data_nef_c30687_6uz5 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 6UZ5 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 85 LYS middle . . 91 B 86 THR middle . . 92 B 87 ILE middle . . 93 B 88 GLN middle . . 94 B 89 GLU middle . . 95 B 90 LYS middle . . 96 B 91 GLU middle . . 97 B 92 GLN middle . . 98 B 93 GLU middle . . 99 B 94 LEU middle . . 100 B 95 LYS middle . . 101 B 96 ASN middle . . 102 B 97 LEU middle . . 103 B 98 LYS middle . . 104 B 99 ASP middle . . 105 B 100 ASN middle . . 106 B 101 VAL middle . . 107 B 102 GLU middle . . 108 B 103 LEU middle . . 109 B 104 GLU middle . . 110 B 105 ARG middle . . 111 B 106 LEU middle . . 112 B 107 LYS middle . . 113 B 108 ASN middle . . 114 B 109 GLU middle . . 115 B 110 ARG middle . . 116 B 111 HIS middle . . 117 B 112 ASP middle . . 118 B 113 HIS middle . . 119 B 114 ASP middle . . 120 B 115 GLU middle . . 121 B 116 GLU middle . . 122 B 117 ALA middle . . 123 B 118 GLU middle . . 124 B 119 ARG middle . . 125 B 120 LYS middle . . 126 B 121 ALA middle . . 127 B 122 LEU middle . . 128 B 123 GLU middle . . 129 B 124 ASP middle . . 130 B 125 LYS middle . . 131 B 126 LEU middle . . 132 B 127 ALA middle . . 133 B 128 ASP middle . . 134 B 129 LYS middle . . 135 B 130 GLN middle . . 136 B 131 GLU middle . . 137 B 132 HIS middle . . 138 B 133 LEU middle . . 139 B 134 ASP middle . . 140 B 135 GLY middle . false 141 B 136 ALA middle . . 142 B 137 LEU middle . . 143 B 138 ARG middle . . 144 B 139 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 HA H 1 4.264 0.02 B -1 SER HBy H 1 3.783 0.02 B -1 SER HBx H 1 3.773 0.02 B -1 SER C C 13 174.600 0.20 B -1 SER CA C 13 62.200 0.20 B -1 SER CB C 13 63.920 0.20 B 85 LYS H H 1 8.506 0.02 B 85 LYS HA H 1 4.400 0.02 B 85 LYS HBy H 1 1.736 0.02 B 85 LYS HBx H 1 1.732 0.02 B 85 LYS HGx H 1 1.401 0.02 B 85 LYS HGy H 1 1.401 0.02 B 85 LYS C C 13 177.200 0.20 B 85 LYS CA C 13 56.640 0.20 B 85 LYS CB C 13 33.690 0.20 B 85 LYS CD C 13 29.190 0.20 B 85 LYS CG C 13 25.010 0.20 B 85 LYS N N 15 124.200 0.20 B 86 THR H H 1 8.410 0.02 B 86 THR HA H 1 4.302 0.02 B 86 THR HG2% H 1 1.162 0.02 B 86 THR C C 13 175.400 0.20 B 86 THR CA C 13 61.700 0.20 B 86 THR CB C 13 70.610 0.20 B 86 THR CG2 C 13 22.040 0.20 B 86 THR N N 15 115.700 0.20 B 87 ILE H H 1 8.402 0.02 B 87 ILE HA H 1 4.044 0.02 B 87 ILE HB H 1 1.775 0.02 B 87 ILE HG1y H 1 1.423 0.02 B 87 ILE HG1x H 1 1.100 0.02 B 87 ILE HG2% H 1 0.823 0.02 B 87 ILE C C 13 177.400 0.20 B 87 ILE CA C 13 61.490 0.20 B 87 ILE CB C 13 38.680 0.20 B 87 ILE CG1 C 13 27.520 0.20 B 87 ILE CG2 C 13 17.560 0.20 B 87 ILE N N 15 122.600 0.20 B 88 GLN H H 1 8.359 0.02 B 88 GLN HA H 1 4.234 0.02 B 88 GLN HBy H 1 1.948 0.02 B 88 GLN HBx H 1 1.936 0.02 B 88 GLN HGx H 1 2.261 0.02 B 88 GLN HGy H 1 2.261 0.02 B 88 GLN C C 13 176.400 0.20 B 88 GLN CA C 13 56.440 0.20 B 88 GLN CB C 13 29.440 0.20 B 88 GLN CG C 13 33.900 0.20 B 88 GLN N N 15 124.400 0.20 B 89 GLU H H 1 8.217 0.02 B 89 GLU HA H 1 4.146 0.02 B 89 GLU HBy H 1 1.976 0.02 B 89 GLU HBx H 1 1.856 0.02 B 89 GLU HGx H 1 2.235 0.02 B 89 GLU HGy H 1 2.235 0.02 B 89 GLU C C 13 176.900 0.20 B 89 GLU CA C 13 57.180 0.20 B 89 GLU CB C 13 30.000 0.20 B 89 GLU CG C 13 36.300 0.20 B 89 GLU N N 15 122.000 0.20 B 90 LYS H H 1 8.054 0.02 B 90 LYS HA H 1 4.200 0.02 B 90 LYS HBy H 1 1.782 0.02 B 90 LYS HBx H 1 1.687 0.02 B 90 LYS C C 13 176.500 0.20 B 90 LYS CA C 13 56.790 0.20 B 90 LYS CB C 13 33.030 0.20 B 90 LYS CD C 13 29.510 0.20 B 90 LYS N N 15 122.000 0.20 B 91 GLU H H 1 8.289 0.02 B 91 GLU HA H 1 4.180 0.02 B 91 GLU C C 13 177.100 0.20 B 91 GLU CA C 13 56.640 0.20 B 91 GLU CB C 13 30.260 0.20 B 91 GLU N N 15 122.800 0.20 B 92 GLN HA H 1 4.232 0.02 B 92 GLN HBx H 1 1.944 0.02 B 92 GLN HBy H 1 1.944 0.02 B 92 GLN HGx H 1 2.279 0.02 B 92 GLN HGy H 1 2.279 0.02 B 92 GLN C C 13 175.900 0.20 B 92 GLN CA C 13 55.870 0.20 B 92 GLN CB C 13 29.530 0.20 B 92 GLN CG C 13 33.890 0.20 B 93 GLU H H 1 8.340 0.02 B 93 GLU HA H 1 4.173 0.02 B 93 GLU HBy H 1 1.907 