Browse entries in the PDBbind-CN Database
HEADER 5VFN_COMPLEX COMPND 5VFN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 121 SER LEU PHE GLU LEU GLY LYS MET ILE LEU GLN GLU THR SEQRES 2 A 121 GLY LYS ASN PRO ALA LYS SER TYR GLY ALA TYR GLY CYS SEQRES 3 A 121 ASN CYS GLY VAL LEU GLY ARG GLY GLN PRO LYS ASP ALA SEQRES 4 A 121 THR ASP ARG CYS CYS TYR VAL HIS LYS CYS CYS TYR LYS SEQRES 5 A 121 LYS LEU THR GLY CYS ASP PRO LYS LYS ASP ARG TYR SER SEQRES 6 A 121 TYR SER TRP LYS ASP LYS THR ILE VAL CYS GLY GLU ASN SEQRES 7 A 121 ASN PRO CYS LEU LYS GLU LEU CYS GLU CYS ASP LYS ALA SEQRES 8 A 121 VAL ALA ILE CYS LEU ARG GLU ASN LEU GLY THR TYR ASN SEQRES 9 A 121 LYS LYS TYR ARG TYR HIS LEU LYS PRO PHE CYS LYS LYS SEQRES 10 A 121 ALA ASP PRO CYS SEQRES 1 B 121 SER LEU PHE GLU LEU GLY LYS MET ILE LEU GLN GLU THR SEQRES 2 B 121 GLY LYS ASN PRO ALA LYS SER TYR GLY ALA TYR GLY CYS SEQRES 3 B 121 ASN CYS GLY VAL LEU GLY ARG GLY GLN PRO LYS ASP ALA SEQRES 4 B 121 THR ASP ARG CYS CYS TYR VAL HIS LYS CYS CYS TYR LYS SEQRES 5 B 121 LYS LEU THR GLY CYS ASP PRO LYS LYS ASP ARG TYR SER SEQRES 6 B 121 TYR SER TRP LYS ASP LYS THR ILE VAL CYS GLY GLU ASN SEQRES 7 B 121 ASN PRO CYS LEU LYS GLU LEU CYS GLU CYS ASP LYS ALA SEQRES 8 B 121 VAL ALA ILE CYS LEU ARG GLU ASN LEU GLY THR TYR ASN SEQRES 9 B 121 LYS LYS TYR ARG TYR HIS LEU LYS PRO PHE CYS LYS LYS SEQRES 10 B 121 ALA ASP PRO CYS HET HCI A 340 18 SSBOND 1 CYS A 29 CYS A 45 SSBOND 2 CYS A 61 CYS A 91 SSBOND 3 CYS A 84 CYS A 96 SSBOND 4 CYS A 51 CYS A 98 SSBOND 5 CYS A 44 CYS A 105 SSBOND 6 CYS A 27 CYS A 126 SSBOND 7 CYS A 50 CYS A 133 SSBOND 8 CYS B 29 CYS B 45 SSBOND 9 CYS B 61 CYS B 91 SSBOND 10 CYS B 84 CYS B 96 SSBOND 11 CYS B 51 CYS B 98 SSBOND 12 CYS B 44 CYS B 105 SSBOND 13 CYS B 27 CYS B 126 SSBOND 14 CYS B 50 CYS B 133 ATOM 1 N SER A 1 41.243 19.329 132.094 1.00 37.19 N ATOM 2 CA SER A 1 40.054 18.484 132.122 1.00 37.73 C ATOM 3 C SER A 1 40.120 17.459 131.006 1.00 37.89 C ATOM 4 O SER A 1 41.155 17.301 130.357 1.00 37.81 O ATOM 5 CB SER A 1 38.782 19.319 131.978 1.00 38.08 C ATOM 6 OG SER A 1 38.671 19.837 130.663 1.00 37.67 O ATOM 7 HG SER A 1 39.455 20.409 130.468 1.00 0.00 H ATOM 8 HN3 SER A 1 41.296 19.821 131.179 1.00 0.00 H ATOM 9 HN2 SER A 1 42.090 18.738 132.221 1.00 0.00 H ATOM 10 HN1 SER A 1 41.188 20.028 132.862 1.00 0.00 H ATOM 11 N LEU A 2 39.001 16.780 130.770 1.00 37.40 N ATOM 12 CA LEU A 2 38.928 15.794 129.701 1.00 36.02 C ATOM 13 C LEU A 2 38.959 16.460 128.330 1.00 35.60 C ATOM 14 O LEU A 2 39.282 15.821 127.332 1.00 35.98 O ATOM 15 CB LEU A 2 37.669 14.935 129.845 1.00 36.42 C ATOM 16 CG LEU A 2 37.683 13.935 131.006 1.00 36.46 C ATOM 17 CD1 LEU A 2 36.413 13.112 131.026 1.00 36.54 C ATOM 18 CD2 LEU A 2 38.901 13.031 130.927 1.00 35.60 C ATOM 19 H LEU A 2 38.163 16.957 131.360 1.00 0.00 H ATOM 20 N PHE A 3 38.634 17.747 128.282 1.00 35.80 N ATOM 21 CA PHE A 3 38.621 18.472 127.018 1.00 36.76 C ATOM 22 C PHE A 3 40.031 18.761 126.517 1.00 37.79 C ATOM 23 O PHE A 3 40.335 18.533 125.346 1.00 39.04 O ATOM 24 CB PHE A 3 37.829 19.772 127.151 1.00 37.88 C ATOM 25 CG PHE A 3 36.364 19.560 127.422 1.00 39.10 C ATOM 26 CD1 PHE A 3 35.532 19.063 126.435 1.00 39.35 C ATOM 27 CD2 PHE A 3 35.821 19.859 128.659 1.00 40.28 C ATOM 28 CE1 PHE A 3 34.191 18.866 126.676 1.00 40.93 C ATOM 29 CE2 PHE A 3 34.480 19.665 128.904 1.00 41.53 C ATOM 30 CZ PHE A 3 33.664 19.168 127.911 1.00 42.03 C ATOM 31 H PHE A 3 38.385 18.245 129.160 1.00 0.00 H ATOM 32 N GLU A 4 40.888 19.266 127.401 1.00 36.78 N ATOM 33 CA GLU A 4 42.268 19.555 127.036 1.00 34.83 C ATOM 34 C GLU A 4 43.002 18.259 126.735 1.00 34.88 C ATOM 35 O GLU A 4 43.783 18.177 125.780 1.00 35.33 O ATOM 36 CB GLU A 4 42.984 20.316 128.151 1.00 34.23 C ATOM 37 CG GLU A 4 42.449 21.711 128.402 1.00 35.73 C ATOM 38 CD GLU A 4 41.247 21.717 129.323 1.00 36.28 C ATOM 39 OE1 GLU A 4 40.901 20.641 129.853 1.00 35.44 O ATOM 40 OE2 GLU A 4 40.650 22.796 129.516 1.00 37.83 O ATOM 41 H GLU A 4 40.566 19.458 128.371 1.00 0.00 H ATOM 42 N LEU A 5 42.739 17.245 127.556 1.00 33.82 N ATOM 43 CA LEU A 5 43.358 15.939 127.386 1.00 32.13 C ATOM 44 C LEU A 5 43.009 15.357 126.021 1.00 31.36 C ATOM 45 O LEU A 5 43.884 14.898 125.293 1.00 31.52 O ATOM 46 CB LEU A 5 42.917 14.985 128.500 1.00 31.69 C ATOM 47 CG LEU A 5 43.317 13.514 128.331 1.00 31.05 C ATOM 48 CD1 LEU A 5 44.837 13.342 128.234 1.00 29.18 C ATOM 49 CD2 LEU A 5 42.734 12.670 129.459 1.00 31.15 C ATOM 50 H LEU A 5 42.072 17.390 128.341 1.00 0.00 H ATOM 51 N GLY A 6 41.728 15.396 125.670 1.00 30.15 N ATOM 52 CA GLY A 6 41.281 14.864 124.398 1.00 29.41 C ATOM 53 C GLY A 6 41.828 15.639 123.214 1.00 30.18 C ATOM 54 O GLY A 6 42.120 15.072 122.162 1.00 31.48 O ATOM 55 H GLY A 6 41.033 15.816 126.320 1.00 0.00 H ATOM 56 N LYS A 7 41.972 16.947 123.384 1.00 29.51 N ATOM 57 CA LYS A 7 42.498 17.779 122.317 1.00 28.81 C ATOM 58 C LYS A 7 43.968 17.447 122.077 1.00 28.13 C ATOM 59 O LYS A 7 44.426 17.387 120.936 1.00 28.36 O ATOM 60 CB LYS A 7 42.360 19.257 122.669 1.00 29.57 C ATOM 61 CG LYS A 7 42.645 20.193 121.512 1.00 31.73 C ATOM 62 CD LYS A 7 42.195 21.607 121.826 1.00 34.78 C ATOM 63 CE LYS A 7 41.567 22.287 120.632 1.00 37.40 C ATOM 64 NZ LYS A 7 40.841 23.515 121.067 1.00 40.07 N ATOM 65 HZ1 LYS A 7 40.096 23.254 121.744 1.00 0.00 H ATOM 66 HZ2 LYS A 7 41.510 24.169 121.521 1.00 0.00 H ATOM 67 HZ3 LYS A 7 40.413 23.975 120.238 1.00 0.00 H ATOM 68 H LYS A 7 41.705 17.381 124.291 1.00 0.00 H ATOM 69 N MET A 8 44.696 17.213 123.137 1.00 27.67 N ATOM 70 CA MET A 8 46.088 16.866 123.062 1.00 26.71 C ATOM 71 C MET A 8 46.302 15.568 122.326 1.00 27.46 C ATOM 72 O MET A 8 47.131 15.486 121.479 1.00 28.28 O ATOM 73 CB MET A 8 46.667 16.770 124.451 1.00 25.18 C ATOM 74 CG MET A 8 46.896 18.074 125.151 1.00 25.47 C ATOM 75 SD MET A 8 47.822 17.803 126.624 1.00 32.06 S ATOM 76 CE MET A 8 47.894 19.377 127.343 1.00 26.60 C ATOM 77 H MET A 8 44.249 17.281 124.074 1.00 0.00 H ATOM 78 N ILE A 9 45.508 14.576 122.666 1.00 27.59 N ATOM 79 CA ILE A 9 45.566 13.297 122.044 1.00 27.19 C ATOM 80 C ILE A 9 45.240 13.366 120.570 1.00 28.55 C ATOM 81 O ILE A 9 45.817 12.677 119.807 1.00 29.29 O ATOM 82 CB ILE A 9 44.672 12.297 122.762 1.00 26.26 C ATOM 83 CG1 ILE A 9 45.119 12.143 124.189 1.00 26.02 C ATOM 84 CG2 ILE A 9 44.756 10.967 122.086 1.00 26.17 C ATOM 85 CD1 ILE A 9 44.374 11.090 124.960 1.00 23.36 C ATOM 86 H ILE A 9 44.809 14.733 123.420 1.00 0.00 H ATOM 87 N LEU A 10 44.310 14.218 120.192 1.00 29.27 N ATOM 88 CA LEU A 10 43.976 14.445 118.805 1.00 30.59 C ATOM 89 C LEU A 10 45.107 15.098 118.089 1.00 34.27 C ATOM 90 O LEU A 10 45.484 14.675 117.044 1.00 35.78 O ATOM 91 CB LEU A 10 42.745 15.315 118.662 1.00 29.71 C ATOM 92 CG LEU A 10 42.459 15.808 117.256 1.00 30.26 C ATOM 93 CD1 LEU A 10 42.297 14.663 116.315 1.00 30.34 C ATOM 94 CD2 LEU A 10 41.227 16.653 117.197 1.00 31.31 C ATOM 95 H LEU A 10 43.795 14.750 120.922 1.00 0.00 H ATOM 96 N GLN A 11 45.653 16.133 118.690 1.00 35.15 N ATOM 97 CA GLN A 11 46.723 16.893 118.068 1.00 36.54 C ATOM 98 C GLN A 11 47.958 16.038 117.796 1.00 36.44 C ATOM 99 O GLN A 11 48.558 16.133 116.724 1.00 37.89 O ATOM 100 CB GLN A 11 47.084 18.089 118.946 1.00 36.54 C ATOM 101 CG GLN A 11 46.162 19.277 118.751 1.00 36.95 C ATOM 102 CD GLN A 11 46.173 20.224 119.929 1.00 37.03 C ATOM 103 OE1 GLN A 11 46.796 19.949 120.955 1.00 37.25 O ATOM 104 NE2 GLN A 11 45.511 21.365 119.776 1.00 37.40 N ATOM 105 HE22 GLN A 11 44.998 21.554 118.891 1.00 0.00 H ATOM 106 HE21 GLN A 11 45.505 22.069 120.541 1.00 0.00 H ATOM 107 H GLN A 11 45.311 16.413 119.631 1.00 0.00 H ATOM 108 N GLU A 12 48.319 15.188 118.753 1.00 35.02 N ATOM 109 CA GLU A 12 49.498 14.339 118.607 1.00 34.83 C ATOM 110 C GLU A 12 49.249 13.147 117.680 1.00 34.98 C ATOM 111 O GLU A 12 50.027 12.911 116.758 1.00 36.35 O ATOM 112 CB GLU A 12 49.978 13.837 119.972 1.00 34.10 C ATOM 113 CG GLU A 12 50.704 14.889 120.817 1.00 34.28 C ATOM 114 CD GLU A 12 52.142 15.127 120.377 1.00 34.29 C ATOM 115 OE1 GLU A 12 52.741 14.231 119.746 1.00 33.54 O ATOM 116 OE2 GLU A 12 52.675 16.219 120.662 1.00 35.44 O ATOM 117 H GLU A 12 47.751 15.127 119.622 1.00 0.00 H ATOM 118 N THR A 13 48.168 12.403 117.917 1.00 32.57 N ATOM 119 CA THR A 13 47.911 11.172 117.168 1.00 30.11 C ATOM 120 C THR A 13 47.150 11.358 115.857 1.00 29.65 C ATOM 121 O THR A 13 47.288 10.550 114.938 1.00 29.05 O ATOM 122 CB THR A 13 47.122 10.162 118.016 1.00 28.92 C ATOM 123 OG1 THR A 13 45.788 10.647 118.236 1.00 29.32 O ATOM 124 CG2 THR A 13 47.815 9.929 119.344 1.00 27.88 C ATOM 125 HG1 THR A 13 45.828 11.514 118.712 1.00 0.00 H ATOM 126 H THR A 13 47.493 12.704 118.649 1.00 0.00 H ATOM 127 N GLY A 15 46.332 12.403 115.770 1.00 29.83 N ATOM 128 CA GLY A 15 45.502 12.597 114.594 1.00 30.51 C ATOM 129 C GLY A 15 44.259 11.724 114.635 1.00 31.27 C ATOM 130 O GLY A 15 43.500 11.659 113.668 1.00 31.04 O ATOM 131 H GLY A 15 46.286 13.088 116.551 1.00 0.00 H ATOM 132 N LYS A 16 44.038 11.056 115.744 1.00 32.04 N ATOM 133 CA LYS A 16 42.916 10.183 115.902 1.00 34.31 C ATOM 134 C LYS A 16 41.852 10.715 116.863 1.00 34.02 C ATOM 135 O LYS A 16 42.136 11.501 117.722 1.00 33.38 O ATOM 136 CB LYS A 16 43.416 8.827 116.366 1.00 35.44 C ATOM 137 CG LYS A 16 44.390 8.153 115.435 1.00 37.51 C ATOM 138 CD LYS A 16 43.798 7.705 114.113 1.00 39.61 C ATOM 139 CE LYS A 16 42.956 6.448 114.235 1.00 40.93 C ATOM 140 NZ LYS A 16 42.550 5.859 112.935 1.00 41.86 N ATOM 141 HZ1 LYS A 16 41.988 6.553 112.402 1.00 0.00 H ATOM 142 HZ2 LYS A 16 43.399 5.607 112.390 1.00 0.00 H ATOM 143 HZ3 LYS A 16 41.980 5.006 113.105 1.00 0.00 H ATOM 144 H LYS A 16 44.703 11.166 116.536 1.00 0.00 H ATOM 145 N ASN A 17 40.626 10.247 116.695 1.00 34.62 N ATOM 146 CA ASN A 17 39.533 10.564 117.613 1.00 35.19 C ATOM 147 C ASN A 17 39.898 10.030 118.991 1.00 34.51 C ATOM 148 O ASN A 17 40.014 8.819 119.179 1.00 34.80 O ATOM 149 CB ASN A 17 38.212 9.955 117.108 1.00 36.91 C ATOM 150 CG ASN A 17 37.007 10.309 117.980 1.00 38.85 C ATOM 151 OD1 ASN A 17 37.124 10.537 119.184 1.00 39.65 O ATOM 152 ND2 ASN A 17 35.835 10.360 117.358 1.00 40.32 N ATOM 153 HD22 ASN A 17 35.778 10.161 116.339 1.00 0.00 H ATOM 154 HD21 ASN A 17 34.974 10.599 117.890 1.00 0.00 H ATOM 155 H ASN A 17 40.433 9.631 115.880 1.00 0.00 H ATOM 156 N PRO A 18 40.022 10.890 119.966 1.00 34.58 N ATOM 157 CA PRO A 18 40.450 10.425 121.264 1.00 35.01 C ATOM 158 C PRO A 18 39.465 9.571 122.005 1.00 37.31 C ATOM 159 O PRO A 18 39.865 8.606 122.596 1.00 38.29 O ATOM 160 CB PRO A 18 40.717 11.707 122.013 1.00 34.20 C ATOM 161 CG PRO A 18 39.955 12.717 121.306 1.00 34.01 C ATOM 162 CD PRO A 18 40.054 12.345 119.896 1.00 34.40 C ATOM 163 N ALA A 19 38.205 9.938 121.995 1.00 37.83 N ATOM 164 CA ALA A 19 37.238 9.223 122.762 1.00 39.36 C ATOM 165 C ALA A 19 37.080 7.867 122.190 1.00 40.15 C ATOM 166 O ALA A 19 36.873 6.944 122.905 1.00 41.88 O ATOM 167 CB ALA A 19 35.912 9.945 122.763 1.00 40.41 C ATOM 168 H ALA A 19 37.910 10.756 121.424 1.00 0.00 H ATOM 169 N LYS A 20 37.201 7.758 120.889 1.00 38.86 N ATOM 170 CA LYS A 20 36.949 6.526 120.209 1.00 38.25 C ATOM 171 C LYS A 20 38.109 5.576 120.314 1.00 35.69 C ATOM 172 O LYS A 20 37.930 4.402 120.397 1.00 35.85 O ATOM 173 CB LYS A 20 36.650 6.813 118.756 1.00 39.79 C ATOM 174 CG LYS A 20 36.333 5.608 117.923 1.00 41.49 C ATOM 175 CD LYS A 20 36.049 6.029 116.512 1.00 44.06 C ATOM 176 CE LYS A 20 36.341 4.926 115.516 1.00 46.22 C ATOM 177 NZ LYS A 20 36.772 5.450 114.199 1.00 47.16 N ATOM 178 HZ1 LYS A 20 36.020 6.049 113.803 1.00 0.00 H ATOM 179 HZ2 LYS A 20 37.639 6.013 114.318 1.00 0.00 H ATOM 180 HZ3 LYS A 20 36.959 4.655 113.555 1.00 0.00 H ATOM 181 H LYS A 20 37.488 8.591 120.336 1.00 0.00 H ATOM 182 N SER A 21 39.309 6.105 120.311 1.00 33.10 N ATOM 183 CA SER A 21 40.484 5.239 120.319 1.00 30.75 C ATOM 184 C SER A 21 41.020 4.988 121.723 1.00 29.16 C ATOM 185 O SER A 21 41.592 3.935 121.993 1.00 30.01 O ATOM 186 CB SER A 21 41.601 5.831 119.453 1.00 29.59 C ATOM 187 OG SER A 21 41.227 5.897 118.089 1.00 30.50 O ATOM 188 HG SER A 21 41.971 6.283 117.562 1.00 0.00 H ATOM 189 H SER A 21 39.423 7.139 120.303 1.00 0.00 H ATOM 190 N TYR A 22 40.825 5.942 122.623 1.00 27.63 N ATOM 191 CA TYR A 22 41.470 5.862 123.927 1.00 27.70 C ATOM 192 C TYR A 22 40.514 6.007 125.111 1.00 28.65 C ATOM 193 O TYR A 22 40.944 5.992 126.265 1.00 29.26 O ATOM 194 CB TYR A 22 42.571 6.926 124.010 1.00 27.53 C ATOM 195 CG TYR A 22 43.608 6.778 122.923 1.00 29.01 C ATOM 196 CD1 TYR A 22 44.594 5.801 123.011 1.00 30.42 C ATOM 197 CD2 TYR A 22 43.591 7.595 121.799 1.00 29.28 C ATOM 198 CE1 TYR A 22 45.541 5.650 122.021 1.00 30.93 C ATOM 199 CE2 TYR A 22 44.541 7.451 120.798 1.00 29.83 C ATOM 200 CZ TYR A 22 45.513 6.475 120.917 1.00 31.33 C ATOM 201 OH TYR A 22 46.469 6.312 119.936 1.00 32.98 O ATOM 202 HH TYR A 22 47.077 5.572 120.189 1.00 0.00 H ATOM 203 H TYR A 22 40.210 6.750 122.397 1.00 0.00 H ATOM 204 N GLY A 23 39.222 6.137 124.828 1.00 28.69 N ATOM 205 CA GLY A 23 38.236 6.301 125.879 1.00 29.07 C ATOM 206 C GLY A 23 38.033 5.053 126.713 1.00 30.74 C ATOM 207 O GLY A 23 37.700 5.136 127.896 1.00 31.35 O ATOM 208 H GLY A 23 38.912 6.121 123.835 1.00 0.00 H ATOM 209 N ALA A 24 38.257 3.893 126.102 1.00 31.32 N ATOM 210 CA ALA A 24 38.072 2.620 126.789 1.00 31.54 C ATOM 211 C ALA A 24 39.121 1.591 126.371 1.00 31.89 C ATOM 212 O ALA A 24 38.867 0.389 126.390 1.00 32.47 O ATOM 213 CB ALA A 24 36.676 2.084 126.524 1.00 30.28 C ATOM 214 H ALA A 24 38.572 3.894 125.111 1.00 0.00 H ATOM 215 N TYR A 25 40.300 2.059 126.037 1.00 32.08 N ATOM 216 CA TYR A 25 41.315 1.175 125.544 1.00 32.43 C ATOM 217 C TYR A 25 42.071 0.558 126.660 1.00 33.44 C ATOM 218 O TYR A 25 42.570 1.238 127.513 1.00 34.89 O ATOM 219 CB TYR A 25 42.268 1.917 124.667 1.00 31.93 C ATOM 220 CG TYR A 25 43.325 1.103 124.001 1.00 33.11 C ATOM 221 CD1 TYR A 25 44.425 0.689 124.677 1.00 33.08 C ATOM 222 CD2 TYR A 25 43.241 0.811 122.678 1.00 34.22 C ATOM 223 CE1 TYR A 25 45.392 -0.032 124.054 1.00 33.63 C ATOM 224 CE2 TYR A 25 44.219 0.110 122.043 1.00 34.40 C ATOM 225 CZ TYR A 25 45.288 -0.302 122.736 1.00 33.60 C ATOM 226 OH TYR A 25 46.219 -0.993 122.083 1.00 33.75 O ATOM 227 HH TYR A 25 46.948 -1.234 122.708 1.00 0.00 H ATOM 228 H TYR A 25 40.499 3.075 126.130 1.00 0.00 H ATOM 229 N GLY A 26 42.131 -0.762 126.626 1.00 32.09 N ATOM 230 CA GLY A 26 42.864 -1.551 127.573 1.00 30.58 C ATOM 231 C GLY A 26 42.398 -1.557 128.993 1.00 30.03 C ATOM 232 O GLY A 26 41.286 -1.338 129.283 1.00 30.73 O ATOM 233 H GLY A 26 41.617 -1.257 125.869 1.00 0.00 H ATOM 234 N CYS A 27 43.280 -1.769 129.912 1.00 31.00 N ATOM 235 CA CYS A 27 42.909 -1.776 131.285 1.00 32.45 C ATOM 236 C CYS A 27 43.136 -0.475 131.940 1.00 32.75 C ATOM 237 O CYS A 27 42.886 -0.362 133.098 1.00 30.82 O ATOM 238 CB CYS A 27 43.711 -2.818 132.047 1.00 32.01 C ATOM 239 SG CYS A 27 43.361 -4.494 131.598 1.00 36.14 S ATOM 240 H CYS A 27 44.271 -1.936 129.646 1.00 0.00 H ATOM 241 N ASN A 28 43.650 0.491 131.204 1.00 28.78 N ATOM 242 CA ASN A 28 44.104 1.728 131.768 1.00 28.60 C ATOM 243 C ASN A 28 43.702 3.000 131.078 1.00 28.65 C ATOM 244 O ASN A 28 43.819 4.014 131.645 1.00 29.69 O ATOM 245 CB ASN A 28 45.634 1.733 131.864 1.00 28.95 C ATOM 246 CG ASN A 28 46.171 0.728 132.823 1.00 30.97 C ATOM 247 OD1 ASN A 28 46.270 0.987 133.993 1.00 32.84 O ATOM 248 ND2 ASN A 28 46.548 -0.408 132.323 1.00 30.79 N ATOM 249 HD22 ASN A 28 46.443 -0.588 131.304 1.00 0.00 H ATOM 250 HD21 ASN A 28 46.955 -1.139 132.941 1.00 0.00 H ATOM 251 H ASN A 28 43.729 0.350 130.177 1.00 0.00 H ATOM 252 N CYS A 29 43.255 2.955 129.848 1.00 27.91 N ATOM 253 CA CYS A 29 43.007 4.171 129.079 1.00 28.40 C ATOM 254 C CYS A 29 41.552 4.616 129.188 1.00 31.19 C ATOM 255 O CYS A 29 40.631 3.860 128.865 1.00 33.03 O ATOM 256 CB CYS A 29 43.387 3.973 127.609 1.00 27.15 C ATOM 257 SG CYS A 29 45.167 4.016 127.292 1.00 40.13 S ATOM 258 H CYS A 29 43.072 2.030 129.408 1.00 0.00 H ATOM 259 N GLY A 30 41.351 5.840 129.668 1.00 30.77 N ATOM 260 CA GLY A 30 40.022 6.418 129.728 1.00 31.61 C ATOM 261 C GLY A 30 39.360 6.236 131.080 1.00 33.95 C ATOM 262 O GLY A 30 39.979 6.455 132.126 1.00 36.14 O ATOM 263 H GLY A 30 42.163 6.394 130.007 1.00 0.00 H ATOM 264 N VAL A 31 38.097 5.823 131.053 1.00 32.93 N ATOM 265 CA VAL A 31 37.305 5.636 132.264 1.00 33.47 C ATOM 266 C VAL A 31 37.950 4.667 133.253 1.00 35.36 C ATOM 267 O VAL A 31 38.765 3.831 132.868 1.00 34.44 O ATOM 268 CB VAL A 31 35.892 5.128 131.927 1.00 32.21 C ATOM 269 CG1 VAL A 31 35.048 6.265 131.394 1.00 31.80 C ATOM 270 CG2 VAL A 31 35.960 3.995 130.918 1.00 30.64 C ATOM 271 H VAL A 31 37.656 5.625 130.132 1.00 0.00 H ATOM 272 N LEU A 32 37.649 4.861 134.518 1.00 37.74 N ATOM 273 CA LEU A 32 38.082 3.978 135.571 1.00 40.62 C ATOM 274 C LEU A 32 39.533 4.101 136.007 1.00 41.89 C ATOM 275 O LEU A 32 40.190 5.068 135.743 1.00 41.69 O ATOM 276 CB LEU A 32 37.763 2.539 135.206 1.00 41.86 C ATOM 277 CG LEU A 32 36.307 2.349 134.870 1.00 44.35 C ATOM 278 CD1 LEU A 32 36.007 0.977 134.355 1.00 45.56 C ATOM 279 CD2 LEU A 32 35.442 2.632 136.060 1.00 46.45 C ATOM 280 H LEU A 32 37.072 5.689 134.770 1.00 0.00 H ATOM 281 N GLY A 33 40.023 3.088 136.694 1.00 42.78 N ATOM 282 CA GLY A 33 41.354 3.113 137.241 1.00 42.49 C ATOM 283 C GLY A 33 42.380 2.371 136.430 1.00 42.22 C ATOM 284 O GLY A 33 42.394 2.446 135.239 1.00 41.04 O ATOM 285 H GLY A 33 39.431 2.247 136.845 1.00 0.00 H ATOM 286 N ARG A 34 43.252 1.653 137.104 1.00 