# atom_name: name of the atom, e.g. HA HB HD, CA # atom_type: type of the atom, e.g. H, C, N # chem_shift: chemical shift of the atom. # res_idx: index of the residue in protein, should be aligned with the fasta # res_type: type of amino acid of the residue atom_name atom_type chem_shift res_idx res_type HA H 4.584 10 HIS HB2 H 3.058 10 HIS HB3 H 3.057 10 HIS HD2 H 7.005 10 HIS CA C 56.144 10 HIS CB C 30.024 10 HIS CD2 C 119.732 10 HIS H H 8.102 11 MET HA H 4.318 11 MET HB2 H 1.894 11 MET HB3 H 1.892 11 MET HE1 H 1.768 11 MET HE2 H 1.768 11 MET HE3 H 1.768 11 MET HG2 H 2.315 11 MET HG3 H 2.249 11 MET CA C 55.347 11 MET CB C 32.096 11 MET CE C 16.186 11 MET CG C 31.621 11 MET N N 119.73 11 MET H H 7.857 12 LEU HA H 4.609 12 LEU HB2 H 1.598 12 LEU HB3 H 1.375 12 LEU HD11 H 0.745 12 LEU HD12 H 0.745 12 LEU HD13 H 0.745 12 LEU HD21 H 0.662 12 LEU HD22 H 0.662 12 LEU HD23 H 0.662 12 LEU HG H 1.463 12 LEU CA C 53.77 12 LEU CB C 43.73 12 LEU CD1 C 24.91 12 LEU CD2 C 22.699 12 LEU CG C 26.471 12 LEU N N 120.405 12 LEU H H 8.438 13 THR HA H 4.334 13 THR HB H 4.481 13 THR HG21 H 1.102 13 THR HG22 H 1.102 13 THR HG23 H 1.102 13 THR CA C 60.928 13 THR CB C 70.504 13 THR CG2 C 21.44 13 THR N N 110.786 13 THR H H 8.882 14 LYS HA H 4.1 14 LYS HB2 H 1.646 14 LYS HB3 H 1.646 14 LYS HD2 H 1.583 14 LYS HD3 H 1.582 14 LYS HE2 H 2.913 14 LYS HE3 H 2.91 14 LYS HG2 H 1.201 14 LYS HG3 H 1.098 14 LYS CA C 57.394 14 LYS CB C 31.92 14 LYS CD C 28.78 14 LYS CE C 41.78 14 LYS CG C 23.952 14 LYS N N 121.792 14 LYS H H 7.933 15 HIS HA H 4.722 15 HIS HB2 H 3.326 15 HIS HB3 H 2.964 15 HIS HD2 H 7.164 15 HIS CA C 55.054 15 HIS CB C 29.33 15 HIS CD2 C 119.628 15 HIS N N 116.562 15 HIS H H 8.289 16 GLY HA2 H 3.669 16 GLY HA3 H 3.972 16 GLY CA C 45.702 16 GLY N N 108.56 16 GLY H H 7.598 17 LYS HA H 4.452 17 LYS HB2 H 1.721 17 LYS HB3 H 1.72 17 LYS HD2 H 1.509 17 LYS HD3 H 1.509 17 LYS HE2 H 2.846 17 LYS HE3 H 2.856 17 LYS HG2 H 1.238 17 LYS HG3 H 1.27 17 LYS CA C 54.364 17 LYS CB C 34.028 17 LYS CD C 28.78 17 LYS CE C 41.78 17 LYS CG C 24.91 17 LYS N N 118.491 17 LYS H H 8.783 18 ASN HA H 4.849 18 ASN HB2 H 2.859 18 ASN HB3 H 2.86 18 ASN HD21 H 7.921 18 ASN HD22 H 7.121 18 ASN CA C 50.95 18 ASN CB C 38.544 18 ASN N N 121.134 18 ASN ND2 N 114.693 18 ASN HA H 3.987 