data_nef_c17958_2ljt save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17955 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 LYS start . . 2 A 2 TYR middle . . 3 A 3 TYR middle . . 4 A 4 GLY middle . false 5 A 5 ASN middle . . 6 A 6 GLY middle . false 7 A 7 VAL middle . . 8 A 8 HIS middle . . 9 A 9 LEU middle . . 10 A 10 THR middle . . 11 A 11 LYS middle . . 12 A 12 SER middle . . 13 A 13 GLY middle . false 14 A 14 LEU middle . . 15 A 15 SER middle . . 16 A 16 VAL middle . . 17 A 17 ASN middle . . 18 A 18 TRP middle . . 19 A 19 GLY middle . false 20 A 20 GLU middle . . 21 A 21 ALA middle . . 22 A 22 PHE middle . . 23 A 23 SER middle . . 24 A 24 ALA middle . . 25 A 25 GLY middle . false 26 A 26 VAL middle . . 27 A 27 HIS middle . . 28 A 28 ARG middle . . 29 A 29 LEU middle . . 30 A 30 ALA middle . . 31 A 31 ASN middle . . 32 A 32 GLY middle . false 33 A 33 GLY middle . false 34 A 34 ASN middle . . 35 A 35 GLY middle . false 36 A 36 PHE middle . . 37 A 37 TRP end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 LYS HA H 1 3.9470 0.02 A 1 LYS HB2 H 1 1.8320 0.02 A 1 LYS HB3 H 1 1.8280 0.02 A 1 LYS HD2 H 1 1.7170 0.02 A 1 LYS HD3 H 1 1.7160 0.02 A 1 LYS HE2 H 1 2.9970 0.02 A 1 LYS HE3 H 1 2.9980 0.02 A 1 LYS HG2 H 1 1.3750 0.02 A 1 LYS HG3 H 1 1.3490 0.02 A 1 LYS C C 13 171.3010 0.2 A 1 LYS CA C 13 56.1390 0.2 A 1 LYS CB C 13 32.9800 0.2 A 1 LYS CD C 13 28.7450 0.2 A 1 LYS CG C 13 23.7610 0.2 A 2 TYR H H 1 8.2020 0.02 A 2 TYR HA H 1 4.5850 0.02 A 2 TYR HB2 H 1 3.0510 0.02 A 2 TYR HB3 H 1 2.9350 0.02 A 2 TYR C C 13 174.9720 0.2 A 2 TYR CA C 13 58.1190 0.2 A 2 TYR CB C 13 38.9650 0.2 A 2 TYR N N 15 121.3770 0.2 A 3 TYR H H 1 7.6800 0.02 A 3 TYR HA H 1 4.5220 0.02 A 3 TYR HB2 H 1 3.0940 0.02 A 3 TYR HB3 H 1 2.8720 0.02 A 3 TYR C C 13 175.8320 0.2 A 3 TYR CA C 13 58.1050 0.2 A 3 TYR CB C 13 38.6830 0.2 A 3 TYR N N 15 122.1590 0.2 A 4 GLY H H 1 6.9400 0.02 A 4 GLY HA2 H 1 3.9200 0.02 A 4 GLY HA3 H 1 3.7670 0.02 A 4 GLY C C 13 173.9590 0.2 A 4 GLY CA C 13 45.7330 0.2 A 4 GLY N N 15 106.4930 0.2 A 5 ASN H H 1 7.9730 0.02 A 5 ASN HA H 1 4.7240 0.02 A 5 ASN HB2 H 1 2.9110 0.02 A 5 ASN HB3 H 1 2.9050 0.02 A 5 ASN C C 13 176.3120 0.2 A 5 ASN CA C 13 54.2930 0.2 A 5 ASN CB C 13 38.3490 0.2 A 5 ASN N N 15 117.0750 0.2 A 6 GLY H H 1 8.2790 0.02 A 6 GLY HA2 H 1 3.9950 0.02 A 6 GLY HA3 H 1 3.9410 0.02 A 6 GLY C C 13 175.5280 0.2 A 6 GLY CA C 13 46.5230 0.2 A 6 GLY N N 15 107.2790 0.2 A 7 VAL H H 1 7.8350 0.02 A 7 VAL HA H 1 3.8420 0.02 A 7 VAL HB H 1 2.1580 0.02 A 7 VAL HG1% H 1 1.0210 0.02 A 7 VAL HG2% H 1 0.9440 0.02 A 7 VAL C C 13 177.0590 0.2 A 7 VAL CA C 13 65.5940 0.2 A 7 VAL CB C 13 32.0230 0.2 A 7 VAL CG1 C 13 20.9530 0.2 A 7 VAL CG2 C 13 20.2610 0.2 A 7 VAL N N 15 121.5660 0.2 A 8 HIS H H 1 8.0930 0.02 A 8 HIS HA H 1 4.5260 0.02 A 8 HIS HB2 H 1 3.3720 0.02 A 8 HIS HB3 H 1 3.3650 0.02 A 8 HIS C C 13 176.4790 0.2 A 8 HIS CA C 13 57.9520 0.2 A 8 HIS CB C 13 28.3510 0.2 A 8 HIS N N 15 117.8060 0.2 A 9 LEU H H 1 8.2550 0.02 A 9 LEU HA H 1 4.2340 0.02 A 9 LEU HB2 H 1 1.8350 0.02 A 9 LEU HB3 H 1 1.7150 0.02 A 9 LEU HD1% H 1 0.9560 0.02 A 9 LEU HD2% H 1 0.9330 0.02 A 9 LEU HG H 1 1.7300 0.02 A 9 LEU C C 13 178.4490 0.2 A 9 LEU CA C 13 57.7810 0.2 A 9 LEU CB C 13 42.2540 0.2 A 9 LEU CD1 C 13 24.1060 0.2 A 9 LEU CD2 C 13 22.6810 0.2 A 9 LEU CG C 13 27.0660 0.2 A 9 LEU N N 15 120.8560 0.2 A 10 THR H H 1 8.0080 0.02 A 10 THR HA H 1 4.1940 0.02 A 10 THR HB H 1 4.3820 0.02 A 10 THR HG2% H 1 1.3160 0.02 A 10 THR C C 13 175.6710 0.2 A 10 THR CA C 13 65.1570 0.2 A 10 THR CB C 13 69.8500 0.2 A 10 THR CG2 C 13 20.5350 0.2 A 10 THR N N 15 113.9480 0.2 A 11 LYS H H 1 8.3120 0.02 A 11 LYS HA H 1 4.1820 0.02 A 11 LYS HB2 H 1 1.9570 0.02 A 11 LYS HB3 H 1 1.9500 0.02 A 11 LYS HD2 H 1 1.7180 0.02 A 11 LYS HD3 H 1 1.7130 0.02 A 11 LYS HE2 H 1 2.9880 0.02 A 11 LYS HE3 H 1 2.9850 0.02 A 11 LYS HG2 