data_nef_c30686_6uz4 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 _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 PDB 6UZ4 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 8 CYS SG 1 85 CYS SG 1 29 CYS SG 1 68 CYS SG 1 57 CYS SG 1 80 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -7 TYR start . . 2 A -6 VAL middle . . 3 A -5 GLU middle . . 4 A -4 PHE middle . . 5 A -3 SER middle . . 6 A -2 GLU middle . . 7 A -1 GLU middle . . 8 A 166 CYS middle -HG . 9 A 167 MET middle . . 10 A 168 HIS middle . . 11 A 169 GLY middle . false 12 A 170 SER middle . . 13 A 171 GLY middle . false 14 A 172 GLU middle . . 15 A 173 ASN middle . . 16 A 174 TYR middle . . 17 A 175 ASP middle . . 18 A 176 GLY middle . false 19 A 177 LYS middle . . 20 A 178 ILE middle . . 21 A 179 SER middle . . 22 A 180 LYS middle . . 23 A 181 THR middle . . 24 A 182 MET middle . . 25 A 183 SER middle . . 26 A 184 GLY middle . false 27 A 185 LEU middle . . 28 A 186 GLU middle . . 29 A 187 CYS middle -HG . 30 A 188 GLN middle . . 31 A 189 ALA middle . . 32 A 190 TRP middle . . 33 A 191 ASP middle . . 34 A 192 SER middle . . 35 A 193 GLN middle . . 36 A 194 SER middle . . 37 A 195 PRO middle . true 38 A 196 HIS middle . . 39 A 197 ALA middle . . 40 A 198 HIS middle . . 41 A 199 GLY middle . false 42 A 200 TYR middle . . 43 A 201 ILE middle . . 44 A 202 PRO middle . false 45 A 203 SER middle . . 46 A 204 LYS middle . . 47 A 205 PHE middle . . 48 A 206 PRO middle . false 49 A 207 ASN middle . . 50 A 208 LYS middle . . 51 A 209 ASN middle . . 52 A 210 LEU middle . . 53 A 211 LYS middle . . 54 A 212 LYS middle . . 55 A 213 ASN middle . . 56 A 214 TYR middle . . 57 A 215 CYS middle -HG . 58 A 216 ARG middle . . 59 A 217 ASN middle . . 60 A 218 PRO middle . false 61 A 219 ASP middle . . 62 A 220 ARG middle . . 63 A 221 ASP middle . . 64 A 222 LEU middle . . 65 A 223 ARG middle . . 66 A 224 PRO middle . false 67 A 225 TRP middle . . 68 A 226 CYS middle -HG . 69 A 227 PHE middle . . 70 A 228 THR middle . . 71 A 229 THR middle . . 72 A 230 ASP middle . . 73 A 231 PRO middle . false 74 A 232 ASN middle . . 75 A 233 LYS middle . . 76 A 234 ARG middle . . 77 A 235 TRP middle . . 78 A 236 GLU middle . . 79 A 237 TYR middle . . 80 A 238 CYS middle -HG . 81 A 239 ASP middle . . 82 A 240 ILE middle . . 83 A 241 PRO middle . false 84 A 242 ARG middle . . 85 A 243 CYS middle -HG . 86 A 244 ALA middle . . 87 A 245 ALA end . . 88 B -2 GLY start . false 89 B -1 SER middle . . 90 B 95 ALA middle . . 91 B 96 GLY middle . false 92 B 97 LEU middle . . 93 B 98 GLN middle . . 94 B 99 GLU middle . . 95 B 100 LYS middle . . 96 B 101 GLU middle . . 97 B 102 ARG middle . . 98 B 103 GLU middle . . 99 B 104 LEU middle . . 100 B 105 GLU middle . . 101 B 106 ASP middle . . 102 B 107 LEU middle . . 103 B 108 LYS middle . . 104 B 109 ASP middle . . 105 B 110 ALA middle . . 106 B 111 GLU middle . . 107 B 112 LEU middle . . 108 B 113 LYS middle . . 109 B 114 ARG middle . . 110 B 115 LEU middle . . 111 B 116 ASN middle . . 112 B 117 GLU middle . . 113 B 118 GLU middle . . 114 B 119 ARG middle . . 115 B 120 HIS middle . . 116 B 121 ASP middle . . 117 B 122 HIS middle . . 118 B 123 ASP middle . . 119 B 124 LYS middle . . 120 B 125 ARG middle . . 121 B 126 GLU middle . . 122 B 127 ALA middle . . 123 B 128 GLU middle . . 124 B 129 ARG middle . . 125 B 130 LYS middle . . 126 B 131 ALA middle . . 127 B 132 LEU middle . . 128 B 133 GLU middle . . 129 B 134 ASP middle . . 130 B 135 LYS middle . . 131 B 136 LEU middle . . 132 B 137 ALA middle . . 133 B 138 ASP middle . . 134 B 139 LYS middle . . 135 B 140 GLN middle . . 136 B 141 GLU middle . . 137 B 142 HIS middle . . 138 B 143 LEU middle . . 139 B 144 ASP middle . . 140 B 145 GLY middle . false 141 B 146 ALA middle . . 142 B 147 LEU middle . . 143 B 148 ARG middle . . 144 B 149 TYR 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 B -1 SER HBy H 1 3.806 0.02 B -1 SER HBx H 1 3.789 0.02 B -1 SER C C 13 174.400 0.20 B -1 SER CA C 13 59.250 0.20 B -1 SER CB C 13 63.980 0.20 B 95 ALA H H 1 8.507 0.02 B 95 ALA HA H 1 4.268 0.02 B 95 ALA HB% H 1 1.351 0.02 B 95 ALA C C 13 178.200 0.20 B 95 ALA CB C 13 19.110 0.20 B 95 ALA N N 15 126.875 0.20 B 96 GLY H H 1 8.359 0.02 B 96 GLY HAx H 1 3.875 0.02 B 96 GLY HAy H 1 3.875 0.02 B 96 GLY C C 13 174.500 0.20 B 96 GLY CA C 13 45.410 0.20 B 96 GLY N N 15 108.820 0.20 B 97 LEU H H 1 8.071 0.02 B 97 LEU HA H 1 4.204 0.02 B 97 LEU HBy H 1 1.554 0.02 B 97 LEU HBx H 1 1.547 0.02 B 97 LEU HDx% H 1 0.808 0.02 B 97 LEU HDy% H 1 0.808 0.02 B 97 LEU C C 13 178.000 0.20 B 