data_nef_c18220_2lop 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 BMRB 18222 BMRB 18221 BMRB 18223 BMRB 18219 BMRB 18218 BMRB 18217 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 -8 MET start . . 2 A -7 THR middle . . 3 A -6 SER middle . . 4 A -5 LEU middle . . 5 A -4 TYR middle . . 6 A -3 LYS middle . . 7 A -2 LYS middle . . 8 A -1 VAL middle . . 9 A 0 GLY middle . false 10 A 1 MET middle . . 11 A 2 ASP middle . . 12 A 3 LEU middle . . 13 A 4 ILE middle . . 14 A 5 GLY middle . false 15 A 6 PHE middle . . 16 A 7 GLY middle . false 17 A 8 TYR middle . . 18 A 9 ALA middle . . 19 A 10 ALA middle . . 20 A 11 LEU middle . . 21 A 12 VAL middle . . 22 A 13 THR middle . . 23 A 14 PHE middle . . 24 A 15 GLY middle . false 25 A 16 SER middle . . 26 A 17 ILE middle . . 27 A 18 PHE middle . . 28 A 19 GLY middle . false 29 A 20 TYR middle . . 30 A 21 LYS middle . . 31 A 22 ARG middle . . 32 A 23 ARG middle . . 33 A 24 GLY middle . false 34 A 25 GLY middle . false 35 A 26 VAL middle . . 36 A 27 PRO middle . false 37 A 28 SER middle . . 38 A 29 LEU middle . . 39 A 30 ILE middle . . 40 A 31 ALA middle . . 41 A 32 GLY middle . false 42 A 33 LEU middle . . 43 A 34 PHE middle . . 44 A 35 VAL middle . . 45 A 36 GLY middle . false 46 A 37 CYS middle . . 47 A 38 LEU middle . . 48 A 39 ALA middle . . 49 A 40 GLY middle . false 50 A 41 TYR middle . . 51 A 42 GLY middle . false 52 A 43 ALA middle . . 53 A 44 TYR middle . . 54 A 45 ARG middle . . 55 A 46 VAL middle . . 56 A 47 SER middle . . 57 A 48 ASN middle . . 58 A 49 ASP middle . . 59 A 50 LYS middle . . 60 A 51 ARG middle . . 61 A 52 ASP middle . . 62 A 53 VAL middle . . 63 A 54 LYS middle . . 64 A 55 VAL middle . . 65 A 56 SER middle . . 66 A 57 LEU middle . . 67 A 58 PHE middle . . 68 A 59 THR middle . . 69 A 60 ALA middle . . 70 A 61 PHE middle . . 71 A 62 PHE middle . . 72 A 63 LEU middle . . 73 A 64 ALA middle . . 74 A 65 THR middle . . 75 A 66 ILE middle . . 76 A 67 MET middle . . 77 A 68 GLY middle . false 78 A 69 VAL middle . . 79 A 70 ARG middle . . 80 A 71 PHE middle . . 81 A 72 LYS middle . . 82 A 73 ARG middle . . 83 A 74 SER middle . . 84 A 75 LYS middle . . 85 A 76 LYS middle . . 86 A 77 ILE middle . . 87 A 78 MET middle . . 88 A 79 PRO middle . false 89 A 80 ALA middle . . 90 A 81 GLY middle . false 91 A 82 LEU middle . . 92 A 83 VAL middle . . 93 A 84 ALA middle . . 94 A 85 GLY middle . false 95 A 86 LEU middle . . 96 A 87 SER middle . . 97 A 88 LEU middle . . 98 A 89 MET middle . . 99 A 90 MET middle . . 100 A 91 ILE middle . . 101 A 92 LEU middle . . 102 A 93 ARG middle . . 103 A 94 LEU middle . . 104 A 95 VAL middle . . 105 A 96 LEU middle . . 106 A 97 LEU middle . . 107 A 98 LEU middle . . 108 A 99 LEU end . . 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 1 MET H H 1 8.261 0.01 A 1 MET CA C 13 57.243 0.1 A 1 MET CB C 13 31.802 0.1 A 1 MET N N 15 118.991 0.1 A 2 ASP H H 1 7.863 0.01 A 2 ASP CA C 13 55.918 0.1 A 2 ASP CB C 13 37.959 0.1 A 2 ASP N N 15 120.536 0.1 A 3 LEU H H 1 8.285 0.01 A 3 LEU C C 13 176.162 0.1 A 3 LEU CA C 13 57.6 0.1 A 3 LEU CB C 13 41.657 0.1 A 3 LEU N N 15 121.414 0.1 A 4 ILE H H 1 8.031 0.01 A 4 ILE HA H 1 3.74 0.01 A 4 ILE C C 13 175.228 0.1 A 4 ILE CA C 13 64.5 0.1 A 4 ILE CB C 13 37.102 0.1 A 4 ILE CD1 C 13 12.667 0.1 A 4 ILE CG1 C 13 28.762 0.1 A 4 ILE CG2 C 13 17.265 0.1 A 4 ILE N N 15 118.854 0.1 A 5 GLY H H 1 8.148 0.01 A 5 GLY HAx H 1 2.98 0.01 A 5 GLY HAy H 1 3.92 0.01 A 5 GLY C C 13 174.424 0.1 A 5 GLY CA C 13 47.059 0.1 A 5 GLY N N 15 107.478 0.1 A 6 PHE H H 1 8.194 0.01 A 6 PHE HA H 1 4.48 0.01 A 6 PHE HBx H 1 3.23 0.01 A 6 PHE HBy H 1 3.23 0.01 A 6 PHE C C 13 175.113 0.1 A 6 PHE CA C 13 60.017 0.1 A 6 PHE CB C 13 38.774 0.1 A 6 PHE N N 15 122.774 0.1 A 7 GLY H H 1 8.697 0.01 A 7 GLY HAx H 1 3.65 0.01 A 7 GLY HAy H 1 3.71 0.01 A 7 GLY C C 13 171.838 0.1 A 7 GLY CA C 13 47.1 0.1 A 7 GLY N N 15 107.938 0.1 A 8 TYR H H 1 8.71 0.01 A 8 TYR HA H 1 4.15 0.01 A 8 TYR HBx H 1 3.119 0.01 A 8 TYR HBy H 1 3.119 0.01 A 8 TYR C C 13 174.18 0.1 A 8 TYR CA C 13 61.3 0.1 A 8 TYR CB C 13 37.959 0.1 A 8 TYR N N 15 121.785 0.1 A 9 ALA H H 1 7.843 0.01 A 9 ALA HA H 1 3.95 0.01 A 9 ALA HB% H 1 1.487 0.01 A 9 ALA C C 13 178.059 0.1 A 9 ALA CA C 13 54.872 0.1 A 9 ALA CB C 13 17.562 0.1 A 9 ALA N N 15 120.233 0.1 A 10 ALA H H 1 8.212 0.01 A 10 ALA HA H 1 3.95 0.01 A 10 ALA HB% H 1 1.385 0.01 A 10 ALA C C 13 176.191 0.1 A 10 ALA CA C 13 54.6 0.1 A 10 ALA CB C 13 17.562 0.1 A 10 ALA N N 15 121.797 0.1 A 11 LEU H H 1 8.065 0.01 A 11 LEU HA H 1 3.937 0.01 A 11 LEU HBx H 1 1.809 0.01 A 11 LEU HBy H 1 1.809 0.01 A 11 LEU C C 13 176.694 0.1 A 11 LEU CA C 13 57.8 0.1 A 11 LEU CB C 13 41.222 0.1 A 11 LEU CDy C 13 24.534 0.1 A 11 LEU CDx C 13 24.237 0.1 A 11 LEU CG C 13 26.685 0.1 A 11 LEU N N 15 119.442 0.1 A 12 VAL H H 1 8.051 0.01 A 12 VAL HA H 1 3.64 0.01 A 12 VAL HB H 1 1.969 0.01 A 12 VAL HGx% H 1 0.709 0.01 A 12 VAL HGy% H 1 0.709 0.01 A 12 VAL C C 13 176.536 0.1 A 12 VAL CA C 13 65.4 0.1 A 12 VAL CB C 13 31.135 0.1 A 12 VAL CGx C 13 21.27 0.1 A 12 VAL CGy C 13 21.27 0.1 A 12 VAL N N 15 118.323 0.1 A 13 THR H H 1 7.944 0.01 A 13 THR HA H 1 4.66 0.01 A 13 THR HG2% H 1 0.845 0.01 A 13 THR C C 13 173.734 0.1 A 13 THR CA C 13 66.3 0.1 A 13 THR CB C 13 67.775 0.1 A 13 THR CG2 C 13 21.345 0.1 A 13 THR N N 15 118.298 0.1 A 14 PHE H H 1 8.567 0.01 A 14 PHE HA H 1 4.34 0.01 A 14 PHE HBx H 1 3.082 0.01 A 14 PHE C C 13 174.783 0.1 A 14 PHE CA C 13 60.5 0.1 A 14 PHE CB C 13 38.626 0.1 A 14 PHE N N 15 121.328 0.1 A 15 GLY H H 1 8.475 0.01 A 15 GLY HAx H 1 3.62 0.01 A 15 GLY HAy H 1 3.72 0.01 A 15 GLY C C 13 172.858 0.1 A 15 GLY CA C 13 46.9 0.1 A 15 GLY N N 15 106.871 0.1 A 16 SER H H 1 7.963 0.01 A 16 SER HA H 1 4.28 0.01 A 16 SER HBx H 1 3.96 0.01 A 16 SER HBy H 1 3.96 0.01 A 16 SER CA C 13 60.3 0.1 A 16 SER CB C 13 62.879 0.1 A 16 SER N N 15 116.214 0.1 A 17 ILE H H 1 7.676 0.01 A 17 ILE HA H 1 3.946 0.01 A 17 ILE HB H 1 1.623 0.01 A 17 ILE C C 13 173.935 0.1 A 17 ILE CA C 13 63.1 0.1 A 17 ILE CB C 13 38.107 0.1 A 17 ILE CD1 C 13 13.301 0.1 A 17 ILE CG1 C 13 27.222 0.1 A 17 ILE CG2 C 13 16.445 0.1 A 17 ILE N N 15 121.024 0.1 A 18 PHE H H 1 7.703 0.01 A 18 PHE HA H 1 4.43 0.01 A 18 PHE HBx H 1 2.662 0.01 A 18 PHE HBy H 1 2.662 0.01 A 18 PHE HDx H 1 7.124 0.01 A 18 PHE HDy H 1 7.124 0.01 A 18 PHE C C 13 173.504 0.1 A 18 PHE CA C 13 58.5 0.1 A 18 PHE CB C 13 38.774 0.1 A 18 PHE N N 15 117.142 0.1 A 19 GLY H H 1 7.722 0.01 A 19 GLY HAx H 1 3.87 0.01 A 19 GLY HAy H 1 3.94 0.01 A 19 GLY C C 13 171.593 0.1 A 19 GLY CA C 13 45.6 0.1 A 19 GLY N N 15 107.303 0.1 A 20 TYR H H 1 7.88 0.01 A 20 TYR HA H 1 4.392 0.01 A 20 TYR HBx H 1 2.946 0.01 A 20 TYR HBy H 1 2.946 0.01 A 20 TYR HDx H 1 7.038 0.01 A 20 TYR HDy H 1 7.038 0.01 A 20 TYR C C 13 173.174 0.1 A 20 TYR CA C 13 58.5 0.1 A 20 TYR CB C 13 38.404 0.1 A 20 TYR N N 15 119.862 0.1 A 21 LYS H H 1 7.934 0.01 A 21 LYS HA H 1 4.39 0.01 A 21 LYS HBx H 1 1.623 0.01 A 21 LYS HBy H 1 1.623 0.01 A 21 LYS C C 13 173.547 0.1 A 21 LYS CA C 13 55.8 0.1 A 21 LYS CB C 13 32.396 0.1 A 21 LYS CG C 13 24.386 0.1 A 21 LYS N N 15 122.335 0.1 A 22 ARG H H 1 7.905 0.01 A 22 ARG C C 13 173.547 0.1 A 22 ARG CA C 13 55.834 0.1 A 22 ARG CB C 13 30.101 0.1 A 22 ARG CD C 13 42.953 0.1 A 22 ARG CG C 13 26.645 0.1 A 22 ARG N N 15 120.612 0.1 A 23 ARG H H 1 8.175 0.01 A 23 ARG HA H 1 4.31 0.01 A 23 ARG C C 13 173.863 0.1 A 23 ARG CA C 13 55.8 0.1 A 23 ARG CB C 13 30.245 0.1 A 23 ARG CD C 13 42.953 0.1 A 23 ARG CG C 13 26.759 0.1 A 23 ARG N N 15 121.748 0.1 A 24 GLY H H 1 8.264 0.01 A 24 GLY HAx H 1 3.92 0.01 A 24 GLY HAy H 1 4.02 0.01 A 24 GLY C C 13 171.752 0.1 A 24 GLY CA C 13 44.9 0.1 A 24 GLY N N 15 109.528 0.1 A 25 GLY H H 1 8.208 0.01 A 25 GLY HAx H 1 3.9 0.01 A 25 GLY HAy H 1 4.09 0.01 A 25 GLY C C 13 171.701 0.1 A 25 GLY CA C 13 44.6 0.1 A 25 GLY N N 15 108.563 0.1 A 26 VAL H H 1 8.485 0.01 A 26 VAL HA H 1 4.01 0.01 A 26 VAL HB H 1 2.156 0.01 A 26 VAL HGx% H 1 0.975 0.01 A 26 VAL HGy% H 1 0.975 0.01 A 26 VAL C C 13 175.888 0.1 A 26 VAL CA C 13 63.9 0.1 A 26 VAL CB C 13 30.69 0.1 A 26 VAL CGx C 13 21.79 0.1 A 26 VAL CGy C 13 22.457 0.1 A 26 VAL N N 15 