data_nef_c19084_2mmh 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 2MMH PDB 2M7Y stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 14 CYS SG 1 23 CYS SG stop_ 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 GLY start . false 2 A 2 SER middle . . 3 A 3 THR middle . . 4 A 4 ALA middle . . 5 A 5 MET middle . . 6 A 6 ALA middle . . 7 A 7 THR middle . . 8 A 8 THR middle . . 9 A 9 MET middle . . 10 A 10 GLU middle . . 11 A 11 GLN middle . . 12 A 12 GLU middle . . 13 A 13 ILE middle . . 14 A 14 CYS middle -HG . 15 A 15 ALA middle . . 16 A 16 HIS middle . . 17 A 17 SER middle . . 18 A 18 MET middle . . 19 A 19 THR middle . . 20 A 20 PHE middle . . 21 A 21 GLU middle . . 22 A 22 GLU middle . . 23 A 23 CYS middle -HG . 24 A 24 PRO middle . false 25 A 25 LYS middle . . 26 A 26 CYS middle . . 27 A 27 SER middle . . 28 A 28 ALA middle . . 29 A 29 LEU middle . . 30 A 30 GLN middle . . 31 A 31 TYR middle . . 32 A 32 ARG middle . . 33 A 33 ASN middle . . 34 A 34 GLY middle . false 35 A 35 PHE middle . . 36 A 36 TYR middle . . 37 A 37 LEU middle . . 38 A 38 LEU middle . . 39 A 39 LYS middle . . 40 A 40 TYR middle . . 41 A 41 ASP middle . . 42 A 42 GLU middle . . 43 A 43 GLU middle . . 44 A 44 TRP middle . . 45 A 45 TYR middle . . 46 A 46 PRO middle . false 47 A 47 GLU middle . . 48 A 48 GLU middle . . 49 A 49 LEU middle . . 50 A 50 LEU middle . . 51 A 51 THR middle . . 52 A 52 ASP middle . . 53 A 53 GLY middle . false 54 A 54 GLU middle . . 55 A 55 ASP middle . . 56 A 56 ASP middle . . 57 A 57 VAL middle . . 58 A 58 PHE middle . . 59 A 59 ASP middle . . 60 A 60 PRO middle . false 61 A 61 ASP middle . . 62 A 62 LEU middle . . 63 A 63 ASP middle . . 64 A 64 MET middle . . 65 A 65 GLU middle . . 66 A 66 VAL middle . . 67 A 67 VAL middle . . 68 A 68 PHE middle . . 69 A 69 GLU middle . . 70 A 70 THR middle . . 71 A 71 GLN end . . 72 B 1 ZN . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_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 2 SER HA H 1 4.580 . A 2 SER HBx H 1 3.877 . A 2 SER HBy H 1 3.877 . A 2 SER C C 13 174.80 . A 2 SER CA C 13 58.29 . A 2 SER CB C 13 63.99 . A 3 THR H H 1 8.304 . A 3 THR HA H 1 4.241 . A 3 THR HB H 1 4.353 . A 3 THR C C 13 174.27 . A 3 THR CA C 13 61.794 . A 3 THR CB C 13 69.697 . A 3 THR CG2 C 13 21.66 . A 3 THR N N 15 116.20 . A 4 ALA H H 1 8.353 . A 4 ALA HA H 1 4.295 . A 4 ALA HB% H 1 1.361 . A 4 ALA C C 13 177.56 . A 4 ALA CA C 13 52.66 . A 4 ALA CB C 13 19.26 . A 4 ALA