Browse entries in the PDBbind-CN Database
HEADER 5YJF_COMPLEX COMPND 5YJF_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 256 PHE THR SER LYS ASP THR TYR LEU SER HIS PHE ASN PRO SEQRES 2 A 256 ARG ASP TYR LEU GLU LYS TYR TYR LYS PHE GLY SER ARG SEQRES 3 A 256 HIS SER ALA GLU SER GLN ILE LEU LYS HIS LEU LEU LYS SEQRES 4 A 256 ASN LEU PHE LYS ILE PHE CYS LEU ASP GLY VAL LYS GLY SEQRES 5 A 256 ASP LEU LEU ILE ASP ILE GLY SER GLY PRO THR ILE TYR SEQRES 6 A 256 GLN LEU LEU SER ALA CYS GLU SER PHE LYS GLU ILE VAL SEQRES 7 A 256 VAL THR ASP TYR SER ASP GLN ASN LEU GLN GLU LEU GLU SEQRES 8 A 256 LYS TRP LEU LYS ALA ALA PRO ALA ALA PHE ASP TRP SER SEQRES 9 A 256 PRO VAL VAL THR TYR VAL CYS ASP LEU GLU GLY ASN ARG SEQRES 10 A 256 VAL LYS GLY PRO GLU LYS GLU GLU LYS LEU ARG GLN ALA SEQRES 11 A 256 VAL LYS GLN VAL LEU LYS CYS ASP VAL THR GLN SER GLN SEQRES 12 A 256 PRO LEU GLY ALA VAL PRO LEU PRO PRO ALA ASP CYS VAL SEQRES 13 A 256 LEU SER THR LEU CYS LEU ASP ALA ALA CYS PRO ASP LEU SEQRES 14 A 256 PRO THR TYR CYS ARG ALA LEU ARG ASN LEU GLY SER LEU SEQRES 15 A 256 LEU LYS PRO GLY GLY PHE LEU VAL ILE MET ASP ALA LEU SEQRES 16 A 256 LYS SER SER TYR TYR MET ILE GLY GLU GLN LYS PHE SER SEQRES 17 A 256 SER LEU PRO LEU GLY ARG GLU ALA VAL GLU ALA ALA VAL SEQRES 18 A 256 LYS GLU ALA GLY TYR THR ILE GLU TRP PHE GLU VAL ILE SEQRES 19 A 256 SER GLN SER TYR SER SER THR MET ALA ASN ASN GLU GLY SEQRES 20 A 256 LEU PHE SER LEU VAL ALA ARG LYS LEU HET UNN A 283 23 ATOM 1 N PHE A 5 -9.404 -19.137 1.572 1.00 38.42 N ATOM 2 CA PHE A 5 -8.614 -17.863 1.677 1.00 36.58 C ATOM 3 C PHE A 5 -9.176 -16.797 0.753 1.00 36.41 C ATOM 4 O PHE A 5 -9.424 -17.046 -0.428 1.00 37.45 O ATOM 5 CB PHE A 5 -7.125 -18.091 1.361 1.00 35.67 C ATOM 6 CG PHE A 5 -6.204 -17.014 1.892 1.00 33.51 C ATOM 7 CD1 PHE A 5 -5.441 -17.236 3.040 1.00 31.73 C ATOM 8 CD2 PHE A 5 -6.076 -15.783 1.235 1.00 32.59 C ATOM 9 CE1 PHE A 5 -4.580 -16.250 3.530 1.00 29.80 C ATOM 10 CE2 PHE A 5 -5.206 -14.785 1.726 1.00 29.97 C ATOM 11 CZ PHE A 5 -4.463 -15.021 2.869 1.00 29.24 C ATOM 12 HN3 PHE A 5 -9.365 -19.488 0.594 1.00 0.00 H ATOM 13 HN2 PHE A 5 -10.393 -18.953 1.836 1.00 0.00 H ATOM 14 HN1 PHE A 5 -8.999 -19.848 2.213 1.00 0.00 H ATOM 15 N THR A 6 -9.367 -15.609 1.318 1.00 35.45 N ATOM 16 CA THR A 6 -9.837 -14.426 0.608 1.00 35.06 C ATOM 17 C THR A 6 -9.135 -14.221 -0.734 1.00 35.30 C ATOM 18 O THR A 6 -7.961 -13.833 -0.798 1.00 34.55 O ATOM 19 CB THR A 6 -9.613 -13.199 1.477 1.00 33.29 C ATOM 20 OG1 THR A 6 -10.099 -13.465 2.797 1.00 33.43 O ATOM 21 CG2 THR A 6 -10.329 -12.011 0.906 1.00 33.52 C ATOM 22 HG1 THR A 6 -9.611 -14.237 3.178 1.00 0.00 H ATOM 23 H THR A 6 -9.168 -15.518 2.335 1.00 0.00 H ATOM 24 N SER A 7 -9.869 -14.483 -1.805 1.00 36.95 N ATOM 25 CA SER A 7 -9.342 -14.360 -3.154 1.00 37.56 C ATOM 26 C SER A 7 -9.194 -12.897 -3.576 1.00 36.67 C ATOM 27 O SER A 7 -9.660 -11.979 -2.883 1.00 35.90 O ATOM 28 CB SER A 7 -10.229 -15.122 -4.137 1.00 39.68 C ATOM 29 OG SER A 7 -11.581 -14.718 -4.012 1.00 40.79 O ATOM 30 HG SER A 7 -12.136 -15.224 -4.657 1.00 0.00 H ATOM 31 H SER A 7 -10.855 -14.787 -1.676 1.00 0.00 H ATOM 32 N LYS A 8 -8.524 -12.696 -4.709 1.00 36.99 N ATOM 33 CA LYS A 8 -8.296 -11.369 -5.275 1.00 36.09 C ATOM 34 C LYS A 8 -9.614 -10.612 -5.422 1.00 36.32 C ATOM 35 O LYS A 8 -9.749 -9.502 -4.931 1.00 35.51 O ATOM 36 CB LYS A 8 -7.625 -11.489 -6.647 1.00 36.93 C ATOM 37 CG LYS A 8 -6.275 -12.189 -6.651 1.00 36.86 C ATOM 38 CD LYS A 8 -5.671 -12.154 -8.041 1.00 38.38 C ATOM 39 CE LYS A 8 -4.230 -12.616 -8.033 1.00 38.51 C ATOM 40 NZ LYS A 8 -3.704 -12.695 -9.420 1.00 39.41 N ATOM 41 HZ1 LYS A 8 -4.274 -13.371 -9.968 1.00 0.00 H ATOM 42 HZ2 LYS A 8 -3.757 -11.756 -9.863 1.00 0.00 H ATOM 43 HZ3 LYS A 8 -2.714 -13.013 -9.396 1.00 0.00 H ATOM 44 H LYS A 8 -8.145 -13.522 -5.214 1.00 0.00 H ATOM 45 N ASP A 9 -10.580 -11.241 -6.083 1.00 37.70 N ATOM 46 CA ASP A 9 -11.900 -10.659 -6.352 1.00 38.12 C ATOM 47 C ASP A 9 -12.735 -10.264 -5.125 1.00 37.06 C ATOM 48 O ASP A 9 -13.555 -9.351 -5.222 1.00 37.07 O ATOM 49 CB ASP A 9 -12.710 -11.586 -7.268 1.00 40.71 C ATOM 50 CG ASP A 9 -12.387 -13.056 -7.052 1.00 42.78 C ATOM 51 OD1 ASP A 9 -13.235 -13.764 -6.477 1.00 45.59 O ATOM 52 OD2 ASP A 9 -11.285 -13.508 -7.451 1.00 44.43 O ATOM 53 H ASP A 9 -10.389 -12.203 -6.430 1.00 0.00 H ATOM 54 N THR A 10 -12.530 -10.936 -3.987 1.00 35.85 N ATOM 55 CA THR A 10 -13.169 -10.542 -2.721 1.00 34.45 C ATOM 56 C THR A 10 -12.720 -9.141 -2.299 1.00 32.23 C ATOM 57 O THR A 10 -13.443 -8.430 -1.608 1.00 31.65 O ATOM 58 CB THR A 10 -12.894 -11.557 -1.576 1.00 34.42 C ATOM 59 OG1 THR A 10 -13.341 -12.861 -1.966 1.00 36.98 O ATOM 60 CG2 THR A 10 -13.629 -11.164 -0.300 1.00 33.41 C ATOM 61 HG1 THR A 10 -12.855 -13.145 -2.780 1.00 0.00 H ATOM 62 H THR A 10 -11.899 -11.763 -3.997 1.00 0.00 H ATOM 63 N TYR A 11 -11.523 -8.755 -2.724 1.00 31.00 N ATOM 64 CA TYR A 11 -11.015 -7.401 -2.492 1.00 29.33 C ATOM 65 C TYR A 11 -11.693 -6.400 -3.411 1.00 29.90 C ATOM 66 O TYR A 11 -11.993 -5.284 -2.999 1.00 29.44 O ATOM 67 CB TYR A 11 -9.489 -7.351 -2.634 1.00 27.96 C ATOM 68 CG TYR A 11 -8.783 -7.815 -1.378 1.00 27.00 C ATOM 69 CD1 TYR A 11 -8.470 -9.166 -1.178 1.00 26.60 C ATOM 70 CD2 TYR A 11 -8.469 -6.910 -0.366 1.00 24.95 C ATOM 71 CE1 TYR A 11 -7.836 -9.590 -0.009 1.00 25.03 C ATOM 72 CE2 TYR A 11 -7.836 -7.326 0.804 1.00 23.99 C ATOM 73 CZ TYR A 11 -7.528 -8.662 0.976 1.00 24.59 C ATOM 74 OH TYR A 11 -6.907 -9.053 2.140 1.00 25.14 O ATOM 75 HH TYR A 11 -7.483 -8.826 2.912 1.00 0.00 H ATOM 76 H TYR A 11 -10.927 -9.435 -3.238 1.00 0.00 H ATOM 77 N LEU A 12 -11.958 -6.819 -4.646 1.00 31.15 N ATOM 78 CA LEU A 12 -12.636 -5.973 -5.628 1.00 32.01 C ATOM 79 C LEU A 12 -14.081 -5.656 -5.224 1.00 33.05 C ATOM 80 O LEU A 12 -14.557 -4.530 -5.397 1.00 32.86 O ATOM 81 CB LEU A 12 -12.609 -6.635 -7.013 1.00 33.16 C ATOM 82 CG LEU A 12 -11.247 -6.844 -7.686 1.00 32.66 C ATOM 83 CD1 LEU A 12 -11.408 -7.652 -8.962 1.00 33.99 C ATOM 84 CD2 LEU A 12 -10.522 -5.516 -7.953 1.00 30.75 C ATOM 85 H LEU A 12 -11.673 -7.780 -4.922 1.00 0.00 H ATOM 86 N SER A 13 -14.762 -6.651 -4.667 1.00 33.92 N ATOM 87 CA SER A 13 -16.184 -6.539 -4.428 1.00 35.50 C ATOM 88 C SER A 13 -16.587 -6.396 -2.965 1.00 35.14 C ATOM 89 O SER A 13 -17.760 -6.188 -2.698 1.00 36.68 O ATOM 90 CB SER A 13 -16.912 -7.732 -5.047 1.00 37.51 C ATOM 91 OG SER A 13 -16.483 -8.940 -4.448 1.00 37.94 O ATOM 92 HG SER A 13 -15.509 -9.049 -4.588 1.00 0.00 H ATOM 93 H SER A 13 -14.265 -7.524 -4.399 1.00 0.00 H ATOM 94 N HIS A 14 -15.645 -6.505 -2.024 1.00 33.69 N ATOM 95 CA HIS A 14 -15.995 -6.445 -0.590 1.00 33.14 C ATOM 96 C HIS A 14 -15.088 -5.624 0.324 1.00 31.31 C ATOM 97 O HIS A 14 -15.431 -5.393 1.486 1.00 31.62 O ATOM 98 CB HIS A 14 -16.162 -7.846 -0.016 1.00 33.86 C ATOM 99 CG HIS A 14 -17.373 -8.549 -0.533 1.00 36.98 C ATOM 100 ND1 HIS A 14 -18.641 -8.286 -0.060 1.00 38.60 N ATOM 101 CD2 HIS A 14 -17.516 -9.485 -1.499 1.00 38.67 C ATOM 102 CE1 HIS A 14 -19.511 -9.038 -0.709 1.00 40.65 C ATOM 103 NE2 HIS A 14 -18.855 -9.771 -1.589 1.00 40.47 N ATOM 104 H HIS A 14 -14.652 -6.634 -2.305 1.00 0.00 H ATOM 105 N PHE A 15 -13.944 -5.182 -0.178 1.00 29.61 N ATOM 106 CA PHE A 15 -13.119 -4.268 0.577 1.00 27.83 C ATOM 107 C PHE A 15 -13.683 -2.856 0.415 1.00 28.16 C ATOM 108 O PHE A 15 -13.534 -2.237 -0.647 1.00 28.06 O ATOM 109 CB PHE A 15 -11.675 -4.331 0.091 1.00 26.71 C ATOM 110 CG PHE A 15 -10.691 -3.654 1.009 1.00 25.53 C ATOM 111 CD1 PHE A 15 -9.940 -4.399 1.903 1.00 23.88 C ATOM 112 CD2 PHE A 15 -10.513 -2.274 0.975 1.00 24.73 C ATOM 113 CE1 PHE A 15 -9.029 -3.786 2.744 1.00 23.70 C ATOM 114 CE2 PHE A 15 -9.609 -1.654 1.824 1.00 24.29 C ATOM 115 CZ PHE A 15 -8.862 -2.410 2.707 1.00 23.86 C ATOM 116 H PHE A 15 -13.638 -5.495 -1.121 1.00 0.00 H ATOM 117 N ASN A 16 -14.346 -2.357 1.458 1.00 28.32 N ATOM 118 CA ASN A 16 -14.853 -0.980 1.457 1.00 28.77 C ATOM 119 C ASN A 16 -13.799 -0.030 2.040 1.00 27.62 C ATOM 120 O ASN A 16 -13.544 -0.054 3.249 1.00 27.24 O ATOM 121 CB ASN A 16 -16.186 -0.881 2.219 1.00 29.86 C ATOM 122 CG ASN A 16 -16.825 0.508 2.130 1.00 30.77 C ATOM 123 OD1 ASN A 16 -16.165 1.540 2.322 1.00 31.29 O ATOM 124 ND2 ASN A 16 -18.124 0.533 1.861 1.00 31.57 N ATOM 125 HD22 ASN A 16 -18.640 -0.356 1.706 1.00 0.00 H ATOM 126 HD21 ASN A 16 -18.626 1.442 1.805 1.00 0.00 H ATOM 127 H ASN A 16 -14.508 -2.957 2.292 1.00 0.00 H ATOM 128 N PRO A 17 -13.179 0.803 1.178 1.00 27.33 N ATOM 129 CA PRO A 17 -12.061 1.672 1.560 1.00 26.26 C ATOM 130 C PRO A 17 -12.380 2.571 2.740 1.00 26.45 C ATOM 131 O PRO A 17 -11.569 2.683 3.661 1.00 24.97 O ATOM 132 CB PRO A 17 -11.843 2.528 0.320 1.00 26.26 C ATOM 133 CG PRO A 17 -12.396 1.751 -0.774 1.00 27.17 C ATOM 134 CD PRO A 17 -13.524 0.958 -0.243 1.00 27.88 C ATOM 135 N ARG A 18 -13.562 3.186 2.707 1.00 28.22 N ATOM 136 CA ARG A 18 -13.965 4.171 3.708 1.00 29.47 C ATOM 137 C ARG A 18 -14.055 3.531 5.088 1.00 29.38 C ATOM 138 O ARG A 18 -13.390 3.967 6.028 1.00 29.09 O ATOM 139 CB ARG A 18 -15.287 4.838 3.313 1.00 30.99 C ATOM 140 CG ARG A 18 -15.847 5.803 4.356 1.00 34.06 C ATOM 141 CD ARG A 18 -14.991 7.057 4.493 1.00 38.95 C ATOM 142 NE ARG A 18 -15.055 7.909 3.300 1.00 43.19 N ATOM 143 CZ ARG A 18 -14.393 9.058 3.146 1.00 44.22 C ATOM 144 NH1 ARG A 18 -13.601 9.513 4.116 1.00 44.47 N ATOM 145 NH2 ARG A 18 -14.521 9.751 2.015 1.00 43.72 N ATOM 146 HE ARG A 18 -15.661 7.594 2.516 1.00 0.00 H ATOM 147 HH12 ARG A 18 -13.088 10.409 3.991 1.00 0.00 H ATOM 148 HH11 ARG A 18 -13.496 8.972 4.998 1.00 0.00 H ATOM 149 HH22 ARG A 18 -14.006 10.646 1.893 1.00 0.00 H ATOM 150 HH21 ARG A 18 -15.136 9.396 1.255 1.00 0.00 H ATOM 151 H ARG A 18 -14.224 2.956 1.938 1.00 0.00 H ATOM 152 N ASP A 19 -14.855 2.476 5.181 1.00 30.00 N ATOM 153 CA ASP A 19 -14.964 1.661 6.381 1.00 30.21 C ATOM 154 C ASP A 19 -13.585 1.292 6.977 1.00 28.36 C ATOM 155 O ASP A 19 -13.329 1.460 8.178 1.00 28.33 O ATOM 156 CB ASP A 19 -15.764 0.405 6.036 1.00 31.36 C ATOM 157 CG ASP A 19 -16.832 0.088 7.059 1.00 33.89 C ATOM 158 OD1 ASP A 19 -17.380 1.036 7.682 1.00 35.95 O ATOM 159 OD2 ASP A 19 -17.132 -1.120 7.225 1.00 35.81 O ATOM 160 H ASP A 19 -15.433 2.219 4.355 1.00 0.00 H ATOM 161 N TYR A 20 -12.691 0.818 6.125 1.00 26.95 N ATOM 162 CA TYR A 20 -11.345 0.436 6.547 1.00 25.36 C ATOM 163 C TYR A 20 -10.626 1.613 7.211 1.00 24.81 C ATOM 164 O TYR A 20 -10.036 1.469 8.297 1.00 24.20 O ATOM 165 CB TYR A 20 -10.569 -0.096 5.338 1.00 24.69 C ATOM 166 CG TYR A 20 -9.161 -0.522 5.617 1.00 23.60 C ATOM 167 CD1 TYR A 20 -8.892 -1.749 6.244 1.00 23.41 C ATOM 168 CD2 TYR A 20 -8.090 0.287 5.255 1.00 22.72 C ATOM 169 CE1 TYR A 20 -7.593 -2.157 6.502 1.00 22.24 C ATOM 170 CE2 TYR A 20 -6.772 -0.113 5.510 1.00 23.20 C ATOM 171 CZ TYR A 20 -6.533 -1.338 6.134 1.00 22.64 C ATOM 172 OH TYR A 20 -5.239 -1.738 6.387 1.00 21.97 O ATOM 173 HH TYR A 20 -5.249 -2.623 6.830 1.00 0.00 H ATOM 174 H TYR A 20 -12.954 0.714 5.124 1.00 0.00 H ATOM 175 N LEU A 21 -10.704 2.779 6.570 1.00 24.67 N ATOM 176 CA LEU A 21 -10.101 3.980 7.115 1.00 24.53 C ATOM 177 C LEU A 21 -10.719 4.335 8.452 1.00 25.26 C ATOM 178 O LEU A 21 -10.008 4.663 9.391 1.00 25.25 O ATOM 179 CB LEU A 21 -10.239 5.147 6.146 1.00 25.06 C ATOM 180 CG LEU A 21 -9.601 4.935 4.770 1.00 24.38 C ATOM 181 CD1 LEU A 21 -9.836 6.144 3.917 1.00 22.12 C ATOM 182 CD2 LEU A 21 -8.107 4.579 4.869 1.00 22.42 C ATOM 183 H LEU A 21 -11.207 2.828 5.661 1.00 0.00 H ATOM 184 N GLU A 22 -12.038 4.242 8.549 1.00 26.32 N ATOM 185 CA GLU A 22 -12.719 4.553 9.808 1.00 27.67 C ATOM 186 C GLU A 22 -12.315 3.611 10.966 1.00 26.85 C ATOM 187 O GLU A 22 -12.066 4.070 12.084 1.00 27.16 O ATOM 188 CB GLU A 22 -14.247 4.587 9.631 1.00 29.10 C ATOM 189 CG GLU A 22 -14.763 5.416 8.435 1.00 32.14 C ATOM 190 CD GLU A 22 -14.900 6.910 8.710 1.00 36.02 C ATOM 191 OE1 GLU A 22 -14.538 7.377 9.818 1.00 37.62 O ATOM 192 OE2 GLU A 22 -15.386 7.629 7.804 1.00 38.16 O ATOM 193 H GLU A 22 -12.595 3.945 7.722 1.00 0.00 H ATOM 194 N LYS A 23 -12.228 2.312 10.691 1.00 25.75 N ATOM 195 CA LYS A 23 -11.961 1.333 11.745 1.00 25.37 C ATOM 196 C LYS A 23 -10.518 1.319 12.290 1.00 24.57 C ATOM 197 O LYS A 23 -10.300 0.993 13.468 1.00 25.36 O ATOM 198 CB LYS A 23 -12.386 -0.068 11.295 1.00 25.10 C ATOM 199 CG LYS A 23 -13.850 -0.161 10.867 1.00 26.24 C ATOM 200 CD LYS A 23 -14.810 -0.111 12.057 1.00 28.66 C ATOM 201 H LYS A 23 -12.352 1.987 9.711 1.00 0.00 H ATOM 202 N TYR A 24 -9.546 1.701 11.462 1.00 23.25 N ATOM 203 CA TYR A 24 -8.139 1.564 11.830 1.00 21.93 C ATOM 204 C TYR A 24 -7.344 2.854 11.953 1.00 21.68 C ATOM 205 O TYR A 24 -6.469 2.964 12.825 1.00 21.67 O ATOM 206 CB TYR A 24 -7.428 0.640 10.846 1.00 21.01 C ATOM 207 CG TYR A 24 -7.910 -0.776 10.916 1.00 20.25 C ATOM 208 CD1 TYR A 24 -7.458 -1.622 11.915 1.00 20.55 C ATOM 209 CD2 TYR A 24 -8.827 -1.270 9.992 1.00 19.86 C ATOM 210 CE1 TYR A 24 -7.894 -2.932 12.002 1.00 20.39 C ATOM 211 CE2 TYR A 24 -9.276 -2.588 10.067 1.00 20.66 C ATOM 212 CZ TYR A 24 -8.803 -3.411 11.088 1.00 21.13 C ATOM 213 OH TYR A 24 -9.214 -4.720 11.202 1.00 22.42 O ATOM 214 HH TYR A 24 -10.196 -4.747 11.325 1.00 0.00 H ATOM 215 H TYR A 24 -9.794 2.104 10.536 1.00 0.00 H ATOM 216 N TYR A 25 -7.637 3.825 11.094 1.00 21.83 N ATOM 217 CA TYR A 25 -6.788 5.005 10.978 1.00 21.57 C ATOM 218 C TYR A 25 -7.381 6.336 11.442 1.00 22.39 C ATOM 219 O TYR A 25 -6.883 7.391 11.065 1.00 22.55 O ATOM 220 CB TYR A 25 -6.206 5.089 9.559 1.00 21.45 C ATOM 221 CG TYR A 25 -5.375 3.871 9.226 1.00 20.88 C ATOM 222 CD1 TYR A 25 -4.106 3.717 9.756 1.00 21.70 C ATOM 223 CD2 TYR A 25 -5.881 2.843 8.428 1.00 21.77 C ATOM 224 CE1 TYR A 25 -3.337 2.584 9.487 1.00 21.26 C ATOM 225 CE2 TYR A 25 -5.120 1.699 8.147 1.00 20.71 C ATOM 226 CZ TYR A 25 -3.846 1.590 8.680 1.00 20.77 C ATOM 227 OH TYR A 25 -3.066 0.490 8.429 1.00 20.97 O ATOM 228 HH TYR A 25 -3.525 -0.322 8.762 1.00 0.00 H ATOM 229 H TYR A 25 -8.484 3.742 10.496 1.00 0.00 H ATOM 230 N LYS A 26 -8.406 6.307 12.286 1.00 23.48 N ATOM 231 CA LYS A 26 -8.990 7.576 12.774 1.00 25.55 C ATOM 232 C LYS A 26 -8.115 8.314 13.784 1.00 26.08 C ATOM 233 O LYS A 26 -8.147 9.548 13.845 1.00 26.57 O ATOM 234 CB LYS A 26 -10.415 7.411 13.318 1.00 26.70 C ATOM 235 CG LYS A 26 -11.501 7.588 12.257 1.00 27.69 C ATOM 236 CD LYS A 26 -12.874 7.895 12.882 1.00 32.73 C ATOM 237 CE LYS A 26 -13.021 9.373 13.265 1.00 34.61 C ATOM 238 NZ LYS A 26 -12.474 10.271 12.192 1.00 35.85 N ATOM 239 HZ1 LYS A 26 -11.465 10.064 12.050 1.00 0.00 H ATOM 240 HZ2 LYS A 26 -12.992 10.105 11.305 1.00 0.00 H ATOM 241 HZ3 LYS A 26 -12.588 11.264 12.481 1.00 0.00 H ATOM 242 H LYS A 26 -8.796 5.397 12.603 1.00 0.00 H ATOM 243 N PHE A 27 -7.337 7.554 14.558 1.00 25.87 N ATOM 244 CA PHE A 27 -6.305 8.122 15.406 1.00 26.91 C ATOM 245 C PHE A 27 -6.921 9.122 16.393 1.00 28.90 C ATOM 246 O PHE A 27 -6.716 10.334 16.288 1.00 29.41 O ATOM 247 CB PHE A 27 -5.244 8.781 14.517 1.00 26.28 C ATOM 248 CG PHE A 27 -3.870 8.818 15.109 1.00 26.98 C ATOM 249 CD1 PHE A 27 -3.284 7.674 15.640 1.00 25.75 C ATOM 250 CD2 PHE A 27 -3.136 10.000 15.098 1.00 28.65 C ATOM 251 CE1 PHE A 27 -2.002 7.716 16.166 1.00 25.81 C ATOM 252 CE2 PHE A 27 -1.854 10.044 15.626 1.00 27.39 C ATOM 253 CZ PHE A 27 -1.287 8.898 16.152 1.00 26.05 C ATOM 254 H PHE A 27 -7.475 6.523 14.553 1.00 0.00 H ATOM 255 N GLY A 28 -7.705 8.594 17.331 1.00 30.17 N ATOM 256 CA GLY A 28 -8.316 9.401 18.381 1.00 32.28 C ATOM 257 C GLY A 28 -7.419 9.459 19.601 1.00 33.14 C ATOM 258 O GLY A 28 -6.424 8.736 19.675 1.00 32.72 O ATOM 259 H GLY A 28 -7.888 7.570 17.314 1.00 0.00 H ATOM 260 N SER A 29 -7.769 10.319 20.554 1.00 35.01 N ATOM 261 CA SER A 29 -7.020 10.461 21.812 1.00 35.67 C ATOM 262 C SER A 29 -7.209 9.319 22.795 1.00 35.85 C ATOM 263 O SER A 29 -6.385 9.147 23.681 1.00 35.91 O ATOM 264 CB SER A 29 -7.340 11.792 22.512 1.00 37.67 C ATOM 265 OG SER A 29 -8.736 11.990 22.692 1.00 37.83 O ATOM 266 HG SER A 29 -8.889 12.857 23.145 1.00 0.00 H ATOM 267 H SER A 29 -8.607 10.916 20.403 1.00 0.00 H ATOM 268 N ARG A 30 -8.292 8.556 22.666 1.00 36.46 N ATOM 269 CA ARG A 30 -8.464 7.359 23.491 1.00 37.60 C ATOM 270 C ARG A 30 -7.402 6.360 23.033 1.00 36.74 C ATOM 271 O ARG A 30 -7.243 6.136 21.826 1.00 35.89 O ATOM 272 CB ARG A 30 -9.872 6.763 23.354 1.00 37.98 C ATOM 273 CG ARG A 30 -10.981 7.496 24.127 1.00 39.81 C ATOM 274 CD ARG A 30 -12.342 6.791 23.947 1.00 40.70 C ATOM 275 NE ARG A 30 -13.454 7.407 24.692 1.00 43.11 N ATOM 276 CZ ARG A 30 -14.030 6.883 25.780 1.00 44.94 C ATOM 277 NH1 ARG A 30 -15.037 7.518 26.373 1.00 46.80 N ATOM 278 NH2 ARG A 30 -13.614 5.726 26.284 1.00 43.47 N ATOM 279 HE ARG A 30 -13.819 8.318 24.346 1.00 0.00 H ATOM 280 HH12 ARG A 30 -15.484 7.109 27.219 1.00 0.00 H ATOM 281 HH11 ARG A 30 -15.378 8.423 25.991 1.00 0.00 H ATOM 282 HH22 ARG A 30 -14.073 5.333 27.130 1.00 0.00 H ATOM 283 HH21 ARG A 30 -12.830 5.214 25.832 1.00 0.00 H ATOM 284 H ARG A 30 -9.023 8.813 21.972 1.00 0.00 H ATOM 285 N HIS A 31 -6.666 5.778 23.981 1.00 37.23 N ATOM 286 CA HIS A 31 -5.471 4.988 23.645 1.00 36.70 C ATOM 287 C HIS A 31 -5.763 3.524 23.316 1.00 35.77 C ATOM 288 O HIS A 31 -5.316 2.624 24.035 1.00 36.40 O ATOM 289 CB HIS A 31 -4.421 5.113 24.757 1.00 37.76 C ATOM 290 CG HIS A 31 -4.130 6.534 25.136 1.00 40.28 C ATOM 291 ND1 HIS A 31 -3.256 7.331 24.423 1.00 41.09 N ATOM 292 CD2 HIS A 31 -4.629 7.312 26.127 1.00 42.22 C ATOM 293 CE1 HIS A 31 -3.223 8.536 24.965 1.00 43.03 C ATOM 294 NE2 HIS A 31 -4.044 