H 1 1.6390 0.02 A 11 LYS HG3 H 1 1.4860 0.02 A 11 LYS C C 13 178.4480 0.2 A 11 LYS CA C 13 59.1040 0.2 A 11 LYS CB C 13 32.1650 0.2 A 11 LYS CD C 13 28.8750 0.2 A 11 LYS CE C 13 42.1900 0.2 A 11 LYS CG C 13 25.1820 0.2 A 11 LYS N N 15 120.2150 0.2 A 12 SER H H 1 8.0680 0.02 A 12 SER HA H 1 4.3180 0.02 A 12 SER HB2 H 1 4.0790 0.02 A 12 SER HB3 H 1 3.9590 0.02 A 12 SER C C 13 175.6350 0.2 A 12 SER CA C 13 61.1560 0.2 A 12 SER CB C 13 63.0740 0.2 A 12 SER N N 15 114.5970 0.2 A 13 GLY H H 1 8.2160 0.02 A 13 GLY HA2 H 1 3.9510 0.02 A 13 GLY C C 13 175.7760 0.2 A 13 GLY CA C 13 46.5710 0.2 A 13 GLY N N 15 109.5630 0.2 A 14 LEU H H 1 8.1730 0.02 A 14 LEU HA H 1 4.3120 0.02 A 14 LEU HB2 H 1 1.8560 0.02 A 14 LEU HB3 H 1 1.6020 0.02 A 14 LEU HD1% H 1 0.9610 0.02 A 14 LEU HD2% H 1 0.9440 0.02 A 14 LEU HG H 1 1.8180 0.02 A 14 LEU C C 13 178.6240 0.2 A 14 LEU CA C 13 57.4840 0.2 A 14 LEU CB C 13 42.0610 0.2 A 14 LEU CD1 C 13 24.2800 0.2 A 14 LEU CD2 C 13 24.2800 0.2 A 14 LEU CG C 13 26.9090 0.2 A 14 LEU N N 15 121.3460 0.2 A 15 SER H H 1 7.9450 0.02 A 15 SER HA H 1 4.3850 0.02 A 15 SER HB2 H 1 4.1620 0.02 A 15 SER HB3 H 1 4.0140 0.02 A 15 SER C C 13 175.9640 0.2 A 15 SER CA C 13 61.2010 0.2 A 15 SER CB C 13 63.3970 0.2 A 15 SER N N 15 113.7950 0.2 A 16 VAL H H 1 7.9130 0.02 A 16 VAL HA H 1 3.9920 0.02 A 16 VAL HB H 1 2.1670 0.02 A 16 VAL HG1% H 1 1.0780 0.02 A 16 VAL HG2% H 1 0.9450 0.02 A 16 VAL C C 13 177.1760 0.2 A 16 VAL CA C 13 65.4190 0.2 A 16 VAL CB C 13 32.0140 0.2 A 16 VAL CG1 C 13 21.1330 0.2 A 16 VAL CG2 C 13 20.2630 0.2 A 16 VAL N N 15 121.9650 0.2 A 17 ASN H H 1 8.0010 0.02 A 17 ASN HA H 1 4.6320 0.02 A 17 ASN HB2 H 1 2.9430 0.02 A 17 ASN HB3 H 1 2.8890 0.02 A 17 ASN C C 13 176.9300 0.2 A 17 ASN CA C 13 55.8560 0.2 A 17 ASN CB C 13 38.6350 0.2 A 17 ASN N N 15 118.7540 0.2 A 18 TRP H H 1 8.4080 0.02 A 18 TRP HA H 1 4.4750 0.02 A 18 TRP HB2 H 1 3.4430 0.02 A 18 TRP C C 13 177.7780 0.2 A 18 TRP CA C 13 60.6370 0.2 A 18 TRP CB C 13 28.8400 0.2 A 18 TRP N N 15 120.8110 0.2 A 19 GLY H H 1 8.3950 0.02 A 19 GLY HA2 H 1 3.9710 0.02 A 19 GLY HA3 H 1 3.8400 0.02 A 19 GLY C C 13 177.0370 0.2 A 19 GLY CA C 13 47.2130 0.2 A 19 GLY N N 15 105.5980 0.2 A 20 GLU H H 1 8.3450 0.02 A 20 GLU HA H 1 4.1530 0.02 A 20 GLU HB2 H 1 2.3500 0.02 A 20 GLU HB3 H 1 2.1940 0.02 A 20 GLU HG2 H 1 2.6980 0.02 A 20 GLU HG3 H 1 2.5300 0.02 A 20 GLU C C 13 177.7920 0.2 A 20 GLU CA C 13 59.0980 0.2 A 20 GLU CB C 13 27.9260 0.2 A 20 GLU CG C 13 32.6580 0.2 A 20 GLU N N 15 121.6560 0.2 A 21 ALA H H 1 8.0650 0.02 A 21 ALA HA H 1 4.1060 0.02 A 21 ALA HB% H 1 1.5170 0.02 A 21 ALA C C 13 180.5520 0.2 A 21 ALA CA C 13 55.3300 0.2 A 21 ALA CB C 13 17.4530 0.2 A 21 ALA N N 15 122.6880 0.2 A 22 PHE H H 1 8.8560 0.02 A 22 PHE HA H 1 4.1660 0.02 A 22 PHE HB2 H 1 2.9050 0.02 A 22 PHE HB3 H 1 2.6830 0.02 A 22 PHE C C 13 177.8770 0.2 A 22 PHE CA C 13 61.1030 0.2 A 22 PHE CB C 13 38.9860 0.2 A 22 PHE N N 15 119.8650 0.2 A 23 SER H H 1 8.2380 0.02 A 23 SER HA H 1 4.1120 0.02 A 23 SER HB2 H 1 4.1470 0.02 A 23 SER HB3 H 1 4.0520 0.02 A 23 SER C C 13 177.3010 0.2 A 23 SER CA C 13 61.5550 0.2 A 23 SER CB C 13 63.0240 0.2 A 23 SER N N 15 113.3330 0.2 A 24 ALA H H 1 8.4370 0.02 A 24 ALA HA H 1 4.1570 0.02 A 24 ALA HB% H 1 1.5530 0.02 A 24 ALA C C 13 180.1360 0.2 A 24 ALA CA C 13 55.5710 0.2 A 24 ALA CB C 13 17.4200 0.2 A 24 ALA N N 15 125.8340 0.2 A 25 GLY H H 1 8.0380 0.02 A 25 GLY HA2 H 1 3.9170 0.02 A 25 GLY HA3 H 1 3.8000 0.02 A 25 GLY C C 13 175.9660 0.2 A 25 GLY CA C 13 47.1040 0.2 A 25 GLY N N 15 106.1830 0.2 A 26 VAL H H 1 8.0930 0.02 A 26 VAL HA H 1 3.6480 0.02 A 26 VAL HB H 1 1.9360 0.02 A 26 VAL HG1% H 1 0.7810 0.02 A 26 VAL HG2% H 1 0.7180 0.02 A 26 VAL C C 13 178.0380 0.2 A 26 VAL CA C 13 66.5690 0.2 A 26 VAL CB C 13 31.5560 0.2 A 26 VAL CG1 C 13 20.2550 0.2 A 26 VAL CG2 C 13 21.7470 0.2 A 26 VAL N N 15 120.8360 0.2 A 