121.164 0.1 A 27 PRO C C 13 177.66 0.1 A 27 PRO CA C 13 61.847 0.1 A 27 PRO CD C 13 49.757 0.1 A 28 SER H H 1 7.948 0.01 A 28 SER HA H 1 4.28 0.01 A 28 SER CA C 13 61.1 0.1 A 28 SER N N 15 116.023 0.1 A 29 LEU H H 1 8.201 0.01 A 29 LEU HA H 1 4.17 0.01 A 29 LEU C C 13 176.132 0.1 A 29 LEU CA C 13 57.5 0.1 A 29 LEU CB C 13 42.038 0.1 A 29 LEU CG C 13 26.907 0.1 A 29 LEU N N 15 124.029 0.1 A 30 ILE H H 1 7.662 0.01 A 30 ILE HA H 1 4.37 0.01 A 30 ILE C C 13 176.478 0.1 A 30 ILE CA C 13 63.079 0.1 A 30 ILE CB C 13 36.973 0.1 A 30 ILE CD1 C 13 13.109 0.1 A 30 ILE CG1 C 13 28.056 0.1 A 30 ILE N N 15 117.098 0.1 A 31 ALA H H 1 8.096 0.01 A 31 ALA HA H 1 4.034 0.01 A 31 ALA HB% H 1 1.45 0.01 A 31 ALA C C 13 177.067 0.1 A 31 ALA CA C 13 55.962 0.1 A 31 ALA CB C 13 17.856 0.1 A 31 ALA N N 15 122.447 0.1 A 32 GLY H H 1 8.123 0.01 A 32 GLY HAx H 1 3.87 0.01 A 32 GLY HAy H 1 3.95 0.01 A 32 GLY C C 13 174.251 0.1 A 32 GLY CA C 13 46.5 0.1 A 32 GLY N N 15 104.056 0.1 A 33 LEU H H 1 7.914 0.01 A 33 LEU HA H 1 3.857 0.01 A 33 LEU HBx H 1 1.511 0.01 A 33 LEU HBy H 1 1.835 0.01 A 33 LEU HDx% H 1 0.824 0.01 A 33 LEU HDy% H 1 0.824 0.01 A 33 LEU HG H 1 1.195 0.01 A 33 LEU C C 13 176.033 0.1 A 33 LEU CA C 13 56.668 0.1 A 33 LEU CB C 13 41.721 0.1 A 33 LEU CDy C 13 24.832 0.1 A 33 LEU CDx C 13 23.373 0.1 A 33 LEU CG C 13 26.324 0.1 A 33 LEU N N 15 123.25 0.1 A 34 PHE H H 1 8.287 0.01 A 34 PHE HA H 1 4.2 0.01 A 34 PHE HBx H 1 3.109 0.01 A 34 PHE HBy H 1 3.262 0.01 A 34 PHE C C 13 174.374 0.1 A 34 PHE CA C 13 59.876 0.1 A 34 PHE CB C 13 38.834 0.1 A 34 PHE N N 15 119.757 0.1 A 35 VAL H H 1 8.235 0.01 A 35 VAL HA H 1 3.61 0.01 A 35 VAL HB H 1 2.17 0.01 A 35 VAL HGx% H 1 0.998 0.01 A 35 VAL HGy% H 1 1.161 0.01 A 35 VAL C C 13 176.205 0.1 A 35 VAL CA C 13 64.559 0.1 A 35 VAL CB C 13 31.432 0.1 A 35 VAL CGx C 13 21.196 0.1 A 35 VAL CGy C 13 22.16 0.1 A 35 VAL N N 15 117.791 0.1 A 36 GLY H H 1 8.178 0.01 A 36 GLY HAx H 1 3.871 0.01 A 36 GLY HAy H 1 3.958 0.01 A 36 GLY C C 13 173.749 0.1 A 36 GLY CA C 13 46.083 0.1 A 36 GLY N N 15 108.551 0.1 A 37 CYS H H 1 8.253 0.01 A 37 CYS HA H 1 4.18 0.01 A 37 CYS HBx H 1 3.055 0.01 A 37 CYS HBy H 1 3.055 0.01 A 37 CYS C C 13 173.71 0.1 A 37 CYS CA C 13 63 0.1 A 37 CYS CB C 13 26.72 0.1 A 37 CYS N N 15 121.173 0.1 A 38 LEU H H 1 7.965 0.01 A 38 LEU HA H 1 4.06 0.01 A 38 LEU C C 13 176.679 0.1 A 38 LEU CA C 13 56.027 0.1 A 38 LEU CB C 13 41.464 0.1 A 38 LEU CG C 13 26.645 0.1 A 38 LEU N N 15 120.283 0.1 A 39 ALA H H 1 8.066 0.01 A 39 ALA HA H 1 4.142 0.01 A 39 ALA HB% H 1 1.421 0.01 A 39 ALA C C 13 177.915 0.1 A 39 ALA CA C 13 53.717 0.1 A 39 ALA CB C 13 17.985 0.1 A 39 ALA N N 15 122.249 0.1 A 40 GLY H H 1 8.172 0.01 A 40 GLY HAx H 1 3.73 0.01 A 40 GLY HAy H 1 3.92 0.01 A 40 GLY C C 13 172.527 0.1 A 40 GLY CA C 13 45.45 0.1 A 40 GLY N N 15 107.377 0.1 A 41 TYR H H 1 7.8 0.01 A 41 TYR HA H 1 3.799 0.01 A 41 TYR HBx H 1 3.018 0.01 A 41 TYR HBy H 1 3.018 0.01 A 41 TYR HDx H 1 7.025 0.01 A 41 TYR HDy H 1 7.025 0.01 A 41 TYR C C 13 174.208 0.1 A 41 TYR CA C 13 59.245 0.1 A 41 TYR CB C 13 37.936 0.1 A 41 TYR N N 15 122.409 0.1 A 42 GLY H H 1 8.199 0.01 A 42 GLY HAx H 1 3.64 0.01 A 42 GLY HAy H 1 3.86 0.01 A 42 GLY C C 13 172.642 0.1 A 42 GLY CA C 13 46.265 0.1 A 42 GLY N N 15 106.935 0.1 A 43 ALA H H 1 7.758 0.01 A 43 ALA HA H 1 4.15 0.01 A 43 ALA HB% H 1 1.327 0.01 A 43 ALA C C 13 176.398 0.1 A 43 ALA CA C 13 52.883 0.1 A 43 ALA CB C 13 18.241 0.1 A 43 ALA N N 15 123.018 0.1 A 44 TYR H H 1 7.92 0.01 A 44 TYR HA H 1 4.318 0.01 A 44 TYR HBx H 1 3.008 0.01 A 44 TYR HBy H 1 3.008 0.01 A 44 TYR HDx H 1 6.988 0.01 A 44 TYR HDy H 1 6.988 0.01 A 44 TYR C C 13 174.18 0.1 A 44 TYR CA C 13 58.593 0.1 A 44 TYR CB C 13 38.192 0.1 A 44 TYR N N 15 119.664 0.1 A 45 ARG H H 1 7.956 0.01 A 45 ARG HA H 1 3.93 0.01 A 45 ARG HBx H 1 1.685 0.01 A 45 ARG HBy H 1 1.685 0.01 A 45 ARG C C 13 174.423 0.1 A 45 ARG CA C 13 56.027 0.1 A 45 ARG CB C 13 30.173 0.1 A 45 ARG CG C 13 26.536 0.1 A 45 ARG N N 15 119.516 0.1 A 46 VAL H H 1 7.489 0.01 A 46 VAL HA H 1 4.06 0.01 A 46 VAL HB H 1 2.09 0.01 A 46 VAL HGx% H 1 0.886 0.01 A 46 VAL HGy% H 1 0.886 0.01 A 46 VAL C C 13 173.806 0.1 A 46 VAL CA C 13 62.3 0.1 A 46 VAL CB C 13 31.521 0.1 A 46 VAL CGx C 13 19.973 0.1 A 46 VAL CGy C 13 20.64 0.1 A 46 VAL N N 15 116.437 0.1 A 47 SER H H 1 7.728 0.01 A 47 SER HA H 1 4.401 0.01 A 47 SER HBx H 1 3.848 0.01 A 47 SER HBy H 1 3.848 0.01 A 47 SER C C 13 172.074 0.1 A 47 SER CA C 13 58.133 0.1 A 47 SER CB C 13 63.468 0.1 A 47 SER N N 15 117.185 0.1 A 48 ASN H H 1 8.228 0.01 A 48 ASN HA H 1 4.59 0.01 A 48 ASN HBx H 1 2.662 0.01 A 48 ASN HBy H 1 2.662 0.01 A 48 ASN HD2y H 1 7.414 0.01 A 48 ASN HD2x H 1 6.745 0.01 A 48 ASN CA C 13 53.6 0.1 A 48 ASN CB C 13 38.641 0.1 A 48 ASN N N 15 121.049 0.1 A 48 ASN ND2 N 15 113.237 0.1 A 49 ASP H H 1 8.192 0.01 A 49 ASP HA H 1 4.53 0.01 A 49 ASP HBx H 1 2.608 0.01 A 49 ASP HBy H 1 2.608 0.01 A 49 ASP CA C 13 54.202 0.1 A 49 ASP CB C 13 40.374 0.1 A 49 ASP N N 15 120.276 0.1 A 50 LYS H H 1 8.003 0.01 A 50 LYS HA H 1 4.2 0.01 A 50 LYS HBx H 1 1.772 0.01 A 50 LYS HBy H 1 1.772 0.01 A 50 LYS HGx H 1 1.358 0.01 A 50 LYS HGy H 1 1.358 0.01 A 50 LYS C C 13 173.474 0.1 A 50 LYS CA C 13 56.3 0.1 A 50 LYS CB C 13 32.034 0.1 A 50 LYS CD C 13 28.505 0.1 A 50 LYS CG C 13 24.336 0.1 A 50 LYS N N 15 120.66 0.1 A 51 ARG H H 1 8.091 0.01 A 51 ARG HA H 1 4.2 0.01 A 51 ARG HBx H 1 1.769 0.01 A 51 ARG HBy H 1 1.769 0.01 A 51 ARG C C 13 173.303 0.1 A 51 ARG CA C 13 56.283 0.1 A 51 ARG CB C 13 30.238 0.1 A 51 ARG CD C 13 43.453 0.1 A 51 ARG CG C 13 26.709 0.1 A 51 ARG N N 15 121.278 0.1 A 52 ASP H H 1 8.261 0.01 A 52 ASP HA H 1 4.615 0.01 A 52 ASP HBx H 1 2.674 0.01 A 52 ASP HBy H 1 2.674 0.01 A 52 ASP C C 13 173.777 0.1 A 52 ASP CA C 13 53.979 0.1 A 52 ASP CB C 13 40.245 0.1 A 52 ASP N N 15 121.185 0.1 A 53 VAL H H 1 7.997 0.01 A 53 VAL HA H 1 3.95 0.01 A 53 VAL HB H 1 1.796 0.01 A 53 VAL HGx% H 1 0.921 0.01 A 53 VAL HGy% H 1 0.921 0.01 A 53 VAL C C 13 173.279 0.1 A 53 VAL CA C 13 63.176 0.1 A 53 VAL CB C 13 32.099 0.1 A 53 VAL CGx C 13 20.794 0.1 A 53 VAL CGy C 13 21.11 0.1 A 53 VAL N N 15 121.902 0.1 A 54 LYS H H 1 8.054 0.01 A 54 LYS HA H 1 4.26 0.01 A 54 LYS HBx H 1 1.846 0.01 A 54 LYS HBy H 1 1.846 0.01 A 54 LYS HGx H 1 1.457 0.01 A 54 LYS HGy H 1 1.457 0.01 A 54 LYS C C 13 174.481 0.1 A 54 LYS CA C 13 56.347 0.1 A 54 LYS CB C 13 32.099 0.1 A 54 LYS CE C 13 41.444 0.1 A 54 LYS CG C 13 24.756 0.1 A 54 LYS N N 15 123.522 0.1 A 55 VAL H H 1 8.225 0.01 A 55 VAL HA H 1 3.947 0.01 A 55 VAL HB H 1 2.081 0.01 A 55 VAL HGx% H 1 0.93 0.01 A 55 VAL HGy% H 1 0.93 0.01 A 55 VAL C C 13 174.955 0.1 A 55 VAL CA C 13 64.6 0.1 A 55 VAL CB C 13 31.877 0.1 A 55 VAL CGx C 13 21.27 0.1 A 55 VAL CGy C 13 21.938 0.1 A 55 VAL N N 15 120.647 0.1 A 56 SER H H 1 8.26 0.01 A 56 SER HA H 1 4.39 0.01 A 56 SER HBx H 1 3.901 0.01 A 56 SER HBy H 1 3.901 0.01 A 56 SER C C 13 172.3 0.1 A 56 SER CA C 13 60 0.1 A 56 SER CB C 13 62.879 0.1 A 56 SER N N 15 117.785 0.1 A 57 LEU H H 1 8.091 0.01 A 57 LEU HA H 1 4.09 0.01 A 57 LEU C C 13 175.932 0.1 A 57 LEU CA C 13 57.502 0.1 A 57 LEU CB C 13 41.721 0.1 A 57 LEU CDx C 13 24.592 0.1 A 57 LEU CG C 13 26.581 0.1 A 57 LEU N N 15 123.318 0.1 A 58 PHE H H 1 8.066 0.01 A 58 PHE HA H 1 4.33 0.01 A 58 PHE HBx H 1 3.184 0.01 A 58 PHE HBy H 1 3.184 0.01 A 58 PHE C C 13 174.912 0.1 A 58 PHE CA C 13 60.6 0.1 A 58 PHE CB C 13 38.552 0.1 A 58 PHE N N 15 118.02 0.1 A 59 THR H H 1 8.287 0.01 A 59 THR HA H 1 4.31 0.01 A 59 THR HB H 1 3.867 0.01 A 59 THR HG2% H 1 1.277 0.01 A 59 THR C C 13 173.38 0.1 A 59 THR CA C 13 66.313 0.1 A 59 THR CB C 13 67.7 0.1 A 59 THR CG2 C 13 21.419 0.1 A 59 THR N N 15 115.324 0.1 A 60 ALA H H 1 7.983 0.01 A 60 ALA HA H 1 4.28 0.01 A 60 ALA HB% H 1 1.472 0.01 A 60 ALA C C 13 176.978 0.1 A 60 ALA CA C 13 55.1 0.1 A 60 ALA CB C 13 17.728 0.1 A 60 ALA N N 15 123.621 0.1 A 61 PHE H H 1 8.007 0.01 A 61 PHE HA H 1 4.26 0.01 A 61 PHE HBx H 1 3.159 0.01 A 61 PHE HBy H 1 3.159 0.01 A 61 PHE C C 13 175.369 0.1 A 61 PHE CA C 13 60.179 0.1 A 61 PHE CB C 13 38.706 0.1 A 61 PHE N N 15 118.52 0.1 A 62 PHE H H 1 8.546 0.01 A 62 PHE HA H 1 4 0.01 A 62 PHE HBx H 1 