8.550 26.002 1.00 44.10 N ATOM 295 H HIS A 31 -6.942 5.885 24.978 1.00 0.00 H ATOM 296 N SER A 32 -6.491 3.300 22.219 1.00 34.61 N ATOM 297 CA SER A 32 -6.921 1.959 21.796 1.00 33.45 C ATOM 298 C SER A 32 -5.800 1.218 21.096 1.00 31.60 C ATOM 299 O SER A 32 -4.822 1.827 20.690 1.00 31.21 O ATOM 300 CB SER A 32 -8.121 2.045 20.843 1.00 33.54 C ATOM 301 OG SER A 32 -7.700 2.139 19.484 1.00 32.29 O ATOM 302 HG SER A 32 -8.495 2.193 18.896 1.00 0.00 H ATOM 303 H SER A 32 -6.768 4.115 21.635 1.00 0.00 H ATOM 304 N ALA A 33 -5.979 -0.092 20.919 1.00 30.71 N ATOM 305 CA ALA A 33 -4.988 -0.957 20.268 1.00 28.93 C ATOM 306 C ALA A 33 -4.641 -0.514 18.846 1.00 27.36 C ATOM 307 O ALA A 33 -3.472 -0.545 18.438 1.00 26.78 O ATOM 308 CB ALA A 33 -5.465 -2.400 20.274 1.00 29.19 C ATOM 309 H ALA A 33 -6.863 -0.521 21.259 1.00 0.00 H ATOM 310 N GLU A 34 -5.653 -0.095 18.102 1.00 26.34 N ATOM 311 CA GLU A 34 -5.458 0.348 16.729 1.00 25.22 C ATOM 312 C GLU A 34 -4.636 1.635 16.647 1.00 24.76 C ATOM 313 O GLU A 34 -3.897 1.842 15.690 1.00 23.95 O ATOM 314 CB GLU A 34 -6.809 0.529 16.035 1.00 25.37 C ATOM 315 CG GLU A 34 -7.467 -0.779 15.610 1.00 26.14 C ATOM 316 CD GLU A 34 -7.811 -1.703 16.782 1.00 28.34 C ATOM 317 OE1 GLU A 34 -8.374 -1.222 17.793 1.00 30.21 O ATOM 318 OE2 GLU A 34 -7.517 -2.916 16.692 1.00 27.93 O ATOM 319 H GLU A 34 -6.610 -0.082 18.508 1.00 0.00 H ATOM 320 N SER A 35 -4.763 2.492 17.656 1.00 25.17 N ATOM 321 CA SER A 35 -4.007 3.733 17.693 1.00 25.13 C ATOM 322 C SER A 35 -2.578 3.441 18.090 1.00 24.65 C ATOM 323 O SER A 35 -1.646 4.043 17.555 1.00 24.58 O ATOM 324 CB SER A 35 -4.615 4.722 18.687 1.00 26.23 C ATOM 325 OG SER A 35 -5.780 5.322 18.156 1.00 27.00 O ATOM 326 HG SER A 35 -6.154 5.957 18.817 1.00 0.00 H ATOM 327 H SER A 35 -5.416 2.270 18.434 1.00 0.00 H ATOM 328 N GLN A 36 -2.407 2.514 19.028 1.00 24.32 N ATOM 329 CA GLN A 36 -1.074 2.145 19.481 1.00 23.98 C ATOM 330 C GLN A 36 -0.233 1.575 18.342 1.00 22.55 C ATOM 331 O GLN A 36 0.917 1.980 18.167 1.00 22.62 O ATOM 332 CB GLN A 36 -1.128 1.188 20.681 1.00 24.78 C ATOM 333 CG GLN A 36 -1.768 1.791 21.938 1.00 26.17 C ATOM 334 CD GLN A 36 -0.954 2.919 22.541 1.00 27.25 C ATOM 335 OE1 GLN A 36 -1.338 4.090 22.468 1.00 29.12 O ATOM 336 NE2 GLN A 36 0.180 2.575 23.139 1.00 27.36 N ATOM 337 HE22 GLN A 36 0.465 1.576 23.177 1.00 0.00 H ATOM 338 HE21 GLN A 36 0.783 3.305 23.569 1.00 0.00 H ATOM 339 H GLN A 36 -3.238 2.046 19.444 1.00 0.00 H ATOM 340 N ILE A 37 -0.802 0.660 17.563 1.00 21.62 N ATOM 341 CA ILE A 37 -0.101 0.104 16.401 1.00 20.89 C ATOM 342 C ILE A 37 0.255 1.204 15.415 1.00 20.52 C ATOM 343 O ILE A 37 1.403 1.278 14.971 1.00 20.30 O ATOM 344 CB ILE A 37 -0.897 -1.051 15.716 1.00 20.70 C ATOM 345 CG1 ILE A 37 -0.578 -2.378 16.398 1.00 20.99 C ATOM 346 CG2 ILE A 37 -0.560 -1.159 14.234 1.00 19.74 C ATOM 347 CD1 ILE A 37 -1.735 -3.357 16.444 1.00 22.40 C ATOM 348 H ILE A 37 -1.764 0.332 17.782 1.00 0.00 H ATOM 349 N LEU A 38 -0.708 2.072 15.101 1.00 20.70 N ATOM 350 CA LEU A 38 -0.445 3.194 14.198 1.00 20.83 C ATOM 351 C LEU A 38 0.739 4.058 14.676 1.00 21.77 C ATOM 352 O LEU A 38 1.588 4.461 13.863 1.00 21.55 O ATOM 353 CB LEU A 38 -1.706 4.039 13.939 1.00 21.07 C ATOM 354 CG LEU A 38 -1.673 5.124 12.834 1.00 20.95 C ATOM 355 CD1 LEU A 38 -1.201 4.593 11.489 1.00 20.15 C ATOM 356 CD2 LEU A 38 -3.013 5.810 12.651 1.00 21.04 C ATOM 357 H LEU A 38 -1.659 1.950 15.503 1.00 0.00 H ATOM 358 N LYS A 39 0.810 4.328 15.979 1.00 22.93 N ATOM 359 CA LYS A 39 1.920 5.113 16.534 1.00 24.33 C ATOM 360 C LYS A 39 3.255 4.433 16.235 1.00 24.56 C ATOM 361 O LYS A 39 4.256 5.095 15.901 1.00 24.15 O ATOM 362 CB LYS A 39 1.769 5.313 18.046 1.00 25.26 C ATOM 363 CG LYS A 39 0.591 6.186 18.453 1.00 26.96 C ATOM 364 CD LYS A 39 0.824 6.875 19.800 1.00 29.37 C ATOM 365 H LYS A 39 0.066 3.976 16.614 1.00 0.00 H ATOM 366 N HIS A 40 3.246 3.100 16.335 1.00 24.85 N ATOM 367 CA HIS A 40 4.461 2.316 16.174 1.00 25.02 C ATOM 368 C HIS A 40 4.841 2.186 14.719 1.00 23.76 C ATOM 369 O HIS A 40 6.023 2.164 14.376 1.00 24.18 O ATOM 370 CB HIS A 40 4.357 0.935 16.838 1.00 25.29 C ATOM 371 CG HIS A 40 5.670 0.445 17.366 1.00 28.75 C ATOM 372 ND1 HIS A 40 6.431 1.181 18.258 1.00 31.30 N ATOM 373 CD2 HIS A 40 6.382 -0.679 17.102 1.00 29.77 C ATOM 374 CE1 HIS A 40 7.546 0.522 18.528 1.00 31.82 C ATOM 375 NE2 HIS A 40 7.538 -0.611 17.845 1.00 30.33 N ATOM 376 H HIS A 40 2.349 2.612 16.533 1.00 0.00 H ATOM 377 N LEU A 41 3.841 2.101 13.859 1.00 22.77 N ATOM 378 CA LEU A 41 4.105 2.100 12.430 1.00 21.58 C ATOM 379 C LEU A 41 4.797 3.400 12.050 1.00 21.26 C ATOM 380 O LEU A 41 5.879 3.369 11.476 1.00 21.26 O ATOM 381 CB LEU A 41 2.820 1.907 11.638 1.00 21.23 C ATOM 382 CG LEU A 41 2.129 0.555 11.833 1.00 21.38 C ATOM 383 CD1 LEU A 41 0.853 0.485 10.967 1.00 20.32 C ATOM 384 CD2 LEU A 41 3.089 -0.627 11.550 1.00 20.39 C ATOM 385 H LEU A 41 2.863 2.035 14.206 1.00 0.00 H ATOM 386 N LEU A 42 4.190 4.526 12.418 1.00 21.07 N ATOM 387 CA LEU A 42 4.754 5.858 12.168 1.00 21.15 C ATOM 388 C LEU A 42 6.177 6.058 12.691 1.00 22.16 C ATOM 389 O LEU A 42 7.019 6.618 11.985 1.00 22.59 O ATOM 390 CB LEU A 42 3.847 6.947 12.741 1.00 21.21 C ATOM 391 CG LEU A 42 2.430 7.053 12.189 1.00 19.67 C ATOM 392 CD1 LEU A 42 1.620 8.031 13.024 1.00 19.57 C ATOM 393 CD2 LEU A 42 2.444 7.448 10.728 1.00 16.84 C ATOM 394 H LEU A 42 3.274 4.459 12.905 1.00 0.00 H ATOM 395 N LYS A 43 6.444 5.624 13.924 1.00 22.96 N ATOM 396 CA LYS A 43 7.791 5.740 14.495 1.00 23.83 C ATOM 397 C LYS A 43 8.812 4.899 13.741 1.00 23.35 C ATOM 398 O LYS A 43 9.908 5.368 13.450 1.00 24.10 O ATOM 399 CB LYS A 43 7.795 5.431 15.991 1.00 24.48 C ATOM 400 CG LYS A 43 7.346 6.638 16.791 1.00 26.55 C ATOM 401 CD LYS A 43 7.464 6.446 18.280 1.00 28.84 C ATOM 402 CE LYS A 43 6.203 5.874 18.894 1.00 27.92 C ATOM 403 NZ LYS A 43 6.256 4.403 18.762 1.00 29.22 N ATOM 404 HZ1 LYS A 43 6.313 4.148 17.755 1.00 0.00 H ATOM 405 HZ2 LYS A 43 7.094 4.041 19.260 1.00 0.00 H ATOM 406 HZ3 LYS A 43 5.398 3.988 19.178 1.00 0.00 H ATOM 407 H LYS A 43 5.684 5.196 14.491 1.00 0.00 H ATOM 408 N ASN A 44 8.440 3.674 13.397 1.00 22.38 N ATOM 409 CA ASN A 44 9.260 2.862 12.510 1.00 22.15 C ATOM 410 C ASN A 44 9.656 3.565 11.226 1.00 21.60 C ATOM 411 O ASN A 44 10.831 3.580 10.859 1.00 21.94 O ATOM 412 CB ASN A 44 8.543 1.578 12.140 1.00 21.71 C ATOM 413 CG ASN A 44 8.579 0.572 13.233 1.00 23.44 C ATOM 414 OD1 ASN A 44 9.587 0.425 13.913 1.00 25.32 O ATOM 415 ND2 ASN A 44 7.475 -0.139 13.417 1.00 26.15 N ATOM 416 HD22 ASN A 44 6.645 0.024 12.812 1.00 0.00 H ATOM 417 HD21 ASN A 44 7.439 -0.860 14.166 1.00 0.00 H ATOM 418 H ASN A 44 7.548 3.287 13.767 1.00 0.00 H ATOM 419 N LEU A 45 8.666 4.126 10.544 1.00 20.75 N ATOM 420 CA LEU A 45 8.875 4.691 9.216 1.00 20.35 C ATOM 421 C LEU A 45 9.734 5.924 9.333 1.00 20.95 C ATOM 422 O LEU A 45 10.652 6.121 8.550 1.00 21.37 O ATOM 423 CB LEU A 45 7.547 5.025 8.546 1.00 19.50 C ATOM 424 CG LEU A 45 6.644 3.834 8.303 1.00 18.31 C ATOM 425 CD1 LEU A 45 5.243 4.320 7.995 1.00 17.91 C ATOM 426 CD2 LEU A 45 7.201 3.007 7.179 1.00 18.38 C ATOM 427 H LEU A 45 7.717 4.164 10.967 1.00 0.00 H ATOM 428 N PHE A 46 9.432 6.732 10.340 1.00 21.54 N ATOM 429 CA PHE A 46 10.229 7.891 10.684 1.00 22.76 C ATOM 430 C PHE A 46 11.695 7.506 10.890 1.00 23.48 C ATOM 431 O PHE A 46 12.596 8.127 10.318 1.00 24.29 O ATOM 432 CB PHE A 46 9.668 8.567 11.936 1.00 22.75 C ATOM 433 CG PHE A 46 10.616 9.545 12.563 1.00 24.17 C ATOM 434 CD1 PHE A 46 11.043 10.674 11.855 1.00 24.09 C ATOM 435 CD2 PHE A 46 11.113 9.324 13.850 1.00 24.27 C ATOM 436 CE1 PHE A 46 11.936 11.570 12.423 1.00 26.17 C ATOM 437 CE2 PHE A 46 12.004 10.220 14.430 1.00 25.73 C ATOM 438 CZ PHE A 46 12.414 11.347 13.717 1.00 26.82 C ATOM 439 H PHE A 46 8.586 6.524 10.908 1.00 0.00 H ATOM 440 N LYS A 47 11.907 6.473 11.696 1.00 23.81 N ATOM 441 CA LYS A 47 13.232 5.948 11.993 1.00 25.19 C ATOM 442 C LYS A 47 13.903 5.399 10.751 1.00 24.87 C ATOM 443 O LYS A 47 15.087 5.613 10.554 1.00 26.11 O ATOM 444 CB LYS A 47 13.145 4.845 13.058 1.00 25.30 C ATOM 445 CG LYS A 47 14.480 4.418 13.615 1.00 27.59 C ATOM 446 CD LYS A 47 14.630 2.906 13.575 1.00 30.64 C ATOM 447 CE LYS A 47 15.879 2.457 14.364 1.00 35.36 C ATOM 448 NZ LYS A 47 17.169 3.157 14.013 1.00 35.95 N ATOM 449 HZ1 LYS A 47 17.387 2.996 13.009 1.00 0.00 H ATOM 450 HZ2 LYS A 47 17.067 4.177 14.188 1.00 0.00 H ATOM 451 HZ3 LYS A 47 17.939 2.778 14.601 1.00 0.00 H ATOM 452 H LYS A 47 11.084 6.015 12.138 1.00 0.00 H ATOM 453 N ILE A 48 13.153 4.682 9.925 1.00 24.30 N ATOM 454 CA ILE A 48 13.705 4.103 8.696 1.00 25.00 C ATOM 455 C ILE A 48 14.077 5.196 7.706 1.00 25.70 C ATOM 456 O ILE A 48 15.242 5.306 7.308 1.00 26.79 O ATOM 457 CB ILE A 48 12.741 3.079 8.029 1.00 23.96 C ATOM 458 CG1 ILE A 48 12.683 1.798 8.866 1.00 24.25 C ATOM 459 CG2 ILE A 48 13.185 2.759 6.613 1.00 24.09 C ATOM 460 CD1 ILE A 48 11.552 0.822 8.492 1.00 22.91 C ATOM 461 H ILE A 48 12.150 4.527 10.154 1.00 0.00 H ATOM 462 N PHE A 49 13.100 6.024 7.346 1.00 25.54 N ATOM 463 CA PHE A 49 13.300 7.017 6.296 1.00 26.33 C ATOM 464 C PHE A 49 14.030 8.282 6.705 1.00 27.99 C ATOM 465 O PHE A 49 14.733 8.861 5.869 1.00 29.37 O ATOM 466 CB PHE A 49 11.983 7.338 5.583 1.00 25.45 C ATOM 467 CG PHE A 49 11.395 6.161 4.885 1.00 24.57 C ATOM 468 CD1 PHE A 49 12.114 5.504 3.883 1.00 24.03 C ATOM 469 CD2 PHE A 49 10.149 5.679 5.243 1.00 23.06 C ATOM 470 CE1 PHE A 49 11.597 4.399 3.244 1.00 22.91 C ATOM 471 CE2 PHE A 49 9.612 4.577 4.595 1.00 23.41 C ATOM 472 CZ PHE A 49 10.347 3.930 3.590 1.00 22.98 C ATOM 473 H PHE A 49 12.177 5.962 7.822 1.00 0.00 H ATOM 474 N CYS A 50 13.892 8.724 7.957 1.00 28.51 N ATOM 475 CA CYS A 50 14.552 9.985 8.363 1.00 30.41 C ATOM 476 C CYS A 50 15.870 9.813 9.098 1.00 31.59 C ATOM 477 O CYS A 50 16.825 10.524 8.829 1.00 32.77 O ATOM 478 CB CYS A 50 13.623 10.882 9.184 1.00 30.56 C ATOM 479 SG CYS A 50 12.010 11.140 8.423 1.00 29.61 S ATOM 480 H CYS A 50 13.325 8.186 8.643 1.00 0.00 H ATOM 481 N LEU A 51 15.916 8.866 10.026 1.00 31.82 N ATOM 482 CA LEU A 51 17.068 8.711 10.909 1.00 33.20 C ATOM 483 C LEU A 51 18.168 7.821 10.333 1.00 34.01 C ATOM 484 O LEU A 51 19.345 7.952 10.698 1.00 35.31 O ATOM 485 CB LEU A 51 16.612 8.187 12.267 1.00 32.84 C ATOM 486 CG LEU A 51 16.307 9.225 13.343 1.00 33.38 C ATOM 487 CD1 LEU A 51 15.652 10.477 12.762 1.00 33.24 C ATOM 488 CD2 LEU A 51 15.455 8.598 14.443 1.00 32.40 C ATOM 489 H LEU A 51 15.110 8.217 10.127 1.00 0.00 H ATOM 490 N ASP A 52 17.778 6.914 9.442 1.00 33.49 N ATOM 491 CA ASP A 52 18.725 6.047 8.755 1.00 34.14 C ATOM 492 C ASP A 52 18.939 6.564 7.332 1.00 34.93 C ATOM 493 O ASP A 52 18.247 7.492 6.884 1.00 35.17 O ATOM 494 CB ASP A 52 18.220 4.602 8.778 1.00 33.05 C ATOM 495 CG ASP A 52 17.865 4.133 10.193 1.00 32.81 C ATOM 496 OD1 ASP A 52 17.129 3.129 10.354 1.00 33.01 O ATOM 497 OD2 ASP A 52 18.319 4.784 11.153 1.00 32.31 O ATOM 498 H ASP A 52 16.764 6.821 9.229 1.00 0.00 H ATOM 499 N GLY A 53 19.899 5.982 6.623 1.00 35.53 N ATOM 500 CA GLY A 53 20.250 6.479 5.299 1.00 36.41 C ATOM 501 C GLY A 53 19.375 5.953 4.177 1.00 35.40 C ATOM 502 O GLY A 53 19.852 5.823 3.036 1.00 36.27 O ATOM 503 H GLY A 53 20.405 5.163 7.017 1.00 0.00 H ATOM 504 N VAL A 54 18.109 5.653 4.490 1.00 33.76 N ATOM 505 CA VAL A 54 17.180 5.080 3.508 1.00 32.49 C ATOM 506 C VAL A 54 16.513 6.183 2.690 1.00 32.47 C ATOM 507 O VAL A 54 15.517 6.791 3.103 1.00 31.83 O ATOM 508 CB VAL A 54 16.155 4.106 4.136 1.00 31.18 C ATOM 509 CG1 VAL A 54 15.212 3.542 3.066 1.00 30.25 C ATOM 510 CG2 VAL A 54 16.874 2.964 4.809 1.00 31.69 C ATOM 511 H VAL A 54 17.773 5.831 5.458 1.00 0.00 H ATOM 512 N LYS A 55 17.102 6.424 1.523 1.00 33.15 N ATOM 513 CA LYS A 55 16.803 7.578 0.697 1.00 33.94 C ATOM 514 C LYS A 55 17.020 7.182 -0.745 1.00 34.15 C ATOM 515 O LYS A 55 17.563 6.111 -1.025 1.00 34.19 O ATOM 516 CB LYS A 55 17.756 8.723 1.039 1.00 35.50 C ATOM 517 CG LYS A 55 17.699 9.202 2.485 1.00 36.55 C ATOM 518 CD LYS A 55 19.094 9.508 3.045 1.00 39.42 C ATOM 519 CE LYS A 55 19.719 10.734 2.388 1.00 41.59 C ATOM 520 NZ LYS A 55 18.792 11.913 2.390 1.00 42.29 N ATOM 521 HZ1 LYS A 55 17.926 11.672 1.867 1.00 0.00 H ATOM 522 HZ2 LYS A 55 18.549 12.160 3.371 1.00 0.00 H ATOM 523 HZ3 LYS A 55 19.260 12.722 1.933 1.00 0.00 H ATOM 524 H LYS A 55 17.816 5.748 1.184 1.00 0.00 H ATOM 525 N GLY A 56 16.609 8.043 -1.664 1.00 34.43 N ATOM 526 CA GLY A 56 16.807 7.767 -3.077 1.00 35.23 C ATOM 527 C GLY A 56 15.845 8.500 -3.988 1.00 35.34 C ATOM 528 O GLY A 56 15.109 9.380 -3.552 1.00 35.27 O ATOM 529 H GLY A 56 16.140 8.924 -1.372 1.00 0.00 H ATOM 530 N ASP A 57 15.850 8.130 -5.261 1.00 35.74 N ATOM 531 CA ASP A 57 15.030 8.811 -6.245 1.00 36.04 C ATOM 532 C ASP A 57 13.614 8.261 -6.309 1.00 34.28 C ATOM 533 O ASP A 57 12.676 9.025 -6.538 1.00 33.99 O ATOM 534 CB ASP A 57 15.680 8.720 -7.612 1.00 37.86 C ATOM 535 CG ASP A 57 17.161 9.029 -7.566 1.00 41.41 C ATOM 536 OD1 ASP A 57 17.535 10.187 -7.241 1.00 44.33 O ATOM 537 OD2 ASP A 57 17.950 8.101 -7.857 1.00 44.01 O ATOM 538 H ASP A 57 16.453 7.337 -5.560 1.00 0.00 H ATOM 539 N LEU A 58 13.466 6.949 -6.092 1.00 32.79 N ATOM 540 CA LEU A 58 12.186 6.264 -6.294 1.00 31.35 C ATOM 541 C LEU A 58 11.782 5.242 -5.213 1.00 29.99 C ATOM 542 O LEU A 58 12.517 4.294 -4.913 1.00 29.71 O ATOM 543 CB LEU A 58 12.138 5.608 -7.688 1.00 31.78 C ATOM 544 CG LEU A 58 10.851 4.883 -8.114 1.00 31.22 C ATOM 545 CD1 LEU A 58 9.677 5.842 -8.213 1.00 30.90 C ATOM 546 CD2 LEU A 58 11.046 4.158 -9.434 1.00 32.42 C ATOM 547 H LEU A 58 14.286 6.397 -5.769 1.00 0.00 H ATOM 548 N LEU A 59 10.585 5.443 -4.663 1.00 28.86 N ATOM 549 CA LEU A 59 9.964 4.488 -3.761 1.00 27.65 C ATOM 550 C LEU A 59 8.688 3.962 -4.399 1.00 27.71 C ATOM 551 O LEU A 59 7.869 4.741 -4.904 1.00 28.00 O ATOM 552 CB LEU A 59 9.670 5.131 -2.394 1.00 26.91 C ATOM 553 CG LEU A 59 9.148 4.257 -1.250 1.00 24.70 C ATOM 554 CD1 LEU A 59 9.878 4.570 0.018 1.00 24.45 C ATOM 555 CD2 LEU A 59 7.679 4.453 -1.046 1.00 24.57 C ATOM 556 H LEU A 59 10.074 6.320 -4.889 1.00 0.00 H ATOM 557 N ILE A 60 8.531 2.640 -4.396 1.00 27.57 N ATOM 558 CA ILE A 60 7.290 2.022 -4.847 1.00 27.65 C ATOM 559 C ILE A 60 6.576 1.429 -3.645 1.00 27.17 C ATOM 560 O ILE A 60 7.100 0.516 -3.013 1.00 26.90 O ATOM 561 CB ILE A 60 7.533 0.944 -5.926 1.00 28.22 C ATOM 562 CG1 ILE A 60 8.123 1.577 -7.190 1.00 28.28 C ATOM 563 CG2 ILE A 60 6.224 0.202 -6.258 1.00 28.15 C ATOM 564 CD1 ILE A 60 8.779 0.588 -8.103 1.00 28.30 C ATOM 565 H ILE A 60 9.310 2.036 -4.065 1.00 0.00 H ATOM 566 N ASP A 61 5.405 1.979 -3.316 1.00 27.41 N ATOM 567 CA ASP A 61 4.574 1.447 -2.226 1.00 27.53 C ATOM 568 C ASP A 61 3.612 0.402 -2.772 1.00 27.18 C ATOM 569 O ASP A 61 2.878 0.645 -3.740 1.00 27.85 O ATOM 570 CB ASP A 61 3.815 2.557 -1.481 1.00 27.87 C ATOM 571 CG ASP A 61 3.274 2.101 -0.100 1.00 30.41 C ATOM 572 OD1 ASP A 61 2.035 2.157 0.115 1.00 33.41 O ATOM 573 OD2 ASP A 61 4.074 1.693 0.782 1.00 32.36 O ATOM 574 H ASP A 61 5.071 2.809 -3.847 1.00 0.00 H ATOM 575 N ILE A 62 3.629 -0.763 -2.141 1.00 26.43 N ATOM 576 CA ILE A 62 2.950 -1.944 -2.652 1.00 26.21 C ATOM 577 C ILE A 62 1.811 -2.330 -1.711 1.00 26.03 C ATOM 578 O ILE A 62 2.040 -2.730 -0.570 1.00 25.81 O ATOM 579 CB ILE A 62 3.959 -3.107 -2.801 1.00 26.03 C ATOM 580 CG1 ILE A 62 4.929 -2.846 -3.970 1.00 26.97 C ATOM 581 CG2 ILE A 62 3.249 -4.422 -2.963 1.00 26.37 C ATOM 582 CD1 ILE A 62 4.276 -2.800 -5.368 1.00 26.95 C ATOM 583 H ILE A 62 4.149 -0.836 -1.243 1.00 0.00 H ATOM 584 N GLY A 63 0.581 -2.205 -2.198 1.00 26.43 N ATOM 585 CA GLY A 63 -0.595 -2.490 -1.397 1.00 26.36 C ATOM 586 C GLY A 63 -1.014 -1.326 -0.520 1.00 26.36 C ATOM 587 O GLY A 63 -1.470 -1.533 0.598 1.00 26.53 O ATOM 588 H GLY A 63 0.457 -1.894 -3.183 1.00 0.00 H ATOM 589 N SER A 64 -0.865 -0.101 -1.021 1.00 26.56 N ATOM 590 CA SER A 64 -1.209 1.112 -0.261 1.00 26.69 C ATOM 591 C SER A 64 -2.580 1.106 0.394 1.00 26.42 C ATOM 592 O SER A 64 -2.794 1.779 1.416 1.00 26.25 O ATOM 593 CB SER A 64 -1.148 2.331 -1.164 1.00 27.06 C ATOM 594 OG SER A 64 0.204 2.622 -1.469 1.00 30.42 O ATOM 595 HG SER A 64 0.698 2.805 -0.631 1.00 0.00 H ATOM 596 H SER A 64 -0.491 0.003 -1.986 1.00 0.00 H ATOM 597 N GLY A 65 -3.508 0.365 -0.211 1.00 26.39 N ATOM 598 CA GLY A 65 -4.913 0.467 0.133 1.00 26.01 C ATOM 599 C GLY A 65 -5.391 1.898 -0.070 1.00 25.88 C ATOM 600 O GLY A 65 -4.933 2.590 -0.992 1.00 26.16 O ATOM 601 H GLY A 65 -3.216 -0.305 -0.951 1.00 0.00 H ATOM 602 N PRO A 66 -6.329 2.348 0.776 1.00 25.54 N ATOM 603 CA PRO A 66 -6.799 3.724 0.713 1.00 25.43 C ATOM 604 C PRO A 66 -6.011 4.642 1.638 1.00 24.44 C ATOM 605 O PRO A 66 -6.399 5.803 1.817 1.00 24.79 O ATOM 606 CB PRO A 66 -8.255 3.609 1.176 1.00 26.16 C ATOM 607 CG PRO A 66 -8.344 2.276 1.930 1.00 26.17 C ATOM 608 CD PRO A 66 -7.026 1.575 1.817 1.00 25.29 C ATOM 609 N THR A 67 -4.908 4.118 2.190 1.00 23.16 N ATOM 610 CA THR A 67 -4.137 4.779 3.254 1.00 22.08 C ATOM 611 C THR A 67 -2.907 5.448 2.697 1.00 21.70 C ATOM 612 O THR A 67 -2.290 4.923 1.779 1.00 21.41 O ATOM 613 CB THR A 67 -3.688 3.811 4.401 1.00 21.42 C ATOM 614 OG1 THR A 67 -2.489 3.113 4.029 1.00 21.62 O ATOM 615 CG2 THR A 67 -4.765 2.816 4.743 1.00 20.40 C ATOM 616 HG1 THR A 67 -1.767 3.768 3.859 1.00 0.00 H ATOM 617 H THR A 67 -4.579 3.193 1.847 1.00 0.00 H ATOM 618 N ILE A 68 -2.566 6.607 3.270 1.00 21.93 N ATOM 619 CA ILE A 68 -1.418 7.432 2.846 1.00 21.76 C ATOM 620 C ILE A 68 -0.413 7.690 3.981 1.00 