97 LEU CA C 13 55.890 0.20 B 97 LEU CB C 13 42.360 0.20 B 97 LEU CDx C 13 23.480 0.20 B 97 LEU CDy C 13 23.480 0.20 B 97 LEU CG C 13 26.640 0.20 B 97 LEU N N 15 122.360 0.20 B 98 GLN H H 1 8.482 0.02 B 98 GLN HA H 1 4.220 0.02 B 98 GLN HBy H 1 2.018 0.02 B 98 GLN HBx H 1 1.973 0.02 B 98 GLN HGx H 1 2.319 0.02 B 98 GLN HGy H 1 2.319 0.02 B 98 GLN C C 13 176.900 0.20 B 98 GLN CA C 13 56.740 0.20 B 98 GLN CB C 13 29.060 0.20 B 98 GLN CG C 13 34.030 0.20 B 98 GLN N N 15 121.242 0.20 B 99 GLU H H 1 8.466 0.02 B 99 GLU HA H 1 4.094 0.02 B 99 GLU HBy H 1 2.007 0.02 B 99 GLU HBx H 1 1.949 0.02 B 99 GLU HGx H 1 2.221 0.02 B 99 GLU HGy H 1 2.221 0.02 B 99 GLU C C 13 177.600 0.20 B 99 GLU CA C 13 58.170 0.20 B 99 GLU CB C 13 29.930 0.20 B 99 GLU CG C 13 36.240 0.20 B 99 GLU N N 15 122.440 0.20 B 100 LYS H H 1 8.245 0.02 B 100 LYS HA H 1 4.146 0.02 B 100 LYS HBy H 1 1.793 0.02 B 100 LYS HBx H 1 1.792 0.02 B 100 LYS HGx H 1 1.387 0.02 B 100 LYS HGy H 1 1.387 0.02 B 100 LYS C C 13 177.900 0.20 B 100 LYS CA C 13 57.650 0.20 B 100 LYS CB C 13 32.440 0.20 B 100 LYS CD C 13 28.550 0.20 B 100 LYS CE C 13 40.930 0.20 B 100 LYS CG C 13 24.530 0.20 B 100 LYS N N 15 121.548 0.20 B 101 GLU H H 1 8.253 0.02 B 101 GLU HA H 1 4.082 0.02 B 101 GLU HBy H 1 2.018 0.02 B 101 GLU HBx H 1 1.993 0.02 B 101 GLU HGx H 1 2.250 0.02 B 101 GLU HGy H 1 2.250 0.02 B 101 GLU C C 13 178.000 0.20 B 101 GLU CA C 13 58.400 0.20 B 101 GLU CB C 13 29.700 0.20 B 101 GLU CG C 13 36.260 0.20 B 101 GLU N N 15 121.015 0.20 B 102 ARG H H 1 8.103 0.02 B 102 ARG HA H 1 4.219 0.02 B 102 ARG HBy H 1 1.790 0.02 B 102 ARG HBx H 1 1.710 0.02 B 102 ARG HDx H 1 3.090 0.02 B 102 ARG HDy H 1 3.090 0.02 B 102 ARG HGx H 1 1.352 0.02 B 102 ARG HGy H 1 1.352 0.02 B 102 ARG C C 13 176.700 0.20 B 102 ARG CA C 13 57.780 0.20 B 102 ARG CB C 13 30.230 0.20 B 102 ARG CG C 13 27.020 0.20 B 102 ARG N N 15 121.591 0.20 B 103 GLU H H 1 8.285 0.02 B 103 GLU HA H 1 4.192 0.02 B 103 GLU HBx H 1 1.959 0.02 B 103 GLU HBy H 1 1.959 0.02 B 103 GLU C C 13 176.000 0.20 B 103 GLU CA C 13 55.920 0.20 B 103 GLU CB C 13 29.480 0.20 B 103 GLU N N 15 121.496 0.20 B 104 LEU HA H 1 4.203 0.02 B 104 LEU HBy H 1 1.547 0.02 B 104 LEU HBx H 1 1.546 0.02 B 104 LEU HDx% H 1 0.836 0.02 B 104 LEU HDy% H 1 0.836 0.02 B 104 LEU C C 13 177.500 0.20 B 104 LEU CA C 13 56.080 0.20 B 104 LEU CB C 13 41.970 0.20 B 104 LEU CDy C 13 24.900 0.20 B 104 LEU CDx C 13 23.600 0.20 B 104 LEU CG C 13 26.700 0.20 B 105 GLU H H 1 8.633 0.02 B 105 GLU HA H 1 4.142 0.02 B 105 GLU HBy H 1 2.034 0.02 B 105 GLU HBx H 1 1.916 0.02 B 105 GLU HGx H 1 2.166 0.02 B 105 GLU HGy H 1 2.166 0.02 B 105 GLU C C 13 176.200 0.20 B 105 GLU CA C 13 57.090 0.20 B 105 GLU CB C 13 29.940 0.20 B 105 GLU CG C 13 36.290 0.20 B 105 GLU N N 15 121.315 0.20 B 106 ASP H H 1 8.159 0.02 B 106 ASP HA H 1 4.460 0.02 B 106 ASP HBy H 1 2.575 0.02 B 106 ASP HBx H 1 2.572 0.02 B 106 ASP C C 13 177.000 0.20 B 106 ASP CA C 13 54.560 0.20 B 106 ASP CB C 13 42.330 0.20 B 106 ASP N N 15 121.344 0.20 B 107 LEU H H 1 8.359 0.02 B 107 LEU HA H 1 4.464 0.02 B 107 LEU HBy H 1 1.872 0.02 B 107 LEU HBx H 1 1.787 0.02 B 107 LEU HDx% H 1 1.076 0.02 B 107 LEU HDy% H 1 1.076 0.02 B 107 LEU C C 13 178.000 0.20 B 107 LEU CA C 13 54.690 0.20 B 107 LEU CB C 13 41.310 0.20 B 107 LEU CG C 13 27.550 0.20 B 107 LEU N N 15 121.762 0.20 B 108 LYS H H 1 7.825 0.02 B 108 LYS HA H 1 4.282 0.02 B 108 LYS HBx H 1 1.753 0.02 B 108 LYS HBy H 1 1.753 0.02 B 108 LYS HDx H 1 1.507 0.02 B 108 LYS HDy H 1 1.507 0.02 B 108 LYS HEx H 1 2.736 0.02 B 108 LYS HEy H 1 2.736 0.02 B 108 LYS C C 13 178.600 0.20 B 108 LYS CA C 13 59.470 0.20 B 108 LYS CB C 13 32.560 0.20 B 108 LYS CD C 13 29.630 0.20 B 108 LYS CG C 13 24.530 0.20 B 108 LYS N N 15 120.785 0.20 B 109 ASP H H 1 8.384 0.02 B 109 ASP HA H 1 4.460 0.02 B 109 ASP HBy H 1 2.775 0.02 B 109 ASP HBx H 1 2.561 0.02 B 109 ASP C C 13 179.400 0.20 B 109 ASP CA C 13 57.690 0.20 B 109 ASP CB C 13 40.440 0.20 B 109 ASP N N 15 120.240 0.20 B 110 ALA H H 1 8.006 0.02 B 110 ALA HA H 1 4.129 0.02 B 110 ALA HB% H 1 1.478 0.02 B 110 ALA C C 13 180.600 0.20 B 110 ALA CA C 13 55.080 0.20 B 110 ALA CB C 13 18.090 0.20 B 110 ALA N N 15 123.845 0.20 B 111 GLU H H 1 8.013 0.02 B 111 GLU HA H 1 4.010 0.02 B 111 GLU HBy H 1 2.028 0.02 B 111 GLU HBx H 1 2.025 0.02 B 111 GLU HGx H 1 2.264 0.02 B 111 GLU HGy H 1 2.264 0.02 B 111 GLU C C 13 178.600 0.20 B 111 GLU CA C 13 58.460 0.20 B 111 GLU CB C 13 29.850 0.20 B 111 GLU CG C 13 36.200 0.20 B 111 GLU N N 15 119.896 0.20 B 112 LEU H H 1 7.973 0.02 B 112 LEU HA H 1 4.155 0.02 B 112 LEU HBy H 1 1.695 0.02 B 