N N 15 126.44 . A 5 MET H H 1 8.271 . A 5 MET HA H 1 4.427 . A 5 MET HBy H 1 1.982 . A 5 MET C C 13 175.91 . A 5 MET CA C 13 55.36 . A 5 MET CB C 13 33.09 . A 5 MET CG C 13 32.00 . A 5 MET N N 15 119.63 . A 6 ALA H H 1 8.306 . A 6 ALA HA H 1 4.37 . A 6 ALA HB% H 1 1.395 . A 6 ALA C C 13 177.84 . A 6 ALA CA C 13 52.65 . A 6 ALA CB C 13 19.45 . A 6 ALA N N 15 125.18 . A 7 THR H H 1 8.163 . A 7 THR HA H 1 4.247 . A 7 THR HB H 1 4.387 . A 7 THR C C 13 174.78 . A 7 THR CA C 13 61.85 . A 7 THR CB C 13 69.86 . A 7 THR CG2 C 13 21.68 . A 7 THR N N 15 113.17 . A 8 THR H H 1 8.101 . A 8 THR HA H 1 4.43 . A 8 THR HB H 1 4.24 . A 8 THR CA C 13 61.79 . A 8 THR CB C 13 69.75 . A 8 THR CG2 C 13 21.65 . A 8 THR N N 15 115.69 . A 9 MET H H 1 8.380 . A 9 MET HA H 1 4.436 . A 9 MET HBx H 1 1.95 . A 9 MET HBy H 1 2.05 . A 9 MET C C 13 176.32 . A 9 MET CA C 13 55.88 . A 9 MET CB C 13 33.07 . A 9 MET CG C 13 32.01 . A 9 MET N N 15 122.30 . A 10 GLU H H 1 8.435 . A 10 GLU HA H 1 4.210 . A 10 GLU HBx H 1 1.937 . A 10 GLU HBy H 1 2.258 . A 10 GLU C C 13 176.34 . A 10 GLU CA C 13 57.22 . A 10 GLU CB C 13 30.08 . A 10 GLU CG C 13 36.40 . A 10 GLU N N 15 121.33 . A 11 GLN H H 1 8.215 . A 11 GLN HA H 1 4.373 . A 11 GLN HBx H 1 1.989 . A 11 GLN HBy H 1 2.139 . A 11 GLN HE2y H 1 7.58 . A 11 GLN HE2x H 1 6.88 . A 11 GLN HGy H 1 2.35 . A 11 GLN C C 13 175.61 . A 11 GLN CA C 13 55.73 . A 11 GLN CB C 13 29.8 . A 11 GLN CG C 13 34.10 . A 11 GLN N N 15 119.53 . A 11 GLN NE2 N 15 112.2 . A 12 GLU H H 1 8.415 . A 12 GLU HA H 1 4.373 . A 12 GLU HBx H 1 2.015 . A 12 GLU HBy H 1 2.114 . A 12 GLU C C 13 175.33 . A 12 GLU CA C 13 56.80 . A 12 GLU CB C 13 30.58 . A 12 GLU CG C 13 36.44 . A 12 GLU N N 15 122.08 . A 13 ILE H H 1 7.994 . A 13 ILE HA H 1 4.600 . A 13 ILE HB H 1 1.783 . A 13 ILE C C 13 175.997 . A 13 ILE CA C 13 58.65 . A 13 ILE CB C 13 38.96 . A 13 ILE CD1 C 13 11.32 . A 13 ILE CG1 C 13 26.31 . A 13 ILE CG2 C 13 17.27 . A 13 ILE N N 15 121.10 . A 14 CYS H H 1 9.095 . A 14 CYS HA H 1 4.541 . A 14 CYS HBx H 1 1.799 . A 14 CYS HBy H 1 3.467 . A 14 CYS C C 13 177.20 . A 14 CYS CA C 13 58.07 . A 14 CYS CB C 13 32.97 . A 14 CYS N N 15 126.597 . A 15 ALA H H 1 8.284 . A 15 ALA HA H 1 3.987 . A 15 ALA HB% H 1 0.96 . A 15 ALA C C 13 177.92 . A 15 ALA CA C 13 53.84 . A 15 ALA CB C 13 18.68 . A 15 ALA N N 15 121.82 . A 16 HIS H H 1 10.375 . A 16 HIS HA H 1 4.593 . A 16 HIS HBx H 1 2.854 . A 16 HIS HBy H 1 3.480 . A 16 HIS C C 13 174.64 . A 16 HIS CA C 13 56.35 . A 16 HIS CB C 13 29.84 . A 16 HIS N N 15 121.96 . A 17 SER H H 1 8.179 . A 17 SER HA H 1 3.803 . A 17 SER HBx H 1 4.106 . A 17 SER HBy H 1 4.106 . A 17 SER C C 13 172.99 . A 17 SER CA C 13 59.65 . A 17 SER CB C 13 60.90 . A 17 SER N N 15 112.04 . A 18 MET H H 1 7.568 . A 18 MET HA H 1 4.792 . A 18 MET HBx H 1 2.018 . A 18 MET HBy H 1 2.197 . A 18 MET C C 13 174.174 . A 18 MET CA C 13 53.79 . A 18 MET CB C 13 36.79 . A 18 MET CG C 13 32.52 . A 18 MET N N 15 119.20 . A 19 THR H H 1 8.450 . A 19 THR HA H 1 4.719 . A 19 THR HB H 1 4.517 . A 19 THR C C 13 176.40 . A 19 THR CA C 13 62.39 . A 19 THR CB C 13 69.77 . A 19 THR CG2 C 13 22.21 . A 19 THR N N 15 111.91 . A 20 PHE H H 1 8.452 . A 20 PHE HA H 1 3.806 . A 20 PHE HBx H 1 2.934 . A 20 PHE HBy H 1 2.934 . A 20 PHE C C 13 177.24 . A 20 PHE CA C 13 63.20 . A 20 PHE CB C 13 39.34 . A 20 PHE N N 15 122.27 . A 21 GLU H H 1 8.33 . A 21 GLU HA H 1 4.006 . A 21 GLU HBy H 1 2.007 . A 21 GLU C C 13 177.41 . A 21 GLU CA C 13 58.71 . A 21 GLU CB C 13 29.68 . A 21 GLU CG C 13 36.66 . A 21 GLU N N 15 112.43 . A 22 GLU H H 1 7.488 . A 22 GLU HA H 1 4.220 . A 22 GLU HBx H 1 2.012 . A 22 GLU HBy H 1 2.012 . A 22 GLU C C 13 176.00 . A 22 GLU CA C 13 56.10 . A 22 GLU CB C 13 31.32 . A 22 GLU CG C 13 36.84 . A 22 GLU N N 15 116.54 . A 23 CYS H H 1 7.763 . A 23 CYS CA C 13 57.12 . A 23 CYS CB C 13 31.44 . A 23 CYS N N 15 124.74 . A 24 PRO HA H 1 4.284 . A 24 PRO HBx H 1 1.943 . A 24 PRO HBy H 1 2.258 . A 24 PRO C C 13 176.83 . A 24 PRO CA C 13 63.42 . A 24 PRO CB C 13 32.24 . A 24 PRO CD C 13 50.79 . A 24 PRO CG C 13 26.84 . A 25 LYS H H 1 8.293 . A 25 LYS HA H 1 4.248 . A 25 LYS HBx H 1 1.411 . A 25 LYS HBy H 1 1.670 . A 25 LYS C C 13 178.89 . A 25 LYS CA C 13 58.31 . A 25 LYS CB C 13 33.77 . A 25 LYS CD C 13 25.11 . A 25 LYS CE C 13 41.5 . A 25 LYS CG C 13 28.79 . A 25 LYS N N 15 119.40 . A 26 CYS H H 1 9.239 . A 26 CYS HA H 1 4.200 . A 26 CYS HBx H 1 2.532 . A 26 CYS HBy H 1 3.112 . A 26 CYS C C 13 177.19 . A 26 CYS CA C 13 63.28 . A 26 CYS CB C 13 29.38 . A 26 CYS N N 15 122.52 . A 27 SER H H 1 8.059 . A 27 SER HA H 1 4.274 . A 27 SER HBx H 1 3.895 . A 27 SER HBy H 1 4.052 . A 27 SER C C 13 175.73 . A 27 SER CA C 13 60.36 . A 27 SER CB C 13 63.47 . A 27 SER N N 15 113.93 . A 28 ALA H H 1 7.426 . A 28 ALA HA H 1 4.308 . A 28 ALA HB% H 1 1.432 . A 28 ALA C C 13 178.40 . A 28 ALA CA C 13 52.94 . A 28 ALA CB C 13 19.07 . A 28 ALA N N 15 123.38 . A 29 LEU H H 1 7.734 . A 29 LEU HA H 1 