21.75 C ATOM 621 O ILE A 68 0.647 8.264 3.745 1.00 22.26 O ATOM 622 CB ILE A 68 -1.869 8.801 2.222 1.00 22.29 C ATOM 623 CG1 ILE A 68 -2.597 9.688 3.236 1.00 21.78 C ATOM 624 CG2 ILE A 68 -2.779 8.568 1.069 1.00 22.51 C ATOM 625 CD1 ILE A 68 -1.710 10.592 4.070 1.00 19.73 C ATOM 626 H ILE A 68 -3.145 6.948 4.063 1.00 0.00 H ATOM 627 N TYR A 69 -0.766 7.291 5.205 1.00 21.51 N ATOM 628 CA TYR A 69 0.088 7.470 6.375 1.00 21.70 C ATOM 629 C TYR A 69 1.501 6.929 6.117 1.00 21.72 C ATOM 630 O TYR A 69 2.482 7.547 6.512 1.00 22.16 O ATOM 631 CB TYR A 69 -0.530 6.794 7.620 1.00 21.50 C ATOM 632 CG TYR A 69 -0.272 5.300 7.673 1.00 20.81 C ATOM 633 CD1 TYR A 69 0.883 4.794 8.263 1.00 21.26 C ATOM 634 CD2 TYR A 69 -1.158 4.399 7.094 1.00 20.28 C ATOM 635 CE1 TYR A 69 1.139 3.423 8.281 1.00 21.45 C ATOM 636 CE2 TYR A 69 -0.913 3.022 7.114 1.00 20.55 C ATOM 637 CZ TYR A 69 0.234 2.544 7.709 1.00 20.52 C ATOM 638 OH TYR A 69 0.489 1.192 7.727 1.00 20.18 O ATOM 639 HH TYR A 69 1.348 1.026 8.190 1.00 0.00 H ATOM 640 H TYR A 69 -1.691 6.832 5.331 1.00 0.00 H ATOM 641 N GLN A 70 1.593 5.785 5.431 1.00 21.62 N ATOM 642 CA GLN A 70 2.867 5.063 5.285 1.00 21.40 C ATOM 643 C GLN A 70 3.902 5.792 4.424 1.00 21.85 C ATOM 644 O GLN A 70 5.051 5.342 4.308 1.00 21.64 O ATOM 645 CB GLN A 70 2.645 3.609 4.815 1.00 20.91 C ATOM 646 CG GLN A 70 2.239 3.428 3.364 1.00 21.87 C ATOM 647 CD GLN A 70 0.733 3.438 3.158 1.00 23.89 C ATOM 648 OE1 GLN A 70 0.005 4.242 3.755 1.00 25.07 O ATOM 649 NE2 GLN A 70 0.256 2.543 2.305 1.00 22.80 N ATOM 650 HE22 GLN A 70 0.903 1.886 1.825 1.00 0.00 H ATOM 651 HE21 GLN A 70 -0.766 2.498 2.116 1.00 0.00 H ATOM 652 H GLN A 70 0.738 5.393 4.987 1.00 0.00 H ATOM 653 N LEU A 71 3.505 6.936 3.866 1.00 22.41 N ATOM 654 CA LEU A 71 4.353 7.698 2.942 1.00 23.32 C ATOM 655 C LEU A 71 4.734 9.072 3.471 1.00 23.99 C ATOM 656 O LEU A 71 5.431 9.839 2.808 1.00 24.53 O ATOM 657 CB LEU A 71 3.639 7.865 1.600 1.00 23.81 C ATOM 658 CG LEU A 71 2.982 6.622 1.009 1.00 23.70 C ATOM 659 CD1 LEU A 71 2.067 7.050 -0.117 1.00 24.47 C ATOM 660 CD2 LEU A 71 4.033 5.613 0.548 1.00 22.64 C ATOM 661 H LEU A 71 2.559 7.302 4.094 1.00 0.00 H ATOM 662 N LEU A 72 4.269 9.382 4.672 1.00 24.56 N ATOM 663 CA LEU A 72 4.515 10.696 5.266 1.00 25.71 C ATOM 664 C LEU A 72 5.974 10.939 5.664 1.00 26.07 C ATOM 665 O LEU A 72 6.472 12.045 5.534 1.00 27.53 O ATOM 666 CB LEU A 72 3.558 10.958 6.435 1.00 25.71 C ATOM 667 CG LEU A 72 2.126 11.210 5.957 1.00 25.41 C ATOM 668 CD1 LEU A 72 1.130 11.041 7.092 1.00 25.25 C ATOM 669 CD2 LEU A 72 1.984 12.585 5.296 1.00 24.88 C ATOM 670 H LEU A 72 3.718 8.677 5.203 1.00 0.00 H ATOM 671 N SER A 73 6.666 9.916 6.133 1.00 25.32 N ATOM 672 CA SER A 73 8.082 10.073 6.385 1.00 25.75 C ATOM 673 C SER A 73 8.876 9.878 5.105 1.00 25.70 C ATOM 674 O SER A 73 9.845 10.605 4.852 1.00 26.12 O ATOM 675 CB SER A 73 8.542 9.125 7.483 1.00 25.58 C ATOM 676 OG SER A 73 8.064 9.590 8.737 1.00 26.52 O ATOM 677 HG SER A 73 8.363 8.974 9.452 1.00 0.00 H ATOM 678 H SER A 73 6.197 9.006 6.319 1.00 0.00 H ATOM 679 N ALA A 74 8.435 8.921 4.290 1.00 24.89 N ATOM 680 CA ALA A 74 9.122 8.553 3.050 1.00 25.34 C ATOM 681 C ALA A 74 9.240 9.682 2.026 1.00 26.68 C ATOM 682 O ALA A 74 10.157 9.668 1.206 1.00 27.40 O ATOM 683 CB ALA A 74 8.473 7.341 2.422 1.00 24.05 C ATOM 684 H ALA A 74 7.564 8.413 4.546 1.00 0.00 H ATOM 685 N CYS A 75 8.326 10.653 2.068 1.00 27.56 N ATOM 686 CA CYS A 75 8.324 11.754 1.095 1.00 28.90 C ATOM 687 C CYS A 75 9.475 12.733 1.307 1.00 30.29 C ATOM 688 O CYS A 75 9.872 13.458 0.383 1.00 31.72 O ATOM 689 CB CYS A 75 6.973 12.488 1.075 1.00 29.29 C ATOM 690 SG CYS A 75 6.561 13.481 2.545 1.00 31.24 S ATOM 691 H CYS A 75 7.596 10.630 2.809 1.00 0.00 H ATOM 692 N GLU A 76 10.003 12.754 2.527 1.00 30.33 N ATOM 693 CA GLU A 76 11.182 13.538 2.861 1.00 31.55 C ATOM 694 C GLU A 76 12.450 12.978 2.217 1.00 31.74 C ATOM 695 O GLU A 76 13.423 13.704 2.034 1.00 33.09 O ATOM 696 CB GLU A 76 11.366 13.580 4.382 1.00 31.69 C ATOM 697 CG GLU A 76 10.185 14.181 5.157 1.00 33.20 C ATOM 698 CD GLU A 76 9.917 15.670 4.849 1.00 36.33 C ATOM 699 OE1 GLU A 76 10.738 16.324 4.159 1.00 38.25 O ATOM 700 OE2 GLU A 76 8.874 16.189 5.308 1.00 36.76 O ATOM 701 H GLU A 76 9.554 12.186 3.274 1.00 0.00 H ATOM 702 N SER A 77 12.423 11.690 1.867 1.00 30.52 N ATOM 703 CA SER A 77 13.617 10.943 1.506 1.00 30.14 C ATOM 704 C SER A 77 13.617 10.418 0.078 1.00 29.78 C ATOM 705 O SER A 77 14.603 9.839 -0.365 1.00 30.53 O ATOM 706 CB SER A 77 13.773 9.763 2.462 1.00 29.64 C ATOM 707 OG SER A 77 14.154 10.196 3.755 1.00 30.83 O ATOM 708 HG SER A 77 14.247 9.411 4.351 1.00 0.00 H ATOM 709 H SER A 77 11.506 11.199 1.852 1.00 0.00 H ATOM 710 N PHE A 78 12.512 10.587 -0.636 1.00 28.93 N ATOM 711 CA PHE A 78 12.413 10.107 -2.012 1.00 28.54 C ATOM 712 C PHE A 78 11.763 11.154 -2.907 1.00 29.24 C ATOM 713 O PHE A 78 10.705 11.677 -2.583 1.00 28.82 O ATOM 714 CB PHE A 78 11.653 8.772 -2.078 1.00 27.29 C ATOM 715 CG PHE A 78 12.362 7.630 -1.377 1.00 26.58 C ATOM 716 CD1 PHE A 78 13.147 6.739 -2.093 1.00 26.96 C ATOM 717 CD2 PHE A 78 12.250 7.457 -0.001 1.00 25.18 C ATOM 718 CE1 PHE A 78 13.816 5.692 -1.452 1.00 26.47 C ATOM 719 CE2 PHE A 78 12.909 6.428 0.643 1.00 25.36 C ATOM 720 CZ PHE A 78 13.696 5.539 -0.082 1.00 25.58 C ATOM 721 H PHE A 78 11.698 11.072 -0.207 1.00 0.00 H ATOM 722 N LYS A 79 12.414 11.464 -4.028 1.00 30.46 N ATOM 723 CA LYS A 79 11.903 12.460 -4.966 1.00 31.54 C ATOM 724 C LYS A 79 10.590 11.991 -5.579 1.00 30.54 C ATOM 725 O LYS A 79 9.665 12.778 -5.764 1.00 31.20 O ATOM 726 CB LYS A 79 12.934 12.774 -6.056 1.00 32.87 C ATOM 727 CG LYS A 79 14.027 13.759 -5.621 1.00 35.17 C ATOM 728 CD LYS A 79 14.992 14.133 -6.764 1.00 36.58 C ATOM 729 CE LYS A 79 16.177 13.168 -6.816 1.00 37.94 C ATOM 730 NZ LYS A 79 17.206 13.524 -7.843 1.00 40.68 N ATOM 731 HZ1 LYS A 79 16.767 13.524 -8.786 1.00 0.00 H ATOM 732 HZ2 LYS A 79 17.587 14.469 -7.637 1.00 0.00 H ATOM 733 HZ3 LYS A 79 17.976 12.825 -7.818 1.00 0.00 H ATOM 734 H LYS A 79 13.311 10.983 -4.241 1.00 0.00 H ATOM 735 N GLU A 80 10.497 10.698 -5.853 1.00 29.38 N ATOM 736 CA GLU A 80 9.342 10.147 -6.540 1.00 28.71 C ATOM 737 C GLU A 80 8.776 8.955 -5.795 1.00 27.08 C ATOM 738 O GLU A 80 9.504 8.021 -5.441 1.00 27.04 O ATOM 739 CB GLU A 80 9.725 9.749 -7.971 1.00 29.66 C ATOM 740 CG GLU A 80 10.223 10.931 -8.813 1.00 32.22 C ATOM 741 CD GLU A 80 11.141 10.527 -9.961 1.00 35.28 C ATOM 742 OE1 GLU A 80 11.429 11.409 -10.811 1.00 36.29 O ATOM 743 OE2 GLU A 80 11.575 9.346 -10.010 1.00 34.20 O ATOM 744 H GLU A 80 11.270 10.062 -5.569 1.00 0.00 H ATOM 745 N ILE A 81 7.473 8.995 -5.545 1.00 25.80 N ATOM 746 CA ILE A 81 6.777 7.853 -4.991 1.00 23.86 C ATOM 747 C ILE A 81 5.766 7.373 -6.036 1.00 24.15 C ATOM 748 O ILE A 81 5.108 8.181 -6.687 1.00 25.08 O ATOM 749 CB ILE A 81 6.078 8.202 -3.650 1.00 23.19 C ATOM 750 CG1 ILE A 81 7.113 8.546 -2.574 1.00 22.31 C ATOM 751 CG2 ILE A 81 5.178 7.053 -3.186 1.00 22.00 C ATOM 752 CD1 ILE A 81 6.535 9.088 -1.292 1.00 22.06 C ATOM 753 H ILE A 81 6.941 9.865 -5.751 1.00 0.00 H ATOM 754 N VAL A 82 5.674 6.060 -6.219 1.00 23.38 N ATOM 755 CA VAL A 82 4.638 5.462 -7.050 1.00 23.06 C ATOM 756 C VAL A 82 3.800 4.618 -6.113 1.00 22.37 C ATOM 757 O VAL A 82 4.348 3.803 -5.374 1.00 22.29 O ATOM 758 CB VAL A 82 5.250 4.576 -8.171 1.00 23.63 C ATOM 759 CG1 VAL A 82 4.163 3.830 -8.946 1.00 22.17 C ATOM 760 CG2 VAL A 82 6.114 5.419 -9.102 1.00 23.32 C ATOM 761 H VAL A 82 6.365 5.438 -5.753 1.00 0.00 H ATOM 762 N VAL A 83 2.486 4.835 -6.096 1.00 22.43 N ATOM 763 CA VAL A 83 1.621 4.027 -5.241 1.00 22.20 C ATOM 764 C VAL A 83 0.784 3.081 -6.049 1.00 22.59 C ATOM 765 O VAL A 83 0.381 3.396 -7.171 1.00 23.26 O ATOM 766 CB VAL A 83 0.701 4.848 -4.343 1.00 21.99 C ATOM 767 CG1 VAL A 83 1.456 5.315 -3.140 1.00 22.02 C ATOM 768 CG2 VAL A 83 0.099 6.015 -5.114 1.00 23.85 C ATOM 769 H VAL A 83 2.075 5.581 -6.693 1.00 0.00 H ATOM 770 N THR A 84 0.531 1.921 -5.450 1.00 22.42 N ATOM 771 CA THR A 84 -0.089 0.787 -6.126 1.00 23.25 C ATOM 772 C THR A 84 -0.945 -0.003 -5.160 1.00 22.98 C ATOM 773 O THR A 84 -0.548 -0.270 -4.028 1.00 22.50 O ATOM 774 CB THR A 84 0.960 -0.210 -6.712 1.00 23.46 C ATOM 775 OG1 THR A 84 1.553 -0.977 -5.654 1.00 23.69 O ATOM 776 CG2 THR A 84 2.075 0.502 -7.496 1.00 23.71 C ATOM 777 HG1 THR A 84 2.003 -0.367 -5.018 1.00 0.00 H ATOM 778 H THR A 84 0.789 1.817 -4.448 1.00 0.00 H ATOM 779 N ASP A 85 -2.132 -0.366 -5.612 1.00 23.97 N ATOM 780 CA ASP A 85 -2.905 -1.377 -4.940 1.00 24.14 C ATOM 781 C ASP A 85 -3.550 -2.216 -6.019 1.00 25.40 C ATOM 782 O ASP A 85 -3.555 -1.833 -7.196 1.00 25.97 O ATOM 783 CB ASP A 85 -3.943 -0.757 -4.007 1.00 24.14 C ATOM 784 CG ASP A 85 -4.481 -1.753 -2.999 1.00 24.62 C ATOM 785 OD1 ASP A 85 -3.784 -2.046 -2.009 1.00 25.33 O ATOM 786 OD2 ASP A 85 -5.605 -2.253 -3.192 1.00 25.95 O ATOM 787 H ASP A 85 -2.514 0.086 -6.467 1.00 0.00 H ATOM 788 N TYR A 86 -4.065 -3.374 -5.623 1.00 25.95 N ATOM 789 CA TYR A 86 -4.779 -4.255 -6.540 1.00 27.18 C ATOM 790 C TYR A 86 -6.211 -3.786 -6.792 1.00 27.88 C ATOM 791 O TYR A 86 -6.830 -4.205 -7.761 1.00 29.08 O ATOM 792 CB TYR A 86 -4.770 -5.704 -6.021 1.00 27.60 C ATOM 793 CG TYR A 86 -5.536 -6.672 -6.899 1.00 29.31 C ATOM 794 CD1 TYR A 86 -4.997 -7.120 -8.105 1.00 31.55 C ATOM 795 CD2 TYR A 86 -6.800 -7.126 -6.536 1.00 29.17 C ATOM 796 CE1 TYR A 86 -5.703 -8.000 -8.934 1.00 33.65 C ATOM 797 CE2 TYR A 86 -7.504 -8.002 -7.344 1.00 31.69 C ATOM 798 CZ TYR A 86 -6.953 -8.439 -8.544 1.00 33.20 C ATOM 799 OH TYR A 86 -7.645 -9.311 -9.358 1.00 34.71 O ATOM 800 HH TYR A 86 -8.502 -8.897 -9.631 1.00 0.00 H ATOM 801 H TYR A 86 -3.956 -3.661 -4.629 1.00 0.00 H ATOM 802 N SER A 87 -6.736 -2.917 -5.935 1.00 27.41 N ATOM 803 CA SER A 87 -8.158 -2.595 -5.992 1.00 28.92 C ATOM 804 C SER A 87 -8.459 -1.137 -6.295 1.00 28.88 C ATOM 805 O SER A 87 -8.064 -0.242 -5.549 1.00 27.64 O ATOM 806 CB SER A 87 -8.854 -3.032 -4.702 1.00 29.13 C ATOM 807 OG SER A 87 -8.416 -2.257 -3.600 1.00 29.68 O ATOM 808 HG SER A 87 -7.439 -2.369 -3.487 1.00 0.00 H ATOM 809 H SER A 87 -6.131 -2.464 -5.221 1.00 0.00 H ATOM 810 N ASP A 88 -9.193 -0.924 -7.385 1.00 30.31 N ATOM 811 CA ASP A 88 -9.480 0.412 -7.906 1.00 30.74 C ATOM 812 C ASP A 88 -10.241 1.289 -6.935 1.00 29.89 C ATOM 813 O ASP A 88 -10.072 2.502 -6.952 1.00 29.57 O ATOM 814 CB ASP A 88 -10.237 0.324 -9.236 1.00 32.94 C ATOM 815 CG ASP A 88 -9.486 -0.489 -10.275 1.00 35.39 C ATOM 816 OD1 ASP A 88 -8.300 -0.821 -10.011 1.00 38.30 O ATOM 817 OD2 ASP A 88 -10.071 -0.803 -11.339 1.00 36.76 O ATOM 818 H ASP A 88 -9.581 -1.746 -7.890 1.00 0.00 H ATOM 819 N GLN A 89 -11.079 0.679 -6.098 1.00 29.52 N ATOM 820 CA GLN A 89 -11.806 1.427 -5.073 1.00 29.36 C ATOM 821 C GLN A 89 -10.863 2.091 -4.079 1.00 27.82 C ATOM 822 O GLN A 89 -11.135 3.189 -3.592 1.00 28.07 O ATOM 823 CB GLN A 89 -12.805 0.547 -4.329 1.00 29.86 C ATOM 824 CG GLN A 89 -12.189 -0.438 -3.357 1.00 29.31 C ATOM 825 CD GLN A 89 -12.083 -1.823 -3.926 1.00 32.29 C ATOM 826 OE1 GLN A 89 -11.501 -2.030 -5.004 1.00 34.36 O ATOM 827 NE2 GLN A 89 -12.653 -2.793 -3.216 1.00 31.83 N ATOM 828 HE22 GLN A 89 -13.129 -2.570 -2.319 1.00 0.00 H ATOM 829 HE21 GLN A 89 -12.623 -3.775 -3.558 1.00 0.00 H ATOM 830 H GLN A 89 -11.219 -0.349 -6.175 1.00 0.00 H ATOM 831 N ASN A 90 -9.752 1.416 -3.800 1.00 26.77 N ATOM 832 CA ASN A 90 -8.735 1.905 -2.892 1.00 25.33 C ATOM 833 C ASN A 90 -7.904 3.018 -3.507 1.00 25.55 C ATOM 834 O ASN A 90 -7.562 4.000 -2.822 1.00 24.82 O ATOM 835 CB ASN A 90 -7.858 0.747 -2.439 1.00 24.07 C ATOM 836 CG ASN A 90 -8.563 -0.151 -1.429 1.00 24.99 C ATOM 837 OD1 ASN A 90 -8.394 -1.376 -1.434 1.00 25.12 O ATOM 838 ND2 ASN A 90 -9.356 0.457 -0.551 1.00 25.05 N ATOM 839 HD22 ASN A 90 -9.470 1.490 -0.582 1.00 0.00 H ATOM 840 HD21 ASN A 90 -9.862 -0.101 0.166 1.00 0.00 H ATOM 841 H ASN A 90 -9.606 0.493 -4.256 1.00 0.00 H ATOM 842 N LEU A 91 -7.598 2.870 -4.800 1.00 26.27 N ATOM 843 CA LEU A 91 -6.842 3.883 -5.525 1.00 27.08 C ATOM 844 C LEU A 91 -7.660 5.164 -5.713 1.00 28.43 C ATOM 845 O LEU A 91 -7.100 6.257 -5.779 1.00 28.39 O ATOM 846 CB LEU A 91 -6.354 3.357 -6.876 1.00 27.74 C ATOM 847 CG LEU A 91 -5.472 2.104 -6.945 1.00 27.85 C ATOM 848 CD1 LEU A 91 -5.079 1.835 -8.398 1.00 27.98 C ATOM 849 CD2 LEU A 91 -4.229 2.208 -6.055 1.00 27.03 C ATOM 850 H LEU A 91 -7.907 2.012 -5.300 1.00 0.00 H ATOM 851 N GLN A 92 -8.982 5.015 -5.791 1.00 30.06 N ATOM 852 CA GLN A 92 -9.901 6.141 -5.888 1.00 31.77 C ATOM 853 C GLN A 92 -10.036 6.907 -4.565 1.00 31.71 C ATOM 854 O GLN A 92 -10.165 8.142 -4.581 1.00 32.35 O ATOM 855 CB GLN A 92 -11.266 5.670 -6.364 1.00 32.88 C ATOM 856 CG GLN A 92 -11.343 5.413 -7.850 1.00 36.01 C ATOM 857 CD GLN A 92 -12.599 4.643 -8.251 1.00 39.20 C ATOM 858 OE1 GLN A 92 -13.687 4.886 -7.722 1.00 40.52 O ATOM 859 NE2 GLN A 92 -12.449 3.707 -9.194 1.00 39.77 N ATOM 860 HE22 GLN A 92 -11.512 3.536 -9.613 1.00 0.00 H ATOM 861 HE21 GLN A 92 -13.269 3.150 -9.509 1.00 0.00 H ATOM 862 H GLN A 92 -9.375 4.052 -5.782 1.00 0.00 H ATOM 863 N GLU A 93 -10.026 6.190 -3.435 1.00 30.95 N ATOM 864 CA GLU A 93 -10.050 6.851 -2.123 1.00 31.13 C ATOM 865 C GLU A 93 -8.766 7.618 -1.893 1.00 30.76 C ATOM 866 O GLU A 93 -8.772 8.731 -1.358 1.00 31.10 O ATOM 867 CB GLU A 93 -10.251 5.864 -0.973 1.00 30.39 C ATOM 868 CG GLU A 93 -11.619 5.928 -0.298 1.00 31.57 C ATOM 869 CD GLU A 93 -11.996 7.308 0.248 1.00 32.11 C ATOM 870 OE1 GLU A 93 -13.131 7.738 -0.029 1.00 34.19 O ATOM 871 OE2 GLU A 93 -11.190 7.959 0.955 1.00 32.04 O ATOM 872 H GLU A 93 -10.001 5.152 -3.486 1.00 0.00 H ATOM 873 N LEU A 94 -7.666 7.000 -2.305 1.00 30.47 N ATOM 874 CA LEU A 94 -6.339 7.580 -2.198 1.00 30.19 C ATOM 875 C LEU A 94 -6.151 8.792 -3.133 1.00 31.42 C ATOM 876 O LEU A 94 -5.435 9.736 -2.789 1.00 31.58 O ATOM 877 CB LEU A 94 -5.323 6.470 -2.462 1.00 29.32 C ATOM 878 CG LEU A 94 -3.982 6.659 -3.156 1.00 29.67 C ATOM 879 CD1 LEU A 94 -3.044 7.502 -2.324 1.00 30.16 C ATOM 880 CD2 LEU A 94 -3.383 5.287 -3.393 1.00 28.84 C ATOM 881 H LEU A 94 -7.759 6.053 -2.725 1.00 0.00 H ATOM 882 N GLU A 95 -6.796 8.755 -4.306 1.00 32.28 N ATOM 883 CA GLU A 95 -6.780 9.861 -5.270 1.00 33.33 C ATOM 884 C GLU A 95 -7.633 11.029 -4.807 1.00 33.42 C ATOM 885 O GLU A 95 -7.353 12.181 -5.146 1.00 33.96 O ATOM 886 CB GLU A 95 -7.280 9.395 -6.634 1.00 34.05 C ATOM 887 CG GLU A 95 -6.205 8.814 -7.541 1.00 35.28 C ATOM 888 CD GLU A 95 -6.757 8.351 -8.895 1.00 36.65 C ATOM 889 OE1 GLU A 95 -7.992 8.154 -9.025 1.00 37.97 O ATOM 890 OE2 GLU A 95 -5.945 8.174 -9.834 1.00 39.61 O ATOM 891 H GLU A 95 -7.336 7.899 -4.546 1.00 0.00 H ATOM 892 N LYS A 96 -8.694 10.721 -4.060 1.00 32.93 N ATOM 893 CA LYS A 96 -9.506 11.748 -3.412 1.00 33.20 C ATOM 894 C LYS A 96 -8.591 12.637 -2.579 1.00 32.52 C ATOM 895 O LYS A 96 -8.667 13.863 -2.657 1.00 33.30 O ATOM 896 CB LYS A 96 -10.585 11.134 -2.508 1.00 33.11 C ATOM 897 CG LYS A 96 -11.915 10.785 -3.179 1.00 33.90 C ATOM 898 CD LYS A 96 -12.927 10.333 -2.110 1.00 33.82 C ATOM 899 CE LYS A 96 -14.072 9.495 -2.696 1.00 33.97 C ATOM 900 NZ LYS A 96 -15.002 9.008 -1.631 1.00 33.04 N ATOM 901 HZ1 LYS A 96 -14.475 8.417 -0.956 1.00 0.00 H ATOM 902 HZ2 LYS A 96 -15.414 9.823 -1.133 1.00 0.00 H ATOM 903 HZ3 LYS A 96 -15.762 8.446 -2.066 1.00 0.00 H ATOM 904 H LYS A 96 -8.951 9.721 -3.935 1.00 0.00 H ATOM 905 N TRP A 97 -7.714 12.001 -1.804 1.00 30.71 N ATOM 906 CA TRP A 97 -6.805 12.715 -0.915 1.00 30.00 C ATOM 907 C TRP A 97 -5.669 13.446 -1.645 1.00 29.49 C ATOM 908 O TRP A 97 -5.356 14.589 -1.311 1.00 30.01 O ATOM 909 CB TRP A 97 -6.258 11.779 0.166 1.00 29.01 C ATOM 910 CG TRP A 97 -5.616 12.528 1.276 1.00 29.74 C ATOM 911 CD1 TRP A 97 -6.225 13.031 2.394 1.00 31.06 C ATOM 912 CD2 TRP A 97 -4.243 12.903 1.365 1.00 29.89 C ATOM 913 NE1 TRP A 97 -5.304 13.679 3.190 1.00 30.51 N ATOM 914 CE2 TRP A 97 -4.080 13.614 2.580 1.00 30.28 C ATOM 915 CE3 TRP A 97 -3.126 12.693 0.546 1.00 29.44 C ATOM 916 CZ2 TRP A 97 -2.845 14.114 2.994 1.00 30.56 C ATOM 917 CZ3 TRP A 97 -1.899 13.191 0.958 1.00 29.86 C ATOM 918 CH2 TRP A 97 -1.768 13.894 2.173 1.00 30.28 C ATOM 919 HE1 TRP A 97 -5.505 14.140 4.100 1.00 0.00 H ATOM 920 H TRP A 97 -7.676 10.962 -1.834 1.00 0.00 H ATOM 921 N LEU A 98 -5.064 12.787 -2.633 1.00 28.19 N ATOM 922 CA LEU A 98 -3.977 13.380 -3.417 1.00 28.00 C ATOM 923 C LEU A 98 -4.412 14.646 -4.149 1.00 28.89 C ATOM 924 O LEU A 98 -3.626 15.566 -4.293 1.00 29.10 O ATOM 925 CB LEU A 98 -3.417 12.368 -4.412 1.00 27.55 C ATOM 926 CG LEU A 98 -2.730 11.162 -3.769 1.00 27.54 C ATOM 927 CD1 LEU A 98 -2.616 10.008 -4.749 1.00 27.54 C ATOM 928 CD2 LEU A 98 -1.354 11.537 -3.186 1.00 28.43 C ATOM 929 H LEU A 98 -5.374 11.819 -2.855 1.00 0.00 H ATOM 930 N LYS A 99 -5.669 14.665 -4.603 1.00 29.22 N ATOM 931 CA LYS A 99 -6.300 15.832 -5.229 1.00 30.45 C ATOM 932 C LYS A 99 -6.943 16.789 -4.213 1.00 30.80 C ATOM 933 O LYS A 99 -7.640 17.729 -4.605 1.00 31.80 O ATOM 934 CB LYS A 99 -7.341 15.391 -6.269 1.00 31.17 C ATOM 935 CG LYS A 99 -6.734 14.781 -7.536 1.00 31.82 C ATOM 936 H LYS A 99 -6.235 13.798 -4.506 1.00 0.00 H ATOM 937 N ALA A 100 -6.697 16.542 -2.918 1.00 29.31 N ATOM 938 CA ALA A 100 -7.147 17.407 -1.825 1.00 29.43 C ATOM 939 C ALA A 100 -8.648 17.665 -1.867 1.00 30.30 C ATOM 940 O ALA A 100 -9.104 18.786 -1.644 1.00 31.73 O ATOM 941 CB ALA A 100 -6.372 18.724 -1.829 1.00 30.45 C ATOM 942 H ALA A 100 -6.156 15.688 -2.676 1.00 0.00 H ATOM 943 N ALA A 101 -9.417 16.623 -2.164 1.00 29.52 N ATOM 944 CA ALA A 101 -10.867 16.742 -2.231 1.00 30.37 C ATOM 945 C ALA A 101 -11.461 16.912 -0.831 1.00 30.43 C ATOM 946 O ALA A 101 -11.101 16.185 0.097 1.00 28.91 O ATOM 947 CB ALA A 101 -11.472 15.528 -2.940 1.00 29.78 C ATOM 948 H ALA A 101 -8.973 15.701 -2.353 1.00 0.00 H ATOM 949 N PRO A 102 -12.358 17.892 -0.662 1.00 31.99 N ATOM 950 CA PRO A 102 -13.048 18.066 0.613 1.00 32.80 C ATOM 951 C PRO A 102 -13.697 16.774 1.154 1.00 32.15 C ATOM 952 O PRO A 102 -13.867 16.634 2.373 1.00 32.03 O ATOM 953 CB PRO A 102 -14.109 19.119 0.286 1.00 34.69 C ATOM 954 CG PRO A 102 -13.498 19.907 -0.795 1.00 34.90 C ATOM 955 CD PRO A 102 -12.760 18.913 -1.636 1.00 33.57 C ATOM 956 N ALA A 103 -14.030 15.838 0.264 1.00 31.86 N ATOM 957 CA ALA A 103 -14.618 14.559 0.677 1.00 31.67 C ATOM 958 C ALA A 103 -13.589 13.455 1.009 1.00 30.08 C ATOM 959 O ALA A 103 -13.965 12.310 1.283 1.00 29.41 O ATOM 960 CB ALA A 103 -15.633 14.072 -0.366 1.00 32.47 C ATOM 961 H ALA A 103 -13.869 16.019 -0.747 1.00 0.00 H ATOM 962 N ALA A 104 -12.301 13.802 0.994 1.00 29.79 N ATOM 963 CA ALA A 104 -11.241 12.863 1.366 1.00 28.63 C ATOM 964 C ALA A 104 -11.177 12.654 2.882 1.00 28.75 C ATOM 965 O ALA A 104 -11.545 13.544 3.658 1.00 29.92 O ATOM 966 CB ALA A 104 -9.903 13.327 0.836 1.00 27.84 C ATOM 967 H ALA A 104 -12.042 14.768 0.710 1.00 0.00 H ATOM 968 N PHE A 105 -10.708 11.470 3.282 1.00 27.93 N ATOM 969 CA PHE A 105 -10.561 11.088 4.682 1.00 27.87 C ATOM 970 C PHE A 105 -9.708 12.110 5.390 1.00 28.39 C ATOM 971 O PHE A 105 -8.766 12.637 4.798 1.00 28.53 O ATOM 972 CB PHE A 105 -9.905 9.704 4.786 1.00 26.16 C ATOM 973 CG PHE A 105 -9.757 9.185 6.212 1.00 25.82 C ATOM 974 CD1 PHE A 105 -10.856 8.669 6.903 1.00 25.80 C ATOM 975 CD2 PHE A 105 -8.502 9.171 6.844 1.00 25.00 C ATOM 976 CE1 PHE A 105 -10.716 8.169 8.207 1.00 25.32 C ATOM 977 CE2 PHE A 105 -8.353 8.676 8.142 1.00 24.15 C ATOM 978 CZ PHE A 105 -9.461 8.176 8.827 1.00 23.88 C ATOM 979 H PHE A 105 -10.432 10.781 2.554 1.00 0.00 H ATOM 980 N ASP A 106 -10.038 12.386 6.651 1.00 29.36 N ATOM 981 CA ASP A 106 -9.237 13.309 7.448 1.00 30.05 C ATOM 982 C ASP A 106 -8.009 12.615 8.000 1.00 28.50 C ATOM 983 O ASP A 106 -8.108 11.773 8.907 1.00 28.47 O ATOM 984 CB ASP A 106 -10.042 13.953 8.577 1.00 31.63 C ATOM 985 CG ASP A 106 -9.264 15.062 9.280 1.00 34.65 C ATOM 986 OD1 ASP A 106 -8.385 15.667 8.622 1.00 38.08 O ATOM 987 OD2 ASP A 106 -9.518 15.333 10.480 1.00 36.37 O ATOM 988 H ASP A 106 -10.877 11.938 7.072 1.00 0.00 H ATOM 989 N TRP A 107 -6.856 12.973 7.442 1.00 27.53 N ATOM 990 CA TRP A 107 -5.572 12.411 7.859 1.00 25.90 C ATOM 991 C TRP A 107 -4.844 13.306 8.853 1.00 26.55 C ATOM 992 O TRP A 107 -3.830 12.913 9.421 1.00 26.06 O ATOM 993 CB TRP A 107 -4.682 12.174 6.645 1.00 24.46 C ATOM 994 CG TRP A 107 -5.030 10.938 5.900 1.00 23.83 C ATOM 995 CD1 TRP A 107 -5.578 10.867 4.655 1.00 23.13 C ATOM 996 CD2 TRP A 107 -4.869 9.574 6.349 1.00 22.43 C ATOM 997 NE1 TRP A 107 -5.772 9.552 4.300 1.00 22.92 N ATOM 998 CE2 TRP A 107 -5.336 8.738 5.315 1.00 21.57 C ATOM 999 CE3 TRP A 107 -4.367 8.981 7.520 1.00 22.29 C ATOM 1000 CZ2 TRP A 107 -5.323 7.339 5.412 1.00 20.25 C ATOM 1001 CZ3 TRP A 107 -4.352 7.580 7.613 1.00 20.42 C ATOM 1002 CH2 TRP A 107 -4.836 6.783 6.564 1.00 19.65 C ATOM 1003 HE1 TRP A 107 -6.185 9.226 3.403 1.00 0.00 H ATOM 1004 H TRP A 107 -6.868 13.680 6.679 1.00 0.00 H ATOM 1005 N SER A 108 -5.382 14.500 9.079 1.00 28.03 N ATOM 1006 CA SER A 108 -4.668 15.538 9.828 1.00 28.71 C ATOM 1007 C SER A 108 -4.167 15.175 11.234 1.00 28.60 C ATOM 1008 O SER A 108 -3.088 15.606 11.596 1.00 28.95 O ATOM 1009 CB SER A 108 -5.441 16.868 9.829 1.00 30.21 C ATOM 1010 OG SER A 108 -6.691 16.758 10.488 1.00 30.32 O ATOM 1011 HG SER A 108 -7.246 16.079 10.029 1.00 0.00 H ATOM 1012 H SER A 108 -6.335 14.703 8.715 1.00 0.00 H ATOM 1013 N PRO A 109 -4.924 14.379 12.027 1.00 28.65 N ATOM 1014 CA PRO A 109 -4.322 13.992 13.328 1.00 28.68 C ATOM 1015 C PRO A 109 -3.082 13.101 13.190 1.00 27.87 C ATOM 1016 O PRO A 109 -2.224 13.092 14.082 1.00 28.35 O ATOM 1017 CB PRO A 109 -5.442 13.232 14.040 1.00 28.51 C ATOM 1018 CG PRO A 109 -6.391 12.831 12.972 1.00 28.45 C ATOM 1019 CD PRO A 109 -6.282 13.823 11.855 1.00 28.36 C ATOM 1020 N VAL A 110 -3.002 12.371 12.076 1.00 27.08 N ATOM 1021 CA VAL A 110 -1.842 11.552 11.724 1.00 26.01 C ATOM 1022 C VAL A 110 -0.728 12.423 11.142 1.00 26.80 C ATOM 1023 O VAL A 110 0.472 12.197 11.401 1.00 26.63 O ATOM 1024 CB VAL A 110 -2.229 10.449 10.720 1.00 24.86 C ATOM 1025 CG1 VAL A 110 -1.005 9.887 10.032 1.00 24.05 C ATOM 1026 CG2 VAL A 110 -3.011 9.338 11.423 1.00 23.95 C ATOM 1027 H VAL A 110 -3.810 12.385 11.421 1.00 0.00 H ATOM 1028 N VAL A 111 -1.128 13.433 10.369 1.00 27.54 N ATOM 1029 CA VAL A 111 -0.169 14.339 9.748 1.00 28.02 C ATOM 1030 C VAL A 111 0.531 15.186 10.813 1.00 29.31 C ATOM 1031 O VAL A 111 1.737 15.416 10.729 1.00 29.94 O ATOM 1032 CB VAL A 111 -0.817 15.160 8.598 1.00 28.80 C ATOM 1033 CG1 VAL A 111 0.091 16.300 8.129 1.00 29.09 C ATOM 1034 CG2 VAL A 111 -1.170 14.218 7.420 1.00 26.94 C ATOM 1035 H VAL A 111 -2.145 13.578 10.206 1.00 0.00 H ATOM 1036 N THR A 112 -0.211 15.587 11.840 1.00 30.29 N ATOM 1037 CA THR A 112 0.347 16.344 12.961 1.00 31.67 C ATOM 1038 C THR A 112 1.289 15.485 13.781 1.00 31.41 C ATOM 1039 O THR A 112 2.318 15.971 14.255 1.00 32.26 O ATOM 1040 CB THR A 112 -0.742 16.891 13.911 1.00 32.86 C ATOM 1041 OG1 THR A 112 -1.899 17.279 13.162 1.00 33.55 O ATOM 1042 CG2 THR A 112 -0.221 18.101 14.680 1.00 34.29 C ATOM 1043 HG1 THR A 112 -2.255 16.493 12.677 1.00 0.00 H ATOM 1044 H THR A 112 -1.225 15.354 11.847 1.00 0.00 H ATOM 1045 N TYR A 113 0.941 14.212 13.956 1.00 30.61 N ATOM 1046 CA TYR A 113 1.804 13.300 14.699 1.00 30.48 C ATOM 1047 C TYR A 113 3.159 13.118 14.006 1.00 29.93 C ATOM 1048 O TYR A 113 4.199 13.096 14.671 1.00 30.25 O ATOM 1049 CB TYR A 113 1.119 11.944 14.942 1.00 30.02 C ATOM 1050 CG TYR A 113 1.853 11.057 15.934 1.00 30.40 C ATOM 1051 CD1 TYR A 113 1.714 11.248 17.313 1.00 32.37 C ATOM 1052 CD2 TYR A 113 2.699 10.035 15.495 1.00 29.47 C ATOM 1053 CE1 TYR A 113 2.400 10.439 18.228 1.00 32.39 C ATOM 1054 CE2 TYR A 113 3.383 9.216 16.399 1.00 29.16 C ATOM 1055 CZ TYR A 113 3.230 9.423 17.757 1.00 31.29 C ATOM 1056 OH TYR A 113 3.905 8.614 18.652 1.00 32.28 O ATOM 1057 HH TYR A 113 3.687 8.893 19.577 1.00 0.00 H ATOM 1058 H TYR A 113 0.045 13.864 13.559 1.00 0.00 H ATOM 1059 N VAL A 114 3.148 13.000 12.678 1.00 29.35 N ATOM 1060 CA VAL A 114 4.394 12.800 11.920 1.00 28.84 C ATOM 1061 C VAL A 114 5.239 14.081 11.922 1.00 30.60 C ATOM 1062 O VAL A 114 6.472 14.024 12.017 1.00 30.92 O ATOM 1063 CB VAL A 114 4.129 12.260 10.490 1.00 27.68 C ATOM 1064 CG1 VAL A 114 5.414 12.209 9.658 1.00 27.30 C ATOM 1065 CG2 VAL A 114 3.509 10.891 10.562 1.00 25.69 C ATOM 1066 H VAL A 114 2.243 13.050 12.168 1.00 0.00 H ATOM 1067 N CYS A 115 4.579 15.231 11.853 1.00 31.86 N ATOM 1068 CA CYS A 115 5.280 16.502 12.016 1.00 34.38 C ATOM 1069 C CYS A 115 5.971 16.639 13.384 1.00 35.94 C ATOM 1070 O CYS A 115 7.097 17.123 13.452 1.00 36.79 O ATOM 1071 CB CYS A 115 4.335 17.668 11.756 1.00 35.23 C ATOM 1072 SG CYS A 115 3.843 17.735 10.042 1.00 34.87 S ATOM 1073 H CYS A 115 3.553 15.227 11.681 1.00 0.00 H ATOM 1074 N ASP A 116 5.298 16.206 14.455 1.00 36.87 N ATOM 1075 CA ASP A 116 5.882 16.159 15.803 1.00 38.76 C ATOM 1076 C ASP A 116 7.200 15.404 15.819 1.00 38.64 C ATOM 1077 O ASP A 116 8.202 15.916 16.312 1.00 39.96 O ATOM 1078 CB ASP A 116 4.952 15.436 16.779 1.00 38.83 C ATOM 1079 CG ASP A 116 3.904 16.339 17.402 1.00 41.91 C ATOM 1080 OD1 ASP A 116 3.949 17.584 17.227 1.00 45.32 O ATOM 1081 OD2 ASP A 116 3.022 15.772 18.088 1.00 43.34 O ATOM 1082 H ASP A 116 4.316 15.888 14.328 1.00 0.00 H ATOM 1083 N LEU A 117 7.181 14.178 15.293 1.00 37.61 N ATOM 1084 CA LEU A 117 8.343 13.290 15.326 1.00 37.74 C ATOM 1085 C LEU A 117 9.578 13.944 14.725 1.00 39.24 C ATOM 1086 O LEU A 117 10.701 13.688 15.153 1.00 39.88 O ATOM 1087 CB LEU A 117 8.055 11.979 14.590 1.00 35.96 C ATOM 1088 CG LEU A 117 6.958 11.038 15.089 1.00 34.26 C ATOM 1089 CD1 LEU A 117 6.862 9.818 14.186 1.00 30.86 C ATOM 1090 CD2 LEU A 117 7.195 10.630 16.534 1.00 35.58 C ATOM 1091 H LEU A 117 6.307 13.841 14.842 1.00 0.00 H ATOM 1092 N GLU A 118 9.351 14.799 13.738 1.00 40.41 N ATOM 1093 CA GLU A 118 10.426 15.466 13.028 1.00 41.90 C ATOM 1094 C GLU A 118 10.646 16.883 13.564 1.00 44.37 C ATOM 1095 O GLU A 118 11.151 17.755 12.853 1.00 45.81 O ATOM 1096 CB GLU A 118 10.098 15.503 11.536 1.00 41.23 C ATOM 1097 CG GLU A 118 9.573 14.195 10.979 1.00 38.80 C ATOM 1098 CD GLU A 118 8.973 14.358 9.597 1.00 38.90 C ATOM 1099 OE1 GLU A 118 8.759 15.511 9.161 1.00 40.24 O ATOM 1100 OE2 GLU A 118 8.712 13.332 8.933 1.00 38.04 O ATOM 1101 H GLU A 118 8.368 14.999 13.463 1.00 0.00 H ATOM 1102 N GLY A 119 10.249 17.113 14.811 1.00 45.47 N ATOM 1103 CA GLY A 119 10.486 18.394 15.479 1.00 48.34 C ATOM 1104 C GLY A 119 9.852 19.618 14.839 1.00 49.92 C ATOM 1105 O GLY A 119 10.429 20.712 14.871 1.00 51.86 O ATOM 1106 H GLY A 119 9.754 16.359 15.329 1.00 0.00 H ATOM 1107 N ASN A 120 8.668 19.433 14.255 1.00 49.43 N ATOM 1108 CA ASN A 120 7.858 20.529 13.694 1.00 50.85 C ATOM 1109 C ASN A 120 8.624 21.549 12.844 1.00 52.39 C ATOM 1110 O ASN A 120 8.350 22.754 12.884 1.00 53.95 O ATOM 1111 CB ASN A 120 7.063 21.222 14.805 1.00 52.28 C ATOM 1112 CG ASN A 120 6.064 20.292 15.459 1.00 51.22 C ATOM 1113 OD1 ASN A 120 6.274 19.835 16.583 1.00 51.51 O ATOM 1114 ND2 ASN A 120 4.978 19.988 14.748 1.00 49.76 N ATOM 1115 HD22 ASN A 120 4.844 20.399 13.802 1.00 0.00 H ATOM 1116 HD21 ASN A 120 4.265 19.340 15.139 1.00 0.00 H ATOM 1117 H ASN A 120 8.296 18.464 14.192 1.00 0.00 H ATOM 1118 N ARG A 121 9.590 21.039 12.084 1.00 52.04 N ATOM 1119 CA ARG A 121 10.281 21.805 11.056 1.00 53.20 C ATOM 1120 C ARG A 121 9.275 22.299 10.012 1.00 52.85 C ATOM 1121 O ARG A 121 9.331 23.460 9.581 1.00 54.52 O ATOM 1122 CB ARG A 121 11.367 20.944 10.390 1.00 52.56 C ATOM 1123 CG ARG A 121 12.387 20.336 11.355 1.00 53.87 C ATOM 1124 CD ARG A 121 12.887 21.364 12.376 1.00 58.52 C ATOM 1125 NE ARG A 121 13.987 20.843 13.181 1.00 60.34 N ATOM 1126 CZ ARG A 121 15.258 21.212 13.052 1.00 62.82 C ATOM 1127 NH1 ARG A 121 15.612 22.126 12.148 1.00 64.21 N ATOM 1128 NH2 ARG A 121 16.180 20.668 13.837 1.00 63.83 N ATOM 1129 HE ARG A 121 13.761 20.133 13.907 1.00 0.00 H ATOM 1130 HH12 ARG A 121 16.609 22.407 12.056 1.00 0.00 H ATOM 1131 HH11 ARG A 121 14.891 22.558 11.535 1.00 0.00 H ATOM 1132 HH22 ARG A 121 17.176 20.951 13.742 1.00 0.00 H ATOM 1133 HH21 ARG A 121 15.906 19.959 14.547 1.00 0.00 H ATOM 1134 H ARG A 121 9.864 20.047 12.231 1.00 0.00 H ATOM 1135 N VAL A 122 8.353 21.414 9.622 1.00 50.55 N ATOM 1136 CA VAL A 122 7.272 21.762 8.692 1.00 49.93 C ATOM 1137 C VAL A 122 5.904 21.794 9.383 1.00 49.11 C ATOM 1138 O VAL A 122 5.654 21.026 10.319 1.00 48.45 O ATOM 1139 CB VAL A 122 7.215 20.804 7.461 1.00 48.26 C ATOM 1140 CG1 VAL A 122 8.421 21.015 6.552 1.00 49.00 C ATOM 1141 CG2 VAL A 122 7.106 19.340 7.899 1.00 46.83 C ATOM 1142 H VAL A 122 8.403 20.443 9.991 1.00 0.00 H ATOM 1143 N LYS A 123 5.032 22.691 8.925 1.00 48.99 N ATOM 1144 CA LYS A 123 3.626 22.657 9.313 1.00 47.94 C ATOM 1145 C LYS A 123 2.851 21.517 8.593 1.00 45.38 C ATOM 1146 O LYS A 123 3.341 20.926 7.617 1.00 44.28 O ATOM 1147 CB LYS A 123 2.977 24.016 9.051 1.00 49.73 C ATOM 1148 H LYS A 123 5.361 23.433 8.275 1.00 0.00 H ATOM 1149 N GLY A 124 1.653 21.210 9.093 1.00 43.93 N ATOM 1150 CA GLY A 124 0.756 20.238 8.468 1.00 41.25 C ATOM 1151 C GLY A 124 0.557 20.443 6.972 1.00 40.53 C ATOM 1152 O GLY A 124 0.929 19.576 6.184 1.00 39.39 O ATOM 1153 H GLY A 124 1.343 21.683 9.966 1.00 0.00 H ATOM 1154 N PRO A 125 -0.056 21.578 6.571 1.00 41.30 N ATOM 1155 CA PRO A 125 -0.223 21.970 5.170 1.00 41.13 C ATOM 1156 C PRO A 125 0.991 21.748 4.256 1.00 40.05 C ATOM 1157 O PRO A 125 0.805 21.430 3.082 1.00 39.38 O ATOM 1158 CB PRO A 125 -0.554 23.457 5.271 1.00 43.28 C ATOM 1159 CG PRO A 125 -1.303 23.556 6.530 1.00 43.97 C ATOM 1160 CD PRO A 125 -0.703 22.553 7.470 1.00 42.85 C ATOM 1161 N GLU A 126 2.205 21.922 4.772 1.00 39.74 N ATOM 1162 CA GLU A 126 3.407 21.718 3.953 1.00 39.29 C ATOM 1163 C GLU A 126 3.891 20.276 3.916 1.00 36.83 C ATOM 1164 O GLU A 126 4.525 19.855 2.948 1.00 36.17 O ATOM 1165 CB GLU A 126 4.536 22.672 4.353 1.00 40.99 C ATOM 1166 CG GLU A 126 4.618 23.893 3.441 1.00 43.93 C ATOM 1167 CD GLU A 126 5.304 25.087 4.089 1.00 47.74 C ATOM 1168 OE1 GLU A 126 5.127 26.219 3.578 1.00 48.58 O ATOM 1169 OE2 GLU A 126 6.013 24.898 5.109 1.00 49.13 O ATOM 1170 H GLU A 126 2.304 22.206 5.768 1.00 0.00 H ATOM 1171 N LYS A 127 3.585 19.529 4.973 1.00 35.62 N ATOM 1172 CA LYS A 127 3.838 18.091 5.017 1.00 33.57 C ATOM 1173 C LYS A 127 2.993 17.424 3.938 1.00 32.43 C ATOM 1174 O LYS A 127 3.507 16.662 3.121 1.00 31.36 O ATOM 1175 CB LYS A 127 3.477 17.532 6.394 1.00 32.88 C ATOM 1176 CG LYS A 127 3.871 16.081 6.589 1.00 31.98 C ATOM 1177 CD LYS A 127 5.327 15.962 7.057 1.00 33.36 C ATOM 1178 CE LYS A 127 6.024 14.805 6.372 1.00 31.28 C ATOM 1179 NZ LYS A 127 7.386 14.596 6.905 1.00 31.55 N ATOM 1180 HZ1 LYS A 127 7.952 15.456 6.754 1.00 0.00 H ATOM 1181 HZ2 LYS A 127 7.331 14.390 7.923 1.00 0.00 H ATOM 1182 HZ3 LYS A 127 7.831 13.796 6.412 1.00 0.00 H ATOM 1183 H LYS A 127 3.149 19.986 5.799 1.00 0.00 H ATOM 1184 N GLU A 128 1.698 17.750 3.950 1.00 32.42 N ATOM 1185 CA GLU A 128 0.726 17.283 2.967 1.00 31.97 C ATOM 1186 C GLU A 128 1.128 17.648 1.540 1.00 31.86 C ATOM 1187 O GLU A 128 1.133 16.794 0.658 1.00 30.98 O ATOM 1188 CB GLU A 128 -0.670 17.834 3.286 1.00 32.48 C ATOM 1189 CG GLU A 128 -1.368 17.127 4.469 1.00 32.76 C ATOM 1190 CD GLU A 128 -2.834 17.548 4.653 1.00 33.84 C ATOM 1191 OE1 GLU A 128 -3.307 17.611 5.816 1.00 36.26 O ATOM 1192 OE2 GLU A 128 -3.513 17.832 3.640 1.00 36.28 O ATOM 1193 H GLU A 128 1.361 18.377 4.708 1.00 0.00 H ATOM 1194 N GLU A 129 1.491 18.909 1.331 1.00 32.69 N ATOM 1195 CA GLU A 129 1.878 19.399 0.021 1.00 33.10 C ATOM 1196 C GLU A 129 3.075 18.656 -0.558 1.00 32.07 C ATOM 1197 O GLU A 129 3.093 18.310 -1.743 1.00 32.01 O ATOM 1198 CB GLU A 129 2.176 20.896 0.080 1.00 35.00 C ATOM 1199 CG GLU A 129 2.441 21.512 -1.277 1.00 37.48 C ATOM 1200 CD GLU A 129 1.436 21.072 -2.356 1.00 39.81 C ATOM 1201 OE1 GLU A 129 1.836 21.044 -3.541 1.00 41.46 O ATOM 1202 OE2 GLU A 129 0.261 20.758 -2.034 1.00 39.84 O ATOM 1203 H GLU A 129 1.498 19.569 2.135 1.00 0.00 H ATOM 1204 N LYS A 130 4.077 18.426 0.278 1.00 31.27 N ATOM 1205 CA LYS A 130 5.253 17.670 -0.126 1.00 30.47 C ATOM 1206 C LYS A 130 4.901 16.250 -0.616 1.00 28.50 C ATOM 1207 O LYS A 130 5.420 15.820 -1.641 1.00 28.36 O ATOM 1208 CB LYS A 130 6.258 17.620 1.023 1.00 30.65 C ATOM 1209 CG LYS A 130 7.693 17.437 0.600 1.00 31.60 C ATOM 1210 CD LYS A 130 8.566 17.212 1.824 1.00 33.84 C ATOM 1211 CE LYS A 130 10.007 16.943 1.425 1.00 36.14 C ATOM 1212 NZ LYS A 130 10.725 18.198 1.057 1.00 39.84 N ATOM 1213 HZ1 LYS A 130 10.242 18.649 0.254 1.00 0.00 H ATOM 1214 HZ2 LYS A 130 10.727 18.846 1.870 1.00 0.00 H ATOM 1215 HZ3 LYS A 130 11.704 17.970 0.791 1.00 0.00 H ATOM 1216 H LYS A 130 4.022 18.796 1.249 1.00 0.00 H ATOM 1217 N LEU A 131 4.023 15.541 0.101 1.00 26.77 N ATOM 1218 CA LEU A 131 3.591 14.196 -0.307 1.00 25.43 C ATOM 1219 C LEU A 131 2.863 14.181 -1.650 1.00 26.02 C ATOM 1220 O LEU A 131 3.087 13.289 -2.483 1.00 25.09 O ATOM 1221 CB LEU A 131 2.692 13.545 0.750 1.00 24.70 C ATOM 1222 CG LEU A 131 2.182 12.116 0.459 1.00 23.52 C ATOM 1223 CD1 LEU A 131 3.350 11.187 0.164 1.00 23.11 C ATOM 1224 CD2 LEU A 131 1.301 11.545 1.593 1.00 22.35 C ATOM 1225 H LEU A 131 3.634 15.953 0.973 1.00 0.00 H ATOM 1226 N ARG A 132 1.986 15.164 -1.843 1.00 27.00 N ATOM 1227 CA ARG A 132 1.202 15.265 -3.060 1.00 27.97 C ATOM 1228 C ARG A 132 2.118 15.454 -4.273 1.00 29.11 C ATOM 1229 O ARG A 132 1.809 14.991 -5.379 1.00 29.74 O ATOM 1230 CB ARG A 132 0.191 16.418 -2.962 1.00 29.17 C ATOM 1231 CG ARG A 132 -0.836 16.237 -1.854 1.00 28.76 C ATOM 1232 CD ARG A 132 -2.074 17.118 -2.005 1.00 29.41 C ATOM 1233 NE ARG A 132 -3.144 16.578 -1.169 1.00 28.74 N ATOM 1234 CZ ARG A 132 -3.615 17.154 -0.070 1.00 30.02 C ATOM 1235 NH1 ARG A 132 -3.159 18.334 0.331 1.00 32.88 N ATOM 1236 NH2 ARG A 132 -4.573 16.562 0.619 1.00 29.39 N ATOM 1237 HE ARG A 132 -3.569 15.673 -1.457 1.00 0.00 H ATOM 1238 HH12 ARG A 132 -3.539 18.772 1.195 1.00 0.00 H ATOM 1239 HH11 ARG A 132 -2.422 18.821 -0.218 1.00 0.00 H ATOM 1240 HH22 ARG A 132 -4.946 17.009 1.481 1.00 0.00 H ATOM 1241 HH21 ARG A 132 -4.955 15.649 0.300 1.00 0.00 H ATOM 1242 H ARG A 132 1.859 15.880 -1.100 1.00 0.00 H ATOM 1243 N GLN A 133 3.240 16.133 -4.058 1.00 29.73 N ATOM 1244 CA GLN A 133 4.176 16.386 -5.128 1.00 31.04 C ATOM 1245 C GLN A 133 5.077 15.190 -5.344 1.00 29.87 C ATOM 1246 O GLN A 133 5.615 15.016 -6.426 1.00 30.91 O ATOM 1247 CB GLN A 133 5.006 17.643 -4.854 1.00 32.53 C ATOM 1248 CG GLN A 133 4.191 18.930 -4.798 1.00 35.87 C ATOM 1249 CD GLN A 133 5.024 20.121 -4.354 1.00 40.39 C ATOM 1250 OE1 GLN A 133 6.237 20.164 -4.571 1.00 42.04 O ATOM 1251 NE2 GLN A 133 4.375 21.098 -3.731 1.00 42.29 N ATOM 1252 HE22 GLN A 133 3.351 21.021 -3.568 1.00 0.00 H ATOM 1253 HE21 GLN A 133 4.891 21.940 -3.406 1.00 0.00 H ATOM 1254 H GLN A 133 3.447 16.488 -3.103 1.00 0.00 H ATOM 1255 N ALA A 134 5.246 14.370 -4.316 1.00 28.65 N ATOM 