112 LEU HBx H 1 1.665 0.02 B 112 LEU HDx% H 1 0.8498 0.02 B 112 LEU HDy% H 1 0.8498 0.02 B 112 LEU C C 13 179.000 0.20 B 112 LEU CA C 13 57.090 0.20 B 112 LEU CB C 13 41.960 0.20 B 112 LEU CDx C 13 23.700 0.20 B 112 LEU CDy C 13 23.700 0.20 B 112 LEU CG C 13 26.770 0.20 B 112 LEU N N 15 121.142 0.20 B 113 LYS H H 1 8.152 0.02 B 113 LYS HA H 1 4.079 0.02 B 113 LYS HBy H 1 1.807 0.02 B 113 LYS HBx H 1 1.755 0.02 B 113 LYS HGx H 1 1.363 0.02 B 113 LYS HGy H 1 1.363 0.02 B 113 LYS C C 13 178.300 0.20 B 113 LYS CA C 13 59.600 0.20 B 113 LYS CB C 13 32.440 0.20 B 113 LYS CE C 13 40.920 0.20 B 113 LYS CG C 13 24.850 0.20 B 113 LYS N N 15 121.345 0.20 B 114 ARG H H 1 8.247 0.02 B 114 ARG HA H 1 4.198 0.02 B 114 ARG HBx H 1 1.763 0.02 B 114 ARG HBy H 1 1.763 0.02 B 114 ARG HDx H 1 3.093 0.02 B 114 ARG HDy H 1 3.093 0.02 B 114 ARG HGx H 1 1.377 0.02 B 114 ARG HGy H 1 1.377 0.02 B 114 ARG C C 13 176.800 0.20 B 114 ARG CA C 13 58.550 0.20 B 114 ARG CB C 13 29.900 0.20 B 114 ARG N N 15 120.374 0.20 B 115 LEU H H 1 8.267 0.02 B 115 LEU HA H 1 4.201 0.02 B 115 LEU HBx H 1 1.569 0.02 B 115 LEU HBy H 1 1.569 0.02 B 115 LEU HDx% H 1 0.845 0.02 B 115 LEU HDy% H 1 0.845 0.02 B 115 LEU C C 13 176.000 0.20 B 115 LEU CA C 13 55.980 0.20 B 115 LEU CB C 13 42.130 0.20 B 115 LEU N N 15 121.015 0.20 B 116 ASN H H 1 7.627 0.02 B 116 ASN HBx H 1 2.782 0.02 B 116 ASN HBy H 1 2.782 0.02 B 116 ASN C C 13 178.700 0.20 B 116 ASN CB C 13 40.450 0.20 B 116 ASN N N 15 119.733 0.20 B 117 GLU H H 1 8.251 0.02 B 117 GLU C C 13 177.300 0.20 B 117 GLU CA C 13 55.700 0.20 B 117 GLU CB C 13 29.820 0.20 B 117 GLU CG C 13 36.570 0.20 B 117 GLU N N 15 120.447 0.20 B 118 GLU HA H 1 4.160 0.02 B 118 GLU HBx H 1 1.971 0.02 B 118 GLU HBy H 1 1.971 0.02 B 118 GLU HGx H 1 2.220 0.02 B 118 GLU HGy H 1 2.220 0.02 B 118 GLU C C 13 179.400 0.20 B 118 GLU CA C 13 59.420 0.20 B 118 GLU CB C 13 29.760 0.20 B 118 GLU CG C 13 36.310 0.20 B 119 ARG H H 1 7.953 0.02 B 119 ARG HA H 1 4.209 0.02 B 119 ARG HBy H 1 1.774 0.02 B 119 ARG HBx H 1 1.719 0.02 B 119 ARG HGy H 1 1.482 0.02 B 119 ARG HGx H 1 1.408 0.02 B 119 ARG C C 13 179.800 0.20 B 119 ARG CA C 13 56.480 0.20 B 119 ARG CB C 13 30.570 0.20 B 119 ARG N N 15 122.229 0.20 B 120 HIS H H 1 7.816 0.02 B 120 HIS HA H 1 4.356 0.02 B 120 HIS HBx H 1 3.071 0.02 B 120 HIS HBy H 1 3.071 0.02 B 120 HIS C C 13 177.400 0.20 B 120 HIS CA C 13 59.870 0.20 B 120 HIS CB C 13 29.100 0.20 B 120 HIS N N 15 118.048 0.20 B 121 ASP H H 1 8.847 0.02 B 121 ASP HA H 1 4.533 0.02 B 121 ASP HBx H 1 2.759 0.02 B 121 ASP HBy H 1 2.759 0.02 B 121 ASP C C 13 178.100 0.20 B 121 ASP CA C 13 57.410 0.20 B 121 ASP CB C 13 41.240 0.20 B 121 ASP N N 15 124.262 0.20 B 122 HIS H H 1 8.393 0.02 B 122 HIS HA H 1 4.472 0.02 B 122 HIS HBy H 1 3.488 0.02 B 122 HIS HBx H 1 3.352 0.02 B 122 HIS C C 13 177.300 0.20 B 122 HIS CA C 13 54.400 0.20 B 122 HIS CB C 13 29.710 0.20 B 122 HIS N N 15 120.253 0.20 B 123 ASP H H 1 7.636 0.02 B 123 ASP HA H 1 4.470 0.02 B 123 ASP HBy H 1 2.578 0.02 B 123 ASP HBx H 1 2.577 0.02 B 123 ASP C C 13 178.900 0.20 B 123 ASP CA C 13 57.100 0.20 B 123 ASP CB C 13 41.220 0.20 B 123 ASP N N 15 119.765 0.20 B 124 LYS H H 1 8.176 0.02 B 124 LYS HA H 1 4.175 0.02 B 124 LYS HBy H 1 1.833 0.02 B 124 LYS HBx H 1 1.729 0.02 B 124 LYS HGx H 1 1.315 0.02 B 124 LYS HGy H 1 1.315 0.02 B 124 LYS C C 13 178.700 0.20 B 124 LYS CA C 13 59.350 0.20 B 124 LYS CB C 13 32.580 0.20 B 124 LYS CD C 13 28.760 0.20 B 124 LYS CE C 13 41.510 0.20 B 124 LYS CG C 13 24.410 0.20 B 124 LYS N N 15 121.835 0.20 B 125 ARG H H 1 7.536 0.02 B 125 ARG HA H 1 4.041 0.02 B 125 ARG HBy H 1 1.943 0.02 B 125 ARG HBx H 1 1.818 0.02 B 125 ARG HDx H 1 3.095 0.02 B 125 ARG HDy H 1 3.095 0.02 B 125 ARG HGx H 1 1.621 0.02 B 125 ARG HGy H 1 1.621 0.02 B 125 ARG C C 13 179.600 0.20 B 125 ARG CA C 13 57.560 0.20 B 125 ARG CB C 13 30.000 0.20 B 125 ARG CD C 13 43.260 0.20 B 125 ARG CG C 13 27.640 0.20 B 125 ARG N N 15 120.522 0.20 B 126 GLU H H 1 8.226 0.02 B 126 GLU HA H 1 4.048 0.02 B 126 GLU HBy H 1 2.087 0.02 B 126 GLU HBx H 1 1.921 0.02 B 126 GLU C C 13 178.300 0.20 B 126 GLU CA C 13 58.580 0.20 B 126 GLU CB C 13 29.880 0.20 B 126 GLU CG C 13 36.340 0.20 B 126 GLU N N 15 121.074 0.20 B 127 ALA H H 1 7.995 0.02 B 127 ALA HA H 1 4.120 0.02 B 127 ALA HB% H 1 1.421 0.02 B 127 ALA C C 13 180.800 0.20 B 127 ALA CA C 13 54.830 0.20 B 127 ALA CB C 13 18.140 0.20 B 127 ALA N N 15 122.974 0.20 B 128 GLU H H 1 8.026 0.02 B 128 GLU HA H 1 4.169 0.02 B 128 GLU HBx H 1 1.975 0.02 B 128 GLU HBy H 1 1.975 0.02 B 128 GLU HGx H 1 2.250 0.02 B 128 GLU HGy H 1 2.250 0.02 B 128 GLU