27 HIS H H 1 8.0050 0.02 A 27 HIS HA H 1 4.2220 0.02 A 27 HIS HB2 H 1 3.2960 0.02 A 27 HIS HB3 H 1 3.3020 0.02 A 27 HIS C C 13 176.4460 0.2 A 27 HIS CA C 13 59.7030 0.2 A 27 HIS CB C 13 27.4950 0.2 A 27 HIS N N 15 115.1160 0.2 A 28 ARG H H 1 8.0900 0.02 A 28 ARG HA H 1 4.1450 0.02 A 28 ARG HB2 H 1 2.2930 0.02 A 28 ARG HB3 H 1 2.0320 0.02 A 28 ARG HD2 H 1 3.1940 0.02 A 28 ARG HD3 H 1 3.2010 0.02 A 28 ARG HG2 H 1 1.7990 0.02 A 28 ARG HG3 H 1 1.6620 0.02 A 28 ARG C C 13 178.3900 0.2 A 28 ARG CA C 13 59.2110 0.2 A 28 ARG CB C 13 29.5030 0.2 A 28 ARG CD C 13 43.1500 0.2 A 28 ARG CG C 13 27.3960 0.2 A 28 ARG N N 15 119.0210 0.2 A 29 LEU H H 1 8.0570 0.02 A 29 LEU HA H 1 4.1570 0.02 A 29 LEU HB2 H 1 1.8660 0.02 A 29 LEU HB3 H 1 1.6480 0.02 A 29 LEU HD1% H 1 0.9130 0.02 A 29 LEU HD2% H 1 0.9060 0.02 A 29 LEU HG H 1 1.7860 0.02 A 29 LEU C C 13 179.1760 0.2 A 29 LEU CA C 13 57.4460 0.2 A 29 LEU CB C 13 42.0460 0.2 A 29 LEU CD1 C 13 23.9560 0.2 A 29 LEU CD2 C 13 22.6040 0.2 A 29 LEU CG C 13 27.0040 0.2 A 29 LEU N N 15 120.2080 0.2 A 30 ALA H H 1 8.2420 0.02 A 30 ALA HA H 1 4.1970 0.02 A 30 ALA HB% H 1 1.4480 0.02 A 30 ALA C C 13 178.3500 0.2 A 30 ALA CA C 13 53.8430 0.2 A 30 ALA CB C 13 17.8330 0.2 A 30 ALA N N 15 120.6040 0.2 A 31 ASN H H 1 7.7980 0.02 A 31 ASN HA H 1 4.7580 0.02 A 31 ASN HB2 H 1 2.9660 0.02 A 31 ASN HB3 H 1 2.8160 0.02 A 31 ASN C C 13 175.9960 0.2 A 31 ASN CA C 13 53.3390 0.2 A 31 ASN CB C 13 39.0960 0.2 A 31 ASN N N 15 114.6060 0.2 A 32 GLY H H 1 8.0210 0.02 A 32 GLY HA3 H 1 3.9280 0.02 A 32 GLY C C 13 174.8240 0.2 A 32 GLY CA C 13 45.9020 0.2 A 32 GLY N N 15 106.8040 0.2 A 33 GLY H H 1 8.1560 0.02 A 33 GLY HA2 H 1 4.0170 0.02 A 33 GLY HA3 H 1 3.8490 0.02 A 33 GLY C C 13 173.8000 0.2 A 33 GLY CA C 13 45.4120 0.2 A 33 GLY N N 15 107.1260 0.2 A 34 ASN H H 1 7.7770 0.02 A 34 ASN HA H 1 4.7390 0.02 A 34 ASN HB2 H 1 2.8380 0.02 A 34 ASN C C 13 175.0530 0.2 A 34 ASN CA C 13 53.1700 0.2 A 34 ASN CB C 13 38.8570 0.2 A 34 ASN N N 15 116.9720 0.2 A 35 GLY H H 1 7.8750 0.02 A 35 GLY HA2 H 1 3.8290 0.02 A 35 GLY HA3 H 1 3.7150 0.02 A 35 GLY C C 13 173.2010 0.2 A 35 GLY CA C 13 45.0650 0.2 A 35 GLY N N 15 106.7580 0.2 A 36 PHE H H 1 7.5370 0.02 A 36 PHE HA H 1 4.5800 0.02 A 36 PHE HB2 H 1 3.0510 0.02 A 36 PHE HB3 H 1 2.9350 0.02 A 36 PHE C C 13 174.9250 0.2 A 36 PHE CA C 13 57.9750 0.2 A 36 PHE CB C 13 39.5420 0.2 A 36 PHE N N 15 118.4860 0.2 A 37 TRP H H 1 7.4450 0.02 A 37 TRP HA H 1 4.7910 0.02 A 37 TRP HB2 H 1 3.3900 0.02 A 37 TRP HB3 H 1 3.3060 0.02 A 37 TRP CA C 13 55.9450 0.2 A 37 TRP CB C 13 29.2430 0.2 A 37 TRP N N 15 119.5980 0.2 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 24 ALA H A 24 ALA HB% 1.0 . 3.13 2 2 A 21 ALA H A 20 GLU HB2 1.0 . 4.32 3 3 A 21 ALA H A 20 GLU HB3 1.0 . 4.32 4 4 A 21 ALA H A 21 ALA HB% 1.0 . 3.24 5 5 A 2 TYR HA A 3 TYR H 1.0 . 3.29 6 6 A 10 THR HA A 14 LEU H 1.0 . 4.54 7 7 A 3 TYR H A 3 TYR HB2 1.0 . 3.98 8 8 A 20 GLU H A 20 GLU HG2 1.0 . 4.22 9 9 A 3 TYR H A 3 TYR HB3 1.0 . 3.98 10 10 A 20 GLU H A 20 GLU HG3 1.0 . 4.22 11 11 A 20 GLU H A 20 GLU HB2 1.0 . 3.92 12 12 A 20 GLU H A 20 GLU HB3 1.0 . 3.92 13 13 A 16 VAL H A 16 VAL HB 1.0 . 3.59 14 14 A 7 VAL H A 7 VAL HB 1.0 . 3.71 15 15 A 14 LEU H A 14 LEU HB2 1.0 . 4.13 16 16 A 16 VAL H A 16 VAL HG1% 1.0 . 3.90 17 17 A 16 VAL H A 16 VAL HG1% 1.0 . 4.27 18 18 A 14 LEU H A 14 LEU HD2% 1.0 . 4.46 19 19 A 14 LEU H A 14 LEU HD2% 1.0 . 5.05 20 20 A 16 VAL H A 16 VAL HG2% 1.0 . 5.20 21 21 A 16 VAL H A 16 VAL HG2% 1.0 . 5.50 22 22 A 16 VAL H A 16 VAL HG2% 1.0 . 5.50 23 23 A 7 VAL H A 7 VAL HG2% 1.0 . 5.47 24 24 A 7 VAL H A 7 VAL HG2% 1.0 . 5.50 25 25 A 7 VAL H A 7 VAL HG2% 1.0 . 5.50 26 26 A 15 SER HA A 18 TRP H 1.0 . 4.42 27 27 A 10 THR HB A 11 LYS H 1.0 . 3.86 28 28 A 26 VAL HA A 29 LEU H 1.0 . 4.52 29 29 A 9 LEU H A 8 HIS HB2 1.0 . 4.59 30 30 A 9 LEU H A 8 HIS HB3 1.0 . 4.59 31 31 A 22 PHE H A 22 PHE HB2 1.0 . 