Browse entries in the PDBbind-CN Database
HEADER 1CEA_COMPLEX COMPND 1CEA_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 80 GLU CYS LYS THR GLY ASN GLY LYS ASN TYR ARG GLY THR SEQRES 2 A 80 MET SER LYS THR LYS ASN GLY ILE THR CYS GLN LYS TRP SEQRES 3 A 80 SER SER THR SER PRO HIS ARG PRO ARG PHE SER PRO ALA SEQRES 4 A 80 THR HIS PRO SER GLU GLY LEU GLU GLU ASN TYR CYS ARG SEQRES 5 A 80 ASN PRO ASP ASN ASP PRO GLN GLY PRO TRP CYS TYR THR SEQRES 6 A 80 THR ASP PRO GLU LYS ARG TYR ASP TYR CYS ASP ILE LEU SEQRES 7 A 80 GLU CYS SEQRES 1 B 80 GLU CYS LYS THR GLY ASN GLY LYS ASN TYR ARG GLY THR SEQRES 2 B 80 MET SER LYS THR LYS ASN GLY ILE THR CYS GLN LYS TRP SEQRES 3 B 80 SER SER THR SER PRO HIS ARG PRO ARG PHE SER PRO ALA SEQRES 4 B 80 THR HIS PRO SER GLU GLY LEU GLU GLU ASN TYR CYS ARG SEQRES 5 B 80 ASN PRO ASP ASN ASP PRO GLN GLY PRO TRP CYS TYR THR SEQRES 6 B 80 THR ASP PRO GLU LYS ARG TYR ASP TYR CYS ASP ILE LEU SEQRES 7 B 80 GLU CYS HET ACA A 309 22 SSBOND 1 CYS A 22 CYS A 62 SSBOND 2 CYS A 50 CYS A 74 SSBOND 3 CYS A 1 CYS A 79 SSBOND 4 CYS B 22 CYS B 62 SSBOND 5 CYS B 50 CYS B 74 SSBOND 6 CYS B 1 CYS B 79 ATOM 1 N GLU A 1A 16.316 -2.836 -19.156 1.00 35.97 N ATOM 2 CA GLU A 1A 15.699 -2.272 -20.362 1.00 35.84 C ATOM 3 C GLU A 1A 16.105 -3.122 -21.577 1.00 35.22 C ATOM 4 O GLU A 1A 17.324 -3.284 -21.828 1.00 37.28 O ATOM 5 CB GLU A 1A 16.160 -0.927 -20.835 1.00 37.35 C ATOM 6 CG GLU A 1A 15.687 0.474 -20.657 1.00 37.98 C ATOM 7 CD GLU A 1A 14.179 0.457 -20.725 1.00 41.37 C ATOM 8 OE1 GLU A 1A 13.611 0.167 -19.687 1.00 41.21 O ATOM 9 OE2 GLU A 1A 13.711 0.709 -21.855 1.00 42.37 O ATOM 10 HA GLU A 1A 14.652 -2.230 -20.062 1.00 0.00 H ATOM 11 HB2 GLU A 1A 17.186 -0.882 -20.470 1.00 0.00 H ATOM 12 HB3 GLU A 1A 16.166 -1.043 -21.919 1.00 0.00 H ATOM 13 HG2 GLU A 1A 16.012 0.856 -19.689 1.00 0.00 H ATOM 14 HG3 GLU A 1A 16.088 1.106 -21.449 1.00 0.00 H ATOM 15 HN3 GLU A 1A 17.331 -2.827 -19.259 1.00 0.00 H ATOM 16 HN2 GLU A 1A 15.994 -3.795 -19.028 1.00 0.00 H ATOM 17 HN1 GLU A 1A 16.050 -2.276 -18.346 1.00 0.00 H ATOM 18 N CYS A 1 15.205 -3.292 -22.507 1.00 33.09 N ATOM 19 CA CYS A 1 15.570 -4.059 -23.709 1.00 30.64 C ATOM 20 C CYS A 1 16.030 -3.104 -24.806 1.00 28.74 C ATOM 21 O CYS A 1 16.034 -1.880 -24.795 1.00 27.67 O ATOM 22 CB CYS A 1 14.325 -4.858 -23.962 1.00 29.52 C ATOM 23 SG CYS A 1 12.916 -3.781 -24.012 1.00 29.06 S ATOM 24 HA CYS A 1 16.422 -4.734 -23.631 1.00 0.00 H ATOM 25 HB2 CYS A 1 14.195 -5.587 -23.163 1.00 0.00 H ATOM 26 HB3 CYS A 1 14.417 -5.378 -24.915 1.00 0.00 H ATOM 27 H CYS A 1 14.268 -2.902 -22.403 1.00 0.00 H ATOM 28 N LYS A 2 16.499 -3.695 -25.862 1.00 28.13 N ATOM 29 CA LYS A 2 17.101 -3.248 -27.091 1.00 27.00 C ATOM 30 C LYS A 2 16.332 -3.516 -28.369 1.00 26.55 C ATOM 31 O LYS A 2 16.174 -4.758 -28.555 1.00 27.16 O ATOM 32 CB LYS A 2 18.278 -4.269 -27.350 1.00 24.78 C ATOM 33 CG LYS A 2 19.476 -3.665 -28.060 1.00 26.10 C ATOM 34 CD LYS A 2 20.305 -4.671 -28.844 1.00 25.54 C ATOM 35 CE LYS A 2 19.519 -5.385 -29.886 1.00 26.41 C ATOM 36 NZ LYS A 2 20.081 -6.686 -30.387 1.00 28.42 N ATOM 37 HA LYS A 2 17.271 -2.181 -26.946 1.00 0.00 H ATOM 38 HB2 LYS A 2 18.611 -4.660 -26.388 1.00 0.00 H ATOM 39 HB3 LYS A 2 17.894 -5.087 -27.960 1.00 0.00 H ATOM 40 HG2 LYS A 2 19.116 -2.904 -28.752 1.00 0.00 H ATOM 41 HG3 LYS A 2 20.119 -3.200 -27.313 1.00 0.00 H ATOM 42 HD2 LYS A 2 21.126 -4.143 -29.329 1.00 0.00 H ATOM 43 HD3 LYS A 2 20.709 -5.406 -28.148 1.00 0.00 H ATOM 44 HE2 LYS A 2 19.421 -4.717 -30.741 1.00 0.00 H ATOM 45 HE3 LYS A 2 18.532 -5.590 -29.472 1.00 0.00 H ATOM 46 HZ1 LYS A 2 21.000 -6.522 -30.798 1.00 0.00 H ATOM 47 HZ2 LYS A 2 20.167 -7.340 -29.609 1.00 0.00 H ATOM 48 HZ3 LYS A 2 19.456 -7.076 -31.093 1.00 0.00 H ATOM 49 H LYS A 2 16.424 -4.711 -25.809 1.00 0.00 H ATOM 50 N THR A 3 16.112 -2.575 -29.269 1.00 25.43 N ATOM 51 CA THR A 3 15.537 -3.071 -30.547 1.00 26.18 C ATOM 52 C THR A 3 16.523 -2.743 -31.684 1.00 25.33 C ATOM 53 O THR A 3 17.207 -1.731 -31.630 1.00 24.03 O ATOM 54 CB THR A 3 14.058 -2.627 -30.844 1.00 26.46 C ATOM 55 OG1 THR A 3 13.646 -3.609 -31.885 1.00 29.97 O ATOM 56 CG2 THR A 3 14.076 -1.186 -31.286 1.00 27.36 C ATOM 57 HA THR A 3 15.424 -4.152 -30.459 1.00 0.00 H ATOM 58 HB THR A 3 13.356 -2.642 -30.010 1.00 0.00 H ATOM 59 HG1 THR A 3 12.740 -3.432 -32.149 1.00 0.00 H ATOM 60 HG23 THR A 3 14.389 -0.556 -30.454 1.00 0.00 H ATOM 61 HG21 THR A 3 14.775 -1.070 -32.114 1.00 0.00 H ATOM 62 HG22 THR A 3 13.077 -0.894 -31.609 1.00 0.00 H ATOM 63 H THR A 3 16.319 -1.590 -29.101 1.00 0.00 H ATOM 64 N GLY A 4 16.671 -3.686 -32.605 1.00 26.37 N ATOM 65 CA GLY A 4 17.566 -3.646 -33.775 1.00 26.26 C ATOM 66 C GLY A 4 19.017 -3.777 -33.296 1.00 26.62 C ATOM 67 O GLY A 4 19.338 -4.791 -32.663 1.00 27.68 O ATOM 68 HA3 GLY A 4 17.438 -2.700 -34.301 1.00 0.00 H ATOM 69 HA2 GLY A 4 17.327 -4.470 -34.447 1.00 0.00 H ATOM 70 H GLY A 4 16.106 -4.527 -32.491 1.00 0.00 H ATOM 71 N ASN A 5 19.797 -2.763 -33.519 1.00 25.66 N ATOM 72 CA ASN A 5 21.193 -2.555 -33.153 1.00 25.52 C ATOM 73 C ASN A 5 21.386 -1.733 -31.868 1.00 24.72 C ATOM 74 O ASN A 5 22.501 -1.510 -31.361 1.00 25.13 O ATOM 75 CB ASN A 5 21.883 -2.027 -34.448 1.00 27.78 C ATOM 76 CG ASN A 5 21.708 -0.519 -34.477 1.00 30.29 C ATOM 77 OD1 ASN A 5 22.697 0.228 -34.546 1.00 30.04 O ATOM 78 ND2 ASN A 5 20.456 -0.015 -34.398 1.00 30.35 N ATOM 79 HA ASN A 5 21.685 -3.477 -32.843 1.00 0.00 H ATOM 80 HB2 ASN A 5 22.943 -2.279 -34.434 1.00 0.00 H ATOM 81 HB3 ASN A 5 21.417 -2.473 -35.327 1.00 0.00 H ATOM 82 HD22 ASN A 5 19.655 -0.645 -34.342 1.00 0.00 H ATOM 83 HD21 ASN A 5 20.312 0.995 -34.394 1.00 0.00 H ATOM 84 H ASN A 5 19.366 -1.992 -34.030 1.00 0.00 H ATOM 85 N GLY A 6 20.325 -1.349 -31.169 1.00 23.83 N ATOM 86 CA GLY A 6 20.186 -0.633 -29.938 1.00 21.70 C ATOM 87 C GLY A 6 20.491 0.815 -29.818 1.00 21.13 C ATOM 88 O GLY A 6 21.148 1.244 -28.874 1.00 20.28 O ATOM 89 HA3 GLY A 6 20.830 -1.139 -29.219 1.00 0.00 H ATOM 90 HA2 GLY A 6 19.145 -0.749 -29.636 1.00 0.00 H ATOM 91 H GLY A 6 19.436 -1.616 -31.592 1.00 0.00 H ATOM 92 N LYS A 7 20.455 1.537 -30.934 1.00 21.02 N ATOM 93 CA LYS A 7 20.707 2.980 -31.079 1.00 20.44 C ATOM 94 C LYS A 7 20.059 3.896 -30.046 1.00 17.85 C ATOM 95 O LYS A 7 20.572 4.962 -29.613 1.00 18.62 O ATOM 96 CB LYS A 7 20.185 3.245 -32.510 1.00 20.63 C ATOM 97 CG LYS A 7 20.121 4.595 -33.099 1.00 22.14 C ATOM 98 CD LYS A 7 21.509 5.243 -32.943 1.00 24.22 C ATOM 99 CE LYS A 7 21.527 6.667 -33.499 1.00 23.26 C ATOM 100 NZ LYS A 7 22.855 7.196 -33.216 1.00 23.53 N ATOM 101 HA LYS A 7 21.758 3.214 -30.910 1.00 0.00 H ATOM 102 HB2 LYS A 7 20.816 2.655 -33.175 1.00 0.00 H ATOM 103 HB3 LYS A 7 19.167 2.856 -32.537 1.00 0.00 H ATOM 104 HG2 LYS A 7 19.860 4.527 -34.155 1.00 0.00 H ATOM 105 HG3 LYS A 7 19.372 5.192 -32.578 1.00 0.00 H ATOM 106 HD2 LYS A 7 21.770 5.272 -31.885 1.00 0.00 H ATOM 107 HD3 LYS A 7 22.243 4.643 -33.481 1.00 0.00 H ATOM 108 HE2 LYS A 7 20.766 7.274 -33.009 1.00 0.00 H ATOM 109 HE3 LYS A 7 21.345 6.656 -34.574 1.00 0.00 H ATOM 110 HZ1 LYS A 7 23.013 7.193 -32.208 1.00 0.00 H ATOM 111 HZ2 LYS A 7 23.556 6.614 -33.674 1.00 0.00 H ATOM 112 HZ3 LYS A 7 22.922 8.151 -33.569 1.00 0.00 H ATOM 113 H LYS A 7 20.226 1.032 -31.790 1.00 0.00 H ATOM 114 N ASN A 8 18.825 3.630 -29.741 1.00 16.18 N ATOM 115 CA ASN A 8 17.987 4.363 -28.822 1.00 15.95 C ATOM 116 C ASN A 8 17.977 3.799 -27.392 1.00 14.88 C ATOM 117 O ASN A 8 17.076 4.166 -26.571 1.00 13.19 O ATOM 118 CB ASN A 8 16.620 4.571 -29.480 1.00 18.48 C ATOM 119 CG ASN A 8 16.742 5.493 -30.700 1.00 19.55 C ATOM 120 OD1 ASN A 8 15.809 5.605 -31.511 1.00 24.08 O ATOM 121 ND2 ASN A 8 17.643 6.436 -30.783 1.00 25.47 N ATOM 122 HA ASN A 8 18.413 5.350 -28.640 1.00 0.00 H ATOM 123 HB2 ASN A 8 16.225 3.606 -29.798 1.00 0.00 H ATOM 124 HB3 ASN A 8 15.939 5.021 -28.757 1.00 0.00 H ATOM 125 HD22 ASN A 8 18.448 6.429 -30.157 1.00 0.00 H ATOM 126 HD21 ASN A 8 17.541 7.179 -31.474 1.00 0.00 H ATOM 127 H ASN A 8 18.405 2.820 -30.197 1.00 0.00 H ATOM 128 N TYR A 9 18.839 2.824 -27.167 1.00 15.45 N ATOM 129 CA TYR A 9 18.976 2.113 -25.875 1.00 17.19 C ATOM 130 C TYR A 9 19.419 3.050 -24.772 1.00 17.14 C ATOM 131 O TYR A 9 20.382 3.839 -24.817 1.00 17.66 O ATOM 132 CB TYR A 9 19.915 0.880 -26.023 1.00 16.73 C ATOM 133 CG TYR A 9 20.138 0.215 -24.679 1.00 13.83 C ATOM 134 CD1 TYR A 9 19.157 -0.562 -24.112 1.00 14.26 C ATOM 135 CD2 TYR A 9 21.324 0.438 -23.999 1.00 15.64 C ATOM 136 CE1 TYR A 9 19.359 -1.205 -22.872 1.00 15.86 C ATOM 137 CE2 TYR A 9 21.524 -0.080 -22.699 1.00 14.45 C ATOM 138 CZ TYR A 9 20.433 -0.788 -22.118 1.00 12.37 C ATOM 139 OH TYR A 9 20.756 -1.420 -20.970 1.00 11.80 O ATOM 140 HA TYR A 9 17.995 1.738 -25.584 1.00 0.00 H ATOM 141 HB3 TYR A 9 20.874 1.206 -26.425 1.00 0.00 H ATOM 142 HB2 TYR A 9 19.460 0.163 -26.707 1.00 0.00 H ATOM 143 HD2 TYR A 9 22.114 1.021 -24.473 1.00 0.00 H ATOM 144 HE2 TYR A 9 22.466 0.056 -22.168 1.00 0.00 H ATOM 145 HE1 TYR A 9 18.694 -1.997 -22.526 1.00 0.00 H ATOM 146 HD1 TYR A 9 18.205 -0.684 -24.629 1.00 0.00 H ATOM 147 HH TYR A 9 19.983 -1.876 -20.629 1.00 0.00 H ATOM 148 H TYR A 9 19.450 2.542 -27.933 1.00 0.00 H ATOM 149 N ARG A 10 18.639 3.056 -23.695 1.00 17.99 N ATOM 150 CA ARG A 10 18.884 3.952 -22.536 1.00 16.55 C ATOM 151 C ARG A 10 18.553 3.181 -21.216 1.00 16.14 C ATOM 152 O ARG A 10 18.152 3.837 -20.262 1.00 13.99 O ATOM 153 CB ARG A 10 18.182 5.280 -22.516 1.00 16.84 C ATOM 154 CG ARG A 10 18.082 6.056 -23.826 1.00 20.81 C ATOM 155 CD ARG A 10 19.511 6.268 -24.234 1.00 24.95 C ATOM 156 NE ARG A 10 19.695 6.855 -25.527 1.00 26.46 N ATOM 157 CZ ARG A 10 20.064 6.699 -26.751 1.00 23.03 C ATOM 158 NH1 ARG A 10 20.502 5.552 -27.284 1.00 22.12 N ATOM 159 NH2 ARG A 10 20.218 7.872 -27.424 1.00 22.72 N ATOM 160 HA ARG A 10 19.937 4.217 -22.632 1.00 0.00 H ATOM 161 HB2 ARG A 10 17.165 5.105 -22.164 1.00 0.00 H ATOM 162 HB3 ARG A 10 18.708 5.914 -21.802 1.00 0.00 H ATOM 163 HG2 ARG A 10 17.546 5.478 -24.579 1.00 0.00 H ATOM 164 HG3 ARG A 10 17.577 7.010 -23.674 1.00 0.00 H ATOM 165 HD2 ARG A 10 20.011 5.299 -24.229 1.00 0.00 H ATOM 166 HD3 ARG A 10 19.979 6.921 -23.497 1.00 0.00 H ATOM 167 HE ARG A 10 19.405 7.829 -25.440 1.00 0.00 H ATOM 168 HH12 ARG A 10 20.775 5.517 -28.266 1.00 0.00 H ATOM 169 HH11 ARG A 10 20.563 4.712 -26.708 1.00 0.00 H ATOM 170 HH22 ARG A 10 20.508 7.865 -28.402 1.00 0.00 H ATOM 171 HH21 ARG A 10 20.043 8.758 -26.951 1.00 0.00 H ATOM 172 H ARG A 10 17.842 2.421 -23.664 1.00 0.00 H ATOM 173 N GLY A 11 19.064 1.972 -21.234 1.00 16.27 N ATOM 174 CA GLY A 11 19.034 1.042 -20.107 1.00 17.55 C ATOM 175 C GLY A 11 20.257 1.324 -19.244 1.00 18.14 C ATOM 176 O GLY A 11 21.071 2.280 -19.468 1.00 19.44 O ATOM 177 HA3 GLY A 11 19.065 0.015 -20.471 1.00 0.00 H ATOM 178 HA2 GLY A 11 18.125 1.193 -19.525 1.00 0.00 H ATOM 179 H GLY A 11 19.513 1.660 -22.095 1.00 0.00 H ATOM 180 N THR A 12 20.403 0.548 -18.174 1.00 17.83 N ATOM 181 CA THR A 12 21.481 0.695 -17.234 1.00 18.73 C ATOM 182 C THR A 12 22.502 -0.429 -17.181 1.00 19.12 C ATOM 183 O THR A 12 23.094 -0.531 -16.068 1.00 18.34 O ATOM 184 CB THR A 12 20.916 1.051 -15.774 1.00 20.31 C ATOM 185 OG1 THR A 12 20.132 -0.062 -15.208 1.00 17.73 O ATOM 186 CG2 THR A 12 20.066 2.356 -15.919 1.00 16.71 C ATOM 187 HA THR A 12 22.060 1.531 -17.626 1.00 0.00 H ATOM 188 HB THR A 12 21.735 1.212 -15.074 1.00 0.00 H ATOM 189 HG1 THR A 12 19.387 -0.252 -15.783 1.00 0.00 H ATOM 190 HG23 THR A 12 20.686 3.147 -16.340 1.00 0.00 H ATOM 191 HG21 THR A 12 19.220 2.166 -16.580 1.00 0.00 H ATOM 192 HG22 THR A 12 19.701 2.661 -14.938 1.00 0.00 H ATOM 193 H THR A 12 19.716 -0.188 -18.012 1.00 0.00 H ATOM 194 N MET A 13 22.718 -1.179 -18.248 1.00 18.60 N ATOM 195 CA MET A 13 23.753 -2.231 -18.184 1.00 17.46 C ATOM 196 C MET A 13 25.024 -1.379 -18.122 1.00 17.02 C ATOM 197 O MET A 13 25.121 -0.361 -18.864 1.00 15.90 O ATOM 198 CB MET A 13 23.730 -3.258 -19.298 1.00 21.75 C ATOM 199 CG MET A 13 23.047 -4.559 -19.092 1.00 28.06 C ATOM 200 SD MET A 13 23.992 -5.850 -18.171 1.00 30.61 S ATOM 201 CE MET A 13 25.659 -5.292 -18.430 1.00 29.48 C ATOM 202 HA MET A 13 23.622 -2.907 -17.339 1.00 0.00 H ATOM 203 HB2 MET A 13 23.252 -2.783 -20.155 1.00 0.00 H ATOM 204 HB3 MET A 13 24.769 -3.482 -19.541 1.00 0.00 H ATOM 205 HG2 MET A 13 22.803 -4.964 -20.074 1.00 0.00 H ATOM 206 HG3 MET A 13 22.126 -4.366 -18.541 1.00 0.00 H ATOM 207 HE1 MET A 13 25.873 -5.273 -19.499 1.00 0.00 H ATOM 208 HE2 MET A 13 25.773 -4.289 -18.018 1.00 0.00 H ATOM 209 HE3 MET A 13 26.350 -5.972 -17.932 1.00 0.00 H ATOM 210 H MET A 13 22.179 -1.034 -19.102 1.00 0.00 H ATOM 211 N SER A 14 25.902 -1.810 -17.187 1.00 14.73 N ATOM 212 CA SER A 14 27.160 -1.085 -16.994 1.00 14.98 C ATOM 213 C SER A 14 28.365 -1.973 -17.115 1.00 15.17 C ATOM 214 O SER A 14 29.487 -1.605 -16.712 1.00 15.88 O ATOM 215 CB SER A 14 26.926 -0.427 -15.616 1.00 15.32 C ATOM 216 OG SER A 14 26.714 -1.440 -14.617 1.00 12.64 O ATOM 217 HA SER A 14 27.394 -0.343 -17.758 1.00 0.00 H ATOM 218 HB2 SER A 14 26.049 0.218 -15.668 1.00 0.00 H ATOM 219 HB3 SER A 14 27.798 0.169 -15.347 1.00 0.00 H ATOM 220 HG SER A 14 26.570 -1.022 -13.765 1.00 0.00 H ATOM 221 H SER A 14 25.690 -2.632 -16.622 1.00 0.00 H ATOM 222 N LYS A 15 28.153 -3.250 -17.475 1.00 15.60 N ATOM 223 CA LYS A 15 29.148 -4.301 -17.617 1.00 15.86 C ATOM 224 C LYS A 15 29.123 -4.929 -19.043 1.00 16.33 C ATOM 225 O LYS A 15 28.017 -5.031 -19.618 1.00 16.13 O ATOM 226 CB LYS A 15 28.934 -5.462 -16.662 1.00 19.65 C ATOM 227 CG LYS A 15 30.010 -5.976 -15.765 1.00 23.63 C ATOM 228 CD LYS A 15 30.042 -5.243 -14.436 1.00 26.91 C ATOM 229 CE LYS A 15 28.986 -5.920 -13.518 1.00 26.67 C ATOM 230 NZ LYS A 15 28.065 -6.608 -14.498 1.00 25.76 N ATOM 231 HA LYS A 15 30.093 -3.801 -17.405 1.00 0.00 H ATOM 232 HB2 LYS A 15 28.111 -5.169 -16.010 1.00 0.00 H ATOM 233 HB3 LYS A 15 28.625 -6.307 -17.278 1.00 0.00 H ATOM 234 HG2 LYS A 15 29.836 -7.036 -15.578 1.00 0.00 H ATOM 235 HG3 LYS A 15 30.972 -5.848 -16.261 1.00 0.00 H ATOM 236 HD2 LYS A 15 31.033 -5.322 -13.989 1.00 0.00 H ATOM 237 HD3 LYS A 15 29.793 -4.192 -14.582 1.00 0.00 H ATOM 238 HE2 LYS A 15 28.447 -5.178 -12.929 1.00 0.00 H ATOM 239 HE3 LYS A 15 29.455 -6.642 -12.849 1.00 0.00 H ATOM 240 HZ1 LYS A 15 27.653 -5.913 -15.121 1.00 0.00 H ATOM 241 HZ2 LYS A 15 28.597 -7.284 -15.046 1.00 0.00 H ATOM 242 HZ3 LYS A 15 27.325 -7.090 -13.987 1.00 0.00 H ATOM 243 H LYS A 15 27.187 -3.511 -17.670 1.00 0.00 H ATOM 244 N THR A 16 30.258 -5.476 -19.459 1.00 15.34 N ATOM 245 CA THR A 16 30.382 -6.043 -20.814 1.00 15.50 C ATOM 246 C THR A 16 29.812 -7.450 -20.875 1.00 15.29 C ATOM 247 O THR A 16 29.193 -7.883 -19.885 1.00 14.96 O ATOM 248 CB THR A 16 31.864 -6.005 -21.382 1.00 12.51 C ATOM 249 OG1 THR A 16 32.632 -6.924 -20.552 1.00 12.48 O ATOM 250 CG2 THR A 16 32.438 -4.595 -21.232 1.00 12.61 C ATOM 251 HA THR A 16 29.791 -5.398 -21.464 1.00 0.00 H ATOM 252 HB THR A 16 31.896 -6.280 -22.436 1.00 0.00 H ATOM 253 HG1 THR A 16 33.543 -6.940 -20.854 1.00 0.00 H ATOM 254 HG23 THR A 16 31.867 -3.904 -21.851 1.00 0.00 H ATOM 255 HG21 THR A 16 32.374 -4.287 -20.188 1.00 0.00 H ATOM 256 HG22 THR A 16 33.481 -4.593 -21.550 1.00 0.00 H ATOM 257 H THR A 16 31.060 -5.505 -18.829 1.00 0.00 H ATOM 258 N LYS A 17 29.889 -7.963 -22.134 1.00 15.72 N ATOM 259 CA LYS A 17 29.490 -9.345 -22.440 1.00 16.27 C ATOM 260 C LYS A 17 30.418 -10.295 -21.669 1.00 17.55 C ATOM 261 O LYS A 17 29.992 -11.360 -21.185 1.00 18.16 O ATOM 262 CB LYS A 17 29.574 -9.562 -23.989 1.00 19.69 C ATOM 263 CG LYS A 17 30.813 -10.372 -24.501 1.00 21.54 C ATOM 264 CD LYS A 17 31.545 -9.717 -25.730 1.00 23.46 C ATOM 265 CE LYS A 17 32.067 -10.684 -26.843 1.00 24.03 C ATOM 266 NZ LYS A 17 33.518 -11.042 -26.988 1.00 24.85 N ATOM 267 HA LYS A 17 28.464 -9.547 -22.132 1.00 0.00 H ATOM 268 HB2 LYS A 17 28.675 -10.094 -24.301 1.00 0.00 H ATOM 269 HB3 LYS A 17 29.597 -8.581 -24.463 1.00 0.00 H ATOM 270 HG2 LYS A 17 31.528 -10.458 -23.683 1.00 0.00 H ATOM 271 HG3 LYS A 17 30.475 -11.366 -24.793 1.00 0.00 H ATOM 272 HD2 LYS A 17 30.846 -9.023 -26.198 1.00 0.00 H ATOM 273 HD3 LYS A 17 32.402 -9.164 -25.346 1.00 0.00 H ATOM 274 HE2 LYS A 17 31.768 -10.241 -27.793 1.00 0.00 H ATOM 275 HE3 LYS A 17 31.536 -11.625 -26.699 1.00 0.00 H ATOM 276 HZ1 LYS A 17 34.061 -10.195 -27.156 1.00 0.00 H ATOM 277 HZ2 LYS A 17 33.843 -11.491 -26.132 1.00 0.00 H ATOM 278 HZ3 LYS A 17 33.632 -11.682 -27.774 1.00 0.00 H ATOM 279 H LYS A 17 30.234 -7.370 -22.889 1.00 0.00 H ATOM 280 N ASN A 18 31.685 -9.855 -21.446 1.00 15.75 N ATOM 281 CA ASN A 18 32.680 -10.496 -20.629 1.00 17.58 C ATOM 282 C ASN A 18 32.649 -10.170 -19.108 1.00 16.17 C ATOM 283 O ASN A 18 33.650 -10.418 -18.445 1.00 15.53 O ATOM 284 CB ASN A 18 34.122 -10.276 -21.226 1.00 17.68 C ATOM 285 CG ASN A 18 34.099 -10.484 -22.718 1.00 20.80 C ATOM 286 OD1 ASN A 18 34.487 -9.599 -23.527 1.00 23.04 O ATOM 287 ND2 ASN A 18 33.638 -11.645 -23.166 1.00 22.63 N ATOM 288 HA ASN A 18 32.410 -11.551 -20.670 1.00 0.00 H ATOM 289 HB2 ASN A 18 34.452 -9.260 -21.008 1.00 0.00 H ATOM 290 HB3 ASN A 18 34.813 -10.987 -20.773 1.00 0.00 H ATOM 291 HD22 ASN A 18 33.325 -12.358 -22.507 1.00 0.00 H ATOM 292 HD21 ASN A 18 33.596 -11.824 -24.169 1.00 0.00 H ATOM 293 H ASN A 18 31.957 -8.985 -21.903 1.00 0.00 H ATOM 294 N GLY A 19 31.714 -9.458 -18.555 1.00 15.26 N ATOM 295 CA GLY A 19 31.533 -9.148 -17.151 1.00 16.96 C ATOM 296 C GLY A 19 32.351 -7.955 -16.677 1.00 17.70 C ATOM 297 O GLY A 19 32.099 -7.633 -15.485 1.00 18.85 O ATOM 298 HA3 GLY A 19 31.825 -10.020 -16.565 1.00 0.00 H ATOM 299 HA2 GLY A 19 30.478 -8.933 -16.979 1.00 0.00 H ATOM 300 H GLY A 19 31.018 -9.067 -19.190 1.00 0.00 H ATOM 301 N ILE A 20 33.135 -7.354 -17.593 1.00 16.00 N ATOM 302 CA ILE A 20 33.959 -6.164 -17.163 1.00 14.27 C ATOM 303 C ILE A 20 33.225 -4.837 -17.064 1.00 14.00 C ATOM 304 O ILE A 20 32.407 -4.369 -17.871 1.00 13.93 O ATOM 305 CB ILE A 20 35.300 -6.238 -17.922 1.00 12.46 C ATOM 306 CG1 ILE A 20 35.826 -4.816 -18.274 1.00 14.73 C ATOM 307 CG2 ILE A 20 35.453 -7.332 -19.005 1.00 17.69 C ATOM 308 CD1 ILE A 20 36.532 -4.345 -16.955 1.00 10.00 C ATOM 309 HA ILE A 20 34.197 -6.219 -16.101 1.00 0.00 H ATOM 310 HB ILE A 20 36.010 -6.656 -17.209 1.00 0.00 H ATOM 311 HG12 ILE A 20 36.534 -4.857 -19.101 1.00 0.00 H ATOM 312 HG13 ILE A 20 35.003 -4.150 -18.534 1.00 0.00 H ATOM 313 HD11 ILE A 20 35.806 -4.328 -16.142 1.00 0.00 H ATOM 314 HD12 ILE A 20 37.339 -5.036 -16.710 1.00 0.00 H ATOM 315 HD13 ILE A 20 36.940 -3.345 -17.100 1.00 0.00 H ATOM 316 HG21 ILE A 20 35.327 -8.314 -18.548 1.00 0.00 H ATOM 317 HG22 ILE A 20 34.695 -7.188 -19.775 1.00 0.00 H ATOM 318 HG23 ILE A 20 36.445 -7.263 -19.452 1.00 0.00 H ATOM 319 H ILE A 20 33.171 -7.695 -18.554 1.00 0.00 H ATOM 320 N THR A 21 33.526 -4.207 -15.904 1.00 14.17 N ATOM 321 CA THR A 21 32.836 -2.929 -15.561 1.00 13.77 C ATOM 322 C THR A 21 33.223 -1.818 -16.450 1.00 13.02 C ATOM 323 O THR A 21 34.374 -1.509 -16.843 1.00 13.43 O ATOM 324 CB THR A 21 32.841 -2.881 -13.925 1.00 16.16 C ATOM 325 OG1 THR A 21 32.500 -1.512 -13.615 1.00 18.68 O ATOM 326 CG2 THR A 21 34.118 -3.381 -13.352 1.00 21.34 C ATOM 327 HA THR A 21 31.779 -2.822 -15.803 1.00 0.00 H ATOM 328 HB THR A 21 32.122 -3.556 -13.462 1.00 0.00 H ATOM 329 HG1 THR A 21 32.481 -1.396 -12.662 1.00 0.00 H ATOM 330 HG23 THR A 21 34.268 -4.418 -13.652 1.00 0.00 H ATOM 331 HG21 THR A 21 34.943 -2.772 -13.721 1.00 0.00 H ATOM 332 HG22 THR A 21 34.076 -3.318 -12.265 1.00 0.00 H ATOM 333 H THR A 21 34.219 -4.603 -15.269 1.00 0.00 H ATOM 334 N CYS A 22 32.104 -1.103 -16.893 1.00 10.92 N ATOM 335 CA CYS A 22 32.395 -0.050 -17.844 1.00 12.36 C ATOM 336 C CYS A 22 33.066 1.185 -17.303 1.00 12.53 C ATOM 337 O CYS A 22 32.912 1.469 -16.089 1.00 11.14 O ATOM 338 CB CYS A 22 31.066 0.381 -18.529 1.00 11.38 C ATOM 339 SG CYS A 22 30.367 -0.894 -19.549 1.00 10.38 S ATOM 340 HA CYS A 22 33.120 -0.490 -18.529 1.00 0.00 H ATOM 341 HB2 CYS A 22 31.262 1.255 -19.150 1.00 0.00 H ATOM 342 HB3 CYS A 22 30.344 0.642 -17.755 1.00 0.00 H ATOM 343 H CYS A 22 31.158 -1.308 -16.571 1.00 0.00 H ATOM 344 N GLN A 23 33.573 1.922 -18.238 1.00 12.31 N ATOM 345 CA GLN A 23 34.121 3.251 -17.890 1.00 13.75 C ATOM 346 C GLN A 23 32.959 4.221 -18.220 1.00 14.39 C ATOM 347 O GLN A 23 31.953 3.959 -18.920 1.00 14.65 O ATOM 348 CB GLN A 23 35.370 3.617 -18.601 1.00 17.25 C ATOM 349 CG GLN A 23 36.332 4.690 -18.211 1.00 15.67 C ATOM 350 CD GLN A 23 37.151 5.128 -19.484 1.00 14.40 C ATOM 351 OE1 GLN A 23 38.030 4.392 -19.818 1.00 12.36 O ATOM 352 NE2 GLN A 23 36.774 6.318 -19.935 1.00 10.00 N ATOM 353 HA GLN A 23 34.434 3.280 -16.846 1.00 0.00 H ATOM 354 HB2 GLN A 23 35.961 2.701 -18.625 1.00 0.00 H ATOM 355 HB3 GLN A 23 35.056 3.872 -19.613 1.00 0.00 H ATOM 356 HG2 GLN A 23 35.785 5.546 -17.815 1.00 0.00 H ATOM 357 HG3 GLN A 23 37.014 4.312 -17.449 1.00 0.00 H ATOM 358 HE22 GLN A 23 35.981 6.797 -19.508 1.00 0.00 H ATOM 359 HE21 GLN A 23 37.277 6.753 -20.708 1.00 0.00 H ATOM 360 H GLN A 23 33.594 1.591 -19.202 1.00 0.00 H ATOM 361 N LYS A 24 32.950 5.283 -17.417 1.00 15.45 N ATOM 362 CA LYS A 24 32.008 6.391 -17.507 1.00 15.23 C ATOM 363 C LYS A 24 32.425 7.123 -18.799 1.00 14.61 C ATOM 364 O LYS A 24 33.612 7.194 -19.116 1.00 14.52 O ATOM 365 CB LYS A 24 31.982 7.308 -16.323 1.00 13.42 C ATOM 366 CG LYS A 24 32.382 6.595 -15.016 1.00 19.20 C ATOM 367 CD LYS A 24 32.112 7.217 -13.667 1.00 18.92 C ATOM 368 CE LYS A 24 30.744 6.751 -13.087 1.00 18.93 C ATOM 369 NZ LYS A 24 30.496 7.915 -12.183 1.00 20.49 N ATOM 370 HA LYS A 24 30.983 6.019 -17.524 1.00 0.00 H ATOM 371 HB2 LYS A 24 32.677 8.129 -16.501 1.00 0.00 H ATOM 372 HB3 LYS A 24 30.973 7.705 -16.210 1.00 0.00 H ATOM 373 HG2 LYS A 24 31.869 5.633 -15.020 1.00 0.00 H ATOM 374 HG3 LYS A 24 33.458 6.432 -15.071 1.00 0.00 H ATOM 375 HD2 LYS A 24 32.906 6.928 -12.978 1.00 0.00 H ATOM 376 HD3 LYS A 24 32.101 8.302 -13.773 1.00 0.00 H ATOM 377 HE2 LYS A 24 30.825 5.812 -12.539 1.00 0.00 H ATOM 378 HE3 LYS A 24 29.979 6.656 -13.858 1.00 0.00 H ATOM 379 HZ1 LYS A 24 31.252 7.981 -11.501 1.00 0.00 H ATOM 380 HZ2 LYS A 24 30.459 8.771 -12.736 1.00 0.00 H ATOM 381 HZ3 LYS A 24 29.609 7.784 -11.697 1.00 0.00 H ATOM 382 H LYS A 24 33.657 5.324 -16.683 1.00 0.00 H ATOM 383 N TRP A 25 31.436 7.588 -19.524 1.00 14.10 N ATOM 384 CA TRP A 25 31.780 8.342 -20.803 1.00 15.41 C ATOM 385 C TRP A 25 32.408 9.696 -20.533 1.00 15.37 C ATOM 386 O TRP A 25 32.777 10.498 -21.441 1.00 15.77 O ATOM 387 CB TRP A 25 30.486 8.403 -21.543 1.00 12.38 C ATOM 388 CG TRP A 25 29.755 7.153 -21.818 1.00 11.95 C ATOM 389 CD1 TRP A 25 28.855 6.531 -20.972 1.00 11.64 C ATOM 390 CD2 TRP A 25 29.999 6.236 -22.916 1.00 10.00 C ATOM 391 NE1 TRP A 25 28.318 5.435 -21.594 1.00 10.28 N ATOM 392 CE2 TRP A 25 29.038 5.223 -22.758 1.00 13.00 C ATOM 393 CE3 TRP A 25 30.733 6.340 -24.094 1.00 12.05 C ATOM 394 CZ2 TRP A 25 28.853 4.250 -23.746 1.00 14.03 C ATOM 395 CZ3 TRP A 25 30.588 5.385 -25.100 1.00 10.86 C ATOM 396 CH2 TRP A 25 29.647 4.374 -24.912 1.00 13.11 C ATOM 397 HA TRP A 25 32.549 7.845 -21.394 1.00 0.00 H ATOM 398 HB2 TRP A 25 29.818 9.042 -20.965 1.00 0.00 H ATOM 399 HB3 TRP A 25 30.691 8.871 -22.506 1.00 0.00 H ATOM 400 HE1 TRP A 25 27.532 4.877 -21.261 1.00 0.00 H ATOM 401 HD1 TRP A 25 28.610 6.863 -19.963 1.00 0.00 H ATOM 402 HZ2 TRP A 25 28.135 3.439 -23.625 1.00 0.00 H ATOM 403 HH2 TRP A 25 29.515 3.639 -25.706 1.00 0.00 H ATOM 404 HZ3 TRP A 25 31.192 5.428 -26.006 1.00 0.00 H ATOM 405 HE3 TRP A 25 31.424 7.172 -24.231 1.00 0.00 H ATOM 406 H TRP A 25 30.466 7.449 -19.240 1.00 0.00 H ATOM 407 N SER A 26 32.291 10.122 -19.267 1.00 16.07 N ATOM 408 CA SER A 26 32.790 11.474 -18.907 1.00 16.69 C ATOM 409 C SER A 26 34.152 11.416 -18.209 1.00 17.29 C ATOM 410 O SER A 26 34.609 12.463 -17.688 1.00 17.10 O ATOM 411 CB SER A 26 31.716 12.238 -18.142 1.00 22.06 C ATOM 412 OG SER A 26 31.196 11.385 -17.091 1.00 26.42 O ATOM 413 HA SER A 26 32.983 12.042 -19.817 1.00 0.00 H ATOM 414 HB2 SER A 26 30.910 12.516 -18.821 1.00 0.00 H ATOM 415 HB3 SER A 26 32.148 13.138 -17.704 1.00 0.00 H ATOM 416 HG SER A 26 30.518 11.858 -16.603 1.00 0.00 H ATOM 417 H SER A 26 31.864 9.524 -18.559 1.00 0.00 H ATOM 418 N SER A 27 34.646 10.186 -18.091 1.00 15.19 N ATOM 419 CA SER A 27 36.022 10.022 -17.485 1.00 16.19 C ATOM 420 C SER A 27 36.988 9.888 -18.673 1.00 16.80 C ATOM 421 O SER A 27 36.632 9.843 -19.881 1.00 12.91 O ATOM 422 CB SER A 27 35.791 8.957 -16.458 1.00 19.56 C ATOM 423 OG SER A 27 36.631 7.875 -16.339 1.00 23.51 O ATOM 424 HA SER A 27 36.521 10.813 -16.926 1.00 0.00 H ATOM 425 HB2 SER A 27 34.797 8.554 -16.652 1.00 0.00 H ATOM 426 HB3 SER A 27 35.796 9.458 -15.490 1.00 0.00 H ATOM 427 HG SER A 27 36.321 7.307 -15.630 1.00 0.00 H ATOM 428 H SER A 27 34.111 9.375 -18.401 1.00 0.00 H ATOM 429 N THR A 28 38.265 10.173 -18.396 1.00 19.05 N ATOM 430 CA THR A 28 39.288 9.991 -19.438 1.00 20.93 C ATOM 431 C THR A 28 40.386 9.096 -18.877 1.00 21.02 C ATOM 432 O THR A 28 41.489 9.167 -19.372 1.00 21.88 O ATOM 433 CB THR A 28 39.692 11.237 -20.313 1.00 23.64 C ATOM 434 OG1 THR A 28 39.238 12.457 -19.637 1.00 23.36 O ATOM 435 CG2 THR A 28 39.001 11.140 -21.711 1.00 20.57 C ATOM 436 HA THR A 28 38.834 9.464 -20.277 1.00 0.00 H ATOM 437 HB THR A 28 40.774 11.260 -20.443 1.00 0.00 H ATOM 438 HG1 THR A 28 39.480 13.222 -20.164 1.00 0.00 H ATOM 439 HG23 THR A 28 39.335 10.235 -22.218 1.00 0.00 H ATOM 440 HG21 THR A 28 37.920 11.106 -21.579 1.00 0.00 H ATOM 441 HG22 THR A 28 39.268 12.012 -22.308 1.00 0.00 H ATOM 442 H THR A 28 38.527 10.513 -17.471 1.00 0.00 H ATOM 443 N SER A 29 39.907 8.041 -18.204 1.00 21.12 N ATOM 444 CA SER A 29 40.781 6.997 -17.656 1.00 21.18 C ATOM 445 C SER A 29 39.976 5.738 -17.303 1.00 20.63 C ATOM 446 O SER A 29 38.892 5.711 -16.652 1.00 20.49 O ATOM 447 CB SER A 29 41.637 7.494 -16.496 1.00 24.46 C ATOM 448 OG SER A 29 41.994 6.399 -15.636 1.00 24.79 O ATOM 449 HA SER A 29 41.489 6.722 -18.438 1.00 0.00 H ATOM 450 HB2 SER A 29 41.075 8.232 -15.924 1.00 0.00 H ATOM 451 HB3 SER A 29 42.544 7.954 -16.889 1.00 0.00 H ATOM 452 HG SER A 29 42.532 6.725 -14.911 1.00 0.00 H ATOM 453 H SER A 29 38.899 7.961 -18.068 1.00 0.00 H ATOM 454 N PRO A 30 40.590 4.550 -17.626 1.00 19.37 N ATOM 455 CA PRO A 30 41.886 4.363 -18.264 1.00 17.09 C ATOM 456 C PRO A 30 42.055 4.929 -19.698 1.00 17.02 C ATOM 457 O PRO A 30 43.163 5.206 -20.157 1.00 16.32 O ATOM 458 CB PRO A 30 41.973 2.862 -18.385 1.00 16.85 C ATOM 459 CG PRO A 30 40.666 2.249 -18.049 1.00 17.37 C ATOM 460 CD PRO A 30 39.868 3.312 -17.342 1.00 16.50 C ATOM 461 HA PRO A 30 42.639 4.885 -17.674 1.00 0.00 H ATOM 462 HD3 PRO A 30 38.852 3.358 -17.734 1.00 0.00 H ATOM 463 HD2 PRO A 30 39.834 3.121 -16.269 1.00 0.00 H ATOM 464 HG3 PRO A 30 40.810 1.388 -17.396 1.00 0.00 H ATOM 465 HG2 PRO A 30 40.153 1.933 -18.957 1.00 0.00 H ATOM 466 HB2 PRO A 30 42.244 2.597 -19.407 1.00 0.00 H ATOM 467 HB3 PRO A 30 42.734 2.488 -17.700 1.00 0.00 H ATOM 468 N HIS A 31 41.030 5.063 -20.458 1.00 15.96 N ATOM 469 CA HIS A 31 40.841 5.422 -21.838 1.00 16.18 C ATOM 470 C HIS A 31 40.206 6.773 -22.109 1.00 17.38 C ATOM 471 O HIS A 31 39.134 7.232 -21.580 1.00 17.34 O ATOM 472 CB HIS A 31 39.960 4.287 -22.454 1.00 16.52 C ATOM 473 CG HIS A 31 40.467 2.889 -22.233 1.00 16.18 C ATOM 474 ND1 HIS A 31 39.746 1.854 -21.665 1.00 16.88 N ATOM 475 CD2 HIS A 31 41.612 2.322 -22.659 1.00 13.25 C ATOM 476 CE1 HIS A 31 40.508 0.772 -21.601 1.00 13.79 C ATOM 477 NE2 HIS A 31 41.673 1.047 -22.142 1.00 14.55 N ATOM 478 HA HIS A 31 41.829 5.521 -22.287 1.00 0.00 H ATOM 479 HB2 HIS A 31 38.964 4.358 -22.016 1.00 0.00 H ATOM 480 HB3 HIS A 31 39.895 4.456 -23.529 1.00 0.00 H ATOM 481 HD2 HIS A 31 42.359 2.790 -23.300 1.00 0.00 H ATOM 482 HE1 HIS A 31 40.217 -0.186 -21.171 1.00 0.00 H ATOM 483 H HIS A 31 40.152 4.872 -19.975 1.00 0.00 H ATOM 484 N ARG A 32 40.858 7.492 -23.058 1.00 17.64 N ATOM 485 CA ARG A 32 40.213 8.842 -23.449 1.00 18.20 C ATOM 486 C ARG A 32 39.171 8.579 -24.510 1.00 18.09 C ATOM 487 O ARG A 32 39.575 8.275 -25.666 1.00 20.12 O ATOM 488 CB ARG A 32 41.350 9.750 -23.765 1.00 23.30 C ATOM 489 CG ARG A 32 41.241 11.266 -23.623 1.00 28.03 C ATOM 490 CD ARG A 32 42.486 11.613 -22.795 1.00 31.60 C ATOM 491 NE ARG A 32 43.024 12.900 -23.039 1.00 33.55 N ATOM 492 CZ ARG A 32 42.839 14.140 -22.588 1.00 34.35 C ATOM 493 NH1 ARG A 32 41.955 14.397 -21.646 1.00 35.01 N ATOM 494 NH2 ARG A 32 43.674 15.112 -23.028 1.00 34.06 N ATOM 495 HA ARG A 32 39.640 9.353 -22.676 1.00 0.00 H ATOM 496 HB2 ARG A 32 42.174 9.442 -23.122 1.00 0.00 H ATOM 497 HB3 ARG A 32 41.612 9.559 -24.806 1.00 0.00 H ATOM 498 HG2 ARG A 32 41.266 11.756 -24.596 1.00 0.00 H ATOM 499 HG3 ARG A 32 40.328 11.548 -23.099 1.00 0.00 H ATOM 500 HD2 ARG A 32 43.257 10.875 -23.017 1.00 0.00 H ATOM 501 HD3 ARG A 32 42.219 11.551 -21.740 1.00 0.00 H ATOM 502 HE ARG A 32 43.750 12.869 -23.754 1.00 0.00 H ATOM 503 HH12 ARG A 32 41.827 15.353 -21.313 1.00 0.00 H ATOM 504 HH11 ARG A 32 41.398 13.640 -21.249 1.00 0.00 H ATOM 505 HH22 ARG A 32 43.558 16.071 -22.701 1.00 0.00 H ATOM 506 HH21 ARG A 32 44.419 14.885 -23.686 1.00 0.00 H ATOM 507 H ARG A 32 41.722 7.161 -23.488 1.00 0.00 H ATOM 508 N PRO A 33 37.874 8.725 -24.243 1.00 16.90 N ATOM 509 CA PRO A 33 36.840 8.397 -25.177 1.00 18.48 C ATOM 510 C PRO A 33 36.816 9.249 -26.461 1.00 18.25 C ATOM 511 O PRO A 33 37.116 10.409 -26.301 1.00 19.05 O ATOM 512 CB PRO A 33 35.498 8.516 -24.445 1.00 18.00 C ATOM 513 CG PRO A 33 35.805 8.725 -22.980 1.00 17.49 C ATOM 514 CD PRO A 33 37.307 9.087 -22.919 1.00 17.67 C ATOM 515 HA PRO A 33 37.039 7.384 -25.527 1.00 0.00 H ATOM 516 HD3 PRO A 33 37.432 10.154 -22.733 1.00 0.00 H ATOM 517 HD2 PRO A 33 37.801 8.521 -22.129 1.00 0.00 H ATOM 518 HG3 PRO A 33 35.610 7.813 -22.416 1.00 0.00 H ATOM 519 HG2 PRO A 33 35.201 9.537 -22.576 1.00 0.00 H ATOM 520 HB2 PRO A 33 34.934 9.364 -24.833 1.00 0.00 H ATOM 521 HB3 PRO A 33 34.917 7.603 -24.579 1.00 0.00 H ATOM 522 N ARG A 34 36.451 8.782 -27.576 1.00 18.52 N ATOM 523 CA ARG A 34 36.233 9.396 -28.899 1.00 18.08 C ATOM 524 C ARG A 34 34.780 9.918 -28.950 1.00 16.22 C ATOM 525 O ARG A 34 34.473 10.945 -29.587 1.00 16.33 O ATOM 526 CB ARG A 34 36.490 8.331 -29.979 1.00 21.06 C ATOM 527 HA ARG A 34 36.911 10.231 -29.075 1.00 0.00 H ATOM 528 HB2 ARG A 34 37.517 7.974 -29.898 1.00 0.00 H ATOM 529 HB3 ARG A 34 35.802 7.498 -29.837 1.00 0.00 H ATOM 530 H ARG A 34 36.271 7.778 -27.558 1.00 0.00 H ATOM 531 N PHE A 35 33.968 9.164 -28.257 1.00 15.43 N ATOM 532 CA PHE A 35 32.541 9.408 -28.085 1.00 16.46 C ATOM 533 C PHE A 35 32.275 9.754 -26.627 1.00 14.31 C ATOM 534 O PHE A 35 32.584 8.947 -25.732 1.00 13.03 O ATOM 535 CB PHE A 35 31.745 8.150 -28.393 1.00 16.97 C ATOM 536 CG PHE A 35 31.699 7.737 -29.857 1.00 19.33 C ATOM 537 CD1 PHE A 35 30.794 8.351 -30.724 1.00 18.42 C ATOM 538 CD2 PHE A 35 32.554 6.735 -30.321 1.00 20.13 C ATOM 539 CE1 PHE A 35 30.722 7.939 -32.056 1.00 21.63 C ATOM 540 CE2 PHE A 35 32.488 6.326 -31.653 1.00 22.00 C ATOM 541 CZ PHE A 35 31.565 6.922 -32.520 1.00 22.61 C ATOM 542 HA PHE A 35 32.246 10.215 -28.755 1.00 0.00 H ATOM 543 HB2 PHE A 35 32.185 7.329 -27.827 1.00 0.00 H ATOM 544 HB3 PHE A 35 30.720 8.312 -28.059 1.00 0.00 H ATOM 545 HD2 PHE A 35 33.272 6.273 -29.643 1.00 0.00 H ATOM 546 HE2 PHE A 35 33.154 5.544 -32.018 1.00 0.00 H ATOM 547 HZ PHE A 35 31.502 6.594 -33.558 1.00 0.00 H ATOM 548 HE1 PHE A 35 30.010 8.409 -32.734 1.00 0.00 H ATOM 549 HD1 PHE A 35 30.146 9.149 -30.363 1.00 0.00 H ATOM 550 H PHE A 35 34.363 8.341 -27.801 1.00 0.00 H ATOM 551 N SER A 36 31.691 10.897 -26.372 1.00 13.67 N ATOM 552 CA SER A 36 31.373 11.319 -24.996 1.00 16.15 C ATOM 553 C SER A 36 30.377 12.469 -25.031 1.00 15.25 C ATOM 554 O SER A 36 30.063 12.991 -26.108 1.00 16.26 O ATOM 555 CB SER A 36 32.661 11.749 -24.277 1.00 17.56 C ATOM 556 OG SER A 36 33.042 13.057 -24.678 1.00 14.41 O ATOM 557 HA SER A 36 30.928 10.485 -24.452 1.00 0.00 H ATOM 558 HB2 SER A 36 33.460 11.051 -24.524 1.00 0.00 H ATOM 559 HB3 SER A 36 32.492 11.739 -23.200 1.00 0.00 H ATOM 560 HG SER A 36 33.847 13.309 -24.220 1.00 0.00 H ATOM 561 H SER A 36 31.449 11.514 -27.148 1.00 0.00 H ATOM 562 N PRO A 37 29.834 12.941 -23.854 1.00 15.86 N ATOM 563 CA PRO A 37 28.826 13.970 -23.764 1.00 15.68 C ATOM 564 C PRO A 37 29.244 15.276 -24.396 1.00 15.95 C ATOM 565 O PRO A 37 28.540 15.957 -25.124 1.00 15.46 O ATOM 566 CB PRO A 37 28.388 14.124 -22.255 1.00 15.56 C ATOM 567 CG PRO A 37 29.069 12.942 -21.583 1.00 14.63 C ATOM 568 CD PRO A 37 30.095 12.353 -22.522 1.00 15.31 C ATOM 569 HA PRO A 37 27.962 13.661 -24.352 1.00 0.00 H ATOM 570 HD3 PRO A 37 31.101 12.608 -22.188 1.00 0.00 H ATOM 571 HD2 PRO A 37 29.990 11.269 -22.562 1.00 0.00 H ATOM 572 HG3 PRO A 37 28.324 12.185 -21.336 1.00 0.00 H ATOM 573 HG2 PRO A 37 29.561 13.277 -20.670 1.00 0.00 H ATOM 574 HB2 PRO A 37 28.739 15.068 -21.839 1.00 0.00 H ATOM 575 HB3 PRO A 37 27.305 14.063 -22.152 1.00 0.00 H ATOM 576 N ALA A 38 30.508 15.582 -24.309 1.00 17.89 N ATOM 577 CA ALA A 38 30.971 16.865 -24.857 1.00 18.93 C ATOM 578 C ALA A 38 30.778 16.894 -26.355 1.00 20.21 C ATOM 579 O ALA A 38 30.508 17.996 -26.885 1.00 22.84 O ATOM 580 CB ALA A 38 32.435 17.040 -24.492 1.00 18.44 C ATOM 581 HA ALA A 38 30.391 17.686 -24.436 1.00 0.00 H ATOM 582 HB1 ALA A 38 32.541 17.037 -23.407 1.00 0.00 H ATOM 583 HB2 ALA A 38 33.015 16.221 -24.917 1.00 0.00 H ATOM 584 HB3 ALA A 38 32.797 17.988 -24.891 1.00 0.00 H ATOM 585 H ALA A 38 31.166 14.940 -23.867 1.00 0.00 H ATOM 586 N THR A 39 30.858 15.763 -27.004 1.00 19.58 N ATOM 587 CA THR A 39 30.813 15.494 -28.437 1.00 16.70 C ATOM 588 C THR A 39 29.543 14.996 -29.044 1.00 16.53 C ATOM 589 O THR A 39 29.161 15.442 -30.163 1.00 15.39 O ATOM 590 CB THR A 39 32.067 14.534 -28.513 1.00 17.84 C ATOM 591 OG1 THR A 39 33.173 15.533 -28.640 1.00 22.54 O ATOM 592 CG2 THR A 39 32.202 13.404 -29.463 1.00 19.09 C ATOM 593 HA THR A 39 30.844 16.388 -29.061 1.00 0.00 H ATOM 594 HB THR A 39 32.019 13.877 -27.645 1.00 0.00 H ATOM 595 HG1 THR A 39 34.014 15.073 -28.697 1.00 0.00 H ATOM 596 HG23 THR A 39 31.371 12.712 -29.324 1.00 0.00 H ATOM 597 HG21 THR A 39 32.191 13.786 -30.484 1.00 0.00 H ATOM 598 HG22 THR A 39 33.143 12.886 -29.278 1.00 0.00 H ATOM 599 H THR A 39 30.970 14.937 -26.416 1.00 0.00 H ATOM 600 N HIS A 40 28.819 14.103 -28.449 1.00 14.99 N ATOM 601 CA HIS A 40 27.618 13.410 -28.811 1.00 16.28 C ATOM 602 C HIS A 40 26.499 13.512 -27.740 1.00 17.40 C ATOM 603 O HIS A 40 26.123 12.534 -27.091 1.00 18.17 O ATOM 604 CB HIS A 40 27.945 11.886 -29.025 1.00 15.14 C ATOM 605 CG HIS A 40 29.049 11.703 -30.000 1.00 13.35 C ATOM 606 ND1 HIS A 40 30.373 11.904 -29.804 1.00 15.74 N ATOM 607 CD2 HIS A 40 28.947 11.302 -31.315 1.00 14.96 C ATOM 608 CE1 HIS A 40 31.097 11.635 -30.883 1.00 14.81 C ATOM 609 NE2 HIS A 40 30.221 11.306 -31.830 1.00 15.57 N ATOM 610 HA HIS A 40 27.251 13.883 -29.722 1.00 0.00 H ATOM 611 HB2 HIS A 40 28.237 11.448 -28.071 1.00 0.00 H ATOM 612 HB3 HIS A 40 27.054 11.380 -29.398 1.00 0.00 H ATOM 613 HD2 HIS A 40 28.033 11.034 -31.844 1.00 0.00 H ATOM 614 HE1 HIS A 40 32.182 11.675 -30.975 1.00 0.00 H ATOM 615 H HIS A 40 29.178 13.837 -27.532 1.00 0.00 H ATOM 616 N PRO A 41 25.958 14.711 -27.595 1.00 17.77 N ATOM 617 CA PRO A 41 24.972 15.011 -26.531 1.00 19.13 C ATOM 618 C PRO A 41 23.588 14.402 -26.689 1.00 19.17 C ATOM 619 O PRO A 41 22.850 14.370 -25.712 1.00 19.07 O ATOM 620 CB PRO A 41 24.916 16.517 -26.421 1.00 18.61 C ATOM 621 CG PRO A 41 25.748 17.073 -27.490 1.00 19.86 C ATOM 622 CD PRO A 41 26.476 15.929 -28.186 1.00 18.33 C ATOM 623 HA PRO A 41 25.316 14.530 -25.615 1.00 0.00 H ATOM 624 HD3 PRO A 41 26.274 15.947 -29.257 1.00 0.00 H ATOM 625 HD2 PRO A 41 27.550 16.005 -28.018 1.00 0.00 H ATOM 626 HG3 PRO A 41 26.474 17.767 -27.067 1.00 0.00 H ATOM 627 HG2 PRO A 41 25.120 17.600 -28.208 1.00 0.00 H ATOM 628 HB2 PRO A 41 23.888 16.860 -26.534 1.00 0.00 H ATOM 629 HB3 PRO A 41 25.298 16.833 -25.450 1.00 0.00 H ATOM 630 N SER A 42 23.245 13.955 -27.874 1.00 20.03 N ATOM 631 CA SER A 42 21.915 13.356 -28.129 1.00 21.74 C ATOM 632 C SER A 42 21.940 11.845 -28.160 1.00 22.18 C ATOM 633 O SER A 42 21.024 11.190 -28.671 1.00 23.72 O ATOM 634 CB SER A 42 21.513 13.907 -29.487 1.00 23.49 C ATOM 635 OG SER A 42 22.818 14.494 -29.857 1.00 30.12 O ATOM 636 HA SER A 42 21.216 13.606 -27.331 1.00 0.00 H ATOM 637 HB2 SER A 42 20.727 14.658 -29.413 1.00 0.00 H ATOM 638 HB3 SER A 42 21.201 13.123 -30.177 1.00 0.00 H ATOM 639 HG SER A 42 22.750 14.903 -30.723 1.00 0.00 H ATOM 640 H SER A 42 23.914 14.022 -28.641 1.00 0.00 H ATOM 641 N GLU A 43 22.978 11.322 -27.527 1.00 22.18 N ATOM 642 CA GLU A 43 23.291 9.890 -27.528 1.00 20.81 C ATOM 643 C GLU A 43 23.088 9.274 -26.165 1.00 19.97 C ATOM 644 O GLU A 43 23.407 8.063 -26.110 1.00 19.43 O ATOM 645 CB GLU A 43 24.740 9.721 -28.031 1.00 19.17 C ATOM 646 CG GLU A 43 24.885 10.018 -29.564 1.00 20.66 C ATOM 647 CD GLU A 43 23.859 9.310 -30.403 1.00 23.42 C ATOM 648 OE1 GLU A 43 23.405 8.224 -30.074 1.00 21.83 O ATOM 649 OE2 GLU A 43 23.361 9.908 -31.391 1.00 26.08 O ATOM 650 HA GLU A 43 22.610 9.360 -28.194 1.00 0.00 H ATOM 651 HB2 GLU A 43 25.383 10.407 -27.480 1.00 0.00 H ATOM 652 HB3 GLU A 43 25.058 8.696 -27.842 1.00 0.00 H ATOM 653 HG2 GLU A 43 24.780 11.092 -29.721 1.00 0.00 H ATOM 654 HG3 GLU A 43 25.876 9.700 -29.887 1.00 0.00 H ATOM 655 H GLU A 43 23.594 11.950 -27.010 1.00 0.00 H ATOM 656 