data_nef_c16947_2ksd 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 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 LYS middle . . 3 A 3 GLN middle . . 4 A 4 ILE middle . . 5 A 5 ARG middle . . 6 A 6 LEU middle . . 7 A 7 LEU middle . . 8 A 8 ALA middle . . 9 A 9 GLN middle . . 10 A 10 TYR middle . . 11 A 11 TYR middle . . 12 A 12 VAL middle . . 13 A 13 ASP middle . . 14 A 14 LEU middle . . 15 A 15 MET middle . . 16 A 16 MET middle . . 17 A 17 LYS middle . . 18 A 18 LEU middle . . 19 A 19 GLY middle . false 20 A 20 LEU middle . . 21 A 21 VAL middle . . 22 A 22 ARG middle . . 23 A 23 PHE middle . . 24 A 24 SER middle . . 25 A 25 MET middle . . 26 A 26 LEU middle . . 27 A 27 LEU middle . . 28 A 28 ALA middle . . 29 A 29 LEU middle . . 30 A 30 ALA middle . . 31 A 31 LEU middle . . 32 A 32 VAL middle . . 33 A 33 VAL middle . . 34 A 34 LEU middle . . 35 A 35 ALA middle . . 36 A 36 ILE middle . . 37 A 37 VAL middle . . 38 A 38 VAL middle . . 39 A 39 GLN middle . . 40 A 40 MET middle . . 41 A 41 ALA middle . . 42 A 42 VAL middle . . 43 A 43 THR middle . . 44 A 44 MET middle . . 45 A 45 VAL middle . . 46 A 46 LEU middle . . 47 A 47 HIS middle . . 48 A 48 GLY middle . false 49 A 49 GLN middle . . 50 A 50 VAL middle . . 51 A 51 GLU middle . . 52 A 52 SER middle . . 53 A 53 ILE middle . . 54 A 54 ASP middle . . 55 A 55 VAL middle . . 56 A 56 ILE middle . . 57 A 57 ARG middle . . 58 A 58 SER middle . . 59 A 59 ILE middle . . 60 A 60 PHE middle . . 61 A 61 PHE middle . . 62 A 62 GLY middle . false 63 A 63 LEU middle . . 64 A 64 LEU middle . . 65 A 65 ILE middle . . 66 A 66 THR middle . . 67 A 67 PRO middle . false 68 A 68 TRP middle . . 69 A 69 ALA middle . . 70 A 70 VAL middle . . 71 A 71 TYR middle . . 72 A 72 PHE middle . . 73 A 73 LEU middle . . 74 A 74 SER middle . . 75 A 75 VAL middle . . 76 A 76 VAL middle . . 77 A 77 VAL middle . . 78 A 78 GLU middle . . 79 A 79 GLN middle . . 80 A 80 LEU middle . . 81 A 81 GLU middle . . 82 A 82 GLU middle . . 83 A 83 SER middle . . 84 A 84 ARG middle . . 85 A 85 GLN middle . . 86 A 86 ARG middle . . 87 A 87 LEU middle . . 88 A 88 SER middle . . 89 A 89 ARG middle . . 90 A 90 LEU middle . . 91 A 91 VAL middle . . 92 A 92 GLN middle . . 93 A 93 LYS middle . . 94 A 94 LEU middle . . 95 A 95 GLU middle . . 96 A 96 GLU middle . . 97 A 97 MET middle . . 98 A 98 ARG middle . . 99 A 99 GLU middle . . 100 A 100 ARG middle . . 101 A 101 ASP middle . . 102 A 102 LEU middle . . 103 A 103 SER middle . . 104 A 104 LEU middle . . 105 A 105 ASN middle . . 106 A 106 VAL middle . . 107 A 107 GLN middle . . 108 A 108 LEU middle . . 109 A 109 LYS middle . . 110 A 110 ASP middle . . 111 A 111 ASN middle . . 112 A 112 ILE middle . . 113 A 113 ALA middle . . 114 A 114 GLN middle . . 115 A 115 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 C C 13 178.081 0.010 A 1 MET CA C 13 55.362 0.010 A 1 MET CB C 13 31.100 0.010 A 2 LYS H H 1 8.697 0.010 A 2 LYS HA H 1 4.107 0.010 A 2 LYS HBx H 1 1.891 0.010 A 2 LYS HBy H 1 1.891 0.010 A 2 LYS HGx H 1 2.003 0.010 A 2 LYS HGy H 1 2.003 0.010 A 2 LYS C C 13 178.636 0.010 A 2 LYS CA C 13 58.923 0.010 A 2 LYS CB C 13 31.043 0.010 A 2 LYS N N 15 120.191 0.010 A 3 GLN H H 1 8.151 0.010 A 3 GLN HA H 1 4.242 0.010 A 3 GLN HBx H 1 2.114 0.010 A 3 GLN HBy H 1 2.114 0.010 A 3 GLN HGx H 1 2.385 0.010 A 3 GLN HGy H 1 2.385 0.010 A 3 GLN C C 13 178.135 0.010 A 3 GLN CA C 13 58.664 0.010 A 3 GLN CB C 13 26.965 0.010 A 3 GLN N N 15 118.562 0.010 A 4 ILE H H 1 8.021 0.010 A 4 ILE HA H 1 3.898 0.010 A 4 ILE HB H 1 1.827 0.010 A 4 ILE C C 13 177.322 0.010 A 4 ILE CA C 13 63.719 0.010 A 4 ILE CB C 13 36.097 0.010 A 4 ILE N N 15 119.555 0.010 A 5 ARG H H 1 8.168 0.010 A 5 ARG HA H 1 4.054 0.010 A 5 ARG HBx H 1 2.034 0.010 A 5 ARG HBy H 1 2.034 0.010 A 5 ARG C C 13 178.572 0.010 A 5 ARG CA C 13 59.153 0.010 A 5 ARG CB C 13 28.631 0.010 A 5 ARG N N 15 119.812 0.010 A 6 LEU H H 1 7.736 0.010 A 6 LEU HA H 1 4.236 0.010 A 6 LEU HBx H 1 1.979 0.010 A 6 LEU HBy H 1 1.979 0.010 A 6 LEU HDx% H 1 1.030 0.010 A 6 LEU HDy% H 1 1.030 0.010 A 6 LEU HG H 1 1.787 0.010 A 6 LEU C C 13 179.222 0.010 A 6 LEU CA C 13 57.114 0.010 A 6 LEU CB C 13 40.692 0.010 A 6 LEU N N 15 120.236 0.010 A 7 LEU H H 1 8.086 0.010 A 7 LEU HA H 1 4.226 0.010 A 7 LEU HBx H 1 2.018 0.010 A 7 LEU HBy H 1 2.018 0.010 A 7 LEU HDx% H 1 1.038 0.010 A 7 LEU HDy% H 1 1.038 0.010 A 7 LEU HG H 1 1.827 0.010 A 7 LEU C C 13 178.552 0.010 A 7 LEU CA C 13 57.449 0.010 A 7 LEU CB C 13 40.749 0.010 A 7 LEU N N 15 120.223 0.010 A 8 ALA H H 1 8.460 0.010 A 8 ALA HA H 1 4.211 0.010 A 8 ALA HB% H 1 1.632 0.010 A 8 ALA C C 13 179.007 0.010 A 8 ALA CA C 13 54.993 0.010 A 8 ALA CB C 13 17.546 0.010 A 8 ALA N N 15 120.526 0.010 A 9 GLN H H 1 8.041 0.010 A 9 GLN HA H 1 4.049 0.010 A 9 GLN HBx H 1 2.291 0.010 A 9 GLN HBy H 1 2.291 0.010 A 9 GLN HGx H 1 2.496 0.010 A 9 GLN HGy H 1 2.496 0.010 A 9 GLN C C 13 178.049 0.010 A 9 GLN CA C 13 58.425 0.010 A 9 GLN CB C 13 27.654 0.010 A 9 GLN N N 15 117.031 0.010 A 10 TYR H H 1 8.060 0.010 A 10 TYR HA H 1 4.234 0.010 A 10 TYR HBx H 1 3.612 0.010 A 10 TYR HBy H 1 3.612 0.010 A 10 TYR C C 13 177.995 0.010 A 10 TYR CA C 13 60.335 0.010 A 10 TYR CB C 13 37.131 0.010 A 10 TYR N N 15 119.338 0.010 A 11 TYR H H 1 8.275 0.010 A 11 TYR HA H 1 4.349 0.010 A 11 TYR C C 13 177.101 0.010 A 11 TYR CA C 13 61.713 0.010 A 11 TYR CB C 13 37.361 0.010 