3.69 32 32 A 18 TRP H A 17 ASN HB2 1.0 . 4.42 33 33 A 22 PHE H A 22 PHE HB3 1.0 . 3.69 34 34 A 18 TRP H A 17 ASN HB3 1.0 . 4.42 35 35 A 11 LYS H A 11 LYS HB2 1.0 . 3.40 36 36 A 9 LEU H A 9 LEU HB2 1.0 . 3.57 37 37 A 9 LEU H A 9 LEU HB3 1.0 . 3.57 38 38 A 11 LYS H A 14 LEU HB3 1.0 . 4.73 39 39 A 11 LYS H A 11 LYS HD2 1.0 . 5.22 40 40 A 11 LYS H A 11 LYS HD3 1.0 . 5.22 41 41 A 29 LEU H A 29 LEU HB2 1.0 . 3.90 42 42 A 29 LEU H A 29 LEU HB3 1.0 . 3.90 43 43 A 21 ALA HB% A 22 PHE H 1.0 . 3.75 44 44 A 30 ALA H A 30 ALA HB% 1.0 . 3.29 45 45 A 11 LYS H A 11 LYS HG2 1.0 . 4.50 46 46 A 11 LYS H A 11 LYS HG3 1.0 . 4.50 47 47 A 11 LYS H A 10 THR HG2% 1.0 . 4.81 48 48 A 11 LYS H A 10 THR HG2% 1.0 . 5.44 49 49 A 9 LEU H A 9 LEU HD2% 1.0 . 4.39 50 50 A 26 VAL H A 26 VAL HG1% 1.0 . 4.87 51 51 A 26 VAL H A 26 VAL HG1% 1.0 . 5.17 52 52 A 26 VAL H A 26 VAL HG2% 1.0 . 3.44 53 53 A 29 LEU H A 29 LEU HD1% 1.0 . 5.48 54 54 A 17 ASN H A 17 ASN HB2 1.0 . 3.73 55 55 A 37 TRP H A 36 PHE HB2 1.0 . 4.71 56 56 A 16 VAL HB A 17 ASN H 1.0 . 4.08 57 57 A 16 VAL HG2% A 17 ASN H 1.0 . 4.79 58 58 A 16 VAL HG2% A 17 ASN H 1.0 . 5.30 59 59 A 8 HIS H A 8 HIS HB2 1.0 . 4.10 60 60 A 8 HIS H A 8 HIS HB3 1.0 . 4.10 61 61 A 7 VAL HB A 8 HIS H 1.0 . 3.94 62 62 A 8 HIS H A 7 VAL HG1% 1.0 . 5.50 63 63 A 8 HIS H A 7 VAL HG1% 1.0 . 5.50 64 64 A 8 HIS H A 7 VAL HG1% 1.0 . 5.50 65 65 A 7 VAL HG2% A 8 HIS H 1.0 . 5.24 66 66 A 7 VAL HG2% A 8 HIS H 1.0 . 5.50 67 67 A 7 VAL HG2% A 8 HIS H 1.0 . 5.50 68 68 A 24 ALA HA A 27 HIS H 1.0 . 4.19 69 69 A 27 HIS H A 27 HIS HB2 1.0 . 4.16 70 70 A 27 HIS H A 27 HIS HB3 1.0 . 4.16 71 71 A 27 HIS H A 26 VAL HB 1.0 . 4.00 72 72 A 26 VAL HG2% A 27 HIS H 1.0 . 4.74 73 73 A 26 VAL HG2% A 27 HIS H 1.0 . 5.27 74 74 A 26 VAL HG1% A 27 HIS H 1.0 . 4.42 75 75 A 10 THR HB A 10 THR H 1.0 . 3.85 76 76 A 15 SER H A 15 SER HB2 1.0 . 4.02 77 77 A 12 SER H A 12 SER HB2 1.0 . 3.82 78 78 A 12 SER H A 12 SER HB3 1.0 . 3.82 79 79 A 15 SER H A 15 SER HB3 1.0 . 4.02 80 80 A 31 ASN H A 31 ASN HB2 1.0 . 3.95 81 81 A 31 ASN H A 31 ASN HB3 1.0 . 3.95 82 82 A 11 LYS HB2 A 12 SER H 1.0 . 3.82 83 83 A 10 THR H A 9 LEU HB2 1.0 . 4.66 84 84 A 14 LEU HB3 A 15 SER H 1.0 . 4.17 85 85 A 10 THR H A 9 LEU HB3 1.0 . 4.66 86 86 A 10 THR H A 9 LEU HG 1.0 . 5.02 87 87 A 30 ALA HB% A 31 ASN H 1.0 . 3.76 88 88 A 10 THR H A 9 LEU HD2% 1.0 . 5.05 89 89 A 10 THR H A 9 LEU HD2% 1.0 . 5.29 90 90 A 14 LEU HD2% A 15 SER H 1.0 . 4.80 91 91 A 23 SER H A 23 SER HB2 1.0 . 3.76 92 92 A 23 SER H A 23 SER HB3 1.0 . 3.76 93 93 A 23 SER H A 19 GLY HA2 1.0 . 4.35 94 94 A 23 SER H A 22 PHE HB2 1.0 . 4.33 95 95 A 23 SER H A 22 PHE HB3 1.0 . 4.33 96 96 A 10 THR HA A 13 GLY H 1.0 . 4.87 97 97 A 13 GLY H A 11 LYS HA 1.0 . 5.24 98 98 A 13 GLY H A 12 SER HB2 1.0 . 4.21 99 99 A 13 GLY H A 12 SER HB3 1.0 . 4.21 100 100 A 6 GLY H A 5 ASN HB2 1.0 . 5.43 101 101 A 6 GLY H A 5 ASN HB3 1.0 . 5.43 102 102 A 29 LEU HA A 33 GLY H 1.0 . 4.48 103 103 A 24 ALA HB% A 25 GLY H 1.0 . 3.73 104 104 A 14 LEU H A 14 LEU HB3 1.0 . 3.62 105 105 A 7 VAL H A 6 GLY H 1.0 . 4.32 106 106 A 6 GLY H A 5 ASN H 1.0 . 4.31 107 107 A 7 VAL H A 8 HIS H 1.0 . 4.23 108 108 A 9 LEU H A 8 HIS H 1.0 . 4.50 109 109 A 9 LEU H A 10 THR H 1.0 . 4.12 110 110 A 11 LYS H A 12 SER H 1.0 . 3.96 111 111 A 14 LEU H A 15 SER H 1.0 . 4.21 112 112 A 16 VAL H A 17 ASN H 1.0 . 3.85 113 113 A 17 ASN H A 17 ASN HB3 1.0 . 3.73 114 114 A 18 TRP H A 17 ASN H 1.0 . 4.22 115 115 A 21 ALA H A 20 GLU H 1.0 . 4.07 116 116 A 22 PHE H A 23 SER H 1.0 . 4.22 117 117 A 21 ALA H A 22 PHE H 1.0 . 4.13 118 118 A 24 ALA H A 25 GLY H 1.0 . 4.01 119 119 A 24 ALA H A 23 SER H 1.0 . 4.17 120 120 A 26 VAL H A 26 VAL HB 1.0 . 3.60 121 121 A 31 ASN H A 32 GLY H 1.0 . 3.98 122 122 A 33 GLY H A 34 ASN H 1.0 . 4.10 123 123 A 35 GLY H A 36 PHE H 1.0 . 4.34 124 124 A 3 TYR H A 4 GLY H 1.0 . 4.05 125 125 A 20 GLU H A 17 ASN HA 1.0 . 