Browse entries in the PDBbind-CN Database
HEADER 4QPD_COMPLEX COMPND 4QPD_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 308 MET LYS ILE ALA VAL ILE GLY GLN SER LEU PHE GLY GLN SEQRES 2 A 308 GLU VAL TYR LYS GLU LEU LYS ASN GLU GLY HIS MET ILE SEQRES 3 A 308 VAL GLY VAL PHE THR ILE PRO ASP LYS ASP GLY LYS VAL SEQRES 4 A 308 ASP PRO LEU ALA ILE GLU ALA GLU LYS ASP GLY VAL PRO SEQRES 5 A 308 VAL PHE LYS PHE PRO ARG TRP ARG LEU LYS GLY LYS ALA SEQRES 6 A 308 ILE THR GLU VAL VAL ASP GLN TYR LYS ALA VAL GLY ALA SEQRES 7 A 308 GLU LEU ASN VAL LEU PRO PHE CYS SER GLN PHE ILE PRO SEQRES 8 A 308 MET GLU VAL ILE ASP HIS PRO LYS HIS GLY SER ILE ILE SEQRES 9 A 308 TYR HIS PRO SER LEU LEU PRO ARG HIS ARG GLY ALA SER SEQRES 10 A 308 ALA ILE ASN TRP THR LEU ILE HIS GLY ASP LYS LYS GLY SEQRES 11 A 308 GLY PHE THR VAL PHE TRP ALA ASP ASP GLY LEU ASP THR SEQRES 12 A 308 GLY PRO ILE LEU LEU GLN ARG GLU CYS ASP VAL GLU PRO SEQRES 13 A 308 ASN ASP ASN VAL ASN SER ILE TYR LYS ARG PHE LEU PHE SEQRES 14 A 308 PRO GLU GLY VAL LYS GLY MET VAL GLU ALA VAL ARG LEU SEQRES 15 A 308 ILE ALA THR GLY LYS ALA PRO ARG ILE LYS GLN PRO GLU SEQRES 16 A 308 GLU GLY ALA THR TYR GLU CYS ILE GLN LYS LYS GLU ASN SEQRES 17 A 308 SER LYS ILE ASP TRP ASN GLN PRO ALA GLU ALA ILE HIS SEQRES 18 A 308 ASN TRP ILE ARG GLY ASN ASP ARG VAL PRO GLY ALA TRP SEQRES 19 A 308 ALA GLU ILE ASP GLY LYS SER VAL SER PHE TYR GLY SER SEQRES 20 A 308 THR LEU LEU GLU ASN ASP HIS PHE SER SER ASN GLY GLN SEQRES 21 A 308 PRO LEU GLU ILE PRO GLY ALA SER ARG ALA ALA LEU VAL SEQRES 22 A 308 THR LYS ASN GLY LEU VAL LEU PHE GLY ASN ASP GLY LYS SEQRES 23 A 308 MET LEU LEU VAL LYS ASN LEU GLN PHE GLU ASP GLY LYS SEQRES 24 A 308 MET ILE PRO GLY SER GLN TYR PHE LYS HET THG A 514 55 ATOM 1 N MET A 1 30.866 0.238 59.967 1.00 25.57 N ATOM 2 CA MET A 1 31.849 0.281 58.888 1.00 28.71 C ATOM 3 C MET A 1 32.464 1.669 58.721 1.00 31.01 C ATOM 4 O MET A 1 31.953 2.660 59.258 1.00 34.02 O ATOM 5 CB MET A 1 31.206 -0.150 57.570 1.00 29.64 C ATOM 6 CG MET A 1 30.259 0.887 57.006 1.00 30.15 C ATOM 7 SD MET A 1 29.501 0.375 55.459 1.00 43.20 S ATOM 8 CE MET A 1 28.664 -1.117 55.985 1.00 23.73 C ATOM 9 HN3 MET A 1 30.098 0.909 59.762 1.00 0.00 H ATOM 10 HN2 MET A 1 31.325 0.498 60.863 1.00 0.00 H ATOM 11 HN1 MET A 1 30.477 -0.724 60.042 1.00 0.00 H ATOM 12 N LYS A 2 33.557 1.728 57.962 1.00 29.82 N ATOM 13 CA LYS A 2 34.246 2.982 57.666 1.00 28.32 C ATOM 14 C LYS A 2 33.562 3.717 56.518 1.00 30.55 C ATOM 15 O LYS A 2 33.439 3.180 55.411 1.00 32.23 O ATOM 16 CB LYS A 2 35.712 2.716 57.321 1.00 29.30 C ATOM 17 CG LYS A 2 36.514 2.118 58.469 1.00 34.96 C ATOM 18 CD LYS A 2 37.910 1.716 58.015 1.00 37.93 C ATOM 19 CE LYS A 2 38.802 1.418 59.208 1.00 43.46 C ATOM 20 NZ LYS A 2 38.233 0.365 60.099 1.00 47.11 N ATOM 21 HZ1 LYS A 2 37.310 0.680 60.460 1.00 0.00 H ATOM 22 HZ2 LYS A 2 38.114 -0.516 59.560 1.00 0.00 H ATOM 23 HZ3 LYS A 2 38.880 0.200 60.896 1.00 0.00 H ATOM 24 H LYS A 2 33.936 0.845 57.564 1.00 0.00 H ATOM 25 N ILE A 3 33.140 4.951 56.781 1.00 27.42 N ATOM 26 CA ILE A 3 32.292 5.693 55.852 1.00 27.13 C ATOM 27 C ILE A 3 32.888 7.060 55.502 1.00 27.72 C ATOM 28 O ILE A 3 33.343 7.793 56.386 1.00 28.25 O ATOM 29 CB ILE A 3 30.867 5.883 56.444 1.00 26.87 C ATOM 30 CG1 ILE A 3 30.173 4.526 56.613 1.00 26.56 C ATOM 31 CG2 ILE A 3 30.026 6.790 55.573 1.00 27.02 C ATOM 32 CD1 ILE A 3 28.763 4.618 57.177 1.00 23.09 C ATOM 33 H ILE A 3 33.423 5.401 57.675 1.00 0.00 H ATOM 34 N ALA A 4 32.911 7.383 54.207 1.00 25.52 N ATOM 35 CA ALA A 4 33.248 8.733 53.759 1.00 23.88 C ATOM 36 C ALA A 4 31.967 9.440 53.362 1.00 24.64 C ATOM 37 O ALA A 4 31.210 8.937 52.530 1.00 23.97 O ATOM 38 CB ALA A 4 34.224 8.704 52.594 1.00 21.87 C ATOM 39 H ALA A 4 32.683 6.656 53.499 1.00 0.00 H ATOM 40 N VAL A 5 31.715 10.599 53.960 1.00 26.02 N ATOM 41 CA VAL A 5 30.513 11.361 53.643 1.00 22.92 C ATOM 42 C VAL A 5 30.864 12.462 52.653 1.00 22.13 C ATOM 43 O VAL A 5 31.655 13.361 52.959 1.00 23.85 O ATOM 44 CB VAL A 5 29.872 11.963 54.902 1.00 21.96 C ATOM 45 CG1 VAL A 5 28.660 12.810 54.533 1.00 20.49 C ATOM 46 CG2 VAL A 5 29.467 10.855 55.865 1.00 19.45 C ATOM 47 H VAL A 5 32.385 10.968 54.665 1.00 0.00 H ATOM 48 N ILE A 6 30.284 12.376 51.461 1.00 20.40 N ATOM 49 CA ILE A 6 30.559 13.335 50.401 1.00 23.02 C ATOM 50 C ILE A 6 29.286 14.108 50.093 1.00 26.03 C ATOM 51 O ILE A 6 28.418 13.614 49.370 1.00 25.90 O ATOM 52 CB ILE A 6 31.066 12.639 49.118 1.00 22.90 C ATOM 53 CG1 ILE A 6 32.225 11.686 49.433 1.00 23.46 C ATOM 54 CG2 ILE A 6 31.477 13.675 48.066 1.00 23.47 C ATOM 55 CD1 ILE A 6 32.701 10.876 48.221 1.00 22.58 C ATOM 56 H ILE A 6 29.614 11.601 51.280 1.00 0.00 H ATOM 57 N GLY A 7 29.165 15.314 50.641 1.00 26.68 N ATOM 58 CA GLY A 7 27.944 16.086 50.483 1.00 26.11 C ATOM 59 C GLY A 7 28.015 17.436 51.169 1.00 25.97 C ATOM 60 O GLY A 7 29.106 17.971 51.375 1.00 25.28 O ATOM 61 H GLY A 7 29.955 15.710 51.190 1.00 0.00 H ATOM 62 N GLN A 8 26.857 17.980 51.538 1.00 25.96 N ATOM 63 CA GLN A 8 26.799 19.325 52.092 1.00 29.36 C ATOM 64 C GLN A 8 25.460 19.606 52.771 1.00 30.80 C ATOM 65 O GLN A 8 24.528 18.793 52.691 1.00 29.13 O ATOM 66 CB GLN A 8 27.042 20.361 50.990 1.00 30.35 C ATOM 67 CG GLN A 8 25.887 20.476 50.000 1.00 32.47 C ATOM 68 CD GLN A 8 26.232 21.309 48.779 1.00 34.28 C ATOM 69 OE1 GLN A 8 26.910 20.840 47.865 1.00 37.09 O ATOM 70 NE2 GLN A 8 25.762 22.549 48.756 1.00 33.54 N ATOM 71 HE22 GLN A 8 25.193 22.904 49.551 1.00 0.00 H ATOM 72 HE21 GLN A 8 25.963 23.166 47.943 1.00 0.00 H ATOM 73 H GLN A 8 25.978 17.434 51.428 1.00 0.00 H ATOM 74 N SER A 9 25.394 20.763 53.432 1.00 29.62 N ATOM 75 CA SER A 9 24.185 21.310 54.070 1.00 31.32 C ATOM 76 C SER A 9 23.729 20.528 55.301 1.00 28.40 C ATOM 77 O SER A 9 24.331 19.517 55.672 1.00 25.28 O ATOM 78 CB SER A 9 23.029 21.394 53.065 1.00 33.04 C ATOM 79 OG SER A 9 22.434 20.119 52.861 1.00 37.68 O ATOM 80 HG SER A 9 23.114 19.491 52.510 1.00 0.00 H ATOM 81 H SER A 9 26.267 21.324 53.502 1.00 0.00 H ATOM 82 N LEU A 10 22.655 21.015 55.919 1.00 28.04 N ATOM 83 CA LEU A 10 22.090 20.404 57.118 1.00 28.20 C ATOM 84 C LEU A 10 21.748 18.933 56.914 1.00 26.81 C ATOM 85 O LEU A 10 21.983 18.115 57.798 1.00 25.82 O ATOM 86 CB LEU A 10 20.844 21.175 57.558 1.00 30.91 C ATOM 87 CG LEU A 10 21.116 22.629 57.948 1.00 33.90 C ATOM 88 CD1 LEU A 10 19.836 23.384 58.269 1.00 36.47 C ATOM 89 CD2 LEU A 10 22.068 22.681 59.125 1.00 33.71 C ATOM 90 H LEU A 10 22.200 21.866 55.531 1.00 0.00 H ATOM 91 N PHE A 11 21.201 18.598 55.746 1.00 27.90 N ATOM 92 CA PHE A 11 20.854 17.215 55.448 1.00 23.26 C ATOM 93 C PHE A 11 22.086 16.324 55.534 1.00 23.12 C ATOM 94 O PHE A 11 22.037 15.241 56.127 1.00 22.31 O ATOM 95 CB PHE A 11 20.207 17.095 54.063 1.00 24.13 C ATOM 96 CG PHE A 11 19.765 15.698 53.729 1.00 20.98 C ATOM 97 CD1 PHE A 11 18.524 15.237 54.147 1.00 22.97 C ATOM 98 CD2 PHE A 11 20.593 14.839 53.015 1.00 20.67 C ATOM 99 CE1 PHE A 11 18.111 13.949 53.853 1.00 22.57 C ATOM 100 CE2 PHE A 11 20.185 13.546 52.716 1.00 23.30 C ATOM 101 CZ PHE A 11 18.942 13.103 53.135 1.00 23.01 C ATOM 102 H PHE A 11 21.019 19.336 55.036 1.00 0.00 H ATOM 103 N GLY A 12 23.187 16.782 54.943 1.00 22.95 N ATOM 104 CA GLY A 12 24.445 16.058 55.008 1.00 22.54 C ATOM 105 C GLY A 12 24.945 15.935 56.436 1.00 24.67 C ATOM 106 O GLY A 12 25.452 14.886 56.849 1.00 25.02 O ATOM 107 H GLY A 12 23.146 17.681 54.421 1.00 0.00 H ATOM 108 N GLN A 13 24.787 17.013 57.191 1.00 25.47 N ATOM 109 CA GLN A 13 25.189 17.056 58.590 1.00 28.00 C ATOM 110 C GLN A 13 24.425 16.027 59.411 1.00 26.94 C ATOM 111 O GLN A 13 25.019 15.275 60.179 1.00 28.57 O ATOM 112 CB GLN A 13 24.969 18.457 59.165 1.00 29.93 C ATOM 113 CG GLN A 13 25.115 18.539 60.687 1.00 34.49 C ATOM 114 CD GLN A 13 24.674 19.877 61.245 1.00 40.97 C ATOM 115 OE1 GLN A 13 23.483 20.120 61.434 1.00 46.11 O ATOM 116 NE2 GLN A 13 25.633 20.755 61.508 1.00 43.25 N ATOM 117 HE22 GLN A 13 26.628 20.507 61.333 1.00 0.00 H ATOM 118 HE21 GLN A 13 25.390 21.692 61.890 1.00 0.00 H ATOM 119 H GLN A 13 24.359 17.861 56.768 1.00 0.00 H ATOM 120 N GLU A 14 23.108 15.989 59.241 1.00 26.16 N ATOM 121 CA GLU A 14 22.280 15.058 60.002 1.00 28.93 C ATOM 122 C GLU A 14 22.578 13.601 59.642 1.00 28.00 C ATOM 123 O GLU A 14 22.676 12.752 60.532 1.00 28.66 O ATOM 124 CB GLU A 14 20.796 15.370 59.795 1.00 30.30 C ATOM 125 CG GLU A 14 20.317 16.602 60.550 1.00 38.62 C ATOM 126 CD GLU A 14 20.585 16.515 62.047 1.00 45.36 C ATOM 127 OE1 GLU A 14 20.205 15.498 62.667 1.00 45.92 O ATOM 128 OE2 GLU A 14 21.176 17.467 62.604 1.00 50.85 O ATOM 129 H GLU A 14 22.661 16.631 58.556 1.00 0.00 H ATOM 130 N VAL A 15 22.731 13.314 58.350 1.00 24.23 N ATOM 131 CA VAL A 15 23.139 11.982 57.918 1.00 22.99 C ATOM 132 C VAL A 15 24.475 11.594 58.566 1.00 23.81 C ATOM 133 O VAL A 15 24.627 10.486 59.077 1.00 26.90 O ATOM 134 CB VAL A 15 23.255 11.895 56.384 1.00 18.81 C ATOM 135 CG1 VAL A 15 23.900 10.595 55.982 1.00 17.27 C ATOM 136 CG2 VAL A 15 21.873 12.021 55.737 1.00 16.91 C ATOM 137 H VAL A 15 22.557 14.052 57.638 1.00 0.00 H ATOM 138 N TYR A 16 25.433 12.515 58.557 1.00 24.08 N ATOM 139 CA TYR A 16 26.696 12.311 59.259 1.00 24.18 C ATOM 140 C TYR A 16 26.455 11.938 60.721 1.00 25.46 C ATOM 141 O TYR A 16 26.910 10.892 61.185 1.00 20.90 O ATOM 142 CB TYR A 16 27.567 13.569 59.170 1.00 24.53 C ATOM 143 CG TYR A 16 28.727 13.597 60.150 1.00 29.89 C ATOM 144 CD1 TYR A 16 29.942 13.007 59.835 1.00 31.22 C ATOM 145 CD2 TYR A 16 28.606 14.221 61.388 1.00 31.71 C ATOM 146 CE1 TYR A 16 30.998 13.029 60.726 1.00 32.74 C ATOM 147 CE2 TYR A 16 29.659 14.243 62.283 1.00 31.49 C ATOM 148 CZ TYR A 16 30.847 13.648 61.942 1.00 31.85 C ATOM 149 OH TYR A 16 31.899 13.664 62.819 1.00 35.88 O ATOM 150 HH TYR A 16 31.635 13.208 63.657 1.00 0.00 H ATOM 151 H TYR A 16 25.279 13.402 58.037 1.00 0.00 H ATOM 152 N LYS A 17 25.726 12.797 61.430 1.00 26.62 N ATOM 153 CA LYS A 17 25.484 12.631 62.862 1.00 26.37 C ATOM 154 C LYS A 17 24.797 11.310 63.199 1.00 26.55 C ATOM 155 O LYS A 17 25.156 10.641 64.173 1.00 25.61 O ATOM 156 CB LYS A 17 24.640 13.793 63.389 1.00 28.95 C ATOM 157 CG LYS A 17 25.376 15.119 63.494 1.00 34.72 C ATOM 158 CD LYS A 17 24.419 16.269 63.786 1.00 40.09 C ATOM 159 CE LYS A 17 23.499 15.950 64.953 1.00 45.91 C ATOM 160 NZ LYS A 17 22.528 17.049 65.230 1.00 48.47 N ATOM 161 HZ1 LYS A 17 23.048 17.920 65.459 1.00 0.00 H ATOM 162 HZ2 LYS A 17 21.937 17.208 64.389 1.00 0.00 H ATOM 163 HZ3 LYS A 17 21.924 16.782 66.034 1.00 0.00 H ATOM 164 H LYS A 17 25.312 13.619 60.946 1.00 0.00 H ATOM 165 N GLU A 18 23.808 10.938 62.394 1.00 25.39 N ATOM 166 CA GLU A 18 23.039 9.722 62.641 1.00 28.14 C ATOM 167 C GLU A 18 23.860 8.467 62.380 1.00 28.19 C ATOM 168 O GLU A 18 23.725 7.472 63.096 1.00 27.97 O ATOM 169 CB GLU A 18 21.773 9.704 61.779 1.00 27.62 C ATOM 170 CG GLU A 18 20.729 10.737 62.179 1.00 35.17 C ATOM 171 CD GLU A 18 20.044 10.398 63.485 1.00 43.09 C ATOM 172 OE1 GLU A 18 19.689 11.338 64.223 1.00 49.75 O ATOM 173 OE2 GLU A 18 19.847 9.195 63.766 1.00 45.41 O ATOM 174 H GLU A 18 23.576 11.527 61.569 1.00 0.00 H ATOM 175 N LEU A 19 24.708 8.512 61.356 1.00 25.01 N ATOM 176 CA LEU A 19 25.577 7.382 61.039 1.00 24.28 C ATOM 177 C LEU A 19 26.662 7.223 62.112 1.00 26.23 C ATOM 178 O LEU A 19 27.000 6.105 62.502 1.00 28.13 O ATOM 179 CB LEU A 19 26.202 7.557 59.651 1.00 24.26 C ATOM 180 CG LEU A 19 25.273 7.335 58.452 1.00 21.01 C ATOM 181 CD1 LEU A 19 25.992 7.600 57.146 1.00 18.50 C ATOM 182 CD2 LEU A 19 24.704 5.927 58.459 1.00 18.62 C ATOM 183 H LEU A 19 24.753 9.369 60.769 1.00 0.00 H ATOM 184 N LYS A 20 27.191 8.343 62.596 1.00 28.64 N ATOM 185 CA LYS A 20 28.158 8.334 63.692 1.00 32.89 C ATOM 186 C LYS A 20 27.570 7.694 64.947 1.00 31.96 C ATOM 187 O LYS A 20 28.241 6.928 65.642 1.00 34.43 O ATOM 188 CB LYS A 20 28.627 9.762 64.006 1.00 36.84 C ATOM 189 CG LYS A 20 29.605 9.860 65.170 1.00 44.66 C ATOM 190 CD LYS A 20 29.848 11.310 65.583 1.00 51.04 C ATOM 191 CE LYS A 20 30.869 11.409 66.721 1.00 58.80 C ATOM 192 NZ LYS A 20 32.183 10.780 66.378 1.00 60.45 N ATOM 193 HZ1 LYS A 20 32.039 9.772 66.167 1.00 0.00 H ATOM 194 HZ2 LYS A 20 32.587 11.256 65.546 1.00 0.00 H ATOM 195 HZ3 LYS A 20 32.833 10.877 67.184 1.00 0.00 H ATOM 196 H LYS A 20 26.908 9.254 62.182 1.00 0.00 H ATOM 197 N ASN A 21 26.308 8.000 65.225 1.00 30.77 N ATOM 198 CA ASN A 21 25.673 7.544 66.457 1.00 33.34 C ATOM 199 C ASN A 21 25.073 6.144 66.336 1.00 31.21 C ATOM 200 O ASN A 21 24.528 5.605 67.301 1.00 29.77 O ATOM 201 CB ASN A 21 24.614 8.559 66.895 1.00 32.76 C ATOM 202 CG ASN A 21 25.224 9.756 67.610 1.00 33.72 C ATOM 203 OD1 ASN A 21 26.125 9.604 68.442 1.00 34.37 O ATOM 204 ND2 ASN A 21 24.741 10.952 67.288 1.00 31.48 N ATOM 205 HD22 ASN A 21 23.982 11.033 66.582 1.00 0.00 H ATOM 206 HD21 ASN A 21 25.122 11.806 67.742 1.00 0.00 H ATOM 207 H ASN A 21 25.762 8.575 64.552 1.00 0.00 H ATOM 208 N GLU A 22 25.193 5.562 65.148 1.00 30.20 N ATOM 209 CA GLU A 22 24.890 4.151 64.948 1.00 34.17 C ATOM 210 C GLU A 22 26.171 3.334 65.097 1.00 34.12 C ATOM 211 O GLU A 22 26.166 2.111 64.939 1.00 36.57 O ATOM 212 CB GLU A 22 24.260 3.914 63.570 1.00 35.60 C ATOM 213 CG GLU A 22 22.855 4.467 63.418 1.00 40.07 C ATOM 214 CD GLU A 22 21.792 3.386 63.459 1.00 43.41 C ATOM 215 OE1 GLU A 22 20.916 3.455 64.346 1.00 47.70 O ATOM 216 OE2 GLU A 22 21.823 2.480 62.593 1.00 41.30 O ATOM 217 H GLU A 22 25.512 6.130 64.337 1.00 0.00 H ATOM 218 N GLY A 23 27.273 4.023 65.383 1.00 31.04 N ATOM 219 CA GLY A 23 28.540 3.365 65.646 1.00 27.65 C ATOM 220 C GLY A 23 29.494 3.303 64.466 1.00 27.44 C ATOM 221 O GLY A 23 30.581 2.737 64.575 1.00 26.57 O ATOM 222 H GLY A 23 27.225 5.061 65.419 1.00 0.00 H ATOM 223 N HIS A 24 29.103 3.876 63.332 1.00 26.94 N ATOM 224 CA HIS A 24 29.975 3.850 62.160 1.00 28.10 C ATOM 225 C HIS A 24 31.155 4.802 62.332 1.00 29.88 C ATOM 226 O HIS A 24 31.029 5.853 62.964 1.00 31.53 O ATOM 227 CB HIS A 24 29.185 4.193 60.893 1.00 26.57 C ATOM 228 CG HIS A 24 28.116 3.197 60.570 1.00 27.53 C ATOM 229 ND1 HIS A 24 28.399 1.908 60.171 1.00 27.99 N ATOM 230 CD2 HIS A 24 26.766 3.296 60.604 1.00 26.61 C ATOM 231 CE1 HIS A 24 27.266 1.258 59.965 1.00 28.37 C ATOM 232 NE2 HIS A 24 26.261 2.077 60.220 1.00 28.56 N ATOM 233 H HIS A 24 28.175 4.343 63.279 1.00 0.00 H ATOM 234 N MET A 25 32.301 4.423 61.775 1.00 27.06 N ATOM 235 CA MET A 25 33.487 5.271 61.801 1.00 29.28 C ATOM 236 C MET A 25 33.522 6.181 60.577 1.00 28.35 C ATOM 237 O MET A 25 33.704 5.712 59.449 1.00 27.37 O ATOM 238 CB MET A 25 34.759 4.420 61.857 1.00 31.03 C ATOM 239 CG MET A 25 36.041 5.235 62.049 1.00 35.28 C ATOM 240 SD MET A 25 37.556 4.246 62.091 1.00 90.83 S ATOM 241 CE MET A 25 38.792 5.537 62.245 1.00 48.02 C ATOM 242 H MET A 25 32.353 3.495 61.307 1.00 0.00 H ATOM 243 N ILE A 26 33.335 7.479 60.795 1.00 26.94 N ATOM 244 CA ILE A 26 33.468 8.444 59.713 1.00 28.06 C ATOM 245 C ILE A 26 34.950 8.759 59.541 1.00 29.46 C ATOM 246 O ILE A 26 35.534 9.500 60.335 1.00 29.11 O ATOM 247 CB ILE A 26 32.665 9.736 59.984 1.00 29.26 C ATOM 248 CG1 ILE A 26 31.280 9.404 60.557 1.00 30.81 C ATOM 249 CG2 ILE A 26 32.541 10.563 58.706 1.00 24.63 C ATOM 250 CD1 ILE A 26 30.435 8.517 59.659 1.00 31.84 C ATOM 251 H ILE A 26 33.091 7.809 61.750 1.00 0.00 H ATOM 252 N VAL A 27 35.558 8.179 58.510 1.00 30.46 N ATOM 253 CA VAL A 27 36.988 8.346 58.279 1.00 34.29 C ATOM 254 C VAL A 27 37.292 9.618 57.489 1.00 36.67 C ATOM 255 O VAL A 27 38.456 9.993 57.337 1.00 40.98 O ATOM 256 CB VAL A 27 37.587 7.136 57.527 1.00 33.09 C ATOM 257 CG1 VAL A 27 37.622 5.898 58.421 1.00 30.80 C ATOM 258 CG2 VAL A 27 36.807 6.867 56.246 1.00 31.02 C ATOM 259 H VAL A 27 35.002 7.594 57.855 1.00 0.00 H ATOM 260 N GLY A 28 36.249 10.281 56.989 1.00 37.76 N ATOM 261 CA GLY A 28 36.437 11.480 56.190 1.00 36.44 C ATOM 262 C GLY A 28 35.167 12.182 55.736 1.00 35.34 C ATOM 263 O GLY A 28 34.127 11.558 55.493 1.00 34.40 O ATOM 264 H GLY A 28 35.286 9.935 57.174 1.00 0.00 H ATOM 265 N VAL A 29 35.265 13.501 55.610 1.00 32.87 N ATOM 266 CA VAL A 29 34.149 14.322 55.171 1.00 31.79 C ATOM 267 C VAL A 29 34.605 15.248 54.047 1.00 33.00 C ATOM 268 O VAL A 29 35.571 16.000 54.194 1.00 37.45 O ATOM 269 CB VAL A 29 33.564 15.128 56.344 1.00 34.77 C ATOM 270 CG1 VAL A 29 32.849 16.370 55.848 1.00 34.92 C ATOM 271 CG2 VAL A 29 32.629 14.245 57.162 1.00 35.24 C ATOM 272 H VAL A 29 36.171 13.961 55.833 1.00 0.00 H ATOM 273 N PHE A 30 33.905 15.172 52.923 1.00 30.40 N ATOM 274 CA PHE A 30 34.277 15.899 51.720 1.00 31.16 C ATOM 275 C PHE A 30 33.124 16.814 51.320 1.00 32.95 C ATOM 276 O PHE A 30 32.116 16.355 50.775 1.00 32.09 O ATOM 277 CB PHE A 30 34.625 14.919 50.591 1.00 29.52 C ATOM 278 CG PHE A 30 35.741 13.961 50.935 1.00 28.96 C ATOM 279 CD1 PHE A 30 35.521 12.877 51.779 1.00 30.07 C ATOM 280 CD2 PHE A 30 37.008 14.136 50.398 1.00 31.56 C ATOM 281 CE1 PHE A 30 36.548 11.998 52.093 1.00 30.81 C ATOM 282 CE2 PHE A 30 38.037 13.262 50.704 1.00 32.95 C ATOM 283 CZ PHE A 30 37.806 12.192 51.554 1.00 33.08 C ATOM 284 H PHE A 30 33.058 14.569 52.901 1.00 0.00 H ATOM 285 N THR A 31 33.257 18.106 51.611 1.00 34.23 N ATOM 286 CA THR A 31 32.181 19.050 51.321 1.00 35.82 C ATOM 287 C THR A 31 32.664 20.208 50.450 1.00 37.56 C ATOM 288 O THR A 31 33.766 20.164 49.905 1.00 36.24 O ATOM 289 CB THR A 31 31.556 19.607 52.619 1.00 35.17 C ATOM 290 OG1 THR A 31 30.404 20.392 52.293 1.00 34.46 O ATOM 291 CG2 THR A 31 32.566 20.462 53.398 1.00 34.83 C ATOM 292 HG1 THR A 31 29.742 19.825 51.823 1.00 0.00 H ATOM 293 H THR A 31 34.136 18.447 52.049 1.00 0.00 H ATOM 294 N ILE A 32 31.831 21.238 50.317 1.00 38.20 N ATOM 295 CA ILE A 32 32.141 22.373 49.455 1.00 38.35 C ATOM 296 C ILE A 32 32.997 23.406 50.191 1.00 40.11 C ATOM 297 O ILE A 32 33.008 23.445 51.423 1.00 41.34 O ATOM 298 CB ILE A 32 30.850 23.045 48.929 1.00 37.39 C ATOM 299 CG1 ILE A 32 30.023 23.598 50.088 1.00 37.92 C ATOM 300 CG2 ILE A 32 30.037 22.058 48.099 1.00 35.43 C ATOM 301 CD1 ILE A 32 28.949 24.576 49.660 1.00 38.01 C ATOM 302 H ILE A 32 30.934 21.233 50.843 1.00 0.00 H ATOM 303 N PRO A 33 33.735 24.237 49.436 1.00 41.84 N ATOM 304 CA PRO A 33 34.544 25.305 50.040 1.00 44.32 C ATOM 305 C PRO A 33 33.731 26.300 50.868 1.00 44.52 C ATOM 306 O PRO A 33 32.523 26.447 50.650 1.00 41.48 O ATOM 307 CB PRO A 33 35.149 26.011 48.823 1.00 44.49 C ATOM 308 CG PRO A 33 35.186 24.983 47.763 1.00 42.09 C ATOM 309 CD PRO A 33 33.976 24.117 47.985 1.00 40.33 C ATOM 310 N ASP A 34 34.395 26.978 51.802 1.00 47.51 N ATOM 311 CA ASP A 34 33.769 28.075 52.531 1.00 52.18 C ATOM 312 C ASP A 34 33.340 29.168 51.556 1.00 55.53 C ATOM 313 O ASP A 34 34.042 29.456 50.585 1.00 55.01 O ATOM 314 CB ASP A 34 34.721 28.669 53.578 1.00 55.32 C ATOM 315 CG ASP A 34 35.325 27.622 54.491 1.00 55.08 C ATOM 316 OD1 ASP A 34 34.625 26.647 54.834 1.00 56.82 O ATOM 317 OD2 ASP A 34 36.504 27.783 54.871 1.00 53.44 O ATOM 318 H ASP A 34 35.380 26.720 52.016 1.00 0.00 H ATOM 319 N LYS A 35 32.182 29.765 51.812 1.00 60.01 N ATOM 320 CA LYS A 35 31.736 30.920 51.046 1.00 67.06 C ATOM 321 C LYS A 35 31.524 32.089 51.992 1.00 70.55 C ATOM 322 O LYS A 35 30.626 32.043 52.833 1.00 69.64 O ATOM 323 CB LYS A 35 30.437 30.627 50.295 1.00 69.17 C ATOM 324 CG LYS A 35 30.415 29.338 49.502 1.00 70.89 C ATOM 325 CD LYS A 35 29.006 29.082 48.990 1.00 72.39 C ATOM 326 CE LYS A 35 28.936 27.857 48.103 1.00 72.82 C ATOM 327 NZ LYS A 35 27.577 27.737 47.513 1.00 73.70 N ATOM 328 HZ1 LYS A 35 26.876 27.649 48.276 1.00 0.00 H ATOM 329 HZ2 LYS A 35 27.370 28.584 46.946 1.00 0.00 H ATOM 330 HZ3 LYS A 35 27.537 26.894 46.906 1.00 0.00 H ATOM 331 H LYS A 35 31.580 29.399 52.577 1.00 0.00 H ATOM 332 N ASP A 36 32.348 33.124 51.855 1.00 74.70 N ATOM 333 CA ASP A 36 32.204 34.347 52.644 1.00 78.60 C ATOM 334 C ASP A 36 32.223 34.077 54.146 1.00 77.42 C ATOM 335 O ASP A 36 31.353 34.547 54.881 1.00 77.98 O ATOM 336 CB ASP A 36 30.910 35.075 52.262 1.00 81.07 C ATOM 337 CG ASP A 36 30.842 35.410 50.783 1.00 83.28 C ATOM 338 OD1 ASP A 36 31.906 35.676 50.183 1.00 85.32 O ATOM 339 OD2 ASP A 36 29.724 35.407 50.221 1.00 82.08 O ATOM 340 H ASP A 36 33.122 33.061 51.163 1.00 0.00 H ATOM 341 N GLY A 37 33.209 33.308 54.595 1.00 75.40 N ATOM 342 CA GLY A 37 33.346 32.997 56.007 1.00 75.34 C ATOM 343 C GLY A 37 32.242 32.109 56.554 1.00 73.37 C ATOM 344 O GLY A 37 32.158 31.882 57.761 1.00 76.06 O ATOM 345 H GLY A 37 33.898 32.920 53.920 1.00 0.00 H ATOM 346 N LYS A 38 31.382 31.615 55.671 1.00 69.04 N ATOM 347 CA LYS A 38 30.375 30.644 56.068 1.00 63.93 C ATOM 348 C LYS A 38 30.937 29.250 55.850 1.00 56.39 C ATOM 349 O LYS A 38 31.361 28.910 54.746 1.00 52.11 O ATOM 350 CB LYS A 38 29.080 30.838 55.278 1.00 65.95 C ATOM 351 CG LYS A 38 27.892 30.058 55.813 1.00 66.10 C ATOM 352 CD LYS A 38 26.592 30.594 55.228 1.00 68.03 C ATOM 353 CE LYS A 38 26.515 32.113 55.358 1.00 71.21 C ATOM 354 NZ LYS A 38 25.335 32.690 54.651 1.00 71.11 N ATOM 355 HZ1 LYS A 38 25.391 32.458 53.639 1.00 0.00 H ATOM 356 HZ2 LYS A 38 24.463 32.290 55.052 1.00 0.00 H ATOM 357 HZ3 LYS A 38 25.331 33.723 54.771 1.00 0.00 H ATOM 358 H LYS A 38 31.429 31.927 54.680 1.00 0.00 H ATOM 359 N VAL A 39 30.971 28.456 56.913 1.00 55.32 N ATOM 360 CA VAL A 39 31.434 27.082 56.814 1.00 53.88 C ATOM 361 C VAL A 39 30.223 26.161 56.698 1.00 52.53 C ATOM 362 O VAL A 39 29.217 26.363 57.382 1.00 55.35 O ATOM 363 CB VAL A 39 32.290 26.682 58.030 1.00 54.90 C ATOM 364 CG1 VAL A 39 32.828 25.268 57.862 1.00 53.37 C ATOM 365 CG2 VAL A 39 33.435 27.667 58.219 1.00 58.40 C ATOM 366 H VAL A 39 30.660 28.824 57.835 1.00 0.00 H ATOM 367 N ASP A 40 30.312 25.169 55.820 1.00 48.26 N ATOM 368 CA ASP A 40 29.233 24.205 55.660 1.00 45.68 C ATOM 369 C ASP A 40 29.001 23.458 56.972 1.00 45.49 C ATOM 370 O ASP A 40 29.955 23.029 57.623 1.00 47.49 O ATOM 371 CB ASP A 40 29.553 23.224 54.534 1.00 42.37 C ATOM 372 CG ASP A 40 28.357 22.392 54.134 1.00 39.89 C ATOM 373 OD1 ASP A 40 27.698 22.747 53.134 1.00 38.55 O ATOM 374 OD2 ASP A 40 28.075 21.388 54.824 1.00 38.94 O ATOM 375 H ASP A 40 31.168 25.079 55.236 1.00 0.00 H ATOM 376 N PRO A 41 27.728 23.318 57.370 1.00 43.89 N ATOM 377 CA PRO A 41 27.338 22.648 58.616 1.00 43.51 C ATOM 378 C PRO A 41 27.938 21.249 58.753 1.00 37.61 C ATOM 379 O PRO A 41 28.235 20.830 59.873 1.00 36.26 O ATOM 380 CB PRO A 41 25.812 22.580 58.507 1.00 45.63 C ATOM 381 CG PRO A 41 25.453 23.745 57.643 1.00 46.12 C ATOM 382 CD PRO A 41 26.561 23.843 56.637 1.00 43.47 C ATOM 383 N LEU A 42 28.111 20.544 57.635 1.00 32.79 N ATOM 384 CA LEU A 42 28.731 19.216 57.644 1.00 33.82 C ATOM 385 C LEU A 42 30.196 19.293 58.066 1.00 37.42 C ATOM 386 O LEU A 42 30.667 18.467 58.850 1.00 38.81 O ATOM 387 CB LEU A 42 28.616 18.549 56.264 1.00 32.30 C ATOM 388 CG LEU A 42 29.351 17.219 56.067 1.00 30.10 C ATOM 389 CD1 LEU A 42 28.810 16.168 57.008 1.00 28.63 C ATOM 390 