A 11 TYR N N 15 119.234 0.010 A 12 VAL H H 1 8.357 0.010 A 12 VAL HB H 1 1.843 0.010 A 12 VAL HGx% H 1 1.050 0.010 A 12 VAL HGy% H 1 1.050 0.010 A 12 VAL C C 13 177.928 0.010 A 12 VAL CA C 13 66.480 0.010 A 12 VAL CB C 13 30.181 0.010 A 12 VAL N N 15 120.273 0.010 A 13 ASP H H 1 8.229 0.010 A 13 ASP C C 13 178.458 0.010 A 13 ASP CA C 13 55.994 0.010 A 13 ASP CB C 13 38.050 0.010 A 13 ASP N N 15 119.461 0.010 A 14 LEU H H 1 8.097 0.010 A 14 LEU HA H 1 4.039 0.010 A 14 LEU C C 13 178.684 0.010 A 14 LEU CA C 13 57.286 0.010 A 14 LEU CB C 13 40.864 0.010 A 14 LEU N N 15 121.016 0.010 A 15 MET H H 1 8.227 0.010 A 15 MET C C 13 179.029 0.010 A 15 MET CA C 13 58.210 0.010 A 15 MET N N 15 119.202 0.010 A 16 MET H H 1 8.268 0.010 A 16 MET C C 13 178.813 0.010 A 16 MET CA C 13 57.068 0.010 A 16 MET N N 15 117.775 0.010 A 17 LYS HA H 1 4.419 0.010 A 17 LYS C C 13 178.250 0.010 A 17 LYS CA C 13 57.889 0.010 A 18 LEU H H 1 8.084 0.010 A 18 LEU HA H 1 4.220 0.010 A 18 LEU HBx H 1 2.032 0.010 A 18 LEU HBy H 1 2.032 0.010 A 18 LEU HDx% H 1 0.990 0.010 A 18 LEU HDy% H 1 0.990 0.010 A 18 LEU CA C 13 55.410 0.010 A 18 LEU CB C 13 42.415 0.010 A 18 LEU N N 15 117.110 0.010 A 19 GLY H H 1 7.868 0.010 A 19 GLY HAy H 1 4.471 0.010 A 19 GLY HAx H 1 4.051 0.010 A 19 GLY CA C 13 44.540 0.010 A 19 GLY N N 15 108.175 0.010 A 20 LEU H H 1 8.385 0.010 A 20 LEU HA H 1 4.760 0.010 A 20 LEU HBx H 1 1.746 0.010 A 20 LEU HBy H 1 1.746 0.010 A 20 LEU CA C 13 56.999 0.010 A 20 LEU CB C 13 41.663 0.010 A 20 LEU N N 15 120.055 0.010 A 24 SER H H 1 8.347 0.010 A 24 SER CA C 13 62.168 0.010 A 24 SER CB C 13 64.987 0.010 A 24 SER N N 15 115.435 0.010 A 25 MET HBx H 1 2.273 0.010 A 25 MET HBy H 1 2.273 0.010 A 25 MET C C 13 177.219 0.010 A 25 MET CA C 13 58.463 0.010 A 26 LEU H H 1 7.851 0.010 A 26 LEU HA H 1 4.230 0.010 A 26 LEU HBx H 1 1.867 0.010 A 26 LEU HBy H 1 1.867 0.010 A 26 LEU CA C 13 57.171 0.010 A 26 LEU CB C 13 40.577 0.010 A 26 LEU N N 15 119.549 0.010 A 27 LEU H H 1 8.305 0.010 A 27 LEU HA H 1 4.276 0.010 A 27 LEU HBx H 1 1.935 0.010 A 27 LEU HBy H 1 1.935 0.010 A 27 LEU CA C 13 56.609 0.010 A 27 LEU CB C 13 39.562 0.010 A 27 LEU N N 15 119.492 0.010 A 28 ALA H H 1 8.255 0.010 A 28 ALA HA H 1 4.207 0.010 A 28 ALA HB% H 1 1.602 0.010 A 28 ALA C C 13 178.932 0.010 A 28 ALA CA C 13 54.821 0.010 A 28 ALA CB C 13 17.488 0.010 A 28 ALA N N 15 120.360 0.010 A 29 LEU H H 1 7.981 0.010 A 29 LEU HA H 1 4.001 0.010 A 29 LEU HBx H 1 1.825 0.010 A 29 LEU HBy H 1 1.825 0.010 A 29 LEU HDx% H 1 0.940 0.010 A 29 LEU HDy% H 1 0.940 0.010 A 29 LEU HG H 1 1.523 0.010 A 29 LEU C C 13 178.102 0.010 A 29 LEU CA C 13 57.401 0.010 A 29 LEU CB C 13 40.635 0.010 A 29 LEU N N 15 116.785 0.010 A 30 ALA H H 1 8.374 0.010 A 30 ALA HA H 1 3.963 0.010 A 30 ALA HB% H 1 1.367 0.010 A 30 ALA C C 13 178.856 0.010 A 30 ALA CA C 13 54.759 0.010 A 30 ALA CB C 13 16.857 0.010 A 30 ALA N N 15 120.649 0.010 A 31 LEU H H 1 8.210 0.010 A 31 LEU HA H 1 4.488 0.010 A 31 LEU HBx H 1 1.752 0.010 A 31 LEU HBy H 1 1.752 0.010 A 31 LEU HDx% H 1 1.002 0.010 A 31 LEU HDy% H 1 1.002 0.010 A 31 LEU C C 13 178.436 0.010 A 31 LEU CA C 13 57.487 0.010 A 31 LEU CB C 13 40.429 0.010 A 31 LEU N N 15 117.007 0.010 A 32 VAL H H 1 8.027 0.010 A 32 VAL HB H 1 1.836 0.010 A 32 VAL C C 13 177.489 0.010 A 32 VAL CA C 13 66.418 0.010 A 32 VAL CB C 13 29.398 0.010 A 32 VAL N N 15 119.304 0.010 A 33 VAL H H 1 8.237 0.010 A 33 VAL HB H 1 1.812 0.010 A 33 VAL C C 13 177.741 0.010 A 33 VAL N N 15 118.896 0.010 A 34 LEU H H 1 8.532 0.010 A 34 LEU HA H 1 3.985 0.010 A 34 LEU HBx H 1 1.805 0.010 A 34 LEU HBy H 1 1.805 0.010 A 34 LEU HDx% H 1 0.891 0.010 A 34 LEU HDy% H 1 0.891 0.010 A 34 LEU C C 13 177.909 0.010 A 34 LEU CA C 13 57.487 0.010 A 34 LEU CB C 13 40.816 0.010 A 34 LEU N N 15 119.461 0.010 A 35 ALA H H 1 8.483 0.010 A 35 ALA HA H 1 3.991 0.010 A 35 ALA HB% H 1 1.573 0.010 A 35 ALA C C 13 179.309 0.010 A 35 ALA CA C 13 54.960 0.010 A 35 ALA CB C 13 17.268 0.010 A 35 ALA N N 15 120.870 0.010 A 36 ILE H H 1 8.114 0.010 A 36 ILE HA H 1 3.601 0.010 A 36 ILE HB H 1 2.172 0.010 A 36 ILE C C 13 178.135 0.010 A 36 ILE CA C 13 64.867 0.010 A 36 ILE CB C 13 36.129 0.010 A 36 ILE N N 15 118.008 0.010 A 37 VAL H H 1 8.518 0.010 A 37 VAL HA H 1 3.670 0.010 A 37 VAL HB H 1 2.376 0.010 A 37 VAL C C 13 178.012 0.010 A 37 VAL CA C 13 66.562 0.010 A 37 VAL CB C 13 30.124 0.010 A 37 VAL N N 15 120.374 0.010 A 38 VAL H H 1 8.832 0.010 A 38 VAL HA H 1 3.988 0.010 A 38 VAL HB H 1 2.336 0.010 A 38 VAL C C 13 177.585 0.010 A 38 VAL CA C 13 66.734 0.010 A 38 VAL CB C 13 30.067 0.010 A 38 VAL N N 15 119.897 0.010 A 39 GLN H H 1 8.458 0.010 A 39 GLN HA H 1 4.099 0.010 A 39 GLN HBx H 1 2.384 0.010 A 39 GLN HBy H 1 2.384 0.010 A 39 GLN C C 13 179.492 0.010 A 39 GLN CA C 13 59.124 0.010 A 39 GLN CB C 13 26.793 0.010 A 39 GLN N N 15 119.860 0.010 A 40 MET H H 1 8.744 0.010 A 40 MET HA H 1 4.211 0.010 A 40 MET HBx H 1 2.408 0.010 A 40 MET HBy H 1 2.408 0.010 A 40 MET HE1 H 1 2.146 0.010 A 40 MET HE2 H 1 2.146 0.010 A 40 MET HE3 H 1 2.146 0.010 A 40 MET C C 13 178.054 0.010 A 40 MET CA C 13 58.406 0.010 A 40 MET CB C 13 30.124 0.010 A 40 MET N N 15 120.744 0.010 A 41 ALA H H 1 8.782 0.010 A 41 ALA HA H 1 4.103 0.010 A 41 ALA HB% H 1 1.589 0.010 A 41 ALA C C 13 179.516 0.010 A 41 ALA CA C 13 55.223 0.010 A 41 ALA CB C 13 17.546 0.010 A 41 ALA N N 15 122.929 0.010 A 42 VAL H H 1 8.835 