0.02 B 93 GLU HBx H 1 1.895 0.02 B 93 GLU HGx H 1 2.195 0.02 B 93 GLU HGy H 1 2.195 0.02 B 93 GLU C C 13 176.200 0.20 B 93 GLU CA C 13 56.680 0.20 B 93 GLU CB C 13 30.410 0.20 B 93 GLU CG C 13 36.430 0.20 B 93 GLU N N 15 122.100 0.20 B 94 LEU H H 1 8.196 0.02 B 94 LEU HA H 1 4.212 0.02 B 94 LEU HBy H 1 1.571 0.02 B 94 LEU HBx H 1 1.482 0.02 B 94 LEU HDx% H 1 0.808 0.02 B 94 LEU HDy% H 1 0.808 0.02 B 94 LEU C C 13 176.900 0.20 B 94 LEU CA C 13 55.150 0.20 B 94 LEU CB C 13 42.410 0.20 B 94 LEU CDy C 13 25.030 0.20 B 94 LEU CDx C 13 23.750 0.20 B 94 LEU CG C 13 27.050 0.20 B 94 LEU N N 15 124.500 0.20 B 95 LYS H H 1 8.140 0.02 B 95 LYS HA H 1 4.151 0.02 B 95 LYS HBy H 1 1.737 0.02 B 95 LYS HBx H 1 1.634 0.02 B 95 LYS HGx H 1 1.414 0.02 B 95 LYS HGy H 1 1.414 0.02 B 95 LYS C C 13 174.700 0.20 B 95 LYS CA C 13 55.560 0.20 B 95 LYS CB C 13 31.170 0.20 B 95 LYS CG C 13 25.170 0.20 B 95 LYS N N 15 122.800 0.20 B 96 ASN H H 1 8.186 0.02 B 96 ASN HA H 1 4.574 0.02 B 96 ASN HBy H 1 2.660 0.02 B 96 ASN HBx H 1 2.580 0.02 B 96 ASN C C 13 175.200 0.20 B 96 ASN CA C 13 56.160 0.20 B 96 ASN CB C 13 38.230 0.20 B 96 ASN N N 15 119.100 0.20 B 97 LEU H H 1 8.037 0.02 B 97 LEU HBy H 1 1.664 0.02 B 97 LEU HBx H 1 1.578 0.02 B 97 LEU HG H 1 1.517 0.02 B 97 LEU C C 13 175.800 0.20 B 97 LEU CA C 13 56.460 0.20 B 97 LEU N N 15 121.400 0.20 B 98 LYS H H 1 8.203 0.02 B 98 LYS HA H 1 4.001 0.02 B 98 LYS HBy H 1 1.921 0.02 B 98 LYS HBx H 1 1.865 0.02 B 98 LYS C C 13 179.800 0.20 B 98 LYS CA C 13 59.560 0.20 B 98 LYS CB C 13 32.450 0.20 B 98 LYS CD C 13 29.640 0.20 B 98 LYS CG C 13 25.390 0.20 B 98 LYS N N 15 121.900 0.20 B 99 ASP H H 1 8.719 0.02 B 99 ASP HA H 1 4.461 0.02 B 99 ASP HBy H 1 2.804 0.02 B 99 ASP HBx H 1 2.710 0.02 B 99 ASP C C 13 177.900 0.20 B 99 ASP CA C 13 56.460 0.20 B 99 ASP CB C 13 40.650 0.20 B 99 ASP N N 15 122.000 0.20 B 100 ASN H H 1 8.177 0.02 B 100 ASN HA H 1 4.509 0.02 B 100 ASN HBy H 1 2.804 0.02 B 100 ASN HBx H 1 2.772 0.02 B 100 ASN C C 13 179.100 0.20 B 100 ASN CA C 13 57.960 0.20 B 100 ASN CB C 13 37.790 0.20 B 100 ASN N N 15 118.400 0.20 B 101 VAL H H 1 8.071 0.02 B 101 VAL HA H 1 4.047 0.02 B 101 VAL HB H 1 1.770 0.02 B 101 VAL HGx% H 1 0.998 0.02 B 101 VAL HGy% H 1 0.998 0.02 B 101 VAL C C 13 178.700 0.20 B 101 VAL CA C 13 66.080 0.20 B 101 VAL CB C 13 32.450 0.20 B 101 VAL N N 15 120.700 0.20 B 102 GLU H H 1 7.911 0.02 B 102 GLU HA H 1 4.177 0.02 B 102 GLU HBy H 1 2.181 0.02 B 102 GLU HBx H 1 1.990 0.02 B 102 GLU HGx H 1 2.239 0.02 B 102 GLU HGy H 1 2.239 0.02 B 102 GLU C C 13 177.700 0.20 B 102 GLU CA C 13 58.160 0.20 B 102 GLU CB C 13 29.700 0.20 B 102 GLU CG C 13 36.270 0.20 B 102 GLU N N 15 122.700 0.20 B 103 LEU H H 1 8.027 0.02 B 103 LEU HA H 1 4.092 0.02 B 103 LEU HBy H 1 1.519 0.02 B 103 LEU HBx H 1 1.499 0.02 B 103 LEU HDx% H 1 0.812 0.02 B 103 LEU HDy% H 1 0.812 0.02 B 103 LEU C C 13 176.900 0.20 B 103 LEU CA C 13 55.090 0.20 B 103 LEU CB C 13 42.380 0.20 B 103 LEU CDy C 13 25.060 0.20 B 103 LEU CDx C 13 23.920 0.20 B 103 LEU CG C 13 26.940 0.20 B 103 LEU N N 15 121.400 0.20 B 104 GLU H H 1 8.528 0.02 B 104 GLU HA H 1 4.227 0.02 B 104 GLU HBy H 1 2.001 0.02 B 104 GLU HBx H 1 1.903 0.02 B 104 GLU HGx H 1 2.214 0.02 B 104 GLU HGy H 1 2.214 0.02 B 104 GLU C C 13 180.500 0.20 B 104 GLU CA C 13 56.120 0.20 B 104 GLU CB C 13 29.870 0.20 B 104 GLU CG C 13 36.230 0.20 B 104 GLU N N 15 123.000 0.20 B 105 ARG H H 1 8.445 0.02 B 105 ARG HA H 1 4.302 0.02 B 105 ARG HBy H 1 1.816 0.02 B 105 ARG HBx H 1 1.770 0.02 B 105 ARG C C 13 178.700 0.20 B 105 ARG CA C 13 59.060 0.20 B 105 ARG CB C 13 30.280 0.20 B 105 ARG CD C 13 41.560 0.20 B 105 ARG CG C 13 29.340 0.20 B 105 ARG N N 15 124.200 0.20 B 106 LEU H H 1 8.610 0.02 B 106 LEU HA H 1 4.140 0.02 B 106 LEU C C 13 178.100 0.20 B 106 LEU CA C 13 58.510 0.20 B 106 LEU CB C 13 41.330 0.20 B 106 LEU CDy C 13 25.630 0.20 B 106 LEU CDx C 13 23.190 0.20 B 106 LEU N N 15 120.600 0.20 B 107 LYS H H 1 8.066 0.02 B 107 LYS HA H 1 4.085 0.02 B 107 LYS C