1256 CA ALA A 134 6.078 13.174 -4.426 1.00 27.78 C ATOM 1257 C ALA A 134 5.369 12.059 -5.182 1.00 27.05 C ATOM 1258 O ALA A 134 6.024 11.284 -5.876 1.00 27.46 O ATOM 1259 CB ALA A 134 6.513 12.686 -3.050 1.00 26.93 C ATOM 1260 H ALA A 134 4.777 14.582 -3.413 1.00 0.00 H ATOM 1261 N VAL A 135 4.041 11.976 -5.047 1.00 26.41 N ATOM 1262 CA VAL A 135 3.285 10.866 -5.631 1.00 25.68 C ATOM 1263 C VAL A 135 3.042 11.110 -7.114 1.00 27.16 C ATOM 1264 O VAL A 135 2.172 11.889 -7.488 1.00 28.10 O ATOM 1265 CB VAL A 135 1.976 10.563 -4.862 1.00 24.86 C ATOM 1266 CG1 VAL A 135 1.208 9.436 -5.526 1.00 24.14 C ATOM 1267 CG2 VAL A 135 2.282 10.185 -3.415 1.00 23.31 C ATOM 1268 H VAL A 135 3.535 12.714 -4.517 1.00 0.00 H ATOM 1269 N LYS A 136 3.844 10.448 -7.944 1.00 27.82 N ATOM 1270 CA LYS A 136 3.876 10.686 -9.387 1.00 29.54 C ATOM 1271 C LYS A 136 2.913 9.803 -10.175 1.00 29.87 C ATOM 1272 O LYS A 136 2.426 10.225 -11.226 1.00 31.26 O ATOM 1273 CB LYS A 136 5.289 10.480 -9.936 1.00 30.20 C ATOM 1274 CG LYS A 136 6.396 11.223 -9.195 1.00 31.26 C ATOM 1275 CD LYS A 136 6.296 12.745 -9.357 1.00 32.47 C ATOM 1276 CE LYS A 136 7.367 13.426 -8.523 1.00 32.78 C ATOM 1277 NZ LYS A 136 7.301 14.908 -8.594 1.00 34.10 N ATOM 1278 HZ1 LYS A 136 7.426 15.212 -9.581 1.00 0.00 H ATOM 1279 HZ2 LYS A 136 6.375 15.230 -8.245 1.00 0.00 H ATOM 1280 HZ3 LYS A 136 8.055 15.316 -8.006 1.00 0.00 H ATOM 1281 H LYS A 136 4.479 9.726 -7.548 1.00 0.00 H ATOM 1282 N GLN A 137 2.664 8.581 -9.687 1.00 28.97 N ATOM 1283 CA GLN A 137 1.769 7.625 -10.354 1.00 29.37 C ATOM 1284 C GLN A 137 0.962 6.762 -9.373 1.00 27.92 C ATOM 1285 O GLN A 137 1.453 6.345 -8.330 1.00 27.19 O ATOM 1286 CB GLN A 137 2.536 6.731 -11.350 1.00 29.79 C ATOM 1287 CG GLN A 137 3.155 7.474 -12.544 1.00 31.94 C ATOM 1288 CD GLN A 137 3.783 6.546 -13.572 1.00 33.39 C ATOM 1289 OE1 GLN A 137 3.079 5.895 -14.353 1.00 37.25 O ATOM 1290 NE2 GLN A 137 5.114 6.499 -13.597 1.00 34.28 N ATOM 1291 HE22 GLN A 137 5.667 7.064 -12.921 1.00 0.00 H ATOM 1292 HE21 GLN A 137 5.600 5.898 -14.293 1.00 0.00 H ATOM 1293 H GLN A 137 3.123 8.296 -8.798 1.00 0.00 H ATOM 1294 N VAL A 138 -0.288 6.502 -9.729 1.00 27.99 N ATOM 1295 CA VAL A 138 -1.166 5.643 -8.951 1.00 26.96 C ATOM 1296 C VAL A 138 -1.533 4.445 -9.835 1.00 26.93 C ATOM 1297 O VAL A 138 -2.226 4.589 -10.837 1.00 27.93 O ATOM 1298 CB VAL A 138 -2.430 6.409 -8.477 1.00 27.14 C ATOM 1299 CG1 VAL A 138 -3.313 5.519 -7.629 1.00 26.52 C ATOM 1300 CG2 VAL A 138 -2.038 7.641 -7.683 1.00 27.54 C ATOM 1301 H VAL A 138 -0.656 6.931 -10.602 1.00 0.00 H ATOM 1302 N LEU A 139 -1.043 3.265 -9.483 1.00 26.03 N ATOM 1303 CA LEU A 139 -1.133 2.140 -10.411 1.00 26.30 C ATOM 1304 C LEU A 139 -1.785 0.911 -9.843 1.00 25.99 C ATOM 1305 O LEU A 139 -1.819 0.700 -8.626 1.00 24.55 O ATOM 1306 CB LEU A 139 0.249 1.768 -10.966 1.00 26.23 C ATOM 1307 CG LEU A 139 1.001 2.853 -11.737 1.00 26.59 C ATOM 1308 CD1 LEU A 139 2.442 2.450 -11.958 1.00 26.66 C ATOM 1309 CD2 LEU A 139 0.310 3.196 -13.066 1.00 27.81 C ATOM 1310 H LEU A 139 -0.597 3.141 -8.552 1.00 0.00 H ATOM 1311 N LYS A 140 -2.341 0.129 -10.766 1.00 27.34 N ATOM 1312 CA LYS A 140 -2.780 -1.222 -10.471 1.00 27.55 C ATOM 1313 C LYS A 140 -1.541 -2.080 -10.204 1.00 27.42 C ATOM 1314 O LYS A 140 -0.584 -2.073 -10.984 1.00 28.09 O ATOM 1315 CB LYS A 140 -3.580 -1.777 -11.652 1.00 28.75 C ATOM 1316 CG LYS A 140 -4.143 -3.172 -11.442 1.00 28.63 C ATOM 1317 CD LYS A 140 -5.455 -3.157 -10.683 1.00 26.49 C ATOM 1318 CE LYS A 140 -6.021 -4.561 -10.613 1.00 26.52 C ATOM 1319 NZ LYS A 140 -7.479 -4.556 -10.337 1.00 26.69 N ATOM 1320 HZ1 LYS A 140 -7.657 -4.087 -9.426 1.00 0.00 H ATOM 1321 HZ2 LYS A 140 -7.972 -4.042 -11.095 1.00 0.00 H ATOM 1322 HZ3 LYS A 140 -7.826 -5.535 -10.297 1.00 0.00 H ATOM 1323 H LYS A 140 -2.465 0.499 -11.730 1.00 0.00 H ATOM 1324 N CYS A 141 -1.532 -2.793 -9.081 1.00 27.19 N ATOM 1325 CA CYS A 141 -0.451 -3.763 -8.855 1.00 27.98 C ATOM 1326 C CYS A 141 -1.025 -5.134 -8.502 1.00 28.15 C ATOM 1327 O CYS A 141 -2.191 -5.238 -8.126 1.00 28.04 O ATOM 1328 CB CYS A 141 0.561 -3.277 -7.813 1.00 26.79 C ATOM 1329 SG CYS A 141 0.335 -3.915 -6.124 1.00 29.16 S ATOM 1330 H CYS A 141 -2.281 -2.666 -8.371 1.00 0.00 H ATOM 1331 N ASP A 142 -0.205 -6.174 -8.648 1.00 28.81 N ATOM 1332 CA ASP A 142 -0.577 -7.541 -8.279 1.00 29.22 C ATOM 1333 C ASP A 142 0.688 -8.317 -7.887 1.00 29.28 C ATOM 1334 O ASP A 142 1.402 -8.853 -8.753 1.00 30.28 O ATOM 1335 CB ASP A 142 -1.317 -8.211 -9.442 1.00 30.79 C ATOM 1336 CG ASP A 142 -1.955 -9.559 -9.069 1.00 31.95 C ATOM 1337 OD1 ASP A 142 -1.395 -10.329 -8.254 1.00 30.45 O ATOM 1338 OD2 ASP A 142 -3.026 -9.858 -9.641 1.00 34.88 O ATOM 1339 H ASP A 142 0.743 -6.007 -9.042 1.00 0.00 H ATOM 1340 N VAL A 143 0.957 -8.379 -6.583 1.00 28.22 N ATOM 1341 CA VAL A 143 2.184 -8.998 -6.067 1.00 28.37 C ATOM 1342 C VAL A 143 2.394 -10.447 -6.522 1.00 30.15 C ATOM 1343 O VAL A 143 3.516 -10.954 -6.481 1.00 30.66 O ATOM 1344 CB VAL A 143 2.301 -8.921 -4.516 1.00 27.18 C ATOM 1345 CG1 VAL A 143 2.161 -7.510 -4.041 1.00 25.51 C ATOM 1346 CG2 VAL A 143 1.304 -9.840 -3.815 1.00 26.87 C ATOM 1347 H VAL A 143 0.275 -7.976 -5.909 1.00 0.00 H ATOM 1348 N THR A 144 1.322 -11.101 -6.964 1.00 31.38 N ATOM 1349 CA THR A 144 1.399 -12.497 -7.356 1.00 33.24 C ATOM 1350 C THR A 144 1.944 -12.648 -8.783 1.00 34.95 C ATOM 1351 O THR A 144 2.450 -13.710 -9.152 1.00 36.20 O ATOM 1352 CB THR A 144 0.029 -13.212 -7.206 1.00 34.13 C ATOM 1353 OG1 THR A 144 -0.873 -12.779 -8.236 1.00 35.59 O ATOM 1354 CG2 THR A 144 -0.583 -12.928 -5.832 1.00 32.87 C ATOM 1355 HG1 THR A 144 -1.008 -11.801 -8.165 1.00 0.00 H ATOM 1356 H THR A 144 0.412 -10.602 -7.030 1.00 0.00 H ATOM 1357 N GLN A 145 1.844 -11.589 -9.584 1.00 35.07 N ATOM 1358 CA GLN A 145 2.389 -11.610 -10.935 1.00 36.63 C ATOM 1359 C GLN A 145 3.895 -11.330 -10.915 1.00 36.53 C ATOM 1360 O GLN A 145 4.362 -10.504 -10.124 1.00 35.17 O ATOM 1361 CB GLN A 145 1.640 -10.617 -11.831 1.00 36.85 C ATOM 1362 CG GLN A 145 0.158 -10.921 -12.015 1.00 38.24 C ATOM 1363 CD GLN A 145 -0.121 -12.391 -12.342 1.00 41.81 C ATOM 1364 OE1 GLN A 145 -0.154 -13.246 -11.453 1.00 42.12 O ATOM 1365 NE2 GLN A 145 -0.337 -12.684 -13.622 1.00 44.20 N ATOM 1366 HE22 GLN A 145 -0.300 -11.933 -14.341 1.00 0.00 H ATOM 1367 HE21 GLN A 145 -0.543 -13.664 -13.904 1.00 0.00 H ATOM 1368 H GLN A 145 1.368 -10.731 -9.239 1.00 0.00 H ATOM 1369 N SER A 146 4.661 -12.018 -11.766 1.00 38.21 N ATOM 1370 CA SER A 146 6.124 -11.827 -11.769 1.00 38.46 C ATOM 1371 C SER A 146 6.569 -10.475 -12.348 1.00 38.05 C ATOM 1372 O SER A 146 7.680 -10.015 -12.081 1.00 38.08 O ATOM 1373 CB SER A 146 6.886 -13.019 -12.374 1.00 40.04 C ATOM 1374 OG SER A 146 6.357 -13.396 -13.620 1.00 41.76 O ATOM 1375 HG SER A 146 6.871 -14.163 -13.977 1.00 0.00 H ATOM 1376 H SER A 146 4.225 -12.690 -12.429 1.00 0.00 H ATOM 1377 N GLN A 147 5.695 -9.843 -13.123 1.00 38.18 N ATOM 1378 CA GLN A 147 5.772 -8.399 -13.351 1.00 37.34 C ATOM 1379 C GLN A 147 4.608 -7.745 -12.584 1.00 35.74 C ATOM 1380 O GLN A 147 3.526 -7.543 -13.151 1.00 36.37 O ATOM 1381 CB GLN A 147 5.680 -8.071 -14.837 1.00 38.72 C ATOM 1382 CG GLN A 147 6.866 -8.519 -15.660 1.00 40.75 C ATOM 1383 CD GLN A 147 6.864 -7.899 -17.049 1.00 42.98 C ATOM 1384 OE1 GLN A 147 5.936 -8.108 -17.835 1.00 45.04 O ATOM 1385 NE2 GLN A 147 7.900 -7.124 -17.354 1.00 43.20 N ATOM 1386 HE22 GLN A 147 8.660 -6.976 -16.660 1.00 0.00 H ATOM 1387 HE21 GLN A 147 7.950 -6.666 -18.286 1.00 0.00 H ATOM 1388 H GLN A 147 4.936 -10.388 -13.580 1.00 0.00 H ATOM 1389 N PRO A 148 4.817 -7.426 -11.289 1.00 33.86 N ATOM 1390 CA PRO A 148 3.715 -6.987 -10.424 1.00 32.58 C ATOM 1391 C PRO A 148 2.925 -5.814 -10.989 1.00 32.48 C ATOM 1392 O PRO A 148 1.718 -5.707 -10.726 1.00 32.17 O ATOM 1393 CB PRO A 148 4.428 -6.576 -9.130 1.00 31.09 C ATOM 1394 CG PRO A 148 5.671 -7.400 -9.116 1.00 31.48 C ATOM 1395 CD PRO A 148 6.099 -7.453 -10.555 1.00 33.41 C ATOM 1396 N LEU A 149 3.601 -4.960 -11.763 1.00 32.57 N ATOM 1397 CA LEU A 149 2.991 -3.753 -12.335 1.00 32.48 C ATOM 1398 C LEU A 149 2.491 -3.951 -13.764 1.00 34.07 C ATOM 1399 O LEU A 149 1.963 -3.025 -14.378 1.00 34.29 O ATOM 1400 CB LEU A 149 3.963 -2.577 -12.260 1.00 31.69 C ATOM 1401 CG LEU A 149 4.552 -2.348 -10.866 1.00 30.88 C ATOM 1402 CD1 LEU A 149 5.414 -1.112 -10.858 1.00 30.50 C ATOM 1403 CD2 LEU A 149 3.485 -2.254 -9.768 1.00 30.19 C ATOM 1404 H LEU A 149 4.601 -5.158 -11.969 1.00 0.00 H ATOM 1405 N GLY A 150 2.655 -5.169 -14.274 1.00 35.36 N ATOM 1406 CA GLY A 150 2.227 -5.530 -15.622 1.00 37.44 C ATOM 1407 C GLY A 150 3.001 -4.806 -16.700 1.00 38.63 C ATOM 1408 O GLY A 150 4.233 -4.800 -16.695 1.00 38.67 O ATOM 1409 H GLY A 150 3.109 -5.897 -13.686 1.00 0.00 H ATOM 1410 N ALA A 151 2.261 -4.195 -17.621 1.00 39.97 N ATOM 1411 CA ALA A 151 2.838 -3.430 -18.728 1.00 41.48 C ATOM 1412 C ALA A 151 3.668 -2.228 -18.256 1.00 40.76 C ATOM 1413 O ALA A 151 4.833 -2.097 -18.641 1.00 41.53 O ATOM 1414 CB ALA A 151 1.737 -2.981 -19.703 1.00 42.68 C ATOM 1415 H ALA A 151 1.226 -4.264 -17.552 1.00 0.00 H ATOM 1416 N VAL A 152 3.071 -1.376 -17.414 1.00 39.55 N ATOM 1417 CA VAL A 152 3.685 -0.110 -16.974 1.00 38.73 C ATOM 1418 C VAL A 152 5.194 -0.191 -16.719 1.00 38.38 C ATOM 1419 O VAL A 152 5.642 -0.964 -15.859 1.00 37.58 O ATOM 1420 CB VAL A 152 3.000 0.463 -15.711 1.00 37.24 C ATOM 1421 CG1 VAL A 152 3.432 1.917 -15.487 1.00 36.80 C ATOM 1422 H VAL A 152 2.127 -1.619 -17.052 1.00 0.00 H ATOM 1423 N PRO A 153 5.975 0.609 -17.470 1.00 38.92 N ATOM 1424 CA PRO A 153 7.431 0.635 -17.373 1.00 38.96 C ATOM 1425 C PRO A 153 7.979 1.690 -16.392 1.00 37.84 C ATOM 1426 O PRO A 153 7.795 2.896 -16.593 1.00 38.33 O ATOM 1427 CB PRO A 153 7.860 0.954 -18.812 1.00 40.87 C ATOM 1428 CG PRO A 153 6.690 1.721 -19.404 1.00 41.27 C ATOM 1429 CD PRO A 153 5.487 1.537 -18.506 1.00 39.91 C ATOM 1430 N LEU A 154 8.652 1.224 -15.345 1.00 36.33 N ATOM 1431 CA LEU A 154 9.321 2.097 -14.405 1.00 35.13 C ATOM 1432 C LEU A 154 10.821 1.830 -14.441 1.00 35.59 C ATOM 1433 O LEU A 154 11.237 0.709 -14.732 1.00 36.09 O ATOM 1434 CB LEU A 154 8.824 1.833 -12.981 1.00 33.63 C ATOM 1435 CG LEU A 154 7.471 2.329 -12.491 1.00 32.69 C ATOM 1436 CD1 LEU A 154 7.225 1.708 -11.137 1.00 32.04 C ATOM 1437 CD2 LEU A 154 7.408 3.853 -12.391 1.00 32.11 C ATOM 1438 H LEU A 154 8.699 0.196 -15.196 1.00 0.00 H ATOM 1439 N PRO A 155 11.641 2.849 -14.103 1.00 35.37 N ATOM 1440 CA PRO A 155 13.061 2.595 -13.883 1.00 35.45 C ATOM 1441 C PRO A 155 13.237 1.718 -12.635 1.00 34.06 C ATOM 1442 O PRO A 155 12.296 1.604 -11.838 1.00 32.45 O ATOM 1443 CB PRO A 155 13.630 3.997 -13.622 1.00 35.57 C ATOM 1444 CG PRO A 155 12.478 4.779 -13.102 1.00 34.69 C ATOM 1445 CD PRO A 155 11.298 4.266 -13.874 1.00 35.03 C ATOM 1446 N PRO A 156 14.425 1.089 -12.467 1.00 34.34 N ATOM 1447 CA PRO A 156 14.715 0.397 -11.211 1.00 32.90 C ATOM 1448 C PRO A 156 14.538 1.323 -10.005 1.00 31.55 C ATOM 1449 O PRO A 156 15.006 2.472 -10.019 1.00 32.16 O ATOM 1450 CB PRO A 156 16.185 0.001 -11.369 1.00 33.99 C ATOM 1451 CG PRO A 156 16.374 -0.134 -12.825 1.00 35.59 C ATOM 1452 CD PRO A 156 15.539 0.959 -13.427 1.00 35.76 C ATOM 1453 N ALA A 157 13.865 0.823 -8.975 1.00 29.64 N ATOM 1454 CA ALA A 157 13.587 1.617 -7.784 1.00 28.19 C ATOM 1455 C ALA A 157 14.694 1.514 -6.745 1.00 27.88 C ATOM 1456 O ALA A 157 15.427 0.525 -6.691 1.00 27.99 O ATOM 1457 CB ALA A 157 12.260 1.224 -7.174 1.00 26.92 C ATOM 1458 H ALA A 157 13.528 -0.160 -9.019 1.00 0.00 H ATOM 1459 N ASP A 158 14.801 2.556 -5.926 1.00 27.06 N ATOM 1460 CA ASP A 158 15.732 2.572 -4.818 1.00 26.82 C ATOM 1461 C ASP A 158 15.130 1.864 -3.597 1.00 25.15 C ATOM 1462 O ASP A 158 15.864 1.376 -2.741 1.00 24.93 O ATOM 1463 CB ASP A 158 16.116 4.011 -4.474 1.00 27.41 C ATOM 1464 CG ASP A 158 16.672 4.773 -5.673 1.00 30.82 C ATOM 1465 OD1 ASP A 158 17.857 4.569 -6.027 1.00 32.75 O ATOM 1466 OD2 ASP A 158 15.920 5.590 -6.262 1.00 33.56 O ATOM 1467 H ASP A 158 14.196 3.387 -6.087 1.00 0.00 H ATOM 1468 N CYS A 159 13.798 1.815 -3.530 1.00 23.81 N ATOM 1469 CA CYS A 159 13.092 1.248 -2.389 1.00 22.45 C ATOM 1470 C CYS A 159 11.691 0.749 -2.726 1.00 21.62 C ATOM 1471 O CYS A 159 10.964 1.359 -3.506 1.00 21.73 O ATOM 1472 CB CYS A 159 13.007 2.259 -1.247 1.00 22.25 C ATOM 1473 SG CYS A 159 12.326 1.599 0.300 1.00 21.67 S ATOM 1474 H CYS A 159 13.243 2.196 -4.323 1.00 0.00 H ATOM 1475 N VAL A 160 11.332 -0.383 -2.135 1.00 20.63 N ATOM 1476 CA VAL A 160 9.979 -0.896 -2.208 1.00 19.84 C ATOM 1477 C VAL A 160 9.450 -1.073 -0.786 1.00 19.00 C ATOM 1478 O VAL A 160 10.082 -1.707 0.054 1.00 18.49 O ATOM 1479 CB VAL A 160 9.912 -2.222 -2.981 1.00 20.62 C ATOM 1480 CG1 VAL A 160 8.552 -2.901 -2.770 1.00 21.07 C ATOM 1481 CG2 VAL A 160 10.211 -2.003 -4.478 1.00 20.37 C ATOM 1482 H VAL A 160 12.045 -0.920 -1.602 1.00 0.00 H ATOM 1483 N LEU A 161 8.300 -0.470 -0.526 1.00 18.72 N ATOM 1484 CA LEU A 161 7.712 -0.475 0.786 1.00 18.52 C ATOM 1485 C LEU A 161 6.386 -1.202 0.689 1.00 18.73 C ATOM 1486 O LEU A 161 5.614 -0.978 -0.241 1.00 18.70 O ATOM 1487 CB LEU A 161 7.508 0.971 1.280 1.00 18.39 C ATOM 1488 CG LEU A 161 6.924 1.243 2.682 1.00 17.52 C ATOM 1489 CD1 LEU A 161 7.608 0.476 3.781 1.00 15.93 C ATOM 1490 CD2 LEU A 161 6.960 2.712 2.995 1.00 18.47 C ATOM 1491 H LEU A 161 7.806 0.024 -1.297 1.00 0.00 H ATOM 1492 N SER A 162 6.128 -2.084 1.647 1.00 19.13 N ATOM 1493 CA SER A 162 4.841 -2.762 1.707 1.00 19.55 C ATOM 1494 C SER A 162 4.369 -2.923 3.140 1.00 19.13 C ATOM 1495 O SER A 162 5.083 -3.464 3.979 1.00 19.61 O ATOM 1496 CB SER A 162 4.922 -4.108 1.026 1.00 19.65 C ATOM 1497 OG SER A 162 3.602 -4.567 0.843 1.00 22.37 O ATOM 1498 HG SER A 162 3.105 -3.922 0.280 1.00 0.00 H ATOM 1499 H SER A 162 6.853 -2.293 2.363 1.00 0.00 H ATOM 1500 N THR A 163 3.172 -2.433 3.432 1.00 19.65 N ATOM 1501 CA THR A 163 2.682 -2.432 4.814 1.00 20.02 C ATOM 1502 C THR A 163 1.353 -3.147 4.966 1.00 20.71 C ATOM 1503 O THR A 163 0.348 -2.777 4.347 1.00 21.31 O ATOM 1504 CB THR A 163 2.599 -1.010 5.416 1.00 19.75 C ATOM 1505 OG1 THR A 163 1.676 -0.208 4.669 1.00 20.72 O ATOM 1506 CG2 THR A 163 3.969 -0.342 5.412 1.00 20.22 C ATOM 1507 HG1 THR A 163 0.779 -0.625 4.699 1.00 0.00 H ATOM 1508 H THR A 163 2.575 -2.046 2.674 1.00 0.00 H ATOM 1509 N LEU A 164 1.358 -4.204 5.776 1.00 21.68 N ATOM 1510 CA LEU A 164 0.148 -4.994 6.029 1.00 22.47 C ATOM 1511 C LEU A 164 -0.514 -5.421 4.717 1.00 23.17 C ATOM 1512 O LEU A 164 -1.740 -5.511 4.623 1.00 23.65 O ATOM 1513 CB LEU A 164 -0.837 -4.212 6.906 1.00 22.25 C ATOM 1514 CG LEU A 164 -0.377 -3.772 8.295 1.00 22.09 C ATOM 1515 CD1 LEU A 164 -0.968 -2.407 8.679 1.00 20.61 C ATOM 1516 CD2 LEU A 164 -0.748 -4.828 9.303 1.00 22.28 C ATOM 1517 H LEU A 164 2.246 -4.478 6.243 1.00 0.00 H ATOM 1518 N CYS A 165 0.304 -5.673 3.702 1.00 24.11 N ATOM 1519 CA CYS A 165 -0.212 -6.103 2.416 1.00 25.11 C ATOM 1520 C CYS A 165 0.087 -7.576 2.178 1.00 25.94 C ATOM 1521 O CYS A 165 -0.757 -8.321 1.665 1.00 27.16 O ATOM 1522 CB CYS A 165 0.346 -5.246 1.277 1.00 24.83 C ATOM 1523 SG CYS A 165 -0.061 -5.898 -0.383 1.00 27.10 S ATOM 1524 H CYS A 165 1.330 -5.560 3.831 1.00 0.00 H ATOM 1525 N LEU A 166 1.284 -7.991 2.567 1.00 25.96 N ATOM 1526 CA LEU A 166 1.798 -9.300 2.185 1.00 27.04 C ATOM 1527 C LEU A 166 1.107 -10.474 2.892 1.00 27.43 C ATOM 1528 O LEU A 166 0.856 -11.501 2.270 1.00 28.53 O ATOM 1529 CB LEU A 166 3.328 -9.342 2.333 1.00 26.93 C ATOM 1530 CG LEU A 166 4.104 -8.495 1.311 1.00 26.98 C ATOM 1531 CD1 LEU A 166 5.607 -8.600 1.507 1.00 28.05 C ATOM 1532 CD2 LEU A 166 3.743 -8.887 -0.110 1.00 28.47 C ATOM 1533 H LEU A 166 1.870 -7.368 3.159 1.00 0.00 H ATOM 1534 N ASP A 167 0.782 -10.314 4.168 1.00 27.08 N ATOM 1535 CA ASP A 167 -0.020 -11.312 4.874 1.00 28.14 C ATOM 1536 C ASP A 167 -1.388 -11.473 4.227 1.00 28.30 C ATOM 1537 O ASP A 167 -1.947 -12.571 4.218 1.00 29.34 O ATOM 1538 CB ASP A 167 -0.229 -10.927 6.345 1.00 28.02 C ATOM 1539 CG ASP A 167 1.053 -10.902 7.137 1.00 29.27 C ATOM 1540 OD1 ASP A 167 0.971 -10.616 8.355 1.00 31.53 O ATOM 1541 OD2 ASP A 167 2.139 -11.141 6.555 1.00 31.48 O ATOM 1542 H ASP A 167 1.103 -9.464 4.675 1.00 0.00 H ATOM 1543 N ALA A 168 -1.918 -10.362 3.712 1.00 27.53 N ATOM 1544 CA ALA A 168 -3.239 -10.316 3.105 1.00 27.64 C ATOM 1545 C ALA A 168 -3.301 -10.946 1.712 1.00 28.33 C ATOM 1546 O ALA A 168 -4.263 -11.646 1.387 1.00 29.17 O ATOM 1547 CB ALA A 168 -3.733 -8.888 3.061 1.00 26.94 C ATOM 1548 H ALA A 168 -1.359 -9.486 3.746 1.00 0.00 H ATOM 1549 N ALA A 169 -2.281 -10.695 0.897 1.00 27.99 N ATOM 1550 CA ALA A 169 -2.313 -11.082 -0.507 1.00 29.07 C ATOM 1551 C ALA A 169 -1.904 -12.527 -0.759 1.00 30.48 C ATOM 1552 O ALA A 169 -2.303 -13.116 -1.766 1.00 31.83 O ATOM 1553 CB ALA A 169 -1.440 -10.160 -1.316 1.00 28.78 C ATOM 1554 H ALA A 169 -1.440 -10.211 1.271 1.00 0.00 H ATOM 1555 N CYS A 170 -1.112 -13.099 0.143 1.00 30.55 N ATOM 1556 CA CYS A 170 -0.517 -14.411 -0.111 1.00 32.16 C ATOM 1557 C CYS A 170 -1.128 -15.557 0.716 1.00 32.87 C ATOM 1558 O CYS A 170 -0.979 -15.591 1.935 1.00 32.24 O ATOM 1559 CB CYS A 170 1.001 -14.326 0.049 1.00 31.80 C ATOM 1560 SG CYS A 170 1.698 -12.847 -0.775 1.00 32.01 S ATOM 1561 H CYS A 170 -0.914 -12.609 1.038 1.00 0.00 H ATOM 1562 N PRO A 171 -1.831 -16.490 0.041 1.00 34.51 N ATOM 1563 CA PRO A 171 -2.471 -17.664 0.666 1.00 35.80 C ATOM 1564 C PRO A 171 -1.521 -18.702 1.295 1.00 36.33 C ATOM 1565 O PRO A 171 -1.969 -19.485 2.130 