19 PRO HB2 H 1.98 19 PRO HB3 H 1.984 19 PRO HD2 H 4.023 19 PRO HD3 H 3.791 19 PRO HG2 H 1.96 19 PRO HG3 H 1.867 19 PRO CA C 64.88 19 PRO CB C 32.458 19 PRO CD C 50.752 19 PRO CG C 27.996 19 PRO H H 7.594 20 VAL HA H 3.385 20 VAL HB H 1.938 20 VAL HG11 H 0.745 20 VAL HG12 H 0.745 20 VAL HG13 H 0.745 20 VAL HG21 H 0.729 20 VAL HG22 H 0.729 20 VAL HG23 H 0.729 20 VAL CA C 65.785 20 VAL CB C 31.442 20 VAL CG1 C 20.537 20 VAL CG2 C 22.467 20 VAL N N 116.615 20 VAL H H 7.12 21 MET HA H 4.144 21 MET HB2 H 2.058 21 MET HB3 H 2.149 21 MET HE1 H 2.056 21 MET HE2 H 2.056 21 MET HE3 H 2.056 21 MET HG2 H 2.628 21 MET HG3 H 2.457 21 MET CA C 57.745 21 MET CB C 32.01 21 MET CE C 17.058 21 MET CG C 32.07 21 MET N N 119.057 21 MET H H 8.232 22 GLU HA H 3.889 22 GLU HB2 H 1.842 22 GLU HB3 H 1.943 22 GLU HG2 H 2.067 22 GLU HG3 H 2.118 22 GLU CA C 59.271 22 GLU CB C 29.303 22 GLU CG C 36.01 22 GLU N N 120.421 22 GLU H H 8.383 23 LEU HA H 3.931 23 LEU HB2 H 2.016 23 LEU HB3 H 1.259 23 LEU HD11 H 0.787 23 LEU HD12 H 0.787 23 LEU HD13 H 0.787 23 LEU HD21 H 0.912 23 LEU HD22 H 0.912 23 LEU HD23 H 0.912 23 LEU HG H 1.61 23 LEU CA C 57.734 23 LEU CB C 40.481 23 LEU CD1 C 22.272 23 LEU CD2 C 26.04 23 LEU CG C 26.77 23 LEU N N 119.181 23 LEU H H 7.743 24 ASN HA H 4.629 24 ASN HB2 H 2.922 24 ASN HB3 H 2.857 24 ASN HD21 H 7.871 24 ASN HD22 H 6.978 24 ASN CA C 54.698 24 ASN CB C 38.331 24 ASN N N 116.978 24 ASN ND2 N 115.411 24 ASN H H 7.363 25 GLU HA H 3.972 25 GLU HB2 H 1.993 25 GLU HB3 H 2.095 25 GLU HG2 H 2.216 25 GLU HG3 H 2.445 25 GLU CA C 57.778 25 GLU CB C 29.473 25 GLU CG C 36.171 25 GLU N N 115.271 25 GLU H H 7.266 26 LYS HA H 4.103 26 LYS HB2 H 1.308 26 LYS HB3 H 1.518 26 LYS HD2 H 0.849 26 LYS HD3 H 0.897 26 LYS HE2 H 2.515 26 LYS HE3 H 2.518 26 LYS HG2 H 0.747 26 LYS HG3 H 1.205 26 LYS CA C 56.048 26 LYS CB C 33.484 26 LYS CD C 27.681 26 LYS CE C 42.018 26 LYS CG C 23.978 26 LYS N N 116.251 26 LYS H H 8.158 27 ARG HA H 4.619 27 ARG HB2 H 1.775 27 ARG HB3 H 1.698 27 ARG HD2 H 3.184 27 ARG HD3 H 3.586 27 ARG HE H 9.135 27 ARG HG2 H 1.417 27 ARG HG3 H 1.518 27 ARG CA C 52.505 27 ARG CB C 32.721 27 ARG CD C 42.179 27 ARG CG C 26.703 27 ARG N N 120.876 27 ARG NE N 85.606 27 ARG H H 8.35 28 ARG HA H 4.407 28 ARG HB2 H 1.786 28 ARG HB3 H 1.766 28 ARG