43.57 N ATOM 287 CA ARG A 34 44.312 0.944 136.433 1.00 44.09 C ATOM 288 C ARG A 34 44.196 -0.535 136.571 1.00 44.19 C ATOM 289 O ARG A 34 43.569 -1.021 137.442 1.00 46.03 O ATOM 290 CB ARG A 34 45.666 1.375 136.953 1.00 44.48 C ATOM 291 CG ARG A 34 45.817 2.841 137.206 1.00 44.95 C ATOM 292 CD ARG A 34 47.117 3.138 137.917 1.00 47.16 C ATOM 293 NE ARG A 34 47.023 2.891 139.342 1.00 50.50 N ATOM 294 CZ ARG A 34 47.819 2.057 139.981 1.00 53.52 C ATOM 295 NH1 ARG A 34 48.752 1.423 139.327 1.00 54.12 N ATOM 296 NH2 ARG A 34 47.687 1.860 141.266 1.00 55.44 N ATOM 297 HE ARG A 34 46.294 3.395 139.886 1.00 0.00 H ATOM 298 HH12 ARG A 34 49.382 0.764 139.828 1.00 0.00 H ATOM 299 HH11 ARG A 34 48.866 1.576 138.305 1.00 0.00 H ATOM 300 HH22 ARG A 34 48.321 1.199 141.759 1.00 0.00 H ATOM 301 HH21 ARG A 34 46.948 2.364 141.796 1.00 0.00 H ATOM 302 H ARG A 34 43.175 1.596 138.140 1.00 0.00 H ATOM 303 N GLY A 35 44.844 -1.235 135.681 1.00 42.49 N ATOM 304 CA GLY A 35 44.973 -2.676 135.782 1.00 42.84 C ATOM 305 C GLY A 35 46.313 -3.014 135.166 1.00 41.78 C ATOM 306 O GLY A 35 47.066 -2.106 134.823 1.00 40.64 O ATOM 307 H GLY A 35 45.281 -0.745 134.875 1.00 0.00 H ATOM 308 N GLN A 36 46.622 -4.298 135.014 1.00 42.25 N ATOM 309 CA GLN A 36 47.872 -4.676 134.372 1.00 41.44 C ATOM 310 C GLN A 36 47.815 -4.246 132.917 1.00 38.67 C ATOM 311 O GLN A 36 46.838 -4.522 132.227 1.00 38.37 O ATOM 312 CB GLN A 36 48.132 -6.178 134.459 1.00 43.94 C ATOM 313 CG GLN A 36 49.560 -6.540 134.081 1.00 46.53 C ATOM 314 CD GLN A 36 49.728 -8.003 133.715 1.00 49.83 C ATOM 315 OE1 GLN A 36 48.773 -8.665 133.314 1.00 51.12 O ATOM 316 NE2 GLN A 36 50.949 -8.511 133.840 1.00 51.13 N ATOM 317 HE22 GLN A 36 51.728 -7.914 134.183 1.00 0.00 H ATOM 318 HE21 GLN A 36 51.126 -9.506 133.594 1.00 0.00 H ATOM 319 H GLN A 36 45.970 -5.033 135.354 1.00 0.00 H ATOM 320 N PRO A 37 48.855 -3.543 132.451 1.00 37.16 N ATOM 321 CA PRO A 37 48.830 -3.064 131.066 1.00 35.38 C ATOM 322 C PRO A 37 48.781 -4.237 130.094 1.00 35.31 C ATOM 323 O PRO A 37 49.223 -5.331 130.436 1.00 35.88 O ATOM 324 CB PRO A 37 50.146 -2.293 130.919 1.00 34.93 C ATOM 325 CG PRO A 37 50.646 -2.055 132.288 1.00 35.74 C ATOM 326 CD PRO A 37 49.985 -3.008 133.228 1.00 37.17 C ATOM 327 N LYS A 38 48.319 -4.006 128.895 1.00 34.61 N ATOM 328 CA LYS A 38 48.122 -5.049 127.961 1.00 36.15 C ATOM 329 C LYS A 38 48.955 -4.858 126.730 1.00 34.70 C ATOM 330 O LYS A 38 49.102 -5.751 125.946 1.00 34.79 O ATOM 331 CB LYS A 38 46.656 -5.129 127.613 1.00 38.17 C ATOM 332 CG LYS A 38 45.883 -6.053 128.518 1.00 41.58 C ATOM 333 CD LYS A 38 44.833 -6.813 127.760 1.00 43.33 C ATOM 334 CE LYS A 38 44.607 -8.163 128.366 1.00 47.06 C ATOM 335 NZ LYS A 38 44.740 -9.247 127.360 1.00 49.42 N ATOM 336 HZ1 LYS A 38 44.039 -9.105 126.605 1.00 0.00 H ATOM 337 HZ2 LYS A 38 45.697 -9.226 126.954 1.00 0.00 H ATOM 338 HZ3 LYS A 38 44.576 -10.166 127.819 1.00 0.00 H ATOM 339 H LYS A 38 48.090 -3.030 128.620 1.00 0.00 H ATOM 340 N ASP A 39 49.493 -3.672 126.582 1.00 33.04 N ATOM 341 CA ASP A 39 50.454 -3.343 125.539 1.00 33.36 C ATOM 342 C ASP A 39 51.063 -1.983 125.863 1.00 33.08 C ATOM 343 O ASP A 39 50.800 -1.431 126.929 1.00 33.42 O ATOM 344 CB ASP A 39 49.796 -3.339 124.152 1.00 33.54 C ATOM 345 CG ASP A 39 48.740 -2.253 123.992 1.00 33.26 C ATOM 346 OD1 ASP A 39 48.330 -1.630 124.992 1.00 32.81 O ATOM 347 OD2 ASP A 39 48.323 -2.020 122.841 1.00 33.78 O ATOM 348 H ASP A 39 49.217 -2.922 127.248 1.00 0.00 H ATOM 349 N ALA A 40 51.876 -1.448 124.968 1.00 32.72 N ATOM 350 CA ALA A 40 52.602 -0.219 125.248 1.00 31.98 C ATOM 351 C ALA A 40 51.697 0.983 125.330 1.00 30.37 C ATOM 352 O ALA A 40 51.850 1.791 126.170 1.00 30.28 O ATOM 353 CB ALA A 40 53.677 0.006 124.223 1.00 32.24 C ATOM 354 H ALA A 40 51.999 -1.915 124.047 1.00 0.00 H ATOM 355 N THR A 41 50.731 1.055 124.452 1.00 29.17 N ATOM 356 CA THR A 41 49.760 2.116 124.486 1.00 26.91 C ATOM 357 C THR A 41 48.934 2.159 125.770 1.00 26.59 C ATOM 358 O THR A 41 48.791 3.187 126.328 1.00 26.11 O ATOM 359 CB THR A 41 48.965 2.268 123.153 1.00 26.78 C ATOM 360 OG1 THR A 41 47.577 2.248 123.405 1.00 25.97 O ATOM 361 CG2 THR A 41 49.274 1.243 122.164 1.00 26.59 C ATOM 362 HG1 THR A 41 47.086 2.345 122.551 1.00 0.00 H ATOM 363 H THR A 41 50.663 0.328 123.711 1.00 0.00 H ATOM 364 N ASP A 42 48.466 1.024 126.268 1.00 27.63 N ATOM 365 CA ASP A 42 47.809 0.951 127.564 1.00 26.92 C ATOM 366 C ASP A 42 48.738 1.427 128.681 1.00 30.20 C ATOM 367 O ASP A 42 48.326 2.189 129.553 1.00 30.36 O ATOM 368 CB ASP A 42 47.335 -0.481 127.842 1.00 27.89 C ATOM 369 CG ASP A 42 46.223 -0.541 128.875 1.00 30.56 C ATOM 370 OD1 ASP A 42 45.452 0.435 128.982 1.00 30.48 O ATOM 371 OD2 ASP A 42 46.118 -1.565 129.582 1.00 31.36 O ATOM 372 H ASP A 42 48.572 0.152 125.711 1.00 0.00 H ATOM 373 N ARG A 43 49.975 0.995 128.654 1.00 30.41 N ATOM 374 CA ARG A 43 50.972 1.413 129.610 1.00 29.86 C ATOM 375 C ARG A 43 51.226 2.885 129.610 1.00 30.91 C ATOM 376 O ARG A 43 51.539 3.421 130.614 1.00 32.97 O ATOM 377 CB ARG A 43 52.258 0.688 129.347 1.00 29.86 C ATOM 378 CG ARG A 43 53.232 0.758 130.461 1.00 31.65 C ATOM 379 CD ARG A 43 54.411 -0.157 130.240 1.00 33.85 C ATOM 380 NE ARG A 43 54.101 -1.555 130.387 1.00 35.00 N ATOM 381 CZ ARG A 43 53.952 -2.413 129.394 1.00 34.16 C ATOM 382 NH1 ARG A 43 54.062 -2.058 128.139 1.00 31.97 N ATOM 383 NH2 ARG A 43 53.700 -3.660 129.684 1.00 34.74 N ATOM 384 HE ARG A 43 53.985 -1.919 131.354 1.00 0.00 H ATOM 385 HH12 ARG A 43 53.937 -2.764 127.386 1.00 0.00 H ATOM 386 HH11 ARG A 43 54.274 -1.070 127.895 1.00 0.00 H ATOM 387 HH22 ARG A 43 53.578 -4.357 128.922 1.00 0.00 H ATOM 388 HH21 ARG A 43 53.621 -3.957 130.678 1.00 0.00 H ATOM 389 H ARG A 43 50.250 0.321 127.911 1.00 0.00 H ATOM 390 N CYS A 44 51.052 3.543 128.482 1.00 26.89 N ATOM 391 CA CYS A 44 51.136 4.978 128.426 1.00 26.26 C ATOM 392 C CYS A 44 50.031 5.612 129.363 1.00 29.66 C ATOM 393 O CYS A 44 50.296 6.575 130.008 1.00 29.32 O ATOM 394 CB CYS A 44 51.372 5.515 126.923 1.00 25.49 C ATOM 395 SG CYS A 44 53.097 6.008 126.420 1.00 34.55 S ATOM 396 H CYS A 44 50.849 3.012 127.611 1.00 0.00 H ATOM 397 N CYS A 45 48.866 4.973 129.550 1.00 29.16 N ATOM 398 CA CYS A 45 47.774 5.452 130.392 1.00 28.60 C ATOM 399 C CYS A 45 47.931 5.029 131.847 1.00 29.86 C ATOM 400 O CYS A 45 47.429 5.702 132.752 1.00 30.22 O ATOM 401 CB CYS A 45 46.433 4.959 129.850 1.00 28.29 C ATOM 402 SG CYS A 45 46.027 5.606 128.214 1.00 40.39 S ATOM 403 H CYS A 45 48.731 4.067 129.057 1.00 0.00 H ATOM 404 N TYR A 46 48.614 3.908 132.062 1.00 30.44 N ATOM 405 CA TYR A 46 48.972 3.456 133.403 1.00 31.90 C ATOM 406 C TYR A 46 49.854 4.515 134.062 1.00 32.55 C ATOM 407 O TYR A 46 49.631 4.906 135.207 1.00 32.95 O ATOM 408 CB TYR A 46 49.690 2.101 133.329 1.00 33.24 C ATOM 409 CG TYR A 46 50.134 1.495 134.647 1.00 34.65 C ATOM 410 CD1 TYR A 46 51.279 1.940 135.297 1.00 36.00 C ATOM 411 CD2 TYR A 46 49.437 0.438 135.211 1.00 35.52 C ATOM 412 CE1 TYR A 46 51.691 1.372 136.492 1.00 37.90 C ATOM 413 CE2 TYR A 46 49.843 -0.138 136.399 1.00 37.60 C ATOM 414 CZ TYR A 46 50.970 0.332 137.036 1.00 39.33 C ATOM 415 OH TYR A 46 51.375 -0.239 138.220 1.00 42.45 O ATOM 416 HH TYR A 46 50.657 -0.141 138.895 1.00 0.00 H ATOM 417 H TYR A 46 48.903 3.333 131.245 1.00 0.00 H ATOM 418 N VAL A 47 50.810 5.038 133.329 1.00 32.29 N ATOM 419 CA VAL A 47 51.709 6.053 133.820 1.00 32.16 C ATOM 420 C VAL A 47 51.002 7.368 134.021 1.00 31.29 C ATOM 421 O VAL A 47 51.181 8.063 134.977 1.00 30.23 O ATOM 422 CB VAL A 47 52.815 6.253 132.797 1.00 30.73 C ATOM 423 CG1 VAL A 47 53.739 7.365 133.164 1.00 31.23 C ATOM 424 CG2 VAL A 47 53.566 4.983 132.576 1.00 30.88 C ATOM 425 H VAL A 47 50.924 4.705 132.350 1.00 0.00 H ATOM 426 N HIS A 48 50.185 7.678 133.053 1.00 31.47 N ATOM 427 CA HIS A 48 49.271 8.789 133.045 1.00 32.74 C ATOM 428 C HIS A 48 48.411 8.808 134.291 1.00 32.99 C ATOM 429 O HIS A 48 48.350 9.782 134.963 1.00 33.33 O ATOM 430 CB HIS A 48 48.534 8.697 131.714 1.00 33.81 C ATOM 431 CG HIS A 48 47.207 9.360 131.640 1.00 36.54 C ATOM 432 ND1 HIS A 48 46.227 8.897 130.801 1.00 37.06 N ATOM 433 CD2 HIS A 48 46.710 10.470 132.218 1.00 38.41 C ATOM 434 CE1 HIS A 48 45.180 9.684 130.873 1.00 37.49 C ATOM 435 NE2 HIS A 48 45.438 10.636 131.737 1.00 38.70 N ATOM 436 H HIS A 48 50.195 7.067 132.211 1.00 0.00 H ATOM 437 N LYS A 49 47.828 7.697 134.660 1.00 33.27 N ATOM 438 CA LYS A 49 47.006 7.713 135.869 1.00 34.90 C ATOM 439 C LYS A 49 47.837 7.710 137.157 1.00 36.65 C ATOM 440 O LYS A 49 47.424 8.288 138.163 1.00 38.93 O ATOM 441 CB LYS A 49 46.011 6.549 135.842 1.00 33.92 C ATOM 442 CG LYS A 49 44.744 6.931 135.076 1.00 32.47 C ATOM 443 CD LYS A 49 43.924 5.748 134.584 1.00 32.98 C ATOM 444 CE LYS A 49 42.574 6.239 134.058 1.00 33.58 C ATOM 445 NZ LYS A 49 41.898 5.294 133.121 1.00 33.69 N ATOM 446 HZ1 LYS A 49 42.507 5.133 132.293 1.00 0.00 H ATOM 447 HZ2 LYS A 49 41.725 4.391 133.606 1.00 0.00 H ATOM 448 HZ3 LYS A 49 40.992 5.702 132.813 1.00 0.00 H ATOM 449 H LYS A 49 47.946 6.824 134.107 1.00 0.00 H ATOM 450 N CYS A 50 48.998 7.063 137.128 1.00 35.03 N ATOM 451 CA CYS A 50 49.930 7.135 138.251 1.00 35.15 C ATOM 452 C CYS A 50 50.422 8.566 138.460 1.00 34.78 C ATOM 453 O CYS A 50 50.666 8.992 139.586 1.00 36.34 O ATOM 454 CB CYS A 50 51.118 6.193 138.033 1.00 34.91 C ATOM 455 SG CYS A 50 50.828 4.479 138.546 1.00 42.12 S ATOM 456 H CYS A 50 49.247 6.496 136.292 1.00 0.00 H ATOM 457 N CYS A 51 50.543 9.306 137.366 1.00 33.65 N ATOM 458 CA CYS A 51 50.986 10.695 137.407 1.00 33.96 C ATOM 459 C CYS A 51 49.931 11.588 138.051 1.00 34.93 C ATOM 460 O CYS A 51 50.261 12.566 138.725 1.00 36.26 O ATOM 461 CB CYS A 51 51.308 11.181 135.988 1.00 32.97 C ATOM 462 SG CYS A 51 51.908 12.874 135.844 1.00 35.42 S ATOM 463 H CYS A 51 50.314 8.880 136.445 1.00 0.00 H ATOM 464 N TYR A 52 48.663 11.241 137.843 1.00 34.14 N ATOM 465 CA TYR A 52 47.553 11.969 138.453 1.00 34.90 C ATOM 466 C TYR A 52 47.613 11.897 139.982 1.00 37.57 C ATOM 467 O TYR A 52 47.155 12.805 140.675 1.00 38.41 O ATOM 468 CB TYR A 52 46.207 11.413 137.966 1.00 33.29 C ATOM 469 CG TYR A 52 45.759 11.889 136.598 1.00 31.38 C ATOM 470 CD1 TYR A 52 46.505 12.813 135.872 1.00 30.59 C ATOM 471 CD2 TYR A 52 44.580 11.416 136.037 1.00 30.58 C ATOM 472 CE1 TYR A 52 46.090 13.243 134.620 1.00 29.73 C ATOM 473 CE2 TYR A 52 44.155 11.840 134.792 1.00 29.88 C ATOM 474 CZ TYR A 52 44.906 12.757 134.089 1.00 29.90 C ATOM 475 OH TYR A 52 44.473 13.171 132.849 1.00 26.27 O ATOM 476 HH TYR A 52 45.117 13.825 132.477 1.00 0.00 H ATOM 477 H TYR A 52 48.456 10.428 137.228 1.00 0.00 H ATOM 478 N LYS A 53 48.193 10.850 140.520 1.00 39.34 N ATOM 479 CA LYS A 53 48.195 10.695 141.950 1.00 41.93 C ATOM 480 C LYS A 53 49.216 11.536 142.682 1.00 42.36 C ATOM 481 O LYS A 53 49.193 11.584 143.883 1.00 44.79 O ATOM 482 CB LYS A 53 48.388 9.246 142.339 1.00 43.34 C ATOM 483 CG LYS A 53 47.507 8.267 141.629 1.00 43.43 C ATOM 484 CD LYS A 53 47.539 7.002 142.419 1.00 45.69 C ATOM 485 CE LYS A 53 46.602 5.960 141.883 1.00 46.26 C ATOM 486 NZ LYS A 53 46.953 4.713 142.569 1.00 48.49 N ATOM 487 HZ1 LYS A 53 47.943 4.472 142.362 1.00 0.00 H ATOM 488 HZ2 LYS A 53 46.832 4.837 143.594 1.00 0.00 H ATOM 489 HZ3 LYS A 53 46.332 3.949 142.235 1.00 0.00 H ATOM 490 H LYS A 53 48.649 10.136 139.916 1.00 0.00 H ATOM 491 N LYS A 57 50.095 12.200 141.962 1.00 39.36 N ATOM 492 CA LYS A 57 51.026 13.088 142.590 1.00 39.91 C ATOM 493 C LYS A 57 50.484 14.495 142.666 1.00 39.83 C ATOM 494 O LYS A 57 51.085 15.349 143.275 1.00 40.11 O ATOM 495 CB LYS A 57 52.384 13.033 141.901 1.00 39.37 C ATOM 496 H LYS A 57 50.113 12.079 140.929 1.00 0.00 H ATOM 497 N LEU A 58 49.320 14.736 142.094 1.00 39.95 N ATOM 498 CA LEU A 58 48.746 16.079 142.151 1.00 42.21 C ATOM 499 C LEU A 58 48.266 16.451 143.554 1.00 44.31 C ATOM 500 O LEU A 58 48.110 15.593 144.422 1.00 44.61 O ATOM 501 CB LEU A 58 47.589 16.212 141.161 1.00 40.96 C ATOM 502 CG LEU A 58 47.889 15.856 139.705 1.00 39.99 C ATOM 503 CD1 LEU A 58 46.595 15.769 138.913 1.00 39.26 C ATOM 504 CD2 LEU A 58 48.841 16.875 139.081 1.00 40.42 C ATOM 505 H LEU A 58 48.812 13.972 141.604 1.00 0.00 H ATOM 506 N THR A 59 48.044 17.745 143.760 1.00 45.46 N ATOM 507 CA THR A 59 47.809 18.294 145.089 1.00 47.88 C ATOM 508 C THR A 59 46.413 18.894 145.271 1.00 48.22 C ATOM 509 O THR A 59 46.216 19.789 146.093 1.00 50.03 O ATOM 510 CB THR A 59 48.866 19.369 145.429 1.00 50.81 C ATOM 511 OG1 THR A 59 48.793 20.438 144.478 1.00 51.48 O ATOM 512 CG2 THR A 59 50.267 18.767 145.398 1.00 50.87 C ATOM 513 HG1 THR A 59 48.966 20.083 143.570 1.00 0.00 H ATOM 514 H THR A 59 48.038 18.389 142.943 1.00 0.00 H ATOM 515 N GLY A 60 45.445 18.416 144.501 1.00 46.50 N ATOM 516 CA GLY A 60 44.074 18.834 144.716 1.00 48.16 C ATOM 517 C GLY A 60 43.349 19.425 143.525 1.00 48.65 C ATOM 518 O GLY A 60 42.370 20.149 143.695 1.00 50.06 O ATOM 519 H GLY A 60 45.670 17.741 143.743 1.00 0.00 H ATOM 520 N CYS A 61 43.940 19.186 142.374 1.00 47.56 N ATOM 521 CA CYS A 61 43.520 19.661 141.088 1.00 46.77 C ATOM 522 C CYS A 61 42.585 18.497 140.651 1.00 45.54 C ATOM 523 O CYS A 61 42.798 17.386 141.063 1.00 44.97 O ATOM 524 CB CYS A 61 44.814 19.879 140.204 1.00 46.14 C ATOM 525 SG CYS A 61 46.462 20.129 141.038 1.00120.16 S ATOM 526 H CYS A 61 44.795 18.595 142.399 1.00 0.00 H ATOM 527 N ASP A 67 41.543 18.753 139.868 1.00 45.98 N ATOM 528 CA ASP A 67 40.645 17.720 139.299 1.00 45.08 C ATOM 529 C ASP A 67 40.967 17.371 137.844 1.00 44.45 C ATOM 530 O ASP A 67 40.700 18.135 136.969 1.00 44.70 O ATOM 531 CB ASP A 67 39.217 18.223 139.363 1.00 46.04 C ATOM 532 CG ASP A 67 38.209 17.211 138.900 1.00 46.18 C ATOM 533 OD1 ASP A 67 38.527 16.052 138.709 1.00 44.47 O ATOM 534 OD2 ASP A 67 37.054 17.580 138.764 1.00 48.71 O ATOM 535 H ASP A 67 41.343 19.747 139.638 1.00 0.00 H ATOM 536 N PRO A 68 41.548 16.210 137.604 1.00 44.03 N ATOM 537 CA PRO A 68 42.128 15.856 136.305 1.00 43.62 C ATOM 538 C PRO A 68 41.061 15.645 135.240 1.00 44.00 C ATOM 539 O PRO A 68 41.340 15.745 134.046 1.00 44.31 O ATOM 540 CB PRO A 68 42.873 14.545 136.598 1.00 42.82 C ATOM 541 CG PRO A 68 43.089 14.550 138.082 1.00 43.82 C ATOM 542 CD PRO A 68 41.864 15.209 138.635 1.00 44.34 C ATOM 543 N LYS A 69 39.848 15.386 135.686 1.00 43.85 N ATOM 544 CA LYS A 69 38.754 15.152 134.802 1.00 42.03 C ATOM 545 C LYS A 69 37.977 16.384 134.494 1.00 40.66 C ATOM 546 O LYS A 69 37.454 16.499 133.428 1.00 41.01 O ATOM 547 CB LYS A 69 37.846 14.084 135.367 1.00 42.90 C ATOM 548 CG LYS A 69 38.518 12.743 135.436 1.00 42.83 C ATOM 549 CD LYS A 69 37.565 11.642 135.803 1.00 44.38 C ATOM 550 CE LYS A 69 37.141 11.743 137.244 1.00 46.46 C ATOM 551 NZ LYS A 69 36.820 10.411 137.802 1.00 47.92 N ATOM 552 HZ1 LYS A 69 36.044 9.986 137.256 1.00 0.00 H ATOM 553 HZ2 LYS A 69 37.660 9.801 137.745 1.00 0.00 H ATOM 554 HZ3 LYS A 69 36.531 10.513 138.796 1.00 0.00 H ATOM 555 H LYS A 69 39.684 15.351 136.712 1.00 0.00 H ATOM 556 N LYS A 70 37.897 17.312 135.427 1.00 39.89 N ATOM 557 CA LYS A 70 37.040 18.466 135.230 1.00 40.42 C ATOM 558 C LYS A 70 37.703 19.803 135.176 1.00 40.46 C ATOM 559 O LYS A 70 37.277 20.647 134.475 1.00 41.92 O ATOM 560 CB LYS A 70 35.908 18.460 136.223 1.00 41.28 C ATOM 561 CG LYS A 70 35.002 17.306 136.007 1.00 41.39 C ATOM 562 CD LYS A 70 34.207 17.011 137.244 1.00 43.66 C ATOM 563 CE LYS A 70 32.758 16.872 136.893 1.00 45.48 C ATOM 564 NZ LYS A 70 32.351 17.929 135.956 1.00 46.66 N ATOM 565 HZ1 LYS A 70 32.505 18.859 136.396 1.00 0.00 H ATOM 566 HZ2 LYS A 70 32.918 17.857 135.087 1.00 0.00 H ATOM 567 HZ3 LYS A 70 31.343 17.816 135.724 1.00 0.00 H ATOM 568 H LYS A 70 38.448 17.217 136.304 1.00 0.00 H ATOM 569 N ASP A 71 38.770 19.980 135.906 1.00 39.30 N ATOM 570 CA ASP A 71 39.456 21.274 135.951 1.00 39.26 C ATOM 571 C ASP A 71 40.140 21.618 134.636 1.00 37.11 C ATOM 572 O ASP A 71 41.007 20.884 134.168 1.00 34.74 O ATOM 573 CB ASP A 71 40.479 21.320 137.088 1.00 40.61 C ATOM 574 CG ASP A 71 39.827 21.433 138.446 1.00 43.30 C ATOM 575 OD1 ASP A 71 38.631 21.781 138.491 1.00 44.77 O ATOM 576 OD2 ASP A 71 40.506 21.191 139.465 1.00 44.15 O ATOM 577 H ASP A 71 39.141 19.187 136.467 1.00 0.00 H ATOM 578 N ARG A 72 39.740 22.745 134.052 1.00 38.31 N ATOM 579 CA ARG A 72 40.334 23.233 132.812 1.00 37.74 C ATOM 580 C ARG A 72 41.686 23.878 133.092 1.00 38.01 C ATOM 581 O ARG A 72 41.980 24.269 134.223 1.00 38.84 O ATOM 582 CB ARG A 72 39.419 24.252 132.121 1.00 39.72 C ATOM 583 CG ARG A 72 37.937 23.888 132.065 1.00 40.77 C ATOM 584 CD ARG A 72 37.651 22.766 131.084 1.00 39.67 C ATOM 585 NE ARG A 72 38.120 23.070 129.736 1.00 39.20 N ATOM 586 CZ ARG A 72 37.357 23.577 128.773 1.00 40.07 C ATOM 587 NH1 ARG A 72 36.079 23.840 129.002 1.00 41.10 N ATOM 588 NH2 ARG A 72 37.871 23.817 127.575 1.00 40.14 N ATOM 589 HE ARG A 72 39.118 22.877 129.514 1.00 0.00 H ATOM 590 HH12 ARG A 72 35.486 24.237 128.245 1.00 0.00 H ATOM 591 HH11 ARG A 72 35.669 23.650 129.939 1.00 0.00 H ATOM 592 HH22 ARG A 72 37.273 24.214 126.822 1.00 0.00 H ATOM 593 HH21 ARG A 72 38.873 23.609 127.388 1.00 0.00 H ATOM 594 H ARG A 72 38.978 23.297 134.495 1.00 0.00 H ATOM 595 N TYR A 73 42.511 23.970 132.055 1.00 37.16 N ATOM 596 CA TYR A 73 43.779 24.678 132.131 1.00 37.66 C ATOM 597 C TYR A 73 44.152 25.178 130.741 1.00 38.19 C ATOM 598 O TYR A 73 43.534 24.789 129.752 1.00 36.96 O ATOM 599 CB TYR A 73 44.873 23.774 132.707 1.00 37.51 C ATOM 600 CG TYR A 73 45.058 22.479 131.950 1.00 