data_nef_c50114_6yel save_entry_information_1 _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information_1 _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 50118 stop_ save_ save_assembly_1 _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly_1 loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 SER middle . . 3 A 3 PRO middle . false 4 A 4 GLU middle . . 5 A 5 PHE middle . . 6 A 6 ASN middle . . 7 A 7 ARG middle . . 8 A 8 TYR middle . . 9 A 9 SER middle . . 10 A 10 LYS middle . . 11 A 11 GLU middle . . 12 A 12 HIS middle . . 13 A 13 MET middle . . 14 A 14 LYS middle . . 15 A 15 LYS middle . . 16 A 16 MET middle . . 17 A 17 MET middle . . 18 A 18 LYS middle . . 19 A 19 ASP middle . . 20 A 20 LEU middle . . 21 A 21 GLU middle . . 22 A 22 GLY middle . false 23 A 23 LEU middle . . 24 A 24 HIS middle . . 25 A 25 ARG middle . . 26 A 26 ALA middle . . 27 A 27 GLU middle . . 28 A 28 GLN middle . . 29 A 29 SER middle . . 30 A 30 LEU middle . . 31 A 31 HIS middle . . 32 A 32 ASP middle . . 33 A 33 LEU middle . . 34 A 34 GLN middle . . 35 A 35 GLU middle . . 36 A 36 ARG middle . . 37 A 37 LEU middle . . 38 A 38 HIS middle . . 39 A 39 LYS middle . . 40 A 40 ALA middle . . 41 A 41 GLN middle . . 42 A 42 GLU middle . . 43 A 43 GLU middle . . 44 A 44 HIS middle . . 45 A 45 ARG middle . . 46 A 46 THR middle . . 47 A 47 VAL middle . . 48 A 48 GLU middle . . 49 A 49 VAL middle . . 50 A 50 GLU middle . . 51 A 51 LYS middle . . 52 A 52 VAL middle . . 53 A 53 HIS middle . . 54 A 54 LEU middle . . 55 A 55 GLU middle . . 56 A 56 LYS middle . . 57 A 57 LYS middle . . 58 A 58 LEU middle . . 59 A 59 ARG middle . . 60 A 60 ASP middle . . 61 A 61 GLU middle . . 62 A 62 ILE middle . . 63 A 63 ASN middle . . 64 A 64 LEU middle . . 65 A 65 ALA middle . . 66 A 66 LYS middle . . 67 A 67 GLN middle . . 68 A 68 GLU middle . . 69 A 69 ALA middle . . 70 A 70 GLN middle . . 71 A 71 ARG middle . . 72 A 72 LEU middle . . 73 A 73 LYS middle . . 74 A 74 GLU middle . . 75 A 75 LEU middle . . 76 A 76 ARG middle . . 77 A 77 GLU middle . . 78 A 78 GLY middle . false 79 A 79 THR middle . . 80 A 80 GLU middle . . 81 A 81 ASN middle . . 82 A 82 GLU middle . . 83 A 83 ARG middle . . 84 A 84 SER middle . . 85 A 85 ARG middle . . 86 A 86 GLN middle . . 87 A 87 LYS middle . . 88 A 88 TYR middle . . 89 A 89 ALA middle . . 90 A 90 GLU middle . . 91 A 91 GLU middle . . 92 A 92 GLU middle . . 93 A 93 LEU middle . . 94 A 94 GLU middle . . 95 A 95 GLN middle . . 96 A 96 VAL middle . . 97 A 97 ARG middle . . 98 A 98 GLU middle . . 99 A 99 ALA middle . . 100 A 100 LEU middle . . 101 A 101 ARG middle . . 102 A 102 LYS middle . . 103 A 103 ALA middle . . 104 A 104 GLU middle . . 105 A 105 LYS middle . . 106 A 106 GLU middle . . 107 A 107 LEU middle . . 108 A 108 GLU middle . . 109 A 109 SER middle . . 110 A 110 HIS middle . . 111 A 111 SER middle . . 112 A 112 SER middle . . 113 A 113 TRP middle . . 114 A 114 TYR middle . . 115 A 115 ALA end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 6 ASN H H 1 8.501 0.020 A 6 ASN HA H 1 4.634 0.020 A 6 ASN HB2 H 1 2.761 0.020 A 6 ASN HB3 H 1 2.761 0.020 A 6 ASN HD21 H 1 6.892 0.020 A 6 ASN HD22 H 1 7.713 0.020 A 6 ASN C C 13 175.266 0.3 A 6 ASN CA C 13 53.727 0.3 A 6 ASN CB C 13 38.672 0.3 A 6 ASN N N 15 120.187 0.3 A 6 ASN ND2 N 15 112.383 0.3 A 7 ARG H H 1 8.102 0.020 A 7 ARG HA H 1 4.096 0.020 A 7 ARG HB2 H 1 1.981 0.020 A 7 ARG HB3 H 1 1.981 0.020 A 7 ARG C C 13 175.990 0.3 A 7 ARG CA C 13 57.363 0.3 A 7 ARG CB C 13 30.779 0.3 A 7 ARG N N 15 119.966 0.3 A 8 TYR H H 1 7.760 0.020 A 8 TYR HA H 1 4.663 0.020 A 8 TYR HB2 H 1 2.879 0.020 A 8 TYR HB3 H 1 2.879 0.020 A 8 TYR HD1 H 1 7.049 0.020 A 8 TYR HD2 H 1 7.049 0.020 A 8 TYR C C 13 174.806 0.3 A 8 TYR CA C 13 57.271 0.3 A 8 TYR CB C 13 39.011 0.3 A 8 TYR N N 15 117.900 0.3 A 9 SER H H 1 7.973 0.020 A 9 SER HA H 1 4.663 0.020 A 9 SER HB2 H 1 3.853 0.020 A 9 SER HB3 H 1 3.853 0.020 A 9 SER HG H 1 5.794 0.020 A 9 SER C C 13 175.107 0.3 A 9 SER CA C 13 59.330 0.3 A 9 SER CB C 13 63.848 0.3 A 9 SER N N 15 115.048 0.3 A 10 LYS H H 1 8.280 0.020 A 10 LYS C C 13 177.361 0.3 A 10 LYS CA C 13 58.211 0.3 A 10 LYS CB C 13 28.187 0.3 A 10 LYS N N 15 116.855 0.3 A 11 GLU H H 1 8.133 0.020 A 11 GLU C C 13 178.206 0.3 A 11 GLU CA C 13 58.862 0.3 A 11 GLU CB C 13 32.169 0.3 A 11 GLU N N 15 120.429 0.3 A 16 MET H H 1 7.918 0.020 A 16 MET HA H 1 4.165 0.020 A 16 MET HB2 H 1 2.162 0.020 A 16 MET HB3 H 1 2.162 0.020 A 16 MET HG2 H 1 2.505 0.020 A 16 MET HG3 H 1 2.505 0.020 A 16 MET C C 13 177.850 0.3 A 16 MET CA C 13 58.276 0.3 A 16 MET CB C 13 32.910 0.3 A 16 MET CG C 13 32.185 0.3 A 16 MET N N 15 117.941 0.3 A 17 MET H H 1 7.910 0.020 A 17 MET HA H 1 4.236 0.020 A 17 MET HB2 H 1 2.127 0.020 A 17 MET HB3 H 1 2.127 0.020 A 17 MET HG2 H 1 2.593 0.020 A 17 MET HG3 H 1 2.593 0.020 A 17 MET C C 13 177.517 0.3 A 17 MET CA C 13 57.638 0.3 A 17 MET CB C 13 32.816 0.3 A 17 MET CG C 13 32.539 0.3 A 17 MET N N 15 116.118 0.3 A 18 LYS H H 1 7.720 0.020 A 18 LYS HB2 H 1 1.954 0.020 A 18 LYS HB3 H 1 1.954 0.020 A 18 LYS C C 13 178.046 0.3 A 18 LYS CA C 13 58.105 0.3 A 18 LYS CB C 13 32.236 0.3 A 18 LYS N N 15 118.176 0.3 A 19 ASP H H 1 8.054 0.020 A 19 ASP HA H 1 4.644 0.020 A 19 ASP HB2 H 1 2.843 0.020 A 19 ASP HB3 H 1 2.843 0.020 A 19 ASP C C 13 177.167 0.3 A 19 ASP CA C 13 55.469 0.3 A 19 ASP CB C 13 40.514 0.3 A 19 ASP N N 15 119.192 0.3 A 20 LEU H H 1 7.855 0.020 A 20 LEU HA H 1 4.204 0.020 A 20 LEU HB2 H 1 1.869 0.020 A 20 LEU HB3 H 1 1.869 0.020 A 20 LEU HD1% H 1 0.966 0.020 A 20 LEU HD2% H 1 0.966 0.020 A 20 LEU HG H 1 1.840 0.020 A 20 LEU C C 13 177.837 0.3 A 20 LEU CA C 13 56.004 0.3 A 20 LEU CB C 13 41.569 0.3 A 20 LEU CD1 C 13 24.346 0.3 A 20 LEU CG C 13 26.553 0.3 A 20 LEU N N 15 120.807 0.3 A 21 GLU H H 1 8.226 0.020 A 21 GLU HA H 1 4.273 0.020 A 21 GLU