2.993 0.01 A 62 PHE HBy H 1 3.126 0.01 A 62 PHE C C 13 174.697 0.1 A 62 PHE CA C 13 60.517 0.1 A 62 PHE CB C 13 38.77 0.1 A 62 PHE N N 15 122.314 0.1 A 63 LEU H H 1 8.396 0.01 A 63 LEU HA H 1 3.87 0.01 A 63 LEU HBx H 1 1.835 0.01 A 63 LEU HBy H 1 1.835 0.01 A 63 LEU HDx% H 1 0.876 0.01 A 63 LEU HDy% H 1 0.876 0.01 A 63 LEU HG H 1 1.493 0.01 A 63 LEU C C 13 175.774 0.1 A 63 LEU CA C 13 56.925 0.1 A 63 LEU CB C 13 41.207 0.1 A 63 LEU CDy C 13 24.913 0.1 A 63 LEU CDx C 13 23.245 0.1 A 63 LEU CG C 13 26.709 0.1 A 63 LEU N N 15 119.399 0.1 A 64 ALA H H 1 8.025 0.01 A 64 ALA HA H 1 3.96 0.01 A 64 ALA HB% H 1 1.381 0.01 A 64 ALA C C 13 177.267 0.1 A 64 ALA CA C 13 54.6 0.1 A 64 ALA CB C 13 17.784 0.1 A 64 ALA N N 15 120.221 0.1 A 65 THR H H 1 7.717 0.01 A 65 THR HA H 1 3.98 0.01 A 65 THR HB H 1 3.773 0.01 A 65 THR HG2% H 1 0.96 0.01 A 65 THR CA C 13 66.291 0.1 A 65 THR CB C 13 67.914 0.1 A 65 THR CG2 C 13 21.085 0.1 A 65 THR N N 15 113.648 0.1 A 66 ILE H H 1 7.738 0.01 A 66 ILE HA H 1 3.74 0.01 A 66 ILE HB H 1 1.754 0.01 A 66 ILE HD1% H 1 0.715 0.01 A 66 ILE C C 13 174.951 0.1 A 66 ILE CA C 13 64.88 0.1 A 66 ILE CB C 13 37.166 0.1 A 66 ILE CG1 C 13 27.736 0.1 A 66 ILE CG2 C 13 17.407 0.1 A 66 ILE N N 15 120.291 0.1 A 67 MET H H 1 7.823 0.01 A 67 MET HA H 1 4.22 0.01 A 67 MET HBx H 1 2.038 0.01 A 67 MET HBy H 1 2.038 0.01 A 67 MET C C 13 175.142 0.1 A 67 MET CA C 13 56.723 0.1 A 67 MET CB C 13 31.951 0.1 A 67 MET CE C 13 17.1 0.1 A 67 MET CG C 13 31.283 0.1 A 67 MET N N 15 117.618 0.1 A 68 GLY H H 1 7.937 0.01 A 68 GLY HAx H 1 3.78 0.01 A 68 GLY HAy H 1 3.93 0.01 A 68 GLY C C 13 172.26 0.1 A 68 GLY CA C 13 45.8 0.1 A 68 GLY N N 15 107.11 0.1 A 69 VAL H H 1 7.697 0.01 A 69 VAL HA H 1 4.22 0.01 A 69 VAL HB H 1 2.077 0.01 A 69 VAL HGx% H 1 0.96 0.01 A 69 VAL HGy% H 1 0.96 0.01 A 69 VAL CA C 13 63.9 0.1 A 69 VAL CB C 13 31.506 0.1 A 69 VAL CGx C 13 21.641 0.1 A 69 VAL CGy C 13 21.641 0.1 A 69 VAL N N 15 120.431 0.1 A 70 ARG H H 1 7.889 0.01 A 70 ARG HA H 1 3.81 0.01 A 70 ARG HBx H 1 1.729 0.01 A 70 ARG HBy H 1 1.729 0.01 A 70 ARG CA C 13 56.4 0.1 A 70 ARG CB C 13 30.097 0.1 A 70 ARG CD C 13 42.889 0.1 A 70 ARG CG C 13 26.685 0.1 A 70 ARG N N 15 121.42 0.1 A 71 PHE H H 1 8.101 0.01 A 71 PHE HA H 1 4.51 0.01 A 71 PHE HBx H 1 2.977 0.01 A 71 PHE HBy H 1 3.141 0.01 A 71 PHE CA C 13 58.6 0.1 A 71 PHE CB C 13 39.145 0.1 A 71 PHE N N 15 119.949 0.1 A 72 LYS H H 1 8.09 0.01 A 72 LYS CA C 13 56.8 0.1 A 72 LYS CB C 13 32.322 0.1 A 72 LYS CG C 13 24.386 0.1 A 72 LYS N N 15 122.193 0.1 A 73 ARG H H 1 8.052 0.01 A 73 ARG CA C 13 56.089 0.1 A 73 ARG CB C 13 30.171 0.1 A 73 ARG N N 15 119.65 0.1 A 74 SER H H 1 7.912 0.01 A 74 SER CA C 13 58.355 0.1 A 74 SER CB C 13 63.404 0.1 A 74 SER N N 15 115.734 0.1 A 75 LYS H H 1 8.067 0.01 A 75 LYS CA C 13 56.135 0.1 A 75 LYS CB C 13 32.175 0.1 A 75 LYS N N 15 122.37 0.1 A 77 ILE H H 1 7.837 0.01 A 77 ILE HA H 1 3.81 0.01 A 77 ILE HB H 1 2.097 0.01 A 77 ILE HG2% H 1 1.014 0.01 A 77 ILE CA C 13 64.9 0.1 A 77 ILE CB C 13 39.145 0.1 A 77 ILE N N 15 119.592 0.1 A 78 MET H H 1 7.95 0.01 A 78 MET CA C 13 52.982 0.1 A 78 MET CB C 13 32.173 0.1 A 78 MET N N 15 121.645 0.1 A 79 PRO HA H 1 4.14 0.01 A 79 PRO C C 13 173.921 0.1 A 79 PRO CA C 13 62.8 0.1 A 79 PRO CB C 13 31.136 0.1 A 79 PRO CG C 13 27.236 0.1 A 80 ALA H H 1 8.32 0.01 A 80 ALA HA H 1 4.4 0.01 A 80 ALA C C 13 176.234 0.1 A 80 ALA CA C 13 53.3 0.1 A 80 ALA CB C 13 18.498 0.1 A 80 ALA N N 15 124.431 0.1 A 81 GLY H H 1 8.458 0.01 A 81 GLY HAx H 1 3.88 0.01 A 81 GLY HAy H 1 3.96 0.01 A 81 GLY C C 13 172.398 0.1 A 81 GLY CA C 13 45.6 0.1 A 81 GLY N N 15 106.834 0.1 A 82 LEU H H 1 7.687 0.01 A 82 LEU HA H 1 4.2 0.01 A 82 LEU C C 13 174.783 0.1 A 82 LEU CA C 13 56.3 0.1 A 82 LEU CB C 13 42.106 0.1 A 82 LEU CDy C 13 24.079 0.1 A 82 LEU CDx C 13 20.743 0.1 A 82 LEU N N 15 121.043 0.1 A 83 VAL H H 1 7.602 0.01 A 83 VAL HA H 1 3.98 0.01 A 83 VAL C C 13 173.634 0.1 A 83 VAL CA C 13 62.4 0.1 A 83 VAL CB C 13 31.585 0.1 A 83 VAL CGy C 13 21.192 0.1 A 83 VAL CGx C 13 20.23 0.1 A 83 VAL N N 15 114.737 0.1 A 84 ALA H H 1 7.891 0.01 A 84 ALA HA H 1 4.15 0.01 A 84 ALA C C 13 175.746 0.1 A 84 ALA CA C 13 53.3 0.1 A 84 ALA CB C 13 18.241 0.1 A 84 ALA N N 15 124.32 0.1 A 85 GLY H H 1 8.204 0.01 A 85 GLY HAx H 1 3.84 0.01 A 85 GLY HAy H 1 3.88 0.01 A 85 GLY C C 13 171.752 0.1 A 85 GLY CA C 13 45.249 0.1 A 85 GLY N N 15 106.807 0.1 A 86 LEU H H 1 7.718 0.01 A 86 LEU HA H 1 4.38 0.01 A 86 LEU C C 13 173.702 0.1 A 86 LEU CA C 13 55 0.1 A 86 LEU CB C 13 42.298 0.1 A 86 LEU CG C 13 26.453 0.1 A 86 LEU N N 15 121.266 0.1 A 87 SER H H 1 7.659 0.01 A 87 SER HA H 1 4.37 0.01 A 87 SER C C 13 172.479 0.1 A 87 SER CA C 13 57.2 0.1 A 87 SER CB C 13 64.174 0.1 A 87 SER N N 15 115.658 0.1 A 88 LEU H H 1 8.733 0.01 A 88 LEU HA H 1 4.6 0.01 A 88 LEU C C 13 175.932 0.1 A 88 LEU CA C 13 57.6 0.1 A 88 LEU CB C 13 41.4 0.1 A 88 LEU CG C 13 26.902 0.1 A 88 LEU N N 15 123.72 0.1 A 89 MET H H 1 8.342 0.01 A 89 MET HA H 1 4.28 0.01 A 89 MET C C 13 175.789 0.1 A 89 MET CA C 13 56.915 0.1 A 89 MET CB C 13 31.007 0.1 A 89 MET CG C 13 31.905 0.1 A 89 MET N N 15 116.684 0.1 A 90 MET H H 1 7.72 0.01 A 90 MET HA H 1 4.11 0.01 A 90 MET C C 13 175.588 0.1 A 90 MET CA C 13 57.951 0.1 A 90 MET CB C 13 32.226 0.1 A 90 MET CG C 13 31.521 0.1 A 90 MET N N 15 119.182 0.1 A 91 ILE H H 1 7.662 0.01 A 91 ILE HA H 1 4.11 0.01 A 91 ILE C C 13 174.634 0.1 A 91 ILE CA C 13 64.1 0.1 A 91 ILE CB C 13 37.143 0.1 A 91 ILE CD1 C 13 12.963 0.1 A 91 ILE CG1 C 13 28.391 0.1 A 91 ILE N N 15 119.077 0.1 A 92 LEU H H 1 8.142 0.01 A 92 LEU HA H 1 4.53 0.01 A 92 LEU C C 13 175.43 0.1 A 92 LEU CA C 13 57.8 0.1 A 92 LEU CB C 13 40.758 0.1 A 92 LEU CDy C 13 24.079 0.1 A 92 LEU CDx C 13 23.63 0.1 A 92 LEU CG C 13 26.517 0.1 A 92 LEU N N 15 119.646 0.1 A 93 ARG H H 1 7.893 0.01 A 93 ARG HA H 1 4.14 0.01 A 93 ARG C C 13 175.961 0.1 A 93 ARG CA C 13 59.1 0.1 A 93 ARG CB C 13 29.404 0.1 A 93 ARG CG C 13 28.056 0.1 A 93 ARG N N 15 116.394 0.1 A 94 LEU H H 1 7.622 0.01 A 94 LEU HA H 1 4.11 0.01 A 94 LEU C C 13 175.889 0.1 A 94 LEU CA C 13 57.3 0.1 A 94 LEU CB C 13 41.296 0.1 A 94 LEU CG C 13 26.611 0.1 A 94 LEU N N 15 119.114 0.1 A 95 VAL H H 1 8.026 0.01 A 95 VAL HA H 1 3.53 0.01 A 95 VAL C C 13 175.042 0.1 A 95 VAL CA C 13 66.419 0.1 A 95 VAL CB C 13 31.357 0.1 A 95 VAL CGy C 13 22.383 0.1 A 95 VAL CGx C 13 21.345 0.1 A 95 VAL N N 15 117.704 0.1 A 96 LEU H H 1 7.893 0.01 A 96 LEU HA H 1 3.98 0.01 A 96 LEU C C 13 176.579 0.1 A 96 LEU CA C 13 56.8 0.1 A 96 LEU CB C 13 40.951 0.1 A 96 LEU CDy C 13 25.362 0.1 A 96 LEU CDx C 13 22.539 0.1 A 96 LEU CG C 13 26.453 0.1 A 96 LEU N N 15 117.185 0.1 A 97 LEU H H 1 7.545 0.01 A 97 LEU HA H 1 4.18 0.01 A 97 LEU C C 13 175.802 0.1 A 97 LEU CA C 13 56.3 0.1 A 97 LEU CB C 13 41.592 0.1 A 97 LEU CDy C 13 25.49 0.1 A 97 LEU CDx C 13 22.603 0.1 A 97 LEU CG C 13 26.517 0.1 A 97 LEU N N 15 118.471 0.1 A 98 LEU H H 1 7.688 0.01 A 98 LEU HA H 1 4.23 0.01 A 98 LEU C C 13 174.174 0.1 A 98 LEU CA C 13 56.283 0.1 A 98 LEU CB C 13 42.362 0.1 A 98 LEU CDx C 13 20.037 0.1 A 98 LEU CDy C 13 21.449 0.1 A 98 LEU CG C 13 26.26 0.1 A 98 LEU N N 15 118.162 0.1 A 99 LEU H H 1 7.287 0.01 A 99 LEU HA H 1 4.23 0.01 A 99 LEU CA C 13 54.985 0.1 A 99 LEU CB C 13 42.038 0.1 A 99 LEU CDy C 13 23.437 0.1 A 99 LEU CDx C 13 22.668 0.1 A 99 LEU CG C 13 26.166 0.1 A 99 LEU N N 15 120.511 0.1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-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 7 GLY H A 20 TYR CB 1.0 . 25.8 2 2 A 20 TYR CB A 8 TYR H 1.0 . 23.9 3 3 A 20 TYR CB A 9 ALA H 1.0 . 21.1 4 4 A 20 TYR CB A 10 ALA H 1.0 . 18.2 5 5 A 10 ALA H A 99 LEU CB 1.0 . 28.8 6 6 A 20 TYR CB A 11 LEU H 1.0 . 16.6 7 7 A 12 VAL H A 37 CYS CB 1.0 . 28.7 8 8 A 20 TYR CB A 13 THR H 1.0 . 14.7 9 9 A 37 CYS CB A 13 THR H 1.0 . 29.7 10 10 A 20 TYR CB A 14 PHE H 1.0 . 14.7 11 11 A 37 CYS CB A 14 PHE H 1.0 . 28.5 12 12 A 20 TYR CB A 15 GLY H 1.0 . 15.0 13 13 A 37 CYS CB A 15 GLY H 1.0 . 27.9 14 14 A 20 TYR CB A 16 SER H 1.0 . 15.0 15 15 A 37 CYS CB A 16 SER H 1.0 . 26.8 16 16 A 99 LEU CB A 16 SER H 1.0 . 28.3 17 17 A 20 TYR CB A 17 ILE H 1.0 . 14.8 18 18 A 37 CYS CB A 17 ILE H 1.0 . 