data_nef_c30200_5ttt save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 5TTT stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 SER middle . . 3 A 3 TRP middle . . 4 A 4 MET middle . . 5 A 5 GLN middle . . 6 A 6 ASN middle . . 7 A 7 LEU middle . . 8 A 8 LYS middle . . 9 A 9 ASN middle . . 10 A 10 TYR middle . . 11 A 11 GLN middle . . 12 A 12 HIS middle . . 13 A 13 LEU middle . . 14 A 14 ARG middle . . 15 A 15 ASP middle . . 16 A 16 PRO middle . false 17 A 17 SER middle . . 18 A 18 GLU middle . . 19 A 19 TYR middle . . 20 A 20 MET middle . . 21 A 21 SER middle . . 22 A 22 GLN middle . . 23 A 23 VAL middle . . 24 A 24 TYR middle . . 25 A 25 GLY middle . false 26 A 26 ASP middle . . 27 A 27 PRO middle . false 28 A 28 LEU middle . . 29 A 29 ALA middle . . 30 A 30 TYR middle . . 31 A 31 LEU middle . . 32 A 32 GLN middle . . 33 A 33 GLU middle . . 34 A 34 THR middle . . 35 A 35 THR middle . . 36 A 36 LYS middle . . 37 A 37 PHE middle . . 38 A 38 VAL middle . . 39 A 39 THR middle . . 40 A 40 GLU middle . . 41 A 41 ARG middle . . 42 A 42 GLU middle . . 43 A 43 TYR middle . . 44 A 44 TYR middle . . 45 A 45 GLU middle . . 46 A 46 ASP middle . . 47 A 47 PHE middle . . 48 A 48 GLY middle . false 49 A 49 TYR middle . . 50 A 50 GLY middle . false 51 A 51 GLU middle . . 52 A 52 CYS middle . . 53 A 53 PHE middle . . 54 A 54 ASN middle . . 55 A 55 SER middle . . 56 A 56 THR middle . . 57 A 57 GLU middle . . 58 A 58 SER middle . . 59 A 59 GLU middle . . 60 A 60 VAL middle . . 61 A 61 GLN middle . . 62 A 62 CYS middle . . 63 A 63 GLU middle . . 64 A 64 LEU middle . . 65 A 65 ILE middle . . 66 A 66 THR middle . . 67 A 67 GLY middle . false 68 A 68 GLU middle . . 69 A 69 PHE middle . . 70 A 70 ASP middle . . 71 A 71 PRO middle . false 72 A 72 LYS middle . . 73 A 73 LEU middle . . 74 A 74 LEU middle . . 75 A 75 PRO middle . false 76 A 76 TYR middle . . 77 A 77 ASP middle . . 78 A 78 LYS middle . . 79 A 79 ARG middle . . 80 A 80 LEU middle . . 81 A 81 ALA middle . . 82 A 82 TRP middle . . 83 A 83 HIS middle . . 84 A 84 PHE middle . . 85 A 85 LYS middle . . 86 A 86 GLU middle . . 87 A 87 PHE middle . . 88 A 88 CYS middle . . 89 A 89 TYR middle . . 90 A 90 LYS middle . . 91 A 91 THR middle . . 92 A 92 SER middle . . 93 A 93 ALA middle . . 94 A 94 HIS middle . . 95 A 95 GLY middle . false 96 A 96 ILE middle . . 97 A 97 PRO middle . false 98 A 98 MET middle . . 99 A 99 ILE middle . . 100 A 100 GLY middle . false 101 A 101 GLU middle . . 102 A 102 ALA middle . . 103 A 103 PRO middle . false 104 A 104 LEU middle . . 105 A 105 GLU middle . . 106 A 106 HIS middle . . 107 A 107 HIS middle . . 108 A 108 HIS middle . . 109 A 109 HIS middle . . 110 A 110 HIS middle . . 111 A 111 HIS end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 3 TRP C C 13 177.501 0.2 A 3 TRP CA C 13 59.083 0.2 A 3 TRP CB C 13 28.036 0.2 A 4 MET H H 1 7.908 0.02 A 4 MET C C 13 177.356 0.2 A 4 MET CA C 13 57.001 0.2 A 4 MET CB C 13 31.156 0.2 A 4 MET N N 15 118.436 0.2 A 5 GLN H H 1 7.645 0.02 A 5 GLN C C 13 176.903 0.2 A 5 GLN CA C 13 57.090 0.2 A 5 GLN CB C 13 27.893 0.2 A 5 GLN N N 15 118.538 0.2 A 6 ASN H H 1 7.856 0.02 A 6 ASN C C 13 175.861 0.2 A 6 ASN CA C 13 54.029 0.2 A 6 ASN CB C 13 38.321 0.2 A 6 ASN N N 15 116.857 0.2 A 7 LEU H H 1 7.775 0.02 A 7 LEU C C 13 177.523 0.2 A 7 LEU CA C 13 55.808 0.2 A 7 LEU CB C 13 40.752 0.2 A 7 LEU N N 15 120.814 0.2 A 8 LYS H H 1 7.828 0.02 A 8 LYS C C 13 177.114 0.2 A 8 LYS CA C 13 57.746 0.2 A 8 LYS CB C 13 31.537 0.2 A 8 LYS N N 15 119.354 0.2 A 9 ASN H H 1 