HD2 H 3.161 28 ARG HD3 H 3.208 28 ARG HG2 H 1.66 28 ARG HG3 H 1.662 28 ARG CA C 55.68 28 ARG CB C 30.867 28 ARG CD C 43.1 28 ARG CG C 27.038 28 ARG N N 122.416 28 ARG H H 8.586 29 GLY HA2 H 3.83 29 GLY HA3 H 3.87 29 GLY CA C 46.262 29 GLY N N 108.952 29 GLY H H 8.111 30 LEU HA H 4.225 30 LEU HB2 H 1.691 30 LEU HB3 H 0.897 30 LEU HD11 H 0.769 30 LEU HD12 H 0.769 30 LEU HD13 H 0.769 30 LEU HD21 H 0.868 30 LEU HD22 H 0.868 30 LEU HD23 H 0.868 30 LEU HG H 1.54 30 LEU CA C 54.951 30 LEU CB C 41.578 30 LEU CD1 C 26.767 30 LEU CD2 C 22.288 30 LEU CG C 26.06 30 LEU N N 119.363 30 LEU H H 8.494 31 LYS HA H 4.599 31 LYS HB2 H 1.786 31 LYS HB3 H 1.7 31 LYS HD2 H 1.671 31 LYS HD3 H 1.673 31 LYS HE2 H 2.968 31 LYS HE3 H 2.969 31 LYS HG2 H 1.407 31 LYS HG3 H 1.299 31 LYS CA C 54.656 31 LYS CB C 34.201 31 LYS CD C 28.918 31 LYS CE C 41.78 31 LYS CG C 24.467 31 LYS N N 121.744 31 LYS H H 8.68 32 TYR HA H 4.944 32 TYR HB2 H 2.513 32 TYR HB3 H 2.856 32 TYR HD1 H 6.819 32 TYR HD2 H 6.819 32 TYR HE1 H 6.663 32 TYR HE2 H 6.663 32 TYR CA C 56.764 32 TYR CB C 39.337 32 TYR CD1 C 132.711 32 TYR CD2 C 132.832 32 TYR CE1 C 117.475 32 TYR CE2 C 117.436 32 TYR N N 124.248 32 TYR H H 9.441 33 GLU HA H 4.634 33 GLU HB2 H 1.943 33 GLU HB3 H 1.814 33 GLU HG2 H 2.219 33 GLU HG3 H 2.06 33 GLU CA C 54.211 33 GLU CB C 32.61 33 GLU CG C 35.425 33 GLU N N 124.37 33 GLU H H 8.791 34 LEU HA H 4.975 34 LEU HB2 H 1.995 34 LEU HB3 H 1.421 34 LEU HD11 H 1.216 34 LEU HD12 H 1.216 34 LEU HD13 H 1.216 34 LEU HD21 H 1.06 34 LEU HD22 H 1.06 34 LEU HD23 H 1.06 34 LEU HG H 1.515 34 LEU CA C 54.951 34 LEU CB C 41.622 34 LEU CD1 C 25.002 34 LEU CD2 C 26.575 34 LEU CG C 27.401 34 LEU N N 126.771 34 LEU H H 8.979 35 ILE HA H 4.358 35 ILE HB H 1.873 35 ILE HD11 H 0.651 35 ILE HD12 H 0.651 35 ILE HD13 H 0.651 35 ILE HG12 H 1.142 35 ILE HG13 H 1.229 35 ILE HG21 H 0.823 35 ILE HG22 H 0.823 35 ILE HG23 H 0.823 35 ILE CA C 60.307 35 ILE CB C 37.614 35 ILE CD1 C 10.733 35 ILE CG1 C 26.818 35 ILE CG2 C 17.071 35 ILE N N 126.944 35 ILE H H 7.562 36 SER HA H 4.56 36 SER HB2 H 3.753 36 SER HB3 H 3.571 36 SER CA C 57.608 36 SER CB C 64.536 36 SER N N 112.175 36 SER H H 8.317 37 GLU HA H 4.815 37 GLU HB2 H 1.815 37 GLU HB3 H 1.861 37 GLU HG2 H 1.502 37 GLU HG3 H 1.787 37 GLU CA C 54.867 37 GLU