1.00 36.93 O ATOM 1566 CB PRO A 171 -3.245 -18.303 -0.497 1.00 37.22 C ATOM 1567 CG PRO A 171 -2.543 -17.845 -1.720 1.00 37.27 C ATOM 1568 CD PRO A 171 -2.073 -16.457 -1.414 1.00 35.27 C ATOM 1569 N ASP A 172 -0.244 -18.710 0.896 1.00 36.34 N ATOM 1570 CA ASP A 172 0.761 -19.646 1.445 1.00 36.98 C ATOM 1571 C ASP A 172 2.205 -19.140 1.317 1.00 36.12 C ATOM 1572 O ASP A 172 2.463 -18.150 0.632 1.00 35.27 O ATOM 1573 CB ASP A 172 0.632 -21.026 0.787 1.00 38.94 C ATOM 1574 CG ASP A 172 0.780 -20.969 -0.727 1.00 40.19 C ATOM 1575 OD1 ASP A 172 1.871 -20.603 -1.223 1.00 39.89 O ATOM 1576 OD2 ASP A 172 -0.200 -21.299 -1.425 1.00 41.75 O ATOM 1577 H ASP A 172 0.055 -18.029 0.169 1.00 0.00 H ATOM 1578 N LEU A 173 3.133 -19.848 1.966 1.00 36.46 N ATOM 1579 CA LEU A 173 4.566 -19.506 1.967 1.00 35.65 C ATOM 1580 C LEU A 173 5.252 -19.519 0.597 1.00 36.01 C ATOM 1581 O LEU A 173 6.033 -18.614 0.307 1.00 35.20 O ATOM 1582 CB LEU A 173 5.342 -20.399 2.945 1.00 36.51 C ATOM 1583 CG LEU A 173 5.482 -19.954 4.400 1.00 35.14 C ATOM 1584 CD1 LEU A 173 6.172 -21.053 5.182 1.00 35.32 C ATOM 1585 CD2 LEU A 173 6.265 -18.639 4.474 1.00 33.25 C ATOM 1586 H LEU A 173 2.827 -20.687 2.500 1.00 0.00 H ATOM 1587 N PRO A 174 5.014 -20.562 -0.230 1.00 37.56 N ATOM 1588 CA PRO A 174 5.460 -20.444 -1.621 1.00 38.12 C ATOM 1589 C PRO A 174 5.030 -19.114 -2.268 1.00 37.05 C ATOM 1590 O PRO A 174 5.849 -18.425 -2.890 1.00 36.85 O ATOM 1591 CB PRO A 174 4.773 -21.622 -2.299 1.00 39.71 C ATOM 1592 CG PRO A 174 4.688 -22.638 -1.233 1.00 40.40 C ATOM 1593 CD PRO A 174 4.414 -21.886 0.030 1.00 38.94 C ATOM 1594 N THR A 175 3.767 -18.741 -2.089 1.00 36.18 N ATOM 1595 CA THR A 175 3.246 -17.529 -2.702 1.00 34.61 C ATOM 1596 C THR A 175 3.880 -16.288 -2.089 1.00 32.58 C ATOM 1597 O THR A 175 4.192 -15.338 -2.802 1.00 31.84 O ATOM 1598 CB THR A 175 1.718 -17.475 -2.608 1.00 34.61 C ATOM 1599 OG1 THR A 175 1.179 -18.715 -3.080 1.00 36.15 O ATOM 1600 CG2 THR A 175 1.160 -16.310 -3.446 1.00 33.98 C ATOM 1601 HG1 THR A 175 1.523 -19.457 -2.522 1.00 0.00 H ATOM 1602 H THR A 175 3.140 -19.326 -1.500 1.00 0.00 H ATOM 1603 N TYR A 176 4.081 -16.322 -0.774 1.00 31.59 N ATOM 1604 CA TYR A 176 4.690 -15.224 -0.032 1.00 30.10 C ATOM 1605 C TYR A 176 6.117 -14.974 -0.489 1.00 30.03 C ATOM 1606 O TYR A 176 6.538 -13.823 -0.650 1.00 28.76 O ATOM 1607 CB TYR A 176 4.691 -15.533 1.466 1.00 30.13 C ATOM 1608 CG TYR A 176 5.061 -14.345 2.331 1.00 29.07 C ATOM 1609 CD1 TYR A 176 4.086 -13.456 2.766 1.00 27.87 C ATOM 1610 CD2 TYR A 176 6.388 -14.113 2.709 1.00 29.55 C ATOM 1611 CE1 TYR A 176 4.415 -12.376 3.548 1.00 27.66 C ATOM 1612 CE2 TYR A 176 6.731 -13.022 3.495 1.00 28.60 C ATOM 1613 CZ TYR A 176 5.737 -12.163 3.909 1.00 27.31 C ATOM 1614 OH TYR A 176 6.050 -11.080 4.681 1.00 26.59 O ATOM 1615 HH TYR A 176 5.225 -10.573 4.887 1.00 0.00 H ATOM 1616 H TYR A 176 3.790 -17.172 -0.250 1.00 0.00 H ATOM 1617 N CYS A 177 6.849 -16.067 -0.688 1.00 31.29 N ATOM 1618 CA CYS A 177 8.233 -16.015 -1.140 1.00 31.65 C ATOM 1619 C CYS A 177 8.357 -15.521 -2.587 1.00 31.78 C ATOM 1620 O CYS A 177 9.194 -14.672 -2.875 1.00 31.52 O ATOM 1621 CB CYS A 177 8.904 -17.388 -0.971 1.00 33.14 C ATOM 1622 SG CYS A 177 10.712 -17.321 -1.160 1.00 34.47 S ATOM 1623 H CYS A 177 6.416 -16.996 -0.514 1.00 0.00 H ATOM 1624 N ARG A 178 7.517 -16.043 -3.482 1.00 32.40 N ATOM 1625 CA ARG A 178 7.513 -15.640 -4.895 1.00 32.86 C ATOM 1626 C ARG A 178 7.156 -14.176 -5.053 1.00 30.98 C ATOM 1627 O ARG A 178 7.691 -13.504 -5.932 1.00 30.92 O ATOM 1628 CB ARG A 178 6.528 -16.477 -5.706 1.00 33.83 C ATOM 1629 CG ARG A 178 6.736 -17.982 -5.583 1.00 36.96 C ATOM 1630 CD ARG A 178 5.537 -18.771 -6.124 1.00 38.64 C ATOM 1631 NE ARG A 178 4.290 -17.998 -6.106 1.00 40.45 N ATOM 1632 CZ ARG A 178 3.157 -18.403 -6.672 1.00 42.50 C ATOM 1633 NH1 ARG A 178 3.116 -19.579 -7.294 1.00 46.48 N ATOM 1634 NH2 ARG A 178 2.068 -17.642 -6.620 1.00 40.39 N ATOM 1635 HE ARG A 178 4.292 -17.078 -5.621 1.00 0.00 H ATOM 1636 HH12 ARG A 178 2.233 -19.902 -7.739 1.00 0.00 H ATOM 1637 HH11 ARG A 178 3.967 -20.175 -7.335 1.00 0.00 H ATOM 1638 HH22 ARG A 178 1.186 -17.966 -7.065 1.00 0.00 H ATOM 1639 HH21 ARG A 178 2.099 -16.723 -6.134 1.00 0.00 H ATOM 1640 H ARG A 178 6.837 -16.764 -3.167 1.00 0.00 H ATOM 1641 N ALA A 179 6.249 -13.695 -4.199 1.00 29.26 N ATOM 1642 CA ALA A 179 5.834 -12.302 -4.189 1.00 27.86 C ATOM 1643 C ALA A 179 7.024 -11.392 -3.899 1.00 27.04 C ATOM 1644 O ALA A 179 7.207 -10.362 -4.544 1.00 26.28 O ATOM 1645 CB ALA A 179 4.725 -12.084 -3.159 1.00 27.01 C ATOM 1646 H ALA A 179 5.821 -14.346 -3.510 1.00 0.00 H ATOM 1647 N LEU A 180 7.835 -11.801 -2.926 1.00 26.80 N ATOM 1648 CA LEU A 180 9.013 -11.056 -2.530 1.00 26.34 C ATOM 1649 C LEU A 180 10.038 -11.001 -3.643 1.00 27.60 C ATOM 1650 O LEU A 180 10.726 -9.994 -3.807 1.00 27.49 O ATOM 1651 CB LEU A 180 9.636 -11.692 -1.298 1.00 26.22 C ATOM 1652 CG LEU A 180 8.995 -11.349 0.038 1.00 24.48 C ATOM 1653 CD1 LEU A 180 9.492 -12.335 1.070 1.00 25.17 C ATOM 1654 CD2 LEU A 180 9.315 -9.918 0.448 1.00 21.65 C ATOM 1655 H LEU A 180 7.615 -12.689 -2.431 1.00 0.00 H ATOM 1656 N ARG A 181 10.134 -12.092 -4.396 1.00 29.10 N ATOM 1657 CA ARG A 181 10.995 -12.167 -5.563 1.00 31.00 C ATOM 1658 C ARG A 181 10.402 -11.331 -6.696 1.00 30.98 C ATOM 1659 O ARG A 181 11.131 -10.613 -7.390 1.00 31.48 O ATOM 1660 CB ARG A 181 11.173 -13.623 -5.997 1.00 32.41 C ATOM 1661 CG ARG A 181 12.559 -13.940 -6.551 1.00 34.57 C ATOM 1662 CD ARG A 181 12.693 -15.405 -6.990 1.00 36.66 C ATOM 1663 NE ARG A 181 12.366 -16.350 -5.918 1.00 40.36 N ATOM 1664 CZ ARG A 181 13.241 -16.837 -5.037 1.00 42.07 C ATOM 1665 NH1 ARG A 181 14.524 -16.469 -5.082 1.00 43.19 N ATOM 1666 NH2 ARG A 181 12.831 -17.692 -4.102 1.00 41.62 N ATOM 1667 HE ARG A 181 11.378 -16.664 -5.839 1.00 0.00 H ATOM 1668 HH12 ARG A 181 15.200 -16.853 -4.391 1.00 0.00 H ATOM 1669 HH11 ARG A 181 14.847 -15.798 -5.808 1.00 0.00 H ATOM 1670 HH22 ARG A 181 13.510 -18.074 -3.413 1.00 0.00 H ATOM 1671 HH21 ARG A 181 11.832 -17.978 -4.061 1.00 0.00 H ATOM 1672 H ARG A 181 9.569 -12.926 -4.139 1.00 0.00 H ATOM 1673 N ASN A 182 9.081 -11.428 -6.868 1.00 30.79 N ATOM 1674 CA ASN A 182 8.345 -10.595 -7.812 1.00 30.79 C ATOM 1675 C ASN A 182 8.604 -9.115 -7.540 1.00 29.82 C ATOM 1676 O ASN A 182 8.893 -8.350 -8.461 1.00 30.14 O ATOM 1677 CB ASN A 182 6.841 -10.884 -7.740 1.00 30.83 C ATOM 1678 CG ASN A 182 6.458 -12.250 -8.315 1.00 31.94 C ATOM 1679 OD1 ASN A 182 7.297 -12.996 -8.831 1.00 33.80 O ATOM 1680 ND2 ASN A 182 5.176 -12.579 -8.220 1.00 30.62 N ATOM 1681 HD22 ASN A 182 4.502 -11.922 -7.778 1.00 0.00 H ATOM 1682 HD21 ASN A 182 4.845 -13.494 -8.587 1.00 0.00 H ATOM 1683 H ASN A 182 8.555 -12.127 -6.305 1.00 0.00 H ATOM 1684 N LEU A 183 8.521 -8.733 -6.265 1.00 28.69 N ATOM 1685 CA LEU A 183 8.784 -7.366 -5.821 1.00 27.62 C ATOM 1686 C LEU A 183 10.226 -6.954 -6.055 1.00 27.99 C ATOM 1687 O LEU A 183 10.519 -5.777 -6.321 1.00 27.78 O ATOM 1688 CB LEU A 183 8.452 -7.216 -4.335 1.00 26.89 C ATOM 1689 CG LEU A 183 6.976 -7.306 -3.923 1.00 26.47 C ATOM 1690 CD1 LEU A 183 6.828 -7.099 -2.422 1.00 25.77 C ATOM 1691 CD2 LEU A 183 6.117 -6.312 -4.695 1.00 25.60 C ATOM 1692 H LEU A 183 8.256 -9.442 -5.552 1.00 0.00 H ATOM 1693 N GLY A 184 11.124 -7.928 -5.954 1.00 28.30 N ATOM 1694 CA GLY A 184 12.535 -7.696 -6.179 1.00 29.03 C ATOM 1695 C GLY A 184 12.866 -7.260 -7.590 1.00 30.28 C ATOM 1696 O GLY A 184 13.885 -6.602 -7.811 1.00 31.04 O ATOM 1697 H GLY A 184 10.804 -8.886 -5.706 1.00 0.00 H ATOM 1698 N SER A 185 12.010 -7.615 -8.547 1.00 30.81 N ATOM 1699 CA SER A 185 12.282 -7.313 -9.951 1.00 32.21 C ATOM 1700 C SER A 185 12.153 -5.827 -10.282 1.00 32.03 C ATOM 1701 O SER A 185 12.583 -5.391 -11.351 1.00 33.46 O ATOM 1702 CB SER A 185 11.397 -8.152 -10.863 1.00 32.89 C ATOM 1703 OG SER A 185 10.038 -7.838 -10.659 1.00 32.81 O ATOM 1704 HG SER A 185 9.796 -8.022 -9.717 1.00 0.00 H ATOM 1705 H SER A 185 11.135 -8.115 -8.291 1.00 0.00 H ATOM 1706 N LEU A 186 11.572 -5.057 -9.362 1.00 30.85 N ATOM 1707 CA LEU A 186 11.461 -3.595 -9.489 1.00 30.38 C ATOM 1708 C LEU A 186 12.608 -2.850 -8.785 1.00 30.12 C ATOM 1709 O LEU A 186 12.610 -1.621 -8.753 1.00 29.91 O ATOM 1710 CB LEU A 186 10.135 -3.100 -8.901 1.00 28.90 C ATOM 1711 CG LEU A 186 8.850 -3.886 -9.139 1.00 28.89 C ATOM 1712 CD1 LEU A 186 7.872 -3.648 -7.988 1.00 27.74 C ATOM 1713 CD2 LEU A 186 8.218 -3.526 -10.465 1.00 29.55 C ATOM 1714 H LEU A 186 11.178 -5.511 -8.513 1.00 0.00 H ATOM 1715 N LEU A 187 13.565 -3.588 -8.225 1.00 30.10 N ATOM 1716 CA LEU A 187 14.595 -3.007 -7.365 1.00 30.22 C ATOM 1717 C LEU A 187 16.004 -2.984 -7.956 1.00 31.76 C ATOM 1718 O LEU A 187 16.464 -3.978 -8.532 1.00 33.19 O ATOM 1719 CB LEU A 187 14.655 -3.768 -6.031 1.00 29.52 C ATOM 1720 CG LEU A 187 13.960 -3.265 -4.767 1.00 27.94 C ATOM 1721 CD1 LEU A 187 14.464 -4.054 -3.579 1.00 26.83 C ATOM 1722 CD2 LEU A 187 14.204 -1.785 -4.529 1.00 28.69 C ATOM 1723 H LEU A 187 13.580 -4.612 -8.406 1.00 0.00 H ATOM 1724 N LYS A 188 16.700 -1.861 -7.781 1.00 31.98 N ATOM 1725 CA LYS A 188 18.146 -1.805 -8.030 1.00 33.12 C ATOM 1726 C LYS A 188 18.845 -2.831 -7.154 1.00 33.23 C ATOM 1727 O LYS A 188 18.441 -3.050 -6.005 1.00 31.88 O ATOM 1728 CB LYS A 188 18.727 -0.432 -7.664 1.00 33.25 C ATOM 1729 CG LYS A 188 18.620 0.639 -8.722 1.00 33.80 C ATOM 1730 CD LYS A 188 19.220 1.962 -8.232 1.00 34.21 C ATOM 1731 CE LYS A 188 18.563 3.162 -8.931 1.00 34.52 C ATOM 1732 NZ LYS A 188 19.053 4.495 -8.453 1.00 33.86 N ATOM 1733 HZ1 LYS A 188 18.859 4.590 -7.436 1.00 0.00 H ATOM 1734 HZ2 LYS A 188 20.077 4.567 -8.620 1.00 0.00 H ATOM 1735 HZ3 LYS A 188 18.562 5.250 -8.973 1.00 0.00 H ATOM 1736 H LYS A 188 16.207 -1.003 -7.460 1.00 0.00 H ATOM 1737 N PRO A 189 19.902 -3.463 -7.685 1.00 34.82 N ATOM 1738 CA PRO A 189 20.829 -4.175 -6.804 1.00 35.33 C ATOM 1739 C PRO A 189 21.264 -3.276 -5.629 1.00 34.79 C ATOM 1740 O PRO A 189 21.576 -2.094 -5.831 1.00 35.11 O ATOM 1741 CB PRO A 189 22.016 -4.499 -7.725 1.00 37.00 C ATOM 1742 CG PRO A 189 21.759 -3.735 -9.011 1.00 37.95 C ATOM 1743 CD PRO A 189 20.286 -3.582 -9.099 1.00 36.45 C ATOM 1744 N GLY A 190 21.242 -3.828 -4.418 1.00 33.94 N ATOM 1745 CA GLY A 190 21.552 -3.071 -3.208 1.00 33.77 C ATOM 1746 C GLY A 190 20.394 -2.224 -2.710 1.00 32.74 C ATOM 1747 O GLY A 190 20.547 -1.455 -1.752 1.00 32.47 O ATOM 1748 H GLY A 190 20.995 -4.834 -4.330 1.00 0.00 H ATOM 1749 N GLY A 191 19.232 -2.384 -3.355 1.00 32.20 N ATOM 1750 CA GLY A 191 18.026 -1.604 -3.070 1.00 30.34 C ATOM 1751 C GLY A 191 17.235 -2.073 -1.866 1.00 28.95 C ATOM 1752 O GLY A 191 17.377 -3.204 -1.404 1.00 28.91 O ATOM 1753 H GLY A 191 19.183 -3.105 -4.103 1.00 0.00 H ATOM 1754 N PHE A 192 16.367 -1.194 -1.383 1.00 27.74 N ATOM 1755 CA PHE A 192 15.712 -1.385 -0.104 1.00 26.58 C ATOM 1756 C PHE A 192 14.328 -1.986 -0.189 1.00 25.37 C ATOM 1757 O PHE A 192 13.459 -1.486 -0.906 1.00 25.57 O ATOM 1758 CB PHE A 192 15.623 -0.053 0.641 1.00 26.46 C ATOM 1759 CG PHE A 192 16.926 0.420 1.169 1.00 27.28 C ATOM 1760 CD1 PHE A 192 17.485 -0.175 2.294 1.00 28.36 C ATOM 1761 CD2 PHE A 192 17.600 1.454 0.547 1.00 27.50 C ATOM 1762 CE1 PHE A 192 18.710 0.256 2.781 1.00 29.40 C ATOM 1763 CE2 PHE A 192 18.813 1.893 1.034 1.00 28.28 C ATOM 1764 CZ PHE A 192 19.374 1.293 2.151 1.00 28.91 C ATOM 1765 H PHE A 192 16.150 -0.342 -1.939 1.00 0.00 H ATOM 1766 N LEU A 193 14.131 -3.060 0.559 1.00 24.32 N ATOM 1767 CA LEU A 193 12.794 -3.577 0.807 1.00 23.07 C ATOM 1768 C LEU A 193 12.405 -3.260 2.253 1.00 21.75 C ATOM 1769 O LEU A 193 13.189 -3.499 3.185 1.00 21.12 O ATOM 1770 CB LEU A 193 12.756 -5.078 0.536 1.00 23.63 C ATOM 1771 CG LEU A 193 11.507 -5.915 0.801 1.00 23.35 C ATOM 1772 CD1 LEU A 193 10.352 -5.552 -0.115 1.00 24.14 C ATOM 1773 CD2 LEU A 193 11.872 -7.375 0.633 1.00 24.09 C ATOM 1774 H LEU A 193 14.950 -3.545 0.979 1.00 0.00 H ATOM 1775 N VAL A 194 11.209 -2.693 2.420 1.00 20.35 N ATOM 1776 CA VAL A 194 10.675 -2.342 3.736 1.00 19.56 C ATOM 1777 C VAL A 194 9.269 -2.944 3.929 1.00 19.44 C ATOM 1778 O VAL A 194 8.306 -2.587 3.232 1.00 18.74 O ATOM 1779 CB VAL A 194 10.640 -0.794 3.968 1.00 19.63 C ATOM 1780 CG1 VAL A 194 10.422 -0.479 5.434 1.00 18.52 C ATOM 1781 CG2 VAL A 194 11.927 -0.117 3.464 1.00 19.85 C ATOM 1782 H VAL A 194 10.632 -2.492 1.579 1.00 0.00 H ATOM 1783 N ILE A 195 9.155 -3.866 4.879 1.00 19.91 N ATOM 1784 CA ILE A 195 7.869 -4.503 5.162 1.00 20.14 C ATOM 1785 C ILE A 195 7.507 -4.382 6.624 1.00 20.35 C ATOM 1786 O ILE A 195 8.342 -4.556 7.513 1.00 20.49 O ATOM 1787 CB ILE A 195 7.840 -6.008 4.771 1.00 20.33 C ATOM 1788 CG1 ILE A 195 8.025 -6.178 3.284 1.00 20.89 C ATOM 1789 CG2 ILE A 195 6.510 -6.632 5.077 1.00 20.78 C ATOM 1790 CD1 ILE A 195 9.375 -6.560 2.964 1.00 25.33 C ATOM 1791 H ILE A 195 9.994 -4.139 5.430 1.00 0.00 H ATOM 1792 N MET A 196 6.243 -4.085 6.876 1.00 20.40 N ATOM 1793 CA MET A 196 5.743 -4.214 8.220 1.00 20.92 C ATOM 1794 C MET A 196 4.450 -4.970 8.131 1.00 20.38 C ATOM 1795 O MET A 196 3.614 -4.683 7.284 1.00 20.35 O ATOM 1796 CB MET A 196 5.565 -2.853 8.872 1.00 20.51 C ATOM 1797 CG MET A 196 6.817 -2.037 8.826 1.00 20.83 C ATOM 1798 SD MET A 196 6.505 -0.291 9.051 1.00 23.57 S ATOM 1799 CE MET A 196 8.163 0.344 8.834 1.00 22.49 C ATOM 1800 H MET A 196 5.617 -3.762 6.111 1.00 0.00 H ATOM 1801 N ASP A 197 4.302 -5.976 8.977 1.00 20.37 N ATOM 1802 CA ASP A 197 3.098 -6.767 8.914 1.00 20.67 C ATOM 1803 C ASP A 197 2.683 -7.362 10.253 1.00 20.40 C ATOM 1804 O ASP A 197 3.393 -7.258 11.241 1.00 20.26 O ATOM 1805 CB ASP A 197 3.255 -7.861 7.863 1.00 21.11 C ATOM 1806 CG ASP A 197 2.035 -8.013 7.020 1.00 22.33 C ATOM 1807 OD1 ASP A 197 0.920 -7.808 7.559 1.00 21.63 O ATOM 1808 OD2 ASP A 197 2.195 -8.340 5.818 1.00 24.94 O ATOM 1809 H ASP A 197 5.041 -6.193 9.676 1.00 0.00 H ATOM 1810 N ALA A 198 1.514 -7.981 10.254 1.00 20.42 N ATOM 1811 CA ALA A 198 1.015 -8.702 11.405 1.00 20.86 C ATOM 1812 C ALA A 198 1.765 -10.020 11.626 1.00 21.18 C ATOM 1813 O ALA A 198 2.166 -10.685 10.671 1.00 21.38 O ATOM 1814 CB ALA A 198 -0.463 -8.956 11.223 1.00 21.01 C ATOM 1815 H ALA A 198 0.931 -7.948 9.394 1.00 0.00 H ATOM 1816 N LEU A 199 1.964 -10.393 12.885 1.00 21.73 N ATOM 1817 CA LEU A 199 2.496 -11.731 13.204 1.00 22.97 C ATOM 1818 C LEU A 199 1.397 -12.730 13.564 1.00 23.94 C ATOM 1819 O LEU A 199 0.431 -12.379 14.248 1.00 24.56 O ATOM 1820 CB LEU A 199 3.539 -11.672 14.326 1.00 23.27 C ATOM 1821 CG LEU A 199 4.947 -11.190 13.957 1.00 22.81 C ATOM 1822 CD1 LEU A 199 5.703 -10.809 15.197 1.00 23.63 C ATOM 1823 CD2 LEU A 199 5.720 -12.256 13.187 1.00 23.65 C ATOM 1824 H LEU A 199 1.742 -9.732 13.657 1.00 0.00 H ATOM 1825 N LYS A 200 1.544 -13.963 13.079 1.00 24.90 N ATOM 1826 CA LYS A 200 0.660 -15.078 13.435 1.00 26.14 C ATOM 1827 C LYS A 200 -0.809 -14.633 13.455 1.00 26.12 C ATOM 1828 O LYS A 200 -1.494 -14.671 14.477 1.00 27.15 O ATOM 1829 CB LYS A 200 1.086 -15.710 14.768 1.00 27.05 C ATOM 1830 CG LYS A 200 2.571 -16.067 14.850 1.00 27.82 C ATOM 1831 CD LYS A 200 2.861 -17.227 15.831 1.00 29.76 C ATOM 1832 CE LYS A 200 4.363 -17.624 15.807 1.00 30.18 C ATOM 1833 NZ LYS A 200 4.654 -18.947 16.463 1.00 32.80 N ATOM 1834 HZ1 LYS A 200 4.360 -18.910 17.460 1.00 0.00 H ATOM 1835 HZ2 LYS A 200 4.128 -19.699 15.973 1.00 0.00 H ATOM 1836 HZ3 LYS A 200 5.674 -19.143 16.408 1.00 0.00 H ATOM 1837 H LYS A 200 2.324 -14.143 12.415 1.00 0.00 H ATOM 1838 N SER A 201 -1.272 -14.191 12.298 1.00 25.38 N ATOM 1839 CA SER A 201 -2.595 -13.641 12.138 1.00 24.61 C ATOM 1840 C SER A 201 -3.239 -14.428 11.014 1.00 25.16 C ATOM 1841 O SER A 201 -2.606 -14.634 9.970 1.00 24.78 O ATOM 1842 CB SER A 201 -2.472 -12.171 11.740 1.00 23.35 C ATOM 1843 OG SER A 201 -3.736 -11.575 11.568 1.00 22.78 O ATOM 1844 HG SER A 201 -3.620 -10.626 11.311 1.00 0.00 H ATOM 1845 H SER A 201 -0.653 -14.243 11.464 1.00 0.00 H ATOM 1846 N SER A 202 -4.479 -14.877 11.228 1.00 25.78 N ATOM 1847 CA SER A 202 -5.208 -15.648 10.210 1.00 26.48 C ATOM 1848 C SER A 202 -6.460 -14.944 9.689 1.00 26.52 C ATOM 1849 O SER A 202 -7.145 -15.456 8.802 1.00 27.96 O ATOM 1850 CB SER A 202 -5.523 -17.079 10.682 1.00 27.72 C ATOM 1851 OG SER A 202 -6.250 -17.090 11.896 1.00 27.51 O ATOM 1852 HG SER A 202 -6.431 -18.026 12.163 1.00 0.00 H ATOM 1853 H SER A 202 -4.941 -14.676 12.138 1.00 0.00 H ATOM 1854 N TYR A 203 -6.755 -13.771 10.229 1.00 25.53 N ATOM 1855 CA TYR A 203 -7.857 -12.967 9.723 1.00 25.16 C ATOM 1856 C TYR A 203 -7.771 -11.554 10.258 1.00 24.11 C ATOM 1857 O TYR A 203 -7.173 -11.317 11.309 1.00 24.08 O ATOM 1858 CB TYR A 203 -9.204 -13.581 10.111 1.00 26.30 C ATOM 1859 CG TYR A 203 -9.624 -13.350 11.552 1.00 26.75 C ATOM 1860 CD1 TYR A 203 -10.024 -12.081 11.989 1.00 26.89 C ATOM 1861 CD2 TYR A 203 -9.653 -14.399 12.472 1.00 27.22 C ATOM 1862 CE1 TYR A 203 -10.421 -11.861 13.302 1.00 27.46 C ATOM 1863 CE2 TYR A 203 -10.049 -14.189 13.787 1.00 27.39 C ATOM 1864 CZ TYR A 203 -10.437 -12.917 14.199 1.00 27.85 C ATOM 1865 OH TYR A 203 -10.841 -12.678 15.503 1.00 27.87 O ATOM 1866 HH TYR A 203 -11.076 -11.722 15.604 1.00 0.00 H ATOM 1867 H TYR A 203 -6.190 -13.419 11.028 1.00 0.00 H ATOM 1868 N TYR A 204 -8.360 -10.622 9.522 1.00 23.85 N ATOM 1869 CA TYR A 204 -8.655 -9.289 10.036 1.00 23.34 C ATOM 1870 C TYR A 204 -10.045 -8.848 9.572 1.00 24.10 C ATOM 1871 O TYR A 204 -10.546 -9.320 8.549 1.00 24.04 O ATOM 1872 CB TYR A 204 -7.577 -8.280 9.663 1.00 21.72 C ATOM 1873 CG TYR