HB2 H 1 2.185 0.020 A 21 GLU HB3 H 1 2.185 0.020 A 21 GLU C C 13 178.368 0.3 A 21 GLU CA C 13 58.593 0.3 A 21 GLU CB C 13 29.289 0.3 A 21 GLU N N 15 121.310 0.3 A 22 GLY H H 1 8.380 0.020 A 22 GLY HA2 H 1 3.926 0.020 A 22 GLY HA3 H 1 3.926 0.020 A 22 GLY C C 13 175.027 0.3 A 22 GLY CA C 13 46.328 0.3 A 22 GLY N N 15 106.974 0.3 A 23 LEU H H 1 7.696 0.020 A 23 LEU HA H 1 4.256 0.020 A 23 LEU HB2 H 1 1.632 0.020 A 23 LEU HB3 H 1 1.632 0.020 A 23 LEU HD1% H 1 0.903 0.020 A 23 LEU HD2% H 1 0.903 0.020 A 23 LEU HG H 1 1.786 0.020 A 23 LEU C C 13 177.804 0.3 A 23 LEU CA C 13 56.253 0.3 A 23 LEU CB C 13 41.591 0.3 A 23 LEU CD1 C 13 24.196 0.3 A 23 LEU CG C 13 27.328 0.3 A 23 LEU N N 15 120.269 0.3 A 24 HIS H H 1 8.078 0.020 A 24 HIS HA H 1 4.633 0.020 A 24 HIS HB2 H 1 3.347 0.020 A 24 HIS HB3 H 1 3.347 0.020 A 24 HIS HE2 H 1 9.264 0.020 A 24 HIS C C 13 176.313 0.3 A 24 HIS CA C 13 57.264 0.3 A 24 HIS CB C 13 28.439 0.3 A 24 HIS N N 15 117.102 0.3 A 25 ARG H H 1 8.212 0.020 A 25 ARG HA H 1 4.261 0.020 A 25 ARG HB2 H 1 1.957 0.020 A 25 ARG HB3 H 1 1.957 0.020 A 25 ARG C C 13 177.523 0.3 A 25 ARG CA C 13 57.888 0.3 A 25 ARG CB C 13 30.311 0.3 A 25 ARG N N 15 119.905 0.3 A 26 ALA H H 1 8.074 0.020 A 26 ALA HA H 1 4.251 0.020 A 26 ALA HB% H 1 1.483 0.020 A 26 ALA C C 13 178.070 0.3 A 26 ALA CA C 13 54.105 0.3 A 26 ALA CB C 13 18.756 0.3 A 26 ALA N N 15 122.659 0.3 A 27 GLU H H 1 8.225 0.020 A 27 GLU HA H 1 4.228 0.020 A 27 GLU HB2 H 1 2.158 0.020 A 27 GLU HB3 H 1 2.158 0.020 A 27 GLU HG2 H 1 2.364 0.020 A 27 GLU HG3 H 1 2.364 0.020 A 27 GLU C C 13 177.749 0.3 A 27 GLU CA C 13 59.150 0.3 A 27 GLU CB C 13 29.437 0.3 A 27 GLU CG C 13 34.081 0.3 A 27 GLU N N 15 117.904 0.3 A 28 GLN H H 1 8.095 0.020 A 28 GLN HA H 1 4.171 0.020 A 28 GLN HB2 H 1 2.177 0.020 A 28 GLN HB3 H 1 2.177 0.020 A 28 GLN HE21 H 1 7.413 0.020 A 28 GLN HE22 H 1 6.785 0.020 A 28 GLN HG2 H 1 2.430 0.020 A 28 GLN HG3 H 1 2.430 0.020 A 28 GLN C C 13 177.516 0.3 A 28 GLN CA C 13 57.845 0.3 A 28 GLN CB C 13 28.711 0.3 A 28 GLN CG C 13 34.000 0.3 A 28 GLN N N 15 118.156 0.3 A 28 GLN NE2 N 15 111.317 0.3 A 29 SER H H 1 8.207 0.020 A 29 SER HA H 1 4.500 0.020 A 29 SER HB2 H 1 3.937 0.020 A 29 SER HB3 H 1 3.937 0.020 A 29 SER C C 13 175.990 0.3 A 29 SER CA C 13 61.059 0.3 A 29 SER CB C 13 63.906 0.3 A 29 SER N N 15 115.950 0.3 A 30 LEU H H 1 8.309 0.020 A 30 LEU HA H 1 4.047 0.020 A 30 LEU HB2 H 1 1.755 0.020 A 30 LEU HB3 H 1 1.755 0.020 A 30 LEU C C 13 178.424 0.3 A 30 LEU CA C 13 57.492 0.3 A 30 LEU CB C 13 42.021 0.3 A 30 LEU CD1 C 13 24.346 0.3 A 30 LEU CG C 13 26.942 0.3 A 30 LEU N N 15 122.040 0.3 A 31 HIS H H 1 8.159 0.020 A 31 HIS HA H 1 4.557 0.020 A 31 HIS HB2 H 1 3.380 0.020 A 31 HIS HB3 H 1 3.380 0.020 A 31 HIS C C 13 177.248 0.3 A 31 HIS CA C 13 58.461 0.3 A 31 HIS CB C 13 29.507 0.3 A 31 HIS N N 15 117.163 0.3 A 32 ASP H H 1 8.353 0.020 A 32 ASP HA H 1 4.686 0.020 A 32 ASP HB2 H 1 2.809 0.020 A 32 ASP HB3 H 1 2.809 0.020 A 32 ASP C C 13 178.769 0.3 A 32 ASP CA C 13 57.370 0.3 A 32 ASP CB C 13 40.515 0.3 A 32 ASP N N 15 120.695 0.3 A 33 LEU H H 1 8.165 0.020 A 33 LEU HA H 1 4.332 0.020 A 33 LEU HB2 H 1 1.722 0.020 A 33 LEU HB3 H 1 1.722 0.020 A 33 LEU HD1% H 1 0.897 0.020 A 33 LEU HD2% H 1 0.897 0.020 A 33 LEU HG H 1 1.620 0.020 A 33 LEU C C 13 178.508 0.3 A 33 LEU CA C 13 57.401 0.3 A 33 LEU CB C 13 41.603 0.3 A 33 LEU CD1 C 13 23.764 0.3 A 33 LEU CG C 13 26.942 0.3 A 33 LEU N N 15 121.770 0.3 A 34 GLN H H 1 8.374 0.020 A 34 GLN HA H 1 4.055 0.020 A 34 GLN HB2 H 1 2.171 0.020 A 34 GLN HB3 H 1 2.171 0.020 A 34 GLN C C 13 178.239 0.3 A 34 GLN CA C 13 59.955 0.3 A 34 GLN CB C 13 28.634 0.3 A 34 GLN CG C 13 32.264 0.3 A 34 GLN N N 15 118.293 0.3 A 35 GLU H H 1 7.949 0.020 A 35 GLU HA H 1 4.084 0.020 A 35 GLU HB2 H 1 2.173 0.020 A 35 GLU HB3 H 1 2.173 0.020 A 35 GLU C C 13 179.350 0.3 A 35 GLU CA C 13 59.357 0.3 A 35 GLU CB C 13 29.436 0.3 A 35 GLU CG C 13 36.028 0.3 A 35 GLU N N 15 118.598 0.3 A 36 ARG H H 1 8.021 0.020 A 36 ARG HA H 1 4.100 0.020 A 36 ARG HB2 H 1 1.958 0.020 A 36 ARG HB3 H 1 1.958 0.020 A 36 ARG HD2 H 1 3.184 0.020 A 36 ARG HD3 H 1 3.184 0.020 A 36 ARG HG2 H 1 1.712 0.020 A 36 ARG HG3 H 1 1.712 0.020 A 36 ARG C C 13 179.363 0.3 A 36 ARG CA C 13 58.278 0.3 A 36 ARG CB C 13 29.171 0.3 A 36 ARG CD C 13 43.340 0.3 A 36 ARG N N 15 120.088 0.3 A 39 LYS H H 1 7.567 0.020 A 39 LYS HA H 1 4.022 0.020 A 39 LYS HB2 H 1 1.920 0.020 A 39 LYS HB3 H 1 1.920 0.020 A 39 LYS HD2 H 1 1.731 0.020 A 39 LYS HD3 H 1 1.731 0.020 A 39 LYS HE2 H 1 3.025 0.020 A 39 LYS HE3 H 1 3.025 0.020 A 39 LYS HG2 H 1 1.475 0.020 A 39 LYS HG3 H 1 1.475 0.020 A 39 LYS C C 13 178.190 0.3 A 39 LYS CA C 13 59.232 0.3 A 39 LYS CB C 13 32.255 0.3 A 39 LYS CD C 13 29.148 0.3 A 39 LYS CE C 13 42.388 0.3 A 39 LYS CG C 13 25.255 0.3 A 39 LYS N N 15 118.785 0.3 A 40 ALA H H 1 7.976 0.020 A 40 ALA HA H 1 4.175 0.020 A 40 ALA HB% H 1 1.567 0.020 A 40 ALA C C 13 179.863 0.3 A 40 ALA CA C 13 55.375 0.3 A 40 ALA CB C 13 18.578 0.3 A 40 ALA N N 15 121.697 0.3 A 41 GLN H H 1 8.176 0.020 A 41 GLN HA H 1 4.127 0.020 A 41 GLN HB2 H 1 2.205 0.020 A 41 GLN HB3 H 1 2.205 0.020 A 41 GLN HG2 H 1 2.553 0.020 A 41 GLN HG3 H 1 2.553 0.020 A 41 GLN C C 13 178.373 0.3 A 41 GLN CA C 13 58.583 0.3 A 41 GLN CB C 13 29.049 0.3 A 41 GLN CG C 13 34.064 0.3 A 41 GLN N N 15 117.070 0.3 A 42 GLU H H 1 7.991 0.020 A 42 GLU HA H 1 4.096 0.020 A 42 GLU HB2 H 1 2.151 0.020 A 42 GLU HB3 H 1 2.151 0.020 A 42 GLU HG2 H 1 2.287 0.020 A 42 GLU HG3 H 1 2.287 0.020 A 42 GLU C C 13 178.124 0.3 A 42 GLU CA C 13 58.459 0.3 A 42 GLU CB C 13 29.927 0.3 A 42 GLU CG C 13 36.028 0.3 A 42 GLU N N 15 119.335 0.3 A 43 GLU H H 1 7.939 0.020 A 43 GLU HA H 1 4.224 0.020 A 43 GLU HB2 H 1 2.021 0.020 A 43 GLU HB3 H 1 2.021 0.020 A 43 GLU HG2 H 1 2.382 0.020 A 43 GLU HG3 H 1 2.382 0.020 A 43 GLU C C 13 176.444 0.3 A 43 GLU CA