7.980 0.02 A 9 ASN C C 13 175.576 0.2 A 9 ASN CA C 13 53.351 0.2 A 9 ASN CB C 13 37.794 0.2 A 9 ASN N N 15 116.374 0.2 A 10 TYR H H 1 7.813 0.02 A 10 TYR C C 13 175.999 0.2 A 10 TYR CA C 13 58.611 0.2 A 10 TYR CB C 13 37.609 0.2 A 10 TYR N N 15 120.076 0.2 A 11 GLN H H 1 7.980 0.02 A 11 GLN C C 13 175.847 0.2 A 11 GLN CA C 13 56.888 0.2 A 11 GLN CB C 13 27.907 0.2 A 11 GLN N N 15 118.877 0.2 A 12 HIS H H 1 7.752 0.02 A 12 HIS C C 13 175.226 0.2 A 12 HIS CA C 13 55.641 0.2 A 12 HIS CB C 13 29.770 0.2 A 12 HIS N N 15 116.944 0.2 A 13 LEU H H 1 7.521 0.02 A 13 LEU C C 13 176.264 0.2 A 13 LEU CA C 13 54.593 0.2 A 13 LEU CB C 13 41.394 0.2 A 13 LEU N N 15 121.435 0.2 A 14 ARG H H 1 7.880 0.02 A 14 ARG C C 13 175.576 0.2 A 14 ARG CA C 13 55.477 0.2 A 14 ARG CB C 13 30.213 0.2 A 14 ARG N N 15 120.839 0.2 A 15 ASP H H 1 8.300 0.02 A 15 ASP CA C 13 51.914 0.2 A 15 ASP CB C 13 41.036 0.2 A 15 ASP N N 15 120.013 0.2 A 16 PRO C C 13 177.220 0.2 A 16 PRO CA C 13 63.751 0.2 A 16 PRO CB C 13 31.049 0.2 A 17 SER H H 1 8.525 0.02 A 17 SER C C 13 176.052 0.2 A 17 SER CA C 13 61.480 0.2 A 17 SER CB C 13 62.172 0.2 A 17 SER N N 15 115.950 0.2 A 18 GLU H H 1 8.150 0.02 A 18 GLU C C 13 178.066 0.2 A 18 GLU CA C 13 58.112 0.2 A 18 GLU CB C 13 28.547 0.2 A 18 GLU N N 15 122.413 0.2 A 19 TYR H H 1 7.717 0.02 A 19 TYR C C 13 177.155 0.2 A 19 TYR CA C 13 59.222 0.2 A 19 TYR CB C 13 37.809 0.2 A 19 TYR N N 15 118.768 0.2 A 20 MET H H 1 7.950 0.02 A 20 MET C C 13 177.334 0.2 A 20 MET CA C 13 56.774 0.2 A 20 MET CB C 13 31.317 0.2 A 20 MET N N 15 117.327 0.2 A 21 SER H H 1 7.952 0.02 A 21 SER C C 13 176.046 0.2 A 21 SER CA C 13 60.423 0.2 A 21 SER CB C 13 62.272 0.2 A 21 SER N N 15 114.597 0.2 A 22 GLN H H 1 7.860 0.02 A 22 GLN C C 13 177.198 0.2 A 22 GLN CA C 13 57.022 0.2 A 22 GLN CB C 13 27.821 0.2 A 22 GLN N N 15 120.999 0.2 A 23 VAL H H 1 7.479 0.02 A 23 VAL C C 13 175.721 0.2 A 23 VAL CA C 13 63.623 0.2 A 23 VAL CB C 13 31.346 0.2 A 23 VAL N N 15 118.510 0.2 A 24 TYR H H 1 7.689 0.02 A 24 TYR C C 13 175.719 0.2 A 24 TYR CA C 13 58.580 0.2 A 24 TYR CB C 13 38.148 0.2 A 24 TYR N N 15 118.494 0.2 A 25 GLY H H 1 7.694 0.02 A 25 GLY C C 13 173.688 0.2 A 25 GLY CA C 13 45.353 0.2 A 25 GLY N N 15 105.596 0.2 A 26 ASP H H 1 7.790 0.02 A 26 ASP CA C 13 51.771 0.2 A 26 ASP CB C 13 40.239 0.2 A 26 ASP N N 15 118.611 0.2 A 27 PRO C C 13 178.412 0.2 A 27 PRO CA C 13 64.716 0.2 A 27 PRO CB C 13 31.334 0.2 A 28 LEU H H 1 8.250 0.02 A 28 LEU C C 13 179.045 0.2 A 28 LEU CA C 13 57.172 0.2 A 28 LEU CB C 13 39.527 0.2 A 28 LEU N N 15 117.304 0.2 A 29 ALA H H 1 7.584 0.02 A 29 ALA C C 13 180.143 0.2 A 29 ALA CA C 13 54.204 0.2 A 29 ALA CB C 13 17.361 0.2 A 29 ALA N N 15 122.659 0.2 A 30 TYR H H 1 7.611 0.02 A 30 TYR C C 13 178.334 0.2 A 30 TYR CA C 13 60.324 0.2 A 30 TYR CB C 13 37.765 0.2 A 30 TYR N N 15 117.638 0.2 A 31 LEU H H 1 8.144 0.02 A 31 LEU C C 13 178.857 0.2 A 31 LEU CA C 13 56.935 0.2 A 31 LEU CB C 13 41.041 0.2 A 31 LEU N N 15 120.733 0.2 A 32 GLN H H 1 8.259 0.02 A 32 GLN C C 13 177.753 0.2 A 32 GLN CA C 13 58.461 0.2 A 32 GLN CB C 13 27.839 0.2 A 32 GLN N N 15 120.229 0.2 A 33 GLU H H 1 8.031 0.02 A 33 GLU C C 13 178.527 0.2 A 33 GLU CA C 13 57.960 0.2 A 33 GLU CB C 13 28.820 0.2 A 33 GLU N N 15 119.369 0.2 A 34 THR H H 1 7.885 0.02 A 34 THR C C 13 175.744 0.2 A 34 THR CA C 13 65.018 0.2 A 34 THR CB C 13 68.361 0.2 A 34 THR N N 15 113.837 0.2 A 35 THR H H 1 7.734 0.02 A 35 THR C C 13 175.641 0.2 A 35 THR CA C 13 63.933 0.2 A 35 THR CB C 13 68.367 0.2 A 35 THR N N 15 113.018 0.2 A 36 LYS H H 1 