C C 13 176.500 0.20 B 128 GLU CA C 13 56.740 0.20 B 128 GLU CB C 13 29.880 0.20 B 128 GLU CG C 13 36.260 0.20 B 128 GLU N N 15 122.510 0.20 B 129 ARG H H 1 7.946 0.02 B 129 ARG HA H 1 4.208 0.02 B 129 ARG HBy H 1 1.880 0.02 B 129 ARG HBx H 1 1.778 0.02 B 129 ARG HDx H 1 3.108 0.02 B 129 ARG HDy H 1 3.108 0.02 B 129 ARG HGx H 1 1.479 0.02 B 129 ARG HGy H 1 1.479 0.02 B 129 ARG C C 13 178.700 0.20 B 129 ARG CA C 13 56.480 0.20 B 129 ARG CB C 13 30.530 0.20 B 129 ARG CD C 13 43.190 0.20 B 129 ARG CG C 13 27.180 0.20 B 129 ARG N N 15 122.758 0.20 B 130 LYS H H 1 8.112 0.02 B 130 LYS HA H 1 4.001 0.02 B 130 LYS HBy H 1 1.794 0.02 B 130 LYS HBx H 1 1.780 0.02 B 130 LYS HEx H 1 2.883 0.02 B 130 LYS HEy H 1 2.883 0.02 B 130 LYS HGx H 1 1.425 0.02 B 130 LYS HGy H 1 1.425 0.02 B 130 LYS C C 13 177.900 0.20 B 130 LYS CA C 13 58.580 0.20 B 130 LYS CB C 13 32.480 0.20 B 130 LYS CD C 13 29.560 0.20 B 130 LYS CE C 13 41.020 0.20 B 130 LYS CG C 13 24.840 0.20 B 130 LYS N N 15 120.634 0.20 B 131 ALA H H 1 7.818 0.02 B 131 ALA HA H 1 4.117 0.02 B 131 ALA HB% H 1 1.415 0.02 B 131 ALA C C 13 179.700 0.20 B 131 ALA CA C 13 54.220 0.20 B 131 ALA CB C 13 18.330 0.20 B 131 ALA N N 15 121.812 0.20 B 132 LEU H H 1 7.686 0.02 B 132 LEU HA H 1 4.180 0.02 B 132 LEU HBy H 1 1.689 0.02 B 132 LEU HBx H 1 1.658 0.02 B 132 LEU HDx% H 1 0.830 0.02 B 132 LEU HDy% H 1 0.830 0.02 B 132 LEU C C 13 178.700 0.20 B 132 LEU CA C 13 56.770 0.20 B 132 LEU CB C 13 42.190 0.20 B 132 LEU CDy C 13 24.810 0.20 B 132 LEU CDx C 13 23.660 0.20 B 132 LEU CG C 13 26.960 0.20 B 132 LEU N N 15 119.746 0.20 B 133 GLU H H 1 8.027 0.02 B 133 GLU HA H 1 4.007 0.02 B 133 GLU HBy H 1 2.014 0.02 B 133 GLU HBx H 1 1.981 0.02 B 133 GLU HGx H 1 2.281 0.02 B 133 GLU HGy H 1 2.281 0.02 B 133 GLU C C 13 178.100 0.20 B 133 GLU CA C 13 58.340 0.20 B 133 GLU CB C 13 29.870 0.20 B 133 GLU CG C 13 35.970 0.20 B 133 GLU N N 15 120.421 0.20 B 134 ASP H H 1 8.381 0.02 B 134 ASP HA H 1 4.426 0.02 B 134 ASP HBy H 1 2.775 0.02 B 134 ASP HBx H 1 2.706 0.02 B 134 ASP C C 13 179.200 0.20 B 134 ASP CA C 13 56.700 0.20 B 134 ASP CB C 13 40.520 0.20 B 134 ASP N N 15 121.120 0.20 B 135 LYS H H 1 7.938 0.02 B 135 LYS HA H 1 4.209 0.02 B 135 LYS HBx H 1 1.722 0.02 B 135 LYS HBy H 1 1.722 0.02 B 135 LYS HEx H 1 2.945 0.02 B 135 LYS HEy H 1 2.945 0.02 B 135 LYS HGx H 1 1.319 0.02 B 135 LYS HGy H 1 1.319 0.02 B 135 LYS C C 13 176.700 0.20 B 135 LYS CA C 13 56.370 0.20 B 135 LYS CB C 13 32.550 0.20 B 135 LYS CD C 13 28.490 0.20 B 135 LYS CG C 13 24.300 0.20 B 135 LYS N N 15 122.700 0.20 B 136 LEU H H 1 8.163 0.02 B 136 LEU HA H 1 4.223 0.02 B 136 LEU HBy H 1 1.567 0.02 B 136 LEU HBx H 1 1.548 0.02 B 136 LEU HDx% H 1 0.811 0.02 B 136 LEU HDy% H 1 0.811 0.02 B 136 LEU C C 13 177.400 0.20 B 136 LEU CA C 13 55.320 0.20 B 136 LEU CB C 13 42.220 0.20 B 136 LEU CDy C 13 24.480 0.20 B 136 LEU CDx C 13 23.180 0.20 B 136 LEU CG C 13 26.680 0.20 B 136 LEU N N 15 123.198 0.20 B 137 ALA H H 1 8.084 0.02 B 137 ALA HA H 1 4.171 0.02 B 137 ALA HB% H 1 1.322 0.02 B 137 ALA C C 13 177.600 0.20 B 137 ALA CA C 13 52.750 0.20 B 137 ALA CB C 13 19.320 0.20 B 137 ALA N N 15 124.764 0.20 B 138 ASP H H 1 8.049 0.02 B 138 ASP HA H 1 4.463 0.02 B 138 ASP HBy H 1 2.612 0.02 B 138 ASP HBx H 1 2.589 0.02 B 138 ASP C C 13 176.400 0.20 B 138 ASP CA C 13 54.600 0.20 B 138 ASP CB C 13 41.220 0.20 B 138 ASP N N 15 119.577 0.20 B 139 LYS H H 1 8.097 0.02 B 139 LYS HA H 1 4.094 0.02 B 139 LYS HBx H 1 1.792 0.02 B 139 LYS HBy H 1 1.792 0.02 B 139 LYS C C 13 177.300 0.20 B 139 LYS CA C 13 56.470 0.20 B 139 LYS CB C 13 32.710 0.20 B 139 LYS N N 15 121.554 0.20 B 140 GLN HA H 1 4.234 0.02 B 140 GLN HBx H 1 1.925 0.02 B 140 GLN HBy H 1 1.925 0.02 B 140 GLN HGx H 1 2.258 0.02 B 140 GLN HGy H 1 2.258 0.02 B 140 GLN C C 13 175.900 0.20 B 140 GLN CA C 13 55.150 0.20 B 140 GLN CB C 13 29.570 0.20 B 140 GLN CG C 13 33.670 0.20 B 141 GLU H H 1 8.346 0.02 B 141 GLU HA H 1 4.145 0.02 B 141 GLU HBy H 1 1.851 0.02 B 141 GLU HBx H 1 1.821 0.02 B 141 GLU HGx H 1 2.089 0.02 B 141 GLU HGy H 1 2.089 0.02 B 141 GLU C C 13 176.200 0.20 B 141 GLU CA C 13 56.720 0.20 B 141 GLU CB C 13 30.550 0.20 B 141 GLU CG C 13 36.170 0.20 B 141 GLU N N 15 122.081 0.20 B 142 HIS H H 1 8.460 0.02 B 142 HIS HA H 1 4.555 0.02 B 142 HIS HBy H 1 3.092 0.02 B 142 HIS HBx H 1 3.091 0.02 B 142 HIS C C 13 174.200 0.20 B 142 HIS CA C 13 55.450 0.20 B 142 HIS CB C 13 29.500 0.20 B 142 HIS N N 15 120.376 0.20 B 143 LEU H H 1 8.292 0.02 B 143 LEU HA H 1 4.299 0.02 B 143 LEU HBy H 1 1.548 0.02 B 143 LEU HBx H 1 1.519 0.02 B 143 LEU HDx% H 1 0.8239 0.02 B 143 LEU