35.93 C ATOM 601 CD1 TYR A 73 45.818 22.431 130.785 1.00 35.64 C ATOM 602 CD2 TYR A 73 44.459 21.306 132.393 1.00 34.89 C ATOM 603 CE1 TYR A 73 45.975 21.252 130.085 1.00 34.55 C ATOM 604 CE2 TYR A 73 44.613 20.121 131.701 1.00 34.12 C ATOM 605 CZ TYR A 73 45.373 20.100 130.549 1.00 34.24 C ATOM 606 OH TYR A 73 45.530 18.923 129.856 1.00 34.06 O ATOM 607 HH TYR A 73 45.960 18.251 130.442 1.00 0.00 H ATOM 608 H TYR A 73 42.241 23.520 131.157 1.00 0.00 H ATOM 609 N SER A 74 45.172 26.027 130.665 1.00 40.55 N ATOM 610 CA SER A 74 45.575 26.629 129.398 1.00 40.92 C ATOM 611 C SER A 74 46.834 25.977 128.847 1.00 40.18 C ATOM 612 O SER A 74 47.798 25.740 129.575 1.00 41.78 O ATOM 613 CB SER A 74 45.806 28.130 129.566 1.00 44.09 C ATOM 614 OG SER A 74 44.590 28.807 129.831 1.00 46.26 O ATOM 615 HG SER A 74 44.769 29.775 129.935 1.00 0.00 H ATOM 616 H SER A 74 45.696 26.268 131.530 1.00 0.00 H ATOM 617 N TYR A 75 46.820 25.691 127.552 1.00 37.99 N ATOM 618 CA TYR A 75 47.997 25.176 126.875 1.00 36.16 C ATOM 619 C TYR A 75 47.949 25.614 125.425 1.00 35.94 C ATOM 620 O TYR A 75 46.888 25.970 124.919 1.00 34.77 O ATOM 621 CB TYR A 75 48.081 23.653 126.989 1.00 34.13 C ATOM 622 CG TYR A 75 47.323 22.884 125.925 1.00 30.81 C ATOM 623 CD1 TYR A 75 45.988 22.546 126.102 1.00 35.35 C ATOM 624 CD2 TYR A 75 47.953 22.474 124.755 1.00 30.07 C ATOM 625 CE1 TYR A 75 45.297 21.836 125.136 1.00 34.37 C ATOM 626 CE2 TYR A 75 47.274 21.768 123.784 1.00 29.07 C ATOM 627 CZ TYR A 75 45.946 21.448 123.980 1.00 34.34 C ATOM 628 OH TYR A 75 45.267 20.743 123.015 1.00 28.18 O ATOM 629 HH TYR A 75 45.710 19.869 122.874 1.00 0.00 H ATOM 630 H TYR A 75 45.946 25.839 127.009 1.00 0.00 H ATOM 631 N SER A 76 49.100 25.594 124.763 1.00 35.22 N ATOM 632 CA SER A 76 49.184 26.041 123.380 1.00 34.94 C ATOM 633 C SER A 76 49.734 24.958 122.467 1.00 33.34 C ATOM 634 O SER A 76 50.541 24.129 122.884 1.00 32.24 O ATOM 635 CB SER A 76 50.063 27.286 123.278 1.00 37.01 C ATOM 636 OG SER A 76 49.600 28.307 124.140 1.00 38.96 O ATOM 637 HG SER A 76 50.186 29.100 124.054 1.00 0.00 H ATOM 638 H SER A 76 49.958 25.252 125.242 1.00 0.00 H ATOM 639 N TRP A 77 49.283 24.959 121.235 1.00 33.55 N ATOM 640 CA TRP A 77 49.820 24.108 120.198 1.00 33.05 C ATOM 641 C TRP A 77 50.763 24.954 119.351 1.00 36.10 C ATOM 642 O TRP A 77 50.355 25.665 118.461 1.00 37.52 O ATOM 643 CB TRP A 77 48.705 23.459 119.404 1.00 30.99 C ATOM 644 CG TRP A 77 49.092 22.502 118.340 1.00 29.67 C ATOM 645 CD1 TRP A 77 48.926 22.676 117.044 1.00 30.02 C ATOM 646 CD2 TRP A 77 49.688 21.219 118.489 1.00 29.69 C ATOM 647 NE1 TRP A 77 49.354 21.619 116.355 1.00 29.07 N ATOM 648 CE2 TRP A 77 49.847 20.699 117.222 1.00 29.15 C ATOM 649 CE3 TRP A 77 50.126 20.471 119.571 1.00 29.57 C ATOM 650 CZ2 TRP A 77 50.408 19.466 116.997 1.00 27.29 C ATOM 651 CZ3 TRP A 77 50.676 19.267 119.339 1.00 28.51 C ATOM 652 CH2 TRP A 77 50.813 18.770 118.071 1.00 27.38 C ATOM 653 HE1 TRP A 77 49.316 21.516 115.321 1.00 0.00 H ATOM 654 H TRP A 77 48.502 25.602 120.993 1.00 0.00 H ATOM 655 N LYS A 78 52.036 24.901 119.704 1.00 35.75 N ATOM 656 CA LYS A 78 53.055 25.774 119.151 1.00 36.98 C ATOM 657 C LYS A 78 54.165 25.018 118.488 1.00 36.59 C ATOM 658 O LYS A 78 54.897 24.308 119.116 1.00 33.77 O ATOM 659 CB LYS A 78 53.619 26.694 120.223 1.00 38.55 C ATOM 660 H LYS A 78 52.322 24.197 120.415 1.00 0.00 H ATOM 661 N ASP A 79 54.252 25.195 117.188 1.00 36.84 N ATOM 662 CA ASP A 79 55.230 24.544 116.376 1.00 36.75 C ATOM 663 C ASP A 79 55.025 23.075 116.528 1.00 33.96 C ATOM 664 O ASP A 79 55.936 22.328 116.679 1.00 32.73 O ATOM 665 CB ASP A 79 56.615 24.971 116.802 1.00 39.82 C ATOM 666 CG ASP A 79 57.630 24.720 115.766 1.00 41.92 C ATOM 667 OD1 ASP A 79 57.320 24.845 114.596 1.00 42.83 O ATOM 668 OD2 ASP A 79 58.742 24.364 116.115 1.00 43.09 O ATOM 669 H ASP A 79 53.577 25.839 116.729 1.00 0.00 H ATOM 670 N LYS A 80 53.776 22.685 116.522 1.00 33.71 N ATOM 671 CA LYS A 80 53.391 21.325 116.757 1.00 32.48 C ATOM 672 C LYS A 80 53.923 20.705 118.022 1.00 32.65 C ATOM 673 O LYS A 80 54.262 19.569 118.050 1.00 33.12 O ATOM 674 CB LYS A 80 53.779 20.522 115.567 1.00 32.66 C ATOM 675 CG LYS A 80 53.171 21.059 114.318 1.00 33.90 C ATOM 676 CD LYS A 80 53.334 20.060 113.227 1.00 34.18 C ATOM 677 CE LYS A 80 54.543 20.395 112.421 1.00 35.19 C ATOM 678 NZ LYS A 80 54.587 19.574 111.215 1.00 36.15 N ATOM 679 HZ1 LYS A 80 54.622 18.569 111.482 1.00 0.00 H ATOM 680 HZ2 LYS A 80 53.736 19.753 110.644 1.00 0.00 H ATOM 681 HZ3 LYS A 80 55.434 19.817 110.662 1.00 0.00 H ATOM 682 H LYS A 80 53.033 23.390 116.339 1.00 0.00 H ATOM 683 N THR A 81 53.999 21.486 119.071 1.00 32.36 N ATOM 684 CA THR A 81 54.388 20.996 120.358 1.00 32.37 C ATOM 685 C THR A 81 53.389 21.449 121.361 1.00 32.62 C ATOM 686 O THR A 81 52.955 22.533 121.348 1.00 33.22 O ATOM 687 CB THR A 81 55.766 21.508 120.805 1.00 34.05 C ATOM 688 OG1 THR A 81 56.734 21.235 119.810 1.00 34.86 O ATOM 689 CG2 THR A 81 56.184 20.839 122.033 1.00 32.68 C ATOM 690 HG1 THR A 81 56.477 21.688 118.968 1.00 0.00 H ATOM 691 H THR A 81 53.769 22.495 118.965 1.00 0.00 H ATOM 692 N ILE A 82 53.031 20.587 122.277 1.00 33.03 N ATOM 693 CA ILE A 82 52.139 20.943 123.363 1.00 33.36 C ATOM 694 C ILE A 82 52.946 21.688 124.388 1.00 34.27 C ATOM 695 O ILE A 82 53.835 21.163 124.943 1.00 35.58 O ATOM 696 CB ILE A 82 51.491 19.681 123.964 1.00 33.26 C ATOM 697 CG1 ILE A 82 50.654 18.979 122.917 1.00 33.31 C ATOM 698 CG2 ILE A 82 50.650 19.979 125.183 1.00 33.19 C ATOM 699 CD1 ILE A 82 49.999 17.706 123.379 1.00 32.40 C ATOM 700 H ILE A 82 53.398 19.615 122.225 1.00 0.00 H ATOM 701 N VAL A 83 52.643 22.941 124.604 1.00 35.00 N ATOM 702 CA VAL A 83 53.342 23.745 125.569 1.00 36.33 C ATOM 703 C VAL A 83 52.418 24.152 126.698 1.00 38.55 C ATOM 704 O VAL A 83 51.500 24.903 126.524 1.00 38.90 O ATOM 705 CB VAL A 83 53.929 24.982 124.908 1.00 37.45 C ATOM 706 CG1 VAL A 83 54.664 25.824 125.920 1.00 38.61 C ATOM 707 CG2 VAL A 83 54.849 24.586 123.784 1.00 36.91 C ATOM 708 H VAL A 83 51.869 23.371 124.059 1.00 0.00 H ATOM 709 N CYS A 84 52.661 23.619 127.866 1.00 40.22 N ATOM 710 CA CYS A 84 51.803 23.900 128.975 1.00 41.78 C ATOM 711 C CYS A 84 52.062 25.314 129.374 1.00 46.67 C ATOM 712 O CYS A 84 53.165 25.676 129.647 1.00 48.55 O ATOM 713 CB CYS A 84 52.121 22.963 130.121 1.00 40.48 C ATOM 714 SG CYS A 84 51.386 21.339 130.021 1.00 44.44 S ATOM 715 H CYS A 84 53.480 22.989 127.989 1.00 0.00 H ATOM 716 N GLY A 85 51.044 26.127 129.377 1.00 49.75 N ATOM 717 CA GLY A 85 51.204 27.444 129.894 1.00 55.18 C ATOM 718 C GLY A 85 50.995 27.310 131.373 1.00 58.25 C ATOM 719 O GLY A 85 51.683 26.607 132.100 1.00 60.25 O ATOM 720 H GLY A 85 50.123 25.817 129.005 1.00 0.00 H ATOM 721 N GLU A 86 49.978 27.973 131.825 1.00 58.69 N ATOM 722 CA GLU A 86 49.399 27.632 133.101 1.00 59.83 C ATOM 723 C GLU A 86 49.978 28.183 134.367 1.00 61.64 C ATOM 724 O GLU A 86 51.079 27.899 134.771 1.00 62.31 O ATOM 725 CB GLU A 86 49.199 26.114 133.232 1.00 57.88 C ATOM 726 CG GLU A 86 47.776 25.639 133.119 1.00 56.68 C ATOM 727 CD GLU A 86 46.753 26.675 133.484 1.00 59.13 C ATOM 728 OE1 GLU A 86 46.797 27.146 134.617 1.00 60.77 O ATOM 729 OE2 GLU A 86 45.955 27.055 132.627 1.00 59.44 O ATOM 730 H GLU A 86 49.578 28.753 131.266 1.00 0.00 H ATOM 731 N ASN A 87 49.139 28.942 135.018 1.00 62.67 N ATOM 732 CA ASN A 87 49.452 29.402 136.321 1.00 64.88 C ATOM 733 C ASN A 87 48.931 28.296 137.135 1.00 62.40 C ATOM 734 O ASN A 87 48.387 27.364 136.603 1.00 60.52 O ATOM 735 CB ASN A 87 48.672 30.668 136.606 1.00 68.03 C ATOM 736 H ASN A 87 48.236 29.211 134.578 1.00 0.00 H ATOM 737 N ASN A 88 49.043 28.404 138.433 1.00 62.64 N ATOM 738 CA ASN A 88 48.475 27.445 139.315 1.00 60.05 C ATOM 739 C ASN A 88 49.298 26.206 139.179 1.00 57.61 C ATOM 740 O ASN A 88 49.276 25.559 138.168 1.00 55.20 O ATOM 741 CB ASN A 88 47.022 27.243 138.960 1.00 58.54 C ATOM 742 CG ASN A 88 46.342 26.293 139.852 1.00 57.13 C ATOM 743 OD1 ASN A 88 46.899 25.302 140.216 1.00 56.01 O ATOM 744 ND2 ASN A 88 45.124 26.578 140.184 1.00 57.67 N ATOM 745 HD22 ASN A 88 44.683 27.455 139.840 1.00 0.00 H ATOM 746 HD21 ASN A 88 44.586 25.930 140.794 1.00 0.00 H ATOM 747 H ASN A 88 49.561 29.213 138.831 1.00 0.00 H ATOM 748 N PRO A 90 50.109 25.913 140.284 1.00 50.15 N ATOM 749 CA PRO A 90 51.015 24.765 140.073 1.00 48.98 C ATOM 750 C PRO A 90 50.386 23.397 139.805 1.00 46.58 C ATOM 751 O PRO A 90 50.901 22.614 139.053 1.00 45.54 O ATOM 752 CB PRO A 90 51.812 24.700 141.359 1.00 51.11 C ATOM 753 CG PRO A 90 51.831 26.070 141.861 1.00 52.52 C ATOM 754 CD PRO A 90 50.435 26.462 141.687 1.00 52.04 C ATOM 755 N CYS A 91 49.287 23.103 140.446 1.00 45.47 N ATOM 756 CA CYS A 91 48.621 21.818 140.256 1.00 42.93 C ATOM 757 C CYS A 91 48.135 21.651 138.818 1.00 40.70 C ATOM 758 O CYS A 91 48.335 20.600 138.204 1.00 38.90 O ATOM 759 CB CYS A 91 47.453 21.663 141.226 1.00 43.28 C ATOM 760 SG CYS A 91 46.861 19.966 141.354 1.00 47.75 S ATOM 761 H CYS A 91 48.879 23.797 141.104 1.00 0.00 H ATOM 762 N LEU A 92 47.477 22.665 138.301 1.00 40.92 N ATOM 763 CA LEU A 92 46.992 22.671 136.946 1.00 39.47 C ATOM 764 C LEU A 92 48.118 22.460 135.946 1.00 38.13 C ATOM 765 O LEU A 92 47.939 21.817 134.977 1.00 35.59 O ATOM 766 CB LEU A 92 46.261 23.971 136.638 1.00 40.03 C ATOM 767 CG LEU A 92 44.912 24.156 137.288 1.00 42.14 C ATOM 768 CD1 LEU A 92 44.143 25.257 136.632 1.00 42.20 C ATOM 769 CD2 LEU A 92 44.104 22.892 137.236 1.00 42.02 C ATOM 770 H LEU A 92 47.299 23.499 138.897 1.00 0.00 H ATOM 771 N LYS A 93 49.279 23.016 136.214 1.00 39.60 N ATOM 772 CA LYS A 93 50.432 22.853 135.378 1.00 39.90 C ATOM 773 C LYS A 93 50.993 21.437 135.391 1.00 39.34 C ATOM 774 O LYS A 93 51.359 20.937 134.379 1.00 38.25 O ATOM 775 CB LYS A 93 51.478 23.889 135.756 1.00 42.11 C ATOM 776 CG LYS A 93 52.919 23.528 135.516 1.00 42.69 C ATOM 777 CD LYS A 93 53.610 24.595 134.718 1.00 44.26 C ATOM 778 CE LYS A 93 53.837 24.130 133.306 1.00 47.03 C ATOM 779 NZ LYS A 93 55.199 23.572 133.089 1.00 47.67 N ATOM 780 HZ1 LYS A 93 55.909 24.302 133.300 1.00 0.00 H ATOM 781 HZ2 LYS A 93 55.342 22.756 133.718 1.00 0.00 H ATOM 782 HZ3 LYS A 93 55.295 23.269 132.099 1.00 0.00 H ATOM 783 H LYS A 93 49.365 23.600 137.070 1.00 0.00 H ATOM 784 N GLU A 94 51.061 20.789 136.535 1.00 40.29 N ATOM 785 CA GLU A 94 51.505 19.423 136.618 1.00 39.64 C ATOM 786 C GLU A 94 50.549 18.519 135.908 1.00 36.67 C ATOM 787 O GLU A 94 50.936 17.576 135.269 1.00 35.15 O ATOM 788 CB GLU A 94 51.508 18.984 138.052 1.00 43.99 C ATOM 789 CG GLU A 94 52.712 19.360 138.855 1.00 48.25 C ATOM 790 CD GLU A 94 54.006 19.178 138.118 1.00 49.47 C ATOM 791 OE1 GLU A 94 54.378 18.042 137.838 1.00 49.25 O ATOM 792 OE2 GLU A 94 54.663 20.180 137.862 1.00 50.58 O ATOM 793 H GLU A 94 50.784 21.281 137.408 1.00 0.00 H ATOM 794 N LEU A 95 49.275 18.821 136.047 1.00 35.29 N ATOM 795 CA LEU A 95 48.238 18.092 135.398 1.00 32.30 C ATOM 796 C LEU A 95 48.348 18.254 133.892 1.00 30.35 C ATOM 797 O LEU A 95 48.241 17.336 133.152 1.00 28.42 O ATOM 798 CB LEU A 95 46.893 18.559 135.898 1.00 33.01 C ATOM 799 CG LEU A 95 45.684 18.257 135.043 1.00 30.95 C ATOM 800 CD1 LEU A 95 45.212 16.849 135.182 1.00 27.58 C ATOM 801 CD2 LEU A 95 44.591 19.200 135.392 1.00 33.62 C ATOM 802 H LEU A 95 49.016 19.624 136.655 1.00 0.00 H ATOM 803 N CYS A 96 48.607 19.459 133.463 1.00 31.94 N ATOM 804 CA CYS A 96 48.876 19.697 132.053 1.00 32.50 C ATOM 805 C CYS A 96 50.082 18.887 131.578 1.00 33.86 C ATOM 806 O CYS A 96 50.077 18.354 130.468 1.00 35.29 O ATOM 807 CB CYS A 96 49.110 21.184 131.794 1.00 32.22 C ATOM 808 SG CYS A 96 49.465 21.569 130.063 1.00 36.88 S ATOM 809 H CYS A 96 48.621 20.254 134.133 1.00 0.00 H ATOM 810 N GLU A 97 51.118 18.801 132.410 1.00 32.87 N ATOM 811 CA GLU A 97 52.288 18.014 132.048 1.00 31.41 C ATOM 812 C GLU A 97 51.952 16.524 132.018 1.00 30.56 C ATOM 813 O GLU A 97 52.427 15.801 131.144 1.00 29.84 O ATOM 814 CB GLU A 97 53.448 18.279 133.015 1.00 32.10 C ATOM 815 CG GLU A 97 54.012 19.700 132.967 1.00 32.62 C ATOM 816 CD GLU A 97 54.602 20.065 131.611 1.00 32.64 C ATOM 817 OE1 GLU A 97 55.030 19.153 130.868 1.00 32.73 O ATOM 818 OE2 GLU A 97 54.642 21.270 131.290 1.00 32.50 O ATOM 819 H GLU A 97 51.091 19.298 133.323 1.00 0.00 H ATOM 820 N CYS A 98 51.108 16.074 132.945 1.00 31.15 N ATOM 821 CA CYS A 98 50.632 14.685 132.930 1.00 30.59 C ATOM 822 C CYS A 98 49.925 14.352 131.618 1.00 29.54 C ATOM 823 O CYS A 98 50.230 13.343 130.981 1.00 29.65 O ATOM 824 CB CYS A 98 49.686 14.409 134.104 1.00 31.20 C ATOM 825 SG CYS A 98 50.469 14.320 135.727 1.00 34.96 S ATOM 826 H CYS A 98 50.780 16.718 133.693 1.00 0.00 H ATOM 827 N ASP A 99 48.978 15.202 131.225 1.00 28.43 N ATOM 828 CA ASP A 99 48.217 14.991 129.997 1.00 27.09 C ATOM 829 C ASP A 99 49.111 15.072 128.761 1.00 26.96 C ATOM 830 O ASP A 99 48.942 14.308 127.810 1.00 26.84 O ATOM 831 CB ASP A 99 47.079 16.010 129.884 1.00 26.54 C ATOM 832 CG ASP A 99 46.044 15.857 130.987 1.00 28.82 C ATOM 833 OD1 ASP A 99 46.042 14.803 131.662 1.00 30.53 O ATOM 834 OD2 ASP A 99 45.225 16.783 131.169 1.00 29.27 O ATOM 835 H ASP A 99 48.775 16.039 131.809 1.00 0.00 H ATOM 836 N LYS A 100 50.063 16.000 128.778 1.00 26.76 N ATOM 837 CA LYS A 100 50.997 16.146 127.669 1.00 25.72 C ATOM 838 C LYS A 100 51.815 14.873 127.482 1.00 24.55 C ATOM 839 O LYS A 100 52.009 14.404 126.359 1.00 24.01 O ATOM 840 CB LYS A 100 51.930 17.335 127.895 1.00 26.37 C ATOM 841 CG LYS A 100 53.109 17.353 126.934 1.00 26.44 C ATOM 842 CD LYS A 100 54.010 18.544 127.147 1.00 26.62 C ATOM 843 CE LYS A 100 55.251 18.445 126.266 1.00 26.27 C ATOM 844 NZ LYS A 100 56.050 19.703 126.309 1.00 26.74 N ATOM 845 HZ1 LYS A 100 55.466 20.495 125.971 1.00 0.00 H ATOM 846 HZ2 LYS A 100 56.352 19.887 127.287 1.00 0.00 H ATOM 847 HZ3 LYS A 100 56.886 19.602 125.699 1.00 0.00 H ATOM 848 H LYS A 100 50.143 16.634 129.599 1.00 0.00 H ATOM 849 N ALA A 101 52.276 14.312 128.594 1.00 24.57 N ATOM 850 CA ALA A 101 53.095 13.109 128.557 1.00 24.87 C ATOM 851 C ALA A 101 52.370 11.959 127.872 1.00 26.40 C ATOM 852 O ALA A 101 52.914 11.329 126.959 1.00 27.70 O ATOM 853 CB ALA A 101 53.497 12.708 129.956 1.00 24.51 C ATOM 854 H ALA A 101 52.047 14.742 129.513 1.00 0.00 H ATOM 855 N VAL A 102 51.132 11.704 128.290 1.00 25.50 N ATOM 856 CA VAL A 102 50.409 10.551 127.774 1.00 24.54 C ATOM 857 C VAL A 102 50.090 10.760 126.301 1.00 23.96 C ATOM 858 O VAL A 102 50.145 9.817 125.518 1.00 24.89 O ATOM 859 CB VAL A 102 49.107 10.251 128.584 1.00 21.04 C ATOM 860 CG1 VAL A 102 48.102 11.388 128.492 1.00 21.75 C ATOM 861 CG2 VAL A 102 48.482 8.948 128.117 1.00 20.94 C ATOM 862 H VAL A 102 50.680 12.330 128.987 1.00 0.00 H ATOM 863 N ALA A 103 49.799 11.999 125.919 1.00 23.76 N ATOM 864 CA ALA A 103 49.475 12.310 124.530 1.00 23.91 C ATOM 865 C ALA A 103 50.639 11.950 123.613 1.00 24.48 C ATOM 866 O ALA A 103 50.460 11.264 122.604 1.00 23.93 O ATOM 867 CB ALA A 103 49.114 13.779 124.384 1.00 20.60 C ATOM 868 H ALA A 103 49.802 12.763 126.624 1.00 0.00 H ATOM 869 N ILE A 104 51.831 12.414 123.981 1.00 25.36 N ATOM 870 CA ILE A 104 53.057 12.074 123.266 1.00 24.18 C ATOM 871 C ILE A 104 53.273 10.565 123.257 1.00 23.64 C ATOM 872 O ILE A 104 53.543 9.974 122.212 1.00 24.04 O ATOM 873 CB ILE A 104 54.286 12.762 123.893 1.00 24.39 C ATOM 874 CG1 ILE A 104 54.169 14.282 123.768 1.00 25.30 C ATOM 875 CG2 ILE A 104 55.592 12.234 123.270 1.00 23.52 C ATOM 876 CD1 ILE A 104 55.166 15.038 124.623 1.00 25.97 C ATOM 877 H ILE A 104 51.891 13.042 124.808 1.00 0.00 H ATOM 878 N CYS A 105 53.139 9.949 124.427 1.00 23.15 N ATOM 879 CA CYS A 105 53.340 8.512 124.563 1.00 24.85 C ATOM 880 C CYS A 105 52.372 7.730 123.671 1.00 26.83 C ATOM 881 O CYS A 105 52.756 6.742 123.037 1.00 28.19 O ATOM 882 CB CYS A 105 53.176 8.090 126.027 1.00 25.09 C ATOM 883 SG CYS A 105 53.633 6.374 126.400 1.00 26.70 S ATOM 884 H CYS A 105 52.884 10.507 125.267 1.00 0.00 H ATOM 885 N LEU A 106 51.123 8.184 123.609 1.00 26.21 N ATOM 886 CA LEU A 106 50.125 7.525 122.779 1.00 26.76 C ATOM 887 C LEU A 106 50.493 7.611 121.303 1.00 28.17 C ATOM 888 O LEU A 106 50.294 6.658 120.547 1.00 29.23 O ATOM 889 CB LEU A 106 48.737 8.127 123.013 1.00 25.89 C ATOM 890 CG LEU A 106 48.084 7.795 124.359 1.00 25.39 C ATOM 891 CD1 LEU A 106 46.720 8.467 124.477 1.00 26.60 C ATOM 892 CD2 LEU A 106 47.980 6.291 124.576 1.00 24.45 C ATOM 893 H LEU A 106 50.855 9.023 124.162 1.00 0.00 H ATOM 894 N ARG A 107 51.023 8.759 120.893 1.00 27.50 N ATOM 895 CA ARG A 107 51.428 8.945 119.507 1.00 27.58 C ATOM 896 C ARG A 107 52.664 8.111 119.179 1.00 28.65 C ATOM 897 O ARG A 107 52.772 7.556 118.088 1.00 30.22 O ATOM 898 CB ARG A 107 51.686 10.422 119.219 1.00 26.76 C ATOM 899 CG ARG A 107 52.143 10.711 117.804 1.00 26.68 C ATOM 900 CD ARG A 107 53.636 10.972 117.766 1.00 26.50 C ATOM 901 NE ARG A 107 54.009 12.040 118.689 1.00 26.91 N ATOM 902 CZ ARG A 107 55.255 12.306 119.067 1.00 26.77 C ATOM 903 NH1 ARG A 107 56.264 11.576 118.607 1.00 27.06 N ATOM 904 NH2 ARG A 107 55.493 13.299 119.913 1.00 25.67 N ATOM 905 HE ARG A 107 53.248 12.633 119.077 1.00 0.00 H ATOM 906 HH12 ARG A 107 57.237 11.788 118.905 1.00 0.00 H ATOM 907 HH11 ARG A 107 56.081 10.792 117.948 1.00 0.00 H ATOM 908 HH22 ARG A 107 56.468 13.508 120.209 1.00 0.00 H ATOM 909 HH21 ARG A 107 54.705 13.869 120.280 1.00 0.00 H ATOM 910 H ARG A 107 51.150 9.536 121.572 1.00 0.00 H ATOM 911 N GLU A 108 53.596 8.026 120.122 1.00 28.73 N ATOM 912 CA