7.563 0.02 A 36 LYS C C 13 176.985 0.2 A 36 LYS CA C 13 57.925 0.2 A 36 LYS CB C 13 31.230 0.2 A 36 LYS N N 15 122.248 0.2 A 37 PHE H H 1 7.770 0.02 A 37 PHE C C 13 175.938 0.2 A 37 PHE CA C 13 58.451 0.2 A 37 PHE CB C 13 38.503 0.2 A 37 PHE N N 15 117.915 0.2 A 38 VAL H H 1 7.657 0.02 A 38 VAL C C 13 175.877 0.2 A 38 VAL CA C 13 62.769 0.2 A 38 VAL CB C 13 31.848 0.2 A 38 VAL N N 15 117.220 0.2 A 39 THR H H 1 7.928 0.02 A 39 THR C C 13 175.058 0.2 A 39 THR CA C 13 61.721 0.2 A 39 THR CB C 13 69.480 0.2 A 39 THR N N 15 113.454 0.2 A 40 GLU H H 1 8.219 0.02 A 40 GLU CA C 13 57.133 0.2 A 40 GLU N N 15 121.953 0.2 A 43 TYR C C 13 175.595 0.2 A 43 TYR CA C 13 58.886 0.2 A 43 TYR CB C 13 37.989 0.2 A 44 TYR H H 1 7.578 0.02 A 44 TYR C C 13 176.179 0.2 A 44 TYR CA C 13 58.193 0.2 A 44 TYR CB C 13 37.734 0.2 A 44 TYR N N 15 116.896 0.2 A 45 GLU H H 1 7.835 0.02 A 45 GLU C C 13 176.427 0.2 A 45 GLU CA C 13 57.115 0.2 A 45 GLU CB C 13 29.348 0.2 A 45 GLU N N 15 121.033 0.2 A 46 ASP H H 1 8.024 0.02 A 46 ASP C C 13 176.235 0.2 A 46 ASP CA C 13 54.257 0.2 A 46 ASP CB C 13 40.502 0.2 A 46 ASP N N 15 119.204 0.2 A 47 PHE H H 1 7.864 0.02 A 47 PHE C C 13 175.141 0.2 A 47 PHE CA C 13 57.723 0.2 A 47 PHE CB C 13 38.223 0.2 A 47 PHE N N 15 118.989 0.2 A 48 GLY H H 1 7.976 0.02 A 48 GLY C C 13 174.566 0.2 A 48 GLY CA C 13 45.232 0.2 A 48 GLY N N 15 107.284 0.2 A 49 TYR H H 1 7.928 0.02 A 49 TYR C C 13 176.599 0.2 A 49 TYR CA C 13 58.724 0.2 A 49 TYR CB C 13 37.798 0.2 A 49 TYR N N 15 119.694 0.2 A 50 GLY H H 1 8.482 0.02 A 50 GLY C C 13 175.087 0.2 A 50 GLY CA C 13 45.846 0.2 A 50 GLY N N 15 108.779 0.2 A 51 GLU H H 1 8.222 0.02 A 51 GLU C C 13 177.502 0.2 A 51 GLU CA C 13 56.968 0.2 A 51 GLU CB C 13 28.827 0.2 A 51 GLU N N 15 120.567 0.2 A 52 CYS H H 1 7.931 0.02 A 52 CYS C C 13 174.359 0.2 A 52 CYS CA C 13 59.794 0.2 A 52 CYS CB C 13 27.236 0.2 A 52 CYS N N 15 117.587 0.2 A 53 PHE H H 1 7.926 0.02 A 53 PHE C C 13 175.084 0.2 A 53 PHE CA C 13 57.402 0.2 A 53 PHE CB C 13 38.512 0.2 A 53 PHE N N 15 118.506 0.2 A 54 ASN H H 1 7.992 0.02 A 54 ASN C C 13 175.284 0.2 A 54 ASN CA C 13 52.889 0.2 A 54 ASN CB C 13 38.479 0.2 A 54 ASN N N 15 119.285 0.2 A 55 SER H H 1 8.176 0.02 A 55 SER C C 13 174.928 0.2 A 55 SER CA C 13 58.042 0.2 A 55 SER CB C 13 63.368 0.2 A 55 SER N N 15 116.602 0.2 A 56 THR H H 1 8.252 0.02 A 56 THR C C 13 175.005 0.2 A 56 THR CA C 13 62.052 0.2 A 56 THR CB C 13 69.019 0.2 A 56 THR N N 15 116.474 0.2 A 57 GLU H H 1 8.392 0.02 A 57 GLU C C 13 176.875 0.2 A 57 GLU CA C 13 56.789 0.2 A 57 GLU CB C 13 29.169 0.2 A 57 GLU N N 15 122.826 0.2 A 58 SER H H 1 8.149 0.02 A 58 SER C C 13 174.807 0.2 A 58 SER CA C 13 58.590 0.2 A 58 SER CB C 13 63.040 0.2 A 58 SER N N 15 116.315 0.2 A 59 GLU H H 1 8.256 0.02 A 59 GLU C C 13 176.885 0.2 A 59 GLU CA C 13 56.723 0.2 A 59 GLU CB C 13 29.325 0.2 A 59 GLU N N 15 123.043 0.2 A 60 VAL H H 1 8.008 0.02 A 60 VAL C C 13 176.174 0.2 A 60 VAL CA C 13 62.468 0.2 A 60 VAL CB C 13 32.032 0.2 A 60 VAL N N 15 120.903 0.2 A 61 GLN H H 1 8.235 0.02 A 61 GLN C C 13 176.219 0.2 A 61 GLN CA C 13 55.732 0.2 A 61 GLN CB C 13 28.322 0.2 A 61 GLN N N 15 123.484 0.2 A 62 CYS H H 1 8.319 0.02 A 62 CYS C C 13 174.910 0.2 A 62 CYS CA C 13 59.177 0.2 A 62 CYS CB C 13 27.299 0.2 A 62 CYS N N 15 120.482 0.2 A 63 GLU H H 1 8.549 0.02 A 63 GLU C C 13 176.807 0.2 A 63 GLU CA C 13 57.006 0.2 A 63 GLU CB C 13 29.011 0.2 A 63 GLU N N 15 123.519 0.2 A 64 LEU H H 1 8.021 0.02 A 64 LEU C C 13 177.095 0.2 A 64 LEU CA C 13 55.507 0.2 A 64 LEU CB C 13 41.505 0.2 A 64 LEU