C 13 176.800 0.20 B 107 LYS CA C 13 57.030 0.20 B 107 LYS CB C 13 32.350 0.20 B 107 LYS CD C 13 28.460 0.20 B 107 LYS CG C 13 25.050 0.20 B 107 LYS N N 15 120.900 0.20 B 108 ASN H H 1 8.246 0.02 B 108 ASN HA H 1 4.496 0.02 B 108 ASN HBy H 1 2.758 0.02 B 108 ASN HBx H 1 2.737 0.02 B 108 ASN C C 13 177.100 0.20 B 108 ASN CA C 13 55.430 0.20 B 108 ASN CB C 13 41.030 0.20 B 108 ASN N N 15 121.100 0.20 B 109 GLU H H 1 8.480 0.02 B 109 GLU HA H 1 4.148 0.02 B 109 GLU HBy H 1 2.006 0.02 B 109 GLU HBx H 1 1.898 0.02 B 109 GLU C C 13 178.100 0.20 B 109 GLU CA C 13 58.230 0.20 B 109 GLU CB C 13 30.190 0.20 B 109 GLU CG C 13 36.410 0.20 B 109 GLU N N 15 122.400 0.20 B 110 ARG H H 1 8.121 0.02 B 110 ARG HA H 1 4.049 0.02 B 110 ARG HBy H 1 1.800 0.02 B 110 ARG HBx H 1 1.724 0.02 B 110 ARG HGx H 1 1.429 0.02 B 110 ARG HGy H 1 1.429 0.02 B 110 ARG C C 13 178.900 0.20 B 110 ARG CA C 13 59.460 0.20 B 110 ARG CB C 13 30.420 0.20 B 110 ARG CG C 13 27.420 0.20 B 110 ARG N N 15 121.800 0.20 B 111 HIS H H 1 7.722 0.02 B 111 HIS HA H 1 4.450 0.02 B 111 HIS HBy H 1 3.428 0.02 B 111 HIS HBx H 1 3.357 0.02 B 111 HIS C C 13 178.700 0.20 B 111 HIS CA C 13 57.590 0.20 B 111 HIS CB C 13 29.730 0.20 B 111 HIS N N 15 116.900 0.20 B 112 ASP H H 1 8.165 0.02 B 112 ASP HA H 1 4.493 0.02 B 112 ASP HBy H 1 2.776 0.02 B 112 ASP HBx H 1 2.736 0.02 B 112 ASP C C 13 177.000 0.20 B 112 ASP CA C 13 56.400 0.20 B 112 ASP CB C 13 40.700 0.20 B 112 ASP N N 15 118.900 0.20 B 113 HIS H H 1 8.179 0.02 B 113 HIS HA H 1 4.604 0.02 B 113 HIS HBy H 1 3.378 0.02 B 113 HIS HBx H 1 3.175 0.02 B 113 HIS C C 13 175.300 0.20 B 113 HIS CA C 13 56.370 0.20 B 113 HIS CB C 13 29.230 0.20 B 113 HIS N N 15 118.200 0.20 B 114 ASP H H 1 8.010 0.02 B 114 ASP HA H 1 4.525 0.02 B 114 ASP HBy H 1 2.774 0.02 B 114 ASP HBx H 1 2.740 0.02 B 114 ASP C C 13 176.900 0.20 B 114 ASP CA C 13 55.200 0.20 B 114 ASP CB C 13 41.000 0.20 B 114 ASP N N 15 122.400 0.20 B 115 GLU H H 1 8.456 0.02 B 115 GLU HA H 1 4.151 0.02 B 115 GLU HBy H 1 1.996 0.02 B 115 GLU HBx H 1 1.958 0.02 B 115 GLU HGx H 1 2.272 0.02 B 115 GLU HGy H 1 2.272 0.02 B 115 GLU C C 13 178.800 0.20 B 115 GLU CA C 13 57.320 0.20 B 115 GLU CB C 13 30.020 0.20 B 115 GLU CG C 13 36.350 0.20 B 115 GLU N N 15 121.800 0.20 B 116 GLU H H 1 8.306 0.02 B 116 GLU HA H 1 4.100 0.02 B 116 GLU HBy H 1 2.002 0.02 B 116 GLU HBx H 1 1.975 0.02 B 116 GLU HGx H 1 2.246 0.02 B 116 GLU HGy H 1 2.246 0.02 B 116 GLU C C 13 177.900 0.20 B 116 GLU CA C 13 58.320 0.20 B 116 GLU CB C 13 29.660 0.20 B 116 GLU CG C 13 36.200 0.20 B 116 GLU N N 15 121.500 0.20 B 117 ALA H H 1 8.088 0.02 B 117 ALA HA H 1 4.113 0.02 B 117 ALA HB% H 1 1.368 0.02 B 117 ALA C C 13 180.100 0.20 B 117 ALA CA C 13 54.340 0.20 B 117 ALA CB C 13 19.050 0.20 B 117 ALA N N 15 123.400 0.20 B 118 GLU H H 1 8.091 0.02 B 118 GLU HA H 1 4.121 0.02 B 118 GLU HBy H 1 2.049 0.02 B 118 GLU HBx H 1 1.999 0.02 B 118 GLU HGx H 1 2.156 0.02 B 118 GLU HGy H 1 2.156 0.02 B 118 GLU C C 13 178.100 0.20 B 118 GLU CA C 13 59.390 0.20 B 118 GLU CB C 13 29.880 0.20 B 118 GLU CG C 13 36.610 0.20 B 118 GLU N N 15 119.500 0.20 B 119 ARG H H 1 7.781 0.02 B 119 ARG HA H 1 4.117 0.02 B 119 ARG HBx H 1 1.865 0.02 B 119 ARG HBy H 1 1.865 0.02 B 119 ARG HDx H 1 3.201 0.02 B 119 ARG HDy H 1 3.201 0.02 B 119 ARG HGy H 1 1.570 0.02 B 119 ARG HGx H 1 1.442 0.02 B 119 ARG C C 13 178.200 0.20 B 119 ARG CA C 13 58.180 0.20 B 119 ARG CB C 13 30.250 0.20 B 119 ARG N N 15 120.100 0.20 B 120 LYS H H 1 8.152 0.02 B 120 LYS HA H 1 4.065 0.02 B 120 LYS HBy H 1 1.792 0.02 B 120 LYS HBx H 1 1.788 0.02 B 120 LYS HDx H 1 1.597 0.02 B 120 LYS HDy H 1 1.597 0.02 B 120 LYS HGx H 1 1.445 0.02 B 120 LYS HGy H 1 1.445 0.02 B 120 LYS C C 13 177.600 0.20 B 120 LYS CA C 13 57.960 0.20 B 120 LYS CB C 13 32.450 0.20 B 120 LYS CD C 13 28.830 0.20 B 120 LYS CG C 13 25.040 0.20 B 120 LYS N N 15 121.300 0.20 B 121 ALA H H 1 7.922 0.02 B 121 ALA HA H 1 4.147 0.02 B 121 ALA HB% H 1 1.382 0.02 B 121 ALA C C 13 179.300 0.20 B 121 ALA