0.010 A 42 VAL HA H 1 3.599 0.010 A 42 VAL HB H 1 2.320 0.010 A 42 VAL C C 13 177.899 0.010 A 42 VAL CA C 13 66.538 0.010 A 42 VAL CB C 13 30.641 0.010 A 42 VAL N N 15 117.632 0.010 A 43 THR H H 1 8.143 0.010 A 43 THR HA H 1 4.719 0.010 A 43 THR HB H 1 4.361 0.010 A 43 THR C C 13 176.508 0.010 A 43 THR CA C 13 66.538 0.010 A 43 THR CB C 13 68.146 0.010 A 43 THR N N 15 115.216 0.010 A 44 MET H H 1 8.331 0.010 A 44 MET HA H 1 4.351 0.010 A 44 MET HBx H 1 2.154 0.010 A 44 MET HBy H 1 2.154 0.010 A 44 MET C C 13 178.296 0.010 A 44 MET CA C 13 58.119 0.010 A 44 MET CB C 13 31.485 0.010 A 44 MET N N 15 120.331 0.010 A 45 VAL H H 1 8.166 0.010 A 45 VAL HA H 1 3.961 0.010 A 45 VAL HB H 1 2.130 0.010 A 45 VAL C C 13 177.855 0.010 A 45 VAL CA C 13 64.872 0.010 A 45 VAL CB C 13 31.043 0.010 A 45 VAL N N 15 118.764 0.010 A 46 LEU H H 1 8.179 0.010 A 46 LEU HA H 1 4.349 0.010 A 46 LEU HBx H 1 1.840 0.010 A 46 LEU HBy H 1 1.840 0.010 A 46 LEU C C 13 178.124 0.010 A 46 LEU N N 15 118.291 0.010 A 47 HIS H H 1 7.903 0.010 A 47 HIS HA H 1 4.833 0.010 A 47 HIS HBx H 1 3.459 0.010 A 47 HIS HBy H 1 3.592 0.010 A 47 HIS C C 13 175.367 0.010 A 47 HIS CA C 13 55.453 0.010 A 47 HIS CB C 13 27.195 0.010 A 47 HIS N N 15 114.583 0.010 A 48 GLY H H 1 8.293 0.010 A 48 GLY HAx H 1 4.129 0.010 A 48 GLY HAy H 1 4.129 0.010 A 48 GLY C C 13 174.171 0.010 A 48 GLY CA C 13 45.459 0.010 A 48 GLY N N 15 108.497 0.010 A 49 GLN H H 1 8.107 0.010 A 49 GLN HA H 1 4.208 0.010 A 49 GLN HBx H 1 2.210 0.010 A 49 GLN HBy H 1 2.210 0.010 A 49 GLN HGx H 1 2.702 0.010 A 49 GLN HGy H 1 2.702 0.010 A 49 GLN C C 13 175.636 0.010 A 49 GLN CA C 13 55.338 0.010 A 49 GLN CB C 13 28.746 0.010 A 49 GLN N N 15 119.291 0.010 A 50 VAL H H 1 8.127 0.010 A 50 VAL HA H 1 4.200 0.010 A 50 VAL HB H 1 2.130 0.010 A 50 VAL HGx% H 1 1.039 0.010 A 50 VAL HGy% H 1 1.039 0.010 A 50 VAL C C 13 176.045 0.010 A 50 VAL CA C 13 61.795 0.010 A 50 VAL CB C 13 31.503 0.010 A 50 VAL N N 15 120.114 0.010 A 51 GLU H H 1 8.509 0.010 A 51 GLU HA H 1 4.438 0.010 A 51 GLU HBx H 1 2.198 0.010 A 51 GLU HBy H 1 2.198 0.010 A 51 GLU HGx H 1 2.482 0.010 A 51 GLU HGy H 1 2.482 0.010 A 51 GLU C C 13 176.250 0.010 A 51 GLU CA C 13 56.544 0.010 A 51 GLU CB C 13 27.884 0.010 A 51 GLU N N 15 123.685 0.010 A 52 SER H H 1 8.136 0.010 A 52 SER HA H 1 4.513 0.010 A 52 SER HBx H 1 4.049 0.010 A 52 SER HBy H 1 4.049 0.010 A 52 SER C C 13 175.834 0.010 A 52 SER CA C 13 58.956 0.010 A 52 SER CB C 13 62.929 0.010 A 52 SER N N 15 114.860 0.010 A 53 ILE H H 1 8.263 0.010 A 53 ILE HA H 1 4.049 0.010 A 53 ILE HB H 1 2.091 0.010 A 53 ILE C C 13 176.756 0.010 A 53 ILE CA C 13 62.287 0.010 A 53 ILE CB C 13 36.557 0.010 A 53 ILE N N 15 122.087 0.010 A 54 ASP H H 1 8.257 0.010 A 54 ASP HA H 1 4.502 0.010 A 54 ASP HBx H 1 2.845 0.010 A 54 ASP HBy H 1 2.845 0.010 A 54 ASP C C 13 178.641 0.010 A 54 ASP CA C 13 57.004 0.010 A 54 ASP CB C 13 39.141 0.010 A 54 ASP N N 15 121.260 0.010 A 55 VAL H H 1 7.851 0.010 A 55 VAL HA H 1 3.939 0.010 A 55 VAL HB H 1 2.089 0.010 A 55 VAL C C 13 177.911 0.010 A 55 VAL CA C 13 65.155 0.010 A 55 VAL CB C 13 30.641 0.010 A 55 VAL N N 15 121.157 0.010 A 56 ILE H H 1 7.746 0.010 A 56 ILE HA H 1 3.812 0.010 A 56 ILE HB H 1 1.995 0.010 A 56 ILE C C 13 177.585 0.010 A 56 ILE CA C 13 64.035 0.010 A 56 ILE CB C 13 36.212 0.010 A 56 ILE N N 15 119.837 0.010 A 57 ARG H H 1 8.494 0.010 A 57 ARG HA H 1 3.995 0.010 A 57 ARG HBx H 1 2.117 0.010 A 57 ARG HBy H 1 2.117 0.010 A 57 ARG C C 13 177.682 0.010 A 57 ARG CA C 13 60.564 0.010 A 57 ARG CB C 13 29.033 0.010 A 57 ARG N N 15 119.632 0.010 A 58 SER H H 1 7.981 0.010 A 58 SER HA H 1 4.405 0.010 A 58 SER HBx H 1 4.163 0.010 A 58 SER HBy H 1 4.163 0.010 A 58 SER C C 13 177.432 0.010 A 58 SER CA C 13 61.364 0.010 A 58 SER CB C 13 62.575 0.010 A 58 SER N N 15 114.224 0.010 A 59 ILE H H 1 8.126 0.010 A 59 ILE HA H 1 3.963 0.010 A 59 ILE HB H 1 2.053 0.010 A 59 ILE C C 13 177.758 0.010 A 59 ILE CA C 13 63.834 0.010 A 59 ILE CB C 13 36.959 0.010 A 59 ILE N N 15 122.910 0.010 A 60 PHE H H 1 8.364 0.010 A 60 PHE HA H 1 3.976 0.010 A 60 PHE HBx H 1 3.173 0.010 A 60 PHE HBy H 1 3.173 0.010 A 60 PHE C C 13 176.885 0.010 A 60 PHE CA C 13 61.254 0.010 A 60 PHE CB C 13 38.165 0.010 A 60 PHE N N 15 119.452 0.010 A 61 PHE H H 1 8.600 0.010 A 61 PHE HA H 1 4.313 0.010 A 61 PHE HBx H 1 3.313 0.010 A 61 PHE HBy H 1 3.313 0.010 A 61 PHE C C 13 178.184 0.010 A 61 PHE CA C 13 60.129 0.010 A 61 PHE CB C 13 37.361 0.010 A 61 PHE N N 15 117.106 0.010 A 62 GLY H H 1 8.047 0.010 A 62 GLY HAx H 1 3.997 0.010 A 62 GLY HAy H 1 3.997 0.010 A 62 GLY C C 13 175.744 0.010 A 62 GLY CA C 13 46.148 0.010 A 62 GLY N N 15 106.595 0.010 A 63 LEU H H 1 7.884 0.010 A 63 LEU HA H 1 4.303 0.010 A 63 LEU HBx H 1 1.986 0.010 A 63 LEU HBy H 1 1.986 0.010 A 63 LEU C C 13 178.375 0.010 A 63 LEU CA C 13 56.429 0.010 A 63 LEU CB C 13 41.152 0.010 A 63 LEU N N 15 120.955 0.010 A 64 LEU H H 1 7.651 0.010 A 64 LEU HA H 1 4.060 0.010 A 64 LEU HBx H 1 1.781 0.010 A 64 LEU HBy H 1 1.781 0.010 A 64 LEU C C 13 176.271 0.010 A 64 LEU CA C 13 55.821 0.010 A 64 LEU CB C 13 40.807 0.010 A 64 LEU N N 15 117.669 0.010 A 65 ILE H H 1 7.094 0.010 A 65 ILE HA H 1 4.452 0.010 A 65 ILE C C 13 176.864 0.010 A 65 ILE CA C 13 60.277 0.010 A 65 ILE CB C 13 36.787 0.010 A 65 ILE N N 15 110.458 0.010 A 66 THR H H 1 7.549 0.010 A 66 THR HA H 1 4.649 0.010 A 66 THR HB H 1 4.026 0.010 