N GLY A 44 22.656 10.087 -25.177 1.00 16.68 N ATOM 657 CA GLY A 44 22.459 9.473 -23.827 1.00 15.42 C ATOM 658 C GLY A 44 23.686 8.770 -23.273 1.00 14.50 C ATOM 659 O GLY A 44 23.556 7.671 -22.569 1.00 16.38 O ATOM 660 HA3 GLY A 44 21.651 8.745 -23.898 1.00 0.00 H ATOM 661 HA2 GLY A 44 22.175 10.262 -23.131 1.00 0.00 H ATOM 662 H GLY A 44 22.472 11.076 -25.344 1.00 0.00 H ATOM 663 N LEU A 45 24.844 9.382 -23.324 1.00 13.34 N ATOM 664 CA LEU A 45 26.104 8.782 -22.826 1.00 16.29 C ATOM 665 C LEU A 45 26.141 9.089 -21.312 1.00 17.34 C ATOM 666 O LEU A 45 26.870 9.987 -20.858 1.00 18.26 O ATOM 667 CB LEU A 45 27.270 9.439 -23.613 1.00 15.07 C ATOM 668 CG LEU A 45 28.002 8.579 -24.673 1.00 14.77 C ATOM 669 CD1 LEU A 45 27.134 7.459 -25.271 1.00 11.63 C ATOM 670 CD2 LEU A 45 28.509 9.454 -25.837 1.00 10.00 C ATOM 671 HA LEU A 45 26.183 7.704 -22.970 1.00 0.00 H ATOM 672 HB2 LEU A 45 26.865 10.312 -24.125 1.00 0.00 H ATOM 673 HB3 LEU A 45 28.014 9.760 -22.884 1.00 0.00 H ATOM 674 HG LEU A 45 28.830 8.118 -24.136 1.00 0.00 H ATOM 675 HD21 LEU A 45 27.663 9.951 -26.312 1.00 0.00 H ATOM 676 HD22 LEU A 45 29.202 10.202 -25.452 1.00 0.00 H ATOM 677 HD23 LEU A 45 29.019 8.825 -26.567 1.00 0.00 H ATOM 678 HD11 LEU A 45 26.811 6.787 -24.476 1.00 0.00 H ATOM 679 HD12 LEU A 45 26.261 7.897 -25.755 1.00 0.00 H ATOM 680 HD13 LEU A 45 27.717 6.902 -26.004 1.00 0.00 H ATOM 681 H LEU A 45 24.880 10.318 -23.727 1.00 0.00 H ATOM 682 N GLU A 46 25.343 8.319 -20.536 1.00 18.10 N ATOM 683 CA GLU A 46 25.202 8.636 -19.101 1.00 17.40 C ATOM 684 C GLU A 46 25.967 7.545 -18.225 1.00 16.33 C ATOM 685 O GLU A 46 26.073 6.360 -18.559 1.00 15.35 O ATOM 686 CB GLU A 46 23.631 8.886 -18.855 1.00 22.30 C ATOM 687 CG GLU A 46 22.714 7.647 -19.025 1.00 26.86 C ATOM 688 CD GLU A 46 21.367 7.640 -19.901 1.00 28.82 C ATOM 689 OE1 GLU A 46 20.975 8.576 -20.714 1.00 28.56 O ATOM 690 OE2 GLU A 46 20.580 6.635 -19.808 1.00 32.39 O ATOM 691 HA GLU A 46 25.695 9.550 -18.769 1.00 0.00 H ATOM 692 HB2 GLU A 46 23.507 9.257 -17.838 1.00 0.00 H ATOM 693 HB3 GLU A 46 23.299 9.647 -19.561 1.00 0.00 H ATOM 694 HG2 GLU A 46 23.346 6.867 -19.449 1.00 0.00 H ATOM 695 HG3 GLU A 46 22.413 7.361 -18.017 1.00 0.00 H ATOM 696 H GLU A 46 24.843 7.526 -20.939 1.00 0.00 H ATOM 697 N GLU A 47 26.550 8.018 -17.106 1.00 14.83 N ATOM 698 CA GLU A 47 27.371 7.184 -16.186 1.00 14.07 C ATOM 699 C GLU A 47 28.233 6.219 -17.008 1.00 12.17 C ATOM 700 O GLU A 47 29.060 6.648 -17.840 1.00 10.88 O ATOM 701 CB GLU A 47 26.499 6.386 -15.218 1.00 15.01 C ATOM 702 CG GLU A 47 25.492 7.248 -14.460 1.00 20.19 C ATOM 703 CD GLU A 47 26.063 8.097 -13.324 1.00 21.53 C ATOM 704 OE1 GLU A 47 27.199 7.819 -12.763 1.00 22.54 O ATOM 705 OE2 GLU A 47 25.380 9.087 -12.946 1.00 17.57 O ATOM 706 HA GLU A 47 28.002 7.851 -15.599 1.00 0.00 H ATOM 707 HB2 GLU A 47 25.952 5.633 -15.785 1.00 0.00 H ATOM 708 HB3 GLU A 47 27.148 5.893 -14.494 1.00 0.00 H ATOM 709 HG2 GLU A 47 25.022 7.921 -15.177 1.00 0.00 H ATOM 710 HG3 GLU A 47 24.737 6.586 -14.036 1.00 0.00 H ATOM 711 H GLU A 47 26.421 9.003 -16.876 1.00 0.00 H ATOM 712 N ASN A 48 28.134 4.968 -16.615 1.00 10.15 N ATOM 713 CA ASN A 48 29.002 3.985 -17.358 1.00 11.94 C ATOM 714 C ASN A 48 28.112 3.061 -18.142 1.00 12.26 C ATOM 715 O ASN A 48 28.391 1.844 -18.280 1.00 15.98 O ATOM 716 CB ASN A 48 30.059 3.424 -16.368 1.00 10.00 C ATOM 717 CG ASN A 48 29.275 2.641 -15.316 1.00 10.00 C ATOM 718 OD1 ASN A 48 28.044 2.625 -15.403 1.00 12.55 O ATOM 719 ND2 ASN A 48 29.896 1.666 -14.699 1.00 12.77 N ATOM 720 HA ASN A 48 29.631 4.403 -18.144 1.00 0.00 H ATOM 721 HB2 ASN A 48 30.755 2.767 -16.889 1.00 0.00 H ATOM 722 HB3 ASN A 48 30.611 4.239 -15.901 1.00 0.00 H ATOM 723 HD22 ASN A 48 30.913 1.675 -14.625 1.00 0.00 H ATOM 724 HD21 ASN A 48 29.362 0.898 -14.293 1.00 0.00 H ATOM 725 H ASN A 48 27.512 4.682 -15.859 1.00 0.00 H ATOM 726 N TYR A 49 26.933 3.519 -18.485 1.00 11.68 N ATOM 727 CA TYR A 49 25.907 2.720 -19.202 1.00 11.72 C ATOM 728 C TYR A 49 26.198 2.447 -20.681 1.00 10.78 C ATOM 729 O TYR A 49 26.426 3.301 -21.548 1.00 11.14 O ATOM 730 CB TYR A 49 24.504 3.288 -18.887 1.00 10.00 C ATOM 731 CG TYR A 49 24.127 3.692 -17.479 1.00 11.36 C ATOM 732 CD1 TYR A 49 24.475 2.922 -16.369 1.00 11.12 C ATOM 733 CD2 TYR A 49 23.417 4.876 -17.194 1.00 10.69 C ATOM 734 CE1 TYR A 49 24.001 3.183 -15.049 1.00 10.00 C ATOM 735 CE2 TYR A 49 22.910 5.186 -15.914 1.00 10.00 C ATOM 736 CZ TYR A 49 23.229 4.311 -14.842 1.00 10.89 C ATOM 737 OH TYR A 49 22.896 4.587 -13.568 1.00 11.11 O ATOM 738 HA TYR A 49 25.944 1.703 -18.812 1.00 0.00 H ATOM 739 HB3 TYR A 49 23.785 2.529 -19.195 1.00 0.00 H ATOM 740 HB2 TYR A 49 24.382 4.175 -19.508 1.00 0.00 H ATOM 741 HD2 TYR A 49 23.251 5.588 -18.003 1.00 0.00 H ATOM 742 HE2 TYR A 49 22.293 6.070 -15.753 1.00 0.00 H ATOM 743 HE1 TYR A 49 24.241 2.511 -14.225 1.00 0.00 H ATOM 744 HD1 TYR A 49 25.145 2.075 -16.518 1.00 0.00 H ATOM 745 HH TYR A 49 23.199 3.876 -12.998 1.00 0.00 H ATOM 746 H TYR A 49 26.706 4.484 -18.245 1.00 0.00 H ATOM 747 N CYS A 50 26.075 1.121 -21.040 1.00 12.01 N ATOM 748 CA CYS A 50 26.182 0.644 -22.431 1.00 11.27 C ATOM 749 C CYS A 50 25.260 1.411 -23.383 1.00 11.71 C ATOM 750 O CYS A 50 24.014 1.510 -23.206 1.00 11.04 O ATOM 751 CB CYS A 50 25.836 -0.840 -22.527 1.00 10.00 C ATOM 752 SG CYS A 50 26.974 -1.848 -21.517 1.00 14.21 S ATOM 753 HA CYS A 50 27.217 0.813 -22.728 1.00 0.00 H ATOM 754 HB2 CYS A 50 25.909 -1.156 -23.568 1.00 0.00 H ATOM 755 HB3 CYS A 50 24.816 -0.992 -22.173 1.00 0.00 H ATOM 756 H CYS A 50 25.901 0.435 -20.305 1.00 0.00 H ATOM 757 N ARG A 51 25.873 1.918 -24.482 1.00 11.25 N ATOM 758 CA ARG A 51 25.211 2.624 -25.562 1.00 10.90 C ATOM 759 C ARG A 51 25.793 2.208 -26.945 1.00 12.13 C ATOM 760 O ARG A 51 26.845 1.506 -27.064 1.00 13.53 O ATOM 761 CB ARG A 51 25.283 4.137 -25.370 1.00 10.00 C ATOM 762 CG ARG A 51 24.831 4.662 -24.011 1.00 12.25 C ATOM 763 CD ARG A 51 23.280 4.659 -24.064 1.00 10.00 C ATOM 764 NE ARG A 51 22.797 5.283 -22.856 1.00 10.00 N ATOM 765 CZ ARG A 51 22.349 4.510 -21.836 1.00 12.96 C ATOM 766 NH1 ARG A 51 22.405 3.153 -21.785 1.00 10.00 N ATOM 767 NH2 ARG A 51 21.832 5.071 -20.759 1.00 10.00 N ATOM 768 HA ARG A 51 24.159 2.340 -25.541 1.00 0.00 H ATOM 769 HB2 ARG A 51 26.319 4.443 -25.518 1.00 0.00 H ATOM 770 HB3 ARG A 51 24.656 4.600 -26.132 1.00 0.00 H ATOM 771 HG2 ARG A 51 25.187 4.011 -23.213 1.00 0.00 H ATOM 772 HG3 ARG A 51 25.206 5.673 -23.848 1.00 0.00 H ATOM 773 HD2 ARG A 51 22.913 3.635 -24.125 1.00 0.00 H ATOM 774 HD3 ARG A 51 22.937 5.219 -24.934 1.00 0.00 H ATOM 775 HE ARG A 51 22.793 6.299 -22.770 1.00 0.00 H ATOM 776 HH12 ARG A 51 22.040 2.658 -20.971 1.00 0.00 H ATOM 777 HH11 ARG A 51 22.812 2.630 -22.560 1.00 0.00 H ATOM 778 HH22 ARG A 51 21.495 4.489 -19.992 1.00 0.00 H ATOM 779 HH21 ARG A 51 21.769 6.087 -20.693 1.00 0.00 H ATOM 780 H ARG A 51 26.883 1.792 -24.555 1.00 0.00 H ATOM 781 N ASN A 52 25.299 2.786 -27.972 1.00 12.09 N ATOM 782 CA ASN A 52 25.658 2.571 -29.386 1.00 12.51 C ATOM 783 C ASN A 52 25.688 3.924 -30.113 1.00 13.14 C ATOM 784 O ASN A 52 24.845 4.206 -30.991 1.00 14.88 O ATOM 785 CB ASN A 52 24.651 1.690 -30.086 1.00 11.42 C ATOM 786 CG ASN A 52 25.259 0.887 -31.229 1.00 10.00 C ATOM 787 OD1 ASN A 52 26.407 1.317 -31.502 1.00 10.00 O ATOM 788 ND2 ASN A 52 24.593 -0.162 -31.642 1.00 10.00 N ATOM 789 HA ASN A 52 26.634 2.086 -29.410 1.00 0.00 H ATOM 790 HB2 ASN A 52 24.230 0.996 -29.358 1.00 0.00 H ATOM 791 HB3 ASN A 52 23.857 2.320 -30.487 1.00 0.00 H ATOM 792 HD22 ASN A 52 23.651 -0.338 -31.292 1.00 0.00 H ATOM 793 HD21 ASN A 52 25.016 -0.803 -32.314 1.00 0.00 H ATOM 794 H ASN A 52 24.571 3.477 -27.793 1.00 0.00 H ATOM 795 N PRO A 53 26.622 4.763 -29.685 1.00 14.06 N ATOM 796 CA PRO A 53 26.670 6.132 -30.251 1.00 15.02 C ATOM 797 C PRO A 53 26.919 6.163 -31.789 1.00 15.83 C ATOM 798 O PRO A 53 26.564 7.223 -32.395 1.00 17.39 O ATOM 799 CB PRO A 53 27.788 6.814 -29.515 1.00 13.73 C ATOM 800 CG PRO A 53 28.532 5.773 -28.775 1.00 13.68 C ATOM 801 CD PRO A 53 27.684 4.533 -28.740 1.00 13.59 C ATOM 802 HA PRO A 53 25.708 6.628 -30.124 1.00 0.00 H ATOM 803 HD3 PRO A 53 28.271 3.662 -29.031 1.00 0.00 H ATOM 804 HD2 PRO A 53 27.277 4.378 -27.741 1.00 0.00 H ATOM 805 HG3 PRO A 53 28.733 6.113 -27.759 1.00 0.00 H ATOM 806 HG2 PRO A 53 29.475 5.563 -29.280 1.00 0.00 H ATOM 807 HB2 PRO A 53 28.450 7.313 -30.223 1.00 0.00 H ATOM 808 HB3 PRO A 53 27.382 7.548 -28.819 1.00 0.00 H ATOM 809 N ASP A 54 27.376 5.061 -32.321 1.00 15.99 N ATOM 810 CA ASP A 54 27.740 4.947 -33.744 1.00 15.10 C ATOM 811 C ASP A 54 26.915 3.885 -34.453 1.00 16.89 C ATOM 812 O ASP A 54 27.233 3.689 -35.662 1.00 14.74 O ATOM 813 CB ASP A 54 29.218 4.703 -33.896 1.00 14.34 C ATOM 814 CG ASP A 54 29.753 3.427 -33.274 1.00 15.18 C ATOM 815 OD1 ASP A 54 29.050 2.846 -32.393 1.00 12.55 O ATOM 816 OD2 ASP A 54 30.857 3.082 -33.728 1.00 12.54 O ATOM 817 HA ASP A 54 27.508 5.896 -34.227 1.00 0.00 H ATOM 818 HB2 ASP A 54 29.443 4.673 -34.962 1.00 0.00 H ATOM 819 HB3 ASP A 54 29.743 5.542 -33.439 1.00 0.00 H ATOM 820 H ASP A 54 27.486 4.242 -31.724 1.00 0.00 H ATOM 821 N ASN A 55 25.848 3.433 -33.751 1.00 15.20 N ATOM 822 CA ASN A 55 25.047 2.418 -34.482 1.00 16.74 C ATOM 823 C ASN A 55 25.845 1.256 -34.996 1.00 16.90 C ATOM 824 O ASN A 55 25.773 0.895 -36.250 1.00 17.78 O ATOM 825 CB ASN A 55 24.341 3.227 -35.625 1.00 18.90 C ATOM 826 CG ASN A 55 23.159 2.494 -36.172 1.00 17.72 C ATOM 827 OD1 ASN A 55 23.238 1.921 -37.293 1.00 23.50 O ATOM 828 ND2 ASN A 55 22.125 2.220 -35.423 1.00 17.73 N ATOM 829 HA ASN A 55 24.334 1.930 -33.817 1.00 0.00 H ATOM 830 HB2 ASN A 55 24.009 4.186 -35.227 1.00 0.00 H ATOM 831 HB3 ASN A 55 25.055 3.397 -36.431 1.00 0.00 H ATOM 832 HD22 ASN A 55 22.025 2.663 -34.510 1.00 0.00 H ATOM 833 HD21 ASN A 55 21.417 1.563 -35.751 1.00 0.00 H ATOM 834 H ASN A 55 25.617 3.758 -32.812 1.00 0.00 H ATOM 835 N ASP A 56 26.618 0.668 -34.124 1.00 15.86 N ATOM 836 CA ASP A 56 27.444 -0.528 -34.555 1.00 16.30 C ATOM 837 C ASP A 56 26.471 -1.655 -34.685 1.00 17.05 C ATOM 838 O ASP A 56 25.574 -1.744 -33.809 1.00 17.87 O ATOM 839 CB ASP A 56 28.613 -0.639 -33.596 1.00 15.38 C ATOM 840 CG ASP A 56 29.541 -1.825 -33.737 1.00 15.62 C ATOM 841 OD1 ASP A 56 29.178 -2.903 -34.229 1.00 15.25 O ATOM 842 OD2 ASP A 56 30.698 -1.775 -33.297 1.00 17.90 O ATOM 843 HA ASP A 56 27.940 -0.483 -35.524 1.00 0.00 H ATOM 844 HB2 ASP A 56 29.217 0.261 -33.716 1.00 0.00 H ATOM 845 HB3 ASP A 56 28.202 -0.667 -32.587 1.00 0.00 H ATOM 846 H ASP A 56 26.666 1.009 -33.164 1.00 0.00 H ATOM 847 N PRO A 57 26.440 -2.398 -35.805 1.00 17.78 N ATOM 848 CA PRO A 57 25.469 -3.528 -35.952 1.00 15.34 C ATOM 849 C PRO A 57 25.659 -4.485 -34.781 1.00 15.31 C ATOM 850 O PRO A 57 24.730 -5.251 -34.445 1.00 13.51 O ATOM 851 CB PRO A 57 25.759 -4.214 -37.302 1.00 15.52 C ATOM 852 CG PRO A 57 26.929 -3.489 -37.854 1.00 14.80 C ATOM 853 CD PRO A 57 27.382 -2.371 -36.930 1.00 15.56 C ATOM 854 HA PRO A 57 24.434 -3.186 -35.942 1.00 0.00 H ATOM 855 HD3 PRO A 57 28.399 -2.551 -36.582 1.00 0.00 H ATOM 856 HD2 PRO A 57 27.339 -1.410 -37.442 1.00 0.00 H ATOM 857 HG3 PRO A 57 26.658 -3.062 -38.819 1.00 0.00 H ATOM 858 HG2 PRO A 57 27.751 -4.193 -37.987 1.00 0.00 H ATOM 859 HB2 PRO A 57 25.995 -5.268 -37.154 1.00 0.00 H ATOM 860 HB3 PRO A 57 24.902 -4.125 -37.970 1.00 0.00 H ATOM 861 N GLN A 58 26.889 -4.411 -34.279 1.00 14.73 N ATOM 862 CA GLN A 58 27.140 -5.264 -33.105 1.00 15.55 C ATOM 863 C GLN A 58 26.333 -4.967 -31.808 1.00 15.37 C ATOM 864 O GLN A 58 26.608 -5.776 -30.827 1.00 11.84 O ATOM 865 CB GLN A 58 28.681 -5.273 -32.812 1.00 15.06 C ATOM 866 CG GLN A 58 29.180 -6.445 -33.646 1.00 18.51 C ATOM 867 CD GLN A 58 30.539 -6.917 -33.203 1.00 19.95 C ATOM 868 OE1 GLN A 58 30.600 -7.722 -32.288 1.00 21.01 O ATOM 869 NE2 GLN A 58 31.573 -6.514 -33.934 1.00 16.55 N ATOM 870 HA GLN A 58 26.763 -6.246 -33.392 1.00 0.00 H ATOM 871 HB2 GLN A 58 29.146 -4.340 -33.129 1.00 0.00 H ATOM 872 HB3 GLN A 58 28.878 -5.434 -31.752 1.00 0.00 H ATOM 873 HG2 GLN A 58 28.473 -7.270 -33.552 1.00 0.00 H ATOM 874 HG3 GLN A 58 29.238 -6.135 -34.689 1.00 0.00 H ATOM 875 HE22 GLN A 58 31.435 -5.835 -34.683 1.00 0.00 H ATOM 876 HE21 GLN A 58 32.505 -6.883 -33.746 1.00 0.00 H ATOM 877 H GLN A 58 27.607 -3.807 -34.679 1.00 0.00 H ATOM 878 N GLY A 59 25.793 -3.757 -31.660 1.00 13.83 N ATOM 879 CA GLY A 59 25.048 -3.430 -30.438 1.00 13.58 C ATOM 880 C GLY A 59 25.827 -2.622 -29.434 1.00 13.91 C ATOM 881 O GLY A 59 26.943 -2.152 -29.756 1.00 15.30 O ATOM 882 HA3 GLY A 59 24.744 -4.363 -29.963 1.00 0.00 H ATOM 883 HA2 GLY A 59 24.162 -2.862 -30.720 1.00 0.00 H ATOM 884 H GLY A 59 25.898 -3.058 -32.396 1.00 0.00 H ATOM 885 N PRO A 60 25.141 -2.199 -28.346 1.00 13.90 N ATOM 886 CA PRO A 60 25.750 -1.441 -27.268 1.00 13.14 C ATOM 887 C PRO A 60 27.109 -1.956 -26.847 1.00 13.00 C ATOM 888 O PRO A 60 27.426 -3.135 -26.973 1.00 13.06 O ATOM 889 CB PRO A 60 24.748 -1.400 -26.145 1.00 13.07 C ATOM 890 CG PRO A 60 23.417 -1.828 -26.743 1.00 12.94 C ATOM 891 CD PRO A 60 23.757 -2.596 -28.031 1.00 13.55 C ATOM 892 HA PRO A 60 25.976 -0.431 -27.609 1.00 0.00 H ATOM 893 HD3 PRO A 60 23.693 -3.672 -27.866 1.00 0.00 H ATOM 894 HD2 PRO A 60 23.082 -2.312 -28.838 1.00 0.00 H ATOM 895 HG3 PRO A 60 22.807 -0.955 -26.973 1.00 0.00 H ATOM 896 HG2 PRO A 60 22.879 -2.473 -26.048 1.00 0.00 H ATOM 897 HB2 PRO A 60 25.043 -2.086 -25.351 1.00 0.00 H ATOM 898 HB3 PRO A 60 24.674 -0.390 -25.742 1.00 0.00 H ATOM 899 N TRP A 61 27.900 -1.000 -26.432 1.00 12.91 N ATOM 900 CA TRP A 61 29.264 -1.232 -25.916 1.00 12.09 C ATOM 901 C TRP A 61 29.701 -0.103 -24.978 1.00 10.25 C ATOM 902 O TRP A 61 28.910 0.850 -24.707 1.00 10.00 O ATOM 903 CB TRP A 61 30.156 -1.385 -27.215 1.00 14.44 C ATOM 904 CG TRP A 61 29.961 -0.171 -28.108 1.00 12.55 C ATOM 905 CD1 TRP A 61 29.042 -0.006 -29.097 1.00 13.76 C ATOM 906 CD2 TRP A 61 30.671 1.063 -28.037 1.00 14.58 C ATOM 907 NE1 TRP A 61 29.094 1.230 -29.598 1.00 12.49 N ATOM 908 CE2 TRP A 61 30.105 1.924 -29.003 1.00 13.17 C ATOM 909 CE3 TRP A 61 31.790 1.488 -27.284 1.00 13.23 C ATOM 910 CZ2 TRP A 61 30.589 3.204 -29.163 1.00 15.33 C ATOM 911 CZ3 TRP A 61 32.275 2.737 -27.484 1.00 14.19 C ATOM 912 CH2 TRP A 61 31.717 3.602 -28.398 1.00 13.67 C ATOM 913 HA TRP A 61 29.348 -2.123 -25.293 1.00 0.00 H ATOM 914 HB2 TRP A 61 31.205 -1.462 -26.929 1.00 0.00 H ATOM 915 HB3 TRP A 61 29.861 -2.285 -27.755 1.00 0.00 H ATOM 916 HE1 TRP A 61 28.472 1.599 -30.317 1.00 0.00 H ATOM 917 HD1 TRP A 61 28.354 -0.781 -29.436 1.00 0.00 H ATOM 918 HZ2 TRP A 61 30.117 3.895 -29.861 1.00 0.00 H ATOM 919 HH2 TRP A 61 32.143 4.596 -28.535 1.00 0.00 H ATOM 920 HZ3 TRP A 61 33.135 3.068 -26.902 1.00 0.00 H ATOM 921 HE3 TRP A 61 32.254 0.823 -26.556 1.00 0.00 H ATOM 922 H TRP A 61 27.555 -0.041 -26.467 1.00 0.00 H ATOM 923 N CYS A 62 30.974 -0.219 -24.538 1.00 10.00 N ATOM 924 CA CYS A 62 31.548 0.781 -23.674 1.00 10.00 C ATOM 925 C CYS A 62 33.073 0.723 -23.634 1.00 10.63 C ATOM 926 O CYS A 62 33.603 -0.372 -23.924 1.00 10.24 O ATOM 927 CB CYS A 62 31.041 0.557 -22.220 1.00 10.00 C ATOM 928 SG CYS A 62 31.530 -0.987 -21.345 1.00 11.00 S ATOM 929 HA CYS A 62 31.244 1.749 -24.073 1.00 0.00 H ATOM 930 HB2 CYS A 62 29.952 0.577 -22.252 1.00 0.00 H ATOM 931 HB3 CYS A 62 31.401 1.394 -21.621 1.00 0.00 H ATOM 932 H CYS A 62 31.534 -1.023 -24.821 1.00 0.00 H ATOM 933 N TYR A 63 33.692 1.834 -23.238 1.00 11.52 N ATOM 934 CA TYR A 63 35.105 1.871 -22.920 1.00 11.41 C ATOM 935 C TYR A 63 35.090 1.290 -21.462 1.00 11.95 C ATOM 936 O TYR A 63 34.373 1.725 -20.578 1.00 11.09 O ATOM 937 CB TYR A 63 35.787 3.226 -22.903 1.00 14.02 C ATOM 938 CG TYR A 63 35.704 4.024 -24.185 1.00 15.07 C ATOM 939 CD1 TYR A 63 36.507 3.602 -25.261 1.00 13.82 C ATOM 940 CD2 TYR A 63 34.673 4.998 -24.403 1.00 13.96 C ATOM 941 CE1 TYR A 63 36.365 4.285 -26.467 1.00 13.32 C ATOM 942 CE2 TYR A 63 34.614 5.720 -25.634 1.00 11.98 C ATOM 943 CZ TYR A 63 35.426 5.262 -26.668 1.00 12.96 C ATOM 944 OH TYR A 63 35.347 5.866 -27.949 1.00 14.43 O ATOM 945 HA TYR A 63 35.673 1.343 -23.685 1.00 0.00 H ATOM 946 HB3 TYR A 63 36.841 3.067 -22.676 1.00 0.00 H ATOM 947 HB2 TYR A 63 35.332 3.819 -22.110 1.00 0.00 H ATOM 948 HD2 TYR A 63 33.932 5.188 -23.626 1.00 0.00 H ATOM 949 HE2 TYR A 63 33.965 6.587 -25.758 1.00 0.00 H ATOM 950 HE1 TYR A 63 37.033 4.030 -27.290 1.00 0.00 H ATOM 951 HD1 TYR A 63 37.210 2.776 -25.155 1.00 0.00 H ATOM 952 HH TYR A 63 35.967 5.437 -28.543 1.00 0.00 H ATOM 953 H TYR A 63 33.149 2.694 -23.155 1.00 0.00 H ATOM 954 N THR A 64 35.755 0.236 -21.216 1.00 13.43 N ATOM 955 CA THR A 64 35.985 -0.721 -20.139 1.00 12.51 C ATOM 956 C THR A 64 37.008 -0.222 -19.158 1.00 11.51 C ATOM 957 O THR A 64 37.914 0.424 -19.697 1.00 10.27 O ATOM 958 CB THR A 64 36.724 -1.979 -20.827 1.00 10.73 C ATOM 959 OG1 THR A 64 35.726 -2.623 -21.624 1.00 15.04 O ATOM 960 CG2 THR A 64 37.612 -2.739 -19.952 1.00 10.31 C ATOM 961 HA THR A 64 35.035 -0.922 -19.644 1.00 0.00 H ATOM 962 HB THR A 64 37.525 -1.700 -21.512 1.00 0.00 H ATOM 963 HG1 THR A 64 36.111 -3.386 -22.062 1.00 0.00 H ATOM 964 HG23 THR A 64 38.290 -2.055 -19.441 1.00 0.00 H ATOM 965 HG21 THR A 64 37.018 -3.281 -19.216 1.00 0.00 H ATOM 966 HG22 THR A 64 38.189 -3.447 -20.548 1.00 0.00 H ATOM 967 H THR A 64 36.305 -0.025 -22.034 1.00 0.00 H ATOM 968 N THR A 65 36.922 -0.763 -17.917 1.00 11.70 N ATOM 969 CA THR A 65 37.984 -0.288 -16.973 1.00 14.83 C ATOM 970 C THR A 65 39.265 -1.047 -17.096 1.00 15.78 C ATOM 971 O THR A 65 40.054 -1.120 -16.143 1.00 17.37 O ATOM 972 CB THR A 65 37.371 -0.280 -15.510 1.00 14.94 C ATOM 973 OG1 THR A 65 36.919 -1.673 -15.408 1.00 17.84 O ATOM 974 CG2 THR A 65 36.214 0.735 -15.483 1.00 14.46 C ATOM 975 HA THR A 65 38.279 0.729 -17.233 1.00 0.00 H ATOM 976 HB THR A 65 38.030 0.009 -14.692 1.00 0.00 H ATOM 977 HG1 THR A 65 36.276 -1.851 -16.098 1.00 0.00 H ATOM 978 HG23 THR A 65 36.616 1.745 -15.562 1.00 0.00 H ATOM 979 HG21 THR A 65 35.544 0.543 -16.321 1.00 0.00 H ATOM 980 HG22 THR A 65 35.665 0.633 -14.547 1.00 0.00 H ATOM 981 H THR A 65 36.200 -1.432 -17.651 1.00 0.00 H ATOM 982 N ASP A 66 39.373 -1.975 -18.045 1.00 17.75 N ATOM 983 CA ASP A 66 40.602 -2.750 -18.283 1.00 16.55 C ATOM 984 C ASP A 66 41.443 -1.835 -19.204 1.00 16.12 C ATOM 985 O ASP A 66 41.001 -1.418 -20.262 1.00 15.88 O ATOM 986 CB ASP A 66 40.296 -4.152 -18.802 1.00 17.31 C ATOM 987 CG ASP A 66 41.546 -4.952 -19.102 1.00 17.21 C ATOM 988 OD1 ASP A 66 42.614 -4.425 -18.798 1.00 16.92 O ATOM 989 OD2 ASP A 66 41.615 -6.044 -19.665 1.00 20.16 O ATOM 990 HA ASP A 66 41.173 -2.981 -17.384 1.00 0.00 H ATOM 991 HB2 ASP A 66 39.714 -4.683 -18.049 1.00 0.00 H ATOM 992 HB3 ASP A 66 39.710 -4.065 -19.717 1.00 0.00 H