4.52 126 126 A 37 TRP H A 36 PHE HB3 1.0 . 4.71 127 127 A 21 ALA H A 22 PHE HB3 1.0 . 5.50 128 128 A 21 ALA H A 22 PHE HB2 1.0 . 5.50 129 129 A 30 ALA H A 31 ASN H 1.0 . 4.08 130 130 A 14 LEU HB2 A 15 SER H 1.0 . 4.63 131 131 A 4 GLY H A 3 TYR HB3 1.0 . 4.79 132 132 A 4 GLY H A 3 TYR HB2 1.0 . 4.79 133 133 A 5 ASN H A 4 GLY H 1.0 . 4.47 134 134 A 32 GLY H A 31 ASN HB2 1.0 . 4.72 135 135 A 32 GLY H A 31 ASN HB3 1.0 . 4.72 136 136 A 17 ASN H A 14 LEU HA 1.0 . 4.79 137 137 A 16 VAL HG1% A 17 ASN H 1.0 . 5.09 138 138 A 16 VAL HG1% A 17 ASN H 1.0 . 5.50 139 139 A 16 VAL HG1% A 17 ASN H 1.0 . 5.50 140 140 A 12 SER H A 13 GLY H 1.0 . 4.26 141 141 A 14 LEU HB3 A 12 SER H 1.0 . 5.37 142 142 A 14 LEU HD2% A 11 LYS H 1.0 . 5.27 143 143 A 10 THR HB A 7 VAL HA 1.0 . 4.07 144 144 A 26 VAL HA A 29 LEU HB3 1.0 . 4.16 145 145 A 26 VAL HA A 29 LEU HB2 1.0 . 4.16 146 146 A 7 VAL HG1% A 7 VAL HA 1.0 . 4.04 147 147 A 10 THR HA A 10 THR HG2% 1.0 . 3.82 148 148 A 10 THR HA A 10 THR HG2% 1.0 . 3.49 149 149 A 16 VAL HG2% A 16 VAL HA 1.0 . 3.61 150 150 A 16 VAL HG2% A 16 VAL HA 1.0 . 3.94 151 151 A 26 VAL HA A 29 LEU HD1% 1.0 . 4.31 152 152 A 26 VAL HB A 23 SER HA 1.0 . 3.63 153 153 A 30 ALA HB% A 27 HIS HA 1.0 . 3.60 154 154 A 26 VAL HG2% A 23 SER HA 1.0 . 4.02 155 155 A 28 ARG HA A 31 ASN HB3 1.0 . 4.79 156 156 A 20 GLU HA A 20 GLU HG3 1.0 . 4.15 157 157 A 14 LEU HB3 A 11 LYS HA 1.0 . 4.77 158 158 A 28 ARG HA A 28 ARG HG2 1.0 . 4.19 159 159 A 11 LYS HA A 11 LYS HD2 1.0 . 5.10 160 160 A 11 LYS HA A 11 LYS HD3 1.0 . 5.10 161 161 A 29 LEU HA A 29 LEU HG 1.0 . 4.08 162 162 A 11 LYS HA A 11 LYS HG2 1.0 . 4.08 163 163 A 11 LYS HA A 11 LYS HG3 1.0 . 4.08 164 164 A 9 LEU HA A 9 LEU HD1% 1.0 . 5.03 165 165 A 24 ALA HB% A 24 ALA HA 1.0 . 2.92 166 166 A 21 ALA HB% A 21 ALA HA 1.0 . 2.92 167 167 A 19 GLY HA2 A 22 PHE HB2 1.0 . 4.60 168 168 A 9 LEU HD2% A 6 GLY HA3 1.0 . 5.50 169 169 A 10 THR HA A 14 LEU HB3 1.0 . 3.69 170 170 A 11 LYS HB3 A 11 LYS HE2 1.0 . 5.47 171 171 A 11 LYS HB3 A 11 LYS HE3 1.0 . 5.47 172 172 A 14 LEU HD2% A 14 LEU HB3 1.0 . 3.80 173 173 A 14 LEU HB2 A 14 LEU HD1% 1.0 . 4.02 174 174 A 14 LEU HA A 17 ASN HB2 1.0 . 4.42 175 175 A 14 LEU HA A 17 ASN HB3 1.0 . 4.42 176 176 A 19 GLY HA3 A 22 PHE HB2 1.0 . 5.10 177 177 A 11 LYS HB2 A 8 HIS HA 1.0 . 4.07 178 178 A 20 GLU HA A 20 GLU HG2 1.0 . 4.15 179 179 A 17 ASN HA A 20 GLU HB2 1.0 . 4.34 180 180 A 17 ASN HA A 20 GLU HB3 1.0 . 4.34 181 181 A 28 ARG HA A 28 ARG HG3 1.0 . 4.19 182 182 A 10 THR HA A 14 LEU HD2% 1.0 . 4.74 183 183 A 29 LEU HA A 29 LEU HD2% 1.0 . 4.66 184 184 A 29 LEU HA A 29 LEU HD2% 1.0 . 5.22 185 185 A 29 LEU HA A 29 LEU HD2% 1.0 . 5.14 186 186 A 9 LEU HD2% A 14 LEU HA 1.0 . 3.33 187 187 A 14 LEU HB2 A 9 LEU HD2% 1.0 . 3.64 188 188 A 14 LEU HD2% A 10 THR HG2% 1.0 . 4.61 189 189 A 10 THR HG2% A 14 LEU HA 1.0 . 5.25 190 190 A 26 VAL HG2% A 23 SER HA 1.0 . 3.96 191 191 A 7 VAL HG2% A 7 VAL HA 1.0 . 4.24 192 192 A 26 VAL HA A 26 VAL HG2% 1.0 . 3.21 193 193 A 26 VAL HA A 26 VAL HG1% 1.0 . 3.50 194 194 A 14 LEU HB3 A 10 THR HG2% 1.0 . 4.61 195 195 A 30 ALA HB% A 26 VAL HG1% 1.0 . 4.16 196 196 A 21 ALA HB% A 18 TRP HA 1.0 . 3.54 197 197 A 30 ALA HB% A 30 ALA HA 1.0 . 2.83 198 198 A 21 ALA HB% A 21 ALA HA 1.0 . 2.94 199 199 A 30 ALA HB% A 26 VAL HG1% 1.0 . 4.54 200 200 A 1 LYS HA A 1 LYS HD2 1.0 . 5.42 201 201 A 1 LYS HA A 1 LYS HD3 1.0 . 5.42 202 202 A 1 LYS HA A 1 LYS HE2 1.0 . 5.50 203 203 A 1 LYS HA A 1 LYS HE3 1.0 . 5.50 204 204 A 9 LEU HD2% A 6 GLY HA2 1.0 . 5.50 205 205 A 1 LYS HA A 2 TYR H 1.0 . 3.47 206 206 A 2 TYR H A 1 LYS HB2 1.0 . 5.50 207 207 A 2 TYR H A 1 LYS HB3 1.0 . 5.50 208 208 A 7 VAL H A 7 VAL HG1% 1.0 . 4.14 209 209 A 7 VAL H A 7 VAL HG1% 1.0 . 4.58 210 210 A 7 VAL H A 7 VAL HG1% 1.0 . 4.71 211 211 A 10 THR HG2% A 10 THR H 1.0 . 5.22 212 212 A 10 THR HG2% A 10 THR H 1.0 . 5.50 213 213 A 10 THR HG2% A 10 THR H 1.0 . 