C 13 56.792 0.3 A 43 GLU CB C 13 30.065 0.3 A 43 GLU CG C 13 36.491 0.3 A 43 GLU N N 15 116.976 0.3 A 44 HIS H H 1 7.957 0.020 A 44 HIS HA H 1 4.618 0.020 A 44 HIS HB2 H 1 3.391 0.020 A 44 HIS HB3 H 1 3.391 0.020 A 44 HIS C C 13 174.424 0.3 A 44 HIS CA C 13 56.987 0.3 A 44 HIS CB C 13 28.305 0.3 A 44 HIS N N 15 116.728 0.3 A 45 ARG H H 1 8.178 0.020 A 45 ARG HA H 1 4.410 0.020 A 45 ARG HB2 H 1 1.868 0.020 A 45 ARG HB3 H 1 1.868 0.020 A 45 ARG HD2 H 1 3.356 0.020 A 45 ARG HD3 H 1 3.356 0.020 A 45 ARG HG2 H 1 1.640 0.020 A 45 ARG HG3 H 1 1.640 0.020 A 45 ARG C C 13 176.243 0.3 A 45 ARG CA C 13 56.643 0.3 A 45 ARG CB C 13 30.853 0.3 A 45 ARG CD C 13 43.511 0.3 A 45 ARG CG C 13 27.261 0.3 A 45 ARG N N 15 119.854 0.3 A 46 THR H H 1 8.061 0.020 A 46 THR HA H 1 4.462 0.020 A 46 THR HB H 1 4.270 0.020 A 46 THR HG2% H 1 1.237 0.020 A 46 THR C C 13 174.545 0.3 A 46 THR CA C 13 61.661 0.3 A 46 THR CB C 13 69.995 0.3 A 46 THR CG2 C 13 21.551 0.3 A 46 THR N N 15 113.874 0.3 A 47 VAL H H 1 7.992 0.020 A 47 VAL HA H 1 4.232 0.020 A 47 VAL HB H 1 2.106 0.020 A 47 VAL HG1% H 1 0.970 0.020 A 47 VAL C C 13 175.527 0.3 A 47 VAL CA C 13 62.259 0.3 A 47 VAL CB C 13 32.917 0.3 A 47 VAL CG1 C 13 20.958 0.3 A 47 VAL N N 15 121.087 0.3 A 48 GLU H H 1 8.290 0.020 A 48 GLU HA H 1 4.403 0.020 A 48 GLU HB2 H 1 1.926 0.020 A 48 GLU HB3 H 1 1.926 0.020 A 48 GLU HG2 H 1 2.281 0.020 A 48 GLU HG3 H 1 2.281 0.020 A 48 GLU C C 13 176.286 0.3 A 48 GLU CA C 13 56.363 0.3 A 48 GLU CB C 13 30.743 0.3 A 48 GLU CG C 13 36.157 0.3 A 48 GLU N N 15 124.355 0.3 A 49 VAL H H 1 7.952 0.020 A 49 VAL HA H 1 4.046 0.020 A 49 VAL HB H 1 2.125 0.020 A 49 VAL HG1% H 1 0.918 0.020 A 49 VAL C C 13 175.984 0.3 A 49 VAL CA C 13 62.855 0.3 A 49 VAL CB C 13 32.058 0.3 A 49 VAL CG1 C 13 21.336 0.3 A 49 VAL N N 15 120.618 0.3 A 50 GLU H H 1 8.507 0.020 A 50 GLU C C 13 176.995 0.3 A 50 GLU CA C 13 57.114 0.3 A 50 GLU CB C 13 30.047 0.3 A 50 GLU N N 15 122.992 0.3 A 51 LYS H H 1 8.160 0.020 A 51 LYS HA H 1 4.341 0.020 A 51 LYS HB2 H 1 1.896 0.020 A 51 LYS HB3 H 1 1.896 0.020 A 51 LYS CA C 13 56.586 0.3 A 51 LYS CB C 13 32.855 0.3 A 51 LYS N N 15 121.080 0.3 A 52 VAL HA H 1 3.681 0.020 A 52 VAL HB H 1 2.286 0.020 A 52 VAL HG1% H 1 1.093 0.020 A 52 VAL CA C 13 66.042 0.3 A 52 VAL CB C 13 31.355 0.3 A 52 VAL CG1 C 13 23.000 0.3 A 55 GLU H H 1 8.287 0.020 A 55 GLU HA H 1 4.411 0.020 A 55 GLU HB2 H 1 2.170 0.020 A 55 GLU HB3 H 1 2.170 0.020 A 55 GLU CA C 13 58.799 0.3 A 55 GLU CB C 13 28.064 0.3 A 55 GLU N N 15 117.004 0.3 A 57 LYS H H 1 8.170 0.020 A 57 LYS HA H 1 3.970 0.020 A 57 LYS HB2 H 1 2.127 0.020 A 57 LYS HB3 H 1 2.127 0.020 A 57 LYS HD2 H 1 1.702 0.020 A 57 LYS HD3 H 1 1.702 0.020 A 57 LYS HE2 H 1 3.038 0.020 A 57 LYS HE3 H 1 3.038 0.020 A 57 LYS HG2 H 1 1.468 0.020 A 57 LYS HG3 H 1 1.468 0.020 A 57 LYS C C 13 178.366 0.3 A 57 LYS CA C 13 59.884 0.3 A 57 LYS CB C 13 32.348 0.3 A 57 LYS CD C 13 29.408 0.3 A 57 LYS CG C 13 25.384 0.3 A 57 LYS N N 15 117.955 0.3 A 59 ARG H H 1 8.135 0.020 A 59 ARG HA H 1 4.129 0.020 A 59 ARG HB2 H 1 1.634 0.020 A 59 ARG HB3 H 1 1.634 0.020 A 59 ARG HD2 H 1 3.024 0.020 A 59 ARG HG2 H 1 1.616 0.020 A 59 ARG HG3 H 1 1.616 0.020 A 59 ARG C C 13 175.963 0.3 A 59 ARG CA C 13 58.248 0.3 A 59 ARG CB C 13 30.902 0.3 A 59 ARG CD C 13 41.677 0.3 A 59 ARG CG C 13 27.600 0.3 A 59 ARG N N 15 119.417 0.3 A 62 ILE H H 1 8.338 0.020 A 62 ILE HA H 1 3.702 0.020 A 62 ILE HB H 1 2.031 0.020 A 62 ILE HD1% H 1 0.874 0.020 A 62 ILE HG12 H 1 1.166 0.020 A 62 ILE HG13 H 1 1.166 0.020 A 62 ILE HG2% H 1 0.984 0.020 A 62 ILE C C 13 178.079 0.3 A 62 ILE CA C 13 64.705 0.3 A 62 ILE CB C 13 37.555 0.3 A 62 ILE CD1 C 13 13.316 0.3 A 62 ILE CG1 C 13 29.336 0.3 A 62 ILE CG2 C 13 17.640 0.3 A 62 ILE N N 15 119.729 0.3 A 63 ASN H H 1 8.086 0.020 A 63 ASN HA H 1 4.496 0.020 A 63 ASN HB2 H 1 2.867 0.020 A 63 ASN HB3 H 1 2.867 0.020 A 63 ASN C C 13 175.193 0.3 A 63 ASN CA C 13 56.536 0.3 A 63 ASN CB C 13 38.298 0.3 A 63 ASN N N 15 118.351 0.3 A 64 LEU H H 1 7.867 0.020 A 64 LEU HA H 1 4.248 0.020 A 64 LEU HB2 H 1 1.773 0.020 A 64 LEU HB3 H 1 1.773 0.020 A 64 LEU HD1% H 1 0.964 0.020 A 64 LEU HD2% H 1 0.964 0.020 A 64 LEU HG H 1 1.499 0.020 A 64 LEU C C 13 179.037 0.3 A 64 LEU CA C 13 57.885 0.3 A 64 LEU CB C 13 41.759 0.3 A 64 LEU CD1 C 13 25.340 0.3 A 64 LEU CG C 13 24.700 0.3 A 64 LEU N N 15 121.342 0.3 A 65 ALA H H 1 8.316 0.020 A 65 ALA HA H 1 4.061 0.020 A 65 ALA HB% H 1 1.513 0.020 A 65 ALA C C 13 179.188 0.3 A 65 ALA CA C 13 55.171 0.3 A 65 ALA CB C 13 18.277 0.3 A 65 ALA N N 15 122.273 0.3 A 66 LYS H H 1 8.408 0.020 A 66 LYS HA H 1 3.952 0.020 A 66 LYS HB2 H 1 1.984 0.020 A 66 LYS HB3 H 1 1.984 0.020 A 66 LYS HD2 H 1 1.761 0.020 A 66 LYS HD3 H 1 1.761 0.020 A 66 LYS HE2 H 1 3.027 0.020 A 66 LYS HE3 H 1 3.027 0.020 A 66 LYS HG2 H 1 1.465 0.020 A 66 LYS HG3 H 1 1.465 0.020 A 66 LYS C C 13 178.812 0.3 A 66 LYS CA C 13 59.866 0.3 A 66 LYS CB C 13 32.590 0.3 A 66 LYS CD C 13 29.152 0.3 A 66 LYS CE C 13 42.128 0.3 A 66 LYS CG C 13 25.474 0.3 A 66 LYS N N 15 116.685 0.3 A 67 GLN H H 1 7.875 0.020 A 67 GLN HA H 1 4.179 0.020 A 67 GLN HB2 H 1 1.951 0.020 A 67 GLN HB3 H 1 1.951 0.020 A 67 GLN HE21 H 1 7.485 0.020 A 67 GLN HE22 H 1 6.793 0.020 A 67 GLN HGx H 1 2.469 0.020 A 67 GLN HGy H 1 2.564 0.020 A 67 GLN C C 13 179.176 0.3 A 67 GLN CA C 13 58.845 0.3 A 67 GLN CB C 13 28.889 0.3 A 67 GLN CG C 13 34.271 0.3 A 67 GLN N N 15 118.055 0.3 A 67 GLN NE2 N 15 111.589 0.3 A 68 GLU H H 1 8.286 0.020 A 68 GLU HA H 1 4.353 0.020 A 68 GLU HB2 H 1 2.113 0.020 A 68 GLU HB3 H 1 2.113 0.020 A 68 GLU HG2 H 1 2.256 0.020 A 68 GLU HG3 H 1 2.256 0.020 A 68 GLU C C 13 178.135 0.3 A 68 GLU CA C 13 57.103 0.3 A 68 GLU CB C 13 29.853 0.3 A 68 GLU CG C 13 35.908 0.3 A 68 GLU N N 15 120.005 0.3 A 69 ALA H H 1 8.510 0.020 A 69 ALA HA H 1 4.280 0.020 A 69 ALA HB% H 1 1.543 0.020 A 69 ALA