CA C 13 53.780 0.20 B 121 ALA CB C 13 18.640 0.20 B 121 ALA N N 15 122.900 0.20 B 122 LEU H H 1 7.811 0.02 B 122 LEU HA H 1 4.092 0.02 B 122 LEU HBx H 1 1.648 0.02 B 122 LEU HBy H 1 1.648 0.02 B 122 LEU HDx% H 1 0.843 0.02 B 122 LEU HDy% H 1 0.843 0.02 B 122 LEU HG H 1 1.532 0.02 B 122 LEU C C 13 178.500 0.20 B 122 LEU CA C 13 56.420 0.20 B 122 LEU CB C 13 42.170 0.20 B 122 LEU CDy C 13 24.840 0.20 B 122 LEU CDx C 13 23.950 0.20 B 122 LEU CG C 13 26.920 0.20 B 122 LEU N N 15 120.300 0.20 B 123 GLU H H 1 8.080 0.02 B 123 GLU HA H 1 4.146 0.02 B 123 GLU HBy H 1 2.019 0.02 B 123 GLU HBx H 1 1.949 0.02 B 123 GLU HGx H 1 2.229 0.02 B 123 GLU HGy H 1 2.229 0.02 B 123 GLU C C 13 177.800 0.20 B 123 GLU CA C 13 57.030 0.20 B 123 GLU CB C 13 30.100 0.20 B 123 GLU CG C 13 36.360 0.20 B 123 GLU N N 15 120.700 0.20 B 124 ASP H H 1 8.246 0.02 B 124 ASP HA H 1 4.451 0.02 B 124 ASP HBy H 1 2.617 0.02 B 124 ASP HBx H 1 2.610 0.02 B 124 ASP C C 13 175.900 0.20 B 124 ASP CA C 13 55.970 0.20 B 124 ASP CB C 13 41.130 0.20 B 124 ASP N N 15 121.000 0.20 B 125 LYS H H 1 8.117 0.02 B 125 LYS HBy H 1 1.787 0.02 B 125 LYS HBx H 1 1.773 0.02 B 125 LYS HGx H 1 1.383 0.02 B 125 LYS HGy H 1 1.383 0.02 B 125 LYS C C 13 177.500 0.20 B 125 LYS CA C 13 56.590 0.20 B 125 LYS CB C 13 32.640 0.20 B 125 LYS CD C 13 28.760 0.20 B 125 LYS CG C 13 25.030 0.20 B 125 LYS N N 15 121.500 0.20 B 126 LEU H H 1 7.935 0.02 B 126 LEU HA H 1 4.202 0.02 B 126 LEU HBy H 1 1.610 0.02 B 126 LEU HBx H 1 1.586 0.02 B 126 LEU HDx% H 1 0.818 0.02 B 126 LEU HDy% H 1 0.818 0.02 B 126 LEU C C 13 177.700 0.20 B 126 LEU CA C 13 55.700 0.20 B 126 LEU CB C 13 42.050 0.20 B 126 LEU CDy C 13 24.710 0.20 B 126 LEU CDx C 13 23.350 0.20 B 126 LEU CG C 13 26.960 0.20 B 126 LEU N N 15 122.900 0.20 B 127 ALA H H 1 7.912 0.02 B 127 ALA HA H 1 4.180 0.02 B 127 ALA HB% H 1 1.312 0.02 B 127 ALA C C 13 177.600 0.20 B 127 ALA CA C 13 52.720 0.20 B 127 ALA CB C 13 19.230 0.20 B 127 ALA N N 15 123.800 0.20 B 128 ASP H H 1 8.140 0.02 B 128 ASP HA H 1 4.464 0.02 B 128 ASP HBy H 1 2.621 0.02 B 128 ASP HBx H 1 2.593 0.02 B 128 ASP C C 13 177.200 0.20 B 128 ASP CA C 13 55.320 0.20 B 128 ASP CB C 13 41.260 0.20 B 128 ASP N N 15 120.400 0.20 B 129 LYS H H 1 7.937 0.02 B 129 LYS HA H 1 4.217 0.02 B 129 LYS HBy H 1 1.809 0.02 B 129 LYS HBx H 1 1.736 0.02 B 129 LYS HGy H 1 1.336 0.02 B 129 LYS HGx H 1 1.271 0.02 B 129 LYS C C 13 177.500 0.20 B 129 LYS CA C 13 56.710 0.20 B 129 LYS CB C 13 32.890 0.20 B 129 LYS CD C 13 29.410 0.20 B 129 LYS CG C 13 24.650 0.20 B 129 LYS N N 15 121.300 0.20 B 130 GLN H H 1 8.395 0.02 B 130 GLN HA H 1 4.169 0.02 B 130 GLN HBy H 1 1.952 0.02 B 130 GLN HBx H 1 1.928 0.02 B 130 GLN HGx H 1 2.267 0.02 B 130 GLN HGy H 1 2.267 0.02 B 130 GLN C C 13 176.900 0.20 B 130 GLN CA C 13 56.980 0.20 B 130 GLN CB C 13 29.390 0.20 B 130 GLN CG C 13 33.850 0.20 B 130 GLN N N 15 122.500 0.20 B 131 GLU H H 1 8.389 0.02 B 131 GLU HA H 1 4.148 0.02 B 131 GLU HBy H 1 1.928 0.02 B 131 GLU HBx H 1 1.830 0.02 B 131 GLU HGx H 1 2.118 0.02 B 131 GLU HGy H 1 2.118 0.02 B 131 GLU C C 13 176.000 0.20 B 131 GLU CA C 13 56.610 0.20 B 131 GLU CB C 13 30.520 0.20 B 131 GLU CG C 13 36.370 0.20 B 131 GLU N N 15 122.500 0.20 B 132 HIS H H 1 8.467 0.02 B 132 HIS HA H 1 4.588 0.02 B 132 HIS HBy H 1 3.112 0.02 B 132 HIS HBx H 1 3.108 0.02 B 132 HIS C C 13 174.100 0.20 B 132 HIS CA C 13 55.500 0.20 B 132 HIS CB C 13 29.450 0.20 B 132 HIS N N 15 120.400 0.20 B 133 LEU H H 1 8.290 0.02 B 133 LEU HA H 1 4.314 0.02 B 133 LEU HBy H 1 1.515 0.02 B 133 LEU HBx H 1 1.471 0.02 B 133 LEU C C 13 176.000 0.20 B 133 LEU CA C 13 55.170 0.20 B 133 LEU CB C 13 42.360 0.20 B 133 LEU CDy C 13 24.650 0.20 B 133 LEU CDx C 13 23.460 0.20 B 133 LEU CG C 13 26.960 0.20 B 133 LEU N N 15 125.500 0.20 B 134 ASP H H 1 8.360 0.02 B 134 ASP HA H 1 4.392 0.02 B 134 ASP HBy H 1 2.643 0.02 B 134 ASP HBx H 1 2.598 0.02 B 134 ASP C C 13 176.600 0.20 B 134 ASP CA C 13 54.900 0.20 B 134 ASP CB C 13 41.460 0.20 B 134 ASP N N 15 