5.50 214 214 A 21 ALA H A 21 ALA HB% 1.0 . 4.18 215 215 A 21 ALA HB% A 22 PHE H 1.0 . 4.27 216 216 A 19 GLY HA3 A 22 PHE HB3 1.0 . 5.10 217 217 A 19 GLY HA2 A 22 PHE HB3 1.0 . 4.60 218 218 A 29 LEU H A 29 LEU HG 1.0 . 4.53 219 219 A 10 THR HG2% A 7 VAL HA 1.0 . 5.50 220 220 A 10 THR HG2% A 7 VAL HA 1.0 . 5.50 221 221 A 18 TRP H A 16 VAL HA 1.0 . 4.77 222 222 A 10 THR HA A 14 LEU HG 1.0 . 5.50 223 223 A 10 THR HA A 14 LEU HB2 1.0 . 3.88 224 224 A 26 VAL H A 23 SER HA 1.0 . 4.82 225 225 A 30 ALA HB% A 31 ASN H 1.0 . 4.56 226 226 A 24 ALA HB% A 25 GLY HA2 1.0 . 5.50 227 227 A 24 ALA HB% A 25 GLY HA2 1.0 . 5.50 228 228 A 24 ALA HB% A 25 GLY HA3 1.0 . 5.50 229 229 A 24 ALA HB% A 25 GLY HA3 1.0 . 5.50 230 230 A 26 VAL HA A 29 LEU HG 1.0 . 4.77 231 231 A 26 VAL HG1% A 23 SER HA 1.0 . 5.50 232 232 A 26 VAL HG1% A 23 SER HA 1.0 . 5.50 233 233 A 26 VAL HG1% A 27 HIS HA 1.0 . 5.50 234 234 A 26 VAL H A 26 VAL HG1% 1.0 . 5.50 235 235 A 26 VAL HG1% A 27 HIS HA 1.0 . 4.51 236 236 A 14 LEU HD2% A 11 LYS HA 1.0 . 4.13 237 237 A 29 LEU HD1% A 29 LEU HA 1.0 . 5.50 238 238 A 10 THR H A 7 VAL HA 1.0 . 5.12 239 239 A 28 ARG HA A 31 ASN HB2 1.0 . 4.79 240 240 A 9 LEU HG A 14 LEU HA 1.0 . 5.20 241 241 A 10 THR HG2% A 11 LYS HA 1.0 . 5.47 242 242 A 10 THR HG2% A 11 LYS HA 1.0 . 5.50 243 243 A 1 LYS HA A 1 LYS HD3 1.0 . 4.64 244 243 A 1 LYS HA A 1 LYS HD2 1.0 . 4.64 245 244 A 2 TYR H A 2 TYR HB2 1.0 . 3.52 246 244 A 2 TYR H A 2 TYR HB3 1.0 . 3.52 247 245 A 3 TYR H A 3 TYR HB3 1.0 . 3.40 248 245 A 3 TYR H A 3 TYR HB2 1.0 . 3.40 249 246 A 6 GLY H A 4 GLY HA2 1.0 . 4.67 250 246 A 6 GLY H A 4 GLY HA3 1.0 . 4.67 251 247 A 5 ASN H A 5 ASN HB3 1.0 . 3.64 252 247 A 5 ASN H A 5 ASN HB2 1.0 . 3.64 253 248 A 9 LEU H A 6 GLY HA3 1.0 . 4.20 254 248 A 9 LEU H A 6 GLY HA2 1.0 . 4.20 255 249 A 6 GLY HA3 A 9 LEU HB3 1.0 . 3.70 256 249 A 6 GLY HA2 A 9 LEU HB3 1.0 . 3.70 257 249 A 9 LEU HB2 A 6 GLY HA3 1.0 . 3.70 258 249 A 6 GLY HA2 A 9 LEU HB2 1.0 . 3.70 259 250 A 9 LEU HG A 6 GLY HA3 1.0 . 5.03 260 250 A 9 LEU HG A 6 GLY HA2 1.0 . 5.03 261 251 A 9 LEU HD1% A 6 GLY HA3 1.0 . 5.34 262 251 A 6 GLY HA2 A 9 LEU HD1% 1.0 . 5.34 263 252 A 6 GLY HA2 A 9 LEU HD1% 1.0 . 4.75 264 252 A 9 LEU HD1% A 6 GLY HA3 1.0 . 4.75 265 253 A 9 LEU HD2% A 6 GLY HA2 1.0 . 4.67 266 253 A 9 LEU HD2% A 6 GLY HA3 1.0 . 4.67 267 254 A 8 HIS H A 8 HIS HB2 1.0 . 3.45 268 254 A 8 HIS H A 8 HIS HB3 1.0 . 3.45 269 255 A 9 LEU H A 8 HIS HB2 1.0 . 3.95 270 255 A 9 LEU H A 8 HIS HB3 1.0 . 3.95 271 256 A 9 LEU HD1% A 9 LEU HB3 1.0 . 3.67 272 256 A 9 LEU HB2 A 9 LEU HD1% 1.0 . 3.67 273 257 A 9 LEU HD2% A 9 LEU HB2 1.0 . 3.38 274 257 A 9 LEU HD2% A 9 LEU HB3 1.0 . 3.38 275 258 A 10 THR H A 9 LEU HB3 1.0 . 3.92 276 258 A 10 THR H A 9 LEU HB2 1.0 . 3.92 277 259 A 10 THR HA A 9 LEU HB3 1.0 . 5.31 278 259 A 10 THR HA A 9 LEU HB2 1.0 . 5.31 279 260 A 9 LEU HD2% A 12 SER HB3 1.0 . 5.34 280 260 A 9 LEU HD2% A 12 SER HB2 1.0 . 5.34 281 261 A 11 LYS H A 11 LYS HG3 1.0 . 3.92 282 261 A 11 LYS H A 11 LYS HG2 1.0 . 3.92 283 262 A 11 LYS H A 11 LYS HD3 1.0 . 4.44 284 262 A 11 LYS H A 11 LYS HD2 1.0 . 4.44 285 263 A 11 LYS HA A 11 LYS HG3 1.0 . 3.52 286 263 A 11 LYS HA A 11 LYS HG2 1.0 . 3.52 287 264 A 11 LYS HA A 11 LYS HD3 1.0 . 4.34 288 264 A 11 LYS HA A 11 LYS HD2 1.0 . 4.34 289 265 A 11 LYS HB3 A 11 LYS HD3 1.0 . 3.61 290 265 A 11 LYS HB3 A 11 LYS HD2 1.0 . 3.61 291 266 A 11 LYS HE3 A 11 LYS HG3 1.0 . 3.32 292 266 A 11 LYS HG2 A 11 LYS HE2 1.0 . 3.32 293 266 A 11 LYS HG2 A 11 LYS HE3 1.0 . 3.32 294 266 A 11 LYS HE2 A 11 LYS HG3 1.0 . 3.32 295 267 A 14 LEU HD2% A 11 LYS HG3 1.0 . 5.34 296 267 A 14 LEU HD2% A 11 LYS HG2 1.0 . 5.34 297 268 A 13 GLY H A 12 SER HB3 1.0 . 3.34 298 268 A 13 GLY H A 12 SER HB2 1.0 . 3.34 299 269 A 16 VAL HB A 13 GLY HA2 1.0 . 4.19 300 269 A 16 VAL HB A 13 GLY HAy 1.0 . 4.19 301 270 A 16 VAL HG1% A 13 GLY HA2 1.0 . 