CB C 31.82 37 GLU CG C 35.453 37 GLU N N 125.042 37 GLU H H 8.48 38 THR HA H 4.614 38 THR HB H 4.188 38 THR HG21 H 1.079 38 THR HG22 H 1.079 38 THR HG23 H 1.079 38 THR CA C 59.865 38 THR CB C 71.532 38 THR CG2 C 21.237 38 THR N N 116.676 38 THR H H 8.375 39 GLY HA2 H 3.718 39 GLY HA3 H 4.271 39 GLY CA C 44.133 39 GLY N N 107.816 39 GLY H H 8.375 40 GLY HA2 H 3.766 40 GLY HA3 H 4.207 40 GLY CA C 44.35 40 GLY N N 108.249 40 GLY HA H 4.634 42 HIS HB2 H 3.107 42 HIS HB3 H 3.202 42 HIS HD2 H 7.093 42 HIS CA C 56.519 42 HIS CB C 29.883 42 HIS CD2 C 119.565 42 HIS H H 7.986 43 ASP HA H 4.607 43 ASP HB2 H 2.579 43 ASP HB3 H 2.437 43 ASP CA C 53.075 43 ASP CB C 39.918 43 ASP N N 120.127 43 ASP H H 7.572 44 LYS HA H 4.337 44 LYS HB2 H 1.814 44 LYS HB3 H 1.541 44 LYS HD2 H 1.42 44 LYS HD3 H 1.29 44 LYS HE2 H 2.644 44 LYS HE3 H 2.712 44 LYS HG2 H 1.369 44 LYS HG3 H 1.177 44 LYS CA C 55.119 44 LYS CB C 32.298 44 LYS CD C 27.576 44 LYS CE C 41.78 44 LYS CG C 23.897 44 LYS N N 121.439 44 LYS HA H 4.354 45 ARG HB2 H 1.509 45 ARG HB3 H 1.453 45 ARG HD2 H 2.954 45 ARG HD3 H 2.954 45 ARG HE H 7.05 45 ARG HG2 H 1.172 45 ARG HG3 H 1.317 45 ARG CB C 32.593 45 ARG CD C 43.1 45 ARG CG C 27.31 45 ARG NE N 84.677 45 ARG HA H 5.158 46 PHE HB2 H 2.587 46 PHE HB3 H 2.55 46 PHE HD1 H 7.016 46 PHE HD2 H 7.016 46 PHE HE1 H 7.342 46 PHE HE2 H 7.342 46 PHE HZ H 7.319 46 PHE CA C 56.571 46 PHE CB C 41.46 46 PHE CD1 C 131.214 46 PHE CD2 C 131.231 46 PHE CE1 C 131.199 46 PHE CE2 C 131.076 46 PHE CZ C 129.898 46 PHE H H 8.625 47 VAL HA H 5.045 47 VAL HB H 1.931 47 VAL HG11 H 0.821 47 VAL HG12 H 0.821 47 VAL HG13 H 0.821 47 VAL HG21 H 0.84 47 VAL HG22 H 0.84 47 VAL HG23 H 0.84 47 VAL CA C 61.279 47 VAL CB C 33.479 47 VAL CG1 C 20.927 47 VAL CG2 C 20.61 47 VAL N N 119.944 47 VAL H H 9.23 48 MET HA H 5.61 48 MET HB2 H 1.793 48 MET HB3 H 1.751 48 MET HE1 H 1.931 48 MET HE2 H 1.931 48 MET HE3 H 1.931 48 MET HG2 H 2.529 48 MET HG3 H 2.345 48 MET CA C 52.17 48 MET CB C 35.417 48 MET CE C 17.038 48 MET CG C 33.062 48 MET N N 125.432 48 MET H H 9.43 49 GLU HA H 5.671 49 GLU HB2 H 1.845 49 GLU HB3 H 2.018 49 GLU HG2 H 2.016 49 GLU HG3 H 1.927 49 GLU CA C 54.091 49 GLU CB C 35.842 49 GLU CG C 38.624 49 GLU N N 121.511 49 GLU H H 9.162 50 VAL HA H 4.754 50 VAL HB H 1.324 50 VAL