C C 13 179.218 0.3 A 69 ALA CA C 13 54.803 0.3 A 69 ALA CB C 13 18.289 0.3 A 69 ALA N N 15 122.011 0.3 A 70 GLN H H 1 7.981 0.020 A 70 GLN HA H 1 4.015 0.020 A 70 GLN HB2 H 1 2.189 0.020 A 70 GLN HB3 H 1 2.189 0.020 A 70 GLN HG2 H 1 2.569 0.020 A 70 GLN HG3 H 1 2.569 0.020 A 70 GLN C C 13 178.299 0.3 A 70 GLN CA C 13 58.799 0.3 A 70 GLN CB C 13 28.129 0.3 A 70 GLN CG C 13 33.813 0.3 A 70 GLN N N 15 116.129 0.3 A 71 ARG H H 1 7.842 0.020 A 71 ARG HA H 1 4.143 0.020 A 71 ARG HB2 H 1 2.033 0.020 A 71 ARG HB3 H 1 2.033 0.020 A 71 ARG HD2 H 1 3.203 0.020 A 71 ARG HD3 H 1 3.203 0.020 A 71 ARG C C 13 179.044 0.3 A 71 ARG CA C 13 58.822 0.3 A 71 ARG CB C 13 30.207 0.3 A 71 ARG CD C 13 43.650 0.3 A 71 ARG CG C 13 27.331 0.3 A 71 ARG N N 15 120.051 0.3 A 72 LEU H H 1 8.163 0.020 A 72 LEU HA H 1 4.096 0.020 A 72 LEU HB2 H 1 1.585 0.020 A 72 LEU HB3 H 1 1.585 0.020 A 72 LEU HD1% H 1 0.896 0.020 A 72 LEU HD2% H 1 0.896 0.020 A 72 LEU HG H 1 1.757 0.020 A 72 LEU C C 13 179.040 0.3 A 72 LEU CA C 13 57.782 0.3 A 72 LEU CB C 13 41.674 0.3 A 72 LEU CD1 C 13 24.442 0.3 A 72 LEU CG C 13 26.462 0.3 A 72 LEU N N 15 119.299 0.3 A 73 LYS H H 1 8.096 0.020 A 73 LYS HA H 1 4.099 0.020 A 73 LYS HB2 H 1 1.963 0.020 A 73 LYS HB3 H 1 1.963 0.020 A 73 LYS HD2 H 1 1.739 0.020 A 73 LYS HD3 H 1 1.739 0.020 A 73 LYS HG2 H 1 1.607 0.020 A 73 LYS HG3 H 1 1.607 0.020 A 73 LYS C C 13 175.983 0.3 A 73 LYS CA C 13 59.629 0.3 A 73 LYS CB C 13 32.312 0.3 A 73 LYS CD C 13 29.531 0.3 A 73 LYS CE C 13 42.388 0.3 A 73 LYS CG C 13 25.313 0.3 A 73 LYS N N 15 118.827 0.3 A 74 GLU H H 1 8.129 0.020 A 74 GLU C C 13 177.674 0.3 A 74 GLU CA C 13 58.639 0.3 A 74 GLU CB C 13 29.335 0.3 A 74 GLU N N 15 118.307 0.3 A 76 ARG H H 1 7.844 0.020 A 76 ARG HA H 1 4.250 0.020 A 76 ARG HB2 H 1 1.946 0.020 A 76 ARG HB3 H 1 1.946 0.020 A 76 ARG HD2 H 1 3.227 0.020 A 76 ARG HD3 H 1 3.227 0.020 A 76 ARG C C 13 177.411 0.3 A 76 ARG CA C 13 56.641 0.3 A 76 ARG CB C 13 30.464 0.3 A 76 ARG CD C 13 43.827 0.3 A 76 ARG CG C 13 27.331 0.3 A 76 ARG N N 15 117.974 0.3 A 77 GLU H H 1 7.978 0.020 A 77 GLU HA H 1 4.234 0.020 A 77 GLU HB2 H 1 2.105 0.020 A 77 GLU HB3 H 1 2.105 0.020 A 77 GLU HG2 H 1 2.298 0.020 A 77 GLU HG3 H 1 2.298 0.020 A 77 GLU C C 13 177.614 0.3 A 77 GLU CA C 13 57.708 0.3 A 77 GLU CB C 13 30.277 0.3 A 77 GLU CG C 13 36.346 0.3 A 77 GLU N N 15 119.855 0.3 A 78 GLY H H 1 8.262 0.020 A 78 GLY HA2 H 1 4.089 0.020 A 78 GLY HA3 H 1 4.089 0.020 A 78 GLY C C 13 174.782 0.3 A 78 GLY CA C 13 45.712 0.3 A 78 GLY N N 15 108.804 0.3 A 79 THR H H 1 7.896 0.020 A 79 THR HA H 1 4.454 0.020 A 79 THR HB H 1 4.341 0.020 A 79 THR HG2% H 1 1.259 0.020 A 79 THR C C 13 174.932 0.3 A 79 THR CA C 13 61.898 0.3 A 79 THR CB C 13 70.216 0.3 A 79 THR CG2 C 13 21.442 0.3 A 79 THR N N 15 112.686 0.3 A 80 GLU H H 1 8.527 0.020 A 80 GLU HA H 1 4.393 0.020 A 80 GLU HB2 H 1 2.037 0.020 A 80 GLU HB3 H 1 2.037 0.020 A 80 GLU C C 13 176.356 0.3 A 80 GLU CA C 13 57.158 0.3 A 80 GLU CB C 13 29.795 0.3 A 80 GLU N N 15 122.242 0.3 A 81 ASN H H 1 8.289 0.020 A 81 ASN HA H 1 4.729 0.020 A 81 ASN HB2 H 1 2.756 0.020 A 81 ASN HB3 H 1 2.756 0.020 A 81 ASN HD21 H 1 7.556 0.020 A 81 ASN HD22 H 1 6.899 0.020 A 81 ASN C C 13 175.173 0.3 A 81 ASN CA C 13 53.650 0.3 A 81 ASN CB C 13 39.423 0.3 A 81 ASN N N 15 118.726 0.3 A 81 ASN ND2 N 15 112.932 0.3 A 82 GLU H H 1 8.341 0.020 A 82 GLU HA H 1 4.317 0.020 A 82 GLU HB2 H 1 1.995 0.020 A 82 GLU HB3 H 1 1.995 0.020 A 82 GLU HG2 H 1 2.256 0.020 A 82 GLU HG3 H 1 2.256 0.020 A 82 GLU C C 13 176.491 0.3 A 82 GLU CA C 13 56.906 0.3 A 82 GLU CB C 13 29.917 0.3 A 82 GLU CG C 13 36.089 0.3 A 82 GLU N N 15 121.136 0.3 A 83 ARG H H 1 8.269 0.020 A 83 ARG HA H 1 4.317 0.020 A 83 ARG HB2 H 1 1.992 0.020 A 83 ARG HB3 H 1 1.992 0.020 A 83 ARG HD2 H 1 3.085 0.020 A 83 ARG HD3 H 1 3.085 0.020 A 83 ARG HG2 H 1 1.706 0.020 A 83 ARG HG3 H 1 1.706 0.020 A 83 ARG C C 13 176.486 0.3 A 83 ARG CA C 13 56.344 0.3 A 83 ARG CB C 13 30.561 0.3 A 83 ARG CD C 13 43.438 0.3 A 83 ARG CG C 13 27.352 0.3 A 83 ARG N N 15 121.643 0.3 A 84 SER H H 1 8.271 0.020 A 84 SER HA H 1 4.439 0.020 A 84 SER HB2 H 1 3.898 0.020 A 84 SER HB3 H 1 3.898 0.020 A 84 SER C C 13 174.784 0.3 A 84 SER CA C 13 59.113 0.3 A 84 SER CB C 13 63.899 0.3 A 84 SER N N 15 116.918 0.3 A 85 ARG H H 1 8.212 0.020 A 85 ARG HA H 1 4.406 0.020 A 85 ARG HB2 H 1 1.971 0.020 A 85 ARG HB3 H 1 1.971 0.020 A 85 ARG HD2 H 1 3.231 0.020 A 85 ARG HD3 H 1 3.231 0.020 A 85 ARG HH21 H 1 7.243 0.020 A 85 ARG HH22 H 1 6.714 0.020 A 85 ARG C C 13 176.369 0.3 A 85 ARG CA C 13 56.458 0.3 A 85 ARG CB C 13 30.118 0.3 A 85 ARG CD C 13 43.555 0.3 A 85 ARG CG C 13 27.272 0.3 A 85 ARG N N 15 122.120 0.3 A 86 GLN H H 1 8.189 0.020 A 86 GLN HA H 1 4.236 0.020 A 86 GLN HB2 H 1 1.977 0.020 A 86 GLN HB3 H 1 1.977 0.020 A 86 GLN C C 13 175.919 0.3 A 86 GLN CA C 13 56.802 0.3 A 86 GLN CB C 13 29.127 0.3 A 86 GLN CG C 13 33.908 0.3 A 86 GLN N N 15 120.425 0.3 A 87 LYS H H 1 8.024 0.020 A 87 LYS HA H 1 4.231 0.020 A 87 LYS HB2 H 1 1.851 0.020 A 87 LYS HB3 H 1 1.851 0.020 A 87 LYS HD2 H 1 1.730 0.020 A 87 LYS HD3 H 1 1.730 0.020 A 87 LYS HE2 H 1 3.000 0.020 A 87 LYS HE3 H 1 3.000 0.020 A 87 LYS HG2 H 1 1.463 0.020 A 87 LYS HG3 H 1 1.463 0.020 A 87 LYS C C 13 176.730 0.3 A 87 LYS CA C 13 56.968 0.3 A 87 LYS CB C 13 32.830 0.3 A 87 LYS CD C 13 28.817 0.3 A 87 LYS CG C 13 25.082 0.3 A 87 LYS N N 15 120.857 0.3 A 88 TYR H H 1 7.912 0.020 A 88 TYR HA H 1 4.527 0.020 A 88 TYR HB2 H 1 2.881 0.020 A 88 TYR HB3 H 1 2.881 0.020 A 88 TYR HD1 H 1 7.043 0.020 A 88 TYR HD2 H 1 7.043 0.020 A 88 TYR C C 13 175.808 0.3 A 88 TYR CA C 13 58.505 0.3 A 88 TYR CB C 13 38.800 0.3 A 88 TYR N N 15 119.748 0.3 A 89 ALA H H 1 8.396 0.020 A 89 ALA HA H 1 4.391 0.020 A 89 ALA HB% H 1 1.511 0.020 A 89 ALA C C 13 178.200 0.3 A 89 ALA CA C 13 52.654 0.3 A 89 ALA CB C 13 19.209 0.3 A 89 ALA