CD2 LEU A 42 29.275 16.721 54.633 1.00 28.20 C ATOM 391 H LEU A 42 27.797 20.948 56.730 1.00 0.00 H ATOM 392 N ALA A 43 30.917 20.281 57.542 1.00 38.29 N ATOM 393 CA ALA A 43 32.315 20.482 57.916 1.00 41.23 C ATOM 394 C ALA A 43 32.451 20.895 59.380 1.00 41.70 C ATOM 395 O ALA A 43 33.374 20.454 60.072 1.00 42.17 O ATOM 396 CB ALA A 43 32.957 21.523 57.019 1.00 43.66 C ATOM 397 H ALA A 43 30.477 20.923 56.852 1.00 0.00 H ATOM 398 N ILE A 44 31.538 21.750 59.839 1.00 40.43 N ATOM 399 CA ILE A 44 31.540 22.223 61.223 1.00 41.77 C ATOM 400 C ILE A 44 31.368 21.072 62.218 1.00 41.65 C ATOM 401 O ILE A 44 32.134 20.954 63.178 1.00 42.63 O ATOM 402 CB ILE A 44 30.425 23.273 61.466 1.00 43.31 C ATOM 403 CG1 ILE A 44 30.725 24.572 60.707 1.00 46.67 C ATOM 404 CG2 ILE A 44 30.276 23.564 62.957 1.00 42.01 C ATOM 405 CD1 ILE A 44 29.544 25.522 60.608 1.00 49.07 C ATOM 406 H ILE A 44 30.799 22.092 59.192 1.00 0.00 H ATOM 407 N GLU A 45 30.365 20.227 61.985 1.00 38.80 N ATOM 408 CA GLU A 45 30.095 19.090 62.864 1.00 37.35 C ATOM 409 C GLU A 45 31.276 18.116 62.904 1.00 35.03 C ATOM 410 O GLU A 45 31.694 17.678 63.975 1.00 32.52 O ATOM 411 CB GLU A 45 28.822 18.362 62.418 1.00 39.15 C ATOM 412 CG GLU A 45 28.309 17.323 63.405 1.00 42.51 C ATOM 413 CD GLU A 45 27.795 17.931 64.699 1.00 49.41 C ATOM 414 OE1 GLU A 45 27.682 17.184 65.694 1.00 51.18 O ATOM 415 OE2 GLU A 45 27.494 19.145 64.723 1.00 53.58 O ATOM 416 H GLU A 45 29.757 20.380 61.155 1.00 0.00 H ATOM 417 N ALA A 46 31.821 17.799 61.735 1.00 33.41 N ATOM 418 CA ALA A 46 32.913 16.836 61.634 1.00 36.04 C ATOM 419 C ALA A 46 34.191 17.302 62.332 1.00 38.18 C ATOM 420 O ALA A 46 34.798 16.535 63.080 1.00 38.55 O ATOM 421 CB ALA A 46 33.201 16.530 60.174 1.00 34.95 C ATOM 422 H ALA A 46 31.460 18.249 60.869 1.00 0.00 H ATOM 423 N GLU A 47 34.601 18.545 62.076 1.00 41.73 N ATOM 424 CA GLU A 47 35.804 19.112 62.689 1.00 46.44 C ATOM 425 C GLU A 47 35.706 19.036 64.210 1.00 50.58 C ATOM 426 O GLU A 47 36.675 18.696 64.898 1.00 52.84 O ATOM 427 CB GLU A 47 36.005 20.562 62.230 1.00 46.57 C ATOM 428 CG GLU A 47 37.348 21.174 62.619 1.00 53.02 C ATOM 429 CD GLU A 47 37.394 21.658 64.064 1.00 58.26 C ATOM 430 OE1 GLU A 47 36.382 22.217 64.540 1.00 58.19 O ATOM 431 OE2 GLU A 47 38.441 21.471 64.724 1.00 61.61 O ATOM 432 H GLU A 47 34.048 19.131 61.419 1.00 0.00 H ATOM 433 N LYS A 48 34.521 19.363 64.717 1.00 50.17 N ATOM 434 CA LYS A 48 34.200 19.237 66.131 1.00 52.62 C ATOM 435 C LYS A 48 34.530 17.842 66.667 1.00 53.00 C ATOM 436 O LYS A 48 35.214 17.697 67.687 1.00 53.71 O ATOM 437 CB LYS A 48 32.719 19.555 66.349 1.00 54.01 C ATOM 438 CG LYS A 48 32.193 19.154 67.706 1.00 59.95 C ATOM 439 CD LYS A 48 30.886 19.855 68.031 1.00 64.38 C ATOM 440 CE LYS A 48 30.755 20.021 69.536 1.00 69.11 C ATOM 441 NZ LYS A 48 31.144 18.764 70.233 1.00 69.78 N ATOM 442 HZ1 LYS A 48 30.523 17.990 69.922 1.00 0.00 H ATOM 443 HZ2 LYS A 48 32.131 18.532 70.002 1.00 0.00 H ATOM 444 HZ3 LYS A 48 31.049 18.895 71.260 1.00 0.00 H ATOM 445 H LYS A 48 33.789 19.726 64.073 1.00 0.00 H ATOM 446 N ASP A 49 34.046 16.824 65.957 1.00 49.31 N ATOM 447 CA ASP A 49 34.249 15.428 66.336 1.00 48.59 C ATOM 448 C ASP A 49 35.680 14.955 66.088 1.00 47.48 C ATOM 449 O ASP A 49 36.042 13.837 66.458 1.00 47.75 O ATOM 450 CB ASP A 49 33.271 14.524 65.572 1.00 46.35 C ATOM 451 CG ASP A 49 31.855 14.609 66.104 1.00 46.33 C ATOM 452 OD1 ASP A 49 31.697 14.840 67.321 1.00 46.68 O ATOM 453 OD2 ASP A 49 30.903 14.439 65.307 1.00 43.95 O ATOM 454 H ASP A 49 33.500 17.032 65.096 1.00 0.00 H ATOM 455 N GLY A 50 36.485 15.797 65.446 1.00 45.13 N ATOM 456 CA GLY A 50 37.854 15.437 65.117 1.00 44.88 C ATOM 457 C GLY A 50 37.985 14.554 63.884 1.00 43.98 C ATOM 458 O GLY A 50 38.945 13.793 63.754 1.00 46.58 O ATOM 459 H GLY A 50 36.127 16.734 65.173 1.00 0.00 H ATOM 460 N VAL A 51 37.015 14.659 62.980 1.00 38.89 N ATOM 461 CA VAL A 51 36.997 13.888 61.743 1.00 38.46 C ATOM 462 C VAL A 51 37.608 14.712 60.609 1.00 38.03 C ATOM 463 O VAL A 51 37.271 15.887 60.458 1.00 37.10 O ATOM 464 CB VAL A 51 35.548 13.467 61.374 1.00 35.67 C ATOM 465 CG1 VAL A 51 35.459 12.996 59.929 1.00 31.08 C ATOM 466 CG2 VAL A 51 35.041 12.388 62.328 1.00 36.80 C ATOM 467 H VAL A 51 36.234 15.321 63.164 1.00 0.00 H ATOM 468 N PRO A 52 38.514 14.103 59.819 1.00 38.47 N ATOM 469 CA PRO A 52 39.146 14.752 58.662 1.00 38.52 C ATOM 470 C PRO A 52 38.143 15.447 57.742 1.00 37.76 C ATOM 471 O PRO A 52 37.137 14.838 57.369 1.00 33.58 O ATOM 472 CB PRO A 52 39.815 13.581 57.940 1.00 39.78 C ATOM 473 CG PRO A 52 40.157 12.636 59.035 1.00 40.90 C ATOM 474 CD PRO A 52 39.012 12.728 60.007 1.00 41.22 C ATOM 475 N VAL A 53 38.412 16.702 57.389 1.00 40.81 N ATOM 476 CA VAL A 53 37.497 17.480 56.553 1.00 38.78 C ATOM 477 C VAL A 53 38.191 17.964 55.284 1.00 41.05 C ATOM 478 O VAL A 53 39.256 18.587 55.340 1.00 43.66 O ATOM 479 CB VAL A 53 36.922 18.700 57.317 1.00 44.62 C ATOM 480 CG1 VAL A 53 36.105 19.591 56.383 1.00 43.39 C ATOM 481 CG2 VAL A 53 36.067 18.241 58.486 1.00 43.37 C ATOM 482 H VAL A 53 39.296 17.141 57.716 1.00 0.00 H ATOM 483 N PHE A 54 37.581 17.673 54.141 1.00 39.96 N ATOM 484 CA PHE A 54 38.124 18.081 52.854 1.00 40.02 C ATOM 485 C PHE A 54 37.144 19.022 52.150 1.00 38.97 C ATOM 486 O PHE A 54 35.923 18.887 52.294 1.00 36.03 O ATOM 487 CB PHE A 54 38.424 16.853 51.988 1.00 39.63 C ATOM 488 CG PHE A 54 39.365 15.865 52.631 1.00 40.18 C ATOM 489 CD1 PHE A 54 38.896 14.918 53.531 1.00 41.02 C ATOM 490 CD2 PHE A 54 40.716 15.874 52.320 1.00 41.64 C ATOM 491 CE1 PHE A 54 39.761 14.005 54.117 1.00 41.95 C ATOM 492 CE2 PHE A 54 41.585 14.966 52.902 1.00 43.66 C ATOM 493 CZ PHE A 54 41.107 14.033 53.801 1.00 41.84 C ATOM 494 H PHE A 54 36.689 17.138 54.166 1.00 0.00 H ATOM 495 N LYS A 55 37.677 19.984 51.403 1.00 39.67 N ATOM 496 CA LYS A 55 36.847 20.990 50.742 1.00 40.93 C ATOM 497 C LYS A 55 37.342 21.259 49.324 1.00 42.09 C ATOM 498 O LYS A 55 37.632 22.401 48.959 1.00 44.25 O ATOM 499 CB LYS A 55 36.831 22.293 51.557 1.00 42.10 C ATOM 500 CG LYS A 55 36.263 22.161 52.970 1.00 39.62 C ATOM 501 CD LYS A 55 36.633 23.372 53.827 1.00 39.88 C ATOM 502 CE LYS A 55 35.917 23.334 55.167 1.00 39.65 C ATOM 503 NZ LYS A 55 36.178 24.564 55.962 1.00 43.25 N ATOM 504 HZ1 LYS A 55 37.199 24.652 56.137 1.00 0.00 H ATOM 505 HZ2 LYS A 55 35.843 25.395 55.433 1.00 0.00 H ATOM 506 HZ3 LYS A 55 35.674 24.502 56.869 1.00 0.00 H ATOM 507 H LYS A 55 38.710 20.022 51.286 1.00 0.00 H ATOM 508 N PHE A 56 37.442 20.197 48.534 1.00 40.24 N ATOM 509 CA PHE A 56 37.883 20.304 47.150 1.00 42.76 C ATOM 510 C PHE A 56 36.889 21.122 46.330 1.00 43.17 C ATOM 511 O PHE A 56 35.699 20.806 46.298 1.00 40.79 O ATOM 512 CB PHE A 56 38.051 18.912 46.534 1.00 42.14 C ATOM 513 CG PHE A 56 38.889 17.975 47.363 1.00 43.33 C ATOM 514 CD1 PHE A 56 38.544 16.635 47.470 1.00 42.60 C ATOM 515 CD2 PHE A 56 40.024 18.427 48.023 1.00 45.43 C ATOM 516 CE1 PHE A 56 39.309 15.763 48.225 1.00 44.18 C ATOM 517 CE2 PHE A 56 40.797 17.559 48.781 1.00 47.24 C ATOM 518 CZ PHE A 56 40.436 16.225 48.881 1.00 47.25 C ATOM 519 H PHE A 56 37.198 19.260 48.915 1.00 0.00 H ATOM 520 N PRO A 57 37.374 22.185 45.668 1.00 46.74 N ATOM 521 CA PRO A 57 36.502 22.986 44.805 1.00 47.58 C ATOM 522 C PRO A 57 36.004 22.155 43.633 1.00 48.04 C ATOM 523 O PRO A 57 34.930 22.438 43.100 1.00 49.53 O ATOM 524 CB PRO A 57 37.407 24.132 44.341 1.00 48.79 C ATOM 525 CG PRO A 57 38.789 23.627 44.517 1.00 50.68 C ATOM 526 CD PRO A 57 38.751 22.705 45.699 1.00 49.58 C ATOM 527 N ARG A 58 36.769 21.135 43.249 1.00 47.48 N ATOM 528 CA ARG A 58 36.318 20.204 42.218 1.00 48.85 C ATOM 529 C ARG A 58 37.055 18.866 42.243 1.00 45.61 C ATOM 530 O ARG A 58 38.166 18.759 42.765 1.00 44.96 O ATOM 531 CB ARG A 58 36.456 20.838 40.835 1.00 55.69 C ATOM 532 CG ARG A 58 37.860 21.267 40.487 1.00 63.11 C ATOM 533 CD ARG A 58 37.866 22.000 39.161 1.00 69.48 C ATOM 534 NE ARG A 58 36.894 23.088 39.134 1.00 73.43 N ATOM 535 CZ ARG A 58 37.174 24.345 39.458 1.00 77.55 C ATOM 536 NH1 ARG A 58 38.403 24.678 39.834 1.00 79.34 N ATOM 537 NH2 ARG A 58 36.227 25.272 39.408 1.00 79.00 N ATOM 538 HE ARG A 58 35.921 22.865 38.843 1.00 0.00 H ATOM 539 HH12 ARG A 58 38.620 25.663 40.087 1.00 0.00 H ATOM 540 HH11 ARG A 58 39.148 23.954 39.875 1.00 0.00 H ATOM 541 HH22 ARG A 58 36.448 26.256 39.662 1.00 0.00 H ATOM 542 HH21 ARG A 58 35.263 25.015 39.115 1.00 0.00 H ATOM 543 H ARG A 58 37.701 20.999 43.690 1.00 0.00 H ATOM 544 N TRP A 59 36.418 17.852 41.660 1.00 41.12 N ATOM 545 CA TRP A 59 36.940 16.489 41.642 1.00 38.43 C ATOM 546 C TRP A 59 37.568 16.139 40.298 1.00 39.44 C ATOM 547 O TRP A 59 38.452 15.282 40.218 1.00 41.06 O ATOM 548 CB TRP A 59 35.822 15.496 41.964 1.00 34.01 C ATOM 549 CG TRP A 59 35.305 15.627 43.349 1.00 33.25 C ATOM 550 CD1 TRP A 59 34.400 16.542 43.806 1.00 31.70 C ATOM 551 CD2 TRP A 59 35.659 14.813 44.474 1.00 33.64 C ATOM 552 NE1 TRP A 59 34.170 16.347 45.147 1.00 32.40 N ATOM 553 CE2 TRP A 59 34.930 15.293 45.581 1.00 33.27 C ATOM 554 CE3 TRP A 59 36.521 13.728 44.653 1.00 34.06 C ATOM 555 CZ2 TRP A 59 35.041 14.723 46.848 1.00 33.83 C ATOM 556 CZ3 TRP A 59 36.627 13.162 45.908 1.00 35.79 C ATOM 557 CH2 TRP A 59 35.893 13.662 46.991 1.00 35.95 C ATOM 558 HE1 TRP A 59 33.523 16.909 45.737 1.00 0.00 H ATOM 559 H TRP A 59 35.506 18.040 41.196 1.00 0.00 H ATOM 560 N ARG A 60 37.100 16.802 39.243 1.00 37.74 N ATOM 561 CA ARG A 60 37.572 16.538 37.886 1.00 35.09 C ATOM 562 C ARG A 60 37.984 17.828 37.183 1.00 39.37 C ATOM 563 O ARG A 60 37.498 18.909 37.520 1.00 40.47 O ATOM 564 CB ARG A 60 36.487 15.829 37.064 1.00 30.60 C ATOM 565 CG ARG A 60 35.956 14.549 37.683 1.00 29.76 C ATOM 566 CD ARG A 60 34.608 14.154 37.080 1.00 31.52 C ATOM 567 NE ARG A 60 34.727 13.695 35.700 1.00 34.04 N ATOM 568 CZ ARG A 60 34.187 14.322 34.661 1.00 40.40 C ATOM 569 NH1 ARG A 60 33.480 15.431 34.852 1.00 39.20 N ATOM 570 NH2 ARG A 60 34.345 13.838 33.434 1.00 45.03 N ATOM 571 HE ARG A 60 35.267 12.825 35.519 1.00 0.00 H ATOM 572 HH12 ARG A 60 33.056 15.924 34.040 1.00 0.00 H ATOM 573 HH11 ARG A 60 33.351 15.806 35.813 1.00 0.00 H ATOM 574 HH22 ARG A 60 33.921 14.331 32.622 1.00 0.00 H ATOM 575 HH21 ARG A 60 34.892 12.966 33.285 1.00 0.00 H ATOM 576 H ARG A 60 36.374 17.532 39.390 1.00 0.00 H ATOM 577 N LEU A 61 38.886 17.703 36.215 1.00 40.39 N ATOM 578 CA LEU A 61 39.261 18.808 35.341 1.00 45.94 C ATOM 579 C LEU A 61 39.570 18.248 33.959 1.00 48.81 C ATOM 580 O LEU A 61 40.164 17.173 33.840 1.00 48.93 O ATOM 581 CB LEU A 61 40.460 19.579 35.902 1.00 48.68 C ATOM 582 CG LEU A 61 40.075 20.807 36.731 1.00 51.51 C ATOM 583 CD1 LEU A 61 41.278 21.431 37.424 1.00 55.45 C ATOM 584 CD2 LEU A 61 39.365 21.840 35.860 1.00 51.74 C ATOM 585 H LEU A 61 39.343 16.779 36.075 1.00 0.00 H ATOM 586 N LYS A 62 39.155 18.978 32.925 1.00 52.60 N ATOM 587 CA LYS A 62 39.247 18.516 31.538 1.00 55.00 C ATOM 588 C LYS A 62 38.562 17.164 31.369 1.00 51.36 C ATOM 589 O LYS A 62 39.019 16.324 30.593 1.00 50.24 O ATOM 590 CB LYS A 62 40.709 18.423 31.072 1.00 58.70 C ATOM 591 CG LYS A 62 41.444 19.758 31.010 1.00 62.36 C ATOM 592 CD LYS A 62 42.738 19.635 30.212 1.00 66.34 C ATOM 593 CE LYS A 62 43.551 20.926 30.238 1.00 70.56 C ATOM 594 NZ LYS A 62 42.918 22.031 29.458 1.00 72.36 N ATOM 595 HZ1 LYS A 62 42.819 21.740 28.465 1.00 0.00 H ATOM 596 HZ2 LYS A 62 41.980 22.240 29.855 1.00 0.00 H ATOM 597 HZ3 LYS A 62 43.516 22.880 29.514 1.00 0.00 H ATOM 598 H LYS A 62 38.748 19.917 33.111 1.00 0.00 H ATOM 599 N GLY A 63 37.468 16.964 32.101 1.00 50.52 N ATOM 600 CA GLY A 63 36.749 15.703 32.075 1.00 49.81 C ATOM 601 C GLY A 63 37.612 14.522 32.493 1.00 51.89 C ATOM 602 O GLY A 63 37.562 13.451 31.880 1.00 52.67 O ATOM 603 H GLY A 63 37.119 17.733 32.708 1.00 0.00 H ATOM 604 N LYS A 64 38.405 14.717 33.543 1.00 50.19 N ATOM 605 CA LYS A 64 39.338 13.698 34.004 1.00 48.52 C ATOM 606 C LYS A 64 39.602 13.859 35.500 1.00 43.84 C ATOM 607 O LYS A 64 39.803 14.976 35.983 1.00 42.91 O ATOM 608 CB LYS A 64 40.645 13.784 33.210 1.00 51.11 C ATOM 609 CG LYS A 64 41.466 12.511 33.203 1.00 52.08 C ATOM 610 CD LYS A 64 42.620 12.612 32.207 1.00 56.75 C ATOM 611 CE LYS A 64 43.561 13.768 32.543 1.00 59.90 C ATOM 612 NZ LYS A 64 44.645 13.945 31.529 1.00 62.92 N ATOM 613 HZ1 LYS A 64 45.214 13.076 31.476 1.00 0.00 H ATOM 614 HZ2 LYS A 64 44.220 14.140 30.600 1.00 0.00 H ATOM 615 HZ3 LYS A 64 45.252 14.742 31.808 1.00 0.00 H ATOM 616 H LYS A 64 38.357 15.624 34.050 1.00 0.00 H ATOM 617 N ALA A 65 39.603 12.746 36.229 1.00 40.28 N ATOM 618 CA ALA A 65 39.776 12.781 37.683 1.00 38.11 C ATOM 619 C ALA A 65 41.074 13.487 38.078 1.00 37.41 C ATOM 620 O ALA A 65 42.137 13.180 37.546 1.00 38.53 O ATOM 621 CB ALA A 65 39.748 11.366 38.254 1.00 34.48 C ATOM 622 H ALA A 65 39.478 11.829 35.755 1.00 0.00 H ATOM 623 N ILE A 66 40.976 14.447 38.993 1.00 38.20 N ATOM 624 CA ILE A 66 42.157 15.121 39.523 1.00 41.20 C ATOM 625 C ILE A 66 42.887 14.156 40.457 1.00 42.13 C ATOM 626 O ILE A 66 42.360 13.778 41.506 1.00 40.94 O ATOM 627 CB ILE A 66 41.781 16.426 40.267 1.00 41.58 C ATOM 628 CG1 ILE A 66 41.112 17.421 39.307 1.00 42.08 C ATOM 629 CG2 ILE A 66 43.008 17.052 40.919 1.00 41.46 C ATOM 630 CD1 ILE A 66 40.284 18.490 39.998 1.00 42.07 C ATOM 631 H ILE A 66 40.035 14.724 39.339 1.00 0.00 H ATOM 632 N THR A 67 44.092 13.750 40.062 1.00 43.95 N ATOM 633 CA THR A 67 44.822 12.679 40.746 1.00 47.45 C ATOM 634 C THR A 67 45.132 12.998 42.214 1.00 47.46 C ATOM 635 O THR A 67 45.067 12.113 43.073 1.00 46.10 O ATOM 636 CB THR A 67 46.144 12.355 40.003 1.00 59.88 C ATOM 637 OG1 THR A 67 45.867 12.108 38.618 1.00 61.08 O ATOM 638 CG2 THR A 67 46.812 11.125 40.591 1.00 59.87 C ATOM 639 HG1 THR A 67 46.712 11.901 38.145 1.00 0.00 H ATOM 640 H THR A 67 44.531 14.209 39.239 1.00 0.00 H ATOM 641 N GLU A 68 45.450 14.259 42.502 1.00 48.49 N ATOM 642 CA GLU A 68 45.815 14.668 43.858 1.00 49.44 C ATOM 643 C GLU A 68 44.651 14.549 44.832 1.00 43.37 C ATOM 644 O GLU A 68 44.832 14.125 45.975 1.00 43.29 O ATOM 645 CB GLU A 68 46.333 16.108 43.872 1.00 56.73 C ATOM 646 CG GLU A 68 47.431 16.404 42.866 1.00 64.85 C ATOM 647 CD GLU A 68 46.885 16.871 41.529 1.00 70.19 C ATOM 648 OE1 GLU A 68 46.994 16.110 40.545 1.00 71.76 O ATOM 649 OE2 GLU A 68 46.355 18.003 41.461 1.00 72.14 O ATOM 650 H GLU A 68 45.438 14.971 41.744 1.00 0.00 H ATOM 651 N VAL A 69 43.457 14.932 44.390 1.00 38.69 N ATOM 652 CA VAL A 69 42.300 14.865 45.268 1.00 37.05 C ATOM 653 C VAL A 69 41.781 13.427 45.346 1.00 35.80 C ATOM 654 O VAL A 69 41.203 13.035 46.360 1.00 37.06 O ATOM 655 CB VAL A 69 41.165 15.828 44.819 1.00 47.72 C ATOM 656 CG1 VAL A 69 41.714 17.223 44.587 1.00 49.76 C ATOM 657 CG2 VAL A 69 40.468 15.321 43.573 1.00 46.49 C ATOM 658 H VAL A 69 43.351 15.280 43.416 1.00 0.00 H ATOM 659 N VAL A 70 42.000 12.638 44.293 1.00 36.98 N ATOM 660 CA VAL A 70 41.643 11.218 44.314 1.00 35.86 C ATOM 661 C VAL A 70 42.511 10.496 45.345 1.00 36.50 C ATOM 662 O VAL A 70 42.032 9.647 46.098 1.00 36.96 O ATOM 663 CB VAL A 70 41.806 10.553 42.918 1.00 37.00 C ATOM 664 CG1 VAL A 70 41.772 9.041 43.029 1.00 35.24 C ATOM 665 CG2 VAL A 70 40.712 11.021 41.964 1.00 37.42 C ATOM 666 H VAL A 70 42.434 13.040 43.438 1.00 0.00 H ATOM 667 N ASP A 71 43.786 10.863 45.395 1.00 39.31 N ATOM 668 CA ASP A 71 44.716 10.255 46.339 1.00 43.35 C ATOM 669 C ASP A 71 44.409 10.672 47.778 1.00 43.68 C ATOM 670 O ASP A 71 44.482 9.852 48.690 1.00 44.87 O ATOM 671 CB ASP A 71 46.160 10.610 45.970 1.00 45.91 C ATOM 672 CG ASP A 71 46.652 9.853 44.750 1.00 48.47 C ATOM 673 OD1 ASP A 71 46.043 8.814 44.416 1.00 49.13 O ATOM 674 OD2 ASP A 71 47.648 10.288 44.134 1.00 51.53 O ATOM 675 H ASP A 71 44.129 11.600 44.747 1.00 0.00 H ATOM 676 N GLN A 72 44.056 11.938 47.978 1.00 42.90 N ATOM 677 CA GLN A 72 43.652 12.413 49.301 1.00 42.13 C ATOM 678 C GLN A 72 42.377 11.723 49.782 1.00 38.87 C ATOM 679 O GLN A 72 42.245 11.414 50.968 1.00 38.68 O ATOM 680 CB GLN A 72 43.445 13.930 49.298 1.00 44.92 C ATOM 681 CG GLN A 72 44.724 14.746 49.197 1.00 48.31 C ATOM 682 CD GLN A 72 44.458 16.235 49.273 1.00 51.50 C ATOM 683 OE1 GLN A 72 44.574 16.949 48.277 1.00 54.57 O ATOM 684 NE2 GLN A 72 44.098 16.713 50.458 1.00 50.87 N ATOM 685 HE22 GLN A 72 44.013 16.073 51.273 1.00 0.00 H ATOM 686 HE21 GLN A 72 43.901 17.728 50.571 1.00 0.00 H ATOM 687 H GLN A 72 44.067 12.603 47.179 1.00 0.00 H ATOM 688 N TYR A 73 41.435 11.496 48.870 1.00 35.85 N ATOM 689 CA TYR A 73 40.216 10.773 49.219 1.00 31.93 C ATOM 690 C TYR A 73 40.525 9.322 49.560 1.00 29.05 C ATOM 691 O TYR A 73 39.994 8.779 50.530 1.00 29.15 O ATOM 692 CB TYR A 73 39.181 10.806 48.088 1.00 33.19 C ATOM 693 CG TYR A 73 38.226 9.635 48.195 1.00 33.51 C ATOM 694 CD1 TYR A 73 38.406 8.488 47.425 1.00 32.26 C ATOM 695 CD2 TYR A 73 37.179 9.655 49.108 1.00 31.36 C ATOM 696 CE1 TYR A 73 37.558 7.411 47.548 1.00 30.64 C ATOM 697 CE2 TYR A 73 36.326 8.583 49.232 1.00 30.14 C ATOM 698 CZ TYR A 73 36.524 7.468 48.452 1.00 29.35 C ATOM 699 OH TYR A 73 35.681 6.399 48.576 1.00 28.89 O ATOM 700 HH TYR A 73 34.756 6.683 48.365 1.00 0.00 H ATOM 701 H TYR A 73 41.569 11.838 47.897 1.00 0.00 H ATOM 702 N LYS A 74 41.351 8.684 48.736 1.00 28.32 N ATOM 703 CA LYS A 74 41.671 7.272 48.917 1.00 29.51 C ATOM 704 C LYS A 74 42.348 7.020 50.260 1.00 32.83 C ATOM 705 O LYS A 74 42.240 5.931 50.828 1.00 33.33 O ATOM 706 CB LYS A 74 42.575 6.770 47.786 1.00 32.21 C ATOM 707 CG LYS A 74 41.861 6.407 46.486 1.00 34.48 C ATOM 708 CD LYS A 74 42.823 5.657 45.560 1.00 40.84 C ATOM 709 CE LYS A 74 42.219 5.386 44.187 1.00 43.78 C ATOM 710 NZ LYS A 74 43.226 4.747 43.284 1.00 46.77 N ATOM 711 HZ1 LYS A 74 44.043 5.381 43.174 1.00 0.00 H ATOM 712 HZ2 LYS A 74 43.539 3.846 43.698 1.00 0.00 H ATOM 713 HZ3 LYS A 74 42.794 4.571 42.354 1.00 0.00 H ATOM 714 H LYS A 74 41.779 9.204 47.944 1.00 0.00 H ATOM 715 N ALA A 75 43.035 8.041 50.762 1.00 33.54 N ATOM 716 CA ALA A 75 43.869 7.915 51.951 1.00 36.28 C ATOM 717 C ALA A 75 43.087 7.558 53.212 1.00 34.73 C ATOM 718 O ALA A 75 43.630 6.910 54.107 1.00 34.50 O ATOM 719 CB ALA A 75 44.645 9.206 52.175 1.00 37.39 C ATOM 720 H ALA A 75 42.975 8.965 50.289 1.00 0.00 H ATOM 721 N VAL A 76 41.824 7.972 53.288 1.00 33.01 N ATOM 722 CA VAL A 76 41.049 7.771 54.512 1.00 35.39 C ATOM 723 C VAL A 76 40.484 6.354 54.620 1.00 35.24 C ATOM 724 O VAL A 76 39.924 5.988 55.654 1.00 35.31 O ATOM 725 CB VAL A 76 39.885 8.786 54.631 1.00 35.23 C ATOM 726 CG1 VAL A 76 40.418 10.208 54.640 1.00 36.19 C ATOM 727 CG2 VAL A 76 38.874 8.593 53.512 1.00 33.57 C ATOM 728 H VAL A 76 41.385 8.442 52.471 1.00 0.00 H ATOM 729 N GLY A 77 40.628 5.563 53.559 1.00 36.44 N ATOM 730 CA GLY A 77 40.252 4.155 53.599 1.00 37.59 C ATOM 731 C GLY A 77 38.779 3.846 53.839 1.00 34.88 C ATOM 732 O GLY A 77 38.439 2.951 54.615 1.00 35.49 O ATOM 733 H GLY A 77 41.018 5.959 52.680 1.00 0.00 H ATOM 734 N ALA A 78 37.903 4.576 53.162 1.00 29.65 N ATOM 735 CA ALA A 78 36.466 4.344 53.274 1.00 27.74 C ATOM 736 C ALA A 78 36.069 2.952 52.783 1.00 27.16 C ATOM 737 O ALA A 78 36.595 2.467 51.781 1.00 30.40 O ATOM 738 CB ALA A 78 35.711 5.405 52.494 1.00 25.83 C ATOM 739 H ALA A 78 38.248 5.332 52.536 1.00 0.00 H ATOM 740 N GLU A 79 35.138 2.317 53.491 1.00 26.63 N ATOM 741 CA GLU A 79 34.558 1.053 53.048 1.00 24.83 C ATOM 742 C GLU A 79 33.246 1.305 52.310 1.00 25.08 C ATOM 743 O GLU A 79 32.733 0.424 51.613 1.00 23.30 O ATOM 744 CB GLU A 79 34.325 0.117 54.237 1.00 29.53 C ATOM 745 CG GLU A 79 35.602 -0.283 54.976 1.00 31.97 C ATOM 746 CD GLU A 79 35.332 -1.172 56.181 1.00 34.46 C ATOM 747 OE1 GLU A 79 34.501 -0.790 57.036 1.00 33.48 O ATOM 748 OE2 GLU A 79 35.954 -2.253 56.276 1.00 37.18 O ATOM 749 H GLU A 79 34.814 2.734 54.387 1.00 0.00 H ATOM 750 N LEU A 80 32.712 2.513 52.480 1.00 22.35 N ATOM 751 CA LEU A 80 31.473 2.929 51.827 1.00 22.07 C ATOM 752 C LEU A 80 31.431 4.443 51.683 1.00 24.02 C ATOM 753 O LEU A 80 31.742 5.175 52.634 1.00 23.90 O ATOM 754 CB LEU A 80 30.246 2.453 52.615 1.00 20.71 C ATOM 755 CG LEU A 80 28.905 2.990 52.091 1.00 20.99 C ATOM 756 CD1 LEU A 80 28.481 2.274 50.815 1.00 18.90 C ATOM 757 CD2 LEU A 80 27.807 2.911 53.140 1.00 20.58 C ATOM 758 H LEU A 80 33.197 3.189 53.104 1.00 0.00 H ATOM 759 N ASN A 81 31.057 4.915 50.495 1.00 21.59 N ATOM 760 CA ASN A 81 30.788 6.333 50.310 1.00 20.01 C ATOM 761 C ASN A 81 29.302 6.615 50.484 1.00 21.40 C ATOM 762 O ASN A 81 28.452 5.874 49.969 1.00 20.28 O ATOM 763 CB ASN A 81 31.239 6.819 48.930 1.00 21.13 C ATOM 764 CG ASN A 81 32.746 6.828 48.764 1.00 24.53 C ATOM 765 OD1 ASN A 81 33.498 7.020 49.728 1.00 24.72 O ATOM 766 ND2 ASN A 81 33.201 6.633 47.522 1.00 21.87 N ATOM 767 HD22 ASN A 81 32.532 6.475 46.742 1.00 0.00 H ATOM 768 HD21 ASN A 81 34.224 6.639 47.336 1.00 0.00 H ATOM 769 H ASN A 81 30.956 4.263 49.691 1.00 0.00 H ATOM 770 N VAL A 82 28.999 7.686 51.213 1.00 20.29 N ATOM 771 CA VAL A 82 27.629 8.150 51.406 1.00 23.68 C ATOM 772 C VAL A 82 27.515 9.580 50.860 1.00 21.93 C ATOM 773 O VAL A 82 28.277 10.465 51.264 1.00 21.77 O ATOM 774 CB VAL A 82 27.226 8.097 52.900 1.00 28.46 C ATOM 775 CG1 VAL A 82 25.946 8.853 53.131 1.00 31.36 C ATOM 776 CG2 VAL A 82 27.076 6.649 53.364 1.00 26.66 C ATOM 777 H VAL A 82 29.772 8.215 51.665 1.00 0.00 H ATOM 778 N LEU A 83 26.588 9.802 49.930 1.00 19.04 N ATOM 779 CA LEU A 83 26.480 11.104 49.261 1.00 21.08 C ATOM 780 C LEU A 83 25.153 11.796 49.561 1.00 22.47 C ATOM 781 O LEU A 83 24.194 11.667 48.797 1.00 22.50 O ATOM 782 CB LEU A 83 26.651 10.956 47.740 1.00 20.72 C ATOM 783 CG LEU A 83 28.077 10.882 47.165 1.00 21.54 C ATOM 784 CD1 LEU A 83 28.845 9.676 47.692 1.00 17.29 C ATOM 785 CD2 LEU A 83 28.075 10.872 45.639 1.00 23.14 C ATOM 786 H LEU A 83 25.929 9.039 49.673 1.00 0.00 H ATOM 787 N PRO A 84 25.095 12.534 50.682 1.00 26.19 N ATOM 788 CA PRO A 84 23.913 13.326 51.033 1.00 30.80 C ATOM 789 C PRO A 84 23.977 14.732 50.440 1.00 34.84 C ATOM 790 O PRO A 84 24.746 15.564 50.923 1.00 39.92 O ATOM 791 CB PRO A 84 23.966 13.371 52.565 1.00 28.82 C ATOM 792 CG PRO A 84 25.432 13.165 52.920 1.00 28.60 C ATOM 793 CD PRO A 84 26.167 12.688 51.682 1.00 25.11 C ATOM 794 N PHE A 85 23.160 14.983 49.421 1.00 32.93 N ATOM 795 CA PHE A 85 23.192 16.231 48.660 1.00 34.99 C ATOM 796 C PHE A 85 24.607 16.619 48.250 1.00 35.64 C ATOM 797 O PHE A 85 25.171 17.608 48.727 1.00 39.78 O ATOM 798 CB PHE A 85 22.528 17.369 49.447 1.00 40.67 C ATOM 799 CG PHE A 85 21.032 17.400 49.300 1.00 46.01 C ATOM 800 CD1 PHE A 85 20.447 17.813 48.106 1.00 46.50 C ATOM 801 CD2 PHE A 85 20.210 16.993 50.341 1.00 45.38 C ATOM 802 CE1 PHE A 85 19.069 17.830 47.960 1.00 45.01 C ATOM 803 CE2 PHE A 85 18.832 17.009 50.203 1.00 43.20 C ATOM 804 CZ PHE A 85 18.262 17.426 49.010 1.00 44.47 C ATOM 805 H PHE A 85 22.465 14.257 49.153 1.00 0.00 H ATOM 806 N CYS A 86 25.172 15.811 47.361 1.00 31.58 