A 66 THR C C 13 173.827 0.010 A 66 THR CA C 13 60.335 0.010 A 66 THR CB C 13 69.007 0.010 A 66 THR N N 15 116.409 0.010 A 67 PRO HDx H 1 3.406 0.010 A 67 PRO HDy H 1 3.406 0.010 A 67 PRO C C 13 179.218 0.010 A 67 PRO CA C 13 65.159 0.010 A 67 PRO CB C 13 30.698 0.010 A 68 TRP H H 1 7.600 0.010 A 68 TRP HA H 1 4.339 0.010 A 68 TRP HBx H 1 3.366 0.010 A 68 TRP HBy H 1 3.366 0.010 A 68 TRP C C 13 177.490 0.010 A 68 TRP CA C 13 58.727 0.010 A 68 TRP CB C 13 28.344 0.010 A 68 TRP N N 15 116.048 0.010 A 69 ALA H H 1 7.517 0.010 A 69 ALA HA H 1 4.168 0.010 A 69 ALA HB% H 1 1.492 0.010 A 69 ALA C C 13 179.136 0.010 A 69 ALA CA C 13 55.453 0.010 A 69 ALA CB C 13 17.890 0.010 A 69 ALA N N 15 123.179 0.010 A 70 VAL H H 1 7.927 0.010 A 70 VAL HA H 1 3.716 0.010 A 70 VAL HB H 1 2.190 0.010 A 70 VAL HGx% H 1 1.135 0.010 A 70 VAL HGy% H 1 1.135 0.010 A 70 VAL C C 13 178.918 0.010 A 70 VAL CA C 13 66.021 0.010 A 70 VAL CB C 13 30.584 0.010 A 70 VAL N N 15 117.342 0.010 A 71 TYR H H 1 8.016 0.010 A 71 TYR HBx H 1 3.188 0.010 A 71 TYR HBy H 1 3.275 0.010 A 71 TYR C C 13 177.952 0.010 A 71 TYR CA C 13 60.560 0.010 A 71 TYR CB C 13 37.189 0.010 A 71 TYR N N 15 121.782 0.010 A 72 PHE H H 1 8.534 0.010 A 72 PHE HA H 1 4.186 0.010 A 72 PHE HBx H 1 3.284 0.010 A 72 PHE HBy H 1 3.284 0.010 A 72 PHE C C 13 177.241 0.010 A 72 PHE CA C 13 60.531 0.010 A 72 PHE CB C 13 38.280 0.010 A 72 PHE N N 15 119.999 0.010 A 73 LEU H H 1 8.649 0.010 A 73 LEU HA H 1 3.994 0.010 A 73 LEU HBx H 1 1.979 0.010 A 73 LEU HBy H 1 1.979 0.010 A 73 LEU C C 13 178.364 0.010 A 73 LEU CA C 13 57.372 0.010 A 73 LEU CB C 13 40.233 0.010 A 73 LEU N N 15 118.899 0.010 A 74 SER H H 1 8.034 0.010 A 74 SER HA H 1 4.233 0.010 A 74 SER HBx H 1 4.080 0.010 A 74 SER HBy H 1 4.080 0.010 A 74 SER C C 13 176.519 0.010 A 74 SER CA C 13 61.278 0.010 A 74 SER CB C 13 61.907 0.010 A 74 SER N N 15 114.705 0.010 A 75 VAL H H 1 7.636 0.010 A 75 VAL HA H 1 3.869 0.010 A 75 VAL HB H 1 2.171 0.010 A 75 VAL HGx% H 1 0.867 0.010 A 75 VAL HGy% H 1 0.867 0.010 A 75 VAL C C 13 178.307 0.010 A 75 VAL CA C 13 65.040 0.010 A 75 VAL CB C 13 30.650 0.010 A 75 VAL N N 15 123.144 0.010 A 76 VAL H H 1 7.934 0.010 A 76 VAL HA H 1 4.148 0.010 A 76 VAL HB H 1 2.190 0.010 A 76 VAL C C 13 177.848 0.010 A 76 VAL CA C 13 66.131 0.010 A 76 VAL CB C 13 30.450 0.010 A 76 VAL N N 15 120.227 0.010 A 77 VAL H H 1 8.412 0.010 A 77 VAL HA H 1 4.231 0.010 A 77 VAL HB H 1 2.247 0.010 A 77 VAL HG1% H 1 0.940 0.010 A 77 VAL HG2% H 1 1.105 0.010 A 77 VAL C C 13 177.902 0.010 A 77 VAL CA C 13 66.562 0.010 A 77 VAL CB C 13 30.450 0.010 A 77 VAL N N 15 119.254 0.010 A 78 GLU H H 1 7.843 0.010 A 78 GLU HA H 1 4.207 0.010 A 78 GLU HBx H 1 2.286 0.010 A 78 GLU HBy H 1 2.286 0.010 A 78 GLU C C 13 179.039 0.010 A 78 GLU CA C 13 58.727 0.010 A 78 GLU CB C 13 27.151 0.010 A 78 GLU N N 15 119.520 0.010 A 79 GLN H H 1 8.151 0.010 A 79 GLN HA H 1 4.231 0.010 A 79 GLN HBx H 1 2.215 0.010 A 79 GLN HBy H 1 2.215 0.010 A 79 GLN C C 13 179.556 0.010 A 79 GLN CA C 13 57.463 0.010 A 79 GLN CB C 13 26.968 0.010 A 79 GLN N N 15 118.028 0.010 A 80 LEU H H 1 8.546 0.010 A 80 LEU HA H 1 4.144 0.010 A 80 LEU HBx H 1 2.058 0.010 A 80 LEU HBy H 1 2.058 0.010 A 80 LEU C C 13 179.029 0.010 A 80 LEU CA C 13 57.401 0.010 A 80 LEU CB C 13 40.462 0.010 A 80 LEU N N 15 122.275 0.010 A 81 GLU H H 1 8.435 0.010 A 81 GLU HA H 1 4.181 0.010 A 81 GLU C C 13 179.610 0.010 A 81 GLU CA C 13 60.220 0.010 A 81 GLU CB C 13 31.962 0.010 A 81 GLU N N 15 118.464 0.010 A 82 GLU H H 1 8.223 0.010 A 82 GLU HA H 1 4.207 0.010 A 82 GLU C C 13 178.512 0.010 A 82 GLU CA C 13 57.578 0.010 A 82 GLU CB C 13 27.827 0.010 A 82 GLU N N 15 118.834 0.010 A 83 SER H H 1 8.020 0.010 A 83 SER HA H 1 4.103 0.010 A 83 SER HBx H 1 4.664 0.010 A 83 SER HBy H 1 4.664 0.010 A 83 SER C C 13 178.512 0.010 A 83 SER CA C 13 60.162 0.010 A 83 SER CB C 13 63.149 0.010 A 83 SER N N 15 115.257 0.010 A 84 ARG H H 1 7.862 0.010 A 84 ARG HA H 1 4.017 0.010 A 84 ARG C C 13 178.059 0.010 A 84 ARG CA C 13 60.105 0.010 A 84 ARG CB C 13 28.975 0.010 A 84 ARG N N 15 122.717 0.010 A 85 GLN H H 1 8.500 0.010 A 85 GLN HA H 1 4.171 0.010 A 85 GLN HBx H 1 2.304 0.010 A 85 GLN HBy H 1 2.304 0.010 A 85 GLN C C 13 178.716 0.010 A 85 GLN CA C 13 58.612 0.010 A 85 GLN CB C 13 27.195 0.010 A 85 GLN N N 15 119.100 0.010 A 86 ARG H H 1 8.058 0.010 A 86 ARG HA H 1 4.243 0.010 A 86 ARG HBx H 1 2.015 0.010 A 86 ARG HBy H 1 2.015 0.010 A 86 ARG C C 13 178.781 0.010 A 86 ARG CA C 13 58.612 0.010 A 86 ARG CB C 13 29.263 0.010 A 86 ARG N N 15 120.149 0.010 A 87 LEU H H 1 8.280 0.010 A 87 LEU HA H 1 4.697 0.010 A 87 LEU HBx H 1 1.932 0.010 A 87 LEU HBy H 1 1.932 0.010 A 87 LEU C C 13 178.501 0.010 A 87 LEU CA C 13 56.826 0.010 A 87 LEU CB C 13 40.577 0.010 A 87 LEU N N 15 119.365 0.010 A 88 SER H H 1 8.308 0.010 A 88 SER HA H 1 4.211 0.010 A 88 SER HBx H 1 4.141 0.010 A 88 SER HBy H 1 4.141 0.010 A 88 SER CA C 13 61.364 0.010 A 88 SER CB C 13 61.773 0.010 A 88 SER N N 15 115.098 0.010 A 89 ARG H H 1 7.805 0.010 A 89 ARG HA H 1 4.265 0.010 A 89 ARG HBx H 1 2.085 0.010 A 89 ARG HBy H 1 2.085 0.010 A 89 ARG HGx H 1 1.916 0.010 A 89 ARG HGy H 1 1.916 0.010 A 89 ARG C C 13 178.891 0.010 A 89 ARG CA C 13 58.497 0.010 A 89 ARG CB C 13 28.803 0.010 A 89 ARG N N 15 120.985 0.010 A 90 LEU H H 1 7.831 0.010 A 90 LEU HA H 1 4.243 0.010 A 90 LEU HBx H 1 1.963 0.010 A 90 LEU HBy H 1 