4.218 . A 29 LEU HBx H 1 1.540 . A 29 LEU HBy H 1 1.794 . A 29 LEU C C 13 177.72 . A 29 LEU CA C 13 55.74 . A 29 LEU CB C 13 42.17 . A 29 LEU CDy C 13 25.17 . A 29 LEU CDx C 13 23.09 . A 29 LEU CG C 13 26.9 . A 29 LEU N N 15 119.06 . A 30 GLN H H 1 8.076 . A 30 GLN HA H 1 4.140 . A 30 GLN HBy H 1 1.914 . A 30 GLN HE2y H 1 7.35 . A 30 GLN HE2x H 1 6.78 . A 30 GLN HGy H 1 2.12 . A 30 GLN C C 13 175.83 . A 30 GLN CA C 13 56.50 . A 30 GLN CB C 13 29.28 . A 30 GLN CG C 13 33.65 . A 30 GLN N N 15 118.37 . A 30 GLN NE2 N 15 111.6 . A 31 TYR H H 1 7.915 . A 31 TYR HA H 1 4.543 . A 31 TYR HBx H 1 2.876 . A 31 TYR HBy H 1 2.992 . A 31 TYR C C 13 176.07 . A 31 TYR CA C 13 57.92 . A 31 TYR CB C 13 38.62 . A 31 TYR N N 15 119.69 . A 32 ARG H H 1 8.122 . A 32 ARG HA H 1 4.203 . A 32 ARG HBx H 1 1.658 . A 32 ARG HBy H 1 1.716 . A 32 ARG C C 13 175.92 . A 32 ARG CA C 13 56.35 . A 32 ARG CB C 13 30.91 . A 32 ARG CD C 13 43.35 . A 32 ARG CG C 13 26.9 . A 32 ARG N N 15 121.80 . A 33 ASN H H 1 8.371 . A 33 ASN HA H 1 4.573 . A 33 ASN HBx H 1 2.732 . A 33 ASN HBy H 1 2.840 . A 33 ASN HD2y H 1 7.57 . A 33 ASN HD2x H 1 6.90 . A 33 ASN C C 13 175.49 . A 33 ASN CA C 13 53.79 . A 33 ASN CB C 13 38.75 . A 33 ASN N N 15 119.04 . A 33 ASN ND2 N 15 112.1 . A 34 GLY H H 1 8.110 . A 34 GLY HAx H 1 3.739 . A 34 GLY HAy H 1 3.898 . A 34 GLY C C 13 173.89 . A 34 GLY CA C 13 45.54 . A 34 GLY N N 15 107.84 . A 35 PHE H H 1 7.919 . A 35 PHE HA H 1 4.508 . A 35 PHE HBx H 1 2.842 . A 35 PHE HBy H 1 3.035 . A 35 PHE C C 13 175.39 . A 35 PHE CA C 13 57.98 . A 35 PHE CB C 13 38.77 . A 35 PHE N N 15 119.89 . A 36 TYR H H 1 8.216 . A 36 TYR HA H 1 4.473 . A 36 TYR HBx H 1 2.838 . A 36 TYR HBy H 1 2.958 . A 36 TYR C C 13 175.16 . A 36 TYR CA C 13 57.97 . A 36 TYR CB C 13 38.88 . A 36 TYR N N 15 121.32 . A 37 LEU H H 1 7.925 . A 37 LEU HA H 1 4.244 . A 37 LEU HBy H 1 1.477 . A 37 LEU C C 13 176.50 . A 37 LEU CA C 13 54.97 . A 37 LEU CB C 13 42.61 . A 37 LEU CDy C 13 24.71 . A 37 LEU CDx C 13 23.86 . A 37 LEU CG C 13 26.6 . A 37 LEU N N 15 123.07 . A 38 LEU H H 1 7.961 . A 38 LEU HA H 1 4.236 . A 38 LEU HBx H 1 1.433 . A 38 LEU HBy H 1 1.506 . A 38 LEU C C 13 176.64 . A 38 LEU CA C 13 55.11 . A 38 LEU CB C 13 42.48 . A 38 LEU CDy C 13 24.84 . A 38 LEU CDx C 13 23.65 . A 38 LEU CG C 13 27.1 . A 38 LEU N N 15 122.64 . A 39 LYS H H 1 8.039 . A 39 LYS HA H 1 4.222 . A 39 LYS HBx H 1 1.564 . A 39 LYS HBy H 1 1.658 . A 39 LYS C C 13 175.95 . A 39 LYS CA C 13 55.82 . A 