N N 15 121.741 0.2 A 65 ILE H H 1 7.835 0.02 A 65 ILE C C 13 176.210 0.2 A 65 ILE CA C 13 60.982 0.2 A 65 ILE CB C 13 37.512 0.2 A 65 ILE N N 15 119.160 0.2 A 66 THR H H 1 7.968 0.02 A 66 THR C C 13 175.364 0.2 A 66 THR CA C 13 61.855 0.2 A 66 THR CB C 13 69.223 0.2 A 66 THR N N 15 114.985 0.2 A 67 GLY H H 1 8.165 0.02 A 67 GLY C C 13 173.805 0.2 A 67 GLY CA C 13 44.920 0.2 A 67 GLY N N 15 110.751 0.2 A 68 GLU H H 1 8.106 0.02 A 68 GLU C C 13 176.015 0.2 A 68 GLU CA C 13 55.906 0.2 A 68 GLU CB C 13 29.510 0.2 A 68 GLU N N 15 120.406 0.2 A 69 PHE H H 1 8.104 0.02 A 69 PHE C C 13 173.986 0.2 A 69 PHE CA C 13 57.150 0.2 A 69 PHE CB C 13 39.095 0.2 A 69 PHE N N 15 121.384 0.2 A 70 ASP H H 1 7.773 0.02 A 70 ASP CA C 13 50.482 0.2 A 70 ASP CB C 13 41.495 0.2 A 70 ASP N N 15 124.689 0.2 A 71 PRO C C 13 177.464 0.2 A 71 PRO CA C 13 63.463 0.2 A 71 PRO CB C 13 31.115 0.2 A 72 LYS H H 1 8.206 0.02 A 72 LYS C C 13 177.232 0.2 A 72 LYS CA C 13 57.517 0.2 A 72 LYS CB C 13 30.710 0.2 A 72 LYS N N 15 117.818 0.2 A 73 LEU H H 1 7.605 0.02 A 73 LEU C C 13 177.136 0.2 A 73 LEU CA C 13 54.339 0.2 A 73 LEU CB C 13 41.345 0.2 A 73 LEU N N 15 118.447 0.2 A 74 LEU H H 1 7.440 0.02 A 74 LEU CA C 13 52.716 0.2 A 74 LEU CB C 13 41.204 0.2 A 74 LEU N N 15 120.783 0.2 A 75 PRO C C 13 176.028 0.2 A 75 PRO CA C 13 62.081 0.2 A 75 PRO CB C 13 33.290 0.2 A 76 TYR H H 1 8.478 0.02 A 76 TYR C C 13 177.194 0.2 A 76 TYR CA C 13 54.919 0.2 A 76 TYR CB C 13 41.201 0.2 A 76 TYR N N 15 124.286 0.2 A 78 LYS C C 13 178.081 0.2 A 78 LYS CA C 13 57.734 0.2 A 78 LYS CB C 13 31.738 0.2 A 79 ARG H H 1 8.439 0.02 A 79 ARG C C 13 177.941 0.2 A 79 ARG CA C 13 57.844 0.2 A 79 ARG CB C 13 29.164 0.2 A 79 ARG N N 15 121.156 0.2 A 80 LEU H H 1 8.065 0.02 A 80 LEU C C 13 177.967 0.2 A 80 LEU CA C 13 56.981 0.2 A 80 LEU CB C 13 40.911 0.2 A 80 LEU N N 15 120.235 0.2 A 81 ALA H H 1 7.808 0.02 A 81 ALA C C 13 178.845 0.2 A 81 ALA CA C 13 54.273 0.2 A 81 ALA CB C 13 17.851 0.2 A 81 ALA N N 15 120.534 0.2 A 82 TRP H H 1 7.994 0.02 A 82 TRP C C 13 177.416 0.2 A 82 TRP CA C 13 59.667 0.2 A 82 TRP CB C 13 28.253 0.2 A 82 TRP N N 15 120.008 0.2 A 83 HIS C C 13 177.532 0.2 A 83 HIS CA C 13 58.437 0.2 A 83 HIS CB C 13 29.859 0.2 A 84 PHE H H 1 8.408 0.02 A 84 PHE C C 13 176.710 0.2 A 84 PHE CA C 13 60.035 0.2 A 84 PHE CB C 13 38.476 0.2 A 84 PHE N N 15 120.185 0.2 A 85 LYS H H 1 8.179 0.02 A 85 LYS C C 13 177.887 0.2 A 85 LYS CA C 13 59.200 0.2 A 85 LYS CB C 13 30.867 0.2 A 85 LYS N N 15 121.485 0.2 A 86 GLU H H 1 8.059 0.02 A 86 GLU C C 13 177.610 0.2 A 86 GLU CA C 13 57.707 0.2 A 86 GLU CB C 13 28.730 0.2 A 86 GLU N N 15 118.487 0.2 A 87 PHE H H 1 7.858 0.02 A 87 PHE C C 13 176.356 0.2 A 87 PHE CA C 13 59.050 0.2 A 87 PHE CB C 13 38.675 0.2 A 87 PHE N N 15 118.958 0.2 A 88 CYS H H 1 7.801 0.02 A 88 CYS C C 13 174.657 0.2 A 88 CYS CA C 13 60.611 0.2 A 88 CYS CB C 13 27.445 0.2 A 88 CYS N N 15 116.944 0.2 A 89 TYR H H 1 7.931 0.02 A 89 TYR C C 13 175.947 0.2 A 89 TYR CA C 13 58.327 0.2 A 89 TYR CB C 13 37.922 0.2 A 89 TYR N N 15 119.354 0.2 A 90 LYS H H 1 7.949 0.02 A 90 LYS C C 13 176.986 0.2 A 90 LYS CA C 13 56.532 0.2 A 90 LYS CB C 13 32.068 0.2 A 90 LYS N N 15 121.596 0.2 A 91 THR H H 1 7.995 0.02 A 91 THR C C 13 174.745 0.2 A 91 THR CA C 13 62.037 0.2 A 91 THR CB C 13 68.960 0.2 A 91 THR N N 15 115.681 0.2 A 92 SER H H 1 8.097 0.02 A 92 SER C C 13 174.370 0.2 A 92 SER CA C 13 58.112 0.2 A 92 SER CB C 13 63.214 0.2 A 92 SER N N 15 118.076 0.2 A 93 ALA H H 1 8.150 0.02 A 93 ALA C C 13 177.527 0.2 A 93 ALA CA C 13 52.373 0.2 