5.24 302 270 A 16 VAL HG1% A 13 GLY HAy 1.0 . 5.24 303 271 A 16 VAL HG1% A 13 GLY HAy 1.0 . 5.34 304 271 A 16 VAL HG1% A 13 GLY HA2 1.0 . 5.34 305 272 A 16 VAL HG1% A 13 GLY HAy 1.0 . 5.34 306 272 A 16 VAL HG1% A 13 GLY HA2 1.0 . 5.34 307 273 A 14 LEU HA A 17 ASN HB3 1.0 . 3.87 308 273 A 14 LEU HA A 17 ASN HB2 1.0 . 3.87 309 274 A 15 SER H A 15 SER HB3 1.0 . 3.49 310 274 A 15 SER H A 15 SER HB2 1.0 . 3.49 311 275 A 15 SER HA A 18 TRP HB2 1.0 . 3.89 312 275 A 15 SER HA A 18 TRP HBy 1.0 . 3.89 313 276 A 16 VAL H A 15 SER HB3 1.0 . 4.15 314 276 A 16 VAL H A 15 SER HB2 1.0 . 4.15 315 277 A 16 VAL HG2% A 20 GLU HG3 1.0 . 4.46 316 277 A 16 VAL HG2% A 20 GLU HG2 1.0 . 4.46 317 278 A 17 ASN HA A 20 GLU HB3 1.0 . 3.82 318 278 A 17 ASN HA A 20 GLU HB2 1.0 . 3.82 319 279 A 18 TRP H A 17 ASN HB3 1.0 . 3.86 320 279 A 18 TRP H A 17 ASN HB2 1.0 . 3.86 321 280 A 18 TRP H A 18 TRP HB2 1.0 . 3.27 322 280 A 18 TRP H A 18 TRP HBy 1.0 . 3.27 323 281 A 19 GLY H A 18 TRP HB2 1.0 . 3.80 324 281 A 18 TRP HBy A 19 GLY H 1.0 . 3.80 325 282 A 19 GLY HA2 A 18 TRP HB2 1.0 . 4.66 326 282 A 19 GLY HA2 A 18 TRP HBy 1.0 . 4.66 327 283 A 21 ALA HB% A 18 TRP HBy 1.0 . 5.18 328 283 A 21 ALA HB% A 18 TRP HB2 1.0 . 5.18 329 284 A 19 GLY HA2 A 22 PHE HB3 1.0 . 3.90 330 284 A 19 GLY HA2 A 22 PHE HB2 1.0 . 3.90 331 285 A 19 GLY HA3 A 22 PHE HB3 1.0 . 4.30 332 285 A 19 GLY HA3 A 22 PHE HB2 1.0 . 4.30 333 286 A 20 GLU H A 20 GLU HB3 1.0 . 3.40 334 286 A 20 GLU H A 20 GLU HB2 1.0 . 3.40 335 287 A 20 GLU H A 20 GLU HG3 1.0 . 3.68 336 287 A 20 GLU H A 20 GLU HG2 1.0 . 3.68 337 288 A 20 GLU HA A 20 GLU HG3 1.0 . 3.46 338 288 A 20 GLU HA A 20 GLU HG2 1.0 . 3.46 339 289 A 21 ALA H A 20 GLU HB3 1.0 . 3.77 340 289 A 21 ALA H A 20 GLU HB2 1.0 . 3.77 341 290 A 21 ALA HB% A 20 GLU HB2 1.0 . 5.34 342 290 A 21 ALA HB% A 20 GLU HB3 1.0 . 5.34 343 291 A 21 ALA HB% A 20 GLU HB3 1.0 . 5.34 344 291 A 21 ALA HB% A 20 GLU HB2 1.0 . 5.34 345 292 A 21 ALA H A 20 GLU HG3 1.0 . 5.28 346 292 A 21 ALA H A 20 GLU HG2 1.0 . 5.28 347 293 A 21 ALA H A 22 PHE HB3 1.0 . 4.79 348 293 A 21 ALA H A 22 PHE HB2 1.0 . 4.79 349 294 A 23 SER H A 22 PHE HB3 1.0 . 3.58 350 294 A 23 SER H A 22 PHE HB2 1.0 . 3.58 351 295 A 23 SER H A 23 SER HB3 1.0 . 3.14 352 295 A 23 SER H A 23 SER HB2 1.0 . 3.14 353 296 A 24 ALA H A 23 SER HB3 1.0 . 3.33 354 296 A 24 ALA H A 23 SER HB2 1.0 . 3.33 355 297 A 24 ALA HA A 27 HIS HB2 1.0 . 3.64 356 297 A 24 ALA HA A 27 HIS HB3 1.0 . 3.64 357 298 A 25 GLY HA2 A 28 ARG HB2 1.0 . 3.58 358 298 A 25 GLY HA3 A 28 ARG HB2 1.0 . 3.58 359 298 A 28 ARG HB3 A 25 GLY HA3 1.0 . 3.58 360 298 A 25 GLY HA2 A 28 ARG HB3 1.0 . 3.58 361 299 A 26 VAL HA A 28 ARG HB2 1.0 . 5.11 362 299 A 26 VAL HA A 28 ARG HB3 1.0 . 5.11 363 300 A 26 VAL HA A 29 LEU HB3 1.0 . 3.60 364 300 A 26 VAL HA A 29 LEU HB2 1.0 . 3.60 365 301 A 27 HIS H A 27 HIS HB2 1.0 . 3.48 366 301 A 27 HIS H A 27 HIS HB3 1.0 . 3.48 367 302 A 28 ARG H A 27 HIS HB2 1.0 . 3.49 368 302 A 27 HIS HB3 A 28 ARG H 1.0 . 3.49 369 303 A 28 ARG H A 28 ARG HB2 1.0 . 3.18 370 303 A 28 ARG HB3 A 28 ARG H 1.0 . 3.18 371 304 A 28 ARG H A 28 ARG HG2 1.0 . 4.32 372 304 A 28 ARG H A 28 ARG HG3 1.0 . 4.32 373 305 A 28 ARG HA A 28 ARG HG2 1.0 . 3.68 374 305 A 28 ARG HA A 28 ARG HG3 1.0 . 3.68 375 306 A 28 ARG HA A 28 ARG HD2 1.0 . 3.99 376 306 A 28 ARG HA A 28 ARG HD3 1.0 . 3.99 377 307 A 28 ARG HA A 31 ASN HB3 1.0 . 4.01 378 307 A 28 ARG HA A 31 ASN HB2 1.0 . 4.01 379 308 A 28 ARG HB3 A 28 ARG HD2 1.0 . 3.32 380 308 A 28 ARG HD3 A 28 ARG HB2 1.0 . 3.32 381 308 A 28 ARG HB3 A 28 ARG HD3 1.0 . 3.32 382 308 A 28 ARG HB2 A 28 ARG HD2 1.0 . 3.32 383 309 A 29 LEU H A 28 ARG HB2 1.0 . 4.16 384 309 A 29 LEU H A 28 ARG HB3 1.0 . 4.16 385 310 A 29 LEU H A 28 ARG HG2 1.0 . 4.84 386 310 A 29 LEU H A 28 ARG HG3 1.0 . 4.84 387 311 A 29 LEU H A 29 LEU HB3 1.0 . 3.32 388 311 A 29 LEU H A 29 LEU HB2 1.0 . 3.32 389 312 A 29 LEU HD2% A 29 LEU HB3 1.0 . 