121.900 0.20 B 135 GLY H H 1 8.291 0.02 B 135 GLY HAx H 1 3.823 0.02 B 135 GLY HAy H 1 3.823 0.02 B 135 GLY C C 13 174.300 0.20 B 135 GLY CA C 13 45.630 0.20 B 135 GLY N N 15 114.900 0.20 B 136 ALA H H 1 8.213 0.02 B 136 ALA HA H 1 4.238 0.02 B 136 ALA HB% H 1 1.297 0.02 B 136 ALA C C 13 177.600 0.20 B 136 ALA CA C 13 52.420 0.20 B 136 ALA CB C 13 19.570 0.20 B 136 ALA N N 15 123.800 0.20 B 137 LEU H H 1 8.235 0.02 B 137 LEU HA H 1 4.202 0.02 B 137 LEU HBy H 1 1.490 0.02 B 137 LEU HBx H 1 1.488 0.02 B 137 LEU HDx% H 1 0.787 0.02 B 137 LEU HDy% H 1 0.787 0.02 B 137 LEU C C 13 176.900 0.20 B 137 LEU CA C 13 55.150 0.20 B 137 LEU CB C 13 42.270 0.20 B 137 LEU CG C 13 27.030 0.20 B 137 LEU N N 15 122.400 0.20 B 138 ARG H H 1 8.022 0.02 B 138 ARG HA H 1 4.215 0.02 B 138 ARG HBy H 1 1.657 0.02 B 138 ARG HBx H 1 1.618 0.02 B 138 ARG HDx H 1 3.071 0.02 B 138 ARG HDy H 1 3.071 0.02 B 138 ARG HGx H 1 1.496 0.02 B 138 ARG HGy H 1 1.496 0.02 B 138 ARG C C 13 174.800 0.20 B 138 ARG CA C 13 55.700 0.20 B 138 ARG CB C 13 31.120 0.20 B 138 ARG CD C 13 43.270 0.20 B 138 ARG CG C 13 26.980 0.20 B 138 ARG N N 15 122.500 0.20 B 139 TYR H H 1 7.639 0.02 B 139 TYR HA H 1 4.284 0.02 B 139 TYR HBy H 1 3.004 0.02 B 139 TYR HBx H 1 2.762 0.02 B 139 TYR C C 13 180.400 0.20 B 139 TYR CA C 13 59.080 0.20 B 139 TYR CB C 13 39.600 0.20 B 139 TYR N N 15 126.700 0.20 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 B 88 GLN H B 87 ILE HA 1.0 2.0 5.0 2 2 B 87 ILE H B 87 ILE HB 1.0 1.8 3.5 3 3 B 88 GLN H B 87 ILE HB 1.0 2.5 4.5 4 4 B 87 ILE H B 87 ILE HG1y 1.0 2.5 4.5 5 4 B 87 ILE H B 87 ILE HG1x 1.0 2.5 4.5 6 5 B 87 ILE H B 87 ILE HG2% 1.0 2.5 4.5 7 6 B 88 GLN H B 88 GLN HBy 1.0 1.8 3.5 8 6 B 88 GLN H B 88 GLN HBx 1.0 1.8 3.5 9 7 B 89 GLU H B 89 GLU HA 1.0 2.0 3.0 10 8 B 89 GLU HA B 90 LYS H 1.0 3.0 4.0 11 9 B 90 LYS H B 90 LYS HBy 1.0 1.8 3.5 12 9 B 90 LYS H B 90 LYS HBx 1.0 1.8 3.5 13 10 B 93 GLU H B 93 GLU HA 1.0 2.0 3.0 14 11 B 93 GLU HA B 94 LEU H 1.0 1.8 5.0 15 12 B 93 GLU H B 93 GLU HBy 1.0 1.8 3.5 16 12 B 93 GLU H B 93 GLU HBx 1.0 1.8 3.5 17 13 B 94 LEU H B 94 LEU HBy 1.0 1.8 3.5 18 13 B 94 LEU H B 94 LEU HBx 1.0 1.8 3.5 19 14 B 96 ASN H B 95 LYS HBy 1.0 2.5 4.5 20 14 B 96 ASN H B 95 LYS HBx 1.0 2.5 4.5 21 15 B 96 ASN H B 96 ASN HA 1.0 2.0 3.0 22 16 B 97 LEU H B 96 ASN HBy 1.0 2.5 4.5 23 16 B 97 LEU H B 96 ASN HBx 1.0 2.5 4.5 24 17 B 97 LEU H B 97 LEU HBy 1.0 1.8 3.5 25 17 B 97 LEU H B 97 LEU HBx 1.0 1.8 3.5 26 18 B 100 ASN H B 99 ASP HA 1.0 3.0 4.0 27 19 B 100 ASN H B 100 ASN HBy 1.0 1.8 3.5 28 19 B 100 ASN H B 100 ASN HBx 1.0 1.8 3.5 29 20 B 101 VAL H B 101 VAL HA 1.0 2.0 3.0 30 21 B 102 GLU H B 102 GLU HBy 1.0 1.8 3.5 31 21 B 102 GLU H B 102 GLU HBx 1.0 1.8 3.5 32 22 B 103 LEU H B 103 LEU HA 1.0 2.0 3.0 33 23 B 108 ASN H B 107 LYS HA 1.0 2.0 5.0 34 24 B 109 GLU H B 108 ASN HA 1.0 3.0 4.0 35 25 B 109 GLU H B 108 ASN HBy 1.0 2.5 4.5 36 25 B 109 GLU H B 108 ASN HBx 1.0 2.5 4.5 37 26 B 109 GLU H B 109 GLU HA 1.0 2.0 3.0 38 27 B 109 GLU H B 109 GLU HBy 1.0 1.8 3.5 39 27 B 109 GLU H B 109 GLU HBx 1.0 1.8 3.5 40 28 B 110 ARG H B 110 ARG HA 1.0 2.0 3.0 41 29 B 110 ARG H B 110 ARG HBy 1.0 1.8 3.5 42 29 B 110 ARG H B 110 ARG HBx 1.0 1.8 3.5 43 30 B 111 HIS HA B 112 ASP H 1.0 3.0 4.0 44 31 B 112 ASP H B 111 HIS HBy 1.0 2.5 4.5 45 31 B 112 ASP H B 111 HIS HBx 1.0 2.5 4.5 46 32 B 112 ASP H B 112 ASP HBy 1.0 1.8 3.5 47 32 B 112 ASP HBx B 112 ASP H 1.0 1.8 3.5 48 33 B 113 HIS H B 112 ASP HBy 1.0 2.5 4.5 49 33 B 112 ASP HBx B 113 HIS H 1.0 2.5 4.5 50 34 B 114 ASP H B 113 HIS HBy 1.0 2.5 4.5 51 34 B 114 ASP H B 113 HIS HBx 1.0 2.5 4.5 52 35 B 114 ASP H B 114 ASP HA 1.0 2.0 3.0 53 36 B 114 ASP HA B 115 GLU H 1.0 2.0 5.0 54 37 B 114 ASP H B 114 ASP HBy 1.0 1.8 3.5 55 37 B 114 ASP H B 114 ASP HBx 1.0 1.8 3.5 56 38 B 115 GLU H B 114 ASP HBy 1.0 2.5 4.5 57 38 B 115 GLU H B 114 ASP HBx 1.0 2.5 4.5 58 39 B 115 GLU H B 115 GLU HBy 1.0 1.8 3.5 59 39 B 115 GLU H B 115 GLU HBx 1.0 1.8 3.5 60 40 B 116 GLU H B 115 GLU HBy 1.0 2.5 4.5 61 40 B 