1.963 0.010 A 90 LEU C C 13 178.404 0.010 A 90 LEU CA C 13 57.573 0.010 A 90 LEU CB C 13 40.462 0.010 A 90 LEU N N 15 121.355 0.010 A 91 VAL H H 1 8.268 0.010 A 91 VAL HA H 1 3.632 0.010 A 91 VAL HB H 1 2.302 0.010 A 91 VAL C C 13 177.769 0.010 A 91 VAL CA C 13 66.590 0.010 A 91 VAL CB C 13 30.411 0.010 A 91 VAL N N 15 118.952 0.010 A 92 GLN H H 1 8.015 0.010 A 92 GLN HA H 1 4.175 0.010 A 92 GLN HBx H 1 2.318 0.010 A 92 GLN HBy H 1 2.318 0.010 A 92 GLN C C 13 178.850 0.010 A 92 GLN CA C 13 58.492 0.010 A 92 GLN CB C 13 27.195 0.010 A 92 GLN N N 15 119.011 0.010 A 93 LYS H H 1 7.926 0.010 A 93 LYS HA H 1 4.782 0.010 A 93 LYS HBx H 1 2.200 0.010 A 93 LYS HBy H 1 2.200 0.010 A 93 LYS C C 13 179.169 0.010 A 93 LYS CA C 13 57.910 0.010 A 93 LYS CB C 13 30.526 0.010 A 93 LYS N N 15 120.085 0.010 A 94 LEU H H 1 8.310 0.010 A 94 LEU HA H 1 4.231 0.010 A 94 LEU HBx H 1 2.066 0.010 A 94 LEU HBy H 1 2.066 0.010 A 94 LEU C C 13 179.104 0.010 A 94 LEU CA C 13 57.372 0.010 A 94 LEU CB C 13 40.405 0.010 A 94 LEU N N 15 120.473 0.010 A 95 GLU H H 1 8.477 0.010 A 95 GLU HA H 1 4.158 0.010 A 95 GLU HBy H 1 2.295 0.010 A 95 GLU HBx H 1 2.115 0.010 A 95 GLU HGy H 1 2.664 0.010 A 95 GLU HGx H 1 2.524 0.010 A 95 GLU C C 13 178.899 0.010 A 95 GLU CA C 13 58.549 0.010 A 95 GLU CB C 13 27.137 0.010 A 95 GLU N N 15 118.623 0.010 A 96 GLU H H 1 8.076 0.010 A 96 GLU HA H 1 4.221 0.010 A 96 GLU HBx H 1 2.015 0.010 A 96 GLU HBy H 1 2.015 0.010 A 96 GLU C C 13 179.072 0.010 A 96 GLU CA C 13 58.439 0.010 A 96 GLU CB C 13 26.793 0.010 A 96 GLU N N 15 119.997 0.010 A 97 MET H H 1 8.178 0.010 A 97 MET HA H 1 4.238 0.010 A 97 MET HBx H 1 2.341 0.010 A 97 MET HBy H 1 2.341 0.010 A 97 MET CA C 13 58.463 0.010 A 97 MET CB C 13 28.056 0.010 A 97 MET N N 15 118.694 0.010 A 98 ARG H H 1 8.134 0.010 A 98 ARG HA H 1 4.200 0.010 A 98 ARG HBx H 1 2.275 0.010 A 98 ARG HBy H 1 2.275 0.010 A 98 ARG C C 13 177.538 0.010 A 98 ARG CA C 13 58.095 0.010 A 98 ARG CB C 13 28.975 0.010 A 98 ARG N N 15 119.472 0.010 A 99 GLU H H 1 7.958 0.010 A 99 GLU HA H 1 4.276 0.010 A 99 GLU HBx H 1 2.187 0.010 A 99 GLU HBy H 1 2.187 0.010 A 99 GLU HGy H 1 2.634 0.010 A 99 GLU HGx H 1 2.464 0.010 A 99 GLU C C 13 177.333 0.010 A 99 GLU CA C 13 57.061 0.010 A 99 GLU CB C 13 27.827 0.010 A 99 GLU N N 15 117.970 0.010 A 100 ARG H H 1 7.878 0.010 A 100 ARG HA H 1 4.405 0.010 A 100 ARG HBx H 1 1.988 0.010 A 100 ARG HBy H 1 1.988 0.010 A 100 ARG C C 13 176.627 0.010 A 100 ARG CA C 13 56.544 0.010 A 100 ARG CB C 13 30.076 0.010 A 100 ARG N N 15 119.078 0.010 A 101 ASP H H 1 8.291 0.010 A 101 ASP HA H 1 4.729 0.010 A 101 ASP HBx H 1 2.799 0.010 A 101 ASP HBy H 1 2.951 0.010 A 101 ASP C C 13 175.707 0.010 A 101 ASP CA C 13 53.845 0.010 A 101 ASP CB C 13 38.337 0.010 A 101 ASP N N 15 118.630 0.010 A 102 LEU H H 1 8.075 0.010 A 102 LEU HA H 1 4.508 0.010 A 102 LEU HBx H 1 1.773 0.010 A 102 LEU HBy H 1 1.773 0.010 A 102 LEU C C 13 177.044 0.010 A 102 LEU CA C 13 55.223 0.010 A 102 LEU CB C 13 41.381 0.010 A 102 LEU N N 15 122.222 0.010 A 103 SER H H 1 8.184 0.010 A 103 SER HA H 1 4.567 0.010 A 103 SER HBx H 1 3.985 0.010 A 103 SER HBy H 1 3.985 0.010 A 103 SER C C 13 174.535 0.010 A 103 SER CA C 13 57.980 0.010 A 103 SER CB C 13 62.986 0.010 A 103 SER N N 15 116.402 0.010 A 104 LEU H H 1 8.099 0.010 A 104 LEU HA H 1 4.449 0.010 A 104 LEU HBx H 1 1.752 0.010 A 104 LEU HBy H 1 1.752 0.010 A 104 LEU C C 13 176.741 0.010 A 104 LEU CA C 13 55.051 0.010 A 104 LEU CB C 13 41.496 0.010 A 104 LEU N N 15 123.592 0.010 A 105 ASN H H 1 8.338 0.010 A 105 ASN HA H 1 4.773 0.010 A 105 ASN HBy H 1 2.939 0.010 A 105 ASN HBx H 1 2.863 0.010 A 105 ASN C C 13 175.313 0.010 A 105 ASN CA C 13 53.328 0.010 A 105 ASN CB C 13 38.165 0.010 A 105 ASN N N 15 119.696 0.010 A 106 VAL H H 1 7.920 0.010 A 106 VAL HA H 1 4.147 0.010 A 106 VAL HB H 1 2.194 0.010 A 106 VAL HGx% H 1 1.042 0.010 A 106 VAL HGy% H 1 1.042 0.010 A 106 VAL C C 13 175.938 0.010 A 106 VAL CA C 13 62.110 0.010 A 106 VAL CB C 13 31.905 0.010 A 106 VAL N N 15 120.089 0.010 A 107 GLN H H 1 8.307 0.010 A 107 GLN HA H 1 4.448 0.010 A 107 GLN HBx H 1 2.173 0.010 A 107 GLN HBy H 1 2.173 0.010 A 107 GLN HGx H 1 2.464 0.010 A 107 GLN HGy H 1 2.464 0.010 A 107 GLN C C 13 176.605 0.010 A 107 GLN CA C 13 55.505 0.010 A 107 GLN CB C 13 28.238 0.010 A 107 GLN N N 15 122.974 0.010 A 108 LEU H H 1 8.272 0.010 A 108 LEU HA H 1 4.393 0.010 A 108 LEU HBx H 1 1.795 0.010 A 108 LEU HBy H 1 1.795 0.010 A 108 LEU C C 13 177.678 0.010 A 108 LEU CA C 13 55.431 0.010 A 108 LEU CB C 13 41.209 0.010 A 108 LEU N N 15 122.949 0.010 A 109 LYS H H 1 8.159 0.010 A 109 LYS HA H 1 4.267 0.010 A 109 LYS HBx H 1 1.935 0.010 A 109 LYS HBy H 1 1.935 0.010 A 109 LYS C C 13 176.967 0.010 A 109 LYS CA C 13 56.982 0.010 A 109 LYS CB C 13 31.617 0.010 A 109 LYS N N 15 120.211 0.010 A 110 ASP H H 1 8.257 0.010 A 110 ASP HA H 1 4.681 0.010 A 110 ASP HBx H 1 2.784 0.010 A 110 ASP HBy H 1 2.784 0.010 A 110 ASP C C 13 176.842 0.010 A 110 ASP CA C 13 54.213 0.010 A 110 ASP CB C 13 39.199 0.010 A 110 ASP N N 15 119.706 0.010 A 111 ASN H H 1 8.178 0.010 A 111 ASN HA H 1 4.734 0.010 A 111 ASN HBx H 1 2.866 0.010 A 111 ASN HBy H 1 2.866 0.010 A 111 ASN C C 13 175.884 0.010 A 111 ASN CA C 13 53.610 0.010 A 111 ASN CB C 13 38.519 0.010 A 111 ASN N N 15 118.494 0.010 A 112 ILE H H 1 8.021 0.010 A 112 ILE HA H 1 4.146 0.010 A 112 ILE HB H 1 2.034 0.010 A 