9.73 C ATOM 2030 CG PHE A 216 0.163 8.792 17.862 1.00 8.68 C ATOM 2031 CD1 PHE A 216 1.419 8.974 18.459 1.00 8.88 C ATOM 2032 CD2 PHE A 216 -0.683 7.842 18.389 1.00 8.62 C ATOM 2033 CE1 PHE A 216 1.761 8.290 19.587 1.00 8.54 C ATOM 2034 CE2 PHE A 216 -0.347 7.152 19.518 1.00 8.42 C ATOM 2035 CZ PHE A 216 0.889 7.354 20.119 1.00 8.67 C ATOM 2036 H PHE A 216 -2.725 9.959 17.492 1.00 0.00 H ATOM 2037 N LEU A 217 -2.015 12.164 15.326 1.00 12.94 N ATOM 2038 CA LEU A 217 -2.294 12.863 14.081 1.00 13.40 C ATOM 2039 C LEU A 217 -2.836 14.257 14.356 1.00 12.88 C ATOM 2040 O LEU A 217 -3.452 14.503 15.372 1.00 12.00 O ATOM 2041 CB LEU A 217 -3.351 12.091 13.314 1.00 14.95 C ATOM 2042 CG LEU A 217 -2.905 10.712 12.779 1.00 17.95 C ATOM 2043 CD1 LEU A 217 -4.090 9.864 12.490 1.00 17.65 C ATOM 2044 CD2 LEU A 217 -2.065 10.856 11.503 1.00 19.52 C ATOM 2045 H LEU A 217 -2.830 11.865 15.899 1.00 0.00 H ATOM 2046 N THR A 218 -2.653 15.157 13.390 1.00 12.59 N ATOM 2047 CA THR A 218 -3.172 16.482 13.565 1.00 13.36 C ATOM 2048 C THR A 218 -4.688 16.441 13.314 1.00 16.29 C ATOM 2049 O THR A 218 -5.271 15.433 12.854 1.00 15.84 O ATOM 2050 CB THR A 218 -2.548 17.517 12.622 1.00 13.17 C ATOM 2051 OG1 THR A 218 -2.889 17.215 11.264 1.00 12.56 O ATOM 2052 CG2 THR A 218 -1.066 17.506 12.798 1.00 12.97 C ATOM 2053 HG1 THR A 218 -2.547 16.315 11.031 1.00 0.00 H ATOM 2054 H THR A 218 -2.141 14.902 12.522 1.00 0.00 H ATOM 2055 N ASN A 219 -5.310 17.567 13.626 1.00 17.41 N ATOM 2056 CA ASN A 219 -6.707 17.702 13.321 1.00 17.17 C ATOM 2057 C ASN A 219 -7.083 17.305 11.903 1.00 17.04 C ATOM 2058 O ASN A 219 -8.161 16.775 11.699 1.00 17.83 O ATOM 2059 CB ASN A 219 -7.139 19.146 13.540 1.00 17.88 C ATOM 2060 CG ASN A 219 -8.600 19.248 13.486 1.00 18.12 C ATOM 2061 OD1 ASN A 219 -9.267 18.486 14.175 1.00 17.53 O ATOM 2062 ND2 ASN A 219 -9.126 20.149 12.660 1.00 15.94 N ATOM 2063 HD22 ASN A 219 -8.504 20.768 12.101 1.00 0.00 H ATOM 2064 HD21 ASN A 219 -10.159 20.234 12.573 1.00 0.00 H ATOM 2065 H ASN A 219 -4.794 18.344 14.086 1.00 0.00 H ATOM 2066 N GLU A 220 -6.243 17.606 10.919 1.00 17.87 N ATOM 2067 CA GLU A 220 -6.456 17.223 9.532 1.00 17.05 C ATOM 2068 C GLU A 220 -5.727 15.977 9.012 1.00 15.90 C ATOM 2069 O GLU A 220 -5.671 15.739 7.783 1.00 14.55 O ATOM 2070 CB GLU A 220 -6.124 18.336 8.644 1.00 19.50 C ATOM 2071 CG GLU A 220 -7.096 19.494 8.889 1.00 22.40 C ATOM 2072 CD GLU A 220 -6.600 20.752 8.224 1.00 25.84 C ATOM 2073 OE1 GLU A 220 -6.599 20.747 6.980 1.00 30.88 O ATOM 2074 OE2 GLU A 220 -6.152 21.689 8.931 1.00 30.34 O ATOM 2075 H GLU A 220 -5.385 18.146 11.153 1.00 0.00 H ATOM 2076 N GLY A 221 -5.172 15.213 9.933 1.00 13.09 N ATOM 2077 CA GLY A 221 -4.660 13.843 9.607 1.00 12.60 C ATOM 2078 C GLY A 221 -3.260 13.785 9.062 1.00 13.27 C ATOM 2079 O GLY A 221 -2.929 12.919 8.259 1.00 11.76 O ATOM 2080 H GLY A 221 -5.088 15.569 10.906 1.00 0.00 H ATOM 2081 N LEU A 222 -2.465 14.778 9.434 1.00 11.08 N ATOM 2082 CA LEU A 222 -1.049 14.681 9.202 1.00 12.18 C ATOM 2083 C LEU A 222 -0.381 14.202 10.496 1.00 11.06 C ATOM 2084 O LEU A 222 -0.906 14.471 11.574 1.00 12.06 O ATOM 2085 CB LEU A 222 -0.494 16.038 8.767 1.00 13.52 C ATOM 2086 CG LEU A 222 -0.967 16.520 7.395 1.00 16.03 C ATOM 2087 CD1 LEU A 222 -0.585 17.986 7.247 1.00 17.17 C ATOM 2088 CD2 LEU A 222 -0.338 15.708 6.319 1.00 15.64 C ATOM 2089 H LEU A 222 -2.863 15.623 9.891 1.00 0.00 H ATOM 2090 N GLU A 223 0.819 13.637 10.425 1.00 11.25 N ATOM 2091 CA GLU A 223 1.511 13.291 11.692 1.00 11.36 C ATOM 2092 C GLU A 223 1.834 14.541 12.481 1.00 10.52 C ATOM 2093 O GLU A 223 2.266 15.603 11.942 1.00 10.55 O ATOM 2094 CB GLU A 223 2.752 12.447 11.433 1.00 11.65 C ATOM 2095 CG GLU A 223 3.350 11.697 12.636 1.00 12.88 C ATOM 2096 CD GLU A 223 2.613 10.393 12.999 1.00 12.26 C ATOM 2097 OE1 GLU A 223 1.662 10.108 12.245 1.00 11.83 O ATOM 2098 OE2 GLU A 223 2.887 9.810 14.089 1.00 12.95 O ATOM 2099 H GLU A 223 1.263 13.442 9.505 1.00 0.00 H ATOM 2100 N LYS A 224 1.683 14.424 13.781 1.00 10.91 N ATOM 2101 CA LYS A 224 2.148 15.494 14.651 1.00 10.75 C ATOM 2102 C LYS A 224 3.663 15.493 14.602 1.00 11.25 C ATOM 2103 O LYS A 224 4.329 14.499 14.346 1.00 12.01 O ATOM 2104 CB LYS A 224 1.703 15.225 16.074 1.00 11.40 C ATOM 2105 CG LYS A 224 0.279 15.609 16.358 1.00 13.06 C ATOM 2106 CD LYS A 224 -0.060 15.421 17.831 1.00 15.43 C ATOM 2107 CE LYS A 224 -1.512 15.781 17.958 1.00 14.99 C ATOM 2108 NZ LYS A 224 -2.023 15.452 19.305 1.00 16.94 N ATOM 2109 HZ1 LYS A 224 -1.915 14.432 19.476 1.00 0.00 H ATOM 2110 HZ2 LYS A 224 -1.483 15.983 20.018 1.00 0.00 H ATOM 2111 HZ3 LYS A 224 -3.028 15.711 19.366 1.00 0.00 H ATOM 2112 H LYS A 224 1.236 13.576 14.184 1.00 0.00 H ATOM 2113 N SER A 225 4.238 16.638 14.972 1.00 11.70 N ATOM 2114 CA SER A 225 5.656 16.696 15.173 1.00 12.17 C ATOM 2115 C SER A 225 6.244 15.796 16.289 1.00 13.50 C ATOM 2116 O SER A 225 5.588 15.484 17.279 1.00 13.10 O ATOM 2117 CB SER A 225 6.011 18.148 15.450 1.00 11.68 C ATOM 2118 OG SER A 225 5.715 18.483 16.777 1.00 13.36 O ATOM 2119 HG SER A 225 5.953 19.431 16.938 1.00 0.00 H ATOM 2120 H SER A 225 3.657 17.489 15.115 1.00 0.00 H ATOM 2121 N PRO A 226 7.509 15.420 16.139 1.00 14.54 N ATOM 2122 CA PRO A 226 8.128 14.674 17.175 1.00 15.06 C ATOM 2123 C PRO A 226 8.074 15.389 18.552 1.00 15.00 C ATOM 2124 O PRO A 226 7.860 14.738 19.561 1.00 13.53 O ATOM 2125 CB PRO A 226 9.531 14.514 16.651 1.00 15.89 C ATOM 2126 CG PRO A 226 9.364 14.461 15.166 1.00 16.56 C ATOM 2127 CD PRO A 226 8.435 15.618 15.013 1.00 15.24 C ATOM 2128 N GLU A 227 8.246 16.712 18.544 1.00 15.51 N ATOM 2129 CA GLU A 227 8.065 17.538 19.745 1.00 16.47 C ATOM 2130 C GLU A 227 6.689 17.246 20.346 1.00 14.77 C ATOM 2131 O GLU A 227 6.578 16.950 21.520 1.00 14.64 O ATOM 2132 CB GLU A 227 8.242 19.068 19.419 1.00 19.72 C ATOM 2133 CG GLU A 227 7.719 20.069 20.449 1.00 26.91 C ATOM 2134 CD GLU A 227 8.430 21.486 20.416 1.00 32.81 C ATOM 2135 OE1 GLU A 227 8.181 22.361 19.515 1.00 42.60 O ATOM 2136 OE2 GLU A 227 9.254 21.770 21.334 1.00 29.73 O ATOM 2137 H GLU A 227 8.518 17.176 17.654 1.00 0.00 H ATOM 2138 N GLU A 228 5.637 17.249 19.540 1.00 13.52 N ATOM 2139 CA GLU A 228 4.273 17.059 20.072 1.00 12.38 C ATOM 2140 C GLU A 228 3.982 15.603 20.455 1.00 12.42 C ATOM 2141 O GLU A 228 3.186 15.320 21.410 1.00 9.96 O ATOM 2142 CB GLU A 228 3.246 17.575 19.051 1.00 15.19 C ATOM 2143 CG GLU A 228 3.087 19.113 19.044 1.00 17.32 C ATOM 2144 CD GLU A 228 2.461 19.562 20.353 1.00 22.43 C ATOM 2145 OE1 GLU A 228 1.192 19.645 20.425 1.00 31.01 O ATOM 2146 OE2 GLU A 228 3.211 19.731 21.346 1.00 23.03 O ATOM 2147 H GLU A 228 5.774 17.387 18.518 1.00 0.00 H ATOM 2148 N ILE A 229 4.590 14.697 19.677 1.00 11.42 N ATOM 2149 CA ILE A 229 4.456 13.283 20.027 1.00 12.20 C ATOM 2150 C ILE A 229 5.094 12.986 21.389 1.00 12.26 C ATOM 2151 O ILE A 229 4.507 12.311 22.228 1.00 11.60 O ATOM 2152 CB ILE A 229 5.038 12.368 18.927 1.00 11.17 C ATOM 2153 CG1 ILE A 229 4.232 12.591 17.666 1.00 12.39 C ATOM 2154 CG2 ILE A 229 4.984 10.964 19.407 1.00 11.42 C ATOM 2155 CD1 ILE A 229 4.865 11.974 16.458 1.00 13.79 C ATOM 2156 H ILE A 229 5.142 14.991 18.846 1.00 0.00 H ATOM 2157 N LYS A 230 6.296 13.506 21.634 1.00 13.60 N ATOM 2158 CA LYS A 230 6.945 13.318 22.937 1.00 13.27 C ATOM 2159 C LYS A 230 6.139 13.903 24.054 1.00 13.58 C ATOM 2160 O LYS A 230 6.044 13.322 25.151 1.00 12.51 O ATOM 2161 CB LYS A 230 8.385 13.889 22.870 1.00 14.29 C ATOM 2162 CG LYS A 230 9.285 13.025 22.016 1.00 15.30 C ATOM 2163 CD LYS A 230 10.743 13.509 22.005 1.00 18.61 C ATOM 2164 CE LYS A 230 