115 GLU HBx B 116 GLU H 1.0 2.5 4.5 62 41 B 116 GLU H B 116 GLU HA 1.0 2.0 3.0 63 42 B 116 GLU HA B 117 ALA H 1.0 3.0 4.0 64 43 B 117 ALA H B 116 GLU HBy 1.0 2.5 4.5 65 43 B 117 ALA H B 116 GLU HBx 1.0 2.5 4.5 66 44 B 117 ALA H B 117 ALA HB% 1.0 1.8 3.5 67 45 B 117 ALA HB% B 118 GLU H 1.0 2.5 4.5 68 46 B 118 GLU H B 118 GLU HA 1.0 2.0 3.0 69 47 B 118 GLU H B 118 GLU HBy 1.0 1.8 3.5 70 47 B 118 GLU H B 118 GLU HBx 1.0 1.8 3.5 71 48 B 119 ARG H B 118 GLU HBy 1.0 2.5 4.5 72 48 B 118 GLU HBx B 119 ARG H 1.0 2.5 4.5 73 49 B 120 LYS H B 119 ARG HDx 1.0 2.5 5.0 74 49 B 120 LYS H B 119 ARG HDy 1.0 2.5 5.0 75 50 B 119 ARG H B 119 ARG HGy 1.0 2.5 4.5 76 50 B 119 ARG H B 119 ARG HGx 1.0 2.5 4.5 77 51 B 120 LYS H B 120 LYS HA 1.0 2.0 3.0 78 52 B 120 LYS HA B 121 ALA H 1.0 3.0 4.0 79 53 B 120 LYS H B 120 LYS HBy 1.0 1.8 3.5 80 53 B 120 LYS H B 120 LYS HBx 1.0 1.8 3.5 81 54 B 121 ALA H B 121 ALA HB% 1.0 1.8 3.5 82 55 B 122 LEU H B 122 LEU HA 1.0 2.0 3.0 83 56 B 123 GLU H B 122 LEU HDx% 1.0 2.5 5.0 84 57 B 122 LEU H B 122 LEU HG 1.0 2.5 4.5 85 58 B 123 GLU H B 123 GLU HBy 1.0 1.8 3.5 86 58 B 123 GLU H B 123 GLU HBx 1.0 1.8 3.5 87 59 B 124 ASP H B 123 GLU HBy 1.0 2.5 4.5 88 59 B 123 GLU HBx B 124 ASP H 1.0 2.5 4.5 89 60 B 124 ASP H B 124 ASP HBy 1.0 1.8 3.5 90 60 B 124 ASP H B 124 ASP HBx 1.0 1.8 3.5 91 61 B 127 ALA H B 127 ALA HA 1.0 2.0 3.0 92 62 B 127 ALA H B 127 ALA HB% 1.0 1.8 3.5 93 63 B 129 LYS H B 128 ASP HBy 1.0 2.5 4.5 94 63 B 129 LYS H B 128 ASP HBx 1.0 2.5 4.5 95 64 B 130 GLN H B 129 LYS HA 1.0 2.0 5.0 96 65 B 129 LYS H B 129 LYS HBy 1.0 1.8 3.5 97 65 B 129 LYS H B 129 LYS HBx 1.0 1.8 3.5 98 66 B 130 GLN H B 129 LYS HBy 1.0 2.5 4.5 99 66 B 130 GLN H B 129 LYS HBx 1.0 2.5 4.5 100 67 B 130 GLN H B 129 LYS HGy 1.0 2.5 5.0 101 67 B 130 GLN H B 129 LYS HGx 1.0 2.5 5.0 102 68 B 131 GLU H B 131 GLU HBy 1.0 1.8 3.5 103 68 B 131 GLU H B 131 GLU HBx 1.0 1.8 3.5 104 69 B 132 HIS H B 132 HIS HA 1.0 2.0 3.0 105 70 B 132 HIS HA B 133 LEU H 1.0 1.8 5.0 106 71 B 134 ASP H B 133 LEU HBy 1.0 2.5 4.5 107 71 B 134 ASP H B 133 LEU HBx 1.0 2.5 4.5 108 72 B 137 LEU H B 137 LEU HA 1.0 2.0 3.0 109 73 B 139 TYR H B 138 ARG HA 1.0 3.0 4.0 110 74 B 86 THR H B 85 LYS HBy 1.0 2.5 4.5 111 74 B 86 THR H B 85 LYS HBx 1.0 2.5 4.5 112 75 B 86 THR H B 86 THR HA 1.0 2.0 3.0 113 76 B 86 THR H B 86 THR HG2% 1.0 2.5 4.5 114 77 B 89 GLU H B 89 GLU HBy 1.0 1.8 3.5 115 77 B 89 GLU H B 89 GLU HBx 1.0 1.8 3.5 116 78 B 98 LYS H B 97 LEU HG 1.0 2.5 5.0 117 79 B 99 ASP H B 98 LYS HBy 1.0 2.5 4.5 118 79 B 99 ASP H B 98 LYS HBx 1.0 2.5 4.5 119 80 B 99 ASP HA B 99 ASP H 1.0 2.0 3.0 120 81 B 99 ASP H B 99 ASP HBy 1.0 1.8 3.5 121 81 B 99 ASP H B 99 ASP HBx 1.0 1.8 3.5 122 82 B 104 GLU H B 104 GLU HBy 1.0 1.8 3.5 123 82 B 104 GLU H B 104 GLU HBx 1.0 1.8 3.5 124 83 B 105 ARG H B 105 ARG HBy 1.0 1.8 3.5 125 83 B 105 ARG H B 105 ARG HBx 1.0 1.8 3.5 126 84 B 105 ARG H B 105 ARG HDx 1.0 2.5 5.0 127 84 B 105 ARG H B 105 ARG HDy 1.0 2.5 5.0 128 85 B 105 ARG H B 105 ARG HGx 1.0 2.5 4.5 129 85 B 105 ARG H B 105 ARG HGy 1.0 2.5 4.5 130 86 B 111 HIS H B 110 ARG HGx 1.0 2.5 5.0 131 86 B 111 HIS H B 110 ARG HGy 1.0 2.5 5.0 132 87 B 111 HIS H B 111 HIS HBy 1.0 1.8 3.5 133 87 B 111 HIS HBx B 111 HIS H 1.0 1.8 3.5 134 88 B 111 HIS H B 112 ASP HBy 1.0 2.5 4.5 135 88 B 112 ASP HBx B 111 HIS H 1.0 2.5 4.5 136 89 B 125 LYS H B 124 ASP HBy 1.0 2.5 4.5 137 89 B 124 ASP HBx B 125 LYS H 1.0 2.5 4.5 138 90 B 127 ALA H B 126 LEU HDx% 1.0 2.5 5.0 139 91 B 133 LEU H B 133 LEU HBy 1.0 1.8 3.5 140 91 B 133 LEU H B 133 LEU HBx 1.0 1.8 3.5 141 92 B 135 GLY H B 134 ASP HBy 1.0 2.5 4.5 142 92 B 135 GLY H B 134 ASP HBx 1.0 2.5 4.5 143 93 B 135 GLY H B 135 GLY HAx 1.0 2.0 3.0 144 93 B 135 GLY H B 135 GLY HAy 1.0 2.0 3.0 145 94 B 139 TYR H B 138 ARG HGx 1.0 2.5 5.0 146 94 B 139 TYR H B 138 ARG HGy 1.0 2.5 5.0 147 95 B 139 TYR H B 139 TYR HBy 1.0 1.8 3.5 148 95 B 139 TYR H B 139 TYR HBx 1.0 1.8 3.5 149 96 B 85 LYS H B -1 SER HA 1.0 3.0 4.0 150 97 B 86 THR H B 85 LYS HA 1.0 2.0 5.0 151 98 