HDy% H 1 0.8239 0.02 B 143 LEU C C 13 176.100 0.20 B 143 LEU CA C 13 55.040 0.20 B 143 LEU CB C 13 42.680 0.20 B 143 LEU CDx C 13 23.410 0.20 B 143 LEU CDy C 13 23.410 0.20 B 143 LEU CG C 13 26.630 0.20 B 143 LEU N N 15 125.568 0.20 B 144 ASP H H 1 8.407 0.02 B 144 ASP HA H 1 4.408 0.02 B 144 ASP HBx H 1 2.646 0.02 B 144 ASP HBy H 1 2.646 0.02 B 144 ASP C C 13 176.600 0.20 B 144 ASP CA C 13 54.940 0.20 B 144 ASP CB C 13 41.240 0.20 B 144 ASP N N 15 121.702 0.20 B 145 GLY H H 1 8.292 0.02 B 145 GLY HAx H 1 3.806 0.02 B 145 GLY HAy H 1 3.806 0.02 B 145 GLY C C 13 174.300 0.20 B 145 GLY CA C 13 45.670 0.20 B 145 GLY N N 15 114.857 0.20 B 146 ALA H H 1 8.211 0.02 B 146 ALA HA H 1 4.197 0.02 B 146 ALA HB% H 1 1.294 0.02 B 146 ALA C C 13 177.700 0.20 B 146 ALA CA C 13 52.480 0.20 B 146 ALA CB C 13 19.410 0.20 B 146 ALA N N 15 123.791 0.20 B 147 LEU H H 1 8.027 0.02 B 147 LEU HA H 1 4.176 0.02 B 147 LEU HBx H 1 1.567 0.02 B 147 LEU HBy H 1 1.567 0.02 B 147 LEU HDx% H 1 0.7609 0.02 B 147 LEU HDy% H 1 0.7609 0.02 B 147 LEU HG H 1 1.465 0.02 B 147 LEU C C 13 176.900 0.20 B 147 LEU CA C 13 55.080 0.20 B 147 LEU CB C 13 42.300 0.20 B 147 LEU CDy C 13 25.010 0.20 B 147 LEU CDx C 13 23.300 0.20 B 147 LEU CG C 13 26.690 0.20 B 147 LEU N N 15 121.355 0.20 B 148 ARG H H 1 8.020 0.02 B 148 ARG HA H 1 4.250 0.02 B 148 ARG HBy H 1 1.642 0.02 B 148 ARG HBx H 1 1.641 0.02 B 148 ARG HDx H 1 3.078 0.02 B 148 ARG HDy H 1 3.078 0.02 B 148 ARG HGx H 1 1.486 0.02 B 148 ARG HGy H 1 1.486 0.02 B 148 ARG C C 13 174.800 0.20 B 148 ARG CA C 13 55.660 0.20 B 148 ARG CB C 13 31.090 0.20 B 148 ARG CD C 13 43.110 0.20 B 148 ARG CG C 13 26.720 0.20 B 148 ARG N N 15 122.468 0.20 B 149 TYR H H 1 7.640 0.02 B 149 TYR HBy H 1 2.990 0.02 B 149 TYR HBx H 1 2.762 0.02 B 149 TYR C C 13 180.400 0.20 B 149 TYR CA C 13 59.110 0.02 B 149 TYR CB C 13 39.600 0.20 B 149 TYR N N 15 126.666 0.20 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 97 LEU H B 95 ALA H 1.0 2.2 5.0 2 2 B 97 LEU H B 96 GLY HAx 1.0 3.0 4.0 3 2 B 97 LEU H B 96 GLY HAy 1.0 3.0 4.0 4 3 B 97 LEU H B 97 LEU HA 1.0 2.0 3.0 5 4 B 97 LEU HA B 98 GLN H 1.0 2.0 5.0 6 5 B 97 LEU H B 97 LEU HBy 1.0 1.8 3.5 7 5 B 97 LEU H B 97 LEU HBx 1.0 1.8 3.5 8 6 B 98 GLN H B 97 LEU HBy 1.0 2.5 4.5 9 6 B 98 GLN H B 97 LEU HBx 1.0 2.5 4.5 10 7 B 98 GLN H B 98 GLN HBy 1.0 1.8 3.5 11 7 B 98 GLN H B 98 GLN HBx 1.0 1.8 3.5 12 8 B 99 GLU H B 99 GLU HA 1.0 2.0 3.0 13 9 B 99 GLU HA B 100 LYS H 1.0 2.0 5.0 14 10 B 99 GLU H B 99 GLU HBy 1.0 1.8 3.5 15 10 B 99 GLU H B 99 GLU HBx 1.0 1.8 3.5 16 11 B 100 LYS H B 100 LYS HBy 1.0 1.8 3.5 17 11 B 100 LYS H B 100 LYS HBx 1.0 1.8 3.5 18 12 B 101 GLU H B 101 GLU HA 1.0 2.0 3.0 19 13 B 101 GLU HA B 102 ARG H 1.0 3.0 4.0 20 14 B 101 GLU H B 101 GLU HBy 1.0 1.8 3.5 21 14 B 101 GLU H B 101 GLU HBx 1.0 1.8 3.5 22 15 B 102 ARG H B 102 ARG HBy 1.0 1.8 3.5 23 15 B 102 ARG H B 102 ARG HBx 1.0 1.8 3.5 24 16 B 106 ASP H B 105 GLU HA 1.0 3.0 4.0 25 17 B 105 GLU HA B 108 LYS H 1.0 2.9 3.9 26 18 B 106 ASP H B 105 GLU HBy 1.0 2.5 4.5 27 18 B 106 ASP H B 105 GLU HBx 1.0 2.5 4.5 28 19 B 108 LYS H B 108 LYS HBx 1.0 1.8 3.5 29 19 B 108 LYS H B 108 LYS HBy 1.0 1.8 3.5 30 20 B 109 ASP H B 108 LYS HBx 1.0 2.5 4.5 31 20 B 108 LYS HBy B 109 ASP H 1.0 2.5 4.5 32 21 B 109 ASP H B 109 ASP HBy 1.0 1.8 3.5 33 21 B 109 ASP H B 109 ASP HBx 1.0 1.8 3.5 34 22 B 110 ALA H B 109 ASP HBy 1.0 2.5 4.5 35 22 B 109 ASP HBx B 110 ALA H 1.0 2.5 4.5 36 23 B 110 ALA H B 110 ALA HA 1.0 2.0 3.0 37 24 B 110 ALA H B 110 ALA HB% 1.0 1.8 3.5 38 25 B 110 ALA HB% B 111 GLU H 1.0 2.5 4.5 39 26 B 111 GLU H B 111 GLU HA 1.0 2.0 3.0 40 27 B 111 GLU HA B 112 LEU H 1.0 3.0 4.0 41 28 B 111 GLU H B 111 GLU HBy 1.0 1.8 3.5 42 28 B 111 GLU HBx B 111 GLU H 1.0 1.8 3.5 43 29 B 112 LEU H B 112 LEU HBy 1.0 1.8 3.5 44 29 B 112 LEU H B 112 LEU HBx 1.0 1.8 3.5 45 30 B 113 LYS H B 112 LEU HBy 1.0 2.5 4.5 46 30 B 112 LEU HBx B 113 LYS H 1.0 2.5 4.5 47 31 B 112 LEU H B 112 LEU HDx% 1.0 2.5 5.0 48 32 B 113 LYS H B 113 LYS HA 1.0 2.0 3.0 49 33 B 113 LYS HA B 114 ARG H 1.0 3.0 4.0 50 34 B 114 ARG H B 113 LYS HBy 1.0 2.5 4.5 51 34 B 114 ARG H B 113 LYS HBx 1.0 2.5 4.5 52 35 B 114 ARG H B 113 LYS HGx 1.0 2.5 5.0 53 35 B 114 ARG H B 113 LYS HGy 1.0 2.5 5.0 54 36 B 115 LEU H B 115 LEU HA 1.0 2.0 3.0 55 37 B 119 ARG H B 118 GLU HA 1.0 3.0 4.0 56 38 B 119 ARG H B 119 ARG HBy 1.0 1.8 3.5 57 38 B 119 ARG H B 119 ARG HBx 1.0 1.8 3.5 58 39 B 119 ARG H B 119 ARG HGy 1.0 2.5 4.5 59 39 B 119 ARG HGx B 119 ARG H 1.0 2.5 4.5 60 40 B 122 HIS H B 121 ASP HBx 1.0 2.5 4.5 61 40 B 122 HIS H B 121 ASP HBy 1.0 2.5 4.5 62 41 B 122 HIS H B 125 ARG H 