26.1 19 19 A 17 ILE H A 56 SER CB 1.0 . 27.5 20 20 A 17 ILE H A 87 SER CB 1.0 . 29.2 21 21 A 20 TYR CB A 18 PHE H 1.0 . 14.7 22 22 A 37 CYS CB A 18 PHE H 1.0 . 24.5 23 23 A 87 SER CB A 18 PHE H 1.0 . 29.1 24 24 A 20 TYR CB A 19 GLY H 1.0 . 14.9 25 25 A 37 CYS CB A 19 GLY H 1.0 . 21.2 26 26 A 56 SER CB A 19 GLY H 1.0 . 27.9 27 27 A 87 SER CB A 19 GLY H 1.0 . 27.5 28 28 A 99 LEU CB A 19 GLY H 1.0 . 26.3 29 29 A 20 TYR CB A 21 LYS H 1.0 . 14.8 30 30 A 20 TYR CB A 22 ARG H 1.0 . 14.8 31 31 A 20 TYR CB A 23 ARG H 1.0 . 14.7 32 32 A 20 TYR CB A 24 GLY H 1.0 . 14.7 33 33 A 20 TYR CB A 25 GLY H 1.0 . 14.9 34 34 A 20 TYR CB A 26 VAL H 1.0 . 15.1 35 35 A 20 TYR CB A 29 LEU H 1.0 . 18.8 36 36 A 20 TYR CB A 30 ILE H 1.0 . 18.5 37 37 A 20 TYR CB A 31 ALA H 1.0 . 18.3 38 38 A 20 TYR CB A 32 GLY H 1.0 . 17.9 39 39 A 20 TYR CB A 33 LEU H 1.0 . 18.7 40 40 A 20 TYR CB A 35 VAL H 1.0 . 18.2 41 41 A 20 TYR CB A 36 GLY H 1.0 . 19.6 42 42 A 37 CYS CB A 20 TYR H 1.0 . 19.6 43 43 A 20 TYR CB A 39 ALA H 1.0 . 26.2 44 44 A 20 TYR CB A 40 GLY H 1.0 . 26.7 45 45 A 20 TYR CB A 41 TYR H 1.0 . 26.6 46 46 A 20 TYR CB A 42 GLY H 1.0 . 25.8 47 47 A 20 TYR CB A 43 ALA H 1.0 . 25.5 48 48 A 20 TYR CB A 44 TYR H 1.0 . 28.1 49 49 A 20 TYR CB A 45 ARG H 1.0 . 25.5 50 50 A 20 TYR CB A 46 VAL H 1.0 . 26.7 51 51 A 20 TYR CB A 80 ALA H 1.0 . 28.5 52 52 A 20 TYR CB A 83 VAL H 1.0 . 26.2 53 53 A 20 TYR CB A 86 LEU H 1.0 . 28.7 54 54 A 20 TYR CB A 87 SER H 1.0 . 26.9 55 55 A 87 SER CB A 20 TYR H 1.0 . 26.3 56 56 A 20 TYR CB A 88 LEU H 1.0 . 24.4 57 57 A 20 TYR CB A 95 VAL H 1.0 . 29.2 58 58 A 20 TYR CB A 99 LEU H 1.0 . 25.3 59 59 A 99 LEU CB A 20 TYR H 1.0 . 24.5 60 60 A 37 CYS CB A 21 LYS H 1.0 . 22.9 61 61 A 87 SER CB A 21 LYS H 1.0 . 27.7 62 62 A 37 CYS CB A 22 ARG H 1.0 . 22.8 63 63 A 87 SER CB A 22 ARG H 1.0 . 29.2 64 64 A 37 CYS CB A 23 ARG H 1.0 . 20.9 65 65 A 56 SER CB A 23 ARG H 1.0 . 28.9 66 66 A 87 SER CB A 23 ARG H 1.0 . 25.6 67 67 A 37 CYS CB A 24 GLY H 1.0 . 19.8 68 68 A 56 SER CB A 24 GLY H 1.0 . 25.6 69 69 A 87 SER CB A 24 GLY H 1.0 . 24.1 70 70 A 99 LEU CB A 24 GLY H 1.0 . 29.3 71 71 A 37 CYS CB A 25 GLY H 1.0 . 19.9 72 72 A 56 SER CB A 25 GLY H 1.0 . 26.7 73 73 A 25 GLY H A 74 SER CB 1.0 . 28.2 74 74 A 87 SER CB A 25 GLY H 1.0 . 23.3 75 75 A 99 LEU CB A 25 GLY H 1.0 . 28.3 76 76 A 37 CYS CB A 26 VAL H 1.0 . 21.3 77 77 A 56 SER CB A 26 VAL H 1.0 . 26.5 78 78 A 26 VAL H A 74 SER CB 1.0 . 26.9 79 79 A 87 SER CB A 26 VAL H 1.0 . 23.6 80 80 A 56 SER CB A 28 SER H 1.0 . 21.5 81 81 A 74 SER CB A 28 SER H 1.0 . 23.5 82 82 A 37 CYS CB A 29 LEU H 1.0 . 15.3 83 83 A 56 SER CB A 29 LEU H 1.0 . 21.6 84 84 A 29 LEU H A 74 SER CB 1.0 . 24.4 85 85 A 87 SER CB A 29 LEU H 1.0 . 18.7 86 86 A 30 ILE H A 47 SER CB 1.0 . 28.1 87 87 A 56 SER CB A 30 ILE H 1.0 . 21.9 88 88 A 30 ILE H A 74 SER CB 1.0 . 25.3 89 89 A 87 SER CB A 30 ILE H 1.0 . 17.7 90 90 A 99 LEU CB A 30 ILE H 1.0 . 26.7 91 91 A 37 CYS CB A 31 ALA H 1.0 . 12.0 92 92 A 31 ALA H A 47 SER CB 1.0 . 28.4 93 93 A 56 SER CB A 31 ALA H 1.0 . 19.8 94 94 A 31 ALA H A 74 SER CB 1.0 . 24.6 95 95 A 87 SER CB A 31 ALA H 1.0 . 17.9 96 96 A 37 CYS CB A 32 GLY H 1.0 . 12.0 97 97 A 32 GLY H A 47 SER CB 1.0 . 24.9 98 98 A 56 SER CB A 32 GLY H 1.0 . 17.6 99 99 A 32 GLY H A 74 SER CB 1.0 . 25.2 100 100 A 87 SER CB A 32 GLY H 1.0 . 16.9 101 101 A 99 LEU CB A 32 GLY H 1.0 . 27.5 102 102 A 37 CYS CB A 33 LEU H 1.0 . 12.0 103 103 A 33 LEU H A 74 SER CB 1.0 . 27.8 104 104 A 87 SER CB A 33 LEU H 1.0 . 16.4 105 105 A 99 LEU CB A 33 LEU H 1.0 . 25.5 106 106 A 37 CYS CB A 34 PHE H 1.0 . 12.0 107 107 A 37 CYS CB A 35 VAL H 1.0 . 12.0 108 108 A 35 VAL H A 47 SER CB 1.0 . 21.2 109 109 A 56 SER CB A 35 VAL H 1.0 . 15.7 110 110 A 35 VAL H A 74 SER CB 1.0 . 28.9 111 111 A 87 SER CB A 35 VAL H 1.0 . 18.7 112 112 A 99 LEU CB A 35 VAL H 1.0 . 25.1 113 113 A 37 CYS CB A 36 GLY H 1.0 . 12.0 114 114 A 36 GLY H A 47 SER CB 1.0 . 20.4 115 115 A 56 SER CB A 36 GLY H 1.0 . 13.2 116 116 A 87 SER CB A 36 GLY H 1.0 . 16.9 117 117 A 99 LEU CB A 36 GLY H 1.0 . 25.2 118 118 A 37 CYS CB A 38 LEU H 1.0 . 12.0 119 119 A 37 CYS CB A 39 ALA H 1.0 . 12.0 120 120 A 37 CYS CB A 40 GLY H 1.0 . 12.0 121 121 A 37 CYS CB A 41 TYR H 1.0 . 12.0 122 122 A 37 CYS CB A 42 GLY H 1.0 . 12.0 123 123 A 37 CYS CB A 43 ALA H 1.0 . 12.0 124 124 A 37 CYS CB A 45 ARG H 1.0 . 12.1 125 125 A 37 CYS CB A 46 VAL H 1.0 . 13.3 126 126 A 37 CYS CB A 47 SER H 1.0 . 14.7 127 127 A 47 SER CB A 37 CYS H 1.0 . 14.1 128 128 A 37 CYS CB A 48 ASN H 1.0 . 17.6 129 129 A 37 CYS CB A 49 ASP H 1.0 . 18.3 130 130 A 37 CYS CB A 50 LYS H 1.0 . 16.3 131 131 A 37 CYS CB A 53 VAL H 1.0 . 15.1 132 132 A 37 CYS CB A 54 LYS H 1.0 . 15.9 133 133 A 37 CYS CB A 55 VAL H 1.0 . 12.7 134 134 A 37 CYS CB A 56 SER H 1.0 . 15.2 135 135 A 37 CYS CB A 57 LEU H 1.0 . 16.2 136 136 A 37 CYS CB A 58 PHE H 1.0 . 14.1 137 137 A 37 CYS CB A 59 THR H 1.0 . 12.9 138 138 A 37 CYS CB A 60 ALA H 1.0 . 15.9 139 139 A 37 CYS CB A 61 PHE H 1.0 . 18.8 140 140 A 37 CYS CB A 62 PHE H 1.0 . 17.3 141 141 A 37 CYS CB A 63 LEU H 1.0 . 19.9 142 142 A 37 CYS CB A 64 ALA H 1.0 . 17.3 143 143 A 37 CYS CB A 65 THR H 1.0 . 18.2 144 144 A 37 CYS CB A 66 ILE H 1.0 . 21.9 145 145 A 37 CYS CB A 67 MET H 1.0 . 20.3 146 146 A 37 CYS CB A 68 GLY H 1.0 . 22.2 147 147 A 37 CYS CB A 69 VAL H 1.0 . 24.1 148 148 A 37 CYS CB A 70 ARG H 1.0 . 25.3 149 149 A 37 CYS CB A 71 PHE H 1.0 . 27.7 150 150 A 37 CYS CB A 80 ALA H 1.0 . 23.1 151 151 A 37 CYS CB A 81 GLY H 1.0 . 20.7 152 152 A 37 CYS CB A 82 LEU H 1.0 . 18.3 153 153 A 37 CYS CB A 83 VAL H 1.0 . 20.4 154 154 A 37 CYS CB A 84 ALA H 1.0 . 18.8 155 155 A 37 CYS CB A 85 GLY H 1.0 . 16.5 156 156 A 37 CYS CB A 86 LEU H 1.0 . 17.8 157 157 A 37 CYS CB A 87 SER H 1.0 . 17.8 158 158 A 37 CYS CB A 88 LEU H 1.0 . 16.9 159 159 A 37 CYS CB A 89 MET H 1.0 . 16.6 160 160 A 37 CYS CB A 90 MET H 1.0 . 16.6 161 161 A 37 CYS CB A 91 ILE H 1.0 . 17.3 162 162 A 37 CYS CB A 92 LEU H 1.0 . 16.7 163 163 A 37 CYS CB A 93 ARG H 1.0 . 17.3 164 164 A 37 CYS CB A 94 LEU H 1.0 . 18.4 165 165 A 37 CYS CB A 95 VAL H 1.0 . 21.1 166 166 A 37 CYS CB A 96 LEU H 1.0 . 20.8 167 167 A 37 CYS CB A 97 LEU H 1.0 . 21.7 168 168 A 37 CYS CB A 98 LEU H 1.0 . 21.7 169 169 A 37 CYS CB A 99 LEU H 1.0 . 20.7 170 170 A 87 SER CB A 39 ALA H 1.0 . 19.6 171 171 A 99 LEU CB A 39 ALA H 1.0 . 23.7 172 172 A 40 GLY H A 47 SER CB 1.0 . 15.5 173 173 A 87 SER CB A 40 GLY H 1.0 . 18.3 174 174 A 99 LEU CB A 40 GLY H 1.0 . 20.7 175 175 A 56 SER CB A 41 TYR H 1.0 . 15.4 176 176 A 87 SER CB A 41 TYR H 1.0 . 20.4 177 177 A 99 LEU CB A 41 TYR H 1.0 . 20.4 178 178 A 42 GLY H A 47 SER CB 1.0 . 12.0 179 179 A 56 SER CB A 42 GLY H 1.0 . 12.0 180 180 A 87 SER CB A 42 GLY H 1.0 . 21.5 181 181 A 99 LEU CB A 42 GLY H 1.0 . 20.8 182 182 A 43 ALA H A 47 SER CB 1.0 . 12.0 183 183 A 56 SER CB A 43 ALA H 1.0 . 12.0 184 184 A 87 SER CB A 43 ALA H 1.0 . 21.1 185 185 A 99 LEU CB A 43 ALA H 1.0 . 22.5 186 186 A 44 TYR H A 47 SER CB 1.0 . 12.0 187 187 A 56 SER CB A 44 TYR H 1.0 . 13.6 188 188 A 87 SER CB A 44 TYR H 1.0 . 25.7 189 189 A 99 LEU CB A 44 TYR H 1.0 . 19.1 190 190 A 45 ARG H A 47 SER CB 1.0 . 12.0 191 191 A 46 VAL H A 47 SER CB 1.0 . 12.0 192 192 A 56 SER CB A 46 VAL H 1.0 . 14.7 193 193 A 99 LEU CB A 46 VAL H 1.0 . 21.6 194 194 A 47 SER CB A 48 ASN H 1.0 . 12.0 195 195 A 47 SER CB A 49 ASP H 1.0 . 12.0 196 196 A 47 SER CB A 52 ASP H 1.0 . 15.1 197 197 A 47 SER CB A 53 VAL H 1.0 . 16.2 198 198 A 47 SER CB A 54 LYS H 1.0 . 20.4 199 199 A 47 SER CB A 55 VAL H 1.0 . 13.9 200 200 A 47 SER CB A 56 SER H 1.0 . 16.1 201 201 A 47 SER CB A 58 PHE H 1.0 . 17.6 202 202 A 47 SER CB A 59 THR H 1.0 . 18.2 203 203 A 47 SER CB A 60 ALA H 1.0 . 21.4 204 204 A 47 SER CB A 61 PHE H 1.0 . 21.9 205 205 A 47 SER CB A 62 PHE H 1.0 . 21.5 206 206 A 47 SER CB A 63 LEU H 1.0 . 21.9 207 207 A 47 SER CB A 64 ALA H 1.0 . 24.6 208 208 A 47 SER CB A 65 THR H 1.0 . 25.4 209 209 A 47 SER CB A 67 MET H 1.0 . 26.6 210 210 A 47 SER CB A 90 MET H 1.0 . 28.9 211 211 A 47 SER CB A 91 ILE H 1.0 . 29.9 212 212 A 47 SER CB A 92 LEU H 1.0 . 29.1 213 213 A 47 SER CB A 93 ARG H 1.0 . 26.7 214 214 A 47 SER CB A 94 LEU H 1.0 . 