39 LYS CB C 13 33.38 . A 39 LYS CD C 13 24.39 . A 39 LYS CE C 13 42.0 . A 39 LYS CG C 13 28.94 . A 39 LYS N N 15 121.46 . A 40 TYR H H 1 8.165 . A 40 TYR CA C 13 57.86 . A 40 TYR CB C 13 38.89 . A 40 TYR N N 15 121.40 . A 41 ASP HA H 1 4.527 . A 41 ASP HBy H 1 2.612 . A 41 ASP C C 13 175.91 . A 41 ASP CA C 13 54.33 . A 41 ASP CB C 13 41.17 . A 42 GLU H H 1 8.176 . A 42 GLU HA H 1 4.165 . A 42 GLU HBy H 1 1.989 . A 42 GLU C C 13 176.56 . A 42 GLU CA C 13 56.70 . A 42 GLU CB C 13 30.42 . A 42 GLU CG C 13 36.34 . A 42 GLU N N 15 120.15 . A 43 GLU H H 1 8.422 . A 43 GLU HA H 1 4.216 . A 43 GLU HBy H 1 1.899 . A 43 GLU C C 13 175.45 . A 43 GLU CA C 13 56.58 . A 43 GLU CB C 13 30.41 . A 43 GLU CG C 13 36.19 . A 43 GLU N N 15 121.96 . A 44 TRP H H 1 7.993 . A 44 TRP HA H 1 4.547 . A 44 TRP HBy H 1 3.104 . A 44 TRP C C 13 174.74 . A 44 TRP CA C 13 57.15 . A 44 TRP CB C 13 30.21 . A 44 TRP N N 15 122.29 . A 45 TYR H H 1 7.752 . A 45 TYR CA C 13 55.10 . A 45 TYR CB C 13 38.87 . A 45 TYR N N 15 124.14 . A 46 PRO C C 13 176.79 . A 46 PRO CA C 13 62.88 . A 46 PRO CB C 13 31.94 . A 46 PRO CD C 13 50.28 . A 46 PRO CG C 13 27.02 . A 47 GLU H H 1 8.375 . A 47 GLU CA C 13 56.76 . A 47 GLU CB C 13 30.42 . A 47 GLU N N 15 121.13 . A 49 LEU HA H 1 4.363 . A 49 LEU HBy H 1 1.582 . A 49 LEU C C 13 176.94 . A 49 LEU CA C 13 54.91 . A 49 LEU CB C 13 42.39 . A 49 LEU CDy C 13 24.74 . A 49 LEU CDx C 13 23.54 . A 49 LEU CG C 13 27.02 . A 50 LEU H H 1 8.280 . A 50 LEU HA H 1 4.457 . A 50 LEU HBx H 1 1.583 . A 50 LEU HBy H 1 1.664 . A 50 LEU C C 13 177.38 . A 50 LEU CA C 13 54.92 . A 50 LEU CB C 13 42.26 . A 50 LEU CDy C 13 24.95 . A 50 LEU CDx C 13 23.34 . A 50 LEU CG C 13 26.91 . A 50 LEU N N 15 124.02 . A 51 THR H H 1 8.135 . A 51 THR HA H 1 4.238 . A 51 THR HB H 1 4.38 . A 51 THR C C 13 174.16 . A 51 THR CA C 13 61.22 . A 51 THR CB C 13 69.96 . A 51 THR CG2 C 13 21.48 . A 51 THR N N 15 114.73 . A 52 ASP H H 1 8.363 . A 52 ASP HA H 1 4.635 . A 52 ASP HBy H 1 2.669 . A 52 ASP C C 13 176.58 . A 52 ASP CA C 13 54.43 . A 52 ASP CB C 13 41.38 . A 52 ASP N N 15 122.76 . A 53 GLY H H 1 8.357 . A 53 GLY HAy H 1 3.956 . A 53 GLY C C 13 174.22 . A 53 GLY CA C 13 45.38 . A 53 GLY N N 15 109.46 . A 54 GLU H H 1 8.302 . A 54 GLU HA H 1 4.24 . A 54 GLU HBx H 1 1.901 . A 54 GLU HBy H 1 1.985 . A 54 GLU C C 13 175.98 . A 54 GLU CA C 13 56.40 . A 54 GLU CB C 13 30.45 . A 54 GLU CG C 13 36.16 . A 54 GLU N N 15 120.40 . A 55 ASP H H 1 8.220 . A 55 ASP HA H 1 4.591 . A 55 ASP HBx H 1 2.561 . A 55 ASP HBy H 1 2.677 . A 55 ASP C C 13 175.86 . A 55 ASP CA C 13 54.36 . A 55 ASP CB C 13 41.27 . A 55 ASP N N 15 123.65 . A 56 ASP H H 1 8.265 . A 56 ASP HA H 1 4.565 . A 56 ASP HBy H 1 2.576 . A 56 ASP C C 13 175.80 . A 56 ASP CA C 13 54.37 . A 56 ASP CB C 13 41.11 . A 56 ASP N N 15 120.99 . A 57 VAL H H 1 7.990 . A 57 VAL HA H 1 4.052 . A 57 VAL C C 13 175.57 . A 57 VAL CA C 13 62.01 . A 57 VAL CB C 13 32.96 . A 57 VAL CGx C 13 20.87 . A 57 VAL N N 15 120.26 . A 58 PHE H H 1 8.309 . A 58 PHE HA H 1 4.617 . A 58 PHE HBy H 1 3.012 . A 58 PHE C C 13 174.54 . A 58 PHE CA C 13 57.28 . A 58 PHE CB C 13 39.98 . A 58 PHE N N 15 125.15 . A 59 ASP H H 1 8.303 . A 59 ASP CA C 13 51.42 . A 59 ASP CB C 13 41.50 . A 59 ASP N N 15 125.19 . A 61 ASP HA H 1 4.572 . A 61 ASP HBx H 1 2.568 . A 61 ASP HBy H 1 2.717 . A 61 ASP C C 13 176.35 . A 61 ASP CA C 13 54.57 . A 61 ASP CB C 13 40.84 . A 62 LEU H H 1 7.743 . A 62 LEU HA H 1 4.243 . A 62 LEU HBy H 1 1.583 . A 62 LEU C C 13 177.09 . A 62 LEU CA C 13 55.36 . A 62 LEU CB C 13 42.54 . A 62 LEU CDy C 13 24.86 . A 62 LEU CDx C 13 23.48 . A 62 LEU CG C 13 26.68 . A 62 LEU N N 15 121.95 . A 63 ASP H H 1 8.256 . A 63 ASP HA H 1 4.586 . A 63 ASP HBx H 1 2.560 . A 63 ASP HBy H 1 2.729 . A 63 ASP C C 13 176.08 . A 63 ASP CA C 13 54.41 . A 63 ASP CB C 13 41.00 . A 63 ASP N N 15 121.21 . A 64 MET H H 1 8.132 . A 64 MET CA C 13 55.40 . A 64 MET CB C 13 33.16 . A 64 MET CG C 13 31.93 . A 64 MET N N 15 120.75 . A 65 GLU HA H 1 4.241 . A 65 GLU HBy H 1 1.958 . A 65 GLU C C 13 176.21 . A 65 GLU CA C 13 56.65 . A 65 GLU CB C 13 30.22 . A 66 VAL H H 1 8.100 . A 66 VAL HA H 1 4.003 . A 66 VAL HB H 1 1.932 . A 66 VAL C C 13 175.66 . A 66 VAL CA C 13 62.37 . A 66 VAL CB C 13 32.74 . A 66 VAL CGx C 13 21.05 . A 66 VAL N N 15 122.44 . A 67 VAL H H 1 8.124 . A 67 VAL HA H 1 4.054 . A 67 VAL HB H 1 1.944 . A 67 VAL C C 13 175.64 . A 67 VAL CA C 13 61.90 . A 67 VAL CB C 13 33.02 . A 67 VAL CGx C 13 20.91 . A 67 VAL N N 15 124.85 . A 68 PHE H H 1 8.369 . A 68 PHE HA H 1 4.649 . A 68 PHE HBx H 1 2.953 . A 68 PHE HBy H 1 3.113 . A 68 PHE C C 13 175.50 . A 68 PHE CA C 13 57.46 . A 68 PHE CB C 13 39.96 . A 68 PHE N N 15 125.00 . A 69 GLU H H 1 8.402 . A 69 GLU HA H 1 4.341 . A 69 GLU HBx H 1 1.902 . A 69 GLU HBy H 1 2.018 . A 69 GLU C C 13 176.18 . A 69 GLU CA C 13 56.41 . A 69 GLU CB C 13 30.64 . A 69 GLU CG C 13 36.19 . A 69 GLU N N 15 122.96 . A 70 THR H H 1 8.220 . A 70 THR HA H 