3.68 390 312 A 29 LEU HD2% A 29 LEU HB2 1.0 . 3.68 391 313 A 30 ALA H A 29 LEU HB3 1.0 . 4.23 392 313 A 30 ALA H A 29 LEU HB2 1.0 . 4.23 393 314 A 31 ASN H A 31 ASN HB3 1.0 . 3.38 394 314 A 31 ASN H A 31 ASN HB2 1.0 . 3.38 395 315 A 34 ASN H A 34 ASN HB2 1.0 . 3.59 396 315 A 34 ASN H A 34 ASN HBy 1.0 . 3.59 397 316 A 36 PHE H A 36 PHE HB3 1.0 . 3.58 398 316 A 36 PHE H A 36 PHE HB2 1.0 . 3.58 399 317 A 37 TRP H A 36 PHE HB3 1.0 . 4.12 400 317 A 37 TRP H A 36 PHE HB2 1.0 . 4.12 401 318 A 37 TRP H A 37 TRP HB2 1.0 . 3.68 402 318 A 37 TRP H A 37 TRP HB3 1.0 . 3.68 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 GLY C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -81.0 -41.0 PHI 2 2 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 HIS N 1.0 -63.3 -11.9 PSI 3 3 A 7 VAL C A 8 HIS N A 8 HIS CA A 8 HIS C 1.0 -84.0 -44.0 PHI 4 4 A 8 HIS N A 8 HIS CA A 8 HIS C A 9 LEU N 1.0 -59.8 -14.4 PSI 5 5 A 8 HIS C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -77.7 -37.7 PHI 6 6 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 THR N 1.0 -61.0 -21.0 PSI 7 7 A 9 LEU C A 10 THR N A 10 THR CA A 10 THR C 1.0 -83.5 -43.5 PHI 8 8 A 10 THR N A 10 THR CA A 10 THR C A 11 LYS N 1.0 -61.9 -21.9 PSI 9 9 A 10 THR C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 -82.9 -42.9 PHI 10 10 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 SER N 1.0 -63.7 -23.7 PSI 11 11 A 13 GLY C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -83.0 -43.0 PHI 12 12 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 SER N 1.0 -60.7 -16.8 PSI 13 13 A 14 LEU C A 15 SER N A 15 SER CA A 15 SER C 1.0 -85.2 -45.2 PHI 14 14 A 15 SER N A 15 SER CA A 15 SER C A 16 VAL N 1.0 -57.6 -17.6 PSI 15 15 A 15 SER C A 16 VAL N A 16 VAL CA A 16 VAL C 1.0 -85.6 -45.6 PHI 16 16 A 16 VAL N A 16 VAL CA A 16 VAL C A 17 ASN N 1.0 -62.0 -22.0 PSI 17 17 A 16 VAL C A 17 ASN N A 17 ASN CA A 17 ASN C 1.0 -83.6 -43.6 PHI 18 18 A 17 ASN N A 17 ASN CA A 17 ASN C A 18 TRP N 1.0 -69.3 -18.7 PSI 19 19 A 17 ASN C A 18 TRP N A 18 TRP CA A 18 TRP C 1.0 -86.5 -46.5 PHI 20 20 A 18 TRP N A 18 TRP CA A 18 TRP C A 19 GLY N 1.0 -58.6 -18.6 PSI 21 21 A 18 TRP C A 19 GLY N A 19 GLY CA A 19 GLY C 1.0 -80.9 -40.9 PHI 22 22 A 19 GLY N A 19 GLY CA A 19 GLY C A 20 GLU N 1.0 -61.7 -21.7 PSI 23 23 A 19 GLY C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -84.4 -44.4 PHI 24 24 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 ALA N 1.0 -61.8 -21.8 PSI 25 25 A 20 GLU C A 21 ALA N A 21 ALA CA A 21 ALA C 1.0 -86.1 -46.1 PHI 26 26 A 21 ALA N A 21 ALA CA A 21 ALA C A 22 PHE N 1.0 -59.0 -19.0 PSI 27 27 A 21 ALA C A 22 PHE N A 22 PHE CA A 22 PHE C 1.0 -85.0 -45.0 PHI 28 28 A 22 PHE N A 22 PHE CA A 22 PHE C A 23 SER N 1.0 -64.1 -24.1 PSI 29 29 A 22 PHE C A 23 SER N A 23 SER CA A 23 SER C 1.0 -81.1 -41.1 PHI 30 30 A 23 SER N A 23 SER CA A 23 SER C A 24 ALA N 1.0 -61.1 -21.1 PSI 31 31 A 23 SER C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -84.6 -44.6 PHI 32 32 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 GLY N 1.0 -63.2 -23.2 PSI 33 33 A 24 ALA C A 25 GLY N A 25 GLY CA A 25 GLY C 1.0 -84.7 -44.7 PHI 34 34 A 25 GLY N A 25 GLY CA A 25 GLY C A 26 VAL N 1.0 -60.9 -20.9 PSI 35 35 A 25 GLY C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -81.8 -41.8 PHI 36 36 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 HIS N 1.0 -64.2 -24.2 PSI 37 37 A 26 VAL C A 27 HIS N A 27 HIS CA A 27 HIS C 1.0 -81.4 -41.4 PHI 38 38 A 27 HIS N A 27 HIS CA A 27 HIS C A 28 ARG N 1.0 -60.6 -20.6 PSI 39 39 A 27 HIS C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -80.1 -40.1 PHI 40 40 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 LEU N 1.0 -62.7 -22.7 PSI 41 41 A 28 ARG C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -83.7 -43.7 PHI 42 42 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 ALA N 1.0 -60.3 -20.3 PSI stop_ save_