26.8 215 215 A 95 VAL H A 47 SER CB 1.0 . 27.3 216 216 A 47 SER CB A 96 LEU H 1.0 . 26.3 217 217 A 47 SER CB A 97 LEU H 1.0 . 25.5 218 218 A 47 SER CB A 98 LEU H 1.0 . 23.5 219 219 A 99 LEU H A 47 SER CB 1.0 . 22.8 220 220 A 87 SER CB A 48 ASN H 1.0 . 28.5 221 221 A 99 LEU CB A 48 ASN H 1.0 . 23.5 222 222 A 56 SER CB A 49 ASP H 1.0 . 15.5 223 223 A 87 SER CB A 49 ASP H 1.0 . 28.3 224 224 A 99 LEU CB A 49 ASP H 1.0 . 24.4 225 225 A 87 SER CB A 50 LYS H 1.0 . 26.9 226 226 A 99 LEU CB A 50 LYS H 1.0 . 20.7 227 227 A 56 SER CB A 51 ARG H 1.0 . 12.0 228 228 A 87 SER CB A 51 ARG H 1.0 . 22.1 229 229 A 56 SER CB A 52 ASP H 1.0 . 12.0 230 230 A 87 SER CB A 52 ASP H 1.0 . 20.1 231 231 A 99 LEU CB A 52 ASP H 1.0 . 19.9 232 232 A 56 SER CB A 53 VAL H 1.0 . 12.0 233 233 A 87 SER CB A 53 VAL H 1.0 . 17.5 234 234 A 99 LEU CB A 53 VAL H 1.0 . 20.9 235 235 A 56 SER CB A 54 LYS H 1.0 . 12.0 236 236 A 87 SER CB A 54 LYS H 1.0 . 16.1 237 237 A 87 SER CB A 55 VAL H 1.0 . 16.8 238 238 A 99 LEU CB A 55 VAL H 1.0 . 19.2 239 239 A 56 SER CB A 57 LEU H 1.0 . 12.0 240 240 A 56 SER CB A 58 PHE H 1.0 . 12.0 241 241 A 56 SER CB A 62 PHE H 1.0 . 12.0 242 242 A 56 SER CB A 63 LEU H 1.0 . 12.4 243 243 A 56 SER CB A 64 ALA H 1.0 . 12.0 244 244 A 56 SER CB A 65 THR H 1.0 . 13.3 245 245 A 56 SER CB A 66 ILE H 1.0 . 14.1 246 246 A 56 SER CB A 67 MET H 1.0 . 15.6 247 247 A 56 SER CB A 72 LYS H 1.0 . 20.9 248 248 A 56 SER CB A 73 ARG H 1.0 . 23.2 249 249 A 56 SER CB A 74 SER H 1.0 . 23.1 250 250 A 74 SER CB A 56 SER H 1.0 . 29.0 251 251 A 56 SER CB A 80 ALA H 1.0 . 20.6 252 252 A 56 SER CB A 81 GLY H 1.0 . 19.3 253 253 A 56 SER CB A 82 LEU H 1.0 . 18.3 254 254 A 56 SER CB A 83 VAL H 1.0 . 16.1 255 255 A 56 SER CB A 84 ALA H 1.0 . 16.2 256 256 A 56 SER CB A 85 GLY H 1.0 . 14.2 257 257 A 56 SER CB A 86 LEU H 1.0 . 12.6 258 258 A 56 SER CB A 87 SER H 1.0 . 12.2 259 259 A 87 SER CB A 56 SER H 1.0 . 16.4 260 260 A 56 SER CB A 88 LEU H 1.0 . 14.7 261 261 A 56 SER CB A 89 MET H 1.0 . 11.9 262 262 A 56 SER CB A 90 MET H 1.0 . 10.5 263 263 A 56 SER CB A 91 ILE H 1.0 . 12.9 264 264 A 56 SER CB A 92 LEU H 1.0 . 14.4 265 265 A 56 SER CB A 93 ARG H 1.0 . 13.8 266 266 A 56 SER CB A 94 LEU H 1.0 . 15.7 267 267 A 56 SER CB A 95 VAL H 1.0 . 16.2 268 268 A 56 SER CB A 96 LEU H 1.0 . 16.9 269 269 A 56 SER CB A 97 LEU H 1.0 . 17.5 270 270 A 56 SER CB A 98 LEU H 1.0 . 19.1 271 271 A 56 SER CB A 99 LEU H 1.0 . 19.8 272 272 A 99 LEU CB A 56 SER H 1.0 . 17.3 273 273 A 74 SER CB A 57 LEU H 1.0 . 25.4 274 274 A 87 SER CB A 57 LEU H 1.0 . 14.3 275 275 A 99 LEU CB A 57 LEU H 1.0 . 18.6 276 276 A 87 SER CB A 58 PHE H 1.0 . 16.9 277 277 A 99 LEU CB A 58 PHE H 1.0 . 23.7 278 278 A 74 SER CB A 59 THR H 1.0 . 23.1 279 279 A 87 SER CB A 59 THR H 1.0 . 16.7 280 280 A 99 LEU CB A 59 THR H 1.0 . 25.6 281 281 A 74 SER CB A 60 ALA H 1.0 . 26.3 282 282 A 87 SER CB A 60 ALA H 1.0 . 14.9 283 283 A 99 LEU CB A 60 ALA H 1.0 . 26.8 284 284 A 74 SER CB A 61 PHE H 1.0 . 26.1 285 285 A 87 SER CB A 61 PHE H 1.0 . 16.8 286 286 A 99 LEU CB A 61 PHE H 1.0 . 28.9 287 287 A 74 SER CB A 62 PHE H 1.0 . 26.9 288 288 A 87 SER CB A 62 PHE H 1.0 . 19.1 289 289 A 74 SER CB A 63 LEU H 1.0 . 20.7 290 290 A 87 SER CB A 63 LEU H 1.0 . 16.5 291 291 A 74 SER CB A 64 ALA H 1.0 . 17.7 292 292 A 87 SER CB A 64 ALA H 1.0 . 16.5 293 293 A 87 SER CB A 65 THR H 1.0 . 19.4 294 294 A 74 SER CB A 66 ILE H 1.0 . 23.9 295 295 A 87 SER CB A 66 ILE H 1.0 . 20.9 296 296 A 99 LEU CB A 66 ILE H 1.0 . 28.5 297 297 A 74 SER CB A 67 MET H 1.0 . 22.8 298 298 A 87 SER CB A 67 MET H 1.0 . 21.4 299 299 A 74 SER CB A 68 GLY H 1.0 . 20.9 300 300 A 87 SER CB A 68 GLY H 1.0 . 19.5 301 301 A 74 SER CB A 69 VAL H 1.0 . 12.0 302 302 A 87 SER CB A 69 VAL H 1.0 . 21.8 303 303 A 87 SER CB A 70 ARG H 1.0 . 19.8 304 304 A 74 SER CB A 71 PHE H 1.0 . 15.6 305 305 A 80 ALA H A 74 SER CB 1.0 . 12.0 306 306 A 74 SER CB A 81 GLY H 1.0 . 12.6 307 307 A 83 VAL H A 74 SER CB 1.0 . 12.5 308 308 A 74 SER CB A 84 ALA H 1.0 . 13.1 309 309 A 87 SER H A 74 SER CB 1.0 . 18.5 310 310 A 74 SER CB A 89 MET H 1.0 . 28.4 311 311 A 87 SER CB A 80 ALA H 1.0 . 12.0 312 312 A 87 SER CB A 81 GLY H 1.0 . 12.0 313 313 A 99 LEU CB A 82 LEU H 1.0 . 28.2 314 314 A 99 LEU CB A 83 VAL H 1.0 . 26.7 315 315 A 87 SER CB A 85 GLY H 1.0 . 12.0 316 316 A 99 LEU CB A 85 GLY H 1.0 . 27.6 317 317 A 99 LEU CB A 86 LEU H 1.0 . 26.5 318 318 A 87 SER CB A 91 ILE H 1.0 . 12.0 319 319 A 87 SER CB A 92 LEU H 1.0 . 12.0 320 320 A 87 SER CB A 93 ARG H 1.0 . 12.0 321 321 A 87 SER CB A 94 LEU H 1.0 . 12.0 322 322 A 87 SER CB A 96 LEU H 1.0 . 15.4 323 323 A 87 SER CB A 97 LEU H 1.0 . 18.4 324 324 A 87 SER CB A 98 LEU H 1.0 . 20.8 325 325 A 87 SER CB A 99 LEU H 1.0 . 23.7 326 326 A 99 LEU CB A 87 SER H 1.0 . 23.8 327 327 A 99 LEU CB A 88 LEU H 1.0 . 24.7 328 328 A 99 LEU CB A 89 MET H 1.0 . 21.5 329 329 A 99 LEU CB A 90 MET H 1.0 . 21.4 330 330 A 99 LEU CB A 91 ILE H 1.0 . 14.6 331 331 A 99 LEU CB A 92 LEU H 1.0 . 15.1 332 332 A 99 LEU CB A 93 ARG H 1.0 . 14.7 333 333 A 99 LEU CB A 94 LEU H 1.0 . 14.9 334 334 A 99 LEU CB A 96 LEU H 1.0 . 14.5 335 335 A 99 LEU CB A 97 LEU H 1.0 . 14.8 336 336 A 99 LEU CB A 98 LEU H 1.0 . 14.6 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type lower-bound-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 20 TYR CB A 2 ASP H 1.0 21.7 . 2 2 A 37 CYS CB A 2 ASP H 1.0 27.5 . 3 3 A 47 SER CB A 2 ASP H 1.0 23.7 . 4 4 A 56 SER CB A 2 ASP H 1.0 25.0 . 5 5 A 74 SER CB A 2 ASP H 1.0 25.0 . 6 6 A 87 SER CB A 2 ASP H 1.0 24.3 . 7 7 A 20 TYR CB A 3 LEU H 1.0 25.0 . 8 8 A 37 CYS CB A 3 LEU H 1.0 25.0 . 9 9 A 47 SER CB A 3 LEU H 1.0 25.0 . 10 10 A 56 SER CB A 3 LEU H 1.0 24.4 . 11 11 A 74 SER CB A 3 LEU H 1.0 25.0 . 12 12 A 87 SER CB A 3 LEU H 1.0 24.3 . 13 13 A 99 LEU CB A 3 LEU H 1.0 24.4 . 14 14 A 20 TYR CB A 4 ILE H 1.0 21.8 . 15 15 A 37 CYS CB A 4 ILE H 1.0 25.0 . 16 16 A 47 SER CB A 4 ILE H 1.0 25.0 . 17 17 A 56 SER CB A 4 ILE H 1.0 25.0 . 18 18 A 74 SER CB A 4 ILE H 1.0 25.0 . 19 19 A 87 SER CB A 4 ILE H 1.0 25.0 . 20 20 A 99 LEU CB A 4 ILE H 1.0 24.6 . 21 21 A 20 TYR CB A 5 GLY H 1.0 21.4 . 22 22 A 37 CYS CB A 5 GLY H 1.0 25.3 . 23 23 A 47 SER CB A 5 GLY H 1.0 25.0 . 24 24 A 56 SER CB A 5 GLY H 1.0 20.4 . 25 25 A 74 SER CB A 5 GLY H 1.0 25.0 . 26 26 A 87 SER CB A 5 GLY H 1.0 27.7 . 27 27 A 99 LEU CB A 5 GLY H 1.0 22.2 . 28 28 A 20 TYR CB A 6 PHE H 1.0 20.2 . 29 29 A 37 CYS CB A 6 PHE H 1.0 25.0 . 30 30 A 47 SER CB A 6 PHE H 1.0 25.0 . 31 31 A 56 SER CB A 6 PHE H 1.0 25.0 . 32 32 A 74 SER CB A 6 PHE H 1.0 25.0 . 33 33 A 87 SER CB A 6 PHE H 1.0 28.1 . 34 34 A 99 LEU CB A 6 PHE H 1.0 23.6 . 35 35 A 7 GLY H A 20 TYR CB 1.0 17.8 . 36 36 A 7 GLY H A 37 CYS CB 1.0 25.0 . 37 37 A 7 GLY H A 47 SER CB 1.0 25.0 . 38 38 A 7 GLY H A 56 SER CB 1.0 25.0 . 39 39 A 7 GLY H A 74 SER CB 1.0 25.0 . 40 40 A 7 GLY H A 87 SER CB 1.0 26.9 . 41 41 A 7 GLY H A 99 LEU CB 1.0 22.3 . 42 42 A 20 TYR CB A 8 TYR H 1.0 15.9 . 43 43 A 8 TYR H A 37 CYS CB 1.0 25.0 . 44 44 A 8 TYR H A 47 SER CB 1.0 25.0 . 45 45 A 8 TYR H A 56 SER CB 1.0 25.0 . 46 46 A 8 TYR H A 74 SER CB 1.0 25.0 . 47 47 A 8 TYR H A 87 SER CB 1.0 27.5 . 48 48 A 8 TYR H A 99 LEU CB 1.0 25.0 . 49 49 A 20 TYR CB A 9 ALA H 1.0 13.1 . 50 50 A 9 ALA H A 37 CYS CB 1.0 25.0 . 51 51 A 9 ALA H A 47 SER CB 1.0 25.0 . 52 52 A 9 ALA H A 56 SER CB 1.0 25.0 . 53 53 A 9 ALA H A 74 SER CB 1.0 25.0 . 54 54 A 9 ALA H A 87 SER CB 1.0 25.0 . 55 55 A 9 ALA H A 99 LEU CB 1.0 20.1 . 56 56 A 20 TYR CB A 10 ALA H 1.0 10.2 . 57 57 A 10 ALA H A 37 CYS CB 1.0 24.3 . 58 58 A 10 ALA H A 47 SER CB 1.0 25.0 . 59 59 A 10 ALA H A 56 SER CB 1.0 25.0 . 60 60 A 10 ALA H A 74 SER CB 1.0 25.0 . 61 61 A 10 ALA H A 87 SER CB 1.0 26.2 . 62 62 A 10 ALA H A 99 LEU CB 1.0 20.8 . 63 63 A 20 TYR CB A 11 LEU H 1.0 8.6 . 64 64 A 11 LEU H A 37 CYS CB 1.0 24.6 . 65 65 A 11 LEU H A 47 SER CB 1.0 25.0 . 66 66 A 11 LEU H A 56 SER CB 1.0 25.0 . 67 67 A 11 LEU H A 74 SER CB 1.0 25.0 . 68 68 A 11 LEU H A 87 SER CB 1.0 24.5 . 69 69 A 99 LEU CB A 11 LEU H 1.0 20.7 . 70 70 A 12 VAL H A 37 CYS CB 1.0 22.7 . 71 71 A 12 VAL H A 47 SER CB 1.0 25.0 . 72 72 A 12 VAL H A 56 SER CB 1.0 24.9 . 73 73 A 12 VAL H A 74 SER CB 1.0 25.0 . 74 74 A 12 VAL H A 87 SER CB 1.0 25.0 . 