data_nef_c18698_2lxu 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 TargetDB HR8614A 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 4 SER start . . 2 A 5 HIS middle . . 3 A 6 MET middle . . 4 A 7 GLY middle . false 5 A 8 GLY middle . false 6 A 9 GLU middle . . 7 A 10 GLY middle . false 8 A 11 PHE middle . . 9 A 12 VAL middle . . 10 A 13 VAL middle . . 11 A 14 LYS middle . . 12 A 15 VAL middle . . 13 A 16 ARG middle . . 14 A 17 GLY middle . false 15 A 18 LEU middle . . 16 A 19 PRO middle . false 17 A 20 TRP middle . . 18 A 21 SER middle . . 19 A 22 CYS middle . . 20 A 23 SER middle . . 21 A 24 ALA middle . . 22 A 25 ASP middle . . 23 A 26 GLU middle . . 24 A 27 VAL middle . . 25 A 28 GLN middle . . 26 A 29 ARG middle . . 27 A 30 PHE middle . . 28 A 31 PHE middle . . 29 A 32 SER middle . . 30 A 33 ASP middle . . 31 A 34 CYS middle . . 32 A 35 LYS middle . . 33 A 36 ILE middle . . 34 A 37 GLN middle . . 35 A 38 ASN middle . . 36 A 39 GLY middle . false 37 A 40 ALA middle . . 38 A 41 GLN middle . . 39 A 42 GLY middle . false 40 A 43 ILE middle . . 41 A 44 ARG middle . . 42 A 45 PHE middle . . 43 A 46 ILE middle . . 44 A 47 TYR middle . . 45 A 48 THR middle . . 46 A 49 ARG middle . . 47 A 50 GLU middle . . 48 A 51 GLY middle . false 49 A 52 ARG middle . . 50 A 53 PRO middle . false 51 A 54 SER middle . . 52 A 55 GLY middle . false 53 A 56 GLU middle . . 54 A 57 ALA middle . . 55 A 58 PHE middle . . 56 A 59 VAL middle . . 57 A 60 GLU middle . . 58 A 61 LEU middle . . 59 A 62 GLU middle . . 60 A 63 SER middle . . 61 A 64 GLU middle . . 62 A 65 ASP middle . . 63 A 66 GLU middle . . 64 A 67 VAL middle . . 65 A 68 LYS middle . . 66 A 69 LEU middle . . 67 A 70 ALA middle . . 68 A 71 LEU middle . . 69 A 72 LYS middle . . 70 A 73 LYS middle . . 71 A 74 ASP middle . . 72 A 75 ARG middle . . 73 A 76 GLU middle . . 74 A 77 THR middle . . 75 A 78 MET middle . . 76 A 79 GLY middle . false 77 A 80 HIS middle . . 78 A 81 ARG middle . . 79 A 82 TYR middle . . 80 A 83 VAL middle . . 81 A 84 GLU middle . . 82 A 85 VAL middle . . 83 A 86 PHE middle . . 84 A 87 LYS middle . . 85 A 88 SER middle . . 86 A 89 ASN middle . . 87 A 90 ASN middle . . 88 A 91 VAL middle . . 89 A 92 GLU middle . . 90 A 93 MET middle . . 91 A 94 ASP middle . . 92 A 95 TRP middle . . 93 A 96 VAL middle . . 94 A 97 LEU middle . . 95 A 98 LYS middle . . 96 A 99 HIS middle . . 97 A 100 THR middle . . 98 A 101 GLY middle . false 99 A 102 PRO middle . false 100 A 103 ASN middle . . 101 A 104 SER middle . . 102 A 105 PRO middle . false 103 A 106 ASP middle . . 104 A 107 THR middle . . 105 A 108 ALA middle . . 106 A 109 ASN middle . . 107 A 110 ASP middle . . 108 A 111 GLY end . false 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 6 MET HA H 1 4.46 0.02 A 6 MET HBx H 1 1.97 0.02 A 6 MET HBy H 1 2.06 0.02 A 6 MET HGx H 1 2.45 0.02 A 6 MET HGy H 1 2.55 0.02 A 6 MET C C 13 176.5 0.2 A 6 MET CA C 13 55.5 0.2 A 6 MET CB C 13 32.6 0.2 A 6 MET CG C 13 31.9 0.2 A 7 GLY H H 1 8.45 0.02 A 7 GLY HAx H 1 3.96 0.02 A 7 GLY HAy H 1 3.96 0.02 A 7 GLY C C 13 174.4 0.2 A 7 GLY CA C 13 45.2 0.2 A 7 GLY N N 15 110.3 0.2 A 8 GLY H H 1 8.22 0.02 A 8 GLY HAx H 1 3.97 0.02 A 8 GLY HAy H 1 3.97 0.02 A 8 GLY C C 13 174.2 0.2 A 8 GLY CA C 13 45.1 0.2 A 8 GLY N N 15 108.6 0.2 A 9 GLU H H 1 8.44 0.02 A 9 GLU HA H 1 4.26 0.02 A 9 GLU HBx H 1 1.95 0.02 A 9 GLU HBy H 1 2.03 0.02 A 9 GLU HGx H 1 2.27 0.02 A 9 GLU HGy H 1 2.27 0.02 A 9 GLU C C 13 176.5 0.2 A 9 GLU CA C 13 57.2 0.2 A 9 GLU CB C 13 30.6 0.2 A 9 GLU CG C 13 36.3 0.2 A 9 GLU N N 15 120.3 0.2 A 10 GLY H H 1 7.95 0.02 A 10 GLY HAx H 1 3.34 0.02 A 10 GLY HAy H 1 3.91 0.02 A 10 GLY C C 13 172.5 0.2 A 10 GLY CA C 13 44.2 0.2 A 10 GLY N N 15 108.4 0.2 A 11 PHE H H 1 8.57 0.02 A 11 PHE HA H 1 4.87 0.02 A 11 PHE HBx H 1 2.59 0.02 A 11 PHE HBy H 1 3.07 0.02 A 11 PHE HDx H 1 7.14 0.02 A 11 PHE HDy H 1 7.14 0.02 A 11 PHE HEx H 1 7.38 0.02 A 11 PHE HEy H 1 7.38 0.02 A 11 PHE C C 13 173.3 0.2 A 11 PHE CA C 13 55.5 0.2 A 11 PHE CB C 13 37.8 0.2 A 11 PHE CDx C 13 132.0 0.2 A 11 PHE CDy C 13 132.0 0.2 A 11 PHE N N 15 123.8 0.2 A 12 VAL H H 1 8.57 0.02 A 12 VAL HA H 1 5.11 0.02 A 12 VAL HB H 1 1.51 0.02 A 12 VAL HGx% H 1 1.01 0.02 A 12 VAL HGy% H 1 0.83 0.02 A 12 VAL C C 13 175.7 0.2 A 12 VAL CA C 13 60.5 0.2 A 12 VAL CB C 13 37.0 0.2 A 12 VAL CGy C 13 23.0 0.2 A 12 VAL CGx C 13 21.7 0.2 A 12 VAL N N 15 123.3 0.2 A 13 VAL H H 1 8.60 0.02 A 13 VAL HA H 1 5.05 0.02 A 13 VAL HB H 1 2.12 0.02 A 13 VAL HGx% H 1 0.78 0.02 A 13 VAL HGy% H 1 0.50 0.02 A 13 VAL C C 13 173.4 0.2 A 13 VAL CA C 13 58.7 0.2 A 13 VAL CB C 13 34.3 0.2 A 13 VAL CGy C 13 22.6 0.2 A 13 VAL CGx C 13 18.3 0.2 A 13 VAL N N 15 116.4 0.2 A 14 LYS H H 1 9.34 0.02 A 14 LYS HA H 1 4.94 0.02 A 14 LYS HBx H 1 1.38 0.02 A 14 LYS HBy H 1 1.59 0.02 A 14 LYS HDx H 1 1.35 0.02 A 14 LYS HDy H 1 1.35 0.02 A 14 LYS HEx H 1 2.35 0.02 A 14 LYS HEy H 1 2.65 0.02 A 14 LYS HGx H 1 0.62 0.02 A 14 LYS HGy H 1 0.92 0.02 A 14 LYS C C 13 174.1 0.2 A 14 LYS CA C 13 54.4 0.2 A 14 LYS CB C 13 35.8 0.2 A 14 LYS CD C 13 29.3 0.2 A 14 LYS CE C 13 41.8 0.2 A 14 LYS CG C 13 25.0 0.2 A 14 LYS N N 15 123.9 0.2 A 15 VAL H H 1 9.10 0.02 A 15 VAL HA H 1 5.53 0.02 A 15 VAL HB H 1 1.87 0.02 A 15 VAL HGx% H 1 0.97 0.02 A 15 VAL HGy% H 1 0.90 0.02 A 15 VAL C C 13 174.7 0.2 A 15 VAL CA C 13 58.8 0.2 A 15 VAL CB C 13 34.7 0.2 A 15 VAL CGy C 13 22.4 0.2 A 15 VAL CGx C 13 21.9 0.2 A 15 VAL N N 15 123.2 0.2 A 16 ARG H H 1 9.16 0.02 A 16 ARG HA H 1 5.11 0.02 A 16 ARG HBx H 1 1.89 0.02 A 16 ARG HBy H 1 1.92 0.02 A 16 ARG HDx H 1 3.21 0.02 A 16 ARG HDy H 1 3.21 0.02 A 16 ARG HE H 1 7.50 0.02 A 16 ARG HGx H 1 1.70 0.02 A 16 ARG HGy H 1 1.70 0.02 A 16 ARG C C 13 174.4 0.2 A 16 ARG CA C 13 54.9 0.2 A 16 ARG CB C 13 34.7 0.2 A 16 ARG CD C 13 44.0 0.2 A 16 ARG CG C 13 27.2 0.2 A 16 ARG N N 15 122.5 0.2 A 16 ARG NE N 15 84.2 0.2 A 17 GLY H H 1 7.95 0.02 A 17 GLY HAx H 1 3.65 0.02 A 17 GLY HAy H 1 4.60 0.02 A 17 GLY C C 13 174.6 0.2 A 17 GLY CA C 13 45.1 0.2 A 17 GLY N N 15 110.3 0.2 A 18 LEU H H 1 8.50 0.02 A 18 LEU HA H 1 4.09 0.02 A 18 LEU HBx H 1 1.28 0.02 A 18 LEU HBy H 1 1.46 0.02 A 18 LEU HDx% H 1 0.63 0.02 A 18 LEU HDy% H 1 0.62 0.02 A 18 LEU HG H 1 1.47 0.02 A 18 LEU CA C 13 53.0 0.2 A 18 LEU CB C 13 40.7 0.2 A 18 LEU CDy C 13 26.3 0.2 A 18 LEU CDx C 13 22.8 0.2 A 18 LEU CG C 13 26.9 0.2 A 18 LEU N N 15 118.9 0.2 A 19 PRO HA H 1 4.35 0.02 A 19 PRO HBx H 1 1.77 0.02 A 19 PRO HBy H 1 2.26 0.02 A 19 PRO HDx H 1 3.42 0.02 A 19 PRO HDy H 1 3.65 0.02 A 19 PRO HGx H 1 1.91 0.02 A 19 PRO HGy H 1 1.91 0.02 A 19 PRO C C 13 178.1 0.2 A 19 PRO CA C 13 62.5 0.2 A 19 PRO CB C 13 32.0 0.2 A 19 PRO CD C 13 50.5 0.2 A 19 PRO CG C 13 27.6 0.2 A 20 TRP H H 1 8.40 0.02 A 20 TRP HA H 1 4.24 0.02 A 20 TRP HBx H 1 3.22 0.02 A 20 TRP HBy H 1 3.31 0.02 A 20 TRP HD1 H 1 7.22 0.02 A 20 TRP HE1 H 1 10.08 0.02 A 20 TRP HE3 H 1 7.50 0.02 A 20 TRP HH2 H 1 7.22 0.02 A 20 TRP HZ2 H 1 7.50 0.02 A 20 TRP HZ3 H 1 7.11 0.02 A 20 TRP C C 13 176.9 0.2 A 20 TRP CA C 13 59.0 0.2 A 20 TRP CB C 13 28.3 0.2 A 20 TRP CD1 C 13 126.6 0.2 A 20 TRP CE3 C 13 120.7 0.2 A 20 TRP CH2 C 13 124.7 0.2 A 20 TRP CZ2 C 13 114.6 0.2 A 20 TRP CZ3 C 13 122.1 0.2 A 20 TRP N N 15 123.7 0.2 A 20 TRP NE1 N 15 129.3 0.2 A 21 SER H H 1 7.36 0.02 A 21 SER HA H 1 4.06 0.02 A 21 SER HBx H 1 3.10 0.02 A 21 SER HBy H 1 3.74 0.02 A 21 SER C C 13 174.1 0.2 A 21 SER CA C 13 57.2 0.2 A 21 SER CB C 13 62.8 0.2 A 21 SER N N 15 111.2 0.2 A 22 CYS H H 1 7.35 0.02 A 22 CYS HA H 1 4.44 0.02 A 22 CYS HBx H 1 2.74 0.02 A 22 CYS HBy H 1 2.83 0.02 A 22 CYS C C 13 173.3 0.2 A 22 CYS CA C 13 59.5 0.2 A 22 CYS CB C 13 28.0 0.2 A 22 CYS N N 15 121.5 0.2 A 23 SER H H 1 8.62 0.02 A 23 SER HA H 1 4.85 0.02 A 23 SER HBx H 1 4.04 0.02 A 23 SER HBy H 1 4.41 0.02 A 23 SER C C 13 176.1 0.2 A 23 SER CA C 13 56.3 0.2 A 23 SER CB C 13 66.7 0.2 A 23 SER N N 15 120.6 0.2 A 24 ALA H H 1 9.56 0.02 A 24 ALA HA H 1 4.18 0.02 A 24 ALA HB% H 1 1.73 0.02 A 24 ALA C C 13 179.5 0.2 A 24 ALA CA C 13 56.3 0.2 A 24 ALA CB C 13 18.3 0.2 A 24 ALA N N 15 124.0 0.2 A 25 ASP H H 1 8.52 0.02 A 25 ASP HA H 1 4.43 0.02 A 25 ASP HBx H 1 2.65 0.02 A 25 ASP HBy H 1 2.65 0.02 A 25 ASP C C 13 178.5 0.2 A 25 ASP CA C 13 57.4 0.2 A 25 ASP CB C 13 40.8 0.2 A 25 ASP N N 15 116.6 0.2 A 26 GLU H H 1 7.79 0.02 A 26 GLU HA H 1 3.94 0.02 A 26 GLU HBx H 1 2.01 0.02 A 26 GLU HBy H 1 2.44 0.02 A 26 GLU HGx H 1 2.29 0.02 A 26 GLU HGy H 1 2.35 0.02 A 26 GLU C C 13 179.8 0.2 A 26 GLU CA C 13 59.7 0.2 A 26 GLU CB C 13 30.1 0.2 A 26 GLU CG C 13 37.6 0.2 A 26 GLU N N 15 119.5 0.2 A 27 VAL H H 1 7.81 0.02 A 27 VAL HA H 1 3.55 0.02 A 27 VAL HB H 1 2.36 0.02 A 27 VAL HGx% H 1 0.97 0.02 A 27 VAL HGy% H 1 1.05 0.02 A 27 VAL C C 13 177.5 0.2 A 27 VAL CA C 13 67.1 0.2 A 27 VAL CB C 13 31.4 0.2 A 27 VAL CGx C 13 22.4 0.2 A 27 VAL CGy C 13 24.4 0.2 A 27 VAL N N 15 121.1 0.2 A 28 GLN H H 1 8.53 0.02 A 28 GLN HA H 1 3.88 0.02 A 28 GLN HBx H 1 2.08 0.02 A 28 GLN HBy H 1 2.24 0.02 A 28 GLN HE21 H 1 7.36 0.02 A 28 GLN HE22 H 1 6.73 0.02 A 28 GLN HGx H 1 2.20 0.02 A 28 GLN HGy H 1 2.37 0.02 A 28 GLN C C 13 178.1 0.2 A 28 GLN CA C 13 60.1 0.2 A 28 GLN CB C 13 29.0 0.2 A 28 GLN CD C 13 179.1 0.2 A 28 GLN CG C 13 35.0 0.2 A 28 GLN N N 15 119.7 0.2 A 28 GLN NE2 N 15 109.8 0.2 A 29 ARG H H 1 7.87 0.02 A 29 ARG HA H 1 4.05 0.02 A 29 ARG HBx H 1 1.90 0.02 A 29 ARG HBy H 1 1.90 0.02 A 29 ARG HDx H 1 3.18 0.02 A 29 ARG HDy H 1 3.26 0.02 A 29 ARG HGx H 1 1.66 0.02 A 29 ARG HGy H 1 1.84 0.02 A 29 ARG C C 13 179.0 0.2 A 29 ARG CA C 13 58.8 0.2 A 29 ARG CB C 13 30.2 0.2 A 29 ARG CD C 13 43.5 0.2 A 29 ARG CG C 13 28.2 0.2 A 29 ARG N N 15 116.8 0.2 A 30 PHE H H 1 7.90 0.02 A 30 PHE HA H 1 4.23 0.02 A 30 PHE HBx H 1 3.01 0.02 A 30 PHE HBy H 1 3.09 0.02 A 30 PHE HDx H 1 6.38 0.02 A 30 PHE HDy H 1 6.38 0.02 A 30 PHE HEx H 1 6.71 0.02 A 30 PHE HEy H 1 6.71 0.02 A 30 PHE HZ H 1 7.01 0.02 A 30 PHE C C 13 177.1 0.2 A 30 PHE CA C 13 61.2 0.2 A 30 PHE CB C 13 39.1 0.2 A 30 PHE CDy C 13 131.3 0.2 A 30 PHE CDx C 13 131.2 0.2 A 30 PHE CEx C 13 131.2 0.2 A 30 PHE CEy C 13 131.2 0.2 A 30 PHE CZ C 13 130.1 0.2 A 30 PHE N N 15 122.9 0.2 A 31 PHE H H 1 7.63 0.02 A 31 PHE HA H 1 4.70 0.02 A 31 PHE HBx H 1 2.70 0.02 A 31 PHE HBy H 1 3.49 0.02 A 31 PHE HDx H 1 7.40 0.02 A 31 PHE HDy H 1 7.40 0.02 A 31 PHE HEx H 1 7.31 0.02 A 31 PHE HEy H 1 7.31 0.02 A 31 PHE HZ H 1 7.10 0.02 A 31 PHE C C 13 177.6 0.2 A 31 PHE CA C 13 57.0 0.2 A 31 PHE CB C 13 37.7 0.2 A 31 PHE CDx C 13 131.9 0.2 A 31 PHE CDy C 13 131.9 0.2 A 31 PHE CEx C 13 130.6 0.2 A 31 PHE CEy C 13 130.6 0.2 A 31 PHE CZ C 13 128.4 0.2 A 31 PHE N N 15 117.0 0.2 A 32 SER H H 1 7.00 0.02 A 32 SER HA H 1 4.13 0.02 A 32 SER HBx H 1 4.00 0.02 A 32 SER HBy H 1 4.27 0.02 A 32 SER C C 13 175.1 0.2 A 32 SER CA C 13 62.0 0.2 A 32 SER CB C 13 63.0 0.2 A 32 SER N N 15 113.9 0.2 A 33 ASP H H 1 8.85 0.02 A 33 ASP HA H 1 4.59 0.02 A 33 ASP HBx H 1 2.76 0.02 A 33 ASP HBy H 1 2.76 0.02 A 33 ASP C C 13 175.4 0.2 A 33 ASP CA C 13 54.2 0.2 A 33 ASP CB C 13 40.1 0.2 A 33 ASP N N 15 118.8 0.2 A 34 CYS H H 1 8.04 0.02 A 34 CYS HA H 1 4.79 0.02 A 34 CYS HBx H 1 2.60 0.02 A 34 CYS HBy H 1 2.95 0.02 A 34 CYS C C 13 174.4 0.2 A 34 CYS CA C 13 58.0 0.2 A 34 CYS