HG11 H 0.696 50 VAL HG12 H 0.696 50 VAL HG13 H 0.696 50 VAL HG21 H 0.262 50 VAL HG22 H 0.262 50 VAL HG23 H 0.262 50 VAL CA C 58.548 50 VAL CB C 35.927 50 VAL CG1 C 18.309 50 VAL CG2 C 21.31 50 VAL N N 125.164 50 VAL H H 8.063 51 GLU HA H 5.288 51 GLU HB2 H 1.968 51 GLU HB3 H 1.683 51 GLU HG2 H 1.807 51 GLU HG3 H 1.808 51 GLU CA C 53.988 51 GLU CB C 31.035 51 GLU CG C 36.411 51 GLU N N 129.133 51 GLU H H 9.375 52 VAL HA H 4.271 52 VAL HB H 2.161 52 VAL HG11 H 0.943 52 VAL HG12 H 0.943 52 VAL HG13 H 0.943 52 VAL HG21 H 0.938 52 VAL HG22 H 0.938 52 VAL HG23 H 0.938 52 VAL CA C 60.843 52 VAL CB C 33.843 52 VAL CG1 C 22.154 52 VAL CG2 C 22.041 52 VAL N N 126.813 52 VAL H H 9.154 53 ASP HA H 4.237 53 ASP HB2 H 2.897 53 ASP HB3 H 2.783 53 ASP CA C 54.764 53 ASP CB C 38.138 53 ASP N N 127.118 53 ASP H H 8.781 54 GLY HA2 H 3.638 54 GLY HA3 H 4.065 54 GLY CA C 45.165 54 GLY N N 103.187 54 GLY H H 8.023 55 GLN HA H 4.418 55 GLN HB2 H 2.037 55 GLN HB3 H 1.749 55 GLN HE21 H 6.797 55 GLN HE22 H 7.537 55 GLN HG2 H 2.165 55 GLN HG3 H 2.038 55 GLN CA C 54.022 55 GLN CB C 31.625 55 GLN CG C 33.96 55 GLN N N 121.223 55 GLN NE2 N 111.81 55 GLN H H 8.203 56 LYS HA H 4.663 56 LYS HB2 H 1.501 56 LYS HB3 H 1.377 56 LYS HD2 H 1.532 56 LYS HD3 H 1.392 56 LYS HE2 H 2.816 56 LYS HE3 H 2.812 56 LYS HG2 H 1.067 56 LYS HG3 H 1.279 56 LYS CA C 55.288 56 LYS CB C 34.153 56 LYS CD C 28.78 56 LYS CE C 41.78 56 LYS CG C 25.282 56 LYS N N 120.645 56 LYS H H 8.797 57 PHE HA H 4.654 57 PHE HB2 H 3.165 57 PHE HB3 H 2.804 57 PHE HD1 H 7.155 57 PHE HD2 H 7.155 57 PHE HE1 H 7.21 57 PHE HE2 H 7.21 57 PHE HZ H 6.933 57 PHE CA C 57.356 57 PHE CB C 41.58 57 PHE CD1 C 132.473 57 PHE CD2 C 132.689 57 PHE CE1 C 131.275 57 PHE CE2 C 131.314 57 PHE CZ C 127.989 57 PHE N N 121.5 57 PHE H H 8.642 58 GLN HA H 5.808 58 GLN HB2 H 1.961 58 GLN HB3 H 1.891 58 GLN HE21 H 8.214 58 GLN HE22 H 6.558 58 GLN HG2 H 2.387 58 GLN HG3 H 2.274 58 GLN CA C 53.896 58 GLN CB C 31.624 58 GLN CG C 33.72 58 GLN N N 119.546 58 GLN NE2 N 111.234 58 GLN H H 8.835 59 GLY HA2 H 4.059 59 GLY HA3 H 4.447 59 GLY CA C 44.691 59 GLY N N 107.365 59 GLY H H 8.309 60 ALA HA H 6.084 60 ALA HB1 H 1.309 60 ALA HB2 H 1.309 60 ALA HB3 H 1.309 60 ALA CA C 49.561 60 ALA CB C 23.272 60 ALA N N 123.517 60 ALA H H 8.533 61 