10.907 14.564 20.960 1.00 21.83 C ATOM 2165 NZ LYS A 230 12.342 14.951 20.817 1.00 23.23 N ATOM 2166 HZ1 LYS A 230 12.692 15.320 21.724 1.00 0.00 H ATOM 2167 HZ2 LYS A 230 12.899 14.117 20.542 1.00 0.00 H ATOM 2168 HZ3 LYS A 230 12.431 15.685 20.086 1.00 0.00 H ATOM 2169 H LYS A 230 6.780 14.052 20.893 1.00 0.00 H ATOM 2170 N ARG A 231 5.466 15.012 23.759 1.00 14.51 N ATOM 2171 CA ARG A 231 4.590 15.670 24.749 1.00 15.37 C ATOM 2172 C ARG A 231 3.387 14.800 25.057 1.00 14.57 C ATOM 2173 O ARG A 231 3.015 14.637 26.247 1.00 14.64 O ATOM 2174 CB ARG A 231 4.091 17.051 24.338 1.00 17.16 C ATOM 2175 CG ARG A 231 3.254 17.662 25.448 1.00 20.28 C ATOM 2176 CD ARG A 231 2.844 19.147 25.251 1.00 24.33 C ATOM 2177 NE ARG A 231 2.070 19.395 24.025 1.00 27.20 N ATOM 2178 CZ ARG A 231 0.732 19.439 23.914 1.00 31.42 C ATOM 2179 NH1 ARG A 231 -0.075 19.204 24.959 1.00 33.41 N ATOM 2180 NH2 ARG A 231 0.185 19.700 22.721 1.00 31.56 N ATOM 2181 HE ARG A 231 2.615 19.553 23.154 1.00 0.00 H ATOM 2182 HH12 ARG A 231 -1.107 19.246 24.839 1.00 0.00 H ATOM 2183 HH11 ARG A 231 0.331 18.980 25.890 1.00 0.00 H ATOM 2184 HH22 ARG A 231 -0.849 19.737 22.620 1.00 0.00 H ATOM 2185 HH21 ARG A 231 0.794 19.866 21.895 1.00 0.00 H ATOM 2186 H ARG A 231 5.559 15.425 22.809 1.00 0.00 H ATOM 2187 N LEU A 232 2.841 14.205 24.005 1.00 12.96 N ATOM 2188 CA LEU A 232 1.693 13.288 24.149 1.00 12.99 C ATOM 2189 C LEU A 232 2.017 12.115 25.071 1.00 12.79 C ATOM 2190 O LEU A 232 1.235 11.762 26.034 1.00 12.60 O ATOM 2191 CB LEU A 232 1.237 12.791 22.750 1.00 12.79 C ATOM 2192 CG LEU A 232 0.121 11.727 22.704 1.00 12.72 C ATOM 2193 CD1 LEU A 232 -1.164 12.194 23.388 1.00 12.74 C ATOM 2194 CD2 LEU A 232 -0.113 11.451 21.249 1.00 12.39 C ATOM 2195 H LEU A 232 3.230 14.388 23.058 1.00 0.00 H ATOM 2196 N PHE A 233 3.131 11.455 24.786 1.00 12.04 N ATOM 2197 CA PHE A 233 3.497 10.283 25.590 1.00 14.23 C ATOM 2198 C PHE A 233 3.650 10.670 27.062 1.00 14.63 C ATOM 2199 O PHE A 233 3.161 10.022 27.992 1.00 13.72 O ATOM 2200 CB PHE A 233 4.793 9.676 25.092 1.00 13.16 C ATOM 2201 CG PHE A 233 4.608 8.727 23.896 1.00 12.39 C ATOM 2202 CD1 PHE A 233 3.858 7.581 24.047 1.00 11.73 C ATOM 2203 CD2 PHE A 233 5.225 8.979 22.692 1.00 11.90 C ATOM 2204 CE1 PHE A 233 3.764 6.648 22.981 1.00 12.05 C ATOM 2205 CE2 PHE A 233 5.141 8.056 21.617 1.00 11.64 C ATOM 2206 CZ PHE A 233 4.347 6.934 21.766 1.00 11.39 C ATOM 2207 H PHE A 233 3.739 11.764 24.001 1.00 0.00 H ATOM 2208 N LYS A 234 4.322 11.781 27.246 1.00 14.79 N ATOM 2209 CA LYS A 234 4.624 12.207 28.603 1.00 17.62 C ATOM 2210 C LYS A 234 3.368 12.641 29.379 1.00 16.07 C ATOM 2211 O LYS A 234 3.174 12.265 30.545 1.00 14.78 O ATOM 2212 CB LYS A 234 5.678 13.315 28.500 1.00 22.06 C ATOM 2213 CG LYS A 234 6.623 13.298 29.650 1.00 31.65 C ATOM 2214 CD LYS A 234 5.999 14.090 30.781 1.00 38.39 C ATOM 2215 CE LYS A 234 6.307 13.461 32.140 1.00 44.22 C ATOM 2216 NZ LYS A 234 6.284 14.549 33.149 1.00 47.56 N ATOM 2217 HZ1 LYS A 234 7.002 15.261 32.906 1.00 0.00 H ATOM 2218 HZ2 LYS A 234 5.343 14.992 33.157 1.00 0.00 H ATOM 2219 HZ3 LYS A 234 6.491 14.153 34.088 1.00 0.00 H ATOM 2220 H LYS A 234 4.634 12.349 26.433 1.00 0.00 H ATOM 2221 N GLU A 235 2.457 13.298 28.715 1.00 16.18 N ATOM 2222 CA GLU A 235 1.190 13.658 29.334 1.00 18.84 C ATOM 2223 C GLU A 235 0.366 12.445 29.697 1.00 18.03 C ATOM 2224 O GLU A 235 -0.441 12.506 30.623 1.00 19.02 O ATOM 2225 CB GLU A 235 0.366 14.540 28.431 1.00 20.88 C ATOM 2226 CG GLU A 235 0.806 15.987 28.377 1.00 25.26 C ATOM 2227 CD GLU A 235 -0.121 16.772 27.447 1.00 32.26 C ATOM 2228 OE1 GLU A 235 0.144 17.964 27.161 1.00 40.56 O ATOM 2229 OE2 GLU A 235 -1.095 16.166 26.942 1.00 34.35 O ATOM 2230 H GLU A 235 2.639 13.569 27.728 1.00 0.00 H ATOM 2231 N LYS A 236 0.492 11.376 28.912 1.00 15.98 N ATOM 2232 CA LYS A 236 -0.155 10.057 29.250 1.00 16.89 C ATOM 2233 C LYS A 236 0.638 9.118 30.181 1.00 16.04 C ATOM 2234 O LYS A 236 0.245 7.918 30.415 1.00 15.87 O ATOM 2235 CB LYS A 236 -0.522 9.364 27.937 1.00 18.06 C ATOM 2236 CG LYS A 236 -1.487 10.184 27.136 1.00 19.52 C ATOM 2237 CD LYS A 236 -2.945 9.808 27.459 1.00 24.68 C ATOM 2238 CE LYS A 236 -3.974 10.675 26.753 1.00 29.36 C ATOM 2239 NZ LYS A 236 -3.449 11.336 25.509 1.00 30.89 N ATOM 2240 HZ1 LYS A 236 -2.644 11.946 25.756 1.00 0.00 H ATOM 2241 HZ2 LYS A 236 -3.140 10.607 24.835 1.00 0.00 H ATOM 2242 HZ3 LYS A 236 -4.202 11.911 25.079 1.00 0.00 H ATOM 2243 H LYS A 236 1.053 11.454 28.040 1.00 0.00 H ATOM 2244 N LYS A 237 1.713 9.617 30.795 1.00 16.29 N ATOM 2245 CA LYS A 237 2.518 8.847 31.739 1.00 18.98 C ATOM 2246 C LYS A 237 3.202 7.673 31.119 1.00 17.08 C ATOM 2247 O LYS A 237 3.450 6.666 31.775 1.00 17.21 O ATOM 2248 CB LYS A 237 1.683 8.265 32.897 1.00 23.37 C ATOM 2249 CG LYS A 237 0.517 9.085 33.329 1.00 28.59 C ATOM 2250 CD LYS A 237 0.861 10.501 33.711 1.00 30.89 C ATOM 2251 CE LYS A 237 -0.461 11.243 33.913 1.00 37.38 C ATOM 2252 NZ LYS A 237 -0.427 12.064 35.141 1.00 36.81 N ATOM 2253 HZ1 LYS A 237 -0.261 11.449 35.963 1.00 0.00 H ATOM 2254 HZ2 LYS A 237 0.340 12.763 35.068 1.00 0.00 H ATOM 2255 HZ3 LYS A 237 -1.336 12.556 35.253 1.00 0.00 H ATOM 2256 H LYS A 237 1.990 10.599 30.592 1.00 0.00 H ATOM 2257 N VAL A 238 3.541 7.821 29.868 1.00 15.24 N ATOM 2258 CA VAL A 238 4.365 6.844 29.202 1.00 15.07 C ATOM 2259 C VAL A 238 5.752 7.424 29.087 1.00 14.09 C ATOM 2260 O VAL A 238 5.953 8.546 28.562 1.00 13.22 O ATOM 2261 CB VAL A 238 3.828 6.526 27.805 1.00 14.83 C ATOM 2262 CG1 VAL A 238 4.754 5.536 27.091 1.00 15.40 C ATOM 2263 CG2 VAL A 238 2.470 5.915 27.921 1.00 17.23 C ATOM 2264 H VAL A 238 3.212 8.656 29.343 1.00 0.00 H ATOM 2265 N ASP A 239 6.712 6.660 29.593 1.00 14.23 N ATOM 2266 CA ASP A 239 8.138 6.959 29.548 1.00 15.30 C ATOM 2267 C ASP A 239 8.838 6.276 28.423 1.00 14.43 C ATOM 2268 O ASP A 239 9.037 5.067 28.422 1.00 12.96 O ATOM 2269 CB ASP A 239 8.792 6.614 30.885 1.00 17.11 C ATOM 2270 CG ASP A 239 10.255 7.130 31.021 1.00 18.69 C ATOM 2271 OD1 ASP A 239 10.842 7.622 30.053 1.00 20.61 O ATOM 2272 OD2 ASP A 239 10.809 7.032 32.141 1.00 23.56 O ATOM 2273 H ASP A 239 6.424 5.776 30.059 1.00 0.00 H ATOM 2274 N LEU A 240 9.206 7.057 27.403 1.00 15.74 N ATOM 2275 CA LEU A 240 9.914 6.524 26.259 1.00 14.94 C ATOM 2276 C LEU A 240 11.325 6.009 26.547 1.00 15.74 C ATOM 2277 O LEU A 240 11.914 5.344 25.690 1.00 16.16 O ATOM 2278 CB LEU A 240 9.949 7.499 25.057 1.00 17.65 C ATOM 2279 CG LEU A 240 8.660 7.816 24.345 1.00 17.53 C ATOM 2280 CD1 LEU A 240 8.759 8.932 23.292 1.00 19.29 C ATOM 2281 CD2 LEU A 240 8.148 6.532 23.743 1.00 17.26 C ATOM 2282 H LEU A 240 8.978 8.071 27.432 1.00 0.00 H ATOM 2283 N SER A 241 11.875 6.284 27.726 1.00 14.85 N ATOM 2284 CA SER A 241 13.157 5.694 28.090 1.00 14.97 C ATOM 2285 C SER A 241 13.027 4.227 28.474 1.00 14.53 C ATOM 2286 O SER A 241 14.027 3.492 28.524 1.00 15.45 O ATOM 2287 CB SER A 241 13.773 6.454 29.282 1.00 14.86 C ATOM 2288 OG SER A 241 13.440 7.823 29.223 1.00 14.47 O ATOM 2289 HG SER A 241 12.456 7.924 29.252 1.00 0.00 H ATOM 2290 H SER A 241 11.390 6.921 28.389 1.00 0.00 H ATOM 2291 N LYS A 242 11.791 3.802 28.742 1.00 14.58 N ATOM 2292 CA LYS A 242 11.485 2.456 29.288 1.00 14.00 C ATOM 2293 C LYS A 242 10.796 1.628 28.211 1.00 13.23 C ATOM 2294 O LYS A 242 10.279 2.220 27.252 1.00 10.89 O ATOM 2295 CB LYS A 242 10.493 2.614 30.437 1.00 17.05 C ATOM 2296 CG LYS A 242 11.124 2.786 31.819 1.00 21.60 C ATOM 2297 CD LYS A 242 11.776 4.095 31.982 1.00 23.79 C ATOM 2298 CE LYS A 242 13.087 4.005 32.757 1.00 27.70 C ATOM 2299 NZ LYS A 242 12.863 3.604 34.168 