N ATOM 807 CA CYS A 86 26.434 16.116 46.709 1.00 29.30 C ATOM 808 C CYS A 86 26.121 16.829 45.395 1.00 28.81 C ATOM 809 O CYS A 86 25.377 16.310 44.559 1.00 28.97 O ATOM 810 CB CYS A 86 27.240 14.834 46.473 1.00 28.45 C ATOM 811 SG CYS A 86 28.774 15.052 45.557 1.00 37.50 S ATOM 812 H CYS A 86 24.690 14.921 47.121 1.00 0.00 H ATOM 813 N SER A 87 26.674 18.022 45.220 1.00 31.12 N ATOM 814 CA SER A 87 26.297 18.873 44.099 1.00 33.29 C ATOM 815 C SER A 87 27.121 18.624 42.835 1.00 33.85 C ATOM 816 O SER A 87 26.912 19.289 41.823 1.00 35.33 O ATOM 817 CB SER A 87 26.416 20.344 44.506 1.00 34.13 C ATOM 818 OG SER A 87 27.747 20.656 44.878 1.00 36.33 O ATOM 819 HG SER A 87 28.016 20.089 45.644 1.00 0.00 H ATOM 820 H SER A 87 27.390 18.356 45.896 1.00 0.00 H ATOM 821 N GLN A 88 28.050 17.676 42.881 1.00 31.79 N ATOM 822 CA GLN A 88 28.908 17.434 41.721 1.00 31.78 C ATOM 823 C GLN A 88 28.968 15.961 41.334 1.00 29.87 C ATOM 824 O GLN A 88 28.792 15.088 42.182 1.00 26.69 O ATOM 825 CB GLN A 88 30.321 17.958 41.992 1.00 34.73 C ATOM 826 CG GLN A 88 30.454 19.462 41.820 1.00 40.45 C ATOM 827 CD GLN A 88 31.765 19.993 42.358 1.00 46.43 C ATOM 828 OE1 GLN A 88 32.173 19.660 43.471 1.00 46.07 O ATOM 829 NE2 GLN A 88 32.438 20.822 41.568 1.00 51.27 N ATOM 830 HE22 GLN A 88 32.056 21.076 40.635 1.00 0.00 H ATOM 831 HE21 GLN A 88 33.347 21.217 41.883 1.00 0.00 H ATOM 832 H GLN A 88 28.168 17.105 43.742 1.00 0.00 H ATOM 833 N PHE A 89 29.198 15.697 40.048 1.00 31.13 N ATOM 834 CA PHE A 89 29.465 14.342 39.578 1.00 30.36 C ATOM 835 C PHE A 89 30.792 13.894 40.164 1.00 28.36 C ATOM 836 O PHE A 89 31.784 14.617 40.084 1.00 31.84 O ATOM 837 CB PHE A 89 29.499 14.281 38.046 1.00 29.16 C ATOM 838 CG PHE A 89 29.797 12.907 37.493 1.00 26.53 C ATOM 839 CD1 PHE A 89 28.775 11.985 37.309 1.00 24.14 C ATOM 840 CD2 PHE A 89 31.093 12.544 37.142 1.00 26.77 C ATOM 841 CE1 PHE A 89 29.037 10.719 36.796 1.00 19.43 C ATOM 842 CE2 PHE A 89 31.362 11.282 36.626 1.00 26.54 C ATOM 843 CZ PHE A 89 30.331 10.368 36.454 1.00 22.82 C ATOM 844 H PHE A 89 29.187 16.478 39.361 1.00 0.00 H ATOM 845 N ILE A 90 30.801 12.713 40.769 1.00 26.06 N ATOM 846 CA ILE A 90 32.008 12.175 41.382 1.00 23.96 C ATOM 847 C ILE A 90 32.625 11.128 40.463 1.00 24.88 C ATOM 848 O ILE A 90 31.931 10.203 40.039 1.00 26.82 O ATOM 849 CB ILE A 90 31.698 11.554 42.760 1.00 19.89 C ATOM 850 CG1 ILE A 90 31.043 12.594 43.670 1.00 19.21 C ATOM 851 CG2 ILE A 90 32.958 11.013 43.394 1.00 19.04 C ATOM 852 CD1 ILE A 90 31.916 13.809 43.911 1.00 20.48 C ATOM 853 H ILE A 90 29.923 12.157 40.807 1.00 0.00 H ATOM 854 N PRO A 91 33.927 11.269 40.146 1.00 27.26 N ATOM 855 CA PRO A 91 34.590 10.323 39.236 1.00 27.41 C ATOM 856 C PRO A 91 34.487 8.890 39.736 1.00 27.75 C ATOM 857 O PRO A 91 34.443 8.672 40.953 1.00 27.93 O ATOM 858 CB PRO A 91 36.052 10.799 39.225 1.00 28.29 C ATOM 859 CG PRO A 91 36.207 11.613 40.460 1.00 28.27 C ATOM 860 CD PRO A 91 34.870 12.266 40.682 1.00 28.35 C ATOM 861 N MET A 92 34.425 7.933 38.813 1.00 26.83 N ATOM 862 CA MET A 92 34.241 6.530 39.177 1.00 25.73 C ATOM 863 C MET A 92 35.422 5.987 39.975 1.00 26.20 C ATOM 864 O MET A 92 35.262 5.050 40.757 1.00 29.33 O ATOM 865 CB MET A 92 34.013 5.681 37.924 1.00 24.69 C ATOM 866 CG MET A 92 32.745 6.040 37.172 1.00 23.03 C ATOM 867 SD MET A 92 31.294 6.053 38.248 1.00 34.63 S ATOM 868 CE MET A 92 31.138 4.308 38.612 1.00 25.08 C ATOM 869 H MET A 92 34.510 8.190 37.809 1.00 0.00 H ATOM 870 N GLU A 93 36.600 6.579 39.778 1.00 28.23 N ATOM 871 CA GLU A 93 37.775 6.269 40.593 1.00 33.31 C ATOM 872 C GLU A 93 37.450 6.383 42.079 1.00 34.42 C ATOM 873 O GLU A 93 37.942 5.602 42.896 1.00 34.54 O ATOM 874 CB GLU A 93 38.937 7.208 40.256 1.00 38.95 C ATOM 875 CG GLU A 93 39.655 6.926 38.938 1.00 45.38 C ATOM 876 CD GLU A 93 39.153 7.783 37.784 1.00 47.57 C ATOM 877 OE1 GLU A 93 37.953 8.143 37.770 1.00 44.86 O ATOM 878 OE2 GLU A 93 39.965 8.100 36.889 1.00 52.26 O ATOM 879 H GLU A 93 36.687 7.285 39.019 1.00 0.00 H ATOM 880 N VAL A 94 36.624 7.368 42.421 1.00 33.16 N ATOM 881 CA VAL A 94 36.213 7.592 43.803 1.00 29.72 C ATOM 882 C VAL A 94 35.003 6.728 44.155 1.00 25.55 C ATOM 883 O VAL A 94 34.996 6.044 45.186 1.00 23.64 O ATOM 884 CB VAL A 94 35.876 9.076 44.052 1.00 28.46 C ATOM 885 CG1 VAL A 94 35.394 9.287 45.487 1.00 27.24 C ATOM 886 CG2 VAL A 94 37.086 9.950 43.756 1.00 29.16 C ATOM 887 H VAL A 94 36.259 7.999 41.679 1.00 0.00 H ATOM 888 N ILE A 95 33.991 6.759 43.288 1.00 23.64 N ATOM 889 CA ILE A 95 32.772 5.967 43.466 1.00 24.27 C ATOM 890 C ILE A 95 33.057 4.472 43.684 1.00 25.60 C ATOM 891 O ILE A 95 32.487 3.848 44.587 1.00 24.40 O ATOM 892 CB ILE A 95 31.828 6.105 42.239 1.00 23.27 C ATOM 893 CG1 ILE A 95 31.288 7.535 42.096 1.00 23.86 C ATOM 894 CG2 ILE A 95 30.694 5.093 42.315 1.00 23.68 C ATOM 895 CD1 ILE A 95 30.555 8.057 43.317 1.00 21.34 C ATOM 896 H ILE A 95 34.070 7.371 42.451 1.00 0.00 H ATOM 897 N ASP A 96 33.941 3.903 42.860 1.00 25.48 N ATOM 898 CA ASP A 96 34.210 2.464 42.897 1.00 27.71 C ATOM 899 C ASP A 96 35.322 2.072 43.869 1.00 30.41 C ATOM 900 O ASP A 96 35.591 0.888 44.053 1.00 31.68 O ATOM 901 CB ASP A 96 34.579 1.947 41.500 1.00 32.88 C ATOM 902 CG ASP A 96 33.427 2.037 40.512 1.00 39.16 C ATOM 903 OD1 ASP A 96 33.691 2.314 39.320 1.00 42.59 O ATOM 904 OD2 ASP A 96 32.266 1.820 40.922 1.00 39.47 O ATOM 905 H ASP A 96 34.451 4.497 42.175 1.00 0.00 H ATOM 906 N HIS A 97 35.978 3.050 44.486 1.00 29.48 N ATOM 907 CA HIS A 97 37.093 2.732 45.376 1.00 29.16 C ATOM 908 C HIS A 97 36.721 1.917 46.628 1.00 27.92 C ATOM 909 O HIS A 97 37.411 0.944 46.949 1.00 26.94 O ATOM 910 CB HIS A 97 37.814 4.005 45.813 1.00 29.50 C ATOM 911 CG HIS A 97 38.940 3.752 46.767 1.00 31.40 C ATOM 912 ND1 HIS A 97 38.927 4.199 48.071 1.00 34.77 N ATOM 913 CD2 HIS A 97 40.107 3.083 46.610 1.00 33.73 C ATOM 914 CE1 HIS A 97 40.042 3.824 48.674 1.00 36.93 C ATOM 915 NE2 HIS A 97 40.776 3.147 47.809 1.00 36.42 N ATOM 916 H HIS A 97 35.698 4.040 44.336 1.00 0.00 H ATOM 917 N PRO A 98 35.654 2.307 47.354 1.00 26.81 N ATOM 918 CA PRO A 98 35.409 1.516 48.567 1.00 26.47 C ATOM 919 C PRO A 98 34.875 0.119 48.273 1.00 27.51 C ATOM 920 O PRO A 98 34.252 -0.099 47.228 1.00 25.40 O ATOM 921 CB PRO A 98 34.347 2.330 49.323 1.00 23.46 C ATOM 922 CG PRO A 98 34.310 3.657 48.669 1.00 24.45 C ATOM 923 CD PRO A 98 34.702 3.426 47.240 1.00 25.03 C ATOM 924 N LYS A 99 35.108 -0.797 49.209 1.00 26.60 N ATOM 925 CA LYS A 99 34.602 -2.162 49.137 1.00 29.87 C ATOM 926 C LYS A 99 33.110 -2.197 48.796 1.00 27.06 C ATOM 927 O LYS A 99 32.680 -2.982 47.947 1.00 27.49 O ATOM 928 CB LYS A 99 34.879 -2.878 50.466 1.00 33.63 C ATOM 929 CG LYS A 99 33.926 -4.016 50.812 1.00 39.27 C ATOM 930 CD LYS A 99 33.831 -4.226 52.331 1.00 40.78 C ATOM 931 CE LYS A 99 34.885 -5.184 52.862 1.00 42.11 C ATOM 932 NZ LYS A 99 34.819 -5.304 54.354 1.00 43.98 N ATOM 933 HZ1 LYS A 99 34.977 -4.370 54.783 1.00 0.00 H ATOM 934 HZ2 LYS A 99 33.882 -5.660 54.631 1.00 0.00 H ATOM 935 HZ3 LYS A 99 35.552 -5.965 54.680 1.00 0.00 H ATOM 936 H LYS A 99 35.680 -0.525 50.034 1.00 0.00 H ATOM 937 N HIS A 100 32.327 -1.326 49.430 1.00 23.33 N ATOM 938 CA HIS A 100 30.879 -1.310 49.216 1.00 23.32 C ATOM 939 C HIS A 100 30.398 -0.299 48.177 1.00 22.80 C ATOM 940 O HIS A 100 29.194 -0.114 48.010 1.00 27.17 O ATOM 941 CB HIS A 100 30.149 -1.035 50.536 1.00 23.66 C ATOM 942 CG HIS A 100 30.260 -2.141 51.536 1.00 27.02 C ATOM 943 ND1 HIS A 100 29.934 -3.447 51.243 1.00 29.60 N ATOM 944 CD2 HIS A 100 30.643 -2.131 52.835 1.00 28.63 C ATOM 945 CE1 HIS A 100 30.120 -4.195 52.317 1.00 30.60 C ATOM 946 NE2 HIS A 100 30.552 -3.421 53.296 1.00 29.63 N ATOM 947 H HIS A 100 32.753 -0.644 50.090 1.00 0.00 H ATOM 948 N GLY A 101 31.315 0.368 47.489 1.00 23.11 N ATOM 949 CA GLY A 101 30.914 1.368 46.508 1.00 23.83 C ATOM 950 C GLY A 101 30.331 2.628 47.132 1.00 23.26 C ATOM 951 O GLY A 101 30.786 3.058 48.196 1.00 24.30 O ATOM 952 H GLY A 101 32.324 0.176 47.650 1.00 0.00 H ATOM 953 N SER A 102 29.319 3.212 46.489 1.00 17.57 N ATOM 954 CA SER A 102 28.762 4.486 46.943 1.00 16.86 C ATOM 955 C SER A 102 27.241 4.535 46.804 1.00 16.74 C ATOM 956 O SER A 102 26.699 4.080 45.801 1.00 18.09 O ATOM 957 CB SER A 102 29.381 5.642 46.153 1.00 18.66 C ATOM 958 OG SER A 102 30.795 5.576 46.153 1.00 18.02 O ATOM 959 HG SER A 102 31.084 4.724 45.740 1.00 0.00 H ATOM 960 H SER A 102 28.917 2.752 45.647 1.00 0.00 H ATOM 961 N ILE A 103 26.560 5.094 47.802 1.00 14.82 N ATOM 962 CA ILE A 103 25.119 5.326 47.704 1.00 16.67 C ATOM 963 C ILE A 103 24.798 6.817 47.733 1.00 18.77 C ATOM 964 O ILE A 103 25.476 7.600 48.416 1.00 18.07 O ATOM 965 CB ILE A 103 24.341 4.625 48.833 1.00 16.37 C ATOM 966 CG1 ILE A 103 24.853 5.071 50.197 1.00 17.97 C ATOM 967 CG2 ILE A 103 24.442 3.113 48.687 1.00 14.21 C ATOM 968 CD1 ILE A 103 24.093 4.449 51.349 1.00 17.13 C ATOM 969 H ILE A 103 27.063 5.371 48.669 1.00 0.00 H ATOM 970 N ILE A 104 23.755 7.200 46.995 1.00 13.71 N ATOM 971 CA ILE A 104 23.371 8.602 46.850 1.00 15.62 C ATOM 972 C ILE A 104 21.914 8.832 47.268 1.00 17.36 C ATOM 973 O ILE A 104 21.037 8.009 46.979 1.00 18.07 O ATOM 974 CB ILE A 104 23.568 9.068 45.390 1.00 15.05 C ATOM 975 CG1 ILE A 104 24.999 8.766 44.928 1.00 18.34 C ATOM 976 CG2 ILE A 104 23.239 10.543 45.236 1.00 13.55 C ATOM 977 CD1 ILE A 104 25.332 9.295 43.539 1.00 17.56 C ATOM 978 H ILE A 104 23.195 6.474 46.505 1.00 0.00 H ATOM 979 N TYR A 105 21.658 9.941 47.958 1.00 17.46 N ATOM 980 CA TYR A 105 20.291 10.365 48.248 1.00 17.91 C ATOM 981 C TYR A 105 19.740 11.180 47.083 1.00 19.30 C ATOM 982 O TYR A 105 20.420 12.069 46.575 1.00 22.16 O ATOM 983 CB TYR A 105 20.244 11.194 49.532 1.00 16.24 C ATOM 984 CG TYR A 105 18.907 11.871 49.785 1.00 18.29 C ATOM 985 CD1 TYR A 105 17.862 11.174 50.378 1.00 14.00 C ATOM 986 CD2 TYR A 105 18.698 13.207 49.448 1.00 17.50 C ATOM 987 CE1 TYR A 105 16.638 11.781 50.619 1.00 15.68 C ATOM 988 CE2 TYR A 105 17.468 13.826 49.685 1.00 18.35 C ATOM 989 CZ TYR A 105 16.447 13.102 50.271 1.00 16.79 C ATOM 990 OH TYR A 105 15.224 13.687 50.521 1.00 19.03 O ATOM 991 HH TYR A 105 14.621 13.023 50.941 1.00 0.00 H ATOM 992 H TYR A 105 22.452 10.520 48.299 1.00 0.00 H ATOM 993 N HIS A 106 18.517 10.878 46.662 1.00 18.77 N ATOM 994 CA HIS A 106 17.852 11.651 45.611 1.00 17.87 C ATOM 995 C HIS A 106 16.411 11.917 45.990 1.00 16.82 C ATOM 996 O HIS A 106 15.644 10.976 46.160 1.00 17.21 O ATOM 997 CB HIS A 106 17.890 10.926 44.261 1.00 16.15 C ATOM 998 CG HIS A 106 17.383 11.758 43.124 1.00 15.47 C ATOM 999 ND1 HIS A 106 18.173 12.676 42.464 1.00 14.81 N ATOM 1000 CD2 HIS A 106 16.162 11.829 42.541 1.00 15.91 C ATOM 1001 CE1 HIS A 106 17.464 13.267 41.517 1.00 15.50 C ATOM 1002 NE2 HIS A 106 16.240 12.772 41.542 1.00 15.42 N ATOM 1003 H HIS A 106 18.019 10.072 47.090 1.00 0.00 H ATOM 1004 N PRO A 107 16.029 13.199 46.100 1.00 16.45 N ATOM 1005 CA PRO A 107 14.676 13.528 46.561 1.00 14.56 C ATOM 1006 C PRO A 107 13.605 13.443 45.467 1.00 18.40 C ATOM 1007 O PRO A 107 12.848 14.402 45.261 1.00 18.65 O ATOM 1008 CB PRO A 107 14.828 14.966 47.054 1.00 16.03 C ATOM 1009 CG PRO A 107 15.867 15.543 46.134 1.00 15.89 C ATOM 1010 CD PRO A 107 16.851 14.411 45.911 1.00 16.54 C ATOM 1011 N SER A 108 13.545 12.315 44.766 1.00 17.39 N ATOM 1012 CA SER A 108 12.414 12.046 43.880 1.00 16.87 C ATOM 1013 C SER A 108 12.232 10.541 43.771 1.00 14.27 C ATOM 1014 O SER A 108 13.075 9.774 44.235 1.00 14.89 O ATOM 1015 CB SER A 108 12.616 12.693 42.501 1.00 17.36 C ATOM 1016 OG SER A 108 13.457 11.918 41.668 1.00 17.10 O ATOM 1017 HG SER A 108 13.560 12.370 40.793 1.00 0.00 H ATOM 1018 H SER A 108 14.311 11.616 44.849 1.00 0.00 H ATOM 1019 N LEU A 109 11.122 10.125 43.175 1.00 14.63 N ATOM 1020 CA LEU A 109 10.869 8.719 42.912 1.00 15.40 C ATOM 1021 C LEU A 109 11.530 8.300 41.600 1.00 16.35 C ATOM 1022 O LEU A 109 10.874 8.253 40.561 1.00 17.53 O ATOM 1023 CB LEU A 109 9.356 8.453 42.872 1.00 16.10 C ATOM 1024 CG LEU A 109 8.598 8.906 44.131 1.00 18.59 C ATOM 1025 CD1 LEU A 109 7.087 8.907 43.932 1.00 18.17 C ATOM 1026 CD2 LEU A 109 8.965 8.031 45.326 1.00 15.48 C ATOM 1027 H LEU A 109 10.411 10.827 42.887 1.00 0.00 H ATOM 1028 N LEU A 110 12.832 8.015 41.652 1.00 17.39 N ATOM 1029 CA LEU A 110 13.571 7.540 40.478 1.00 18.71 C ATOM 1030 C LEU A 110 12.874 6.334 39.842 1.00 20.92 C ATOM 1031 O LEU A 110 12.346 5.464 40.555 1.00 20.73 O ATOM 1032 CB LEU A 110 15.014 7.188 40.862 1.00 15.32 C ATOM 1033 CG LEU A 110 15.901 8.379 41.242 1.00 15.23 C ATOM 1034 CD1 LEU A 110 17.247 7.928 41.771 1.00 15.65 C ATOM 1035 CD2 LEU A 110 16.096 9.312 40.044 1.00 17.80 C ATOM 1036 H LEU A 110 13.338 8.133 42.553 1.00 0.00 H ATOM 1037 N PRO A 111 12.885 6.256 38.497 1.00 16.88 N ATOM 1038 CA PRO A 111 13.650 7.059 37.532 1.00 17.98 C ATOM 1039 C PRO A 111 13.053 8.420 37.175 1.00 21.69 C ATOM 1040 O PRO A 111 13.588 9.100 36.296 1.00 20.32 O ATOM 1041 CB PRO A 111 13.657 6.169 36.293 1.00 17.74 C ATOM 1042 CG PRO A 111 12.315 5.511 36.343 1.00 18.37 C ATOM 1043 CD PRO A 111 12.051 5.248 37.814 1.00 16.62 C ATOM 1044 N ARG A 112 11.961 8.808 37.819 1.00 21.02 N ATOM 1045 CA ARG A 112 11.351 10.091 37.509 1.00 22.08 C ATOM 1046 C ARG A 112 12.119 11.227 38.190 1.00 19.25 C ATOM 1047 O ARG A 112 12.564 11.093 39.337 1.00 17.36 O ATOM 1048 CB ARG A 112 9.878 10.101 37.929 1.00 21.39 C ATOM 1049 CG ARG A 112 9.107 11.336 37.478 1.00 21.23 C ATOM 1050 CD ARG A 112 7.600 11.160 37.648 1.00 22.44 C ATOM 1051 NE ARG A 112 6.912 12.440 37.517 1.00 23.43 N ATOM 1052 CZ ARG A 112 6.568 12.985 36.355 1.00 25.33 C ATOM 1053 NH1 ARG A 112 6.840 12.352 35.214 1.00 21.90 N ATOM 1054 NH2 ARG A 112 5.951 14.164 36.332 1.00 24.00 N ATOM 1055 HE ARG A 112 6.676 12.958 38.387 1.00 0.00 H ATOM 1056 HH12 ARG A 112 6.570 12.779 34.305 1.00 0.00 H ATOM 1057 HH11 ARG A 112 7.322 11.431 35.233 1.00 0.00 H ATOM 1058 HH22 ARG A 112 5.681 14.592 35.423 1.00 0.00 H ATOM 1059 HH21 ARG A 112 5.739 14.657 37.223 1.00 0.00 H ATOM 1060 H ARG A 112 11.541 8.195 38.546 1.00 0.00 H ATOM 1061 N HIS A 113 12.282 12.328 37.463 1.00 19.16 N ATOM 1062 CA HIS A 113 12.950 13.528 37.965 1.00 16.61 C ATOM 1063 C HIS A 113 14.391 13.259 38.387 1.00 19.10 C ATOM 1064 O HIS A 113 14.805 13.641 39.483 1.00 19.63 O ATOM 1065 CB HIS A 113 12.181 14.143 39.137 1.00 14.20 C ATOM 1066 CG HIS A 113 10.769 14.519 38.811 1.00 18.07 C ATOM 1067 ND1 HIS A 113 10.420 15.195 37.660 1.00 19.09 N ATOM 1068 CD2 HIS A 113 9.614 14.322 39.494 1.00 20.48 C ATOM 1069 CE1 HIS A 113 9.114 15.389 37.645 1.00 20.88 C ATOM 1070 NE2 HIS A 113 8.600 14.870 38.747 1.00 18.67 N ATOM 1071 H HIS A 113 11.916 12.336 36.489 1.00 0.00 H ATOM 1072 N ARG A 114 15.149 12.600 37.516 1.00 16.27 N ATOM 1073 CA ARG A 114 16.603 12.674 37.587 1.00 20.84 C ATOM 1074 C ARG A 114 16.990 14.145 37.441 1.00 25.57 C ATOM 1075 O ARG A 114 16.276 14.913 36.774 1.00 23.25 O ATOM 1076 CB ARG A 114 17.256 11.831 36.485 1.00 21.92 C ATOM 1077 CG ARG A 114 17.034 10.325 36.615 1.00 20.60 C ATOM 1078 CD ARG A 114 17.480 9.570 35.359 1.00 23.25 C ATOM 1079 NE ARG A 114 17.382 8.126 35.560 1.00 21.62 N ATOM 1080 CZ ARG A 114 17.338 7.227 34.582 1.00 22.32 C ATOM 1081 NH1 ARG A 114 17.251 5.938 34.876 1.00 19.35 N ATOM 1082 NH2 ARG A 114 17.377 7.611 33.315 1.00 19.07 N ATOM 1083 HE ARG A 114 17.344 7.777 36.539 1.00 0.00 H ATOM 1084 HH12 ARG A 114 17.216 5.232 34.113 1.00 0.00 H ATOM 1085 HH11 ARG A 114 17.217 5.632 35.870 1.00 0.00 H ATOM 1086 HH22 ARG A 114 17.342 6.902 32.555 1.00 0.00 H ATOM 1087 HH21 ARG A 114 17.442 8.622 33.080 1.00 0.00 H ATOM 1088 H ARG A 114 14.699 12.025 36.775 1.00 0.00 H ATOM 1089 N GLY A 115 18.095 14.552 38.059 1.00 21.83 N ATOM 1090 CA GLY A 115 18.518 15.941 37.983 1.00 21.74 C ATOM 1091 C GLY A 115 18.709 16.594 39.340 1.00 23.16 C ATOM 1092 O GLY A 115 18.391 16.003 40.374 1.00 23.59 O ATOM 1093 H GLY A 115 18.662 13.870 38.602 1.00 0.00 H ATOM 1094 N ALA A 116 19.213 17.825 39.342 1.00 23.92 N ATOM 1095 CA ALA A 116 19.631 18.473 40.584 1.00 23.36 C ATOM 1096 C ALA A 116 18.523 19.272 41.269 1.00 23.10 C ATOM 1097 O ALA A 116 18.716 19.767 42.377 1.00 22.64 O ATOM 1098 CB ALA A 116 20.819 19.376 40.307 1.00 27.09 C ATOM 1099 H ALA A 116 19.312 18.337 38.442 1.00 0.00 H ATOM 1100 N SER A 117 17.380 19.423 40.600 1.00 22.06 N ATOM 1101 CA SER A 117 16.245 20.151 41.168 1.00 20.13 C ATOM 1102 C SER A 117 14.995 19.288 41.146 1.00 21.12 C ATOM 1103 O SER A 117 13.941 19.739 40.693 1.00 21.95 O ATOM 1104 CB SER A 117 15.980 21.452 40.394 1.00 19.88 C ATOM 1105 OG SER A 117 17.096 22.323 40.432 1.00 19.55 O ATOM 1106 HG SER A 117 17.299 22.556 41.372 1.00 0.00 H ATOM 1107 H SER A 117 17.293 19.012 39.649 1.00 0.00 H ATOM 1108 N ALA A 118 15.117 18.053 41.625 1.00 20.66 N ATOM 1109 CA ALA A 118 14.032 17.076 41.533 1.00 16.93 C ATOM 1110 C ALA A 118 12.795 17.486 42.315 1.00 15.55 C ATOM 1111 O ALA A 118 11.665 17.180 41.908 1.00 16.08 O ATOM 1112 CB ALA A 118 14.511 15.711 42.013 1.00 13.71 C ATOM 1113 H ALA A 118 16.010 17.774 42.078 1.00 0.00 H ATOM 1114 N ILE A 119 12.996 18.162 43.442 1.00 14.68 N ATOM 1115 CA ILE A 119 11.870 18.597 44.265 1.00 17.03 C ATOM 1116 C ILE A 119 11.071 19.683 43.549 1.00 18.14 C ATOM 1117 O ILE A 119 9.833 19.662 43.552 1.00 15.97 O ATOM 1118 CB ILE A 119 12.329 19.137 45.630 1.00 14.21 C ATOM 1119 CG1 ILE A 119 13.197 18.103 46.346 1.00 14.81 C ATOM 1120 CG2 ILE A 119 11.127 19.507 46.480 1.00 12.63 C ATOM 1121 CD1 ILE A 119 13.871 18.633 47.591 1.00 13.86 C ATOM 1122 H ILE A 119 13.967 18.384 43.741 1.00 0.00 H ATOM 1123 N ASN A 120 11.779 20.638 42.948 1.00 14.28 N ATOM 1124 CA ASN A 120 11.125 21.688 42.180 1.00 14.23 C ATOM 1125 C ASN A 120 10.228 21.100 41.105 1.00 16.59 C ATOM 1126 O ASN A 120 9.052 21.465 40.994 1.00 16.14 O ATOM 1127 CB ASN A 120 12.166 22.617 41.547 1.00 15.35 C ATOM 1128 CG ASN A 120 13.066 23.261 42.574 1.00 19.91 C ATOM 1129 OD1 ASN A 120 13.742 22.568 43.331 1.00 20.37 O ATOM 1130 ND2 ASN A 120 13.089 24.593 42.602 1.00 19.69 N ATOM 1131 HD22 ASN A 120 12.499 25.137 41.941 1.00 0.00 H ATOM 1132 HD21 ASN A 120 13.697 25.088 43.285 1.00 0.00 H ATOM 1133 H ASN A 120 12.816 20.634 43.029 1.00 0.00 H ATOM 1134 N TRP A 121 10.781 20.173 40.323 1.00 14.14 N ATOM 1135 CA TRP A 121 10.056 19.620 39.180 1.00 16.09 C ATOM 1136 C TRP A 121 8.956 18.665 39.600 1.00 18.52 C ATOM 1137 O TRP A 121 7.987 18.466 38.862 1.00 17.62 O ATOM 1138 CB TRP A 121 11.025 18.924 38.225 1.00 16.09 C ATOM 1139 CG TRP A 121 11.841 19.909 37.485 1.00 16.23 C ATOM 1140 CD1 TRP A 121 13.139 20.254 37.729 1.00 16.68 C ATOM 1141 CD2 TRP A 121 11.403 20.726 36.393 1.00 20.93 C ATOM 1142 NE1 TRP A 121 13.543 21.222 36.839 1.00 18.23 N ATOM 1143 CE2 TRP A 121 12.496 21.531 36.011 1.00 19.55 C ATOM 1144 CE3 TRP A 121 10.196 20.849 35.700 1.00 22.38 C ATOM 1145 CZ2 TRP A 121 12.413 22.447 34.966 1.00 23.29 C ATOM 1146 CZ3 TRP A 121 10.117 21.758 34.660 1.00 27.46 C ATOM 1147 CH2 TRP A 121 11.218 22.544 34.302 1.00 27.82 C ATOM 1148 HE1 TRP A 121 14.490 21.650 36.801 1.00 0.00 H ATOM 1149 H TRP A 121 11.744 19.838 40.529 1.00 0.00 H ATOM 1150 N THR A 122 9.104 18.062 40.774 1.00 17.91 N ATOM 1151 CA THR A 122 8.017 17.282 41.350 1.00 17.42 C ATOM 1152 C THR A 122 6.779 18.171 41.442 1.00 18.16 C ATOM 1153 O THR A 122 5.686 17.767 41.046 1.00 13.53 O ATOM 1154 CB THR A 122 8.380 16.732 42.746 1.00 18.74 C ATOM 1155 OG1 THR A 122 9.429 15.762 42.620 1.00 17.36 O ATOM 1156 CG2 THR A 122 7.163 16.078 43.410 1.00 17.46 C ATOM 1157 HG1 THR A 122 10.225 16.189 42.216 1.00 0.00 H ATOM 1158 H THR A 122 10.005 18.148 41.287 1.00 0.00 H ATOM 1159 N LEU A 123 6.966 19.398 41.926 1.00 18.44 N ATOM 1160 CA LEU A 123 5.855 20.329 42.131 1.00 19.07 C ATOM 1161 C LEU A 123 5.447 21.085 40.865 1.00 15.30 C ATOM 1162 O LEU A 123 4.263 21.344 40.655 1.00 17.00 O ATOM 1163 CB LEU A 123 6.214 21.328 43.231 1.00 17.08 C ATOM 1164 CG LEU A 123 6.560 20.674 44.566 1.00 19.59 C ATOM 1165 CD1 LEU A 123 6.855 21.715 45.625 1.00 18.85 C ATOM 1166 CD2 LEU A 123 5.423 19.776 45.013 1.00 16.41 C ATOM 1167 H LEU A 123 7.931 19.704 42.166 1.00 0.00 H ATOM 1168 N ILE A 124 6.418 21.446 40.032 1.00 15.94 N ATOM 1169 CA ILE A 124 6.128 22.143 38.776 1.00 18.98 C ATOM 1170 C ILE A 124 5.194 21.318 37.891 1.00 21.92 C ATOM 1171 O ILE A 124 4.280 21.856 37.252 1.00 21.07 O ATOM 1172 CB ILE A 124 7.428 22.454 38.002 1.00 19.84 C ATOM 1173 CG1 ILE A 124 8.202 23.585 38.686 1.00 20.66 C ATOM 1174 CG2 ILE A 124 7.129 22.830 36.552 1.00 19.96 C ATOM 1175 CD1 ILE A 124 9.696 23.569 38.401 1.00 21.42 C ATOM 1176 H ILE A 124 7.405 21.229 40.277 1.00 0.00 H ATOM 1177 N HIS A 125 5.420 20.008 37.872 1.00 19.41 N ATOM 1178 CA HIS A 125 4.653 19.113 37.017 1.00 25.26 C ATOM 1179 C HIS A 125 3.309 18.752 37.648 1.00 27.25 C ATOM 1180 O HIS A 125 2.453 18.150 37.002 1.00 30.80 O ATOM 1181 CB HIS A 125 5.462 17.848 36.722 1.00 23.95 C ATOM 1182 CG HIS A 125 6.503 18.026 35.661 1.00 26.94 C ATOM 1183 ND1 HIS A 125 7.488 17.092 35.424 1.00 29.17 N ATOM 1184 CD2 HIS A 125 6.707 19.023 34.766 1.00 28.06 C ATOM 1185 CE1 HIS A 125 8.255 17.505 34.431 1.00 30.19 C ATOM 1186 NE2 HIS A 125 7.802 18.672 34.012 1.00 28.31 N ATOM 1187 H HIS A 125 6.163 19.613 38.483 1.00 0.00 H ATOM 1188 N GLY A 126 3.127 19.119 38.911 1.00 27.13 N ATOM 1189 CA GLY A 126 1.882 18.833 39.598 1.00 26.51 C ATOM 1190 C GLY A 126 1.730 17.379 40.013 1.00 24.30 C ATOM 1191 O GLY A 126 0.604 16.885 40.125 1.00 23.55 O ATOM 1192 H GLY A 126 3.888 19.618 39.415 1.00 0.00 H ATOM 1193 N ASP A 127 2.854 16.699 40.239 1.00 20.84 N ATOM 1194 CA ASP A 127 2.853 15.313 40.720 1.00 20.58 C ATOM 1195 C ASP A 127 2.022 15.143 41.990 1.00 23.77 C ATOM 1196 O ASP A 127 2.086 15.981 42.900 1.00 23.87 O ATOM 1197 CB ASP A 127 4.288 14.844 40.987 1.00 19.42 C ATOM 1198 CG ASP A 127 5.085 14.642 39.713 1.00 20.66 C ATOM 1199 OD1 ASP A 127 4.579 15.017 38.633 1.00 20.64 O ATOM 1200 OD2 ASP A 127 6.221 14.114 39.794 1.00 17.89 O ATOM 1201 H ASP A 127 3.766 17.169 40.068 1.00 0.00 H ATOM 1202 N LYS A 128 1.244 14.064 42.056 1.00 22.41 N ATOM 1203 CA LYS A 128 0.450 13.784 43.249 1.00 22.71 C ATOM 1204 C LYS A 128 1.259 13.004 44.285 1.00 22.22 C ATOM 1205 O LYS A 128 1.038 13.142 45.490 1.00 23.03 O ATOM 1206 CB LYS A 128 -0.819 13.016 42.879 1.00 28.57 C ATOM 1207 CG LYS A 128 -1.714 13.755 41.894 1.00 35.74 C ATOM 1208 CD LYS A 128 -2.114 15.127 42.421 1.00 38.95 C ATOM 1209 CE LYS A 128 -2.988 15.875 41.414 1.00 42.26 C ATOM 1210 NZ LYS A 128 -3.624 17.081 42.017 1.00 43.64 N ATOM 1211 HZ1 LYS A 128 -4.222 16.792 42.817 1.00 0.00 H ATOM 1212 HZ2 LYS A 128 -2.884 17.730 42.352 1.00 0.00 H ATOM 1213 HZ3 LYS A 128 -4.207 17.559 41.301 1.00 0.00 H ATOM 1214 H LYS A 128 1.201 13.412 41.247 1.00 0.00 H ATOM 1215 N LYS A 129 2.198 12.190 43.812 1.00 23.05 N ATOM 1216 CA LYS A 129 3.100 11.464 44.701 1.00 