A 93 ALA CB C 13 18.193 0.2 A 93 ALA N N 15 125.414 0.2 A 94 HIS H H 1 8.002 0.02 A 94 HIS C C 13 175.633 0.2 A 94 HIS CA C 13 55.717 0.2 A 94 HIS CB C 13 29.844 0.2 A 94 HIS N N 15 117.537 0.2 A 95 GLY H H 1 8.137 0.02 A 95 GLY C C 13 173.518 0.2 A 95 GLY CA C 13 44.723 0.2 A 95 GLY N N 15 109.763 0.2 A 96 ILE H H 1 7.995 0.02 A 96 ILE CA C 13 58.184 0.2 A 96 ILE CB C 13 37.571 0.2 A 96 ILE N N 15 122.016 0.2 A 97 PRO C C 13 176.415 0.2 A 97 PRO CA C 13 62.794 0.2 A 97 PRO CB C 13 31.227 0.2 A 98 MET H H 1 8.321 0.02 A 98 MET C C 13 176.152 0.2 A 98 MET CA C 13 55.413 0.2 A 98 MET CB C 13 32.137 0.2 A 98 MET N N 15 120.123 0.2 A 99 ILE H H 1 8.011 0.02 A 99 ILE C C 13 176.292 0.2 A 99 ILE CA C 13 60.761 0.2 A 99 ILE CB C 13 37.827 0.2 A 99 ILE N N 15 121.266 0.2 A 100 GLY H H 1 8.280 0.02 A 100 GLY C C 13 173.608 0.2 A 100 GLY CA C 13 44.540 0.2 A 100 GLY N N 15 112.620 0.2 A 101 GLU H H 1 8.102 0.02 A 101 GLU C C 13 175.963 0.2 A 101 GLU CA C 13 55.558 0.2 A 101 GLU CB C 13 29.891 0.2 A 101 GLU N N 15 120.708 0.2 A 102 ALA H H 1 8.338 0.02 A 102 ALA CA C 13 50.071 0.2 A 102 ALA CB C 13 17.312 0.2 A 102 ALA N N 15 127.173 0.2 A 103 PRO C C 13 176.903 0.2 A 103 PRO CA C 13 62.468 0.2 A 103 PRO CB C 13 31.094 0.2 A 104 LEU H H 1 8.240 0.02 A 104 LEU C C 13 177.414 0.2 A 104 LEU CA C 13 54.731 0.2 A 104 LEU CB C 13 41.313 0.2 A 104 LEU N N 15 122.631 0.2 A 105 GLU H H 1 8.224 0.02 A 105 GLU C C 13 176.070 0.2 A 105 GLU CA C 13 55.846 0.2 A 105 GLU CB C 13 29.575 0.2 A 105 GLU N N 15 121.849 0.2 A 106 HIS H H 1 8.228 0.02 A 106 HIS CA C 13 55.662 0.2 A 106 HIS N N 15 120.735 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 52 CYS HG A 62 CYS HG 1.0 1.8 6.6 2 2 A 52 CYS HG A 88 CYS HG 1.0 1.8 6.6 3 3 A 52 CYS HG A 62 CYS HG 1.0 1.8 6.6 4 4 A 62 CYS HG A 88 CYS HG 1.0 1.8 6.6 5 5 A 52 CYS HG A 88 CYS HG 1.0 1.8 6.6 6 6 A 62 CYS HG A 88 CYS HG 1.0 1.8 6.6 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 50 GLY H A 63 GLU H 1.0 1.8 7.70 2 2 A 22 GLN H A 31 LEU H 1.0 1.8 9.90 3 3 A 22 GLN H A 31 LEU H 1.0 1.8 9.90 4 4 A 50 GLY H A 63 GLU H 1.0 1.8 7.70 5 5 A 42 GLU H A 47 PHE HD% 1.0 1.8 7.15 6 6 A 42 GLU H A 47 PHE HE% 1.0 1.8 7.15 7 7 A 21 SER H A 30 TYR HD% 1.0 1.8 7.70 8 8 A 24 TYR H A 53 PHE HBx 1.0 1.8 9.35 9 8 A 24 TYR H A 53 PHE HBy 1.0 1.8 9.35 10 9 A 25 GLY H A 54 ASN HD2y 1.0 1.8 7.15 11 9 A 25 GLY H A 54 ASN HD2x 1.0 1.8 7.15 12 10 A 26 ASP H A 53 PHE HBx 1.0 1.8 7.70 13 10 A 53 PHE HBy A 26 ASP H 1.0 1.8 7.70 14 11 A 23 VAL HG21 A 28 LEU HD11 1.0 1.8 7.70 15 11 A 23 VAL HG11 A 28 LEU HD11 1.0 1.8 7.70 16 11 A 28 LEU HD21 A 23 VAL HG11 1.0 1.8 7.70 17 11 A 23 VAL HG21 A 28 LEU HD21 1.0 1.8 7.70 18 12 A 37 PHE H A 19 TYR HBx 1.0 1.8 8.25 19 12 A 37 PHE H A 19 TYR HBy 1.0 1.8 8.25 20 13 A 24 TYR HE% A 54 ASN HD2y 1.0 1.8 6.05 21 13 A 54 ASN HD2x A 24 TYR HE% 1.0 1.8 6.05 22 14 A 43 TYR HD% A 38 VAL HG11 1.0 1.8 7.15 23 14 A 38 VAL HG21 A 43 TYR HD% 1.0 1.8 7.15 24 15 A 44 TYR HE% A 38 VAL HG11 1.0 1.8 7.15 25 15 A 38 VAL HG21 A 44 TYR HE% 1.0 1.8 7.15 26 16 A 43 TYR HD% A 48 GLY H 1.0 1.8 7.70 27 17 A 98 MET H A 53 PHE HD% 1.0 1.8 6.05 28 18 A 98 MET H A 53 PHE HE% 1.0 1.8 6.05 29 19 A 48 GLY H A 53 PHE HD% 1.0 1.8 7.70 30 20 A 48 GLY H A 53 PHE HE% 1.0 1.8 7.70 31 21 A 84 PHE H A 38 VAL HG11 1.0 1.8 6.60 32 21 A 38 VAL HG21 A 84 PHE H 1.0 1.8 6.60 33 22 A 84 PHE HD% A 38 VAL H 1.0 1.8 7.15 34 23 A 38 VAL H A 84 PHE HE% 1.0 1.8 6.60 35 24 A 74 LEU H A 9 ASN HD2y 1.0 1.8 5.50 36 24 A 74 LEU H A 9 ASN HD2x 1.0 1.8 5.50 37 25 A 79 ARG H A 74 LEU HD11 1.0 