ATOM 993 H ASP A 66 38.563 -2.158 -18.637 1.00 0.00 H ATOM 994 N PRO A 67 42.603 -1.418 -18.696 1.00 16.09 N ATOM 995 CA PRO A 67 43.433 -0.518 -19.492 1.00 15.28 C ATOM 996 C PRO A 67 43.810 -1.163 -20.841 1.00 15.78 C ATOM 997 O PRO A 67 43.901 -0.440 -21.833 1.00 15.71 O ATOM 998 CB PRO A 67 44.523 -0.058 -18.531 1.00 16.13 C ATOM 999 CG PRO A 67 44.311 -0.750 -17.244 1.00 15.77 C ATOM 1000 CD PRO A 67 43.099 -1.704 -17.353 1.00 15.67 C ATOM 1001 HA PRO A 67 42.950 0.386 -19.863 1.00 0.00 H ATOM 1002 HD3 PRO A 67 43.405 -2.746 -17.258 1.00 0.00 H ATOM 1003 HD2 PRO A 67 42.347 -1.477 -16.597 1.00 0.00 H ATOM 1004 HG3 PRO A 67 44.122 -0.013 -16.464 1.00 0.00 H ATOM 1005 HG2 PRO A 67 45.202 -1.325 -16.991 1.00 0.00 H ATOM 1006 HB2 PRO A 67 45.504 -0.313 -18.933 1.00 0.00 H ATOM 1007 HB3 PRO A 67 44.460 1.021 -18.387 1.00 0.00 H ATOM 1008 N GLU A 68 43.955 -2.437 -20.982 1.00 15.35 N ATOM 1009 CA GLU A 68 44.388 -3.275 -22.041 1.00 16.61 C ATOM 1010 C GLU A 68 43.334 -3.800 -22.998 1.00 15.41 C ATOM 1011 O GLU A 68 43.606 -4.632 -23.823 1.00 16.00 O ATOM 1012 CB GLU A 68 45.112 -4.522 -21.507 1.00 18.12 C ATOM 1013 CG GLU A 68 46.594 -4.387 -21.129 1.00 22.52 C ATOM 1014 CD GLU A 68 46.697 -3.996 -19.630 1.00 25.60 C ATOM 1015 OE1 GLU A 68 46.202 -4.883 -18.907 1.00 23.16 O ATOM 1016 OE2 GLU A 68 47.111 -2.928 -19.208 1.00 25.23 O ATOM 1017 HA GLU A 68 45.027 -2.592 -22.600 1.00 0.00 H ATOM 1018 HB2 GLU A 68 44.578 -4.850 -20.615 1.00 0.00 H ATOM 1019 HB3 GLU A 68 45.042 -5.292 -22.275 1.00 0.00 H ATOM 1020 HG2 GLU A 68 47.102 -5.337 -21.296 1.00 0.00 H ATOM 1021 HG3 GLU A 68 47.059 -3.615 -21.742 1.00 0.00 H ATOM 1022 H GLU A 68 43.701 -2.959 -20.143 1.00 0.00 H ATOM 1023 N LYS A 69 42.178 -3.276 -22.856 1.00 15.98 N ATOM 1024 CA LYS A 69 40.909 -3.460 -23.476 1.00 16.69 C ATOM 1025 C LYS A 69 40.117 -2.169 -23.562 1.00 16.49 C ATOM 1026 O LYS A 69 39.267 -1.733 -22.703 1.00 18.04 O ATOM 1027 CB LYS A 69 40.268 -4.557 -22.594 1.00 18.63 C ATOM 1028 CG LYS A 69 38.731 -4.499 -22.757 1.00 21.27 C ATOM 1029 CD LYS A 69 38.468 -5.125 -24.144 1.00 18.00 C ATOM 1030 CE LYS A 69 37.456 -6.295 -23.982 1.00 20.48 C ATOM 1031 NZ LYS A 69 38.080 -7.364 -24.897 1.00 19.27 N ATOM 1032 HA LYS A 69 40.959 -3.759 -24.523 1.00 0.00 H ATOM 1033 HB2 LYS A 69 40.632 -5.536 -22.905 1.00 0.00 H ATOM 1034 HB3 LYS A 69 40.532 -4.388 -21.550 1.00 0.00 H ATOM 1035 HG2 LYS A 69 38.238 -5.075 -21.974 1.00 0.00 H ATOM 1036 HG3 LYS A 69 38.378 -3.468 -22.725 1.00 0.00 H ATOM 1037 HD2 LYS A 69 38.053 -4.372 -24.814 1.00 0.00 H ATOM 1038 HD3 LYS A 69 39.402 -5.503 -24.559 1.00 0.00 H ATOM 1039 HE2 LYS A 69 36.460 -6.011 -24.322 1.00 0.00 H ATOM 1040 HE3 LYS A 69 37.403 -6.636 -22.948 1.00 0.00 H ATOM 1041 HZ1 LYS A 69 38.134 -7.004 -25.850 1.00 0.00 H ATOM 1042 HZ2 LYS A 69 39.017 -7.590 -24.564 1.00 0.00 H ATOM 1043 HZ3 LYS A 69 37.501 -8.203 -24.881 1.00 0.00 H ATOM 1044 H LYS A 69 42.159 -2.560 -22.130 1.00 0.00 H ATOM 1045 N ARG A 70 40.294 -1.472 -24.673 1.00 14.86 N ATOM 1046 CA ARG A 70 39.659 -0.149 -24.896 1.00 14.15 C ATOM 1047 C ARG A 70 38.175 -0.136 -24.839 1.00 12.94 C ATOM 1048 O ARG A 70 37.606 0.781 -24.158 1.00 12.75 O ATOM 1049 CB ARG A 70 40.170 0.595 -26.168 1.00 12.37 C ATOM 1050 CG ARG A 70 39.750 2.051 -26.341 1.00 14.26 C ATOM 1051 CD ARG A 70 40.210 2.746 -27.654 1.00 13.27 C ATOM 1052 NE ARG A 70 39.653 4.110 -27.654 1.00 14.72 N ATOM 1053 CZ ARG A 70 39.884 5.167 -26.930 1.00 17.26 C ATOM 1054 NH1 ARG A 70 40.775 5.315 -25.931 1.00 17.44 N ATOM 1055 NH2 ARG A 70 39.198 6.320 -27.217 1.00 19.60 N ATOM 1056 HA ARG A 70 39.997 0.414 -24.026 1.00 0.00 H ATOM 1057 HB2 ARG A 70 41.259 0.568 -26.148 1.00 0.00 H ATOM 1058 HB3 ARG A 70 39.810 0.044 -27.037 1.00 0.00 H ATOM 1059 HG2 ARG A 70 38.661 2.090 -26.307 1.00 0.00 H ATOM 1060 HG3 ARG A 70 40.158 2.617 -25.504 1.00 0.00 H ATOM 1061 HD2 ARG A 70 39.840 2.193 -28.517 1.00 0.00 H ATOM 1062 HD3 ARG A 70 41.299 2.789 -27.691 1.00 0.00 H ATOM 1063 HE ARG A 70 38.940 4.256 -28.368 1.00 0.00 H ATOM 1064 HH12 ARG A 70 40.851 6.208 -25.444 1.00 0.00 H ATOM 1065 HH11 ARG A 70 41.374 4.534 -25.662 1.00 0.00 H ATOM 1066 HH22 ARG A 70 39.361 7.162 -26.664 1.00 0.00 H ATOM 1067 HH21 ARG A 70 38.525 6.336 -27.983 1.00 0.00 H ATOM 1068 H ARG A 70 40.890 -1.859 -25.405 1.00 0.00 H ATOM 1069 N TYR A 71 37.510 -0.992 -25.572 1.00 14.18 N ATOM 1070 CA TYR A 71 36.047 -1.118 -25.486 1.00 13.58 C ATOM 1071 C TYR A 71 35.701 -2.607 -25.759 1.00 14.84 C ATOM 1072 O TYR A 71 36.624 -3.334 -26.168 1.00 14.09 O ATOM 1073 CB TYR A 71 35.318 -0.156 -26.413 1.00 18.38 C ATOM 1074 CG TYR A 71 35.253 -0.702 -27.847 1.00 21.75 C ATOM 1075 CD1 TYR A 71 36.387 -0.843 -28.646 1.00 22.74 C ATOM 1076 CD2 TYR A 71 34.097 -1.363 -28.220 1.00 21.89 C ATOM 1077 CE1 TYR A 71 36.311 -1.448 -29.897 1.00 23.88 C ATOM 1078 CE2 TYR A 71 33.991 -1.956 -29.456 1.00 23.05 C ATOM 1079 CZ TYR A 71 35.082 -1.952 -30.275 1.00 23.76 C ATOM 1080 OH TYR A 71 34.901 -2.556 -31.506 1.00 29.97 O ATOM 1081 HA TYR A 71 35.702 -0.834 -24.492 1.00 0.00 H ATOM 1082 HB3 TYR A 71 35.845 0.798 -26.420 1.00 0.00 H ATOM 1083 HB2 TYR A 71 34.303 -0.007 -26.043 1.00 0.00 H ATOM 1084 HD2 TYR A 71 33.259 -1.415 -27.525 1.00 0.00 H ATOM 1085 HE2 TYR A 71 33.057 -2.419 -29.774 1.00 0.00 H ATOM 1086 HE1 TYR A 71 37.182 -1.521 -30.549 1.00 0.00 H ATOM 1087 HD1 TYR A 71 37.347 -0.474 -28.285 1.00 0.00 H ATOM 1088 HH TYR A 71 34.201 -2.105 -31.983 1.00 0.00 H ATOM 1089 H TYR A 71 38.021 -1.589 -26.222 1.00 0.00 H ATOM 1090 N ASP A 72 34.461 -2.942 -25.607 1.00 14.36 N ATOM 1091 CA ASP A 72 33.826 -4.234 -25.744 1.00 16.01 C ATOM 1092 C ASP A 72 32.277 -4.036 -25.630 1.00 15.95 C ATOM 1093 O ASP A 72 31.660 -3.080 -25.061 1.00 16.67 O ATOM 1094 CB ASP A 72 34.520 -5.173 -24.753 1.00 18.51 C ATOM 1095 CG ASP A 72 34.202 -6.638 -24.920 1.00 20.43 C ATOM 1096 OD1 ASP A 72 33.806 -6.951 -26.079 1.00 20.63 O ATOM 1097 OD2 ASP A 72 34.397 -7.474 -24.040 1.00 20.34 O ATOM 1098 HA ASP A 72 33.942 -4.718 -26.714 1.00 0.00 H ATOM 1099 HB2 ASP A 72 35.597 -5.047 -24.867 1.00 0.00 H ATOM 1100 HB3 ASP A 72 34.226 -4.877 -23.746 1.00 0.00 H ATOM 1101 H ASP A 72 33.835 -2.178 -25.351 1.00 0.00 H ATOM 1102 N TYR A 73 31.588 -4.983 -26.246 1.00 14.10 N ATOM 1103 CA TYR A 73 30.163 -5.089 -26.416 1.00 14.59 C ATOM 1104 C TYR A 73 29.493 -5.650 -25.179 1.00 14.34 C ATOM 1105 O TYR A 73 30.158 -6.383 -24.491 1.00 12.55 O ATOM 1106 CB TYR A 73 29.800 -5.939 -27.681 1.00 14.18 C ATOM 1107 CG TYR A 73 30.341 -5.215 -28.929 1.00 12.03 C ATOM 1108 CD1 TYR A 73 29.681 -4.213 -29.595 1.00 10.00 C ATOM 1109 CD2 TYR A 73 31.614 -5.661 -29.354 1.00 11.79 C ATOM 1110 CE1 TYR A 73 30.356 -3.529 -30.633 1.00 13.27 C ATOM 1111 CE2 TYR A 73 32.225 -5.070 -30.478 1.00 11.78 C ATOM 1112 CZ TYR A 73 31.576 -4.049 -31.144 1.00 12.75 C ATOM 1113 OH TYR A 73 32.269 -3.458 -32.148 1.00 10.22 O ATOM 1114 HA TYR A 73 29.783 -4.079 -26.569 1.00 0.00 H ATOM 1115 HB3 TYR A 73 28.718 -6.043 -27.756 1.00 0.00 H ATOM 1116 HB2 TYR A 73 30.254 -6.927 -27.603 1.00 0.00 H ATOM 1117 HD2 TYR A 73 32.121 -6.460 -28.813 1.00 0.00 H ATOM 1118 HE2 TYR A 73 33.201 -5.416 -30.819 1.00 0.00 H ATOM 1119 HE1 TYR A 73 29.942 -2.606 -31.040 1.00 0.00 H ATOM 1120 HD1 TYR A 73 28.657 -3.949 -29.329 1.00 0.00 H ATOM 1121 HH TYR A 73 31.732 -2.767 -32.542 1.00 0.00 H ATOM 1122 H TYR A 73 32.140 -5.737 -26.654 1.00 0.00 H ATOM 1123 N CYS A 74 28.322 -5.115 -24.919 1.00 15.70 N ATOM 1124 CA CYS A 74 27.465 -5.538 -23.777 1.00 17.16 C ATOM 1125 C CYS A 74 26.394 -6.474 -24.297 1.00 19.94 C ATOM 1126 O CYS A 74 26.045 -6.572 -25.524 1.00 22.05 O ATOM 1127 CB CYS A 74 26.822 -4.369 -23.075 1.00 12.49 C ATOM 1128 SG CYS A 74 27.997 -3.038 -22.796 1.00 13.38 S ATOM 1129 HA CYS A 74 28.099 -6.039 -23.045 1.00 0.00 H ATOM 1130 HB2 CYS A 74 26.432 -4.704 -22.114 1.00 0.00 H ATOM 1131 HB3 CYS A 74 26.002 -3.995 -23.688 1.00 0.00 H ATOM 1132 H CYS A 74 27.982 -4.372 -25.530 1.00 0.00 H ATOM 1133 N ASP A 75 25.805 -7.233 -23.391 1.00 21.05 N ATOM 1134 CA ASP A 75 24.770 -8.209 -23.773 1.00 22.49 C ATOM 1135 C ASP A 75 23.369 -7.740 -23.331 1.00 22.62 C ATOM 1136 O ASP A 75 23.116 -7.950 -22.163 1.00 22.03 O ATOM 1137 CB ASP A 75 25.192 -9.531 -23.092 1.00 23.41 C ATOM 1138 CG ASP A 75 25.259 -10.541 -24.243 1.00 26.70 C ATOM 1139 OD1 ASP A 75 24.408 -10.560 -25.121 1.00 25.32 O ATOM 1140 OD2 ASP A 75 26.258 -11.293 -24.078 1.00 31.01 O ATOM 1141 HA ASP A 75 24.696 -8.331 -24.854 1.00 0.00 H ATOM 1142 HB2 ASP A 75 26.165 -9.426 -22.612 1.00 0.00 H ATOM 1143 HB3 ASP A 75 24.454 -9.837 -22.351 1.00 0.00 H ATOM 1144 H ASP A 75 26.071 -7.142 -22.411 1.00 0.00 H ATOM 1145 N ILE A 76 22.639 -7.114 -24.226 1.00 22.87 N ATOM 1146 CA ILE A 76 21.339 -6.538 -24.009 1.00 24.72 C ATOM 1147 C ILE A 76 20.243 -7.348 -24.716 1.00 25.58 C ATOM 1148 O ILE A 76 20.315 -7.681 -25.914 1.00 26.07 O ATOM 1149 CB ILE A 76 21.310 -5.006 -24.399 1.00 23.01 C ATOM 1150 CG1 ILE A 76 22.382 -4.154 -23.704 1.00 23.37 C ATOM 1151 CG2 ILE A 76 19.878 -4.514 -24.170 1.00 23.59 C ATOM 1152 CD1 ILE A 76 22.957 -4.521 -22.299 1.00 23.72 C ATOM 1153 HA ILE A 76 21.125 -6.589 -22.941 1.00 0.00 H ATOM 1154 HB ILE A 76 21.580 -4.891 -25.449 1.00 0.00 H ATOM 1155 HG12 ILE A 76 23.234 -4.124 -24.383 1.00 0.00 H ATOM 1156 HG13 ILE A 76 21.960 -3.153 -23.608 1.00 0.00 H ATOM 1157 HD11 ILE A 76 22.148 -4.534 -21.569 1.00 0.00 H ATOM 1158 HD12 ILE A 76 23.423 -5.505 -22.344 1.00 0.00 H ATOM 1159 HD13 ILE A 76 23.700 -3.779 -22.007 1.00 0.00 H ATOM 1160 HG21 ILE A 76 19.194 -5.085 -24.798 1.00 0.00 H ATOM 1161 HG22 ILE A 76 19.611 -4.651 -23.122 1.00 0.00 H ATOM 1162 HG23 ILE A 76 19.813 -3.457 -24.428 1.00 0.00 H ATOM 1163 H ILE A 76 23.031 -7.028 -25.164 1.00 0.00 H ATOM 1164 N LEU A 77 19.165 -7.548 -23.971 1.00 26.71 N ATOM 1165 CA LEU A 77 18.063 -8.361 -24.513 1.00 27.25 C ATOM 1166 C LEU A 77 17.180 -7.466 -25.368 1.00 28.10 C ATOM 1167 O LEU A 77 17.000 -6.260 -25.211 1.00 27.71 O ATOM 1168 CB LEU A 77 17.583 -9.297 -23.423 1.00 25.39 C ATOM 1169 CG LEU A 77 18.561 -10.466 -23.147 1.00 25.83 C ATOM 1170 CD1 LEU A 77 19.944 -10.264 -23.778 1.00 26.90 C ATOM 1171 CD2 LEU A 77 18.805 -10.629 -21.653 1.00 24.42 C ATOM 1172 HA LEU A 77 18.278 -9.115 -25.270 1.00 0.00 H ATOM 1173 HB2 LEU A 77 17.459 -8.724 -22.504 1.00 0.00 H ATOM 1174 HB3 LEU A 77 16.621 -9.713 -23.722 1.00 0.00 H ATOM 1175 HG LEU A 77 18.078 -11.339 -23.586 1.00 0.00 H ATOM 1176 HD21 LEU A 77 19.235 -9.710 -21.254 1.00 0.00 H ATOM 1177 HD22 LEU A 77 17.859 -10.837 -21.152 1.00 0.00 H ATOM 1178 HD23 LEU A 77 19.495 -11.456 -21.487 1.00 0.00 H ATOM 1179 HD11 LEU A 77 19.839 -10.172 -24.859 1.00 0.00 H ATOM 1180 HD12 LEU A 77 20.396 -9.357 -23.377 1.00 0.00 H ATOM 1181 HD13 LEU A 77 20.577 -11.120 -23.545 1.00 0.00 H ATOM 1182 H LEU A 77 19.100 -7.145 -23.036 1.00 0.00 H ATOM 1183 N GLU A 78 16.860 -8.173 -26.464 1.00 29.81 N ATOM 1184 CA GLU A 78 16.044 -7.704 -27.574 1.00 30.47 C ATOM 1185 C GLU A 78 14.698 -7.388 -26.978 1.00 30.98 C ATOM 1186 O GLU A 78 14.258 -8.007 -25.989 1.00 31.71 O ATOM 1187 CB GLU A 78 15.930 -8.688 -28.696 1.00 32.52 C ATOM 1188 CG GLU A 78 16.676 -8.418 -30.014 1.00 35.65 C ATOM 1189 CD GLU A 78 15.788 -7.594 -30.914 1.00 38.76 C ATOM 1190 OE1 GLU A 78 14.633 -7.995 -31.106 1.00 39.68 O ATOM 1191 OE2 GLU A 78 16.293 -6.449 -31.185 1.00 40.48 O ATOM 1192 HA GLU A 78 16.507 -6.833 -28.037 1.00 0.00 H ATOM 1193 HB2 GLU A 78 16.289 -9.645 -28.318 1.00 0.00 H ATOM 1194 HB3 GLU A 78 14.871 -8.770 -28.941 1.00 0.00 H ATOM 1195 HG2 GLU A 78 17.597 -7.873 -29.809 1.00 0.00 H ATOM 1196 HG3 GLU A 78 16.915 -9.364 -30.501 1.00 0.00 H ATOM 1197 H GLU A 78 17.222 -9.125 -26.524 1.00 0.00 H ATOM 1198 N CYS A 79 14.217 -6.232 -27.388 1.00 30.92 N ATOM 1199 CA CYS A 79 12.919 -5.726 -26.954 1.00 30.38 C ATOM 1200 C CYS A 79 11.907 -6.352 -27.936 1.00 30.99 C ATOM 1201 O CYS A 79 11.064 -7.168 -27.541 1.00 29.55 O ATOM 1202 CB CYS A 79 12.968 -4.257 -27.138 1.00 29.79 C ATOM 1203 SG CYS A 79 12.632 -3.116 -25.847 1.00 33.39 S ATOM 1204 HA CYS A 79 12.659 -5.959 -25.922 1.00 0.00 H ATOM 1205 HB2 CYS A 79 12.256 -4.030 -27.931 1.00 0.00 H ATOM 1206 HB3 CYS A 79 13.977 -4.031 -27.482 1.00 0.00 H ATOM 1207 H CYS A 79 14.773 -5.670 -28.033 1.00 0.00 H TER 1208 CYS A 79 ATOM 1209 N GLU B 1A 38.984 3.418 -37.388 1.00 38.47 N ATOM 1210 CA GLU B 1A 39.825 4.185 -36.431 1.00 38.30 C ATOM 1211 C GLU B 1A 40.943 4.934 -37.174 1.00 37.46 C ATOM 1212 O GLU B 1A 40.672 5.928 -37.913 1.00 38.41 O ATOM 1213 CB GLU B 1A 40.507 3.320 -35.374 1.00 38.73 C ATOM 1214 CG GLU B 1A 41.266 2.128 -36.005 1.00 41.35 C ATOM 1215 CD GLU B 1A 42.038 1.366 -34.972 1.00 42.07 C ATOM 1216 OE1 GLU B 1A 41.447 0.641 -34.198 1.00 42.76 O ATOM 1217 OE2 GLU B 1A 43.281 1.591 -35.006 1.00 44.04 O ATOM 1218 HA GLU B 1A 39.131 4.864 -35.935 1.00 0.00 H ATOM 1219 HB2 GLU B 1A 41.215 3.935 -34.819 1.00 0.00 H ATOM 1220 HB3 GLU B 1A 39.750 2.934 -34.692 1.00 0.00 H ATOM 1221 HG2 GLU B 1A 40.547 1.458 -36.477 1.00 0.00 H ATOM 1222 HG3 GLU B 1A 41.957 2.506 -36.758 1.00 0.00 H ATOM 1223 HN3 GLU B 1A 39.565 2.741 -37.882 1.00 0.00 H ATOM 1224 HN2 GLU B 1A 38.563 4.060 -38.059 1.00 0.00 H ATOM 1225 HN1 GLU B 1A 38.249 2.929 -36.877 1.00 0.00 H ATOM 1226 N CYS B 1 42.161 4.378 -37.031 1.00 34.83 N ATOM 1227 CA CYS B 1 43.294 4.962 -37.758 1.00 32.13 C ATOM 1228 C CYS B 1 43.715 3.874 -38.803 1.00 30.87 C ATOM 1229 O CYS B 1 43.739 2.643 -38.667 1.00 31.07 O ATOM 1230 CB CYS B 1 44.439 5.479 -36.930 1.00 31.31 C ATOM 1231 SG CYS B 1 45.465 4.109 -36.320 1.00 32.28 S ATOM 1232 HA CYS B 1 42.974 5.892 -38.228 1.00 0.00 H ATOM 1233 HB2 CYS B 1 44.043 6.035 -36.080 1.00 0.00 H ATOM 1234 HB3 CYS B 1 45.053 6.140 -37.542 1.00 0.00 H ATOM 1235 H CYS B 1 42.294 3.566 -36.428 1.00 0.00 H ATOM 1236 N LYS B 2 44.117 4.456 -39.903 1.00 28.05 N ATOM 1237 CA LYS B 2 44.552 3.743 -41.074 1.00 25.88 C ATOM 1238 C LYS B 2 45.958 4.165 -41.474 1.00 24.80 C ATOM 1239 O LYS B 2 46.414 5.316 -41.344 1.00 22.78 O ATOM 1240 CB LYS B 2 43.596 4.098 -42.188 1.00 26.79 C ATOM 1241 CG LYS B 2 44.281 4.678 -43.441 1.00 24.71 C ATOM 1242 CD LYS B 2 43.167 4.930 -44.430 1.00 26.47 C ATOM 1243 CE LYS B 2 43.533 6.120 -45.333 1.00 25.93 C ATOM 1244 NZ LYS B 2 43.126 5.606 -46.668 1.00 30.45 N ATOM 1245 HA LYS B 2 44.564 2.671 -40.876 1.00 0.00 H ATOM 1246 HB2 LYS B 2 43.057 3.196 -42.478 1.00 0.00 H ATOM 1247 HB3 LYS B 2 42.889 4.837 -41.811 1.00 0.00 H ATOM 1248 HG2 LYS B 2 44.794 5.609 -43.199 1.00 0.00 H ATOM 1249 HG3 LYS B 2 44.998 3.965 -43.848 1.00 0.00 H ATOM 1250 HD2 LYS B 2 43.019 4.041 -45.044 1.00 0.00 H ATOM 1251 HD3 LYS B 2 42.247 5.154 -43.890 1.00 0.00 H ATOM 1252 HE2 LYS B 2 44.601 6.336 -45.296 1.00 0.00 H ATOM 1253 HE3 LYS B 2 42.973 7.015 -45.061 1.00 0.00 H ATOM 1254 HZ1 LYS B 2 43.653 4.759 -46.880 1.00 0.00 H ATOM 1255 HZ2 LYS B 2 42.128 5.394 -46.660 1.00 0.00 H ATOM 1256 HZ3 LYS B 2 43.319 6.314 -47.377 1.00 0.00 H ATOM 1257 H LYS B 2 44.122 5.476 -39.932 1.00 0.00 H ATOM 1258 N THR B 3 46.565 3.139 -42.073 1.00 24.42 N ATOM 1259 CA THR B 3 47.939 3.363 -42.632 1.00 23.55 C ATOM 1260 C THR B 3 47.914 2.938 -44.103 1.00 22.92 C ATOM 1261 O THR B 3 47.378 1.915 -44.537 1.00 19.55 O ATOM 1262 CB THR B 3 48.830 2.630 -41.594 1.00 27.06 C ATOM 1263 OG1 THR B 3 50.111 2.282 -42.174 1.00 29.47 O ATOM 1264 CG2 THR B 3 48.110 1.355 -41.061 1.00 29.34 C ATOM 1265 HA THR B 3 48.341 4.372 -42.723 1.00 0.00 H ATOM 1266 HB THR B 3 49.005 3.305 -40.756 1.00 0.00 H ATOM 1267 HG1 THR B 3 50.646 1.830 -41.517 1.00 0.00 H ATOM 1268 HG23 THR B 3 47.149 1.636 -40.629 1.00 0.00 H ATOM 1269 HG21 THR B 3 47.950 0.659 -41.884 1.00 0.00 H ATOM 1270 HG22 THR B 3 48.729 0.882 -40.298 1.00 0.00 H ATOM 1271 H THR B 3 46.109 2.230 -42.149 1.00 0.00 H ATOM 1272 N GLY B 4 48.667 3.680 -44.930 1.00 23.04 N ATOM 1273 CA GLY B 4 48.779 3.374 -46.392 1.00 24.00 C ATOM 1274 C GLY B 4 47.321 3.490 -46.960 1.00 22.99 C ATOM 1275 O GLY B 4 46.674 4.380 -46.445 1.00 22.01 O ATOM 1276 HA3 GLY B 4 49.167 2.366 -46.542 1.00 0.00 H ATOM 1277 HA2 GLY B 4 49.437 4.092 -46.882 1.00 0.00 H ATOM 1278 H GLY B 4 49.179 4.477 -44.551 1.00 0.00 H ATOM 1279 N ASN B 5 46.928 2.471 -47.682 1.00 22.96 N ATOM 1280 CA ASN B 5 45.591 2.421 -48.286 1.00 23.93 C ATOM 1281 C ASN B 5 44.532 1.853 -47.325 1.00 23.64 C ATOM 1282 O ASN B 5 43.310 1.803 -47.661 1.00 23.80 O ATOM 1283 CB ASN B 5 45.772 1.696 -49.611 1.00 27.48 C ATOM 1284 CG ASN B 5 45.638 0.198 -49.656 1.00 29.74 C ATOM 1285 OD1 ASN B 5 44.616 -0.268 -50.195 1.00 31.02 O ATOM 1286 ND2 ASN B 5 46.543 -0.665 -49.193 1.00 32.78 N ATOM 1287 HA ASN B 5 45.175 3.409 -48.487 1.00 0.00 H ATOM 1288 HB2 ASN B 5 45.031 2.102 -50.300 1.00 0.00 H ATOM 1289 HB3 ASN B 5 46.772 1.937 -49.971 1.00 0.00 H ATOM 1290 HD22 ASN B 5 47.393 -0.322 -48.745 1.00 0.00 H ATOM 1291 HD21 ASN B 5 46.385 -1.668 -49.287 1.00 0.00 H ATOM 1292 H ASN B 5 47.568 1.691 -47.829 1.00 0.00 H ATOM 1293 N GLY B 6 44.996 1.570 -46.098 1.00 22.27 N ATOM 1294 CA GLY B 6 44.062 0.945 -45.108 1.00 21.43 C ATOM 1295 C GLY B 6 43.759 -0.502 -45.502 1.00 20.35 C ATOM 1296 O GLY B 6 42.653 -1.047 -45.330 1.00 20.12 O ATOM 1297 HA3 GLY B 6 43.132 1.513 -45.083 1.00 0.00 H ATOM 1298 HA2 GLY B 6 44.522 0.960 -44.120 1.00 0.00 H ATOM 1299 H GLY B 6 45.963 1.776 -45.845 1.00 0.00 H ATOM 1300 N LYS B 7 44.794 -1.162 -46.068 1.00 19.69 N ATOM 1301 CA LYS B 7 44.722 -2.584 -46.386 1.00 19.53 C ATOM 1302 C LYS B 7 44.491 -3.456 -45.149 1.00 18.99 C ATOM 1303 O LYS B 7 43.789 -4.475 -45.045 1.00 18.64 O ATOM 1304 CB LYS B 7 46.092 -3.095 -46.968 1.00 19.91 C ATOM 1305 CG LYS B 7 45.820 -3.801 -48.272 1.00 20.87 C ATOM 1306 CD LYS B 7 44.397 -4.371 -48.144 1.00 23.71 C ATOM 1307 CE LYS B 7 43.984 -5.219 -49.295 1.00 25.74 C ATOM 1308 NZ LYS B 7 44.509 -6.613 -49.217 1.00 22.76 N ATOM 1309 HA LYS B 7 43.895 -2.670 -47.091 1.00 0.00 H ATOM 1310 HB2 LYS B 7 46.758 -2.249 -47.139 1.00 0.00 H ATOM 1311 HB3 LYS B 7 46.557 -3.786 -46.265 1.00 0.00 H ATOM 1312 HG2 LYS B 7 45.876 -3.099 -49.104 1.00 0.00 H ATOM 1313 HG3 LYS B 7 46.540 -4.605 -48.427 1.00 0.00 H ATOM 1314 HD2 LYS B 7 44.348 -4.974 -47.237 1.00 0.00 H ATOM 1315 HD3 LYS B 7 43.699 -3.538 -48.063 1.00 0.00 H ATOM 1316 HE2 LYS B 7 44.352 -4.761 -50.213 1.00 0.00 H ATOM 1317 HE3 LYS B 7 42.895 -5.260 -49.322 1.00 0.00 H ATOM 1318 HZ1 LYS B 7 45.529 -6.591 -49.201 1.00 0.00 H ATOM 1319 HZ2 LYS B 7 44.164 -7.058 -48.367 1.00 0.00 H ATOM 1320 HZ3 LYS B 7 44.192 -7.140 -50.031 1.00 0.00 H ATOM 1321 H LYS B 7 45.651 -0.651 -46.279 1.00 0.00 H ATOM 1322 N ASN B 8 45.239 -3.067 -44.130 1.00 19.46 N ATOM 1323 CA ASN B 8 45.270 -3.741 -42.845 1.00 20.33 C ATOM 1324 C ASN B 8 44.301 -3.097 -41.848 1.00 17.89 C ATOM 1325 O ASN B 8 44.496 -3.374 -40.653 1.00 18.69 O ATOM 1326 CB ASN B 8 46.669 -3.794 -42.235 1.00 23.77 C ATOM 1327 CG ASN B 8 47.570 -4.796 -42.944 1.00 26.08 C ATOM 1328 OD1 ASN B 8 48.045 -5.561 -42.106 1.00 28.44 O ATOM 1329 ND2 ASN B 8 47.617 -5.010 -44.252 1.00 24.88 N ATOM 1330 HA ASN B 8 44.954 -4.765 -43.044 1.00 0.00 H ATOM 1331 HB2 ASN B 8 47.121 -2.804 -42.306 1.00 0.00 H ATOM 1332 HB3 ASN B 8 46.584 -4.079 -41.186 1.00 0.00 H ATOM 1333 HD22 ASN B 8 47.203 -4.335 -44.894 1.00 0.00 H ATOM 1334 HD21 ASN B 8 48.067 -5.850 -44.615 1.00 0.00 H ATOM 1335 H ASN B 8 45.829 -2.244 -44.255 1.00 0.00 H ATOM 1336 N TYR B 9 43.498 -2.174 -42.326 1.00 18.58 N ATOM 1337 CA TYR B 9 42.536 -1.477 -41.456 1.00 14.69 C ATOM 1338 C TYR B 9 41.538 -2.553 -40.974 1.00 13.87 C ATOM 1339 O TYR B 9 40.952 -3.282 -41.747 1.00 12.84 O ATOM 1340 CB TYR B 9 41.772 -0.338 -42.094 1.00 14.52 C ATOM 1341 CG TYR B 9 40.553 0.181 -41.333 1.00 14.02 C ATOM 1342 CD1 TYR B 9 40.699 1.045 -40.249 1.00 15.71 C ATOM 1343 CD2 TYR B 9 39.282 -0.162 -41.702 1.00 14.80 C ATOM 1344 CE1 TYR B 9 39.565 1.452 -39.521 1.00 17.06 C ATOM 1345 CE2 TYR B 9 38.108 0.233 -41.075 1.00 13.63 C ATOM 1346 CZ TYR B 9 38.292 1.146 -40.053 1.00 13.94 C ATOM 1347 OH TYR B 9 37.197 1.629 -39.435 1.00 16.81 O ATOM 1348 HA TYR B 9 43.104 -1.001 -40.657 1.00 0.00 H ATOM 1349 HB3 TYR B 9 41.432 -0.675 -43.073 1.00 0.00 H ATOM 1350 HB2 TYR B 9 42.464 0.495 -42.219 1.00 0.00 H ATOM 1351 HD2 TYR B 9 39.181 -0.809 -42.574 1.00 0.00 H ATOM 1352 HE2 TYR B 9 37.127 -0.144 -41.363 1.00 0.00 H ATOM 1353 HE1 TYR B 9 39.666 1.987 -38.576 1.00 0.00 H ATOM 1354 HD1 TYR B 9 41.688 1.404 -39.966 1.00 0.00 H ATOM 1355 HH TYR B 9 37.464 2.248 -38.751 1.00 0.00 H ATOM 1356 H TYR B 9 43.542 -1.936 -43.317 1.00 0.00 H ATOM 1357 N ARG B 10 41.346 -2.610 -39.686 1.00 14.13 N ATOM 1358 CA ARG B 10 40.422 -3.481 -39.008 1.00 12.31 C ATOM 1359 C ARG B 10 39.572 -2.726 -37.990 1.00 14.20 C ATOM 1360 O ARG B 10 38.768 -3.385 -37.308 1.00 15.08 O ATOM 1361 CB ARG B 10 41.240 -4.666 -38.478 1.00 15.79 C ATOM 1362 CG ARG B 10 41.742 -5.642 -39.513 1.00 15.89 C ATOM 1363 CD ARG B 10 40.586 -6.327 -40.172 1.00 17.00 C ATOM 1364 NE ARG B 10 41.150 -6.893 -41.333 1.00 22.15 N ATOM 1365 CZ ARG B 10 41.777 -6.506 -42.407 1.00 20.14 C ATOM 1366 NH1 ARG B 10 42.069 -5.324 -42.823 1.00 20.60 N ATOM 1367 NH2 ARG B 10 42.395 -7.598 -42.945 1.00 23.42 N ATOM 1368 HA ARG B 10 39.660 -3.885 -39.675 1.00 0.00 H ATOM 1369 HB2 ARG B 10 42.106 -4.264 -37.951 1.00 0.00 H ATOM 1370 HB3 ARG B 10 40.613 -5.217 -37.777 1.00 0.00 H ATOM 1371 HG2 ARG B 10 42.321 -5.106 -40.265 1.00 0.00 H ATOM 1372 HG3 ARG B 10 42.376 -6.386 -39.031 1.00 0.00 H ATOM 1373 HD2 ARG B 10 39.805 -5.612 -40.428 1.00 0.00 H ATOM 1374 HD3 ARG B 10 40.171 -7.100 -39.525 1.00 0.00 H ATOM 1375 HE ARG B 10 41.032 -7.906 -41.332 1.00 0.00 H ATOM 1376 HH12 ARG B 10 42.573 -5.202 -43.702 1.00 0.00 H ATOM 1377 HH11 ARG B 10 41.797 -4.508 -42.274 1.00 0.00 H ATOM 1378 HH22 ARG B 10 42.944 -7.504 -43.799 1.00 0.00 H ATOM 1379 HH21 ARG B 10 42.307 -8.508 -42.493 1.00 0.00 H ATOM 1380 H ARG B 10 41.901 -1.980 -39.106 1.00 0.00 H ATOM 1381 N GLY B 11 39.330 -1.456 -38.088 1.00 13.04 N ATOM 1382 CA GLY B 11 38.559 -0.515 -37.391 1.00 14.88 C ATOM 1383 C GLY B 11 37.087 -0.803 -37.623 1.00 16.20 C ATOM 1384 O GLY B 11 36.775 -1.765 -38.307 1.00 17.89 O ATOM 1385 HA3 GLY B 11 38.795 0.487 -37.749 1.00 0.00 H ATOM 1386 HA2 GLY B 11 38.780 -0.580 -36.326 1.00 0.00 H ATOM 1387 H GLY B 11 39.827 -1.034 -38.872 1.00 0.00 H ATOM 1388 N THR B 12 36.180 -0.007 -37.017 1.00 16.05 N ATOM 1389 CA THR B 12 34.756 -0.313 -37.110 1.00 16.39 C ATOM 1390 C THR B 12 33.911 0.827 -37.693 1.00 15.59 C ATOM 1391 O THR B 12 32.721 0.972 -37.462 1.00 14.10 O ATOM 1392 CB THR B 12 34.190 -0.827 -35.739 1.00 15.50 C ATOM 1393 OG1 THR B 12 34.375 0.295 -34.779 1.00 16.18 O ATOM 1394 CG2 THR B 12 34.892 -2.065 -35.257 1.00 14.67 C ATOM 1395 HA THR B 12 34.673 -1.124 -37.833 1.00 0.00 H ATOM 1396 HB THR B 12 33.142 -1.110 -35.841 1.00 0.00 H ATOM 1397 HG1 THR B 12 35.309 0.508 -34.713 1.00 0.00 H ATOM 1398 HG23 THR B 12 34.741 -2.870 -35.976 1.00 0.00 H ATOM 1399 HG21 THR B 12 35.958 -1.861 -35.156 1.00 0.00 H ATOM 1400 HG22 THR B 12 34.484 -2.359 -34.290 1.00 0.00 H ATOM 1401 H THR B 12 36.491 0.811 -36.493 1.00 0.00 H ATOM 1402 N MET B 13 34.585 1.567 -38.574 1.00 15.56 N ATOM 1403 CA MET B 13 33.705 2.632 -39.211 1.00 14.89 C ATOM 1404 C MET B 13 32.608 1.812 -39.876 1.00 15.14 C ATOM 1405 O MET B 13 32.854 0.722 -40.529 1.00 14.08 O ATOM 1406 CB MET B 13 34.548 3.361 -40.199 1.00 17.15 C ATOM 1407 CG MET B 13 35.051 4.691 -40.056 1.00 22.01 C ATOM 1408 SD MET B 13 33.878 5.986 -39.661 1.00 26.06 S ATOM 1409 CE MET B 13 32.482 5.497 -40.668 1.00 22.07 C ATOM 1410 HA MET B 13 33.284 3.376 -38.534 1.00 0.00 H ATOM 1411 HB2 MET B 13 35.430 2.736 -40.339 1.00 0.00 H ATOM 1412 HB3 MET B 13 33.964 3.374 -41.119 1.00 0.00 H ATOM 1413 HG2 MET B 13 35.530 4.961 -40.997 1.00 0.00 H ATOM 1414 HG3 MET B 13 35.797 4.674 -39.262 1.00 0.00 H ATOM 1415 HE1 MET B 13 32.779 5.483 -41.717 1.00 0.00 H ATOM 1416 HE2 MET B 13 32.151 4.502 -40.369 1.00 0.00 H ATOM 1417 HE3 MET B 13 31.668 6.209 -40.529 1.00 0.00 H ATOM 1418 H MET B 13 35.572 1.435 -38.794 1.00 0.00 H ATOM 1419 N SER B 14 31.371 2.374 -39.812 1.00 14.94 N ATOM 1420 CA SER B 14 30.346 1.643 -40.580 1.00 15.65 C ATOM 1421 C SER B 14 29.559 2.560 -41.472 1.00 15.60 C ATOM 1422 O SER B 14 28.508 2.090 -41.885 1.00 16.71 O ATOM 1423 CB SER B 14 29.498 0.797 -39.664 1.00 11.96 C ATOM 1424 OG SER B 14 29.072 1.489 -38.551 1.00 19.42 O ATOM 1425 HA SER B 14 30.843 0.950 -41.259 1.00 0.00 H ATOM 1426 HB2 SER B 14 30.084 -0.062 -39.339 1.00 0.00 H ATOM 1427 HB3 SER B 14 28.624 0.451 -40.216 1.00 0.00 H ATOM 1428 HG SER B 14 29.835 1.792 -38.053 1.00 0.00 H ATOM 1429 H SER B 14 31.171 3.222 -39.282 1.00 0.00 H ATOM 1430 N LYS B 15 30.040 3.712 -41.824 1.00 16.81 N ATOM 1431 CA LYS B 15 29.257 4.657 -42.679 1.00 16.83 C ATOM 1432 C LYS B 15 30.270 5.274 -43.600 1.00 15.12 C ATOM 1433 O LYS B 15 31.391 5.436 -43.172 1.00 16.30 O ATOM 1434 CB LYS B 15 28.506 5.791 -41.976 1.00 19.81 C ATOM 1435 CG LYS B 15 26.988 5.690 -41.895 1.00 19.03 C ATOM 1436 CD LYS B 15 26.359 6.891 -41.225 1.00 22.78 C ATOM 1437 CE LYS B 15 27.494 7.625 -40.536 1.00 23.76 C ATOM 1438 NZ LYS B 15 28.115 6.769 -39.463 1.00 26.40 N ATOM 1439 HA LYS B 15 28.464 4.074 -43.147 1.00 0.00 H ATOM 1440 HB2 LYS B 15 28.884 5.849 -40.955 1.00 0.00 H ATOM 1441 HB3 LYS B 15 28.744 6.715 -42.503 1.00 0.00 H ATOM 1442 HG2 LYS B 15 26.589 5.605 -42.906 1.00 0.00 H ATOM 1443 HG3 LYS B 15 26.727 4.797 -41.327 1.00 0.00 H ATOM 1444 HD2 LYS B 15 25.886 7.535 -41.967 1.00 0.00 H ATOM 1445 HD3 LYS B 15 25.615 6.572 -40.495 1.00 0.00 H ATOM 1446 HE2 LYS B 15 27.107 8.538 -40.085 1.00 0.00 H ATOM 1447 HE3 LYS B 15 28.254 7.880 -41.274 1.00 0.00 H ATOM 1448 HZ1 LYS B 15 27.408 6.531 -38.768 1.00 0.00 H ATOM 1449 HZ2 LYS B 15 28.483 5.915 -39.882 1.00 0.00 H ATOM 1450 HZ3 LYS B 15 28.874 7.284 -39.016 1.00 0.00 H ATOM 1451 H LYS B 15 30.973 3.979 -41.511 1.00 0.00 H ATOM 1452 N THR B 16 29.797 5.627 -44.789 1.00 16.82 N ATOM 1453 CA THR B 16 30.712 6.191 -45.804 1.00 14.88 C ATOM 1454 C THR B 16 30.945 7.662 -45.448 1.00 16.86 C ATOM 1455 O THR B 16 30.362 8.382 -44.655 1.00 15.06 O ATOM 1456 CB THR B 16 30.173 5.995 -47.239 1.00 14.04 C ATOM 1457 OG1 THR B 16 29.005 6.904 -47.271 1.00 14.02 O ATOM 1458 CG2 THR B 16 29.724 4.589 -47.645 1.00 12.19 C ATOM 1459 HA THR B 16 31.665 5.662 -45.793 1.00 0.00 H ATOM 1460 HB THR B 16 30.980 6.190 -47.945 1.00 0.00 H ATOM 1461 HG1 THR B 16 28.589 6.858 -48.135 1.00 0.00 H ATOM 1462 HG23 THR B 16 30.580 3.915 -47.623 1.00 0.00 H ATOM 1463 HG21 THR B 16 28.964 4.236 -46.948 1.00 0.00 H ATOM 1464 HG22 THR B 16 29.309 4.618 -48.652 1.00 0.00 H ATOM 1465 H THR B 16 28.806 5.510 -45.001 1.00 0.00 H ATOM 1466 N LYS B 17 31.917 8.170 -46.225 1.00 17.01 N ATOM 1467 CA LYS B 17 32.414 9.531 -46.097 1.00 17.48 C ATOM 1468 C LYS B 17 31.251 10.495 -46.182 1.00 17.74 C ATOM 1469 O LYS B 17 31.487 11.659 -45.796 1.00 16.82 O ATOM 1470 CB LYS B 17 33.558 9.700 -47.143 1.00 18.46 C ATOM 1471 CG LYS B 17 32.897 9.938 -48.508 1.00 17.73 C ATOM 1472 CD LYS B 17 33.870 10.253 -49.618 1.00 19.23 C ATOM 1473 CE LYS B 17 33.122 11.189 -50.587 1.00 19.34 C ATOM 1474 NZ LYS B 17 32.788 10.340 -51.768 1.00 21.92 N ATOM 1475 HA LYS B 17 32.861 9.757 -45.129 1.00 0.00 H ATOM 1476 HB2 LYS B 17 34.184 10.552 -46.878 1.00 0.00 H ATOM 1477 HB3 LYS B 17 34.169 8.798 -47.176 1.00 0.00 H ATOM 1478 HG2 LYS B 17 32.344 9.040 -48.782 1.00 0.00 H ATOM 1479 HG3 LYS B 17 32.204 10.774 -48.412 1.00 0.00 H ATOM 1480 HD2 LYS B 17 34.754 10.750 -49.218 1.00 0.00 H ATOM 1481 HD3 LYS B 17 34.170 9.339 -50.130 1.00 0.00 H ATOM 1482 HE2 LYS B 17 33.759 12.023 -50.883 1.00 0.00 H ATOM 1483 HE3 LYS B 17 32.214 11.574 -50.123 1.00 0.00 H ATOM 1484 HZ1 LYS B 17 33.649 9.981 -52.181 1.00 0.00 H ATOM 1485 HZ2 LYS B 17 32.201 9.561 -51.470 1.00 0.00 H ATOM 1486 HZ3 LYS B 17 32.287 10.900 -52.457 1.00 0.00 H ATOM 1487 H LYS B 17 32.327 7.570 -46.941 1.00 0.00 H ATOM 1488 N ASN B 18 30.201 10.078 -46.861 1.00 17.20 N ATOM 1489 CA ASN B 18 28.944 10.755 -47.083 1.00 18.01 C ATOM 1490 C ASN B 18 27.929 10.496 -45.978 1.00 17.79 C ATOM 1491 O ASN B 18 26.776 10.939 -46.129 1.00 19.84 O ATOM 1492 CB ASN B 18 28.400 10.499 -48.498 1.00 20.69 C ATOM 1493 CG ASN B 18 28.909 11.354 -49.612 1.00 22.25 C ATOM 1494 OD1 ASN B 18 28.715 11.137 -50.834 1.00 25.49 O ATOM 1495 ND2 ASN B 18 29.587 12.412 -49.226 1.00 21.79 N ATOM 1496 HA ASN B 18 29.144 11.825 -47.029 1.00 0.00 H ATOM 1497 HB2 ASN B 18 28.631 9.464 -48.752 1.00 0.00 H ATOM 1498 HB3 ASN B 18 27.319 10.629 -48.458 1.00 0.00 H ATOM 1499 HD22 ASN B 18 29.742 12.584 -48.233 1.00 0.00 H ATOM 1500 HD21 ASN B 18 29.958 13.061 -49.920 1.00 0.00 H ATOM 1501 H ASN B 18 30.287 9.155 -47.286 1.00 0.00 H ATOM 1502 N GLY B 19 28.121 9.672 -44.995 1.00 17.76 N ATOM 1503 CA GLY B 19 27.188 9.483 -43.898 1.00 17.82 C ATOM 1504 C GLY B 19 26.105 8.456 -44.205 1.00 17.45 C ATOM 1505 O GLY B 19 25.104 8.411 -43.425 1.00 19.00 O ATOM 1506 HA3 GLY B 19 26.709 10.438 -43.681 1.00 0.00 H ATOM 1507 HA2 GLY B 19 27.745 9.149 -43.022 1.00 0.00 H ATOM 1508 H GLY B 19 28.980 9.123 -44.992 1.00 0.00 H ATOM 1509 N ILE B 20 26.270 7.678 -45.248 1.00 16.89 N ATOM 1510 CA ILE B 20 25.292 6.586 -45.560 1.00 16.32 C ATOM 1511 C ILE B 20 25.785 5.269 -44.976 1.00 14.37 C ATOM 1512 O ILE B 20 26.925 4.879 -45.041 1.00 13.27 O ATOM 1513 CB ILE B 20 24.934 6.505 -47.074 1.00 17.38 C ATOM 1514 CG1 ILE B 20 24.649 5.067 -47.580 1.00 16.87 C ATOM 1515 CG2 ILE B 20 25.948 7.273 -47.954 1.00 21.59 C ATOM 1516 CD1 ILE B 20 23.136 4.794 -47.795 1.00 19.14 C ATOM 1517 HA ILE B 20 24.344 6.825 -45.077 1.00 0.00 H ATOM 1518 HB ILE B 20 23.979 7.020 -47.178 1.00 0.00 H ATOM 1519 HG12 ILE B 20 25.168 4.922 -48.528 1.00 0.00 H ATOM 1520 HG13 ILE B 20 25.030 4.357 -46.846 1.00 0.00 H ATOM 1521 HD11 ILE B 20 22.606 4.927 -46.852 1.00 0.00 H ATOM 1522 HD12 ILE B 20 22.744 5.492 -48.535 1.00 0.00 H ATOM 1523 HD13 ILE B 20 22.999 3.772 -48.149 1.00 0.00 H ATOM 1524 HG21 ILE B 20 25.958 8.323 -47.663 1.00 0.00 H ATOM 1525 HG22 ILE B 20 26.942 6.847 -47.816 1.00 0.00 H ATOM 1526 HG23 ILE B 20 25.656 7.188 -49.001 1.00 0.00 H ATOM 1527 H ILE B 20 27.077 7.818 -45.856 1.00 0.00 H ATOM 1528 N THR B 21 24.842 4.583 -44.307 1.00 14.97 N ATOM 1529 CA THR B 21 25.302 3.303 -43.710 1.00 15.54 C ATOM 1530 C THR B 21 25.536 2.193 -44.725 1.00 14.12 C ATOM 1531 O THR B 21 25.018 2.056 -45.831 1.00 13.21 O ATOM 1532 CB THR B 21 24.424 3.022 -42.418 1.00 19.01 C ATOM 1533 OG1 THR B 21 23.947 1.674 -42.478 1.00 21.00 O ATOM 1534 CG2 THR B 21 23.469 4.179 -42.199 1.00 18.39 C ATOM 1535 HA THR B 21 26.326 3.367 -43.342 1.00 0.00 H ATOM 1536 HB THR B 21 24.968 3.024 -41.474 1.00 0.00 H ATOM 1537 HG1 THR B 21 23.413 1.490 -41.702 1.00 0.00 H ATOM 1538 HG23 THR B 21 24.030 5.114 -42.186 1.00 0.00 H ATOM 1539 HG21 THR B 21 22.739 4.204 -43.008 1.00 0.00 H ATOM 1540 HG22 THR B 21 22.955 4.049 -41.247 1.00 0.00 H ATOM 1541 H THR B 21 23.882 4.917 -44.216 1.00 0.00 H ATOM 1542 N CYS B 22 26.639 1.543 -44.359 1.00 13.05 N ATOM 1543 CA CYS B 22 27.239 0.458 -45.124 1.00 14.46 C ATOM 1544 C CYS B 22 26.353 -0.773 -45.033 1.00 15.02 C ATOM 1545 O CYS B 22 25.866 -0.892 -43.895 1.00 15.07 O ATOM 1546 CB CYS B 22 28.588 0.006 -44.567 1.00 10.56 C ATOM 1547 SG CYS B 22 29.905 1.277 -44.799 1.00 13.77 S ATOM 1548 HA CYS B 22 27.358 0.843 -46.137 1.00 0.00 H ATOM 1549 HB2 CYS B 22 28.890 -0.908 -45.078 1.00 0.00 H ATOM 1550 HB3 CYS B 22 28.478 -0.194 -43.501 1.00 0.00 H ATOM 1551 H CYS B 22 27.092 1.822 -43.489 1.00 0.00 H ATOM 1552 N GLN B 23 26.464 -1.516 -46.113 1.00 13.95 N ATOM 1553 CA GLN B 23 25.762 -2.811 -46.147 1.00 11.82 C ATOM 1554 C GLN B 23 26.709 -3.906 -45.678 1.00 12.26 C ATOM 1555 O GLN B 23 27.932 -3.657 -45.607 1.00 11.72 O ATOM 1556 CB GLN B 23 25.197 -3.028 -47.512 1.00 13.61 C ATOM 1557 CG GLN B 23 25.100 -4.543 -47.790 1.00 15.49 C ATOM 1558 CD GLN B 23 24.997 -4.808 -49.301 1.00 14.36 C ATOM 1559 OE1 GLN B 23 24.335 -3.999 -50.017 1.00 15.22 O ATOM 1560 NE2 GLN B 23 25.556 -5.965 -49.575 1.00 11.93 N ATOM 1561 HA GLN B 23 24.915 -2.827 -45.461 1.00 0.00 H ATOM 1562 HB2 GLN B 23 24.204 -2.583 -47.570 1.00 0.00 H ATOM 1563 HB3 GLN B 23 25.847 -2.562 -48.253 1.00 0.00 H ATOM 1564 HG2 GLN B 23 25.989 -5.037 -47.399 1.00 0.00 H ATOM 1565 HG3 GLN B 23 24.215 -4.943 -47.294 1.00 0.00 H ATOM 1566 HE22 GLN B 23 26.056 -6.475 -48.847 1.00 0.00 H ATOM 1567 HE21 GLN B 23 25.490 -6.353 -50.516 1.00 0.00 H ATOM 1568 H GLN B 23 27.022 -1.203 -46.907 1.00 0.00 H ATOM 1569 N LYS B 24 26.145 -4.938 -45.048 1.00 12.33 N ATOM 1570 CA LYS B 24 26.953 -6.073 -44.505 1.00 12.62 C ATOM 1571 C LYS B 24 27.490 -6.921 -45.665 1.00 11.41 C ATOM 1572 O LYS B 24 26.817 -7.059 -46.705 1.00 10.43 O ATOM 1573 CB LYS B 24 26.195 -6.924 -43.486 1.00 14.44 C ATOM 1574 CG LYS B 24 25.387 -6.058 -42.468 1.00 13.80 C ATOM 1575 CD LYS B 24 26.236 -6.189 -41.200 1.00 16.83 C ATOM 1576 CE LYS B 24 26.234 -7.743 -40.914 1.00 21.61 C ATOM 1577 NZ LYS B 24 25.770 -7.962 -39.495 1.00 25.27 N ATOM 1578 HA LYS B 24 27.790 -5.646 -43.953 1.00 0.00 H ATOM 1579 HB2 LYS B 24 25.502 -7.575 -44.020 1.00 0.00 H ATOM 1580 HB3 LYS B 24 26.912 -7.533 -42.936 1.00 0.00 H ATOM 1581 HG2 LYS B 24 25.319 -5.020 -42.795 1.00 0.00 H ATOM 1582 HG3 LYS B 24 24.384 -6.456 -42.317 1.00 0.00 H ATOM 1583 HD2 LYS B 24 27.249 -5.825 -41.370 1.00 0.00 H ATOM 1584 HD3 LYS B 24 25.788 -5.640 -40.372 1.00 0.00 H ATOM 1585 HE2 LYS B 24 27.240 -8.143 -41.039 1.00 0.00 H ATOM 1586 HE3 LYS B 24 25.557 -8.245 -41.605 1.00 0.00 H ATOM 1587 HZ1 LYS B 24 26.406 -7.488 -38.854 1.00 0.00 H ATOM 1588 HZ2 LYS B 24 24.829 -7.584 -39.384 1.00 0.00 H ATOM 1589 HZ3 LYS B 24 25.762 -8.961 -39.292 1.00 0.00 H ATOM 1590 H LYS B 24 25.132 -4.953 -44.933 1.00 0.00 H ATOM 1591 N TRP B 25 28.780 -7.153 -45.536 1.00 11.00 N ATOM 1592 CA TRP B 25 29.454 -7.916 -46.614 1.00 12.73 C ATOM 1593 C TRP B 25 28.804 -9.249 -46.897 1.00 14.90 C ATOM 1594 O TRP B 25 29.032 -9.863 -47.931 1.00 15.06 O ATOM 1595 CB TRP B 25 30.912 -8.056 -46.318 1.00 11.85 C ATOM 1596 CG TRP B 25 31.625 -6.781 -46.079 1.00 10.11 C ATOM 1597 CD1 TRP B 25 31.662 -6.157 -44.883 1.00 12.05 C ATOM 1598 CD2 TRP B 25 32.355 -5.950 -46.991 1.00 12.00 C ATOM 1599 NE1 TRP B 25 32.414 -5.021 -44.931 1.00 12.28 N ATOM 1600 CE2 TRP B 25 32.907 -4.893 -46.216 1.00 10.96 C ATOM 1601 CE3 TRP B 25 32.679 -6.023 -48.341 1.00 10.00 C ATOM 1602 CZ2 TRP B 25 33.667 -3.825 -46.766 1.00 12.69 C ATOM 1603 CZ3 TRP B 25 33.408 -4.939 -48.871 1.00 10.95 C ATOM 1604 CH2 TRP B 25 33.965 -3.899 -48.135 1.00 10.00 C ATOM 1605 HA TRP B 25 29.341 -7.341 -47.533 1.00 0.00 H ATOM 1606 HB2 TRP B 25 31.019 -8.676 -45.428 1.00 0.00 H ATOM 1607 HB3 TRP B 25 31.383 -8.554 -47.165 1.00 0.00 H ATOM 1608 HE1 TRP B 25 32.583 -4.379 -44.156 1.00 0.00 H ATOM 1609 HD1 TRP B 25 31.153 -6.517 -43.989 1.00 0.00 H ATOM 1610 HZ2 TRP B 25 34.002 -2.988 -46.153 1.00 0.00 H ATOM 1611 HH2 TRP B 25 34.614 -3.162 -48.608 1.00 0.00 H ATOM 1612 HZ3 TRP B 25 33.547 -4.914 -49.952 1.00 0.00 H ATOM 1613 HE3 TRP B 25 32.385 -6.873 -48.957 1.00 0.00 H ATOM 1614 H TRP B 25 29.297 -6.819 -44.723 1.00 0.00 H ATOM 1615 N SER B 26 28.354 -9.831 -45.781 1.00 17.48 N ATOM 1616 CA SER B 26 27.706 -11.151 -45.805 1.00 18.75 C ATOM 1617 C SER B 26 26.324 -11.048 -46.416 1.00 18.15 C ATOM 1618 O SER B 26 25.522 -12.004 -46.490 1.00 17.41 O ATOM 1619 CB SER B 26 27.593 -11.582 -44.301 1.00 21.50 C ATOM 1620 OG SER B 26 27.384 -10.274 -43.668 1.00 29.53 O ATOM 1621 HA SER B 26 28.271 -11.869 -46.399 1.00 0.00 H ATOM 1622 HB2 SER B 26 28.507 -12.060 -43.948 1.00 0.00 H ATOM 1623 HB3 SER B 26 26.748 -12.250 -44.135 1.00 0.00 H ATOM 1624 HG SER B 26 28.135 -9.706 -43.854 1.00 0.00 H ATOM 1625 H SER B 26 28.463 -9.347 -44.890 1.00 0.00 H ATOM 1626 N SER B 27 25.992 -9.828 -46.833 1.00 17.55 N ATOM 1627 CA SER B 27 24.639 -9.675 -47.390 1.00 18.59 C ATOM 1628 C SER B 27 24.521 -9.559 -48.900 1.00 19.76 C ATOM 1629 O SER B 27 25.508 -9.272 -49.556 1.00 20.38 O ATOM 1630 CB SER B 27 24.195 -8.439 -46.623 1.00 19.24 C ATOM 1631 OG SER B 27 22.833 -8.544 -46.761 1.00 24.22 O ATOM 1632 HA SER B 27 24.018 -10.562 -47.264 1.00 0.00 H ATOM 1633 HB2 SER B 27 24.578 -7.524 -47.075 1.00 0.00 H ATOM 1634 HB3 SER B 27 24.500 -8.481 -45.577 1.00 0.00 H ATOM 1635 HG SER B 27 22.409 -7.808 -46.313 1.00 0.00 H ATOM 1636 H SER B 27 26.640 -9.043 -46.770 1.00 0.00 H ATOM 1637 N THR B 28 23.346 -9.840 -49.506 1.00 21.66 N ATOM 1638 CA THR B 28 23.182 -9.658 -50.983 1.00 21.94 C ATOM 1639 C THR B 28 22.062 -8.724 -51.354 1.00 20.43 C ATOM 1640 O THR B 28 21.534 -8.932 -52.461 1.00 23.30 O ATOM 1641 CB THR B 28 22.950 -10.940 -51.867 1.00 21.29 C ATOM 1642 OG1 THR B 28 21.904 -11.726 -51.187 1.00 20.44 O ATOM 1643 CG2 THR B 28 24.222 -11.661 -52.295 1.00 21.54 C ATOM 1644 HA THR B 28 24.171 -9.259 -51.209 1.00 0.00 H ATOM 1645 HB THR B 28 22.584 -10.683 -52.861 1.00 0.00 H ATOM 1646 HG1 THR B 28 21.726 -12.523 -51.691 1.00 0.00 H ATOM 1647 HG23 THR B 28 24.894 -10.953 -52.780 1.00 0.00 H ATOM 1648 HG21 THR B 28 24.711 -12.085 -51.418 1.00 0.00 H ATOM 1649 HG22 THR B 28 23.968 -12.459 -52.992 1.00 0.00 H ATOM 1650 H THR B 28 22.561 -10.180 -48.950 1.00 0.00 H ATOM 1651 N SER B 29 21.768 -7.754 -50.565 1.00 20.45 N ATOM 1652 CA SER B 29 20.666 -6.798 -50.851 1.00 19.91 C ATOM 1653 C SER B 29 20.996 -5.581 -49.964 1.00 20.15 C ATOM 1654 O SER B 29 