24.37 C ATOM 1217 C LYS A 129 4.520 12.000 44.558 1.00 22.79 C ATOM 1218 O LYS A 129 4.965 12.320 43.449 1.00 25.74 O ATOM 1219 CB LYS A 129 3.078 9.959 44.399 1.00 27.36 C ATOM 1220 CG LYS A 129 1.778 9.231 44.757 1.00 32.74 C ATOM 1221 CD LYS A 129 1.576 9.141 46.268 1.00 37.02 C ATOM 1222 CE LYS A 129 0.495 8.127 46.631 1.00 42.23 C ATOM 1223 NZ LYS A 129 0.090 8.221 48.064 1.00 43.36 N ATOM 1224 HZ1 LYS A 129 0.917 8.042 48.669 1.00 0.00 H ATOM 1225 HZ2 LYS A 129 -0.282 9.173 48.256 1.00 0.00 H ATOM 1226 HZ3 LYS A 129 -0.646 7.513 48.262 1.00 0.00 H ATOM 1227 H LYS A 129 2.292 12.068 42.784 1.00 0.00 H ATOM 1228 N GLY A 130 5.221 12.113 45.681 1.00 16.77 N ATOM 1229 CA GLY A 130 6.636 12.439 45.662 1.00 17.45 C ATOM 1230 C GLY A 130 7.364 11.455 46.558 1.00 17.69 C ATOM 1231 O GLY A 130 6.782 10.452 46.978 1.00 18.21 O ATOM 1232 H GLY A 130 4.746 11.965 46.594 1.00 0.00 H ATOM 1233 N GLY A 131 8.626 11.730 46.863 1.00 17.43 N ATOM 1234 CA GLY A 131 9.379 10.849 47.735 1.00 19.90 C ATOM 1235 C GLY A 131 10.869 10.955 47.502 1.00 18.79 C ATOM 1236 O GLY A 131 11.332 11.870 46.808 1.00 16.55 O ATOM 1237 H GLY A 131 9.078 12.582 46.474 1.00 0.00 H ATOM 1238 N PHE A 132 11.635 10.034 48.084 1.00 15.94 N ATOM 1239 CA PHE A 132 13.072 10.029 47.838 1.00 15.40 C ATOM 1240 C PHE A 132 13.570 8.640 47.482 1.00 15.28 C ATOM 1241 O PHE A 132 12.887 7.639 47.713 1.00 18.00 O ATOM 1242 CB PHE A 132 13.834 10.561 49.050 1.00 15.13 C ATOM 1243 CG PHE A 132 13.786 9.655 50.241 1.00 14.53 C ATOM 1244 CD1 PHE A 132 14.730 8.649 50.407 1.00 15.16 C ATOM 1245 CD2 PHE A 132 12.805 9.819 51.211 1.00 17.38 C ATOM 1246 CE1 PHE A 132 14.685 7.814 51.510 1.00 17.36 C ATOM 1247 CE2 PHE A 132 12.758 8.988 52.317 1.00 15.73 C ATOM 1248 CZ PHE A 132 13.700 7.988 52.464 1.00 16.60 C ATOM 1249 H PHE A 132 11.210 9.322 48.711 1.00 0.00 H ATOM 1250 N THR A 133 14.779 8.582 46.939 1.00 11.88 N ATOM 1251 CA THR A 133 15.385 7.315 46.556 1.00 14.97 C ATOM 1252 C THR A 133 16.800 7.248 47.110 1.00 15.60 C ATOM 1253 O THR A 133 17.513 8.257 47.111 1.00 15.41 O ATOM 1254 CB THR A 133 15.433 7.149 45.017 1.00 14.31 C ATOM 1255 OG1 THR A 133 14.115 7.299 44.471 1.00 13.30 O ATOM 1256 CG2 THR A 133 15.990 5.778 44.634 1.00 14.46 C ATOM 1257 HG1 THR A 133 13.767 8.199 44.693 1.00 0.00 H ATOM 1258 H THR A 133 15.307 9.464 46.783 1.00 0.00 H ATOM 1259 N VAL A 134 17.205 6.082 47.601 1.00 13.37 N ATOM 1260 CA VAL A 134 18.627 5.828 47.831 1.00 13.11 C ATOM 1261 C VAL A 134 19.085 4.888 46.732 1.00 12.69 C ATOM 1262 O VAL A 134 18.524 3.801 46.581 1.00 18.20 O ATOM 1263 CB VAL A 134 18.907 5.199 49.208 1.00 14.29 C ATOM 1264 CG1 VAL A 134 20.398 4.870 49.345 1.00 11.81 C ATOM 1265 CG2 VAL A 134 18.449 6.126 50.326 1.00 12.99 C ATOM 1266 H VAL A 134 16.506 5.345 47.823 1.00 0.00 H ATOM 1267 N PHE A 135 20.079 5.296 45.948 1.00 14.63 N ATOM 1268 CA PHE A 135 20.527 4.451 44.842 1.00 15.54 C ATOM 1269 C PHE A 135 22.047 4.319 44.810 1.00 13.76 C ATOM 1270 O PHE A 135 22.761 5.127 45.403 1.00 14.16 O ATOM 1271 CB PHE A 135 20.002 4.999 43.503 1.00 13.26 C ATOM 1272 CG PHE A 135 20.675 6.271 43.048 1.00 14.90 C ATOM 1273 CD1 PHE A 135 20.278 7.505 43.551 1.00 15.79 C ATOM 1274 CD2 PHE A 135 21.681 6.231 42.090 1.00 16.08 C ATOM 1275 CE1 PHE A 135 20.892 8.683 43.118 1.00 16.29 C ATOM 1276 CE2 PHE A 135 22.300 7.387 41.654 1.00 15.94 C ATOM 1277 CZ PHE A 135 21.905 8.621 42.166 1.00 16.18 C ATOM 1278 H PHE A 135 20.536 6.214 46.121 1.00 0.00 H ATOM 1279 N TRP A 136 22.538 3.281 44.134 1.00 18.27 N ATOM 1280 CA TRP A 136 23.975 3.072 43.970 1.00 19.96 C ATOM 1281 C TRP A 136 24.531 3.936 42.838 1.00 20.32 C ATOM 1282 O TRP A 136 24.061 3.844 41.701 1.00 20.96 O ATOM 1283 CB TRP A 136 24.277 1.598 43.671 1.00 20.06 C ATOM 1284 CG TRP A 136 23.781 0.624 44.696 1.00 19.25 C ATOM 1285 CD1 TRP A 136 22.572 -0.024 44.705 1.00 20.63 C ATOM 1286 CD2 TRP A 136 24.496 0.155 45.845 1.00 18.87 C ATOM 1287 NE1 TRP A 136 22.492 -0.857 45.803 1.00 19.87 N ATOM 1288 CE2 TRP A 136 23.660 -0.766 46.515 1.00 18.51 C ATOM 1289 CE3 TRP A 136 25.761 0.428 46.375 1.00 20.21 C ATOM 1290 CZ2 TRP A 136 24.051 -1.411 47.691 1.00 21.93 C ATOM 1291 CZ3 TRP A 136 26.146 -0.215 47.548 1.00 19.74 C ATOM 1292 CH2 TRP A 136 25.297 -1.121 48.188 1.00 21.21 C ATOM 1293 HE1 TRP A 136 21.678 -1.456 46.050 1.00 0.00 H ATOM 1294 H TRP A 136 21.878 2.598 43.710 1.00 0.00 H ATOM 1295 N ALA A 137 25.540 4.752 43.130 1.00 22.26 N ATOM 1296 CA ALA A 137 26.177 5.579 42.099 1.00 23.77 C ATOM 1297 C ALA A 137 26.776 4.744 40.975 1.00 22.86 C ATOM 1298 O ALA A 137 27.520 3.796 41.238 1.00 23.09 O ATOM 1299 CB ALA A 137 27.265 6.454 42.720 1.00 25.01 C ATOM 1300 H ALA A 137 25.885 4.805 44.110 1.00 0.00 H ATOM 1301 N ASP A 138 26.460 5.093 39.726 1.00 20.81 N ATOM 1302 CA ASP A 138 27.207 4.552 38.592 1.00 20.63 C ATOM 1303 C ASP A 138 27.723 5.697 37.707 1.00 20.36 C ATOM 1304 O ASP A 138 27.686 6.860 38.116 1.00 19.88 O ATOM 1305 CB ASP A 138 26.361 3.536 37.792 1.00 24.98 C ATOM 1306 CG ASP A 138 25.170 4.164 37.053 1.00 30.43 C ATOM 1307 OD1 ASP A 138 25.046 5.411 36.973 1.00 28.53 O ATOM 1308 OD2 ASP A 138 24.353 3.374 36.520 1.00 31.15 O ATOM 1309 H ASP A 138 25.676 5.755 39.558 1.00 0.00 H ATOM 1310 N ASP A 139 28.199 5.374 36.506 1.00 20.45 N ATOM 1311 CA ASP A 139 28.901 6.352 35.670 1.00 27.39 C ATOM 1312 C ASP A 139 27.994 7.408 35.020 1.00 27.87 C ATOM 1313 O ASP A 139 28.487 8.399 34.465 1.00 26.44 O ATOM 1314 CB ASP A 139 29.693 5.626 34.584 1.00 30.22 C ATOM 1315 CG ASP A 139 28.796 4.902 33.596 1.00 34.95 C ATOM 1316 OD1 ASP A 139 28.131 3.925 33.999 1.00 36.79 O ATOM 1317 OD2 ASP A 139 28.767 5.302 32.415 1.00 38.71 O ATOM 1318 H ASP A 139 28.070 4.404 36.153 1.00 0.00 H ATOM 1319 N GLY A 140 26.681 7.201 35.084 1.00 26.13 N ATOM 1320 CA GLY A 140 25.735 8.176 34.562 1.00 24.70 C ATOM 1321 C GLY A 140 25.279 9.127 35.653 1.00 25.29 C ATOM 1322 O GLY A 140 25.828 9.117 36.764 1.00 25.41 O ATOM 1323 H GLY A 140 26.324 6.325 35.516 1.00 0.00 H ATOM 1324 N LEU A 141 24.275 9.949 35.351 1.00 22.95 N ATOM 1325 CA LEU A 141 23.821 10.966 36.298 1.00 21.66 C ATOM 1326 C LEU A 141 22.435 10.634 36.848 1.00 20.71 C ATOM 1327 O LEU A 141 21.431 10.791 36.148 1.00 20.04 O ATOM 1328 CB LEU A 141 23.818 12.344 35.626 1.00 22.71 C ATOM 1329 CG LEU A 141 23.881 13.573 36.536 1.00 26.62 C ATOM 1330 CD1 LEU A 141 25.107 13.514 37.430 1.00 26.94 C ATOM 1331 CD2 LEU A 141 23.901 14.854 35.712 1.00 26.62 C ATOM 1332 H LEU A 141 23.806 9.866 34.426 1.00 0.00 H ATOM 1333 N ASP A 142 22.394 10.185 38.102 1.00 16.69 N ATOM 1334 CA ASP A 142 21.169 9.717 38.761 1.00 16.99 C ATOM 1335 C ASP A 142 20.550 8.502 38.066 1.00 16.80 C ATOM 1336 O ASP A 142 19.325 8.330 38.064 1.00 20.50 O ATOM 1337 CB ASP A 142 20.136 10.851 38.856 1.00 19.38 C ATOM 1338 CG ASP A 142 20.615 12.004 39.717 1.00 24.33 C ATOM 1339 OD1 ASP A 142 21.582 11.807 40.484 1.00 24.91 O ATOM 1340 OD2 ASP A 142 20.018 13.104 39.629 1.00 18.29 O ATOM 1341 H ASP A 142 23.281 10.165 38.645 1.00 0.00 H ATOM 1342 N THR A 143 21.399 7.647 37.504 1.00 16.82 N ATOM 1343 CA THR A 143 20.929 6.510 36.711 1.00 18.17 C ATOM 1344 C THR A 143 21.157 5.161 37.395 1.00 20.03 C ATOM 1345 O THR A 143 20.703 4.119 36.901 1.00 19.99 O ATOM 1346 CB THR A 143 21.620 6.475 35.333 1.00 20.97 C ATOM 1347 OG1 THR A 143 23.031 6.658 35.510 1.00 25.86 O ATOM 1348 CG2 THR A 143 21.096 7.581 34.440 1.00 18.67 C ATOM 1349 HG1 THR A 143 23.388 5.932 36.080 1.00 0.00 H ATOM 1350 H THR A 143 22.421 7.789 37.631 1.00 0.00 H ATOM 1351 N GLY A 144 21.860 5.175 38.526 1.00 19.58 N ATOM 1352 CA GLY A 144 22.285 3.941 39.172 1.00 18.52 C ATOM 1353 C GLY A 144 21.168 3.127 39.795 1.00 19.63 C ATOM 1354 O GLY A 144 20.078 3.645 40.030 1.00 21.12 O ATOM 1355 H GLY A 144 22.111 6.087 38.957 1.00 0.00 H ATOM 1356 N PRO A 145 21.435 1.841 40.079 1.00 21.47 N ATOM 1357 CA PRO A 145 20.363 0.974 40.587 1.00 20.42 C ATOM 1358 C PRO A 145 19.835 1.393 41.969 1.00 17.90 C ATOM 1359 O PRO A 145 20.585 1.891 42.813 1.00 12.35 O ATOM 1360 CB PRO A 145 21.024 -0.408 40.643 1.00 23.38 C ATOM 1361 CG PRO A 145 22.498 -0.143 40.655 1.00 27.68 C ATOM 1362 CD PRO A 145 22.700 1.114 39.872 1.00 23.88 C ATOM 1363 N ILE A 146 18.539 1.185 42.183 1.00 16.79 N ATOM 1364 CA ILE A 146 17.865 1.585 43.416 1.00 17.43 C ATOM 1365 C ILE A 146 18.176 0.638 44.587 1.00 15.12 C ATOM 1366 O ILE A 146 18.167 -0.586 44.416 1.00 15.89 O ATOM 1367 CB ILE A 146 16.337 1.640 43.188 1.00 15.25 C ATOM 1368 CG1 ILE A 146 16.000 2.734 42.168 1.00 15.62 C ATOM 1369 CG2 ILE A 146 15.588 1.872 44.500 1.00 11.61 C ATOM 1370 CD1 ILE A 146 14.576 2.656 41.632 1.00 15.71 C ATOM 1371 H ILE A 146 17.981 0.717 41.440 1.00 0.00 H ATOM 1372 N LEU A 147 18.475 1.201 45.760 1.00 13.74 N ATOM 1373 CA LEU A 147 18.618 0.405 46.986 1.00 13.70 C ATOM 1374 C LEU A 147 17.274 0.394 47.728 1.00 13.91 C ATOM 1375 O LEU A 147 16.725 -0.671 48.025 1.00 12.15 O ATOM 1376 CB LEU A 147 19.750 0.962 47.864 1.00 13.88 C ATOM 1377 CG LEU A 147 20.304 0.137 49.035 1.00 17.69 C ATOM 1378 CD1 LEU A 147 21.684 0.651 49.456 1.00 19.74 C ATOM 1379 CD2 LEU A 147 19.361 0.131 50.243 1.00 13.55 C ATOM 1380 H LEU A 147 18.610 2.231 45.807 1.00 0.00 H ATOM 1381 N LEU A 148 16.735 1.580 48.017 1.00 12.24 N ATOM 1382 CA LEU A 148 15.387 1.668 48.580 1.00 12.16 C ATOM 1383 C LEU A 148 14.700 2.946 48.115 1.00 13.50 C ATOM 1384 O LEU A 148 15.355 3.884 47.657 1.00 17.13 O ATOM 1385 CB LEU A 148 15.418 1.589 50.120 1.00 10.02 C ATOM 1386 CG LEU A 148 16.241 2.606 50.926 1.00 18.27 C ATOM 1387 CD1 LEU A 148 15.492 3.914 51.128 1.00 18.05 C ATOM 1388 CD2 LEU A 148 16.655 2.020 52.283 1.00 14.96 C ATOM 1389 H LEU A 148 17.278 2.449 47.841 1.00 0.00 H ATOM 1390 N GLN A 149 13.378 2.975 48.242 1.00 15.83 N ATOM 1391 CA GLN A 149 12.586 4.129 47.835 1.00 14.34 C ATOM 1392 C GLN A 149 11.437 4.326 48.828 1.00 16.14 C ATOM 1393 O GLN A 149 10.887 3.355 49.350 1.00 16.31 O ATOM 1394 CB GLN A 149 12.069 3.930 46.401 1.00 12.90 C ATOM 1395 CG GLN A 149 11.447 5.165 45.757 1.00 12.72 C ATOM 1396 CD GLN A 149 11.255 4.993 44.261 1.00 16.21 C ATOM 1397 OE1 GLN A 149 10.252 4.437 43.814 1.00 18.22 O ATOM 1398 NE2 GLN A 149 12.225 5.459 43.480 1.00 16.04 N ATOM 1399 HE22 GLN A 149 13.055 5.922 43.902 1.00 0.00 H ATOM 1400 HE21 GLN A 149 12.154 5.360 42.447 1.00 0.00 H ATOM 1401 H GLN A 149 12.893 2.148 48.645 1.00 0.00 H ATOM 1402 N ARG A 150 11.092 5.581 49.104 1.00 15.80 N ATOM 1403 CA ARG A 150 10.006 5.889 50.038 1.00 19.63 C ATOM 1404 C ARG A 150 9.106 6.976 49.448 1.00 20.32 C ATOM 1405 O ARG A 150 9.598 7.978 48.921 1.00 21.59 O ATOM 1406 CB ARG A 150 10.573 6.332 51.401 1.00 16.75 C ATOM 1407 CG ARG A 150 11.485 5.307 52.090 1.00 14.77 C ATOM 1408 CD ARG A 150 10.668 4.181 52.727 1.00 15.75 C ATOM 1409 NE ARG A 150 11.507 3.198 53.415 1.00 17.34 N ATOM 1410 CZ ARG A 150 11.992 2.092 52.854 1.00 19.84 C ATOM 1411 NH1 ARG A 150 11.743 1.812 51.577 1.00 17.67 N ATOM 1412 NH2 ARG A 150 12.742 1.263 53.569 1.00 21.57 N ATOM 1413 HE ARG A 150 11.741 3.376 54.413 1.00 0.00 H ATOM 1414 HH12 ARG A 150 12.127 0.945 51.150 1.00 0.00 H ATOM 1415 HH11 ARG A 150 11.164 2.460 51.006 1.00 0.00 H ATOM 1416 HH22 ARG A 150 13.122 0.399 53.133 1.00 0.00 H ATOM 1417 HH21 ARG A 150 12.950 1.478 54.565 1.00 0.00 H ATOM 1418 H ARG A 150 11.605 6.361 48.646 1.00 0.00 H ATOM 1419 N GLU A 151 7.793 6.778 49.530 1.00 19.92 N ATOM 1420 CA GLU A 151 6.845 7.729 48.952 1.00 21.40 C ATOM 1421 C GLU A 151 6.189 8.641 49.982 1.00 22.25 C ATOM 1422 O GLU A 151 6.133 8.322 51.173 1.00 20.89 O ATOM 1423 CB GLU A 151 5.744 6.994 48.189 1.00 20.95 C ATOM 1424 CG GLU A 151 6.215 6.247 46.964 1.00 23.17 C ATOM 1425 CD GLU A 151 5.070 5.907 46.026 1.00 30.23 C ATOM 1426 OE1 GLU A 151 5.345 5.403 44.917 1.00 32.91 O ATOM 1427 OE2 GLU A 151 3.895 6.148 46.393 1.00 32.71 O ATOM 1428 H GLU A 151 7.434 5.931 50.014 1.00 0.00 H ATOM 1429 N CYS A 152 5.679 9.774 49.504 1.00 18.78 N ATOM 1430 CA CYS A 152 4.803 10.622 50.306 1.00 18.88 C ATOM 1431 C CYS A 152 3.789 11.295 49.402 1.00 21.50 C ATOM 1432 O CYS A 152 3.983 11.379 48.186 1.00 22.62 O ATOM 1433 CB CYS A 152 5.599 11.679 51.078 1.00 16.75 C ATOM 1434 SG CYS A 152 6.317 12.967 50.028 1.00 25.35 S ATOM 1435 H CYS A 152 5.911 10.063 48.532 1.00 0.00 H ATOM 1436 N ASP A 153 2.702 11.769 49.993 1.00 23.96 N ATOM 1437 CA ASP A 153 1.725 12.530 49.233 1.00 29.14 C ATOM 1438 C ASP A 153 2.231 13.948 49.010 1.00 27.61 C ATOM 1439 O ASP A 153 2.892 14.523 49.881 1.00 29.03 O ATOM 1440 CB ASP A 153 0.376 12.545 49.954 1.00 32.81 C ATOM 1441 CG ASP A 153 -0.303 11.190 49.940 1.00 38.61 C ATOM 1442 OD1 ASP A 153 -0.335 10.555 48.865 1.00 39.99 O ATOM 1443 OD2 ASP A 153 -0.799 10.757 51.000 1.00 43.64 O ATOM 1444 H ASP A 153 2.547 11.595 51.007 1.00 0.00 H ATOM 1445 N VAL A 154 1.947 14.498 47.832 1.00 25.14 N ATOM 1446 CA VAL A 154 2.193 15.911 47.573 1.00 23.04 C ATOM 1447 C VAL A 154 0.919 16.695 47.875 1.00 22.31 C ATOM 1448 O VAL A 154 -0.122 16.435 47.273 1.00 25.53 O ATOM 1449 CB VAL A 154 2.608 16.180 46.115 1.00 21.75 C ATOM 1450 CG1 VAL A 154 2.805 17.668 45.908 1.00 22.59 C ATOM 1451 CG2 VAL A 154 3.876 15.425 45.753 1.00 20.70 C ATOM 1452 H VAL A 154 1.540 13.906 47.079 1.00 0.00 H ATOM 1453 N GLU A 155 0.991 17.644 48.802 1.00 22.81 N ATOM 1454 CA GLU A 155 -0.170 18.467 49.116 1.00 24.99 C ATOM 1455 C GLU A 155 -0.356 19.523 48.026 1.00 22.88 C ATOM 1456 O GLU A 155 0.620 19.979 47.427 1.00 22.60 O ATOM 1457 CB GLU A 155 -0.017 19.100 50.504 1.00 28.45 C ATOM 1458 CG GLU A 155 -0.116 18.073 51.631 1.00 37.58 C ATOM 1459 CD GLU A 155 0.386 18.590 52.966 1.00 47.14 C ATOM 1460 OE1 GLU A 155 0.493 19.823 53.138 1.00 50.56 O ATOM 1461 OE2 GLU A 155 0.673 17.754 53.848 1.00 52.67 O ATOM 1462 H GLU A 155 1.885 17.801 49.309 1.00 0.00 H ATOM 1463 N PRO A 156 -1.616 19.893 47.742 1.00 26.53 N ATOM 1464 CA PRO A 156 -1.918 20.842 46.659 1.00 25.70 C ATOM 1465 C PRO A 156 -1.208 22.192 46.783 1.00 23.61 C ATOM 1466 O PRO A 156 -0.924 22.806 45.754 1.00 25.18 O ATOM 1467 CB PRO A 156 -3.442 21.021 46.758 1.00 27.80 C ATOM 1468 CG PRO A 156 -3.853 20.377 48.047 1.00 29.38 C ATOM 1469 CD PRO A 156 -2.841 19.311 48.310 1.00 27.59 C ATOM 1470 N ASN A 157 -0.932 22.644 48.006 1.00 22.40 N ATOM 1471 CA ASN A 157 -0.246 23.922 48.211 1.00 20.14 C ATOM 1472 C ASN A 157 1.160 23.766 48.800 1.00 20.62 C ATOM 1473 O ASN A 157 1.750 24.735 49.287 1.00 23.36 O ATOM 1474 CB ASN A 157 -1.087 24.835 49.109 1.00 23.66 C ATOM 1475 CG ASN A 157 -2.401 25.235 48.468 1.00 26.23 C ATOM 1476 OD1 ASN A 157 -2.478 25.463 47.260 1.00 26.09 O ATOM 1477 ND2 ASN A 157 -3.445 25.329 49.281 1.00 28.57 N ATOM 1478 HD22 ASN A 157 -3.334 25.127 50.295 1.00 0.00 H ATOM 1479 HD21 ASN A 157 -4.374 25.605 48.904 1.00 0.00 H ATOM 1480 H ASN A 157 -1.210 22.077 48.833 1.00 0.00 H ATOM 1481 N ASP A 158 1.682 22.541 48.767 1.00 19.95 N ATOM 1482 CA ASP A 158 3.094 22.292 49.057 1.00 18.20 C ATOM 1483 C ASP A 158 3.986 23.194 48.214 1.00 17.48 C ATOM 1484 O ASP A 158 3.774 23.303 47.000 1.00 18.42 O ATOM 1485 CB ASP A 158 3.461 20.833 48.758 1.00 18.48 C ATOM 1486 CG ASP A 158 3.567 19.974 50.007 1.00 22.24 C ATOM 1487 OD1 ASP A 158 3.817 20.526 51.106 1.00 21.32 O ATOM 1488 OD2 ASP A 158 3.418 18.735 49.870 1.00 20.91 O ATOM 1489 H ASP A 158 1.067 21.737 48.528 1.00 0.00 H ATOM 1490 N ASN A 159 4.972 23.838 48.836 1.00 16.95 N ATOM 1491 CA ASN A 159 6.074 24.407 48.065 1.00 18.29 C ATOM 1492 C ASN A 159 7.312 23.554 48.328 1.00 21.00 C ATOM 1493 O ASN A 159 7.231 22.554 49.061 1.00 20.85 O ATOM 1494 CB ASN A 159 6.319 25.888 48.399 1.00 18.37 C ATOM 1495 CG ASN A 159 6.658 26.132 49.865 1.00 22.30 C ATOM 1496 OD1 ASN A 159 6.878 25.201 50.641 1.00 23.56 O ATOM 1497 ND2 ASN A 159 6.710 27.406 50.246 1.00 23.61 N ATOM 1498 HD22 ASN A 159 6.517 28.163 49.559 1.00 0.00 H ATOM 1499 HD21 ASN A 159 6.943 27.645 51.231 1.00 0.00 H ATOM 1500 H ASN A 159 4.957 23.936 49.871 1.00 0.00 H ATOM 1501 N VAL A 160 8.440 23.919 47.720 1.00 18.10 N ATOM 1502 CA VAL A 160 9.669 23.142 47.875 1.00 20.64 C ATOM 1503 C VAL A 160 10.010 22.991 49.350 1.00 20.19 C ATOM 1504 O VAL A 160 10.346 21.900 49.816 1.00 20.27 O ATOM 1505 CB VAL A 160 10.856 23.790 47.128 1.00 21.99 C ATOM 1506 CG1 VAL A 160 12.142 23.019 47.393 1.00 20.84 C ATOM 1507 CG2 VAL A 160 10.571 23.847 45.630 1.00 22.48 C ATOM 1508 H VAL A 160 8.446 24.772 47.125 1.00 0.00 H ATOM 1509 N ASN A 161 9.877 24.082 50.092 1.00 18.30 N ATOM 1510 CA ASN A 161 10.236 24.093 51.503 1.00 21.03 C ATOM 1511 C ASN A 161 9.363 23.202 52.389 1.00 18.08 C ATOM 1512 O ASN A 161 9.868 22.535 53.292 1.00 16.19 O ATOM 1513 CB ASN A 161 10.202 25.530 52.028 1.00 28.65 C ATOM 1514 CG ASN A 161 11.430 26.324 51.628 1.00 36.64 C ATOM 1515 OD1 ASN A 161 11.863 26.294 50.471 1.00 36.70 O ATOM 1516 ND2 ASN A 161 12.011 27.030 52.592 1.00 42.22 N ATOM 1517 HD22 ASN A 161 11.612 27.026 53.552 1.00 0.00 H ATOM 1518 HD21 ASN A 161 12.865 27.587 52.386 1.00 0.00 H ATOM 1519 H ASN A 161 9.507 24.951 49.656 1.00 0.00 H ATOM 1520 N SER A 162 8.055 23.195 52.145 1.00 17.85 N ATOM 1521 CA SER A 162 7.150 22.450 53.016 1.00 20.40 C ATOM 1522 C SER A 162 7.297 20.934 52.833 1.00 19.45 C ATOM 1523 O SER A 162 7.315 20.188 53.819 1.00 16.58 O ATOM 1524 CB SER A 162 5.697 22.885 52.784 1.00 21.95 C ATOM 1525 OG SER A 162 5.285 22.671 51.445 1.00 20.18 O ATOM 1526 HG SER A 162 5.358 21.708 51.228 1.00 0.00 H ATOM 1527 H SER A 162 7.676 23.721 51.332 1.00 0.00 H ATOM 1528 N ILE A 163 7.418 20.457 51.597 1.00 18.79 N ATOM 1529 CA ILE A 163 7.513 19.011 51.413 1.00 19.34 C ATOM 1530 C ILE A 163 8.904 18.509 51.820 1.00 16.87 C ATOM 1531 O ILE A 163 9.051 17.369 52.279 1.00 16.11 O ATOM 1532 CB ILE A 163 7.169 18.578 49.957 1.00 22.27 C ATOM 1533 CG1 ILE A 163 6.990 17.055 49.882 1.00 19.66 C ATOM 1534 CG2 ILE A 163 8.210 19.083 48.956 1.00 20.52 C ATOM 1535 CD1 ILE A 163 6.381 16.558 48.582 1.00 21.99 C ATOM 1536 H ILE A 163 7.444 21.100 50.780 1.00 0.00 H ATOM 1537 N TYR A 164 9.915 19.365 51.697 1.00 16.07 N ATOM 1538 CA TYR A 164 11.264 19.016 52.146 1.00 15.91 C ATOM 1539 C TYR A 164 11.315 18.877 53.664 1.00 20.28 C ATOM 1540 O TYR A 164 11.807 17.880 54.193 1.00 17.51 O ATOM 1541 CB TYR A 164 12.271 20.068 51.677 1.00 18.57 C ATOM 1542 CG TYR A 164 13.728 19.731 51.935 1.00 22.50 C ATOM 1543 CD1 TYR A 164 14.335 18.651 51.305 1.00 23.81 C ATOM 1544 CD2 TYR A 164 14.503 20.512 52.786 1.00 23.24 C ATOM 1545 CE1 TYR A 164 15.669 18.346 51.525 1.00 25.34 C ATOM 1546 CE2 TYR A 164 15.837 20.215 53.011 1.00 26.72 C ATOM 1547 CZ TYR A 164 16.410 19.132 52.377 1.00 27.62 C ATOM 1548 OH TYR A 164 17.737 18.834 52.594 1.00 31.36 O ATOM 1549 HH TYR A 164 18.296 19.601 52.314 1.00 0.00 H ATOM 1550 H TYR A 164 9.744 20.300 51.274 1.00 0.00 H ATOM 1551 N LYS A 165 10.803 19.884 54.363 1.00 22.51 N ATOM 1552 CA LYS A 165 10.817 19.875 55.821 1.00 25.30 C ATOM 1553 C LYS A 165 9.920 18.775 56.400 1.00 22.66 C ATOM 1554 O LYS A 165 10.305 18.090 57.350 1.00 21.73 O ATOM 1555 CB LYS A 165 10.390 21.241 56.368 1.00 30.08 C ATOM 1556 CG LYS A 165 10.370 21.293 57.886 1.00 36.77 C ATOM 1557 CD LYS A 165 9.715 22.557 58.414 1.00 41.37 C ATOM 1558 CE LYS A 165 9.659 22.527 59.934 1.00 45.97 C ATOM 1559 NZ LYS A 165 8.857 23.652 60.493 1.00 50.44 N ATOM 1560 HZ1 LYS A 165 9.282 24.556 60.204 1.00 0.00 H ATOM 1561 HZ2 LYS A 165 7.883 23.594 60.133 1.00 0.00 H ATOM 1562 HZ3 LYS A 165 8.849 23.588 61.531 1.00 0.00 H ATOM 1563 H LYS A 165 10.385 20.693 53.861 1.00 0.00 H ATOM 1564 N ARG A 166 8.730 18.607 55.832 1.00 21.66 N ATOM 1565 CA ARG A 166 7.775 17.625 56.350 1.00 23.54 C ATOM 1566 C ARG A 166 8.231 16.178 56.135 1.00 22.99 C ATOM 1567 O ARG A 166 8.129 15.353 57.044 1.00 20.27 O ATOM 1568 CB ARG A 166 6.394 17.819 55.709 1.00 25.59 C ATOM 1569 CG ARG A 166 5.330 16.875 56.272 1.00 29.80 C ATOM 1570 CD ARG A 166 3.962 17.056 55.620 1.00 31.73 C ATOM 1571 NE ARG A 166 3.944 16.616 54.227 1.00 30.17 N ATOM 1572 CZ ARG A 166 3.899 17.445 53.188 1.00 30.27 C ATOM 1573 NH1 ARG A 166 3.859 18.759 53.389 1.00 32.26 N ATOM 1574 NH2 ARG A 166 3.889 16.968 51.946 1.00 25.99 N ATOM 1575 HE ARG A 166 3.968 15.594 54.037 1.00 0.00 H ATOM 1576 HH12 ARG A 166 3.824 19.408 52.577 1.00 0.00 H ATOM 1577 HH11 ARG A 166 3.863 19.137 54.358 1.00 0.00 H ATOM 1578 HH22 ARG A 166 3.854 17.622 51.138 1.00 0.00 H ATOM 1579 HH21 ARG A 166 3.916 15.941 51.783 1.00 0.00 H ATOM 1580 H ARG A 166 8.473 19.183 55.005 1.00 0.00 H ATOM 1581 N PHE A 167 8.734 15.870 54.942 1.00 20.53 N ATOM 1582 CA PHE A 167 9.036 14.482 54.601 1.00 19.10 C ATOM 1583 C PHE A 167 10.461 14.221 54.095 1.00 18.75 C ATOM 1584 O PHE A 167 11.196 13.414 54.676 1.00 16.75 O ATOM 1585 CB PHE A 167 8.039 13.988 53.551 1.00 14.78 C ATOM 1586 CG PHE A 167 8.211 12.544 53.187 1.00 17.95 C ATOM 1587 CD1 PHE A 167 7.606 11.553 53.945 1.00 17.18 C ATOM 1588 CD2 PHE A 167 8.977 12.176 52.086 1.00 16.48 C ATOM 1589 CE1 PHE A 167 7.758 10.214 53.611 1.00 22.00 C ATOM 1590 CE2 PHE A 167 9.140 10.842 51.750 1.00 20.17 C ATOM 1591 CZ PHE A 167 8.530 9.859 52.513 1.00 22.10 C ATOM 1592 H PHE A 167 8.913 16.623 54.247 1.00 0.00 H ATOM 1593 N LEU A 168 10.836 14.879 53.001 1.00 16.77 N ATOM 1594 CA LEU A 168 12.054 14.522 52.270 1.00 18.15 C ATOM 1595 C LEU A 168 13.331 14.619 53.116 1.00 21.31 C ATOM 1596 O LEU A 168 14.235 13.797 52.966 1.00 22.09 O ATOM 1597 CB LEU A 168 12.190 15.395 51.016 1.00 20.45 C ATOM 1598 CG LEU A 168 11.073 15.246 49.979 1.00 19.50 C ATOM 1599 CD1 LEU A 168 11.220 16.246 48.844 1.00 14.30 C ATOM 1600 CD2 LEU A 168 11.040 13.831 49.428 1.00 21.99 C ATOM 1601 H LEU A 168 10.250 15.666 52.657 1.00 0.00 H ATOM 1602 N PHE A 169 13.401 15.612 54.001 1.00 18.19 N ATOM 1603 CA PHE A 169 14.555 15.760 54.887 1.00 19.02 C ATOM 1604 C PHE A 169 14.503 14.701 56.006 1.00 20.68 C ATOM 1605 O PHE A 169 15.379 13.843 56.066 1.00 22.63 O ATOM 1606 CB PHE A 169 14.622 17.202 55.446 1.00 18.14 C ATOM 1607 CG PHE A 169 15.796 17.471 56.369 1.00 23.29 C ATOM 1608 CD1 PHE A 169 15.769 17.064 57.699 1.00 25.00 C ATOM 1609 CD2 PHE A 169 16.905 18.173 55.915 1.00 25.25 C ATOM 1610 CE1 PHE A 169 16.837 17.322 58.549 1.00 26.22 C ATOM 1611 CE2 PHE A 169 17.973 18.438 56.761 1.00 29.52 C ATOM 1612 CZ PHE A 169 17.939 18.009 58.079 1.00 28.14 C ATOM 1613 H PHE A 169 12.620 16.296 54.063 1.00 0.00 H ATOM 1614 N PRO A 170 13.465 14.720 56.871 1.00 22.56 N ATOM 1615 CA PRO A 170 13.567 13.779 57.998 1.00 23.56 C ATOM 1616 C PRO A 170 13.472 12.297 57.615 1.00 22.07 C ATOM 1617 O PRO A 170 14.150 11.483 58.234 1.00 19.18 O ATOM 1618 CB PRO A 170 12.390 14.178 58.896 1.00 24.97 C ATOM 1619 CG PRO A 170 11.398 14.769 57.976 1.00 24.65 C ATOM 1620 CD PRO A 170 12.188 15.461 56.895 1.00 22.97 C ATOM 1621 N GLU A 171 12.653 11.943 56.630 1.00 23.31 N ATOM 1622 CA GLU A 171 12.552 10.540 