GLU A 108 54.817 7.259 119.900 1.00 29.94 C ATOM 913 C GLU A 108 54.521 5.772 119.761 1.00 31.96 C ATOM 914 O GLU A 108 55.279 5.038 119.128 1.00 33.44 O ATOM 915 CB GLU A 108 55.821 7.489 121.034 1.00 28.63 C ATOM 916 CG GLU A 108 56.453 8.869 121.037 1.00 28.51 C ATOM 917 CD GLU A 108 57.246 9.143 122.295 1.00 29.71 C ATOM 918 OE1 GLU A 108 57.021 8.439 123.301 1.00 30.25 O ATOM 919 OE2 GLU A 108 58.101 10.058 122.278 1.00 30.54 O ATOM 920 H GLU A 108 53.453 8.512 121.030 1.00 0.00 H ATOM 921 N ASN A 109 53.411 5.331 120.341 1.00 32.55 N ATOM 922 CA ASN A 109 53.081 3.915 120.321 1.00 32.96 C ATOM 923 C ASN A 109 51.877 3.606 119.447 1.00 33.63 C ATOM 924 O ASN A 109 51.128 2.668 119.710 1.00 36.07 O ATOM 925 CB ASN A 109 52.846 3.416 121.744 1.00 31.90 C ATOM 926 CG ASN A 109 54.094 3.513 122.598 1.00 30.87 C ATOM 927 OD1 ASN A 109 54.974 2.651 122.529 1.00 31.13 O ATOM 928 ND2 ASN A 109 54.180 4.562 123.406 1.00 29.49 N ATOM 929 HD22 ASN A 109 53.413 5.264 123.430 1.00 0.00 H ATOM 930 HD21 ASN A 109 55.015 4.682 124.015 1.00 0.00 H ATOM 931 H ASN A 109 52.773 6.003 120.813 1.00 0.00 H ATOM 932 N LEU A 110 51.712 4.386 118.386 1.00 31.93 N ATOM 933 CA LEU A 110 50.659 4.128 117.418 1.00 30.77 C ATOM 934 C LEU A 110 50.967 2.873 116.614 1.00 30.49 C ATOM 935 O LEU A 110 50.063 2.217 116.091 1.00 30.53 O ATOM 936 CB LEU A 110 50.485 5.326 116.487 1.00 30.26 C ATOM 937 CG LEU A 110 49.468 6.368 116.947 1.00 28.72 C ATOM 938 CD1 LEU A 110 49.553 7.621 116.096 1.00 28.31 C ATOM 939 CD2 LEU A 110 48.080 5.767 116.886 1.00 29.54 C ATOM 940 H LEU A 110 52.348 5.197 118.245 1.00 0.00 H ATOM 941 N GLY A 111 52.251 2.533 116.537 1.00 29.29 N ATOM 942 CA GLY A 111 52.698 1.406 115.744 1.00 28.87 C ATOM 943 C GLY A 111 52.236 0.066 116.276 1.00 29.90 C ATOM 944 O GLY A 111 52.185 -0.908 115.534 1.00 32.12 O ATOM 945 H GLY A 111 52.954 3.092 117.061 1.00 0.00 H ATOM 946 N THR A 112 51.896 0.011 117.560 1.00 29.98 N ATOM 947 CA THR A 112 51.410 -1.229 118.160 1.00 30.44 C ATOM 948 C THR A 112 49.988 -1.083 118.698 1.00 31.71 C ATOM 949 O THR A 112 49.552 -1.868 119.546 1.00 31.94 O ATOM 950 CB THR A 112 52.330 -1.711 119.301 1.00 28.63 C ATOM 951 OG1 THR A 112 52.460 -0.678 120.285 1.00 28.87 O ATOM 952 CG2 THR A 112 53.701 -2.083 118.761 1.00 27.10 C ATOM 953 HG1 THR A 112 52.852 0.129 119.865 1.00 0.00 H ATOM 954 H THR A 112 51.977 0.865 118.147 1.00 0.00 H ATOM 955 N TYR A 113 49.268 -0.080 118.205 1.00 32.30 N ATOM 956 CA TYR A 113 47.875 0.101 118.594 1.00 32.06 C ATOM 957 C TYR A 113 47.047 -1.094 118.131 1.00 33.98 C ATOM 958 O TYR A 113 47.025 -1.432 116.948 1.00 35.08 O ATOM 959 CB TYR A 113 47.312 1.408 118.025 1.00 31.52 C ATOM 960 CG TYR A 113 45.901 1.709 118.478 1.00 32.37 C ATOM 961 CD1 TYR A 113 44.805 1.099 117.870 1.00 33.92 C ATOM 962 CD2 TYR A 113 45.663 2.576 119.536 1.00 31.94 C ATOM 963 CE1 TYR A 113 43.515 1.364 118.287 1.00 34.17 C ATOM 964 CE2 TYR A 113 44.373 2.846 119.962 1.00 32.69 C ATOM 965 CZ TYR A 113 43.304 2.235 119.334 1.00 33.88 C ATOM 966 OH TYR A 113 42.021 2.496 119.755 1.00 34.69 O ATOM 967 HH TYR A 113 41.926 2.231 120.704 1.00 0.00 H ATOM 968 H TYR A 113 49.704 0.584 117.533 1.00 0.00 H ATOM 969 N ASN A 114 46.364 -1.722 119.064 1.00 34.78 N ATOM 970 CA ASN A 114 45.557 -2.903 118.808 1.00 36.96 C ATOM 971 C ASN A 114 44.056 -2.660 118.975 1.00 37.77 C ATOM 972 O ASN A 114 43.574 -2.436 120.042 1.00 36.29 O ATOM 973 CB ASN A 114 46.026 -4.005 119.725 1.00 37.56 C ATOM 974 CG ASN A 114 45.677 -5.354 119.240 1.00 40.76 C ATOM 975 OD1 ASN A 114 44.912 -5.516 118.337 1.00 42.28 O ATOM 976 ND2 ASN A 114 46.244 -6.337 119.853 1.00 42.60 N ATOM 977 HD22 ASN A 114 46.904 -6.151 120.635 1.00 0.00 H ATOM 978 HD21 ASN A 114 46.041 -7.316 119.566 1.00 0.00 H ATOM 979 H ASN A 114 46.404 -1.354 120.036 1.00 0.00 H ATOM 980 N LYS A 115 43.332 -2.678 117.877 1.00 39.98 N ATOM 981 CA LYS A 115 41.931 -2.317 117.894 1.00 42.17 C ATOM 982 C LYS A 115 41.137 -3.218 118.752 1.00 43.06 C ATOM 983 O LYS A 115 40.127 -2.843 119.217 1.00 43.70 O ATOM 984 CB LYS A 115 41.351 -2.370 116.512 1.00 44.82 C ATOM 985 CG LYS A 115 41.477 -1.103 115.733 1.00 46.32 C ATOM 986 CD LYS A 115 41.121 -1.364 114.306 1.00 49.34 C ATOM 987 CE LYS A 115 39.646 -1.153 114.096 1.00 51.42 C ATOM 988 NZ LYS A 115 39.405 0.135 113.419 1.00 54.20 N ATOM 989 HZ1 LYS A 115 39.779 0.909 114.005 1.00 0.00 H ATOM 990 HZ2 LYS A 115 39.884 0.135 112.496 1.00 0.00 H ATOM 991 HZ3 LYS A 115 38.383 0.267 113.281 1.00 0.00 H ATOM 992 H LYS A 115 43.775 -2.957 116.979 1.00 0.00 H ATOM 993 N LYS A 116 41.617 -4.419 118.971 1.00 44.03 N ATOM 994 CA LYS A 116 40.925 -5.377 119.795 1.00 44.64 C ATOM 995 C LYS A 116 40.889 -5.026 121.267 1.00 42.06 C ATOM 996 O LYS A 116 40.185 -5.646 122.019 1.00 42.96 O ATOM 997 CB LYS A 116 41.504 -6.773 119.586 1.00 47.08 C ATOM 998 CG LYS A 116 42.883 -6.995 120.153 1.00 47.27 C ATOM 999 CD LYS A 116 43.355 -8.425 119.994 1.00 49.29 C ATOM 1000 CE LYS A 116 43.837 -8.946 121.337 1.00 50.60 C ATOM 1001 NZ LYS A 116 44.994 -9.867 121.311 1.00 52.51 N ATOM 1002 HZ1 LYS A 116 44.753 -10.708 120.749 1.00 0.00 H ATOM 1003 HZ2 LYS A 116 45.810 -9.385 120.883 1.00 0.00 H ATOM 1004 HZ3 LYS A 116 45.229 -10.153 122.283 1.00 0.00 H ATOM 1005 H LYS A 116 42.523 -4.687 118.537 1.00 0.00 H ATOM 1006 N TYR A 117 41.638 -4.011 121.654 1.00 38.85 N ATOM 1007 CA TYR A 117 41.632 -3.463 123.007 1.00 36.03 C ATOM 1008 C TYR A 117 40.804 -2.177 123.101 1.00 33.75 C ATOM 1009 O TYR A 117 40.607 -1.642 124.192 1.00 32.64 O ATOM 1010 CB TYR A 117 43.066 -3.177 123.473 1.00 35.71 C ATOM 1011 CG TYR A 117 43.954 -4.399 123.567 1.00 36.38 C ATOM 1012 CD1 TYR A 117 43.467 -5.604 124.063 1.00 37.40 C ATOM 1013 CD2 TYR A 117 45.285 -4.343 123.175 1.00 36.03 C ATOM 1014 CE1 TYR A 117 44.277 -6.720 124.151 1.00 38.16 C ATOM 1015 CE2 TYR A 117 46.105 -5.452 123.261 1.00 37.23 C ATOM 1016 CZ TYR A 117 45.597 -6.639 123.749 1.00 38.93 C ATOM 1017 OH TYR A 117 46.411 -7.747 123.837 1.00 40.08 O ATOM 1018 HH TYR A 117 45.894 -8.507 124.204 1.00 0.00 H ATOM 1019 H TYR A 117 42.271 -3.575 120.953 1.00 0.00 H ATOM 1020 N ARG A 118 40.319 -1.697 121.956 1.00 32.68 N ATOM 1021 CA ARG A 118 39.628 -0.408 121.861 1.00 32.98 C ATOM 1022 C ARG A 118 38.469 -0.231 122.839 1.00 33.96 C ATOM 1023 O ARG A 118 38.419 0.752 123.577 1.00 34.98 O ATOM 1024 CB ARG A 118 39.119 -0.196 120.437 1.00 34.64 C ATOM 1025 CG ARG A 118 38.557 1.183 120.182 1.00 34.85 C ATOM 1026 CD ARG A 118 38.385 1.422 118.698 1.00 36.14 C ATOM 1027 NE ARG A 118 39.615 1.901 118.072 1.00 35.86 N ATOM 1028 CZ ARG A 118 39.705 2.260 116.795 1.00 37.07 C ATOM 1029 NH1 ARG A 118 38.638 2.197 116.014 1.00 39.57 N ATOM 1030 NH2 ARG A 118 40.854 2.686 116.297 1.00 36.29 N ATOM 1031 HE ARG A 118 40.471 1.965 118.660 1.00 0.00 H ATOM 1032 HH12 ARG A 118 38.708 2.478 115.015 1.00 0.00 H ATOM 1033 HH11 ARG A 118 37.730 1.867 116.399 1.00 0.00 H ATOM 1034 HH22 ARG A 118 40.916 2.965 115.297 1.00 0.00 H ATOM 1035 HH21 ARG A 118 41.696 2.742 116.905 1.00 0.00 H ATOM 1036 H ARG A 118 40.436 -2.263 121.091 1.00 0.00 H ATOM 1037 N TYR A 119 37.533 -1.173 122.833 1.00 33.26 N ATOM 1038 CA TYR A 119 36.419 -1.127 123.768 1.00 31.94 C ATOM 1039 C TYR A 119 36.572 -2.268 124.768 1.00 31.47 C ATOM 1040 O TYR A 119 35.730 -3.160 124.860 1.00 32.67 O ATOM 1041 CB TYR A 119 35.080 -1.216 123.030 1.00 32.44 C ATOM 1042 CG TYR A 119 35.015 -0.364 121.780 1.00 31.84 C ATOM 1043 CD1 TYR A 119 34.799 1.007 121.858 1.00 31.59 C ATOM 1044 CD2 TYR A 119 35.157 -0.933 120.522 1.00 31.52 C ATOM 1045 CE1 TYR A 119 34.743 1.789 120.715 1.00 31.88 C ATOM 1046 CE2 TYR A 119 35.096 -0.162 119.375 1.00 32.44 C ATOM 1047 CZ TYR A 119 34.889 1.199 119.476 1.00 32.95 C ATOM 1048 OH TYR A 119 34.825 1.972 118.336 1.00 34.60 O ATOM 1049 HH TYR A 119 34.673 2.917 118.588 1.00 0.00 H ATOM 1050 H TYR A 119 37.597 -1.955 122.150 1.00 0.00 H ATOM 1051 N HIS A 120 37.664 -2.216 125.519 1.00 30.36 N ATOM 1052 CA HIS A 120 38.073 -3.308 126.387 1.00 30.74 C ATOM 1053 C HIS A 120 37.151 -3.414 127.599 1.00 33.33 C ATOM 1054 O HIS A 120 36.738 -2.400 128.167 1.00 34.38 O ATOM 1055 CB HIS A 120 39.526 -3.103 126.828 1.00 28.62 C ATOM 1056 CG HIS A 120 40.140 -4.300 127.481 1.00 28.42 C ATOM 1057 ND1 HIS A 120 40.521 -5.420 126.777 1.00 28.74 N ATOM 1058 CD2 HIS A 120 40.438 -4.554 128.780 1.00 28.32 C ATOM 1059 CE1 HIS A 120 41.026 -6.313 127.610 1.00 28.89 C ATOM 1060 NE2 HIS A 120 40.984 -5.813 128.830 1.00 28.61 N ATOM 1061 H HIS A 120 38.252 -1.359 125.485 1.00 0.00 H ATOM 1062 N LEU A 121 36.830 -4.642 127.997 1.00 33.42 N ATOM 1063 CA LEU A 121 36.016 -4.861 129.187 1.00 32.47 C ATOM 1064 C LEU A 121 36.881 -4.829 130.433 1.00 30.98 C ATOM 1065 O LEU A 121 37.437 -5.847 130.836 1.00 32.39 O ATOM 1066 CB LEU A 121 35.273 -6.192 129.092 1.00 34.25 C ATOM 1067 CG LEU A 121 34.304 -6.318 127.917 1.00 36.35 C ATOM 1068 CD1 LEU A 121 33.786 -7.739 127.803 1.00 38.86 C ATOM 1069 CD2 LEU A 121 33.144 -5.338 128.065 1.00 36.49 C ATOM 1070 H LEU A 121 37.165 -5.460 127.450 1.00 0.00 H ATOM 1071 N LYS A 122 36.965 -3.657 131.054 1.00 29.62 N ATOM 1072 CA LYS A 122 37.897 -3.416 132.157 1.00 29.31 C ATOM 1073 C LYS A 122 37.614 -4.141 133.487 1.00 31.44 C ATOM 1074 O LYS A 122 38.561 -4.406 134.233 1.00 31.77 O ATOM 1075 CB LYS A 122 37.980 -1.912 132.427 1.00 27.86 C ATOM 1076 CG LYS A 122 38.368 -1.104 131.201 1.00 26.93 C ATOM 1077 CD LYS A 122 38.289 0.395 131.446 1.00 27.45 C ATOM 1078 CE LYS A 122 38.799 1.168 130.229 1.00 26.55 C ATOM 1079 NZ LYS A 122 40.282 1.337 130.266 1.00 25.80 N ATOM 1080 HZ1 LYS A 122 40.549 1.861 131.124 1.00 0.00 H ATOM 1081 HZ2 LYS A 122 40.736 0.401 130.275 1.00 0.00 H ATOM 1082 HZ3 LYS A 122 40.591 1.865 129.425 1.00 0.00 H ATOM 1083 H LYS A 122 36.345 -2.881 130.745 1.00 0.00 H ATOM 1084 N PRO A 123 36.335 -4.465 133.800 1.00 31.45 N ATOM 1085 CA PRO A 123 36.147 -5.205 135.055 1.00 31.99 C ATOM 1086 C PRO A 123 36.892 -6.537 135.123 1.00 32.49 C ATOM 1087 O PRO A 123 37.191 -6.987 136.226 1.00 33.96 O ATOM 1088 CB PRO A 123 34.630 -5.439 135.098 1.00 32.49 C ATOM 1089 CG PRO A 123 34.068 -4.288 134.379 1.00 32.02 C ATOM 1090 CD PRO A 123 35.038 -4.031 133.245 1.00 31.62 C ATOM 1091 N PHE A 125 37.196 -7.152 133.984 1.00 31.22 N ATOM 1092 CA PHE A 125 37.916 -8.423 133.997 1.00 33.22 C ATOM 1093 C PHE A 125 39.434 -8.258 133.902 1.00 34.13 C ATOM 1094 O PHE A 125 40.157 -9.242 133.763 1.00 34.51 O ATOM 1095 CB PHE A 125 37.421 -9.324 132.867 1.00 32.94 C ATOM 1096 CG PHE A 125 35.957 -9.626 132.948 1.00 33.93 C ATOM 1097 CD1 PHE A 125 35.494 -10.643 133.766 1.00 34.86 C ATOM 1098 CD2 PHE A 125 35.041 -8.888 132.218 1.00 33.59 C ATOM 1099 CE1 PHE A 125 34.147 -10.918 133.858 1.00 36.12 C ATOM 1100 CE2 PHE A 125 33.690 -9.160 132.306 1.00 35.22 C ATOM 1101 CZ PHE A 125 33.242 -10.177 133.127 1.00 36.13 C ATOM 1102 H PHE A 125 36.919 -6.725 133.077 1.00 0.00 H ATOM 1103 N CYS A 126 39.919 -7.022 133.994 1.00 34.65 N ATOM 1104 CA CYS A 126 41.358 -6.789 134.001 1.00 34.77 C ATOM 1105 C CYS A 126 41.958 -7.220 135.327 1.00 38.10 C ATOM 1106 O CYS A 126 41.334 -7.068 136.379 1.00 40.07 O ATOM 1107 CB CYS A 126 41.687 -5.315 133.742 1.00 32.93 C ATOM 1108 SG CYS A 126 41.411 -4.740 132.054 1.00 36.74 S ATOM 1109 H CYS A 126 39.266 -6.216 134.061 1.00 0.00 H ATOM 1110 N LYS A 127 43.174 -7.755 135.270 1.00 39.04 N ATOM 1111 CA LYS A 127 43.905 -8.119 136.475 1.00 40.85 C ATOM 1112 C LYS A 127 44.427 -6.854 137.145 1.00 40.62 C ATOM 1113 O LYS A 127 44.727 -5.867 136.475 1.00 39.80 O ATOM 1114 CB LYS A 127 45.059 -9.074 136.149 1.00 41.26 C ATOM 1115 H LYS A 127 43.614 -7.917 134.342 1.00 0.00 H ATOM 1116 N LYS A 129 44.539 -6.899 138.468 1.00 42.61 N ATOM 1117 CA LYS A 129 44.864 -5.722 139.264 1.00 45.27 C ATOM 1118 C LYS A 129 46.245 -5.141 138.959 1.00 47.12 C ATOM 1119 O LYS A 129 47.185 -5.868 138.630 1.00 47.82 O ATOM 1120 CB LYS A 129 44.762 -6.059 140.754 1.00 47.38 C ATOM 1121 H LYS A 129 44.389 -7.807 138.953 1.00 0.00 H ATOM 1122 N ALA A 130 46.350 -3.820 139.054 1.00 47.57 N ATOM 1123 CA ALA A 130 47.610 -3.130 138.814 1.00 47.79 C ATOM 1124 C ALA A 130 48.465 -3.076 140.077 1.00 50.90 C ATOM 1125 O ALA A 130 47.948 -3.124 141.191 1.00 52.31 O ATOM 1126 CB ALA A 130 47.352 -1.727 138.297 1.00 46.16 C ATOM 1127 H ALA A 130 45.509 -3.263 139.307 1.00 0.00 H ATOM 1128 N ASP A 131 49.773 -3.009 139.915 1.00 52.32 N ATOM 1129 CA ASP A 131 50.642 -2.789 141.040 1.00 55.57 C ATOM 1130 C ASP A 131 50.420 -1.388 141.549 1.00 56.55 C ATOM 1131 O ASP A 131 49.745 -0.619 140.923 1.00 54.15 O ATOM 1132 CB ASP A 131 52.105 -2.957 140.666 1.00 55.97 C ATOM 1133 CG ASP A 131 52.411 -4.324 140.155 1.00 56.65 C ATOM 1134 OD1 ASP A 131 52.026 -5.282 140.835 1.00 57.87 O ATOM 1135 OD2 ASP A 131 53.014 -4.442 139.077 1.00 55.57 O ATOM 1136 H ASP A 131 50.180 -3.116 138.964 1.00 0.00 H ATOM 1137 N PRO A 132 51.039 -1.091 142.770 1.00 60.09 N ATOM 1138 CA PRO A 132 50.842 0.290 143.206 1.00 61.23 C ATOM 1139 C PRO A 132 51.888 1.200 142.617 1.00 61.47 C ATOM 1140 O PRO A 132 53.011 0.805 142.360 1.00 61.72 O ATOM 1141 CB PRO A 132 50.956 0.205 144.708 1.00 63.36 C ATOM 1142 CG PRO A 132 52.044 -0.745 144.915 1.00 63.91 C ATOM 1143 CD PRO A 132 51.881 -1.788 143.870 1.00 62.33 C ATOM 1144 N CYS A 133 51.478 2.431 142.394 1.00 61.43 N ATOM 1145 CA CYS A 133 52.213 3.375 141.597 1.00 60.40 C ATOM 1146 C CYS A 133 53.548 3.737 142.238 1.00 62.39 C ATOM 1147 O CYS A 133 53.525 4.030 143.475 1.00 64.20 O ATOM 1148 CB CYS A 133 51.321 4.586 141.303 1.00 59.60 C ATOM 1149 SG CYS A 133 50.443 4.524 139.739 1.00 50.46 S ATOM 1150 OXT CYS A 133 54.592 3.694 141.503 1.00 62.21 O ATOM 1151 H CYS A 133 50.577 2.736 142.815 1.00 0.00 H TER 1152 CYS A 133 ATOM 1153 N SER B 1 26.707 -11.373 133.304 1.00 35.42 N ATOM 1154 CA SER B 1 27.903 -10.538 133.263 1.00 36.90 C ATOM 1155 C SER B 1 27.858 -9.583 132.075 1.00 37.42 C ATOM 1156 O SER B 1 26.821 -9.431 131.429 1.00 37.56 O ATOM 1157 CB SER B 1 29.163 -11.402 133.188 1.00 38.10 C ATOM 1158 OG SER B 1 29.268 -12.035 131.927 1.00 38.05 O ATOM 1159 HG SER B 1 28.477 -12.612 131.782 1.00 0.00 H ATOM 1160 HN3 SER B 1 26.644 -11.930 132.428 1.00 0.00 H ATOM 1161 HN2 SER B 1 25.866 -10.768 133.392 1.00 0.00 H ATOM 1162 HN1 SER B 1 26.761 -12.014 134.121 1.00 0.00 H ATOM 1163 N LEU B 2 28.990 -8.943 131.790 1.00 37.68 N ATOM 1164 CA LEU B 2 29.099 -8.040 130.644 1.00 35.03 C ATOM 1165 C LEU B 2 29.071 -8.803 129.321 1.00 34.25 C ATOM 1166 O LEU B 2 28.781 -8.229 128.273 1.00 33.84 O ATOM 1167 CB LEU B 2 30.375 -7.195 130.738 1.00 33.12 C ATOM 1168 CG LEU B 2 30.346 -6.083 131.790 1.00 30.51 C ATOM 1169 CD1 LEU B 2 31.629 -5.294 131.789 1.00 32.38 C ATOM 1170 CD2 LEU B 2 29.179 -5.156 131.522 1.00 27.40 C ATOM 1171 H LEU B 2 29.820 -9.089 132.399 1.00 0.00 H ATOM 1172 N PHE B 3 29.363 -10.097 129.375 1.00 34.94 N ATOM 1173 CA PHE B 3 29.383 -10.913 128.167 1.00 36.92 C ATOM 1174 C PHE B 3 27.977 -11.214 127.648 1.00 38.47 C ATOM 1175 O PHE B 3 27.707 -11.065 126.454 1.00 38.18 O ATOM 1176 CB PHE B 3 30.147 -12.215 128.418 1.00 37.60 C ATOM 1177 CG PHE B 3 31.606 -12.008 128.714 1.00 39.47 C ATOM 1178 CD1 PHE B 3 32.473 -11.591 127.718 1.00 40.19 C ATOM 1179 CD2 PHE B 3 32.114 -12.241 129.981 1.00 41.40 C ATOM 1180 CE1 PHE B 3 33.817 -11.398 127.982 1.00 42.19 C ATOM 1181 CE2 PHE B 3 33.460 -12.052 130.251 1.00 42.95 C ATOM 1182 CZ PHE B 3 34.311 -11.630 129.250 1.00 43.28 C ATOM 1183 H PHE B 3 29.581 -10.535 130.293 1.00 0.00 H ATOM 1184 N GLU B 4 27.098 -11.596 128.549 1.00 39.72 N ATOM 1185 CA GLU B 4 25.737 -11.854 128.195 1.00 39.85 C ATOM 1186 C GLU B 4 25.026 -10.572 127.861 1.00 38.47 C ATOM 1187 O GLU B 4 24.254 -10.536 126.960 1.00 38.12 O ATOM 1188 CB GLU B 4 25.024 -12.584 129.312 1.00 41.09 C ATOM 1189 CG GLU B 4 25.514 -13.972 129.562 1.00 44.08 C ATOM 1190 CD GLU B 4 26.748 -14.034 130.418 1.00 46.59 C ATOM 1191 OE1 GLU B 4 27.398 -13.034 130.625 1.00 47.60 O ATOM 1192 OE2 GLU B 4 27.079 -15.103 130.872 1.00 48.00 O ATOM 1193 H GLU B 4 27.399 -11.713 129.538 1.00 0.00 H ATOM 1194 N LEU B 5 25.298 -9.516 128.598 1.00 38.02 N ATOM 1195 CA LEU B 5 24.687 -8.248 128.323 1.00 36.55 C ATOM 1196 C LEU B 5 25.004 -7.829 126.909 1.00 35.87 C ATOM 1197 O LEU B 5 24.172 -7.412 126.188 1.00 36.69 O ATOM 1198 CB LEU B 5 25.107 -7.178 129.326 1.00 35.92 C ATOM 1199 CG LEU B 5 24.538 -5.796 129.064 1.00 34.60 C ATOM 1200 CD1 LEU B 5 23.059 -5.801 128.850 1.00 33.10 C ATOM 1201 CD2 LEU B 5 24.930 -4.803 130.112 1.00 35.05 C ATOM 1202 H LEU B 5 25.965 -9.602 129.391 1.00 0.00 H ATOM 1203 N GLY B 6 26.227 -8.065 126.510 1.00 34.97 N ATOM 1204 CA GLY B 6 26.687 -7.672 125.220 1.00 33.64 C ATOM 1205 C GLY B 6 26.126 -8.474 124.091 1.00 33.36 C ATOM 1206 O GLY B 6 25.911 -7.956 123.034 1.00 34.47 O ATOM 1207 H GLY B 6 26.883 -8.554 127.153 1.00 0.00 H ATOM 1208 N LYS B 7 25.886 -9.733 124.317 1.00 32.00 N ATOM 1209 CA LYS B 7 25.372 -10.550 123.274 1.00 32.17 C ATOM 1210 C LYS B 7 23.911 -10.229 123.030 1.00 32.54 C ATOM 1211 O LYS B 7 23.452 -10.217 121.928 1.00 32.67 O ATOM 1212 CB LYS B 7 25.581 -12.007 123.618 1.00 33.57 C ATOM 1213 CG LYS B 7 25.269 -12.990 122.516 1.00 35.62 C ATOM 1214 CD LYS B 7 26.403 -13.955 122.244 1.00 38.99 C ATOM 1215 CE LYS B 7 26.206 -15.313 122.879 1.00 40.94 C ATOM 1216 NZ LYS B 7 27.495 -15.996 123.140 1.00 42.48 N ATOM 1217 HZ1 LYS B 7 28.004 -16.127 122.243 1.00 0.00 H ATOM 1218 HZ2 LYS B 7 