75 75 A 99 LEU CB A 12 VAL H 1.0 20.9 . 76 76 A 37 CYS CB A 13 THR H 1.0 23.7 . 77 77 A 13 THR H A 47 SER CB 1.0 25.0 . 78 78 A 13 THR H A 74 SER CB 1.0 25.0 . 79 79 A 13 THR H A 87 SER CB 1.0 24.3 . 80 80 A 99 LEU CB A 13 THR H 1.0 21.3 . 81 81 A 37 CYS CB A 14 PHE H 1.0 22.5 . 82 82 A 14 PHE H A 47 SER CB 1.0 25.0 . 83 83 A 14 PHE H A 56 SER CB 1.0 25.0 . 84 84 A 14 PHE H A 74 SER CB 1.0 25.0 . 85 85 A 14 PHE H A 87 SER CB 1.0 25.0 . 86 86 A 99 LEU CB A 14 PHE H 1.0 22.1 . 87 87 A 37 CYS CB A 15 GLY H 1.0 21.9 . 88 88 A 15 GLY H A 47 SER CB 1.0 25.0 . 89 89 A 15 GLY H A 56 SER CB 1.0 25.0 . 90 90 A 15 GLY H A 74 SER CB 1.0 25.0 . 91 91 A 15 GLY H A 87 SER CB 1.0 25.0 . 92 92 A 99 LEU CB A 15 GLY H 1.0 20.5 . 93 93 A 37 CYS CB A 16 SER H 1.0 20.8 . 94 94 A 16 SER H A 47 SER CB 1.0 25.0 . 95 95 A 16 SER H A 56 SER CB 1.0 25.0 . 96 96 A 16 SER H A 74 SER CB 1.0 25.0 . 97 97 A 16 SER H A 87 SER CB 1.0 24.5 . 98 98 A 99 LEU CB A 16 SER H 1.0 20.3 . 99 99 A 37 CYS CB A 17 ILE H 1.0 20.1 . 100 100 A 17 ILE H A 47 SER CB 1.0 25.0 . 101 101 A 17 ILE H A 56 SER CB 1.0 21.5 . 102 102 A 17 ILE H A 74 SER CB 1.0 25.0 . 103 103 A 17 ILE H A 87 SER CB 1.0 23.2 . 104 104 A 99 LEU CB A 17 ILE H 1.0 23.2 . 105 105 A 37 CYS CB A 18 PHE H 1.0 18.5 . 106 106 A 56 SER CB A 18 PHE H 1.0 24.4 . 107 107 A 18 PHE H A 74 SER CB 1.0 25.0 . 108 108 A 87 SER CB A 18 PHE H 1.0 23.1 . 109 109 A 37 CYS CB A 19 GLY H 1.0 15.2 . 110 110 A 19 GLY H A 47 SER CB 1.0 25.0 . 111 111 A 56 SER CB A 19 GLY H 1.0 21.9 . 112 112 A 19 GLY H A 74 SER CB 1.0 25.0 . 113 113 A 87 SER CB A 19 GLY H 1.0 21.5 . 114 114 A 99 LEU CB A 19 GLY H 1.0 18.3 . 115 115 A 20 TYR CB A 29 LEU H 1.0 10.8 . 116 116 A 20 TYR CB A 30 ILE H 1.0 10.5 . 117 117 A 20 TYR CB A 31 ALA H 1.0 10.3 . 118 118 A 20 TYR CB A 32 GLY H 1.0 9.9 . 119 119 A 20 TYR CB A 33 LEU H 1.0 10.7 . 120 120 A 20 TYR CB A 35 VAL H 1.0 10.2 . 121 121 A 20 TYR CB A 36 GLY H 1.0 11.6 . 122 122 A 37 CYS CB A 20 TYR H 1.0 13.6 . 123 123 A 20 TYR CB A 39 ALA H 1.0 18.2 . 124 124 A 20 TYR CB A 40 GLY H 1.0 18.7 . 125 125 A 20 TYR CB A 41 TYR H 1.0 18.6 . 126 126 A 20 TYR CB A 42 GLY H 1.0 17.8 . 127 127 A 20 TYR CB A 43 ALA H 1.0 17.5 . 128 128 A 20 TYR CB A 44 TYR H 1.0 20.1 . 129 129 A 20 TYR CB A 45 ARG H 1.0 17.5 . 130 130 A 20 TYR CB A 46 VAL H 1.0 18.7 . 131 131 A 20 TYR H A 47 SER CB 1.0 25.0 . 132 132 A 20 TYR CB A 48 ASN H 1.0 25.0 . 133 133 A 20 TYR CB A 49 ASP H 1.0 25.0 . 134 134 A 20 TYR CB A 50 LYS H 1.0 25.0 . 135 135 A 20 TYR CB A 51 ARG H 1.0 25.0 . 136 136 A 20 TYR CB A 52 ASP H 1.0 25.0 . 137 137 A 20 TYR CB A 53 VAL H 1.0 22.6 . 138 138 A 20 TYR CB A 54 LYS H 1.0 25.0 . 139 139 A 20 TYR CB A 55 VAL H 1.0 23.8 . 140 140 A 20 TYR CB A 56 SER H 1.0 22.5 . 141 141 A 56 SER CB A 20 TYR H 1.0 24.2 . 142 142 A 20 TYR CB A 57 LEU H 1.0 22.4 . 143 143 A 20 TYR CB A 58 PHE H 1.0 25.0 . 144 144 A 20 TYR CB A 59 THR H 1.0 25.0 . 145 145 A 20 TYR CB A 60 ALA H 1.0 25.0 . 146 146 A 20 TYR CB A 61 PHE H 1.0 25.0 . 147 147 A 20 TYR CB A 62 PHE H 1.0 25.0 . 148 148 A 20 TYR CB A 63 LEU H 1.0 24.8 . 149 149 A 20 TYR CB A 64 ALA H 1.0 25.0 . 150 150 A 20 TYR CB A 65 THR H 1.0 25.0 . 151 151 A 20 TYR CB A 66 ILE H 1.0 25.0 . 152 152 A 20 TYR CB A 67 MET H 1.0 25.0 . 153 153 A 20 TYR CB A 68 GLY H 1.0 25.0 . 154 154 A 20 TYR CB A 69 VAL H 1.0 25.0 . 155 155 A 20 TYR CB A 70 ARG H 1.0 22.4 . 156 156 A 20 TYR CB A 71 PHE H 1.0 23.7 . 157 157 A 20 TYR CB A 72 LYS H 1.0 23.3 . 158 158 A 20 TYR CB A 73 ARG H 1.0 25.0 . 159 159 A 20 TYR CB A 74 SER H 1.0 25.0 . 160 160 A 20 TYR H A 74 SER CB 1.0 25.0 . 161 161 A 20 TYR CB A 75 LYS H 1.0 25.0 . 162 162 A 20 TYR CB A 76 LYS H 1.0 25.0 . 163 163 A 20 TYR CB A 77 ILE H 1.0 25.0 . 164 164 A 20 TYR CB A 78 MET H 1.0 25.0 . 165 165 A 20 TYR CB A 80 ALA H 1.0 20.5 . 166 166 A 20 TYR CB A 81 GLY H 1.0 22.1 . 167 167 A 20 TYR CB A 82 LEU H 1.0 22.5 . 168 168 A 20 TYR CB A 83 VAL H 1.0 18.2 . 169 169 A 20 TYR CB A 84 ALA H 1.0 23.4 . 170 170 A 20 TYR CB A 85 GLY H 1.0 22.1 . 171 171 A 20 TYR CB A 86 LEU H 1.0 20.7 . 172 172 A 20 TYR CB A 87 SER H 1.0 18.9 . 173 173 A 87 SER CB A 20 TYR H 1.0 20.3 . 174 174 A 20 TYR CB A 88 LEU H 1.0 16.4 . 175 175 A 20 TYR CB A 89 MET H 1.0 22.4 . 176 176 A 20 TYR CB A 90 MET H 1.0 23.4 . 177 177 A 20 TYR CB A 91 ILE H 1.0 22.2 . 178 178 A 20 TYR CB A 92 LEU H 1.0 22.1 . 179 179 A 20 TYR CB A 93 ARG H 1.0 22.9 . 180 180 A 20 TYR CB A 94 LEU H 1.0 24.7 . 181 181 A 20 TYR CB A 95 VAL H 1.0 21.2 . 182 182 A 20 TYR CB A 96 LEU H 1.0 21.5 . 183 183 A 20 TYR CB A 97 LEU H 1.0 20.4 . 184 184 A 20 TYR CB A 98 LEU H 1.0 23.5 . 185 185 A 20 TYR CB A 99 LEU H 1.0 17.3 . 186 186 A 99 LEU CB A 20 TYR H 1.0 16.5 . 187 187 A 37 CYS CB A 21 LYS H 1.0 16.9 . 188 188 A 21 LYS H A 47 SER CB 1.0 25.0 . 189 189 A 56 SER CB A 21 LYS H 1.0 24.5 . 190 190 A 21 LYS H A 74 SER CB 1.0 25.0 . 191 191 A 87 SER CB A 21 LYS H 1.0 21.7 . 192 192 A 37 CYS CB A 22 ARG H 1.0 16.8 . 193 193 A 22 ARG H A 47 SER CB 1.0 22.8 . 194 194 A 22 ARG H A 74 SER CB 1.0 25.0 . 195 195 A 87 SER CB A 22 ARG H 1.0 23.2 . 196 196 A 99 LEU CB A 22 ARG H 1.0 21.4 . 197 197 A 37 CYS CB A 23 ARG H 1.0 14.9 . 198 198 A 23 ARG H A 47 SER CB 1.0 23.6 . 199 199 A 56 SER CB A 23 ARG H 1.0 22.9 . 200 200 A 23 ARG H A 74 SER CB 1.0 25.0 . 201 201 A 87 SER CB A 23 ARG H 1.0 19.6 . 202 202 A 37 CYS CB A 24 GLY H 1.0 13.8 . 203 203 A 24 GLY H A 47 SER CB 1.0 24.4 . 204 204 A 56 SER CB A 24 GLY H 1.0 19.6 . 205 205 A 24 GLY H A 74 SER CB 1.0 22.3 . 206 206 A 87 SER CB A 24 GLY H 1.0 18.1 . 207 207 A 99 LEU CB A 24 GLY H 1.0 21.3 . 208 208 A 37 CYS CB A 25 GLY H 1.0 13.9 . 209 209 A 25 GLY H A 47 SER CB 1.0 25.0 . 210 210 A 56 SER CB A 25 GLY H 1.0 20.7 . 211 211 A 25 GLY H A 74 SER CB 1.0 20.2 . 212 212 A 87 SER CB A 25 GLY H 1.0 17.3 . 213 213 A 99 LEU CB A 25 GLY H 1.0 20.3 . 214 214 A 37 CYS CB A 26 VAL H 1.0 15.3 . 215 215 A 26 VAL H A 47 SER CB 1.0 25.0 . 216 216 A 56 SER CB A 26 VAL H 1.0 20.5 . 217 217 A 26 VAL H A 74 SER CB 1.0 18.9 . 218 218 A 87 SER CB A 26 VAL H 1.0 17.6 . 219 219 A 99 LEU CB A 26 VAL H 1.0 22.5 . 220 220 A 28 SER H A 47 SER CB 1.0 25.0 . 221 221 A 56 SER CB A 28 SER H 1.0 15.5 . 222 222 A 74 SER CB A 28 SER H 1.0 15.5 . 223 223 A 99 LEU CB A 28 SER H 1.0 24.4 . 224 224 A 37 CYS CB A 29 LEU H 1.0 9.3 . 225 225 A 29 LEU H A 47 SER CB 1.0 25.0 . 226 226 A 56 SER CB A 29 LEU H 1.0 15.6 . 227 227 A 29 LEU H A 74 SER CB 1.0 16.4 . 228 228 A 87 SER CB A 29 LEU H 1.0 12.7 . 229 229 A 99 LEU CB A 29 LEU H 1.0 23.8 . 230 230 A 30 ILE H A 47 SER CB 1.0 20.1 . 231 231 A 56 SER CB A 30 ILE H 1.0 15.9 . 232 232 A 30 ILE H A 74 SER CB 1.0 17.3 . 233 233 A 87 SER CB A 30 ILE H 1.0 11.7 . 234 234 A 99 LEU CB A 30 ILE H 1.0 18.7 . 235 235 A 31 ALA H A 47 SER CB 1.0 20.4 . 236 236 A 56 SER CB A 31 ALA H 1.0 13.8 . 237 237 A 31 ALA H A 74 SER CB 1.0 16.6 . 238 238 A 87 SER CB A 31 ALA H 1.0 11.9 . 239 239 A 99 LEU CB A 31 ALA H 1.0 22.4 . 240 240 A 32 GLY H A 47 SER CB 1.0 16.9 . 241 241 A 56 SER CB A 32 GLY H 1.0 11.6 . 242 242 A 32 GLY H A 74 SER CB 1.0 17.2 . 243 243 A 87 SER CB A 32 GLY H 1.0 10.9 . 244 244 A 99 LEU CB A 32 GLY H 1.0 19.5 . 245 245 A 33 LEU H A 74 SER CB 1.0 19.8 . 246 246 A 87 SER CB A 33 LEU H 1.0 10.4 . 247 247 A 99 LEU CB A 33 LEU H 1.0 17.5 . 248 248 A 35 VAL H A 47 SER CB 1.0 13.2 . 249 249 A 56 SER CB A 35 VAL H 1.0 9.7 . 250 250 A 35 VAL H A 74 SER CB 1.0 20.9 . 251 251 A 87 SER CB A 35 VAL H 1.0 12.7 . 252 252 A 99 LEU CB A 35 VAL H 1.0 17.1 . 253 253 A 36 GLY H A 47 SER CB 1.0 12.4 . 254 254 A 56 SER CB A 36 GLY H 1.0 7.2 . 255 255 A 36 GLY H A 74 SER CB 1.0 22.4 . 256 256 A 87 SER CB A 36 GLY H 1.0 10.9 . 257 257 A 99 LEU CB A 36 GLY H 1.0 17.2 . 258 258 A 37 CYS CB A 47 SER H 1.0 8.7 . 259 259 A 47 SER CB A 37 CYS H 1.0 8.1 . 260 260 A 37 CYS CB A 48 ASN H 1.0 11.6 . 261 261 A 37 CYS CB A 49 ASP H 1.0 12.3 . 262 262 A 37 CYS CB A 50 LYS H 1.0 10.3 . 263 263 A 37 CYS CB A 53 VAL H 1.0 9.1 . 264 264 A 37 CYS CB A 54 LYS H 1.0 9.9 . 265 265 A 37 CYS CB A 55 VAL H 1.0 6.7 . 266 266 A 37 CYS CB A 56 SER H 1.0 9.2 . 267 267 A 37 CYS CB A 57 LEU H 1.0 10.2 . 268 268 A 37 CYS CB A 58 PHE H 1.0 8.1 . 