56.247 1.00 21.02 C ATOM 1623 C GLU A 171 13.735 10.147 55.378 1.00 18.52 C ATOM 1624 O GLU A 171 14.178 8.996 55.408 1.00 18.33 O ATOM 1625 CB GLU A 171 11.233 10.259 55.527 1.00 20.98 C ATOM 1626 CG GLU A 171 10.020 10.394 56.426 1.00 23.45 C ATOM 1627 CD GLU A 171 10.022 9.391 57.573 1.00 29.77 C ATOM 1628 OE1 GLU A 171 9.602 9.770 58.686 1.00 34.84 O ATOM 1629 OE2 GLU A 171 10.428 8.223 57.366 1.00 27.33 O ATOM 1630 H GLU A 171 12.088 12.662 56.136 1.00 0.00 H ATOM 1631 N GLY A 172 14.255 11.112 54.621 1.00 14.31 N ATOM 1632 CA GLY A 172 15.480 10.912 53.868 1.00 13.67 C ATOM 1633 C GLY A 172 16.667 10.554 54.750 1.00 14.84 C ATOM 1634 O GLY A 172 17.462 9.675 54.402 1.00 16.81 O ATOM 1635 H GLY A 172 13.772 12.031 54.568 1.00 0.00 H ATOM 1636 N VAL A 173 16.797 11.228 55.891 1.00 17.85 N ATOM 1637 CA VAL A 173 17.866 10.912 56.837 1.00 19.71 C ATOM 1638 C VAL A 173 17.714 9.475 57.337 1.00 21.30 C ATOM 1639 O VAL A 173 18.690 8.719 57.406 1.00 23.86 O ATOM 1640 CB VAL A 173 17.872 11.882 58.042 1.00 23.35 C ATOM 1641 CG1 VAL A 173 18.756 11.351 59.153 1.00 24.44 C ATOM 1642 CG2 VAL A 173 18.337 13.264 57.620 1.00 21.30 C ATOM 1643 H VAL A 173 16.127 11.992 56.113 1.00 0.00 H ATOM 1644 N LYS A 174 16.488 9.095 57.678 1.00 19.60 N ATOM 1645 CA LYS A 174 16.220 7.724 58.106 1.00 21.55 C ATOM 1646 C LYS A 174 16.525 6.732 56.991 1.00 19.22 C ATOM 1647 O LYS A 174 17.080 5.657 57.238 1.00 18.14 O ATOM 1648 CB LYS A 174 14.764 7.562 58.552 1.00 20.73 C ATOM 1649 CG LYS A 174 14.391 8.298 59.834 1.00 25.06 C ATOM 1650 CD LYS A 174 12.948 7.979 60.216 1.00 27.44 C ATOM 1651 CE LYS A 174 12.385 9.016 61.156 1.00 36.79 C ATOM 1652 NZ LYS A 174 10.951 8.745 61.456 1.00 43.79 N ATOM 1653 HZ1 LYS A 174 10.404 8.764 60.572 1.00 0.00 H ATOM 1654 HZ2 LYS A 174 10.862 7.809 61.900 1.00 0.00 H ATOM 1655 HZ3 LYS A 174 10.590 9.474 62.104 1.00 0.00 H ATOM 1656 H LYS A 174 15.708 9.782 57.640 1.00 0.00 H ATOM 1657 N GLY A 175 16.149 7.091 55.767 1.00 19.48 N ATOM 1658 CA GLY A 175 16.359 6.226 54.618 1.00 17.35 C ATOM 1659 C GLY A 175 17.827 5.928 54.401 1.00 16.68 C ATOM 1660 O GLY A 175 18.203 4.787 54.106 1.00 17.41 O ATOM 1661 H GLY A 175 15.693 8.015 55.628 1.00 0.00 H ATOM 1662 N MET A 176 18.664 6.948 54.561 1.00 16.23 N ATOM 1663 CA MET A 176 20.101 6.779 54.397 1.00 15.58 C ATOM 1664 C MET A 176 20.670 5.883 55.481 1.00 18.08 C ATOM 1665 O MET A 176 21.532 5.044 55.214 1.00 18.51 O ATOM 1666 CB MET A 176 20.805 8.135 54.413 1.00 17.60 C ATOM 1667 CG MET A 176 20.536 8.982 53.181 1.00 21.65 C ATOM 1668 SD MET A 176 21.048 8.224 51.621 1.00 32.00 S ATOM 1669 CE MET A 176 22.768 8.741 51.563 1.00 25.05 C ATOM 1670 H MET A 176 18.285 7.885 54.808 1.00 0.00 H ATOM 1671 N VAL A 177 20.182 6.057 56.705 1.00 20.06 N ATOM 1672 CA VAL A 177 20.628 5.227 57.817 1.00 22.21 C ATOM 1673 C VAL A 177 20.233 3.775 57.572 1.00 23.98 C ATOM 1674 O VAL A 177 21.070 2.871 57.672 1.00 23.20 O ATOM 1675 CB VAL A 177 20.043 5.720 59.147 1.00 21.53 C ATOM 1676 CG1 VAL A 177 20.315 4.721 60.265 1.00 21.17 C ATOM 1677 CG2 VAL A 177 20.613 7.093 59.492 1.00 23.39 C ATOM 1678 H VAL A 177 19.471 6.797 56.872 1.00 0.00 H ATOM 1679 N GLU A 178 18.966 3.555 57.221 1.00 20.85 N ATOM 1680 CA GLU A 178 18.481 2.202 56.943 1.00 23.14 C ATOM 1681 C GLU A 178 19.265 1.548 55.805 1.00 19.29 C ATOM 1682 O GLU A 178 19.568 0.357 55.852 1.00 19.99 O ATOM 1683 CB GLU A 178 16.980 2.222 56.618 1.00 26.54 C ATOM 1684 CG GLU A 178 16.426 0.910 56.037 1.00 35.30 C ATOM 1685 CD GLU A 178 16.289 -0.227 57.056 1.00 45.10 C ATOM 1686 OE1 GLU A 178 15.566 -1.205 56.752 1.00 47.95 O ATOM 1687 OE2 GLU A 178 16.897 -0.158 58.150 1.00 49.30 O ATOM 1688 H GLU A 178 18.311 4.359 57.143 1.00 0.00 H ATOM 1689 N ALA A 179 19.612 2.333 54.791 1.00 18.03 N ATOM 1690 CA ALA A 179 20.390 1.816 53.671 1.00 16.71 C ATOM 1691 C ALA A 179 21.761 1.336 54.131 1.00 16.62 C ATOM 1692 O ALA A 179 22.208 0.242 53.752 1.00 16.05 O ATOM 1693 CB ALA A 179 20.534 2.887 52.573 1.00 12.30 C ATOM 1694 H ALA A 179 19.324 3.332 54.796 1.00 0.00 H ATOM 1695 N VAL A 180 22.433 2.144 54.949 1.00 16.16 N ATOM 1696 CA VAL A 180 23.756 1.770 55.434 1.00 20.67 C ATOM 1697 C VAL A 180 23.661 0.494 56.269 1.00 20.64 C ATOM 1698 O VAL A 180 24.534 -0.374 56.212 1.00 21.40 O ATOM 1699 CB VAL A 180 24.394 2.900 56.267 1.00 20.75 C ATOM 1700 CG1 VAL A 180 25.679 2.418 56.939 1.00 23.51 C ATOM 1701 CG2 VAL A 180 24.678 4.094 55.386 1.00 18.48 C ATOM 1702 H VAL A 180 22.011 3.048 55.244 1.00 0.00 H ATOM 1703 N ARG A 181 22.578 0.383 57.027 1.00 21.33 N ATOM 1704 CA ARG A 181 22.340 -0.789 57.861 1.00 24.12 C ATOM 1705 C ARG A 181 22.144 -2.034 56.998 1.00 20.10 C ATOM 1706 O ARG A 181 22.670 -3.109 57.304 1.00 18.82 O ATOM 1707 CB ARG A 181 21.127 -0.545 58.758 1.00 26.77 C ATOM 1708 CG ARG A 181 20.976 -1.513 59.912 1.00 37.47 C ATOM 1709 CD ARG A 181 20.324 -0.808 61.089 1.00 46.53 C ATOM 1710 NE ARG A 181 19.266 0.097 60.646 1.00 50.89 N ATOM 1711 CZ ARG A 181 18.854 1.165 61.326 1.00 56.28 C ATOM 1712 NH1 ARG A 181 19.414 1.476 62.488 1.00 58.09 N ATOM 1713 NH2 ARG A 181 17.883 1.930 60.839 1.00 56.65 N ATOM 1714 HE ARG A 181 18.803 -0.107 59.737 1.00 0.00 H ATOM 1715 HH12 ARG A 181 19.088 2.311 63.015 1.00 0.00 H ATOM 1716 HH11 ARG A 181 20.179 0.884 62.872 1.00 0.00 H ATOM 1717 HH22 ARG A 181 17.562 2.764 61.371 1.00 0.00 H ATOM 1718 HH21 ARG A 181 17.444 1.695 59.926 1.00 0.00 H ATOM 1719 H ARG A 181 21.879 1.153 57.026 1.00 0.00 H ATOM 1720 N LEU A 182 21.400 -1.882 55.906 1.00 19.33 N ATOM 1721 CA LEU A 182 21.183 -2.988 54.976 1.00 19.94 C ATOM 1722 C LEU A 182 22.494 -3.416 54.321 1.00 21.67 C ATOM 1723 O LEU A 182 22.720 -4.606 54.093 1.00 24.62 O ATOM 1724 CB LEU A 182 20.153 -2.599 53.910 1.00 17.05 C ATOM 1725 CG LEU A 182 18.719 -2.461 54.420 1.00 18.56 C ATOM 1726 CD1 LEU A 182 17.802 -1.880 53.350 1.00 18.91 C ATOM 1727 CD2 LEU A 182 18.197 -3.817 54.875 1.00 20.12 C ATOM 1728 H LEU A 182 20.964 -0.958 55.710 1.00 0.00 H ATOM 1729 N ILE A 183 23.355 -2.448 54.019 1.00 19.24 N ATOM 1730 CA ILE A 183 24.656 -2.740 53.428 1.00 17.39 C ATOM 1731 C ILE A 183 25.543 -3.475 54.424 1.00 20.95 C ATOM 1732 O ILE A 183 26.250 -4.409 54.056 1.00 21.93 O ATOM 1733 CB ILE A 183 25.368 -1.444 52.953 1.00 19.61 C ATOM 1734 CG1 ILE A 183 24.581 -0.788 51.814 1.00 16.99 C ATOM 1735 CG2 ILE A 183 26.801 -1.737 52.503 1.00 17.49 C ATOM 1736 CD1 ILE A 183 25.053 0.626 51.472 1.00 16.53 C ATOM 1737 H ILE A 183 23.094 -1.459 54.209 1.00 0.00 H ATOM 1738 N ALA A 184 25.494 -3.068 55.690 1.00 23.84 N ATOM 1739 CA ALA A 184 26.319 -3.691 56.724 1.00 24.83 C ATOM 1740 C ALA A 184 26.001 -5.178 56.906 1.00 29.77 C ATOM 1741 O ALA A 184 26.875 -5.967 57.271 1.00 31.52 O ATOM 1742 CB ALA A 184 26.149 -2.950 58.041 1.00 21.10 C ATOM 1743 H ALA A 184 24.855 -2.290 55.950 1.00 0.00 H ATOM 1744 N THR A 185 24.753 -5.555 56.642 1.00 31.16 N ATOM 1745 CA THR A 185 24.325 -6.948 56.763 1.00 30.61 C ATOM 1746 C THR A 185 24.335 -7.681 55.418 1.00 31.41 C ATOM 1747 O THR A 185 23.967 -8.855 55.349 1.00 32.63 O ATOM 1748 CB THR A 185 22.915 -7.043 57.374 1.00 32.32 C ATOM 1749 OG1 THR A 185 21.997 -6.274 56.583 1.00 30.62 O ATOM 1750 CG2 THR A 185 22.914 -6.502 58.798 1.00 33.63 C ATOM 1751 HG1 THR A 185 22.288 -5.328 56.569 1.00 0.00 H ATOM 1752 H THR A 185 24.062 -4.839 56.341 1.00 0.00 H ATOM 1753 N GLY A 186 24.741 -6.994 54.352 1.00 31.33 N ATOM 1754 CA GLY A 186 24.841 -7.619 53.041 1.00 29.99 C ATOM 1755 C GLY A 186 23.509 -7.855 52.350 1.00 30.18 C ATOM 1756 O GLY A 186 23.427 -8.603 51.363 1.00 30.05 O ATOM 1757 H GLY A 186 24.992 -5.990 54.458 1.00 0.00 H ATOM 1758 N LYS A 187 22.463 -7.202 52.852 1.00 24.74 N ATOM 1759 CA LYS A 187 21.108 -7.424 52.350 1.00 24.37 C ATOM 1760 C LYS A 187 20.640 -6.359 51.361 1.00 20.53 C ATOM 1761 O LYS A 187 19.620 -6.537 50.688 1.00 18.90 O ATOM 1762 CB LYS A 187 20.121 -7.501 53.522 1.00 29.70 C ATOM 1763 CG LYS A 187 20.178 -8.803 54.297 1.00 34.53 C ATOM 1764 CD LYS A 187 19.042 -8.913 55.313 1.00 40.79 C ATOM 1765 CE LYS A 187 19.168 -7.888 56.423 1.00 42.68 C ATOM 1766 NZ LYS A 187 18.350 -8.258 57.618 1.00 44.69 N ATOM 1767 HZ1 LYS A 187 17.349 -8.322 57.345 1.00 0.00 H ATOM 1768 HZ2 LYS A 187 18.670 -9.177 57.985 1.00 0.00 H ATOM 1769 HZ3 LYS A 187 18.464 -7.531 58.353 1.00 0.00 H ATOM 1770 H LYS A 187 22.614 -6.517 53.620 1.00 0.00 H ATOM 1771 N ALA A 188 21.372 -5.253 51.285 1.00 17.66 N ATOM 1772 CA ALA A 188 21.021 -4.165 50.372 1.00 17.61 C ATOM 1773 C ALA A 188 20.934 -4.669 48.930 1.00 18.87 C ATOM 1774 O ALA A 188 21.855 -5.326 48.445 1.00 20.63 O ATOM 1775 CB ALA A 188 22.035 -3.036 50.484 1.00 14.39 C ATOM 1776 H ALA A 188 22.214 -5.158 51.888 1.00 0.00 H ATOM 1777 N PRO A 189 19.813 -4.378 48.250 1.00 16.96 N ATOM 1778 CA PRO A 189 19.607 -4.847 46.879 1.00 18.19 C ATOM 1779 C PRO A 189 20.089 -3.839 45.854 1.00 18.87 C ATOM 1780 O PRO A 189 20.556 -2.759 46.228 1.00 18.08 O ATOM 1781 CB PRO A 189 18.092 -4.999 46.801 1.00 15.12 C ATOM 1782 CG PRO A 189 17.609 -3.833 47.642 1.00 13.40 C ATOM 1783 CD PRO A 189 18.607 -3.710 48.777 1.00 11.81 C ATOM 1784 N ARG A 190 19.950 -4.198 44.581 1.00 19.53 N ATOM 1785 CA ARG A 190 20.332 -3.352 43.455 1.00 21.46 C ATOM 1786 C ARG A 190 19.291 -3.468 42.361 1.00 19.73 C ATOM 1787 O ARG A 190 19.450 -4.272 41.449 1.00 23.43 O ATOM 1788 CB ARG A 190 21.695 -3.762 42.888 1.00 24.05 C ATOM 1789 CG ARG A 190 22.850 -3.549 43.811 1.00 31.27 C ATOM 1790 CD ARG A 190 24.136 -4.088 43.211 1.00 36.22 C ATOM 1791 NE ARG A 190 25.280 -3.577 43.955 1.00 40.09 N ATOM 1792 CZ ARG A 190 25.897 -2.440 43.659 1.00 40.12 C ATOM 1793 NH1 ARG A 190 25.488 -1.717 42.623 1.00 36.55 N ATOM 1794 NH2 ARG A 190 26.925 -2.031 44.387 1.00 45.11 N ATOM 1795 HE ARG A 190 25.632 -4.133 44.761 1.00 0.00 H ATOM 1796 HH12 ARG A 190 25.970 -0.826 42.389 1.00 0.00 H ATOM 1797 HH11 ARG A 190 24.686 -2.042 42.046 1.00 0.00 H ATOM 1798 HH22 ARG A 190 27.406 -1.139 44.152 1.00 0.00 H ATOM 1799 HH21 ARG A 190 27.251 -2.601 45.193 1.00 0.00 H ATOM 1800 H ARG A 190 19.546 -5.134 44.376 1.00 0.00 H ATOM 1801 N ILE A 191 18.227 -2.680 42.440 1.00 17.30 N ATOM 1802 CA ILE A 191 17.184 -2.781 41.436 1.00 16.72 C ATOM 1803 C ILE A 191 17.481 -1.803 40.310 1.00 17.75 C ATOM 1804 O ILE A 191 17.489 -0.588 40.525 1.00 15.50 O ATOM 1805 CB ILE A 191 15.799 -2.512 42.037 1.00 18.22 C ATOM 1806 CG1 ILE A 191 15.617 -3.365 43.303 1.00 17.11 C ATOM 1807 CG2 ILE A 191 14.705 -2.817 41.008 1.00 17.77 C ATOM 1808 CD1 ILE A 191 14.642 -2.787 44.296 1.00 16.82 C ATOM 1809 H ILE A 191 18.141 -1.994 43.217 1.00 0.00 H ATOM 1810 N LYS A 192 17.762 -2.336 39.121 1.00 18.40 N ATOM 1811 CA LYS A 192 18.000 -1.492 37.957 1.00 20.44 C ATOM 1812 C LYS A 192 16.799 -0.583 37.751 1.00 21.95 C ATOM 1813 O LYS A 192 15.656 -1.056 37.752 1.00 23.72 O ATOM 1814 CB LYS A 192 18.251 -2.343 36.707 1.00 23.06 C ATOM 1815 CG LYS A 192 18.403 -1.536 35.412 1.00 28.17 C ATOM 1816 CD LYS A 192 18.692 -2.454 34.222 1.00 34.52 C ATOM 1817 CE LYS A 192 18.991 -1.663 32.948 1.00 37.62 C ATOM 1818 NZ LYS A 192 17.775 -1.013 32.383 1.00 40.05 N ATOM 1819 HZ1 LYS A 192 17.070 -1.742 32.151 1.00 0.00 H ATOM 1820 HZ2 LYS A 192 17.378 -0.355 33.084 1.00 0.00 H ATOM 1821 HZ3 LYS A 192 18.032 -0.490 31.521 1.00 0.00 H ATOM 1822 H LYS A 192 17.812 -3.370 39.022 1.00 0.00 H ATOM 1823 N GLN A 193 17.046 0.717 37.610 1.00 20.00 N ATOM 1824 CA GLN A 193 15.971 1.649 37.289 1.00 20.68 C ATOM 1825 C GLN A 193 15.269 1.181 36.019 1.00 22.14 C ATOM 1826 O GLN A 193 15.926 0.874 35.027 1.00 23.93 O ATOM 1827 CB GLN A 193 16.513 3.076 37.124 1.00 21.25 C ATOM 1828 CG GLN A 193 17.076 3.684 38.416 1.00 18.67 C ATOM 1829 CD GLN A 193 17.392 5.169 38.284 1.00 18.56 C ATOM 1830 OE1 GLN A 193 16.755 5.889 37.509 1.00 18.25 O ATOM 1831 NE2 GLN A 193 18.382 5.630 39.037 1.00 17.58 N ATOM 1832 HE22 GLN A 193 18.892 4.987 39.676 1.00 0.00 H ATOM 1833 HE21 GLN A 193 18.648 6.634 38.988 1.00 0.00 H ATOM 1834 H GLN A 193 18.016 1.072 37.730 1.00 0.00 H ATOM 1835 N PRO A 194 13.932 1.084 36.062 1.00 22.46 N ATOM 1836 CA PRO A 194 13.161 0.700 34.873 1.00 26.07 C ATOM 1837 C PRO A 194 13.288 1.759 33.794 1.00 27.77 C ATOM 1838 O PRO A 194 13.533 2.911 34.139 1.00 27.23 O ATOM 1839 CB PRO A 194 11.721 0.618 35.392 1.00 24.22 C ATOM 1840 CG PRO A 194 11.707 1.489 36.615 1.00 23.85 C ATOM 1841 CD PRO A 194 13.067 1.332 37.230 1.00 21.11 C ATOM 1842 N GLU A 195 13.141 1.390 32.526 1.00 30.08 N ATOM 1843 CA GLU A 195 13.154 2.385 31.460 1.00 35.22 C ATOM 1844 C GLU A 195 11.931 3.288 31.556 1.00 30.55 C ATOM 1845 O GLU A 195 12.051 4.513 31.560 1.00 27.97 O ATOM 1846 CB GLU A 195 13.202 1.711 30.087 1.00 42.91 C ATOM 1847 CG GLU A 195 14.549 1.105 29.722 1.00 51.05 C ATOM 1848 CD GLU A 195 14.516 0.367 28.389 1.00 60.15 C ATOM 1849 OE1 GLU A 195 13.601 0.637 27.580 1.00 63.41 O ATOM 1850 OE2 GLU A 195 15.401 -0.484 28.151 1.00 63.42 O ATOM 1851 H GLU A 195 13.016 0.384 32.292 1.00 0.00 H ATOM 1852 N GLU A 196 10.757 2.668 31.639 1.00 30.95 N ATOM 1853 CA GLU A 196 9.485 3.388 31.661 1.00 34.80 C ATOM 1854 C GLU A 196 9.388 4.357 32.835 1.00 33.01 C ATOM 1855 O GLU A 196 9.592 3.972 33.992 1.00 30.01 O ATOM 1856 CB GLU A 196 8.319 2.395 31.710 1.00 41.94 C ATOM 1857 CG GLU A 196 6.936 3.036 31.765 1.00 50.06 C ATOM 1858 CD GLU A 196 5.815 2.007 31.790 1.00 58.14 C ATOM 1859 OE1 GLU A 196 4.876 2.167 32.599 1.00 59.40 O ATOM 1860 OE2 GLU A 196 5.872 1.041 30.999 1.00 62.18 O ATOM 1861 H GLU A 196 10.744 1.629 31.690 1.00 0.00 H ATOM 1862 N GLY A 197 9.088 5.619 32.533 1.00 33.41 N ATOM 1863 CA GLY A 197 8.911 6.630 33.561 1.00 29.63 C ATOM 1864 C GLY A 197 10.150 7.462 33.843 1.00 26.60 C ATOM 1865 O GLY A 197 10.116 8.398 34.649 1.00 21.72 O ATOM 1866 H GLY A 197 8.977 5.888 31.534 1.00 0.00 H ATOM 1867 N ALA A 198 11.255 7.125 33.188 1.00 25.74 N ATOM 1868 CA ALA A 198 12.483 7.892 33.370 1.00 26.46 C ATOM 1869 C ALA A 198 12.322 9.290 32.801 1.00 25.72 C ATOM 1870 O ALA A 198 11.989 9.441 31.631 1.00 29.16 O ATOM 1871 CB ALA A 198 13.656 7.189 32.711 1.00 26.01 C ATOM 1872 H ALA A 198 11.245 6.310 32.542 1.00 0.00 H ATOM 1873 N THR A 199 12.539 10.309 33.628 1.00 22.02 N ATOM 1874 CA THR A 199 12.617 11.683 33.129 1.00 20.95 C ATOM 1875 C THR A 199 13.850 12.360 33.691 1.00 22.25 C ATOM 1876 O THR A 199 14.395 11.936 34.711 1.00 22.23 O ATOM 1877 CB THR A 199 11.390 12.539 33.504 1.00 21.12 C ATOM 1878 OG1 THR A 199 11.448 12.876 34.899 1.00 21.31 O ATOM 1879 CG2 THR A 199 10.087 11.816 33.183 1.00 21.61 C ATOM 1880 HG1 THR A 199 12.276 13.388 35.079 1.00 0.00 H ATOM 1881 H THR A 199 12.655 10.127 34.645 1.00 0.00 H ATOM 1882 N TYR A 200 14.272 13.427 33.031 1.00 21.41 N ATOM 1883 CA TYR A 200 15.377 14.240 33.515 1.00 21.64 C ATOM 1884 C TYR A 200 15.024 15.698 33.283 1.00 21.09 C ATOM 1885 O TYR A 200 14.628 16.060 32.175 1.00 19.75 O ATOM 1886 CB TYR A 200 16.686 13.884 32.792 1.00 24.71 C ATOM 1887 CG TYR A 200 17.894 14.554 33.391 1.00 26.91 C ATOM 1888 CD1 TYR A 200 18.725 13.868 34.262 1.00 24.46 C ATOM 1889 CD2 TYR A 200 18.199 15.877 33.096 1.00 28.69 C ATOM 1890 CE1 TYR A 200 19.824 14.478 34.831 1.00 25.66 C ATOM 1891 CE2 TYR A 200 19.291 16.495 33.656 1.00 30.06 C ATOM 1892 CZ TYR A 200 20.101 15.790 34.523 1.00 28.48 C ATOM 1893 OH TYR A 200 21.195 16.405 35.086 1.00 26.75 O ATOM 1894 HH TYR A 200 20.897 17.187 35.614 1.00 0.00 H ATOM 1895 H TYR A 200 13.801 13.691 32.142 1.00 0.00 H ATOM 1896 N GLU A 201 15.163 16.537 34.306 1.00 20.99 N ATOM 1897 CA GLU A 201 14.956 17.972 34.111 1.00 22.24 C ATOM 1898 C GLU A 201 16.194 18.762 34.503 1.00 24.13 C ATOM 1899 O GLU A 201 16.922 18.370 35.420 1.00 20.85 O ATOM 1900 CB GLU A 201 13.755 18.473 34.917 1.00 19.94 C ATOM 1901 CG GLU A 201 12.425 17.930 34.461 1.00 19.09 C ATOM 1902 CD GLU A 201 12.116 16.577 35.069 1.00 22.74 C ATOM 1903 OE1 GLU A 201 12.430 16.372 36.265 1.00 23.24 O ATOM 1904 OE2 GLU A 201 11.555 15.719 34.347 1.00 22.72 O ATOM 1905 H GLU A 201 15.419 16.172 35.246 1.00 0.00 H ATOM 1906 N CYS A 202 16.416 19.875 33.806 1.00 27.36 N ATOM 1907 CA CYS A 202 17.535 20.767 34.080 1.00 30.05 C ATOM 1908 C CYS A 202 17.429 21.381 35.466 1.00 28.78 C ATOM 1909 O CYS A 202 16.343 21.444 36.046 1.00 28.83 O ATOM 1910 CB CYS A 202 17.600 21.878 33.028 1.00 33.23 C ATOM 1911 SG CYS A 202 16.131 22.940 32.970 1.00 53.05 S ATOM 1912 H CYS A 202 15.763 20.118 33.034 1.00 0.00 H ATOM 1913 N ILE A 203 18.562 21.833 35.992 1.00 27.98 N ATOM 1914 CA ILE A 203 18.592 22.509 37.282 1.00 26.82 C ATOM 1915 C ILE A 203 17.812 23.817 37.194 1.00 27.40 C ATOM 1916 O ILE A 203 17.856 24.498 36.169 1.00 27.26 O ATOM 1917 CB ILE A 203 20.050 22.767 37.746 1.00 32.05 C ATOM 1918 CG1 ILE A 203 20.083 23.410 39.134 1.00 33.97 C ATOM 1919 CG2 ILE A 203 20.804 23.615 36.734 1.00 32.73 C ATOM 1920 CD1 ILE A 203 21.369 23.152 39.901 1.00 37.15 C ATOM 1921 H ILE A 203 19.451 21.701 35.469 1.00 0.00 H ATOM 1922 N GLN A 204 17.070 24.149 38.251 1.00 27.73 N ATOM 1923 CA GLN A 204 16.332 25.412 38.293 1.00 30.40 C ATOM 1924 C GLN A 204 17.189 26.543 38.837 1.00 30.56 C ATOM 1925 O GLN A 204 17.758 26.427 39.918 1.00 30.18 O ATOM 1926 CB GLN A 204 15.067 25.282 39.149 1.00 28.44 C ATOM 1927 CG GLN A 204 13.924 24.604 38.446 1.00 27.59 C ATOM 1928 CD GLN A 204 13.545 25.326 37.179 1.00 29.15 C ATOM 1929 OE1 GLN A 204 13.928 24.916 36.083 1.00 30.96 O ATOM 1930 NE2 GLN A 204 12.805 26.421 37.318 1.00 25.59 N ATOM 1931 HE22 GLN A 204 12.505 26.729 38.265 1.00 0.00 H ATOM 1932 HE21 GLN A 204 12.526 26.970 36.480 1.00 0.00 H ATOM 1933 H GLN A 204 17.015 23.498 39.060 1.00 0.00 H ATOM 1934 N LYS A 205 17.271 27.636 38.086 1.00 33.79 N ATOM 1935 CA LYS A 205 17.934 28.846 38.557 1.00 35.41 C ATOM 1936 C LYS A 205 17.027 30.046 38.342 1.00 33.37 C ATOM 1937 O LYS A 205 15.948 29.914 37.758 1.00 32.56 O ATOM 1938 CB LYS A 205 19.263 29.045 37.835 1.00 42.76 C ATOM 1939 CG LYS A 205 20.242 27.917 38.053 1.00 48.62 C ATOM 1940 CD LYS A 205 21.243 27.835 36.915 1.00 55.53 C ATOM 1941 CE LYS A 205 22.445 27.023 37.341 1.00 59.35 C ATOM 1942 NZ LYS A 205 23.015 27.564 38.607 1.00 61.72 N ATOM 1943 HZ1 LYS A 205 23.307 28.551 38.460 1.00 0.00 H ATOM 1944 HZ2 LYS A 205 22.295 27.522 39.356 1.00 0.00 H ATOM 1945 HZ3 LYS A 205 23.840 26.995 38.885 1.00 0.00 H ATOM 1946 H LYS A 205 16.850 27.628 37.135 1.00 0.00 H ATOM 1947 N LYS A 206 17.458 31.214 38.813 1.00 32.44 N ATOM 1948 CA LYS A 206 16.663 32.428 38.669 1.00 31.29 C ATOM 1949 C LYS A 206 16.331 32.703 37.200 1.00 31.00 C ATOM 1950 O LYS A 206 15.199 33.061 36.873 1.00 28.89 O ATOM 1951 CB LYS A 206 17.399 33.625 39.280 1.00 33.20 C ATOM 1952 CG LYS A 206 16.493 34.802 39.617 1.00 35.27 C ATOM 1953 CD LYS A 206 15.505 34.421 40.706 1.00 32.97 C ATOM 1954 CE LYS A 206 14.646 35.604 41.130 1.00 32.11 C ATOM 1955 NZ LYS A 206 13.802 35.243 42.306 1.00 30.86 N ATOM 1956 HZ1 LYS A 206 13.181 34.447 42.055 1.00 0.00 H ATOM 1957 HZ2 LYS A 206 14.415 34.968 43.100 1.00 0.00 H ATOM 1958 HZ3 LYS A 206 13.223 36.062 42.580 1.00 0.00 H ATOM 1959 H LYS A 206 18.379 31.262 39.293 1.00 0.00 H ATOM 1960 N GLU A 207 17.314 32.508 36.323 1.00 33.36 N ATOM 1961 CA GLU A 207 17.142 32.756 34.890 1.00 45.67 C ATOM 1962 C GLU A 207 15.953 32.018 34.270 1.00 45.38 C ATOM 1963 O GLU A 207 15.178 32.611 33.516 1.00 49.88 O ATOM 1964 CB GLU A 207 18.415 32.374 34.123 1.00 55.78 C ATOM 1965 CG GLU A 207 18.239 32.396 32.601 1.00 65.63 C ATOM 1966 CD GLU A 207 19.426 31.819 31.844 1.00 73.89 C ATOM 1967 OE1 GLU A 207 19.535 32.086 30.626 1.00 77.89 O ATOM 1968 OE2 GLU A 207 20.244 31.098 32.458 1.00 74.85 O ATOM 1969 H GLU A 207 18.235 32.168 36.667 1.00 0.00 H ATOM 1970 N ASN A 208 15.812 30.732 34.584 1.00 40.19 N ATOM 1971 CA ASN A 208 14.770 29.914 33.965 1.00 39.79 C ATOM 1972 C ASN A 208 13.573 29.651 34.886 1.00 34.54 C ATOM 1973 O ASN A 208 12.847 28.674 34.705 1.00 35.04 O ATOM 1974 CB ASN A 208 15.359 28.580 33.467 1.00 41.12 C ATOM 1975 CG ASN A 208 16.029 27.770 34.575 1.00 41.88 C ATOM 1976 OD1 ASN A 208 16.432 28.315 35.601 1.00 46.42 O ATOM 1977 ND2 ASN A 208 16.160 26.461 34.361 1.00 37.59 N ATOM 1978 HD22 ASN A 208 15.805 26.040 33.479 1.00 0.00 H ATOM 1979 HD21 ASN A 208 16.617 25.860 35.076 1.00 0.00 H ATOM 1980 H ASN A 208 16.453 30.302 35.281 1.00 0.00 H ATOM 1981 N SER A 209 13.357 30.534 35.859 1.00 31.14 N ATOM 1982 CA SER A 209 12.181 30.437 36.725 1.00 30.13 C ATOM 1983 C SER A 209 11.166 31.546 36.425 1.00 28.00 C ATOM 1984 O SER A 209 10.239 31.788 37.204 1.00 26.05 O ATOM 1985 CB SER A 209 12.600 30.482 38.195 1.00 32.65 C ATOM 1986 OG SER A 209 13.141 31.749 38.524 1.00 38.59 O ATOM 1987 HG SER A 209 13.935 31.924 37.959 1.00 0.00 H ATOM 1988 H SER A 209 14.037 31.307 36.006 1.00 0.00 H ATOM 1989 N LYS A 210 11.340 32.218 35.291 1.00 20.73 N ATOM 1990 CA LYS A 210 10.410 33.260 34.881 1.00 24.46 C ATOM 1991 C LYS A 210 9.039 32.653 34.596 1.00 27.28 C ATOM 1992 O LYS A 210 8.935 31.554 34.050 1.00 28.28 O ATOM 1993 CB LYS A 210 10.936 34.005 33.649 1.00 27.30 C ATOM 1994 CG LYS A 210 10.074 35.202 33.233 1.00 30.70 C ATOM 1995 CD LYS A 210 10.564 35.830 31.926 1.00 35.79 C ATOM 1996 CE LYS A 210 9.579 36.871 31.414 1.00 38.67 C ATOM 1997 NZ LYS A 210 10.117 37.614 30.241 1.00 43.70 N ATOM 1998 HZ1 LYS A 210 10.995 38.101 30.513 1.00 0.00 H ATOM 1999 HZ2 LYS A 210 10.315 36.945 29.470 1.00 0.00 H ATOM 2000 HZ3 LYS A 210 9.415 38.313 29.923 1.00 0.00 H ATOM 2001 H LYS A 210 12.156 31.995 34.686 1.00 0.00 H ATOM 2002 N ILE A 211 7.991 33.371 34.982 1.00 28.07 N ATOM 2003 CA ILE A 211 6.619 32.879 34.878 1.00 27.53 C ATOM 2004 C ILE A 211 6.038 33.031 33.464 1.00 26.26 C ATOM 2005 O ILE A 211 6.267 34.042 32.799 1.00 25.99 O ATOM 2006 CB ILE A 211 5.720 33.621 35.889 1.00 28.33 C ATOM 2007 CG1 ILE A 211 6.090 33.212 37.319 1.00 26.60 C ATOM 2008 CG2 ILE A 211 4.246 33.353 35.622 1.00 30.17 C ATOM 2009 CD1 ILE A 211 5.550 34.143 38.374 1.00 22.55 C ATOM 2010 H ILE A 211 8.153 34.321 35.374 1.00 0.00 H ATOM 2011 N ASP A 212 5.309 32.013 33.009 1.00 26.91 N ATOM 2012 CA ASP A 212 4.522 32.087 31.777 1.00 25.60 C ATOM 2013 C ASP A 212 3.056 32.312 32.149 1.00 25.11 C ATOM 2014 O ASP A 212 2.427 31.442 32.755 1.00 25.00 O ATOM 2015 CB ASP A 212 4.692 30.799 30.957 1.00 25.73 C ATOM 2016 CG ASP A 212 3.822 30.772 29.697 1.00 28.87 C ATOM 2017 OD1 ASP A 212 3.301 31.834 29.276 1.00 28.18 O ATOM 2018 OD2 ASP A 212 3.671 29.674 29.123 1.00 30.78 O ATOM 2019 H ASP A 212 5.299 31.127 33.553 1.00 0.00 H ATOM 2020 N TRP A 213 2.510 33.473 31.803 1.00 28.78 N ATOM 2021 CA TRP A 213 1.164 33.824 32.255 1.00 30.64 C ATOM 2022 C TRP A 213 0.063 33.152 31.432 1.00 32.97 C ATOM 2023 O TRP A 213 -1.111 33.188 31.811 1.00 30.77 O ATOM 2024 CB TRP A 213 0.975 35.345 32.238 1.00 27.56 C ATOM 2025 CG TRP A 213 1.798 36.061 33.275 1.00 30.26 C ATOM 2026 CD1 TRP