1.00 28.00 N ATOM 2300 HZ1 LYS A 242 12.254 4.306 34.634 1.00 0.00 H ATOM 2301 HZ2 LYS A 242 12.402 2.672 34.193 1.00 0.00 H ATOM 2302 HZ3 LYS A 242 13.777 3.554 34.662 1.00 0.00 H ATOM 2303 H LYS A 242 10.998 4.449 28.558 1.00 0.00 H ATOM 2304 N PRO A 243 10.773 0.290 28.357 1.00 11.94 N ATOM 2305 CA PRO A 243 10.144 -0.509 27.328 1.00 11.01 C ATOM 2306 C PRO A 243 8.655 -0.164 27.119 1.00 10.69 C ATOM 2307 O PRO A 243 7.894 0.182 28.074 1.00 9.39 O ATOM 2308 CB PRO A 243 10.430 -1.922 27.768 1.00 11.53 C ATOM 2309 CG PRO A 243 11.652 -1.814 28.684 1.00 12.92 C ATOM 2310 CD PRO A 243 11.440 -0.547 29.365 1.00 12.68 C ATOM 2311 N LEU A 244 8.220 -0.304 25.868 1.00 10.05 N ATOM 2312 CA LEU A 244 6.868 0.071 25.463 1.00 11.00 C ATOM 2313 C LEU A 244 6.376 -0.976 24.480 1.00 9.42 C ATOM 2314 O LEU A 244 7.145 -1.360 23.591 1.00 9.55 O ATOM 2315 CB LEU A 244 6.958 1.447 24.787 1.00 13.22 C ATOM 2316 CG LEU A 244 5.702 2.063 24.254 1.00 15.59 C ATOM 2317 CD1 LEU A 244 4.725 1.937 25.370 1.00 16.61 C ATOM 2318 CD2 LEU A 244 5.807 3.504 23.809 1.00 16.18 C ATOM 2319 H LEU A 244 8.867 -0.695 25.153 1.00 0.00 H ATOM 2320 N VAL A 245 5.121 -1.436 24.641 1.00 7.85 N ATOM 2321 CA VAL A 245 4.486 -2.412 23.755 1.00 7.10 C ATOM 2322 C VAL A 245 3.160 -1.838 23.337 1.00 6.87 C ATOM 2323 O VAL A 245 2.429 -1.293 24.166 1.00 7.64 O ATOM 2324 CB VAL A 245 4.278 -3.779 24.470 1.00 7.26 C ATOM 2325 CG1 VAL A 245 3.391 -4.744 23.706 1.00 7.86 C ATOM 2326 CG2 VAL A 245 5.626 -4.428 24.702 1.00 7.50 C ATOM 2327 H VAL A 245 4.569 -1.075 25.445 1.00 0.00 H ATOM 2328 N ALA A 246 2.876 -1.868 22.034 1.00 6.58 N ATOM 2329 CA ALA A 246 1.650 -1.299 21.432 1.00 6.54 C ATOM 2330 C ALA A 246 0.548 -2.301 21.225 1.00 5.70 C ATOM 2331 O ALA A 246 0.814 -3.425 20.816 1.00 5.91 O ATOM 2332 CB ALA A 246 2.000 -0.606 20.104 1.00 6.77 C ATOM 2333 H ALA A 246 3.563 -2.322 21.398 1.00 0.00 H ATOM 2334 N THR A 247 -0.706 -1.935 21.507 1.00 5.46 N ATOM 2335 CA THR A 247 -1.823 -2.870 21.344 1.00 5.73 C ATOM 2336 C THR A 247 -3.069 -2.082 20.923 1.00 5.63 C ATOM 2337 O THR A 247 -3.072 -0.851 21.078 1.00 6.08 O ATOM 2338 CB THR A 247 -2.063 -3.677 22.617 1.00 5.94 C ATOM 2339 OG1 THR A 247 -3.012 -4.742 22.394 1.00 6.92 O ATOM 2340 CG2 THR A 247 -2.545 -2.748 23.765 1.00 5.98 C ATOM 2341 HG1 THR A 247 -3.875 -4.357 22.098 1.00 0.00 H ATOM 2342 H THR A 247 -0.893 -0.970 21.848 1.00 0.00 H TER 2343 THR A 247 ATOM 2344 N GLY A 249 -7.282 -3.187 18.805 1.00 5.18 N ATOM 2345 CA GLY A 249 -8.311 -4.182 18.649 1.00 5.48 C ATOM 2346 C GLY A 249 -7.679 -5.491 18.100 1.00 5.57 C ATOM 2347 O GLY A 249 -7.897 -6.571 18.647 1.00 5.27 O ATOM 2348 HN3 GLY A 249 -6.839 -3.001 17.883 1.00 0.00 H ATOM 2349 HN2 GLY A 249 -6.564 -3.534 19.472 1.00 0.00 H ATOM 2350 HN1 GLY A 249 -7.703 -2.310 19.172 1.00 0.00 H ATOM 2351 N SER A 250 -6.934 -5.358 16.991 1.00 6.07 N ATOM 2352 CA SER A 250 -6.408 -6.523 16.264 1.00 6.41 C ATOM 2353 C SER A 250 -4.950 -6.386 15.887 1.00 6.17 C ATOM 2354 O SER A 250 -4.445 -7.236 15.111 1.00 6.42 O ATOM 2355 CB SER A 250 -7.287 -6.852 15.052 1.00 7.23 C ATOM 2356 OG SER A 250 -7.225 -5.777 14.044 1.00 7.51 O ATOM 2357 HG SER A 250 -7.800 -6.015 13.274 1.00 0.00 H ATOM 2358 H SER A 250 -6.723 -4.404 16.636 1.00 0.00 H ATOM 2359 N GLY A 251 -4.286 -5.331 16.358 1.00 5.87 N ATOM 2360 CA GLY A 251 -2.832 -5.094 16.088 1.00 6.29 C ATOM 2361 C GLY A 251 -2.544 -4.184 14.878 1.00 6.72 C ATOM 2362 O GLY A 251 -1.383 -4.103 14.456 1.00 7.02 O ATOM 2363 H GLY A 251 -4.801 -4.640 16.940 1.00 0.00 H ATOM 2364 N VAL A 252 -3.592 -3.547 14.343 1.00 6.51 N ATOM 2365 CA VAL A 252 -3.435 -2.720 13.122 1.00 6.67 C ATOM 2366 C VAL A 252 -3.162 -1.285 13.576 1.00 6.17 C ATOM 2367 O VAL A 252 -2.045 -0.759 13.380 1.00 5.77 O ATOM 2368 CB VAL A 252 -4.694 -2.778 12.293 1.00 6.57 C ATOM 2369 CG1 VAL A 252 -4.694 -1.775 11.173 1.00 6.64 C ATOM 2370 CG2 VAL A 252 -4.888 -4.205 11.706 1.00 7.33 C ATOM 2371 H VAL A 252 -4.528 -3.633 14.789 1.00 0.00 H ATOM 2372 N THR A 253 -4.107 -0.667 14.244 1.00 6.22 N ATOM 2373 CA THR A 253 -3.937 0.741 14.673 1.00 7.00 C ATOM 2374 C THR A 253 -2.856 0.951 15.755 1.00 6.93 C ATOM 2375 O THR A 253 -2.351 2.055 15.897 1.00 7.00 O ATOM 2376 CB THR A 253 -5.255 1.434 15.095 1.00 7.59 C ATOM 2377 OG1 THR A 253 -5.773 0.851 16.320 1.00 7.12 O ATOM 2378 CG2 THR A 253 -6.312 1.405 13.990 1.00 8.17 C ATOM 2379 HG1 THR A 253 -6.614 1.308 16.571 1.00 0.00 H ATOM 2380 H THR A 253 -4.986 -1.172 14.475 1.00 0.00 H ATOM 2381 N ALA A 254 -2.517 -0.106 16.489 1.00 6.49 N ATOM 2382 CA ALA A 254 -1.316 -0.179 17.385 1.00 7.30 C ATOM 2383 C ALA A 254 -0.087 0.347 16.682 1.00 6.86 C ATOM 2384 O ALA A 254 0.778 0.923 17.323 1.00 6.18 O ATOM 2385 CB ALA A 254 -1.048 -1.605 17.835 1.00 7.31 C ATOM 2386 H ALA A 254 -3.131 -0.944 16.438 1.00 0.00 H ATOM 2387 N SER A 255 0.011 0.165 15.365 1.00 6.77 N ATOM 2388 CA SER A 255 1.170 0.574 14.630 1.00 7.28 C ATOM 2389 C SER A 255 1.330 2.104 14.600 1.00 6.97 C ATOM 2390 O SER A 255 2.409 2.587 14.331 1.00 7.15 O ATOM 2391 CB SER A 255 1.115 0.009 13.234 1.00 7.49 C ATOM 2392 OG SER A 255 1.042 -1.459 13.243 1.00 7.83 O ATOM 2393 HG SER A 255 0.227 -1.745 13.727 1.00 0.00 H ATOM 2394 H SER A 255 -0.776 -0.287 14.857 1.00 0.00 H ATOM 2395 N HIS A 256 0.306 2.846 14.941 1.00 6.97 N ATOM 2396 CA HIS A 256 0.489 4.302 15.136 1.00 7.38 C ATOM 2397 C HIS A 256 1.300 4.614 16.369 1.00 7.35 C ATOM 2398 O HIS A 256 1.999 5.618 16.360 1.00 7.10 O ATOM 2399 CB HIS A 256 -0.845 5.002 15.288 1.00 7.40 C ATOM 2400 CG HIS A 256 -1.391 5.521 13.991 1.00 8.11 C ATOM 2401 ND1 HIS A 256 -0.794 6.571 13.316 1.00 9.25 N ATOM 2402 CD2 HIS A 256 -2.414 5.115 13.231 1.00 8.59 C ATOM 2403 CE1 HIS A 256 -1.514 6.861 12.258 1.00 9.13 C ATOM 2404 NE2 HIS A 256 -2.508 5.990 12.180 1.00 8.87 N ATOM 2405 H HIS A 256 -0.631 2.415 15.074 1.00 0.00 H ATOM 2406 N VAL A 257 1.234 3.780 17.406 1.00 7.02 N ATOM 2407 CA VAL A 257 2.051 3.945 18.575 1.00 7.17 C ATOM 2408 C VAL A 257 3.487 3.692 18.239 1.00 7.45 C ATOM 2409 O VAL A 257 4.352 4.506 18.538 1.00 7.14 O ATOM 2410 CB VAL A 257 1.559 3.090 19.775 1.00 7.39 C ATOM 2411 CG1 VAL A 257 2.485 3.245 20.957 1.00 7.67 C ATOM 2412 CG2 VAL A 257 0.113 3.403 20.135 1.00 7.75 C ATOM 2413 H VAL A 257 0.568 2.982 17.367 1.00 0.00 H ATOM 2414 N VAL A 258 3.695 2.609 17.511 1.00 6.99 N ATOM 2415 CA VAL A 258 4.981 2.214 17.000 1.00 6.83 C ATOM 2416 C VAL A 258 5.570 3.353 16.169 1.00 6.85 C ATOM 2417 O VAL A 258 6.758 3.748 16.397 1.00 7.05 O ATOM 2418 CB VAL A 258 4.869 0.924 16.169 1.00 6.70 C ATOM 2419 CG1 VAL A 258 6.218 0.543 15.541 1.00 6.97 C ATOM 2420 CG2 VAL A 258 4.259 -0.233 16.941 1.00 6.64 C ATOM 2421 H VAL A 258 2.878 2.004 17.294 1.00 0.00 H ATOM 2422 N LEU A 259 4.813 3.860 15.192 1.00 6.68 N ATOM 2423 CA LEU A 259 5.284 4.995 14.390 1.00 6.84 C ATOM 2424 C LEU A 259 5.629 6.233 15.193 1.00 7.44 C ATOM 2425 O LEU A 259 6.668 6.863 15.025 1.00 7.23 O ATOM 2426 CB LEU A 259 4.266 5.334 13.313 1.00 7.04 C ATOM 2427 CG LEU A 259 4.476 6.594 12.448 1.00 6.80 C ATOM 2428 CD1 LEU A 259 5.772 6.305 11.690 1.00 6.71 C ATOM 2429 CD2 LEU A 259 3.288 6.775 11.512 1.00 7.53 C ATOM 2430 H LEU A 259 3.879 3.446 14.998 1.00 0.00 H ATOM 2431 N GLY A 260 4.725 6.631 16.080 1.00 7.05 N ATOM 2432 CA GLY A 260 4.974 7.798 16.922 1.00 7.40 C ATOM 2433 C GLY A 260 6.269 7.644 17.733 1.00 7.85 C ATOM 2434 O GLY A 260 7.064 8.582 17.825 1.00 7.98 O ATOM 2435 H GLY A 260 3.832 6.107 16.176 1.00 0.00 H ATOM 2436 N ALA A 261 6.500 6.465 18.300 1.00 8.32 N ATOM 2437 CA ALA A 261 7.728 