CB C 13 30.7 0.2 A 34 CYS N N 15 116.9 0.2 A 35 LYS H H 1 9.25 0.02 A 35 LYS HA H 1 4.39 0.02 A 35 LYS HBx H 1 1.52 0.02 A 35 LYS HBy H 1 1.60 0.02 A 35 LYS HDx H 1 1.54 0.02 A 35 LYS HDy H 1 1.64 0.02 A 35 LYS HEx H 1 2.96 0.02 A 35 LYS HEy H 1 2.96 0.02 A 35 LYS HGx H 1 1.28 0.02 A 35 LYS HGy H 1 1.43 0.02 A 35 LYS C C 13 174.8 0.2 A 35 LYS CA C 13 55.5 0.2 A 35 LYS CB C 13 31.2 0.2 A 35 LYS CD C 13 29.0 0.2 A 35 LYS CE C 13 42.1 0.2 A 35 LYS CG C 13 24.5 0.2 A 35 LYS N N 15 124.5 0.2 A 36 ILE H H 1 8.16 0.02 A 36 ILE HA H 1 4.05 0.02 A 36 ILE HB H 1 1.64 0.02 A 36 ILE HD1% H 1 0.77 0.02 A 36 ILE HG1x H 1 0.64 0.02 A 36 ILE HG1y H 1 1.54 0.02 A 36 ILE HG2% H 1 0.98 0.02 A 36 ILE C C 13 177.8 0.2 A 36 ILE CA C 13 61.6 0.2 A 36 ILE CB C 13 38.8 0.2 A 36 ILE CD1 C 13 14.1 0.2 A 36 ILE CG1 C 13 28.1 0.2 A 36 ILE CG2 C 13 17.3 0.2 A 36 ILE N N 15 127.5 0.2 A 37 GLN H H 1 8.93 0.02 A 37 GLN HA H 1 4.05 0.02 A 37 GLN HBx H 1 1.48 0.02 A 37 GLN HBy H 1 1.76 0.02 A 37 GLN HE21 H 1 7.32 0.02 A 37 GLN HE22 H 1 6.76 0.02 A 37 GLN HGx H 1 2.07 0.02 A 37 GLN HGy H 1 2.23 0.02 A 37 GLN C C 13 175.2 0.2 A 37 GLN CA C 13 56.9 0.2 A 37 GLN CB C 13 29.2 0.2 A 37 GLN CD C 13 179.6 0.2 A 37 GLN CG C 13 33.4 0.2 A 37 GLN N N 15 131.7 0.2 A 37 GLN NE2 N 15 111.2 0.2 A 38 ASN H H 1 9.21 0.02 A 38 ASN HA H 1 4.29 0.02 A 38 ASN HBx H 1 2.84 0.02 A 38 ASN HBy H 1 2.96 0.02 A 38 ASN HD21 H 1 7.66 0.02 A 38 ASN HD22 H 1 6.95 0.02 A 38 ASN C C 13 176.1 0.2 A 38 ASN CA C 13 54.4 0.2 A 38 ASN CB C 13 37.5 0.2 A 38 ASN CG C 13 178.3 0.2 A 38 ASN N N 15 120.1 0.2 A 38 ASN ND2 N 15 114.6 0.2 A 39 GLY H H 1 7.98 0.02 A 39 GLY HAx H 1 3.51 0.02 A 39 GLY HAy H 1 3.86 0.02 A 39 GLY C C 13 174.7 0.2 A 39 GLY CA C 13 46.7 0.2 A 39 GLY N N 15 108.2 0.2 A 40 ALA H H 1 8.81 0.02 A 40 ALA HA H 1 3.85 0.02 A 40 ALA HB% H 1 1.45 0.02 A 40 ALA C C 13 179.3 0.2 A 40 ALA CA C 13 54.9 0.2 A 40 ALA CB C 13 18.1 0.2 A 40 ALA N N 15 126.7 0.2 A 41 GLN H H 1 7.62 0.02 A 41 GLN HA H 1 4.24 0.02 A 41 GLN HBx H 1 2.15 0.02 A 41 GLN HBy H 1 2.25 0.02 A 41 GLN HE21 H 1 7.62 0.02 A 41 GLN HE22 H 1 6.90 0.02 A 41 GLN HGx H 1 2.48 0.02 A 41 GLN HGy H 1 2.52 0.02 A 41 GLN C C 13 177.2 0.2 A 41 GLN CA C 13 57.4 0.2 A 41 GLN CB C 13 28.7 0.2 A 41 GLN CD C 13 180.4 0.2 A 41 GLN CG C 13 35.0 0.2 A 41 GLN N N 15 113.3 0.2 A 41 GLN NE2 N 15 112.4 0.2 A 42 GLY H H 1 8.20 0.02 A 42 GLY HAx H 1 4.14 0.02 A 42 GLY HAy H 1 4.40 0.02 A 42 GLY C C 13 172.4 0.2 A 42 GLY CA C 13 45.7 0.2 A 42 GLY N N 15 109.3 0.2 A 43 ILE H H 1 7.04 0.02 A 43 ILE HA H 1 4.46 0.02 A 43 ILE HB H 1 1.88 0.02 A 43 ILE HD1% H 1 0.91 0.02 A 43 ILE HG1x H 1 0.96 0.02 A 43 ILE HG1y H 1 1.60 0.02 A 43 ILE HG2% H 1 0.22 0.02 A 43 ILE C C 13 174.6 0.2 A 43 ILE CA C 13 60.0 0.2 A 43 ILE CB C 13 38.2 0.2 A 43 ILE CD1 C 13 15.3 0.2 A 43 ILE CG1 C 13 28.1 0.2 A 43 ILE CG2 C 13 17.4 0.2 A 43 ILE N N 15 119.7 0.2 A 44 ARG H H 1 9.14 0.02 A 44 ARG HA H 1 4.80 0.02 A 44 ARG HBx H 1 1.89 0.02 A 44 ARG HBy H 1 1.95 0.02 A 44 ARG HDx H 1 3.15 0.02 A 44 ARG HDy H 1 3.21 0.02 A 44 ARG HE H 1 7.37 0.02 A 44 ARG HGx H 1 1.59 0.02 A 44 ARG HGy H 1 1.70 0.02 A 44 ARG C C 13 175.4 0.2 A 44 ARG CA C 13 53.0 0.2 A 44 ARG CB C 13 30.7 0.2 A 44 ARG CD C 13 43.1 0.2 A 44 ARG CG C 13 26.8 0.2 A 44 ARG N N 15 127.0 0.2 A 44 ARG NE N 15 85.1 0.2 A 45 PHE H H 1 8.54 0.02 A 45 PHE HA H 1 4.34 0.02 A 45 PHE HBx H 1 2.72 0.02 A 45 PHE HBy H 1 2.82 0.02 A 45 PHE HDx H 1 7.32 0.02 A 45 PHE HDy H 1 7.32 0.02 A 45 PHE HEx H 1 7.10 0.02 A 45 PHE HEy H 1 7.10 0.02 A 45 PHE HZ H 1 6.75 0.02 A 45 PHE C C 13 173.9 0.2 A 45 PHE CA C 13 59.7 0.2 A 45 PHE CB C 13 39.4 0.2 A 45 PHE CDx C 13 131.7 0.2 A 45 PHE CDy C 13 131.7 0.2 A 45 PHE CEx C 13 130.8 0.2 A 45 PHE CEy C 13 130.8 0.2 A 45 PHE CZ C 13 128.8 0.2 A 45 PHE N N 15 123.1 0.2 A 46 ILE H H 1 7.55 0.02 A 46 ILE HA H 1 4.46 0.02 A 46 ILE HB H 1 1.64 0.02 A 46 ILE HD1% H 1 0.60 0.02 A 46 ILE HG1x H 1 1.14 0.02 A 46 ILE HG1y H 1 1.49 0.02 A 46 ILE HG2% H 1 0.94 0.02 A 46 ILE C C 13 176.6 0.2 A 46 ILE CA C 13 59.5 0.2 A 46 ILE CB C 13 38.0 0.2 A 46 ILE CD1 C 13 12.8 0.2 A 46 ILE CG1 C 13 27.6 0.2 A 46 ILE CG2 C 13 17.8 0.2 A 46 ILE N N 15 119.5 0.2 A 47 TYR H H 1 9.59 0.02 A 47 TYR HA H 1 5.16 0.02 A 47 TYR HBx H 1 2.84 0.02 A 47 TYR HBy H 1 2.92 0.02 A 47 TYR HDx H 1 6.90 0.02 A 47 TYR HDy H 1 6.90 0.02 A 47 TYR HEx H 1 6.79 0.02 A 47 TYR HEy H 1 6.79 0.02 A 47 TYR C C 13 176.8 0.2 A 47 TYR CA C 13 57.6 0.2 A 47 TYR CB C 13 41.5 0.2 A 47 TYR CDx C 13 132.9 0.2 A 47 TYR CDy C 13 132.9 0.2 A 47 TYR CEx C 13 118.1 0.2 A 47 TYR CEy C 13 118.1 0.2 A 47 TYR N N 15 129.9 0.2 A 48 THR H H 1 9.40 0.02 A 48 THR HA H 1 4.61 0.02 A 48 THR HB H 1 4.82 0.02 A 48 THR HG2% H 1 1.25 0.02 A 48 THR C C 13 177.3 0.2 A 48 THR CA C 13 60.6 0.2 A 48 THR CB C 13 71.8 0.2 A 48 THR CG2 C 13 21.6 0.2 A 48 THR N N 15 111.1 0.2 A 49 ARG H H 1 9.11 0.02 A 49 ARG HA H 1 3.91 0.02 A 49 ARG HBx H 1 1.86 0.02 A 49 ARG HBy H 1 1.91 0.02 A 49 ARG HDx H 1 3.22 0.02 A 49 ARG HDy H 1 3.22 0.02 A 49 ARG HE H 1 7.23 0.02 A 49 ARG HGx H 1 1.70 0.02 A 49 ARG HGy H 1 1.70 0.02 A 49 ARG C C 13 176.9 0.2 A 49 ARG CA C 13 58.7 0.2 A 49 ARG CB C 13 29.6 0.2 A 49 ARG CD C 13 43.2 0.2 A 49 ARG CG C 13 27.5 0.2 A 49 ARG N N 15 121.4 0.2 A 50 GLU H H 1 7.78 0.02 A 50 GLU HA H 1 4.32 0.02 A 50 GLU HBx H 1 1.84 0.02 A 50 GLU HBy H 1 2.20 0.02 A 50 GLU HGx H 1 2.21 0.02 A 50 GLU HGy H 1 2.35 0.02 A 50 GLU C C 13 176.7 0.2 A 50 GLU CA C 13 56.7 0.2 A 50 GLU CB C 13 29.4 0.2 A 50 GLU CG C 13 36.9 0.2 A 50 GLU N N 15 114.3 0.2 A 51 GLY H H 1 8.24 0.02 A 51 GLY HAx H 1 3.56 0.02 A 51 GLY HAy H 1 4.21 0.02 A 51 GLY C C 13 173.7 0.2 A 51 GLY CA C 13 45.5 0.2 A 51 GLY N N 15 107.5 0.2 A 52 ARG H H 1 7.31 0.02 A 52 ARG HA H 1 4.87 0.02 A 52 ARG HBx H 1 1.62 0.02 A 52 ARG HBy H 1 1.79 0.02 A 52 ARG HDx H 1 3.00 0.02 A 52 ARG HDy H 1 3.00 0.02 A 52 ARG HGx H 1 1.54 0.02 A 52 ARG HGy H 1 1.54 0.02 A 52 ARG CA C 13 53.2 0.2 A 52 ARG CB C 13 30.2 0.2 A 52 ARG CD C 13 43.2 0.2 A 52 ARG CG C 13 27.2 0.2 A 52 ARG N N 15 119.1 0.2 A 53 PRO HA H 1 4.22 0.02 A 53 PRO HBx H 1 1.88 0.02 A 53 PRO HBy H 1 2.23 0.02 A 53 PRO HDx H 1 3.48 0.02 A 53 PRO HDy H 1 3.97 0.02 A 53 PRO HGx H 1 1.89 0.02 A 53 PRO HGy H 1 2.19 0.02 A 53 PRO C C 13 176.9 0.2 A 53 PRO CA C 13 63.9 0.2 A 53 PRO CB C 13 32.2 0.2 A 53 PRO CD C 13 50.6 0.2 A 53 PRO CG C 13 28.3 0.2 A 54 SER H H 1 8.62 0.02 A 54 SER HA H 1 4.26 0.02 A 54 SER HBx H 1 3.61 0.02 A 54 SER HBy H 1 4.09 0.02 A 54 SER C C 13 176.3 0.2 A 54 SER CA C 13 59.5 0.2 A 54 SER CB C 13 66.1 0.2 A 54 SER N N 15 117.4 0.2 A 55 GLY H H 1 9.00 0.02 A 55 GLY HAx H 1 3.79 0.02 A 55 GLY HAy H 1 4.56 0.02 A 55 GLY C C 13 172.2 0.2 A 55 GLY CA C 13 45.6 0.2 A 55 GLY N N 15 113.1 0.2 A 56 GLU H H 1 7.89 0.02 A 56 GLU HA H 1 5.64 0.02 A 56 GLU HBx H 1 1.84 0.02 A 56 GLU HBy H 1 1.84 0.02 A 56 GLU HGx H 1 2.07 0.02 A 56 GLU HGy H 1 2.19 0.02 A 56 GLU C C 13 176.5 0.2 A 56 GLU CA C 13 53.5 0.2 A 56 GLU CB C 13 33.9 0.2 A 56 GLU CG C 13 36.9 0.2 A 56 GLU N N 15 117.8 0.2 A 57 ALA H H 1 8.66 0.02 A 57 ALA HA H 1 4.86 0.02 A 57 ALA HB% H 1 0.80 0.02 A 57 ALA C C 13 174.8 0.2 A 57 ALA CA C 13 51.3 0.2 A 57 ALA CB C 13 22.6 0.2 A 57 ALA N N 15 121.9 0.2 A 58 PHE H H 1 8.90 0.02 A 58 PHE HA H 1 5.37 0.02 A 58 PHE HBx H 1 2.67 0.02 A 58 PHE HBy H 1 3.01 0.02 A 58 PHE HDx H 1 7.09 0.02 A 58 PHE HDy H 1 7.09 0.02 A 58 PHE HEx H 1 7.35 0.02 A 58 PHE HEy H 1 7.35 0.02 A 58 PHE HZ H 1 7.10 0.02 A 58 PHE C C 13 174.7 0.2 A 58 PHE CA C 13 57.4 0.2 A 58 PHE CB C 13 42.7 0.2 A 58 PHE CDx C 13 131.4 0.2 A 58 PHE CDy C 13 131.4 0.2 A 58 PHE CEx C 13 131.6 0.2 A 58 PHE CEy C 13 131.6 0.2 A 58 PHE CZ C 13 129.0 0.2 A 58 PHE N N 15 117.1 0.2 A 59 VAL H H 1 9.07 0.02 A 59 VAL HA H 1 4.71 0.02 A 59 VAL HB H 1 1.59 0.02 A 59 VAL HGx% H 1 0.44 0.02 A 59 VAL HGy% H 1 0.57 0.02 A 59 VAL C C 13 174.2 0.2 A 59 VAL CA C 13 61.1 0.2 A 59 VAL CB C 13 34.0 0.2 A 59 VAL CGy C 13 21.6 0.2 A 59 VAL CGx C 13 20.6 0.2 A 59 VAL N N 15 121.2 0.2 A 60 GLU H H 1 8.89 0.02 A 60 GLU HA H 1 4.75 0.02 A 60 GLU HBx H 1 2.07 0.02 A 60 GLU HBy H 1 2.07 0.02 A 60 GLU HGx H 1 2.09 0.02 A 60 GLU HGy H 1 2.36 0.02 A 60 GLU C C 13 175.5 0.2 A 60 GLU CA C 13 55.9 0.2 A 60 GLU CB C 13 31.9 0.2 A 60 GLU CG C 13 37.6 0.2 A 60 GLU N N 15 127.2 0.2 A 61 LEU H H 1 9.10 0.02 A 61 LEU HA H 1 5.01 0.02 A 61 LEU HBx H 1 1.49 0.02 A 61 LEU HBy H 1 1.74 0.02 A 61 LEU HDx% H 1 0.61 0.02 A 61 LEU HDy% H 1 0.62 0.02 A 61 LEU HG H 1 1.49 0.02 A 61 LEU C C 13 177.7 0.2 A 61 LEU CA C 13 53.6 0.2 A 61 LEU CB C 13 44.4 0.2 A 61 LEU CDy C 13 27.2 0.2 A 61 LEU CDx C 13 25.4 0.2 A 61 LEU CG C 13 27.6 0.2 A 61 LEU N N 15 124.4 0.2 A 62 GLU H H 1 7.84 0.02 A 62 GLU HA H 1 4.24 0.02 A 62 GLU HBx H 1 1.77 0.02 A 62 GLU HBy H 1 2.14 0.02 A 62 GLU HGx H 1 2.16 0.02 A 62 GLU HGy H 1 2.22 0.02 A 62 GLU C C 13 176.2 0.2 A 62 GLU CA C 13 59.2 0.2 A 62 GLU CB C 13 31.9 0.2 A 62 GLU CG C 13 37.1 0.2 A 62 GLU N N 15 114.3 0.2 A 63 SER H H 1 6.98 0.02 A 63 SER HA H 1 3.55 0.02 A 63 SER HBx H 1 3.75 0.02 A 63 SER HBy H 1 3.92 0.02 A 63 SER C C 13 173.7 0.2 A 63 SER CA C 13 56.7 0.2 A 63 SER CB C 13 66.2 0.2 A 63 SER N N 15 107.8 0.2 A 64 GLU H H 1 8.37 0.02 A 64 GLU HA H 1 3.75 0.02 A 64 GLU HBx H 1 1.90 0.02 A 64 GLU HBy H 1 2.06 0.02 A 64 GLU HGx H 1 2.33 0.02 A 64 GLU HGy H 1 2.33 0.02 A 64 GLU C C 13 178.5 0.2 A 64 GLU CA C 13 58.9 0.2 A 64 GLU CB C 13 29.5 0.2 A 64 GLU CG C 13 36.1 0.2 A 64 GLU N N 15 121.5 0.2 A 65 ASP H H 1 8.01 0.02 A 65 ASP HA H 1 4.30 0.02 A 65 ASP HBx H 1 2.45 0.02 A 65 ASP HBy H 1 2.58 0.02 A 65 ASP C C 13 179.0 0.2 A 65 ASP CA C 13 57.4 0.2 A 65 ASP CB C 13 40.1 0.2 A 65 ASP N N 15 119.3 0.2 A 66 GLU H H 1 7.33 0.02 A 66 GLU HA H 1 4.14 0.02 A 66 GLU HBx H 1 2.09 0.02 A 66 GLU HBy H 1 2.28 0.02 A 66 GLU HGx H 1 2.55 0.02 A 66 GLU HGy H 1 2.55 0.02 A 66 GLU C C 13 178.4 0.2 A 66 GLU CA C 13 57.8 0.2 A 66 GLU CB C 13 30.8 0.2 A 66 GLU CG C 13 35.9 0.2 A 66 GLU N N 15 117.4 0.2 A 67 VAL H H 1 7.40 0.02 A 67 VAL HA H 1 3.34 0.02 A 67 VAL HB H 1 2.49 0.02 A 67 VAL HGx% H 1 0.92 0.02 A 67 VAL HGy% H 1 1.13 0.02 A 67 VAL C C 13 177.2 0.2 A 67 VAL CA C 13 66.7 0.2 A 67 VAL CB C 13 31.2 0.2 A 67 VAL CGx C 13 21.0 0.2 A 67 VAL CGy C 13 23.9 0.2 A 67 VAL N N 15 120.0 0.2 A 68 LYS H H 1 7.65 0.02 A 68 LYS HA H 1 3.86 0.02 A 68 LYS HBx H 1 1.87 0.02 A 68 LYS HBy H 1 1.93 0.02 A 68 LYS HDx H 1 1.72 0.02 A 68 LYS HDy H 1 1.72 0.02 A 68 LYS HEx H 1 2.97 0.02 A 68 LYS HEy H 1 2.97 0.02 A 68 LYS HGx H 1 1.44 0.02 A 68 LYS HGy H 1 1.68 0.02 A 68 LYS C C 13 179.5 0.2 A 68 LYS CA C 13 60.2 0.2 A 68 LYS CB C 13 32.2 0.2 A 68 LYS CD C 13 29.4 0.2 A 68 LYS CE C 13 42.0 0.2 A 68 LYS CG C 13 25.9 0.2 A 68 LYS N N 15 116.8 0.2 A 69 LEU H H 1 7.22 0.02 A 69 LEU HA H 1 3.99 0.02 A 69 LEU HBx H 1 1.46 0.02 A 69 LEU HBy H 1 1.91 0.02 A 69 LEU HDx% H 1 0.90 0.02 A 69 LEU HDy% H 1 0.82 0.02 A 69 LEU HG H 1 1.68 0.02 A 69 LEU C C 13 179.8 0.2 A 69 LEU CA C 13 57.6 0.2 A 69 LEU CB C 13 42.3 0.2 A 69 LEU CDy C 13 25.2 0.2 A 69 LEU CDx C 13 23.4 0.2 A 69 LEU CG C 13 26.7 0.2 A 69 LEU N N 15 118.3 0.2 A 70 ALA H H 1 8.35 0.02 A 70 ALA HA H 1 4.11 0.02 A 70 ALA HB% H 1 1.30 0.02 A 70 ALA C C 13 180.1 0.2 A 70 ALA CA C 13 55.4 0.2 