21.577 -5.640 -48.840 1.00 18.79 O ATOM 1655 CB SER B 29 19.282 -7.385 -50.726 1.00 21.74 C ATOM 1656 OG SER B 29 18.283 -6.436 -50.315 1.00 18.89 O ATOM 1657 HA SER B 29 20.619 -6.499 -51.898 1.00 0.00 H ATOM 1658 HB2 SER B 29 19.315 -8.189 -49.991 1.00 0.00 H ATOM 1659 HB3 SER B 29 18.992 -7.791 -51.695 1.00 0.00 H ATOM 1660 HG SER B 29 17.431 -6.875 -50.256 1.00 0.00 H ATOM 1661 H SER B 29 22.311 -7.635 -49.710 1.00 0.00 H ATOM 1662 N PRO B 30 20.781 -4.408 -50.557 1.00 19.40 N ATOM 1663 CA PRO B 30 20.240 -4.216 -51.872 1.00 19.54 C ATOM 1664 C PRO B 30 21.214 -4.601 -52.987 1.00 19.35 C ATOM 1665 O PRO B 30 20.806 -4.408 -54.133 1.00 20.98 O ATOM 1666 CB PRO B 30 19.934 -2.712 -51.979 1.00 19.61 C ATOM 1667 CG PRO B 30 20.676 -2.049 -50.865 1.00 19.38 C ATOM 1668 CD PRO B 30 21.158 -3.125 -49.895 1.00 19.18 C ATOM 1669 HA PRO B 30 19.364 -4.852 -51.999 1.00 0.00 H ATOM 1670 HD3 PRO B 30 22.237 -3.064 -49.755 1.00 0.00 H ATOM 1671 HD2 PRO B 30 20.661 -3.027 -48.930 1.00 0.00 H ATOM 1672 HG3 PRO B 30 20.016 -1.354 -50.345 1.00 0.00 H ATOM 1673 HG2 PRO B 30 21.531 -1.505 -51.265 1.00 0.00 H ATOM 1674 HB2 PRO B 30 20.273 -2.326 -52.940 1.00 0.00 H ATOM 1675 HB3 PRO B 30 18.863 -2.537 -51.876 1.00 0.00 H ATOM 1676 N HIS B 31 22.491 -4.767 -52.777 1.00 19.99 N ATOM 1677 CA HIS B 31 23.594 -5.067 -53.690 1.00 17.42 C ATOM 1678 C HIS B 31 24.249 -6.396 -53.533 1.00 17.44 C ATOM 1679 O HIS B 31 24.720 -6.664 -52.395 1.00 15.93 O ATOM 1680 CB HIS B 31 24.764 -4.014 -53.480 1.00 16.72 C ATOM 1681 CG HIS B 31 24.276 -2.594 -53.624 1.00 14.12 C ATOM 1682 ND1 HIS B 31 24.253 -1.674 -52.594 1.00 15.15 N ATOM 1683 CD2 HIS B 31 23.684 -1.966 -54.702 1.00 10.13 C ATOM 1684 CE1 HIS B 31 23.734 -0.524 -52.999 1.00 10.00 C ATOM 1685 NE2 HIS B 31 23.479 -0.676 -54.284 1.00 11.89 N ATOM 1686 HA HIS B 31 23.114 -5.040 -54.668 1.00 0.00 H ATOM 1687 HB2 HIS B 31 25.180 -4.144 -52.481 1.00 0.00 H ATOM 1688 HB3 HIS B 31 25.541 -4.197 -54.223 1.00 0.00 H ATOM 1689 HD2 HIS B 31 23.435 -2.400 -55.671 1.00 0.00 H ATOM 1690 HE1 HIS B 31 23.555 0.365 -52.394 1.00 0.00 H ATOM 1691 H HIS B 31 22.770 -4.670 -51.801 1.00 0.00 H ATOM 1692 N ARG B 32 24.421 -7.220 -54.586 1.00 17.26 N ATOM 1693 CA ARG B 32 25.247 -8.448 -54.485 1.00 18.07 C ATOM 1694 C ARG B 32 26.738 -8.169 -54.481 1.00 19.06 C ATOM 1695 O ARG B 32 27.364 -7.776 -55.539 1.00 18.12 O ATOM 1696 CB ARG B 32 24.840 -9.351 -55.667 1.00 23.52 C ATOM 1697 CG ARG B 32 25.711 -10.630 -55.753 1.00 27.93 C ATOM 1698 CD ARG B 32 25.201 -11.604 -56.782 1.00 30.80 C ATOM 1699 NE ARG B 32 24.387 -12.628 -56.093 1.00 34.29 N ATOM 1700 CZ ARG B 32 23.105 -12.392 -55.724 1.00 35.77 C ATOM 1701 NH1 ARG B 32 22.546 -11.241 -56.152 1.00 35.68 N ATOM 1702 NH2 ARG B 32 22.356 -13.294 -55.078 1.00 33.49 N ATOM 1703 HA ARG B 32 25.061 -8.938 -53.529 1.00 0.00 H ATOM 1704 HB2 ARG B 32 23.797 -9.644 -55.543 1.00 0.00 H ATOM 1705 HB3 ARG B 32 24.950 -8.788 -56.594 1.00 0.00 H ATOM 1706 HG2 ARG B 32 26.729 -10.343 -56.016 1.00 0.00 H ATOM 1707 HG3 ARG B 32 25.713 -11.119 -54.779 1.00 0.00 H ATOM 1708 HD2 ARG B 32 26.041 -12.080 -57.287 1.00 0.00 H ATOM 1709 HD3 ARG B 32 24.589 -11.079 -57.515 1.00 0.00 H ATOM 1710 HE ARG B 32 24.802 -13.537 -55.890 1.00 0.00 H ATOM 1711 HH12 ARG B 32 21.583 -11.017 -55.901 1.00 0.00 H ATOM 1712 HH11 ARG B 32 23.086 -10.594 -56.727 1.00 0.00 H ATOM 1713 HH22 ARG B 32 21.395 -13.069 -54.821 1.00 0.00 H ATOM 1714 HH21 ARG B 32 22.746 -14.206 -54.842 1.00 0.00 H ATOM 1715 H ARG B 32 23.972 -6.994 -55.474 1.00 0.00 H ATOM 1716 N PRO B 33 27.444 -8.387 -53.357 1.00 18.23 N ATOM 1717 CA PRO B 33 28.853 -8.129 -53.210 1.00 19.45 C ATOM 1718 C PRO B 33 29.725 -8.984 -54.136 1.00 19.43 C ATOM 1719 O PRO B 33 29.326 -10.155 -54.297 1.00 20.10 O ATOM 1720 CB PRO B 33 29.223 -8.472 -51.713 1.00 19.33 C ATOM 1721 CG PRO B 33 27.950 -8.850 -51.039 1.00 18.50 C ATOM 1722 CD PRO B 33 26.856 -8.866 -52.087 1.00 19.25 C ATOM 1723 HA PRO B 33 29.044 -7.089 -53.473 1.00 0.00 H ATOM 1724 HD3 PRO B 33 26.476 -9.880 -52.212 1.00 0.00 H ATOM 1725 HD2 PRO B 33 26.041 -8.209 -51.784 1.00 0.00 H ATOM 1726 HG3 PRO B 33 27.710 -8.122 -50.264 1.00 0.00 H ATOM 1727 HG2 PRO B 33 28.048 -9.838 -50.590 1.00 0.00 H ATOM 1728 HB2 PRO B 33 29.928 -9.303 -51.680 1.00 0.00 H ATOM 1729 HB3 PRO B 33 29.664 -7.603 -51.225 1.00 0.00 H ATOM 1730 N ARG B 34 30.766 -8.448 -54.679 1.00 19.18 N ATOM 1731 CA ARG B 34 31.683 -9.216 -55.568 1.00 19.60 C ATOM 1732 C ARG B 34 32.924 -9.599 -54.755 1.00 19.01 C ATOM 1733 O ARG B 34 33.785 -10.458 -55.000 1.00 18.93 O ATOM 1734 CB ARG B 34 31.788 -8.425 -56.842 1.00 22.66 C ATOM 1735 CG ARG B 34 32.571 -9.095 -57.996 1.00 26.16 C ATOM 1736 CD ARG B 34 31.909 -8.843 -59.334 1.00 26.98 C ATOM 1737 NE ARG B 34 31.655 -7.455 -59.537 1.00 28.23 N ATOM 1738 CZ ARG B 34 32.483 -6.424 -59.816 1.00 29.06 C ATOM 1739 NH1 ARG B 34 33.743 -6.424 -60.293 1.00 25.51 N ATOM 1740 NH2 ARG B 34 31.871 -5.211 -59.576 1.00 29.59 N ATOM 1741 HA ARG B 34 31.355 -10.196 -55.914 1.00 0.00 H ATOM 1742 HB2 ARG B 34 30.776 -8.227 -57.196 1.00 0.00 H ATOM 1743 HB3 ARG B 34 32.281 -7.481 -56.609 1.00 0.00 H ATOM 1744 HG2 ARG B 34 33.583 -8.691 -58.019 1.00 0.00 H ATOM 1745 HG3 ARG B 34 32.614 -10.170 -57.818 1.00 0.00 H ATOM 1746 HD2 ARG B 34 30.964 -9.385 -59.370 1.00 0.00 H ATOM 1747 HD3 ARG B 34 32.564 -9.203 -60.127 1.00 0.00 H ATOM 1748 HE ARG B 34 30.672 -7.193 -59.457 1.00 0.00 H ATOM 1749 HH12 ARG B 34 34.230 -5.541 -60.448 1.00 0.00 H ATOM 1750 HH11 ARG B 34 34.210 -7.307 -60.499 1.00 0.00 H ATOM 1751 HH22 ARG B 34 32.378 -4.342 -59.743 1.00 0.00 H ATOM 1752 HH21 ARG B 34 30.911 -5.183 -59.232 1.00 0.00 H ATOM 1753 H ARG B 34 30.968 -7.466 -54.493 1.00 0.00 H ATOM 1754 N PHE B 35 32.952 -9.014 -53.565 1.00 18.05 N ATOM 1755 CA PHE B 35 33.929 -9.123 -52.503 1.00 18.37 C ATOM 1756 C PHE B 35 33.193 -9.596 -51.226 1.00 17.75 C ATOM 1757 O PHE B 35 32.296 -8.856 -50.856 1.00 18.25 O ATOM 1758 CB PHE B 35 34.662 -7.785 -52.200 1.00 18.76 C ATOM 1759 CG PHE B 35 35.657 -7.441 -53.266 1.00 19.96 C ATOM 1760 CD1 PHE B 35 35.282 -6.819 -54.442 1.00 21.53 C ATOM 1761 CD2 PHE B 35 36.975 -7.921 -53.127 1.00 22.02 C ATOM 1762 CE1 PHE B 35 36.191 -6.596 -55.482 1.00 21.43 C ATOM 1763 CE2 PHE B 35 37.938 -7.710 -54.168 1.00 22.06 C ATOM 1764 CZ PHE B 35 37.516 -7.017 -55.310 1.00 23.48 C ATOM 1765 HA PHE B 35 34.693 -9.831 -52.824 1.00 0.00 H ATOM 1766 HB2 PHE B 35 33.924 -6.985 -52.134 1.00 0.00 H ATOM 1767 HB3 PHE B 35 35.183 -7.876 -51.247 1.00 0.00 H ATOM 1768 HD2 PHE B 35 37.264 -8.456 -52.222 1.00 0.00 H ATOM 1769 HE2 PHE B 35 38.961 -8.075 -54.074 1.00 0.00 H ATOM 1770 HZ PHE B 35 38.244 -6.798 -56.092 1.00 0.00 H ATOM 1771 HE1 PHE B 35 35.876 -6.107 -56.404 1.00 0.00 H ATOM 1772 HD1 PHE B 35 34.249 -6.493 -54.563 1.00 0.00 H ATOM 1773 H PHE B 35 32.166 -8.394 -53.369 1.00 0.00 H ATOM 1774 N SER B 36 33.582 -10.687 -50.616 1.00 18.03 N ATOM 1775 CA SER B 36 32.890 -11.027 -49.358 1.00 19.28 C ATOM 1776 C SER B 36 33.681 -12.134 -48.659 1.00 19.40 C ATOM 1777 O SER B 36 34.684 -12.579 -49.191 1.00 20.04 O ATOM 1778 CB SER B 36 31.435 -11.363 -49.503 1.00 19.91 C ATOM 1779 OG SER B 36 31.199 -12.566 -50.156 1.00 20.78 O ATOM 1780 HA SER B 36 32.870 -10.128 -48.741 1.00 0.00 H ATOM 1781 HB2 SER B 36 30.952 -10.565 -50.067 1.00 0.00 H ATOM 1782 HB3 SER B 36 30.994 -11.420 -48.508 1.00 0.00 H ATOM 1783 HG SER B 36 31.572 -12.528 -51.040 1.00 0.00 H ATOM 1784 H SER B 36 34.327 -11.273 -50.992 1.00 0.00 H ATOM 1785 N PRO B 37 33.212 -12.357 -47.460 1.00 19.34 N ATOM 1786 CA PRO B 37 33.804 -13.359 -46.612 1.00 19.62 C ATOM 1787 C PRO B 37 33.932 -14.694 -47.313 1.00 19.65 C ATOM 1788 O PRO B 37 34.977 -15.325 -47.230 1.00 20.37 O ATOM 1789 CB PRO B 37 32.929 -13.371 -45.335 1.00 19.23 C ATOM 1790 CG PRO B 37 31.858 -12.367 -45.521 1.00 19.31 C ATOM 1791 CD PRO B 37 31.952 -11.767 -46.902 1.00 19.45 C ATOM 1792 HA PRO B 37 34.838 -13.134 -46.349 1.00 0.00 H ATOM 1793 HD3 PRO B 37 31.090 -12.047 -47.507 1.00 0.00 H ATOM 1794 HD2 PRO B 37 32.021 -10.680 -46.850 1.00 0.00 H ATOM 1795 HG3 PRO B 37 31.967 -11.579 -44.776 1.00 0.00 H ATOM 1796 HG2 PRO B 37 30.887 -12.847 -45.400 1.00 0.00 H ATOM 1797 HB2 PRO B 37 32.492 -14.359 -45.192 1.00 0.00 H ATOM 1798 HB3 PRO B 37 33.534 -13.113 -44.466 1.00 0.00 H ATOM 1799 N ALA B 38 32.987 -15.207 -48.059 1.00 20.11 N ATOM 1800 CA ALA B 38 33.161 -16.546 -48.647 1.00 21.40 C ATOM 1801 C ALA B 38 34.349 -16.609 -49.622 1.00 21.63 C ATOM 1802 O ALA B 38 35.083 -17.580 -49.753 1.00 20.79 O ATOM 1803 CB ALA B 38 31.838 -16.930 -49.407 1.00 21.00 C ATOM 1804 HA ALA B 38 33.371 -17.248 -47.840 1.00 0.00 H ATOM 1805 HB1 ALA B 38 31.005 -16.936 -48.704 1.00 0.00 H ATOM 1806 HB2 ALA B 38 31.647 -16.199 -50.193 1.00 0.00 H ATOM 1807 HB3 ALA B 38 31.949 -17.920 -49.849 1.00 0.00 H ATOM 1808 H ALA B 38 32.131 -14.680 -48.233 1.00 0.00 H ATOM 1809 N THR B 39 34.490 -15.516 -50.361 1.00 20.91 N ATOM 1810 CA THR B 39 35.415 -15.321 -51.481 1.00 20.07 C ATOM 1811 C THR B 39 36.726 -14.716 -51.202 1.00 19.98 C ATOM 1812 O THR B 39 37.757 -14.900 -51.865 1.00 19.27 O ATOM 1813 CB THR B 39 34.362 -14.536 -52.424 1.00 22.08 C ATOM 1814 OG1 THR B 39 34.151 -15.602 -53.403 1.00 24.73 O ATOM 1815 CG2 THR B 39 34.698 -13.116 -52.780 1.00 21.24 C ATOM 1816 HA THR B 39 35.871 -16.212 -51.913 1.00 0.00 H ATOM 1817 HB THR B 39 33.417 -14.188 -52.006 1.00 0.00 H ATOM 1818 HG1 THR B 39 33.527 -15.304 -54.069 1.00 0.00 H ATOM 1819 HG23 THR B 39 34.802 -12.529 -51.868 1.00 0.00 H ATOM 1820 HG21 THR B 39 35.635 -13.094 -53.336 1.00 0.00 H ATOM 1821 HG22 THR B 39 33.900 -12.698 -53.394 1.00 0.00 H ATOM 1822 H THR B 39 33.890 -14.726 -50.124 1.00 0.00 H ATOM 1823 N HIS B 40 36.787 -14.005 -50.082 1.00 19.80 N ATOM 1824 CA HIS B 40 37.939 -13.283 -49.591 1.00 19.34 C ATOM 1825 C HIS B 40 38.119 -13.453 -48.071 1.00 19.43 C ATOM 1826 O HIS B 40 38.116 -12.470 -47.342 1.00 19.19 O ATOM 1827 CB HIS B 40 37.889 -11.775 -49.925 1.00 15.36 C ATOM 1828 CG HIS B 40 37.981 -11.474 -51.374 1.00 14.49 C ATOM 1829 ND1 HIS B 40 36.916 -11.612 -52.238 1.00 16.22 N ATOM 1830 CD2 HIS B 40 39.027 -11.179 -52.153 1.00 16.57 C ATOM 1831 CE1 HIS B 40 37.270 -11.241 -53.480 1.00 15.68 C ATOM 1832 NE2 HIS B 40 38.552 -10.993 -53.457 1.00 13.79 N ATOM 1833 HA HIS B 40 38.793 -13.722 -50.108 1.00 0.00 H ATOM 1834 HB2 HIS B 40 36.948 -11.372 -49.550 1.00 0.00 H ATOM 1835 HB3 HIS B 40 38.720 -11.284 -49.419 1.00 0.00 H ATOM 1836 HD2 HIS B 40 40.065 -11.098 -51.830 1.00 0.00 H ATOM 1837 HE1 HIS B 40 36.611 -11.162 -54.344 1.00 0.00 H ATOM 1838 H HIS B 40 35.941 -13.965 -49.514 1.00 0.00 H ATOM 1839 N PRO B 41 38.400 -14.702 -47.731 1.00 21.04 N ATOM 1840 CA PRO B 41 38.558 -15.107 -46.346 1.00 20.75 C ATOM 1841 C PRO B 41 39.535 -14.332 -45.531 1.00 20.03 C ATOM 1842 O PRO B 41 39.194 -14.209 -44.321 1.00 20.93 O ATOM 1843 CB PRO B 41 38.884 -16.610 -46.320 1.00 20.93 C ATOM 1844 CG PRO B 41 38.697 -17.059 -47.699 1.00 21.41 C ATOM 1845 CD PRO B 41 38.378 -15.877 -48.597 1.00 20.06 C ATOM 1846 HA PRO B 41 37.609 -14.885 -45.858 1.00 0.00 H ATOM 1847 HD3 PRO B 41 39.128 -15.784 -49.383 1.00 0.00 H ATOM 1848 HD2 PRO B 41 37.393 -15.998 -49.048 1.00 0.00 H ATOM 1849 HG3 PRO B 41 37.874 -17.773 -47.737 1.00 0.00 H ATOM 1850 HG2 PRO B 41 39.610 -17.541 -48.048 1.00 0.00 H ATOM 1851 HB2 PRO B 41 39.913 -16.774 -45.999 1.00 0.00 H ATOM 1852 HB3 PRO B 41 38.207 -17.138 -45.649 1.00 0.00 H ATOM 1853 N SER B 42 40.590 -13.812 -46.092 1.00 20.09 N ATOM 1854 CA SER B 42 41.579 -13.080 -45.281 1.00 19.74 C ATOM 1855 C SER B 42 41.385 -11.582 -45.272 1.00 17.61 C ATOM 1856 O SER B 42 42.293 -10.958 -44.684 1.00 17.47 O ATOM 1857 CB SER B 42 42.995 -13.398 -45.813 1.00 19.92 C ATOM 1858 OG SER B 42 42.776 -12.972 -47.189 1.00 32.08 O ATOM 1859 HA SER B 42 41.444 -13.415 -44.252 1.00 0.00 H ATOM 1860 HB2 SER B 42 43.239 -14.458 -45.739 1.00 0.00 H ATOM 1861 HB3 SER B 42 43.768 -12.813 -45.314 1.00 0.00 H ATOM 1862 HG SER B 42 42.068 -13.493 -47.575 1.00 0.00 H ATOM 1863 H SER B 42 40.732 -13.912 -47.097 1.00 0.00 H ATOM 1864 N GLU B 43 40.335 -11.038 -45.837 1.00 17.01 N ATOM 1865 CA GLU B 43 40.211 -9.556 -45.860 1.00 15.58 C ATOM 1866 C GLU B 43 39.488 -8.941 -44.663 1.00 15.63 C ATOM 1867 O GLU B 43 39.275 -7.695 -44.735 1.00 14.90 O ATOM 1868 CB GLU B 43 39.496 -9.042 -47.118 1.00 14.78 C ATOM 1869 CG GLU B 43 40.038 -9.525 -48.472 1.00 14.93 C ATOM 1870 CD GLU B 43 41.532 -9.369 -48.537 1.00 16.06 C ATOM 1871 OE1 GLU B 43 42.126 -8.431 -48.036 1.00 16.09 O ATOM 1872 OE2 GLU B 43 42.056 -10.357 -49.039 1.00 22.72 O ATOM 1873 HA GLU B 43 41.254 -9.240 -45.835 1.00 0.00 H ATOM 1874 HB2 GLU B 43 38.452 -9.349 -47.052 1.00 0.00 H ATOM 1875 HB3 GLU B 43 39.555 -7.954 -47.109 1.00 0.00 H ATOM 1876 HG2 GLU B 43 39.782 -10.576 -48.605 1.00 0.00 H ATOM 1877 HG3 GLU B 43 39.582 -8.938 -49.269 1.00 0.00 H ATOM 1878 H GLU B 43 39.612 -11.623 -46.256 1.00 0.00 H ATOM 1879 N GLY B 44 39.085 -9.730 -43.665 1.00 15.26 N ATOM 1880 CA GLY B 44 38.357 -9.102 -42.486 1.00 15.77 C ATOM 1881 C GLY B 44 37.076 -8.347 -42.833 1.00 15.26 C ATOM 1882 O GLY B 44 36.744 -7.261 -42.289 1.00 15.68 O ATOM 1883 HA3 GLY B 44 39.039 -8.403 -42.003 1.00 0.00 H ATOM 1884 HA2 GLY B 44 38.100 -9.898 -41.787 1.00 0.00 H ATOM 1885 H GLY B 44 39.262 -10.734 -43.692 1.00 0.00 H ATOM 1886 N LEU B 45 36.319 -8.836 -43.807 1.00 14.30 N ATOM 1887 CA LEU B 45 35.028 -8.346 -44.215 1.00 15.79 C ATOM 1888 C LEU B 45 33.860 -8.690 -43.264 1.00 16.01 C ATOM 1889 O LEU B 45 32.881 -9.306 -43.688 1.00 16.98 O ATOM 1890 CB LEU B 45 34.702 -8.909 -45.636 1.00 14.98 C ATOM 1891 CG LEU B 45 35.107 -8.075 -46.875 1.00 17.44 C ATOM 1892 CD1 LEU B 45 36.201 -7.041 -46.701 1.00 10.40 C ATOM 1893 CD2 LEU B 45 35.651 -9.119 -47.896 1.00 12.10 C ATOM 1894 HA LEU B 45 35.108 -7.259 -44.203 1.00 0.00 H ATOM 1895 HB2 LEU B 45 35.201 -9.874 -45.721 1.00 0.00 H ATOM 1896 HB3 LEU B 45 33.623 -9.053 -45.685 1.00 0.00 H ATOM 1897 HG LEU B 45 34.225 -7.501 -47.159 1.00 0.00 H ATOM 1898 HD21 LEU B 45 36.505 -9.639 -47.462 1.00 0.00 H ATOM 1899 HD22 LEU B 45 34.867 -9.838 -48.131 1.00 0.00 H ATOM 1900 HD23 LEU B 45 35.961 -8.607 -48.807 1.00 0.00 H ATOM 1901 HD11 LEU B 45 35.894 -6.311 -45.952 1.00 0.00 H ATOM 1902 HD12 LEU B 45 37.117 -7.534 -46.375 1.00 0.00 H ATOM 1903 HD13 LEU B 45 36.377 -6.536 -47.651 1.00 0.00 H ATOM 1904 H LEU B 45 36.688 -9.638 -44.317 1.00 0.00 H ATOM 1905 N GLU B 46 33.901 -8.338 -42.046 1.00 16.83 N ATOM 1906 CA GLU B 46 33.079 -8.376 -40.870 1.00 17.10 C ATOM 1907 C GLU B 46 31.945 -7.368 -40.845 1.00 16.30 C ATOM 1908 O GLU B 46 32.117 -6.147 -41.037 1.00 15.67 O ATOM 1909 CB GLU B 46 33.903 -7.882 -39.614 1.00 24.12 C ATOM 1910 CG GLU B 46 35.227 -8.441 -39.230 1.00 28.42 C ATOM 1911 CD GLU B 46 36.506 -7.862 -38.769 1.00 30.96 C ATOM 1912 OE1 GLU B 46 36.790 -6.871 -38.081 1.00 34.54 O ATOM 1913 OE2 GLU B 46 37.486 -8.612 -39.091 1.00 31.22 O ATOM 1914 HA GLU B 46 32.723 -9.406 -40.861 1.00 0.00 H ATOM 1915 HB2 GLU B 46 34.062 -6.814 -39.763 1.00 0.00 H ATOM 1916 HB3 GLU B 46 33.253 -8.035 -38.752 1.00 0.00 H ATOM 1917 HG2 GLU B 46 34.974 -9.137 -38.430 1.00 0.00 H ATOM 1918 HG3 GLU B 46 35.520 -9.001 -40.118 1.00 0.00 H ATOM 1919 H GLU B 46 34.793 -7.890 -41.838 1.00 0.00 H ATOM 1920 N GLU B 47 30.727 -7.845 -40.634 1.00 15.40 N ATOM 1921 CA GLU B 47 29.611 -6.898 -40.566 1.00 14.37 C ATOM 1922 C GLU B 47 29.511 -5.994 -41.792 1.00 13.92 C ATOM 1923 O GLU B 47 29.088 -6.588 -42.832 1.00 11.48 O ATOM 1924 CB GLU B 47 29.666 -6.108 -39.274 1.00 14.88 C ATOM 1925 CG GLU B 47 29.654 -7.099 -38.099 1.00 19.36 C ATOM 1926 CD GLU B 47 28.385 -7.725 -37.682 1.00 21.38 C ATOM 1927 OE1 GLU B 47 27.245 -7.257 -37.840 1.00 23.19 O ATOM 1928 OE2 GLU B 47 28.658 -8.829 -37.143 1.00 23.60 O ATOM 1929 HA GLU B 47 28.692 -7.484 -40.570 1.00 0.00 H ATOM 1930 HB2 GLU B 47 30.579 -5.513 -39.245 1.00 0.00 H ATOM 1931 HB3 GLU B 47 28.801 -5.448 -39.208 1.00 0.00 H ATOM 1932 HG2 GLU B 47 30.335 -7.909 -38.362 1.00 0.00 H ATOM 1933 HG3 GLU B 47 30.043 -6.566 -37.232 1.00 0.00 H ATOM 1934 H GLU B 47 30.570 -8.847 -40.522 1.00 0.00 H ATOM 1935 N ASN B 48 29.461 -4.702 -41.466 1.00 13.52 N ATOM 1936 CA ASN B 48 29.276 -3.636 -42.500 1.00 13.41 C ATOM 1937 C ASN B 48 30.421 -2.652 -42.334 1.00 12.68 C ATOM 1938 O ASN B 48 30.278 -1.449 -42.588 1.00 16.12 O ATOM 1939 CB ASN B 48 27.895 -2.947 -42.464 1.00 11.70 C ATOM 1940 CG ASN B 48 27.635 -2.111 -41.163 1.00 12.70 C ATOM 1941 OD1 ASN B 48 28.474 -2.318 -40.244 1.00 12.85 O ATOM 1942 ND2 ASN B 48 26.767 -1.103 -41.205 1.00 10.00 N ATOM 1943 HA ASN B 48 29.297 -4.094 -43.489 1.00 0.00 H ATOM 1944 HB2 ASN B 48 27.822 -2.279 -43.322 1.00 0.00 H ATOM 1945 HB3 ASN B 48 27.126 -3.716 -42.538 1.00 0.00 H ATOM 1946 HD22 ASN B 48 26.124 -1.016 -41.992 1.00 0.00 H ATOM 1947 HD21 ASN B 48 26.745 -0.417 -40.450 1.00 0.00 H ATOM 1948 H ASN B 48 29.551 -4.433 -40.486 1.00 0.00 H ATOM 1949 N TYR B 49 31.598 -3.147 -41.965 1.00 12.97 N ATOM 1950 CA TYR B 49 32.701 -2.222 -41.658 1.00 10.82 C ATOM 1951 C TYR B 49 33.411 -1.807 -42.905 1.00 10.50 C ATOM 1952 O TYR B 49 33.635 -2.747 -43.730 1.00 11.34 O ATOM 1953 CB TYR B 49 33.649 -2.625 -40.539 1.00 13.76 C ATOM 1954 CG TYR B 49 33.043 -2.942 -39.117 1.00 14.16 C ATOM 1955 CD1 TYR B 49 31.897 -2.335 -38.644 1.00 12.24 C ATOM 1956 CD2 TYR B 49 33.504 -4.125 -38.480 1.00 11.04 C ATOM 1957 CE1 TYR B 49 31.454 -2.576 -37.313 1.00 13.26 C ATOM 1958 CE2 TYR B 49 32.847 -4.556 -37.312 1.00 13.60 C ATOM 1959 CZ TYR B 49 31.822 -3.800 -36.705 1.00 12.68 C ATOM 1960 OH TYR B 49 31.221 -4.197 -35.507 1.00 11.41 O ATOM 1961 HA TYR B 49 32.208 -1.353 -41.223 1.00 0.00 H ATOM 1962 HB3 TYR B 49 34.361 -1.810 -40.411 1.00 0.00 H ATOM 1963 HB2 TYR B 49 34.177 -3.519 -40.871 1.00 0.00 H ATOM 1964 HD2 TYR B 49 34.346 -4.686 -38.886 1.00 0.00 H ATOM 1965 HE2 TYR B 49 33.140 -5.505 -36.862 1.00 0.00 H ATOM 1966 HE1 TYR B 49 30.851 -1.842 -36.779 1.00 0.00 H ATOM 1967 HD1 TYR B 49 31.329 -1.668 -39.293 1.00 0.00 H ATOM 1968 HH TYR B 49 30.551 -3.556 -35.258 1.00 0.00 H ATOM 1969 H TYR B 49 31.735 -4.155 -41.895 1.00 0.00 H ATOM 1970 N CYS B 50 34.110 -0.664 -42.870 1.00 10.72 N ATOM 1971 CA CYS B 50 34.844 -0.227 -44.098 1.00 10.94 C ATOM 1972 C CYS B 50 36.082 -1.059 -44.197 1.00 12.45 C ATOM 1973 O CYS B 50 36.879 -1.093 -43.248 1.00 13.98 O ATOM 1974 CB CYS B 50 35.163 1.266 -44.066 1.00 10.15 C ATOM 1975 SG CYS B 50 33.613 2.196 -43.921 1.00 14.12 S ATOM 1976 HA CYS B 50 34.222 -0.374 -44.981 1.00 0.00 H ATOM 1977 HB2 CYS B 50 35.676 1.550 -44.985 1.00 0.00 H ATOM 1978 HB3 CYS B 50 35.803 1.485 -43.211 1.00 0.00 H ATOM 1979 H CYS B 50 34.141 -0.101 -42.020 