A 204 -7.446 -7.970 8.182 1.00 22.33 C ATOM 1874 CD1 TYR A 204 -7.901 -6.752 7.660 1.00 22.29 C ATOM 1875 CD2 TYR A 204 -6.827 -8.869 7.305 1.00 22.54 C ATOM 1876 CE1 TYR A 204 -7.762 -6.449 6.301 1.00 22.13 C ATOM 1877 CE2 TYR A 204 -6.691 -8.577 5.944 1.00 22.77 C ATOM 1878 CZ TYR A 204 -7.157 -7.368 5.454 1.00 22.29 C ATOM 1879 OH TYR A 204 -7.019 -7.077 4.122 1.00 21.78 O ATOM 1880 HH TYR A 204 -7.498 -7.757 3.585 1.00 0.00 H ATOM 1881 H TYR A 204 -8.622 -10.850 8.542 1.00 0.00 H ATOM 1882 N MET A 205 -10.670 -7.970 10.353 1.00 24.85 N ATOM 1883 CA MET A 205 -12.053 -7.559 10.112 1.00 26.44 C ATOM 1884 C MET A 205 -12.146 -6.135 9.610 1.00 26.70 C ATOM 1885 O MET A 205 -11.389 -5.266 10.047 1.00 25.88 O ATOM 1886 CB MET A 205 -12.885 -7.669 11.391 1.00 26.95 C ATOM 1887 CG MET A 205 -12.996 -9.074 11.953 1.00 26.60 C ATOM 1888 SD MET A 205 -14.014 -10.177 10.968 1.00 24.90 S ATOM 1889 CE MET A 205 -15.659 -9.457 11.179 1.00 24.05 C ATOM 1890 H MET A 205 -10.158 -7.563 11.161 1.00 0.00 H ATOM 1891 N ILE A 206 -13.077 -5.908 8.685 1.00 28.37 N ATOM 1892 CA ILE A 206 -13.494 -4.555 8.328 1.00 29.13 C ATOM 1893 C ILE A 206 -15.021 -4.480 8.347 1.00 31.25 C ATOM 1894 O ILE A 206 -15.697 -4.907 7.399 1.00 32.48 O ATOM 1895 CB ILE A 206 -12.970 -4.106 6.953 1.00 28.44 C ATOM 1896 CG1 ILE A 206 -11.518 -4.527 6.743 1.00 27.16 C ATOM 1897 CG2 ILE A 206 -13.123 -2.602 6.818 1.00 28.24 C ATOM 1898 CD1 ILE A 206 -11.066 -4.402 5.316 1.00 26.70 C ATOM 1899 H ILE A 206 -13.519 -6.717 8.204 1.00 0.00 H ATOM 1900 N GLY A 207 -15.563 -3.928 9.425 1.00 32.35 N ATOM 1901 CA GLY A 207 -17.013 -3.910 9.621 1.00 34.62 C ATOM 1902 C GLY A 207 -17.503 -5.330 9.831 1.00 35.97 C ATOM 1903 O GLY A 207 -17.050 -6.022 10.742 1.00 35.79 O ATOM 1904 H GLY A 207 -14.946 -3.500 10.144 1.00 0.00 H ATOM 1905 N GLU A 208 -18.408 -5.761 8.960 1.00 37.43 N ATOM 1906 CA GLU A 208 -18.946 -7.118 8.979 1.00 39.01 C ATOM 1907 C GLU A 208 -18.008 -8.098 8.274 1.00 37.95 C ATOM 1908 O GLU A 208 -17.965 -9.275 8.621 1.00 38.82 O ATOM 1909 CB GLU A 208 -20.346 -7.154 8.331 1.00 40.81 C ATOM 1910 CG GLU A 208 -20.438 -6.473 6.942 1.00 41.31 C ATOM 1911 CD GLU A 208 -21.771 -6.712 6.237 1.00 43.74 C ATOM 1912 OE1 GLU A 208 -22.764 -7.058 6.923 1.00 46.94 O ATOM 1913 OE2 GLU A 208 -21.828 -6.549 4.992 1.00 44.98 O ATOM 1914 H GLU A 208 -18.749 -5.102 8.231 1.00 0.00 H ATOM 1915 N GLN A 209 -17.255 -7.602 7.295 1.00 36.43 N ATOM 1916 CA GLN A 209 -16.405 -8.445 6.446 1.00 35.65 C ATOM 1917 C GLN A 209 -15.129 -8.987 7.118 1.00 33.77 C ATOM 1918 O GLN A 209 -14.349 -8.242 7.710 1.00 32.09 O ATOM 1919 CB GLN A 209 -16.037 -7.689 5.160 1.00 35.27 C ATOM 1920 CG GLN A 209 -15.802 -8.592 3.946 1.00 36.77 C ATOM 1921 CD GLN A 209 -17.089 -9.186 3.385 1.00 39.65 C ATOM 1922 OE1 GLN A 209 -18.099 -8.490 3.221 1.00 39.68 O ATOM 1923 NE2 GLN A 209 -17.054 -10.483 3.085 1.00 41.18 N ATOM 1924 HE22 GLN A 209 -16.183 -11.029 3.240 1.00 0.00 H ATOM 1925 HE21 GLN A 209 -17.898 -10.950 2.696 1.00 0.00 H ATOM 1926 H GLN A 209 -17.270 -6.576 7.125 1.00 0.00 H ATOM 1927 N LYS A 210 -14.935 -10.296 7.004 1.00 34.00 N ATOM 1928 CA LYS A 210 -13.724 -10.966 7.457 1.00 33.08 C ATOM 1929 C LYS A 210 -12.766 -11.104 6.276 1.00 32.26 C ATOM 1930 O LYS A 210 -13.199 -11.322 5.145 1.00 33.20 O ATOM 1931 CB LYS A 210 -14.069 -12.344 8.030 1.00 34.09 C ATOM 1932 CG LYS A 210 -12.934 -13.047 8.775 1.00 34.22 C ATOM 1933 CD LYS A 210 -13.457 -14.140 9.736 1.00 35.52 C ATOM 1934 CE LYS A 210 -13.497 -13.621 11.184 1.00 35.63 C ATOM 1935 NZ LYS A 210 -14.324 -14.438 12.116 1.00 36.50 N ATOM 1936 HZ1 LYS A 210 -15.307 -14.460 11.777 1.00 0.00 H ATOM 1937 HZ2 LYS A 210 -13.947 -15.407 12.154 1.00 0.00 H ATOM 1938 HZ3 LYS A 210 -14.293 -14.016 13.066 1.00 0.00 H ATOM 1939 H LYS A 210 -15.685 -10.871 6.570 1.00 0.00 H ATOM 1940 N PHE A 211 -11.471 -10.973 6.542 1.00 30.74 N ATOM 1941 CA PHE A 211 -10.449 -11.115 5.512 1.00 29.80 C ATOM 1942 C PHE A 211 -9.336 -12.040 5.969 1.00 29.34 C ATOM 1943 O PHE A 211 -8.797 -11.876 7.057 1.00 28.42 O ATOM 1944 CB PHE A 211 -9.880 -9.746 5.135 1.00 28.74 C ATOM 1945 CG PHE A 211 -10.779 -8.950 4.243 1.00 29.10 C ATOM 1946 CD1 PHE A 211 -10.733 -9.124 2.859 1.00 28.89 C ATOM 1947 CD2 PHE A 211 -11.674 -8.034 4.779 1.00 28.92 C ATOM 1948 CE1 PHE A 211 -11.570 -8.399 2.021 1.00 29.96 C ATOM 1949 CE2 PHE A 211 -12.522 -7.304 3.946 1.00 30.73 C ATOM 1950 CZ PHE A 211 -12.468 -7.487 2.562 1.00 30.35 C ATOM 1951 H PHE A 211 -11.177 -10.762 7.517 1.00 0.00 H ATOM 1952 N SER A 212 -8.999 -13.009 5.125 1.00 30.06 N ATOM 1953 CA SER A 212 -7.972 -13.999 5.436 1.00 29.97 C ATOM 1954 C SER A 212 -6.595 -13.388 5.617 1.00 28.72 C ATOM 1955 O SER A 212 -6.228 -12.408 4.957 1.00 27.78 O ATOM 1956 CB SER A 212 -7.906 -15.073 4.348 1.00 31.41 C ATOM 1957 OG SER A 212 -9.028 -15.945 4.391 1.00 32.21 O ATOM 1958 HG SER A 212 -9.059 -16.397 5.271 1.00 0.00 H ATOM 1959 H SER A 212 -9.485 -13.064 4.207 1.00 0.00 H ATOM 1960 N SER A 213 -5.835 -13.974 6.535 1.00 28.73 N ATOM 1961 CA SER A 213 -4.438 -13.622 6.702 1.00 27.47 C ATOM 1962 C SER A 213 -3.577 -14.869 6.843 1.00 27.80 C ATOM 1963 O SER A 213 -3.974 -15.841 7.470 1.00 28.53 O ATOM 1964 CB SER A 213 -4.245 -12.696 7.898 1.00 26.61 C ATOM 1965 OG SER A 213 -2.926 -12.185 7.916 1.00 25.49 O ATOM 1966 HG SER A 213 -2.816 -11.586 8.697 1.00 0.00 H ATOM 1967 H SER A 213 -6.252 -14.703 7.149 1.00 0.00 H ATOM 1968 N LEU A 214 -2.402 -14.821 6.230 1.00 27.44 N ATOM 1969 CA LEU A 214 -1.416 -15.880 6.315 1.00 27.87 C ATOM 1970 C LEU A 214 -0.682 -15.754 7.648 1.00 27.75 C ATOM 1971 O LEU A 214 0.062 -14.787 7.861 1.00 26.46 O ATOM 1972 CB LEU A 214 -0.431 -15.779 5.146 1.00 27.62 C ATOM 1973 CG LEU A 214 0.773 -16.721 5.097 1.00 27.92 C ATOM 1974 CD1 LEU A 214 0.321 -18.170 4.964 1.00 29.18 C ATOM 1975 CD2 LEU A 214 1.700 -16.338 3.953 1.00 27.94 C ATOM 1976 H LEU A 214 -2.177 -13.981 5.660 1.00 0.00 H ATOM 1977 N PRO A 215 -0.873 -16.744 8.543 1.00 28.92 N ATOM 1978 CA PRO A 215 -0.266 -16.676 9.858 1.00 29.13 C ATOM 1979 C PRO A 215 1.178 -17.189 9.844 1.00 29.68 C ATOM 1980 O PRO A 215 1.419 -18.395 9.859 1.00 31.20 O ATOM 1981 CB PRO A 215 -1.173 -17.578 10.715 1.00 30.14 C ATOM 1982 CG PRO A 215 -1.965 -18.400 9.759 1.00 30.76 C ATOM 1983 CD PRO A 215 -1.621 -17.998 8.360 1.00 30.36 C ATOM 1984 N LEU A 216 2.135 -16.276 9.806 1.00 28.89 N ATOM 1985 CA LEU A 216 3.525 -16.686 9.916 1.00 29.35 C ATOM 1986 C LEU A 216 4.231 -15.968 11.051 1.00 28.60 C ATOM 1987 O LEU A 216 3.876 -14.834 11.381 1.00 27.69 O ATOM 1988 CB LEU A 216 4.284 -16.517 8.592 1.00 29.51 C ATOM 1989 CG LEU A 216 3.836 -15.575 7.483 1.00 28.42 C ATOM 1990 CD1 LEU A 216 4.045 -14.132 7.859 1.00 27.50 C ATOM 1991 CD2 LEU A 216 4.627 -15.917 6.260 1.00 29.39 C ATOM 1992 H LEU A 216 1.894 -15.270 9.698 1.00 0.00 H ATOM 1993 N GLY A 217 5.205 -16.652 11.653 1.00 28.84 N ATOM 1994 CA GLY A 217 6.052 -16.073 12.689 1.00 28.37 C ATOM 1995 C GLY A 217 7.283 -15.394 12.117 1.00 27.83 C ATOM 1996 O GLY A 217 7.470 -15.366 10.898 1.00 27.35 O ATOM 1997 H GLY A 217 5.367 -17.640 11.372 1.00 0.00 H ATOM 1998 N ARG A 218 8.118 -14.856 13.008 1.00 27.92 N ATOM 1999 CA ARG A 218 9.391 -14.209 12.653 1.00 28.23 C ATOM 2000 C ARG A 218 10.354 -15.103 11.856 1.00 29.24 C ATOM 2001 O ARG A 218 11.084 -14.620 10.982 1.00 29.17 O ATOM 2002 CB ARG A 218 10.090 -13.699 13.913 1.00 28.42 C ATOM 2003 CG ARG A 218 10.092 -14.702 15.046 1.00 31.31 C ATOM 2004 CD ARG A 218 10.331 -14.041 16.381 1.00 35.18 C ATOM 2005 NE ARG A 218 9.138 -13.388 16.926 1.00 36.04 N ATOM 2006 CZ ARG A 218 8.491 -13.790 18.018 1.00 38.35 C ATOM 2007 NH1 ARG A 218 8.910 -14.853 18.699 1.00 41.21 N ATOM 2008 NH2 ARG A 218 7.422 -13.123 18.441 1.00 38.45 N ATOM 2009 HE ARG A 218 8.771 -12.553 16.426 1.00 0.00 H ATOM 2010 HH12 ARG A 218 8.398 -15.160 19.551 1.00 0.00 H ATOM 2011 HH11 ARG A 218 9.749 -15.377 18.380 1.00 0.00 H ATOM 2012 HH22 ARG A 218 6.917 -13.437 19.294 1.00 0.00 H ATOM 2013 HH21 ARG A 218 7.091 -12.287 17.919 1.00 0.00 H ATOM 2014 H ARG A 218 7.853 -14.896 14.013 1.00 0.00 H ATOM 2015 N GLU A 219 10.348 -16.398 12.155 1.00 30.22 N ATOM 2016 CA GLU A 219 11.259 -17.345 11.523 1.00 31.82 C ATOM 2017 C GLU A 219 10.902 -17.563 10.055 1.00 31.30 C ATOM 2018 O GLU A 219 11.770 -17.487 9.180 1.00 31.60 O ATOM 2019 CB GLU A 219 11.285 -18.674 12.287 1.00 33.48 C ATOM 2020 CG GLU A 219 11.758 -18.564 13.758 1.00 36.94 C ATOM 2021 CD GLU A 219 10.665 -18.087 14.756 1.00 40.14 C ATOM 2022 OE1 GLU A 219 9.618 -17.537 14.319 1.00 40.27 O ATOM 2023 OE2 GLU A 219 10.862 -18.256 15.991 1.00 41.10 O ATOM 2024 H GLU A 219 9.671 -16.747 12.863 1.00 0.00 H ATOM 2025 N ALA A 220 9.624 -17.814 9.788 1.00 30.56 N ATOM 2026 CA ALA A 220 9.155 -18.017 8.426 1.00 30.15 C ATOM 2027 C ALA A 220 9.370 -16.759 7.596 1.00 28.80 C ATOM 2028 O ALA A 220 9.914 -16.828 6.493 1.00 29.15 O ATOM 2029 CB ALA A 220 7.687 -18.426 8.421 1.00 30.33 C ATOM 2030 H ALA A 220 8.943 -17.867 10.572 1.00 0.00 H ATOM 2031 N VAL A 221 8.961 -15.615 8.139 1.00 27.19 N ATOM 2032 CA VAL A 221 9.101 -14.336 7.451 1.00 26.32 C ATOM 2033 C VAL A 221 10.539 -14.102 7.009 1.00 27.02 C ATOM 2034 O VAL A 221 10.822 -13.909 5.826 1.00 27.03 O ATOM 2035 CB VAL A 221 8.672 -13.165 8.351 1.00 25.03 C ATOM 2036 CG1 VAL A 221 8.939 -11.808 7.659 1.00 23.68 C ATOM 2037 CG2 VAL A 221 7.235 -13.299 8.702 1.00 24.23 C ATOM 2038 H VAL A 221 8.528 -15.633 9.084 1.00 0.00 H ATOM 2039 N GLU A 222 11.435 -14.127 7.982 1.00 27.72 N ATOM 2040 CA GLU A 222 12.849 -13.939 7.753 1.00 29.37 C ATOM 2041 C GLU A 222 13.403 -14.957 6.743 1.00 30.12 C ATOM 2042 O GLU A 222 14.050 -14.566 5.761 1.00 30.93 O ATOM 2043 CB GLU A 222 13.565 -13.985 9.098 1.00 29.43 C ATOM 2044 CG GLU A 222 15.004 -14.418 9.091 1.00 32.71 C ATOM 2045 CD GLU A 222 15.594 -14.379 10.489 1.00 33.66 C ATOM 2046 OE1 GLU A 222 15.212 -13.468 11.263 1.00 37.13 O ATOM 2047 OE2 GLU A 222 16.434 -15.249 10.814 1.00 37.93 O ATOM 2048 H GLU A 222 11.107 -14.289 8.955 1.00 0.00 H ATOM 2049 N ALA A 223 13.123 -16.245 6.954 1.00 30.46 N ATOM 2050 CA ALA A 223 13.556 -17.277 6.004 1.00 31.15 C ATOM 2051 C ALA A 223 13.007 -17.038 4.588 1.00 30.53 C ATOM 2052 O ALA A 223 13.729 -17.229 3.615 1.00 31.46 O ATOM 2053 CB ALA A 223 13.198 -18.660 6.499 1.00 32.17 C ATOM 2054 H ALA A 223 12.591 -16.521 7.804 1.00 0.00 H ATOM 2055 N ALA A 224 11.752 -16.602 4.471 1.00 28.93 N ATOM 2056 CA ALA A 224 11.187 -16.282 3.157 1.00 28.52 C ATOM 2057 C ALA A 224 11.895 -15.092 2.511 1.00 27.94 C ATOM 2058 O ALA A 224 12.075 -15.071 1.295 1.00 28.77 O ATOM 2059 CB ALA A 224 9.676 -16.039 3.231 1.00 27.24 C ATOM 2060 H ALA A 224 11.167 -16.488 5.323 1.00 0.00 H ATOM 2061 N VAL A 225 12.309 -14.113 3.319 1.00 26.56 N ATOM 2062 CA VAL A 225 12.981 -12.931 2.777 1.00 25.59 C ATOM 2063 C VAL A 225 14.378 -13.306 2.281 1.00 26.60 C ATOM 2064 O VAL A 225 14.734 -13.026 1.125 1.00 27.11 O ATOM 2065 CB VAL A 225 12.999 -11.746 3.784 1.00 24.34 C ATOM 2066 CG1 VAL A 225 13.947 -10.647 3.342 1.00 22.91 C ATOM 2067 CG2 VAL A 225 11.597 -11.184 3.957 1.00 23.04 C ATOM 2068 H VAL A 225 12.152 -14.191 4.344 1.00 0.00 H ATOM 2069 N LYS A 226 15.146 -13.962 3.146 1.00 27.10 N ATOM 2070 CA LYS A 226 16.506 -14.399 2.816 1.00 28.26 C ATOM 2071 C LYS A 226 16.491 -15.251 1.565 1.00 29.18 C ATOM 2072 O LYS A 226 17.330 -15.097 0.682 1.00 29.95 O ATOM 2073 CB LYS A 226 17.102 -15.214 3.956 1.00 29.17 C ATOM 2074 CG LYS A 226 17.452 -14.421 5.199 1.00 28.84 C ATOM 2075 CD LYS A 226 17.563 -15.351 6.390 1.00 29.67 C ATOM 2076 CE LYS A 226 18.547 -14.846 7.434 1.00 29.99 C ATOM 2077 NZ LYS A 226 19.788 -15.673 7.439 1.00 30.79 N ATOM 2078 HZ1 LYS A 226 19.544 -16.660 7.658 1.00 0.00 H ATOM 2079 HZ2 LYS A 226 20.239 -15.625 6.503 1.00 0.00 H ATOM 2080 HZ3 LYS A 226 20.443 -15.308 8.160 1.00 0.00 H ATOM 2081 H LYS A 226 14.768 -14.173 4.092 1.00 0.00 H ATOM 2082 N GLU A 227 15.511 -16.143 1.490 1.00 29.34 N ATOM 2083 CA GLU A 227 15.384 -17.065 0.372 1.00 30.52 C ATOM 2084 C GLU A 227 15.088 -16.347 -0.941 1.00 30.25 C ATOM 2085 O GLU A 227 15.499 -16.789 -2.009 1.00 31.40 O ATOM 2086 CB GLU A 227 14.278 -18.038 0.676 1.00 30.37 C ATOM 2087 CG GLU A 227 14.275 -19.213 -0.194 1.00 32.80 C ATOM 2088 CD GLU A 227 13.811 -20.432 0.541 1.00 36.29 C ATOM 2089 OE1 GLU A 227 13.460 -20.328 1.749 1.00 35.28 O ATOM 2090 OE2 GLU A 227 13.813 -21.505 -0.094 1.00 39.41 O ATOM 2091 H GLU A 227 14.810 -16.184 2.257 1.00 0.00 H ATOM 2092 N ALA A 228 14.381 -15.229 -0.844 1.00 28.88 N ATOM 2093 CA ALA A 228 13.963 -14.478 -2.012 1.00 28.65 C ATOM 2094 C ALA A 228 15.124 -13.682 -2.626 1.00 28.95 C ATOM 2095 O ALA A 228 14.971 -13.052 -3.677 1.00 29.11 O ATOM 2096 CB ALA A 228 12.800 -13.573 -1.649 1.00 27.04 C ATOM 2097 H ALA A 228 14.118 -14.880 0.100 1.00 0.00 H ATOM 2098 N GLY A 229 16.282 -13.723 -1.970 1.00 29.15 N ATOM 2099 CA GLY A 229 17.484 -13.047 -2.466 1.00 29.91 C ATOM 2100 C GLY A 229 17.766 -11.705 -1.808 1.00 29.02 C ATOM 2101 O GLY A 229 18.384 -10.821 -2.407 1.00 29.70 O ATOM 2102 H GLY A 229 16.335 -14.252 -1.076 1.00 0.00 H ATOM 2103 N TYR A 230 17.311 -11.552 -0.571 1.00 27.81 N ATOM 2104 CA TYR A 230 17.534 -10.331 0.171 1.00 26.71 C ATOM 2105 C TYR A 230 18.481 -10.574 1.320 1.00 26.90 C ATOM 2106 O TYR A 230 18.593 -11.693 1.819 1.00 27.47 O ATOM 2107 CB TYR A 230 16.214 -9.795 0.716 1.00 25.34 C ATOM 2108 CG TYR A 230 15.244 -9.388 -0.354 1.00 25.14 C ATOM 2109 CD1 TYR A 230 15.402 -8.181 -1.039 1.00 25.59 C ATOM 2110 CD2 TYR A 230 14.170 -10.198 -0.688 1.00 24.97 C ATOM 2111 CE1 TYR A 230 14.512 -7.793 -2.031 1.00 24.49 C ATOM 2112 CE2 TYR A 230 13.273 -9.814 -1.673 1.00 24.93 C ATOM 2113 CZ TYR A 230 13.457 -8.611 -2.337 1.00 24.37 C ATOM 2114 OH TYR A 230 12.578 -8.219 -3.306 1.00 24.98 O ATOM 2115 HH TYR A 230 12.567 -8.892 -4.032 1.00 0.00 H ATOM 2116 H TYR A 230 16.782 -12.328 -0.125 1.00 0.00 H ATOM 2117 N THR A 231 19.154 -9.511 1.738 1.00 26.56 N ATOM 2118 CA THR A 231 19.986 -9.546 2.925 1.00 26.99 C ATOM 2119 C THR A 231 19.353 -8.660 4.003 1.00 25.70 C ATOM 2120 O THR A 231 19.155 -7.464 3.786 1.00 25.30 O ATOM 2121 CB THR A 231 21.491 -9.212 2.604 1.00 28.27 C ATOM 2122 OG1 THR A 231 22.245 -9.116 3.818 1.00 29.72 O ATOM 2123 CG2 THR A 231 21.657 -7.923 1.808 1.00 28.19 C ATOM 2124 HG1 THR A 231 23.188 -8.906 3.603 1.00 0.00 H ATOM 2125 H THR A 231 19.083 -8.625 1.198 1.00 0.00 H ATOM 2126 N ILE A 232 19.006 -9.261 5.142 1.00 25.51 N ATOM 2127 CA ILE A 232 18.298 -8.557 6.219 1.00 24.95 C ATOM 2128 C ILE A 232 19.210 -7.584 6.962 1.00 25.44 C ATOM 2129 O ILE A 232 20.175 -7.989 7.598 1.00 26.65 O ATOM 2130 CB ILE A 232 17.616 -9.517 7.238 1.00 24.74 C ATOM 2131 CG1 ILE A 232 16.820 -10.608 6.521 1.00 25.77 C ATOM 2132 CG2 ILE A 232 16.667 -8.756 8.162 1.00 23.34 C ATOM 2133 CD1 ILE A 232 16.090 -11.548 7.455 1.00 24.97 C ATOM 2134 H ILE A 232 19.246 -10.265 5.272 1.00 0.00 H ATOM 2135 N GLU A 233 18.896 -6.298 6.874 1.00 24.86 N ATOM 2136 CA GLU A 233 19.673 -5.285 7.579 1.00 25.76 C ATOM 2137 C GLU A 233 19.193 -5.191 9.026 1.00 25.23 C ATOM 2138 O GLU A 233 19.993 -5.220 9.961 1.00 25.13 O ATOM 2139 CB GLU A 233 19.587 -3.936 6.863 1.00 25.50 C ATOM 2140 CG GLU A 233 20.137 -3.989 5.460 1.00 26.76 C ATOM 2141 CD GLU A 233 21.359 -3.136 5.294 1.00 30.47 C ATOM 2142 OE1 GLU A 233 22.466 -3.696 5.120 1.00 33.05 O ATOM 2143 OE2 GLU A 233 21.214 -1.893 5.342 1.00 31.76 O ATOM 2144 H GLU A 233 18.083 -6.008 6.293 1.00 0.00 H ATOM 2145 N TRP A 234 17.880 -5.082 9.207 1.00 24.45 N ATOM 2146 CA TRP A 234 17.331 -5.246 10.535 1.00 24.48 C ATOM 2147 C TRP A 234 15.916 -5.732 10.553 1.00 23.22 C ATOM 2148 O TRP A 234 15.230 -5.706 9.541 1.00 22.39 O ATOM 2149 CB TRP A 234 17.524 -3.999 11.405 1.00 25.97 C ATOM 2150 CG TRP A 234 16.850 -2.756 10.965 1.00 25.89 C ATOM 2151 CD1 TRP A 234 17.401 -1.726 10.238 1.00 27.22 C ATOM 2152 CD2 TRP A 234 15.508 -2.367 11.268 1.00 26.64 C ATOM 2153 NE1 TRP A 234 16.467 -0.727 10.063 1.00 28.21 N ATOM 2154 CE2 TRP A 234 15.297 -1.100 10.682 1.00 27.22 C ATOM 2155 CE3 TRP A 234 14.453 -2.973 11.970 1.00 26.48 C ATOM 2156 CZ2 TRP A 234 14.068 -0.431 10.778 1.00 26.44 C ATOM 2157 CZ3 TRP A 234 13.231 -2.304 12.058 1.00 25.45 C ATOM 2158 CH2 TRP A 234 13.049 -1.050 11.465 1.00 24.26 C ATOM 2159 HE1 TRP A 234 16.622 0.163 9.547 1.00 0.00 H ATOM 2160 H TRP A 234 17.254 -4.881 8.401 1.00 0.00 H ATOM 2161 N PHE A 235 15.514 -6.203 11.728 1.00 23.36 N ATOM 2162 CA PHE A 235 14.285 -6.944 11.914 1.00 23.35 C ATOM 2163 C PHE A 235 13.827 -6.767 13.357 1.00 23.17 C ATOM 2164 O PHE A 235 14.594 -6.998 14.298 1.00 24.03 O ATOM 2165 CB PHE A 235 14.530 -8.435 11.598 1.00 24.52 C ATOM 2166 CG PHE A 235 13.275 -9.280 11.576 1.00 25.38 C ATOM 2167 CD1 PHE A 235 12.796 -9.795 10.384 1.00 26.94 C ATOM 2168 CD2 PHE A 235 12.577 -9.565 12.746 1.00 25.69 C ATOM 2169 CE1 PHE A 235 11.644 -10.586 10.357 1.00 27.15 C ATOM 2170 CE2 PHE A 235 11.432 -10.335 12.721 1.00 25.83 C ATOM 2171 CZ PHE A 235 10.967 -10.851 11.527 1.00 25.66 C ATOM 2172 H PHE A 235 16.115 -6.030 12.559 1.00 0.00 H ATOM 2173 N GLU A 236 12.571 -6.375 13.521 1.00 22.52 N ATOM 2174 CA GLU A 236 12.020 -6.022 14.830 1.00 23.33 C ATOM 2175 C GLU A 236 10.679 -6.708 15.045 1.00 22.33 C ATOM 2176 O GLU A 236 9.835 -6.740 14.155 1.00 21.51 O ATOM 2177 CB GLU A 236 11.844 -4.501 14.933 1.00 23.20 C ATOM 2178 CG GLU A 236 11.509 -3.963 16.333 1.00 25.34 C ATOM 2179 CD