1 4.309 . A 70 THR HB H 1 4.205 . A 70 THR C C 13 173.70 . A 70 THR CA C 13 61.79 . A 70 THR CB C 13 69.88 . A 70 THR CG2 C 13 21.56 . A 70 THR N N 15 116.00 . A 71 GLN H H 1 8.054 . A 71 GLN HA H 1 4.17 . A 71 GLN HBx H 1 1.91 . A 71 GLN HBy H 1 2.11 . A 71 GLN HE2y H 1 7.51 . A 71 GLN HE2x H 1 6.78 . A 71 GLN HGy H 1 2.29 . A 71 GLN CA C 13 57.41 . A 71 GLN CB C 13 30.51 . A 71 GLN CG C 13 34.3 . A 71 GLN N N 15 127.75 . A 71 GLN NE2 N 15 112.1 . stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 12 GLU C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -143.3 -21.3 PHI 2 2 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 CYS N 1.0 102.3 177.9 PSI 3 3 A 13 ILE C A 14 CYS N A 14 CYS CA A 14 CYS C 1.0 -127.0 -51.5 PHI 4 4 A 14 CYS N A 14 CYS CA A 14 CYS C A 15 ALA N 1.0 -59.8 -16.0 PSI 5 5 A 15 ALA C A 16 HIS N A 16 HIS CA A 16 HIS C 1.0 -131.4 -22.5 PHI 6 6 A 16 HIS N A 16 HIS CA A 16 HIS C A 17 SER N 1.0 -74.3 50.2 PSI 7 7 A 16 HIS C A 17 SER N A 17 SER CA A 17 SER C 1.0 39.0 79.0 PHI 8 8 A 17 SER N A 17 SER CA A 17 SER C A 18 MET N 1.0 -6.8 85.1 PSI 9 9 A 18 MET C A 19 THR N A 19 THR CA A 19 THR C 1.0 -134.9 -40.5 PHI 10 10 A 19 THR N A 19 THR CA A 19 THR C A 20 PHE N 1.0 114.4 185.4 PSI 11 11 A 19 THR C A 20 PHE N A 20 PHE CA A 20 PHE C 1.0 -82.0 -42.0 PHI 12 12 A 20 PHE N A 20 PHE CA A 20 PHE C A 21 GLU N 1.0 -57.7 -15.7 PSI 13 13 A 20 PHE C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -91.6 -46.1 PHI 14 14 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 GLU N 1.0 -61.9 14.3 PSI 15 15 A 21 GLU C A 22 GLU N A 22 GLU CA A 22 GLU C 1.0 -141.2 -55.1 PHI 16 16 A 22 GLU N A 22 GLU CA A 22 GLU C A 23 CYS N 1.0 -51.9 30.8 PSI 17 17 A 24 PRO N A 24 PRO CA A 24 PRO C A 25 LYS N 1.0 -46.8 2.5 PSI 18 18 A 25 LYS C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -75.3 -35.3 PHI 19 19 A 26 CYS N A 26 CYS CA A 26 CYS C A 27 SER N 1.0 -60.6 -20.6 PSI 20 20 A 26 CYS C A 27 SER N A 27 SER CA A 27 SER C 1.0 -86.7 -46.7 PHI 21 21 A 27 SER N A 27 SER CA A 27 SER C A 28 ALA N 1.0 -64.7 -6.0 PSI 22 22 A 27 SER C A 28 ALA N A 28 ALA CA A 28 ALA C 1.0 -89.7 -49.7 PHI 23 23 A 28 ALA N A 28 ALA CA A 28 ALA C A 29 LEU N 1.0 -51.6 -10.8 PSI 24 24 A 28 ALA C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -88.1 -48.1 PHI 25 25 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 GLN N 1.0 -61.9 -18.6 PSI 26 26 A 29 LEU C A 30 GLN N A 30 GLN CA A 30 GLN C 1.0 -81.7 -41.7 PHI 27 27 A 30 GLN N A 30 GLN CA A 