A 70 ALA CB C 13 18.7 0.2 A 70 ALA N N 15 124.6 0.2 A 71 LEU H H 1 8.31 0.02 A 71 LEU HA H 1 3.88 0.02 A 71 LEU HBx H 1 1.56 0.02 A 71 LEU HBy H 1 1.87 0.02 A 71 LEU HDx% H 1 0.90 0.02 A 71 LEU HDy% H 1 0.78 0.02 A 71 LEU HG H 1 1.90 0.02 A 71 LEU C C 13 179.9 0.2 A 71 LEU CA C 13 57.4 0.2 A 71 LEU CB C 13 41.4 0.2 A 71 LEU CDy C 13 26.4 0.2 A 71 LEU CDx C 13 22.7 0.2 A 71 LEU CG C 13 26.9 0.2 A 71 LEU N N 15 116.0 0.2 A 72 LYS H H 1 7.37 0.02 A 72 LYS HA H 1 4.20 0.02 A 72 LYS HBx H 1 1.98 0.02 A 72 LYS HBy H 1 1.98 0.02 A 72 LYS HDx H 1 1.73 0.02 A 72 LYS HDy H 1 1.73 0.02 A 72 LYS HEx H 1 3.00 0.02 A 72 LYS HEy H 1 3.00 0.02 A 72 LYS HGx H 1 1.56 0.02 A 72 LYS HGy H 1 1.81 0.02 A 72 LYS C C 13 177.5 0.2 A 72 LYS CA C 13 58.0 0.2 A 72 LYS CB C 13 32.0 0.2 A 72 LYS CD C 13 29.2 0.2 A 72 LYS CE C 13 41.8 0.2 A 72 LYS CG C 13 25.2 0.2 A 72 LYS N N 15 117.9 0.2 A 73 LYS H H 1 7.74 0.02 A 73 LYS HA H 1 4.11 0.02 A 73 LYS HBx H 1 1.79 0.02 A 73 LYS HBy H 1 1.96 0.02 A 73 LYS HDx H 1 1.10 0.02 A 73 LYS HDy H 1 1.24 0.02 A 73 LYS HEx H 1 2.43 0.02 A 73 LYS HEy H 1 2.62 0.02 A 73 LYS HGx H 1 1.15 0.02 A 73 LYS HGy H 1 1.32 0.02 A 73 LYS C C 13 175.2 0.2 A 73 LYS CA C 13 55.1 0.2 A 73 LYS CB C 13 31.1 0.2 A 73 LYS CD C 13 27.4 0.2 A 73 LYS CE C 13 42.1 0.2 A 73 LYS CG C 13 24.4 0.2 A 73 LYS N N 15 117.1 0.2 A 74 ASP H H 1 7.25 0.02 A 74 ASP HA H 1 4.29 0.02 A 74 ASP HBx H 1 2.62 0.02 A 74 ASP HBy H 1 2.94 0.02 A 74 ASP C C 13 176.4 0.2 A 74 ASP CA C 13 57.4 0.2 A 74 ASP CB C 13 42.3 0.2 A 74 ASP N N 15 117.1 0.2 A 75 ARG H H 1 9.18 0.02 A 75 ARG HA H 1 3.69 0.02 A 75 ARG HBx H 1 2.02 0.02 A 75 ARG HBy H 1 2.07 0.02 A 75 ARG HDx H 1 3.03 0.02 A 75 ARG HDy H 1 3.03 0.02 A 75 ARG HE H 1 7.22 0.02 A 75 ARG HGx H 1 1.41 0.02 A 75 ARG HGy H 1 1.61 0.02 A 75 ARG C C 13 176.1 0.2 A 75 ARG CA C 13 58.8 0.2 A 75 ARG CB C 13 26.9 0.2 A 75 ARG CD C 13 43.2 0.2 A 75 ARG CG C 13 28.5 0.2 A 75 ARG N N 15 121.1 0.2 A 75 ARG NE N 15 85.1 0.2 A 76 GLU H H 1 8.08 0.02 A 76 GLU HA H 1 4.56 0.02 A 76 GLU HBx H 1 2.25 0.02 A 76 GLU HBy H 1 2.25 0.02 A 76 GLU HGx H 1 2.20 0.02 A 76 GLU HGy H 1 2.33 0.02 A 76 GLU C C 13 175.7 0.2 A 76 GLU CA C 13 56.7 0.2 A 76 GLU CB C 13 30.0 0.2 A 76 GLU CG C 13 37.3 0.2 A 76 GLU N N 15 118.9 0.2 A 77 THR H H 1 8.19 0.02 A 77 THR HA H 1 4.86 0.02 A 77 THR HB H 1 3.83 0.02 A 77 THR HG2% H 1 0.77 0.02 A 77 THR C C 13 175.0 0.2 A 77 THR CA C 13 61.1 0.2 A 77 THR CB C 13 71.0 0.2 A 77 THR CG2 C 13 21.5 0.2 A 77 THR N N 15 110.2 0.2 A 78 MET H H 1 8.50 0.02 A 78 MET HA H 1 4.39 0.02 A 78 MET HBx H 1 1.38 0.02 A 78 MET HBy H 1 1.62 0.02 A 78 MET HE% H 1 1.60 0.02 A 78 MET HGx H 1 2.06 0.02 A 78 MET HGy H 1 2.21 0.02 A 78 MET C C 13 176.0 0.2 A 78 MET CA C 13 55.4 0.2 A 78 MET CB C 13 35.0 0.2 A 78 MET CE C 13 17.0 0.2 A 78 MET CG C 13 32.0 0.2 A 78 MET N N 15 123.9 0.2 A 79 GLY H H 1 8.91 0.02 A 79 GLY HAx H 1 3.57 0.02 A 79 GLY HAy H 1 3.84 0.02 A 79 GLY CA C 13 47.2 0.2 A 79 GLY N N 15 116.3 0.2 A 80 HIS HA H 1 4.46 0.02 A 80 HIS HBx H 1 3.16 0.02 A 80 HIS HBy H 1 3.25 0.02 A 80 HIS HD2 H 1 7.02 0.02 A 80 HIS HE1 H 1 7.45 0.02 A 80 HIS C C 13 174.2 0.2 A 80 HIS CA C 13 56.2 0.2 A 80 HIS CB C 13 29.5 0.2 A 80 HIS CD2 C 13 119.8 0.2 A 80 HIS CE1 C 13 135.0 0.2 A 81 ARG H H 1 7.65 0.02 A 81 ARG HA H 1 4.48 0.02 A 81 ARG HBx H 1 1.74 0.02 A 81 ARG HBy H 1 1.91 0.02 A 81 ARG HDx H 1 3.08 0.02 A 81 ARG HDy H 1 3.08 0.02 A 81 ARG HGx H 1 1.43 0.02 A 81 ARG HGy H 1 1.48 0.02 A 81 ARG C C 13 174.7 0.2 A 81 ARG CA C 13 54.6 0.2 A 81 ARG CB C 13 31.7 0.2 A 81 ARG CD C 13 43.0 0.2 A 81 ARG CG C 13 26.7 0.2 A 81 ARG N N 15 119.8 0.2 A 82 TYR H H 1 8.07 0.02 A 82 TYR HA H 1 4.57 0.02 A 82 TYR HBx H 1 2.72 0.02 A 82 TYR HBy H 1 2.82 0.02 A 82 TYR HDx H 1 7.06 0.02 A 82 TYR HDy H 1 7.06 0.02 A 82 TYR HEx H 1 6.79 0.02 A 82 TYR HEy H 1 6.79 0.02 A 82 TYR C C 13 174.8 0.2 A 82 TYR CA C 13 57.8 0.2 A 82 TYR CB C 13 39.0 0.2 A 82 TYR CDx C 13 133.4 0.2 A 82 TYR CDy C 13 133.4 0.2 A 82 TYR CEx C 13 118.1 0.2 A 82 TYR CEy C 13 118.1 0.2 A 82 TYR N N 15 120.2 0.2 A 83 VAL H H 1 8.41 0.02 A 83 VAL HA H 1 4.52 0.02 A 83 VAL HB H 1 1.86 0.02 A 83 VAL HGx% H 1 0.50 0.02 A 83 VAL HGy% H 1 0.45 0.02 A 83 VAL C C 13 175.4 0.2 A 83 VAL CA C 13 61.1 0.2 A 83 VAL CB C 13 33.3 0.2 A 83 VAL CGy C 13 21.7 0.2 A 83 VAL CGx C 13 21.4 0.2 A 83 VAL N N 15 123.1 0.2 A 84 GLU H H 1 8.55 0.02 A 84 GLU HA H 1 4.93 0.02 A 84 GLU HBx H 1 1.82 0.02 A 84 GLU HBy H 1 1.94 0.02 A 84 GLU HGx H 1 2.14 0.02 A 84 GLU HGy H 1 2.19 0.02 A 84 GLU C C 13 175.1 0.2 A 84 GLU CA C 13 54.4 0.2 A 84 GLU CB C 13 34.2 0.2 A 84 GLU CG C 13 37.5 0.2 A 84 GLU N N 15 123.9 0.2 A 85 VAL H H 1 8.83 0.02 A 85 VAL HA H 1 4.84 0.02 A 85 VAL HB H 1 1.80 0.02 A 85 VAL HGx% H 1 0.94 0.02 A 85 VAL HGy% H 1 1.08 0.02 A 85 VAL C C 13 173.8 0.2 A 85 VAL CA C 13 61.1 0.2 A 85 VAL CB C 13 34.9 0.2 A 85 VAL CGy C 13 21.6 0.2 A 85 VAL CGx C 13 20.9 0.2 A 85 VAL N N 15 121.4 0.2 A 86 PHE H H 1 9.24 0.02 A 86 PHE HA H 1 4.89 0.02 A 86 PHE HBx H 1 2.77 0.02 A 86 PHE HBy H 1 3.26 0.02 A 86 PHE HDx H 1 7.16 0.02 A 86 PHE HDy H 1 7.16 0.02 A 86 PHE HEx H 1 7.20 0.02 A 86 PHE HEy H 1 7.20 0.02 A 86 PHE HZ H 1 7.25 0.02 A 86 PHE C C 13 175.6 0.2 A 86 PHE CA C 13 55.2 0.2 A 86 PHE CB C 13 42.5 0.2 A 86 PHE CDx C 13 132.2 0.2 A 86 PHE CDy C 13 132.2 0.2 A 86 PHE CEx C 13 131.1 0.2 A 86 PHE CEy C 13 131.1 0.2 A 86 PHE CZ C 13 130.0 0.2 A 86 PHE N N 15 122.5 0.2 A 87 LYS H H 1 9.24 0.02 A 87 LYS HA H 1 4.16 0.02 A 87 LYS HBx H 1 1.87 0.02 A 87 LYS HBy H 1 2.02 0.02 A 87 LYS HDx H 1 1.82 0.02 A 87 LYS HDy H 1 1.86 0.02 A 87 LYS HEx H 1 3.16 0.02 A 87 LYS HEy H 1 3.16 0.02 A 87 LYS HGx H 1 1.64 0.02 A 87 LYS HGy H 1 1.76 0.02 A 87 LYS C C 13 176.0 0.2 A 87 LYS CA C 13 58.9 0.2 A 87 LYS CB C 13 32.9 0.2 A 87 LYS CD C 13 29.7 0.2 A 87 LYS CE C 13 42.2 0.2 A 87 LYS CG C 13 26.2 0.2 A 87 LYS N N 15 123.5 0.2 A 88 SER H H 1 8.42 0.02 A 88 SER HA H 1 4.72 0.02 A 88 SER HBx H 1 3.34 0.02 A 88 SER HBy H 1 3.86 0.02 A 88 SER C C 13 174.1 0.2 A 88 SER CA C 13 55.3 0.2 A 88 SER CB C 13 64.5 0.2 A 88 SER N N 15 122.2 0.2 A 89 ASN H H 1 9.71 0.02 A 89 ASN HA H 1 4.55 0.02 A 89 ASN HBx H 1 3.12 0.02 A 89 ASN HBy H 1 3.39 0.02 A 89 ASN HD21 H 1 7.56 0.02 A 89 ASN HD22 H 1 6.86 0.02 A 89 ASN C C 13 174.0 0.2 A 89 ASN CA C 13 53.1 0.2 A 89 ASN CB C 13 39.4 0.2 A 89 ASN CG C 13 177.3 0.2 A 89 ASN N N 15 116.3 0.2 A 89 ASN ND2 N 15 114.6 0.2 A 90 ASN H H 1 8.81 0.02 A 90 ASN HA H 1 4.24 0.02 A 90 ASN HBx H 1 2.66 0.02 A 90 ASN HBy H 1 2.66 0.02 A 90 ASN HD21 H 1 7.22 0.02 A 90 ASN HD22 H 1 6.66 0.02 A 90 ASN C C 13 176.7 0.2 A 90 ASN CA C 13 56.7 0.2 A 90 ASN CB C 13 38.4 0.2 A 90 ASN CG C 13 175.3 0.2 A 90 ASN N N 15 116.5 0.2 A 90 ASN ND2 N 15 109.8 0.2 A 91 VAL H H 1 7.94 0.02 A 91 VAL HA H 1 3.73 0.02 A 91 VAL HB H 1 2.03 0.02 A 91 VAL HGx% H 1 0.91 0.02 A 91 VAL HGy% H 1 1.00 0.02 A 91 VAL C C 13 178.8 0.2 A 91 VAL CA C 13 66.2 0.2 A 91 VAL CB C 13 31.6 0.2 A 91 VAL CGx C 13 21.0 0.2 A 91 VAL CGy C 13 22.5 0.2 A 91 VAL N N 15 121.5 0.2 A 92 GLU H H 1 8.33 0.02 A 92 GLU HA H 1 4.06 0.02 A 92 GLU HBx H 1 2.01 0.02 A 92 GLU HBy H 1 2.01 0.02 A 92 GLU HGx H 1 2.32 0.02 A 92 GLU HGy H 1 2.42 0.02 A 92 GLU C C 13 177.3 0.2 A 92 GLU CA C 13 59.4 0.2 A 92 GLU CB C 13 29.3 0.2 A 92 GLU CG C 13 37.0 0.2 A 92 GLU N N 15 122.1 0.2 A 93 MET H H 1 7.62 0.02 A 93 MET HA H 1 2.57 0.02 A 93 MET HBx H 1 1.21 0.02 A 93 MET HBy H 1 1.86 0.02 A 93 MET HE% H 1 1.91 0.02 A 93 MET HGx H 1 1.35 0.02 A 93 MET HGy H 1 1.86 0.02 A 93 MET C C 13 176.6 0.2 A 93 MET CA C 13 58.8 0.2 A 93 MET CB C 13 33.6 0.2 A 93 MET CE C 13 16.8 0.2 A 93 MET CG C 13 31.2 0.2 A 93 MET N N 15 117.3 0.2 A 94 ASP H H 1 8.06 0.02 A 94 ASP HA H 1 4.23 0.02 A 94 ASP HBx H 1 2.59 0.02 A 94 ASP HBy H 1 2.75 0.02 A 94 ASP C C 13 178.1 0.2 A 94 ASP CA C 13 57.5 0.2 A 94 ASP CB C 13 41.5 0.2 A 94 ASP N N 15 116.3 0.2 A 95 TRP H H 1 8.12 0.02 A 95 TRP HA H 1 4.20 0.02 A 95 TRP HBx H 1 3.45 0.02 A 95 TRP HBy H 1 3.45 0.02 A 95 TRP HD1 H 1 7.15 0.02 A 95 TRP HE1 H 1 9.97 0.02 A 95 TRP HE3 H 1 7.51 0.02 A 95 TRP HH2 H 1 7.07 0.02 A 95 TRP HZ2 H 1 7.11 0.02 A 95 TRP HZ3 H 1 7.09 0.02 A 95 TRP C C 13 180.5 0.2 A 95 TRP CA C 13 62.2 0.2 A 95 TRP CB C 13 29.3 0.2 A 95 TRP CD1 C 13 126.9 0.2 A 95 TRP CE3 C 13 120.6 0.2 A 95 TRP CH2 C 13 124.6 0.2 A 95 TRP CZ2 C 13 114.4 0.2 A 95 TRP CZ3 C 13 122.1 0.2 A 95 TRP N N 15 118.3 0.2 A 95 TRP NE1 N 15 129.5 0.2 A 96 VAL H H 1 9.10 0.02 A 96 VAL HA H 1 3.70 0.02 A 96 VAL HB H 1 2.33 0.02 A 96 VAL HGx% H 1 1.17 0.02 A 96 VAL HGy% H 1 1.50 0.02 A 96 VAL C C 13 180.1 0.2 A 96 VAL CA C 13 67.4 0.2 A 96 VAL CB C 13 31.8 0.2 A 96 VAL CGx C 13 22.2 0.2 A 96 VAL CGy C 13 24.2 0.2 A 96 VAL N N 15 120.8 0.2 A 97 LEU H H 1 8.52 0.02 A 97 LEU HA H 1 4.07 0.02 A 97 LEU HBx H 1 1.46 0.02 A 97 LEU HBy H 1 1.93 0.02 A 97 LEU HDx% H 1 0.85 0.02 A 97 LEU HDy% H 1 0.97 0.02 A 97 LEU HG H 1 1.91 0.02 A 97 LEU C C 13 179.2 0.2 A 97 LEU CA C 13 58.1 0.2 A 97 LEU CB C 13 41.0 0.2 A 97 LEU CDy C 13 26.6 0.2 A 97 LEU CDx C 13 22.7 0.2 A 97 LEU CG C 13 27.0 0.2 A 97 LEU N N 15 119.8 0.2 A 98 LYS H H 1 7.57 0.02 A 98 LYS HA H 1 4.11 0.02 A 98 LYS HBx H 1 1.46 0.02 A 98 LYS HBy H 1 1.64 0.02 A 98 LYS HDx H 1 1.50 0.02 A 98 LYS HDy H 1 1.50 0.02 A 98 LYS HEx H 1 2.88 0.02 A 98 LYS HEy H 1 2.88 0.02 A 98 LYS HGx H 1 1.19 0.02 A 98 LYS HGy H 1 1.37 0.02 A 98 LYS C C 13 176.8 0.2 A 98 LYS CA C 13 57.5 0.2 A 98 LYS CB C 13 33.0 0.2 A 98 LYS CD C 13 28.9 0.2 A 98 LYS CE C 13 42.2 0.2 A 98 LYS CG C 13 25.9 0.2 A 98 LYS N N 15 115.7 0.2 A 99 HIS H H 1 7.58 0.02 A 99 HIS HA H 1 4.53 0.02 A 99 HIS HBx H 1 2.18 0.02 A 99 HIS HBy H 1 3.28 0.02 A 99 HIS C C 13 173.5 0.2 A 99 HIS CA C 13 56.9 0.2 A 99 HIS CB C 13 28.4 0.2 A 99 HIS N N 15 115.0 0.2 A 100 THR H H 1 7.33 0.02 A 100 THR HA H 1 4.77 0.02 A 100 THR HB H 1 4.52 0.02 A 100 THR HG2% H 1 1.32 0.02 A 100 THR C C 13 174.4 0.2 A 100 THR CA C 13 60.7 0.2 A 100 THR CB C 13 72.0 0.2 A 100 THR CG2 C 13 22.4 0.2 A 100 THR N N 15 110.4 0.2 A 101 GLY H H 1 8.13 0.02 A 101 GLY HAx H 1 3.77 0.02 A 101 GLY HAy H 1 4.31 0.02 A 101 GLY CA C 13 45.2 0.2 A 101 GLY N N 15 107.9 0.2 A 102 PRO HA H 1 4.51 0.02 A 102 PRO HBx H 1 1.91 0.02 A 102 PRO HBy H 1 2.20 0.02 A 102 PRO HDx H 1 3.53 0.02 A 102 PRO HDy H 1 3.72 0.02 A 102 PRO HGx H 1 1.89 0.02 A 102 PRO HGy H 1 1.94 0.02 A 102 PRO C C 13 176.7 0.2 A 102 PRO CA C 13 63.8 0.2 A 102 PRO CB C 13 32.2 0.2 A 102 PRO CD C 13 49.9 0.2 A 102 PRO CG C 13 27.0 0.2 A 103 ASN H H 1 8.36 0.02 A 103 ASN HA H 1 4.69 0.02 A 103 ASN HBx H 1 2.62 0.02 A 103 ASN HBy H 1 2.84 0.02 A 103 ASN HD21 H 1 7.54 0.02 A 103 ASN HD22 H 1 6.92 0.02 A 103 ASN C C 13 174.6 0.2 A 103 ASN CA C 13 53.0 0.2 A 103 ASN CB C 13 38.9 0.2 A 103 ASN CG C 13 177.3 0.2 A 103 ASN N N 15 116.8 0.2 A 103 ASN ND2 N 15 113.2 0.2 A 104 SER H H 1 7.75 0.02 A 104 SER HA H 1 4.59 0.02 A 104 SER HBx H 1 3.76 0.02 A 104 SER HBy H 1 3.76 0.02 A 104 SER CA C 13 56.7 0.2 A 104 SER CB C 13 63.4 0.2 A 104 SER N N 15 116.7 0.2 A 105 PRO HA H 1 4.45 0.02 A 105 PRO HBx H 1 1.96 0.02 A 105 PRO HBy H 1 2.29 0.02 A 105 PRO HDx H 1 3.68 0.02 A 105 PRO HDy H 1 3.78 0.02 A 105 PRO HGx H 1 1.98 0.02 A 105 PRO HGy H 1 1.98 0.02 A 105 PRO C