269 269 A 37 CYS CB A 59 THR H 1.0 6.9 . 270 270 A 37 CYS CB A 60 ALA H 1.0 9.9 . 271 271 A 37 CYS CB A 61 PHE H 1.0 12.8 . 272 272 A 37 CYS CB A 62 PHE H 1.0 11.3 . 273 273 A 37 CYS CB A 63 LEU H 1.0 13.9 . 274 274 A 37 CYS CB A 64 ALA H 1.0 11.3 . 275 275 A 37 CYS CB A 65 THR H 1.0 12.2 . 276 276 A 37 CYS CB A 66 ILE H 1.0 15.9 . 277 277 A 37 CYS CB A 67 MET H 1.0 14.3 . 278 278 A 37 CYS CB A 68 GLY H 1.0 16.2 . 279 279 A 37 CYS CB A 69 VAL H 1.0 18.1 . 280 280 A 37 CYS CB A 70 ARG H 1.0 19.3 . 281 281 A 37 CYS CB A 71 PHE H 1.0 21.7 . 282 282 A 37 CYS CB A 80 ALA H 1.0 17.1 . 283 283 A 37 CYS CB A 81 GLY H 1.0 14.7 . 284 284 A 37 CYS CB A 82 LEU H 1.0 12.3 . 285 285 A 37 CYS CB A 83 VAL H 1.0 14.4 . 286 286 A 37 CYS CB A 84 ALA H 1.0 12.8 . 287 287 A 37 CYS CB A 85 GLY H 1.0 10.5 . 288 288 A 37 CYS CB A 86 LEU H 1.0 11.8 . 289 289 A 37 CYS CB A 87 SER H 1.0 11.8 . 290 290 A 37 CYS CB A 88 LEU H 1.0 10.9 . 291 291 A 37 CYS CB A 89 MET H 1.0 10.6 . 292 292 A 37 CYS CB A 90 MET H 1.0 10.6 . 293 293 A 37 CYS CB A 91 ILE H 1.0 11.3 . 294 294 A 37 CYS CB A 92 LEU H 1.0 10.7 . 295 295 A 37 CYS CB A 93 ARG H 1.0 11.3 . 296 296 A 37 CYS CB A 94 LEU H 1.0 12.4 . 297 297 A 37 CYS CB A 95 VAL H 1.0 15.1 . 298 298 A 37 CYS CB A 96 LEU H 1.0 14.8 . 299 299 A 37 CYS CB A 97 LEU H 1.0 15.7 . 300 300 A 37 CYS CB A 98 LEU H 1.0 15.7 . 301 301 A 37 CYS CB A 99 LEU H 1.0 14.7 . 302 302 A 39 ALA H A 74 SER CB 1.0 25.0 . 303 303 A 87 SER CB A 39 ALA H 1.0 13.6 . 304 304 A 99 LEU CB A 39 ALA H 1.0 15.7 . 305 305 A 40 GLY H A 47 SER CB 1.0 7.5 . 306 306 A 40 GLY H A 74 SER CB 1.0 25.0 . 307 307 A 87 SER CB A 40 GLY H 1.0 12.3 . 308 308 A 99 LEU CB A 40 GLY H 1.0 12.7 . 309 309 A 56 SER CB A 41 TYR H 1.0 9.4 . 310 310 A 41 TYR H A 74 SER CB 1.0 25.0 . 311 311 A 87 SER CB A 41 TYR H 1.0 14.4 . 312 312 A 99 LEU CB A 41 TYR H 1.0 12.4 . 313 313 A 42 GLY H A 74 SER CB 1.0 25.0 . 314 314 A 87 SER CB A 42 GLY H 1.0 15.5 . 315 315 A 99 LEU CB A 42 GLY H 1.0 12.8 . 316 316 A 43 ALA H A 74 SER CB 1.0 25.0 . 317 317 A 87 SER CB A 43 ALA H 1.0 15.1 . 318 318 A 99 LEU CB A 43 ALA H 1.0 14.5 . 319 319 A 56 SER CB A 44 TYR H 1.0 7.6 . 320 320 A 44 TYR H A 74 SER CB 1.0 25.0 . 321 321 A 87 SER CB A 44 TYR H 1.0 19.7 . 322 322 A 99 LEU CB A 44 TYR H 1.0 11.1 . 323 323 A 56 SER CB A 46 VAL H 1.0 8.7 . 324 324 A 46 VAL H A 74 SER CB 1.0 25.0 . 325 325 A 99 LEU CB A 46 VAL H 1.0 13.6 . 326 326 A 47 SER CB A 52 ASP H 1.0 7.1 . 327 327 A 47 SER CB A 53 VAL H 1.0 8.2 . 328 328 A 47 SER CB A 54 LYS H 1.0 12.4 . 329 329 A 47 SER CB A 55 VAL H 1.0 5.9 . 330 330 A 47 SER CB A 56 SER H 1.0 8.1 . 331 331 A 47 SER CB A 58 PHE H 1.0 9.6 . 332 332 A 47 SER CB A 59 THR H 1.0 10.2 . 333 333 A 47 SER CB A 60 ALA H 1.0 13.4 . 334 334 A 47 SER CB A 61 PHE H 1.0 13.9 . 335 335 A 47 SER CB A 62 PHE H 1.0 13.5 . 336 336 A 47 SER CB A 63 LEU H 1.0 13.9 . 337 337 A 47 SER CB A 64 ALA H 1.0 16.6 . 338 338 A 47 SER CB A 65 THR H 1.0 17.4 . 339 339 A 47 SER CB A 66 ILE H 1.0 22.4 . 340 340 A 47 SER CB A 67 MET H 1.0 18.6 . 341 341 A 47 SER CB A 68 GLY H 1.0 25.0 . 342 342 A 47 SER CB A 69 VAL H 1.0 22.8 . 343 343 A 47 SER CB A 70 ARG H 1.0 22.3 . 344 344 A 47 SER CB A 71 PHE H 1.0 25.0 . 345 345 A 47 SER CB A 72 LYS H 1.0 25.0 . 346 346 A 74 SER CB A 47 SER H 1.0 25.0 . 347 347 A 47 SER CB A 77 ILE H 1.0 25.0 . 348 348 A 47 SER CB A 78 MET H 1.0 25.0 . 349 349 A 80 ALA H A 47 SER CB 1.0 25.0 . 350 350 A 47 SER CB A 81 GLY H 1.0 25.0 . 351 351 A 47 SER CB A 82 LEU H 1.0 25.0 . 352 352 A 83 VAL H A 47 SER CB 1.0 25.0 . 353 353 A 47 SER CB A 84 ALA H 1.0 25.0 . 354 354 A 47 SER CB A 85 GLY H 1.0 25.0 . 355 355 A 86 LEU H A 47 SER CB 1.0 23.6 . 356 356 A 87 SER H A 47 SER CB 1.0 24.3 . 357 357 A 88 LEU H A 47 SER CB 1.0 23.2 . 358 358 A 47 SER CB A 89 MET H 1.0 21.7 . 359 359 A 47 SER CB A 90 MET H 1.0 20.9 . 360 360 A 47 SER CB A 91 ILE H 1.0 21.9 . 361 361 A 47 SER CB A 92 LEU H 1.0 21.1 . 362 362 A 47 SER CB A 93 ARG H 1.0 18.7 . 363 363 A 47 SER CB A 94 LEU H 1.0 18.8 . 364 364 A 95 VAL H A 47 SER CB 1.0 19.3 . 365 365 A 47 SER CB A 96 LEU H 1.0 18.3 . 366 366 A 47 SER CB A 97 LEU H 1.0 17.5 . 367 367 A 47 SER CB A 98 LEU H 1.0 15.5 . 368 368 A 99 LEU H A 47 SER CB 1.0 14.8 . 369 369 A 74 SER CB A 48 ASN H 1.0 25.0 . 370 370 A 87 SER CB A 48 ASN H 1.0 22.5 . 371 371 A 99 LEU CB A 48 ASN H 1.0 15.5 . 372 372 A 56 SER CB A 49 ASP H 1.0 9.5 . 373 373 A 74 SER CB A 49 ASP H 1.0 25.0 . 374 374 A 87 SER CB A 49 ASP H 1.0 22.3 . 375 375 A 99 LEU CB A 49 ASP H 1.0 16.4 . 376 376 A 74 SER CB A 50 LYS H 1.0 25.0 . 377 377 A 87 SER CB A 50 LYS H 1.0 20.9 . 378 378 A 99 LEU CB A 50 LYS H 1.0 12.7 . 379 379 A 74 SER CB A 51 ARG H 1.0 25.0 . 380 380 A 87 SER CB A 51 ARG H 1.0 16.1 . 381 381 A 74 SER CB A 52 ASP H 1.0 25.0 . 382 382 A 87 SER CB A 52 ASP H 1.0 14.1 . 383 383 A 99 LEU CB A 52 ASP H 1.0 11.9 . 384 384 A 74 SER CB A 53 VAL H 1.0 25.0 . 385 385 A 87 SER CB A 53 VAL H 1.0 11.5 . 386 386 A 99 LEU CB A 53 VAL H 1.0 12.9 . 387 387 A 74 SER CB A 54 LYS H 1.0 25.0 . 388 388 A 87 SER CB A 54 LYS H 1.0 10.1 . 389 389 A 74 SER CB A 55 VAL H 1.0 25.0 . 390 390 A 87 SER CB A 55 VAL H 1.0 10.8 . 391 391 A 99 LEU CB A 55 VAL H 1.0 11.2 . 392 392 A 56 SER CB A 63 LEU H 1.0 6.4 . 393 393 A 56 SER CB A 65 THR H 1.0 7.3 . 394 394 A 56 SER CB A 66 ILE H 1.0 8.1 . 395 395 A 56 SER CB A 67 MET H 1.0 9.6 . 396 396 A 56 SER CB A 72 LYS H 1.0 14.9 . 397 397 A 56 SER CB A 73 ARG H 1.0 17.2 . 398 398 A 56 SER CB A 74 SER H 1.0 17.1 . 399 399 A 74 SER CB A 56 SER H 1.0 21.0 . 400 400 A 56 SER CB A 80 ALA H 1.0 14.6 . 401 401 A 56 SER CB A 81 GLY H 1.0 13.3 . 402 402 A 56 SER CB A 82 LEU H 1.0 12.3 . 403 403 A 56 SER CB A 83 VAL H 1.0 10.1 . 404 404 A 56 SER CB A 84 ALA H 1.0 10.2 . 405 405 A 56 SER CB A 85 GLY H 1.0 8.2 . 406 406 A 56 SER CB A 86 LEU H 1.0 6.6 . 407 407 A 56 SER CB A 87 SER H 1.0 6.2 . 408 408 A 87 SER CB A 56 SER H 1.0 10.4 . 409 409 A 56 SER CB A 88 LEU H 1.0 8.7 . 410 410 A 56 SER CB A 91 ILE H 1.0 6.9 . 411 411 A 56 SER CB A 92 LEU H 1.0 8.4 . 412 412 A 56 SER CB A 93 ARG H 1.0 7.8 . 413 413 A 56 SER CB A 94 LEU H 1.0 9.7 . 414 414 A 56 SER CB A 95 VAL H 1.0 10.2 . 415 415 A 56 SER CB A 96 LEU H 1.0 10.9 . 416 416 A 56 SER CB A 97 LEU H 1.0 11.5 . 417 417 A 56 SER CB A 98 LEU H 1.0 13.1 . 418 418 A 56 SER CB A 99 LEU H 1.0 13.8 . 419 419 A 99 LEU CB A 56 SER H 1.0 9.3 . 420 420 A 74 SER CB A 57 LEU H 1.0 17.4 . 421 421 A 87 SER CB A 57 LEU H 1.0 8.3 . 422 422 A 99 LEU CB A 57 LEU H 1.0 10.6 . 423 423 A 87 SER CB A 58 PHE H 1.0 10.9 . 424 424 A 99 LEU CB A 58 PHE H 1.0 15.7 . 425 425 A 74 SER CB A 59 THR H 1.0 15.1 . 426 426 A 87 SER CB A 59 THR H 1.0 10.7 . 427 427 A 99 LEU CB A 59 THR H 1.0 17.6 . 428 428 A 74 SER CB A 60 ALA H 1.0 18.3 . 429 429 A 87 SER CB A 60 ALA H 1.0 8.9 . 430 430 A 99 LEU CB A 60 ALA H 1.0 18.8 . 431 431 A 74 SER CB A 61 PHE H 1.0 18.1 . 432 432 A 87 SER CB A 61 PHE H 1.0 10.8 . 433 433 A 99 LEU CB A 61 PHE H 1.0 20.9 . 434 434 A 74 SER CB A 62 PHE H 1.0 18.9 . 435 435 A 87 SER CB A 62 PHE H 1.0 13.1 . 436 436 A 99 LEU CB A 62 PHE H 1.0 21.7 . 437 437 A 74 SER CB A 63 LEU H 1.0 12.7 . 438 438 A 87 SER CB A 63 LEU H 1.0 10.5 . 439 439 A 99 LEU CB A 63 LEU H 1.0 21.5 . 440 440 A 74 SER CB A 64 ALA H 1.0 9.7 . 441 441 A 87 SER CB A 64 ALA H 1.0 10.5 . 442 442 A 99 LEU CB A 64 ALA H 1.0 21.1 . 443 443 A 87 SER CB A 65 THR H 1.0 13.4 . 444 444 A 99 LEU CB A 65 THR H 1.0 25.0 . 445 445 A 74 SER CB A 66 ILE H 1.0 15.9 . 446 446 A 87 SER CB A 66 ILE H 1.0 14.9 . 447 447 A 99 LEU CB A 66 ILE H 1.0 20.5 . 448 448 A 74 SER CB A 67 MET H 1.0 14.8 . 449 449 A 87 SER CB A 67 MET H 1.0 15.4 . 450 450 A 99 LEU CB A 67 MET H 1.0 25.0 . 451 451 A 74 SER CB A 68 GLY H 1.0 12.9 . 452 452 A 87 SER CB A 68 GLY H 1.0 13.5 . 453 453 A 99 LEU CB A 68 GLY H 1.0 25.0 . 454 454 A 87 SER CB A 69 VAL H 1.0 15.8 . 455 455 A 99 LEU CB A 69 VAL H 1.0 25.0 . 456 456 A 87 SER CB A 70 ARG H 1.0 13.8 . 457 457 A 99 LEU CB A 70 ARG H 1.0 22.6 . 458 458 A 74 SER CB A 71 PHE H 1.0 7.6 . 459 459 A 99 LEU CB A 71 PHE H 1.0 23.2 . 460 460 A 87 SER H A 74 SER CB 1.0 10.5 . 461 461 A 74 SER CB A 89 MET H 1.0 20.4 . 