1.8 8.25 38 25 A 79 ARG H A 74 LEU HD21 1.0 1.8 8.25 39 26 A 48 GLY H A 53 PHE HBx 1.0 1.8 6.60 40 26 A 53 PHE HBy A 48 GLY H 1.0 1.8 6.60 41 27 A 49 TYR H A 87 PHE HD% 1.0 1.8 7.70 42 28 A 49 TYR H A 87 PHE HE% 1.0 1.8 6.60 43 29 A 51 GLU H A 58 SER H 1.0 1.8 6.60 44 30 A 52 CYS H A 87 PHE HBx 1.0 1.8 8.80 45 30 A 52 CYS H A 87 PHE HBy 1.0 1.8 8.80 46 31 A 29 ALA H A 24 TYR HD% 1.0 1.8 10.45 47 32 A 30 TYR H A 87 PHE HBx 1.0 1.8 8.25 48 32 A 87 PHE HBy A 30 TYR H 1.0 1.8 8.25 49 33 A 31 LEU H A 87 PHE HBx 1.0 1.8 11.00 50 33 A 31 LEU H A 87 PHE HBy 1.0 1.8 11.00 51 34 A 31 LEU H A 87 PHE HD% 1.0 1.8 9.35 52 35 A 33 GLU H A 19 TYR HBx 1.0 1.8 7.70 53 35 A 19 TYR HBy A 33 GLU H 1.0 1.8 7.70 54 36 A 24 TYR H A 53 PHE HBx 1.0 1.8 9.35 55 36 A 24 TYR H A 53 PHE HBy 1.0 1.8 9.35 56 37 A 25 GLY H A 54 ASN HD2y 1.0 1.8 7.70 57 37 A 25 GLY H A 54 ASN HD2x 1.0 1.8 7.70 58 38 A 26 ASP H A 53 PHE HBx 1.0 1.8 7.70 59 38 A 53 PHE HBy A 26 ASP H 1.0 1.8 7.70 60 39 A 23 VAL H A 87 PHE HBx 1.0 1.8 8.25 61 39 A 87 PHE HBy A 23 VAL H 1.0 1.8 8.25 62 40 A 25 GLY H A 87 PHE HBx 1.0 1.8 8.80 63 40 A 25 GLY H A 87 PHE HBy 1.0 1.8 8.80 64 41 A 37 PHE H A 84 PHE HD% 1.0 1.8 7.70 65 42 A 37 PHE H A 84 PHE HE% 1.0 1.8 7.15 66 43 A 53 PHE HD% A 44 TYR H 1.0 1.8 8.25 67 44 A 53 PHE HE% A 44 TYR H 1.0 1.8 7.70 68 45 A 87 PHE HD% A 45 GLU H 1.0 1.8 8.80 69 46 A 87 PHE HE% A 45 GLU H 1.0 1.8 7.70 70 47 A 46 ASP H A 53 PHE HBx 1.0 1.8 7.70 71 47 A 53 PHE HBy A 46 ASP H 1.0 1.8 7.70 72 48 A 24 TYR H A 69 PHE HD% 1.0 1.8 8.25 73 49 A 24 TYR H A 69 PHE HE% 1.0 1.8 8.25 74 50 A 52 CYS H A 69 PHE HD% 1.0 1.8 10.45 75 51 A 52 CYS H A 69 PHE HE% 1.0 1.8 8.80 76 52 A 69 PHE HD% A 53 PHE H 1.0 1.8 12.10 77 53 A 69 PHE HE% A 53 PHE H 1.0 1.8 10.45 78 54 A 63 GLU H A 69 PHE HD% 1.0 1.8 6.60 79 55 A 63 GLU H A 69 PHE HE% 1.0 1.8 6.60 80 56 A 69 PHE HD% A 64 LEU H 1.0 1.8 6.60 81 57 A 69 PHE HE% A 64 LEU H 1.0 1.8 6.60 82 58 A 69 PHE HD% A 65 ILE H 1.0 1.8 7.15 83 59 A 69 PHE HD% A 66 THR H 1.0 1.8 7.15 84 60 A 69 PHE HD% A 67 GLY H 1.0 1.8 6.60 85 61 A 69 PHE HD% A 68 GLU H 1.0 1.8 6.60 86 62 A 69 PHE HE% A 65 ILE H 1.0 1.8 6.60 87 63 A 69 PHE HE% A 66 THR H 1.0 1.8 6.60 88 64 A 69 PHE HE% A 67 GLY H 1.0 1.8 6.60 89 65 A 69 PHE HE% A 68 GLU H 1.0 1.8 6.60 90 66 A 69 PHE HD% A 73 LEU H 1.0 1.8 8.80 91 67 A 74 LEU H A 69 PHE HD% 1.0 1.8 8.80 92 68 A 69 PHE HD% A 85 LYS H 1.0 1.8 7.70 93 69 A 69 PHE HD% A 88 CYS H 1.0 1.8 6.60 94 70 A 69 PHE HE% A 73 LEU H 1.0 1.8 10.45 95 71 A 74 LEU H A 69 PHE HE% 1.0 1.8 10.45 96 72 A 69 PHE HE% A 85 LYS H 1.0 1.8 8.25 97 73 A 69 PHE HE% A 88 CYS H 1.0 1.8 6.60 98 74 A 5 GLN H A 69 PHE H 1.0 1.8 7.70 99 75 A 69 PHE HD% A 5 GLN H 1.0 1.8 8.25 100 76 A 69 PHE HE% A 5 GLN H 1.0 1.8 10.45 101 77 A 69 PHE H A 5 GLN HE2y 1.0 1.8 6.05 102 77 A 69 PHE H A 5 GLN HE2x 1.0 1.8 6.05 103 78 A 15 ASP H A 10 TYR HD% 1.0 1.8 8.25 104 79 A 17 SER H A 11 GLN HE2y 1.0 1.8 7.70 105 79 A 17 SER H A 11 GLN HE2x 1.0 1.8 7.70 106 80 A 11 GLN HE2x A 38 VAL HG11 1.0 1.8 8.80 107 80 A 11 GLN HE2y A 38 VAL HG11 1.0 1.8 8.80 108 80 A 38 VAL HG21 A 11 GLN HE2y 1.0 1.8 8.80 109 80 A 38 VAL HG21 A 11 GLN HE2x 1.0 1.8 8.80 110 81 A 13 LEU H A 37 PHE HE% 1.0 1.8 7.70 111 82 A 57 GLU H A 23 VAL HG11 1.0 1.8 9.90 112 82 A 23 VAL HG21 A 57 GLU H 1.0 1.8 9.90 113 83 A 58 SER H A 23 VAL HG11 1.0 1.8 7.70 114 83 A 23 VAL HG21 A 58 SER H 1.0 1.8 7.70 115 84 A 89 TYR H A 86 GLU H 1.0 1.8 5.50 116 85 A 84 PHE HD% A 90 LYS H 1.0 1.8 9.90 117 86 A 84 PHE HE% A 90 LYS H 1.0 1.8 11.55 118 87 A 98 MET H A 49 TYR HD% 