B 86 THR H B 85 LYS HDx 1.0 2.5 5.0 152 98 B 86 THR H B 85 LYS HDy 1.0 2.5 5.0 153 99 B 86 THR H B 85 LYS HGx 1.0 2.5 5.0 154 99 B 86 THR H B 85 LYS HGy 1.0 2.5 5.0 155 100 B 87 ILE H B 86 THR HB 1.0 2.5 4.5 156 101 B 87 ILE H B 86 THR HG2% 1.0 2.5 5.0 157 102 B 87 ILE HA B 87 ILE H 1.0 2.0 3.0 158 103 B 88 GLN H B 87 ILE HG1y 1.0 2.5 5.0 159 103 B 88 GLN H B 87 ILE HG1x 1.0 2.5 5.0 160 104 B 88 GLN H B 87 ILE HG2% 1.0 2.5 5.0 161 105 B 88 GLN H B 88 GLN HA 1.0 2.0 3.0 162 106 B 88 GLN H B 88 GLN HGx 1.0 2.5 4.5 163 106 B 88 GLN H B 88 GLN HGy 1.0 2.5 4.5 164 107 B 90 LYS H B 89 GLU HBy 1.0 2.5 4.5 165 107 B 90 LYS H B 89 GLU HBx 1.0 2.5 4.5 166 108 B 89 GLU H B 89 GLU HGx 1.0 2.5 4.5 167 108 B 89 GLU H B 89 GLU HGy 1.0 2.5 4.5 168 109 B 90 LYS H B 89 GLU HGx 1.0 2.5 5.0 169 109 B 90 LYS H B 89 GLU HGy 1.0 2.5 5.0 170 110 B 90 LYS H B 90 LYS HA 1.0 2.0 3.0 171 111 B 91 GLU H B 91 GLU HA 1.0 2.0 3.0 172 112 B 91 GLU H B 91 GLU HBx 1.0 1.8 3.5 173 112 B 91 GLU H B 91 GLU HBy 1.0 1.8 3.5 174 113 B 93 GLU H B 92 GLN HA 1.0 3.0 4.0 175 114 B 93 GLU H B 93 GLU HGx 1.0 2.5 4.5 176 114 B 93 GLU H B 93 GLU HGy 1.0 2.5 4.5 177 115 B 94 LEU H B 93 GLU HBy 1.0 2.5 4.5 178 115 B 94 LEU H B 93 GLU HBx 1.0 2.5 4.5 179 116 B 95 LYS H B 94 LEU HBy 1.0 2.5 4.5 180 116 B 94 LEU HBx B 95 LYS H 1.0 2.5 4.5 181 117 B 94 LEU H B 94 LEU HG 1.0 2.5 4.5 182 118 B 95 LYS H B 94 LEU HG 1.0 2.5 5.0 183 119 B 96 ASN H B 95 LYS HGx 1.0 2.5 5.0 184 119 B 96 ASN H B 95 LYS HGy 1.0 2.5 5.0 185 120 B 95 LYS H B 95 LYS HA 1.0 2.0 3.0 186 121 B 98 LYS H B 97 LEU HA 1.0 3.0 4.0 187 122 B 99 ASP H B 98 LYS HA 1.0 3.0 4.0 188 123 B 99 ASP H B 98 LYS HDx 1.0 2.5 5.0 189 123 B 99 ASP H B 98 LYS HDy 1.0 2.5 5.0 190 124 B 99 ASP H B 98 LYS HGx 1.0 2.5 5.0 191 124 B 99 ASP H B 98 LYS HGy 1.0 2.5 5.0 192 125 B 100 ASN H B 99 ASP HBy 1.0 2.5 4.5 193 125 B 100 ASN H B 99 ASP HBx 1.0 2.5 4.5 194 126 B 101 VAL H B 100 ASN HA 1.0 3.0 4.0 195 127 B 103 LEU H B 100 ASN HA 1.0 2.9 3.9 196 128 B 101 VAL H B 101 VAL HB 1.0 1.8 3.5 197 129 B 102 GLU H B 101 VAL HB 1.0 2.5 4.5 198 130 B 103 LEU H B 102 GLU HBy 1.0 2.5 4.5 199 130 B 102 GLU HBx B 103 LEU H 1.0 2.5 4.5 200 131 B 103 LEU H B 102 GLU HGx 1.0 2.5 5.0 201 131 B 103 LEU H B 102 GLU HGy 1.0 2.5 5.0 202 132 B 103 LEU HA B 104 GLU H 1.0 3.0 4.0 203 133 B 103 LEU H B 103 LEU HBy 1.0 1.8 3.5 204 133 B 103 LEU H B 103 LEU HBx 1.0 1.8 3.5 205 134 B 103 LEU H B 103 LEU HDx% 1.0 2.5 5.0 206 135 B 103 LEU H B 103 LEU HDy% 1.0 2.5 5.0 207 136 B 103 LEU H B 103 LEU HG 1.0 2.5 4.5 208 137 B 105 ARG H B 104 GLU HA 1.0 2.0 5.0 209 138 B 104 GLU H B 104 GLU HGx 1.0 2.5 4.5 210 138 B 104 GLU H B 104 GLU HGy 1.0 2.5 4.5 211 139 B 105 ARG H B 104 GLU HGx 1.0 2.5 5.0 212 139 B 105 ARG H B 104 GLU HGy 1.0 2.5 5.0 213 140 B 106 LEU H B 105 ARG HA 1.0 3.0 4.0 214 141 B 106 LEU H B 105 ARG HGx 1.0 2.5 5.0 215 141 B 105 ARG HGy B 106 LEU H 1.0 2.5 5.0 216 142 B 106 LEU H B 106 LEU HBx 1.0 1.8 3.5 217 142 B 106 LEU H B 106 LEU HBy 1.0 1.8 3.5 218 143 B 106 LEU H B 106 LEU HD11 1.0 2.5 5.0 219 144 B 106 LEU H B 106 LEU HD21 1.0 2.5 5.0 220 145 B 107 LYS H B 106 LEU HBx 1.0 2.5 4.5 221 145 B 106 LEU HBy B 107 LYS H 1.0 2.5 4.5 222 146 B 107 LYS H B 107 LYS HBx 1.0 1.8 3.5 223 146 B 107 LYS H B 107 LYS HBy 1.0 1.8 3.5 224 147 B 107 LYS H B 107 LYS HDx 1.0 2.5 5.0 225 147 B 107 LYS H B 107 LYS HDy 1.0 2.5 5.0 226 148 B 107 LYS H B 107 LYS HGx 1.0 2.5 4.5 227 148 B 107 LYS H B 107 LYS HGy 1.0 2.5 4.5 228 149 B 108 ASN H B 107 LYS HBx 1.0 2.5 4.5 229 149 B 108 ASN H B 107 LYS HBy 1.0 2.5 4.5 230 150 B 108 ASN H B 108 ASN HBy 1.0 1.8 3.5 231 150 B 108 ASN H B 108 ASN HBx 1.0 1.8 3.5 232 151 B 109 GLU HA B 110 ARG H 1.0 3.0 4.0 233 152 B 110 ARG H B 109 GLU HBy 1.0 2.5 4.5 234 152 B 109 GLU HBx B 110 ARG H 1.0 2.5 4.5 235 153 B 109 GLU H B 109 GLU HGx 1.0 2.5 4.5 236 153 B 109 GLU H B 109 GLU HGy 1.0 2.5 4.5 237 154 B 110 ARG H B 109 GLU HGx 1.0 2.5 5.0 238 154 B 110 ARG H B 109 GLU HGy 1.0 2.5 5.0 239 155 B 110 ARG HA B 