N N 15 123.401 0.3 A 90 GLU H H 1 8.495 0.020 A 90 GLU HA H 1 4.068 0.020 A 90 GLU HB2 H 1 2.112 0.020 A 90 GLU HB3 H 1 2.112 0.020 A 90 GLU HG2 H 1 2.363 0.020 A 90 GLU HG3 H 1 2.363 0.020 A 90 GLU C C 13 177.116 0.3 A 90 GLU CA C 13 59.456 0.3 A 90 GLU CB C 13 29.607 0.3 A 90 GLU CG C 13 36.292 0.3 A 90 GLU N N 15 119.912 0.3 A 91 GLU H H 1 7.725 0.020 A 91 GLU C C 13 177.125 0.3 A 91 GLU CA C 13 57.911 0.3 A 91 GLU CB C 13 32.887 0.3 A 91 GLU N N 15 118.786 0.3 A 93 LEU H H 1 8.414 0.020 A 93 LEU HA H 1 4.095 0.020 A 93 LEU HB2 H 1 2.041 0.020 A 93 LEU HB3 H 1 2.041 0.020 A 93 LEU HD1% H 1 0.902 0.020 A 93 LEU HD2% H 1 0.902 0.020 A 93 LEU HG H 1 1.724 0.020 A 93 LEU C C 13 178.416 0.3 A 93 LEU CA C 13 57.886 0.3 A 93 LEU CB C 13 41.491 0.3 A 93 LEU N N 15 120.310 0.3 A 96 VAL H H 1 7.858 0.020 A 96 VAL HA H 1 3.884 0.020 A 96 VAL HB H 1 2.323 0.020 A 96 VAL HG2% H 1 0.963 0.020 A 96 VAL C C 13 177.343 0.3 A 96 VAL CA C 13 66.137 0.3 A 96 VAL CB C 13 31.508 0.3 A 96 VAL CG1 C 13 22.962 0.3 A 96 VAL CG2 C 13 21.368 0.3 A 96 VAL N N 15 120.562 0.3 A 97 ARG H H 1 8.330 0.020 A 97 ARG HA H 1 3.872 0.020 A 97 ARG HB2 H 1 1.955 0.020 A 97 ARG HB3 H 1 1.955 0.020 A 97 ARG HD2 H 1 3.263 0.020 A 97 ARG HD3 H 1 3.263 0.020 A 97 ARG HG2 H 1 1.730 0.020 A 97 ARG HG3 H 1 1.730 0.020 A 97 ARG C C 13 178.635 0.3 A 97 ARG CA C 13 60.206 0.3 A 97 ARG CB C 13 30.504 0.3 A 97 ARG CD C 13 43.556 0.3 A 97 ARG CG C 13 27.721 0.3 A 97 ARG N N 15 118.975 0.3 A 98 GLU H H 1 8.130 0.020 A 98 GLU HA H 1 4.117 0.020 A 98 GLU HB2 H 1 2.133 0.020 A 98 GLU HB3 H 1 2.133 0.020 A 98 GLU HG2 H 1 2.384 0.020 A 98 GLU HG3 H 1 2.384 0.020 A 98 GLU C C 13 178.817 0.3 A 98 GLU CA C 13 59.151 0.3 A 98 GLU CB C 13 29.302 0.3 A 98 GLU CG C 13 35.898 0.3 A 98 GLU N N 15 117.754 0.3 A 99 ALA H H 1 7.935 0.020 A 99 ALA HA H 1 4.047 0.020 A 99 ALA HB% H 1 1.603 0.020 A 99 ALA C C 13 180.120 0.3 A 99 ALA CA C 13 55.378 0.3 A 99 ALA CB C 13 18.255 0.3 A 99 ALA N N 15 122.919 0.3 A 100 LEU H H 1 8.278 0.020 A 100 LEU HA H 1 4.095 0.020 A 100 LEU HB2 H 1 1.884 0.020 A 100 LEU HB3 H 1 1.884 0.020 A 100 LEU HD1% H 1 0.955 0.020 A 100 LEU HD2% H 1 0.955 0.020 A 100 LEU HG H 1 1.749 0.020 A 100 LEU C C 13 178.848 0.3 A 100 LEU CA C 13 58.118 0.3 A 100 LEU CB C 13 41.614 0.3 A 100 LEU CD1 C 13 24.723 0.3 A 100 LEU CG C 13 26.919 0.3 A 100 LEU N N 15 118.010 0.3 A 101 ARG H H 1 8.198 0.020 A 101 ARG HA H 1 4.084 0.020 A 101 ARG HB2 H 1 2.151 0.020 A 101 ARG HB3 H 1 2.151 0.020 A 101 ARG C C 13 178.341 0.3 A 101 ARG CA C 13 59.607 0.3 A 101 ARG CB C 13 29.586 0.3 A 101 ARG CD C 13 36.157 0.3 A 101 ARG CG C 13 25.384 0.3 A 101 ARG N N 15 118.672 0.3 A 103 ALA H H 1 8.180 0.020 A 103 ALA HA H 1 4.253 0.020 A 103 ALA HB% H 1 1.507 0.020 A 103 ALA C C 13 179.059 0.3 A 103 ALA CA C 13 54.216 0.3 A 103 ALA CB C 13 18.763 0.3 A 103 ALA N N 15 122.134 0.3 A 104 GLU H H 1 8.469 0.020 A 104 GLU HA H 1 4.100 0.020 A 104 GLU HB2 H 1 1.961 0.020 A 104 GLU HB3 H 1 1.961 0.020 A 104 GLU HG2 H 1 2.284 0.020 A 104 GLU HG3 H 1 2.284 0.020 A 104 GLU C C 13 178.144 0.3 A 104 GLU CA C 13 59.953 0.3 A 104 GLU CB C 13 29.576 0.3 A 104 GLU CG C 13 36.109 0.3 A 104 GLU N N 15 117.783 0.3 A 106 GLU H H 1 8.381 0.020 A 106 GLU HA H 1 4.110 0.020 A 106 GLU HB2 H 1 2.145 0.020 A 106 GLU HB3 H 1 2.145 0.020 A 106 GLU HG2 H 1 2.416 0.020 A 106 GLU HG3 H 1 2.416 0.020 A 106 GLU C C 13 178.905 0.3 A 106 GLU CA C 13 59.174 0.3 A 106 GLU CB C 13 29.307 0.3 A 106 GLU CG C 13 35.898 0.3 A 106 GLU N N 15 117.841 0.3 A 108 GLU H H 1 8.218 0.020 A 108 GLU HA H 1 4.091 0.020 A 108 GLU HB2 H 1 2.109 0.020 A 108 GLU HB3 H 1 2.109 0.020 A 108 GLU HG2 H 1 2.276 0.020 A 108 GLU HG3 H 1 2.276 0.020 A 108 GLU C C 13 178.318 0.3 A 108 GLU CA C 13 58.919 0.3 A 108 GLU CB C 13 30.296 0.3 A 108 GLU CG C 13 36.157 0.3 A 108 GLU N N 15 118.513 0.3 A 109 SER H H 1 7.825 0.020 A 109 SER HA H 1 4.365 0.020 A 109 SER HB2 H 1 4.039 0.020 A 109 SER HB3 H 1 4.039 0.020 A 109 SER C C 13 174.949 0.3 A 109 SER CA C 13 59.796 0.3 A 109 SER CB C 13 63.450 0.3 A 109 SER N N 15 112.816 0.3 A 110 HIS H H 1 7.856 0.020 A 110 HIS HA H 1 4.738 0.020 A 110 HIS HB2 H 1 3.237 0.020 A 110 HIS HB3 H 1 3.237 0.020 A 110 HIS C C 13 174.448 0.3 A 110 HIS CA C 13 55.908 0.3 A 110 HIS CB C 13 29.501 0.3 A 110 HIS N N 15 119.134 0.3 A 111 SER H H 1 7.960 0.020 A 111 SER HA H 1 4.657 0.020 A 111 SER HB2 H 1 3.940 0.020 A 111 SER HB3 H 1 3.940 0.020 A 111 SER C C 13 175.438 0.3 A 111 SER CA C 13 59.311 0.3 A 111 SER CB C 13 64.867 0.3 A 111 SER N N 15 115.153 0.3 A 113 TRP H H 1 7.869 0.020 A 113 TRP HB2 H 1 3.145 0.020 A 113 TRP HB3 H 1 3.145 0.020 A 113 TRP HE1 H 1 9.973 0.020 A 113 TRP C C 13 175.857 0.3 A 113 TRP CA C 13 57.810 0.3 A 113 TRP CB C 13 29.544 0.3 A 113 TRP N N 15 121.475 0.3 A 113 TRP NE1 N 15 128.588 0.3 A 114 TYR H H 1 7.419 0.020 A 114 TYR HA H 1 4.517 0.020 A 114 TYR HB2 H 1 2.762 0.020 A 114 TYR HB3 H 1 2.762 0.020 A 114 TYR HD1 H 1 6.972 0.020 A 114 TYR HD2 H 1 6.972 0.020 A 114 TYR C C 13 174.253 0.3 A 114 TYR CA C 13 57.500 0.3 A 114 TYR CB C 13 38.909 0.3 A 114 TYR N N 15 118.269 0.3 A 115 ALA H H 1 7.493 0.020 A 115 ALA HA H 1 4.074 0.020 A 115 ALA HB% H 1 1.307 0.020 A 115 ALA C C 13 182.340 0.3 A 115 ALA CA C 13 54.019 0.3 A 115 ALA CB C 13 20.399 0.3 A 115 ALA N N 15 130.113 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 PRO O A 7 ARG N 1.0 0.0 2.90 2 2 A 4 GLU OE1 A 7 ARG NHx 1.0 0.0 3.54 3 3 A 4 GLU O A 8 TYR N 1.0 0.0 2.92 4 4 A 6 ASN O A 9 SER N 1.0 0.0 3.18 5 5 A 6 ASN O A 9 SER OG 1.0 0.0 3.33 6 6 A 10 LYS NZ A 80 GLU OE1 1.0 0.0 2.85 7 7 A 8 TYR O A 12 HIS N 1.0 0.0 3.00 8 8 A 9 SER O A 13 MET N 1.0 0.0 2.90 9 9 A 10 LYS O A 14 LYS N 1.0 0.0 3.09 10 10 A 11 GLU OE2 A 14 LYS NZ 1.0 0.0 2.82 11 11 A 11 GLU O A 15 LYS N 1.0 0.0 3.23 12 12 A 15 LYS NZ A 19 ASP OD2 1.0 0.0 2.86 13 13 A 15 