28.069 -15.416 123.784 1.00 0.00 H ATOM 1219 HZ3 LYS B 7 27.313 -16.923 123.575 1.00 0.00 H ATOM 1220 H LYS B 7 26.070 -10.139 125.257 1.00 0.00 H ATOM 1221 N MET B 8 23.196 -9.962 124.100 1.00 32.08 N ATOM 1222 CA MET B 8 21.805 -9.591 124.052 1.00 30.66 C ATOM 1223 C MET B 8 21.631 -8.324 123.258 1.00 30.23 C ATOM 1224 O MET B 8 20.816 -8.271 122.425 1.00 31.28 O ATOM 1225 CB MET B 8 21.262 -9.408 125.461 1.00 29.73 C ATOM 1226 CG MET B 8 20.703 -10.628 126.154 1.00 29.61 C ATOM 1227 SD MET B 8 20.149 -10.275 127.814 1.00 32.74 S ATOM 1228 CE MET B 8 19.672 -11.840 128.423 1.00 26.48 C ATOM 1229 H MET B 8 23.659 -10.022 125.030 1.00 0.00 H ATOM 1230 N ILE B 9 22.422 -7.314 123.518 1.00 29.28 N ATOM 1231 CA ILE B 9 22.342 -6.043 122.807 1.00 28.56 C ATOM 1232 C ILE B 9 22.683 -6.209 121.327 1.00 30.46 C ATOM 1233 O ILE B 9 22.040 -5.608 120.460 1.00 32.53 O ATOM 1234 CB ILE B 9 23.280 -4.993 123.435 1.00 27.01 C ATOM 1235 CG1 ILE B 9 22.895 -4.745 124.895 1.00 27.18 C ATOM 1236 CG2 ILE B 9 23.219 -3.685 122.666 1.00 23.88 C ATOM 1237 CD1 ILE B 9 23.737 -3.691 125.586 1.00 27.57 C ATOM 1238 H ILE B 9 23.139 -7.423 124.264 1.00 0.00 H ATOM 1239 N LEU B 10 23.676 -7.045 121.043 1.00 29.93 N ATOM 1240 CA LEU B 10 24.043 -7.360 119.668 1.00 29.87 C ATOM 1241 C LEU B 10 22.892 -8.062 118.968 1.00 30.36 C ATOM 1242 O LEU B 10 22.522 -7.711 117.850 1.00 29.88 O ATOM 1243 CB LEU B 10 25.300 -8.234 119.622 1.00 29.49 C ATOM 1244 CG LEU B 10 25.691 -8.778 118.244 1.00 29.49 C ATOM 1245 CD1 LEU B 10 25.763 -7.654 117.227 1.00 29.21 C ATOM 1246 CD2 LEU B 10 27.027 -9.526 118.309 1.00 30.14 C ATOM 1247 H LEU B 10 24.205 -7.486 121.822 1.00 0.00 H ATOM 1248 N GLN B 11 22.330 -9.058 119.639 1.00 31.36 N ATOM 1249 CA GLN B 11 21.258 -9.852 119.061 1.00 31.37 C ATOM 1250 C GLN B 11 20.028 -9.001 118.762 1.00 30.06 C ATOM 1251 O GLN B 11 19.418 -9.145 117.703 1.00 29.55 O ATOM 1252 CB GLN B 11 20.909 -11.018 119.992 1.00 31.93 C ATOM 1253 CG GLN B 11 21.831 -12.219 119.809 1.00 33.74 C ATOM 1254 CD GLN B 11 21.878 -13.150 121.012 1.00 35.87 C ATOM 1255 OE1 GLN B 11 21.298 -12.869 122.059 1.00 37.63 O ATOM 1256 NE2 GLN B 11 22.560 -14.274 120.856 1.00 36.49 N ATOM 1257 HE22 GLN B 11 23.036 -14.472 119.953 1.00 0.00 H ATOM 1258 HE21 GLN B 11 22.620 -14.959 121.637 1.00 0.00 H ATOM 1259 H GLN B 11 22.663 -9.276 120.600 1.00 0.00 H ATOM 1260 N GLU B 12 19.688 -8.093 119.673 1.00 29.94 N ATOM 1261 CA GLU B 12 18.495 -7.259 119.505 1.00 29.94 C ATOM 1262 C GLU B 12 18.689 -6.120 118.506 1.00 31.00 C ATOM 1263 O GLU B 12 17.894 -5.962 117.580 1.00 31.48 O ATOM 1264 CB GLU B 12 18.060 -6.685 120.856 1.00 29.59 C ATOM 1265 CG GLU B 12 17.383 -7.692 121.784 1.00 30.36 C ATOM 1266 CD GLU B 12 15.924 -7.950 121.422 1.00 31.37 C ATOM 1267 OE1 GLU B 12 15.304 -7.075 120.775 1.00 31.96 O ATOM 1268 OE2 GLU B 12 15.397 -9.024 121.793 1.00 31.03 O ATOM 1269 H GLU B 12 20.280 -7.973 120.520 1.00 0.00 H ATOM 1270 N THR B 13 19.755 -5.344 118.686 1.00 31.65 N ATOM 1271 CA THR B 13 20.000 -4.152 117.871 1.00 31.60 C ATOM 1272 C THR B 13 20.748 -4.457 116.573 1.00 34.49 C ATOM 1273 O THR B 13 20.625 -3.724 115.590 1.00 35.81 O ATOM 1274 CB THR B 13 20.812 -3.094 118.650 1.00 29.71 C ATOM 1275 OG1 THR B 13 22.136 -3.589 118.895 1.00 29.09 O ATOM 1276 CG2 THR B 13 20.147 -2.770 119.977 1.00 28.42 C ATOM 1277 HG1 THR B 13 22.082 -4.422 119.428 1.00 0.00 H ATOM 1278 H THR B 13 20.437 -5.592 119.431 1.00 0.00 H ATOM 1279 N GLY B 15 21.538 -5.525 116.576 1.00 35.29 N ATOM 1280 CA GLY B 15 22.366 -5.851 115.430 1.00 36.49 C ATOM 1281 C GLY B 15 23.635 -5.018 115.398 1.00 37.40 C ATOM 1282 O GLY B 15 24.421 -5.101 114.452 1.00 38.22 O ATOM 1283 H GLY B 15 21.563 -6.139 117.415 1.00 0.00 H ATOM 1284 N LYS B 16 23.860 -4.230 116.429 1.00 37.19 N ATOM 1285 CA LYS B 16 25.017 -3.369 116.503 1.00 38.49 C ATOM 1286 C LYS B 16 26.013 -3.823 117.541 1.00 38.44 C ATOM 1287 O LYS B 16 25.626 -4.417 118.516 1.00 39.77 O ATOM 1288 CB LYS B 16 24.570 -1.982 116.869 1.00 39.84 C ATOM 1289 CG LYS B 16 23.474 -1.448 115.994 1.00 41.45 C ATOM 1290 CD LYS B 16 23.886 -0.134 115.369 1.00 43.80 C ATOM 1291 CE LYS B 16 24.100 -0.268 113.871 1.00 45.77 C ATOM 1292 NZ LYS B 16 24.705 0.936 113.258 1.00 47.12 N ATOM 1293 HZ1 LYS B 16 24.082 1.754 113.415 1.00 0.00 H ATOM 1294 HZ2 LYS B 16 25.632 1.117 113.693 1.00 0.00 H ATOM 1295 HZ3 LYS B 16 24.825 0.781 112.237 1.00 0.00 H ATOM 1296 H LYS B 16 23.181 -4.228 117.217 1.00 0.00 H ATOM 1297 N ASN B 17 27.289 -3.536 117.339 1.00 36.52 N ATOM 1298 CA ASN B 17 28.309 -3.780 118.344 1.00 34.76 C ATOM 1299 C ASN B 17 27.967 -3.061 119.613 1.00 31.55 C ATOM 1300 O ASN B 17 27.884 -1.878 119.605 1.00 30.78 O ATOM 1301 CB ASN B 17 29.663 -3.305 117.831 1.00 37.65 C ATOM 1302 CG ASN B 17 30.793 -3.479 118.832 1.00 39.89 C ATOM 1303 OD1 ASN B 17 30.608 -3.485 120.012 1.00 40.54 O ATOM 1304 ND2 ASN B 17 31.968 -3.606 118.332 1.00 41.67 N ATOM 1305 HD22 ASN B 17 32.098 -3.597 117.300 1.00 0.00 H ATOM 1306 HD21 ASN B 17 32.790 -3.718 118.959 1.00 0.00 H ATOM 1307 H ASN B 17 27.572 -3.121 116.428 1.00 0.00 H ATOM 1308 N PRO B 18 27.760 -3.794 120.691 1.00 31.08 N ATOM 1309 CA PRO B 18 27.317 -3.230 121.969 1.00 30.93 C ATOM 1310 C PRO B 18 28.367 -2.331 122.616 1.00 31.79 C ATOM 1311 O PRO B 18 28.036 -1.235 123.071 1.00 31.42 O ATOM 1312 CB PRO B 18 27.061 -4.473 122.831 1.00 30.34 C ATOM 1313 CG PRO B 18 27.891 -5.548 122.208 1.00 30.98 C ATOM 1314 CD PRO B 18 27.879 -5.261 120.740 1.00 31.32 C ATOM 1315 N ALA B 19 29.618 -2.775 122.633 1.00 32.72 N ATOM 1316 CA ALA B 19 30.660 -2.032 123.328 1.00 34.70 C ATOM 1317 C ALA B 19 30.909 -0.690 122.650 1.00 37.15 C ATOM 1318 O ALA B 19 31.151 0.317 123.316 1.00 38.67 O ATOM 1319 CB ALA B 19 31.936 -2.843 123.388 1.00 35.39 C ATOM 1320 H ALA B 19 29.856 -3.662 122.145 1.00 0.00 H ATOM 1321 N LYS B 20 30.851 -0.671 121.340 1.00 37.42 N ATOM 1322 CA LYS B 20 31.085 0.519 120.557 1.00 37.48 C ATOM 1323 C LYS B 20 29.944 1.518 120.527 1.00 35.02 C ATOM 1324 O LYS B 20 30.170 2.691 120.438 1.00 34.98 O ATOM 1325 CB LYS B 20 31.453 0.118 119.143 1.00 40.02 C ATOM 1326 CG LYS B 20 31.406 1.209 118.102 1.00 42.39 C ATOM 1327 CD LYS B 20 31.554 0.610 116.733 1.00 44.71 C ATOM 1328 CE LYS B 20 31.410 1.644 115.654 1.00 46.58 C ATOM 1329 NZ LYS B 20 30.928 1.079 114.374 1.00 47.09 N ATOM 1330 HZ1 LYS B 20 31.602 0.362 114.038 1.00 0.00 H ATOM 1331 HZ2 LYS B 20 29.996 0.640 114.519 1.00 0.00 H ATOM 1332 HZ3 LYS B 20 30.849 1.839 113.669 1.00 0.00 H ATOM 1333 H LYS B 20 30.626 -1.555 120.841 1.00 0.00 H ATOM 1334 N SER B 21 28.719 1.046 120.543 1.00 32.97 N ATOM 1335 CA SER B 21 27.563 1.946 120.493 1.00 30.69 C ATOM 1336 C SER B 21 27.004 2.287 121.869 1.00 28.04 C ATOM 1337 O SER B 21 26.455 3.368 122.073 1.00 28.42 O ATOM 1338 CB SER B 21 26.453 1.343 119.635 1.00 30.70 C ATOM 1339 OG SER B 21 26.879 1.213 118.291 1.00 32.64 O ATOM 1340 HG SER B 21 26.148 0.821 117.751 1.00 0.00 H ATOM 1341 H SER B 21 28.567 0.018 120.592 1.00 0.00 H ATOM 1342 N TYR B 22 27.164 1.374 122.818 1.00 26.34 N ATOM 1343 CA TYR B 22 26.513 1.527 124.109 1.00 25.62 C ATOM 1344 C TYR B 22 27.460 1.443 125.305 1.00 27.15 C ATOM 1345 O TYR B 22 27.017 1.529 126.450 1.00 26.97 O ATOM 1346 CB TYR B 22 25.413 0.473 124.248 1.00 24.46 C ATOM 1347 CG TYR B 22 24.358 0.560 123.165 1.00 24.73 C ATOM 1348 CD1 TYR B 22 23.384 1.553 123.203 1.00 24.60 C ATOM 1349 CD2 TYR B 22 24.326 -0.351 122.114 1.00 24.99 C ATOM 1350 CE1 TYR B 22 22.417 1.644 122.222 1.00 25.74 C ATOM 1351 CE2 TYR B 22 23.350 -0.272 121.126 1.00 24.65 C ATOM 1352 CZ TYR B 22 22.397 0.730 121.189 1.00 25.72 C ATOM 1353 OH TYR B 22 21.412 0.839 120.229 1.00 26.09 O ATOM 1354 HH TYR B 22 20.829 1.610 120.442 1.00 0.00 H ATOM 1355 H TYR B 22 27.760 0.541 122.637 1.00 0.00 H ATOM 1356 N GLY B 23 28.756 1.287 125.040 1.00 28.32 N ATOM 1357 CA GLY B 23 29.747 1.190 126.098 1.00 29.37 C ATOM 1358 C GLY B 23 29.962 2.502 126.829 1.00 31.35 C ATOM 1359 O GLY B 23 30.322 2.521 128.007 1.00 26.63 O ATOM 1360 H GLY B 23 29.067 1.233 124.049 1.00 0.00 H ATOM 1361 N ALA B 24 29.731 3.607 126.127 1.00 32.50 N ATOM 1362 CA ALA B 24 29.913 4.935 126.706 1.00 33.19 C ATOM 1363 C ALA B 24 28.849 5.922 126.204 1.00 32.74 C ATOM 1364 O ALA B 24 29.091 7.122 126.105 1.00 33.75 O ATOM 1365 CB ALA B 24 31.308 5.454 126.400 1.00 27.98 C ATOM 1366 H ALA B 24 29.413 3.523 125.140 1.00 0.00 H ATOM 1367 N TYR B 25 27.663 5.413 125.899 1.00 32.17 N ATOM 1368 CA TYR B 25 26.601 6.263 125.373 1.00 32.19 C ATOM 1369 C TYR B 25 25.952 7.100 126.473 1.00 33.15 C ATOM 1370 O TYR B 25 25.498 6.564 127.486 1.00 33.95 O ATOM 1371 CB TYR B 25 25.533 5.413 124.683 1.00 29.50 C ATOM 1372 CG TYR B 25 24.524 6.201 123.874 1.00 29.28 C ATOM 1373 CD1 TYR B 25 23.444 6.833 124.488 1.00 29.15 C ATOM 1374 CD2 TYR B 25 24.634 6.290 122.493 1.00 29.51 C ATOM 1375 CE1 TYR B 25 22.520 7.550 123.753 1.00 29.58 C ATOM 1376 CE2 TYR B 25 23.709 7.000 121.749 1.00 30.58 C ATOM 1377 CZ TYR B 25 22.652 7.626 122.383 1.00 30.75 C ATOM 1378 OH TYR B 25 21.729 8.330 121.640 1.00 32.32 O ATOM 1379 HH TYR B 25 21.044 8.712 122.244 1.00 0.00 H ATOM 1380 H TYR B 25 27.488 4.397 126.036 1.00 0.00 H ATOM 1381 N GLY B 26 25.907 8.413 126.264 1.00 31.97 N ATOM 1382 CA GLY B 26 25.189 9.304 127.156 1.00 31.10 C ATOM 1383 C GLY B 26 25.634 9.259 128.603 1.00 30.54 C ATOM 1384 O GLY B 26 26.785 8.944 128.904 1.00 30.93 O ATOM 1385 H GLY B 26 26.400 8.811 125.439 1.00 0.00 H ATOM 1386 N CYS B 27 24.742 9.610 129.469 1.00 28.85 N ATOM 1387 CA CYS B 27 25.070 9.842 130.826 1.00 29.11 C ATOM 1388 C CYS B 27 24.653 8.654 131.671 1.00 31.64 C ATOM 1389 O CYS B 27 24.645 8.707 132.850 1.00 28.67 O ATOM 1390 CB CYS B 27 24.619 11.289 131.284 1.00 30.17 C ATOM 1391 SG CYS B 27 25.976 12.512 131.469 1.00 37.07 S ATOM 1392 H CYS B 27 23.756 9.725 129.160 1.00 0.00 H ATOM 1393 N ASN B 28 24.370 7.543 131.009 1.00 30.53 N ATOM 1394 CA ASN B 28 23.844 6.346 131.652 1.00 28.98 C ATOM 1395 C ASN B 28 24.301 4.995 131.149 1.00 28.19 C ATOM 1396 O ASN B 28 24.281 4.074 131.878 1.00 29.60 O ATOM 1397 CB ASN B 28 22.323 6.334 131.641 1.00 28.49 C ATOM 1398 CG ASN B 28 21.730 7.305 132.595 1.00 30.82 C ATOM 1399 OD1 ASN B 28 21.553 7.017 133.739 1.00 31.64 O ATOM 1400 ND2 ASN B 28 21.453 8.467 132.128 1.00 32.35 N ATOM 1401 HD22 ASN B 28 21.622 8.678 131.124 1.00 0.00 H ATOM 1402 HD21 ASN B 28 21.059 9.198 132.754 1.00 0.00 H ATOM 1403 H ASN B 28 24.531 7.524 129.982 1.00 0.00 H ATOM 1404 N CYS B 29 24.690 4.880 129.906 1.00 27.00 N ATOM 1405 CA CYS B 29 24.905 3.603 129.279 1.00 27.15 C ATOM 1406 C CYS B 29 26.355 3.140 129.313 1.00 30.07 C ATOM 1407 O CYS B 29 27.235 3.852 128.924 1.00 31.84 O ATOM 1408 CB CYS B 29 24.429 3.689 127.839 1.00 27.07 C ATOM 1409 SG CYS B 29 22.676 3.505 127.586 1.00 32.03 S ATOM 1410 H CYS B 29 24.850 5.744 129.350 1.00 0.00 H ATOM 1411 N GLY B 30 26.594 1.936 129.781 1.00 28.98 N ATOM 1412 CA GLY B 30 27.927 1.374 129.840 1.00 28.02 C ATOM 1413 C GLY B 30 28.626 1.641 131.157 1.00 29.93 C ATOM 1414 O GLY B 30 28.041 1.474 132.228 1.00 31.11 O ATOM 1415 H GLY B 30 25.795 1.365 130.122 1.00 0.00 H ATOM 1416 N VAL B 31 29.887 2.058 131.067 1.00 30.84 N ATOM 1417 CA VAL B 31 30.717 2.320 132.239 1.00 32.32 C ATOM 1418 C VAL B 31 30.104 3.358 133.179 1.00 34.10 C ATOM 1419 O VAL B 31 29.321 4.204 132.754 1.00 33.85 O ATOM 1420 CB VAL B 31 32.124 2.789 131.826 1.00 31.85 C ATOM 1421 CG1 VAL B 31 32.933 1.611 131.319 1.00 31.65 C ATOM 1422 CG2 VAL B 31 32.038 3.856 130.754 1.00 31.08 C ATOM 1423 H VAL B 31 30.298 2.203 130.123 1.00 0.00 H ATOM 1424 N LEU B 32 30.421 3.260 134.446 1.00 36.04 N ATOM 1425 CA LEU B 32 29.998 4.228 135.412 1.00 37.35 C ATOM 1426 C LEU B 32 28.567 4.053 135.891 1.00 38.55 C ATOM 1427 O LEU B 32 28.006 2.999 135.748 1.00 39.15 O ATOM 1428 CB LEU B 32 30.273 5.619 134.890 1.00 37.41 C ATOM 1429 CG LEU B 32 31.766 5.841 134.681 1.00 37.74 C ATOM 1430 CD1 LEU B 32 32.077 7.258 134.341 1.00 37.78 C ATOM 1431 CD2 LEU B 32 32.540 5.468 135.909 1.00 38.57 C ATOM 1432 H LEU B 32 30.998 2.454 134.760 1.00 0.00 H ATOM 1433 N GLY B 33 28.011 5.079 136.506 1.00 40.45 N ATOM 1434 CA GLY B 33 26.706 5.006 137.107 1.00 39.90 C ATOM 1435 C GLY B 33 25.666 5.677 136.265 1.00 40.72 C ATOM 1436 O GLY B 33 25.721 5.603 135.077 1.00 41.37 O ATOM 1437 H GLY B 33 28.536 5.975 136.558 1.00 0.00 H ATOM 1438 N ARG B 34 24.719 6.344 136.891 1.00 40.73 N ATOM 1439 CA ARG B 34 23.682 7.025 136.143 1.00 40.51 C ATOM 1440 C ARG B 34 23.798 8.514 136.196 1.00 41.70 C ATOM 1441 O ARG B 34 24.412 9.048 137.063 1.00 43.36 O ATOM 1442 CB ARG B 34 22.298 6.641 136.622 1.00 39.61 C ATOM 1443 CG ARG B 34 22.206 5.319 137.303 1.00 39.11 C ATOM 1444 CD ARG B 34 20.878 5.167 137.987 1.00 40.30 C ATOM 1445 NE ARG B 34 20.978 5.468 139.398 1.00 42.52 N ATOM 1446 CZ ARG B 34 20.305 6.433 139.999 1.00 44.80 C ATOM 1447 NH1 ARG B 34 19.493 7.193 139.325 1.00 45.58 N ATOM 1448 NH2 ARG B 34 20.442 6.636 141.278 1.00 46.31 N ATOM 1449 HE ARG B 34 21.620 4.889 139.976 1.00 0.00 H ATOM 1450 HH12 ARG B 34 18.968 7.950 139.808 1.00 0.00 H ATOM 1451 HH11 ARG B 34 19.369 7.044 138.303 1.00 0.00 H ATOM 1452 HH22 ARG B 34 19.909 7.398 141.744 1.00 0.00 H ATOM 1453 HH21 ARG B 34 21.085 6.036 141.834 1.00 0.00 H ATOM 1454 H ARG B 34 24.715 6.382 137.930 1.00 0.00 H ATOM 1455 N GLY B 35 23.188 9.187 135.245 1.00 41.75 N ATOM 1456 CA GLY B 35 22.966 10.609 135.276 1.00 43.38 C ATOM 1457 C GLY B 35 21.677 10.943 134.567 1.00 43.41 C ATOM 1458 O GLY B 35 20.996 10.078 134.142 1.00 42.34 O ATOM 1459 H GLY B 35 22.844 8.658 134.418 1.00 0.00 H ATOM 1460 N GLN B 36 21.361 12.209 134.431 1.00 44.54 N ATOM 1461 CA GLN B 36 20.183 12.624 133.735 1.00 44.99 C ATOM 1462 C GLN B 36 20.198 12.142 132.311 1.00 42.65 C ATOM 1463 O GLN B 36 21.062 12.466 131.567 1.00 43.26 O ATOM 1464 CB GLN B 36 20.110 14.140 133.767 1.00 49.34 C ATOM 1465 CG GLN B 36 18.743 14.760 133.654 1.00 52.89 C ATOM 1466 CD GLN B 36 18.752 16.053 132.868 1.00 58.70 C ATOM 1467 OE1 GLN B 36 18.213 17.072 133.294 1.00 61.99 O ATOM 1468 NE2 GLN B 36 19.355 16.015 131.703 1.00 59.89 N ATOM 1469 HE22 GLN B 36 19.800 15.134 131.376 1.00 0.00 H ATOM 1470 HE21 GLN B 36 19.388 16.866 131.106 1.00 0.00 H ATOM 1471 H GLN B 36 21.986 12.932 134.842 1.00 0.00 H ATOM 1472 N PRO B 37 19.197 11.406 131.902 1.00 40.48 N ATOM 1473 CA PRO B 37 19.223 10.820 130.556 1.00 39.19 C ATOM 1474 C PRO B 37 19.286 11.900 129.480 1.00 40.93 C ATOM 1475 O PRO B 37 18.828 13.018 129.709 1.00 42.09 O ATOM 1476 CB PRO B 37 17.913 10.030 130.473 1.00 37.68 C ATOM 1477 CG PRO B 37 17.424 9.884 131.867 1.00 37.07 C ATOM 1478 CD PRO B 37 18.082 10.915 132.728 1.00 38.95 C ATOM 1479 N LYS B 38 19.780 11.550 128.316 1.00 40.97 N ATOM 1480 CA LYS B 38 20.052 12.481 127.270 1.00 42.19 C ATOM 1481 C LYS B 38 19.059 12.308 126.166 1.00 41.63 C ATOM 1482 O LYS B 38 18.794 13.207 125.430 1.00 42.93 O ATOM 1483 CB LYS B 38 21.444 12.204 126.731 1.00 43.47 C ATOM 1484 CG LYS B 38 22.368 13.389 126.641 1.00 46.59 C ATOM 1485 CD LYS B 38 22.592 14.062 127.973 1.00 47.05 C ATOM 1486 CE LYS B 38 23.577 15.189 127.809 1.00 49.76 C ATOM 1487 NZ LYS B 38 22.947 16.516 127.973 1.00 52.14 N ATOM 1488 HZ1 LYS B 38 22.200 16.635 127.259 1.00 0.00 H ATOM 1489 HZ2 LYS B 38 22.533 16.587 128.924 1.00 0.00 H ATOM 1490 HZ3 LYS B 38 23.666 17.257 127.851 1.00 0.00 H ATOM 1491 H LYS B 38 19.983 10.544 128.148 1.00 0.00 H ATOM 1492 N ASP B 39 18.525 11.115 126.071 1.00 39.92 N ATOM 1493 CA ASP B 39 17.509 10.743 125.099 1.00 40.07 C ATOM 1494 C ASP B 39 16.900 9.407 125.514 1.00 38.54 C ATOM 1495 O ASP B 39 17.192 8.907 126.601 1.00 37.38 O ATOM 1496 CB ASP B 39 18.103 10.684 123.689 1.00 41.49 C ATOM 1497 CG ASP B 39 19.207 9.655 123.557 1.00 41.52 C ATOM 1498 OD1 ASP B 39 19.673 9.141 124.592 1.00 41.25 O ATOM 1499 OD2 ASP B 39 19.629 9.384 122.415 1.00 42.35 O ATOM 1500 H ASP B 39 18.850 10.384 126.736 1.00 0.00 H ATOM 1501 N ALA B 40 16.067 8.826 124.653 1.00 38.20 N ATOM 1502 CA ALA B 40 15.379 7.583 124.991 1.00 36.18 C ATOM 1503 C ALA B 40 16.371 6.428 125.139 1.00 34.33 C ATOM 1504 O ALA B 40 16.272 5.640 126.081 1.00 32.41 O ATOM 1505 CB ALA B 40 14.329 7.250 123.947 1.00 36.75 C ATOM 1506 H ALA B 40 15.904 9.265 123.724 1.00 0.00 H ATOM 1507 N THR B 41 17.321 6.333 124.211 1.00 34.98 N ATOM 1508 CA THR B 41 18.398 5.341 124.296 1.00 32.78 C ATOM 1509 C THR B 41 19.080 5.380 125.669 1.00 31.40 C ATOM 1510 O THR B 41 19.264 4.353 126.321 1.00 28.01 O ATOM 1511 CB THR B 41 19.459 5.557 123.194 1.00 31.53 C ATOM 1512 OG1 THR B 41 18.893 5.278 121.906 1.00 31.67 O ATOM 1513 CG2 THR B 41 20.643 4.641 123.418 1.00 29.94 C ATOM 1514 HG1 THR B 41 18.127 5.885 121.745 1.00 0.00 H ATOM 1515 H THR B 41 17.299 6.983 123.400 1.00 0.00 H ATOM 1516 N ASP B 42 19.456 6.578 126.096 1.00 29.83 N ATOM 1517 CA ASP B 42 20.091 6.754 127.391 1.00 32.98 C ATOM 1518 C ASP B 42 19.164 6.341 128.543 1.00 31.88 C ATOM 1519 O ASP B 42 19.594 5.659 129.473 1.00 31.33 O ATOM 1520 CB ASP B 42 20.550 8.207 127.559 1.00 30.88 C ATOM 1521 CG ASP B 42 21.673 8.348 128.565 1.00 30.83 C ATOM 1522 OD1 ASP B 42 22.429 7.371 128.723 1.00 35.47 O ATOM 1523 OD2 ASP B 42 21.816 9.429 129.177 1.00 31.92 O ATOM 1524 H ASP B 42 19.293 7.408 125.492 1.00 0.00 H ATOM 1525 N ARG B 43 17.902 6.732 128.487 1.00 32.69 N ATOM 1526 CA ARG B 43 16.881 6.403 129.502 1.00 32.44 C ATOM 1527 C ARG B 43 16.656 4.913 129.675 1.00 31.43 C ATOM 1528 O ARG B 43 