A 213 2.788 36.983 33.054 1.00 31.82 C ATOM 2027 CD2 TRP A 213 1.708 35.902 34.695 1.00 28.72 C ATOM 2028 NE1 TRP A 213 3.312 37.408 34.253 1.00 29.54 N ATOM 2029 CE2 TRP A 213 2.669 36.759 35.274 1.00 29.77 C ATOM 2030 CE3 TRP A 213 0.908 35.119 35.532 1.00 28.56 C ATOM 2031 CZ2 TRP A 213 2.846 36.854 36.659 1.00 27.19 C ATOM 2032 CZ3 TRP A 213 1.087 35.214 36.905 1.00 29.17 C ATOM 2033 CH2 TRP A 213 2.046 36.077 37.453 1.00 27.56 C ATOM 2034 HE1 TRP A 213 4.073 38.108 34.366 1.00 0.00 H ATOM 2035 H TRP A 213 3.044 34.137 31.206 1.00 0.00 H ATOM 2036 N ASN A 214 0.443 32.536 30.317 1.00 35.05 N ATOM 2037 CA ASN A 214 -0.527 31.894 29.430 1.00 36.80 C ATOM 2038 C ASN A 214 -0.750 30.408 29.750 1.00 36.11 C ATOM 2039 O ASN A 214 -0.581 29.539 28.888 1.00 39.25 O ATOM 2040 CB ASN A 214 -0.088 32.072 27.973 1.00 36.73 C ATOM 2041 CG ASN A 214 -0.097 33.530 27.542 1.00 39.29 C ATOM 2042 OD1 ASN A 214 -1.030 34.270 27.851 1.00 40.35 O ATOM 2043 ND2 ASN A 214 0.948 33.952 26.839 1.00 41.92 N ATOM 2044 HD22 ASN A 214 1.715 33.291 26.600 1.00 0.00 H ATOM 2045 HD21 ASN A 214 0.999 34.943 26.528 1.00 0.00 H ATOM 2046 H ASN A 214 1.453 32.510 30.070 1.00 0.00 H ATOM 2047 N GLN A 215 -1.129 30.136 30.999 1.00 29.12 N ATOM 2048 CA GLN A 215 -1.498 28.795 31.457 1.00 30.26 C ATOM 2049 C GLN A 215 -2.746 28.899 32.340 1.00 33.06 C ATOM 2050 O GLN A 215 -3.115 30.003 32.750 1.00 29.97 O ATOM 2051 CB GLN A 215 -0.356 28.146 32.248 1.00 30.45 C ATOM 2052 CG GLN A 215 0.988 28.067 31.543 1.00 31.21 C ATOM 2053 CD GLN A 215 2.074 27.536 32.465 1.00 28.93 C ATOM 2054 OE1 GLN A 215 2.195 26.331 32.667 1.00 30.93 O ATOM 2055 NE2 GLN A 215 2.860 28.438 33.038 1.00 28.85 N ATOM 2056 HE22 GLN A 215 2.722 29.449 32.839 1.00 0.00 H ATOM 2057 HE21 GLN A 215 3.614 28.134 33.687 1.00 0.00 H ATOM 2058 H GLN A 215 -1.164 30.918 31.684 1.00 0.00 H ATOM 2059 N PRO A 216 -3.402 27.760 32.635 1.00 34.97 N ATOM 2060 CA PRO A 216 -4.463 27.797 33.651 1.00 33.05 C ATOM 2061 C PRO A 216 -3.889 28.145 35.024 1.00 28.21 C ATOM 2062 O PRO A 216 -2.694 27.920 35.247 1.00 23.85 O ATOM 2063 CB PRO A 216 -5.022 26.366 33.638 1.00 33.93 C ATOM 2064 CG PRO A 216 -4.686 25.841 32.276 1.00 35.27 C ATOM 2065 CD PRO A 216 -3.349 26.457 31.943 1.00 35.03 C ATOM 2066 N ALA A 217 -4.715 28.672 35.926 1.00 26.12 N ATOM 2067 CA ALA A 217 -4.243 29.075 37.253 1.00 23.57 C ATOM 2068 C ALA A 217 -3.457 27.964 37.946 1.00 23.36 C ATOM 2069 O ALA A 217 -2.409 28.220 38.538 1.00 22.06 O ATOM 2070 CB ALA A 217 -5.421 29.518 38.126 1.00 23.74 C ATOM 2071 H ALA A 217 -5.718 28.800 35.683 1.00 0.00 H ATOM 2072 N GLU A 218 -3.950 26.731 37.854 1.00 24.97 N ATOM 2073 CA GLU A 218 -3.302 25.595 38.507 1.00 24.83 C ATOM 2074 C GLU A 218 -1.844 25.402 38.068 1.00 23.40 C ATOM 2075 O GLU A 218 -0.972 25.111 38.896 1.00 19.48 O ATOM 2076 CB GLU A 218 -4.093 24.307 38.246 1.00 29.38 C ATOM 2077 CG GLU A 218 -3.512 23.083 38.958 1.00 36.22 C ATOM 2078 CD GLU A 218 -4.457 21.892 38.968 1.00 42.81 C ATOM 2079 OE1 GLU A 218 -5.653 22.074 38.658 1.00 47.28 O ATOM 2080 OE2 GLU A 218 -4.002 20.775 39.295 1.00 43.23 O ATOM 2081 H GLU A 218 -4.818 26.572 37.304 1.00 0.00 H ATOM 2082 N ALA A 219 -1.571 25.560 36.777 1.00 24.44 N ATOM 2083 CA ALA A 219 -0.205 25.386 36.276 1.00 24.99 C ATOM 2084 C ALA A 219 0.737 26.491 36.776 1.00 24.21 C ATOM 2085 O ALA A 219 1.897 26.227 37.105 1.00 27.33 O ATOM 2086 CB ALA A 219 -0.207 25.342 34.757 1.00 22.93 C ATOM 2087 H ALA A 219 -2.334 25.810 36.116 1.00 0.00 H ATOM 2088 N ILE A 220 0.236 27.724 36.817 1.00 19.42 N ATOM 2089 CA ILE A 220 1.000 28.857 37.333 1.00 21.56 C ATOM 2090 C ILE A 220 1.279 28.654 38.824 1.00 22.23 C ATOM 2091 O ILE A 220 2.390 28.903 39.311 1.00 19.46 O ATOM 2092 CB ILE A 220 0.245 30.189 37.101 1.00 21.15 C ATOM 2093 CG1 ILE A 220 0.079 30.453 35.600 1.00 21.46 C ATOM 2094 CG2 ILE A 220 0.978 31.355 37.755 1.00 21.03 C ATOM 2095 CD1 ILE A 220 -0.895 31.577 35.260 1.00 21.25 C ATOM 2096 H ILE A 220 -0.731 27.886 36.470 1.00 0.00 H ATOM 2097 N HIS A 221 0.254 28.191 39.536 1.00 21.72 N ATOM 2098 CA HIS A 221 0.366 27.804 40.938 1.00 19.70 C ATOM 2099 C HIS A 221 1.507 26.822 41.150 1.00 17.47 C ATOM 2100 O HIS A 221 2.329 26.986 42.063 1.00 18.38 O ATOM 2101 CB HIS A 221 -0.956 27.191 41.411 1.00 23.19 C ATOM 2102 CG HIS A 221 -0.923 26.659 42.809 1.00 21.72 C ATOM 2103 ND1 HIS A 221 -0.650 27.453 43.900 1.00 23.44 N ATOM 2104 CD2 HIS A 221 -1.161 25.417 43.294 1.00 22.39 C ATOM 2105 CE1 HIS A 221 -0.711 26.721 45.000 1.00 24.13 C ATOM 2106 NE2 HIS A 221 -1.022 25.484 44.660 1.00 23.96 N ATOM 2107 H HIS A 221 -0.671 28.101 39.070 1.00 0.00 H ATOM 2108 N ASN A 222 1.556 25.797 40.307 1.00 17.35 N ATOM 2109 CA ASN A 222 2.597 24.776 40.416 1.00 19.39 C ATOM 2110 C ASN A 222 3.986 25.356 40.140 1.00 18.44 C ATOM 2111 O ASN A 222 4.968 25.001 40.800 1.00 19.15 O ATOM 2112 CB ASN A 222 2.313 23.609 39.456 1.00 18.36 C ATOM 2113 CG ASN A 222 1.144 22.742 39.906 1.00 20.76 C ATOM 2114 OD1 ASN A 222 0.802 22.695 41.091 1.00 23.43 O ATOM 2115 ND2 ASN A 222 0.529 22.046 38.957 1.00 18.53 N ATOM 2116 HD22 ASN A 222 0.850 22.115 37.970 1.00 0.00 H ATOM 2117 HD21 ASN A 222 -0.274 21.432 39.200 1.00 0.00 H ATOM 2118 H ASN A 222 0.841 25.719 39.556 1.00 0.00 H ATOM 2119 N TRP A 223 4.069 26.244 39.158 1.00 18.14 N ATOM 2120 CA TRP A 223 5.340 26.888 38.825 1.00 18.33 C ATOM 2121 C TRP A 223 5.876 27.717 39.991 1.00 18.26 C ATOM 2122 O TRP A 223 7.061 27.633 40.338 1.00 18.93 O ATOM 2123 CB TRP A 223 5.187 27.779 37.594 1.00 21.83 C ATOM 2124 CG TRP A 223 6.493 28.356 37.148 1.00 22.33 C ATOM 2125 CD1 TRP A 223 6.972 29.613 37.395 1.00 22.68 C ATOM 2126 CD2 TRP A 223 7.505 27.677 36.402 1.00 23.24 C ATOM 2127 NE1 TRP A 223 8.216 29.760 36.827 1.00 22.99 N ATOM 2128 CE2 TRP A 223 8.566 28.584 36.217 1.00 24.71 C ATOM 2129 CE3 TRP A 223 7.611 26.392 35.865 1.00 24.17 C ATOM 2130 CZ2 TRP A 223 9.722 28.242 35.510 1.00 25.47 C ATOM 2131 CZ3 TRP A 223 8.759 26.052 35.169 1.00 26.36 C ATOM 2132 CH2 TRP A 223 9.800 26.974 34.999 1.00 26.52 C ATOM 2133 HE1 TRP A 223 8.796 30.623 36.856 1.00 0.00 H ATOM 2134 H TRP A 223 3.216 26.487 38.615 1.00 0.00 H ATOM 2135 N ILE A 224 5.003 28.522 40.589 1.00 16.51 N ATOM 2136 CA ILE A 224 5.398 29.381 41.702 1.00 16.99 C ATOM 2137 C ILE A 224 5.812 28.583 42.947 1.00 19.66 C ATOM 2138 O ILE A 224 6.859 28.863 43.555 1.00 20.73 O ATOM 2139 CB ILE A 224 4.264 30.350 42.070 1.00 18.30 C ATOM 2140 CG1 ILE A 224 3.989 31.302 40.897 1.00 20.31 C ATOM 2141 CG2 ILE A 224 4.615 31.123 43.337 1.00 16.25 C ATOM 2142 CD1 ILE A 224 2.811 32.242 41.112 1.00 22.11 C ATOM 2143 H ILE A 224 4.018 28.540 40.257 1.00 0.00 H ATOM 2144 N ARG A 225 5.004 27.594 43.323 1.00 16.48 N ATOM 2145 CA ARG A 225 5.299 26.788 44.506 1.00 16.26 C ATOM 2146 C ARG A 225 6.465 25.841 44.237 1.00 17.38 C ATOM 2147 O ARG A 225 7.206 25.487 45.156 1.00 14.76 O ATOM 2148 CB ARG A 225 4.055 26.009 44.964 1.00 17.52 C ATOM 2149 CG ARG A 225 3.622 24.820 44.094 1.00 20.10 C ATOM 2150 CD ARG A 225 2.174 24.413 44.423 1.00 22.66 C ATOM 2151 NE ARG A 225 1.698 23.249 43.670 1.00 19.10 N ATOM 2152 CZ ARG A 225 1.620 22.014 44.165 1.00 19.97 C ATOM 2153 NH1 ARG A 225 1.994 21.765 45.417 1.00 16.86 N ATOM 2154 NH2 ARG A 225 1.168 21.018 43.410 1.00 21.84 N ATOM 2155 HE ARG A 225 1.401 23.397 42.684 1.00 0.00 H ATOM 2156 HH12 ARG A 225 1.930 20.799 45.796 1.00 0.00 H ATOM 2157 HH11 ARG A 225 2.350 22.537 46.017 1.00 0.00 H ATOM 2158 HH22 ARG A 225 1.109 20.056 43.800 1.00 0.00 H ATOM 2159 HH21 ARG A 225 0.874 21.201 42.429 1.00 0.00 H ATOM 2160 H ARG A 225 4.149 27.392 42.766 1.00 0.00 H ATOM 2161 N GLY A 226 6.633 25.446 42.976 1.00 16.11 N ATOM 2162 CA GLY A 226 7.752 24.605 42.580 1.00 16.94 C ATOM 2163 C GLY A 226 9.086 25.340 42.578 1.00 19.48 C ATOM 2164 O GLY A 226 10.136 24.723 42.411 1.00 19.10 O ATOM 2165 H GLY A 226 5.946 25.747 42.255 1.00 0.00 H ATOM 2166 N ASN A 227 9.058 26.658 42.758 1.00 18.37 N ATOM 2167 CA ASN A 227 10.297 27.424 42.843 1.00 18.91 C ATOM 2168 C ASN A 227 10.352 28.272 44.109 1.00 17.92 C ATOM 2169 O ASN A 227 11.136 29.213 44.207 1.00 17.16 O ATOM 2170 CB ASN A 227 10.464 28.307 41.601 1.00 21.66 C ATOM 2171 CG ASN A 227 10.732 27.496 40.340 1.00 25.64 C ATOM 2172 OD1 ASN A 227 11.799 26.895 40.191 1.00 27.66 O ATOM 2173 ND2 ASN A 227 9.763 27.472 39.430 1.00 22.62 N ATOM 2174 HD22 ASN A 227 8.879 27.994 39.598 1.00 0.00 H ATOM 2175 HD21 ASN A 227 9.889 26.931 38.551 1.00 0.00 H ATOM 2176 H ASN A 227 8.144 27.147 42.839 1.00 0.00 H ATOM 2177 N ASP A 228 9.518 27.914 45.078 1.00 17.91 N ATOM 2178 CA ASP A 228 9.395 28.632 46.341 1.00 17.76 C ATOM 2179 C ASP A 228 9.938 27.727 47.450 1.00 21.28 C ATOM 2180 O ASP A 228 9.388 26.648 47.672 1.00 22.52 O ATOM 2181 CB ASP A 228 7.913 29.005 46.556 1.00 19.96 C ATOM 2182 CG ASP A 228 7.616 29.568 47.933 1.00 20.98 C ATOM 2183 OD1 ASP A 228 6.418 29.645 48.285 1.00 18.86 O ATOM 2184 OD2 ASP A 228 8.549 29.942 48.666 1.00 23.74 O ATOM 2185 H ASP A 228 8.920 27.076 44.928 1.00 0.00 H ATOM 2186 N ARG A 229 10.998 28.132 48.154 1.00 21.72 N ATOM 2187 CA ARG A 229 11.564 29.481 48.134 1.00 26.20 C ATOM 2188 C ARG A 229 12.666 29.729 47.100 1.00 27.86 C ATOM 2189 O ARG A 229 12.865 30.867 46.670 1.00 30.18 O ATOM 2190 CB ARG A 229 12.127 29.807 49.522 1.00 35.89 C ATOM 2191 CG ARG A 229 11.168 29.582 50.680 1.00 44.82 C ATOM 2192 CD ARG A 229 10.294 30.797 50.926 1.00 53.62 C ATOM 2193 NE ARG A 229 11.029 32.037 50.713 1.00 62.04 N ATOM 2194 CZ ARG A 229 10.886 33.121 51.465 1.00 68.96 C ATOM 2195 NH1 ARG A 229 11.597 34.212 51.208 1.00 72.71 N ATOM 2196 NH2 ARG A 229 10.032 33.110 52.480 1.00 70.03 N ATOM 2197 HE ARG A 229 11.706 32.075 49.925 1.00 0.00 H ATOM 2198 HH12 ARG A 229 11.482 35.059 51.800 1.00 0.00 H ATOM 2199 HH11 ARG A 229 12.269 34.220 50.415 1.00 0.00 H ATOM 2200 HH22 ARG A 229 9.917 33.957 53.072 1.00 0.00 H ATOM 2201 HH21 ARG A 229 9.478 32.254 52.684 1.00 0.00 H ATOM 2202 H ARG A 229 11.459 27.430 48.767 1.00 0.00 H ATOM 2203 N VAL A 230 13.398 28.686 46.718 1.00 27.00 N ATOM 2204 CA VAL A 230 14.512 28.860 45.785 1.00 29.76 C ATOM 2205 C VAL A 230 14.261 28.133 44.464 1.00 28.61 C ATOM 2206 O VAL A 230 13.804 26.989 44.457 1.00 27.52 O ATOM 2207 CB VAL A 230 15.847 28.378 46.404 1.00 36.21 C ATOM 2208 CG1 VAL A 230 16.278 29.318 47.512 1.00 36.80 C ATOM 2209 CG2 VAL A 230 15.717 26.960 46.950 1.00 39.93 C ATOM 2210 H VAL A 230 13.177 27.739 47.086 1.00 0.00 H ATOM 2211 N PRO A 231 14.564 28.794 43.333 1.00 26.55 N ATOM 2212 CA PRO A 231 15.177 30.127 43.257 1.00 28.13 C ATOM 2213 C PRO A 231 14.179 31.286 43.238 1.00 25.40 C ATOM 2214 O PRO A 231 14.604 32.436 43.125 1.00 26.59 O ATOM 2215 CB PRO A 231 15.944 30.069 41.933 1.00 31.07 C ATOM 2216 CG PRO A 231 15.083 29.199 41.070 1.00 29.46 C ATOM 2217 CD PRO A 231 14.478 28.160 42.005 1.00 26.70 C ATOM 2218 N GLY A 232 12.886 31.002 43.342 1.00 21.61 N ATOM 2219 CA GLY A 232 11.891 32.057 43.313 1.00 20.26 C ATOM 2220 C GLY A 232 11.373 32.365 41.920 1.00 22.33 C ATOM 2221 O GLY A 232 12.100 32.903 41.085 1.00 23.54 O ATOM 2222 H GLY A 232 12.583 30.012 43.445 1.00 0.00 H ATOM 2223 N ALA A 233 10.115 32.021 41.666 1.00 20.48 N ATOM 2224 CA ALA A 233 9.476 32.348 40.396 1.00 18.79 C ATOM 2225 C ALA A 233 9.270 33.854 40.307 1.00 21.92 C ATOM 2226 O ALA A 233 8.961 34.504 41.313 1.00 19.85 O ATOM 2227 CB ALA A 233 8.146 31.617 40.262 1.00 16.31 C ATOM 2228 H ALA A 233 9.573 31.507 42.389 1.00 0.00 H ATOM 2229 N TRP A 234 9.441 34.417 39.115 1.00 23.97 N ATOM 2230 CA TRP A 234 9.367 35.863 38.977 1.00 22.54 C ATOM 2231 C TRP A 234 8.760 36.291 37.654 1.00 22.28 C ATOM 2232 O TRP A 234 8.683 35.504 36.707 1.00 22.93 O ATOM 2233 CB TRP A 234 10.754 36.479 39.125 1.00 23.19 C ATOM 2234 CG TRP A 234 11.681 36.064 38.057 1.00 26.87 C ATOM 2235 CD1 TRP A 234 12.481 34.959 38.054 1.00 27.54 C ATOM 2236 CD2 TRP A 234 11.921 36.740 36.819 1.00 30.20 C ATOM 2237 NE1 TRP A 234 13.202 34.902 36.889 1.00 30.54 N ATOM 2238 CE2 TRP A 234 12.880 35.986 36.114 1.00 32.88 C ATOM 2239 CE3 TRP A 234 11.420 37.911 36.239 1.00 32.10 C ATOM 2240 CZ2 TRP A 234 13.349 36.368 34.854 1.00 37.35 C ATOM 2241 CZ3 TRP A 234 11.891 38.289 34.993 1.00 34.81 C ATOM 2242 CH2 TRP A 234 12.842 37.520 34.313 1.00 38.24 C ATOM 2243 HE1 TRP A 234 13.882 34.158 36.635 1.00 0.00 H ATOM 2244 H TRP A 234 9.628 33.824 38.281 1.00 0.00 H ATOM 2245 N ALA A 235 8.335 37.550 37.602 1.00 20.98 N ATOM 2246 CA ALA A 235 7.801 38.156 36.388 1.00 22.75 C ATOM 2247 C ALA A 235 8.035 39.654 36.457 1.00 26.06 C ATOM 2248 O ALA A 235 8.277 40.196 37.538 1.00 25.37 O ATOM 2249 CB ALA A 235 6.312 37.849 36.231 1.00 19.16 C ATOM 2250 H ALA A 235 8.386 38.128 38.465 1.00 0.00 H ATOM 2251 N GLU A 236 7.975 40.325 35.309 1.00 28.80 N ATOM 2252 CA GLU A 236 8.118 41.775 35.275 1.00 31.46 C ATOM 2253 C GLU A 236 6.815 42.454 35.697 1.00 32.42 C ATOM 2254 O GLU A 236 5.735 42.092 35.212 1.00 33.50 O ATOM 2255 CB GLU A 236 8.525 42.251 33.876 1.00 36.97 C ATOM 2256 CG GLU A 236 8.409 43.764 33.679 1.00 45.68 C ATOM 2257 CD GLU A 236 8.557 44.193 32.222 1.00 55.10 C ATOM 2258 OE1 GLU A 236 9.706 44.376 31.764 1.00 59.20 O ATOM 2259 OE2 GLU A 236 7.522 44.354 31.537 1.00 57.14 O ATOM 2260 H GLU A 236 7.823 39.806 34.421 1.00 0.00 H ATOM 2261 N ILE A 237 6.919 43.408 36.624 1.00 28.64 N ATOM 2262 CA ILE A 237 5.819 44.316 36.951 1.00 29.33 C ATOM 2263 C ILE A 237 6.361 45.739 37.073 1.00 32.96 C ATOM 2264 O ILE A 237 7.254 45.986 37.887 1.00 30.58 O ATOM 2265 CB ILE A 237 5.112 43.951 38.276 1.00 29.31 C ATOM 2266 CG1 ILE A 237 4.730 42.469 38.325 1.00 26.27 C ATOM 2267 CG2 ILE A 237 3.876 44.817 38.459 1.00 32.08 C ATOM 2268 CD1 ILE A 237 4.090 42.046 39.651 1.00 26.13 C ATOM 2269 H ILE A 237 7.819 43.511 37.135 1.00 0.00 H ATOM 2270 N ASP A 238 5.821 46.666 36.278 1.00 35.10 N ATOM 2271 CA ASP A 238 6.244 48.069 36.299 1.00 41.76 C ATOM 2272 C ASP A 238 7.744 48.224 36.051 1.00 41.27 C ATOM 2273 O ASP A 238 8.399 49.054 36.686 1.00 39.27 O ATOM 2274 CB ASP A 238 5.872 48.734 37.636 1.00 51.18 C ATOM 2275 CG ASP A 238 4.387 49.054 37.745 1.00 59.28 C ATOM 2276 OD1 ASP A 238 3.779 49.413 36.714 1.00 63.70 O ATOM 2277 OD2 ASP A 238 3.831 48.953 38.863 1.00 60.10 O ATOM 2278 H ASP A 238 5.070 46.381 35.617 1.00 0.00 H ATOM 2279 N GLY A 239 8.283 47.419 35.136 1.00 42.80 N ATOM 2280 CA GLY A 239 9.702 47.465 34.819 1.00 43.61 C ATOM 2281 C GLY A 239 10.582 46.949 35.946 1.00 41.62 C ATOM 2282 O GLY A 239 11.795 47.170 35.955 1.00 43.93 O ATOM 2283 H GLY A 239 7.674 46.741 34.636 1.00 0.00 H ATOM 2284 N LYS A 240 9.960 46.274 36.907 1.00 38.85 N ATOM 2285 CA LYS A 240 10.676 45.652 38.015 1.00 40.57 C ATOM 2286 C LYS A 240 10.530 44.140 37.937 1.00 35.98 C ATOM 2287 O LYS A 240 9.466 43.641 37.570 1.00 28.53 O ATOM 2288 CB LYS A 240 10.144 46.155 39.361 1.00 42.88 C ATOM 2289 CG LYS A 240 10.449 47.607 39.663 1.00 50.84 C ATOM 2290 CD LYS A 240 11.914 47.786 40.020 1.00 57.10 C ATOM 2291 CE LYS A 240 12.231 49.233 40.368 1.00 61.28 C ATOM 2292 NZ LYS A 240 13.468 49.352 41.195 1.00 63.35 N ATOM 2293 HZ1 LYS A 240 13.342 48.824 42.082 1.00 0.00 H ATOM 2294 HZ2 LYS A 240 14.275 48.960 40.668 1.00 0.00 H ATOM 2295 HZ3 LYS A 240 13.646 50.354 41.408 1.00 0.00 H ATOM 2296 H LYS A 240 8.924 46.186 36.868 1.00 0.00 H ATOM 2297 N SER A 241 11.595 43.417 38.271 1.00 36.66 N ATOM 2298 CA SER A 241 11.515 41.965 38.397 1.00 35.84 C ATOM 2299 C SER A 241 11.002 41.602 39.787 1.00 30.90 C ATOM 2300 O SER A 241 11.706 41.769 40.781 1.00 33.07 O ATOM 2301 CB SER A 241 12.876 41.313 38.140 1.00 40.27 C ATOM 2302 OG SER A 241 13.294 41.522 36.804 1.00 45.36 O ATOM 2303 HG SER A 241 14.175 41.092 36.664 1.00 0.00 H ATOM 2304 H SER A 241 12.502 43.895 38.446 1.00 0.00 H ATOM 2305 N VAL A 242 9.770 41.111 39.841 1.00 26.70 N ATOM 2306 CA VAL A 242 9.099 40.795 41.096 1.00 24.87 C ATOM 2307 C VAL A 242 8.998 39.283 41.282 1.00 24.28 C ATOM 2308 O VAL A 242 8.540 38.586 40.376 1.00 22.35 O ATOM 2309 CB VAL A 242 7.687 41.425 41.122 1.00 25.42 C ATOM 2310 CG1 VAL A 242 6.914 41.000 42.366 1.00 21.06 C ATOM 2311 CG2 VAL A 242 7.784 42.951 41.015 1.00 24.43 C ATOM 2312 H VAL A 242 9.261 40.945 38.949 1.00 0.00 H ATOM 2313 N SER A 243 9.425 38.775 42.439 1.00 21.15 N ATOM 2314 CA SER A 243 9.326 37.345 42.732 1.00 20.40 C ATOM 2315 C SER A 243 8.084 37.022 43.575 1.00 19.39 C ATOM 2316 O SER A 243 7.628 37.854 44.360 1.00 19.81 O ATOM 2317 CB SER A 243 10.590 36.853 43.447 1.00 24.99 C ATOM 2318 OG SER A 243 11.743 37.048 42.649 1.00 22.86 O ATOM 2319 HG SER A 243 11.848 38.013 42.452 1.00 0.00 H ATOM 2320 H SER A 243 9.838 39.411 43.150 1.00 0.00 H ATOM 2321 N PHE A 244 7.552 35.812 43.406 1.00 19.58 N ATOM 2322 CA PHE A 244 6.281 35.415 44.009 1.00 18.90 C ATOM 2323 C PHE A 244 6.453 34.246 44.975 1.00 18.41 C ATOM 2324 O PHE A 244 7.080 33.239 44.629 1.00 18.53 O ATOM 2325 CB PHE A 244 5.271 35.027 42.917 1.00 19.84 C ATOM 2326 CG PHE A 244 4.977 36.127 41.928 1.00 23.60 C ATOM 2327 CD1 PHE A 244 5.890 36.459 40.940 1.00 26.05 C ATOM 2328 CD2 PHE A 244 3.772 36.811 41.977 1.00 26.48 C ATOM 2329 CE1 PHE A 244 5.612 37.468 40.021 1.00 29.70 C ATOM 2330 CE2 PHE A 244 3.481 37.817 41.062 1.00 26.94 C ATOM 2331 CZ PHE A 244 4.403 38.146 40.086 1.00 27.10 C ATOM 2332 H PHE A 244 8.063 35.121 42.820 1.00 0.00 H ATOM 2333 N TYR A 245 5.883 34.367 46.174 1.00 16.90 N ATOM 2334 CA TYR A 245 5.994 33.306 47.180 1.00 19.90 C ATOM 2335 C TYR A 245 4.675 33.085 47.916 1.00 23.91 C ATOM 2336 O TYR A 245 3.932 34.039 48.168 1.00 26.73 O ATOM 2337 CB TYR A 245 7.101 33.631 48.194 1.00 21.18 C ATOM 2338 CG TYR A 245 8.451 33.917 47.570 1.00 24.95 C ATOM 2339 CD1 TYR A 245 9.292 32.881 47.182 1.00 23.93 C ATOM 2340 CD2 TYR A 245 8.885 35.224 47.370 1.00 26.55 C ATOM 2341 CE1 TYR A 245 10.528 33.139 46.613 1.00 25.84 C ATOM 2342 CE2 TYR A 245 10.124 35.493 46.800 1.00 24.43 C ATOM 2343 CZ TYR A 245 10.935 34.444 46.425 1.00 26.06 C ATOM 2344 OH TYR A 245 12.162 34.693 45.858 1.00 28.50 O ATOM 2345 HH TYR A 245 12.609 33.834 45.651 1.00 0.00 H ATOM 2346 H TYR A 245 5.349 35.231 46.400 1.00 0.00 H ATOM 2347 N GLY A 246 4.391 31.831 48.264 1.00 24.91 N ATOM 2348 CA GLY A 246 3.216 31.509 49.060 1.00 25.46 C ATOM 2349 C GLY A 246 1.919 31.500 48.268 1.00 25.44 C ATOM 2350 O GLY A 246 0.945 32.168 48.632 1.00 26.27 O ATOM 2351 H GLY A 246 5.024 31.064 47.960 1.00 0.00 H ATOM 2352 N SER A 247 1.909 30.735 47.181 1.00 20.40 N ATOM 2353 CA SER A 247 0.723 30.580 46.349 1.00 23.09 C ATOM 2354 C SER A 247 -0.251 29.531 46.903 1.00 26.84 C ATOM 2355 O SER A 247 0.153 28.447 47.338 1.00 30.37 O ATOM 2356 CB SER A 247 1.140 30.209 44.924 1.00 21.88 C ATOM 2357 OG SER A 247 0.020 29.981 44.091 1.00 25.27 O ATOM 2358 HG SER A 247 -0.519 29.238 44.461 1.00 0.00 H ATOM 2359 H SER A 247 2.778 30.229 46.915 1.00 0.00 H ATOM 2360 N THR A 248 -1.535 29.880 46.906 1.00 26.53 N ATOM 2361 CA THR A 248 -2.615 28.934 47.186 1.00 28.67 C ATOM 2362 C THR A 248 -3.700 29.094 46.121 1.00 29.70 C ATOM 2363 O THR A 248 -4.013 30.215 45.721 1.00 27.44 O ATOM 2364 CB THR A 248 -3.231 29.147 48.586 1.00 30.97 C ATOM 2365 OG1 THR A 248 -3.690 30.498 48.708 1.00 33.59 O ATOM 2366 CG2 THR A 248 -2.209 28.867 49.672 1.00 33.65 C ATOM 2367 HG1 THR A 248 -2.927 31.117 48.586 1.00 0.00 H ATOM 2368 H THR A 248 -1.782 30.869 46.700 1.00 0.00 H ATOM 2369 N LEU A 249 -4.269 27.987 45.656 1.00 32.04 N ATOM 2370 CA LEU A 249 -5.376 28.063 44.706 1.00 39.82 C ATOM 2371 C LEU A 249 -6.612 28.648 45.389 1.00 46.89 C ATOM 2372 O LEU A 249 -6.812 28.460 46.591 1.00 49.79 O ATOM 2373 CB LEU A 249 -5.674 26.685 44.112 1.00 41.36 C ATOM 2374 CG LEU A 249 -4.656 26.239 43.057 1.00 39.15 C ATOM 2375 CD1 LEU A 249 -4.774 24.761 42.744 1.00 41.80 C ATOM 2376 CD2 LEU A 249 -4.827 27.048 41.787 1.00 37.68 C ATOM 2377 H LEU A 249 -3.923 27.058 45.971 1.00 0.00 H ATOM 2378 N LEU A 250 -7.430 29.373 44.630 1.00 52.16 N ATOM 2379 CA LEU A 250 -8.529 30.133 45.221 1.00 59.62 C ATOM 2380 C LEU A 250 -9.812 30.046 44.392 1.00 69.70 C ATOM 2381 O LEU A 250 -9.792 30.235 43.173 1.00 71.81 O ATOM 2382 CB LEU A 250 -8.111 31.601 45.392 1.00 57.86 C ATOM 2383 CG LEU A 250 -8.820 32.452 46.449 1.00 62.53 C ATOM 2384 CD1 LEU A 250 -8.532 31.923 47.847 1.00 63.39 C ATOM 2385 CD2 LEU A 250 -8.407 33.913 46.336 1.00 61.66 C ATOM 2386 H LEU A 250 -7.285 29.399 43.601 1.00 0.00 H ATOM 2387 N GLU A 251 -10.924 29.763 45.065 1.00 78.09 N ATOM 2388 CA GLU A 251 -12.241 29.768 44.436 1.00 86.17 C ATOM 2389 C GLU A 251 -12.948 31.096 44.701 1.00 94.91 C ATOM 2390 O GLU A 251 -13.466 31.732 43.785 1.00 95.46 O ATOM 2391 CB GLU A 251 -13.087 28.604 44.954 1.00 87.95 C ATOM 2392 CG GLU A 251 -12.532 27.229 44.623 1.00 86.35 C ATOM 2393 CD GLU A 251 -12.958 26.744 43.251 1.00 87.28 C ATOM 2394 OE1 GLU A 251 -14.176 26.556 43.042 1.00 90.33 O ATOM 2395 OE2 GLU A 251 -12.077 26.553 42.383 1.00 84.45 O ATOM 2396 H GLU A 251 -10.852 29.530 46.076 1.00 0.00 H ATOM 2397 N ASN A 252 -12.958 31.496 45.970 1.00103.46 N ATOM 2398 CA ASN A 252 -13.515 32.773 46.415 1.00112.94 C ATOM 2399 C ASN A 252 -12.514 33.438 47.374 1.00119.18 C ATOM 2400 O ASN A 252 -11.704 32.732 47.977 1.00117.84 O ATOM 2401 CB ASN A 252 -14.882 32.559 47.082 1.00115.43 C ATOM 2402 CG ASN A 252 -16.025 32.521 46.081 1.00116.55 C ATOM 2403 OD1 ASN A 252 -15.903 31.949 44.999 1.00114.52 O ATOM 2404 ND2 ASN A 252 -17.143 33.140 46.441 1.00120.33 N ATOM 2405 HD22 ASN A 252 -17.202 33.611 47.366 1.00 0.00 H ATOM 2406 HD21 ASN A 252 -17.960 33.154 45.798 1.00 0.00 H ATOM 2407 H ASN A 252 -12.546 30.864 46.686 1.00 0.00 H ATOM 2408 N ASP A 253 -12.542 34.765 47.546 1.00126.60 N ATOM 2409 CA ASP A 253 -13.569 35.685 47.045 1.00135.84 C ATOM 2410 C ASP A 253 -13.489 35.999 45.550 1.00141.42 C ATOM 2411 O ASP A 253 -12.408 36.241 45.011 1.00138.05 O ATOM 2412 CB ASP A 253 -13.492 36.997 47.828 1.00135.77 C ATOM 2413 CG ASP A 253 -14.840 37.453 48.337 1.00139.81 C ATOM 2414 OD1 ASP A 253 -15.206 37.075 49.469 1.00141.65 O ATOM 2415 OD2 ASP A 253 -15.536 38.188 47.608 1.00141.56 O ATOM 2416 H ASP A 253 -11.760 35.185 48.088 1.00 0.00 H ATOM 2417 N HIS A 254 -14.649 36.012 44.895 1.00150.99 N ATOM 2418 CA HIS A 254 -14.728 36.338 43.474 1.00156.52 C ATOM 2419 C HIS A 254 -15.765 37.441 43.215 1.00163.54 C ATOM 2420 O HIS A 254 -16.911 37.343 43.663 1.00168.16 O ATOM 2421 CB HIS A 254 -15.050 35.084 42.651 1.00159.04 C ATOM 2422 CG HIS A 254 -16.503 34.724 42.627 1.00166.01 C ATOM 2423 ND1 HIS A 254 -17.214 34.406 43.764 1.00169.75 N ATOM 2424 CD2 HIS A 254 -17.380 34.632 41.599 1.00169.93 C ATOM 2425 CE1 HIS A 254 -18.465 34.134 43.439 1.00174.84 C ATOM 2426 NE2 HIS A 254 -18.592 34.264 42.131 1.00175.04 N ATOM 2427 H HIS A 254 -15.523 35.783 45.410 1.00 0.00 H ATOM 2428 N PHE A 255 -15.364 38.506 42.520 1.00164.47 N ATOM 2429 CA PHE