LYS NZ A 90 GLU OE2 1.0 0.0 2.88 14 14 A 12 HIS O A 16 MET N 1.0 0.0 2.93 15 15 A 13 MET O A 17 MET N 1.0 0.0 2.84 16 16 A 14 LYS O A 18 LYS N 1.0 0.0 3.08 17 17 A 15 LYS O A 19 ASP N 1.0 0.0 2.73 18 18 A 16 MET O A 20 LEU N 1.0 0.0 2.93 19 19 A 17 MET O A 21 GLU N 1.0 0.0 3.46 20 20 A 18 LYS O A 22 GLY N 1.0 0.0 3.11 21 21 A 19 ASP O A 23 LEU N 1.0 0.0 2.88 22 22 A 20 LEU O A 24 HIS N 1.0 0.0 2.99 23 23 A 24 HIS ND1 A 27 GLU OE2 1.0 0.0 2.82 24 24 A 21 GLU O A 25 ARG N 1.0 0.0 2.88 25 25 A 21 GLU OE2 A 25 ARG NE 1.0 0.0 3.14 26 26 A 21 GLU OE2 A 25 ARG NHy 1.0 0.0 2.94 27 27 A 22 GLY O A 26 ALA N 1.0 0.0 2.82 28 28 A 23 LEU O A 27 GLU N 1.0 0.0 3.00 29 29 A 24 HIS O A 28 GLN N 1.0 0.0 3.17 30 30 A 25 ARG O A 29 SER N 1.0 0.0 3.16 31 31 A 26 ALA O A 29 SER OG 1.0 0.0 2.58 32 32 A 26 ALA O A 30 LEU N 1.0 0.0 3.06 33 33 A 27 GLU O A 31 HIS N 1.0 0.0 2.89 34 34 A 31 HIS ND1 A 34 GLN OE1 1.0 0.0 2.73 35 35 A 28 GLN O A 32 ASP N 1.0 0.0 3.11 36 36 A 29 SER O A 33 LEU N 1.0 0.0 3.30 37 37 A 30 LEU O A 34 GLN N 1.0 0.0 2.92 38 38 A 34 GLN NE2 A 61 GLU OE1 1.0 0.0 3.12 39 39 A 31 HIS O A 35 GLU N 1.0 0.0 2.87 40 40 A 32 ASP O A 36 ARG N 1.0 0.0 3.01 41 41 A 33 LEU O A 37 LEU N 1.0 0.0 2.98 42 42 A 34 GLN O A 38 HIS N 1.0 0.0 2.78 43 43 A 35 GLU O A 39 LYS N 1.0 0.0 2.92 44 44 A 36 ARG O A 40 ALA N 1.0 0.0 2.98 45 45 A 37 LEU O A 41 GLN N 1.0 0.0 2.75 46 46 A 38 HIS O A 42 GLU N 1.0 0.0 2.96 47 47 A 39 LYS O A 43 GLU N 1.0 0.0 2.90 48 48 A 41 GLN O A 44 HIS N 1.0 0.0 3.32 49 49 A 40 ALA O A 45 ARG N 1.0 0.0 2.80 50 50 A 43 GLU OE1 A 45 ARG NE 1.0 0.0 2.67 51 51 A 46 THR O A 49 VAL N 1.0 0.0 3.05 52 52 A 48 GLU O A 51 LYS N 1.0 0.0 3.11 53 53 A 48 GLU O A 52 VAL N 1.0 0.0 2.79 54 54 A 53 HIS O A 57 LYS N 1.0 0.0 3.09 55 55 A 57 LYS NZ A 61 GLU OE2 1.0 0.0 2.72 56 56 A 57 LYS NZ A 106 GLU OE1 1.0 0.0 2.87 57 57 A 57 LYS NZ A 110 HIS NE2 1.0 0.0 2.85 58 58 A 54 LEU O A 58 LEU N 1.0 0.0 2.87 59 59 A 55 GLU O A 59 ARG N 1.0 0.0 2.91 60 60 A 55 GLU OE2 A 59 ARG NE 1.0 0.0 3.19 61 61 A 55 GLU OE2 A 59 ARG NHy 1.0 0.0 2.94 62 62 A 56 LYS O A 60 ASP N 1.0 0.0 2.96 63 63 A 57 LYS O A 61 GLU N 1.0 0.0 2.96 64 64 A 58 LEU O A 62 ILE N 1.0 0.0 2.99 65 65 A 59 ARG O A 63 ASN N 1.0 0.0 3.03 66 66 A 60 ASP O A 64 LEU N 1.0 0.0 2.95 67 67 A 61 GLU O A 65 ALA N 1.0 0.0 2.83 68 68 A 62 ILE O A 66 LYS N 1.0 0.0 2.87 69 69 A 63 ASN O A 67 GLN N 1.0 0.0 3.10 70 70 A 64 LEU O A 68 GLU N 1.0 0.0 3.00 71 71 A 65 ALA O A 69 ALA N 1.0 0.0 2.71 72 72 A 66 LYS O A 70 GLN N 1.0 0.0 2.93 73 73 A 70 GLN NE2 A 74 GLU OE2 1.0 0.0 3.26 74 74 A 67 GLN O A 71 ARG N 1.0 0.0 3.26 75 75 A 71 ARG NHx A 92 GLU OE2 1.0 0.0 2.94 76 76 A 68 GLU O A 72 LEU N 1.0 0.0 2.96 77 77 A 69 ALA O A 73 LYS N 1.0 0.0 2.84 78 78 A 70 GLN O A 74 GLU N 1.0 0.0 2.81 79 79 A 71 ARG O A 75 LEU N 1.0 0.0 3.17 80 80 A 72 LEU O A 76 ARG N 1.0 0.0 2.92 81 81 A 73 LYS O A 77 GLU N 1.0 0.0 3.03 82 82 A 75 LEU O A 78 GLY N 1.0 0.0 2.87 83 83 A 81 ASN OD1 A 83 ARG N 1.0 0.0 2.94 84 84 A 83 ARG O A 86 GLN N 1.0 0.0 2.83 85 85 A 74 GLU OE1 A 88 TYR OH 1.0 0.0 2.86 86 86 A 86 GLN O A 89 ALA N 1.0 0.0 3.37 87 87 A 82 GLU OE1 A 90 GLU N 1.0 0.0 3.07 88 88 A 89 ALA O A 92 GLU N 1.0 0.0 2.89 89 89 A 90 GLU O A 94 GLU N 1.0 0.0 3.16 90 90 A 91 GLU O A 95 GLN N 1.0 0.0 2.96 91 91 A 91 GLU OE2 A 95 GLN NE2 1.0 0.0 2.97 92 92 A 92 GLU O A 96 VAL N 1.0 0.0 2.86 93 93 A 93 LEU O A 97 ARG N 1.0 0.0 2.98 94 94 A 94 GLU OE1 A 97 ARG NE 1.0 0.0 2.81 95 95 A 97 ARG NHx A 98 GLU OE2 1.0 0.0 2.74 96 96 A 94 GLU OE1 A 97 ARG NHy 1.0 0.0 2.76 97 97 A 98 GLU OE2 A 97 ARG NHy 1.0 0.0 2.89 98 98 A 94 GLU O A 98 GLU N 1.0 0.0 3.03 99 99 A 95 GLN O A 99 ALA N 1.0 0.0 3.01 100 100 A 96 VAL O A 100 LEU N 1.0 0.0 2.82 101 101 A 97 ARG O A 101 ARG N 1.0 0.0 3.00 102 102 A 101 ARG NHx A 104 GLU OE1 1.0 0.0 2.76 103 103 A 98 GLU O A 102 LYS N 1.0 0.0 2.88 104 104 A 102 LYS NZ A 106 GLU OE2 1.0 0.0 2.70 105 105 A 99 ALA O A 103 ALA N 1.0 0.0 3.02 106 106 A 100 LEU O A 104 GLU N 1.0 0.0 2.82 107 107 A 101 ARG O A 105 LYS N 1.0 0.0 3.01 108 108 A 102 LYS O A 106 GLU N 1.0 0.0 3.15 109 109 A 103 ALA O A 107 LEU N 1.0 0.0 2.83 110 110 A 104 GLU O A 108 GLU N 1.0 0.0 2.94 111 111 A 105 LYS O A 109 SER N 1.0 0.0 3.05 112 112 A 106 GLU O A 109 SER OG 1.0 0.0 2.55 113 113 A 106 GLU O A 110 HIS N 1.0 0.0 2.94 114 114 A 48 GLU OE1 A 110 HIS ND1 1.0 0.0 2.71 115 115 A 107 LEU O A 111 SER N 1.0 0.0 3.01 116 116 A 108 GLU O A 111 SER OG 1.0 0.0 2.76 117 117 A 108 GLU O A 112 SER N 1.0 0.0 2.79 118 118 A 108 GLU O A 112 SER OG 1.0 0.0 2.70 119 119 A 26 ALA H A 69 ALA HB% 1.0 0.0 5.00 120 120 A 30 LEU H A 65 ALA HB% 1.0 0.0 5.00 121 121 A 68 GLU H A 99 ALA HA 1.0 0.0 5.50 122 122 A 69 ALA H A 70 GLN H 1.0 0.0 5.00 123 123 A 115 ALA HB% A 45 ARG HG2 1.0 0.0 5.00 124 123 A 45 ARG HG3 A 115 ALA HB% 1.0 0.0 5.00 125 124 A 30 LEU HA A 62 ILE H 1.0 0.0 5.00 126 125 A 89 ALA H A 82 GLU HG2 1.0 0.0 5.00 127 125 A 82 GLU HG3 A 89 ALA H 1.0 0.0 5.00 128 126 A 23 LEU HD1% A 76 ARG HD2 1.0 0.0 6.00 129 126 A 23 LEU HD2% A 76 ARG HD2 1.0 0.0 6.00 130 126 A 76 ARG HD3 A 23 LEU HD1% 1.0 0.0 6.00 131 126 A 23 LEU HD2% A 76 ARG HD3 1.0 0.0 6.00 132 127 A 72 LEU H A 20 LEU HD1% 1.0 0.0 6.00 133 127 A 20 LEU HD2% A 72 LEU H 1.0 0.0 6.00 134 128 A 99 ALA HA A 68 GLU HB2 1.0 0.0 5.00 135 128 A 99 ALA HA A 68 GLU HB3 1.0 0.0 5.00 136 129 A 19 ASP HB2 A 76 ARG HD2 1.0 0.0 5.00 137 129 A 19 ASP HB3 A 76 ARG HD2 1.0 0.0 5.00 138 129 A 76 ARG HD3 A 19 ASP HB2 1.0 0.0 5.00 139 129 A 76 ARG HD3 A 19 ASP HB3 1.0 0.0 5.00 140 130 A 65 ALA HB% A 33 LEU HD1% 1.0 0.0 6.50 141 130 A 65 ALA HB% A 33 LEU HD2% 1.0 0.0 6.50 142 131 A 41 GLN H A 52 VAL HG1% 1.0 0.0 5.00 143 132 A 72 LEU HA A 23 LEU HD1% 1.0 0.0 5.00 144 132 A 23 LEU HD2% A 72 LEU HA 1.0 0.0 5.00 145 133 A 46 THR H A 111 SER HA 1.0 0.0 5.00 146 134 A 65 ALA H A 33 LEU HD1% 1.0 0.0 5.00 147 