16.334 4.450 130.715 1.00 32.18 O ATOM 1529 CB ARG B 43 15.577 7.121 129.209 1.00 32.34 C ATOM 1530 CG ARG B 43 14.687 7.254 130.390 1.00 33.44 C ATOM 1531 CD ARG B 43 13.545 8.214 130.163 1.00 36.58 C ATOM 1532 NE ARG B 43 13.990 9.557 129.940 1.00 38.70 N ATOM 1533 CZ ARG B 43 14.046 10.116 128.760 1.00 40.27 C ATOM 1534 NH1 ARG B 43 13.683 9.472 127.707 1.00 39.70 N ATOM 1535 NH2 ARG B 43 14.450 11.333 128.644 1.00 42.32 N ATOM 1536 HE ARG B 43 14.285 10.119 130.764 1.00 0.00 H ATOM 1537 HH12 ARG B 43 13.733 9.930 126.774 1.00 0.00 H ATOM 1538 HH11 ARG B 43 13.340 8.494 127.788 1.00 0.00 H ATOM 1539 HH22 ARG B 43 14.495 11.779 127.705 1.00 0.00 H ATOM 1540 HH21 ARG B 43 14.731 11.870 129.489 1.00 0.00 H ATOM 1541 H ARG B 43 17.609 7.310 127.674 1.00 0.00 H ATOM 1542 N CYS B 44 16.904 4.178 128.630 1.00 30.19 N ATOM 1543 CA CYS B 44 16.891 2.721 128.671 1.00 28.70 C ATOM 1544 C CYS B 44 17.878 2.213 129.712 1.00 28.39 C ATOM 1545 O CYS B 44 17.550 1.346 130.530 1.00 28.04 O ATOM 1546 CB CYS B 44 17.273 2.140 127.307 1.00 26.62 C ATOM 1547 SG CYS B 44 16.035 2.260 126.022 1.00 31.28 S ATOM 1548 H CYS B 44 17.120 4.650 127.729 1.00 0.00 H ATOM 1549 N CYS B 45 19.081 2.789 129.687 1.00 27.44 N ATOM 1550 CA CYS B 45 20.168 2.365 130.557 1.00 26.78 C ATOM 1551 C CYS B 45 19.988 2.892 131.970 1.00 28.04 C ATOM 1552 O CYS B 45 20.465 2.281 132.927 1.00 28.56 O ATOM 1553 CB CYS B 45 21.520 2.826 129.995 1.00 26.98 C ATOM 1554 SG CYS B 45 21.971 2.095 128.392 1.00 30.58 S ATOM 1555 H CYS B 45 19.248 3.570 129.021 1.00 0.00 H ATOM 1556 N TYR B 46 19.301 4.025 132.093 1.00 29.48 N ATOM 1557 CA TYR B 46 18.940 4.566 133.400 1.00 31.66 C ATOM 1558 C TYR B 46 18.101 3.549 134.156 1.00 30.39 C ATOM 1559 O TYR B 46 18.369 3.252 135.320 1.00 29.79 O ATOM 1560 CB TYR B 46 18.169 5.885 133.244 1.00 35.76 C ATOM 1561 CG TYR B 46 17.708 6.529 134.539 1.00 39.77 C ATOM 1562 CD1 TYR B 46 16.575 6.075 135.207 1.00 40.95 C ATOM 1563 CD2 TYR B 46 18.394 7.608 135.081 1.00 42.82 C ATOM 1564 CE1 TYR B 46 16.152 6.668 136.384 1.00 43.20 C ATOM 1565 CE2 TYR B 46 17.976 8.208 136.257 1.00 44.68 C ATOM 1566 CZ TYR B 46 16.857 7.734 136.903 1.00 45.50 C ATOM 1567 OH TYR B 46 16.438 8.328 138.072 1.00 48.56 O ATOM 1568 HH TYR B 46 17.155 8.260 138.751 1.00 0.00 H ATOM 1569 H TYR B 46 19.014 4.539 131.236 1.00 0.00 H ATOM 1570 N VAL B 47 17.090 3.017 133.475 1.00 30.57 N ATOM 1571 CA VAL B 47 16.185 2.032 134.060 1.00 31.09 C ATOM 1572 C VAL B 47 16.947 0.746 134.336 1.00 30.90 C ATOM 1573 O VAL B 47 16.818 0.126 135.392 1.00 30.12 O ATOM 1574 CB VAL B 47 14.998 1.740 133.113 1.00 30.14 C ATOM 1575 CG1 VAL B 47 14.178 0.563 133.611 1.00 26.00 C ATOM 1576 CG2 VAL B 47 14.147 2.982 132.933 1.00 27.50 C ATOM 1577 H VAL B 47 16.939 3.314 132.490 1.00 0.00 H ATOM 1578 N HIS B 48 17.772 0.392 133.364 1.00 31.74 N ATOM 1579 CA HIS B 48 18.651 -0.765 133.405 1.00 33.97 C ATOM 1580 C HIS B 48 19.516 -0.766 134.668 1.00 33.67 C ATOM 1581 O HIS B 48 19.627 -1.783 135.352 1.00 34.58 O ATOM 1582 CB HIS B 48 19.492 -0.745 132.122 1.00 36.54 C ATOM 1583 CG HIS B 48 20.699 -1.624 132.125 1.00 39.03 C ATOM 1584 ND1 HIS B 48 21.876 -1.260 131.498 1.00 40.19 N ATOM 1585 CD2 HIS B 48 20.902 -2.880 132.594 1.00 40.26 C ATOM 1586 CE1 HIS B 48 22.759 -2.232 131.617 1.00 40.53 C ATOM 1587 NE2 HIS B 48 22.192 -3.228 132.273 1.00 40.82 N ATOM 1588 H HIS B 48 17.793 0.984 132.509 1.00 0.00 H ATOM 1589 N LYS B 49 20.107 0.378 134.994 1.00 33.05 N ATOM 1590 CA LYS B 49 20.929 0.480 136.196 1.00 33.86 C ATOM 1591 C LYS B 49 20.096 0.599 137.470 1.00 34.75 C ATOM 1592 O LYS B 49 20.502 0.123 138.533 1.00 35.09 O ATOM 1593 CB LYS B 49 21.906 1.650 136.070 1.00 34.46 C ATOM 1594 CG LYS B 49 23.190 1.240 135.356 1.00 34.96 C ATOM 1595 CD LYS B 49 23.968 2.413 134.784 1.00 35.91 C ATOM 1596 CE LYS B 49 25.339 1.951 134.319 1.00 36.51 C ATOM 1597 NZ LYS B 49 25.968 2.853 133.311 1.00 37.97 N ATOM 1598 HZ1 LYS B 49 25.359 2.909 132.470 1.00 0.00 H ATOM 1599 HZ2 LYS B 49 26.084 3.802 133.721 1.00 0.00 H ATOM 1600 HZ3 LYS B 49 26.899 2.475 133.042 1.00 0.00 H ATOM 1601 H LYS B 49 19.982 1.212 134.385 1.00 0.00 H ATOM 1602 N CYS B 50 18.940 1.245 137.368 1.00 35.44 N ATOM 1603 CA CYS B 50 17.996 1.264 138.480 1.00 35.56 C ATOM 1604 C CYS B 50 17.527 -0.158 138.748 1.00 33.87 C ATOM 1605 O CYS B 50 17.275 -0.539 139.888 1.00 35.03 O ATOM 1606 CB CYS B 50 16.810 2.183 138.187 1.00 35.75 C ATOM 1607 SG CYS B 50 17.131 3.916 138.563 1.00 43.43 S ATOM 1608 H CYS B 50 18.705 1.743 136.486 1.00 0.00 H ATOM 1609 N CYS B 51 17.433 -0.945 137.684 1.00 32.19 N ATOM 1610 CA CYS B 51 17.046 -2.342 137.800 1.00 33.37 C ATOM 1611 C CYS B 51 18.164 -3.154 138.461 1.00 35.79 C ATOM 1612 O CYS B 51 17.901 -4.103 139.197 1.00 37.37 O ATOM 1613 CB CYS B 51 16.703 -2.909 136.421 1.00 32.30 C ATOM 1614 SG CYS B 51 16.151 -4.628 136.404 1.00 34.61 S ATOM 1615 H CYS B 51 17.641 -0.553 136.743 1.00 0.00 H ATOM 1616 N TYR B 52 19.411 -2.773 138.200 1.00 35.98 N ATOM 1617 CA TYR B 52 20.564 -3.420 138.829 1.00 36.85 C ATOM 1618 C TYR B 52 20.618 -3.281 140.353 1.00 38.13 C ATOM 1619 O TYR B 52 21.169 -4.149 141.030 1.00 39.03 O ATOM 1620 CB TYR B 52 21.875 -2.873 138.248 1.00 36.14 C ATOM 1621 CG TYR B 52 22.310 -3.495 136.936 1.00 34.78 C ATOM 1622 CD1 TYR B 52 21.584 -4.525 136.352 1.00 33.55 C ATOM 1623 CD2 TYR B 52 23.472 -3.070 136.302 1.00 34.56 C ATOM 1624 CE1 TYR B 52 21.987 -5.095 135.160 1.00 33.04 C ATOM 1625 CE2 TYR B 52 23.885 -3.637 135.114 1.00 34.01 C ATOM 1626 CZ TYR B 52 23.144 -4.653 134.552 1.00 33.64 C ATOM 1627 OH TYR B 52 23.547 -5.216 133.363 1.00 33.20 O ATOM 1628 HH TYR B 52 22.908 -5.925 133.102 1.00 0.00 H ATOM 1629 H TYR B 52 19.572 -1.994 137.530 1.00 0.00 H ATOM 1630 N LYS B 53 20.135 -2.145 140.833 1.00 38.20 N ATOM 1631 CA LYS B 53 20.199 -1.724 142.220 1.00 39.34 C ATOM 1632 C LYS B 53 19.696 -2.675 143.291 1.00 40.26 C ATOM 1633 O LYS B 53 20.216 -2.700 144.375 1.00 41.04 O ATOM 1634 CB LYS B 53 19.642 -0.309 142.361 1.00 40.62 C ATOM 1635 CG LYS B 53 20.537 0.655 143.092 1.00 42.21 C ATOM 1636 CD LYS B 53 21.501 1.401 142.190 1.00 44.42 C ATOM 1637 CE LYS B 53 22.968 1.127 142.520 1.00 44.71 C ATOM 1638 NZ LYS B 53 23.736 2.244 143.117 1.00 45.52 N ATOM 1639 HZ1 LYS B 53 23.740 3.051 142.460 1.00 0.00 H ATOM 1640 HZ2 LYS B 53 23.293 2.528 144.014 1.00 0.00 H ATOM 1641 HZ3 LYS B 53 24.713 1.935 143.294 1.00 0.00 H ATOM 1642 H LYS B 53 19.672 -1.502 140.160 1.00 0.00 H ATOM 1643 N LYS B 57 18.702 -3.469 142.973 1.00 40.40 N ATOM 1644 CA LYS B 57 18.192 -4.422 143.913 1.00 40.66 C ATOM 1645 C LYS B 57 18.997 -5.686 143.984 1.00 41.47 C ATOM 1646 O LYS B 57 18.707 -6.527 144.803 1.00 42.70 O ATOM 1647 CB LYS B 57 16.801 -4.854 143.471 1.00 39.43 C ATOM 1648 H LYS B 57 18.278 -3.406 142.025 1.00 0.00 H ATOM 1649 N LEU B 58 19.994 -5.861 143.131 1.00 45.39 N ATOM 1650 CA LEU B 58 20.600 -7.174 143.110 1.00 45.07 C ATOM 1651 C LEU B 58 21.848 -7.220 143.967 1.00 46.43 C ATOM 1652 O LEU B 58 22.929 -7.132 143.462 1.00 46.29 O ATOM 1653 CB LEU B 58 20.947 -7.532 141.673 1.00 43.05 C ATOM 1654 CG LEU B 58 19.943 -7.282 140.582 1.00 42.61 C ATOM 1655 CD1 LEU B 58 20.670 -7.067 139.295 1.00 41.17 C ATOM 1656 CD2 LEU B 58 19.017 -8.462 140.413 1.00 44.68 C ATOM 1657 H LEU B 58 20.324 -5.095 142.509 1.00 0.00 H ATOM 1658 N THR B 59 21.708 -7.364 145.267 1.00 47.92 N ATOM 1659 CA THR B 59 22.815 -7.068 146.158 1.00 46.83 C ATOM 1660 C THR B 59 23.666 -8.155 146.767 1.00 54.17 C ATOM 1661 O THR B 59 24.494 -7.856 147.567 1.00 55.55 O ATOM 1662 CB THR B 59 22.390 -6.112 147.286 1.00 48.96 C ATOM 1663 OG1 THR B 59 21.378 -6.712 148.069 1.00 49.66 O ATOM 1664 CG2 THR B 59 21.846 -4.878 146.729 1.00 47.45 C ATOM 1665 HG1 THR B 59 21.110 -6.091 148.792 1.00 0.00 H ATOM 1666 H THR B 59 20.801 -7.691 145.658 1.00 0.00 H ATOM 1667 N GLY B 60 23.478 -9.412 146.447 1.00 54.25 N ATOM 1668 CA GLY B 60 22.763 -9.880 145.307 1.00 53.27 C ATOM 1669 C GLY B 60 23.734 -10.674 144.478 1.00 53.15 C ATOM 1670 O GLY B 60 24.334 -11.604 144.946 1.00 54.17 O ATOM 1671 H GLY B 60 23.886 -10.130 147.080 1.00 0.00 H ATOM 1672 N CYS B 61 23.811 -10.277 143.217 1.00 51.44 N ATOM 1673 CA CYS B 61 24.738 -10.723 142.192 1.00 49.84 C ATOM 1674 C CYS B 61 25.711 -9.623 141.796 1.00 48.92 C ATOM 1675 O CYS B 61 25.531 -8.461 142.163 1.00 48.64 O ATOM 1676 CB CYS B 61 23.973 -11.204 140.967 1.00 47.86 C ATOM 1677 SG CYS B 61 22.605 -12.249 141.398 1.00100.61 S ATOM 1678 H CYS B 61 23.121 -9.556 142.924 1.00 0.00 H ATOM 1679 N ASP B 67 26.755 -10.005 141.070 1.00 47.85 N ATOM 1680 CA ASP B 67 27.646 -9.036 140.454 1.00 45.78 C ATOM 1681 C ASP B 67 27.208 -8.887 138.997 1.00 43.62 C ATOM 1682 O ASP B 67 27.492 -9.754 138.171 1.00 43.70 O ATOM 1683 CB ASP B 67 29.104 -9.482 140.553 1.00 46.86 C ATOM 1684 CG ASP B 67 30.080 -8.387 140.165 1.00 46.60 C ATOM 1685 OD1 ASP B 67 29.645 -7.336 139.650 1.00 44.81 O ATOM 1686 OD2 ASP B 67 31.292 -8.574 140.389 1.00 48.82 O ATOM 1687 H ASP B 67 26.939 -11.020 140.939 1.00 0.00 H ATOM 1688 N PRO B 68 26.512 -7.783 138.681 1.00 41.45 N ATOM 1689 CA PRO B 68 25.922 -7.557 137.355 1.00 40.36 C ATOM 1690 C PRO B 68 26.956 -7.443 136.238 1.00 40.39 C ATOM 1691 O PRO B 68 26.621 -7.637 135.067 1.00 40.15 O ATOM 1692 CB PRO B 68 25.167 -6.232 137.528 1.00 39.65 C ATOM 1693 CG PRO B 68 24.951 -6.104 139.002 1.00 40.42 C ATOM 1694 CD PRO B 68 26.181 -6.695 139.615 1.00 41.22 C ATOM 1695 N LYS B 69 28.200 -7.197 136.594 1.00 40.85 N ATOM 1696 CA LYS B 69 29.250 -7.066 135.621 1.00 40.29 C ATOM 1697 C LYS B 69 30.005 -8.328 135.422 1.00 39.99 C ATOM 1698 O LYS B 69 30.433 -8.611 134.359 1.00 40.04 O ATOM 1699 CB LYS B 69 30.192 -5.955 136.015 1.00 41.93 C ATOM 1700 CG LYS B 69 29.597 -4.611 135.757 1.00 42.84 C ATOM 1701 CD LYS B 69 30.503 -3.496 136.193 1.00 45.66 C ATOM 1702 CE LYS B 69 31.003 -3.721 137.599 1.00 48.51 C ATOM 1703 NZ LYS B 69 31.632 -2.499 138.126 1.00 50.58 N ATOM 1704 HZ1 LYS B 69 32.435 -2.235 137.520 1.00 0.00 H ATOM 1705 HZ2 LYS B 69 30.934 -1.728 138.135 1.00 0.00 H ATOM 1706 HZ3 LYS B 69 31.969 -2.674 139.094 1.00 0.00 H ATOM 1707 H LYS B 69 28.428 -7.095 137.604 1.00 0.00 H ATOM 1708 N LYS B 70 30.169 -9.072 136.494 1.00 40.27 N ATOM 1709 CA LYS B 70 31.028 -10.233 136.483 1.00 42.17 C ATOM 1710 C LYS B 70 30.351 -11.585 136.574 1.00 42.46 C ATOM 1711 O LYS B 70 30.804 -12.509 135.957 1.00 44.63 O ATOM 1712 CB LYS B 70 32.122 -10.102 137.521 1.00 44.21 C ATOM 1713 CG LYS B 70 33.240 -9.246 137.056 1.00 44.34 C ATOM 1714 CD LYS B 70 34.007 -8.692 138.209 1.00 46.77 C ATOM 1715 CE LYS B 70 35.485 -8.828 137.977 1.00 49.22 C ATOM 1716 NZ LYS B 70 36.212 -7.905 138.871 1.00 51.67 N ATOM 1717 HZ1 LYS B 70 35.918 -6.928 138.671 1.00 0.00 H ATOM 1718 HZ2 LYS B 70 35.993 -8.139 139.861 1.00 0.00 H ATOM 1719 HZ3 LYS B 70 37.235 -8.001 138.709 1.00 0.00 H ATOM 1720 H LYS B 70 29.669 -8.818 137.370 1.00 0.00 H ATOM 1721 N ASP B 71 29.270 -11.694 137.311 1.00 40.94 N ATOM 1722 CA ASP B 71 28.582 -12.957 137.425 1.00 40.47 C ATOM 1723 C ASP B 71 27.924 -13.397 136.142 1.00 37.83 C ATOM 1724 O ASP B 71 27.087 -12.723 135.631 1.00 36.33 O ATOM 1725 CB ASP B 71 27.569 -12.898 138.549 1.00 41.15 C ATOM 1726 CG ASP B 71 28.200 -12.777 139.905 1.00 44.13 C ATOM 1727 OD1 ASP B 71 29.337 -13.187 140.097 1.00 46.21 O ATOM 1728 OD2 ASP B 71 27.544 -12.282 140.799 1.00 44.98 O ATOM 1729 H ASP B 71 28.906 -10.862 137.818 1.00 0.00 H ATOM 1730 N ARG B 72 28.284 -14.571 135.656 1.00 38.12 N ATOM 1731 CA ARG B 72 27.718 -15.135 134.436 1.00 38.45 C ATOM 1732 C ARG B 72 26.368 -15.802 134.696 1.00 39.69 C ATOM 1733 O ARG B 72 26.070 -16.195 135.824 1.00 41.92 O ATOM 1734 CB ARG B 72 28.685 -16.140 133.811 1.00 38.10 C ATOM 1735 H ARG B 72 29.005 -15.119 136.167 1.00 0.00 H ATOM 1736 N TYR B 73 25.563 -15.939 133.644 1.00 37.89 N ATOM 1737 CA TYR B 73 24.301 -16.671 133.727 1.00 37.89 C ATOM 1738 C TYR B 73 23.934 -17.264 132.367 1.00 37.23 C ATOM 1739 O TYR B 73 24.555 -16.946 131.351 1.00 36.12 O ATOM 1740 CB TYR B 73 23.165 -15.770 134.230 1.00 37.51 C ATOM 1741 CG TYR B 73 22.954 -14.520 133.405 1.00 36.22 C ATOM 1742 CD1 TYR B 73 22.256 -14.565 132.204 1.00 36.21 C ATOM 1743 CD2 TYR B 73 23.428 -13.291 133.839 1.00 35.29 C ATOM 1744 CE1 TYR B 73 22.063 -13.429 131.446 1.00 34.58 C ATOM 1745 CE2 TYR B 73 23.233 -12.146 133.091 1.00 33.99 C ATOM 1746 CZ TYR B 73 22.549 -12.221 131.896 1.00 33.49 C ATOM 1747 OH TYR B 73 22.357 -11.085 131.144 1.00 31.42 O ATOM 1748 HH TYR B 73 21.846 -10.423 131.673 1.00 0.00 H ATOM 1749 H TYR B 73 25.841 -15.513 132.737 1.00 0.00 H ATOM 1750 N SER B 74 22.914 -18.117 132.354 1.00 38.28 N ATOM 1751 CA SER B 74 22.509 -18.810 131.137 1.00 39.82 C ATOM 1752 C SER B 74 21.240 -18.223 130.516 1.00 39.51 C ATOM 1753 O SER B 74 20.261 -17.953 131.210 1.00 39.53 O ATOM 1754 CB SER B 74 22.296 -20.295 131.427 1.00 43.34 C ATOM 1755 OG SER B 74 23.522 -20.937 131.724 1.00 45.96 O ATOM 1756 HG SER B 74 24.135 -20.849 130.951 1.00 0.00 H ATOM 1757 H SER B 74 22.391 -18.294 133.235 1.00 0.00 H ATOM 1758 N TYR B 75 21.267 -18.032 129.201 1.00 39.46 N ATOM 1759 CA TYR B 75 20.086 -17.599 128.465 1.00 38.69 C ATOM 1760 C TYR B 75 20.133 -18.107 127.029 1.00 39.57 C ATOM 1761 O TYR B 75 21.199 -18.446 126.514 1.00 39.47 O ATOM 1762 CB TYR B 75 19.954 -16.075 128.489 1.00 36.23 C ATOM 1763 CG TYR B 75 20.701 -15.333 127.399 1.00 35.14 C ATOM 1764 CD1 TYR B 75 22.016 -14.922 127.585 1.00 34.79 C ATOM 1765 CD2 TYR B 75 20.083 -15.023 126.190 1.00 34.50 C ATOM 1766 CE1 TYR B 75 22.695 -14.231 126.598 1.00 33.65 C ATOM 1767 CE2 TYR B 75 20.754 -14.338 125.199 1.00 33.24 C ATOM 1768 CZ TYR B 75 22.060 -13.942 125.408 1.00 33.66 C ATOM 1769 OH TYR B 75 22.735 -13.257 124.425 1.00 33.82 O ATOM 1770 HH TYR B 75 22.780 -13.814 123.608 1.00 0.00 H ATOM 1771 H TYR B 75 22.154 -18.196 128.684 1.00 0.00 H ATOM 1772 N SER B 76 18.972 -18.155 126.383 1.00 40.08 N ATOM 1773 CA SER B 76 18.892 -18.663 125.019 1.00 41.01 C ATOM 1774 C SER B 76 18.282 -17.659 124.049 1.00 39.23 C ATOM 1775 O SER B 76 17.421 -16.859 124.415 1.00 38.69 O ATOM 1776 CB SER B 76 18.087 -19.964 124.984 1.00 43.98 C ATOM 1777 OG SER B 76 18.642 -20.928 125.860 1.00 46.30 O ATOM 1778 HG SER B 76 18.104 -21.758 125.819 1.00 0.00 H ATOM 1779 H SER B 76 18.108 -17.825 126.858 1.00 0.00 H ATOM 1780 N TRP B 77 18.679 -17.758 122.797 1.00 38.35 N ATOM 1781 CA TRP B 77 18.115 -16.990 121.727 1.00 36.79 C ATOM 1782 C TRP B 77 17.185 -17.853 120.900 1.00 39.29 C ATOM 1783 O TRP B 77 17.559 -18.426 119.932 1.00 40.96 O ATOM 1784 CB TRP B 77 19.244 -16.372 120.913 1.00 35.11 C ATOM 1785 CG TRP B 77 18.905 -15.579 119.706 1.00 33.24 C ATOM 1786 CD1 TRP B 77 19.131 -15.937 118.458 1.00 33.82 C ATOM 1787 CD2 TRP B 77 18.330 -14.282 119.650 1.00 31.49 C ATOM 1788 NE1 TRP B 77 18.729 -14.986 117.612 1.00 33.17 N ATOM 1789 CE2 TRP B 77 18.233 -13.942 118.324 1.00 31.37 C ATOM 1790 CE3 TRP B 77 17.871 -13.386 120.599 1.00 30.87 C ATOM 1791 CZ2 TRP B 77 17.691 -12.759 117.905 1.00 29.94 C ATOM 1792 CZ3 TRP B 77 17.348 -12.233 120.184 1.00 29.84 C ATOM 1793 CH2 TRP B 77 17.262 -11.918 118.850 1.00 29.23 C ATOM 1794 HE1 TRP B 77 18.786 -15.037 116.575 1.00 0.00 H ATOM 1795 H TRP B 77 19.442 -18.429 122.573 1.00 0.00 H ATOM 1796 N LYS B 78 15.944 -17.923 121.328 1.00 40.28 N ATOM 1797 CA LYS B 78 14.960 -18.834 120.811 1.00 42.41 C ATOM 1798 C LYS B 78 13.941 -18.094 120.003 1.00 42.47 C ATOM 1799 O LYS B 78 13.220 -17.312 120.523 1.00 42.17 O ATOM 1800 CB LYS B 78 14.273 -19.509 121.988 1.00 44.50 C ATOM 1801 CG LYS B 78 13.775 -20.914 121.743 1.00 48.74 C ATOM 1802 CD LYS B 78 13.661 -21.706 123.038 1.00 51.90 C ATOM 1803 CE LYS B 78 12.316 -22.411 123.165 1.00 55.96 C ATOM 1804 NZ LYS B 78 11.497 -22.054 124.360 1.00 56.69 N ATOM 1805 HZ1 LYS B 78 12.027 -22.287 125.224 1.00 0.00 H ATOM 1806 HZ2 LYS B 78 11.288 -21.035 124.344 1.00 0.00 H ATOM 1807 HZ3 LYS B 78 10.607 -22.592 124.342 1.00 0.00 H ATOM 1808 H LYS B 78 15.656 -17.277 122.090 1.00 0.00 H ATOM 1809 N ASP B 79 13.890 -18.362 118.719 1.00 43.30 N ATOM 1810 CA ASP B 79 13.005 -17.667 117.816 1.00 44.17 C ATOM 1811 C ASP B 79 13.089 -16.167 117.927 1.00 40.32 C ATOM 1812 O ASP B 79 12.101 -15.495 117.929 1.00 39.22 O ATOM 1813 CB ASP B 79 11.568 -18.160 117.961 1.00 49.49 C ATOM 1814 CG ASP B 79 10.854 -18.248 116.641 1.00 53.47 C ATOM 1815 OD1 ASP B 79 11.200 -19.122 115.827 1.00 55.77 O ATOM 1816 OD2 ASP B 79 9.957 -17.442 116.401 1.00 54.10 O ATOM 1817 H ASP B 79 14.511 -19.104 118.338 1.00 0.00 H ATOM 1818 N LYS B 80 14.315 -15.669 117.979 1.00 38.61 N ATOM 1819 CA LYS B 80 14.624 -14.269 117.973 1.00 35.97 C ATOM 1820 C LYS B 80 14.041 -13.644 119.164 1.00 36.50 C ATOM 1821 O LYS B 80 13.641 -12.532 119.147 1.00 36.11 O ATOM 1822 CB LYS B 80 14.105 -13.618 116.714 1.00 34.39 C ATOM 1823 CG LYS B 80 14.692 -14.189 115.452 1.00 32.80 C ATOM 1824 CD LYS B 80 14.627 -13.217 114.314 1.00 32.20 C ATOM 1825 CE LYS B 80 13.334 -13.276 113.590 1.00 33.62 C ATOM 1826 NZ LYS B 80 13.319 -12.349 112.461 1.00 35.27 N ATOM 1827 HZ1 LYS B 80 13.462 -11.379 112.808 1.00 0.00 H ATOM 1828 HZ2 LYS B 80 14.082 -12.598 111.800 1.00 0.00 H ATOM 1829 HZ3 LYS B 80 12.402 -12.413 111.974 1.00 0.00 H ATOM 1830 H LYS B 80 15.108 -16.340 118.028 1.00 0.00 H ATOM 1831 N THR B 81 13.990 -14.411 120.219 1.00 37.33 N ATOM 1832 CA THR B 81 13.492 -13.925 121.493 1.00 36.66 C ATOM 1833 C THR B 81 14.481 -14.329 122.565 1.00 36.00 C ATOM 