GLY HA2 H 4.487 61 GLY HA3 H 4.075 61 GLY CA C 45.163 61 GLY N N 103.241 61 GLY H H 8.894 62 SER HA H 4.712 62 SER HB2 H 4.118 62 SER HB3 H 3.989 62 SER CA C 59.423 62 SER CB C 63.26 62 SER N N 114.556 62 SER H H 7.522 63 ASN HA H 4.624 63 ASN HB2 H 2.914 63 ASN HB3 H 2.862 63 ASN HD21 H 7.584 63 ASN HD22 H 6.765 63 ASN CA C 51.744 63 ASN CB C 40.651 63 ASN N N 112.606 63 ASN ND2 N 115.048 63 ASN H H 8.29 64 LYS HA H 3.279 64 LYS HB2 H 1.361 64 LYS HB3 H 1.44 64 LYS HD2 H 1.455 64 LYS HD3 H 1.524 64 LYS HE2 H 2.743 64 LYS HE3 H 2.741 64 LYS HG2 H 0.581 64 LYS HG3 H 0.705 64 LYS CA C 60.434 64 LYS CB C 32.256 64 LYS CD C 29.202 64 LYS CE C 41.78 64 LYS CG C 26.138 64 LYS N N 119.851 64 LYS H H 7.846 65 LYS HA H 3.736 65 LYS HB2 H 1.787 65 LYS HB3 H 1.735 65 LYS HD2 H 1.577 65 LYS HD3 H 1.58 65 LYS HE2 H 2.881 65 LYS HE3 H 2.885 65 LYS HG2 H 1.445 65 LYS HG3 H 1.263 65 LYS CA C 59.936 65 LYS CB C 31.715 65 LYS CD C 28.78 65 LYS CE C 41.78 65 LYS CG C 25.33 65 LYS N N 119.363 65 LYS H H 8.261 66 VAL HA H 3.61 66 VAL HB H 1.842 66 VAL HG11 H 1.116 66 VAL HG12 H 1.116 66 VAL HG13 H 1.116 66 VAL HG21 H 1.041 66 VAL HG22 H 1.041 66 VAL HG23 H 1.041 66 VAL CA C 65.201 66 VAL CB C 31.971 66 VAL CG1 C 21.65 66 VAL CG2 C 22.54 66 VAL N N 120.889 66 VAL H H 7.414 67 ALA HA H 3.8 67 ALA HB1 H 1.37 67 ALA HB2 H 1.37 67 ALA HB3 H 1.37 67 ALA CA C 55.5 67 ALA CB C 18.307 67 ALA N N 121.317 67 ALA H H 7.98 68 LYS HA H 3.538 68 LYS HB2 H 1.602 68 LYS HB3 H 1.292 68 LYS HD2 H 1.225 68 LYS HD3 H 1.226 68 LYS HE2 H 2.225 68 LYS HE3 H 1.987 68 LYS HG2 H 1.367 68 LYS HG3 H 0.802 68 LYS CA C 60.078 68 LYS CB C 32.096 68 LYS CD C 28.78 68 LYS CE C 40.796 68 LYS CG C 25.665 68 LYS N N 115.457 68 LYS H H 7.521 69 ALA HA H 3.868 69 ALA HB1 H 1.384 69 ALA HB2 H 1.384 69 ALA HB3 H 1.384 69 ALA CA C 55.246 69 ALA CB C 17.663 69 ALA N N 119.816 69 ALA H H 8.334 70 TYR HA H 4.398 70 TYR HB2 H 2.984 70 TYR HB3 H 3.319 70 TYR HD1 H 7.329 70 TYR HD2 H 7.329 70 TYR HE1 H 6.802 70 TYR HE2 H 6.802 70 TYR CA C 61.488 70 TYR CB C 37.489 70 TYR CD1 C 132.797 70 TYR CD2 C 132.996 70 TYR CE1 C 117.885 70 TYR CE2 C 117.91 70 TYR N N 115.273 70 TYR H H 8.128 71 ALA HA H 3.966 71 ALA HB1 H 1.52 71 ALA HB2 H 1.52 71 ALA HB3 H 1.52 71 ALA CA C 55.371 71 ALA CB C 16.945 71 ALA