1.0 2.0 5.0 63 42 B 124 LYS H B 124 LYS HA 1.0 2.0 3.0 64 43 B 125 ARG H B 125 ARG HA 1.0 2.0 3.0 65 44 B 125 ARG H B 125 ARG HBy 1.0 1.8 3.5 66 44 B 125 ARG H B 125 ARG HBx 1.0 1.8 3.5 67 45 B 126 GLU H B 126 GLU HA 1.0 2.0 3.0 68 46 B 126 GLU H B 126 GLU HBy 1.0 1.8 3.5 69 46 B 126 GLU HBx B 126 GLU H 1.0 1.8 3.5 70 47 B 127 ALA H B 126 GLU HBy 1.0 2.5 4.5 71 47 B 126 GLU HBx B 127 ALA H 1.0 2.5 4.5 72 48 B 127 ALA H B 127 ALA HA 1.0 2.0 3.0 73 49 B 127 ALA H B 127 ALA HB% 1.0 1.8 3.5 74 50 B 129 ARG H B 128 GLU HA 1.0 2.0 5.0 75 51 B 129 ARG H B 129 ARG HBy 1.0 1.8 3.5 76 51 B 129 ARG H B 129 ARG HBx 1.0 1.8 3.5 77 52 B 129 ARG H B 129 ARG HGx 1.0 2.5 4.5 78 52 B 129 ARG H B 129 ARG HGy 1.0 2.5 4.5 79 53 B 130 LYS H B 130 LYS HBy 1.0 1.8 3.5 80 53 B 130 LYS H B 130 LYS HBx 1.0 1.8 3.5 81 54 B 131 ALA H B 130 LYS HBy 1.0 2.5 4.5 82 54 B 130 LYS HBx B 131 ALA H 1.0 2.5 4.5 83 55 B 131 ALA H B 131 ALA HA 1.0 2.0 3.0 84 56 B 131 ALA HA B 132 LEU H 1.0 3.0 4.0 85 57 B 131 ALA HA B 134 ASP H 1.0 2.9 3.9 86 58 B 131 ALA H B 131 ALA HB% 1.0 1.8 3.5 87 59 B 132 LEU H B 132 LEU HBy 1.0 1.8 3.5 88 59 B 132 LEU H B 132 LEU HBx 1.0 1.8 3.5 89 60 B 133 GLU H B 132 LEU HBy 1.0 2.5 4.5 90 60 B 132 LEU HBx B 133 GLU H 1.0 2.5 4.5 91 61 B 133 GLU H B 133 GLU HA 1.0 2.0 3.0 92 62 B 133 GLU H B 133 GLU HBy 1.0 1.8 3.5 93 62 B 133 GLU H B 133 GLU HBx 1.0 1.8 3.5 94 63 B 134 ASP H B 133 GLU HBy 1.0 2.5 4.5 95 63 B 134 ASP H B 133 GLU HBx 1.0 2.5 4.5 96 64 B 134 ASP H B 134 ASP HA 1.0 2.0 3.0 97 65 B 134 ASP H B 134 ASP HBy 1.0 1.8 3.5 98 65 B 134 ASP H B 134 ASP HBx 1.0 1.8 3.5 99 66 B 139 LYS H B 139 LYS HA 1.0 2.0 3.0 100 67 B 139 LYS H B 139 LYS HBx 1.0 1.8 3.5 101 67 B 139 LYS H B 139 LYS HBy 1.0 1.8 3.5 102 68 B 96 GLY H B 96 GLY HAx 1.0 2.0 3.0 103 68 B 96 GLY HAy B 96 GLY H 1.0 2.0 3.0 104 69 B 97 LEU H B 97 LEU HDx% 1.0 2.5 5.0 105 70 B 103 GLU H B 102 ARG HBy 1.0 2.5 4.5 106 70 B 102 ARG HBx B 103 GLU H 1.0 2.5 4.5 107 71 B 103 GLU H B 103 GLU HA 1.0 2.0 3.0 108 72 B 107 LEU H B 107 LEU HBy 1.0 1.8 3.5 109 72 B 107 LEU H B 107 LEU HBx 1.0 1.8 3.5 110 73 B 113 LYS H B 112 LEU HDx% 1.0 2.5 5.0 111 74 B 115 LEU H B 115 LEU HDx% 1.0 2.5 5.0 112 75 B 117 GLU H B 116 ASN HBx 1.0 2.5 4.5 113 75 B 117 GLU H B 116 ASN HBy 1.0 2.5 4.5 114 76 B 120 HIS H B 120 HIS HBx 1.0 1.8 3.5 115 76 B 120 HIS H B 120 HIS HBy 1.0 1.8 3.5 116 77 B 119 ARG H B 121 ASP HBx 1.0 2.0 5.0 117 77 B 119 ARG H B 121 ASP HBy 1.0 2.0 5.0 118 78 B 121 ASP H B 121 ASP HBx 1.0 1.8 3.5 119 78 B 121 ASP HBy B 121 ASP H 1.0 1.8 3.5 120 79 B 122 HIS H B 122 HIS HBy 1.0 1.8 3.5 121 79 B 122 HIS H B 122 HIS HBx 1.0 1.8 3.5 122 80 B 124 LYS H B 123 ASP HBy 1.0 2.5 4.5 123 80 B 124 LYS H B 123 ASP HBx 1.0 2.5 4.5 124 81 B 132 LEU H B 132 LEU HDx% 1.0 2.5 5.0 125 82 B 133 GLU H B 132 LEU HDx% 1.0 2.5 5.0 126 83 B 135 LYS H B 134 ASP HBy 1.0 2.5 4.5 127 83 B 134 ASP HBx B 135 LYS H 1.0 2.5 4.5 128 84 B 137 ALA H B 136 LEU HA 1.0 2.0 5.0 129 85 B 138 ASP H B 137 ALA HA 1.0 3.0 4.0 130 86 B 138 ASP H B 137 ALA HB% 1.0 2.5 4.5 131 87 B 138 ASP H B 138 ASP HBy 1.0 1.8 3.5 132 87 B 138 ASP H B 138 ASP HBx 1.0 1.8 3.5 133 88 B 141 GLU H B 140 GLN HA 1.0 2.0 5.0 134 89 B 142 HIS H B 141 GLU HA 1.0 3.0 4.0 135 90 B 141 GLU H B 141 GLU HBy 1.0 1.8 3.5 136 90 B 141 GLU H B 141 GLU HBx 1.0 1.8 3.5 137 91 B 143 LEU H B 142 HIS HA 1.0 2.0 5.0 138 92 B 144 ASP H B 143 LEU HBy 1.0 2.5 4.5 139 92 B 144 ASP H B 143 LEU HBx 1.0 2.5 4.5 140 93 B 144 ASP H B 143 LEU HDx% 1.0 2.5 5.0 141 94 B 149 TYR H B 148 ARG HA 1.0 2.0 5.0 142 95 B 95 ALA H B -1 SER HA 1.0 3.0 4.0 143 96 B 95 ALA H B -1 SER HBy 1.0 2.5 4.5 144 96 B 95 ALA H B -1 SER HBx 1.0 2.5 4.5 145 97 B 96 GLY H B 95 ALA HA 1.0 3.0 4.0 146 98 B 95 ALA H B 95 ALA HB% 1.0 1.8 3.5 147 99 B 96 GLY H B 95 ALA HB% 1.0 2.5 4.5 148 100 B 98 GLN H B 97 LEU HDx% 1.0 2.5 5.0 149 101 B 102 ARG H B 102 ARG HDx 1.0 2.5 5.0 150 101 B 102 ARG H B 102 ARG HDy 1.0 2.5 5.0 151 102 B 105 GLU H B 104 LEU HA 1.0 2.0 5.0 152 103 B 105 GLU H B 104 LEU HBy 1.0 2.5 4.5 153 103 B 105 GLU H B 104 LEU HBx 1.0 2.5 4.5 154 104 B 105 GLU H B 105 GLU HBy 1.0 1.8 3.5 155 104 B 105 GLU HBx B 105 GLU H 1.0 1.8 3.5 156 105 B 115 LEU HA B 116 ASN H 1.0 2.0 5.0 157 106 B 116 ASN H B 115 LEU HBx 1.0 2.5 4.5 158 106 B 116 ASN H B 115 LEU HBy 1.0 2.5 4.5 159 107 B 115 LEU HDx% B 116 ASN H 1.0 2.5 5.0 160 108 B 116 ASN H B 116 ASN HBx 1.0 1.8 3.5 161 108 B 116 ASN HBy B 116 ASN H 1.0 1.8 3.5 162 109 B 116 ASN H B 117 GLU HBx 1.0 2.5 4.5 163 109 B 116 ASN H B 117 GLU HBy 1.0 2.5 4.5 164 110 B 120 HIS H B 118 GLU HBx 1.0 2.0 5.0 165 110 B 120 HIS H