1834 O THR B 81 14.984 -15.451 122.553 1.00 37.58 O ATOM 1835 CB THR B 81 12.094 -14.498 121.828 1.00 39.36 C ATOM 1836 OG1 THR B 81 11.193 -14.235 120.748 1.00 35.18 O ATOM 1837 CG2 THR B 81 11.551 -13.874 123.102 1.00 38.49 C ATOM 1838 HG1 THR B 81 11.535 -14.663 119.923 1.00 0.00 H ATOM 1839 H THR B 81 14.315 -15.396 120.145 1.00 0.00 H ATOM 1840 N ILE B 82 14.777 -13.413 123.477 1.00 36.09 N ATOM 1841 CA ILE B 82 15.672 -13.710 124.587 1.00 36.44 C ATOM 1842 C ILE B 82 14.943 -14.475 125.690 1.00 38.20 C ATOM 1843 O ILE B 82 14.032 -13.951 126.325 1.00 32.37 O ATOM 1844 CB ILE B 82 16.296 -12.421 125.164 1.00 34.12 C ATOM 1845 CG1 ILE B 82 17.168 -11.748 124.107 1.00 32.34 C ATOM 1846 CG2 ILE B 82 17.119 -12.729 126.404 1.00 34.84 C ATOM 1847 CD1 ILE B 82 17.735 -10.422 124.538 1.00 30.82 C ATOM 1848 H ILE B 82 14.361 -12.463 123.398 1.00 0.00 H ATOM 1849 N VAL B 83 15.347 -15.721 125.906 1.00 40.85 N ATOM 1850 CA VAL B 83 14.744 -16.534 126.951 1.00 44.09 C ATOM 1851 C VAL B 83 15.732 -16.767 128.090 1.00 45.35 C ATOM 1852 O VAL B 83 16.736 -17.458 127.924 1.00 47.34 O ATOM 1853 CB VAL B 83 14.268 -17.898 126.409 1.00 47.07 C ATOM 1854 CG1 VAL B 83 13.658 -18.721 127.526 1.00 40.54 C ATOM 1855 CG2 VAL B 83 13.269 -17.704 125.277 1.00 38.53 C ATOM 1856 H VAL B 83 16.106 -16.122 125.319 1.00 0.00 H ATOM 1857 N CYS B 84 15.450 -16.173 129.244 1.00 44.56 N ATOM 1858 CA CYS B 84 16.274 -16.365 130.430 1.00 44.15 C ATOM 1859 C CYS B 84 15.997 -17.742 131.025 1.00 47.92 C ATOM 1860 O CYS B 84 14.865 -18.033 131.409 1.00 48.79 O ATOM 1861 CB CYS B 84 15.998 -15.278 131.470 1.00 41.93 C ATOM 1862 SG CYS B 84 16.670 -13.646 131.079 1.00 41.31 S ATOM 1863 H CYS B 84 14.617 -15.553 129.303 1.00 0.00 H ATOM 1864 N GLY B 85 17.023 -18.563 131.128 1.00 50.28 N ATOM 1865 CA GLY B 85 16.894 -19.840 131.779 1.00 55.46 C ATOM 1866 C GLY B 85 17.754 -19.994 133.003 1.00 58.31 C ATOM 1867 O GLY B 85 18.760 -20.674 132.989 1.00 60.72 O ATOM 1868 H GLY B 85 17.943 -18.283 130.732 1.00 0.00 H ATOM 1869 N GLU B 86 17.355 -19.365 134.085 1.00 58.31 N ATOM 1870 CA GLU B 86 18.197 -19.323 135.262 1.00 58.94 C ATOM 1871 C GLU B 86 17.475 -19.725 136.512 1.00 61.40 C ATOM 1872 O GLU B 86 16.459 -19.161 136.874 1.00 61.69 O ATOM 1873 CB GLU B 86 18.731 -17.912 135.476 1.00 56.04 C ATOM 1874 CG GLU B 86 20.060 -17.607 134.857 1.00 55.08 C ATOM 1875 CD GLU B 86 21.115 -18.582 135.259 1.00 57.86 C ATOM 1876 OE1 GLU B 86 21.097 -19.046 136.398 1.00 59.86 O ATOM 1877 OE2 GLU B 86 21.952 -18.904 134.426 1.00 58.08 O ATOM 1878 H GLU B 86 16.428 -18.894 134.096 1.00 0.00 H ATOM 1879 N ASN B 87 18.034 -20.691 137.188 1.00 63.51 N ATOM 1880 CA ASN B 87 17.626 -20.937 138.529 1.00 65.42 C ATOM 1881 C ASN B 87 18.623 -20.077 139.192 1.00 62.56 C ATOM 1882 O ASN B 87 19.684 -19.886 138.643 1.00 61.07 O ATOM 1883 CB ASN B 87 17.802 -22.401 138.911 1.00 69.41 C ATOM 1884 H ASN B 87 18.773 -21.277 136.750 1.00 0.00 H ATOM 1885 N ASN B 88 18.235 -19.567 140.343 1.00 61.85 N ATOM 1886 CA ASN B 88 18.982 -18.665 141.201 1.00 58.33 C ATOM 1887 C ASN B 88 18.306 -17.324 141.103 1.00 54.51 C ATOM 1888 O ASN B 88 18.299 -16.726 140.085 1.00 52.53 O ATOM 1889 CB ASN B 88 20.467 -18.646 140.897 1.00 56.81 C ATOM 1890 CG ASN B 88 21.218 -17.629 141.681 1.00 55.22 C ATOM 1891 OD1 ASN B 88 20.774 -16.526 141.853 1.00 53.10 O ATOM 1892 ND2 ASN B 88 22.390 -17.996 142.128 1.00 56.57 N ATOM 1893 HD22 ASN B 88 22.733 -18.962 141.955 1.00 0.00 H ATOM 1894 HD21 ASN B 88 22.979 -17.322 142.657 1.00 0.00 H ATOM 1895 H ASN B 88 17.288 -19.841 140.674 1.00 0.00 H ATOM 1896 N PRO B 90 17.665 -16.902 142.272 1.00 37.01 N ATOM 1897 CA PRO B 90 16.871 -15.683 142.131 1.00 36.28 C ATOM 1898 C PRO B 90 17.531 -14.448 141.610 1.00 35.63 C ATOM 1899 O PRO B 90 16.976 -13.774 140.809 1.00 35.41 O ATOM 1900 CB PRO B 90 16.476 -15.381 143.554 1.00 36.80 C ATOM 1901 CG PRO B 90 16.243 -16.682 144.115 1.00 37.97 C ATOM 1902 CD PRO B 90 17.482 -17.342 143.741 1.00 37.83 C ATOM 1903 N CYS B 91 18.681 -14.124 142.126 1.00 35.63 N ATOM 1904 CA CYS B 91 19.393 -12.918 141.731 1.00 34.45 C ATOM 1905 C CYS B 91 19.796 -12.948 140.261 1.00 33.85 C ATOM 1906 O CYS B 91 19.579 -11.981 139.532 1.00 34.12 O ATOM 1907 CB CYS B 91 20.629 -12.712 142.602 1.00 33.60 C ATOM 1908 SG CYS B 91 21.339 -11.058 142.454 1.00 53.15 S ATOM 1909 H CYS B 91 19.104 -14.747 142.843 1.00 0.00 H ATOM 1910 N LEU B 92 20.398 -14.054 139.838 1.00 33.54 N ATOM 1911 CA LEU B 92 20.833 -14.209 138.453 1.00 33.09 C ATOM 1912 C LEU B 92 19.661 -14.141 137.487 1.00 33.45 C ATOM 1913 O LEU B 92 19.791 -13.618 136.383 1.00 32.70 O ATOM 1914 CB LEU B 92 21.588 -15.528 138.270 1.00 32.75 C ATOM 1915 CG LEU B 92 22.964 -15.631 138.925 1.00 32.79 C ATOM 1916 CD1 LEU B 92 23.657 -16.906 138.481 1.00 33.36 C ATOM 1917 CD2 LEU B 92 23.812 -14.415 138.582 1.00 32.21 C ATOM 1918 H LEU B 92 20.564 -14.830 140.511 1.00 0.00 H ATOM 1919 N LYS B 93 18.515 -14.667 137.908 1.00 34.69 N ATOM 1920 CA LYS B 93 17.331 -14.638 137.066 1.00 35.71 C ATOM 1921 C LYS B 93 16.853 -13.204 136.890 1.00 35.34 C ATOM 1922 O LYS B 93 16.506 -12.788 135.787 1.00 35.04 O ATOM 1923 CB LYS B 93 16.215 -15.497 137.669 1.00 37.65 C ATOM 1924 H LYS B 93 18.465 -15.104 138.850 1.00 0.00 H ATOM 1925 N GLU B 94 16.857 -12.450 137.983 1.00 35.79 N ATOM 1926 CA GLU B 94 16.461 -11.048 137.948 1.00 36.46 C ATOM 1927 C GLU B 94 17.446 -10.231 137.119 1.00 35.66 C ATOM 1928 O GLU B 94 17.053 -9.360 136.342 1.00 35.08 O ATOM 1929 CB GLU B 94 16.378 -10.478 139.363 1.00 37.98 C ATOM 1930 CG GLU B 94 15.259 -11.050 140.212 1.00 40.71 C ATOM 1931 CD GLU B 94 13.903 -10.966 139.539 1.00 42.30 C ATOM 1932 OE1 GLU B 94 13.557 -9.881 139.019 1.00 41.89 O ATOM 1933 OE2 GLU B 94 13.179 -11.982 139.541 1.00 43.47 O ATOM 1934 H GLU B 94 17.150 -12.871 138.888 1.00 0.00 H ATOM 1935 N LEU B 95 18.731 -10.530 137.297 1.00 34.64 N ATOM 1936 CA LEU B 95 19.794 -9.866 136.563 1.00 32.82 C ATOM 1937 C LEU B 95 19.617 -10.064 135.068 1.00 32.33 C ATOM 1938 O LEU B 95 19.706 -9.117 134.286 1.00 31.71 O ATOM 1939 CB LEU B 95 21.159 -10.396 137.009 1.00 33.66 C ATOM 1940 CG LEU B 95 22.365 -10.056 136.127 1.00 33.58 C ATOM 1941 CD1 LEU B 95 22.650 -8.567 136.192 1.00 33.38 C ATOM 1942 CD2 LEU B 95 23.581 -10.854 136.556 1.00 34.14 C ATOM 1943 H LEU B 95 18.983 -11.266 137.987 1.00 0.00 H ATOM 1944 N CYS B 96 19.357 -11.308 134.685 1.00 32.28 N ATOM 1945 CA CYS B 96 19.134 -11.655 133.290 1.00 32.60 C ATOM 1946 C CYS B 96 17.941 -10.899 132.714 1.00 33.26 C ATOM 1947 O CYS B 96 17.989 -10.433 131.577 1.00 34.28 O ATOM 1948 CB CYS B 96 18.933 -13.168 133.149 1.00 32.69 C ATOM 1949 SG CYS B 96 18.663 -13.750 131.460 1.00 39.34 S ATOM 1950 H CYS B 96 19.311 -12.058 135.404 1.00 0.00 H ATOM 1951 N GLU B 97 16.880 -10.768 133.503 1.00 33.06 N ATOM 1952 CA GLU B 97 15.690 -10.034 133.073 1.00 31.97 C ATOM 1953 C GLU B 97 15.981 -8.540 132.932 1.00 30.10 C ATOM 1954 O GLU B 97 15.405 -7.873 132.074 1.00 30.74 O ATOM 1955 CB GLU B 97 14.529 -10.256 134.048 1.00 31.90 C ATOM 1956 CG GLU B 97 13.997 -11.684 134.086 1.00 32.61 C ATOM 1957 CD GLU B 97 13.395 -12.133 132.766 1.00 34.04 C ATOM 1958 OE1 GLU B 97 12.916 -11.271 131.998 1.00 34.75 O ATOM 1959 OE2 GLU B 97 13.402 -13.352 132.492 1.00 34.28 O ATOM 1960 H GLU B 97 16.896 -11.198 134.450 1.00 0.00 H ATOM 1961 N CYS B 98 16.848 -8.012 133.792 1.00 27.95 N ATOM 1962 CA CYS B 98 17.279 -6.620 133.672 1.00 26.58 C ATOM 1963 C CYS B 98 17.936 -6.379 132.316 1.00 26.61 C ATOM 1964 O CYS B 98 17.562 -5.466 131.573 1.00 26.61 O ATOM 1965 CB CYS B 98 18.259 -6.250 134.788 1.00 25.73 C ATOM 1966 SG CYS B 98 17.550 -6.105 136.433 1.00 43.58 S ATOM 1967 H CYS B 98 17.226 -8.599 134.563 1.00 0.00 H ATOM 1968 N ASP B 99 18.904 -7.230 132.000 1.00 26.35 N ATOM 1969 CA ASP B 99 19.666 -7.126 130.764 1.00 27.13 C ATOM 1970 C ASP B 99 18.784 -7.343 129.545 1.00 28.35 C ATOM 1971 O ASP B 99 18.972 -6.695 128.514 1.00 29.01 O ATOM 1972 CB ASP B 99 20.822 -8.133 130.760 1.00 27.43 C ATOM 1973 CG ASP B 99 21.846 -7.854 131.849 1.00 29.15 C ATOM 1974 OD1 ASP B 99 21.827 -6.742 132.420 1.00 29.71 O ATOM 1975 OD2 ASP B 99 22.688 -8.739 132.123 1.00 30.94 O ATOM 1976 H ASP B 99 19.127 -8.001 132.661 1.00 0.00 H ATOM 1977 N LYS B 100 17.833 -8.269 129.654 1.00 28.12 N ATOM 1978 CA LYS B 100 16.917 -8.522 128.548 1.00 27.66 C ATOM 1979 C LYS B 100 16.099 -7.273 128.258 1.00 29.26 C ATOM 1980 O LYS B 100 15.927 -6.883 127.102 1.00 30.51 O ATOM 1981 CB LYS B 100 15.994 -9.702 128.849 1.00 26.58 C ATOM 1982 CG LYS B 100 14.843 -9.823 127.863 1.00 26.94 C ATOM 1983 CD LYS B 100 13.962 -11.027 128.140 1.00 27.12 C ATOM 1984 CE LYS B 100 12.751 -11.017 127.217 1.00 25.40 C ATOM 1985 NZ LYS B 100 11.980 -12.273 127.310 1.00 26.04 N ATOM 1986 HZ1 LYS B 100 12.589 -13.073 127.042 1.00 0.00 H ATOM 1987 HZ2 LYS B 100 11.646 -12.402 128.286 1.00 0.00 H ATOM 1988 HZ3 LYS B 100 11.164 -12.226 126.667 1.00 0.00 H ATOM 1989 H LYS B 100 17.743 -8.816 130.534 1.00 0.00 H ATOM 1990 N ALA B 101 15.614 -6.643 129.323 1.00 29.35 N ATOM 1991 CA ALA B 101 14.795 -5.444 129.204 1.00 29.71 C ATOM 1992 C ALA B 101 15.541 -4.324 128.484 1.00 29.78 C ATOM 1993 O ALA B 101 15.005 -3.720 127.552 1.00 29.74 O ATOM 1994 CB ALA B 101 14.337 -4.976 130.582 1.00 28.91 C ATOM 1995 H ALA B 101 15.826 -7.017 130.270 1.00 0.00 H ATOM 1996 N VAL B 102 16.776 -4.051 128.911 1.00 28.77 N ATOM 1997 CA VAL B 102 17.515 -2.922 128.354 1.00 27.78 C ATOM 1998 C VAL B 102 17.847 -3.209 126.892 1.00 28.24 C ATOM 1999 O VAL B 102 17.769 -2.312 126.052 1.00 29.10 O ATOM 2000 CB VAL B 102 18.813 -2.593 129.163 1.00 23.62 C ATOM 2001 CG1 VAL B 102 19.822 -3.735 129.123 1.00 24.15 C ATOM 2002 CG2 VAL B 102 19.455 -1.310 128.643 1.00 24.21 C ATOM 2003 H VAL B 102 17.214 -4.645 129.644 1.00 0.00 H ATOM 2004 N ALA B 103 18.155 -4.468 126.587 1.00 27.54 N ATOM 2005 CA ALA B 103 18.479 -4.873 125.224 1.00 27.62 C ATOM 2006 C ALA B 103 17.296 -4.585 124.314 1.00 28.48 C ATOM 2007 O ALA B 103 17.458 -3.976 123.255 1.00 28.42 O ATOM 2008 CB ALA B 103 18.860 -6.348 125.168 1.00 26.86 C ATOM 2009 H ALA B 103 18.165 -5.183 127.342 1.00 0.00 H ATOM 2010 N ILE B 104 16.109 -5.012 124.742 1.00 28.82 N ATOM 2011 CA ILE B 104 14.871 -4.712 124.023 1.00 28.53 C ATOM 2012 C ILE B 104 14.657 -3.206 123.879 1.00 28.25 C ATOM 2013 O ILE B 104 14.402 -2.710 122.779 1.00 29.95 O ATOM 2014 CB ILE B 104 13.642 -5.328 124.730 1.00 28.35 C ATOM 2015 CG1 ILE B 104 13.682 -6.858 124.630 1.00 28.73 C ATOM 2016 CG2 ILE B 104 12.348 -4.804 124.122 1.00 25.59 C ATOM 2017 CD1 ILE B 104 12.701 -7.557 125.548 1.00 25.20 C ATOM 2018 H ILE B 104 16.061 -5.576 125.614 1.00 0.00 H ATOM 2019 N CYS B 105 14.793 -2.483 124.987 1.00 25.98 N ATOM 2020 CA CYS B 105 14.588 -1.039 124.992 1.00 26.58 C ATOM 2021 C CYS B 105 15.537 -0.327 124.029 1.00 28.61 C ATOM 2022 O CYS B 105 15.136 0.605 123.325 1.00 28.67 O ATOM 2023 CB CYS B 105 14.764 -0.483 126.407 1.00 24.01 C ATOM 2024 SG CYS B 105 14.353 1.262 126.589 1.00 35.61 S ATOM 2025 H CYS B 105 15.053 -2.960 125.874 1.00 0.00 H ATOM 2026 N LEU B 106 16.789 -0.777 123.995 1.00 29.48 N ATOM 2027 CA LEU B 106 17.790 -0.184 123.112 1.00 29.84 C ATOM 2028 C LEU B 106 17.418 -0.364 121.646 1.00 26.68 C ATOM 2029 O LEU B 106 17.592 0.550 120.842 1.00 27.40 O ATOM 2030 CB LEU B 106 19.171 -0.791 123.379 1.00 29.17 C ATOM 2031 CG LEU B 106 19.846 -0.383 124.689 1.00 26.96 C ATOM 2032 CD1 LEU B 106 21.178 -1.096 124.834 1.00 27.10 C ATOM 2033 CD2 LEU B 106 20.024 1.124 124.749 1.00 25.72 C ATOM 2034 H LEU B 106 17.061 -1.569 124.611 1.00 0.00 H ATOM 2035 N ARG B 107 16.889 -1.535 121.307 1.00 28.99 N ATOM 2036 CA ARG B 107 16.488 -1.819 119.933 1.00 30.89 C ATOM 2037 C ARG B 107 15.255 -1.010 119.533 1.00 31.46 C ATOM 2038 O ARG B 107 15.157 -0.519 118.408 1.00 32.53 O ATOM 2039 CB ARG B 107 16.220 -3.316 119.754 1.00 30.98 C ATOM 2040 CG ARG B 107 15.784 -3.710 118.351 1.00 31.96 C ATOM 2041 CD ARG B 107 14.288 -3.959 118.296 1.00 31.94 C ATOM 2042 NE ARG B 107 13.893 -4.950 119.286 1.00 30.43 N ATOM 2043 CZ ARG B 107 12.641 -5.178 119.658 1.00 29.16 C ATOM 2044 NH1 ARG B 107 11.651 -4.475 119.126 1.00 29.78 N ATOM 2045 NH2 ARG B 107 12.386 -6.101 120.571 1.00 28.30 N ATOM 2046 HE ARG B 107 14.643 -5.517 119.731 1.00 0.00 H ATOM 2047 HH12 ARG B 107 10.669 -4.655 119.419 1.00 0.00 H ATOM 2048 HH11 ARG B 107 11.856 -3.743 118.416 1.00 0.00 H ATOM 2049 HH22 ARG B 107 11.406 -6.284 120.866 1.00 0.00 H ATOM 2050 HH21 ARG B 107 13.166 -6.644 120.994 1.00 0.00 H ATOM 2051 H ARG B 107 16.758 -2.265 122.037 1.00 0.00 H ATOM 2052 N GLU B 108 14.322 -0.862 120.462 1.00 31.42 N ATOM 2053 CA GLU B 108 13.092 -0.123 120.189 1.00 32.84 C ATOM 2054 C GLU B 108 13.386 1.351 119.942 1.00 32.72 C ATOM 2055 O GLU B 108 12.637 2.034 119.244 1.00 32.11 O ATOM 2056 CB GLU B 108 12.107 -0.282 121.352 1.00 32.88 C ATOM 2057 CG GLU B 108 11.517 -1.675 121.471 1.00 34.64 C ATOM 2058 CD GLU B 108 10.777 -1.881 122.773 1.00 36.60 C ATOM 2059 OE1 GLU B 108 11.022 -1.105 123.722 1.00 37.27 O ATOM 2060 OE2 GLU B 108 9.949 -2.814 122.849 1.00 37.53 O ATOM 2061 H GLU B 108 14.468 -1.280 121.403 1.00 0.00 H ATOM 2062 N ASN B 109 14.496 1.829 120.496 1.00 33.25 N ATOM 2063 CA ASN B 109 14.841 3.239 120.390 1.00 35.01 C ATOM 2064 C ASN B 109 16.059 3.489 119.505 1.00 36.96 C ATOM 2065 O ASN B 109 16.817 4.433 119.719 1.00 38.47 O ATOM 2066 CB ASN B 109 15.057 3.825 121.786 1.00 33.62 C ATOM 2067 CG ASN B 109 13.786 3.811 122.622 1.00 32.13 C ATOM 2068 OD1 ASN B 109 13.661 3.050 123.585 1.00 30.09 O ATOM 2069 ND2 ASN B 109 12.835 4.660 122.254 1.00 32.58 N ATOM 2070 HD22 ASN B 109 12.983 5.284 121.435 1.00 0.00 H ATOM 2071 HD21 ASN B 109 11.941 4.702 122.784 1.00 0.00 H ATOM 2072 H ASN B 109 15.128 1.185 121.013 1.00 0.00 H ATOM 2073 N LEU B 110 16.224 2.646 118.493 1.00 37.29 N ATOM 2074 CA LEU B 110 17.276 2.842 117.511 1.00 38.82 C ATOM 2075 C LEU B 110 16.952 4.040 116.636 1.00 39.34 C ATOM 2076 O LEU B 110 17.845 4.668 116.071 1.00 41.51 O ATOM 2077 CB LEU B 110 17.455 1.591 116.649 1.00 40.39 C ATOM 2078 CG LEU B 110 18.469 0.563 117.149 1.00 40.61 C ATOM 2079 CD1 LEU B 110 18.335 -0.722 116.357 1.00 42.29 C ATOM 2080 CD2 LEU B 110 19.888 1.116 117.043 1.00 40.14 C ATOM 2081 H LEU B 110 15.587 1.829 118.401 1.00 0.00 H ATOM 2082 N GLY B 111 15.668 4.366 116.549 1.00 38.01 N ATOM 2083 CA GLY B 111 15.212 5.431 115.677 1.00 37.77 C ATOM 2084 C GLY B 111 15.692 6.799 116.114 1.00 36.84 C ATOM 2085 O GLY B 111 15.749 7.724 115.307 1.00 38.52 O ATOM 2086 H GLY B 111 14.972 3.845 117.120 1.00 0.00 H ATOM 2087 N THR B 112 16.038 6.931 117.390 1.00 34.67 N ATOM 2088 CA THR B 112 16.539 8.196 117.910 1.00 34.72 C ATOM 2089 C THR B 112 17.956 8.051 118.452 1.00 35.97 C ATOM 2090 O THR B 112 18.402 8.866 119.262 1.00 36.26 O ATOM 2091 CB THR B 112 15.637 8.758 119.024 1.00 32.11 C ATOM 2092 OG1 THR B 112 15.513 7.797 120.080 1.00 30.56 O ATOM 2093 CG2 THR B 112 14.264 9.105 118.474 1.00 31.99 C ATOM 2094 HG1 THR B 112 16.409 7.600 120.452 1.00 0.00 H ATOM 2095 H THR B 112 15.949 6.116 118.030 1.00 0.00 H ATOM 2096 N TYR B 113 18.653 7.004 118.024 1.00 36.29 N ATOM 2097 CA TYR B 113 20.041 6.832 118.421 1.00 36.57 C ATOM 2098 C TYR B 113 20.873 7.977 117.848 1.00 38.44 C ATOM 2099 O TYR B 113 20.861 8.219 116.638 1.00 40.55 O ATOM 2100 CB TYR B 113 20.590 5.477 117.959 1.00 36.23 C ATOM 2101 CG TYR B 113 21.994 5.203 118.455 1.00 36.00 C ATOM 2102 CD1 TYR B 113 23.099 5.784 117.838 1.00 37.41 C ATOM 2103 CD2 TYR B 113 22.215 4.372 119.545 1.00 34.78 C ATOM 2104 CE1 TYR B 113 24.378 5.546 118.295 1.00 37.90 C ATOM 2105 CE2 TYR B 113 23.494 4.123 120.007 1.00 34.91 C ATOM 2106 CZ TYR B 113 24.572 4.717 119.379 1.00 36.90 C ATOM 2107 OH TYR B 113 25.849 4.482 119.831 1.00 37.49 O ATOM 2108 HH TYR B 113 25.925 4.782 120.771 1.00 0.00 H ATOM 2109 H TYR B 113 18.203 6.303 117.401 1.00 0.00 H ATOM 2110 N ASN B 114 21.585 8.682 118.723 1.00 37.44 N ATOM 2111 CA ASN B 114 22.408 9.818 118.315 1.00 38.51 C ATOM 2112 C ASN B 114 23.906 9.579 118.533 1.00 39.03 C ATOM 2113 O ASN B 114 24.366 9.445 119.670 1.00 37.75 O ATOM 2114 CB ASN B 114 21.975 11.082 119.053 1.00 38.18 C ATOM 2115 CG ASN B 114 22.450 12.341 118.366 1.00 40.87 C ATOM 2116 OD1 ASN B 114 23.262 12.287 117.442 1.00 43.17 O ATOM 2117 ND2 ASN B 114 21.945 13.485 118.809 1.00 41.31 N ATOM 2118 HD22 ASN B 114 21.261 13.483 119.593 1.00 0.00 H ATOM 2119 HD21 ASN B 114 22.233 14.384 118.373 1.00 0.00 H ATOM 2120 H ASN B 114 21.555 8.416 119.728 1.00 0.00 H ATOM 2121 N LYS B 115 24.656 9.578 117.449 1.00 40.53 N ATOM 2122 CA LYS B 115 26.051 9.224 117.482 1.00 40.68 C ATOM 2123 C LYS B 115 26.875 10.250 118.167 1.00 42.07 C ATOM 2124 O LYS B 115 27.994 10.019 118.466 1.00 42.15 O ATOM 2125 CB LYS B 115 26.568 8.928 116.092 1.00 41.02 C ATOM 2126 H LYS B 115 24.226 9.842 116.540 1.00 0.00 H ATOM 2127 N LYS B 116 26.282 11.374 118.466 1.00 43.89 N ATOM 2128 CA LYS B 116 26.989 12.428 119.160 1.00 44.95 C ATOM 2129 C LYS B 116 27.118 12.152 120.646 1.00 42.13 C ATOM 2130 O LYS B 116 27.905 12.756 121.326 1.00 41.04 O ATOM 2131 CB LYS B 116 26.350 13.782 118.866 1.00 47.45 C ATOM 2132 CG LYS B 116 25.279 14.271 119.819 1.00 47.48 C ATOM 2133 CD LYS B 116 24.452 15.344 119.135 1.00 49.85 C ATOM 2134 CE LYS B 116 23.596 16.150 120.086 1.00 50.28 C ATOM 2135 NZ LYS B 116 22.510 16.884 119.373 1.00 51.70 N ATOM 2136 HZ1 LYS B 116 22.931 17.536 118.681 1.00 0.00 