134 A 33 LEU HD2% A 65 ALA H 1.0 0.0 5.00 148 135 A 72 LEU HG A 96 VAL HG2% 1.0 0.0 5.50 149 136 A 65 ALA HA A 33 LEU HD1% 1.0 0.0 5.00 150 136 A 33 LEU HD2% A 65 ALA HA 1.0 0.0 5.00 151 137 A 62 ILE HD1% A 30 LEU HB2 1.0 0.0 5.00 152 137 A 30 LEU HB3 A 62 ILE HD1% 1.0 0.0 5.00 153 138 A 69 ALA H A 26 ALA HB% 1.0 0.0 5.00 154 139 A 62 ILE HG2% A 33 LEU HB2 1.0 0.0 5.50 155 139 A 33 LEU HB3 A 62 ILE HG2% 1.0 0.0 5.50 156 140 A 30 LEU HA A 62 ILE HD1% 1.0 0.0 5.00 157 141 A 23 LEU HD2% A 72 LEU HB2 1.0 0.0 5.00 158 141 A 23 LEU HD1% A 72 LEU HB2 1.0 0.0 5.00 159 141 A 72 LEU HB3 A 23 LEU HD1% 1.0 0.0 5.00 160 141 A 23 LEU HD2% A 72 LEU HB3 1.0 0.0 5.00 161 142 A 69 ALA HB% A 23 LEU HD1% 1.0 0.0 5.00 162 142 A 69 ALA HB% A 23 LEU HD2% 1.0 0.0 5.00 163 143 A 72 LEU HA A 23 LEU HG 1.0 0.0 5.00 164 144 A 72 LEU HA A 23 LEU HA 1.0 0.0 5.50 165 145 A 52 VAL HG1% A 40 ALA HB% 1.0 0.0 5.00 166 146 A 72 LEU H A 23 LEU HG 1.0 0.0 5.00 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 6 ASN C A 7 ARG N A 7 ARG CA A 7 ARG C 1.0 -84.7 -44.7 PHI 2 2 A 7 ARG N A 7 ARG CA A 7 ARG C A 8 TYR N 1.0 -49.5 -9.5 PSI 3 3 A 7 ARG C A 8 TYR N A 8 TYR CA A 8 TYR C 1.0 -126.9 -86.9 PHI 4 4 A 8 TYR N A 8 TYR CA A 8 TYR C A 9 SER N 1.0 -20.1 31.3 PSI 5 5 A 8 TYR C A 9 SER N A 9 SER CA A 9 SER C 1.0 -85.5 -45.5 PHI 6 6 A 9 SER N A 9 SER CA A 9 SER C A 10 LYS N 1.0 -56.2 -13.8 PSI 7 7 A 10 LYS C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -86.0 -46.0 PHI 8 8 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 HIS N 1.0 -51.2 -11.2 PSI 9 9 A 15 LYS C A 16 MET N A 16 MET CA A 16 MET C 1.0 -83.7 -43.7 PHI 10 10 A 16 MET N A 16 MET CA A 16 MET C A 17 MET N 1.0 -57.1 -17.1 PSI 11 11 A 16 MET C A 17 MET N A 17 MET CA A 17 MET C 1.0 -87.2 -47.2 PHI 12 12 A 17 MET N A 17 MET CA A 17 MET C A 18 LYS N 1.0 -54.5 -14.5 PSI 13 13 A 17 MET C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -90.6 -50.6 PHI 14 14 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ASP N 1.0 -55.0 -15.0 PSI 15 15 A 18 LYS C A 19 ASP N A 19 ASP CA A 19 ASP C 1.0 -88.3 -48.3 PHI 16 16 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 LEU N 1.0 -55.0 -15.0 PSI 17 17 A 19 ASP C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -89.0 -49.0 PHI 18 18 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 GLU N 1.0 -54.5 -14.5 PSI 19 19 A 20 LEU C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -87.0 -47.0 PHI 20 20 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 GLY N 1.0 -59.8 -19.8 PSI 21 21 A 21 GLU C A 22 GLY N A 22 GLY CA A 22 GLY C 1.0 -86.4 -46.4 PHI 22 22 A 22 GLY N A 22 GLY CA A 22 GLY C A 23 LEU N 1.0 -58.8 -18.8 PSI 23 23 A 22 GLY C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -88.7 -48.7 PHI 24 24 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 HIS N 1.0 -59.7 -19.7 PSI 25 25 A 23 LEU C A 24 HIS N A 24 HIS CA A 24 HIS C 1.0 -89.9 -49.9 PHI 26 26 A 24 HIS N A 24 HIS CA A 24 HIS C A 25 ARG N 1.0 -55.5 -15.5 PSI 27 27 A 24 HIS C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -87.7 -47.7 PHI 28 28 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 ALA N 1.0 -60.6 -20.6 PSI 29 29 A 25 ARG C A 26 ALA N A 26 ALA CA A 26 ALA C 1.0 -88.3 -48.3 PHI 30 30 A 26 ALA N A 26 ALA CA A 26 ALA C A 27 GLU N 1.0 -58.0 -18.0 PSI 31 31 A 26 ALA C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -85.1 -45.1 PHI 32 32 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 GLN N 1.0 -60.5 -20.5 PSI 33 33 A 27 GLU C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -87.8 -47.8 PHI 34 34 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 SER N 1.0 -58.7 -18.7 PSI 35 35 A 28 GLN C A 29 SER N A 29 SER CA A 29 SER C 1.0 -87.1 -47.1 PHI 36 36 A 29 SER N A 29 SER CA A 29 SER C A 30 LEU N 1.0 -58.7 -18.7 PSI 37 37 A 29 SER C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -86.4 -46.4 PHI 38 38 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 HIS N 1.0 -60.6 -20.6 PSI 39 39 A 30 LEU C A 31 HIS N A 31 HIS CA A 31 HIS C 1.0 -86.9 -46.9 PHI 40 40 A 31 HIS N A 31 HIS CA A 31 HIS C A 32 ASP N 1.0 -55.6 -15.6 PSI 41 41 A 31 HIS C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -86.2 -46.2 PHI 42 42 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 LEU N 1.0 -59.5 -19.5 PSI 43 43 A 32 ASP C A 33 LEU N A 33 LEU CA A 33 LEU C 1.0 -84.7 -44.7 PHI 44 44 A 33 LEU N A 33 LEU CA A 33 LEU C A 34 GLN N 1.0 -61.3 -21.3 PSI 45 45 A 33 LEU C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -81.6 -41.6 PHI 46 46 A 34 GLN N A 34 GLN CA A 34 GLN C A 35 GLU N 1.0 -62.5 -22.5 PSI 47 47 A 34 GLN C A 35 GLU N A 35 GLU CA A 35 GLU C 1.0 -85.6 -45.6 PHI 48 48 A 35 GLU N A 35 GLU CA A 35 GLU C A 36 ARG N 1.0 -56.6 -16.6 PSI 49 49 A 35 GLU C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -88.8 -48.8 PHI 50 50 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 LEU N 1.0 -55.5 -15.5 PSI 51 51 A 38 HIS C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -86.9 -46.9 PHI 52 52 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 ALA N 1.0 -57.1 -17.1 PSI 53 53 A 39 LYS C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -87.2 -47.2 PHI 54 54 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 GLN N 1.0 -56.6 -16.6 PSI 55 55 A 40 ALA C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -86.8 -46.8 PHI 56 56 A 41 GLN N A 41 GLN CA A 41 GLN C A 42 GLU N 1.0 -59.1 -19.1 PSI 57 57 A 41 GLN C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -86.9 -46.9 PHI 58 58 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 GLU N 1.0 -52.2 -12.2 PSI 59 59 A 42 GLU C A 43 GLU N A 43 GLU CA A 43 GLU C 1.0 -96.0 -51.8 PHI 60 60 A 43 GLU N A 43 GLU CA A 43 GLU C A 44 HIS N 1.0 -46.4 1.0 PSI 61 61 A 43 GLU C A 44 HIS N A 44 HIS CA A 44 HIS C 1.0 -96.8 -56.8 PHI 62 62 A 44 HIS N A 44 HIS CA A 44 HIS C A 45 ARG N 1.0 -38.0 2.0 PSI 63 63 A 51 