112 ILE HG2% H 1 1.010 0.010 A 112 ILE C C 13 176.129 0.010 A 112 ILE CA C 13 61.828 0.010 A 112 ILE CB C 13 37.131 0.010 A 112 ILE N N 15 120.323 0.010 A 113 ALA H H 1 8.059 0.010 A 113 ALA HA H 1 4.384 0.010 A 113 ALA HB% H 1 1.524 0.010 A 113 ALA C C 13 177.446 0.010 A 113 ALA CA C 13 52.409 0.010 A 113 ALA CB C 13 18.005 0.010 A 113 ALA N N 15 124.742 0.010 A 114 GLN H H 1 7.922 0.010 A 114 GLN HA H 1 4.413 0.010 A 114 GLN HBx H 1 2.068 0.010 A 114 GLN HBy H 1 2.068 0.010 A 114 GLN HGy H 1 2.476 0.010 A 114 GLN HGx H 1 2.267 0.010 A 114 GLN C C 13 175.438 0.010 A 114 GLN CA C 13 55.280 0.010 A 114 GLN CB C 13 28.525 0.010 A 114 GLN N N 15 117.913 0.010 A 115 LEU H H 1 7.802 0.010 A 115 LEU HA H 1 4.313 0.010 A 115 LEU HBx H 1 1.770 0.010 A 115 LEU HBy H 1 1.770 0.010 A 115 LEU C C 13 180.515 0.010 A 115 LEU CA C 13 54.902 0.010 A 115 LEU CB C 13 41.554 0.010 A 115 LEU N N 15 126.118 0.010 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 noe _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 24 SER H A 25 MET H 1.0 . 5.0 2 2 A 25 MET H A 26 LEU H 1.0 . 5.0 3 3 A 26 LEU H A 27 LEU H 1.0 . 3.0 4 4 A 26 LEU H A 28 ALA H 1.0 . 5.0 5 5 A 27 LEU H A 28 ALA H 1.0 . 3.0 6 6 A 28 ALA H A 29 LEU H 1.0 . 3.0 7 7 A 28 ALA H A 30 ALA H 1.0 . 5.0 8 8 A 29 LEU H A 30 ALA H 1.0 . 3.0 9 9 A 29 LEU H A 31 LEU H 1.0 . 5.0 10 10 A 30 ALA H A 31 LEU H 1.0 . 3.0 11 11 A 30 ALA H A 32 VAL H 1.0 . 5.0 12 12 A 31 LEU H A 32 VAL H 1.0 . 3.0 13 13 A 31 LEU H A 33 VAL H 1.0 . 5.0 14 14 A 32 VAL H A 33 VAL H 1.0 . 3.0 15 15 A 32 VAL H A 34 LEU H 1.0 . 5.0 16 16 A 33 VAL H A 34 LEU H 1.0 . 3.0 17 17 A 33 VAL H A 35 ALA H 1.0 . 5.0 18 18 A 34 LEU H A 35 ALA H 1.0 . 3.0 19 19 A 34 LEU H A 36 ILE H 1.0 . 5.0 20 20 A 35 ALA H A 36 ILE H 1.0 . 3.0 21 21 A 35 ALA H A 37 VAL H 1.0 . 5.0 22 22 A 36 ILE H A 37 VAL H 1.0 . 3.0 23 23 A 36 ILE H A 38 VAL H 1.0 . 5.0 24 24 A 37 VAL H A 38 VAL H 1.0 . 3.0 25 25 A 38 VAL H A 39 GLN H 1.0 . 3.0 26 26 A 39 GLN H A 40 MET H 1.0 . 3.0 27 27 A 40 MET H A 41 ALA H 1.0 . 3.0 28 28 A 41 ALA H A 42 VAL H 1.0 . 3.0 29 29 A 42 VAL H A 43 THR H 1.0 . 3.0 30 30 A 43 THR H A 44 MET H 1.0 . 3.0 31 31 A 44 MET H A 45 VAL H 1.0 . 3.0 32 32 A 44 MET H A 46 LEU H 1.0 . 5.0 33 33 A 45 VAL H A 46 LEU H 1.0 . 3.0 34 34 A 46 LEU H A 47 HIS H 1.0 . 5.0 35 35 A 51 GLU H A 52 SER H 1.0 . 5.0 36 36 A 52 SER H A 53 ILE H 1.0 . 5.0 37 37 A 53 ILE H A 54 ASP H 1.0 . 5.0 38 38 A 58 SER H A 59 ILE H 1.0 . 5.0 39 39 A 58 SER H A 60 PHE H 1.0 . 5.0 40 40 A 59 ILE H A 60 PHE H 1.0 . 3.0 41 41 A 59 ILE H A 61 PHE H 1.0 . 5.0 42 42 A 60 PHE H A 61 PHE H 1.0 . 3.0 43 43 A 60 PHE H A 62 GLY H 1.0 . 5.0 44 44 A 61 PHE H A 62 GLY H 1.0 . 3.0 45 45 A 62 GLY H A 63 LEU H 1.0 . 3.0 46 46 A 62 GLY H A 64 LEU H 1.0 . 5.0 47 47 A 63 LEU H A 64 LEU H 1.0 . 3.0 48 48 A 63 LEU H A 65 ILE H 1.0 . 5.0 49 49 A 64 LEU H A 65 ILE H 1.0 . 3.0 50 50 A 64 LEU H A 66 THR H 1.0 . 5.0 51 51 A 65 ILE H A 66 THR H 1.0 . 3.0 52 52 A 66 THR H A 68 TRP H 1.0 . 5.0 53 53 A 68 TRP H A 69 ALA H 1.0 . 3.0 54 54 A 68 TRP H A 70 VAL H 1.0 . 5.0 55 55 A 69 ALA H A 70 VAL H 1.0 . 3.0 56 56 A 69 ALA H A 71 TYR H 1.0 . 5.0 57 57 A 70 VAL H A 71 TYR H 1.0 . 3.0 58 58 A 70 VAL H A 72 PHE H 1.0 . 5.0 59 59 A 71 TYR H A 72 PHE H 1.0 . 3.0 60 60 A 71 TYR H A 73 LEU H 1.0 . 5.0 61 61 A 72 PHE H A 73 LEU H 1.0 . 3.0 62 62 A 72 PHE H A 74 SER H 1.0 . 5.0 63 63 A 73 LEU H A 74 SER H 1.0 . 3.0 64 64 A 73 LEU H A 75 VAL H 1.0 . 5.0 65 65 A 74 SER H A 75 VAL H 1.0 . 3.0 66 66 A 74 SER H A 76 VAL H 1.0 . 5.0 67 67 A 75 VAL H A 76 VAL H 1.0 . 3.0 68 68 A 75 VAL H A 77 VAL H 1.0 . 5.0 69 69 A 76 VAL H A 77 VAL H 1.0 . 3.0 70 70 A 76 VAL H A 78 GLU H 1.0 . 5.0 71 71 A 77 VAL H A 78 GLU H 1.0 . 3.0 72 72 A 77 VAL H A 79 GLN H 1.0 . 5.0 73 73 A 78 GLU H A 79 GLN H 1.0 . 5.0 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 pre _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 18 LEU H A 23 PHE CB 1.0 . 14.0 2 2 A 18 LEU H A 79 GLN CB 1.0 . 17.0 3 3 A 23 PHE CB A 19 GLY H 1.0 . 14.0 4 4 A 79 GLN CB A 19 GLY H 1.0 . 14.0 5 5 A 23 PHE CB A 20 LEU H 1.0 . 14.0 6 6 A 79 GLN CB A 20 LEU H 1.0 . 11.0 7 7 A 24 SER H A 23 PHE CB 1.0 . 7.0 8 8 A 26 LEU H A 23 PHE CB 1.0 . 11.0 9 9 A 27 LEU H A 23 PHE CB 1.0 . 14.0 10 10 A 28 ALA H A 23 PHE CB 1.0 . 14.0 11 11 A 29 LEU H A 23 PHE CB 1.0 . 14.0 12 12 A 30 ALA H A 23 PHE CB 1.0 . 17.0 13 13 A 31 LEU H A 23 PHE CB 1.0 . 17.0 14 14 A 32 VAL H A 23 PHE CB 1.0 . 17.0 15 15 A 33 VAL H A 23 PHE CB 1.0 . 21.0 16 16 A 34 LEU H A 23 PHE CB 1.0 . 21.0 17 17 A 35 ALA H A 23 PHE CB 1.0 . 21.0 18 18 A 36 ILE H A 23 PHE CB 1.0 . 25.0 19 19 A 37 VAL H A 23 PHE CB 1.0 . 25.0 20 20 A 69 ALA H A 23 PHE CB 1.0 . 25.0 21 21 A 70 VAL H A 23 PHE CB 1.0 . 25.0 22 22 A 71 TYR H A 23 PHE CB 1.0 . 25.0 23 23 A 72 PHE H A 23 PHE CB 1.0 . 21.0 24 24 A 73 LEU H A 23 PHE CB 1.0 . 21.0 25 25 A 74 SER H A 23 PHE CB 1.0 . 21.0 26 26 A 75 VAL H A 23 PHE CB 1.0 . 21.0 27 27 A 76 VAL H A 23 PHE CB 1.0 . 17.0 28 28 A 77 VAL H A 23 PHE CB 1.0 . 21.0 29 29 A 78 GLU H A 23 PHE CB 1.0 . 21.0 30 30 A 79 GLN CB A 23 PHE H 1.0 . 21.0 31 31 A 79 GLN H A 23 PHE CB 1.0 . 21.0 32 32 A 23 PHE CB A 80 LEU H 1.0 . 21.0 33 33 A 23 PHE CB A 81 GLU H 1.0 . 21.0 34 34 A 23 PHE CB A 82 GLU H 1.0 . 21.0 35 35 A 23 PHE CB A 83 SER H 1.0 . 25.0 36 36 A 23 PHE CB A 84 ARG H 1.0 . 25.0 37 37 A 23 PHE CB A 85 GLN H 1.0 . 25.0 38 38 A 23 PHE CB A 86 ARG H 1.0 . 