1.00 0.00 H ATOM 1980 N ARG B 51 36.398 -1.570 -45.361 1.00 13.80 N ATOM 1981 CA ARG B 51 37.485 -2.477 -45.746 1.00 12.36 C ATOM 1982 C ARG B 51 38.053 -2.187 -47.145 1.00 12.98 C ATOM 1983 O ARG B 51 37.503 -1.418 -47.976 1.00 14.08 O ATOM 1984 CB ARG B 51 36.935 -3.921 -45.603 1.00 11.39 C ATOM 1985 CG ARG B 51 36.616 -4.479 -44.213 1.00 10.44 C ATOM 1986 CD ARG B 51 37.770 -4.840 -43.406 1.00 12.44 C ATOM 1987 NE ARG B 51 37.479 -5.169 -41.983 1.00 14.08 N ATOM 1988 CZ ARG B 51 37.420 -4.311 -40.981 1.00 12.44 C ATOM 1989 NH1 ARG B 51 37.249 -2.978 -41.048 1.00 10.96 N ATOM 1990 NH2 ARG B 51 37.142 -4.898 -39.798 1.00 12.95 N ATOM 1991 HA ARG B 51 38.343 -2.331 -45.090 1.00 0.00 H ATOM 1992 HB2 ARG B 51 36.012 -3.966 -46.181 1.00 0.00 H ATOM 1993 HB3 ARG B 51 37.674 -4.586 -46.049 1.00 0.00 H ATOM 1994 HG2 ARG B 51 36.048 -3.724 -43.669 1.00 0.00 H ATOM 1995 HG3 ARG B 51 36.003 -5.371 -44.341 1.00 0.00 H ATOM 1996 HD2 ARG B 51 38.467 -4.002 -43.422 1.00 0.00 H ATOM 1997 HD3 ARG B 51 38.241 -5.711 -43.863 1.00 0.00 H ATOM 1998 HE ARG B 51 37.309 -6.150 -41.761 1.00 0.00 H ATOM 1999 HH12 ARG B 51 37.221 -2.424 -40.192 1.00 0.00 H ATOM 2000 HH11 ARG B 51 37.147 -2.522 -41.955 1.00 0.00 H ATOM 2001 HH22 ARG B 51 37.072 -4.332 -38.952 1.00 0.00 H ATOM 2002 HH21 ARG B 51 37.002 -5.907 -39.750 1.00 0.00 H ATOM 2003 H ARG B 51 35.786 -1.291 -46.128 1.00 0.00 H ATOM 2004 N ASN B 52 39.300 -2.515 -47.390 1.00 12.51 N ATOM 2005 CA ASN B 52 40.038 -2.317 -48.698 1.00 12.26 C ATOM 2006 C ASN B 52 40.562 -3.692 -49.253 1.00 11.67 C ATOM 2007 O ASN B 52 41.753 -4.085 -49.499 1.00 11.66 O ATOM 2008 CB ASN B 52 41.113 -1.232 -48.575 1.00 12.50 C ATOM 2009 CG ASN B 52 41.478 -0.708 -49.952 1.00 12.82 C ATOM 2010 OD1 ASN B 52 40.997 -1.283 -50.917 1.00 15.30 O ATOM 2011 ND2 ASN B 52 42.156 0.429 -50.161 1.00 14.32 N ATOM 2012 HA ASN B 52 39.343 -1.940 -49.448 1.00 0.00 H ATOM 2013 HB2 ASN B 52 40.732 -0.413 -47.965 1.00 0.00 H ATOM 2014 HB3 ASN B 52 42.000 -1.653 -48.102 1.00 0.00 H ATOM 2015 HD22 ASN B 52 42.568 0.929 -49.373 1.00 0.00 H ATOM 2016 HD21 ASN B 52 42.260 0.794 -51.108 1.00 0.00 H ATOM 2017 H ASN B 52 39.822 -2.944 -46.626 1.00 0.00 H ATOM 2018 N PRO B 53 39.595 -4.484 -49.647 1.00 10.88 N ATOM 2019 CA PRO B 53 39.877 -5.828 -50.181 1.00 13.23 C ATOM 2020 C PRO B 53 40.749 -5.770 -51.446 1.00 14.05 C ATOM 2021 O PRO B 53 41.636 -6.596 -51.641 1.00 14.83 O ATOM 2022 CB PRO B 53 38.517 -6.461 -50.456 1.00 11.67 C ATOM 2023 CG PRO B 53 37.476 -5.463 -50.227 1.00 11.36 C ATOM 2024 CD PRO B 53 38.169 -4.255 -49.654 1.00 11.23 C ATOM 2025 HA PRO B 53 40.450 -6.422 -49.469 1.00 0.00 H ATOM 2026 HD3 PRO B 53 37.943 -3.381 -50.265 1.00 0.00 H ATOM 2027 HD2 PRO B 53 37.822 -4.084 -48.635 1.00 0.00 H ATOM 2028 HG3 PRO B 53 36.736 -5.844 -49.523 1.00 0.00 H ATOM 2029 HG2 PRO B 53 36.985 -5.207 -51.166 1.00 0.00 H ATOM 2030 HB2 PRO B 53 38.475 -6.804 -51.490 1.00 0.00 H ATOM 2031 HB3 PRO B 53 38.365 -7.308 -49.787 1.00 0.00 H ATOM 2032 N ASP B 54 40.521 -4.775 -52.272 1.00 16.37 N ATOM 2033 CA ASP B 54 41.263 -4.628 -53.530 1.00 18.36 C ATOM 2034 C ASP B 54 42.434 -3.654 -53.390 1.00 18.96 C ATOM 2035 O ASP B 54 43.071 -3.343 -54.416 1.00 21.22 O ATOM 2036 CB ASP B 54 40.318 -4.250 -54.654 1.00 16.47 C ATOM 2037 CG ASP B 54 39.383 -3.125 -54.340 1.00 15.24 C ATOM 2038 OD1 ASP B 54 39.492 -2.628 -53.177 1.00 18.43 O ATOM 2039 OD2 ASP B 54 38.835 -2.546 -55.335 1.00 15.44 O ATOM 2040 HA ASP B 54 41.708 -5.590 -53.784 1.00 0.00 H ATOM 2041 HB2 ASP B 54 40.917 -3.962 -55.518 1.00 0.00 H ATOM 2042 HB3 ASP B 54 39.721 -5.127 -54.904 1.00 0.00 H ATOM 2043 H ASP B 54 39.809 -4.085 -52.033 1.00 0.00 H ATOM 2044 N ASN B 55 42.595 -3.143 -52.202 1.00 18.54 N ATOM 2045 CA ASN B 55 43.715 -2.189 -52.020 1.00 17.09 C ATOM 2046 C ASN B 55 43.482 -0.958 -52.914 1.00 16.96 C ATOM 2047 O ASN B 55 44.524 -0.552 -53.484 1.00 17.83 O ATOM 2048 CB ASN B 55 44.985 -2.892 -52.381 1.00 19.97 C ATOM 2049 CG ASN B 55 46.310 -2.590 -51.742 1.00 21.76 C ATOM 2050 OD1 ASN B 55 47.045 -1.684 -52.117 1.00 24.01 O ATOM 2051 ND2 ASN B 55 46.763 -3.510 -50.871 1.00 23.71 N ATOM 2052 HA ASN B 55 43.778 -1.846 -50.987 1.00 0.00 H ATOM 2053 HB2 ASN B 55 44.801 -3.951 -52.200 1.00 0.00 H ATOM 2054 HB3 ASN B 55 45.124 -2.726 -53.449 1.00 0.00 H ATOM 2055 HD22 ASN B 55 46.150 -4.263 -50.560 1.00 0.00 H ATOM 2056 HD21 ASN B 55 47.720 -3.454 -50.522 1.00 0.00 H ATOM 2057 H ASN B 55 41.976 -3.389 -51.430 1.00 0.00 H ATOM 2058 N ASP B 56 42.286 -0.468 -53.061 1.00 15.29 N ATOM 2059 CA ASP B 56 42.025 0.699 -53.928 1.00 15.20 C ATOM 2060 C ASP B 56 42.770 1.841 -53.342 1.00 15.87 C ATOM 2061 O ASP B 56 42.645 2.151 -52.133 1.00 18.32 O ATOM 2062 CB ASP B 56 40.521 0.877 -54.041 1.00 12.59 C ATOM 2063 CG ASP B 56 40.004 2.096 -54.786 1.00 14.99 C ATOM 2064 OD1 ASP B 56 40.608 3.198 -54.961 1.00 12.11 O ATOM 2065 OD2 ASP B 56 38.836 1.952 -55.265 1.00 11.56 O ATOM 2066 HA ASP B 56 42.377 0.590 -54.954 1.00 0.00 H ATOM 2067 HB2 ASP B 56 40.126 -0.004 -54.547 1.00 0.00 H ATOM 2068 HB3 ASP B 56 40.122 0.922 -53.028 1.00 0.00 H ATOM 2069 H ASP B 56 41.508 -0.901 -52.564 1.00 0.00 H ATOM 2070 N PRO B 57 43.444 2.624 -54.143 1.00 17.90 N ATOM 2071 CA PRO B 57 44.236 3.744 -53.645 1.00 16.76 C ATOM 2072 C PRO B 57 43.333 4.775 -52.963 1.00 14.93 C ATOM 2073 O PRO B 57 43.837 5.462 -52.064 1.00 13.92 O ATOM 2074 CB PRO B 57 45.019 4.217 -54.838 1.00 17.59 C ATOM 2075 CG PRO B 57 44.477 3.528 -56.020 1.00 18.25 C ATOM 2076 CD PRO B 57 43.448 2.530 -55.620 1.00 18.09 C ATOM 2077 HA PRO B 57 44.940 3.490 -52.852 1.00 0.00 H ATOM 2078 HD3 PRO B 57 42.472 2.788 -56.031 1.00 0.00 H ATOM 2079 HD2 PRO B 57 43.726 1.528 -55.948 1.00 0.00 H ATOM 2080 HG3 PRO B 57 45.288 3.018 -56.540 1.00 0.00 H ATOM 2081 HG2 PRO B 57 44.024 4.262 -56.686 1.00 0.00 H ATOM 2082 HB2 PRO B 57 44.910 5.296 -54.952 1.00 0.00 H ATOM 2083 HB3 PRO B 57 46.074 3.971 -54.714 1.00 0.00 H ATOM 2084 N GLN B 58 42.020 4.783 -53.133 1.00 14.43 N ATOM 2085 CA GLN B 58 41.218 5.793 -52.380 1.00 14.37 C ATOM 2086 C GLN B 58 40.934 5.279 -50.957 1.00 14.37 C ATOM 2087 O GLN B 58 40.379 6.144 -50.216 1.00 13.55 O ATOM 2088 CB GLN B 58 39.970 6.229 -53.095 1.00 17.58 C ATOM 2089 CG GLN B 58 40.189 6.423 -54.600 1.00 16.66 C ATOM 2090 CD GLN B 58 39.341 7.517 -55.169 1.00 19.94 C ATOM 2091 OE1 GLN B 58 39.399 8.695 -54.811 1.00 24.23 O ATOM 2092 NE2 GLN B 58 38.632 7.169 -56.240 1.00 19.23 N ATOM 2093 HA GLN B 58 41.819 6.699 -52.310 1.00 0.00 H ATOM 2094 HB2 GLN B 58 39.201 5.471 -52.949 1.00 0.00 H ATOM 2095 HB3 GLN B 58 39.634 7.173 -52.666 1.00 0.00 H ATOM 2096 HG2 GLN B 58 41.237 6.668 -54.772 1.00 0.00 H ATOM 2097 HG3 GLN B 58 39.947 5.491 -55.111 1.00 0.00 H ATOM 2098 HE22 GLN B 58 38.590 6.192 -56.528 1.00 0.00 H ATOM 2099 HE21 GLN B 58 38.130 7.880 -56.773 1.00 0.00 H ATOM 2100 H GLN B 58 41.569 4.118 -53.761 1.00 0.00 H ATOM 2101 N GLY B 59 41.300 4.034 -50.671 1.00 13.19 N ATOM 2102 CA GLY B 59 41.070 3.623 -49.223 1.00 13.06 C ATOM 2103 C GLY B 59 39.944 2.698 -48.944 1.00 12.08 C ATOM 2104 O GLY B 59 39.338 2.215 -49.916 1.00 13.38 O ATOM 2105 HA3 GLY B 59 40.895 4.533 -48.649 1.00 0.00 H ATOM 2106 HA2 GLY B 59 41.983 3.142 -48.871 1.00 0.00 H ATOM 2107 H GLY B 59 41.702 3.405 -51.365 1.00 0.00 H ATOM 2108 N PRO B 60 39.628 2.346 -47.644 1.00 12.41 N ATOM 2109 CA PRO B 60 38.525 1.500 -47.251 1.00 11.87 C ATOM 2110 C PRO B 60 37.196 2.061 -47.646 1.00 11.23 C ATOM 2111 O PRO B 60 36.860 3.258 -47.605 1.00 11.44 O ATOM 2112 CB PRO B 60 38.619 1.266 -45.687 1.00 12.80 C ATOM 2113 CG PRO B 60 39.889 1.813 -45.322 1.00 13.27 C ATOM 2114 CD PRO B 60 40.348 2.766 -46.457 1.00 12.38 C ATOM 2115 HA PRO B 60 38.602 0.549 -47.779 1.00 0.00 H ATOM 2116 HD3 PRO B 60 40.101 3.798 -46.209 1.00 0.00 H ATOM 2117 HD2 PRO B 60 41.423 2.679 -46.614 1.00 0.00 H ATOM 2118 HG3 PRO B 60 40.615 1.010 -45.197 1.00 0.00 H ATOM 2119 HG2 PRO B 60 39.798 2.367 -44.388 1.00 0.00 H ATOM 2120 HB2 PRO B 60 37.812 1.785 -45.170 1.00 0.00 H ATOM 2121 HB3 PRO B 60 38.575 0.202 -45.452 1.00 0.00 H ATOM 2122 N TRP B 61 36.403 1.122 -48.162 1.00 11.07 N ATOM 2123 CA TRP B 61 35.094 1.397 -48.747 1.00 10.89 C ATOM 2124 C TRP B 61 34.105 0.338 -48.288 1.00 11.66 C ATOM 2125 O TRP B 61 34.463 -0.603 -47.561 1.00 10.89 O ATOM 2126 CB TRP B 61 35.201 1.366 -50.293 1.00 11.16 C ATOM 2127 CG TRP B 61 35.976 0.150 -50.858 1.00 12.52 C ATOM 2128 CD1 TRP B 61 37.319 0.018 -51.041 1.00 10.05 C ATOM 2129 CD2 TRP B 61 35.372 -1.049 -51.295 1.00 11.28 C ATOM 2130 NE1 TRP B 61 37.547 -1.294 -51.585 1.00 11.68 N ATOM 2131 CE2 TRP B 61 36.383 -1.904 -51.723 1.00 10.00 C ATOM 2132 CE3 TRP B 61 34.040 -1.464 -51.353 1.00 13.98 C ATOM 2133 CZ2 TRP B 61 36.120 -3.195 -52.207 1.00 12.28 C ATOM 2134 CZ3 TRP B 61 33.795 -2.749 -51.860 1.00 12.62 C ATOM 2135 CH2 TRP B 61 34.785 -3.576 -52.270 1.00 10.00 C ATOM 2136 HA TRP B 61 34.752 2.381 -48.427 1.00 0.00 H ATOM 2137 HB2 TRP B 61 34.192 1.348 -50.704 1.00 0.00 H ATOM 2138 HB3 TRP B 61 35.708 2.274 -50.618 1.00 0.00 H ATOM 2139 HE1 TRP B 61 38.457 -1.688 -51.825 1.00 0.00 H ATOM 2140 HD1 TRP B 61 38.079 0.767 -50.817 1.00 0.00 H ATOM 2141 HZ2 TRP B 61 36.922 -3.865 -52.518 1.00 0.00 H ATOM 2142 HH2 TRP B 61 34.530 -4.562 -52.658 1.00 0.00 H ATOM 2143 HZ3 TRP B 61 32.764 -3.096 -51.927 1.00 0.00 H ATOM 2144 HE3 TRP B 61 33.227 -0.819 -51.019 1.00 0.00 H ATOM 2145 H TRP B 61 36.730 0.156 -48.147 1.00 0.00 H ATOM 2146 N CYS B 62 32.872 0.494 -48.731 1.00 10.98 N ATOM 2147 CA CYS B 62 31.850 -0.505 -48.403 1.00 10.25 C ATOM 2148 C CYS B 62 30.663 -0.414 -49.360 1.00 10.32 C ATOM 2149 O CYS B 62 30.458 0.626 -50.008 1.00 10.00 O ATOM 2150 CB CYS B 62 31.369 -0.298 -46.964 1.00 12.61 C ATOM 2151 SG CYS B 62 30.258 1.164 -46.787 1.00 13.83 S ATOM 2152 HA CYS B 62 32.295 -1.495 -48.504 1.00 0.00 H ATOM 2153 HB2 CYS B 62 32.239 -0.155 -46.323 1.00 0.00 H ATOM 2154 HB3 CYS B 62 30.827 -1.189 -46.646 1.00 0.00 H ATOM 2155 H CYS B 62 32.631 1.306 -49.299 1.00 0.00 H ATOM 2156 N TYR B 63 29.917 -1.540 -49.459 1.00 10.00 N ATOM 2157 CA TYR B 63 28.671 -1.533 -50.242 1.00 10.47 C ATOM 2158 C TYR B 63 27.733 -0.704 -49.368 1.00 11.59 C ATOM 2159 O TYR B 63 27.805 -0.730 -48.124 1.00 11.36 O ATOM 2160 CB TYR B 63 28.107 -2.954 -50.539 1.00 10.65 C ATOM 2161 CG TYR B 63 29.023 -3.772 -51.457 1.00 14.34 C ATOM 2162 CD1 TYR B 63 30.058 -4.504 -50.884 1.00 10.19 C ATOM 2163 CD2 TYR B 63 28.829 -3.792 -52.866 1.00 14.79 C ATOM 2164 CE1 TYR B 63 30.954 -5.208 -51.691 1.00 13.54 C ATOM 2165 CE2 TYR B 63 29.735 -4.506 -53.681 1.00 14.77 C ATOM 2166 CZ TYR B 63 30.809 -5.194 -53.082 1.00 14.09 C ATOM 2167 OH TYR B 63 31.758 -5.813 -53.833 1.00 11.85 O ATOM 2168 HA TYR B 63 28.813 -1.123 -51.242 1.00 0.00 H ATOM 2169 HB3 TYR B 63 27.134 -2.850 -51.019 1.00 0.00 H ATOM 2170 HB2 TYR B 63 27.991 -3.488 -49.596 1.00 0.00 H ATOM 2171 HD2 TYR B 63 27.989 -3.261 -53.313 1.00 0.00 H ATOM 2172 HE2 TYR B 63 29.605 -4.525 -54.763 1.00 0.00 H ATOM 2173 HE1 TYR B 63 31.769 -5.770 -51.235 1.00 0.00 H ATOM 2174 HD1 TYR B 63 30.170 -4.528 -49.800 1.00 0.00 H ATOM 2175 HH TYR B 63 32.404 -6.225 -53.254 1.00 0.00 H ATOM 2176 H TYR B 63 30.219 -2.394 -48.990 1.00 0.00 H ATOM 2177 N THR B 64 26.870 0.017 -49.996 1.00 11.86 N ATOM 2178 CA THR B 64 25.978 0.965 -49.303 1.00 10.84 C ATOM 2179 C THR B 64 24.536 0.465 -49.218 1.00 10.96 C ATOM 2180 O THR B 64 24.106 -0.370 -50.003 1.00 10.19 O ATOM 2181 CB THR B 64 25.985 2.228 -50.162 1.00 11.23 C ATOM 2182 OG1 THR B 64 26.914 3.178 -49.654 1.00 16.20 O ATOM 2183 CG2 THR B 64 24.608 2.869 -50.273 1.00 14.57 C ATOM 2184 HA THR B 64 26.327 1.115 -48.281 1.00 0.00 H ATOM 2185 HB THR B 64 26.287 1.919 -51.163 1.00 0.00 H ATOM 2186 HG1 THR B 64 26.903 3.962 -50.207 1.00 0.00 H ATOM 2187 HG23 THR B 64 23.899 2.138 -50.662 1.00 0.00 H ATOM 2188 HG21 THR B 64 24.283 3.203 -49.287 1.00 0.00 H ATOM 2189 HG22 THR B 64 24.660 3.723 -50.948 1.00 0.00 H ATOM 2190 H THR B 64 26.801 -0.071 -51.010 1.00 0.00 H ATOM 2191 N THR B 65 23.774 1.004 -48.273 1.00 10.60 N ATOM 2192 CA THR B 65 22.351 0.640 -48.150 1.00 10.07 C ATOM 2193 C THR B 65 21.535 1.463 -49.156 1.00 11.25 C ATOM 2194 O THR B 65 20.315 1.596 -49.030 1.00 12.36 O ATOM 2195 CB THR B 65 21.834 0.909 -46.732 1.00 13.26 C ATOM 2196 OG1 THR B 65 22.242 2.218 -46.323 1.00 10.99 O ATOM 2197 CG2 THR B 65 22.351 -0.140 -45.732 1.00 10.58 C ATOM 2198 HA THR B 65 22.244 -0.425 -48.357 1.00 0.00 H ATOM 2199 HB THR B 65 20.746 0.844 -46.744 1.00 0.00 H ATOM 2200 HG1 THR B 65 21.879 2.869 -46.928 1.00 0.00 H ATOM 2201 HG23 THR B 65 22.035 -1.133 -46.053 1.00 0.00 H ATOM 2202 HG21 THR B 65 23.440 -0.099 -45.694 1.00 0.00 H ATOM 2203 HG22 THR B 65 21.944 0.071 -44.743 1.00 0.00 H ATOM 2204 H THR B 65 24.179 1.679 -47.624 1.00 0.00 H ATOM 2205 N ASP B 66 22.113 2.283 -50.049 1.00 10.74 N ATOM 2206 CA ASP B 66 21.390 3.088 -51.018 1.00 10.86 C ATOM 2207 C ASP B 66 21.455 2.251 -52.282 1.00 10.90 C ATOM 2208 O ASP B 66 22.601 1.950 -52.686 1.00 10.98 O ATOM 2209 CB ASP B 66 22.091 4.438 -51.147 1.00 13.61 C ATOM 2210 CG ASP B 66 21.265 5.323 -52.076 1.00 14.41 C ATOM 2211 OD1 ASP B 66 20.355 4.799 -52.719 1.00 15.37 O ATOM 2212 OD2 ASP B 66 21.630 6.439 -52.411 1.00 17.67 O ATOM 2213 HA ASP B 66 20.356 3.317 -50.759 1.00 0.00 H ATOM 2214 HB2 ASP B 66 22.171 4.907 -50.166 1.00 0.00 H ATOM 2215 HB3 ASP B 66 23.088 4.297 -51.563 1.00 0.00 H ATOM 2216 H ASP B 66 23.131 2.345 -50.047 1.00 0.00 H ATOM 2217 N PRO B 67 20.298 1.884 -52.784 1.00 10.80 N ATOM 2218 CA PRO B 67 20.201 1.066 -53.958 1.00 10.45 C ATOM 2219 C PRO B 67 20.892 1.690 -55.175 1.00 12.62 C ATOM 2220 O PRO B 67 21.298 0.957 -56.100 1.00 10.46 O ATOM 2221 CB PRO B 67 18.698 0.699 -54.083 1.00 10.16 C ATOM 2222 CG PRO B 67 18.106 1.162 -52.759 1.00 10.53 C ATOM 2223 CD PRO B 67 18.985 2.182 -52.158 1.00 10.00 C ATOM 2224 HA PRO B 67 20.765 0.136 -53.888 1.00 0.00 H ATOM 2225 HD3 PRO B 67 18.649 3.188 -52.407 1.00 0.00 H ATOM 2226 HD2 PRO B 67 19.031 2.074 -51.074 1.00 0.00 H ATOM 2227 HG3 PRO B 67 18.019 0.312 -52.082 1.00 0.00 H ATOM 2228 HG2 PRO B 67 17.118 1.589 -52.932 1.00 0.00 H ATOM 2229 HB2 PRO B 67 18.237 1.223 -54.920 1.00 0.00 H ATOM 2230 HB3 PRO B 67 18.569 -0.375 -54.213 1.00 0.00 H ATOM 2231 N GLU B 68 21.060 2.986 -55.101 1.00 13.66 N ATOM 2232 CA GLU B 68 21.745 3.778 -56.174 1.00 15.62 C ATOM 2233 C GLU B 68 23.153 4.157 -55.952 1.00 15.29 C ATOM 2234 O GLU B 68 23.744 4.991 -56.733 1.00 17.89 O ATOM 2235 CB GLU B 68 20.977 5.108 -56.443 1.00 13.64 C ATOM 2236 CG GLU B 68 19.649 4.673 -57.088 1.00 19.14 C ATOM 2237 CD GLU B 68 18.545 5.577 -57.428 1.00 18.74 C ATOM 2238 OE1 GLU B 68 18.678 6.788 -57.172 1.00 18.88 O ATOM 2239 OE2 GLU B 68 17.559 5.151 -58.048 1.00 24.61 O ATOM 2240 HA GLU B 68 21.739 3.078 -57.009 1.00 0.00 H ATOM 2241 HB2 GLU B 68 20.794 5.641 -55.510 1.00 0.00 H ATOM 2242 HB3 GLU B 68 21.542 5.747 -57.121 1.00 0.00 H ATOM 2243 HG2 GLU B 68 19.925 4.186 -58.023 1.00 0.00 H ATOM 2244 HG3 GLU B 68 19.223 3.936 -56.408 1.00 0.00 H ATOM 2245 H GLU B 68 20.710 3.478 -54.279 1.00 0.00 H ATOM 2246 N LYS B 69 23.706 3.798 -54.839 1.00 14.61 N ATOM 2247 CA LYS B 69 25.105 3.956 -54.532 1.00 15.92 C ATOM 2248 C LYS B 69 25.645 2.566 -54.077 1.00 15.72 C ATOM 2249 O LYS B 69 25.418 2.220 -52.952 1.00 16.61 O ATOM 2250 CB LYS B 69 25.512 4.986 -53.526 1.00 17.72 C ATOM 2251 CG LYS B 69 27.008 5.294 -53.568 1.00 19.97 C ATOM 2252 CD LYS B 69 27.194 6.684 -54.167 1.00 23.22 C ATOM 2253 CE LYS B 69 28.595 7.016 -54.672 1.00 22.05 C ATOM 2254 NZ LYS B 69 28.661 8.490 -54.994 1.00 23.61 N ATOM 2255 HA LYS B 69 25.538 4.340 -55.455 1.00 0.00 H ATOM 2256 HB2 LYS B 69 24.961 5.905 -53.725 1.00 0.00 H ATOM 2257 HB3 LYS B 69 25.259 4.621 -52.531 1.00 0.00 H ATOM 2258 HG2 LYS B 69 27.418 5.269 -52.558 1.00 0.00 H ATOM 2259 HG3 LYS B 69 27.520 4.555 -54.185 1.00 0.00 H ATOM 2260 HD2 LYS B 69 26.506 6.780 -55.007 1.00 0.00 H ATOM 2261 HD3 LYS B 69 26.934 7.414 -53.401 1.00 0.00 H ATOM 2262 HE2 LYS B 69 28.808 6.435 -55.569 1.00 0.00 H ATOM 2263 HE3 LYS B 69 29.328 6.776 -53.902 1.00 0.00 H ATOM 2264 HZ1 LYS B 69 27.973 8.711 -55.714 1.00 0.00 H ATOM 2265 HZ2 LYS B 69 28.460 9.030 -54.152 1.00 0.00 H ATOM 2266 HZ3 LYS B 69 29.595 8.721 -55.333 1.00 0.00 H ATOM 2267 H LYS B 69 23.110 3.373 -54.129 1.00 0.00 H ATOM 2268 N ARG B 70 26.174 1.781 -55.029 1.00 15.72 N ATOM 2269 CA ARG B 70 26.719 0.456 -54.858 1.00 15.42 C ATOM 2270 C ARG B 70 27.839 0.433 -53.820 1.00 14.77 C ATOM 2271 O ARG B 70 27.636 -0.177 -52.760 1.00 16.86 O ATOM 2272 CB ARG B 70 27.266 -0.204 -56.152 1.00 14.86 C ATOM 2273 CG ARG B 70 27.443 -1.760 -55.954 1.00 13.37 C ATOM 2274 CD ARG B 70 27.850 -2.324 -57.346 1.00 13.93 C ATOM 2275 NE ARG B 70 28.639 -3.549 -57.187 1.00 14.82 N ATOM 2276 CZ ARG B 70 27.999 -4.743 -56.852 1.00 14.36 C ATOM 2277 NH1 ARG B 70 26.714 -4.887 -57.061 1.00 14.08 N ATOM 2278 NH2 ARG B 70 28.618 -5.874 -56.595 1.00 14.57 N ATOM 2279 HA ARG B 70 25.858 -0.125 -54.527 1.00 0.00 H ATOM 2280 HB2 ARG B 70 26.567 -0.024 -56.969 1.00 0.00 H ATOM 2281 HB3 ARG B 70 28.232 0.238 -56.398 1.00 0.00 H ATOM 2282 HG2 ARG B 70 28.223 -1.963 -55.220 1.00 0.00 H ATOM 2283 HG3 ARG B 70 26.507 -2.209 -55.622 1.00 0.00 H ATOM 2284 HD2 ARG B 70 28.444 -1.580 -57.876 1.00 0.00 H ATOM 2285 HD3 ARG B 70 26.951 -2.547 -57.921 1.00 0.00 H ATOM 2286 HE ARG B 70 29.650 -3.529 -57.320 1.00 0.00 H ATOM 2287 HH12 ARG B 70 26.252 -5.762 -56.814 1.00 0.00 H ATOM 2288 HH11 ARG B 70 26.175 -4.124 -57.471 1.00 0.00 H ATOM 2289 HH22 ARG B 70 28.080 -6.707 -56.357 1.00 0.00 H ATOM 2290 HH21 ARG B 70 29.636 -5.918 -56.634 1.00 0.00 H ATOM 2291 H ARG B 70 26.193 2.162 -55.975 1.00 0.00 H ATOM 2292 N TYR B 71 28.768 1.331 -53.916 1.00 14.78 N ATOM 2293 CA TYR B 71 29.899 1.381 -52.952 1.00 15.93 C ATOM 2294 C TYR B 71 30.386 2.840 -52.866 1.00 15.30 C ATOM 2295 O TYR B 71 29.969 3.594 -53.756 1.00 14.93 O ATOM 2296 CB TYR B 71 31.069 0.410 -53.343 1.00 16.95 C ATOM 2297 CG TYR B 71 31.982 1.056 -54.375 1.00 20.75 C ATOM 2298 CD1 TYR B 71 31.636 1.066 -55.765 1.00 22.77 C ATOM 2299 CD2 TYR B 71 33.129 1.717 -53.984 1.00 20.62 C ATOM 2300 CE1 TYR B 71 32.457 1.784 -56.675 1.00 23.22 C ATOM 2301 CE2 TYR B 71 33.940 2.417 -54.873 1.00 19.69 C ATOM 2302 CZ TYR B 71 33.616 2.395 -56.206 1.00 21.54 C ATOM 2303 OH TYR B 71 34.461 3.073 -57.046 1.00 26.08 O ATOM 2304 HA TYR B 71 29.551 1.039 -51.977 1.00 0.00 H ATOM 2305 HB3 TYR B 71 30.650 -0.506 -53.759 1.00 0.00 H ATOM 2306 HB2 TYR B 71 31.649 0.171 -52.452 1.00 0.00 H ATOM 2307 HD2 TYR B 71 33.412 1.690 -52.932 1.00 0.00 H ATOM 2308 HE2 TYR B 71 34.811 2.969 -54.519 1.00 0.00 H ATOM 2309 HE1 TYR B 71 32.183 1.855 -57.727 1.00 0.00 H ATOM 