B 118 GLU HBy 1.0 2.0 5.0 166 111 B 121 ASP H B 118 GLU HBx 1.0 2.0 5.0 167 111 B 121 ASP H B 118 GLU HBy 1.0 2.0 5.0 168 112 B 120 HIS H B 119 ARG HA 1.0 3.0 4.0 169 113 B 121 ASP H B 119 ARG HA 1.0 2.4 5.0 170 114 B 120 HIS H B 119 ARG HGy 1.0 2.5 5.0 171 114 B 119 ARG HGx B 120 HIS H 1.0 2.5 5.0 172 115 B 120 HIS HA B 121 ASP H 1.0 3.0 4.0 173 116 B 121 ASP H B 120 HIS HBx 1.0 2.5 4.5 174 116 B 120 HIS HBy B 121 ASP H 1.0 2.5 4.5 175 117 B 120 HIS H B 121 ASP H 1.0 2.3 3.3 176 118 B 120 HIS H B 121 ASP H 1.0 2.3 3.3 177 119 B 123 ASP H B 122 HIS HBy 1.0 2.5 4.5 178 119 B 122 HIS HBx B 123 ASP H 1.0 2.5 4.5 179 120 B 122 HIS H B 121 ASP H 1.0 2.3 3.3 180 121 B 122 HIS H B 123 ASP H 1.0 2.3 3.3 181 122 B 125 ARG H B 125 ARG HDx 1.0 2.5 5.0 182 122 B 125 ARG H B 125 ARG HDy 1.0 2.5 5.0 183 123 B 126 GLU H B 125 ARG HDx 1.0 2.5 5.0 184 123 B 126 GLU H B 125 ARG HDy 1.0 2.5 5.0 185 124 B 130 LYS H B 129 ARG HDx 1.0 2.5 5.0 186 124 B 130 LYS H B 129 ARG HDy 1.0 2.5 5.0 187 125 B 137 ALA H B 137 ALA HB% 1.0 1.8 3.5 188 126 B 139 LYS H B 138 ASP HBy 1.0 2.5 4.5 189 126 B 139 LYS H B 138 ASP HBx 1.0 2.5 4.5 190 127 B 142 HIS H B 142 HIS HBy 1.0 1.8 3.5 191 127 B 142 HIS H B 142 HIS HBx 1.0 1.8 3.5 192 128 B 143 LEU H B 142 HIS HBy 1.0 2.5 4.5 193 128 B 143 LEU H B 142 HIS HBx 1.0 2.5 4.5 194 129 B 143 LEU H B 143 LEU HA 1.0 2.0 3.0 195 130 B 143 LEU H B 143 LEU HBy 1.0 1.8 3.5 196 130 B 143 LEU H B 143 LEU HBx 1.0 1.8 3.5 197 131 B 143 LEU H B 143 LEU HDx% 1.0 2.5 5.0 198 132 B 145 GLY H B 144 ASP HBx 1.0 2.5 4.5 199 132 B 145 GLY H B 144 ASP HBy 1.0 2.5 4.5 200 133 B 145 GLY H B 145 GLY HAx 1.0 2.0 3.0 201 133 B 145 GLY H B 145 GLY HAy 1.0 2.0 3.0 202 134 B 146 ALA H B 145 GLY HAx 1.0 2.0 5.0 203 134 B 145 GLY HAy B 146 ALA H 1.0 2.0 5.0 204 135 B 146 ALA H B 146 ALA HA 1.0 2.0 3.0 205 136 B 146 ALA H B 146 ALA HB% 1.0 1.8 3.5 206 137 B 149 TYR H B 148 ARG HBy 1.0 2.5 4.5 207 137 B 149 TYR H B 148 ARG HBx 1.0 2.5 4.5 208 138 B 149 TYR H B 149 TYR HBy 1.0 1.8 3.5 209 138 B 149 TYR H B 149 TYR HBx 1.0 1.8 3.5 210 139 B 97 LEU H B 97 LEU HG 1.0 2.5 4.5 211 140 B 98 GLN H B 98 GLN HGx 1.0 2.5 4.5 212 140 B 98 GLN H B 98 GLN HGy 1.0 2.5 4.5 213 141 B 99 GLU H B 98 GLN HA 1.0 2.0 5.0 214 142 B 99 GLU H B 99 GLU HGx 1.0 2.5 4.5 215 142 B 99 GLU H B 99 GLU HGy 1.0 2.5 4.5 216 143 B 99 GLU H B 98 GLN HGx 1.0 2.5 5.0 217 143 B 99 GLU H B 98 GLN HGy 1.0 2.5 5.0 218 144 B 100 LYS H B 100 LYS HA 1.0 2.0 3.0 219 145 B 100 LYS H B 99 GLU HBy 1.0 2.5 4.5 220 145 B 100 LYS H B 99 GLU HBx 1.0 2.5 4.5 221 146 B 100 LYS H B 100 LYS HGx 1.0 2.5 4.5 222 146 B 100 LYS H B 100 LYS HGy 1.0 2.5 4.5 223 147 B 100 LYS H B 99 GLU HGx 1.0 2.5 5.0 224 147 B 100 LYS H B 99 GLU HGy 1.0 2.5 5.0 225 148 B 101 GLU H B 100 LYS HA 1.0 3.0 4.0 226 149 B 101 GLU H B 100 LYS HEx 1.0 2.0 5.0 227 149 B 101 GLU H B 100 LYS HEy 1.0 2.0 5.0 228 150 B 101 GLU H B 101 GLU HGx 1.0 2.5 4.5 229 150 B 101 GLU H B 101 GLU HGy 1.0 2.5 4.5 230 151 B 101 GLU H B 100 LYS HBy 1.0 2.5 4.5 231 151 B 100 LYS HBx B 101 GLU H 1.0 2.5 4.5 232 152 B 101 GLU H B 100 LYS HGx 1.0 2.5 5.0 233 152 B 101 GLU H B 100 LYS HGy 1.0 2.5 5.0 234 153 B 102 ARG H B 102 ARG HA 1.0 2.0 3.0 235 154 B 102 ARG H B 101 GLU HGx 1.0 2.5 5.0 236 154 B 102 ARG H B 101 GLU HGy 1.0 2.5 5.0 237 155 B 102 ARG H B 102 ARG HGx 1.0 2.5 4.5 238 155 B 102 ARG H B 102 ARG HGy 1.0 2.5 4.5 239 156 B 103 GLU H B 103 GLU HBx 1.0 1.8 3.5 240 156 B 103 GLU H B 103 GLU HBy 1.0 1.8 3.5 241 157 B 105 GLU H B 105 GLU HGx 1.0 2.5 4.5 242 157 B 105 GLU H B 105 GLU HGy 1.0 2.5 4.5 243 158 B 106 ASP H B 105 GLU HGx 1.0 2.5 5.0 244 158 B 106 ASP H B 105 GLU HGy 1.0 2.5 5.0 245 159 B 108 LYS H B 108 LYS HA 1.0 2.0 3.0 246 160 B 108 LYS H B 106 ASP HA 1.0 2.4 5.0 247 161 B 108 LYS H B 107 LEU HBy 1.0 2.5 4.5 248 161 B 108 LYS H B 107 LEU HBx 1.0 2.5 4.5 249 162 B 108 LYS H B 108 LYS HDx 1.0 2.5 5.0 250 162 B 108 LYS H B 108 LYS HDy 1.0 2.5 5.0 251 163 B 108 LYS H B 108 LYS HGx 1.0 2.5 4.5 252 163 B 108 LYS H B 108 LYS HGy 1.0 2.5 4.5 253 164 B 108 LYS H B 107 LEU HG 1.0 2.5 5.0 254 165 B 109 ASP H B 108 LYS HA 1.0 3.0 4.0 255 166 B 110 ALA H B 109 ASP HA 1.0 3.0 4.0 256 167 B 111 GLU H B 111 GLU HGx 1.0 2.5 4.5 257 167 B 111 GLU HGy B 111 GLU H 1.0 2.5 4.5 258 168 B 112 LEU H B 112 LEU HA 1.0 2.0 3.0 259 169 B 112 LEU H B 111 GLU HGx 1.0 2.5 5.0 260 169 B 111 GLU HGy B 112 LEU H 1.0 2.5 5.0 261 170 B 112 LEU H B 111 GLU HBy 1.0 2.5 4.5 262 170 B 111 GLU HBx B 112 LEU H 1.0 2.5 4.5 263 171 B 112 LEU H B 112 LEU HG 1.0 2.5 4.5 264 172 B 114 ARG H B 114 ARG HA 1.0 2.0 3.0 265 173 B 114 ARG H B 114 ARG HBx 