25.0 39 39 A 23 PHE CB A 87 LEU H 1.0 . 25.0 40 40 A 24 SER H A 79 GLN CB 1.0 . 17.0 41 41 A 26 LEU H A 79 GLN CB 1.0 . 11.0 42 42 A 27 LEU H A 79 GLN CB 1.0 . 11.0 43 43 A 28 ALA H A 79 GLN CB 1.0 . 9.0 44 44 A 29 LEU H A 79 GLN CB 1.0 . 11.0 45 45 A 30 ALA H A 79 GLN CB 1.0 . 14.0 46 46 A 31 LEU H A 52 SER CB 1.0 . 25.0 47 47 A 31 LEU H A 79 GLN CB 1.0 . 11.0 48 48 A 32 VAL H A 52 SER CB 1.0 . 25.0 49 49 A 32 VAL H A 79 GLN CB 1.0 . 14.0 50 50 A 33 VAL H A 52 SER CB 1.0 . 25.0 51 51 A 33 VAL H A 79 GLN CB 1.0 . 17.0 52 52 A 34 LEU H A 52 SER CB 1.0 . 25.0 53 53 A 34 LEU H A 79 GLN CB 1.0 . 17.0 54 54 A 35 ALA H A 52 SER CB 1.0 . 21.0 55 55 A 35 ALA H A 79 GLN CB 1.0 . 17.0 56 56 A 36 ILE H A 52 SER CB 1.0 . 21.0 57 57 A 36 ILE H A 79 GLN CB 1.0 . 17.0 58 58 A 37 VAL H A 52 SER CB 1.0 . 17.0 59 59 A 37 VAL H A 79 GLN CB 1.0 . 21.0 60 60 A 38 VAL H A 52 SER CB 1.0 . 21.0 61 61 A 38 VAL H A 79 GLN CB 1.0 . 21.0 62 62 A 39 GLN H A 52 SER CB 1.0 . 17.0 63 63 A 39 GLN H A 79 GLN CB 1.0 . 21.0 64 64 A 40 MET H A 52 SER CB 1.0 . 14.0 65 65 A 40 MET H A 79 GLN CB 1.0 . 25.0 66 66 A 41 ALA H A 52 SER CB 1.0 . 14.0 67 67 A 41 ALA H A 79 GLN CB 1.0 . 25.0 68 68 A 42 VAL H A 52 SER CB 1.0 . 14.0 69 69 A 42 VAL H A 79 GLN CB 1.0 . 25.0 70 70 A 43 THR H A 52 SER CB 1.0 . 14.0 71 71 A 43 THR H A 79 GLN CB 1.0 . 25.0 72 72 A 44 MET H A 52 SER CB 1.0 . 14.0 73 73 A 45 VAL H A 52 SER CB 1.0 . 14.0 74 74 A 46 LEU H A 52 SER CB 1.0 . 14.0 75 75 A 47 HIS H A 52 SER CB 1.0 . 14.0 76 76 A 52 SER CB A 48 GLY H 1.0 . 11.0 77 77 A 52 SER CB A 49 GLN H 1.0 . 14.0 78 78 A 52 SER CB A 50 VAL H 1.0 . 11.0 79 79 A 51 GLU H A 52 SER CB 1.0 . 7.0 80 80 A 53 ILE H A 52 SER CB 1.0 . 7.0 81 81 A 54 ASP H A 52 SER CB 1.0 . 9.0 82 82 A 52 SER CB A 55 VAL H 1.0 . 11.0 83 83 A 52 SER CB A 56 ILE H 1.0 . 9.0 84 84 A 52 SER CB A 57 ARG H 1.0 . 11.0 85 85 A 58 SER H A 52 SER CB 1.0 . 11.0 86 86 A 59 ILE H A 52 SER CB 1.0 . 11.0 87 87 A 60 PHE H A 52 SER CB 1.0 . 14.0 88 88 A 61 PHE H A 52 SER CB 1.0 . 14.0 89 89 A 62 GLY H A 52 SER CB 1.0 . 17.0 90 90 A 63 LEU H A 52 SER CB 1.0 . 17.0 91 91 A 64 LEU H A 52 SER CB 1.0 . 21.0 92 92 A 65 ILE H A 52 SER CB 1.0 . 21.0 93 93 A 66 THR H A 52 SER CB 1.0 . 21.0 94 94 A 68 TRP H A 52 SER CB 1.0 . 25.0 95 95 A 69 ALA H A 52 SER CB 1.0 . 25.0 96 96 A 70 VAL H A 52 SER CB 1.0 . 25.0 97 97 A 72 PHE H A 52 SER CB 1.0 . 25.0 98 98 A 62 GLY H A 79 GLN CB 1.0 . 25.0 99 99 A 63 LEU H A 79 GLN CB 1.0 . 25.0 100 100 A 64 LEU H A 79 GLN CB 1.0 . 25.0 101 101 A 65 ILE H A 79 GLN CB 1.0 . 21.0 102 102 A 66 THR H A 79 GLN CB 1.0 . 21.0 103 103 A 68 TRP H A 79 GLN CB 1.0 . 17.0 104 104 A 69 ALA H A 79 GLN CB 1.0 . 17.0 105 105 A 70 VAL H A 79 GLN CB 1.0 . 17.0 106 106 A 71 TYR H A 79 GLN CB 1.0 . 14.0 107 107 A 72 PHE H A 79 GLN CB 1.0 . 11.0 108 108 A 73 LEU H A 79 GLN CB 1.0 . 11.0 109 109 A 74 SER H A 79 GLN CB 1.0 . 11.0 110 110 A 75 VAL H A 79 GLN CB 1.0 . 7.0 111 111 A 76 VAL H A 79 GLN CB 1.0 . 7.0 112 112 A 77 VAL H A 79 GLN CB 1.0 . 7.0 113 113 A 78 GLU H A 79 GLN CB 1.0 . 7.0 114 114 A 79 GLN CB A 80 LEU H 1.0 . 7.0 115 115 A 79 GLN CB A 81 GLU H 1.0 . 7.0 116 116 A 79 GLN CB A 82 GLU H 1.0 . 9.0 117 117 A 79 GLN CB A 83 SER H 1.0 . 11.0 118 118 A 79 GLN CB A 84 ARG H 1.0 . 14.0 119 119 A 79 GLN CB A 85 GLN H 1.0 . 11.0 120 120 A 79 GLN CB A 86 ARG H 1.0 . 11.0 121 121 A 79 GLN CB A 87 LEU H 1.0 . 11.0 122 122 A 79 GLN CB A 88 SER H 1.0 . 11.0 123 123 A 79 GLN CB A 89 ARG H 1.0 . 14.0 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 pre _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 18 LEU H A 23 PHE CB 1.0 4.0 . 2 2 A 18 LEU H A 52 SER CB 1.0 19.0 . 3 3 A 18 LEU H A 79 GLN CB 1.0 7.0 . 4 4 A 23 PHE CB A 19 GLY H 1.0 4.0 . 5 5 A 19 GLY H A 52 SER CB 1.0 21.0 . 6 6 A 79 GLN CB A 19 GLY H 1.0 4.0 . 7 7 A 23 PHE CB A 20 LEU H 1.0 4.0 . 8 8 A 20 LEU H A 52 SER CB 1.0 25.0 . 9 9 A 79 GLN CB A 20 LEU H 1.0 4.0 . 10 10 A 28 ALA H A 23 PHE CB 1.0 4.0 . 11 11 A 29 LEU H A 23 PHE CB 1.0 7.0 . 12 12 A 30 ALA H A 23 PHE CB 1.0 7.0 . 13 13 A 31 LEU H A 23 PHE CB 1.0 9.0 . 14 14 A 32 VAL H A 23 PHE CB 1.0 7.0 . 15 15 A 33 VAL H A 23 PHE CB 1.0 11.0 . 16 16 A 34 LEU H A 23 PHE CB 1.0 11.0 . 17 17 A 35 ALA H A 23 PHE CB 1.0 14.0 . 18 18 A 36 ILE H A 23 PHE CB 1.0 14.0 . 19 19 A 37 VAL H A 23 PHE CB 1.0 17.0 . 20 20 A 38 VAL H A 23 PHE CB 1.0 17.0 . 21 21 A 39 GLN H A 23 PHE CB 1.0 17.0 . 22 22 A 40 MET H A 23 PHE CB 1.0 21.0 . 23 23 A 41 ALA H A 23 PHE CB 1.0 21.0 . 24 24 A 42 VAL H A 23 PHE CB 1.0 19.0 . 25 25 A 43 THR H A 23 PHE CB 1.0 25.0 . 26 26 A 44 MET H A 23 PHE CB 1.0 25.0 . 27 27 A 45 VAL H A 23 PHE CB 1.0 25.0 . 28 28 A 46 LEU H A 23 PHE CB 1.0 25.0 . 29 29 A 47 HIS H A 23 PHE CB 1.0 25.0 . 30 30 A 23 PHE CB A 48 GLY H 1.0 25.0 . 31 31 A 23 PHE CB A 49 GLN H 1.0 25.0 . 32 32 A 23 PHE CB A 50 VAL H 1.0 25.0 . 33 33 A 51 GLU H A 23 PHE CB 1.0 25.0 . 34 34 A 23 PHE H A 52 SER CB 1.0 25.0 . 35 35 A 52 SER H A 23 PHE CB 1.0 25.0 . 36 36 A 53 ILE H A 23 PHE CB 1.0 25.0 . 37 37 A 54 ASP H A 23 PHE CB 1.0 25.0 . 38 38 A 23 PHE CB A 55 VAL H 1.0 25.0 . 39 39 A 23 PHE CB A 56 ILE H 1.0 25.0 . 40 40 A 23 PHE CB A 57 ARG H 1.0 25.0 . 41 41 A 58 SER H A 23 PHE CB 1.0 25.0 . 42 42 A 59 ILE H A 23 PHE CB 1.0 25.0 . 43 43 A 60 PHE H A 23 PHE CB 1.0 25.0 . 44 44 A 61 PHE H A 23 PHE CB 1.0 21.0 . 45 45 A 62 GLY H A 23 PHE CB 1.0 21.0 . 