6.186 19.055 1.00 8.08 C ATOM 2438 C ALA A 261 8.943 6.235 18.130 1.00 8.67 C ATOM 2439 O ALA A 261 9.977 6.865 18.466 1.00 9.43 O ATOM 2440 CB ALA A 261 7.623 4.885 19.779 1.00 8.28 C ATOM 2441 H ALA A 261 5.787 5.714 18.206 1.00 0.00 H ATOM 2442 N PHE A 262 8.829 5.650 16.949 1.00 8.33 N ATOM 2443 CA PHE A 262 9.904 5.633 15.954 1.00 8.46 C ATOM 2444 C PHE A 262 10.322 7.025 15.589 1.00 9.29 C ATOM 2445 O PHE A 262 11.570 7.308 15.538 1.00 11.53 O ATOM 2446 CB PHE A 262 9.431 4.828 14.744 1.00 8.44 C ATOM 2447 CG PHE A 262 10.489 4.550 13.692 1.00 7.85 C ATOM 2448 CD1 PHE A 262 11.006 3.254 13.534 1.00 8.22 C ATOM 2449 CD2 PHE A 262 10.807 5.523 12.746 1.00 8.48 C ATOM 2450 CE1 PHE A 262 11.911 2.949 12.569 1.00 8.33 C ATOM 2451 CE2 PHE A 262 11.690 5.216 11.691 1.00 8.62 C ATOM 2452 CZ PHE A 262 12.240 3.940 11.600 1.00 9.02 C ATOM 2453 H PHE A 262 7.932 5.179 16.715 1.00 0.00 H ATOM 2454 N LEU A 263 9.337 7.895 15.362 1.00 9.49 N ATOM 2455 CA LEU A 263 9.575 9.306 14.952 1.00 10.21 C ATOM 2456 C LEU A 263 10.160 10.126 16.110 1.00 10.69 C ATOM 2457 O LEU A 263 10.751 11.210 15.889 1.00 11.47 O ATOM 2458 CB LEU A 263 8.309 9.950 14.454 1.00 9.83 C ATOM 2459 CG LEU A 263 7.722 9.355 13.210 1.00 9.78 C ATOM 2460 CD1 LEU A 263 6.327 9.865 12.938 1.00 10.98 C ATOM 2461 CD2 LEU A 263 8.631 9.615 12.049 1.00 10.22 C ATOM 2462 H LEU A 263 8.355 7.572 15.477 1.00 0.00 H ATOM 2463 N SER A 264 9.988 9.644 17.326 1.00 11.71 N ATOM 2464 CA SER A 264 10.542 10.271 18.517 1.00 14.78 C ATOM 2465 C SER A 264 11.841 9.631 18.977 1.00 15.95 C ATOM 2466 O SER A 264 12.229 9.835 20.137 1.00 19.00 O ATOM 2467 CB SER A 264 9.581 10.105 19.659 1.00 14.24 C ATOM 2468 OG SER A 264 8.324 10.582 19.352 1.00 18.40 O ATOM 2469 HG SER A 264 7.966 10.088 18.572 1.00 0.00 H ATOM 2470 H SER A 264 9.430 8.774 17.439 1.00 0.00 H ATOM 2471 N GLY A 265 12.387 8.732 18.182 1.00 16.06 N ATOM 2472 CA GLY A 265 13.705 8.154 18.443 1.00 18.21 C ATOM 2473 C GLY A 265 13.704 6.744 18.965 1.00 20.18 C ATOM 2474 O GLY A 265 14.776 6.132 19.041 1.00 22.20 O ATOM 2475 H GLY A 265 11.862 8.423 17.339 1.00 0.00 H ATOM 2476 N LYS A 266 12.541 6.180 19.307 1.00 15.45 N ATOM 2477 CA LYS A 266 12.520 4.836 19.886 1.00 14.26 C ATOM 2478 C LYS A 266 12.062 3.808 18.884 1.00 13.60 C ATOM 2479 O LYS A 266 10.875 3.777 18.552 1.00 13.91 O ATOM 2480 CB LYS A 266 11.556 4.831 21.095 1.00 14.01 C ATOM 2481 CG LYS A 266 11.557 3.510 21.861 1.00 14.72 C ATOM 2482 CD LYS A 266 10.502 3.514 22.962 1.00 13.34 C ATOM 2483 CE LYS A 266 10.826 2.449 23.966 1.00 13.57 C ATOM 2484 NZ LYS A 266 12.072 2.656 24.827 1.00 14.63 N ATOM 2485 HZ1 LYS A 266 12.909 2.724 24.213 1.00 0.00 H ATOM 2486 HZ2 LYS A 266 11.971 3.534 25.375 1.00 0.00 H ATOM 2487 HZ3 LYS A 266 12.181 1.851 25.476 1.00 0.00 H ATOM 2488 H LYS A 266 11.650 6.697 19.161 1.00 0.00 H ATOM 2489 N SER A 267 12.971 3.040 18.360 1.00 13.09 N ATOM 2490 CA SER A 267 12.635 2.124 17.255 1.00 15.41 C ATOM 2491 C SER A 267 12.146 0.760 17.693 1.00 16.84 C ATOM 2492 O SER A 267 11.804 -0.085 16.836 1.00 19.56 O ATOM 2493 CB SER A 267 13.853 1.930 16.355 1.00 17.29 C ATOM 2494 OG SER A 267 14.843 1.379 17.143 1.00 18.36 O ATOM 2495 HG SER A 267 15.656 1.235 16.597 1.00 0.00 H ATOM 2496 H SER A 267 13.945 3.072 18.724 1.00 0.00 H ATOM 2497 N ASP A 268 12.230 0.456 18.979 1.00 14.38 N ATOM 2498 CA ASP A 268 11.949 -0.931 19.402 1.00 16.01 C ATOM 2499 C ASP A 268 10.665 -0.928 20.231 1.00 14.58 C ATOM 2500 O ASP A 268 10.686 -0.920 21.498 1.00 17.49 O ATOM 2501 CB ASP A 268 13.077 -1.535 20.200 1.00 16.17 C ATOM 2502 CG ASP A 268 13.389 -0.757 21.418 1.00 17.34 C ATOM 2503 OD1 ASP A 268 13.353 0.493 21.393 1.00 19.50 O ATOM 2504 OD2 ASP A 268 13.802 -1.377 22.410 1.00 23.28 O ATOM 2505 H ASP A 268 12.489 1.181 19.679 1.00 0.00 H ATOM 2506 N VAL A 269 9.567 -0.709 19.531 1.00 11.43 N ATOM 2507 CA VAL A 269 8.257 -0.842 20.175 1.00 9.40 C ATOM 2508 C VAL A 269 7.529 -2.005 19.510 1.00 8.83 C ATOM 2509 O VAL A 269 6.993 -1.850 18.404 1.00 7.99 O ATOM 2510 CB VAL A 269 7.440 0.453 20.088 1.00 9.16 C ATOM 2511 CG1 VAL A 269 5.987 0.248 20.567 1.00 9.48 C ATOM 2512 CG2 VAL A 269 8.198 1.549 20.852 1.00 9.36 C ATOM 2513 H VAL A 269 9.631 -0.443 18.528 1.00 0.00 H ATOM 2514 N PRO A 270 7.491 -3.171 20.185 1.00 8.22 N ATOM 2515 CA PRO A 270 6.779 -4.333 19.587 1.00 8.39 C ATOM 2516 C PRO A 270 5.279 -4.173 19.590 1.00 7.65 C ATOM 2517 O PRO A 270 4.794 -3.349 20.344 1.00 7.26 O ATOM 2518 CB PRO A 270 7.112 -5.504 20.485 1.00 9.15 C ATOM 2519 CG PRO A 270 7.893 -5.017 21.564 1.00 10.25 C ATOM 2520 CD PRO A 270 8.257 -3.547 21.385 1.00 9.37 C ATOM 2521 N VAL A 271 4.633 -4.908 18.693 1.00 6.73 N ATOM 2522 CA VAL A 271 3.168 -4.937 18.677 1.00 6.41 C ATOM 2523 C VAL A 271 2.650 -6.201 19.321 1.00 6.29 C ATOM 2524 O VAL A 271 3.095 -7.294 18.979 1.00 6.82 O ATOM 2525 CB VAL A 271 2.686 -4.818 17.227 1.00 6.63 C ATOM 2526 CG1 VAL A 271 1.134 -4.956 17.179 1.00 6.89 C ATOM 2527 CG2 VAL A 271 3.109 -3.455 16.688 1.00 7.39 C ATOM 2528 H VAL A 271 5.169 -5.466 17.998 1.00 0.00 H ATOM 2529 N TYR A 272 1.655 -6.080 20.202 1.00 5.71 N ATOM 2530 CA TYR A 272 0.982 -7.263 20.705 1.00 5.52 C ATOM 2531 C TYR A 272 -0.056 -7.599 19.612 1.00 5.14 C ATOM 2532 O TYR A 272 -1.169 -7.009 19.541 1.00 5.54 O ATOM 2533 CB TYR A 272 0.274 -6.960 22.008 1.00 5.36 C ATOM 2534 CG TYR A 272 -0.664 -8.062 22.470 1.00 5.15 C ATOM 2535 CD1 TYR A 272 -0.396 -9.394 22.146 1.00 5.22 C ATOM 2536 CD2 TYR A 272 -1.855 -7.758 23.178 1.00 5.29 C ATOM 2537 CE1 TYR A 272 -1.245 -10.405 22.509 1.00 5.26 C ATOM 2538 CE2 TYR A 272 -2.692 -8.785 23.595 1.00 5.14 C ATOM 2539 CZ TYR A 272 -2.370 -10.105 23.245 1.00 5.61 C ATOM 2540 OH TYR A 272 -3.246 -11.118 23.636 1.00 5.85 O ATOM 2541 HH TYR A 272 -2.898 -11.991 23.325 1.00 0.00 H ATOM 2542 H TYR A 272 1.362 -5.137 20.528 1.00 0.00 H ATOM 2543 N ASP A 273 0.353 -8.516 18.739 1.00 4.89 N ATOM 2544 CA ASP A 273 -0.375 -8.783 17.518 1.00 4.71 C ATOM 2545 C ASP A 273 -1.753 -9.337 17.835 1.00 4.65 C ATOM 2546 O ASP A 273 -2.753 -8.932 17.176 1.00 4.98 O ATOM 2547 CB ASP A 273 0.423 -9.738 16.667 1.00 4.81 C ATOM 2548 CG ASP A 273 -0.021 -9.817 15.214 1.00 5.01 C ATOM 2549 OD1 ASP A 273 -0.859 -9.016 14.732 1.00 5.66 O ATOM 2550 OD2 ASP A 273 0.426 -10.759 14.553 1.00 5.60 O ATOM 2551 H ASP A 273 1.219 -9.055 18.940 1.00 0.00 H ATOM 2552 N GLY A 274 -1.888 -10.171 18.886 1.00 4.17 N ATOM 2553 CA GLY A 274 -3.188 -10.703 19.209 1.00 4.30 C ATOM 2554 C GLY A 274 -4.176 -9.612 19.631 1.00 4.50 C ATOM 2555 O GLY A 274 -5.347 -9.623 19.305 1.00 4.41 O ATOM 2556 H GLY A 274 -1.060 -10.429 19.460 1.00 0.00 H ATOM 2557 N SER A 275 -3.662 -8.642 20.373 1.00 4.40 N ATOM 2558 CA SER A 275 -4.383 -7.422 20.695 1.00 4.61 C ATOM 2559 C SER A 275 -5.659 -7.761 21.459 1.00 4.67 C ATOM 2560 O SER A 275 -5.722 -8.788 22.149 1.00 4.58 O ATOM 2561 CB SER A 275 -4.574 -6.549 19.419 1.00 4.97 C ATOM 2562 OG SER A 275 -3.522 -5.635 19.259 1.00 5.59 O ATOM 2563 HG SER A 275 -2.668 -6.128 19.177 1.00 0.00 H ATOM 2564 H SER A 275 -2.697 -8.759 20.742 1.00 0.00 H ATOM 2565 N TRP A 276 -6.672 -6.892 21.432 1.00 4.89 N ATOM 2566 CA TRP A 276 -7.781 -7.031 22.426 1.00 5.36 C ATOM 2567 C TRP A 276 -8.648 -8.247 22.078 1.00 5.59 C ATOM 2568 O TRP A 276 -9.117 -8.951 22.959 1.00 5.91 O ATOM 2569 CB TRP A 276 -8.608 -5.767 22.497 1.00 5.53 C ATOM 2570 CG TRP A 276 -9.774 -5.876 23.406 1.00 5.81 C ATOM 2571 CD1 TRP A 276 -11.082 -5.968 23.046 1.00 6.09 C ATOM 2572 CD2 TRP A 276 -9.712 -5.913 24.820 1.00 5.93 C ATOM 2573 NE1 TRP A 276 -11.857 -6.053 24.195 1.00 5.94 N ATOM 2574 CE2 TRP A 276 -11.041 -6.049 25.296 1.00 6.02 C ATOM 2575 CE3 TRP A 276 -8.657 -5.843 25.738 1.00 5.66 C ATOM 2576 CZ2 TRP A 276 -11.349 -6.126 26.650 1.00 6.42 C ATOM 2577 CZ3 TRP A 276 -8.929 -5.969 27.056 1.00 6.12 C ATOM 2578 CH2 TRP A 276 -10.288 -6.087 27.530 1.00 6.25 C ATOM 2579 HE1 TRP A 276 -12.895 -6.111 24.217 1.00 0.00 H ATOM 2580 H TRP A 276 -6.690 -6.127 20.728 1.00 0.00 H ATOM 2581 N VAL A 277 -8.810 -8.536 20.789 1.00 6.08 N ATOM 2582 CA VAL A 277 -9.575 -9.691 20.394 1.00 6.30 C ATOM 2583 C VAL A 277 -9.005 -10.927 21.089 1.00 5.67 C ATOM 2584 O VAL A 277 -9.728 -11.743 21.644 1.00 5.54 O ATOM 2585 CB VAL A 277 -9.664 -9.830 18.846 1.00 6.85 C ATOM 2586 CG1 VAL A 277 -10.180 -11.198 18.389 1.00 7.81 C ATOM 2587 CG2 VAL A 277 -10.593 -8.728 18.316 1.00 7.67 C ATOM 2588 H VAL A 277 -8.382 -7.925 20.064 1.00 0.00 H ATOM 2589 N GLU A 278 -7.710 -11.151 20.985 1.00 5.57 N ATOM 2590 CA GLU A 278 -7.124 -12.314 21.555 1.00 5.17 C ATOM 2591 C GLU A 278 -7.209 -12.241 23.084 1.00 5.30 C ATOM 2592 O GLU A 278 -7.584 -13.255 23.763 1.00 5.02 O ATOM 2593 CB GLU A 278 -5.629 -12.494 21.151 1.00 5.46 C ATOM 2594 CG GLU A 278 -5.076 -13.801 21.696 1.00 5.53 C ATOM 2595 CD GLU A 278 -3.633 -13.983 21.522 1.00 5.51 C ATOM 2596 OE1 GLU A 278 -2.849 -13.018 21.682 1.00 6.11 O ATOM 2597 OE2 GLU A 278 -3.260 -15.143 21.248 1.00 6.08 O ATOM 2598 H GLU A 278 -7.110 -10.468 20.480 1.00 0.00 H ATOM 2599 N TRP A 279 -6.853 -11.067 23.598 1.00 4.81 N ATOM 2600 CA TRP A 279 -6.779 -10.904 25.011 1.00 5.69 C ATOM 2601 C TRP A 279 -8.144 -11.269 25.638 1.00 5.61 C ATOM 2602 O TRP A 279 -8.216 -12.053 26.672 1.00 5.81 O ATOM 2603 CB TRP A 279 -6.381 -9.465 25.376 1.00 5.87 C ATOM 2604 CG TRP A 279 -6.249 -9.330 26.867 1.00 6.04 C ATOM 2605 CD1 TRP A 279 -7.176 -8.827 27.729 1.00 6.49 C ATOM 2606 CD2 TRP A 279 -5.174 -9.814 27.672 1.00 5.91 C ATOM 2607 NE1 TRP A 279 -6.733 -8.910 29.039 1.00 6.27 N ATOM 2608 CE2 TRP A 279 -5.525 -9.545 29.034 1.00 5.74 C ATOM 2609 CE3 TRP A 279 -3.971 -10.503 27.382 1.00 5.72 C ATOM 2610 CZ2 TRP A 279 -4.687 -9.850 30.073 1.00 5.86 C ATOM 2611 CZ3 TRP A 279 -3.184 -10.880 28.444 1.00 5.79 C ATOM 2612 CH2 TRP A 279 -3.530 -10.510 29.772 1.00 6.06 C ATOM 2613 HE1 TRP A 279 -7.233 -8.552 29.878 1.00 0.00 H ATOM 2614 H TRP A 279 -6.629 -10.269 22.969 1.00 0.00 H ATOM 2615 N TYR A 280 -9.203 -10.681 25.072 1.00 6.16 N ATOM 2616 CA TYR A 280 -10.590 -10.929 25.586 1.00 6.84 C ATOM 2617 C TYR A 280 -10.921 -12.427 25.468 1.00 6.85 C ATOM 2618 O TYR A 280 -11.383 -13.052 26.388 1.00 6.64 O ATOM 2619 CB TYR A 280 -11.580 -10.157 24.778 1.00 7.35 C ATOM 2620 CG TYR A 280 -12.967 -10.333 25.332 1.00 8.20 C ATOM 2621 CD1 TYR A 280 -13.780 -11.320 24.853 1.00 9.27 C ATOM 2622 CD2 TYR A 280 -13.423 -9.539 26.384 1.00 9.10 C ATOM 2623 CE1 TYR A 280 -14.988 -11.590 25.429 1.00 10.41 C ATOM 2624 CE2 TYR A 280 -14.667 -9.763 26.912 1.00 11.07 C ATOM 2625 CZ TYR A 280 -15.452 -10.772 26.420 1.00 11.61 C ATOM 2626 OH TYR A 280 -16.764 -11.000 26.879 1.00 14.27 O ATOM 2627 HH TYR A 280 -16.744 -11.193 27.850 1.00 0.00 H ATOM 2628 H TYR A 280 -9.063 -10.042 24.263 1.00 0.00 H ATOM 2629 N MET A 281 -10.667 -13.020 24.299 1.00 7.00 N ATOM 2630 CA MET A 281 -10.975 -14.449 24.101 1.00 7.36 C ATOM 2631 C MET A 281 -10.215 -15.390 25.058 1.00 7.37 C ATOM 2632 O MET A 281 -10.730 -16.489 25.449 1.00 7.14 O ATOM 2633 CB MET A 281 -10.771 -14.878 22.649 1.00 8.08 C ATOM 2634 CG MET A 281 -11.773 -14.262 21.682 1.00 8.33 C ATOM 2635 SD MET A 281 -11.346 -14.438 19.953 1.00 10.26 S ATOM 2636 CE MET A 281 -11.700 -16.138 19.573 1.00 10.21 C ATOM 2637 H MET A 281 -10.249 -12.470 23.522 1.00 0.00 H ATOM 2638 N ARG A 282 -8.966 -15.047 25.349 1.00 6.79 N ATOM 2639 CA ARG A 282 -8.164 -15.850 26.260 1.00 6.34 C ATOM 2640 C ARG A 282 -8.232 -15.429 27.730 1.00 6.72 C ATOM 2641 O ARG A 282 -7.531 -16.014 28.545 1.00 7.14 O ATOM 2642 CB ARG A 282 -6.713 -15.942 25.770 1.00 6.37 C ATOM 2643 CG ARG A 282 -6.638 -16.524 24.352 1.00 6.25 C ATOM 2644 CD ARG A 282 -5.238 -16.565 23.768 1.00 6.20 C ATOM 2645 NE ARG A 282 -4.459 -17.550 24.476 1.00 6.21 N ATOM 2646 CZ ARG A 282 -3.217 -17.848 24.133 1.00 6.82 C ATOM 2647 NH1 ARG A 282 -2.637 -17.229 23.166 1.00 6.46 N ATOM 2648 NH2 ARG A 282 -2.580 -18.792 24.768 1.00 7.96 N ATOM 2649 HE ARG A 282 -4.889 -18.043 25.284 1.00 0.00 H ATOM 2650 HH12 ARG A 282 -1.660 -17.472 22.905 1.00 0.00 H ATOM 2651 HH11 ARG A 282 -3.145 -16.486 22.645 1.00 0.00 H ATOM 2652 HH22 ARG A 282 -1.603 -19.030 24.502 1.00 0.00 H ATOM 2653 HH21 ARG A 282 -3.049 -19.307 25.540 1.00 0.00 H ATOM 2654 H ARG A 282 -8.555 -14.193 24.920 1.00 0.00 H ATOM 2655 N ALA A 283 -9.061 -14.452 28.053 1.00 7.29 N ATOM 2656 CA ALA A 283 -9.105 -13.901 29.423 1.00 7.49 C ATOM 2657 C ALA A 283 -9.780 -14.757 30.518 1.00 8.49 C ATOM 2658 O ALA A 283 -10.777 -15.411 30.249 1.00 9.17 O ATOM 2659 CB ALA A 283 -9.778 -12.596 29.348 1.00 6.95 C ATOM 2660 H ALA A 283 -9.696 -14.063 27.327 1.00 0.00 H ATOM 2661 N GLN A 284 -9.240 -14.690 31.748 1.00 9.07 N ATOM 2662 CA GLN A 284 -10.017 -14.909 32.968 1.00 12.10 C ATOM 2663 C GLN A 284 -10.682 -13.566 33.397 1.00 11.97 C ATOM 2664 O GLN A 284 -10.338 -12.449 32.915 1.00 9.54 O ATOM 2665 CB GLN A 284 -9.106 -15.412 34.052 1.00 12.20 C ATOM 2666 CG GLN A 284 -8.543 -16.806 33.801 1.00 15.20 C ATOM 2667 CD GLN A 284 -9.635 -17.798 33.744 1.00 17.33 C ATOM 2668 OE1 GLN A 284 -10.359 -17.997 34.706 1.00 22.97 O ATOM 2669 NE2 GLN A 284 -9.800 -18.397 32.621 1.00 16.31 N ATOM 2670 HE22 GLN A 284 -9.159 -18.198 31.826 1.00 0.00 H ATOM 2671 HE21 GLN A 284 -10.574 -19.082 32.506 1.00 0.00 H ATOM 2672 H GLN A 284 -8.227 -14.473 31.836 1.00 0.00 H ATOM 2673 N PRO A 285 -11.716 -13.654 34.258 1.00 11.81 N ATOM 2674 CA PRO A 285 -12.437 -12.425 34.533 1.00 12.49 C ATOM 2675 C PRO A 285 -11.572 -11.296 35.100 1.00 11.06 C ATOM 2676 O PRO A 285 -11.839 -10.178 34.775 1.00 13.05 O ATOM 2677 CB PRO A 285 -13.497 -12.881 35.551 1.00 12.37 C ATOM 2678 CG PRO A 285 -13.671 -14.311 35.263 1.00 12.58 C ATOM 2679 CD PRO A 285 -12.369 -14.838 34.848 1.00 12.31 C ATOM 2680 N GLU A 286 -10.527 -11.606 35.859 1.00 11.98 N ATOM 2681 CA GLU A 286 -9.604 -10.580 36.402 1.00 13.57 C ATOM 2682 C GLU A 286 -8.861 -9.826 35.349 1.00 13.07 C ATOM 2683 O GLU A 286 -8.343 -8.775 35.617 1.00 11.46 O ATOM 2684 CB GLU A 286 -8.620 -11.165 37.451 1.00 14.04 C ATOM 2685 CG GLU A 286 -7.717 -12.285 36.992 1.00 14.81 C ATOM 2686 CD GLU A 286 -8.306 -13.673 37.149 1.00 14.96 C ATOM 2687 OE1 GLU A 286 -7.496 -14.608 37.262 1.00 17.02 O ATOM 2688 OE2 GLU A 286 -9.548 -13.886 37.073 1.00 15.67 O ATOM 2689 H GLU A 286 -10.349 -12.606 36.081 1.00 0.00 H ATOM 2690 N HIS A 287 -8.896 -10.330 34.121 1.00 10.79 N ATOM 2691 CA HIS A 287 -8.134 -9.716 33.029 1.00 11.70 C ATOM 2692 C HIS A 287 -8.843 -8.732 32.218 1.00 10.66 C ATOM 2693 O HIS A 287 -8.266 -8.200 31.299 1.00 11.68 O ATOM 2694 CB HIS A 287 -7.543 -10.780 32.108 1.00 10.77 C ATOM 2695 CG HIS A 287 -6.641 -11.707 32.831 1.00 10.88 C ATOM 2696 ND1 HIS A 287 -6.604 -13.055 32.570 1.00 11.33 N ATOM 2697 CD2 HIS A 287 -5.768 -11.485 33.829 1.00 10.42 C ATOM 2698 CE1 HIS A 287 -5.687 -13.606 33.344 1.00 11.31 C ATOM 2699 NE2 HIS A 287 -5.189 -12.685 34.135 1.00 11.41 N ATOM 2700 H HIS A 287 -9.473 -11.174 33.931 1.00 0.00 H ATOM 2701 N ILE A 288 -10.105 -8.428 32.556 1.00 10.38 N ATOM 2702 CA ILE A 288 -10.939 -7.533 31.755 1.00 10.24 C ATOM 2703 C ILE A 288 -11.419 -6.365 32.609 1.00 11.24 C ATOM 2704 O ILE A 288 -12.326 -6.517 33.440 1.00 12.14 O ATOM 2705 CB ILE A 288 -12.230 -8.228 31.238 1.00 10.10 C ATOM 2706 CG1 ILE A 288 -11.933 -9.472 30.387 1.00 9.57 C ATOM 2707 CG2 ILE A 288 -13.088 -7.236 30.455 1.00 10.02 C ATOM 2708 CD1 ILE A 288 -11.063 -9.199 29.216 1.00 9.74 C ATOM 2709 H ILE A 288 -10.506 -8.845 33.421 1.00 0.00 H ATOM 2710 N ILE A 289 -10.826 -5.207 32.419 1.00 11.26 N ATOM 2711 CA ILE A 289 -11.159 -4.030 33.240 1.00 11.40 C ATOM 2712 C ILE A 289 -12.129 -3.254 32.391 1.00 12.11 C ATOM 2713 O ILE A 289 -11.789 -2.802 31.259 1.00 11.87 O ATOM 2714 CB ILE A 289 -9.972 -3.109 33.522 1.00 11.81 C ATOM 2715 CG1 ILE A 289 -8.780 -3.792 34.144 1.00 11.81 C ATOM 2716 CG2 ILE A 289 -10.424 -1.976 34.449 1.00 12.24 C ATOM 2717 CD1 ILE A 289 -9.027 -4.568 35.393 1.00 12.64 C ATOM 2718 H ILE A 289 -10.106 -5.120 31.673 1.00 0.00 H ATOM 2719 N SER A 290 -13.343 -3.027 32.900 1.00 13.99 N ATOM 2720 CA SER A 290 -14.391 -2.360 32.102 1.00 14.20 C ATOM 2721 C SER A 290 -15.413 -1.629 32.971 1.00 17.75 C ATOM 2722 O SER A 290 -15.843 -2.171 33.983 1.00 17.50 O ATOM 2723 CB SER A 290 -15.145 -3.357 31.254 1.00 14.47 C ATOM 2724 OG SER A 290 -16.183 -2.756 30.496 1.00 14.80 O ATOM 2725 HG SER A 290 -16.643 -3.450 29.961 1.00 0.00 H ATOM 2726 H SER A 290 -13.553 -3.325 33.874 1.00 0.00 H ATOM 2727 N GLU A 291 -15.822 -0.439 32.545 1.00 19.64 N ATOM 2728 CA GLU A 291 -16.980 0.269 33.155 1.00 23.25 C ATOM 2729 C GLU A 291 -18.319 -0.311 32.767 1.00 22.16 C ATOM 2730 O GLU A 291 -19.341 0.076 33.356 1.00 22.44 O ATOM 2731 CB GLU A 291 -16.980 1.727 32.744 1.00 24.50 C ATOM 2732 CG GLU A 291 -15.847 2.538 33.285 1.00 26.83 C ATOM 2733 CD GLU A 291 -15.687 3.885 32.559 1.00 34.14 C ATOM 2734 OE1 GLU A 291 -16.430 4.180 31.601 1.00 41.53 O ATOM 2735 OE2 GLU A 291 -14.786 4.670 32.930 1.00 37.49 O ATOM 2736 H GLU A 291 -15.315 0.014 31.758 1.00 0.00 H ATOM 2737 N GLY A 292 -18.319 -1.178 31.764 1.00 18.87 N ATOM 2738 CA GLY A 292 -19.429 -2.024 31.337 1.00 23.14 C ATOM 2739 C GLY A 292 -19.631 -3.263 32.185 1.00 24.17 C ATOM 2740 O GLY A 292 -18.689 -3.772 32.791 1.00 26.28 O ATOM 2741 H GLY A 292 -17.434 -1.264 31.224 1.00 0.00 H ATOM 2742 N ARG A 293 -20.896 -3.666 32.307 1.00 26.29 N ATOM 2743 CA ARG A 293 -21.350 -4.757 33.108 1.00 23.68 C ATOM 2744 C ARG A 293 -21.457 -5.968 32.206 1.00 29.49 C ATOM 2745 O ARG A 293 -22.233 -5.982 31.224 1.00 35.32 O ATOM 2746 CB ARG A 293 -22.722 -4.334 33.681 1.00 21.18 C ATOM 2747 CG ARG A 293 -23.083 -4.941 34.962 1.00 18.95 C ATOM 2748 CD ARG A 293 -24.554 -4.700 35.296 1.00 17.13 C ATOM 2749 NE ARG A 293 -25.136 -5.940 35.764 1.00 13.89 N ATOM 2750 CZ ARG A 293 -26.417 -6.146 36.021 1.00 13.28 C ATOM 2751 NH1 ARG A 293 -27.320 -5.196 35.904 1.00 13.79 N ATOM 2752 NH2 ARG A 293 -26.807 -7.344 36.393 1.00 13.88 N ATOM 2753 HE ARG A 293 -24.489 -6.741 35.911 1.00 0.00 H ATOM 2754 HH12 ARG A 293 -28.318 -5.398 36.116 1.00 0.00 H ATOM 2755 HH11 ARG A 293 -27.036 -4.243 35.600 1.00 0.00 H ATOM 2756 HH22 ARG A 293 -27.810 -7.524 36.599 1.00 0.00 H ATOM 2757 HH21 ARG A 293 -26.112 -8.113 36.481 1.00 0.00 H ATOM 2758 H ARG A 293 -21.615 -3.139 31.772 1.00 0.00 H ATOM 2759 N GLY A 294 -20.707 -7.009 32.479 1.00 27.17 N ATOM 2760 CA GLY A 294 -20.817 -8.193 31.660 1.00 29.16 C ATOM 2761 C GLY A 294 -22.087 -9.011 31.829 1.00 34.70 C ATOM 2762 O GLY A 294 -22.851 -8.811 32.786 1.00 30.87 O ATOM 2763 H GLY A 294 -20.040 -6.982 33.277 1.00 0.00 H ATOM 2764 N LYS A 295 -22.305 -9.950 30.900 1.00 35.54 N ATOM 2765 CA LYS A 295 -23.467 -10.863 30.902 1.00 37.53 C ATOM 2766 C LYS A 295 -23.458 -11.670 32.180 1.00 35.00 C ATOM 2767 O LYS A 295 -24.488 -12.028 32.737 1.00 41.35 O ATOM 2768 CB LYS A 295 -23.393 -11.828 29.681 1.00 41.93 C ATOM 2769 CG LYS A 295 -24.409 -12.969 29.668 1.00 45.94 C ATOM 2770 CD LYS A 295 -25.853 -12.500 29.869 1.00 50.45 C ATOM 2771 CE LYS A 295 -26.830 -13.665 29.688 1.00 52.33 C ATOM 2772 NZ LYS A 295 -28.207 -13.362 30.195 1.00 51.14 N ATOM 2773 HZ1 LYS A 295 -28.161 -13.144 31.211 1.00 0.00 H ATOM 2774 HZ2 LYS A 295 -28.592 -12.544 29.681 1.00 0.00 H ATOM 2775 HZ3 LYS A 295 -28.820 -14.188 30.044 1.00 0.00 H ATOM 2776 H LYS A 295 -21.613 -10.043 30.129 1.00 0.00 H ATOM 2777 N THR A 296 -22.266 -11.919 32.670 1.00 34.92 N ATOM 2778 CA THR A 296 -22.101 -12.673 33.880 1.00 31.04 C ATOM 2779 C THR A 296 -22.368 -11.812 35.129 1.00 25.24 C ATOM 2780 O THR A 296 -22.608 -12.371 36.196 1.00 28.93 O ATOM 2781 CB THR A 296 -20.650 -13.273 33.984 1.00 35.98 C ATOM 2782 OG1 THR A 296 -19.749 -12.332 34.604 1.00 34.54 O ATOM 2783 CG2 THR A 296 -20.088 -13.646 32.619 1.00 37.18 C ATOM 2784 HG1 THR A 296 -18.844 -12.730 34.659 1.00 0.00 H ATOM 2785 H THR A 296 -21.425 -11.563 32.172 1.00 0.00 H ATOM 2786 N GLN A 297 -22.368 -10.484 34.993 1.00 22.39 N ATOM 2787 CA GLN A 297 -22.353 -9.587 36.168 1.00 19.28 C ATOM 2788 C GLN A 297 -23.685 -8.878 36.386 1.00 17.67 C ATOM 2789 O GLN A 297 -24.666 -9.183 35.716 1.00 13.41 O ATOM 2790 CB GLN A 297 -21.236 -8.549 36.023 1.00 18.73 C ATOM 2791 CG GLN A 297 -19.913 -9.178 35.624 1.00 19.29 C ATOM 2792 CD GLN A 297 -18.768 -8.189 35.647 1.00 19.89 C ATOM 2793 OE1 GLN A 297 -18.697 -7.263 34.828 1.00 20.27 O ATOM 2794 NE2 GLN A 297 -17.863 -8.372 36.591 1.00 20.44 N ATOM 2795 HE22 GLN A 297 -17.961 -9.163 37.259 1.00 0.00 H ATOM 2796 HE21 GLN A 297 -17.052 -7.725 36.667 1.00 0.00 H ATOM 2797 H GLN A 297 -22.379 -10.071 34.039 1.00 0.00 H TER 2798 GLN A 297 HETATM 2799 NA NA A 1 -3.267 -9.128 14.919 1.00 6.64 NA HETATM 2800 NA NA A 2 -18.846 -6.629 19.903 1.00 18.80 NA HETATM 2801 O HOH 3 -8.160 11.652 19.148 1.00 22.32 O HETATM 2802 O HOH 4 -3.980 -8.239 8.261 1.00 18.78 O HETATM 2803 O HOH 5 23.310 2.845 11.920 1.00 21.28 O HETATM 2804 O HOH 6 -6.707 -10.761 7.731 1.00 24.04 O HETATM 2805 O HOH 7 -8.963 -15.227 12.117 1.00 16.18 O HETATM 2806 O HOH 8 -10.528 1.401 14.392 1.00 9.90 O HETATM 2807 O HOH 9 4.101 15.595 5.265 1.00 23.15 O HETATM 2808 O HOH 10 -21.918 -8.103 39.413 1.00 19.53 O HETATM 2809 O HOH 11 7.666 -12.815 22.548 1.00 17.06 O HETATM 2810 O HOH 12 -14.780 -6.853 33.882 1.00 18.86 O HETATM 2811 O HOH 13 1.460 7.767 14.452 1.00 10.02 O HETATM 2812 O HOH 14 -1.471 -14.014 -0.143 1.00 21.44 O HETATM 2813 O HOH 15 -16.423 2.395 -0.786 1.00 12.82 O HETATM 2814 O HOH 16 -0.818 -10.241 -6.198 1.00 17.61 O HETATM 2815 O HOH 17 -14.741 6.855 22.414 1.00 18.17 O HETATM 2816 O HOH 18 -11.285 -17.130 28.140 1.00 15.36 O HETATM 2817 O HOH 19 -13.738 -4.945 6.679 1.00 24.67 O HETATM 2818 O HOH 20 -3.554 -13.811 4.243 1.00 21.31 O HETATM 2819 O HOH 21 18.303 3.459 0.647 1.00 16.81 O HETATM 2820 O HOH 22 13.569 6.400 -2.818 1.00 22.91 O HETATM 2821 O HOH 23 -14.014 -5.176 -3.735 1.00 21.43 O HETATM 2822 O HOH 24 10.337 -1.261 24.050 1.00 12.78 O HETATM 2823 O HOH 25 -4.005 -8.388 -3.539 1.00 10.43 O HETATM 2824 O HOH 26 -9.855 3.941 0.385 1.00 9.76 O HETATM 2825 O HOH 27 3.624 -2.172 32.907 1.00 23.33 O HETATM 2826 O HOH 28 -6.994 -7.272 37.276 1.00 18.05 O HETATM 2827 O HOH 29 -11.630 -3.751 -7.668 1.00 19.82 O HETATM 2828 O HOH 30 22.865 5.859 -5.332 1.00 20.00 O HETATM 2829 O HOH 31 3.449 15.906 9.615 1.00 10.53 O HETATM 2830 O HOH 32 -5.940 4.591 -3.574 1.00 10.31 O HETATM 2831 O HOH 33 -8.396 -17.084 37.364 1.00 26.16 O HETATM 2832 O HOH 34 -18.616 -4.980 13.074 1.00 21.75 O HETATM 2833 O HOH 35 -9.247 -18.215 21.886 1.00 15.15 O HETATM 2834 O HOH 36 -2.152 -6.389 -7.662 1.00 9.70 O HETATM 2835 O HOH 37 -0.491 -4.262 31.432 1.00 11.41 O HETATM 2836 O HOH 38 14.931 8.637 9.885 1.00 22.28 O HETATM 2837 O HOH 39 