C 13 176.6 0.2 A 105 PRO CA C 13 63.3 0.2 A 105 PRO CB C 13 32.1 0.2 A 105 PRO CD C 13 50.7 0.2 A 105 PRO CG C 13 27.3 0.2 A 106 ASP H H 1 8.43 0.02 A 106 ASP HA H 1 4.62 0.02 A 106 ASP HBx H 1 2.61 0.02 A 106 ASP HBy H 1 2.74 0.02 A 106 ASP C C 13 176.6 0.2 A 106 ASP CA C 13 54.5 0.2 A 106 ASP CB C 13 41.1 0.2 A 106 ASP N N 15 120.5 0.2 A 107 THR H H 1 8.03 0.02 A 107 THR HA H 1 4.33 0.02 A 107 THR HB H 1 4.29 0.02 A 107 THR HG2% H 1 1.21 0.02 A 107 THR C C 13 174.5 0.2 A 107 THR CA C 13 61.8 0.2 A 107 THR CB C 13 69.8 0.2 A 107 THR CG2 C 13 21.7 0.2 A 107 THR N N 15 114.0 0.2 A 108 ALA H H 1 8.31 0.02 A 108 ALA HA H 1 4.33 0.02 A 108 ALA HB% H 1 1.41 0.02 A 108 ALA C C 13 177.5 0.2 A 108 ALA CA C 13 52.8 0.2 A 108 ALA CB C 13 19.2 0.2 A 108 ALA N N 15 126.0 0.2 A 109 ASN H H 1 8.35 0.02 A 109 ASN HA H 1 4.76 0.02 A 109 ASN HBx H 1 2.72 0.02 A 109 ASN HBy H 1 2.86 0.02 A 109 ASN HD21 H 1 7.65 0.02 A 109 ASN HD22 H 1 6.90 0.02 A 109 ASN C C 13 174.8 0.2 A 109 ASN CA C 13 53.2 0.2 A 109 ASN CB C 13 39.1 0.2 A 109 ASN CG C 13 177.2 0.2 A 109 ASN N N 15 117.9 0.2 A 109 ASN ND2 N 15 113.3 0.2 A 110 ASP H H 1 8.29 0.02 A 110 ASP HA H 1 4.66 0.02 A 110 ASP HBx H 1 2.65 0.02 A 110 ASP HBy H 1 2.71 0.02 A 110 ASP C C 13 175.6 0.2 A 110 ASP CA C 13 54.3 0.2 A 110 ASP CB C 13 41.3 0.2 A 110 ASP N N 15 121.1 0.2 A 111 GLY H H 1 7.94 0.02 A 111 GLY HAx H 1 3.75 0.02 A 111 GLY HAy H 1 3.75 0.02 A 111 GLY CA C 13 46.3 0.2 A 111 GLY N N 15 115.1 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 8 GLY H A 7 GLY HAx 1.0 1.8 3.5 2 1 A 7 GLY HAy A 8 GLY H 1.0 1.8 3.5 3 2 A 9 GLU H A 8 GLY HAx 1.0 1.8 3.5 4 2 A 8 GLY HAy A 9 GLU H 1.0 1.8 3.5 5 3 A 9 GLU HA A 10 GLY H 1.0 1.8 3.5 6 4 A 9 GLU HA A 9 GLU HGx 1.0 1.8 3.5 7 4 A 9 GLU HA A 9 GLU HGy 1.0 1.8 3.5 8 5 A 10 GLY H A 9 GLU HBy 1.0 1.8 5.0 9 6 A 10 GLY H A 9 GLU HBx 1.0 1.8 5.0 10 7 A 10 GLY H A 9 GLU HGx 1.0 1.8 5.0 11 7 A 10 GLY H A 9 GLU HGy 1.0 1.8 5.0 12 8 A 9 GLU H A 10 GLY H 1.0 1.8 5.0 13 9 A 9 GLU H A 9 GLU HBy 1.0 1.8 3.5 14 9 A 9 GLU H A 9 GLU HBx 1.0 1.8 3.5 15 10 A 9 GLU H A 9 GLU HGx 1.0 1.8 5.0 16 10 A 9 GLU H A 9 GLU HGy 1.0 1.8 5.0 17 11 A 11 PHE H A 10 GLY HAx 1.0 1.8 3.5 18 11 A 10 GLY HAy A 11 PHE H 1.0 1.8 3.5 19 12 A 12 VAL HGy% A 10 GLY HAx 1.0 1.8 5.0 20 12 A 10 GLY HAy A 12 VAL HGy% 1.0 1.8 5.0 21 13 A 90 ASN H A 10 GLY HAx 1.0 1.8 5.0 22 13 A 10 GLY HAy A 90 ASN H 1.0 1.8 5.0 23 14 A 10 GLY H A 11 PHE H 1.0 1.8 5.0 24 15 A 11 PHE HA A 12 VAL H 1.0 1.8 3.5 25 16 A 11 PHE HA A 67 VAL HGy% 1.0 1.8 5.0 26 17 A 11 PHE HBy A 61 LEU HBx 1.0 1.8 5.0 27 17 A 11 PHE HBx A 61 LEU HBx 1.0 1.8 5.0 28 17 A 61 LEU HBy A 11 PHE HBx 1.0 1.8 5.0 29 17 A 11 PHE HBy A 61 LEU HBy 1.0 1.8 5.0 30 18 A 64 GLU H A 11 PHE HBx 1.0 1.8 6.0 31 18 A 11 PHE HBy A 64 GLU H 1.0 1.8 6.0 32 19 A 67 VAL HGy% A 11 PHE HBx 1.0 1.8 3.5 33 19 A 67 VAL HGy% A 11 PHE HBy 1.0 1.8 3.5 34 20 A 12 VAL H A 11 PHE HBy 1.0 1.8 5.0 35 21 A 12 VAL H A 11 PHE HBx 1.0 1.8 5.0 36 22 A 12 VAL H A 11 PHE HD% 1.0 1.8 5.0 37 23 A 11 PHE HD% A 63 SER HA 1.0 1.8 5.0 38 24 A 11 PHE HD% A 64 GLU HA 1.0 1.8 5.0 39 25 A 11 PHE HD% A 64 GLU HGx 1.0 1.8 5.0 40 25 A 11 PHE HD% A 64 GLU HGy 1.0 1.8 5.0 41 26 A 64 GLU H A 11 PHE HD% 1.0 1.8 5.0 42 27 A 67 VAL HGy% A 11 PHE HD% 1.0 1.8 5.0 43 28 A 63 SER HA A 11 PHE HE% 1.0 1.8 5.0 44 29 A 64 GLU H A 11 PHE HE% 1.0 1.8 6.0 45 30 A 11 PHE H A 11 PHE HBx 1.0 1.8 3.5 46 30 A 11 PHE H A 11 PHE HBy 1.0 1.8 3.5 47 31 A 11 PHE H A 11 PHE HD% 1.0 1.8 5.0 48 32 A 11 PHE H A 12 VAL HGy% 1.0 1.8 5.0 49 33 A 11 PHE H A 61 LEU H 1.0 1.8 6.0 50 34 A 12 VAL HA A 12 VAL HGx% 1.0 1.8 3.5 51 35 A 12 VAL HGy% A 12 VAL HA 1.0 1.8 3.5 52 36 A 12 VAL HA A 13 VAL HGy% 1.0 1.8 5.0 53 37 A 12 VAL HA A 13 VAL H 1.0 1.8 3.5 54 38 A 12 VAL HA A 60 GLU HA 1.0 1.8 5.0 55 39 A 12 VAL HA A 61 LEU HDx% 1.0 1.8 5.0 56 40 A 61 LEU H A 12 VAL HA 1.0 1.8 5.0 57 41 A 13 VAL H A 12 VAL HB 1.0 1.8 5.0 58 42 A 12 VAL HB A 88 SER HBy 1.0 1.8 5.0 59 42 A 12 VAL HB A 88 SER HBx 1.0 1.8 5.0 60 43 A 12 VAL HB A 89 ASN HA 1.0 1.8 5.0 61 44 A 12 VAL HB A 89 ASN H 1.0 1.8 5.0 62 45 A 12 VAL HGx% A 13 VAL H 1.0 1.8 3.5 63 46 A 12 VAL HGx% A 58 PHE HA 1.0 1.8 5.0 64 47 A 12 VAL HGx% A 58 PHE HBx 1.0 1.8 5.0 65 47 A 12 VAL HGx% A 58 PHE HBy 1.0 1.8 5.0 66 48 A 12 VAL HGx% A 58 PHE HD% 1.0 1.8 3.5 67 49 A 12 VAL HGx% A 59 VAL H 1.0 1.8 5.0 68 50 A 12 VAL HGx% A 60 GLU HA 1.0 1.8 5.0 69 51 A 12 VAL HGx% A 88 SER HBy 1.0 1.8 3.5 70 51 A 12 VAL HGx% A 88 SER HBx 1.0 1.8 3.5 71 52 A 12 VAL HGx% A 88 SER H 1.0 1.8 5.0 72 53 A 12 VAL HGx% A 89 ASN HA 1.0 1.8 6.0 73 54 A 12 VAL HGx% A 89 ASN H 1.0 1.8 5.0 74 55 A 12 VAL HGx% A 90 ASN HA 1.0 1.8 5.0 75 56 A 90 ASN H A 12 VAL HGx% 1.0 1.8 6.0 76 57 A 12 VAL HGx% A 93 MET HBx 1.0 1.8 5.0 77 57 A 12 VAL HGx% A 93 MET HBy 1.0 1.8 5.0 78 58 A 12 VAL HGx% A 93 MET HE% 1.0 1.8 3.5 79 59 A 12 VAL HGx% A 93 MET H 1.0 1.8 5.0 80 60 A 12 VAL HGy% A 59 VAL H 1.0 1.8 6.0 81 61 A 12 VAL HGy% A 60 GLU HA 1.0 1.8 5.0 82 62 A 12 VAL HGy% A 60 GLU HBx 1.0 1.8 5.0 83 62 A 12 VAL HGy% A 60 GLU HBy 1.0 1.8 5.0 84 63 A 12 VAL HGy% A 60 GLU HGx 1.0 1.8 3.5 85 63 A 12 VAL HGy% A 60 GLU HGy 1.0 1.8 3.5 86 64 A 12 VAL HGy% A 61 LEU H 1.0 1.8 5.0 87 65 A 12 VAL HGy% A 88 SER HBy 1.0 1.8 6.0 88 65 A 12 VAL HGy% A 88 SER HBx 1.0 1.8 6.0 89 66 A 12 VAL HGy% A 89 ASN HA 1.0 1.8 5.0 90 67 A 12 VAL HGy% A 89 ASN H 1.0 1.8 6.0 91 68 A 12 VAL HGy% A 90 ASN HA 1.0 1.8 5.0 92 69 A 12 VAL HGy% A 90 ASN HBx 1.0 1.8 5.0 93 69 A 12 VAL HGy% A 90 ASN HBy 1.0 1.8 5.0 94 70 A 12 VAL HGy% A 90 ASN H 1.0 1.8 5.0 95 71 A 12 VAL HGy% A 93 MET HE% 1.0 1.8 3.5 96 72 A 12 VAL H A 12 VAL HB 1.0 1.8 3.5 97 73 A 12 VAL H A 12 VAL HGx% 1.0 1.8 5.0 98 74 A 12 VAL HGy% A 12 VAL H 1.0 1.8 3.5 99 75 A 12 VAL H A 67 VAL HGx% 1.0 1.8 5.0 100 76 A 12 VAL H A 67 VAL HGy% 1.0 1.8 5.0 101 77 A 12 VAL H A 88 SER H 1.0 1.8 5.0 102 78 A 12 VAL H A 89 ASN HA 1.0 1.8 5.0 103 79 A 13 VAL HA A 13 VAL HGx% 1.0 1.8 3.5 104 80 A 13 VAL HA A 14 LYS H 1.0 1.8 3.5 105 81 A 67 VAL HGx% A 13 VAL HA 1.0 1.8 5.0 106 82 A 13 VAL HA A 85 VAL HGx% 1.0 1.8 5.0 107 83 A 13 VAL HA A 87 LYS HA 1.0 1.8 5.0 108 84 A 13 VAL HA A 88 SER HBy 1.0 1.8 5.0 109 84 A 88 SER HBx A 13 VAL HA 1.0 1.8 5.0 110 85 A 88 SER H A 13 VAL HA 1.0 1.8 5.0 111 86 A 14 LYS H A 13 VAL HB 1.0 1.8 5.0 112 87 A 13 VAL HB A 15 VAL HGy% 1.0 1.8 5.0 113 88 A 85 VAL HGx% A 13 VAL HB 1.0 1.8 3.5 114 89 A 13 VAL HB A 86 PHE H 1.0 1.8 5.0 115 90 A 13 VAL HGx% A 14 LYS H 1.0 1.8 5.0 116 91 A 59 VAL H A 13 VAL HGx% 1.0 1.8 6.0 117 92 A 13 VAL HGx% A 67 VAL HA 1.0 1.8 5.0 118 93 A 67 VAL HGx% A 13 VAL HGx% 1.0 1.8 3.5 119 94 A 67 VAL HGy% A 13 VAL HGx% 1.0 1.8 5.0 120 95 A 13 VAL HGx% A 70 ALA HB% 1.0 1.8 3.5 121 96 A 13 VAL HGx% A 70 ALA H 1.0 1.8 6.0 122 97 A 13 VAL HGx% A 71 LEU H 1.0 1.8 5.0 123 98 A 13 VAL HGx% A 85 VAL HGy% 1.0 1.8 6.0 124 99 A 13 VAL HGx% A 87 LYS HA 1.0 1.8 3.5 125 100 A 13 VAL HGx% A 87 LYS HGy 1.0 1.8 5.0 126 100 A 13 VAL HGx% A 87 LYS HGx 1.0 1.8 5.0 127 101 A 88 SER H A 13 VAL HGx% 1.0 1.8 5.0 128 102 A 13 VAL HGy% A 14 LYS HA 1.0 1.8 6.0 129 103 A 13 VAL HGy% A 14 LYS H 1.0 1.8 5.0 130 104 A 13 VAL HGy% A 15 VAL HGy% 1.0 1.8 5.0 131 105 A 13 VAL HGy% A 31 PHE HE% 1.0 1.8 5.0 132 106 A 13 VAL HGy% A 31 PHE HZ 1.0 1.8 5.0 133 107 A 13 VAL HGy% A 59 VAL HB 1.0 1.8 3.5 134 108 A 13 VAL HGy% A 59 VAL HGy% 1.0 1.8 5.0 135 109 A 13 VAL HGy% A 59 VAL H 1.0 1.8 5.0 136 110 A 13 VAL HGy% A 61 LEU HDx% 1.0 1.8 5.0 137 111 A 13 VAL HGy% A 67 VAL HGx% 1.0 1.8 6.0 138 112 A 67 VAL HGy% A 13 VAL HGy% 1.0 1.8 6.0 139 113 A 13 VAL HGy% A 70 ALA HB% 1.0 1.8 3.5 140 114 A 13 VAL HGy% A 85 VAL HGx% 1.0 1.8 5.0 141 115 A 13 VAL H A 13 VAL HGx% 1.0 1.8 5.0 142 116 A 13 VAL HGy% A 13 VAL H 1.0 1.8 3.5 143 117 A 13 VAL H A 59 VAL HB 1.0 1.8 5.0 144 118 A 13 VAL H A 59 VAL HGy% 1.0 1.8 6.0 145 119 A 13 VAL H A 59 VAL H 1.0 1.8 5.0 146 120 A 13 VAL H A 60 GLU HA 1.0 1.8 5.0 147 121 A 13 VAL H A 61 LEU HDx% 1.0 1.8 6.0 148 122 A 13 VAL H A 61 LEU HG 1.0 1.8 6.0 149 123 A 61 LEU H A 13 VAL H 1.0 1.8 6.0 150 124 A 15 VAL HGy% A 14 LYS HA 1.0 1.8 5.0 151 125 A 14 LYS HA A 15 VAL H 1.0 1.8 3.5 152 126 A 58 PHE HA A 14 LYS HA 1.0 1.8 5.0 153 127 A 58 PHE HD% A 14 LYS HA 1.0 1.8 5.0 154 128 A 59 VAL H A 14 LYS HA 1.0 1.8 5.0 155 129 A 14 LYS HBx A 14 LYS HEx 1.0 1.8 5.0 156 129 A 14 LYS HBy A 14 LYS HEx 1.0 1.8 5.0 157 129 A 14 LYS HEy A 14 LYS HBx 1.0 1.8 5.0 158 129 A 14 LYS HBy A 14 LYS HEy 1.0 1.8 5.0 159 130 A 58 PHE HD% A 14 LYS HBx 1.0 1.8 6.0 160 130 A 58 PHE HD% A 14 LYS HBy 1.0 1.8 6.0 161 131 A 58 PHE HE% A 14 LYS HBx 1.0 1.8 6.0 162 131 A 14 LYS HBy A 58 PHE HE% 1.0 1.8 6.0 163 132 A 58 PHE HZ A 14 LYS HBx 1.0 1.8 6.0 164 132 A 14 LYS HBy A 58 PHE HZ 1.0 1.8 6.0 165 133 A 14 LYS HBy A 86 PHE HBx 1.0 1.8 6.0 166 133 A 14 LYS HBx A 86 PHE HBx 1.0 1.8 6.0 167 133 A 86 PHE HBy A 14 LYS HBx 1.0 1.8 6.0 168 133 A 14 LYS HBy A 86 PHE HBy 1.0 1.8 6.0 169 134 A 86 PHE HD% A 14 LYS HBx 1.0 1.8 5.0 170 134 A 14 LYS HBy A 86 PHE HD% 1.0 1.8 5.0 171 135 A 14 LYS HBy A 88 SER HBy 1.0 1.8 6.0 172 135 A 14 LYS HBx A 88 SER HBy 1.0 1.8 6.0 173 136 A 88 SER HBx A 14 LYS HBx 1.0 1.8 6.0 174 136 A 88 SER HBx A 14 LYS HBy 1.0 1.8 6.0 175 137 A 88 SER HBx A 14 LYS HBy 1.0 1.8 6.0 176 137 A 14 LYS HBy A 88 SER HBy 1.0 1.8 6.0 177 138 A 88 SER HBx A 14 LYS HBx 1.0 1.8 6.0 178 138 A 14 LYS HBx A 88 SER HBy 1.0 1.8 6.0 179 139 A 15 VAL H A 14 LYS HDx 1.0 1.8 6.0 180 139 A 15 VAL H A 14 LYS HDy 1.0 1.8 6.0 181 140 A 58 PHE HZ A 14 LYS HDx 1.0 1.8 6.0 182 140 A 58 PHE HZ A 14 LYS HDy 1.0 1.8 6.0 183 141 A 86 PHE HD% A 14 LYS HEx 1.0 1.8 5.0 184 141 A 14 LYS HEy A 86 PHE HD% 1.0 1.8 5.0 185 142 A 15 VAL H A 14 LYS HGx 1.0 1.8 5.0 186 142 A 15 VAL H A 14 LYS HGy 1.0 1.8 5.0 187 143 A 57 ALA H A 14 LYS HGx 1.0 1.8 5.0 188 143 A 14 LYS HGy A 57 ALA H 1.0 1.8 5.0 189 144 A 58 PHE HE% A 14 LYS HGx 1.0 1.8 6.0 190 144 A 58 PHE HE% A 14 LYS HGy 1.0 1.8 6.0 191 145 A 86 PHE HD% A 14 LYS HGx 1.0 1.8 6.0 192 145 A 86 PHE HD% A 14 LYS HGy 1.0 1.8 6.0 193 146 A 14 LYS H A 85 VAL HGx% 1.0 1.8 5.0 194 147 A 14 LYS H A 86 PHE HBx 1.0 1.8 5.0 195 147 A 14 LYS H A 86 PHE HBy 1.0 1.8 5.0 196 148 A 14 LYS H A 86 PHE H 1.0 1.8 5.0 197 149 A 14 LYS H A 87 LYS HA 1.0 1.8 5.0 198 150 A 14 LYS H A 88 SER HBy 1.0 1.8 5.0 199 150 A 88 SER HBx A 14 LYS H 1.0 1.8 5.0 200 151 A 88 SER H A 14 LYS H 1.0 1.8 5.0 201 152 A 15 VAL HA A 15 VAL HGx% 1.0 1.8 3.5 202 153 A 15 VAL HGy% A 15 VAL HA 1.0 1.8 3.5 203 154 A 15 VAL HA A 16 ARG H 1.0 1.8 3.5 204 155 A 15 VAL HA A 85 VAL HA 1.0 1.8 5.0 205 156 A 85 VAL HGy% A 15 VAL HA 1.0 1.8 5.0 206 157 A 86 PHE H A 15 VAL HA 1.0 1.8 5.0 207 158 A 15 VAL HB A 18 LEU HDx% 1.0 1.8 5.0 208 159 A 15 VAL HB A 18 LEU HDy% 1.0 1.8 5.0 209 160 A 15 VAL HB A 57 ALA HB% 1.0 1.8 5.0 210 161 A 57 ALA H A 15 VAL HB 1.0 1.8 5.0 211 162 A 59 VAL HGy% A 15 VAL HB 1.0 1.8 5.0 212 163 A 15 VAL HB A 83 VAL HGx% 1.0 1.8 5.0 213 164 A 15 VAL HB A 83 VAL HGy% 1.0 1.8 6.0 214 165 A 15 VAL HGx% A 16 ARG H 1.0 1.8 5.0 215 166 A 15 VAL HGx% A 18 LEU HDx% 1.0 1.8 3.5 216 167 A 15 VAL HGx% A 18 LEU HDy% 1.0 1.8 3.5 217 168 A 15 VAL HGx% A 18 LEU HG 1.0 1.8 5.0 218 169 A 15 VAL HGx% A 30 PHE HE% 1.0 1.8 5.0 219 170 