46 46 A 63 LEU H A 23 PHE CB 1.0 21.0 . 47 47 A 64 LEU H A 23 PHE CB 1.0 21.0 . 48 48 A 65 ILE H A 23 PHE CB 1.0 17.0 . 49 49 A 66 THR H A 23 PHE CB 1.0 17.0 . 50 50 A 68 TRP H A 23 PHE CB 1.0 19.0 . 51 51 A 69 ALA H A 23 PHE CB 1.0 17.0 . 52 52 A 70 VAL H A 23 PHE CB 1.0 17.0 . 53 53 A 71 TYR H A 23 PHE CB 1.0 17.0 . 54 54 A 72 PHE H A 23 PHE CB 1.0 14.0 . 55 55 A 73 LEU H A 23 PHE CB 1.0 14.0 . 56 56 A 74 SER H A 23 PHE CB 1.0 14.0 . 57 57 A 75 VAL H A 23 PHE CB 1.0 14.0 . 58 58 A 76 VAL H A 23 PHE CB 1.0 11.0 . 59 59 A 77 VAL H A 23 PHE CB 1.0 11.0 . 60 60 A 78 GLU H A 23 PHE CB 1.0 14.0 . 61 61 A 79 GLN CB A 23 PHE H 1.0 9.0 . 62 62 A 79 GLN H A 23 PHE CB 1.0 11.0 . 63 63 A 23 PHE CB A 80 LEU H 1.0 11.0 . 64 64 A 23 PHE CB A 81 GLU H 1.0 11.0 . 65 65 A 23 PHE CB A 82 GLU H 1.0 9.0 . 66 66 A 23 PHE CB A 83 SER H 1.0 11.0 . 67 67 A 23 PHE CB A 84 ARG H 1.0 11.0 . 68 68 A 23 PHE CB A 85 GLN H 1.0 11.0 . 69 69 A 23 PHE CB A 86 ARG H 1.0 11.0 . 70 70 A 23 PHE CB A 87 LEU H 1.0 11.0 . 71 71 A 23 PHE CB A 88 SER H 1.0 14.0 . 72 72 A 23 PHE CB A 89 ARG H 1.0 11.0 . 73 73 A 24 SER H A 52 SER CB 1.0 25.0 . 74 74 A 24 SER H A 79 GLN CB 1.0 9.0 . 75 75 A 25 MET H A 52 SER CB 1.0 25.0 . 76 76 A 25 MET H A 79 GLN CB 1.0 4.0 . 77 77 A 26 LEU H A 52 SER CB 1.0 25.0 . 78 78 A 26 LEU H A 79 GLN CB 1.0 4.0 . 79 79 A 27 LEU H A 52 SER CB 1.0 25.0 . 80 80 A 28 ALA H A 52 SER CB 1.0 21.0 . 81 81 A 29 LEU H A 52 SER CB 1.0 21.0 . 82 82 A 29 LEU H A 79 GLN CB 1.0 4.0 . 83 83 A 30 ALA H A 52 SER CB 1.0 21.0 . 84 84 A 30 ALA H A 79 GLN CB 1.0 4.0 . 85 85 A 31 LEU H A 52 SER CB 1.0 17.0 . 86 86 A 32 VAL H A 52 SER CB 1.0 17.0 . 87 87 A 32 VAL H A 79 GLN CB 1.0 7.0 . 88 88 A 33 VAL H A 52 SER CB 1.0 17.0 . 89 89 A 33 VAL H A 79 GLN CB 1.0 9.0 . 90 90 A 34 LEU H A 52 SER CB 1.0 17.0 . 91 91 A 34 LEU H A 79 GLN CB 1.0 9.0 . 92 92 A 35 ALA H A 52 SER CB 1.0 14.0 . 93 93 A 35 ALA H A 79 GLN CB 1.0 7.0 . 94 94 A 36 ILE H A 52 SER CB 1.0 14.0 . 95 95 A 36 ILE H A 79 GLN CB 1.0 11.0 . 96 96 A 37 VAL H A 52 SER CB 1.0 11.0 . 97 97 A 37 VAL H A 79 GLN CB 1.0 14.0 . 98 98 A 38 VAL H A 52 SER CB 1.0 14.0 . 99 99 A 38 VAL H A 79 GLN CB 1.0 14.0 . 100 100 A 39 GLN H A 52 SER CB 1.0 11.0 . 101 101 A 39 GLN H A 79 GLN CB 1.0 14.0 . 102 102 A 40 MET H A 52 SER CB 1.0 7.0 . 103 103 A 40 MET H A 79 GLN CB 1.0 17.0 . 104 104 A 41 ALA H A 52 SER CB 1.0 7.0 . 105 105 A 41 ALA H A 79 GLN CB 1.0 17.0 . 106 106 A 42 VAL H A 52 SER CB 1.0 7.0 . 107 107 A 42 VAL H A 79 GLN CB 1.0 17.0 . 108 108 A 43 THR H A 52 SER CB 1.0 7.0 . 109 109 A 43 THR H A 79 GLN CB 1.0 17.0 . 110 110 A 44 MET H A 52 SER CB 1.0 7.0 . 111 111 A 44 MET H A 79 GLN CB 1.0 21.0 . 112 112 A 45 VAL H A 52 SER CB 1.0 7.0 . 113 113 A 45 VAL H A 79 GLN CB 1.0 21.0 . 114 114 A 46 LEU H A 52 SER CB 1.0 7.0 . 115 115 A 46 LEU H A 79 GLN CB 1.0 21.0 . 116 116 A 47 HIS H A 52 SER CB 1.0 7.0 . 117 117 A 47 HIS H A 79 GLN CB 1.0 25.0 . 118 118 A 52 SER CB A 48 GLY H 1.0 4.0 . 119 119 A 79 GLN CB A 48 GLY H 1.0 25.0 . 120 120 A 52 SER CB A 49 GLN H 1.0 4.0 . 121 121 A 79 GLN CB A 49 GLN H 1.0 25.0 . 122 122 A 79 GLN CB A 50 VAL H 1.0 25.0 . 123 123 A 51 GLU H A 79 GLN CB 1.0 25.0 . 124 124 A 52 SER CB A 55 VAL H 1.0 4.0 . 125 125 A 60 PHE H A 52 SER CB 1.0 7.0 . 126 126 A 61 PHE H A 52 SER CB 1.0 7.0 . 127 127 A 62 GLY H A 52 SER CB 1.0 9.0 . 128 128 A 63 LEU H A 52 SER CB 1.0 9.0 . 129 129 A 64 LEU H A 52 SER CB 1.0 9.0 . 130 130 A 65 ILE H A 52 SER CB 1.0 11.0 . 131 131 A 66 THR H A 52 SER CB 1.0 11.0 . 132 132 A 68 TRP H A 52 SER CB 1.0 14.0 . 133 133 A 69 ALA H A 52 SER CB 1.0 14.0 . 134 134 A 70 VAL H A 52 SER CB 1.0 17.0 . 135 135 A 71 TYR H A 52 SER CB 1.0 19.0 . 136 136 A 72 PHE H A 52 SER CB 1.0 17.0 . 137 137 A 73 LEU H A 52 SER CB 1.0 19.0 . 138 138 A 74 SER H A 52 SER CB 1.0 21.0 . 139 139 A 75 VAL H A 52 SER CB 1.0 21.0 . 140 140 A 76 VAL H A 52 SER CB 1.0 21.0 . 141 141 A 77 VAL H A 52 SER CB 1.0 25.0 . 142 142 A 78 GLU H A 52 SER CB 1.0 25.0 . 143 143 A 52 SER H A 79 GLN CB 1.0 25.0 . 144 144 A 79 GLN H A 52 SER CB 1.0 25.0 . 145 145 A 80 LEU H A 52 SER CB 1.0 25.0 . 146 146 A 81 GLU H A 52 SER CB 1.0 25.0 . 147 147 A 82 GLU H A 52 SER CB 1.0 25.0 . 148 148 A 83 SER H A 52 SER CB 1.0 25.0 . 149 149 A 84 ARG H A 52 SER CB 1.0 25.0 . 150 150 A 85 GLN H A 52 SER CB 1.0 25.0 . 151 151 A 86 ARG H A 52 SER CB 1.0 25.0 . 152 152 A 87 LEU H A 52 SER CB 1.0 25.0 . 153 153 A 52 SER CB A 88 SER H 1.0 25.0 . 154 154 A 52 SER CB A 89 ARG H 1.0 21.0 . 155 155 A 53 ILE H A 79 GLN CB 1.0 25.0 . 156 156 A 54 ASP H A 79 GLN CB 1.0 25.0 . 157 157 A 79 GLN CB A 55 VAL H 1.0 25.0 . 158 158 A 79 GLN CB A 56 ILE H 1.0 25.0 . 159 159 A 79 GLN CB A 57 ARG H 1.0 25.0 . 160 160 A 58 SER H A 79 GLN CB 1.0 25.0 . 161 161 A 59 ILE H A 79 GLN CB 1.0 25.0 . 162 162 A 60 PHE H A 79 GLN CB 1.0 25.0 . 163 163 A 61 PHE H A 79 GLN CB 1.0 21.0 . 164 164 A 62 GLY H A 79 GLN CB 1.0 17.0 . 165 165 A 63 LEU H A 79 GLN CB 1.0 17.0 . 166 166 A 64 LEU H A 79 GLN CB 1.0 17.0 . 167 167 A 65 ILE H A 79 GLN CB 1.0 14.0 . 168 168 A 66 THR H A 79 GLN CB 1.0 14.0 . 169 169 A 68 TRP H A 79 GLN CB 1.0 14.0 . 170 170 A 69 ALA H A 79 GLN CB 1.0 11.0 . 171 171 A 70 VAL H A 79 GLN CB 1.0 11.0 . 172 172 A 71 TYR H A 79 GLN CB 1.0 7.0 . 173 173 A 73 LEU H A 79 GLN CB 1.0 4.0 . 174 174 A 74 SER H A 79 GLN CB 1.0 4.0 . 175 175 A 79 GLN CB A 84 ARG H 1.0 4.0 . 176 176 A 79 GLN CB A 89 ARG H 1.0 4.0 . stop_ save_