16.664 -6.826 15.962 1.00 21.09 O HETATM 2838 O HOH 40 6.405 -10.410 29.660 1.00 11.57 O HETATM 2839 O HOH 41 15.224 -6.058 12.541 1.00 16.51 O HETATM 2840 O HOH 42 2.413 18.229 12.412 1.00 14.66 O HETATM 2841 O HOH 43 0.772 -14.857 13.521 1.00 6.98 O HETATM 2842 O HOH 44 -2.000 0.941 11.154 1.00 5.56 O HETATM 2843 O HOH 45 8.022 -3.147 16.301 1.00 12.02 O HETATM 2844 O HOH 46 -4.539 0.461 33.525 1.00 24.60 O HETATM 2845 O HOH 47 16.269 -5.839 -6.162 1.00 27.15 O HETATM 2846 O HOH 48 13.706 -6.901 10.492 1.00 8.82 O HETATM 2847 O HOH 49 13.471 -6.946 1.381 1.00 11.61 O HETATM 2848 O HOH 50 -1.184 -16.556 14.027 1.00 9.54 O HETATM 2849 O HOH 51 15.687 -8.305 3.822 1.00 23.79 O HETATM 2850 O HOH 52 1.485 -11.681 35.714 1.00 15.35 O HETATM 2851 O HOH 53 15.620 -2.700 1.242 1.00 23.08 O HETATM 2852 O HOH 54 -9.359 6.289 28.054 1.00 18.65 O HETATM 2853 O HOH 55 6.094 -15.608 24.491 1.00 19.11 O HETATM 2854 O HOH 56 -16.207 -0.801 5.545 1.00 15.90 O HETATM 2855 O HOH 57 -0.277 -19.579 22.580 1.00 16.13 O HETATM 2856 O HOH 58 -8.613 2.541 -1.630 1.00 11.17 O HETATM 2857 O HOH 59 2.655 -10.236 -9.982 1.00 16.94 O HETATM 2858 O HOH 60 -6.220 9.342 3.698 1.00 11.21 O HETATM 2859 O HOH 61 12.791 12.408 17.211 1.00 18.26 O HETATM 2860 O HOH 62 12.490 1.383 8.296 1.00 8.96 O HETATM 2861 O HOH 63 19.148 5.318 -9.625 1.00 31.55 O HETATM 2862 O HOH 64 -4.811 -19.654 20.692 1.00 11.13 O HETATM 2863 O HOH 65 -6.260 -12.642 28.465 1.00 7.38 O HETATM 2864 O HOH 66 14.156 -9.600 9.834 1.00 11.92 O HETATM 2865 O HOH 67 14.439 1.711 23.570 1.00 18.68 O HETATM 2866 O HOH 68 -3.367 -12.968 36.136 1.00 18.66 O HETATM 2867 O HOH 69 -5.640 -3.580 2.748 1.00 11.33 O HETATM 2868 O HOH 70 -20.176 -8.602 20.760 1.00 25.95 O HETATM 2869 O HOH 71 -6.837 21.823 11.563 1.00 23.94 O HETATM 2870 O HOH 72 -9.896 7.864 18.650 1.00 15.59 O HETATM 2871 O HOH 73 -12.198 1.371 10.127 1.00 11.61 O HETATM 2872 O HOH 74 7.930 -1.640 36.605 1.00 14.96 O HETATM 2873 O HOH 75 -17.126 -4.753 28.896 1.00 19.14 O HETATM 2874 O HOH 76 -1.387 -1.189 -10.279 1.00 12.61 O HETATM 2875 O HOH 77 5.808 21.177 17.207 1.00 16.42 O HETATM 2876 O HOH 78 17.406 0.129 -2.299 1.00 24.26 O HETATM 2877 O HOH 79 -17.186 1.518 19.183 1.00 19.37 O HETATM 2878 O HOH 80 0.216 -16.638 21.874 1.00 12.53 O HETATM 2879 O HOH 81 -5.581 -2.565 27.046 1.00 8.47 O HETATM 2880 O HOH 82 -3.605 -6.283 -5.244 1.00 9.87 O HETATM 2881 O HOH 83 -8.334 16.294 -5.960 1.00 27.15 O HETATM 2882 O HOH 84 11.314 12.112 13.364 1.00 22.14 O HETATM 2883 O HOH 85 12.729 -8.560 3.542 1.00 11.97 O HETATM 2884 O HOH 86 -0.034 -8.106 -8.282 1.00 14.39 O HETATM 2885 O HOH 87 12.754 -1.335 24.950 1.00 23.42 O HETATM 2886 O HOH 88 -1.502 -8.822 8.993 1.00 14.57 O HETATM 2887 O HOH 89 18.992 -0.221 -4.163 1.00 19.29 O HETATM 2888 O HOH 90 -14.457 -9.363 34.563 1.00 19.40 O HETATM 2889 O HOH 91 7.752 -19.229 6.258 1.00 13.84 O HETATM 2890 O HOH 92 8.122 17.708 23.669 1.00 28.54 O HETATM 2891 O HOH 93 9.963 -2.480 -7.143 1.00 18.72 O HETATM 2892 O HOH 94 -8.363 1.212 17.186 1.00 11.44 O HETATM 2893 O HOH 95 -0.329 -13.989 21.122 1.00 6.85 O HETATM 2894 O HOH 96 -5.572 -4.161 23.317 1.00 5.78 O HETATM 2895 O HOH 97 10.223 -7.253 -11.072 1.00 28.90 O HETATM 2896 O HOH 98 -9.952 8.582 0.458 1.00 19.02 O HETATM 2897 O HOH 99 0.665 -11.823 19.562 1.00 6.59 O HETATM 2898 O HOH 100 -23.014 -2.403 31.033 1.00 25.17 O HETATM 2899 O HOH 101 15.163 -13.266 12.500 1.00 23.36 O HETATM 2900 O HOH 102 10.998 3.730 8.030 1.00 5.79 O HETATM 2901 O HOH 103 4.428 2.228 -7.665 1.00 10.70 O HETATM 2902 O HOH 104 14.622 -9.209 -3.075 1.00 23.39 O HETATM 2903 O HOH 105 -13.239 -2.393 2.446 1.00 17.92 O HETATM 2904 O HOH 106 7.555 -3.427 -9.477 1.00 12.73 O HETATM 2905 O HOH 107 -5.457 -13.484 11.327 1.00 7.74 O HETATM 2906 O HOH 108 3.625 13.843 -9.944 1.00 21.98 O HETATM 2907 O HOH 109 9.309 -0.399 15.268 1.00 11.57 O HETATM 2908 O HOH 110 -6.231 13.093 14.454 1.00 15.23 O HETATM 2909 O HOH 111 -11.810 6.170 -4.790 1.00 20.13 O HETATM 2910 O HOH 112 1.063 -15.162 -0.130 1.00 12.02 O HETATM 2911 O HOH 113 8.251 9.826 27.597 1.00 17.41 O HETATM 2912 O HOH 114 -0.971 -17.462 27.648 1.00 7.27 O HETATM 2913 O HOH 115 -22.874 1.617 10.085 1.00 14.36 O HETATM 2914 O HOH 116 -2.065 -16.418 19.048 1.00 11.90 O HETATM 2915 O HOH 117 -19.022 -3.416 5.030 1.00 15.51 O HETATM 2916 O HOH 118 -11.738 2.615 -12.650 1.00 23.23 O HETATM 2917 O HOH 119 -6.670 -9.977 16.848 1.00 5.59 O HETATM 2918 O HOH 120 -5.143 5.398 30.087 1.00 13.33 O HETATM 2919 O HOH 121 -0.458 12.883 1.387 1.00 11.67 O HETATM 2920 O HOH 122 2.019 -13.002 15.149 1.00 7.16 O HETATM 2921 O HOH 123 -0.723 -19.584 7.902 1.00 21.55 O HETATM 2922 O HOH 124 2.474 -15.967 30.777 1.00 12.07 O HETATM 2923 O HOH 125 -11.823 -13.271 15.403 1.00 18.50 O HETATM 2924 O HOH 126 2.249 15.066 2.985 1.00 12.59 O HETATM 2925 O HOH 127 7.261 -1.088 32.680 1.00 22.02 O HETATM 2926 O HOH 128 4.371 -15.084 11.769 1.00 17.86 O HETATM 2927 O HOH 129 -17.942 -10.424 38.560 1.00 18.86 O HETATM 2928 O HOH 130 6.398 13.736 12.542 1.00 13.45 O HETATM 2929 O HOH 131 0.861 -6.484 30.254 1.00 9.15 O HETATM 2930 O HOH 132 -5.501 -15.214 30.379 1.00 10.34 O HETATM 2931 O HOH 133 -8.841 5.031 -3.241 1.00 12.11 O HETATM 2932 O HOH 134 9.416 -8.612 21.668 1.00 24.89 O HETATM 2933 O HOH 135 11.939 -3.020 32.226 1.00 20.45 O HETATM 2934 O HOH 136 13.464 -0.702 11.036 1.00 13.35 O HETATM 2935 O HOH 137 8.954 2.054 17.313 1.00 8.80 O HETATM 2936 O HOH 138 -1.058 10.752 8.152 1.00 13.99 O HETATM 2937 O HOH 139 1.496 -4.480 33.422 1.00 17.35 O HETATM 2938 O HOH 140 11.441 -15.578 2.015 1.00 11.44 O HETATM 2939 O HOH 141 -4.827 3.642 32.330 1.00 22.31 O HETATM 2940 O HOH 142 -9.732 -20.539 9.858 1.00 22.30 O HETATM 2941 O HOH 143 12.420 -7.217 30.881 1.00 25.46 O HETATM 2942 O HOH 144 -5.592 -1.951 35.709 1.00 18.21 O HETATM 2943 O HOH 145 -8.497 -2.212 -14.686 1.00 14.17 O HETATM 2944 O HOH 146 1.837 -20.851 4.715 1.00 18.61 O HETATM 2945 O HOH 147 -13.429 -6.122 18.178 1.00 15.15 O HETATM 2946 O HOH 148 -8.161 -18.296 30.242 1.00 12.58 O HETATM 2947 O HOH 149 -0.467 1.717 34.548 1.00 23.81 O HETATM 2948 O HOH 150 0.752 -17.247 6.966 1.00 17.52 O HETATM 2949 O HOH 151 4.673 -4.001 -15.133 1.00 15.90 O HETATM 2950 O HOH 152 -14.639 -2.818 4.750 1.00 29.50 O HETATM 2951 O HOH 153 2.520 18.946 15.329 1.00 20.58 O HETATM 2952 O HOH 154 4.257 -17.554 23.688 1.00 32.47 O HETATM 2953 O HOH 155 10.786 -5.369 29.074 1.00 22.29 O HETATM 2954 O HOH 156 16.013 -3.599 3.986 1.00 17.49 O HETATM 2955 O HOH 157 7.878 -16.927 9.506 1.00 16.75 O HETATM 2956 O HOH 158 11.951 8.595 10.284 1.00 16.49 O HETATM 2957 O HOH 159 -3.986 19.556 15.323 1.00 25.67 O HETATM 2958 O HOH 160 13.911 -9.228 -0.437 1.00 17.78 O HETATM 2959 O HOH 161 -19.127 -5.151 21.690 1.00 14.17 O HETATM 2960 O HOH 162 -17.514 -2.775 12.071 1.00 14.96 O HETATM 2961 O HOH 163 16.798 -7.006 8.637 1.00 16.18 O HETATM 2962 O HOH 164 -11.660 -3.339 4.246 1.00 13.31 O HETATM 2963 O HOH 165 -6.446 -6.753 -9.298 1.00 17.00 O HETATM 2964 O HOH 166 -7.607 2.602 5.757 1.00 15.99 O HETATM 2965 O HOH 167 16.072 7.547 4.889 1.00 18.42 O HETATM 2966 O HOH 168 -17.971 -10.211 13.997 1.00 15.94 O HETATM 2967 O HOH 169 -10.451 2.959 17.691 1.00 12.04 O HETATM 2968 O HOH 170 -6.894 14.948 -7.559 1.00 21.87 O HETATM 2969 O HOH 171 -10.741 8.297 21.615 1.00 18.68 O HETATM 2970 O HOH 172 1.958 -1.525 -9.311 1.00 20.34 O HETATM 2971 O HOH 173 10.879 4.682 -9.256 1.00 23.37 O HETATM 2972 O HOH 174 -13.273 2.473 16.951 1.00 14.88 O HETATM 2973 O HOH 175 8.262 -10.326 27.563 