A 31 PHE HE% A 15 VAL HGx% 1.0 1.8 5.0 220 171 A 31 PHE HZ A 15 VAL HGx% 1.0 1.8 5.0 221 172 A 15 VAL HGx% A 56 GLU HA 1.0 1.8 6.0 222 173 A 15 VAL HGx% A 78 MET HE% 1.0 1.8 5.0 223 174 A 15 VAL HGx% A 83 VAL HGx% 1.0 1.8 3.5 224 175 A 15 VAL HGx% A 84 GLU H 1.0 1.8 5.0 225 176 A 15 VAL HGx% A 85 VAL HA 1.0 1.8 5.0 226 177 A 15 VAL HGy% A 18 LEU HDx% 1.0 1.8 5.0 227 178 A 15 VAL HGy% A 18 LEU HDy% 1.0 1.8 5.0 228 179 A 15 VAL HGy% A 31 PHE HE% 1.0 1.8 5.0 229 180 A 15 VAL HGy% A 31 PHE HZ 1.0 1.8 3.5 230 181 A 15 VAL HGy% A 57 ALA H 1.0 1.8 5.0 231 182 A 15 VAL HGy% A 59 VAL HGy% 1.0 1.8 3.5 232 183 A 59 VAL H A 15 VAL HGy% 1.0 1.8 5.0 233 184 A 15 VAL HGy% A 15 VAL H 1.0 1.8 3.5 234 185 A 15 VAL H A 57 ALA H 1.0 1.8 5.0 235 186 A 58 PHE HA A 15 VAL H 1.0 1.8 5.0 236 187 A 16 ARG HA A 17 GLY H 1.0 1.8 3.5 237 188 A 16 ARG HA A 18 LEU HBx 1.0 1.8 6.0 238 188 A 16 ARG HA A 18 LEU HBy 1.0 1.8 6.0 239 189 A 18 LEU HG A 16 ARG HA 1.0 1.8 6.0 240 190 A 16 ARG HA A 18 LEU H 1.0 1.8 5.0 241 191 A 56 GLU HA A 16 ARG HA 1.0 1.8 5.0 242 192 A 16 ARG HA A 56 GLU HGx 1.0 1.8 5.0 243 192 A 16 ARG HA A 56 GLU HGy 1.0 1.8 5.0 244 193 A 57 ALA H A 16 ARG HA 1.0 1.8 5.0 245 194 A 84 GLU H A 16 ARG HBx 1.0 1.8 5.0 246 194 A 84 GLU H A 16 ARG HBy 1.0 1.8 5.0 247 195 A 86 PHE HE% A 16 ARG HBx 1.0 1.8 5.0 248 195 A 16 ARG HBy A 86 PHE HE% 1.0 1.8 5.0 249 196 A 86 PHE HE% A 16 ARG HDx 1.0 1.8 5.0 250 196 A 86 PHE HE% A 16 ARG HDy 1.0 1.8 5.0 251 197 A 17 GLY H A 16 ARG HGx 1.0 1.8 5.0 252 197 A 17 GLY H A 16 ARG HGy 1.0 1.8 5.0 253 198 A 16 ARG HGx A 56 GLU HGx 1.0 1.8 5.0 254 198 A 56 GLU HGy A 16 ARG HGx 1.0 1.8 5.0 255 198 A 56 GLU HGy A 16 ARG HGy 1.0 1.8 5.0 256 198 A 16 ARG HGy A 56 GLU HGx 1.0 1.8 5.0 257 199 A 86 PHE HE% A 16 ARG HGx 1.0 1.8 5.0 258 199 A 86 PHE HE% A 16 ARG HGy 1.0 1.8 5.0 259 200 A 16 ARG H A 16 ARG HGx 1.0 1.8 5.0 260 200 A 16 ARG H A 16 ARG HGy 1.0 1.8 5.0 261 201 A 16 ARG H A 83 VAL HGx% 1.0 1.8 5.0 262 202 A 16 ARG H A 84 GLU H 1.0 1.8 5.0 263 203 A 16 ARG H A 85 VAL HA 1.0 1.8 5.0 264 204 A 17 GLY H A 18 LEU HBx 1.0 1.8 6.0 265 204 A 17 GLY H A 18 LEU HBy 1.0 1.8 6.0 266 205 A 18 LEU HG A 17 GLY H 1.0 1.8 6.0 267 206 A 17 GLY H A 18 LEU H 1.0 1.8 3.5 268 207 A 56 GLU HA A 17 GLY H 1.0 1.8 5.0 269 208 A 18 LEU HDy% A 18 LEU HA 1.0 1.8 3.5 270 209 A 18 LEU HA A 19 PRO HDy 1.0 1.8 3.5 271 209 A 18 LEU HA A 19 PRO HDx 1.0 1.8 3.5 272 210 A 18 LEU HA A 19 PRO HGx 1.0 1.8 5.0 273 210 A 18 LEU HA A 19 PRO HGy 1.0 1.8 5.0 274 211 A 83 VAL HGy% A 18 LEU HA 1.0 1.8 5.0 275 212 A 18 LEU HDx% A 18 LEU HBx 1.0 1.8 3.5 276 212 A 18 LEU HDx% A 18 LEU HBy 1.0 1.8 3.5 277 213 A 18 LEU HBx A 55 GLY HAx 1.0 1.8 5.0 278 213 A 18 LEU HBy A 55 GLY HAx 1.0 1.8 5.0 279 213 A 55 GLY HAy A 18 LEU HBx 1.0 1.8 5.0 280 213 A 18 LEU HBy A 55 GLY HAy 1.0 1.8 5.0 281 214 A 18 LEU HBy A 19 PRO HDx 1.0 1.8 5.0 282 214 A 18 LEU HBy A 19 PRO HDy 1.0 1.8 5.0 283 215 A 19 PRO HDx A 18 LEU HBx 1.0 1.8 5.0 284 215 A 18 LEU HBx A 19 PRO HDy 1.0 1.8 5.0 285 216 A 18 LEU HDx% A 22 CYS HBx 1.0 1.8 6.0 286 216 A 18 LEU HDx% A 22 CYS HBy 1.0 1.8 6.0 287 217 A 18 LEU HDx% A 27 VAL HGy% 1.0 1.8 5.0 288 218 A 18 LEU HDx% A 45 PHE HD% 1.0 1.8 5.0 289 219 A 18 LEU HDx% A 45 PHE HE% 1.0 1.8 5.0 290 220 A 18 LEU HDx% A 55 GLY HAx 1.0 1.8 5.0 291 220 A 18 LEU HDx% A 55 GLY HAy 1.0 1.8 5.0 292 221 A 18 LEU HDx% A 56 GLU HA 1.0 1.8 5.0 293 222 A 18 LEU HDx% A 57 ALA HB% 1.0 1.8 5.0 294 223 A 57 ALA H A 18 LEU HDx% 1.0 1.8 5.0 295 224 A 18 LEU HDy% A 19 PRO HDy 1.0 1.8 5.0 296 225 A 18 LEU HDy% A 19 PRO HDx 1.0 1.8 5.0 297 226 A 18 LEU HDy% A 19 PRO HGx 1.0 1.8 5.0 298 226 A 18 LEU HDy% A 19 PRO HGy 1.0 1.8 5.0 299 227 A 18 LEU HDy% A 22 CYS HBx 1.0 1.8 5.0 300 227 A 18 LEU HDy% A 22 CYS HBy 1.0 1.8 5.0 301 228 A 18 LEU HDy% A 27 VAL HA 1.0 1.8 5.0 302 229 A 18 LEU HDy% A 27 VAL HGy% 1.0 1.8 3.5 303 230 A 18 LEU HDy% A 45 PHE HE% 1.0 1.8 5.0 304 231 A 18 LEU HDy% A 78 MET HE% 1.0 1.8 3.5 305 232 A 18 LEU HDy% A 83 VAL HGx% 1.0 1.8 5.0 306 233 A 18 LEU HDy% A 83 VAL HGy% 1.0 1.8 3.5 307 234 A 18 LEU HG A 19 PRO HDy 1.0 1.8 6.0 308 234 A 18 LEU HG A 19 PRO HDx 1.0 1.8 6.0 309 235 A 18 LEU H A 18 LEU HBx 1.0 1.8 3.5 310 235 A 18 LEU HBy A 18 LEU H 1.0 1.8 3.5 311 236 A 18 LEU HDx% A 18 LEU H 1.0 1.8 5.0 312 237 A 18 LEU HDy% A 18 LEU H 1.0 1.8 5.0 313 238 A 18 LEU HG A 18 LEU H 1.0 1.8 5.0 314 239 A 18 LEU H A 55 GLY HAx 1.0 1.8 5.0 315 239 A 18 LEU H A 55 GLY HAy 1.0 1.8 5.0 316 240 A 21 SER H A 19 PRO HBx 1.0 1.8 5.0 317 240 A 19 PRO HBy A 21 SER H 1.0 1.8 5.0 318 241 A 22 CYS H A 19 PRO HBx 1.0 1.8 5.0 319 241 A 19 PRO HBy A 22 CYS H 1.0 1.8 5.0 320 242 A 19 PRO HDy A 22 CYS HBx 1.0 1.8 5.0 321 242 A 22 CYS HBy A 19 PRO HDy 1.0 1.8 5.0 322 242 A 19 PRO HDx A 22 CYS HBy 1.0 1.8 5.0 323 242 A 19 PRO HDx A 22 CYS HBx 1.0 1.8 5.0 324 243 A 78 MET HE% A 19 PRO HDy 1.0 1.8 5.0 325 243 A 78 MET HE% A 19 PRO HDx 1.0 1.8 5.0 326 244 A 22 CYS HA A 19 PRO HGx 1.0 1.8 5.0 327 244 A 19 PRO HGy A 22 CYS HA 1.0 1.8 5.0 328 245 A 22 CYS HBy A 19 PRO HGx 1.0 1.8 5.0 329 245 A 19 PRO HGy A 22 CYS HBy 1.0 1.8 5.0 330 246 A 19 PRO HGx A 22 CYS HBx 1.0 1.8 5.0 331 246 A 19 PRO HGy A 22 CYS HBx 1.0 1.8 5.0 332 247 A 22 CYS H A 19 PRO HGx 1.0 1.8 5.0 333 247 A 19 PRO HGy A 22 CYS H 1.0 1.8 5.0 334 248 A 20 TRP HA A 20 TRP HD1 1.0 1.8 5.0 335 249 A 20 TRP HD1 A 20 TRP H 1.0 1.8 6.0 336 250 A 22 CYS HA A 23 SER H 1.0 1.8 3.5 337 251 A 22 CYS HA A 26 GLU HBy 1.0 1.8 5.0 338 251 A 22 CYS HA A 26 GLU HBx 1.0 1.8 5.0 339 252 A 22 CYS HBy A 23 SER H 1.0 1.8 5.0 340 253 A 23 SER H A 22 CYS HBx 1.0 1.8 5.0 341 254 A 22 CYS H A 22 CYS HBx 1.0 1.8 3.5 342 254 A 22 CYS HBy A 22 CYS H 1.0 1.8 3.5 343 255 A 24 ALA HB% A 23 SER HBy 1.0 1.8 5.0 344 255 A 23 SER HBx A 24 ALA HB% 1.0 1.8 5.0 345 256 A 25 ASP H A 23 SER HBy 1.0 1.8 3.5 346 256 A 23 SER HBx A 25 ASP H 1.0 1.8 3.5 347 257 A 26 GLU H A 23 SER HBy 1.0 1.8 5.0 348 257 A 23 SER HBx A 26 GLU H 1.0 1.8 5.0 349 258 A 24 ALA H A 23 SER HBy 1.0 1.8 5.0 350 259 A 23 SER HBx A 24 ALA H 1.0 1.8 5.0 351 260 A 23 SER H A 26 GLU HBy 1.0 1.8 5.0 352 260 A 23 SER H A 26 GLU HBx 1.0 1.8 5.0 353 261 A 23 SER H A 26 GLU HGx 1.0 1.8 5.0 354 261 A 23 SER H A 26 GLU HGy 1.0 1.8 5.0 355 262 A 23 SER H A 26 GLU H 1.0 1.8 5.0 356 263 A 23 SER H A 27 VAL H 1.0 1.8 6.0 357 264 A 26 GLU H A 24 ALA HA 1.0 1.8 5.0 358 265 A 24 ALA HA A 27 VAL HB 1.0 1.8 5.0 359 266 A 27 VAL HGy% A 24 ALA HA 1.0 1.8 5.0 360 267 A 27 VAL H A 24 ALA HA 1.0 1.8 5.0 361 268 A 24 ALA HA A 28 GLN H 1.0 1.8 6.0 362 269 A 24 ALA HA A 40 ALA HB% 1.0 1.8 5.0 363 270 A 24 ALA HA A 43 ILE HD1% 1.0 1.8 5.0 364 271 A 24 ALA HA A 43 ILE HG2% 1.0 1.8 5.0 365 272 A 45 PHE HE% A 24 ALA HA 1.0 1.8 5.0 366 273 A 24 ALA HA A 45 PHE HZ 1.0 1.8 5.0 367 274 A 24 ALA HB% A 25 ASP HA 1.0 1.8 5.0 368 275 A 24 ALA HB% A 25 ASP H 1.0 1.8 3.5 369 276 A 24 ALA HB% A 27 VAL HB 1.0 1.8 5.0 370 277 A 27 VAL HGy% A 24 ALA HB% 1.0 1.8 5.0 371 278 A 24 ALA HB% A 28 GLN HGy 1.0 1.8 6.0 372 278 A 24 ALA HB% A 28 GLN HGx 1.0 1.8 6.0 373 279 A 24 ALA HB% A 40 ALA HA 1.0 1.8 5.0 374 280 A 24 ALA HB% A 40 ALA HB% 1.0 1.8 3.5 375 281 A 24 ALA HB% A 43 ILE HD1% 1.0 1.8 3.5 376 282 A 24 ALA HB% A 43 ILE HG2% 1.0 1.8 5.0 377 283 A 45 PHE HE% A 24 ALA HB% 1.0 1.8 5.0 378 284 A 24 ALA HB% A 45 PHE HZ 1.0 1.8 5.0 379 285 A 24 ALA HB% A 24 ALA H 1.0 1.8 3.5 380 286 A 25 ASP H A 24 ALA H 1.0 1.8 5.0 381 287 A 25 ASP HA A 28 GLN HBy 1.0 1.8 3.5 382 287 A 25 ASP HA A 28 GLN HBx 1.0 1.8 3.5 383 288 A 25 ASP HA A 28 GLN HGy 1.0 1.8 6.0 384 289 A 25 ASP HA A 28 GLN HGx 1.0 1.8 6.0 385 290 A 28 GLN H A 25 ASP HA 1.0 1.8 5.0 386 291 A 25 ASP HA A 29 ARG H 1.0 1.8 5.0 387 292 A 40 ALA HB% A 25 ASP HA 1.0 1.8 5.0 388 293 A 25 ASP H A 25 ASP HBx 1.0 1.8 3.5 389 293 A 25 ASP H A 25 ASP HBy 1.0 1.8 3.5 390 294 A 25 ASP H A 26 GLU H 1.0 1.8 3.5 391 295 A 26 GLU HA A 26 GLU HGx 1.0 1.8 3.5 392 295 A 26 GLU HGy A 26 GLU HA 1.0 1.8 3.5 393 296 A 26 GLU HA A 29 ARG HBx 1.0 1.8 5.0 394 296 A 26 GLU HA A 29 ARG HBy 1.0 1.8 5.0 395 297 A 26 GLU HA A 29 ARG HGx 1.0 1.8 5.0 396 297 A 26 GLU HA A 29 ARG HGy 1.0 1.8 5.0 397 298 A 29 ARG H A 26 GLU HA 1.0 1.8 5.0 398 299 A 26 GLU HA A 30 PHE H 1.0 1.8 5.0 399 300 A 78 MET HE% A 26 GLU HBy 1.0 1.8 3.5 400 300 A 78 MET HE% A 26 GLU HBx 1.0 1.8 3.5 401 301 A 27 VAL H A 26 GLU HBy 1.0 1.8 5.0 402 302 A 26 GLU HBx A 27 VAL H 1.0 1.8 5.0 403 303 A 78 MET HE% A 26 GLU HGx 1.0 1.8 5.0 404 303 A 78 MET HE% A 26 GLU HGy 1.0 1.8 5.0 405 304 A 26 GLU H A 26 GLU HBy 1.0 1.8 3.5 406 304 A 26 GLU HBx A 26 GLU H 1.0 1.8 3.5 407 305 A 26 GLU H A 26 GLU HGx 1.0 1.8 3.5 408 305 A 26 GLU H A 26 GLU HGy 1.0 1.8 3.5 409 306 A 27 VAL HGy% A 26 GLU H 1.0 1.8 5.0 410 307 A 27 VAL HA A 27 VAL HGx% 1.0 1.8 3.5 411 308 A 27 VAL HGy% A 27 VAL HA 1.0 1.8 3.5 412 309 A 27 VAL HA A 30 PHE HBy 1.0 1.8 5.0 413 310 A 27 VAL HA A 30 PHE HBx 1.0 1.8 5.0 414 311 A 27 VAL HA A 30 PHE HD% 1.0 1.8 5.0 415 312 A 27 VAL HA A 30 PHE H 1.0 1.8 5.0 416 313 A 27 VAL HA A 31 PHE H 1.0 1.8 5.0 417 314 A 27 VAL HA A 43 ILE HD1% 1.0 1.8 5.0 418 315 A 78 MET HE% A 27 VAL HA 1.0 1.8 3.5 419 316 A 27 VAL HB A 28 GLN H 1.0 1.8 3.5 420 317 A 27 VAL HB A 29 ARG H 1.0 1.8 6.0 421 318 A 27 VAL HB A 43 ILE HD1% 1.0 1.8 3.5 422 319 A 27 VAL HB A 43 ILE HG2% 1.0 1.8 5.0 423 320 A 28 GLN H A 27 VAL HGx% 1.0 1.8 5.0 424 321 A 27 VAL HGx% A 30 PHE HBy 1.0 1.8 6.0 425 322 A 27 VAL HGx% A 30 PHE HBx 1.0 1.8 6.0 426 323 A 30 PHE H A 27 VAL HGx% 1.0 1.8 6.0 427 324 A 27 VAL HGx% A 31 PHE HD% 1.0 1.8 3.5 428 325 A 31 PHE HE% A 27 VAL HGx% 1.0 1.8 5.0 429 326 A 27 VAL HGx% A 31 PHE H 1.0 1.8 6.0 430 327 A 43 ILE HG2% A 27 VAL HGx% 1.0 1.8 3.5 431 328 A 27 VAL HGx% A 44 ARG H 1.0 1.8 6.0 432 329 A 59 VAL HGy% A 27 VAL HGx% 1.0 1.8 3.5 433 330 A 78 MET HE% A 27 VAL HGx% 1.0 1.8 5.0 434 331 A 27 VAL HGy% A 28 GLN H 1.0 1.8 5.0 435 332 A 27 VAL HGy% A 30 PHE HBy 1.0 1.8 6.0 436 333 A 27 VAL HGy% A 30 PHE HBx 1.0 1.8 6.0 437 334 A 27 VAL HGy% A 31 PHE HD% 1.0 1.8 6.0 438 335 A 31 PHE HE% A 27 VAL HGy% 1.0 1.8 6.0 439 336 A 27 VAL HGy% A 43 ILE HG2% 1.0 1.8 3.5 440 337 A 27 VAL HGy% A 45 PHE HD% 1.0 1.8 6.0 441 338 A 27 VAL HGy% A 45 PHE HE% 1.0 1.8 5.0 442 339 A 27 VAL HGy% A 45 PHE HZ 1.0 1.8 5.0 443 340 A 57 ALA HB% A 27 VAL HGy% 1.0 1.8 5.0 444 341 A 59 VAL HGy% A 27 VAL HGy% 1.0 1.8 5.0 445 342 A 78 MET HE% A 27 VAL HGy% 1.0 1.8 3.5 446 343 A 27 VAL H A 27 VAL HB 1.0 1.8 3.5 447 344 A 27 VAL HGy% A 27 VAL H 1.0 1.8 3.5 448 345 A 27 VAL H A 28 GLN H 1.0 1.8 3.5 449 346 A 27 VAL H A 43 ILE HD1% 1.0 1.8 5.0 450 347 A 28 GLN HA A 28 GLN HE21 1.0 1.8 5.0 451 347 A 28 GLN HA A 28 GLN HE22 1.0 1.8 5.0 452 348 A 28 GLN HA A 31 PHE HBy 1.0 1.8 6.0 453 349 A 28 GLN HA A 31 PHE HBx 1.0 1.8 6.0 454 350 A 31 PHE HD% A 28 GLN HA 1.0 1.8 6.0 455 351 A 28 GLN HA A 36 ILE HD1% 1.0 1.8 3.5 456 352 A 43 ILE HD1% A 28 GLN HA 1.0 1.8 5.0 457 353 A 29 ARG HA A 28 GLN HBy 1.0 1.8 5.0 458 353 A 28 GLN HBx A 29 ARG HA 1.0 1.8 5.0 459 354 A 29 ARG H A 28 GLN HBy 1.0 1.8 3.5 460 354 A 28 GLN HBx A 29 ARG H 1.0 1.8 3.5 461 355 A 43 ILE HD1% A 28 GLN HBy 1.0 1.8 5.0 462 355 A 43 ILE HD1% A 28 GLN HBx 1.0 1.8 5.0 463 356 A 36 ILE HD1% A 28 GLN HBy 1.0 1.8 5.0 464 357 A 28 GLN HBx