N N 126.458 71 ALA H H 8.347 72 ALA HA H 3.961 72 ALA HB1 H 1.493 72 ALA HB2 H 1.493 72 ALA HB3 H 1.493 72 ALA CA C 54.316 72 ALA CB C 17.662 72 ALA N N 118.235 72 ALA H H 8.575 73 LEU HA H 3.912 73 LEU HB2 H 1.753 73 LEU HB3 H 1.671 73 LEU HD11 H 0.775 73 LEU HD12 H 0.775 73 LEU HD13 H 0.775 73 LEU HD21 H 0.839 73 LEU HD22 H 0.839 73 LEU HD23 H 0.839 73 LEU HG H 1.618 73 LEU CA C 57.607 73 LEU CB C 42.296 73 LEU CD1 C 24.276 73 LEU CD2 C 24.715 73 LEU CG C 26.718 73 LEU N N 117.616 73 LEU H H 7.8 74 ALA HA H 4.149 74 ALA HB1 H 1.775 74 ALA HB2 H 1.775 74 ALA HB3 H 1.775 74 ALA CA C 54.741 74 ALA CB C 17.662 74 ALA N N 121.011 74 ALA H H 7.359 75 ALA HA H 2.052 75 ALA HB1 H 0.868 75 ALA HB2 H 0.868 75 ALA HB3 H 0.868 75 ALA CA C 53.885 75 ALA CB C 19.181 75 ALA N N 121.317 75 ALA H H 8.543 76 LEU HA H 3.94 76 LEU HB2 H 1.946 76 LEU HB3 H 1.462 76 LEU HD11 H 0.88 76 LEU HD12 H 0.88 76 LEU HD13 H 0.88 76 LEU HD21 H 0.715 76 LEU HD22 H 0.715 76 LEU HD23 H 0.715 76 LEU HG H 1.807 76 LEU CA C 58.157 76 LEU CB C 41.917 76 LEU CD1 C 26.0 76 LEU CD2 C 23.374 76 LEU CG C 26.77 76 LEU N N 118.141 76 LEU H H 8.262 77 GLU HA H 3.87 77 GLU HB2 H 1.959 77 GLU HB3 H 2.067 77 GLU HG2 H 2.218 77 GLU HG3 H 2.458 77 GLU CA C 58.493 77 GLU CB C 29.431 77 GLU CG C 36.554 77 GLU N N 115.676 77 GLU H H 7.197 78 LYS HA H 4.256 78 LYS HB2 H 1.994 78 LYS HB3 H 1.87 78 LYS HD2 H 1.921 78 LYS HD3 H 1.783 78 LYS HE2 H 3.09 78 LYS HE3 H 3.089 78 LYS HG2 H 1.701 78 LYS HG3 H 1.456 78 LYS CA C 56.847 78 LYS CB C 33.269 78 LYS CD C 28.247 78 LYS CE C 42.211 78 LYS CG C 24.653 78 LYS N N 115.515 78 LYS H H 8.194 79 LEU HA H 4.006 79 LEU HB2 H 1.251 79 LEU HB3 H 0.375 79 LEU HD11 H 0.736 79 LEU HD12 H 0.736 79 LEU HD13 H 0.736 79 LEU HD21 H 0.784 79 LEU HD22 H 0.784 79 LEU HD23 H 0.784 79 LEU HG H 1.475 79 LEU CA C 55.458 79 LEU CB C 42.761 79 LEU CD1 C 26.096 79 LEU CD2 C 21.774 79 LEU CG C 26.77 79 LEU N N 115.31 79 LEU H H 7.864 80 PHE HA H 5.049 80 PHE HB2 H 3.178 80 PHE HB3 H 2.91 80 PHE HD1 H 7.201 80 PHE HD2 H 7.201 80 PHE HE1 H 7.029 80 PHE HE2 H 7.029 80 PHE HZ H 6.929 80 PHE CA C 54.371 80 PHE CB C 38.945 80 PHE CD1 C 132.978 80 PHE CD2 C 132.928 80 PHE CE1 C 130.379 80 PHE CE2 C 130.6 80 PHE CZ C 128.254 80 PHE N N 116.554 80 PHE HA H 4.414 81 PRO