1.00 17.13 O HETATM 2974 O HOH 176 13.382 0.805 26.837 1.00 18.51 O HETATM 2975 O HOH 177 -0.752 -8.323 -11.069 1.00 9.20 O HETATM 2976 O HOH 178 13.180 -8.900 -8.872 1.00 17.31 O HETATM 2977 O HOH 179 -11.478 -4.269 -0.079 1.00 17.56 O HETATM 2978 O HOH 180 -9.968 -8.816 -12.228 1.00 14.82 O HETATM 2979 O HOH 181 15.922 -6.215 2.636 1.00 19.88 O HETATM 2980 O HOH 182 13.306 15.734 23.617 1.00 20.65 O HETATM 2981 O HOH 183 3.685 17.884 0.684 1.00 17.08 O HETATM 2982 O HOH 184 -7.598 -4.427 -7.688 1.00 9.39 O HETATM 2983 O HOH 185 26.270 3.989 8.987 1.00 22.03 O HETATM 2984 O HOH 186 10.448 10.587 8.665 1.00 15.31 O HETATM 2985 O HOH 187 -17.416 -3.786 -6.769 1.00 27.33 O HETATM 2986 O HOH 188 -11.887 6.113 7.355 1.00 17.41 O HETATM 2987 O HOH 189 2.286 -19.981 9.880 1.00 17.54 O HETATM 2988 O HOH 190 -4.142 -8.039 -8.631 1.00 23.09 O HETATM 2989 O HOH 191 3.730 -13.012 36.375 1.00 25.43 O HETATM 2990 O HOH 192 -10.334 6.615 -1.556 1.00 22.22 O HETATM 2991 O HOH 193 -7.516 6.094 30.207 1.00 30.95 O HETATM 2992 O HOH 194 -20.667 -6.660 18.595 1.00 24.81 O HETATM 2993 O HOH 195 -1.692 -18.957 20.220 1.00 11.44 O HETATM 2994 O HOH 196 -6.333 -19.156 32.282 1.00 15.91 O HETATM 2995 O HOH 197 4.087 21.310 15.314 1.00 20.57 O HETATM 2996 O HOH 198 -6.254 -20.698 6.498 1.00 17.33 O HETATM 2997 O HOH 199 14.081 -16.196 2.093 1.00 23.91 O HETATM 2998 O HOH 200 -13.146 -4.650 -6.110 1.00 29.17 O HETATM 2999 O HOH 201 -7.169 3.212 33.234 1.00 28.65 O HETATM 3000 O HOH 202 -16.359 1.736 -3.470 1.00 21.56 O HETATM 3001 O HOH 203 -2.540 -6.257 37.456 1.00 25.04 O HETATM 3002 O HOH 204 2.589 -16.850 13.240 1.00 19.33 O HETATM 3003 O HOH 205 -4.572 -8.237 36.527 1.00 19.42 O HETATM 3004 O HOH 206 15.779 -10.912 11.466 1.00 23.48 O HETATM 3005 O HOH 207 5.146 -22.817 8.246 1.00 21.00 O HETATM 3006 O HOH 208 6.006 15.301 10.427 1.00 16.06 O HETATM 3007 O HOH 209 -13.564 -13.044 17.436 1.00 31.32 O HETATM 3008 O HOH 210 7.006 17.469 12.065 1.00 22.24 O HETATM 3009 O HOH 211 17.755 -6.607 11.339 1.00 16.69 O HETATM 3010 O HOH 212 0.687 -22.035 8.992 1.00 9.62 O HETATM 3011 O HOH 213 1.833 -15.930 33.588 1.00 24.08 O HETATM 3012 O HOH 214 -4.950 -16.848 32.593 1.00 13.39 O HETATM 3013 O HOH 215 5.136 -16.868 30.856 1.00 24.40 O HETATM 3014 O HOH 216 2.779 1.776 31.980 1.00 14.01 O HETATM 3015 O HOH 217 -15.258 -10.939 32.342 1.00 30.60 O HETATM 3016 O HOH 218 12.290 -6.310 -9.600 1.00 19.66 O HETATM 3017 O HOH 219 -4.936 -17.875 3.696 1.00 21.74 O HETATM 3018 O HOH 220 16.168 -9.650 8.128 1.00 17.04 O HETATM 3019 O HOH 221 12.375 17.181 16.839 1.00 21.91 O HETATM 3020 O HOH 222 4.558 18.473 8.905 1.00 24.51 O HETATM 3021 O HOH 223 2.372 19.280 4.965 1.00 25.94 O HETATM 3022 O HOH 224 13.200 15.051 16.362 1.00 19.13 O HETATM 3023 O HOH 225 1.803 -13.713 17.780 1.00 10.07 O HETATM 3024 O HOH 226 20.216 -0.227 13.954 1.00 16.53 O HETATM 3025 O HOH 227 0.262 -16.035 18.158 1.00 16.22 O HETATM 3026 O HOH 228 4.532 -13.832 14.280 1.00 14.46 O HETATM 3027 O HOH 229 4.172 -15.147 18.290 1.00 21.09 O HETATM 3028 O1 UNN A 230 -12.951 -5.747 14.689 1.00 -0.38 O HETATM 3029 C2 UNN A 230 -12.036 -6.457 14.222 1.00 0.14 C HETATM 3030 C3 UNN A 230 -10.733 -6.581 14.966 1.00 0.09 C HETATM 3031 S UNN A 230 -10.683 -5.389 16.250 1.00 0.00 S HETATM 3032 C4 UNN A 230 -10.147 -3.967 15.428 1.00 0.21 C HETATM 3033 N1 UNN A 230 -10.268 -2.750 15.969 1.00 -0.26 N HETATM 3034 C7 UNN A 230 -9.876 -1.646 15.373 1.00 0.11 C HETATM 3035 O UNN A 230 -10.093 -0.516 15.894 1.00 -0.44 O HETATM 3036 C6 UNN A 230 -9.289 -1.760 14.133 1.00 -0.01 C HETATM 3037 C5 UNN A 230 -9.142 -2.998 13.598 1.00 0.07 C HETATM 3038 N UNN A 230 -9.553 -4.107 14.230 1.00 -0.21 N HETATM 3039 H4 UNN A 230 -9.418 -5.038 13.810 1.00 0.25 H HETATM 3040 C8 UNN A 230 -8.422 -3.124 12.300 1.00 0.01 C HETATM 3041 H5 UNN A 230 -8.161 -2.123 11.927 1.00 0.05 H HETATM 3042 H6 UNN A 230 -9.069 -3.631 11.569 1.00 0.05 H HETATM 3043 H7 UNN A 230 -7.504 -3.712 12.446 1.00 0.05 H HETATM 3044 H3 UNN A 230 -8.950 -0.876 13.594 1.00 0.02 H HETATM 3045 H1 UNN A 230 -9.896 -6.410 14.273 1.00 0.06 H HETATM 3046 H2 UNN A 230 -10.651 -7.590 15.398 1.00 0.06 H HETATM 3047 C1 UNN A 230 -12.221 -7.124 12.895 1.00 0.04 C HETATM 3048 C11 UNN A 230 -11.119 -7.510 12.139 1.00 -0.04 C HETATM 3049 C12 UNN A 230 -11.238 -8.205 10.939 1.00 -0.05 C HETATM 3050 C10 UNN A 230 -12.485 -8.477 10.388 1.00 -0.05 C HETATM 3051 C9 UNN A 230 -13.653 -8.160 11.065 1.00 -0.01 C HETATM 3052 C16 UNN A 230 -14.885 -8.487 10.505 1.00 -0.05 C HETATM 3053 C15 UNN A 230 -16.011 -8.155 11.254 1.00 -0.06 C HETATM 3054 C14 UNN A 230 -15.980 -7.451 12.445 1.00 -0.06 C HETATM 3055 C13 UNN A 230 -14.780 -7.138 13.059 1.00 -0.05 C HETATM 3056 C UNN A 230 -13.592 -7.440 12.373 1.00 -0.00 C HETATM 3057 H14 UNN A 230 -14.758 -6.674 14.039 1.00 0.06 H HETATM 3058 H13 UNN A 230 -16.911 -7.140 12.905 1.00 0.06 H HETATM 3059 H12 UNN A 230 -16.978 -8.470 10.878 1.00 0.06 H HETATM 3060 H11 UNN A 230 -14.963 -8.973 9.539 1.00 0.06 H HETATM 3061 H10 UNN A 230 -12.545 -8.945 9.412 1.00 0.07 H HETATM 3062 H9 UNN A 230 -10.344 -8.540 10.426 1.00 0.06 H HETATM 3063 H8 UNN A 230 -10.128 -7.259 12.499 1.00 0.07 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 685 684 2799 CONECT 694 693 2799 CONECT 1843 1842 2800 CONECT 1860 1859 2800 CONECT 2344 2345 2348 2349 2350 CONECT 2348 2344 CONECT 2349 2344 CONECT 2350 2344 CONECT 2354 2353 2799 CONECT 2546 2545 2799 CONECT 2799 685 694 2354 2546 CONECT 2800 1843 1860 CONECT 3028 3029 CONECT 3029 3028 3030 3047 CONECT 3030 3029 3031 3045 3046 CONECT 3031 3030 3032 CONECT 3032 3031 3033 3038 CONECT 3033 3032 3034 CONECT 3034 3033 3035 3036 CONECT 3035 3034 CONECT 3036 3034 3037 3044 CONECT 3037 3036 3038 3040 CONECT 3038 3032 3037 3039 CONECT 3039 3038 CONECT 3040 3037 3041 3042 3043 CONECT 3041 3040 CONECT 3042 3040 CONECT 3043 3040 CONECT 3044 3036 CONECT 3045 3030 CONECT 3046 3030 CONECT 3047 3029 3048 3056 CONECT 3048 3047 3049 3063 CONECT 3049 3048 3050 3062 CONECT 3050 3049 3051 3061 CONECT 3051 3050 3052 3056 CONECT 3052 3051 3053 3060 CONECT 3053 3052 3054 3059 CONECT 3054 3053 3055 3058 CONECT 3055 3054 3056 3057 CONECT 3056 3047 3051 3055 CONECT 3057 3055 CONECT 3058 3054 CONECT 3059 3053 CONECT 3060 3052 CONECT 3061 3050 CONECT 3062 3049 CONECT 3063 3048 MASTER 0 0 0 0 0 0 0 0 3061 2 52 23 END
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Structure:
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Related entries of code: 5wqk
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5wqj
RCSB PDB
PDBbind
297aa, >5WQJ_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5wqk
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
3-Mercaptopyruvate Sulfurtransferase
Ligand Name
7NC
EC.Number
E.C.-.-.-.-
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Kd=0.5uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Sci Rep Vol. 7: pp. 40227-40227
Ligand Properties
Formula
C
1
7
H
1
4
N
2
O
2
S
Molecular Weight
310.370
Exact Mass
310.078
No. of atoms
36
No. of bonds
38
Polar Surface Area
88.12
LOGP Value
3.25 (
Computed with XLOGP3
)
3.21 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
O=c1cc(C)[nH]c(n1)SCC(=O)c1cccc2c1cccc2
InChI String
InChI=1S/C17H14N2O2S/c1-11-9-16(21)19-17(18-11)22-10-15(20)14-8-4-6-12-5-2-3-7-13(12)14/h2-9H,10H2,1H3,(H,18,19,21)
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):
Q99J99
Entrez Gene ID
NCBI Entrez Gene ID:
246221
ASD
Information of known allosteric effects of PDB entries
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