A 36 ILE HD1% 1.0 1.8 5.0 465 358 A 36 ILE HD1% A 28 GLN HE21 1.0 1.8 5.0 466 358 A 36 ILE HD1% A 28 GLN HE22 1.0 1.8 5.0 467 359 A 36 ILE HG2% A 28 GLN HE21 1.0 1.8 5.0 468 359 A 36 ILE HG2% A 28 GLN HE22 1.0 1.8 5.0 469 360 A 39 GLY HAy A 28 GLN HE21 1.0 1.8 5.0 470 360 A 28 GLN HE22 A 39 GLY HAx 1.0 1.8 5.0 471 360 A 39 GLY HAy A 28 GLN HE22 1.0 1.8 5.0 472 360 A 28 GLN HE21 A 39 GLY HAx 1.0 1.8 5.0 473 361 A 40 ALA HA A 28 GLN HE21 1.0 1.8 5.0 474 361 A 40 ALA HA A 28 GLN HE22 1.0 1.8 5.0 475 362 A 40 ALA HB% A 28 GLN HE21 1.0 1.8 5.0 476 362 A 40 ALA HB% A 28 GLN HE22 1.0 1.8 5.0 477 363 A 40 ALA H A 28 GLN HE21 1.0 1.8 5.0 478 363 A 40 ALA H A 28 GLN HE22 1.0 1.8 5.0 479 364 A 43 ILE HD1% A 28 GLN HE21 1.0 1.8 5.0 480 364 A 43 ILE HD1% A 28 GLN HE22 1.0 1.8 5.0 481 365 A 40 ALA HB% A 28 GLN HE21 1.0 1.8 5.0 482 366 A 40 ALA HB% A 28 GLN HE22 1.0 1.8 5.0 483 367 A 28 GLN HE21 A 28 GLN HGy 1.0 1.8 5.0 484 367 A 28 GLN HGx A 28 GLN HE21 1.0 1.8 5.0 485 367 A 28 GLN HGx A 28 GLN HE22 1.0 1.8 5.0 486 367 A 28 GLN HE22 A 28 GLN HGy 1.0 1.8 5.0 487 368 A 36 ILE HG2% A 28 GLN HGy 1.0 1.8 5.0 488 368 A 28 GLN HGx A 36 ILE HG2% 1.0 1.8 5.0 489 369 A 40 ALA HA A 28 GLN HGy 1.0 1.8 5.0 490 369 A 28 GLN HGx A 40 ALA HA 1.0 1.8 5.0 491 370 A 29 ARG H A 28 GLN HGy 1.0 1.8 6.0 492 371 A 36 ILE HD1% A 28 GLN HGy 1.0 1.8 5.0 493 372 A 43 ILE HD1% A 28 GLN HGy 1.0 1.8 5.0 494 373 A 28 GLN HGx A 29 ARG H 1.0 1.8 6.0 495 374 A 28 GLN HGx A 36 ILE HD1% 1.0 1.8 5.0 496 375 A 43 ILE HD1% A 28 GLN HGx 1.0 1.8 5.0 497 376 A 28 GLN H A 28 GLN HBy 1.0 1.8 3.5 498 376 A 28 GLN H A 28 GLN HBx 1.0 1.8 3.5 499 377 A 28 GLN H A 28 GLN HGy 1.0 1.8 5.0 500 378 A 28 GLN H A 28 GLN HGx 1.0 1.8 5.0 501 379 A 28 GLN H A 29 ARG H 1.0 1.8 3.5 502 380 A 28 GLN H A 30 PHE H 1.0 1.8 5.0 503 381 A 28 GLN H A 36 ILE HD1% 1.0 1.8 5.0 504 382 A 28 GLN H A 43 ILE HD1% 1.0 1.8 5.0 505 383 A 28 GLN H A 43 ILE HG2% 1.0 1.8 5.0 506 384 A 29 ARG HA A 29 ARG HGx 1.0 1.8 3.5 507 384 A 29 ARG HGy A 29 ARG HA 1.0 1.8 3.5 508 385 A 29 ARG HA A 32 SER HBy 1.0 1.8 5.0 509 386 A 29 ARG HA A 32 SER HBx 1.0 1.8 5.0 510 387 A 29 ARG HA A 32 SER H 1.0 1.8 6.0 511 388 A 29 ARG HBx A 29 ARG HDy 1.0 1.8 3.5 512 388 A 29 ARG HBy A 29 ARG HDy 1.0 1.8 3.5 513 388 A 29 ARG HDx A 29 ARG HBx 1.0 1.8 3.5 514 388 A 29 ARG HBy A 29 ARG HDx 1.0 1.8 3.5 515 389 A 30 PHE H A 29 ARG HDy 1.0 1.8 6.0 516 390 A 30 PHE H A 29 ARG HDx 1.0 1.8 6.0 517 391 A 30 PHE H A 29 ARG HGx 1.0 1.8 5.0 518 391 A 29 ARG HGy A 30 PHE H 1.0 1.8 5.0 519 392 A 29 ARG H A 29 ARG HBx 1.0 1.8 3.5 520 392 A 29 ARG H A 29 ARG HBy 1.0 1.8 3.5 521 393 A 29 ARG H A 29 ARG HDy 1.0 1.8 5.0 522 393 A 29 ARG H A 29 ARG HDx 1.0 1.8 5.0 523 394 A 29 ARG H A 29 ARG HGx 1.0 1.8 5.0 524 394 A 29 ARG H A 29 ARG HGy 1.0 1.8 5.0 525 395 A 30 PHE HD% A 30 PHE HA 1.0 1.8 5.0 526 396 A 31 PHE HD% A 30 PHE HBx 1.0 1.8 5.0 527 396 A 31 PHE HD% A 30 PHE HBy 1.0 1.8 5.0 528 397 A 31 PHE H A 30 PHE HBy 1.0 1.8 5.0 529 398 A 78 MET HE% A 30 PHE HBy 1.0 1.8 5.0 530 399 A 31 PHE H A 30 PHE HBx 1.0 1.8 5.0 531 400 A 78 MET HE% A 30 PHE HBx 1.0 1.8 5.0 532 401 A 30 PHE HD% A 31 PHE H 1.0 1.8 5.0 533 402 A 83 VAL HGx% A 30 PHE HE% 1.0 1.8 5.0 534 403 A 83 VAL HGy% A 30 PHE HE% 1.0 1.8 5.0 535 404 A 85 VAL HGy% A 30 PHE HE% 1.0 1.8 5.0 536 405 A 30 PHE H A 30 PHE HBy 1.0 1.8 3.5 537 406 A 30 PHE H A 30 PHE HBx 1.0 1.8 3.5 538 407 A 30 PHE H A 30 PHE HD% 1.0 1.8 5.0 539 408 A 30 PHE H A 31 PHE H 1.0 1.8 3.5 540 409 A 30 PHE H A 32 SER H 1.0 1.8 6.0 541 410 A 78 MET HE% A 30 PHE H 1.0 1.8 5.0 542 411 A 30 PHE HZ A 76 GLU HBx 1.0 1.8 5.0 543 411 A 30 PHE HZ A 76 GLU HBy 1.0 1.8 5.0 544 412 A 30 PHE HZ A 83 VAL HB 1.0 1.8 5.0 545 413 A 83 VAL HGx% A 30 PHE HZ 1.0 1.8 5.0 546 414 A 83 VAL HGy% A 30 PHE HZ 1.0 1.8 5.0 547 415 A 31 PHE HD% A 31 PHE HA 1.0 1.8 5.0 548 416 A 32 SER H A 31 PHE HA 1.0 1.8 3.5 549 417 A 31 PHE HBy A 34 CYS HBx 1.0 1.8 5.0 550 417 A 31 PHE HBx A 34 CYS HBx 1.0 1.8 5.0 551 417 A 34 CYS HBy A 31 PHE HBx 1.0 1.8 5.0 552 417 A 31 PHE HBy A 34 CYS HBy 1.0 1.8 5.0 553 418 A 34 CYS H A 31 PHE HBx 1.0 1.8 5.0 554 418 A 31 PHE HBy A 34 CYS H 1.0 1.8 5.0 555 419 A 36 ILE HD1% A 31 PHE HBy 1.0 1.8 5.0 556 420 A 36 ILE HD1% A 31 PHE HBx 1.0 1.8 5.0 557 421 A 31 PHE HZ A 31 PHE HD% 1.0 1.8 5.0 558 422 A 31 PHE HD% A 36 ILE HD1% 1.0 1.8 5.0 559 423 A 59 VAL HGy% A 31 PHE HD% 1.0 1.8 5.0 560 424 A 31 PHE HD% A 61 LEU HDy% 1.0 1.8 6.0 561 425 A 31 PHE HD% A 70 ALA HA 1.0 1.8 5.0 562 426 A 70 ALA HB% A 31 PHE HD% 1.0 1.8 5.0 563 427 A 31 PHE HD% A 73 LYS HDx 1.0 1.8 5.0 564 427 A 31 PHE HD% A 73 LYS HDy 1.0 1.8 5.0 565 428 A 31 PHE HD% A 73 LYS HEx 1.0 1.8 6.0 566 428 A 31 PHE HD% A 73 LYS HEy 1.0 1.8 6.0 567 429 A 31 PHE HD% A 73 LYS HGx 1.0 1.8 6.0 568 429 A 31 PHE HD% A 73 LYS HGy 1.0 1.8 6.0 569 430 A 31 PHE HE% A 59 VAL HGx% 1.0 1.8 5.0 570 431 A 31 PHE HE% A 59 VAL HGy% 1.0 1.8 5.0 571 432 A 31 PHE HE% A 70 ALA HA 1.0 1.8 5.0 572 433 A 70 ALA HB% A 31 PHE HE% 1.0 1.8 5.0 573 434 A 31 PHE HE% A 73 LYS HBx 1.0 1.8 5.0 574 434 A 31 PHE HE% A 73 LYS HBy 1.0 1.8 5.0 575 435 A 31 PHE HE% A 73 LYS HDx 1.0 1.8 5.0 576 435 A 31 PHE HE% A 73 LYS HDy 1.0 1.8 5.0 577 436 A 31 PHE HE% A 73 LYS HGx 1.0 1.8 6.0 578 436 A 31 PHE HE% A 73 LYS HGy 1.0 1.8 6.0 579 437 A 85 VAL HGx% A 31 PHE HE% 1.0 1.8 5.0 580 438 A 85 VAL HGy% A 31 PHE HE% 1.0 1.8 5.0 581 439 A 31 PHE H A 31 PHE HBx 1.0 1.8 3.5 582 439 A 31 PHE H A 31 PHE HBy 1.0 1.8 3.5 583 440 A 31 PHE H A 32 SER H 1.0 1.8 5.0 584 441 A 31 PHE H A 36 ILE HD1% 1.0 1.8 5.0 585 442 A 31 PHE HZ A 59 VAL HGy% 1.0 1.8 6.0 586 443 A 85 VAL HGx% A 31 PHE HZ 1.0 1.8 5.0 587 444 A 85 VAL HGy% A 31 PHE HZ 1.0 1.8 3.5 588 445 A 34 CYS H A 32 SER HA 1.0 1.8 5.0 589 446 A 32 SER H A 32 SER HBy 1.0 1.8 3.5 590 446 A 32 SER H A 32 SER HBx 1.0 1.8 3.5 591 447 A 32 SER H A 33 ASP H 1.0 1.8 5.0 592 448 A 32 SER H A 34 CYS H 1.0 1.8 5.0 593 449 A 69 LEU HDx% A 33 ASP HBx 1.0 1.8 5.0 594 449 A 33 ASP HBy A 69 LEU HDx% 1.0 1.8 5.0 595 450 A 69 LEU HDy% A 33 ASP HBx 1.0 1.8 6.0 596 450 A 33 ASP HBy A 69 LEU HDy% 1.0 1.8 6.0 597 451 A 34 CYS H A 33 ASP H 1.0 1.8 3.5 598 452 A 69 LEU HDx% A 34 CYS HA 1.0 1.8 5.0 599 453 A 35 LYS HA A 34 CYS HBx 1.0 1.8 5.0 600 453 A 34 CYS HBy A 35 LYS HA 1.0 1.8 5.0 601 454 A 36 ILE HD1% A 34 CYS HBx 1.0 1.8 5.0 602 454 A 36 ILE HD1% A 34 CYS HBy 1.0 1.8 5.0 603 455 A 61 LEU HDx% A 34 CYS HBx 1.0 1.8 5.0 604 455 A 61 LEU HDx% A 34 CYS HBy 1.0 1.8 5.0 605 456 A 61 LEU HDy% A 34 CYS HBx 1.0 1.8 3.5 606 456 A 34 CYS HBy A 61 LEU HDy% 1.0 1.8 3.5 607 457 A 69 LEU HDx% A 34 CYS HBx 1.0 1.8 6.0 608 457 A 34 CYS HBy A 69 LEU HDx% 1.0 1.8 6.0 609 458 A 34 CYS H A 34 CYS HBx 1.0 1.8 3.5 610 458 A 34 CYS HBy A 34 CYS H 1.0 1.8 3.5 611 459 A 34 CYS H A 35 LYS H 1.0 1.8 5.0 612 460 A 34 CYS H A 61 LEU HDy% 1.0 1.8 5.0 613 461 A 35 LYS HA A 35 LYS HDy 1.0 1.8 5.0 614 462 A 35 LYS HA A 35 LYS HDx 1.0 1.8 5.0 615 463 A 35 LYS HA A 35 LYS HEx 1.0 1.8 6.0 616 463 A 35 LYS HA A 35 LYS HEy 1.0 1.8 6.0 617 464 A 35 LYS HA A 35 LYS HGx 1.0 1.8 3.5 618 464 A 35 LYS HA A 35 LYS HGy 1.0 1.8 3.5 619 465 A 35 LYS HA A 36 ILE HB 1.0 1.8 6.0 620 466 A 35 LYS HA A 36 ILE H 1.0 1.8 3.5 621 467 A 35 LYS HBx A 35 LYS HEx 1.0 1.8 5.0 622 467 A 35 LYS HBy A 35 LYS HEx 1.0 1.8 5.0 623 467 A 35 LYS HEy A 35 LYS HBx 1.0 1.8 5.0 624 467 A 35 LYS HEy A 35 LYS HBy 1.0 1.8 5.0 625 468 A 35 LYS HBy A 62 GLU HBx 1.0 1.8 5.0 626 468 A 35 LYS HBx A 62 GLU HBx 1.0 1.8 5.0 627 468 A 62 GLU HBy A 35 LYS HBx 1.0 1.8 5.0 628 468 A 35 LYS HBy A 62 GLU HBy 1.0 1.8 5.0 629 469 A 35 LYS HBy A 66 GLU HGx 1.0 1.8 5.0 630 469 A 35 LYS HBx A 66 GLU HGx 1.0 1.8 5.0 631 469 A 66 GLU HGy A 35 LYS HBx 1.0 1.8 5.0 632 469 A 35 LYS HBy A 66 GLU HGy 1.0 1.8 5.0 633 470 A 36 ILE H A 35 LYS HBy 1.0 1.8 6.0 634 471 A 36 ILE H A 35 LYS HBx 1.0 1.8 6.0 635 472 A 35 LYS HDy A 66 GLU HGx 1.0 1.8 5.0 636 472 A 35 LYS HDy A 66 GLU HGy 1.0 1.8 5.0 637 473 A 35 LYS HDx A 66 GLU HGx 1.0 1.8 5.0 638 473 A 35 LYS HDx A 66 GLU HGy 1.0 1.8 5.0 639 474 A 35 LYS HEy A 35 LYS HGx 1.0 1.8 3.5 640 474 A 35 LYS HEx A 35 LYS HGx 1.0 1.8 3.5 641 474 A 35 LYS HGy A 35 LYS HEx 1.0 1.8 3.5 642 474 A 35 LYS HEy A 35 LYS HGy 1.0 1.8 3.5 643 475 A 36 ILE H A 35 LYS HGx 1.0 1.8 5.0 644 475 A 35 LYS HGy A 36 ILE H 1.0 1.8 5.0 645 476 A 35 LYS HGx A 66 GLU HGx 1.0 1.8 5.0 646 476 A 66 GLU HGy A 35 LYS HGx 1.0 1.8 5.0 647 476 A 35 LYS HGy A 66 GLU HGy 1.0 1.8 5.0 648 476 A 35 LYS HGy A 66 GLU HGx 1.0 1.8 5.0 649 477 A 35 LYS H A 35 LYS HDy 1.0 1.8 6.0 650 478 A 35 LYS H A 35 LYS HDx 1.0 1.8 6.0 651 479 A 35 LYS H A 35 LYS HGx 1.0 1.8 5.0 652 479 A 35 LYS H A 35 LYS HGy 1.0 1.8 5.0 653 480 A 35 LYS H A 66 GLU HBy 1.0 1.8 6.0 654 481 A 35 LYS H A 66 GLU HBx 1.0 1.8 6.0 655 482 A 35 LYS H A 66 GLU HGx 1.0 1.8 6.0 656 482 A 35 LYS H A 66 GLU HGy 1.0 1.8 6.0 657 483 A 36 ILE HD1% A 36 ILE HA 1.0 1.8 5.0 658 484 A 36 ILE HG2% A 36 ILE HA 1.0 1.8 3.5 659 485 A 36 ILE HA A 37 GLN H 1.0 1.8 3.5 660 486 A 59 VAL HGx% A 36 ILE HA 1.0 1.8 6.0 661 487 A 36 ILE HA A 61 LEU HA 1.0 1.8 5.0 662 488 A 61 LEU HDy% A 36 ILE HA 1.0 1.8 5.0 663 489 A 36 ILE HA A 62 GLU H 1.0 1.8 5.0 664 490 A 36 ILE HD1% A 36 ILE HB 1.0 1.8 3.5 665 491 A 36 ILE HB A 37 GLN H 1.0 1.8 5.0 666 492 A 36 ILE HB A 39 GLY HAx 1.0 1.8 5.0 667 492 A 39 GLY HAy A 36 ILE HB 1.0 1.8 5.0 668 493 A 36 ILE HB A 39 GLY H 1.0 1.8 5.0 669 494 A 36 ILE HB A 42 GLY HAx 1.0 1.8 6.0 670 494 A 36 ILE HB A 42 GLY HAy 1.0 1.8 6.0 671 495 A 36 ILE HD1% A 39 GLY HAx 1.0 1.8 5.0 672 495 A 36 ILE HD1% A 39 GLY HAy 1.0 1.8 5.0 673 496 A 36 ILE HD1% A 43 ILE HG1x 1.0 1.8 5.0 674 496 A 36 ILE HD1% A 43 ILE HG1y 1.0 1.8 5.0 675 497 A 36 ILE HD1% A 59 VAL HGx% 1.0 1.8 3.5 676 498 A 37 GLN H A 36 ILE HG1x 1.0 1.8 5.0 677 498 A 37 GLN H A 36 ILE HG1y 1.0 1.8 5.0 678 499 A 59 VAL HGx% A 36 ILE HG1x 1.0 1.8 5.0 679 499 A 59 VAL HGx% A 36 ILE HG1y 1.0 1.8 5.0 680 500 A 36 ILE HD1% A 36 ILE HG2% 1.0 1.8 3.5 681 501 A 36 ILE HG2% A 36 ILE HG1x 1.0 1.8 3.5 682 501 A 36 ILE HG2% A 36 ILE HG1y 1.0 1.8 3.5 683 502 A 36 ILE HG2% A 37 GLN H 1.0 1.8 3.5 684 503 A 36 ILE HG2% A 39 GLY HAx 1.0 1.8 5.0 685 503 A 36 ILE HG2% A 39 GLY HAy 1.0 1.8 5.0 686 504 A 36 ILE HG2% A 39 GLY H 1.0 1.8 5.0 687 505 A 40 ALA HA A 36 ILE HG2% 1.0 1.8 5.0 688 506 A 36 ILE HG2% A 42 GLY HAx 1.0 1.8 3.5 689 506 A 36 ILE HG2% A 42 GLY HAy 1.0 1.8 3.5 690 507 A 36 ILE HG2% A 42 GLY H 1.0 1.8 5.0 691 508 A 36 ILE HG2% A 43 ILE HG1x 1.0 1.8 3.5 692 508 A 36 ILE HG2% A 43 ILE HG1y 1.0 1.8 3.5 693 509 A 36 ILE HG2% A 43 ILE H 1.0 1.8 5.0 694 510 A 36 ILE HG2% A 59 VAL HGx% 1.0 1.8 3.5 695 511 A 36 ILE HG2% A 60 GLU HBx 1.0 1.8 5.0 696 511 A 60 GLU HBy A 36 ILE HG2% 1.0 1.8 5.0 697 512 A 36 ILE HG2% A 60 GLU H 1.0 1.8 5.0 698 513 A 36 ILE HG2% A 61 LEU HA 1.0 1.8 5.0 699 514 A 36 ILE HD1% A 36 ILE H 1.0 1.8 5.0 700 515 A 36 ILE H A 36 ILE HG1x 1.0 1.8 5.0 701 515 A 36 ILE H A 36 ILE HG1y 1.0 1.8 5.0 702 516 A 61 LEU HDy% A 36 ILE H 1.0 1.8 6.0 703 517 A 37 GLN HA A 37 GLN HGy 1.0 1.8 3.5 704 517 A 37 GLN HA A 37 GLN HGx 1.0 1.8 3.5 705 518 A 39 GLY H A 37 GLN HA 1.0 1.8 5.0 706 519 A 62 GLU H A 37 GLN HA 1.0 1.8 6.0 707 520 A 37 GLN HBy A 60 GLU HBx 1.0 1.8 5.0 708 520 A 