462 462 A 74 SER CB A 90 MET H 1.0 22.1 . 463 463 A 74 SER CB A 91 ILE H 1.0 22.6 . 464 464 A 74 SER CB A 92 LEU H 1.0 24.9 . 465 465 A 74 SER CB A 93 ARG H 1.0 25.0 . 466 466 A 74 SER CB A 94 LEU H 1.0 25.0 . 467 467 A 95 VAL H A 74 SER CB 1.0 25.0 . 468 468 A 74 SER CB A 96 LEU H 1.0 25.0 . 469 469 A 74 SER CB A 97 LEU H 1.0 25.0 . 470 470 A 74 SER CB A 98 LEU H 1.0 25.0 . 471 471 A 99 LEU H A 74 SER CB 1.0 25.0 . 472 472 A 99 LEU CB A 77 ILE H 1.0 23.2 . 473 473 A 99 LEU CB A 78 MET H 1.0 23.7 . 474 474 A 99 LEU CB A 80 ALA H 1.0 25.0 . 475 475 A 99 LEU CB A 81 GLY H 1.0 22.4 . 476 476 A 99 LEU CB A 82 LEU H 1.0 20.2 . 477 477 A 99 LEU CB A 83 VAL H 1.0 18.7 . 478 478 A 99 LEU CB A 84 ALA H 1.0 20.1 . 479 479 A 99 LEU CB A 85 GLY H 1.0 19.6 . 480 480 A 99 LEU CB A 86 LEU H 1.0 18.5 . 481 481 A 87 SER CB A 96 LEU H 1.0 9.4 . 482 482 A 87 SER CB A 97 LEU H 1.0 12.4 . 483 483 A 87 SER CB A 98 LEU H 1.0 14.8 . 484 484 A 87 SER CB A 99 LEU H 1.0 17.7 . 485 485 A 99 LEU CB A 87 SER H 1.0 15.8 . 486 486 A 99 LEU CB A 88 LEU H 1.0 16.7 . 487 487 A 99 LEU CB A 89 MET H 1.0 13.5 . 488 488 A 99 LEU CB A 90 MET H 1.0 13.4 . 489 489 A 99 LEU CB A 92 LEU H 1.0 7.1 . stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-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 19 GLY H A 15 GLY O 1.0 . 1.8 2 2 A 15 GLY O A 19 GLY N 1.0 . 2.7 3 3 A 18 PHE H A 14 PHE O 1.0 . 1.8 4 4 A 14 PHE O A 18 PHE N 1.0 . 2.7 5 5 A 17 ILE H A 13 THR O 1.0 . 1.8 6 6 A 13 THR O A 17 ILE N 1.0 . 2.7 7 7 A 16 SER H A 12 VAL O 1.0 . 1.8 8 8 A 12 VAL O A 16 SER N 1.0 . 2.7 9 9 A 15 GLY H A 11 LEU O 1.0 . 1.8 10 10 A 11 LEU O A 15 GLY N 1.0 . 2.7 11 11 A 14 PHE H A 10 ALA O 1.0 . 1.8 12 12 A 10 ALA O A 14 PHE N 1.0 . 2.7 13 13 A 13 THR H A 9 ALA O 1.0 . 1.8 14 14 A 9 ALA O A 13 THR N 1.0 . 2.7 15 15 A 12 VAL H A 8 TYR O 1.0 . 1.8 16 16 A 8 TYR O A 12 VAL N 1.0 . 2.7 17 17 A 44 TYR H A 40 GLY O 1.0 . 1.8 18 18 A 40 GLY O A 44 TYR N 1.0 . 2.7 19 19 A 43 ALA H A 39 ALA O 1.0 . 1.8 20 20 A 39 ALA O A 43 ALA N 1.0 . 2.7 21 21 A 42 GLY H A 38 LEU O 1.0 . 1.8 22 22 A 38 LEU O A 42 GLY N 1.0 . 2.7 23 23 A 41 TYR H A 37 CYS O 1.0 . 1.8 24 24 A 37 CYS O A 41 TYR N 1.0 . 2.7 25 25 A 40 GLY H A 36 GLY O 1.0 . 1.8 26 26 A 36 GLY O A 40 GLY N 1.0 . 2.7 27 27 A 39 ALA H A 35 VAL O 1.0 . 1.8 28 28 A 35 VAL O A 39 ALA N 1.0 . 2.7 29 29 A 38 LEU H A 34 PHE O 1.0 . 1.8 30 30 A 34 PHE O A 38 LEU N 1.0 . 2.7 31 31 A 37 CYS H A 33 LEU O 1.0 . 1.8 32 32 A 33 LEU O A 37 CYS N 1.0 . 2.7 33 33 A 36 GLY H A 32 GLY O 1.0 . 1.8 34 34 A 32 GLY O A 36 GLY N 1.0 . 2.7 35 35 A 35 VAL H A 31 ALA O 1.0 . 1.8 36 36 A 31 ALA O A 35 VAL N 1.0 . 2.7 37 37 A 34 PHE H A 30 ILE O 1.0 . 1.8 38 38 A 30 ILE O A 34 PHE N 1.0 . 2.7 39 39 A 33 LEU H A 29 LEU O 1.0 . 1.8 40 40 A 29 LEU O A 33 LEU N 1.0 . 2.7 41 41 A 32 GLY H A 28 SER O 1.0 . 1.8 42 42 A 28 SER O A 32 GLY N 1.0 . 2.7 43 43 A 68 GLY H A 64 ALA O 1.0 . 1.8 44 44 A 64 ALA O A 68 GLY N 1.0 . 2.7 45 45 A 67 MET H A 63 LEU O 1.0 . 1.8 46 46 A 63 LEU O A 67 MET N 1.0 . 2.7 47 47 A 66 ILE H A 62 PHE O 1.0 . 1.8 48 48 A 62 PHE O A 66 ILE N 1.0 . 2.7 49 49 A 65 THR H A 61 PHE O 1.0 . 1.8 50 50 A 61 PHE O A 65 THR N 1.0 . 2.7 51 51 A 64 ALA H A 60 ALA O 1.0 . 1.8 52 52 A 60 ALA O A 64 ALA N 1.0 . 2.7 53 53 A 63 LEU H A 59 THR O 1.0 . 1.8 54 54 A 59 THR O A 63 LEU N 1.0 . 2.7 55 55 A 62 PHE H A 58 PHE O 1.0 . 1.8 56 56 A 58 PHE O A 62 PHE N 1.0 . 2.7 57 57 A 61 PHE H A 57 LEU O 1.0 . 1.8 58 58 A 57 LEU O A 61 PHE N 1.0 . 2.7 59 59 A 60 ALA H A 56 SER O 1.0 . 1.8 60 60 A 56 SER O A 60 ALA N 1.0 . 2.7 61 61 A 59 THR H A 55 VAL O 1.0 . 1.8 62 62 A 55 VAL O A 59 THR N 1.0 . 2.7 63 63 A 58 PHE H A 54 LYS O 1.0 . 1.8 64 64 A 54 LYS O A 58 PHE N 1.0 . 2.7 65 65 A 57 LEU H A 53 VAL O 1.0 . 1.8 66 66 A 53 VAL O A 57 LEU N 1.0 . 2.7 67 67 A 94 LEU H A 90 MET O 1.0 . 1.8 68 68 A 90 MET O A 94 LEU N 1.0 . 2.7 69 69 A 93 ARG H A 89 MET O 1.0 . 1.8 70 70 A 89 MET O A 93 ARG N 1.0 . 2.7 71 71 A 92 LEU H A 88 LEU O 1.0 . 1.8 72 72 A 88 LEU O A 92 LEU N 1.0 . 2.7 73 73 A 91 ILE H A 87 SER O 1.0 . 1.8 74 74 A 87 SER O A 91 ILE N 1.0 . 2.7 75 75 A 90 MET H A 86 LEU O 1.0 . 1.8 76 76 A 86 LEU O A 90 MET N 1.0 . 2.7 77 77 A 89 MET H A 85 GLY O 1.0 . 1.8 78 78 A 85 GLY O A 89 MET N 1.0 . 2.7 79 79 A 88 LEU H A 84 ALA O 1.0 . 1.8 80 80 A 84 ALA O A 88 LEU N 1.0 . 2.7 81 81 A 87 SER H A 83 VAL O 1.0 . 1.8 82 82 A 83 VAL O A 87 SER N 1.0 . 2.7 83 83 A 86 LEU H A 82 LEU O 1.0 . 1.8 84 84 A 82 LEU O A 86 LEU N 1.0 . 2.7 85 85 A 85 GLY H A 81 GLY O 1.0 . 1.8 86 86 A 81 GLY O A 85 GLY N 1.0 . 2.7 87 87 A 84 ALA H A 80 ALA O 1.0 . 1.8 88 88 A 80 ALA O A 84 ALA N 1.0 . 2.7 89 89 A 19 GLY H A 15 GLY O 1.0 . 2.0 90 90 A 15 GLY O A 19 GLY N 1.0 . 3.0 91 91 A 18 PHE H A 14 PHE O 1.0 . 2.0 92 92 A 14 PHE O A 18 PHE N 1.0 . 3.0 93 93 A 17 ILE H A 13 THR O 1.0 . 2.0 94 94 A 13 THR O A 17 ILE N 1.0 . 3.0 95 95 A 16 SER H A 12 VAL O 1.0 . 2.0 96 96 A 12 VAL O A 16 SER N 1.0 . 3.0 97 97 A 15 GLY H A 11 LEU O 1.0 . 2.0 98 98 A 11 LEU O A 15 GLY N 1.0 . 3.0 99 99 A 14 PHE H A 10 ALA O 1.0 . 2.0 100 100 A 10 ALA O A 14 PHE N 1.0 . 3.0 101 101 A 13 THR H A 9 ALA O 1.0 . 2.0 102 102 A 9 ALA O A 13 THR N 1.0 . 3.0 103 103 A 12 VAL H A 8 TYR O 1.0 . 2.0 104 104 A 8 TYR O A 12 VAL N 1.0 . 3.0 105 105 A 44 TYR H A 40 GLY O 1.0 . 2.0 106 106 A 40 GLY O A 44 TYR N 1.0 . 3.0 107 107 A 43 ALA H A 39 ALA O 1.0 . 2.0 108 108 A 39 ALA O A 43 ALA N 1.0 . 3.0 109 109 A 42 GLY H A 38 LEU O 1.0 . 2.0 110 110 A 38 LEU O A 42 GLY N 1.0 . 3.0 111 111 A 41 TYR H A 37 CYS O 1.0 . 2.0 112 112 A 37 CYS O A 41 TYR N 1.0 . 3.0 113 113 A 40 GLY H A 36 GLY O 1.0 . 2.0 114 114 A 36 GLY O A 40 GLY N 1.0 . 3.0 115 115 A 39 ALA H A 35 VAL O 1.0 . 2.0 116 116 A 35 VAL O A 39 ALA N 1.0 . 3.0 117 117 A 38 LEU H A 34 PHE O 1.0 . 2.0 118 118 A 34 PHE O A 38 LEU N 1.0 . 3.0 119 119 A 37 CYS H A 33 LEU O 1.0 . 2.0 120 120 A 33 LEU O A 37 CYS N 1.0 . 3.0 121 121 A 36 GLY H A 32 GLY O 1.0 . 2.0 122 122 A 32 GLY O A 36 GLY N 1.0 . 3.0 123 123 A 35 VAL H A 31 ALA O 1.0 . 2.0 124 124 A 31 ALA O A 35 VAL N 1.0 . 3.0 125 125 A 34 PHE H A 30 ILE O 1.0 . 2.0 126 126 A 30 ILE O A 34 PHE N 1.0 . 3.0 127 127 A 33 LEU H A 29 LEU O 1.0 . 2.0 128 128 A 29 LEU O A 33 LEU N 1.0 . 3.0 129 129 A 32 GLY H A 28 SER O 1.0 . 2.0 130 130 A 28 SER O A 32 GLY N 1.0 . 3.0 131 131 A 68 GLY H A 64 ALA O 1.0 . 2.0 132 132 A 64 ALA O A 68 GLY N 1.0 . 3.0 133 133 A 67 MET H A 63 LEU O 1.0 . 2.0 134 134 A 63 LEU O A 67 MET N 1.0 . 3.0 135 135 A 66 ILE H A 62 PHE O 1.0 . 2.0 136 136 A 62 PHE O A 66 ILE N 1.0 . 3.0 137 137 A 65 THR H A 61 PHE O 1.0 . 2.0 138 138 A 61 PHE O A 65 THR N 1.0 . 3.0 139 139 A 64 ALA H A 60 ALA O 1.0 . 2.0 140 140 A 60 ALA O A 64 ALA N 1.0 . 3.0 141 141 A 63 LEU H A 59 THR O 1.0 . 2.0 142 142 A 59 THR O A 63 LEU N 1.0 . 3.0 143 143 A 62 PHE H A 58 PHE O 1.0 . 2.0 144 144 A 58 PHE O A 62 PHE N 1.0 . 3.0 145 145 A 61 PHE H A 57 LEU O 1.0 . 2.0 146 146 A 57 LEU O A 61 PHE N 1.0 . 3.0 147 147 A 60 ALA H A 56 SER O 1.0 . 2.0 148 148 A 56 SER O A 60 ALA N 1.0 . 3.0 149 149 A 59 THR H A 55 VAL O 1.0 . 2.0 150 150 A 55 VAL O A 59 THR N 1.0 . 3.0 151 151 A 58 PHE H A 54 LYS O 1.0 . 2.0 152 152 A 54 LYS O A 58 PHE N 1.0 . 3.0 153 153 A 57 LEU H A 53 VAL O 1.0 . 2.0 154 154 A 53 VAL O A 57 LEU N 1.0 . 3.0 155 155 A 94 LEU H A 90 MET O 1.0 . 2.0 156 156 A 90 MET O A 94 LEU N 1.0 . 3.0 157 157 A 93 ARG H A 89 MET O 1.0 . 2.0 158 158 A 89 MET O A 93 ARG N 1.0 . 3.0 159 159 A 92 LEU H A 88 LEU O 1.0 . 2.0 160 160 A 88 LEU O A 92 LEU N 1.0 . 3.0 161 161 A 91 ILE H A 87 SER O 1.0 . 2.0 162 162 A 87 SER O A 91 ILE N 1.0 . 3.0 163 163 A 90 MET H A 86 LEU O 1.0 . 2.0 164 164 A 86 LEU O A 90 MET N 1.0 . 3.0 165 165 A 89 MET H A 85 GLY O 1.0 . 2.0 166 166 A 85 GLY O A 89 MET N 1.0 . 3.0 167 167 A 88 LEU H A 84 ALA O 1.0 . 2.0 168 168 A 84 ALA O A 88 LEU N 1.0 . 3.0 169 169 A 87 SER H A 83 VAL O 1.0 . 2.0 170 170 A 83 VAL O A 87 SER N 1.0 . 3.0 171 171 A 86 LEU H A 82 LEU O 1.0 . 2.0 172 172 A 82 LEU O A 86 LEU N 1.0 . 3.0 173 173 A 85 GLY H A 81 GLY O 1.0 . 2.0 174 174 A 81 GLY O A 85 GLY N 1.0 . 3.0 175 175 A 84 ALA H A 80 ALA O 1.0 . 2.0 176 176 A 80 ALA O A 84 ALA N 1.0 . 3.0 stop_ save_