1.0 1.8 7.15 119 88 A 98 MET H A 49 TYR HE% 1.0 1.8 6.60 120 89 A 94 HIS H A 53 PHE HBx 1.0 1.8 9.90 121 89 A 53 PHE HBy A 94 HIS H 1.0 1.8 9.90 122 90 A 96 ILE H A 102 ALA H 1.0 1.8 6.60 123 91 A 96 ILE H A 102 ALA O 1.0 1.8 5.50 124 92 A 98 MET H A 101 GLU H 1.0 1.8 6.60 125 93 A 98 MET H A 101 GLU O 1.0 1.8 6.60 126 94 A 98 MET H A 44 TYR HBx 1.0 1.8 6.60 127 94 A 98 MET H A 44 TYR HBy 1.0 1.8 6.60 128 95 A 99 ILE H A 82 TRP HE1 1.0 1.8 5.50 129 96 A 53 PHE HD% A 99 ILE H 1.0 1.8 7.70 130 97 A 53 PHE HE% A 99 ILE H 1.0 1.8 7.70 131 98 A 82 TRP HE1 A 100 GLY H 1.0 1.8 6.38 132 99 A 6 ASN H A 19 TYR H 1.0 1.8 11.00 133 100 A 19 TYR H A 7 LEU H 1.0 1.8 8.80 134 101 A 8 LYS H A 19 TYR HD% 1.0 1.8 7.70 135 102 A 15 ASP H A 19 TYR HE% 1.0 1.8 7.70 136 103 A 15 ASP H A 19 TYR HD% 1.0 1.8 7.70 137 104 A 15 ASP H A 19 TYR HBx 1.0 1.8 8.80 138 104 A 19 TYR HBy A 15 ASP H 1.0 1.8 8.80 139 105 A 37 PHE H A 19 TYR HD% 1.0 1.8 7.15 140 106 A 37 PHE H A 43 TYR HD% 1.0 1.8 6.60 141 107 A 43 TYR HD% A 39 THR H 1.0 1.8 6.60 142 108 A 43 TYR HD% A 40 GLU H 1.0 1.8 6.60 143 109 A 43 TYR HD% A 41 ARG H 1.0 1.8 6.60 144 110 A 42 GLU H A 43 TYR HD% 1.0 1.8 6.60 145 111 A 43 TYR HD% A 44 TYR H 1.0 1.8 6.60 146 112 A 43 TYR HD% A 45 GLU H 1.0 1.8 6.60 147 113 A 43 TYR HD% A 46 ASP H 1.0 1.8 7.15 148 114 A 37 PHE H A 84 PHE HD% 1.0 1.8 8.80 149 115 A 37 PHE H A 84 PHE HE% 1.0 1.8 8.80 150 116 A 83 HIS H A 37 PHE HD% 1.0 1.8 8.80 151 117 A 37 PHE HE% A 83 HIS H 1.0 1.8 8.80 152 118 A 30 TYR H A 87 PHE HBx 1.0 1.8 9.90 153 118 A 87 PHE HBy A 30 TYR H 1.0 1.8 9.90 154 119 A 31 LEU H A 87 PHE HD% 1.0 1.8 9.90 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 6 ASN H A 2 SER O 1.0 1.8 2.2 2 2 A 2 SER O A 6 ASN N 1.0 1.8 3.3 3 3 A 7 LEU H A 3 TRP O 1.0 1.8 2.2 4 4 A 3 TRP O A 7 LEU N 1.0 1.8 3.3 5 5 A 8 LYS H A 4 MET O 1.0 1.8 2.2 6 6 A 4 MET O A 8 LYS N 1.0 1.8 3.3 7 7 A 5 GLN O A 9 ASN H 1.0 1.8 2.2 8 8 A 5 GLN O A 9 ASN N 1.0 1.8 3.3 9 9 A 16 PRO O A 20 MET H 1.0 1.8 2.2 10 10 A 16 PRO O A 20 MET N 1.0 1.8 3.3 11 11 A 21 SER H A 17 SER O 1.0 1.8 2.2 12 12 A 17 SER O A 21 SER N 1.0 1.8 3.3 13 13 A 22 GLN H A 18 GLU O 1.0 1.8 2.2 14 14 A 18 GLU O A 22 GLN N 1.0 1.8 3.3 15 15 A 23 VAL H A 19 TYR O 1.0 1.8 2.2 16 16 A 19 TYR O A 23 VAL N 1.0 1.8 3.3 17 17 A 31 LEU H A 27 PRO O 1.0 1.8 2.2 18 18 A 27 PRO O A 31 LEU N 1.0 1.8 3.3 19 19 A 28 LEU O A 32 GLN H 1.0 1.8 2.2 20 20 A 28 LEU O A 32 GLN N 1.0 1.8 3.3 21 21 A 33 GLU H A 29 ALA O 1.0 1.8 2.2 22 22 A 29 ALA O A 33 GLU N 1.0 1.8 3.3 23 23 A 30 TYR O A 34 THR H 1.0 1.8 2.2 24 24 A 30 TYR O A 34 THR N 1.0 1.8 3.3 25 25 A 31 LEU O A 35 THR H 1.0 1.8 2.2 26 26 A 31 LEU O A 35 THR N 1.0 1.8 3.3 27 27 A 32 GLN O A 36 LYS H 1.0 1.8 2.2 28 28 A 32 GLN O A 36 LYS N 1.0 1.8 3.3 29 29 A 44 TYR H A 40 GLU O 1.0 1.8 2.2 30 30 A 40 GLU O A 44 TYR N 1.0 1.8 3.3 31 31 A 45 GLU H A 41 ARG O 1.0 1.8 2.2 32 32 A 41 ARG O A 45 GLU N 1.0 1.8 3.3 33 33 A 77 ASP O A 81 ALA H 1.0 1.8 2.2 34 34 A 77 ASP O A 81 ALA N 1.0 1.8 3.3 35 35 A 78 LYS O A 82 TRP H 1.0 1.8 2.2 36 36 A 78 LYS O A 82 TRP N 1.0 1.8 3.3 37 37 A 83 HIS H A 79 ARG O 1.0 1.8 2.2 38 38 A 79 ARG O A 83 HIS N 1.0 1.8 3.3 39 39 A 84 PHE H A 80 LEU O 1.0 1.8 2.2 40 40 A 80 LEU O A 84 PHE N 1.0 1.8 3.3 41 41 A 85 LYS H A 81 ALA O 1.0 1.8 2.2 42 42 A 81 ALA O A 85 LYS N 1.0 1.8 3.3 43 43 A 86 GLU H A 82 TRP O 1.0 1.8 2.2 44 44 A 82 TRP O A 86 GLU N 1.0 1.8 3.3 45 45 A 83 HIS O A 87 PHE H 1.0 1.8 2.2 46 46 A 83 HIS O A 87 PHE N 1.0 1.8 3.3 47 47 A 88 CYS H A 84 PHE O 1.0 1.8 2.2 48 48 A 84 PHE O A 88 CYS