HB2 H 2.293 81 PRO HB3 H 1.97 81 PRO HD2 H 3.383 81 PRO HD3 H 3.156 81 PRO HG2 H 1.86 81 PRO HG3 H 1.92 81 PRO CA C 63.401 81 PRO CB C 31.471 81 PRO CD C 50.056 81 PRO CG C 27.14 81 PRO H H 8.541 82 ASP HA H 4.619 82 ASP HB2 H 2.685 82 ASP HB3 H 2.594 82 ASP CA C 54.191 82 ASP CB C 40.819 82 ASP N N 120.095 82 ASP H H 8.074 83 THR HA H 4.567 83 THR HB H 4.124 83 THR HG21 H 1.212 83 THR HG22 H 1.212 83 THR HG23 H 1.212 83 THR CA C 59.454 83 THR CB C 69.709 83 THR CG2 C 21.06 83 THR N N 116.492 83 THR HA H 4.367 84 PRO HB2 H 2.254 84 PRO HB3 H 1.854 84 PRO HD2 H 3.815 84 PRO HD3 H 3.673 84 PRO HG2 H 1.996 84 PRO HG3 H 1.949 84 PRO CA C 62.944 84 PRO CB C 31.386 84 PRO CD C 50.773 84 PRO CG C 27.14 84 PRO H H 8.307 85 LEU HA H 4.259 85 LEU HB2 H 1.513 85 LEU HB3 H 1.59 85 LEU HD11 H 0.889 85 LEU HD12 H 0.889 85 LEU HD13 H 0.889 85 LEU HD21 H 0.836 85 LEU HD22 H 0.836 85 LEU HD23 H 0.836 85 LEU HG H 1.604 85 LEU CA C 54.823 85 LEU CB C 42.212 85 LEU CD1 C 24.73 85 LEU CD2 C 23.249 85 LEU CG C 26.77 85 LEU N N 122.416 85 LEU H H 8.249 86 ALA HA H 4.291 86 ALA HB1 H 1.34 86 ALA HB2 H 1.34 86 ALA HB3 H 1.34 86 ALA CA C 51.913 86 ALA CB C 18.844 86 ALA N N 124.92 86 ALA H H 8.192 87 LEU HA H 4.243 87 LEU HB2 H 1.598 87 LEU HB3 H 1.532 87 LEU HD11 H 0.892 87 LEU HD12 H 0.892 87 LEU HD13 H 0.892 87 LEU HD21 H 0.843 87 LEU HD22 H 0.843 87 LEU HD23 H 0.843 87 LEU HG H 1.609 87 LEU CA C 54.993 87 LEU CB C 42.156 87 LEU CD1 C 24.73 87 LEU CD2 C 23.404 87 LEU CG C 26.77 87 LEU N N 121.5 87 LEU H H 8.249 88 ASP HA H 4.531 88 ASP HB2 H 2.665 88 ASP HB3 H 2.585 88 ASP CA C 53.81 88 ASP CB C 40.945 88 ASP N N 120.584 88 ASP H H 8.108 89 ALA HA H 4.252 89 ALA HB1 H 1.355 89 ALA HB2 H 1.355 89 ALA HB3 H 1.355 89 ALA CA C 52.504 89 ALA CB C 19.012 89 ALA N N 123.943 89 ALA H H 8.376 90 ASN HA H 4.671 90 ASN HB2 H 2.832 90 ASN HB3 H 2.714 90 ASN HD21 H 7.632 90 ASN HD22 H 6.89 90 ASN CA C 53.214 90 ASN CB C 38.593 90 ASN N N 117.47 90 ASN ND2 N 113.245 90 ASN H H 7.717 91 LYS HA H 4.102 91 LYS HB2 H 1.792 91 LYS HB3 H 1.687 91 LYS HD2 H 1.637 91 LYS HD3 H 1.636 91 LYS HE2 H 2.965 91 LYS HE3 H 2.965 91 LYS HG2 H 1.35 91 LYS HG3 H 1.35 91 LYS CA C 57.532 91 LYS CB C 33.33 91 LYS CD C 28.938 91 LYS CE C 41.863 91 LYS CG C 24.403 91 LYS N N 126.141 91 LYS