30 GLN C A 31 TYR N 1.0 -59.5 -14.0 PSI 28 28 A 39 LYS C A 40 TYR N A 40 TYR CA A 40 TYR C 1.0 -110.3 -22.0 PHI 29 29 A 40 TYR N A 40 TYR CA A 40 TYR C A 41 ASP N 1.0 -70.3 8.0 PSI 30 30 A 40 TYR C A 41 ASP N A 41 ASP CA A 41 ASP C 1.0 -130.4 -72.9 PHI 31 31 A 41 ASP N A 41 ASP CA A 41 ASP C A 42 GLU N 1.0 -23.6 21.3 PSI 32 32 A 41 ASP C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -145.9 -25.4 PHI 33 33 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 GLU N 1.0 115.8 179.1 PSI 34 34 A 44 TRP C A 45 TYR N A 45 TYR CA A 45 TYR C 1.0 -109.6 -25.8 PHI 35 35 A 45 TYR N A 45 TYR CA A 45 TYR C A 46 PRO N 1.0 -61.5 4.9 PSI 36 36 A 46 PRO N A 46 PRO CA A 46 PRO C A 47 GLU N 1.0 -48.0 23.7 PSI 37 37 A 46 PRO C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -115.0 -27.7 PHI 38 38 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 GLU N 1.0 -86.0 38.8 PSI 39 39 A 47 GLU C A 48 GLU N A 48 GLU CA A 48 GLU C 1.0 -91.2 -48.7 PHI 40 40 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 LEU N 1.0 -60.8 7.6 PSI 41 41 A 48 GLU C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -131.4 -78.5 PHI 42 42 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 LEU N 1.0 -22.3 25.4 PSI 43 43 A 50 LEU C A 51 THR N A 51 THR CA A 51 THR C 1.0 -111.6 -27.4 PHI 44 44 A 51 THR N A 51 THR CA A 51 THR C A 52 ASP N 1.0 -66.0 20.2 PSI 45 45 A 54 GLU C A 55 ASP N A 55 ASP CA A 55 ASP C 1.0 -124.8 -26.5 PHI 46 46 A 55 ASP N A 55 ASP CA A 55 ASP C A 56 ASP N 1.0 -64.9 32.0 PSI 47 47 A 55 ASP C A 56 ASP N A 56 ASP CA A 56 ASP C 1.0 -121.4 -71.3 PHI 48 48 A 56 ASP N A 56 ASP CA A 56 ASP C A 57 VAL N 1.0 -34.0 29.2 PSI 49 49 A 57 VAL C A 58 PHE N A 58 PHE CA A 58 PHE C 1.0 -113.2 -68.4 PHI 50 50 A 58 PHE N A 58 PHE CA A 58 PHE C A 59 ASP N 1.0 73.4 158.1 PSI 51 51 A 58 PHE C A 59 ASP N A 59 ASP CA A 59 ASP C 1.0 -80.4 -35.2 PHI 52 52 A 59 ASP N A 59 ASP CA A 59 ASP C A 60 PRO N 1.0 -54.5 -14.5 PSI 53 53 A 60 PRO N A 60 PRO CA A 60 PRO C A 61 ASP N 1.0 -44.5 -2.1 PSI 54 54 A 62 LEU C A 63 ASP N A 63 ASP CA A 63 ASP C 1.0 -84.6 -44.6 PHI 55 55 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 MET N 1.0 -63.1 -7.3 PSI 56 56 A 63 ASP C A 64 MET N A 64 MET CA A 64 MET C 1.0 -94.1 -42.6 PHI 57 57 A 64 MET N A 64 MET CA A 64 MET C A 65 GLU N 1.0 -81.6 3.3 PSI 58 58 A 64 MET C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -121.6 -74.4 PHI 59 59 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 VAL N 1.0 -24.3 22.4 PSI stop_ save_