37 GLN HBx A 60 GLU HBx 1.0 1.8 5.0 709 520 A 60 GLU HBy A 37 GLN HBx 1.0 1.8 5.0 710 520 A 60 GLU HBy A 37 GLN HBy 1.0 1.8 5.0 711 521 A 62 GLU HA A 37 GLN HBx 1.0 1.8 5.0 712 521 A 37 GLN HBy A 62 GLU HA 1.0 1.8 5.0 713 522 A 37 GLN HE22 A 37 GLN HGy 1.0 1.8 3.5 714 522 A 37 GLN HE21 A 37 GLN HGy 1.0 1.8 3.5 715 522 A 37 GLN HGx A 37 GLN HE21 1.0 1.8 3.5 716 522 A 37 GLN HGx A 37 GLN HE22 1.0 1.8 3.5 717 523 A 38 ASN HA A 37 GLN HGy 1.0 1.8 5.0 718 523 A 37 GLN HGx A 38 ASN HA 1.0 1.8 5.0 719 524 A 38 ASN HD21 A 37 GLN HGy 1.0 1.8 5.0 720 524 A 38 ASN HD22 A 37 GLN HGy 1.0 1.8 5.0 721 524 A 37 GLN HGx A 38 ASN HD21 1.0 1.8 5.0 722 524 A 37 GLN HGx A 38 ASN HD22 1.0 1.8 5.0 723 525 A 38 ASN H A 37 GLN HGy 1.0 1.8 5.0 724 525 A 37 GLN HGx A 38 ASN H 1.0 1.8 5.0 725 526 A 62 GLU HA A 37 GLN HGy 1.0 1.8 6.0 726 526 A 37 GLN HGx A 62 GLU HA 1.0 1.8 6.0 727 527 A 38 ASN HD21 A 37 GLN HGy 1.0 1.8 6.0 728 528 A 38 ASN HD22 A 37 GLN HGy 1.0 1.8 6.0 729 529 A 37 GLN HGx A 38 ASN HD21 1.0 1.8 6.0 730 530 A 37 GLN HGx A 38 ASN HD22 1.0 1.8 6.0 731 531 A 37 GLN H A 37 GLN HGy 1.0 1.8 5.0 732 531 A 37 GLN H A 37 GLN HGx 1.0 1.8 5.0 733 532 A 37 GLN H A 60 GLU HBx 1.0 1.8 5.0 734 532 A 60 GLU HBy A 37 GLN H 1.0 1.8 5.0 735 533 A 37 GLN H A 61 LEU HA 1.0 1.8 5.0 736 534 A 61 LEU HDy% A 37 GLN H 1.0 1.8 5.0 737 535 A 61 LEU H A 37 GLN H 1.0 1.8 5.0 738 536 A 38 ASN HD22 A 38 ASN HBy 1.0 1.8 3.5 739 536 A 38 ASN HD21 A 38 ASN HBy 1.0 1.8 3.5 740 536 A 38 ASN HD22 A 38 ASN HBx 1.0 1.8 3.5 741 536 A 38 ASN HD21 A 38 ASN HBx 1.0 1.8 3.5 742 537 A 38 ASN HBy A 41 GLN HBy 1.0 1.8 3.5 743 537 A 38 ASN HBx A 41 GLN HBy 1.0 1.8 3.5 744 537 A 41 GLN HBx A 38 ASN HBy 1.0 1.8 3.5 745 537 A 38 ASN HBx A 41 GLN HBx 1.0 1.8 3.5 746 538 A 41 GLN H A 38 ASN HBy 1.0 1.8 5.0 747 538 A 38 ASN HBx A 41 GLN H 1.0 1.8 5.0 748 539 A 38 ASN HBy A 41 GLN HBy 1.0 1.8 5.0 749 540 A 41 GLN HBx A 38 ASN HBy 1.0 1.8 5.0 750 541 A 42 GLY H A 38 ASN HBy 1.0 1.8 5.0 751 542 A 38 ASN HBx A 41 GLN HBy 1.0 1.8 5.0 752 543 A 38 ASN HBx A 41 GLN HBx 1.0 1.8 5.0 753 544 A 42 GLY H A 38 ASN HBx 1.0 1.8 5.0 754 545 A 38 ASN HD21 A 41 GLN HBx 1.0 1.8 5.0 755 545 A 38 ASN HD22 A 41 GLN HBy 1.0 1.8 5.0 756 545 A 38 ASN HD22 A 41 GLN HBx 1.0 1.8 5.0 757 545 A 38 ASN HD21 A 41 GLN HBy 1.0 1.8 5.0 758 546 A 39 GLY H A 38 ASN H 1.0 1.8 5.0 759 547 A 40 ALA HB% A 39 GLY HAx 1.0 1.8 5.0 760 547 A 40 ALA HB% A 39 GLY HAy 1.0 1.8 5.0 761 548 A 40 ALA H A 39 GLY HAx 1.0 1.8 3.5 762 548 A 39 GLY HAy A 40 ALA H 1.0 1.8 3.5 763 549 A 41 GLN H A 39 GLY HAx 1.0 1.8 5.0 764 549 A 39 GLY HAy A 41 GLN H 1.0 1.8 5.0 765 550 A 40 ALA H A 39 GLY H 1.0 1.8 5.0 766 551 A 40 ALA HA A 42 GLY H 1.0 1.8 5.0 767 552 A 40 ALA HA A 43 ILE HB 1.0 1.8 6.0 768 553 A 43 ILE HD1% A 40 ALA HA 1.0 1.8 3.5 769 554 A 40 ALA HA A 43 ILE HG1x 1.0 1.8 5.0 770 554 A 40 ALA HA A 43 ILE HG1y 1.0 1.8 5.0 771 555 A 40 ALA HA A 43 ILE H 1.0 1.8 5.0 772 556 A 40 ALA HB% A 41 GLN HA 1.0 1.8 5.0 773 557 A 40 ALA HB% A 41 GLN HE21 1.0 1.8 5.0 774 558 A 40 ALA HB% A 42 GLY H 1.0 1.8 5.0 775 559 A 40 ALA HB% A 43 ILE HD1% 1.0 1.8 5.0 776 560 A 40 ALA HB% A 40 ALA H 1.0 1.8 3.5 777 561 A 40 ALA H A 41 GLN H 1.0 1.8 5.0 778 562 A 41 GLN HA A 41 GLN HE21 1.0 1.8 5.0 779 563 A 41 GLN HA A 41 GLN HGx 1.0 1.8 3.5 780 563 A 41 GLN HA A 41 GLN HGy 1.0 1.8 3.5 781 564 A 43 ILE H A 41 GLN HA 1.0 1.8 5.0 782 565 A 42 GLY H A 41 GLN HBy 1.0 1.8 5.0 783 566 A 42 GLY H A 41 GLN HBx 1.0 1.8 5.0 784 567 A 42 GLY H A 41 GLN HGx 1.0 1.8 6.0 785 567 A 42 GLY H A 41 GLN HGy 1.0 1.8 6.0 786 568 A 41 GLN H A 41 GLN HBy 1.0 1.8 3.5 787 568 A 41 GLN HBx A 41 GLN H 1.0 1.8 3.5 788 569 A 41 GLN H A 41 GLN HGx 1.0 1.8 5.0 789 569 A 41 GLN H A 41 GLN HGy 1.0 1.8 5.0 790 570 A 42 GLY H A 41 GLN H 1.0 1.8 3.5 791 571 A 43 ILE H A 41 GLN H 1.0 1.8 5.0 792 572 A 42 GLY HAx A 60 GLU HBx 1.0 1.8 5.0 793 572 A 42 GLY HAy A 60 GLU HBx 1.0 1.8 5.0 794 572 A 60 GLU HBy A 42 GLY HAx 1.0 1.8 5.0 795 572 A 60 GLU HBy A 42 GLY HAy 1.0 1.8 5.0 796 573 A 60 GLU H A 42 GLY HAx 1.0 1.8 5.0 797 573 A 42 GLY HAy A 60 GLU H 1.0 1.8 5.0 798 574 A 42 GLY H A 43 ILE HB 1.0 1.8 5.0 799 575 A 42 GLY H A 43 ILE HG1x 1.0 1.8 5.0 800 575 A 43 ILE HG1y A 42 GLY H 1.0 1.8 5.0 801 576 A 42 GLY H A 43 ILE H 1.0 1.8 3.5 802 577 A 43 ILE HD1% A 43 ILE HA 1.0 1.8 5.0 803 578 A 43 ILE HA A 43 ILE HG1x 1.0 1.8 3.5 804 578 A 43 ILE HG1y A 43 ILE HA 1.0 1.8 3.5 805 579 A 43 ILE HG2% A 43 ILE HA 1.0 1.8 3.5 806 580 A 44 ARG H A 43 ILE HA 1.0 1.8 3.5 807 581 A 43 ILE HA A 59 VAL HA 1.0 1.8 5.0 808 582 A 59 VAL HGy% A 43 ILE HA 1.0 1.8 5.0 809 583 A 60 GLU H A 43 ILE HA 1.0 1.8 5.0 810 584 A 43 ILE HD1% A 43 ILE HB 1.0 1.8 3.5 811 585 A 59 VAL HGy% A 43 ILE HB 1.0 1.8 6.0 812 586 A 43 ILE HD1% A 59 VAL HA 1.0 1.8 6.0 813 587 A 43 ILE HD1% A 59 VAL HGx% 1.0 1.8 5.0 814 588 A 59 VAL HGy% A 43 ILE HD1% 1.0 1.8 5.0 815 589 A 44 ARG H A 43 ILE HG1x 1.0 1.8 6.0 816 589 A 44 ARG H A 43 ILE HG1y 1.0 1.8 6.0 817 590 A 59 VAL HGx% A 43 ILE HG1x 1.0 1.8 3.5 818 590 A 59 VAL HGx% A 43 ILE HG1y 1.0 1.8 3.5 819 591 A 59 VAL HGy% A 43 ILE HG1x 1.0 1.8 5.0 820 591 A 59 VAL HGy% A 43 ILE HG1y 1.0 1.8 5.0 821 592 A 60 GLU H A 43 ILE HG1x 1.0 1.8 5.0 822 592 A 43 ILE HG1y A 60 GLU H 1.0 1.8 5.0 823 593 A 43 ILE HD1% A 43 ILE HG2% 1.0 1.8 3.5 824 594 A 43 ILE HG2% A 43 ILE HG1x 1.0 1.8 3.5 825 594 A 43 ILE HG2% A 43 ILE HG1y 1.0 1.8 3.5 826 595 A 43 ILE HG2% A 44 ARG H 1.0 1.8 5.0 827 596 A 45 PHE HD% A 43 ILE HG2% 1.0 1.8 5.0 828 597 A 45 PHE HE% A 43 ILE HG2% 1.0 1.8 5.0 829 598 A 43 ILE HG2% A 45 PHE H 1.0 1.8 6.0 830 599 A 43 ILE HG2% A 45 PHE HZ 1.0 1.8 5.0 831 600 A 57 ALA HB% A 43 ILE HG2% 1.0 1.8 3.5 832 601 A 43 ILE HG2% A 59 VAL HGx% 1.0 1.8 5.0 833 602 A 59 VAL HGy% A 43 ILE HG2% 1.0 1.8 3.5 834 603 A 43 ILE H A 43 ILE HB 1.0 1.8 3.5 835 604 A 43 ILE HD1% A 43 ILE H 1.0 1.8 5.0 836 605 A 43 ILE H A 43 ILE HG1x 1.0 1.8 5.0 837 605 A 43 ILE HG1y A 43 ILE H 1.0 1.8 5.0 838 606 A 44 ARG H A 43 ILE H 1.0 1.8 5.0 839 607 A 44 ARG HA A 44 ARG HDx 1.0 1.8 5.0 840 607 A 44 ARG HA A 44 ARG HDy 1.0 1.8 5.0 841 608 A 45 PHE H A 44 ARG HA 1.0 1.8 3.5 842 609 A 44 ARG HA A 97 LEU HDx% 1.0 1.8 5.0 843 610 A 44 ARG HBx A 58 PHE HBx 1.0 1.8 5.0 844 610 A 44 ARG HBy A 58 PHE HBx 1.0 1.8 5.0 845 610 A 58 PHE HBy A 44 ARG HBy 1.0 1.8 5.0 846 610 A 58 PHE HBy A 44 ARG HBx 1.0 1.8 5.0 847 611 A 97 LEU HDx% A 44 ARG HBy 1.0 1.8 5.0 848 611 A 97 LEU HDx% A 44 ARG HBx 1.0 1.8 5.0 849 612 A 58 PHE H A 44 ARG HBy 1.0 1.8 5.0 850 613 A 44 ARG HBx A 58 PHE H 1.0 1.8 5.0 851 614 A 97 LEU HDx% A 44 ARG HDx 1.0 1.8 5.0 852 614 A 44 ARG HDy A 97 LEU HDx% 1.0 1.8 5.0 853 615 A 97 LEU HDx% A 44 ARG HE 1.0 1.8 6.0 854 616 A 97 LEU HDx% A 44 ARG HGx 1.0 1.8 5.0 855 616 A 97 LEU HDx% A 44 ARG HGy 1.0 1.8 5.0 856 617 A 44 ARG H A 44 ARG HDx 1.0 1.8 5.0 857 617 A 44 ARG H A 44 ARG HDy 1.0 1.8 5.0 858 618 A 44 ARG H A 44 ARG HGx 1.0 1.8 5.0 859 618 A 44 ARG H A 44 ARG HGy 1.0 1.8 5.0 860 619 A 57 ALA HB% A 44 ARG H 1.0 1.8 5.0 861 620 A 44 ARG H A 58 PHE H 1.0 1.8 5.0 862 621 A 44 ARG H A 59 VAL HA 1.0 1.8 5.0 863 622 A 59 VAL HGy% A 44 ARG H 1.0 1.8 5.0 864 623 A 45 PHE HD% A 45 PHE HA 1.0 1.8 5.0 865 624 A 45 PHE HA A 46 ILE H 1.0 1.8 3.5 866 625 A 45 PHE HA A 57 ALA HA 1.0 1.8 5.0 867 626 A 57 ALA HB% A 45 PHE HA 1.0 1.8 3.5 868 627 A 58 PHE H A 45 PHE HA 1.0 1.8 5.0 869 628 A 47 TYR HE% A 45 PHE HBx 1.0 1.8 3.5 870 628 A 45 PHE HBy A 47 TYR HE% 1.0 1.8 3.5 871 629 A 46 ILE H A 45 PHE HBy 1.0 1.8 5.0 872 630 A 46 ILE H A 45 PHE HBx 1.0 1.8 5.0 873 631 A 45 PHE HD% A 46 ILE H 1.0 1.8 5.0 874 632 A 57 ALA HB% A 45 PHE HD% 1.0 1.8 5.0 875 633 A 57 ALA HB% A 45 PHE HE% 1.0 1.8 5.0 876 634 A 45 PHE H A 45 PHE HBx 1.0 1.8 3.5 877 634 A 45 PHE H A 45 PHE HBy 1.0 1.8 3.5 878 635 A 45 PHE HD% A 45 PHE H 1.0 1.8 5.0 879 636 A 45 PHE H A 97 LEU HDx% 1.0 1.8 6.0 880 637 A 46 ILE HA A 46 ILE HD1% 1.0 1.8 5.0 881 638 A 46 ILE HA A 46 ILE HG2% 1.0 1.8 3.5 882 639 A 46 ILE HA A 47 TYR H 1.0 1.8 3.5 883 640 A 46 ILE HA A 96 VAL HGx% 1.0 1.8 6.0 884 641 A 46 ILE HA A 97 LEU HDy% 1.0 1.8 5.0 885 642 A 97 LEU HDy% A 46 ILE HB 1.0 1.8 6.0 886 643 A 46 ILE HD1% A 56 GLU HBx 1.0 1.8 5.0 887 643 A 46 ILE HD1% A 56 GLU HBy 1.0 1.8 5.0 888 644 A 58 PHE HD% A 46 ILE HD1% 1.0 1.8 5.0 889 645 A 58 PHE HE% A 46 ILE HD1% 1.0 1.8 5.0 890 646 A 58 PHE H A 46 ILE HD1% 1.0 1.8 5.0 891 647 A 46 ILE HD1% A 96 VAL HB 1.0 1.8 5.0 892 648 A 46 ILE HD1% A 96 VAL HGx% 1.0 1.8 5.0 893 649 A 46 ILE HD1% A 97 LEU HDy% 1.0 1.8 5.0 894 650 A 58 PHE HE% A 46 ILE HG1x 1.0 1.8 5.0 895 650 A 58 PHE HE% A 46 ILE HG1y 1.0 1.8 5.0 896 651 A 97 LEU HDy% A 46 ILE HG1x 1.0 1.8 5.0 897 651 A 97 LEU HDy% A 46 ILE HG1y 1.0 1.8 5.0 898 652 A 46 ILE HG2% A 100 THR HB 1.0 1.8 5.0 899 653 A 46 ILE HG2% A 100 THR HG2% 1.0 1.8 5.0 900 654 A 46 ILE HD1% A 46 ILE HG2% 1.0 1.8 3.5 901 655 A 46 ILE HG2% A 46 ILE HG1x 1.0 1.8 3.5 902 655 A 46 ILE HG2% A 46 ILE HG1y 1.0 1.8 3.5 903 656 A 46 ILE HG2% A 47 TYR H 1.0 1.8 5.0 904 657 A 46 ILE HG2% A 56 GLU HBx 1.0 1.8 5.0 905 657 A 46 ILE HG2% A 56 GLU HBy 1.0 1.8 5.0 906 658 A 58 PHE HE% A 46 ILE HG2% 1.0 1.8 5.0 907 659 A 46 ILE HG2% A 96 VAL HGx% 1.0 1.8 5.0 908 660 A 46 ILE HG2% A 97 LEU HDy% 1.0 1.8 5.0 909 661 A 46 ILE H A 46 ILE HD1% 1.0 1.8 5.0 910 662 A 46 ILE H A 46 ILE HG1x 1.0 1.8 5.0 911 662 A 46 ILE H A 46 ILE HG1y 1.0 1.8 5.0 912 663 A 46 ILE H A 57 ALA HA 1.0 1.8 5.0 913 664 A 57 ALA HB% A 46 ILE H 1.0 1.8 5.0 914 665 A 47 TYR HA A 47 TYR HD% 1.0 1.8 5.0 915 666 A 47 TYR HA A 48 THR HG2% 1.0 1.8 5.0 916 667 A 47 TYR HA A 48 THR H 1.0 1.8 3.5 917 668 A 47 TYR HA A 53 PRO HA 1.0 1.8 5.0 918 669 A 47 TYR HA A 54 SER H 1.0 1.8 5.0 919 670 A 48 THR H A 47 TYR HBy 1.0 1.8 5.0 920 671 A 48 THR H A 47 TYR HBx 1.0 1.8 5.0 921 672 A 47 TYR HD% A 53 PRO HA 1.0 1.8 5.0 922 673 A 47 TYR HE% A 53 PRO HBy 1.0 1.8 5.0 923 673 A 47 TYR HE% A 53 PRO HBx 1.0 1.8 5.0 924 674 A 47 TYR HE% A 53 PRO HDy 1.0 1.8 5.0 925 674 A 47 TYR HE% A 53 PRO HDx 1.0 1.8 5.0 926 675 A 47 TYR HE% A 53 PRO HGy 1.0 1.8 6.0 927 676 A 47 TYR HE% A 53 PRO HGx 1.0 1.8 6.0 928 677 A 47 TYR H A 47 TYR HD% 1.0 1.8 5.0 929 678 A 47 TYR H A 97 LEU HDy% 1.0 1.8 5.0 930 679 A 48 THR HG2% A 48 THR HA 1.0 1.8 3.5 931 680 A 48 THR HB A 49 ARG H 1.0 1.8 3.5 932 681 A 48 THR HG2% A 49 ARG H 1.0 1.8 5.0 933 682 A 48 THR HG2% A 52 ARG HBx 1.0 1.8 5.0 934 682 A 48 THR HG2% A 52 ARG HBy 1.0 1.8 5.0 935 683 A 48 THR HG2% A 52 ARG H 1.0 1.8 5.0 936 684 A 48 THR HG2% A 54 SER HA 1.0 1.8 5.0 937 685 A 48 THR HG2% A 54 SER HBy 1.0 1.8 5.0 938 686 A 48 THR HG2% A 54 SER HBx 1.0 1.8 5.0 939 687 A 48 THR HG2% A 54 SER H 1.0 1.8 5.0 940 688 A 48 THR HG2% A 48 THR H 1.0 1.8 3.5 941 689 A 48 THR H A 51 GLY H 1.0 1.8 5.0 942 690 A 48 THR H A 52 ARG H 1.0 1.8 5.0 943 691 A 48 THR H A 53 PRO HA 1.0 1.8 5.0 944 692 A 48 THR H A 54 SER H 1.0 1.8 5.0 945 693 A 49 ARG HA A 49 ARG HDx 1.0 1.8 5.0 946 693 A 49 ARG HA A 49 ARG HDy 1.0 1.8 5.0 947 694 A 51 GLY H A 49 ARG HA 1.0 1.8 5.0 948 695 A 49 ARG HBy A 49 ARG HDx 1.0 1.8 3.5 949 695 A 49 ARG HBx A 49 ARG HDx 1.0 1.8 3.5 950 695 A 49 ARG HDy A 49 ARG HBx 1.0 1.8 3.5 951 695 A 49 ARG HDy A 49 ARG HBy 1.0 1.8 3.5 952 696 A 50 GLU H A 49 ARG HGx 1.0 