A 255 -13.989 38.704 42.043 1.00160.86 C ATOM 2430 C PHE A 255 -12.901 38.987 43.106 1.00155.12 C ATOM 2431 O PHE A 255 -11.836 38.374 43.030 1.00151.71 O ATOM 2432 CB PHE A 255 -13.958 39.835 41.006 1.00164.08 C ATOM 2433 CG PHE A 255 -14.037 39.359 39.585 1.00165.97 C ATOM 2434 CD1 PHE A 255 -12.995 38.637 39.024 1.00163.08 C ATOM 2435 CD2 PHE A 255 -15.146 39.641 38.805 1.00170.54 C ATOM 2436 CE1 PHE A 255 -13.061 38.199 37.717 1.00163.83 C ATOM 2437 CE2 PHE A 255 -15.217 39.205 37.494 1.00171.25 C ATOM 2438 CZ PHE A 255 -14.173 38.483 36.950 1.00167.81 C ATOM 2439 H PHE A 255 -16.067 39.241 42.303 1.00 0.00 H ATOM 2440 N SER A 256 -13.117 39.878 44.083 1.00153.03 N ATOM 2441 CA SER A 256 -14.361 40.609 44.342 1.00153.01 C ATOM 2442 C SER A 256 -14.341 42.054 43.850 1.00149.77 C ATOM 2443 O SER A 256 -15.289 42.804 44.092 1.00154.49 O ATOM 2444 CB SER A 256 -14.666 40.591 45.844 1.00153.77 C ATOM 2445 OG SER A 256 -15.184 41.833 46.288 1.00156.13 O ATOM 2446 HG SER A 256 -16.023 42.032 45.801 1.00 0.00 H ATOM 2447 H SER A 256 -12.320 40.071 44.723 1.00 0.00 H ATOM 2448 N SER A 257 -13.261 42.441 43.172 1.00140.91 N ATOM 2449 CA SER A 257 -13.022 43.835 42.775 1.00135.92 C ATOM 2450 C SER A 257 -13.058 44.782 43.977 1.00131.12 C ATOM 2451 O SER A 257 -13.158 46.001 43.822 1.00132.78 O ATOM 2452 CB SER A 257 -14.032 44.289 41.716 1.00139.64 C ATOM 2453 OG SER A 257 -13.655 43.839 40.425 1.00138.21 O ATOM 2454 HG SER A 257 -14.323 44.146 39.762 1.00 0.00 H ATOM 2455 H SER A 257 -12.555 41.723 42.912 1.00 0.00 H ATOM 2456 N ASN A 258 -12.980 44.205 45.172 1.00123.89 N ATOM 2457 CA ASN A 258 -12.809 44.960 46.401 1.00116.98 C ATOM 2458 C ASN A 258 -11.325 45.260 46.558 1.00104.61 C ATOM 2459 O ASN A 258 -10.927 46.179 47.275 1.00104.75 O ATOM 2460 CB ASN A 258 -13.349 44.173 47.598 1.00118.32 C ATOM 2461 CG ASN A 258 -13.733 45.063 48.767 1.00120.89 C ATOM 2462 OD1 ASN A 258 -13.012 45.995 49.121 1.00120.03 O ATOM 2463 ND2 ASN A 258 -14.881 44.777 49.372 1.00123.98 N ATOM 2464 HD22 ASN A 258 -15.460 43.979 49.039 1.00 0.00 H ATOM 2465 HD21 ASN A 258 -15.201 45.351 50.178 1.00 0.00 H ATOM 2466 H ASN A 258 -13.044 43.169 45.229 1.00 0.00 H ATOM 2467 N GLY A 259 -10.512 44.467 45.865 1.00 92.32 N ATOM 2468 CA GLY A 259 -9.077 44.672 45.823 1.00 79.94 C ATOM 2469 C GLY A 259 -8.690 45.697 44.775 1.00 71.30 C ATOM 2470 O GLY A 259 -9.530 46.152 43.997 1.00 73.34 O ATOM 2471 H GLY A 259 -10.920 43.671 45.334 1.00 0.00 H ATOM 2472 N GLN A 260 -7.412 46.063 44.759 1.00 60.77 N ATOM 2473 CA GLN A 260 -6.917 47.094 43.856 1.00 53.77 C ATOM 2474 C GLN A 260 -6.281 46.468 42.612 1.00 44.52 C ATOM 2475 O GLN A 260 -5.350 45.667 42.723 1.00 39.96 O ATOM 2476 CB GLN A 260 -5.919 47.995 44.591 1.00 53.78 C ATOM 2477 CG GLN A 260 -6.457 48.529 45.918 1.00 59.15 C ATOM 2478 CD GLN A 260 -5.437 49.341 46.699 1.00 62.97 C ATOM 2479 OE1 GLN A 260 -4.651 48.794 47.479 1.00 63.56 O ATOM 2480 NE2 GLN A 260 -5.453 50.656 46.504 1.00 65.05 N ATOM 2481 HE22 GLN A 260 -6.132 51.075 45.837 1.00 0.00 H ATOM 2482 HE21 GLN A 260 -4.786 51.266 47.018 1.00 0.00 H ATOM 2483 H GLN A 260 -6.746 45.600 45.410 1.00 0.00 H ATOM 2484 N PRO A 261 -6.790 46.832 41.423 1.00 40.28 N ATOM 2485 CA PRO A 261 -6.355 46.237 40.151 1.00 38.03 C ATOM 2486 C PRO A 261 -4.894 46.548 39.840 1.00 38.21 C ATOM 2487 O PRO A 261 -4.453 47.682 40.041 1.00 33.52 O ATOM 2488 CB PRO A 261 -7.277 46.891 39.113 1.00 36.70 C ATOM 2489 CG PRO A 261 -8.391 47.511 39.898 1.00 58.61 C ATOM 2490 CD PRO A 261 -7.796 47.885 41.218 1.00 38.71 C ATOM 2491 N LEU A 262 -4.155 45.547 39.371 1.00 37.86 N ATOM 2492 CA LEU A 262 -2.757 45.729 38.990 1.00 37.11 C ATOM 2493 C LEU A 262 -2.483 45.110 37.630 1.00 34.88 C ATOM 2494 O LEU A 262 -2.630 43.899 37.455 1.00 34.47 O ATOM 2495 CB LEU A 262 -1.821 45.110 40.031 1.00 36.94 C ATOM 2496 CG LEU A 262 -0.336 45.025 39.655 1.00 36.73 C ATOM 2497 CD1 LEU A 262 0.264 46.419 39.535 1.00 38.25 C ATOM 2498 CD2 LEU A 262 0.446 44.190 40.665 1.00 33.03 C ATOM 2499 H LEU A 262 -4.586 44.606 39.272 1.00 0.00 H ATOM 2500 N GLU A 263 -2.079 45.938 36.671 1.00 37.45 N ATOM 2501 CA GLU A 263 -1.718 45.449 35.343 1.00 39.08 C ATOM 2502 C GLU A 263 -0.410 44.672 35.394 1.00 36.28 C ATOM 2503 O GLU A 263 0.563 45.127 35.992 1.00 36.43 O ATOM 2504 CB GLU A 263 -1.590 46.608 34.353 1.00 46.28 C ATOM 2505 CG GLU A 263 -2.888 47.362 34.087 1.00 55.13 C ATOM 2506 CD GLU A 263 -3.987 46.471 33.536 1.00 60.06 C ATOM 2507 OE1 GLU A 263 -3.674 45.522 32.787 1.00 60.62 O ATOM 2508 OE2 GLU A 263 -5.167 46.719 33.861 1.00 63.94 O ATOM 2509 H GLU A 263 -2.019 46.957 36.871 1.00 0.00 H ATOM 2510 N ILE A 264 -0.385 43.503 34.769 1.00 36.36 N ATOM 2511 CA ILE A 264 0.834 42.708 34.722 1.00 35.67 C ATOM 2512 C ILE A 264 1.162 42.346 33.285 1.00 37.01 C ATOM 2513 O ILE A 264 0.358 41.710 32.596 1.00 36.00 O ATOM 2514 CB ILE A 264 0.718 41.436 35.583 1.00 32.30 C ATOM 2515 CG1 ILE A 264 0.808 41.820 37.061 1.00 34.00 C ATOM 2516 CG2 ILE A 264 1.825 40.439 35.233 1.00 28.20 C ATOM 2517 CD1 ILE A 264 0.419 40.739 38.018 1.00 31.91 C ATOM 2518 H ILE A 264 -1.247 43.149 34.307 1.00 0.00 H ATOM 2519 N PRO A 265 2.341 42.781 32.822 1.00 40.25 N ATOM 2520 CA PRO A 265 2.839 42.527 31.469 1.00 41.85 C ATOM 2521 C PRO A 265 2.665 41.075 31.043 1.00 37.22 C ATOM 2522 O PRO A 265 3.391 40.206 31.528 1.00 36.00 O ATOM 2523 CB PRO A 265 4.318 42.894 31.580 1.00 43.33 C ATOM 2524 CG PRO A 265 4.323 44.010 32.582 1.00 42.95 C ATOM 2525 CD PRO A 265 3.253 43.654 33.586 1.00 41.77 C ATOM 2526 N GLY A 266 1.692 40.820 30.169 1.00 36.69 N ATOM 2527 CA GLY A 266 1.488 39.493 29.607 1.00 34.77 C ATOM 2528 C GLY A 266 0.399 38.619 30.213 1.00 33.04 C ATOM 2529 O GLY A 266 0.078 37.558 29.671 1.00 34.19 O ATOM 2530 H GLY A 266 1.059 41.593 29.880 1.00 0.00 H ATOM 2531 N ALA A 267 -0.167 39.040 31.337 1.00 29.33 N ATOM 2532 CA ALA A 267 -1.206 38.244 31.994 1.00 28.36 C ATOM 2533 C ALA A 267 -2.527 38.273 31.210 1.00 30.12 C ATOM 2534 O ALA A 267 -2.764 39.181 30.408 1.00 28.96 O ATOM 2535 CB ALA A 267 -1.419 38.736 33.418 1.00 26.35 C ATOM 2536 H ALA A 267 0.130 39.944 31.756 1.00 0.00 H ATOM 2537 N SER A 268 -3.378 37.275 31.443 1.00 30.80 N ATOM 2538 CA SER A 268 -4.663 37.184 30.748 1.00 34.45 C ATOM 2539 C SER A 268 -5.590 38.339 31.130 1.00 32.56 C ATOM 2540 O SER A 268 -6.371 38.816 30.301 1.00 34.69 O ATOM 2541 CB SER A 268 -5.341 35.843 31.048 1.00 39.62 C ATOM 2542 OG SER A 268 -4.427 34.770 30.938 1.00 42.09 O ATOM 2543 HG SER A 268 -3.687 34.901 31.583 1.00 0.00 H ATOM 2544 H SER A 268 -3.123 36.542 32.136 1.00 0.00 H ATOM 2545 N ARG A 269 -5.500 38.778 32.385 1.00 29.36 N ATOM 2546 CA ARG A 269 -6.199 39.982 32.848 1.00 34.18 C ATOM 2547 C ARG A 269 -5.501 40.541 34.086 1.00 30.85 C ATOM 2548 O ARG A 269 -4.607 39.902 34.640 1.00 27.30 O ATOM 2549 CB ARG A 269 -7.678 39.698 33.157 1.00 39.56 C ATOM 2550 CG ARG A 269 -7.917 38.800 34.364 1.00 42.93 C ATOM 2551 CD ARG A 269 -9.070 39.315 35.223 1.00 49.24 C ATOM 2552 NE ARG A 269 -8.645 40.392 36.117 1.00 54.79 N ATOM 2553 CZ ARG A 269 -9.409 40.927 37.067 1.00 60.14 C ATOM 2554 NH1 ARG A 269 -8.931 41.901 37.836 1.00 58.88 N ATOM 2555 NH2 ARG A 269 -10.648 40.486 37.252 1.00 64.89 N ATOM 2556 HE ARG A 269 -7.681 40.765 36.003 1.00 0.00 H ATOM 2557 HH12 ARG A 269 -9.528 42.318 38.578 1.00 0.00 H ATOM 2558 HH11 ARG A 269 -7.960 42.245 37.695 1.00 0.00 H ATOM 2559 HH22 ARG A 269 -11.244 40.905 37.995 1.00 0.00 H ATOM 2560 HH21 ARG A 269 -11.023 39.722 36.654 1.00 0.00 H ATOM 2561 H ARG A 269 -4.913 38.248 33.061 1.00 0.00 H ATOM 2562 N ALA A 270 -5.916 41.728 34.515 1.00 32.10 N ATOM 2563 CA ALA A 270 -5.297 42.409 35.648 1.00 32.05 C ATOM 2564 C ALA A 270 -5.358 41.583 36.930 1.00 29.73 C ATOM 2565 O ALA A 270 -6.374 40.958 37.233 1.00 29.89 O ATOM 2566 CB ALA A 270 -5.960 43.765 35.871 1.00 34.01 C ATOM 2567 H ALA A 270 -6.710 42.188 34.026 1.00 0.00 H ATOM 2568 N ALA A 271 -4.264 41.588 37.682 1.00 26.95 N ATOM 2569 CA ALA A 271 -4.261 40.985 39.009 1.00 27.41 C ATOM 2570 C ALA A 271 -5.049 41.861 39.980 1.00 30.61 C ATOM 2571 O ALA A 271 -5.557 42.919 39.602 1.00 31.53 O ATOM 2572 CB ALA A 271 -2.847 40.791 39.496 1.00 22.81 C ATOM 2573 H ALA A 271 -3.395 42.029 37.318 1.00 0.00 H ATOM 2574 N LEU A 272 -5.157 41.425 41.228 1.00 30.35 N ATOM 2575 CA LEU A 272 -5.837 42.225 42.240 1.00 32.66 C ATOM 2576 C LEU A 272 -5.045 42.236 43.546 1.00 30.29 C ATOM 2577 O LEU A 272 -4.729 41.183 44.099 1.00 27.82 O ATOM 2578 CB LEU A 272 -7.260 41.697 42.475 1.00 37.14 C ATOM 2579 CG LEU A 272 -8.294 42.077 41.411 1.00 44.37 C ATOM 2580 CD1 LEU A 272 -9.581 41.269 41.551 1.00 48.88 C ATOM 2581 CD2 LEU A 272 -8.593 43.569 41.482 1.00 45.66 C ATOM 2582 H LEU A 272 -4.752 40.503 41.488 1.00 0.00 H ATOM 2583 N VAL A 273 -4.707 43.426 44.027 1.00 32.14 N ATOM 2584 CA VAL A 273 -4.073 43.555 45.338 1.00 32.41 C ATOM 2585 C VAL A 273 -5.156 43.543 46.417 1.00 34.05 C ATOM 2586 O VAL A 273 -5.946 44.483 46.522 1.00 39.23 O ATOM 2587 CB VAL A 273 -3.233 44.844 45.442 1.00 33.87 C ATOM 2588 CG1 VAL A 273 -2.693 45.025 46.860 1.00 34.26 C ATOM 2589 CG2 VAL A 273 -2.097 44.821 44.428 1.00 32.51 C ATOM 2590 H VAL A 273 -4.896 44.279 43.463 1.00 0.00 H ATOM 2591 N THR A 274 -5.207 42.477 47.209 1.00 32.37 N ATOM 2592 CA THR A 274 -6.272 42.336 48.203 1.00 35.35 C ATOM 2593 C THR A 274 -5.716 42.271 49.614 1.00 39.19 C ATOM 2594 O THR A 274 -4.502 42.199 49.806 1.00 35.50 O ATOM 2595 CB THR A 274 -7.119 41.076 47.964 1.00 34.76 C ATOM 2596 OG1 THR A 274 -6.439 39.937 48.507 1.00 32.69 O ATOM 2597 CG2 THR A 274 -7.368 40.870 46.476 1.00 33.79 C ATOM 2598 HG1 THR A 274 -6.984 39.125 48.354 1.00 0.00 H ATOM 2599 H THR A 274 -4.483 41.736 47.122 1.00 0.00 H ATOM 2600 N LYS A 275 -6.627 42.278 50.583 1.00 43.62 N ATOM 2601 CA LYS A 275 -6.316 42.128 52.002 1.00 47.76 C ATOM 2602 C LYS A 275 -5.389 40.952 52.299 1.00 45.15 C ATOM 2603 O LYS A 275 -4.492 41.052 53.139 1.00 44.27 O ATOM 2604 CB LYS A 275 -7.615 41.949 52.788 1.00 53.41 C ATOM 2605 CG LYS A 275 -7.788 42.860 53.980 1.00 59.39 C ATOM 2606 CD LYS A 275 -9.222 42.783 54.509 1.00 64.92 C ATOM 2607 CE LYS A 275 -9.537 41.421 55.114 1.00 65.60 C ATOM 2608 NZ LYS A 275 -8.798 41.215 56.387 1.00 66.42 N ATOM 2609 HZ1 LYS A 275 -7.775 41.270 56.206 1.00 0.00 H ATOM 2610 HZ2 LYS A 275 -9.071 41.952 57.068 1.00 0.00 H ATOM 2611 HZ3 LYS A 275 -9.033 40.279 56.775 1.00 0.00 H ATOM 2612 H LYS A 275 -7.624 42.398 50.313 1.00 0.00 H ATOM 2613 N ASN A 276 -5.614 39.835 51.613 1.00 40.90 N ATOM 2614 CA ASN A 276 -4.917 38.597 51.936 1.00 39.27 C ATOM 2615 C ASN A 276 -3.731 38.305 51.019 1.00 35.90 C ATOM 2616 O ASN A 276 -3.064 37.281 51.172 1.00 34.33 O ATOM 2617 CB ASN A 276 -5.903 37.421 51.902 1.00 41.71 C ATOM 2618 CG ASN A 276 -7.090 37.628 52.828 1.00 47.91 C ATOM 2619 OD1 ASN A 276 -6.955 37.575 54.052 1.00 50.27 O ATOM 2620 ND2 ASN A 276 -8.261 37.865 52.247 1.00 49.53 N ATOM 2621 HD22 ASN A 276 -8.329 37.901 51.210 1.00 0.00 H ATOM 2622 HD21 ASN A 276 -9.110 38.014 52.829 1.00 0.00 H ATOM 2623 H ASN A 276 -6.300 39.845 50.832 1.00 0.00 H ATOM 2624 N GLY A 277 -3.472 39.202 50.070 1.00 33.91 N ATOM 2625 CA GLY A 277 -2.347 39.045 49.162 1.00 29.94 C ATOM 2626 C GLY A 277 -2.666 39.380 47.715 1.00 30.28 C ATOM 2627 O GLY A 277 -3.732 39.929 47.406 1.00 31.61 O ATOM 2628 H GLY A 277 -4.088 40.034 49.976 1.00 0.00 H ATOM 2629 N LEU A 278 -1.739 39.051 46.818 1.00 26.61 N ATOM 2630 CA LEU A 278 -1.926 39.325 45.395 1.00 26.99 C ATOM 2631 C LEU A 278 -2.714 38.212 44.716 1.00 24.87 C ATOM 2632 O LEU A 278 -2.239 37.082 44.622 1.00 23.19 O ATOM 2633 CB LEU A 278 -0.575 39.504 44.697 1.00 26.13 C ATOM 2634 CG LEU A 278 -0.669 39.864 43.214 1.00 23.97 C ATOM 2635 CD1 LEU A 278 -1.513 41.128 43.022 1.00 24.84 C ATOM 2636 CD2 LEU A 278 0.703 40.050 42.606 1.00 24.28 C ATOM 2637 H LEU A 278 -0.863 38.589 47.137 1.00 0.00 H ATOM 2638 N VAL A 279 -3.922 38.528 44.256 1.00 26.89 N ATOM 2639 CA VAL A 279 -4.720 37.575 43.484 1.00 26.20 C ATOM 2640 C VAL A 279 -4.312 37.618 42.010 1.00 25.16 C ATOM 2641 O VAL A 279 -4.360 38.681 41.386 1.00 26.76 O ATOM 2642 CB VAL A 279 -6.234 37.868 43.604 1.00 31.10 C ATOM 2643 CG1 VAL A 279 -7.029 37.013 42.616 1.00 31.97 C ATOM 2644 CG2 VAL A 279 -6.721 37.637 45.033 1.00 32.46 C ATOM 2645 H VAL A 279 -4.308 39.474 44.450 1.00 0.00 H ATOM 2646 N LEU A 280 -3.911 36.473 41.460 1.00 24.64 N ATOM 2647 CA LEU A 280 -3.532 36.377 40.047 1.00 25.24 C ATOM 2648 C LEU A 280 -4.513 35.510 39.277 1.00 29.36 C ATOM 2649 O LEU A 280 -5.131 34.609 39.854 1.00 30.12 O ATOM 2650 CB LEU A 280 -2.128 35.793 39.899 1.00 22.88 C ATOM 2651 CG LEU A 280 -0.960 36.540 40.536 1.00 23.46 C ATOM 2652 CD1 LEU A 280 0.253 35.625 40.608 1.00 20.60 C ATOM 2653 CD2 LEU A 280 -0.640 37.800 39.744 1.00 22.14 C ATOM 2654 H LEU A 280 -3.865 35.619 42.052 1.00 0.00 H ATOM 2655 N PHE A 281 -4.636 35.758 37.976 1.00 27.12 N ATOM 2656 CA PHE A 281 -5.540 34.978 37.137 1.00 28.46 C ATOM 2657 C PHE A 281 -4.772 34.143 36.117 1.00 26.03 C ATOM 2658 O PHE A 281 -3.797 34.616 35.523 1.00 20.68 O ATOM 2659 CB PHE A 281 -6.538 35.892 36.407 1.00 31.28 C ATOM 2660 CG PHE A 281 -7.583 36.506 37.303 1.00 35.67 C ATOM 2661 CD1 PHE A 281 -7.356 37.724 37.924 1.00 34.65 C ATOM 2662 CD2 PHE A 281 -8.802 35.871 37.508 1.00 40.04 C ATOM 2663 CE1 PHE A 281 -8.320 38.293 38.748 1.00 38.88 C ATOM 2664 CE2 PHE A 281 -9.770 36.436 38.328 1.00 41.88 C ATOM 2665 CZ PHE A 281 -9.529 37.647 38.947 1.00 40.76 C ATOM 2666 H PHE A 281 -4.077 36.523 37.548 1.00 0.00 H ATOM 2667 N GLY A 282 -5.217 32.903 35.919 1.00 26.74 N ATOM 2668 CA GLY A 282 -4.737 32.081 34.816 1.00 28.25 C ATOM 2669 C GLY A 282 -5.636 32.323 33.617 1.00 29.50 C ATOM 2670 O GLY A 282 -6.636 33.036 33.734 1.00 30.23 O ATOM 2671 H GLY A 282 -5.927 32.511 36.570 1.00 0.00 H ATOM 2672 N ASN A 283 -5.316 31.737 32.468 1.00 27.51 N ATOM 2673 CA ASN A 283 -6.128 32.006 31.284 1.00 33.58 C ATOM 2674 C ASN A 283 -7.468 31.267 31.324 1.00 34.80 C ATOM 2675 O ASN A 283 -8.296 31.431 30.430 1.00 32.02 O ATOM 2676 CB ASN A 283 -5.356 31.675 29.993 1.00 32.99 C ATOM 2677 CG ASN A 283 -4.891 30.219 29.911 1.00 34.17 C ATOM 2678 OD1 ASN A 283 -5.394 29.334 30.606 1.00 32.67 O ATOM 2679 ND2 ASN A 283 -3.927 29.971 29.032 1.00 37.48 N ATOM 2680 HD22 ASN A 283 -3.529 30.746 28.464 1.00 0.00 H ATOM 2681 HD21 ASN A 283 -3.570 29.002 28.911 1.00 0.00 H ATOM 2682 H ASN A 283 -4.499 31.096 32.413 1.00 0.00 H ATOM 2683 N ASP A 284 -7.686 30.468 32.367 1.00 28.70 N ATOM 2684 CA ASP A 284 -8.971 29.800 32.537 1.00 33.78 C ATOM 2685 C ASP A 284 -9.888 30.651 33.410 1.00 37.05 C ATOM 2686 O ASP A 284 -11.020 30.257 33.713 1.00 39.70 O ATOM 2687 CB ASP A 284 -8.791 28.403 33.139 1.00 31.89 C ATOM 2688 CG ASP A 284 -8.065 28.422 34.477 1.00 28.98 C ATOM 2689 OD1 ASP A 284 -7.499 29.472 34.853 1.00 26.44 O ATOM 2690 OD2 ASP A 284 -8.050 27.364 35.142 1.00 27.93 O ATOM 2691 H ASP A 284 -6.932 30.319 33.068 1.00 0.00 H ATOM 2692 N GLY A 285 -9.398 31.826 33.798 1.00 32.42 N ATOM 2693 CA GLY A 285 -10.178 32.749 34.604 1.00 35.99 C ATOM 2694 C GLY A 285 -10.219 32.386 36.078 1.00 36.58 C ATOM 2695 O GLY A 285 -10.892 33.053 36.867 1.00 37.34 O ATOM 2696 H GLY A 285 -8.432 32.090 33.517 1.00 0.00 H ATOM 2697 N LYS A 286 -9.505 31.327 36.454 1.00 35.55 N ATOM 2698 CA LYS A 286 -9.453 30.906 37.852 1.00 35.34 C ATOM 2699 C LYS A 286 -8.296 31.598 38.573 1.00 33.20 C ATOM 2700 O LYS A 286 -7.398 32.160 37.934 1.00 24.71 O ATOM 2701 CB LYS A 286 -9.336 29.380 37.957 1.00 32.55 C ATOM 2702 CG LYS A 286 -10.550 28.632 37.407 1.00 38.20 C ATOM 2703 CD LYS A 286 -10.523 27.144 37.767 1.00 43.19 C ATOM 2704 CE LYS A 286 -10.902 26.888 39.227 1.00 46.48 C ATOM 2705 NZ LYS A 286 -12.356 27.094 39.501 1.00 53.06 N ATOM 2706 HZ1 LYS A 286 -12.614 28.076 39.276 1.00 0.00 H ATOM 2707 HZ2 LYS A 286 -12.914 26.444 38.912 1.00 0.00 H ATOM 2708 HZ3 LYS A 286 -12.548 26.905 40.505 1.00 0.00 H ATOM 2709 H LYS A 286 -8.974 30.789 35.739 1.00 0.00 H ATOM 2710 N MET A 287 -8.320 31.558 39.903 1.00 31.95 N ATOM 2711 CA MET A 287 -7.431 32.398 40.700 1.00 32.31 C ATOM 2712 C MET A 287 -6.422 31.638 41.565 1.00 33.80 C ATOM 2713 O MET A 287 -6.675 30.518 42.022 1.00 33.05 O ATOM 2714 CB MET A 287 -8.270 33.309 41.600 1.00 31.75 C ATOM 2715 CG MET A 287 -9.258 34.159 40.834 1.00 32.34 C ATOM 2716 SD MET A 287 -10.359 35.114 41.890 1.00 37.90 S ATOM 2717 CE MET A 287 -11.440 33.813 42.487 1.00 49.43 C ATOM 2718 H MET A 287 -8.984 30.917 40.383 1.00 0.00 H ATOM 2719 N LEU A 288 -5.269 32.263 41.775 1.00 29.93 N ATOM 2720 CA LEU A 288 -4.367 31.840 42.832 1.00 29.46 C ATOM 2721 C LEU A 288 -3.955 33.070 43.643 1.00 25.95 C ATOM 2722 O LEU A 288 -3.852 34.184 43.121 1.00 23.90 O ATOM 2723 CB LEU A 288 -3.155 31.062 42.278 1.00 29.93 C ATOM 2724 CG LEU A 288 -2.141 31.419 41.173 1.00 31.98 C ATOM 2725 CD1 LEU A 288 -2.775 31.948 39.886 1.00 32.33 C ATOM 2726 CD2 LEU A 288 -1.056 32.358 41.670 1.00 32.84 C ATOM 2727 H LEU A 288 -5.008 33.069 41.172 1.00 0.00 H ATOM 2728 N LEU A 289 -3.769 32.868 44.938 1.00 23.52 N ATOM 2729 CA LEU A 289 -3.427 33.964 45.831 1.00 23.17 C ATOM 2730 C LEU A 289 -1.962 33.884 46.239 1.00 23.78 C ATOM 2731 O LEU A 289 -1.526 32.880 46.819 1.00 25.33 O ATOM 2732 CB LEU A 289 -4.322 33.942 47.068 1.00 24.17 C ATOM 2733 CG LEU A 289 -3.951 34.949 48.159 1.00 27.92 C ATOM 2734 CD1 LEU A 289 -4.504 36.333 47.825 1.00 27.38 C ATOM 2735 CD2 LEU A 289 -4.413 34.482 49.544 1.00 30.18 C ATOM 2736 H LEU A 289 -3.869 31.908 45.324 1.00 0.00 H ATOM 2737 N VAL A 290 -1.202 34.935 45.938 1.00 23.62 N ATOM 2738 CA VAL A 290 0.207 34.979 46.314 1.00 24.23 C ATOM 2739 C VAL A 290 0.383 35.855 47.553 1.00 25.68 C ATOM 2740 O VAL A 290 0.070 37.047 47.532 1.00 27.20 O ATOM 2741 CB VAL A 290 1.081 35.494 45.148 1.00 25.55 C ATOM 2742 CG1 VAL A 290 2.509 35.735 45.618 1.00 26.92 C ATOM 2743 CG2 VAL A 290 1.065 34.492 44.000 1.00 19.41 C ATOM 2744 H VAL A 290 -1.620 35.738 45.426 1.00 0.00 H ATOM 2745 N LYS A 291 0.867 35.258 48.638 1.00 26.14 N ATOM 2746 CA LYS A 291 0.944 35.952 49.920 1.00 30.86 C ATOM 2747 C LYS A 291 2.108 36.931 50.014 1.00 28.46 C ATOM 2748 O LYS A 291 1.992 37.981 50.642 1.00 25.42 O ATOM 2749 CB LYS A 291 1.050 34.944 51.071 1.00 33.56 C ATOM 2750 CG LYS A 291 -0.284 34.401 51.556 1.00 41.67 C ATOM 2751 CD LYS A 291 -0.112 33.534 52.803 1.00 47.47 C ATOM 2752 CE LYS A 291 0.766 32.317 52.524 1.00 47.08 C ATOM 2753 NZ LYS A 291 0.179 31.396 51.509 1.00 44.47 N ATOM 2754 HZ1 LYS A 291 -0.742 31.051 51.847 1.00 0.00 H ATOM 2755 HZ2 LYS A 291 0.051 31.907 50.612 1.00 0.00 H ATOM 2756 HZ3 LYS A 291 0.820 30.590 51.362 1.00 0.00 H ATOM 2757 H LYS A 291 1.198 34.274 48.572 1.00 0.00 H ATOM 2758 N ASN A 292 3.236 36.580 49.411 1.00 27.76 N ATOM 2759 CA ASN A 292 4.436 37.391 49.564 1.00 28.24 C ATOM 2760 C ASN A 292 5.072 37.731 48.231 1.00 25.60 C ATOM 2761 O ASN A 292 5.098 36.897 47.325 1.00 24.39 O ATOM 2762 CB ASN A 292 5.448 36.665 50.457 1.00 26.07 C ATOM 2763 CG ASN A 292 5.055 36.689 51.921 1.00 27.01 C ATOM 2764 OD1 ASN A 292 4.649 37.725 52.446 1.00 28.41 O ATOM 2765 ND2 ASN A 292 5.173 35.545 52.587 1.00 24.42 N ATOM 2766 HD22 ASN A 292 5.521 34.694 52.101 1.00 0.00 H ATOM 2767 HD21 ASN A 292 4.917 35.501 53.594 1.00 0.00 H ATOM 2768 H ASN A 292 3.264 35.721 48.826 1.00 0.00 H ATOM 2769 N LEU A 293 5.578 38.957 48.126 1.00 25.45 N ATOM 2770 CA LEU A 293 6.279 39.424 46.935 1.00 24.32 C ATOM 2771 C LEU A 293 7.687 39.859 47.319 1.00 26.53 C ATOM 2772 O LEU A 293 7.955 40.131 48.490 1.00 28.94 O ATOM 2773 CB LEU A 293 5.532 40.588 46.278 1.00 24.31 C ATOM 2774 CG LEU A 293 4.136 40.312 45.719 1.00 25.13 C ATOM 2775 CD1 LEU A 293 3.477 41.608 45.266 1.00 23.42 C ATOM 2776 CD2 LEU A 293 4.204 39.313 44.575 1.00 22.25 C ATOM 2777 H LEU A 293 5.469 39.611 48.928 1.00 0.00 H ATOM 2778 N GLN A 294 8.587 39.922 46.342 1.00 25.42 N ATOM 2779 CA GLN A 294 9.943 40.392 46.601 1.00 30.31 C ATOM 2780 C GLN A 294 10.528 41.094 45.387 1.00 32.54 C ATOM 2781 O GLN A 294 10.497 40.561 44.275 1.00 27.96 O ATOM 2782 CB GLN A 294 10.848 39.231 47.015 1.00 33.69 C ATOM 2783 CG GLN A 294 12.277 39.654 47.321 1.00 45.71 C ATOM 2784 CD GLN A 294 13.112 38.517 47.884 1.00 52.62 C ATOM 2785 OE1 GLN A 294 13.099 37.402 47.359 1.00 53.60 O ATOM 2786 NE2 GLN A 294 13.840 38.793 48.961 1.00 56.10 N ATOM 2787 HE22 GLN A 294 13.821 39.749 49.371 1.00 0.00 H ATOM 2788 HE21 GLN A 294 14.429 38.053 49.394 1.00 0.00 H ATOM 2789 H GLN A 294 8.320 39.632 45.380 1.00 0.00 H ATOM 2790 N PHE A 295 11.060 42.291 45.602 1.00 39.93 N ATOM 2791 CA PHE A 295 11.737 43.015 44.538 1.00 49.12 C ATOM 2792 C PHE A 295 13.232 42.730 44.597 1.00 59.77 C ATOM 2793 O PHE A 295 13.742 42.295 45.634 1.00 61.41 O ATOM 2794 CB PHE A 295 11.476 44.517 44.652 1.00 51.64 C ATOM 2795 CG PHE A 295 10.021 44.874 44.755 1.00 52.34 C ATOM 2796 CD1 PHE A 295 9.243 45.007 43.615 1.00 52.39 C ATOM 2797 CD2 PHE A 295 9.435 45.093 45.991 1.00 54.72 C ATOM 2798 CE1 PHE A 295 7.905 45.341 43.708 1.00 52.05 C ATOM 2799 CE2 PHE A 295 8.099 45.425 46.092 1.00 55.24 C ATOM 2800 CZ PHE A 295 7.334 45.551 44.949 1.00 53.36 C ATOM 2801 H PHE A 295 10.991 42.718 46.548 1.00 0.00 H ATOM 2802 N GLU A 296 13.922 42.955 43.480 1.00 68.94 N ATOM 2803 CA GLU A 296 15.379 42.901 43.446 1.00 79.86 C ATOM 2804 C GLU A 296 15.933 43.779 44.556 1.00 90.76 C ATOM 2805 O GLU A 296 15.526 44.934 44.690 1.00 92.39 O ATOM 2806 CB GLU A 296 15.913 43.374 42.095 1.00 81.73 C ATOM 2807 CG GLU A 296 15.199 42.789 40.892 1.00 80.50 C ATOM 2808 CD GLU A 296 15.337 43.661 39.659 1.00 82.35 C ATOM 2809 OE1 GLU A 296 14.488 44.559 39.470 1.00 81.12 O ATOM 2810 OE2 GLU A 296 16.290 43.449 38.879 1.00 84.73 O ATOM 2811 H GLU A 296 13.406 43.176 42.605 1.00 0.00 H ATOM 2812 N ASP A 297 16.851 43.231 45.347 1.00 99.90 N ATOM 2813 CA ASP A 297 17.401 43.931 46.507 1.00106.32 C ATOM 2814 C ASP A 297 16.306 44.461 47.427 1.00100.94 C ATOM 2815 O ASP A 297 16.062 45.667 47.496 1.00103.56 O ATOM 2816 CB ASP A 297 18.309 45.080 46.064 1.00117.97 C ATOM 2817 CG ASP A 297 19.553 44.595 45.353 1.00126.13 C ATOM 2818 OD1 ASP A 297 20.615 44.504 46.005 1.00131.49 O ATOM 2819 OD2 ASP A 297 19.468 44.298 44.142 1.00126.31 O ATOM 2820 H ASP A 297 17.189 42.271 45.133 1.00 0.00 H ATOM 2821 N GLY A 298 15.649 43.550 48.132 1.00 90.80 N ATOM 2822 CA GLY A 298 14.607 43.922 49.065 1.00 84.38 C ATOM 2823 C GLY A 298 14.177 42.717 49.869 1.00 77.25 C ATOM 2824 O GLY A 298 14.365 41.576 49.442 1.00 75.85 O ATOM 2825 H GLY A 298 15.888 42.545 48.012 1.00 0.00 H ATOM 2826 N LYS A 299 13.616 42.964 51.045 1.00 72.58 N ATOM 2827 CA LYS A 299 13.048 41.890 51.841 1.00 66.84 C ATOM 2828 C LYS A 299 11.667 41.580 51.277 1.00 58.36 C ATOM 2829 O LYS A 299 11.117 42.373 50.507 1.00 55.58 O ATOM 2830 CB LYS A 299 