N 1.0 1.8 3.3 49 49 A 89 TYR H A 85 LYS O 1.0 1.8 2.2 50 50 A 85 LYS O A 89 TYR N 1.0 1.8 3.3 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 55 SER C A 56 THR N A 56 THR CA A 56 THR C 1.0 -149.1 -69.1 PHI 2 2 A 56 THR N A 56 THR CA A 56 THR C A 57 GLU N 1.0 76.8 176.8 PSI 3 3 A 65 ILE C A 66 THR N A 66 THR CA A 66 THR C 1.0 -138.2 -58.2 PHI 4 4 A 66 THR N A 66 THR CA A 66 THR C A 67 GLY N 1.0 -55.1 44.9 PSI 5 5 A 69 PHE C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -133.3 -53.3 PHI 6 6 A 70 ASP N A 70 ASP CA A 70 ASP C A 71 PRO N 1.0 69.0 169.1 PSI 7 7 A 71 PRO C A 72 LYS N A 72 LYS CA A 72 LYS C 1.0 -105.1 -25.1 PHI 8 8 A 72 LYS N A 72 LYS CA A 72 LYS C A 73 LEU N 1.0 -78.8 21.2 PSI 9 9 A 72 LYS C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -127.8 -47.8 PHI 10 10 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 LEU N 1.0 -58.7 41.3 PSI 11 11 A 73 LEU C A 74 LEU N A 74 LEU CA A 74 LEU C 1.0 -133.6 -53.6 PHI 12 12 A 74 LEU N A 74 LEU CA A 74 LEU C A 75 PRO N 1.0 91.6 191.6 PSI 13 13 A 75 PRO N A 75 PRO CA A 75 PRO C A 76 TYR N 1.0 103.3 203.3 PSI 14 14 A 75 PRO C A 76 TYR N A 76 TYR CA A 76 TYR C 1.0 -150.8 -70.8 PHI 15 15 A 76 TYR N A 76 TYR CA A 76 TYR C A 77 ASP N 1.0 98.9 198.9 PSI 16 16 A 76 TYR C A 77 ASP N A 77 ASP CA A 77 ASP C 1.0 -118.4 -38.4 PHI 17 17 A 77 ASP N A 77 ASP CA A 77 ASP C A 78 LYS N 1.0 95.1 195.1 PSI 18 18 A 77 ASP C A 78 LYS N A 78 LYS CA A 78 LYS C 1.0 -101.2 -21.2 PHI 19 19 A 78 LYS N A 78 LYS CA A 78 LYS C A 79 ARG N 1.0 -89.4 10.6 PSI 20 20 A 78 LYS C A 79 ARG N A 79 ARG CA A 79 ARG C 1.0 -102.2 -22.2 PHI 21 21 A 79 ARG N A 79 ARG CA A 79 ARG C A 80 LEU N 1.0 -91.6 8.4 PSI 22 22 A 79 ARG C A 80 LEU N A 80 LEU CA A 80 LEU C 1.0 -102.3 -22.3 PHI 23 23 A 80 LEU N A 80 LEU CA A 80 LEU C A 81 ALA N 1.0 -91.6 8.4 PSI 24 24 A 80 LEU C A 81 ALA N A 81 ALA CA A 81 ALA C 1.0 -102.0 -22.0 PHI 25 25 A 81 ALA N A 81 ALA CA A 81 ALA C A 82 TRP N 1.0 -88.0 12.0 PSI 26 26 A 81 ALA C A 82 TRP N A 82 TRP CA A 82 TRP C 1.0 -104.7 -24.7 PHI 27 27 A 82 TRP N A 82 TRP CA A 82 TRP C A 83 HIS N 1.0 -90.9 9.1 PSI 28 28 A 82 TRP C A 83 HIS N A 83 HIS CA A 83 HIS C 1.0 -103.4 -23.4 PHI 29 29 A 83 HIS N A 83 HIS CA A 83 HIS C A 84 PHE N 1.0 -96.4 3.6 PSI 30 30 A 83 HIS C A 84 PHE N A 84 PHE CA A 84 PHE C 1.0 -98.9 -18.9 PHI 31 31 A 84 PHE N A 84 PHE CA A 84 PHE C A 85 LYS N 1.0 -95.3 4.7 PSI 32 32 A 84 PHE C A 85 LYS N A 85 LYS CA A 85 LYS C 1.0 -103.5 -23.5 PHI 33 33 A 85 LYS N A 85 LYS CA A 85 LYS C A 86 GLU N 1.0 -83.4 16.6 PSI 34 34 A 85 LYS C A 86 GLU N A 86 GLU CA A 86 GLU C 1.0 -101.4 -21.4 PHI 35 35 A 86 GLU N A 86 GLU CA A 86 GLU C A 87 PHE N 1.0 -88.5 11.5 PSI 36 36 A 86 GLU C A 87 PHE N A 87 PHE CA A 87 PHE C 1.0 -109.4 -29.4 PHI 37 37 A 87 PHE N A 87 PHE CA A 87 PHE C A 88 CYS N 1.0 -79.9 20.1 PSI 38 38 A 87 PHE C A 88 CYS N A 88 CYS CA A 88 CYS C 1.0 -105.1 -25.1 PHI 39 39 A 88 CYS N A 88 CYS CA A 88 CYS C A 89 TYR N 1.0 -77.7 22.3 PSI 40 40 A 88 CYS C A 89 TYR N A 89 TYR CA A 89 TYR C 1.0 -139.0 -59.0 PHI 41 41 A 89 TYR N A 89 TYR CA A 89 TYR C A 90 LYS N 1.0 -56.8 43.2 PSI 42 42 A 91 THR C A 92 SER N A 92 SER CA A 92 SER C 1.0 -128.0 -48.0 PHI 43 43 A 92 SER N A 92 SER CA A 92 SER C A 93 ALA N 1.0 97.1 197.1 PSI 44 44 A 100 GLY C A 101 GLU N A 101 GLU CA A 101 GLU C 1.0 -131.5 -51.5 PHI 45 45 A 101 GLU N A 101 GLU CA A 101 GLU C A 102 ALA N 1.0 82.3 182.3 PSI 46 46 A 101 GLU C A 102 ALA N A 102 ALA CA A 102 ALA C 1.0 -128.5 -48.5 PHI 47 47 A 102 ALA N A 102 ALA CA A 102 ALA C A 103 PRO N 1.0 91.2 191.2 PSI stop_ save_