GLU A 236 11.073 -2.490 16.313 1.00 25.04 C ATOM 2180 OE1 GLU A 236 10.083 -2.167 15.626 1.00 27.86 O ATOM 2181 OE2 GLU A 236 11.698 -1.650 16.999 1.00 28.78 O ATOM 2182 H GLU A 236 11.953 -6.316 12.687 1.00 0.00 H ATOM 2183 N VAL A 237 10.495 -7.255 16.234 1.00 22.70 N ATOM 2184 CA VAL A 237 9.234 -7.861 16.620 1.00 22.34 C ATOM 2185 C VAL A 237 8.644 -7.067 17.778 1.00 22.58 C ATOM 2186 O VAL A 237 9.351 -6.707 18.725 1.00 23.06 O ATOM 2187 CB VAL A 237 9.440 -9.341 17.006 1.00 23.12 C ATOM 2188 CG1 VAL A 237 8.245 -9.905 17.766 1.00 23.48 C ATOM 2189 CG2 VAL A 237 9.728 -10.171 15.760 1.00 23.36 C ATOM 2190 H VAL A 237 11.280 -7.251 16.916 1.00 0.00 H ATOM 2191 N ILE A 238 7.355 -6.780 17.696 1.00 22.32 N ATOM 2192 CA ILE A 238 6.674 -6.110 18.787 1.00 23.40 C ATOM 2193 C ILE A 238 5.425 -6.871 19.212 1.00 23.88 C ATOM 2194 O ILE A 238 4.729 -7.465 18.382 1.00 23.43 O ATOM 2195 CB ILE A 238 6.349 -4.624 18.461 1.00 22.81 C ATOM 2196 CG1 ILE A 238 5.196 -4.511 17.492 1.00 23.05 C ATOM 2197 CG2 ILE A 238 7.536 -3.925 17.838 1.00 22.75 C ATOM 2198 CD1 ILE A 238 3.906 -4.195 18.156 1.00 26.11 C ATOM 2199 H ILE A 238 6.824 -7.038 16.840 1.00 0.00 H ATOM 2200 N SER A 239 5.154 -6.839 20.516 1.00 25.14 N ATOM 2201 CA SER A 239 4.060 -7.595 21.128 1.00 26.16 C ATOM 2202 C SER A 239 2.657 -7.035 20.867 1.00 25.91 C ATOM 2203 O SER A 239 1.683 -7.788 20.798 1.00 26.47 O ATOM 2204 CB SER A 239 4.292 -7.681 22.627 1.00 27.20 C ATOM 2205 OG SER A 239 5.618 -8.089 22.864 1.00 29.22 O ATOM 2206 HG SER A 239 5.775 -8.147 23.840 1.00 0.00 H ATOM 2207 H SER A 239 5.749 -6.247 21.130 1.00 0.00 H ATOM 2208 N GLN A 240 2.559 -5.719 20.748 1.00 25.57 N ATOM 2209 CA GLN A 240 1.280 -5.048 20.550 1.00 25.90 C ATOM 2210 C GLN A 240 0.379 -5.703 19.487 1.00 25.32 C ATOM 2211 O GLN A 240 0.779 -5.880 18.327 1.00 24.61 O ATOM 2212 CB GLN A 240 1.526 -3.566 20.244 1.00 25.80 C ATOM 2213 CG GLN A 240 0.274 -2.759 20.010 1.00 27.37 C ATOM 2214 CD GLN A 240 -0.623 -2.731 21.220 1.00 29.72 C ATOM 2215 OE1 GLN A 240 -0.170 -2.438 22.334 1.00 31.28 O ATOM 2216 NE2 GLN A 240 -1.910 -3.032 21.013 1.00 29.46 N ATOM 2217 HE22 GLN A 240 -2.241 -3.272 20.057 1.00 0.00 H ATOM 2218 HE21 GLN A 240 -2.580 -3.026 21.809 1.00 0.00 H ATOM 2219 H GLN A 240 3.425 -5.145 20.798 1.00 0.00 H ATOM 2220 N SER A 241 -0.837 -6.061 19.915 1.00 25.75 N ATOM 2221 CA SER A 241 -1.865 -6.678 19.060 1.00 25.06 C ATOM 2222 C SER A 241 -2.944 -5.679 18.680 1.00 24.46 C ATOM 2223 O SER A 241 -3.087 -4.639 19.324 1.00 24.92 O ATOM 2224 CB SER A 241 -2.545 -7.842 19.799 1.00 26.15 C ATOM 2225 OG SER A 241 -1.743 -9.014 19.815 1.00 26.70 O ATOM 2226 HG SER A 241 -1.565 -9.303 18.885 1.00 0.00 H ATOM 2227 H SER A 241 -1.071 -5.893 20.914 1.00 0.00 H ATOM 2228 N TYR A 242 -3.707 -6.003 17.635 1.00 23.43 N ATOM 2229 CA TYR A 242 -4.980 -5.349 17.373 1.00 22.60 C ATOM 2230 C TYR A 242 -5.994 -5.758 18.424 1.00 23.47 C ATOM 2231 O TYR A 242 -5.708 -6.608 19.260 1.00 24.06 O ATOM 2232 CB TYR A 242 -5.511 -5.728 15.992 1.00 21.88 C ATOM 2233 CG TYR A 242 -4.779 -5.055 14.883 1.00 19.89 C ATOM 2234 CD1 TYR A 242 -4.979 -3.697 14.615 1.00 18.90 C ATOM 2235 CD2 TYR A 242 -3.873 -5.768 14.106 1.00 18.66 C ATOM 2236 CE1 TYR A 242 -4.286 -3.067 13.584 1.00 19.33 C ATOM 2237 CE2 TYR A 242 -3.168 -5.155 13.089 1.00 18.61 C ATOM 2238 CZ TYR A 242 -3.376 -3.813 12.824 1.00 18.31 C ATOM 2239 OH TYR A 242 -2.686 -3.230 11.801 1.00 17.22 O ATOM 2240 HH TYR A 242 -2.940 -2.275 11.735 1.00 0.00 H ATOM 2241 H TYR A 242 -3.381 -6.748 16.986 1.00 0.00 H ATOM 2242 N SER A 243 -7.179 -5.154 18.371 1.00 23.89 N ATOM 2243 CA SER A 243 -8.266 -5.486 19.284 1.00 25.23 C ATOM 2244 C SER A 243 -8.764 -6.884 18.934 1.00 25.81 C ATOM 2245 O SER A 243 -8.695 -7.289 17.777 1.00 25.37 O ATOM 2246 CB SER A 243 -9.387 -4.437 19.194 1.00 25.79 C ATOM 2247 OG SER A 243 -8.883 -3.110 19.355 1.00 24.95 O ATOM 2248 HG SER A 243 -8.221 -2.921 18.644 1.00 0.00 H ATOM 2249 H SER A 243 -7.335 -4.419 17.652 1.00 0.00 H ATOM 2250 N SER A 244 -9.231 -7.638 19.926 1.00 27.46 N ATOM 2251 CA SER A 244 -9.560 -9.051 19.687 1.00 28.49 C ATOM 2252 C SER A 244 -10.735 -9.223 18.732 1.00 28.95 C ATOM 2253 O SER A 244 -10.881 -10.285 18.123 1.00 29.78 O ATOM 2254 CB SER A 244 -9.744 -9.862 20.983 1.00 29.61 C ATOM 2255 OG SER A 244 -10.599 -9.235 21.919 1.00 31.41 O ATOM 2256 HG SER A 244 -10.676 -9.803 22.726 1.00 0.00 H ATOM 2257 H SER A 244 -9.364 -7.227 20.872 1.00 0.00 H ATOM 2258 N THR A 245 -11.532 -8.165 18.572 1.00 28.83 N ATOM 2259 CA THR A 245 -12.678 -8.164 17.648 1.00 29.03 C ATOM 2260 C THR A 245 -12.261 -7.816 16.213 1.00 28.02 C ATOM 2261 O THR A 245 -13.094 -7.780 15.300 1.00 28.12 O ATOM 2262 CB THR A 245 -13.753 -7.134 18.083 1.00 29.69 C ATOM 2263 OG1 THR A 245 -13.189 -5.812 18.055 1.00 28.92 O ATOM 2264 CG2 THR A 245 -14.279 -7.434 19.477 1.00 30.20 C ATOM 2265 HG1 THR A 245 -13.876 -5.155 18.333 1.00 0.00 H ATOM 2266 H THR A 245 -11.335 -7.305 19.123 1.00 0.00 H ATOM 2267 N MET A 246 -10.974 -7.555 16.008 1.00 26.76 N ATOM 2268 CA MET A 246 -10.541 -6.995 14.742 1.00 26.24 C ATOM 2269 C MET A 246 -9.550 -7.836 13.974 1.00 25.25 C ATOM 2270 O MET A 246 -9.641 -7.893 12.748 1.00 24.90 O ATOM 2271 CB MET A 246 -10.012 -5.592 14.944 1.00 25.21 C ATOM 2272 CG MET A 246 -11.046 -4.717 15.603 1.00 27.42 C ATOM 2273 SD MET A 246 -10.706 -3.022 15.222 1.00 27.74 S ATOM 2274 CE MET A 246 -11.386 -2.960 13.558 1.00 31.18 C ATOM 2275 H MET A 246 -10.278 -7.752 16.755 1.00 0.00 H ATOM 2276 N ALA A 247 -8.595 -8.434 14.692 1.00 24.81 N ATOM 2277 CA ALA A 247 -7.604 -9.374 14.138 1.00 24.38 C ATOM 2278 C ALA A 247 -7.142 -10.333 15.234 1.00 24.83 C ATOM 2279 O ALA A 247 -7.300 -10.039 16.425 1.00 25.89 O ATOM 2280 CB ALA A 247 -6.414 -8.640 13.540 1.00 22.63 C ATOM 2281 H ALA A 247 -8.548 -8.222 15.709 1.00 0.00 H ATOM 2282 N ASN A 248 -6.592 -11.478 14.846 1.00 24.51 N ATOM 2283 CA ASN A 248 -6.063 -12.421 15.829 1.00 25.00 C ATOM 2284 C ASN A 248 -4.523 -12.527 15.855 1.00 24.59 C ATOM 2285 O ASN A 248 -3.970 -13.616 16.098 1.00 25.42 O ATOM 2286 CB ASN A 248 -6.714 -13.804 15.661 1.00 25.80 C ATOM 2287 CG ASN A 248 -6.406 -14.451 14.310 1.00 24.97 C ATOM 2288 OD1 ASN A 248 -6.026 -13.781 13.343 1.00 21.68 O ATOM 2289 ND2 ASN A 248 -6.583 -15.769 14.243 1.00 25.44 N ATOM 2290 HD22 ASN A 248 -6.904 -16.294 15.081 1.00 0.00 H ATOM 2291 HD21 ASN A 248 -6.400 -16.274 13.352 1.00 0.00 H ATOM 2292 H ASN A 248 -6.537 -11.706 13.833 1.00 0.00 H ATOM 2293 N ASN A 249 -3.836 -11.405 15.633 1.00 23.40 N ATOM 2294 CA ASN A 249 -2.368 -11.403 15.612 1.00 23.38 C ATOM 2295 C ASN A 249 -1.703 -11.442 16.996 1.00 24.10 C ATOM 2296 O ASN A 249 -2.273 -11.025 18.007 1.00 24.45 O ATOM 2297 CB ASN A 249 -1.801 -10.265 14.739 1.00 21.77 C ATOM 2298 CG ASN A 249 -1.973 -8.887 15.360 1.00 22.00 C ATOM 2299 OD1 ASN A 249 -3.038 -8.549 15.888 1.00 23.02 O ATOM 2300 ND2 ASN A 249 -0.922 -8.068 15.279 1.00 20.11 N ATOM 2301 HD22 ASN A 249 -0.044 -8.392 14.826 1.00 0.00 H ATOM 2302 HD21 ASN A 249 -0.981 -7.106 15.669 1.00 0.00 H ATOM 2303 H ASN A 249 -4.350 -10.515 15.472 1.00 0.00 H ATOM 2304 N GLU A 250 -0.495 -11.979 17.030 1.00 24.74 N ATOM 2305 CA GLU A 250 0.300 -11.975 18.249 1.00 25.77 C ATOM 2306 C GLU A 250 1.123 -10.697 18.321 1.00 24.94 C ATOM 2307 O GLU A 250 1.420 -10.199 19.407 1.00 25.83 O ATOM 2308 CB GLU A 250 1.196 -13.202 18.320 1.00 26.41 C ATOM 2309 CG GLU A 250 0.441 -14.499 18.142 1.00 28.99 C ATOM 2310 CD GLU A 250 1.167 -15.677 18.729 1.00 33.37 C ATOM 2311 OE1 GLU A 250 2.292 -15.481 19.246 1.00 34.98 O ATOM 2312 OE2 GLU A 250 0.611 -16.802 18.679 1.00 35.87 O ATOM 2313 H GLU A 250 -0.105 -12.413 16.169 1.00 0.00 H ATOM 2314 N GLY A 251 1.483 -10.164 17.163 1.00 23.68 N ATOM 2315 CA GLY A 251 2.129 -8.869 17.108 1.00 22.55 C ATOM 2316 C GLY A 251 2.392 -8.411 15.693 1.00 21.63 C ATOM 2317 O GLY A 251 1.697 -8.795 14.745 1.00 21.02 O ATOM 2318 H GLY A 251 1.299 -10.683 16.281 1.00 0.00 H ATOM 2319 N LEU A 252 3.404 -7.564 15.562 1.00 21.13 N ATOM 2320 CA LEU A 252 3.832 -7.079 14.266 1.00 20.08 C ATOM 2321 C LEU A 252 5.348 -7.099 14.124 1.00 19.49 C ATOM 2322 O LEU A 252 6.089 -7.180 15.111 1.00 19.33 O ATOM 2323 CB LEU A 252 3.286 -5.685 14.027 1.00 19.98 C ATOM 2324 CG LEU A 252 1.785 -5.639 13.776 1.00 21.73 C ATOM 2325 CD1 LEU A 252 1.038 -5.291 15.060 1.00 23.77 C ATOM 2326 CD2 LEU A 252 1.505 -4.602 12.700 1.00 23.99 C ATOM 2327 H LEU A 252 3.904 -7.239 16.414 1.00 0.00 H ATOM 2328 N PHE A 253 5.801 -7.044 12.881 1.00 18.55 N ATOM 2329 CA PHE A 253 7.232 -6.987 12.608 1.00 18.18 C ATOM 2330 C PHE A 253 7.544 -5.886 11.614 1.00 17.46 C ATOM 2331 O PHE A 253 6.693 -5.535 10.811 1.00 16.64 O ATOM 2332 CB PHE A 253 7.736 -8.334 12.072 1.00 18.13 C ATOM 2333 CG PHE A 253 7.340 -8.610 10.653 1.00 16.39 C ATOM 2334 CD1 PHE A 253 8.092 -8.098 9.593 1.00 15.33 C ATOM 2335 CD2 PHE A 253 6.219 -9.382 10.374 1.00 15.85 C ATOM 2336 CE1 PHE A 253 7.732 -8.332 8.282 1.00 13.94 C ATOM 2337 CE2 PHE A 253 5.846 -9.641 9.063 1.00 14.80 C ATOM 2338 CZ PHE A 253 6.611 -9.114 8.013 1.00 16.16 C ATOM 2339 H PHE A 253 5.127 -7.041 12.089 1.00 0.00 H ATOM 2340 N SER A 254 8.763 -5.357 11.695 1.00 18.09 N ATOM 2341 CA SER A 254 9.340 -4.483 10.677 1.00 18.36 C ATOM 2342 C SER A 254 10.629 -5.113 10.213 1.00 19.38 C ATOM 2343 O SER A 254 11.365 -5.694 11.014 1.00 19.99 O ATOM 2344 CB SER A 254 9.691 -3.089 11.221 1.00 18.53 C ATOM 2345 OG SER A 254 8.685 -2.506 12.037 1.00 18.48 O ATOM 2346 HG SER A 254 8.987 -1.615 12.345 1.00 0.00 H ATOM 2347 H SER A 254 9.338 -5.579 12.532 1.00 0.00 H ATOM 2348 N LEU A 255 10.907 -5.010 8.918 1.00 19.97 N ATOM 2349 CA LEU A 255 12.244 -5.301 8.423 1.00 21.04 C ATOM 2350 C LEU A 255 12.676 -4.336 7.353 1.00 21.35 C ATOM 2351 O LEU A 255 11.852 -3.835 6.573 1.00 20.95 O ATOM 2352 CB LEU A 255 12.369 -6.732 7.913 1.00 21.46 C ATOM 2353 CG LEU A 255 11.440 -7.225 6.818 1.00 22.36 C ATOM 2354 CD1 LEU A 255 11.972 -6.841 5.447 1.00 22.54 C ATOM 2355 CD2 LEU A 255 11.330 -8.740 6.942 1.00 23.88 C ATOM 2356 H LEU A 255 10.163 -4.719 8.252 1.00 0.00 H ATOM 2357 N VAL A 256 13.975 -4.081 7.330 1.00 22.08 N ATOM 2358 CA VAL A 256 14.597 -3.424 6.213 1.00 23.06 C ATOM 2359 C VAL A 256 15.605 -4.404 5.642 1.00 24.59 C ATOM 2360 O VAL A 256 16.485 -4.908 6.355 1.00 25.80 O ATOM 2361 CB VAL A 256 15.233 -2.061 6.611 1.00 23.37 C ATOM 2362 CG1 VAL A 256 16.218 -1.584 5.572 1.00 23.64 C ATOM 2363 CG2 VAL A 256 14.152 -1.022 6.793 1.00 22.65 C ATOM 2364 H VAL A 256 14.561 -4.364 8.142 1.00 0.00 H ATOM 2365 N ALA A 257 15.451 -4.685 4.353 1.00 25.21 N ATOM 2366 CA ALA A 257 16.319 -5.616 3.642 1.00 26.53 C ATOM 2367 C ALA A 257 16.941 -4.934 2.420 1.00 27.48 C ATOM 2368 O ALA A 257 16.446 -3.898 1.963 1.00 27.36 O ATOM 2369 CB ALA A 257 15.536 -6.843 3.238 1.00 25.91 C ATOM 2370 H ALA A 257 14.680 -4.222 3.830 1.00 0.00 H ATOM 2371 N ARG A 258 18.040 -5.496 1.920 1.00 29.11 N ATOM 2372 CA ARG A 258 18.674 -5.017 0.685 1.00 30.39 C ATOM 2373 C ARG A 258 18.772 -6.145 -0.333 1.00 31.30 C ATOM 2374 O ARG A 258 19.069 -7.290 0.024 1.00 31.48 O ATOM 2375 CB ARG A 258 20.060 -4.428 0.963 1.00 31.48 C ATOM 2376 CG ARG A 258 20.050 -3.005 1.522 1.00 31.53 C ATOM 2377 CD ARG A 258 21.476 -2.500 1.771 1.00 32.43 C ATOM 2378 NE ARG A 258 21.660 -1.114 1.327 1.00 33.04 N ATOM 2379 HE ARG A 258 20.866 -0.595 0.900 1.00 0.00 H ATOM 2380 H ARG A 258 18.464 -6.302 2.422 1.00 0.00 H ATOM 2381 N LYS A 259 18.509 -5.819 -1.598 1.00 31.99 N ATOM 2382 CA LYS A 259 18.545 -6.804 -2.681 1.00 33.41 C ATOM 2383 C LYS A 259 19.985 -7.151 -3.064 1.00 35.43 C ATOM 2384 O LYS A 259 20.881 -6.331 -2.897 1.00 35.89 O ATOM 2385 CB LYS A 259 17.784 -6.271 -3.890 1.00 33.29 C ATOM 2386 CG LYS A 259 17.355 -7.337 -4.882 1.00 34.22 C ATOM 2387 CD LYS A 259 17.276 -6.755 -6.274 1.00 34.23 C ATOM 2388 CE LYS A 259 16.974 -7.824 -7.310 1.00 34.28 C ATOM 2389 NZ LYS A 259 16.600 -7.163 -8.590 1.00 34.32 N ATOM 2390 HZ1 LYS A 259 15.759 -6.570 -8.440 1.00 0.00 H ATOM 2391 HZ2 LYS A 259 17.390 -6.570 -8.916 1.00 0.00 H ATOM 2392 HZ3 LYS A 259 16.391 -7.888 -9.305 1.00 0.00 H ATOM 2393 H LYS A 259 18.270 -4.832 -1.824 1.00 0.00 H ATOM 2394 N LEU A 260 20.205 -8.371 -3.561 1.00 37.47 N ATOM 2395 CA LEU A 260 21.562 -8.857 -3.913 1.00 39.84 C ATOM 2396 C LEU A 260 21.898 -8.750 -5.405 1.00 41.26 C ATOM 2397 O LEU A 260 21.001 -8.653 -6.256 1.00 41.29 O ATOM 2398 CB LEU A 260 21.768 -10.301 -3.438 1.00 40.65 C ATOM 2399 CG LEU A 260 21.803 -10.537 -1.923 1.00 40.82 C ATOM 2400 CD1 LEU A 260 22.087 -12.006 -1.590 1.00 42.16 C ATOM 2401 CD2 LEU A 260 22.835 -9.633 -1.261 1.00 42.07 C ATOM 2402 H LEU A 260 19.394 -9.005 -3.707 1.00 0.00 H TER 2403 LEU A 260 HETATM 2404 O HOH 1 0.947 -10.462 21.797 1.00 17.16 O HETATM 2405 O HOH 2 -1.292 -8.212 6.543 1.00 27.97 O HETATM 2406 O HOH 3 -14.646 -4.160 3.527 1.00 25.72 O HETATM 2407 O HOH 4 -8.176 6.120 19.466 1.00 19.84 O HETATM 2408 O HOH 5 -6.305 5.242 14.372 1.00 32.43 O HETATM 2409 O HOH 6 8.735 -17.235 17.019 1.00 33.69 O HETATM 2410 O HOH 7 -9.718 -18.192 5.486 1.00 34.94 O HETATM 2411 O HOH 8 -4.580 0.790 13.355 1.00 12.23 O HETATM 2412 O HOH 9 -3.012 -0.675 11.161 1.00 9.84 O HETATM 2413 O HOH 10 9.447 -1.254 -14.682 1.00 24.93 O HETATM 2414 O HOH 11 -15.438 -5.279 12.753 1.00 31.49 O HETATM 2415 O HOH 12 7.093 6.893 5.488 1.00 24.63 O HETATM 2416 O HOH 13 3.033 -5.905 3.884 1.00 15.53 O HETATM 2417 O HOH 14 0.601 -13.201 10.074 1.00 18.14 O HETATM 2418 O HOH 15 3.472 15.338 -8.179 1.00 23.12 O HETATM 2419 O HOH 16 -6.082 -6.192 22.040 1.00 24.39 O HETATM 2420 O HOH 17 -6.886 10.329 11.060 1.00 23.83 O HETATM 2421 O HOH 18 -8.203 -7.690 -11.700 1.00 39.89 O HETATM 2422 O HOH 19 4.669 -17.211 -8.874 1.00 39.81 O HETATM 2423 O HOH 20 13.095 16.574 0.434 1.00 36.52 O HETATM 2424 O HOH 21 -6.030 15.263 5.565 1.00 29.28 O HETATM 2425 O HOH 22 6.705 -15.158 15.603 1.00 26.08 O HETATM 2426 O HOH 23 -12.556 11.752 8.114 1.00 23.61 O HETATM 2427 O HOH 24 5.757 -19.754 11.723 1.00 21.62 O HETATM 2428 O HOH 25 22.600 -16.277 6.133 1.00 32.38 O HETATM 2429 O HOH 26 -0.601 -8.666 22.882 1.00 18.94 O HETATM 2430 C4 UNN A 27 -4.291 -6.683 10.263 1.00 0.05 C HETATM 2431 C5 UNN A 27 -4.662 -5.385 10.003 1.00 0.09 C HETATM 2432 C1 UNN A 27 -4.704 -4.932 8.701 1.00 0.28 C HETATM 2433 N1 UNN A 27 -4.396 -5.742 7.689 1.00 -0.26 N HETATM 2434 C2 UNN A 27 -4.037 -7.010 7.900 1.00 0.09 C HETATM 2435 C3 UNN A 27 -3.979 -7.490 9.194 1.00 0.16 C HETATM 2436 C6 UNN A 27 -3.595 -8.887 9.471 1.00 0.28 C HETATM 2437 N2 UNN A 27 -3.168 -9.573 8.348 1.00 -0.29 N HETATM 2438 H10 UNN A 27 -2.884 -10.529 8.424 1.00 0.18 H HETATM 2439 H11 UNN A 27 -3.144 -9.113 7.460 1.00 0.18 H HETATM 2440 O1 UNN A 27 -3.680 -9.324 10.622 1.00 -0.33 O HETATM 2441 H3 UNN A 27 -3.793 -7.657 7.065 1.00 0.13 H HETATM 2442 C8 UNN A 27 -4.444 -5.238 6.327 1.00 0.02 C HETATM 2443 H4 UNN A 27 -4.161 -6.040 5.629 1.00 0.04 H HETATM 2444 H5 UNN A 27 -3.743 -4.397 6.222 1.00 0.04 H HETATM 2445 H6 UNN A 27 -5.464 -4.896 6.098 1.00 0.04 H HETATM 2446 O2 UNN A 27 -5.069 -3.624 8.442 1.00 -0.22 O HETATM 2447 C7 UNN A 27 -5.336 -2.992 9.684 1.00 0.10 C HETATM 2448 H7 UNN A 27 -5.630 -1.947 9.508 1.00 0.07 H HETATM 2449 H8 UNN A 27 -4.432 -3.018 10.311 1.00 0.07 H HETATM 2450 H9 UNN A 27 -6.153 -3.521 10.197 1.00 0.07 H HETATM 2451 H2 UNN A 27 -4.921 -4.720 10.819 1.00 0.12 H HETATM 2452 H1 UNN A 27 -4.246 -7.059 11.279 1.00 0.10 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 2430 2431 2435 2452 CONECT 2431 2430 2432 2451 CONECT 2432 2431 2433 2446 CONECT 2433 2432 2434 2442 CONECT 2434 2433 2435 2441 CONECT 2435 2430 2434 2436 CONECT 2436 2435 2437 2440 CONECT 2437 2436 2438 2439 CONECT 2438 2437 CONECT 2439 2437 CONECT 2440 2436 CONECT 2441 2434 CONECT 2442 2433 2443 2444 2445 CONECT 2443 2442 CONECT 2444 2442 CONECT 2445 2442 CONECT 2446 2432 2447 CONECT 2447 2446 2448 2449 2450 CONECT 2448 2447 CONECT 2449 2447 CONECT 2450 2447 CONECT 2451 2431 CONECT 2452 2430 MASTER 0 0 0 0 0 0 0 0 2451 1 27 20 END
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Related entries of code: 5yjf
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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RCSB PDB
PDBbind
284aa, >5XVQ_1|Chains... *
6chh
RCSB PDB
PDBbind
283aa, >6CHH_1|Chains... at 96%
6pvs
RCSB PDB
PDBbind
283aa, >6PVS_1|Chains... at 96%
6pve
RCSB PDB
PDBbind
283aa, >6PVE_1|Chains... at 96%
6orr
RCSB PDB
PDBbind
283aa, >6ORR_1|Chains... at 96%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5yji
RCSB PDB
PDBbind
8WO
Entry Information
PDB ID
5yjf
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Nicotinamide N-methyltransferase
Ligand Name
8WO
EC.Number
E.C.-.-.-.-
Resolution
2.49(Å)
Affinity (Kd/Ki/IC50)
IC50=1.8uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Sci Rep Vol. 8: pp. 3660-3660
Ligand Properties
Formula
C
8
H
1
1
N
2
O
2
Molecular Weight
167.185
Exact Mass
167.082
No. of atoms
23
No. of bonds
23
Polar Surface Area
56.2
LOGP Value
0.16 (
Computed with XLOGP3
)
0.32 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 1
Canonical SMILES
COc1ccc(c[n+]1C)C(=O)N
InChI String
InChI=1S/C8H10N2O2/c1-10-5-6(8(9)11)3-4-7(10)12-2/h3-5H,1-2H3,(H-,9,11)/p+1
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):
P40261
Entrez Gene ID
NCBI Entrez Gene ID:
4837
ASD
Information of known allosteric effects of PDB entries
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