111 HIS H 1.0 3.0 4.0 240 156 B 111 HIS HA B 111 HIS H 1.0 2.0 3.0 241 157 B 112 ASP HA B 113 HIS H 1.0 2.0 5.0 242 158 B 113 HIS H B 113 HIS HBy 1.0 1.8 3.5 243 158 B 113 HIS H B 113 HIS HBx 1.0 1.8 3.5 244 159 B 115 GLU H B 115 GLU HA 1.0 2.0 3.0 245 160 B 117 ALA H B 115 GLU HA 1.0 2.4 5.0 246 161 B 115 GLU H B 115 GLU HGx 1.0 2.5 4.5 247 161 B 115 GLU H B 115 GLU HGy 1.0 2.5 4.5 248 162 B 116 GLU H B 116 GLU HGx 1.0 2.5 4.5 249 162 B 116 GLU H B 116 GLU HGy 1.0 2.5 4.5 250 163 B 117 ALA H B 116 GLU HGx 1.0 2.5 5.0 251 163 B 117 ALA H B 116 GLU HGy 1.0 2.5 5.0 252 164 B 117 ALA H B 117 ALA HA 1.0 2.0 3.0 253 165 B 120 LYS H B 117 ALA HA 1.0 2.9 3.9 254 166 B 118 GLU HA B 119 ARG H 1.0 3.0 4.0 255 167 B 118 GLU H B 118 GLU HGx 1.0 2.5 4.5 256 167 B 118 GLU H B 118 GLU HGy 1.0 2.5 4.5 257 168 B 119 ARG H B 118 GLU HGx 1.0 2.5 5.0 258 168 B 119 ARG H B 118 GLU HGy 1.0 2.5 5.0 259 169 B 120 LYS H B 119 ARG HBx 1.0 2.5 4.5 260 169 B 120 LYS H B 119 ARG HBy 1.0 2.5 4.5 261 170 B 121 ALA H B 120 LYS HBy 1.0 2.5 4.5 262 170 B 121 ALA H B 120 LYS HBx 1.0 2.5 4.5 263 171 B 120 LYS H B 120 LYS HGx 1.0 2.5 4.5 264 171 B 120 LYS H B 120 LYS HGy 1.0 2.5 4.5 265 172 B 121 ALA H B 120 LYS HGx 1.0 2.5 5.0 266 172 B 121 ALA H B 120 LYS HGy 1.0 2.5 5.0 267 173 B 121 ALA H B 121 ALA HA 1.0 2.0 3.0 268 174 B 122 LEU H B 121 ALA HA 1.0 3.0 4.0 269 175 B 122 LEU HA B 123 GLU H 1.0 1.8 5.0 270 176 B 122 LEU H B 122 LEU HBx 1.0 1.8 3.5 271 176 B 122 LEU H B 122 LEU HBy 1.0 1.8 3.5 272 177 B 123 GLU H B 122 LEU HBx 1.0 2.5 4.5 273 177 B 123 GLU H B 122 LEU HBy 1.0 2.5 4.5 274 178 B 122 LEU H B 122 LEU HDx% 1.0 2.5 5.0 275 179 B 124 ASP H B 123 GLU HA 1.0 3.0 4.0 276 180 B 123 GLU H B 123 GLU HGx 1.0 2.5 4.5 277 180 B 123 GLU H B 123 GLU HGy 1.0 2.5 4.5 278 181 B 124 ASP H B 123 GLU HGx 1.0 2.5 5.0 279 181 B 124 ASP H B 123 GLU HGy 1.0 2.5 5.0 280 182 B 125 LYS H B 125 LYS HBy 1.0 1.8 3.5 281 182 B 125 LYS H B 125 LYS HBx 1.0 1.8 3.5 282 183 B 127 ALA H B 126 LEU HG 1.0 2.5 5.0 283 184 B 126 LEU H B 126 LEU HA 1.0 2.0 3.0 284 185 B 127 ALA H B 126 LEU HA 1.0 2.0 5.0 285 186 B 126 LEU H B 126 LEU HBy 1.0 1.8 3.5 286 186 B 126 LEU H B 126 LEU HBx 1.0 1.8 3.5 287 187 B 127 ALA H B 126 LEU HBy 1.0 2.5 4.5 288 187 B 127 ALA H B 126 LEU HBx 1.0 2.5 4.5 289 188 B 127 ALA H B 126 LEU HDy% 1.0 2.5 5.0 290 189 B 128 ASP H B 128 ASP HA 1.0 2.0 3.0 291 190 B 129 LYS H B 128 ASP HA 1.0 1.8 5.0 292 191 B 128 ASP H B 128 ASP HBy 1.0 1.8 3.5 293 191 B 128 ASP HBx B 128 ASP H 1.0 1.8 3.5 294 192 B 129 LYS H B 129 LYS HDx 1.0 2.5 5.0 295 192 B 129 LYS H B 129 LYS HDy 1.0 2.5 5.0 296 193 B 130 GLN H B 129 LYS HDx 1.0 2.5 5.0 297 193 B 130 GLN H B 129 LYS HDy 1.0 2.5 5.0 298 194 B 129 LYS H B 129 LYS HGy 1.0 2.5 4.5 299 194 B 129 LYS H B 129 LYS HGx 1.0 2.5 4.5 300 195 B 131 GLU H B 131 GLU HA 1.0 2.0 3.0 301 196 B 132 HIS H B 131 GLU HA 1.0 2.0 5.0 302 197 B 132 HIS H B 131 GLU HGx 1.0 2.5 5.0 303 197 B 132 HIS H B 131 GLU HGy 1.0 2.5 5.0 304 198 B 132 HIS H B 132 HIS HBy 1.0 1.8 3.5 305 198 B 132 HIS H B 132 HIS HBx 1.0 1.8 3.5 306 199 B 136 ALA H B 135 GLY HAx 1.0 3.0 4.0 307 199 B 135 GLY HAy B 136 ALA H 1.0 3.0 4.0 308 200 B 136 ALA H B 136 ALA HA 1.0 2.0 3.0 309 201 B 136 ALA H B 136 ALA HB% 1.0 1.8 3.5 310 202 B 137 LEU HA B 138 ARG H 1.0 3.0 4.0 311 203 B 137 LEU H B 137 LEU HBy 1.0 1.8 3.5 312 203 B 137 LEU H B 137 LEU HBx 1.0 1.8 3.5 313 204 B 139 TYR H B 138 ARG HBy 1.0 2.5 4.5 314 204 B 139 TYR H B 138 ARG HBx 1.0 2.5 4.5 315 205 B 139 TYR H B 139 TYR HA 1.0 2.0 3.0 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 save_ save_CNS/XPLOR_dipolar_coupling_3 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_3 _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 105 ARG H B 105 ARG N 1.0 . . . 2 2 B 109 GLU H B 109 GLU N 1.0 . . . 3 3 B 110 ARG H B 110 ARG N 1.0 . . . 4 4 B 115 GLU H B 115 GLU N 1.0 . . . 5 5 B 117 ALA H B 117 ALA N 1.0 . . . 6 6 B 120 LYS N B 120 LYS 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_