LYS C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -84.4 -44.4 PHI 64 64 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 HIS N 1.0 -53.6 -13.6 PSI 65 65 A 55 GLU C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -89.6 -49.6 PHI 66 66 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 LYS N 1.0 -56.2 -16.2 PSI 67 67 A 57 LYS C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -90.2 -50.2 PHI 68 68 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 ARG N 1.0 -52.5 -9.9 PSI 69 69 A 61 GLU C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -82.2 -42.2 PHI 70 70 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 ASN N 1.0 -57.5 -17.5 PSI 71 71 A 62 ILE C A 63 ASN N A 63 ASN CA A 63 ASN C 1.0 -85.8 -45.8 PHI 72 72 A 63 ASN N A 63 ASN CA A 63 ASN C A 64 LEU N 1.0 -57.0 -17.0 PSI 73 73 A 63 ASN C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -87.7 -47.7 PHI 74 74 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 ALA N 1.0 -62.0 -22.0 PSI 75 75 A 64 LEU C A 65 ALA N A 65 ALA CA A 65 ALA C 1.0 -84.3 -44.3 PHI 76 76 A 65 ALA N A 65 ALA CA A 65 ALA C A 66 LYS N 1.0 -60.4 -20.4 PSI 77 77 A 65 ALA C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -83.6 -43.6 PHI 78 78 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 GLN N 1.0 -61.5 -21.5 PSI 79 79 A 66 LYS C A 67 GLN N A 67 GLN CA A 67 GLN C 1.0 -85.9 -45.9 PHI 80 80 A 67 GLN N A 67 GLN CA A 67 GLN C A 68 GLU N 1.0 -61.1 -21.1 PSI 81 81 A 67 GLN C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -87.0 -47.0 PHI 82 82 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 ALA N 1.0 -56.3 -16.3 PSI 83 83 A 68 GLU C A 69 ALA N A 69 ALA CA A 69 ALA C 1.0 -84.5 -44.5 PHI 84 84 A 69 ALA N A 69 ALA CA A 69 ALA C A 70 GLN N 1.0 -60.3 -20.3 PSI 85 85 A 69 ALA C A 70 GLN N A 70 GLN CA A 70 GLN C 1.0 -86.1 -46.1 PHI 86 86 A 70 GLN N A 70 GLN CA A 70 GLN C A 71 ARG N 1.0 -58.6 -18.6 PSI 87 87 A 70 GLN C A 71 ARG N A 71 ARG CA A 71 ARG C 1.0 -86.6 -46.6 PHI 88 88 A 71 ARG N A 71 ARG CA A 71 ARG C A 72 LEU N 1.0 -63.0 -23.0 PSI 89 89 A 71 ARG C A 72 LEU N A 72 LEU CA A 72 LEU C 1.0 -85.4 -45.4 PHI 90 90 A 72 LEU N A 72 LEU CA A 72 LEU C A 73 LYS N 1.0 -61.2 -21.2 PSI 91 91 A 72 LEU C A 73 LYS N A 73 LYS CA A 73 LYS C 1.0 -82.5 -42.5 PHI 92 92 A 73 LYS N A 73 LYS CA A 73 LYS C A 74 GLU N 1.0 -57.4 -17.4 PSI 93 93 A 73 LYS C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -87.2 -47.2 PHI 94 94 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 LEU N 1.0 -57.4 -17.4 PSI 95 95 A 74 GLU C A 75 LEU N A 75 LEU CA A 75 LEU C 1.0 -88.2 -48.2 PHI 96 96 A 75 LEU N A 75 LEU CA A 75 LEU C A 76 ARG N 1.0 -54.2 -14.2 PSI 97 97 A 75 LEU C A 76 ARG N A 76 ARG CA A 76 ARG C 1.0 -88.8 -48.8 PHI 98 98 A 76 ARG N A 76 ARG CA A 76 ARG C A 77 GLU N 1.0 -48.7 -8.7 PSI 99 99 A 76 ARG C A 77 GLU N A 77 GLU CA A 77 GLU C 1.0 -98.1 -51.7 PHI 100 100 A 77 GLU N A 77 GLU CA A 77 GLU C A 78 GLY N 1.0 -65.2 15.4 PSI 101 101 A 88 TYR C A 89 ALA N A 89 ALA CA A 89 ALA C 1.0 -86.7 -46.7 PHI 102 102 A 89 ALA N A 89 ALA CA A 89 ALA C A 90 GLU N 1.0 -56.6 -16.6 PSI 103 103 A 89 ALA C A 90 GLU N A 90 GLU CA A 90 GLU C 1.0 -85.3 -45.3 PHI 104 104 A 90 GLU N A 90 GLU CA A 90 GLU C A 91 GLU N 1.0 -56.8 -16.8 PSI 105 105 A 90 GLU C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -88.2 -48.2 PHI 106 106 A 91 GLU N A 91 GLU CA A 91 GLU C A 92 GLU N 1.0 -59.4 -19.4 PSI 107 107 A 91 GLU C A 92 GLU N A 92 GLU CA A 92 GLU C 1.0 -87.3 -47.3 PHI 108 108 A 92 GLU N A 92 GLU CA A 92 GLU C A 93 LEU N 1.0 -58.3 -18.3 PSI 109 109 A 95 GLN C A 96 VAL N A 96 VAL CA A 96 VAL C 1.0 -83.0 -43.0 PHI 110 110 A 96 VAL N A 96 VAL CA A 96 VAL C A 97 ARG N 1.0 -60.9 -20.9 PSI 111 111 A 96 VAL C A 97 ARG N A 97 ARG CA A 97 ARG C 1.0 -80.3 -40.3 PHI 112 112 A 97 ARG N A 97 ARG CA A 97 ARG C A 98 GLU N 1.0 -58.0 -18.0 PSI 113 113 A 97 ARG C A 98 GLU N A 98 GLU CA A 98 GLU C 1.0 -86.0 -46.0 PHI 114 114 A 98 GLU N A 98 GLU CA A 98 GLU C A 99 ALA N 1.0 -60.6 -20.6 PSI 115 115 A 98 GLU C A 99 ALA N A 99 ALA CA A 99 ALA C 1.0 -84.9 -44.9 PHI 116 116 A 99 ALA N A 99 ALA CA A 99 ALA C A 100 LEU N 1.0 -62.8 -22.8 PSI 117 117 A 99 ALA C A 100 LEU N A 100 LEU CA A 100 LEU C 1.0 -84.2 -44.2 PHI 118 118 A 100 LEU N A 100 LEU CA A 100 LEU C A 101 ARG N 1.0 -59.0 -19.0 PSI 119 119 A 100 LEU C A 101 ARG N A 101 ARG CA A 101 ARG C 1.0 -85.2 -45.2 PHI 120 120 A 101 ARG N A 101 ARG CA A 101 ARG C A 102 LYS N 1.0 -57.9 -17.9 PSI 121 121 A 101 ARG C A 102 LYS N A 102 LYS CA A 102 LYS C 1.0 -87.8 -47.8 PHI 122 122 A 102 LYS N A 102 LYS CA A 102 LYS C A 103 ALA N 1.0 -58.0 -18.0 PSI 123 123 A 102 LYS C A 103 ALA N A 103 ALA CA A 103 ALA C 1.0 -86.2 -46.2 PHI 124 124 A 103 ALA N A 103 ALA CA A 103 ALA C A 104 GLU N 1.0 -58.5 -18.5 PSI 125 125 A 103 ALA C A 104 GLU N A 104 GLU CA A 104 GLU C 1.0 -84.8 -44.8 PHI 126 126 A 104 GLU N A 104 GLU CA A 104 GLU C A 105 LYS N 1.0 -58.0 -18.0 PSI 127 127 A 104 GLU C A 105 LYS N A 105 LYS CA A 105 LYS C 1.0 -88.7 -48.7 PHI 128 128 A 105 LYS N A 105 LYS CA A 105 LYS C A 106 GLU N 1.0 -57.8 -17.8 PSI 129 129 A 106 GLU C A 107 LEU N A 107 LEU CA A 107 LEU C 1.0 -88.2 -48.2 PHI 130 130 A 107 LEU N A 107 LEU CA A 107 LEU C A 108 GLU N 1.0 -55.4 -15.4 PSI 131 131 A 107 LEU C A 108 GLU N A 108 GLU CA A 108 GLU C 1.0 -82.6 -42.6 PHI 132 132 A 108 GLU N A 108 GLU CA A 108 GLU C A 109 SER N 1.0 -53.4 -13.4 PSI 133 133 A 108 GLU C A 109 SER N A 109 SER CA A 109 SER C 1.0 -91.3 -51.3 PHI 134 134 A 109 SER N A 109 SER CA A 109 SER C A 110 HIS N 1.0 -43.6 -3.6 PSI 135 135 A 109 SER C A 110 HIS N A 110 HIS CA A 110 HIS C 1.0 -118.1 -78.1 PHI 136 136 A 110 HIS N A 110 HIS CA A 110 HIS C A 111 SER N 1.0 -20.7 23.9 PSI 137 137 A 111 SER C A 112 SER N A 112 SER CA A 112 SER C 1.0 -106.1 -28.3 PHI 138 138 A 112 SER N A 112 SER CA A 112 SER C A 113 TRP N 1.0 -51.6 9.8 PSI stop_ save_