H ATOM 2137 HZ2 LYS B 116 21.898 16.202 118.881 1.00 0.00 H ATOM 2138 HZ3 LYS B 116 21.948 17.423 120.062 1.00 0.00 H ATOM 2139 H LYS B 116 25.286 11.514 118.201 1.00 0.00 H ATOM 2140 N TYR B 117 26.325 11.204 121.114 1.00 40.63 N ATOM 2141 CA TYR B 117 26.331 10.757 122.505 1.00 38.09 C ATOM 2142 C TYR B 117 27.145 9.479 122.654 1.00 35.82 C ATOM 2143 O TYR B 117 27.334 8.984 123.766 1.00 34.82 O ATOM 2144 CB TYR B 117 24.911 10.502 123.017 1.00 38.44 C ATOM 2145 CG TYR B 117 24.014 11.717 123.065 1.00 40.30 C ATOM 2146 CD1 TYR B 117 24.492 12.947 123.503 1.00 41.77 C ATOM 2147 CD2 TYR B 117 22.684 11.629 122.675 1.00 39.01 C ATOM 2148 CE1 TYR B 117 23.672 14.057 123.544 1.00 42.20 C ATOM 2149 CE2 TYR B 117 21.860 12.729 122.715 1.00 40.59 C ATOM 2150 CZ TYR B 117 22.354 13.938 123.151 1.00 42.66 C ATOM 2151 OH TYR B 117 21.519 15.031 123.190 1.00 44.63 O ATOM 2152 HH TYR B 117 22.021 15.817 123.523 1.00 0.00 H ATOM 2153 H TYR B 117 25.660 10.751 120.455 1.00 0.00 H ATOM 2154 N ARG B 118 27.613 8.948 121.528 1.00 35.74 N ATOM 2155 CA ARG B 118 28.315 7.665 121.505 1.00 35.75 C ATOM 2156 C ARG B 118 29.461 7.587 122.502 1.00 35.38 C ATOM 2157 O ARG B 118 29.509 6.680 123.328 1.00 35.53 O ATOM 2158 CB ARG B 118 28.848 7.379 120.105 1.00 36.96 C ATOM 2159 CG ARG B 118 29.452 6.007 119.943 1.00 36.87 C ATOM 2160 CD ARG B 118 29.641 5.687 118.481 1.00 38.31 C ATOM 2161 NE ARG B 118 28.439 5.118 117.886 1.00 37.53 N ATOM 2162 CZ ARG B 118 28.374 4.684 116.633 1.00 38.57 C ATOM 2163 NH1 ARG B 118 29.447 4.762 115.852 1.00 39.43 N ATOM 2164 NH2 ARG B 118 27.244 4.170 116.161 1.00 37.79 N ATOM 2165 HE ARG B 118 27.585 5.048 118.475 1.00 0.00 H ATOM 2166 HH12 ARG B 118 29.401 4.423 114.870 1.00 0.00 H ATOM 2167 HH11 ARG B 118 30.332 5.162 116.223 1.00 0.00 H ATOM 2168 HH22 ARG B 118 27.197 3.831 115.179 1.00 0.00 H ATOM 2169 HH21 ARG B 118 26.406 4.106 116.774 1.00 0.00 H ATOM 2170 H ARG B 118 27.475 9.462 120.634 1.00 0.00 H ATOM 2171 N TYR B 119 30.380 8.541 122.431 1.00 35.74 N ATOM 2172 CA TYR B 119 31.491 8.573 123.374 1.00 35.92 C ATOM 2173 C TYR B 119 31.370 9.779 124.291 1.00 36.48 C ATOM 2174 O TYR B 119 32.223 10.663 124.302 1.00 38.44 O ATOM 2175 CB TYR B 119 32.819 8.591 122.630 1.00 36.42 C ATOM 2176 CG TYR B 119 32.872 7.626 121.472 1.00 37.11 C ATOM 2177 CD1 TYR B 119 33.103 6.274 121.681 1.00 37.36 C ATOM 2178 CD2 TYR B 119 32.700 8.067 120.168 1.00 38.65 C ATOM 2179 CE1 TYR B 119 33.161 5.385 120.622 1.00 38.64 C ATOM 2180 CE2 TYR B 119 32.757 7.188 119.101 1.00 40.35 C ATOM 2181 CZ TYR B 119 32.988 5.846 119.335 1.00 40.15 C ATOM 2182 OH TYR B 119 33.044 4.961 118.282 1.00 41.21 O ATOM 2183 HH TYR B 119 33.216 4.049 118.627 1.00 0.00 H ATOM 2184 H TYR B 119 30.307 9.273 121.696 1.00 0.00 H ATOM 2185 N HIS B 120 30.294 9.791 125.065 1.00 35.20 N ATOM 2186 CA HIS B 120 29.920 10.937 125.877 1.00 34.75 C ATOM 2187 C HIS B 120 30.867 11.135 127.052 1.00 35.89 C ATOM 2188 O HIS B 120 31.324 10.171 127.668 1.00 35.95 O ATOM 2189 CB HIS B 120 28.486 10.762 126.384 1.00 30.84 C ATOM 2190 CG HIS B 120 27.913 11.983 127.031 1.00 30.99 C ATOM 2191 ND1 HIS B 120 27.534 13.100 126.316 1.00 31.41 N ATOM 2192 CD2 HIS B 120 27.624 12.251 128.327 1.00 31.16 C ATOM 2193 CE1 HIS B 120 27.057 14.009 127.147 1.00 31.44 C ATOM 2194 NE2 HIS B 120 27.095 13.518 128.372 1.00 30.67 N ATOM 2195 H HIS B 120 29.691 8.944 125.092 1.00 0.00 H ATOM 2196 N LEU B 121 31.151 12.372 127.373 1.00 36.50 N ATOM 2197 CA LEU B 121 31.902 12.663 128.550 1.00 36.90 C ATOM 2198 C LEU B 121 31.015 12.725 129.717 1.00 31.52 C ATOM 2199 O LEU B 121 30.443 13.710 129.974 1.00 32.01 O ATOM 2200 CB LEU B 121 32.640 13.978 128.427 1.00 37.20 C ATOM 2201 CG LEU B 121 33.558 13.947 127.247 1.00 37.47 C ATOM 2202 CD1 LEU B 121 34.084 15.325 126.977 1.00 39.70 C ATOM 2203 CD2 LEU B 121 34.642 12.934 127.492 1.00 36.16 C ATOM 2204 H LEU B 121 30.826 13.150 126.764 1.00 0.00 H ATOM 2205 N LYS B 122 30.974 11.647 130.454 1.00 30.53 N ATOM 2206 CA LYS B 122 30.095 11.477 131.571 1.00 32.04 C ATOM 2207 C LYS B 122 30.358 12.273 132.821 1.00 33.11 C ATOM 2208 O LYS B 122 29.436 12.575 133.485 1.00 33.54 O ATOM 2209 CB LYS B 122 29.977 10.014 131.895 1.00 30.76 C ATOM 2210 CG LYS B 122 29.819 9.183 130.665 1.00 30.08 C ATOM 2211 CD LYS B 122 29.583 7.742 131.003 1.00 29.19 C ATOM 2212 CE LYS B 122 28.964 7.001 129.859 1.00 28.74 C ATOM 2213 NZ LYS B 122 27.611 6.543 130.188 1.00 27.31 N ATOM 2214 HZ1 LYS B 122 27.652 5.907 131.010 1.00 0.00 H ATOM 2215 HZ2 LYS B 122 27.013 7.364 130.412 1.00 0.00 H ATOM 2216 HZ3 LYS B 122 27.211 6.034 129.374 1.00 0.00 H ATOM 2217 H LYS B 122 31.618 10.866 130.215 1.00 0.00 H ATOM 2218 N PRO B 123 31.584 12.629 133.157 1.00 33.50 N ATOM 2219 CA PRO B 123 31.727 13.467 134.357 1.00 34.30 C ATOM 2220 C PRO B 123 30.961 14.796 134.307 1.00 36.94 C ATOM 2221 O PRO B 123 30.619 15.339 135.357 1.00 38.29 O ATOM 2222 CB PRO B 123 33.237 13.721 134.420 1.00 34.58 C ATOM 2223 CG PRO B 123 33.833 12.512 133.803 1.00 33.53 C ATOM 2224 CD PRO B 123 32.899 12.163 132.673 1.00 33.60 C ATOM 2225 N PHE B 125 30.677 15.299 133.111 1.00 37.59 N ATOM 2226 CA PHE B 125 29.968 16.568 132.973 1.00 39.16 C ATOM 2227 C PHE B 125 28.455 16.376 132.905 1.00 41.25 C ATOM 2228 O PHE B 125 27.711 17.311 132.600 1.00 42.60 O ATOM 2229 CB PHE B 125 30.467 17.317 131.739 1.00 38.96 C ATOM 2230 CG PHE B 125 31.939 17.614 131.777 1.00 38.84 C ATOM 2231 CD1 PHE B 125 32.414 18.728 132.448 1.00 39.74 C ATOM 2232 CD2 PHE B 125 32.846 16.767 131.161 1.00 38.02 C ATOM 2233 CE1 PHE B 125 33.765 19.001 132.496 1.00 41.48 C ATOM 2234 CE2 PHE B 125 34.202 17.033 131.205 1.00 39.57 C ATOM 2235 CZ PHE B 125 34.664 18.150 131.876 1.00 41.25 C ATOM 2236 H PHE B 125 30.965 14.780 132.257 1.00 0.00 H ATOM 2237 N CYS B 126 28.008 15.155 133.177 1.00 40.67 N ATOM 2238 CA CYS B 126 26.585 14.865 133.251 1.00 39.93 C ATOM 2239 C CYS B 126 25.979 15.418 134.535 1.00 41.16 C ATOM 2240 O CYS B 126 26.619 15.413 135.587 1.00 41.82 O ATOM 2241 CB CYS B 126 26.336 13.357 133.169 1.00 38.35 C ATOM 2242 SG CYS B 126 26.646 12.636 131.546 1.00 38.17 S ATOM 2243 H CYS B 126 28.692 14.389 133.341 1.00 0.00 H ATOM 2244 N LYS B 127 24.741 15.892 134.439 1.00 41.27 N ATOM 2245 CA LYS B 127 24.001 16.349 135.606 1.00 41.41 C ATOM 2246 C LYS B 127 23.523 15.135 136.394 1.00 40.29 C ATOM 2247 O LYS B 127 23.323 14.060 135.827 1.00 39.03 O ATOM 2248 CB LYS B 127 22.822 17.234 135.201 1.00 41.75 C ATOM 2249 H LYS B 127 24.288 15.938 133.504 1.00 0.00 H ATOM 2250 N LYS B 129 23.364 15.303 137.702 1.00 41.10 N ATOM 2251 CA LYS B 129 23.048 14.183 138.576 1.00 41.45 C ATOM 2252 C LYS B 129 21.706 13.555 138.211 1.00 42.62 C ATOM 2253 O LYS B 129 20.783 14.238 137.766 1.00 42.83 O ATOM 2254 CB LYS B 129 23.037 14.633 140.038 1.00 42.18 C ATOM 2255 H LYS B 129 23.467 16.254 138.110 1.00 0.00 H ATOM 2256 N ALA B 130 21.610 12.257 138.389 1.00 43.36 N ATOM 2257 CA ALA B 130 20.389 11.541 138.128 1.00 43.36 C ATOM 2258 C ALA B 130 19.409 11.640 139.293 1.00 45.71 C ATOM 2259 O ALA B 130 19.803 11.780 140.406 1.00 46.37 O ATOM 2260 CB ALA B 130 20.713 10.100 137.848 1.00 41.15 C ATOM 2261 H ALA B 130 22.441 11.731 138.729 1.00 0.00 H ATOM 2262 N ASP B 131 18.125 11.537 139.011 1.00 47.23 N ATOM 2263 CA ASP B 131 17.147 11.395 140.058 1.00 49.90 C ATOM 2264 C ASP B 131 17.324 10.050 140.730 1.00 50.19 C ATOM 2265 O ASP B 131 17.697 9.095 140.111 1.00 48.28 O ATOM 2266 CB ASP B 131 15.737 11.518 139.508 1.00 51.18 C ATOM 2267 CG ASP B 131 15.426 12.896 139.039 1.00 53.91 C ATOM 2268 OD1 ASP B 131 15.956 13.845 139.610 1.00 56.39 O ATOM 2269 OD2 ASP B 131 14.663 13.051 138.090 1.00 53.81 O ATOM 2270 H ASP B 131 17.815 11.559 138.019 1.00 0.00 H ATOM 2271 N PRO B 132 17.011 10.030 142.094 1.00 52.26 N ATOM 2272 CA PRO B 132 17.097 8.698 142.707 1.00 51.83 C ATOM 2273 C PRO B 132 16.209 7.672 142.025 1.00 50.12 C ATOM 2274 O PRO B 132 15.249 8.003 141.376 1.00 50.17 O ATOM 2275 CB PRO B 132 16.591 8.931 144.128 1.00 53.73 C ATOM 2276 CG PRO B 132 15.689 10.096 144.016 1.00 54.36 C ATOM 2277 CD PRO B 132 16.543 10.982 143.216 1.00 53.67 C ATOM 2278 N CYS B 133 16.541 6.414 142.198 1.00 48.55 N ATOM 2279 CA CYS B 133 15.861 5.372 141.475 1.00 47.31 C ATOM 2280 C CYS B 133 14.467 5.148 142.045 1.00 47.33 C ATOM 2281 O CYS B 133 14.400 5.215 143.309 1.00 48.69 O ATOM 2282 CB CYS B 133 16.722 4.088 141.450 1.00 46.47 C ATOM 2283 SG CYS B 133 17.695 3.831 139.966 1.00 39.07 S ATOM 2284 OXT CYS B 133 13.498 4.944 141.248 1.00 45.84 O ATOM 2285 H CYS B 133 17.302 6.168 142.863 1.00 0.00 H TER 2286 CYS B 133 HETATM 2287 O HOH 1 44.111 16.929 142.022 1.00 30.75 O HETATM 2288 O HOH 2 57.981 18.539 106.368 1.00 43.83 O HETATM 2289 O HOH 3 45.466 -10.741 125.875 1.00 41.73 O HETATM 2290 O HOH 4 42.690 17.616 132.434 1.00 41.41 O HETATM 2291 O HOH 5 49.495 -3.926 120.686 1.00 26.91 O HETATM 2292 O HOH 6 51.980 24.195 116.142 1.00 25.43 O HETATM 2293 O HOH 7 58.079 20.539 111.496 1.00 45.73 O HETATM 2294 O HOH 8 54.880 16.777 130.135 1.00 26.28 O HETATM 2295 O HOH 9 41.613 13.421 133.061 1.00 33.70 O HETATM 2296 O HOH 10 57.074 8.862 125.812 1.00 37.57 O HETATM 2297 O HOH 11 54.945 3.395 117.173 1.00 39.84 O HETATM 2298 O HOH 12 53.964 -3.046 132.516 1.00 30.94 O HETATM 2299 O HOH 13 53.910 18.080 122.422 1.00 17.44 O HETATM 2300 O HOH 14 48.844 4.423 120.354 1.00 28.24 O HETATM 2301 O HOH 15 43.262 7.722 129.713 1.00 22.60 O HETATM 2302 O HOH 16 60.797 9.769 122.238 1.00 26.18 O HETATM 2303 O HOH 17 54.237 2.927 126.944 1.00 22.19 O HETATM 2304 O HOH 18 54.808 0.800 120.358 1.00 21.86 O HETATM 2305 O HOH 19 55.175 22.088 128.675 1.00 27.91 O HETATM 2306 O HOH 20 44.717 13.700 141.779 1.00 38.77 O HETATM 2307 O HOH 21 39.273 7.701 135.294 1.00 36.77 O HETATM 2308 O HOH 22 52.094 8.741 130.242 1.00 20.32 O HETATM 2309 O HOH 23 58.529 12.448 120.828 1.00 27.23 O HETATM 2310 O HOH 24 54.034 7.660 115.555 1.00 34.65 O HETATM 2311 O HOH 25 46.979 26.165 120.094 1.00 36.03 O HETATM 2312 O HOH 26 44.769 8.063 139.161 1.00 36.43 O HETATM 2313 O HOH 27 45.144 23.959 120.960 1.00 39.56 O HETATM 2314 O HOH 28 50.250 19.839 142.060 1.00 34.23 O HETATM 2315 O HOH 29 57.863 5.707 117.897 1.00 33.33 O HETATM 2316 O HOH 30 44.748 29.045 135.588 1.00 45.73 O HETATM 2317 O HOH 31 57.343 19.388 129.000 1.00 40.10 O HETATM 2318 O HOH 32 32.997 11.002 118.040 1.00 42.78 O HETATM 2319 O HOH 33 50.244 -3.609 137.011 1.00 47.28 O HETATM 2320 O HOH 34 45.333 16.108 114.366 1.00 36.40 O HETATM 2321 O HOH 35 51.448 10.602 131.687 1.00 21.82 O HETATM 2322 O HOH 36 49.201 3.858 144.544 1.00 35.74 O HETATM 2323 O HOH 37 44.853 30.033 132.919 1.00 54.39 O HETATM 2324 O HOH 38 50.171 -8.191 127.740 1.00 47.78 O HETATM 2325 O HOH 39 55.971 0.609 127.734 1.00 39.62 O HETATM 2326 O HOH 40 54.440 3.709 128.909 1.00 33.38 O HETATM 2327 O HOH 41 56.291 -4.253 131.976 1.00 19.87 O HETATM 2328 O HOH 42 38.356 26.891 125.867 1.00 57.25 O HETATM 2329 O HOH 43 35.657 26.053 125.650 1.00 53.01 O HETATM 2330 O HOH 44 57.377 -2.443 131.968 1.00 24.71 O HETATM 2331 O HOH 45 47.558 1.503 145.196 1.00 62.30 O HETATM 2332 O HOH 46 53.345 -5.196 133.752 1.00 40.19 O HETATM 2333 O HOH 47 41.130 10.775 133.124 1.00 45.78 O HETATM 2334 O HOH 48 57.690 1.328 129.544 1.00 16.85 O HETATM 2335 O HOH 49 56.233 3.137 131.107 1.00 26.74 O HETATM 2336 O HOH 50 32.843 8.388 112.573 1.00 50.60 O HETATM 2337 O HOH 51 56.521 -0.995 136.452 1.00 43.09 O HETATM 2338 O HOH 52 11.614 5.459 123.744 1.00 36.95 O HETATM 2339 O HOH 53 25.302 -8.802 133.785 1.00 41.10 O HETATM 2340 O HOH 54 14.679 -8.335 137.411 1.00 44.04 O HETATM 2341 O HOH 55 24.830 0.092 129.849 1.00 28.95 O HETATM 2342 O HOH 56 29.839 4.171 122.971 1.00 29.25 O HETATM 2343 O HOH 57 13.238 6.611 120.218 1.00 24.88 O HETATM 2344 O HOH 58 11.020 -11.478 130.251 1.00 34.13 O HETATM 2345 O HOH 59 17.549 7.763 121.709 1.00 24.19 O HETATM 2346 O HOH 60 11.078 1.474 124.235 1.00 33.80 O HETATM 2347 O HOH 61 12.961 3.155 116.872 1.00 25.37 O HETATM 2348 O HOH 62 26.374 -5.320 133.732 1.00 28.82 O HETATM 2349 O HOH 63 23.111 0.203 139.200 1.00 38.01 O HETATM 2350 O HOH 64 19.418 2.652 120.319 1.00 24.37 O HETATM 2351 O HOH 65 22.288 -20.818 125.758 1.00 43.42 O HETATM 2352 O HOH 66 13.654 -10.906 123.587 1.00 28.28 O HETATM 2353 O HOH 67 24.924 -22.206 129.656 1.00 51.10 O HETATM 2354 O HOH 68 13.307 -15.606 134.235 1.00 43.58 O HETATM 2355 O HOH 69 29.335 -10.315 124.213 1.00 36.97 O HETATM 2356 O HOH 70 13.284 -14.351 129.746 1.00 24.79 O HETATM 2357 O HOH 71 32.677 -6.057 139.989 1.00 29.97 O HETATM 2358 O HOH 72 13.640 4.702 126.887 1.00 20.13 O HETATM 2359 O HOH 73 34.320 -4.890 119.529 1.00 42.37 O HETATM 2360 O HOH 74 11.992 -17.365 131.527 1.00 31.13 O HETATM 2361 O HOH 75 10.153 1.203 117.807 1.00 26.72 O HETATM 2362 O HOH 76 20.561 18.310 127.718 1.00 33.97 O HETATM 2363 O HOH 77 13.703 3.624 129.497 1.00 33.73 O HETATM 2364 O HOH 78 12.353 -2.336 128.053 1.00 33.50 O HETATM 2365 O HOH 79 30.113 -15.563 130.711 1.00 37.51 O HETATM 2366 O HOH 80 14.344 0.281 137.258 1.00 34.26 O HETATM 2367 O HOH 81 33.176 1.283 125.506 1.00 45.80 O HETATM 2368 O HOH 82 17.472 -23.477 132.307 1.00 43.36 O HETATM 2369 O HOH 83 27.754 -12.098 143.969 1.00 49.52 O HETATM 2370 O HOH 84 13.278 -19.217 136.778 1.00 29.31 O HETATM 2371 O HOH 85 15.861 -1.380 130.744 1.00 35.31 O HETATM 2372 O HOH 86 26.260 -15.063 142.078 1.00 42.61 O HETATM 2373 O HOH 87 34.583 -4.627 138.510 1.00 43.11 O HETATM 2374 O HOH 88 32.515 6.919 115.200 1.00 42.44 O HETATM 2375 O HOH 89 11.379 6.539 128.002 1.00 42.03 O HETATM 2376 O HOH 90 13.053 -1.132 129.509 1.00 19.17 O HETATM 2377 O HOH 91 29.331 -9.244 121.621 1.00 43.23 O HETATM 2378 O HOH 92 11.006 3.950 126.657 1.00 14.50 O HETATM 2379 O HOH 93 21.935 -20.912 122.613 1.00 35.43 O HETATM 2380 O HOH 94 12.815 -2.327 136.056 1.00 46.48 O HETATM 2381 O HOH 95 13.621 -3.805 133.803 1.00 22.41 O HETATM 2382 O HOH 96 11.632 5.113 131.274 1.00 29.23 O HETATM 2383 O HOH 97 9.591 7.162 129.567 1.00 39.98 O HETATM 2384 C1 HCI A 98 35.135 1.961 113.235 1.00 0.05 C HETATM 2385 O1 HCI A 98 34.206 1.243 112.820 1.00 -0.56 O HETATM 2386 O2 HCI A 98 34.866 2.914 114.002 1.00 -0.56 O HETATM 2387 C2 HCI A 98 36.560 1.682 112.817 1.00 -0.03 C HETATM 2388 C3 HCI A 98 37.336 2.769 112.915 1.00 -0.05 C HETATM 2389 C1' HCI A 98 38.793 2.945 112.627 1.00 -0.02 C HETATM 2390 C2' HCI A 98 39.743 1.929 112.900 1.00 -0.05 C HETATM 2391 C3' HCI A 98 41.110 2.145 112.616 1.00 -0.06 C HETATM 2392 C4' HCI A 98 41.529 3.387 112.076 1.00 -0.06 C HETATM 2393 C5' HCI A 98 40.576 4.410 111.825 1.00 -0.06 C HETATM 2394 C6' HCI A 98 39.215 4.183 112.102 1.00 -0.05 C HETATM 2395 H7 HCI A 98 38.488 4.964 111.911 1.00 0.06 H HETATM 2396 H6 HCI A 98 40.896 5.364 111.421 1.00 0.06 H HETATM 2397 H5 HCI A 98 42.577 3.556 111.855 1.00 0.06 H HETATM 2398 H4 HCI A 98 41.836 1.364 112.810 1.00 0.06 H HETATM 2399 H3 HCI A 98 39.421 0.986 113.327 1.00 0.06 H HETATM 2400 H2 HCI A 98 36.825 3.667 113.259 1.00 0.07 H HETATM 2401 H1 HCI A 98 36.914 0.711 112.476 1.00 0.06 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 239 238 1108 CONECT 257 256 402 CONECT 395 394 883 CONECT 402 257 401 CONECT 455 454 1149 CONECT 462 461 825 CONECT 525 524 760 CONECT 714 713 808 CONECT 760 525 759 CONECT 808 714 807 CONECT 825 462 824 CONECT 883 395 882 CONECT 1108 239 1107 CONECT 1149 455 1148 CONECT 1153 1154 1160 1161 1162 CONECT 1160 1153 CONECT 1161 1153 CONECT 1162 1153 CONECT 1391 1390 2242 CONECT 1409 1408 1554 CONECT 1547 1546 2024 CONECT 1554 1409 1553 CONECT 1607 1606 2283 CONECT 1614 1613 1966 CONECT 1677 1676 1908 CONECT 1862 1861 1949 CONECT 1908 1677 1907 CONECT 1949 1862 1948 CONECT 1966 1614 1965 CONECT 2024 1547 2023 CONECT 2242 1391 2241 CONECT 2283 1607 2282 CONECT 2384 2385 2386 2387 CONECT 2385 2384 CONECT 2386 2384 CONECT 2387 2384 2388 2401 CONECT 2388 2387 2389 2400 CONECT 2389 2388 2390 2394 CONECT 2390 2389 2391 2399 CONECT 2391 2390 2392 2398 CONECT 2392 2391 2393 2397 CONECT 2393 2392 2394 2396 CONECT 2394 2389 2393 2395 CONECT 2395 2394 CONECT 2396 2393 CONECT 2397 2392 CONECT 2398 2391 CONECT 2399 2390 CONECT 2400 2388 CONECT 2401 2387 MASTER 0 0 0 0 0 0 0 0 2399 2 54 20 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 5vfn
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4yv5
RCSB PDB
PDBbind
122aa, >4YV5_1|Chains... *
5vfj
RCSB PDB
PDBbind
121aa, >5VFJ_1|Chains... at 95%
5vfm
RCSB PDB
PDBbind
121aa, >5VFM_1|Chains... at 95%
6dik
RCSB PDB
PDBbind
121aa, >6DIK_1|Chains... at 95%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1ahx
RCSB PDB
PDBbind
HCI
1tog
RCSB PDB
PDBbind
HCI
1toi
RCSB PDB
PDBbind
HCI
1toj
RCSB PDB
PDBbind
HCI
Entry Information
PDB ID
5vfn
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Basic phospholipase A2 homolog BnSP-7
Ligand Name
HCI
EC.Number
E.C.-.-.-.-
Resolution
2.39(Å)
Affinity (Kd/Ki/IC50)
Kd=300uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Biochimie Vol. 142: pp. 11-21
Ligand Properties
Formula
C
9
H
8
O
2
Molecular Weight
148.159
Exact Mass
148.052
No. of atoms
19
No. of bonds
19
Polar Surface Area
37.3
LOGP Value
3.18 (
Computed with XLOGP3
)
1.78 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 1
Canonical SMILES
OC(=O)/C=C/c1ccccc1
InChI String
InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9IAT9
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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