12.978 42.284 53.321 1.00 69.68 C ATOM 2831 CG LYS A 299 12.957 41.102 54.291 1.00 69.20 C ATOM 2832 CD LYS A 299 13.113 41.555 55.745 1.00 71.12 C ATOM 2833 CE LYS A 299 14.464 42.217 55.994 1.00 75.39 C ATOM 2834 NZ LYS A 299 15.598 41.293 55.723 1.00 77.19 N ATOM 2835 HZ1 LYS A 299 15.524 40.463 56.345 1.00 0.00 H ATOM 2836 HZ2 LYS A 299 15.565 40.987 54.730 1.00 0.00 H ATOM 2837 HZ3 LYS A 299 16.496 41.785 55.905 1.00 0.00 H ATOM 2838 H LYS A 299 13.582 43.940 51.402 1.00 0.00 H ATOM 2839 N MET A 300 11.111 40.425 51.629 1.00 52.23 N ATOM 2840 CA MET A 300 9.753 40.105 51.208 1.00 46.53 C ATOM 2841 C MET A 300 8.764 41.110 51.788 1.00 45.23 C ATOM 2842 O MET A 300 8.939 41.592 52.907 1.00 47.32 O ATOM 2843 CB MET A 300 9.358 38.692 51.632 1.00 43.53 C ATOM 2844 CG MET A 300 9.841 37.587 50.710 1.00 40.78 C ATOM 2845 SD MET A 300 9.029 36.027 51.108 1.00 68.32 S ATOM 2846 CE MET A 300 9.011 36.126 52.896 1.00 85.72 C ATOM 2847 H MET A 300 11.647 39.747 52.207 1.00 0.00 H ATOM 2848 N ILE A 301 7.744 41.447 51.007 1.00 38.76 N ATOM 2849 CA ILE A 301 6.629 42.242 51.500 1.00 37.72 C ATOM 2850 C ILE A 301 5.340 41.494 51.185 1.00 36.30 C ATOM 2851 O ILE A 301 5.275 40.752 50.201 1.00 35.93 O ATOM 2852 CB ILE A 301 6.590 43.652 50.877 1.00 39.39 C ATOM 2853 CG1 ILE A 301 6.343 43.571 49.372 1.00 38.57 C ATOM 2854 CG2 ILE A 301 7.876 44.406 51.179 1.00 41.75 C ATOM 2855 CD1 ILE A 301 5.207 44.457 48.896 1.00 41.55 C ATOM 2856 H ILE A 301 7.742 41.134 50.015 1.00 0.00 H ATOM 2857 N PRO A 302 4.312 41.669 52.026 1.00 36.70 N ATOM 2858 CA PRO A 302 3.027 41.026 51.738 1.00 33.80 C ATOM 2859 C PRO A 302 2.462 41.523 50.418 1.00 30.39 C ATOM 2860 O PRO A 302 2.645 42.701 50.096 1.00 31.06 O ATOM 2861 CB PRO A 302 2.142 41.464 52.908 1.00 37.05 C ATOM 2862 CG PRO A 302 3.102 41.814 54.000 1.00 41.58 C ATOM 2863 CD PRO A 302 4.295 42.394 53.308 1.00 41.54 C ATOM 2864 N GLY A 303 1.799 40.648 49.668 1.00 26.45 N ATOM 2865 CA GLY A 303 1.171 41.047 48.421 1.00 28.41 C ATOM 2866 C GLY A 303 0.137 42.138 48.627 1.00 31.03 C ATOM 2867 O GLY A 303 -0.132 42.925 47.722 1.00 33.14 O ATOM 2868 H GLY A 303 1.729 39.659 49.981 1.00 0.00 H ATOM 2869 N SER A 304 -0.431 42.195 49.830 1.00 30.45 N ATOM 2870 CA SER A 304 -1.428 43.204 50.164 1.00 30.36 C ATOM 2871 C SER A 304 -0.826 44.599 50.167 1.00 31.60 C ATOM 2872 O SER A 304 -1.537 45.599 50.056 1.00 30.02 O ATOM 2873 CB SER A 304 -2.037 42.907 51.537 1.00 34.48 C ATOM 2874 OG SER A 304 -1.044 42.964 52.543 1.00 28.64 O ATOM 2875 HG SER A 304 -1.455 42.770 53.422 1.00 0.00 H ATOM 2876 H SER A 304 -0.155 41.499 50.552 1.00 0.00 H ATOM 2877 N GLN A 305 0.491 44.658 50.326 1.00 27.81 N ATOM 2878 CA GLN A 305 1.174 45.927 50.526 1.00 31.90 C ATOM 2879 C GLN A 305 1.831 46.464 49.258 1.00 34.77 C ATOM 2880 O GLN A 305 2.575 47.448 49.327 1.00 36.11 O ATOM 2881 CB GLN A 305 2.229 45.778 51.631 1.00 31.77 C ATOM 2882 CG GLN A 305 1.656 45.347 52.976 1.00 34.70 C ATOM 2883 CD GLN A 305 0.552 46.274 53.457 1.00 37.76 C ATOM 2884 OE1 GLN A 305 0.791 47.447 53.752 1.00 38.48 O ATOM 2885 NE2 GLN A 305 -0.670 45.752 53.526 1.00 39.08 N ATOM 2886 HE22 GLN A 305 -0.826 44.757 53.267 1.00 0.00 H ATOM 2887 HE21 GLN A 305 -1.469 46.339 53.839 1.00 0.00 H ATOM 2888 H GLN A 305 1.046 43.779 50.307 1.00 0.00 H ATOM 2889 N TYR A 306 1.551 45.835 48.113 1.00 34.25 N ATOM 2890 CA TYR A 306 2.226 46.189 46.859 1.00 33.85 C ATOM 2891 C TYR A 306 2.202 47.688 46.559 1.00 37.02 C ATOM 2892 O TYR A 306 3.224 48.259 46.173 1.00 39.27 O ATOM 2893 CB TYR A 306 1.622 45.441 45.662 1.00 32.57 C ATOM 2894 CG TYR A 306 2.301 45.809 44.354 1.00 34.32 C ATOM 2895 CD1 TYR A 306 3.450 45.149 43.939 1.00 33.73 C ATOM 2896 CD2 TYR A 306 1.808 46.834 43.552 1.00 37.76 C ATOM 2897 CE1 TYR A 306 4.082 45.488 42.757 1.00 35.25 C ATOM 2898 CE2 TYR A 306 2.435 47.186 42.373 1.00 39.59 C ATOM 2899 CZ TYR A 306 3.569 46.508 41.981 1.00 38.95 C ATOM 2900 OH TYR A 306 4.193 46.859 40.807 1.00 40.07 O ATOM 2901 HH TYR A 306 4.985 46.282 40.670 1.00 0.00 H ATOM 2902 H TYR A 306 0.839 45.077 48.110 1.00 0.00 H ATOM 2903 N PHE A 307 1.044 48.322 46.716 1.00 37.63 N ATOM 2904 CA PHE A 307 0.922 49.743 46.404 1.00 42.10 C ATOM 2905 C PHE A 307 1.425 50.650 47.525 1.00 49.05 C ATOM 2906 O PHE A 307 1.818 51.790 47.275 1.00 53.69 O ATOM 2907 CB PHE A 307 -0.530 50.102 46.087 1.00 43.87 C ATOM 2908 CG PHE A 307 -0.998 49.632 44.738 1.00 41.86 C ATOM 2909 CD1 PHE A 307 -2.084 48.778 44.629 1.00 42.13 C ATOM 2910 CD2 PHE A 307 -0.358 50.051 43.580 1.00 40.13 C ATOM 2911 CE1 PHE A 307 -2.526 48.346 43.390 1.00 41.12 C ATOM 2912 CE2 PHE A 307 -0.793 49.623 42.337 1.00 40.67 C ATOM 2913 CZ PHE A 307 -1.878 48.767 42.242 1.00 40.85 C ATOM 2914 H PHE A 307 0.215 47.800 47.065 1.00 0.00 H ATOM 2915 N LYS A 308 1.403 50.153 48.758 1.00 52.57 N ATOM 2916 CA LYS A 308 1.726 50.985 49.917 1.00 61.75 C ATOM 2917 C LYS A 308 3.232 51.218 50.072 1.00 65.18 C ATOM 2918 O LYS A 308 4.043 50.318 49.838 1.00 65.43 O ATOM 2919 CB LYS A 308 1.160 50.354 51.192 1.00 63.75 C ATOM 2920 CG LYS A 308 1.084 51.319 52.365 1.00 69.28 C ATOM 2921 CD LYS A 308 0.742 50.597 53.656 1.00 69.40 C ATOM 2922 CE LYS A 308 0.772 51.554 54.835 1.00 72.83 C ATOM 2923 NZ LYS A 308 1.064 50.845 56.111 1.00 71.80 N ATOM 2924 HZ1 LYS A 308 0.328 50.131 56.286 1.00 0.00 H ATOM 2925 HZ2 LYS A 308 1.991 50.379 56.043 1.00 0.00 H ATOM 2926 HZ3 LYS A 308 1.076 51.531 56.892 1.00 0.00 H ATOM 2927 H LYS A 308 1.151 49.154 48.901 1.00 0.00 H TER 2928 LYS A 308 HETATM 2929 O HOH 1 13.379 -1.140 51.601 1.00 4.56 O HETATM 2930 O HOH 2 24.199 6.891 38.837 1.00 17.80 O HETATM 2931 O HOH 3 6.779 12.301 41.464 1.00 11.68 O HETATM 2932 O HOH 4 14.264 16.816 38.022 1.00 16.86 O HETATM 2933 O HOH 5 16.069 18.801 38.096 1.00 17.83 O HETATM 2934 O HOH 6 0.608 18.155 43.320 1.00 21.99 O HETATM 2935 O HOH 7 19.629 20.698 53.875 1.00 19.50 O HETATM 2936 O HOH 8 14.558 -2.354 48.743 1.00 15.00 O HETATM 2937 O HOH 9 -2.879 34.720 33.127 1.00 20.22 O HETATM 2938 O HOH 10 8.470 30.935 43.537 1.00 16.41 O HETATM 2939 O HOH 11 20.953 12.361 43.036 1.00 18.18 O HETATM 2940 O HOH 12 4.819 39.899 33.713 1.00 27.61 O HETATM 2941 O HOH 13 19.815 1.475 37.174 1.00 15.06 O HETATM 2942 O HOH 14 19.421 18.731 36.734 1.00 22.83 O HETATM 2943 O HOH 15 2.342 27.130 48.461 1.00 19.82 O HETATM 2944 O HOH 16 28.440 2.416 43.750 1.00 17.96 O HETATM 2945 O HOH 17 7.341 4.608 44.083 1.00 27.50 O HETATM 2946 O HOH 18 9.229 12.123 42.662 1.00 19.74 O HETATM 2947 O HOH 19 10.035 3.848 40.996 1.00 24.64 O HETATM 2948 O HOH 20 -7.255 37.136 28.369 1.00 19.23 O HETATM 2949 O HOH 21 4.386 9.048 53.354 1.00 23.96 O HETATM 2950 O HOH 22 -6.647 26.070 36.956 1.00 22.88 O HETATM 2951 O HOH 23 -1.369 17.693 45.726 1.00 27.15 O HETATM 2952 O HOH 24 7.388 38.963 32.885 1.00 24.87 O HETATM 2953 O HOH 25 38.639 6.384 50.892 1.00 28.75 O HETATM 2954 O HOH 26 20.156 32.576 36.835 1.00 36.57 O HETATM 2955 O HOH 27 17.627 -5.419 38.858 1.00 19.87 O HETATM 2956 O HOH 28 8.531 7.071 39.833 1.00 21.95 O HETATM 2957 O HOH 29 6.244 21.229 56.064 1.00 27.40 O HETATM 2958 O HOH 30 14.860 12.058 60.652 1.00 25.83 O HETATM 2959 O HOH 31 37.138 -0.570 51.177 1.00 30.43 O HETATM 2960 O HOH 32 4.168 28.805 46.886 1.00 29.09 O HETATM 2961 O HOH 33 9.876 14.087 44.961 1.00 23.94 O HETATM 2962 O HOH 34 30.685 6.194 65.531 1.00 37.07 O HETATM 2963 O HOH 35 20.237 -5.306 39.141 1.00 39.22 O HETATM 2964 O HOH 36 24.435 0.666 36.654 1.00 30.29 O HETATM 2965 O HOH 37 21.760 7.456 64.815 1.00 32.55 O HETATM 2966 O HOH 38 11.236 43.389 48.259 1.00 33.09 O HETATM 2967 O HOH 39 -8.048 28.349 41.368 1.00 30.35 O HETATM 2968 O HOH 40 5.941 27.738 32.622 1.00 31.42 O HETATM 2969 O HOH 41 23.841 5.468 32.540 1.00 32.06 O HETATM 2970 O HOH 42 -2.853 43.156 33.215 1.00 32.44 O HETATM 2971 O HOH 43 30.931 1.179 42.668 1.00 28.66 O HETATM 2972 O HOH 44 14.562 20.310 31.790 1.00 26.51 O HETATM 2973 O HOH 45 -1.341 19.180 41.540 1.00 40.31 O HETATM 2974 O HOH 46 -1.143 47.682 48.656 1.00 34.26 O HETATM 2975 O HOH 47 -3.778 33.785 28.100 1.00 22.78 O HETATM 2976 O HOH 48 12.290 6.941 55.704 1.00 20.79 O HETATM 2977 O HOH 49 34.495 18.240 39.377 1.00 32.82 O HETATM 2978 O HOH 50 2.044 29.172 27.460 1.00 26.79 O HETATM 2979 O HOH 51 28.317 3.574 30.532 1.00 27.76 O HETATM 2980 O HOH 52 43.981 12.245 52.837 1.00 39.68 O HETATM 2981 O HOH 53 11.004 15.931 31.786 1.00 36.14 O HETATM 2982 O HOH 54 32.589 -0.678 44.183 1.00 29.47 O HETATM 2983 O HOH 55 15.201 39.154 40.695 1.00 37.88 O HETATM 2984 O HOH 56 26.482 -0.320 38.480 1.00 40.14 O HETATM 2985 O HOH 57 10.852 29.765 32.542 1.00 34.02 O HETATM 2986 O HOH 58 3.753 24.451 36.212 1.00 29.60 O HETATM 2987 O HOH 59 12.831 39.561 42.399 1.00 39.24 O HETATM 2988 O HOH 60 8.751 3.990 36.451 1.00 18.15 O HETATM 2989 O HOH 61 2.207 14.738 37.152 1.00 29.93 O HETATM 2990 O HOH 62 3.972 35.073 30.252 1.00 34.94 O HETATM 2991 O HOH 63 21.920 -0.381 36.575 1.00 30.51 O HETATM 2992 O HOH 64 19.893 3.572 34.343 1.00 28.30 O HETATM 2993 O HOH 65 15.934 3.953 33.269 1.00 29.35 O HETATM 2994 O HOH 66 16.899 5.867 61.686 1.00 41.47 O HETATM 2995 O HOH 67 1.349 21.933 36.109 1.00 31.87 O HETATM 2996 O HOH 68 32.672 24.756 53.998 1.00 39.82 O HETATM 2997 O HOH 69 -2.302 21.989 43.086 1.00 37.55 O HETATM 2998 O HOH 70 28.047 1.392 40.037 1.00 35.30 O HETATM 2999 O HOH 71 -7.798 25.925 39.585 1.00 44.05 O HETATM 3000 O HOH 72 5.523 29.385 34.358 1.00 29.63 O HETATM 3001 O HOH 73 7.671 9.562 34.852 1.00 28.59 O HETATM 3002 O HOH 74 7.693 28.507 53.015 1.00 35.06 O HETATM 3003 O HOH 75 0.941 12.674 39.716 1.00 30.35 O HETATM 3004 O HOH 76 4.171 5.910 42.746 1.00 47.08 O HETATM 3005 O HOH 77 -2.285 36.834 27.923 1.00 38.89 O HETATM 3006 O HOH 78 38.878 10.367 35.265 1.00 45.56 O HETATM 3007 O HOH 79 2.851 46.666 35.499 1.00 47.29 O HETATM 3008 O HOH 80 -4.246 45.886 50.600 1.00 37.01 O HETATM 3009 O HOH 81 28.781 18.616 47.199 1.00 40.31 O HETATM 3010 O HOH 82 40.524 8.953 58.668 1.00 41.12 O HETATM 3011 O HOH 83 2.473 11.166 41.169 1.00 35.01 O HETATM 3012 O HOH 84 13.928 3.443 60.012 1.00 50.30 O HETATM 3013 O HOH 85 9.488 19.565 31.835 1.00 40.57 O HETATM 3014 O HOH 86 19.327 31.247 40.614 1.00 41.67 O HETATM 3015 O HOH 87 16.360 4.459 59.895 1.00 31.47 O HETATM 3016 O HOH 88 23.265 3.121 34.188 1.00 48.57 O HETATM 3017 O HOH 89 -6.036 26.176 48.128 1.00 34.29 O HETATM 3018 O HOH 90 12.399 12.377 62.117 1.00 39.02 O HETATM 3019 O HOH 91 37.473 26.302 51.582 1.00 44.01 O HETATM 3020 O HOH 92 32.815 16.336 38.800 1.00 41.03 O HETATM 3021 O HOH 93 38.159 24.914 49.505 1.00 44.82 O HETATM 3022 O HOH 94 30.529 26.862 52.322 1.00 42.99 O HETATM 3023 O HOH 95 26.554 -5.459 51.329 1.00 45.85 O HETATM 3024 O HOH 96 6.737 20.104 58.503 1.00 45.96 O HETATM 3025 O HOH 97 12.659 18.878 59.006 1.00 42.97 O HETATM 3026 O HOH 98 17.855 8.117 61.752 1.00 38.82 O HETATM 3027 O HOH 99 29.285 20.440 35.314 1.00 42.60 O HETATM 3028 O HOH 100 7.561 15.607 59.598 1.00 41.87 O HETATM 3029 O HOH 101 16.818 36.335 36.154 1.00 38.79 O HETATM 3030 O HOH 102 33.719 8.314 63.507 1.00 27.16 O HETATM 3031 O HOH 103 -9.577 36.443 29.219 1.00 30.67 O HETATM 3032 O HOH 104 13.202 13.712 30.234 1.00 29.09 O HETATM 3033 O HOH 105 -8.131 37.763 48.789 1.00 35.19 O HETATM 3034 O HOH 106 22.084 11.119 66.321 1.00 43.15 O HETATM 3035 O HOH 107 16.430 5.780 31.009 1.00 32.50 O HETATM 3036 O HOH 108 3.962 20.543 55.746 1.00 31.74 O HETATM 3037 O HOH 109 5.776 33.072 51.592 1.00 41.00 O HETATM 3038 O HOH 110 6.255 36.528 32.068 1.00 36.08 O HETATM 3039 O HOH 111 -6.081 46.344 48.576 1.00 40.18 O HETATM 3040 O HOH 112 2.260 6.172 48.597 1.00 50.74 O HETATM 3041 O HOH 113 6.414 39.717 53.768 1.00 35.04 O HETATM 3042 O HOH 114 31.006 18.280 45.438 1.00 43.81 O HETATM 3043 O HOH 115 15.131 38.117 37.729 1.00 42.04 O HETATM 3044 O HOH 116 4.945 9.620 56.079 1.00 44.47 O HETATM 3045 O HOH 117 33.108 7.787 65.821 1.00 33.26 O HETATM 3046 O HOH 118 23.176 2.606 59.810 1.00 29.66 O HETATM 3047 O HOH 119 1.655 36.656 27.457 1.00 37.63 O HETATM 3048 O HOH 120 8.817 2.916 38.883 1.00 20.30 O HETATM 3049 O HOH 121 34.290 8.881 35.877 1.00 29.26 O HETATM 3050 O HOH 122 17.586 16.689 43.011 1.00 18.02 O HETATM 3051 O HOH 123 -8.564 35.258 32.516 1.00 35.65 O HETATM 3052 O HOH 124 29.235 2.151 36.386 1.00 37.46 O HETATM 3053 O HOH 125 2.209 5.025 44.114 1.00 40.07 O HETATM 3054 O HOH 126 10.281 28.776 54.373 1.00 46.46 O HETATM 3055 O HOH 127 -2.489 23.119 32.225 1.00 34.20 O HETATM 3056 O HOH 128 41.220 6.352 57.600 1.00 42.12 O HETATM 3057 O HOH 129 -3.626 38.410 36.891 1.00 30.68 O HETATM 3058 O HOH 130 20.358 15.521 42.608 1.00 39.26 O HETATM 3059 O HOH 131 6.951 34.419 29.988 1.00 43.96 O HETATM 3060 O HOH 132 -2.097 36.847 36.034 1.00 45.31 O HETATM 3061 O HOH 133 39.345 2.052 51.222 1.00 45.71 O HETATM 3062 O HOH 134 36.021 11.303 35.093 1.00 44.08 O HETATM 3063 O HOH 135 -3.176 23.339 34.489 1.00 33.82 O HETATM 3064 O HOH 136 -10.667 42.507 48.372 1.00 47.76 O HETATM 3065 O HOH 137 -2.330 48.165 54.133 1.00 47.86 O HETATM 3066 O HOH 138 30.517 0.833 38.906 1.00 45.31 O HETATM 3067 O HOH 139 -9.443 25.259 34.433 1.00 39.35 O HETATM 3068 O HOH 140 18.521 23.422 42.841 1.00 47.78 O HETATM 3069 O HOH 141 5.848 7.873 40.268 1.00 42.25 O HETATM 3070 O HOH 142 -8.561 35.283 50.057 1.00 39.37 O HETATM 3071 O HOH 143 13.946 36.920 45.312 1.00 41.48 O HETATM 3072 O HOH 144 15.367 35.219 44.773 1.00 38.51 O HETATM 3073 O HOH 145 28.506 21.738 33.230 1.00 48.06 O HETATM 3074 O HOH 146 8.600 6.349 29.786 1.00 39.89 O HETATM 3075 O HOH 147 27.913 -0.041 43.380 1.00 45.16 O HETATM 3076 O HOH 148 30.266 1.977 68.242 1.00 46.94 O HETATM 3077 O HOH 149 -0.575 7.971 51.740 1.00 47.84 O HETATM 3078 O HOH 150 -5.868 22.834 34.449 1.00 43.18 O HETATM 3079 O HOH 151 21.104 20.590 34.818 1.00 34.47 O HETATM 3080 O HOH 152 39.075 0.079 49.269 1.00 44.61 O HETATM 3081 O HOH 153 4.840 27.404 29.883 1.00 44.49 O HETATM 3082 O HOH 154 5.993 45.894 29.702 1.00 50.61 O HETATM 3083 O HOH 155 11.865 17.368 61.295 1.00 46.72 O HETATM 3084 O HOH 156 40.606 9.927 61.023 1.00 45.02 O HETATM 3085 O HOH 157 6.944 10.107 31.996 1.00 40.30 O HETATM 3086 O HOH 158 17.238 33.001 43.509 1.00 40.33 O HETATM 3087 O HOH 159 3.189 13.947 52.729 1.00 42.36 O HETATM 3088 O HOH 160 12.033 23.702 54.484 1.00 49.13 O HETATM 3089 O HOH 161 26.970 10.492 71.082 1.00 29.17 O HETATM 3090 O HOH 162 4.380 13.505 54.823 1.00 38.89 O HETATM 3091 O HOH 163 14.287 32.977 46.664 1.00 36.58 O HETATM 3092 O HOH 164 3.347 32.404 26.776 1.00 27.40 O HETATM 3093 O HOH 165 -7.796 43.211 32.961 1.00 50.49 O HETATM 3094 O HOH 166 9.652 15.499 61.488 1.00 45.96 O HETATM 3095 O HOH 167 38.227 21.370 59.088 1.00 45.99 O HETATM 3096 O HOH 168 36.602 23.031 58.531 1.00 55.65 O HETATM 3097 O HOH 169 13.201 26.108 34.097 1.00 28.81 O HETATM 3098 O HOH 170 25.008 -2.751 40.311 1.00 46.00 O HETATM 3099 O HOH 171 16.067 10.219 62.429 1.00 44.86 O HETATM 3100 O HOH 172 -0.204 42.999 28.607 1.00 48.74 O HETATM 3101 O HOH 173 36.284 2.637 38.284 1.00 44.31 O HETATM 3102 O HOH 174 14.419 16.010 61.229 1.00 53.21 O HETATM 3103 O HOH 175 22.291 17.192 44.102 1.00 40.16 O HETATM 3104 O HOH 176 15.477 19.613 44.221 1.00 45.26 O HETATM 3105 O HOH 177 46.275 15.589 38.081 1.00 47.90 O HETATM 3106 O HOH 178 -12.104 23.819 44.956 1.00 45.73 O HETATM 3107 O HOH 179 24.231 20.875 41.658 1.00 50.99 O HETATM 3108 O HOH 180 -1.931 21.928 50.594 1.00 36.93 O HETATM 3109 O HOH 181 23.865 13.558 46.561 1.00 31.41 O HETATM 3110 O HOH 182 14.358 39.880 44.319 1.00 43.87 O HETATM 3111 O HOH 183 2.389 24.827 52.208 1.00 44.39 O HETATM 3112 O HOH 184 39.882 0.814 55.493 1.00 50.73 O HETATM 3113 O HOH 185 43.979 12.087 55.689 1.00 56.58 O HETATM 3114 O HOH 186 2.357 11.103 52.670 1.00 47.57 O HETATM 3115 O HOH 187 7.097 30.766 50.767 1.00 40.18 O HETATM 3116 O HOH 188 26.316 26.628 60.280 1.00 45.64 O HETATM 3117 O HOH 189 16.924 40.949 47.500 1.00 51.06 O HETATM 3118 O HOH 190 7.236 46.485 40.869 1.00 51.69 O HETATM 3119 O HOH 191 37.585 -5.652 54.653 1.00 49.04 O HETATM 3120 O HOH 192 47.254 12.911 30.299 1.00 57.45 O HETATM 3121 O HOH 193 4.987 15.164 33.542 1.00 45.04 O HETATM 3122 O HOH 194 39.645 26.257 47.802 1.00 39.83 O HETATM 3123 O HOH 195 36.543 -1.974 45.434 1.00 44.13 O HETATM 3124 O HOH 196 -1.525 32.064 49.544 1.00 28.87 O HETATM 3125 O HOH 197 -3.074 42.636 28.427 1.00 32.13 O HETATM 3126 O HOH 198 -9.022 43.482 49.927 1.00 40.38 O HETATM 3127 O HOH 199 -11.002 36.487 32.999 1.00 44.34 O HETATM 3128 O HOH 200 4.414 26.565 53.025 1.00 48.25 O HETATM 3129 O HOH 201 1.065 48.221 36.553 1.00 46.18 O HETATM 3130 O HOH 202 -3.783 24.663 51.999 1.00 49.28 O HETATM 3131 O HOH 203 6.807 13.915 32.235 1.00 47.53 O HETATM 3132 O HOH 204 -4.992 18.148 39.548 1.00 48.11 O HETATM 3133 O HOH 205 -2.022 14.519 48.491 1.00 53.90 O HETATM 3134 N3 THG A 206 26.819 9.392 39.647 1.00 -0.20 N HETATM 3135 C2 THG A 206 28.023 9.821 40.086 1.00 0.30 C HETATM 3136 N1 THG A 206 28.167 10.921 40.877 1.00 -0.27 N HETATM 3137 C8A THG A 206 27.101 11.610 41.244 1.00 0.17 C HETATM 3138 C4A THG A 206 25.840 11.213 40.808 1.00 0.15 C HETATM 3139 C4 THG A 206 25.765 10.101 40.023 1.00 0.25 C HETATM 3140 O4 THG A 206 24.664 9.731 39.633 1.00 -0.39 O HETATM 3141 N5 THG A 206 24.695 11.984 41.206 1.00 0.27 N HETATM 3142 C6 THG A 206 25.023 13.309 41.696 1.00 0.02 C HETATM 3143 C7 THG A 206 26.075 13.128 42.736 1.00 0.08 C HETATM 3144 N8 THG A 206 27.239 12.764 42.052 1.00 -0.28 N HETATM 3145 H3 THG A 206 28.121 13.290 42.129 1.00 0.19 H HETATM 3146 H4 THG A 206 26.233 14.067 43.286 1.00 0.06 H HETATM 3147 H5 THG A 206 25.783 12.335 43.441 1.00 0.06 H HETATM 3148 C9 THG A 206 23.817 13.985 42.315 1.00 0.07 C HETATM 3149 N10 THG A 206 22.820 14.346 41.294 1.00 -0.31 N HETATM 3150 C4' THG A 206 23.040 15.483 40.386 1.00 0.04 C HETATM 3151 C3' THG A 206 24.086 16.414 40.634 1.00 -0.04 C HETATM 3152 C2' THG A 206 24.279 17.490 39.767 1.00 -0.05 C HETATM 3153 C1' THG A 206 23.427 17.640 38.643 1.00 0.04 C HETATM 3154 C6' THG A 206 22.400 16.730 38.407 1.00 -0.05 C HETATM 3155 C5' THG A 206 22.203 15.644 39.285 1.00 -0.04 C HETATM 3156 H15 THG A 206 21.402 14.937 39.103 1.00 0.05 H HETATM 3157 H14 THG A 206 21.751 16.856 37.548 1.00 0.06 H HETATM 3158 C11 THG A 206 23.643 18.845 37.681 1.00 0.20 C HETATM 3159 N THG A 206 24.456 19.897 38.096 1.00 -0.27 N HETATM 3160 CA THG A 206 24.665 21.009 37.239 1.00 0.10 C HETATM 3161 C THG A 206 25.911 20.761 36.411 1.00 0.06 C HETATM 3162 OX2 THG A 206 26.922 20.188 36.921 1.00 -0.57 O HETATM 3163 OX1 THG A 206 25.926 21.127 35.197 1.00 -0.57 O HETATM 3164 CB THG A 206 24.842 22.240 38.093 1.00 -0.01 C HETATM 3165 CG THG A 206 24.590 23.498 37.256 1.00 0.00 C HETATM 3166 CD THG A 206 25.003 24.701 38.090 1.00 0.04 C HETATM 3167 OE1 THG A 206 25.034 24.608 39.345 1.00 -0.57 O HETATM 3168 OE2 THG A 206 25.318 25.782 37.516 1.00 -0.57 O HETATM 3169 H20 THG A 206 23.523 23.569 36.999 1.00 0.04 H HETATM 3170 H21 THG A 206 25.187 23.459 36.333 1.00 0.04 H HETATM 3171 H18 THG A 206 25.868 22.265 38.488 1.00 0.03 H HETATM 3172 H19 THG A 206 24.128 22.209 38.929 1.00 0.03 H HETATM 3173 H17 THG A 206 23.799 21.140 36.574 1.00 0.07 H HETATM 3174 H16 THG A 206 24.892 19.869 38.996 1.00 0.19 H HETATM 3175 O11 THG A 206 23.108 18.881 36.592 1.00 -0.39 O HETATM 3176 H13 THG A 206 25.073 18.205 39.951 1.00 0.06 H HETATM 3177 H12 THG A 206 24.732 16.288 41.495 1.00 0.05 H HETATM 3178 H11 THG A 206 21.954 13.794 41.214 1.00 0.18 H HETATM 3179 H9 THG A 206 24.145 14.898 42.833 1.00 0.06 H HETATM 3180 H10 THG A 206 23.355 13.299 43.039 1.00 0.06 H HETATM 3181 H6 THG A 206 25.404 13.929 40.871 1.00 0.09 H HETATM 3182 H7 THG A 206 24.214 11.485 41.938 1.00 0.21 H HETATM 3183 H8 THG A 206 24.085 12.082 40.409 1.00 0.21 H HETATM 3184 H2 THG A 206 25.937 11.838 39.908 1.00 0.14 H HETATM 3185 N2 THG A 206 29.171 9.099 39.714 1.00 -0.22 N HETATM 3186 H22 THG A 206 30.100 9.406 40.036 1.00 0.46 H HETATM 3187 H23 THG A 206 29.083 8.263 39.119 1.00 0.46 H HETATM 3188 H1 THG A 206 26.728 8.581 39.068 1.00 0.19 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 3134 3135 3139 3188 CONECT 3135 3134 3136 3185 CONECT 3136 3135 3137 CONECT 3137 3136 3138 3144 CONECT 3138 3137 3139 3141 3184 CONECT 3139 3134 3138 3140 CONECT 3140 3139 CONECT 3141 3138 3142 3182 3183 CONECT 3142 3141 3143 3148 3181 CONECT 3143 3142 3144 3146 3147 CONECT 3144 3137 3143 3145 CONECT 3145 3144 CONECT 3146 3143 CONECT 3147 3143 CONECT 3148 3142 3149 3179 3180 CONECT 3149 3148 3150 3178 CONECT 3150 3149 3151 3155 CONECT 3151 3150 3152 3177 CONECT 3152 3151 3153 3176 CONECT 3153 3152 3154 3158 CONECT 3154 3153 3155 3157 CONECT 3155 3150 3154 3156 CONECT 3156 3155 CONECT 3157 3154 CONECT 3158 3153 3159 3175 CONECT 3159 3158 3160 3174 CONECT 3160 3159 3161 3164 3173 CONECT 3161 3160 3162 3163 CONECT 3162 3161 CONECT 3163 3161 CONECT 3164 3160 3165 3171 3172 CONECT 3165 3164 3166 3169 3170 CONECT 3166 3165 3167 3168 CONECT 3167 3166 CONECT 3168 3166 CONECT 3169 3165 CONECT 3170 3165 CONECT 3171 3164 CONECT 3172 3164 CONECT 3173 3160 CONECT 3174 3159 CONECT 3175 3158 CONECT 3176 3152 CONECT 3177 3151 CONECT 3178 3149 CONECT 3179 3148 CONECT 3180 3148 CONECT 3181 3142 CONECT 3182 3141 CONECT 3183 3141 CONECT 3184 3138 CONECT 3185 3135 3186 3187 CONECT 3186 3185 CONECT 3187 3185 CONECT 3188 3134 MASTER 0 0 0 0 0 0 0 0 3187 1 59 24 END
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Structure:
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Related entries of code: 4qpd
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
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Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4qpd
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
hydrolase domain of 10-formyltetrahydrofolate dehydrogenase (wild-type)
Ligand Name
THG
EC.Number
E.C.1.5.1.6
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=15nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Acta Crystallogr.,Sect.D Vol. 71: pp. 1006-1021
Ligand Properties
Formula
C
1
9
H
2
5
N
7
O
6
Molecular Weight
447.445
Exact Mass
447.187
No. of atoms
57
No. of bonds
59
Polar Surface Area
213.79
LOGP Value
-0.37 (
Computed with XLOGP3
)
-0.55 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 13
No. of Rings: 3
Canonical SMILES
OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)NC[C@H]1CNC2=NC(=[NH+]C(=O)[C@H]2[NH2+]1)N
InChI String
InChI=1S/C19H23N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,11-12,14,21,23H,5-8H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)/p+2/t11-,12-,14-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
E3NZ06
Entrez Gene ID
NCBI Entrez Gene ID:
100526683
ASD
Information of known allosteric effects of PDB entries
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