2310 HD1 TYR B 71 30.755 0.530 -56.119 1.00 0.00 H ATOM 2311 HH TYR B 71 35.343 2.699 -56.981 1.00 0.00 H ATOM 2312 H TYR B 71 28.723 2.018 -54.669 1.00 0.00 H ATOM 2313 N ASP B 72 31.016 3.141 -51.755 1.00 13.95 N ATOM 2314 CA ASP B 72 31.623 4.416 -51.465 1.00 14.79 C ATOM 2315 C ASP B 72 32.712 4.199 -50.401 1.00 13.39 C ATOM 2316 O ASP B 72 32.645 3.310 -49.558 1.00 12.62 O ATOM 2317 CB ASP B 72 30.594 5.512 -51.100 1.00 17.45 C ATOM 2318 CG ASP B 72 31.225 6.869 -51.503 1.00 15.66 C ATOM 2319 OD1 ASP B 72 32.203 6.948 -52.229 1.00 20.59 O ATOM 2320 OD2 ASP B 72 30.784 7.860 -51.017 1.00 16.63 O ATOM 2321 HA ASP B 72 32.092 4.809 -52.367 1.00 0.00 H ATOM 2322 HB2 ASP B 72 29.665 5.352 -51.647 1.00 0.00 H ATOM 2323 HB3 ASP B 72 30.391 5.495 -50.029 1.00 0.00 H ATOM 2324 H ASP B 72 31.081 2.416 -51.041 1.00 0.00 H ATOM 2325 N TYR B 73 33.667 5.047 -50.406 1.00 13.36 N ATOM 2326 CA TYR B 73 34.831 5.132 -49.558 1.00 13.29 C ATOM 2327 C TYR B 73 34.368 5.792 -48.237 1.00 13.00 C ATOM 2328 O TYR B 73 33.382 6.555 -48.200 1.00 11.02 O ATOM 2329 CB TYR B 73 35.976 5.962 -50.223 1.00 13.89 C ATOM 2330 CG TYR B 73 36.332 5.376 -51.601 1.00 10.00 C ATOM 2331 CD1 TYR B 73 37.037 4.219 -51.706 1.00 10.00 C ATOM 2332 CD2 TYR B 73 35.736 5.960 -52.714 1.00 11.50 C ATOM 2333 CE1 TYR B 73 37.283 3.695 -52.979 1.00 12.66 C ATOM 2334 CE2 TYR B 73 35.972 5.454 -54.004 1.00 12.62 C ATOM 2335 CZ TYR B 73 36.733 4.310 -54.136 1.00 11.30 C ATOM 2336 OH TYR B 73 36.913 3.815 -55.380 1.00 13.11 O ATOM 2337 HA TYR B 73 35.244 4.139 -49.381 1.00 0.00 H ATOM 2338 HB3 TYR B 73 36.858 5.936 -49.583 1.00 0.00 H ATOM 2339 HB2 TYR B 73 35.648 6.994 -50.345 1.00 0.00 H ATOM 2340 HD2 TYR B 73 35.079 6.820 -52.584 1.00 0.00 H ATOM 2341 HE2 TYR B 73 35.563 5.954 -54.882 1.00 0.00 H ATOM 2342 HE1 TYR B 73 37.903 2.805 -53.085 1.00 0.00 H ATOM 2343 HD1 TYR B 73 37.404 3.709 -50.815 1.00 0.00 H ATOM 2344 HH TYR B 73 37.456 3.025 -55.333 1.00 0.00 H ATOM 2345 H TYR B 73 33.596 5.774 -51.117 1.00 0.00 H ATOM 2346 N CYS B 74 35.116 5.335 -47.236 1.00 13.84 N ATOM 2347 CA CYS B 74 34.875 5.905 -45.904 1.00 17.33 C ATOM 2348 C CYS B 74 36.156 6.689 -45.511 1.00 19.64 C ATOM 2349 O CYS B 74 37.214 6.529 -46.148 1.00 21.84 O ATOM 2350 CB CYS B 74 34.456 4.928 -44.846 1.00 12.64 C ATOM 2351 SG CYS B 74 33.716 3.431 -45.508 1.00 13.49 S ATOM 2352 HA CYS B 74 34.006 6.560 -45.967 1.00 0.00 H ATOM 2353 HB2 CYS B 74 33.729 5.414 -44.195 1.00 0.00 H ATOM 2354 HB3 CYS B 74 35.335 4.651 -44.264 1.00 0.00 H ATOM 2355 H CYS B 74 35.827 4.619 -47.387 1.00 0.00 H ATOM 2356 N ASP B 75 36.014 7.510 -44.510 1.00 21.47 N ATOM 2357 CA ASP B 75 36.992 8.347 -43.883 1.00 23.30 C ATOM 2358 C ASP B 75 37.482 7.903 -42.493 1.00 24.71 C ATOM 2359 O ASP B 75 36.998 8.567 -41.581 1.00 25.80 O ATOM 2360 CB ASP B 75 36.385 9.671 -43.365 1.00 25.06 C ATOM 2361 CG ASP B 75 35.794 10.419 -44.521 1.00 25.56 C ATOM 2362 OD1 ASP B 75 34.744 9.838 -44.949 1.00 27.16 O ATOM 2363 OD2 ASP B 75 36.527 11.368 -44.808 1.00 28.07 O ATOM 2364 HA ASP B 75 37.741 8.363 -44.675 1.00 0.00 H ATOM 2365 HB2 ASP B 75 35.607 9.455 -42.632 1.00 0.00 H ATOM 2366 HB3 ASP B 75 37.165 10.274 -42.899 1.00 0.00 H ATOM 2367 H ASP B 75 35.074 7.564 -44.118 1.00 0.00 H ATOM 2368 N ILE B 76 38.472 7.127 -42.417 1.00 26.38 N ATOM 2369 CA ILE B 76 39.221 6.717 -41.258 1.00 28.05 C ATOM 2370 C ILE B 76 40.395 7.733 -41.206 1.00 28.26 C ATOM 2371 O ILE B 76 40.942 8.220 -42.227 1.00 28.50 O ATOM 2372 CB ILE B 76 39.730 5.243 -41.432 1.00 28.58 C ATOM 2373 CG1 ILE B 76 38.596 4.506 -42.185 1.00 29.61 C ATOM 2374 CG2 ILE B 76 40.096 4.626 -40.074 1.00 30.84 C ATOM 2375 CD1 ILE B 76 37.438 4.018 -41.293 1.00 28.45 C ATOM 2376 HA ILE B 76 38.637 6.718 -40.338 1.00 0.00 H ATOM 2377 HB ILE B 76 40.654 5.174 -42.006 1.00 0.00 H ATOM 2378 HG12 ILE B 76 38.186 5.187 -42.931 1.00 0.00 H ATOM 2379 HG13 ILE B 76 39.028 3.639 -42.685 1.00 0.00 H ATOM 2380 HD11 ILE B 76 37.824 3.323 -40.547 1.00 0.00 H ATOM 2381 HD12 ILE B 76 36.981 4.872 -40.794 1.00 0.00 H ATOM 2382 HD13 ILE B 76 36.693 3.515 -41.910 1.00 0.00 H ATOM 2383 HG21 ILE B 76 40.885 5.217 -39.608 1.00 0.00 H ATOM 2384 HG22 ILE B 76 39.216 4.620 -39.430 1.00 0.00 H ATOM 2385 HG23 ILE B 76 40.446 3.604 -40.223 1.00 0.00 H ATOM 2386 H ILE B 76 38.788 6.733 -43.303 1.00 0.00 H ATOM 2387 N LEU B 77 40.787 8.040 -40.009 1.00 29.19 N ATOM 2388 CA LEU B 77 41.936 8.938 -39.853 1.00 29.47 C ATOM 2389 C LEU B 77 43.189 8.040 -39.901 1.00 29.77 C ATOM 2390 O LEU B 77 43.322 6.841 -39.661 1.00 27.61 O ATOM 2391 CB LEU B 77 41.698 9.853 -38.692 1.00 29.53 C ATOM 2392 CG LEU B 77 40.700 11.003 -38.709 1.00 29.18 C ATOM 2393 CD1 LEU B 77 39.692 11.013 -39.841 1.00 28.95 C ATOM 2394 CD2 LEU B 77 39.938 10.816 -37.396 1.00 27.48 C ATOM 2395 HA LEU B 77 42.098 9.665 -40.648 1.00 0.00 H ATOM 2396 HB2 LEU B 77 41.396 9.210 -37.865 1.00 0.00 H ATOM 2397 HB3 LEU B 77 42.665 10.303 -38.466 1.00 0.00 H ATOM 2398 HG LEU B 77 41.245 11.938 -38.841 1.00 0.00 H ATOM 2399 HD21 LEU B 77 39.453 9.840 -37.395 1.00 0.00 H ATOM 2400 HD22 LEU B 77 40.635 10.878 -36.561 1.00 0.00 H ATOM 2401 HD23 LEU B 77 39.184 11.597 -37.300 1.00 0.00 H ATOM 2402 HD11 LEU B 77 40.218 11.063 -40.794 1.00 0.00 H ATOM 2403 HD12 LEU B 77 39.094 10.102 -39.802 1.00 0.00 H ATOM 2404 HD13 LEU B 77 39.041 11.881 -39.738 1.00 0.00 H ATOM 2405 H LEU B 77 40.306 7.664 -39.192 1.00 0.00 H ATOM 2406 N GLU B 78 44.137 8.768 -40.495 1.00 31.46 N ATOM 2407 CA GLU B 78 45.486 8.294 -40.738 1.00 32.48 C ATOM 2408 C GLU B 78 46.088 8.084 -39.357 1.00 33.42 C ATOM 2409 O GLU B 78 46.160 9.067 -38.617 1.00 34.70 O ATOM 2410 CB GLU B 78 46.354 9.356 -41.398 1.00 31.23 C ATOM 2411 CG GLU B 78 47.052 9.015 -42.718 1.00 34.08 C ATOM 2412 CD GLU B 78 47.000 7.546 -43.023 1.00 34.00 C ATOM 2413 OE1 GLU B 78 45.820 7.243 -43.342 1.00 34.90 O ATOM 2414 OE2 GLU B 78 47.944 6.820 -42.826 1.00 35.13 O ATOM 2415 HA GLU B 78 45.450 7.412 -41.377 1.00 0.00 H ATOM 2416 HB2 GLU B 78 45.718 10.221 -41.585 1.00 0.00 H ATOM 2417 HB3 GLU B 78 47.131 9.626 -40.683 1.00 0.00 H ATOM 2418 HG2 GLU B 78 46.562 9.559 -43.525 1.00 0.00 H ATOM 2419 HG3 GLU B 78 48.095 9.324 -42.654 1.00 0.00 H ATOM 2420 H GLU B 78 43.899 9.713 -40.796 1.00 0.00 H ATOM 2421 N CYS B 79 46.566 6.887 -39.136 1.00 34.12 N ATOM 2422 CA CYS B 79 47.293 6.566 -37.923 1.00 33.27 C ATOM 2423 C CYS B 79 48.418 7.602 -37.759 1.00 33.21 C ATOM 2424 O CYS B 79 48.608 7.924 -36.571 1.00 33.48 O ATOM 2425 CB CYS B 79 47.917 5.194 -38.010 1.00 31.01 C ATOM 2426 SG CYS B 79 46.940 3.790 -37.661 1.00 32.05 S ATOM 2427 HA CYS B 79 46.603 6.581 -37.079 1.00 0.00 H ATOM 2428 HB2 CYS B 79 48.755 5.180 -37.313 1.00 0.00 H ATOM 2429 HB3 CYS B 79 48.290 5.078 -39.027 1.00 0.00 H ATOM 2430 H CYS B 79 46.424 6.159 -39.836 1.00 0.00 H TER 2431 CYS B 79 HETATM 2432 O HOH 1 23.642 5.939 -28.165 1.00 11.48 O HETATM 2433 O HOH 2 32.557 4.166 -35.797 1.00 20.28 O HETATM 2434 O HOH 3 35.469 -5.553 -13.866 1.00 10.00 O HETATM 2435 O HOH 4 18.169 -1.796 -17.571 1.00 13.79 O HETATM 2436 O HOH 5 26.532 4.370 -38.128 1.00 22.09 O HETATM 2437 O HOH 6 33.362 10.114 -14.479 1.00 28.63 O HETATM 2438 O HOH 7 16.770 0.356 -28.201 1.00 17.32 O HETATM 2439 O HOH 8 43.586 6.246 -24.976 1.00 26.48 O HETATM 2440 O HOH 9 20.083 11.408 -25.590 1.00 39.50 O HETATM 2441 O HOH 10 32.721 20.224 -27.309 1.00 26.05 O HETATM 2442 O HOH 11 36.012 -7.194 -28.497 1.00 21.82 O HETATM 2443 O HOH 12 44.255 10.147 -19.117 1.00 46.32 O HETATM 2444 O HOH 13 29.679 7.645 -35.333 1.00 12.41 O HETATM 2445 O HOH 14 17.115 1.273 -30.907 1.00 16.87 O HETATM 2446 O HOH 15 22.598 -2.301 -14.959 1.00 21.53 O HETATM 2447 O HOH 16 26.564 12.438 -13.896 1.00 18.30 O HETATM 2448 O HOH 17 26.262 11.765 -11.090 1.00 15.67 O HETATM 2449 O HOH 18 28.718 -0.315 -13.138 1.00 17.99 O HETATM 2450 O HOH 19 42.630 3.776 -24.768 1.00 24.31 O HETATM 2451 O HOH 20 21.297 -6.264 -33.927 1.00 21.00 O HETATM 2452 O HOH 21 18.899 5.324 -17.706 1.00 20.08 O HETATM 2453 O HOH 22 18.790 -6.367 -21.030 1.00 21.08 O HETATM 2454 O HOH 23 16.335 8.623 -21.064 1.00 21.25 O HETATM 2455 O HOH 24 21.457 -10.215 -27.411 1.00 10.22 O HETATM 2456 O HOH 25 36.338 -2.718 -12.542 1.00 18.87 O HETATM 2457 O HOH 26 15.364 0.584 -26.239 1.00 20.01 O HETATM 2458 O HOH 27 36.973 -11.603 -25.635 1.00 26.65 O HETATM 2459 O HOH 28 38.692 -7.514 -18.392 1.00 23.47 O HETATM 2460 O HOH 29 24.283 6.006 -35.497 1.00 24.06 O HETATM 2461 O HOH 30 22.679 3.710 -27.458 1.00 16.29 O HETATM 2462 O HOH 31 19.989 7.820 -30.022 1.00 28.77 O HETATM 2463 O HOH 32 35.921 12.249 -22.135 1.00 24.65 O HETATM 2464 O HOH 33 23.464 -0.881 -38.348 1.00 27.73 O HETATM 2465 O HOH 34 25.632 -9.421 -20.347 1.00 12.99 O HETATM 2466 O HOH 35 27.821 8.548 -10.831 1.00 21.16 O HETATM 2467 O HOH 36 29.889 -3.061 -12.465 1.00 27.27 O HETATM 2468 O HOH 37 32.425 -9.319 -31.262 1.00 19.71 O HETATM 2469 O HOH 38 25.271 12.040 -24.585 1.00 18.47 O HETATM 2470 O HOH 39 15.491 5.132 -17.667 1.00 22.91 O HETATM 2471 O HOH 40 13.751 -0.106 -17.024 1.00 23.66 O HETATM 2472 O HOH 41 33.087 -8.917 -28.674 1.00 18.23 O HETATM 2473 O HOH 42 44.901 3.743 -22.242 1.00 18.27 O HETATM 2474 O HOH 43 14.667 9.056 -31.119 1.00 11.51 O HETATM 2475 O HOH 44 41.966 -6.226 -26.977 1.00 34.70 O HETATM 2476 O HOH 45 34.558 -4.699 -33.732 1.00 30.54 O HETATM 2477 O HOH 46 17.855 12.006 -28.969 1.00 14.19 O HETATM 2478 O HOH 47 31.714 3.889 -21.478 1.00 19.80 O HETATM 2479 O HOH 48 26.945 -6.954 -21.050 1.00 22.61 O HETATM 2480 O HOH 49 39.622 10.946 -15.538 1.00 29.17 O HETATM 2481 O HOH 50 22.635 -4.754 -28.824 1.00 23.48 O HETATM 2482 O HOH 51 16.509 -10.771 -26.116 1.00 31.94 O HETATM 2483 O HOH 52 31.711 1.129 -11.289 1.00 27.43 O HETATM 2484 O HOH 53 22.639 -5.792 -15.133 1.00 26.05 O HETATM 2485 O HOH 54 17.385 0.110 -16.360 1.00 26.87 O HETATM 2486 O HOH 55 26.815 -5.511 -28.217 1.00 20.57 O HETATM 2487 O HOH 56 24.196 -0.646 -13.397 1.00 20.20 O HETATM 2488 O HOH 57 19.802 3.628 -36.207 1.00 26.38 O HETATM 2489 O HOH 58 27.604 11.049 -18.865 1.00 20.15 O HETATM 2490 O HOH 59 13.646 4.515 -15.397 1.00 20.35 O HETATM 2491 O HOH 60 42.485 -1.869 -26.843 1.00 31.93 O HETATM 2492 O HOH 61 9.988 -10.410 -26.197 1.00 20.67 O HETATM 2493 O HOH 62 29.191 10.460 -14.705 1.00 28.10 O HETATM 2494 O HOH 63 23.727 11.980 -32.200 1.00 22.36 O HETATM 2495 O HOH 64 36.100 12.869 -30.009 1.00 24.60 O HETATM 2496 O HOH 65 23.694 16.554 -31.039 1.00 24.17 O HETATM 2497 O HOH 66 34.525 -3.088 -10.647 1.00 20.08 O HETATM 2498 O HOH 67 45.482 2.301 -25.499 1.00 30.22 O HETATM 2499 O HOH 68 41.573 17.507 -22.642 1.00 32.62 O HETATM 2500 O HOH 69 26.208 0.773 -39.010 1.00 21.39 O HETATM 2501 O HOH 70 37.324 -9.130 -22.871 1.00 25.04 O HETATM 2502 O HOH 71 19.132 7.399 -32.819 1.00 23.60 O HETATM 2503 O HOH 72 24.925 13.886 -22.989 1.00 23.02 O HETATM 2504 O HOH 73 17.385 8.585 -25.314 1.00 22.52 O HETATM 2505 O HOH 74 43.922 -6.943 -25.279 1.00 22.99 O HETATM 2506 O HOH 75 34.763 -6.823 -21.878 1.00 23.16 O HETATM 2507 O HOH 76 30.019 -3.905 -47.278 1.00 12.91 O HETATM 2508 O HOH 77 44.436 -6.311 -52.559 1.00 18.58 O HETATM 2509 O HOH 78 40.433 -5.481 -46.330 1.00 13.78 O HETATM 2510 O HOH 79 36.789 -11.783 -44.742 1.00 10.61 O HETATM 2511 O HOH 80 43.088 -1.882 -37.291 1.00 16.10 O HETATM 2512 O HOH 81 23.755 1.419 -58.015 1.00 17.07 O HETATM 2513 O HOH 82 25.661 -15.355 -57.890 1.00 10.00 O HETATM 2514 O HOH 83 22.546 -14.947 -52.808 1.00 31.63 O HETATM 2515 O HOH 84 40.572 -3.414 -44.886 1.00 26.08 O HETATM 2516 O HOH 85 23.010 -4.649 -44.569 1.00 24.94 O HETATM 2517 O HOH 86 43.922 -7.337 -45.704 1.00 10.86 O HETATM 2518 O HOH 87 37.672 8.821 -51.005 1.00 20.81 O HETATM 2519 O HOH 88 37.373 -0.291 -33.242 1.00 12.17 O HETATM 2520 O HOH 89 24.440 7.119 -50.534 1.00 31.16 O HETATM 2521 O HOH 90 47.282 -1.136 -42.785 1.00 33.65 O HETATM 2522 O HOH 91 33.629 6.929 -43.414 1.00 13.39 O HETATM 2523 O HOH 92 31.237 -9.837 -35.766 1.00 18.84 O HETATM 2524 O HOH 93 26.079 2.692 -57.922 1.00 15.14 O HETATM 2525 O HOH 94 18.623 -1.035 -47.495 1.00 25.48 O HETATM 2526 O HOH 95 23.499 -2.251 -43.151 1.00 13.42 O HETATM 2527 O HOH 96 43.706 5.355 -33.561 1.00 22.18 O HETATM 2528 O HOH 97 30.493 4.883 -37.982 1.00 15.94 O HETATM 2529 O HOH 98 49.249 -3.292 -49.877 1.00 14.96 O HETATM 2530 O HOH 99 32.731 13.964 -50.017 1.00 22.63 O HETATM 2531 O HOH 100 31.725 -12.178 -53.015 1.00 18.88 O HETATM 2532 O HOH 101 29.449 3.606 -56.239 1.00 35.41 O HETATM 2533 O HOH 102 41.803 -11.266 -41.721 1.00 12.69 O HETATM 2534 O HOH 103 21.869 5.828 -44.169 1.00 10.00 O HETATM 2535 O HOH 104 46.429 4.737 -50.898 1.00 17.96 O HETATM 2536 O HOH 105 41.675 -7.370 -55.862 1.00 17.71 O HETATM 2537 O HOH 106 27.722 -10.428 -57.168 1.00 27.64 O HETATM 2538 O HOH 107 24.148 -10.612 -43.630 1.00 26.26 O HETATM 2539 O HOH 108 18.024 4.200 -47.304 1.00 38.40 O HETATM 2540 O HOH 109 20.019 2.722 -44.571 1.00 41.02 O HETATM 2541 O HOH 110 45.265 -5.841 -39.815 1.00 16.86 O HETATM 2542 O HOH 111 47.002 6.605 -46.956 1.00 33.92 O HETATM 2543 O HOH 112 29.823 1.042 -36.154 1.00 14.84 O HETATM 2544 O HOH 113 35.589 12.251 -52.815 1.00 21.18 O HETATM 2545 O HOH 114 49.745 -1.673 -41.409 1.00 26.79 O HETATM 2546 O HOH 115 44.700 -9.521 -50.300 1.00 23.77 O HETATM 2547 O HOH 116 48.894 -5.905 -53.373 1.00 31.93 O HETATM 2548 O HOH 117 48.751 5.767 -34.144 1.00 42.80 O HETATM 2549 O HOH 118 49.235 -8.574 -45.293 1.00 22.00 O HETATM 2550 O HOH 119 44.623 8.486 -50.838 1.00 25.14 O HETATM 2551 O HOH 120 26.775 8.331 -36.575 1.00 33.84 O HETATM 2552 O HOH 121 21.763 -10.668 -59.606 1.00 19.61 O HETATM 2553 O HOH 122 45.339 -11.517 -47.988 1.00 30.73 O HETATM 2554 O HOH 123 29.312 -9.275 -43.172 1.00 13.37 O HETATM 2555 O HOH 124 35.664 5.035 -42.631 1.00 28.38 O HETATM 2556 O HOH 125 50.981 8.507 -41.375 1.00 17.59 O HETATM 2557 O HOH 126 41.252 -13.786 -49.245 1.00 27.12 O HETATM 2558 O HOH 127 35.150 -15.769 -45.046 1.00 20.17 O HETATM 2559 O HOH 128 21.197 -7.117 -43.893 1.00 23.82 O HETATM 2560 O HOH 129 48.985 -12.128 -48.309 1.00 24.19 O HETATM 2561 O HOH 130 46.227 -7.726 -44.785 1.00 26.51 O HETATM 2562 O HOH 131 20.055 -8.283 -54.544 1.00 24.57 O HETATM 2563 O HOH 132 20.500 5.194 -41.790 1.00 31.14 O HETATM 2564 O HOH 133 33.711 13.618 -47.585 1.00 26.28 O HETATM 2565 O HOH 134 20.693 4.005 -47.361 1.00 28.89 O HETATM 2566 O HOH 135 33.150 12.221 -43.734 1.00 25.55 O HETATM 2567 O HOH 136 22.078 -12.340 -44.666 1.00 27.15 O HETATM 2568 O HOH 137 26.250 -11.414 -49.480 1.00 17.82 O HETATM 2569 O HOH 138 37.008 1.632 -34.621 1.00 23.05 O HETATM 2570 O HOH 139 22.350 -8.570 -38.276 1.00 23.55 O HETATM 2571 O HOH 140 48.633 -0.474 -48.409 1.00 22.83 O HETATM 2572 O HOH 141 47.215 -2.049 -38.948 1.00 23.29 O HETATM 2573 O HOH 142 46.865 -6.696 -51.113 1.00 21.03 O HETATM 2574 O HOH 143 41.088 9.682 -50.119 1.00 19.86 O HETATM 2575 O HOH 144 34.801 -8.594 -36.992 1.00 24.44 O HETATM 2576 O HOH 145 51.413 -3.738 -43.160 1.00 23.69 O HETATM 2577 O HOH 146 26.218 -8.646 -36.077 1.00 26.41 O HETATM 2578 O HOH 147 31.097 -11.355 -42.160 1.00 29.09 O HETATM 2579 O HOH 148 51.141 -6.142 -52.617 1.00 24.33 O HETATM 2580 C1 ACA A 149 37.158 4.421 -30.046 1.00 0.03 C HETATM 2581 O1 ACA A 149 38.145 3.684 -30.269 1.00 -0.57 O HETATM 2582 O2 ACA A 149 36.919 5.669 -30.014 1.00 -0.57 O HETATM 2583 C2 ACA A 149 35.907 3.512 -29.701 1.00 0.00 C HETATM 2584 C3 ACA A 149 35.464 3.068 -31.094 1.00 -0.04 C HETATM 2585 C4 ACA A 149 33.916 2.928 -31.090 1.00 -0.05 C HETATM 2586 C5 ACA A 149 33.578 1.456 -30.887 1.00 -0.01 C HETATM 2587 C6 ACA A 149 32.320 1.024 -31.494 1.00 -0.04 C HETATM 2588 N6 ACA A 149 32.413 0.640 -32.918 1.00 0.22 N HETATM 2589 H11 ACA A 149 31.504 0.358 -33.250 1.00 0.20 H HETATM 2590 H12 ACA A 149 33.060 -0.127 -33.018 1.00 0.20 H HETATM 2591 H13 ACA A 149 32.739 1.427 -33.458 1.00 0.20 H HETATM 2592 H9 ACA A 149 31.599 1.851 -31.410 1.00 0.08 H HETATM 2593 H10 ACA A 149 31.950 0.155 -30.930 1.00 0.08 H HETATM 2594 H7 ACA A 149 33.519 1.265 -29.805 1.00 0.03 H HETATM 2595 H8 ACA A 149 34.391 0.856 -31.321 1.00 0.03 H HETATM 2596 H5 ACA A 149 33.507 3.276 -32.050 1.00 0.03 H HETATM 2597 H6 ACA A 149 33.489 3.526 -30.271 1.00 0.03 H HETATM 2598 H3 ACA A 149 35.925 2.100 -31.340 1.00 0.03 H HETATM 2599 H4 ACA A 149 35.768 3.819 -31.838 1.00 0.03 H HETATM 2600 H1 ACA A 149 35.119 4.088 -29.193 1.00 0.04 H HETATM 2601 H2 ACA A 149 36.194 2.653 -29.077 1.00 0.04 H CONECT 1 2 15 16 17 CONECT 15 1 CONECT 16 1 CONECT 17 1 CONECT 23 22 1203 CONECT 339 338 928 CONECT 752 751 1128 CONECT 928 339 927 CONECT 1128 752 1127 CONECT 1203 23 1202 CONECT 1209 1210 1223 1224 1225 CONECT 1223 1209 CONECT 1224 1209 CONECT 1225 1209 CONECT 1231 1230 2426 CONECT 1547 1546 2151 CONECT 1975 1974 2351 CONECT 2151 1547 2150 CONECT 2351 1975 2350 CONECT 2426 1231 2425 CONECT 2580 2581 2582 2583 CONECT 2581 2580 CONECT 2582 2580 CONECT 2583 2580 2584 2600 2601 CONECT 2584 2583 2585 2598 2599 CONECT 2585 2584 2586 2596 2597 CONECT 2586 2585 2587 2594 2595 CONECT 2587 2586 2588 2592 2593 CONECT 2588 2587 2589 2590 2591 CONECT 2589 2588 CONECT 2590 2588 CONECT 2591 2588 CONECT 2592 2587 CONECT 2593 2587 CONECT 2594 2586 CONECT 2595 2586 CONECT 2596 2585 CONECT 2597 2585 CONECT 2598 2584 CONECT 2599 2584 CONECT 2600 2583 CONECT 2601 2583 MASTER 0 0 0 0 0 0 0 0 2599 2 42 14 END
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Structure:
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Protein
Pocket-Ligand
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Related entries of code: 1cea
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1ceb
RCSB PDB
PDBbind
88aa, >1CEB_1|Chains... at 100%
4cik
RCSB PDB
PDBbind
83aa, >4CIK_1|Chain... at 97%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3kiv
RCSB PDB
PDBbind
ACA
Entry Information
PDB ID
1cea
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
plasminogen
Ligand Name
ACA
EC.Number
E.C.3.4.21.7
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=11uM
Release Year
1996
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v35 pp. 2567-76, 1996
Ligand Properties
Formula
C
6
H
1
4
NO
2
Molecular Weight
132.181
Exact Mass
132.102
No. of atoms
23
No. of bonds
22
Polar Surface Area
64.94
LOGP Value
-0.98 (
Computed with XLOGP3
)
-0.13 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 0
Canonical SMILES
[NH3+]CCCCCC(=O)O
InChI String
InChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9)/p+1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00747
Entrez Gene ID
NCBI Entrez Gene ID:
5340
ASD
Information of known allosteric effects of PDB entries
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