1.0 1.8 3.5 266 173 B 114 ARG H B 114 ARG HBy 1.0 1.8 3.5 267 174 B 114 ARG H B 114 ARG HGx 1.0 2.5 4.5 268 174 B 114 ARG H B 114 ARG HGy 1.0 2.5 4.5 269 175 B 117 GLU H B 117 GLU HA 1.0 2.0 3.0 270 176 B 117 GLU H B 117 GLU HGx 1.0 2.5 4.5 271 176 B 117 GLU H B 117 GLU HGy 1.0 2.5 4.5 272 177 B 117 GLU H B 117 GLU HBx 1.0 1.8 3.5 273 177 B 117 GLU H B 117 GLU HBy 1.0 1.8 3.5 274 178 B 119 ARG H B 119 ARG HA 1.0 2.0 3.0 275 179 B 120 HIS HA B 120 HIS H 1.0 2.0 3.0 276 180 B 120 HIS H B 121 ASP HBx 1.0 2.5 4.5 277 180 B 121 ASP HBy B 120 HIS H 1.0 2.5 4.5 278 181 B 121 ASP H B 121 ASP HA 1.0 2.0 3.0 279 182 B 123 ASP H B 123 ASP HA 1.0 2.0 3.0 280 183 B 120 HIS HA B 123 ASP H 1.0 2.9 3.9 281 184 B 124 LYS H B 122 HIS HA 1.0 2.4 5.0 282 185 B 124 LYS H B 124 LYS HBy 1.0 1.8 3.5 283 185 B 124 LYS H B 124 LYS HBx 1.0 1.8 3.5 284 186 B 124 LYS H B 124 LYS HDx 1.0 2.5 5.0 285 186 B 124 LYS H B 124 LYS HDy 1.0 2.5 5.0 286 187 B 125 ARG H B 124 LYS HA 1.0 3.0 4.0 287 188 B 125 ARG H B 124 LYS HBy 1.0 2.5 4.5 288 188 B 125 ARG H B 124 LYS HBx 1.0 2.5 4.5 289 189 B 125 ARG H B 125 ARG HGx 1.0 2.5 4.5 290 189 B 125 ARG H B 125 ARG HGy 1.0 2.5 4.5 291 190 B 125 ARG H B 124 LYS HGx 1.0 2.5 5.0 292 190 B 125 ARG H B 124 LYS HGy 1.0 2.5 5.0 293 191 B 125 ARG H B 124 LYS HEx 1.0 2.0 5.0 294 191 B 125 ARG H B 124 LYS HEy 1.0 2.0 5.0 295 192 B 125 ARG HA B 127 ALA H 1.0 2.4 5.0 296 193 B 127 ALA H B 126 GLU HGx 1.0 2.5 5.0 297 193 B 127 ALA H B 126 GLU HGy 1.0 2.5 5.0 298 194 B 130 LYS H B 130 LYS HA 1.0 2.0 3.0 299 195 B 130 LYS H B 129 ARG HBy 1.0 2.5 4.5 300 195 B 129 ARG HBx B 130 LYS H 1.0 2.5 4.5 301 196 B 130 LYS H B 129 ARG HGx 1.0 2.5 5.0 302 196 B 129 ARG HGy B 130 LYS H 1.0 2.5 5.0 303 197 B 130 LYS H B 130 LYS HGx 1.0 2.5 4.5 304 197 B 130 LYS H B 130 LYS HGy 1.0 2.5 4.5 305 198 B 130 LYS H B 130 LYS HEx 1.0 2.0 5.0 306 198 B 130 LYS H B 130 LYS HEy 1.0 2.0 5.0 307 199 B 127 ALA HA B 130 LYS H 1.0 2.9 3.9 308 200 B 131 ALA H B 130 LYS HA 1.0 3.0 4.0 309 201 B 131 ALA H B 130 LYS HDx 1.0 2.5 5.0 310 201 B 131 ALA H B 130 LYS HDy 1.0 2.5 5.0 311 202 B 131 ALA H B 130 LYS HGx 1.0 2.5 5.0 312 202 B 131 ALA H B 130 LYS HGy 1.0 2.5 5.0 313 203 B 132 LEU H B 130 LYS HA 1.0 2.4 5.0 314 204 B 132 LEU H B 132 LEU HA 1.0 2.0 3.0 315 205 B 132 LEU H B 132 LEU HG 1.0 2.5 4.5 316 206 B 133 GLU H B 132 LEU HG 1.0 2.5 5.0 317 207 B 133 GLU H B 133 GLU HGx 1.0 2.5 4.5 318 207 B 133 GLU H B 133 GLU HGy 1.0 2.5 4.5 319 208 B 134 ASP H B 133 GLU HA 1.0 3.0 4.0 320 209 B 134 ASP H B 133 GLU HGx 1.0 2.5 5.0 321 209 B 134 ASP H B 133 GLU HGy 1.0 2.5 5.0 322 210 B 135 LYS H B 135 LYS HBx 1.0 1.8 3.5 323 210 B 135 LYS H B 135 LYS HBy 1.0 1.8 3.5 324 211 B 136 LEU H B 135 LYS HA 1.0 2.0 5.0 325 212 B 136 LEU H B 136 LEU HBy 1.0 1.8 3.5 326 212 B 136 LEU H B 136 LEU HBx 1.0 1.8 3.5 327 213 B 137 ALA H B 137 ALA HA 1.0 2.0 3.0 328 214 B 137 ALA H B 136 LEU HBy 1.0 2.5 4.5 329 214 B 137 ALA H B 136 LEU HBx 1.0 2.5 4.5 330 215 B 138 ASP H B 138 ASP HA 1.0 2.0 3.0 331 216 B 141 GLU H B 141 GLU HA 1.0 2.0 3.0 332 217 B 141 GLU H B 141 GLU HGx 1.0 2.5 4.5 333 217 B 141 GLU H B 141 GLU HGy 1.0 2.5 4.5 334 218 B 144 ASP H B 143 LEU HG 1.0 2.5 5.0 335 219 B 143 LEU H B 143 LEU HG 1.0 2.5 4.5 336 220 B 145 GLY H B 144 ASP HA 1.0 3.0 4.0 337 221 B 146 ALA HA B 147 LEU H 1.0 2.0 5.0 338 222 B 147 LEU H B 147 LEU HBx 1.0 1.8 3.5 339 222 B 147 LEU H B 147 LEU HBy 1.0 1.8 3.5 340 223 B 147 LEU H B 147 LEU HG 1.0 2.5 4.5 341 224 B 147 LEU H B 147 LEU HDx% 1.0 2.5 5.0 342 225 B 148 ARG H B 147 LEU HA 1.0 3.0 4.0 343 226 B 149 TYR H B 149 TYR HA 1.0 2.0 3.0 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 save_ save_CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 B 100 LYS H B 100 LYS N 1.0 . . . 2 2 B 108 LYS H B 108 LYS N 1.0 . . . 3 3 B 110 ALA H B 110 ALA N 1.0 . . . 4 4 B 111 GLU H B 111 GLU N 1.0 . . . 5 5 B 112 LEU H B 112 LEU N 1.0 . . . 6 6 B 119 ARG N B 119 ARG H 1.0 . . . 7 7 B 120 HIS N B 120 HIS H 1.0 . . . 8 8 B 121 ASP N B 121 ASP H 1.0 . . . 9 9 B 124 LYS N B 124 LYS H 1.0 . . . 10 10 B 125 ARG N B 125 ARG H 1.0 . . . 11 11 B 130 LYS N B 130 LYS H 1.0 . . . 12 12 B 131 ALA N B 131 ALA H 1.0 . . . 13 13 B 132 LEU N B 132 LEU H 1.0 . . . 14 14 B 133 GLU N B 133 GLU H 1.0 . . . 15 15 B 134 ASP N B 134 ASP H 1.0 . . . stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 2 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 17 . . . . 2 ppm . . 26 . . . . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 2 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 17 . . . . 2 ppm . . 36 . . . . stop_ save_