1.8 6.0 953 696 A 49 ARG HGy A 50 GLU H 1.0 1.8 6.0 954 697 A 49 ARG H A 49 ARG HGx 1.0 1.8 5.0 955 697 A 49 ARG H A 49 ARG HGy 1.0 1.8 5.0 956 698 A 49 ARG H A 50 GLU H 1.0 1.8 5.0 957 699 A 50 GLU HBy A 52 ARG HGx 1.0 1.8 5.0 958 699 A 50 GLU HBx A 52 ARG HGx 1.0 1.8 5.0 959 699 A 52 ARG HGy A 50 GLU HBy 1.0 1.8 5.0 960 699 A 50 GLU HBx A 52 ARG HGy 1.0 1.8 5.0 961 700 A 52 ARG H A 50 GLU HBy 1.0 1.8 5.0 962 700 A 52 ARG H A 50 GLU HBx 1.0 1.8 5.0 963 701 A 51 GLY H A 50 GLU HBy 1.0 1.8 5.0 964 702 A 51 GLY H A 50 GLU HBx 1.0 1.8 5.0 965 703 A 50 GLU H A 50 GLU HGx 1.0 1.8 5.0 966 703 A 50 GLU H A 50 GLU HGy 1.0 1.8 5.0 967 704 A 51 GLY H A 50 GLU H 1.0 1.8 5.0 968 705 A 52 ARG H A 50 GLU H 1.0 1.8 5.0 969 706 A 52 ARG H A 51 GLY H 1.0 1.8 3.5 970 707 A 52 ARG HA A 53 PRO HDy 1.0 1.8 3.5 971 707 A 53 PRO HDx A 52 ARG HA 1.0 1.8 3.5 972 708 A 52 ARG HBx A 52 ARG HDx 1.0 1.8 3.5 973 708 A 52 ARG HBy A 52 ARG HDx 1.0 1.8 3.5 974 708 A 52 ARG HDy A 52 ARG HBx 1.0 1.8 3.5 975 708 A 52 ARG HBy A 52 ARG HDy 1.0 1.8 3.5 976 709 A 52 ARG HBx A 53 PRO HDy 1.0 1.8 5.0 977 709 A 52 ARG HBy A 53 PRO HDy 1.0 1.8 5.0 978 710 A 53 PRO HDx A 52 ARG HBy 1.0 1.8 5.0 979 710 A 53 PRO HDx A 52 ARG HBx 1.0 1.8 5.0 980 711 A 52 ARG HDx A 53 PRO HDy 1.0 1.8 5.0 981 711 A 52 ARG HDy A 53 PRO HDy 1.0 1.8 5.0 982 711 A 53 PRO HDx A 52 ARG HDx 1.0 1.8 5.0 983 711 A 53 PRO HDx A 52 ARG HDy 1.0 1.8 5.0 984 712 A 52 ARG HGx A 53 PRO HDy 1.0 1.8 5.0 985 712 A 52 ARG HGy A 53 PRO HDy 1.0 1.8 5.0 986 713 A 53 PRO HDx A 52 ARG HGy 1.0 1.8 5.0 987 713 A 53 PRO HDx A 52 ARG HGx 1.0 1.8 5.0 988 714 A 52 ARG H A 52 ARG HBx 1.0 1.8 3.5 989 714 A 52 ARG HBy A 52 ARG H 1.0 1.8 3.5 990 715 A 52 ARG H A 52 ARG HDx 1.0 1.8 6.0 991 715 A 52 ARG H A 52 ARG HDy 1.0 1.8 6.0 992 716 A 52 ARG H A 52 ARG HGx 1.0 1.8 5.0 993 716 A 52 ARG H A 52 ARG HGy 1.0 1.8 5.0 994 717 A 53 PRO HA A 54 SER H 1.0 1.8 3.5 995 718 A 53 PRO HA A 55 GLY H 1.0 1.8 5.0 996 719 A 55 GLY H A 53 PRO HBy 1.0 1.8 5.0 997 719 A 53 PRO HBx A 55 GLY H 1.0 1.8 5.0 998 720 A 54 SER H A 53 PRO HBy 1.0 1.8 5.0 999 721 A 54 SER H A 53 PRO HBx 1.0 1.8 5.0 1000 722 A 54 SER H A 55 GLY H 1.0 1.8 5.0 1001 723 A 54 SER H A 56 GLU H 1.0 1.8 5.0 1002 724 A 55 GLY H A 56 GLU HBx 1.0 1.8 6.0 1003 724 A 56 GLU HBy A 55 GLY H 1.0 1.8 6.0 1004 725 A 55 GLY H A 56 GLU H 1.0 1.8 3.5 1005 726 A 57 ALA H A 56 GLU HA 1.0 1.8 3.5 1006 727 A 56 GLU H A 56 GLU HGx 1.0 1.8 5.0 1007 727 A 56 GLU HGy A 56 GLU H 1.0 1.8 5.0 1008 728 A 57 ALA H A 56 GLU H 1.0 1.8 6.0 1009 729 A 58 PHE H A 57 ALA HA 1.0 1.8 3.5 1010 730 A 57 ALA HB% A 58 PHE H 1.0 1.8 3.5 1011 731 A 59 VAL H A 57 ALA HB% 1.0 1.8 6.0 1012 732 A 58 PHE HA A 58 PHE HD% 1.0 1.8 5.0 1013 733 A 58 PHE HA A 59 VAL HGy% 1.0 1.8 5.0 1014 734 A 58 PHE HA A 59 VAL H 1.0 1.8 3.5 1015 735 A 58 PHE HBx A 93 MET HGy 1.0 1.8 5.0 1016 735 A 58 PHE HBy A 93 MET HGy 1.0 1.8 5.0 1017 735 A 93 MET HGx A 58 PHE HBx 1.0 1.8 5.0 1018 735 A 58 PHE HBy A 93 MET HGx 1.0 1.8 5.0 1019 736 A 58 PHE HBy A 59 VAL H 1.0 1.8 5.0 1020 737 A 59 VAL H A 58 PHE HBx 1.0 1.8 5.0 1021 738 A 58 PHE HD% A 59 VAL HGy% 1.0 1.8 6.0 1022 739 A 58 PHE HD% A 59 VAL H 1.0 1.8 5.0 1023 740 A 58 PHE HD% A 88 SER HBy 1.0 1.8 5.0 1024 740 A 88 SER HBx A 58 PHE HD% 1.0 1.8 5.0 1025 741 A 58 PHE HD% A 93 MET HBx 1.0 1.8 5.0 1026 741 A 58 PHE HD% A 93 MET HBy 1.0 1.8 5.0 1027 742 A 58 PHE HD% A 93 MET HGy 1.0 1.8 6.0 1028 742 A 58 PHE HD% A 93 MET HGx 1.0 1.8 6.0 1029 743 A 58 PHE HD% A 97 LEU HDx% 1.0 1.8 5.0 1030 744 A 58 PHE HD% A 97 LEU HDy% 1.0 1.8 5.0 1031 745 A 58 PHE HE% A 92 GLU HGy 1.0 1.8 5.0 1032 745 A 58 PHE HE% A 92 GLU HGx 1.0 1.8 5.0 1033 746 A 58 PHE HE% A 93 MET HA 1.0 1.8 5.0 1034 747 A 58 PHE HE% A 96 VAL HB 1.0 1.8 5.0 1035 748 A 58 PHE HE% A 96 VAL HGx% 1.0 1.8 5.0 1036 749 A 58 PHE HE% A 96 VAL HGy% 1.0 1.8 5.0 1037 750 A 58 PHE HE% A 97 LEU HDx% 1.0 1.8 6.0 1038 751 A 58 PHE HD% A 58 PHE H 1.0 1.8 5.0 1039 752 A 59 VAL HGy% A 58 PHE H 1.0 1.8 5.0 1040 753 A 59 VAL H A 58 PHE H 1.0 1.8 5.0 1041 754 A 58 PHE HZ A 92 GLU HGy 1.0 1.8 5.0 1042 754 A 58 PHE HZ A 92 GLU HGx 1.0 1.8 5.0 1043 755 A 58 PHE HZ A 93 MET HA 1.0 1.8 5.0 1044 756 A 58 PHE HZ A 96 VAL HB 1.0 1.8 5.0 1045 757 A 58 PHE HZ A 96 VAL HGx% 1.0 1.8 5.0 1046 758 A 58 PHE HZ A 96 VAL HGy% 1.0 1.8 5.0 1047 759 A 59 VAL HGx% A 59 VAL HA 1.0 1.8 3.5 1048 760 A 59 VAL HGy% A 59 VAL HA 1.0 1.8 3.5 1049 761 A 60 GLU H A 59 VAL HA 1.0 1.8 3.5 1050 762 A 59 VAL HB A 60 GLU H 1.0 1.8 6.0 1051 763 A 59 VAL HGx% A 60 GLU HBx 1.0 1.8 6.0 1052 763 A 60 GLU HBy A 59 VAL HGx% 1.0 1.8 6.0 1053 764 A 59 VAL HGx% A 60 GLU H 1.0 1.8 5.0 1054 765 A 61 LEU HDx% A 59 VAL HGx% 1.0 1.8 5.0 1055 766 A 61 LEU HDy% A 59 VAL HGx% 1.0 1.8 5.0 1056 767 A 61 LEU H A 59 VAL HGx% 1.0 1.8 5.0 1057 768 A 59 VAL HGy% A 60 GLU H 1.0 1.8 5.0 1058 769 A 59 VAL H A 59 VAL HGx% 1.0 1.8 5.0 1059 770 A 59 VAL H A 59 VAL HGy% 1.0 1.8 5.0 1060 771 A 59 VAL H A 60 GLU H 1.0 1.8 5.0 1061 772 A 61 LEU H A 60 GLU HA 1.0 1.8 3.5 1062 773 A 61 LEU HA A 60 GLU HBx 1.0 1.8 5.0 1063 773 A 60 GLU HBy A 61 LEU HA 1.0 1.8 5.0 1064 774 A 60 GLU H A 60 GLU HBx 1.0 1.8 3.5 1065 774 A 60 GLU HBy A 60 GLU H 1.0 1.8 3.5 1066 775 A 60 GLU H A 60 GLU HGx 1.0 1.8 5.0 1067 775 A 60 GLU HGy A 60 GLU H 1.0 1.8 5.0 1068 776 A 61 LEU H A 60 GLU H 1.0 1.8 6.0 1069 777 A 61 LEU HDx% A 61 LEU HA 1.0 1.8 5.0 1070 778 A 61 LEU HDy% A 61 LEU HA 1.0 1.8 3.5 1071 779 A 61 LEU HA A 63 SER H 1.0 1.8 5.0 1072 780 A 61 LEU HDx% A 61 LEU HBx 1.0 1.8 3.5 1073 780 A 61 LEU HBy A 61 LEU HDx% 1.0 1.8 3.5 1074 781 A 61 LEU HDy% A 61 LEU HBx 1.0 1.8 3.5 1075 781 A 61 LEU HBy A 61 LEU HDy% 1.0 1.8 3.5 1076 782 A 63 SER H A 61 LEU HBx 1.0 1.8 5.0 1077 782 A 61 LEU HBy A 63 SER H 1.0 1.8 5.0 1078 783 A 61 LEU HBy A 66 GLU HBy 1.0 1.8 5.0 1079 783 A 61 LEU HBx A 66 GLU HBy 1.0 1.8 5.0 1080 784 A 61 LEU HBy A 66 GLU HBx 1.0 1.8 5.0 1081 784 A 66 GLU HBx A 61 LEU HBx 1.0 1.8 5.0 1082 785 A 61 LEU HBx A 66 GLU HGx 1.0 1.8 5.0 1083 785 A 61 LEU HBy A 66 GLU HGx 1.0 1.8 5.0 1084 785 A 66 GLU HGy A 61 LEU HBx 1.0 1.8 5.0 1085 785 A 61 LEU HBy A 66 GLU HGy 1.0 1.8 5.0 1086 786 A 66 GLU H A 61 LEU HBx 1.0 1.8 5.0 1087 786 A 61 LEU HBy A 66 GLU H 1.0 1.8 5.0 1088 787 A 67 VAL HGy% A 61 LEU HBx 1.0 1.8 5.0 1089 787 A 67 VAL HGy% A 61 LEU HBy 1.0 1.8 5.0 1090 788 A 67 VAL H A 61 LEU HBx 1.0 1.8 5.0 1091 788 A 61 LEU HBy A 67 VAL H 1.0 1.8 5.0 1092 789 A 61 LEU HBy A 62 GLU H 1.0 1.8 5.0 1093 790 A 62 GLU H A 61 LEU HBx 1.0 1.8 5.0 1094 791 A 61 LEU HDx% A 63 SER H 1.0 1.8 5.0 1095 792 A 61 LEU HDx% A 66 GLU HBy 1.0 1.8 5.0 1096 793 A 61 LEU HDx% A 66 GLU HBx 1.0 1.8 5.0 1097 794 A 61 LEU HDx% A 67 VAL HA 1.0 1.8 3.5 1098 795 A 61 LEU HDx% A 67 VAL HGx% 1.0 1.8 5.0 1099 796 A 67 VAL HGy% A 61 LEU HDx% 1.0 1.8 3.5 1100 797 A 61 LEU HDx% A 67 VAL H 1.0 1.8 5.0 1101 798 A 61 LEU HDx% A 70 ALA HB% 1.0 1.8 3.5 1102 799 A 61 LEU HDx% A 70 ALA H 1.0 1.8 5.0 1103 800 A 61 LEU HDy% A 62 GLU H 1.0 1.8 5.0 1104 801 A 61 LEU HDy% A 63 SER H 1.0 1.8 5.0 1105 802 A 61 LEU HDy% A 66 GLU HBy 1.0 1.8 5.0 1106 803 A 61 LEU HDy% A 66 GLU HBx 1.0 1.8 5.0 1107 804 A 67 VAL HA A 61 LEU HDy% 1.0 1.8 5.0 1108 805 A 61 LEU HDy% A 67 VAL H 1.0 1.8 6.0 1109 806 A 70 ALA HB% A 61 LEU HDy% 1.0 1.8 5.0 1110 807 A 67 VAL HA A 61 LEU HG 1.0 1.8 5.0 1111 808 A 61 LEU H A 61 LEU HDx% 1.0 1.8 5.0 1112 809 A 61 LEU H A 61 LEU HDy% 1.0 1.8 5.0 1113 810 A 61 LEU H A 61 LEU HG 1.0 1.8 5.0 1114 811 A 62 GLU HA A 62 GLU HGx 1.0 1.8 3.5 1115 811 A 62 GLU HA A 62 GLU HGy 1.0 1.8 3.5 1116 812 A 63 SER H A 62 GLU HBx 1.0 1.8 3.5 1117 812 A 62 GLU HBy A 63 SER H 1.0 1.8 3.5 1118 813 A 62 GLU HBx A 66 GLU HGx 1.0 1.8 5.0 1119 813 A 62 GLU HBy A 66 GLU HGx 1.0 1.8 5.0 1120 813 A 66 GLU HGy A 62 GLU HBx 1.0 1.8 5.0 1121 813 A 62 GLU HBy A 66 GLU HGy 1.0 1.8 5.0 1122 814 A 62 GLU H A 62 GLU HBx 1.0 1.8 3.5 1123 814 A 62 GLU HBy A 62 GLU H 1.0 1.8 3.5 1124 815 A 62 GLU H A 62 GLU HGx 1.0 1.8 5.0 1125 815 A 62 GLU H A 62 GLU HGy 1.0 1.8 5.0 1126 816 A 62 GLU H A 63 SER H 1.0 1.8 5.0 1127 817 A 62 GLU H A 66 GLU HGx 1.0 1.8 5.0 1128 817 A 66 GLU HGy A 62 GLU H 1.0 1.8 5.0 1129 818 A 64 GLU H A 63 SER HA 1.0 1.8 3.5 1130 819 A 63 SER HA A 65 ASP H 1.0 1.8 5.0 1131 820 A 64 GLU H A 63 SER HBy 1.0 1.8 3.5 1132 820 A 64 GLU H A 63 SER HBx 1.0 1.8 3.5 1133 821 A 66 GLU H A 63 SER HBy 1.0 1.8 5.0 1134 821 A 66 GLU H A 63 SER HBx 1.0 1.8 5.0 1135 822 A 65 ASP H A 63 SER HBy 1.0 1.8 5.0 1136 823 A 65 ASP H A 63 SER HBx 1.0 1.8 5.0 1137 824 A 63 SER H A 66 GLU HBy 1.0 1.8 5.0 1138 825 A 63 SER H A 66 GLU HBx 1.0 1.8 5.0 1139 826 A 63 SER H A 66 GLU HGx 1.0 1.8 5.0 1140 826 A 66 GLU HGy A 63 SER H 1.0 1.8 5.0 1141 827 A 63 SER H A 66 GLU H 1.0 1.8 5.0 1142 828 A 67 VAL HGy% A 63 SER H 1.0 1.8 5.0 1143 829 A 64 GLU HA A 64 GLU HGx 1.0 1.8 3.5 1144 829 A 64 GLU HA A 64 GLU HGy 1.0 1.8 3.5 1145 830 A 64 GLU HA A 66 GLU H 1.0 1.8 6.0 1146 831 A 64 GLU HA A 67 VAL HB 1.0 1.8 5.0 1147 832 A 64 GLU HA A 67 VAL HGx% 1.0 1.8 5.0 1148 833 A 67 VAL HGy% A 64 GLU HA 1.0 1.8 5.0 1149 834 A 64 GLU HA A 67 VAL H 1.0 1.8 5.0 1150 835 A 65 ASP H A 64 GLU HBy 1.0 1.8 3.5 1151 835 A 65 ASP H A 64 GLU HBx 1.0 1.8 3.5 1152 836 A 67 VAL HGy% A 64 GLU HBy 1.0 1.8 5.0 1153 836 A 67 VAL HGy% A 64 GLU HBx 1.0 1.8 5.0 1154 837 A 67 VAL H A 64 GLU HBy 1.0 1.8 6.0 1155 837 A 67 VAL H A 64 GLU HBx 1.0 1.8 6.0 1156 838 A 64 GLU HBy A 68 LYS HEx 1.0 1.8 5.0 1157 838 A 68 LYS HEy A 64 GLU HBy 1.0 1.8 5.0 1158 838 A 64 GLU HBx A 68 LYS HEy 1.0 1.8 5.0 1159 838 A 64 GLU HBx A 68 LYS HEx 1.0 1.8 5.0 1160 839 A 65 ASP H A 64 GLU HGx 1.0 1.8 5.0 1161 839 A 64 GLU HGy A 65 ASP H 1.0 1.8 5.0 1162 840 A 67 VAL HGx% A 64 GLU HGx 1.0 1.8 5.0 1163 840 A 64 GLU HGy A 67 VAL HGx% 1.0 1.8 5.0 1164 841 A 67 VAL HGy% A 64 GLU HGx 1.0 1.8 5.0 1165 841 A 67 VAL HGy% A 64 GLU HGy 1.0 1.8 5.0 1166 842 A 67 VAL H A 64 GLU HGx 1.0 1.8 5.0 1167 842 A 64 GLU HGy A 67 VAL H 1.0 1.8 5.0 1168 843 A 64 GLU HGx A 68 LYS HEx 1.0 1.8 5.0 1169 843 A 64 GLU HGy A 68 LYS HEx 1.0 1.8 5.0 1170 843 A 68 LYS HEy A 64 GLU HGx 1.0 1.8 5.0 1171 843 A 64 GLU HGy A 68 LYS HEy 1.0 1.8 5.0 1172 844 A 64 GLU HGx A 68 LYS HGx 1.0 1.8 5.0 1173 844 A 64 GLU HGy A 68 LYS HGx 1.0 1.8 5.0 1174 844 A 68 LYS HGy A 64 GLU HGx 1.0 1.8 5.0 1175 844 A 64 GLU HGy A 68 LYS HGy 1.0 1.8 5.0 1176 845 A 64 GLU H A 64 GLU HBy 1.0 1.8 3.5 1177 846 A 64 GLU H A 64 GLU HBx 1.0 1.8 3.5 1178 847 A 64 GLU H A 64 GLU HGx 1.0 1.8 5.0 1179 847 A 64 GLU H A 64 GLU HGy 1.0 1.8 5.0 1180 848 A 64 GLU H A 65 ASP HBy 1.0 1.8 6.0 1181 848 A 64 GLU H A 65 ASP HBx 1.0 1.8 6.0 1182 849 A 64 GLU H A 65 ASP H 1.0 1.8 3.5 1183 850 A 64 GLU H A 66 GLU H 1.0 1.8 6.0 1184 851 A 64 GLU H A 67 VAL H 1.0 1.8 6.0 1185 852 A 65 ASP HA A 68 LYS HBy 1.0 1.8 6.0 1186 853 A 65 ASP HA A 68 LYS HBx 1.0 1.8 6.0 1187 854 A 65 ASP HA A 68 LYS HDx 1.0 1.8 5.0 1188 854 A 65 ASP HA A 68 LYS HDy 1.0 1.8 5.0 1189 855 A 65 ASP HA A 68 LYS HGx 1.0 1.8 5.0 1190 855 A 68 LYS HGy A 65 ASP HA 1.0 1.8 5.0 1191 856 A 65 ASP HA A 68 LYS H 1.0 1.8 5.0 1192 857 A 65 ASP HA A 69 LEU H 1.0 1.8 6.0 1193 858 A 66 GLU H A 65 ASP HBy 1.0 1.8 5.0 1194 859 A 66 GLU H A 65 ASP HBx 1.0 1.8 5.0 1195 860 A 65 ASP H A 65 ASP HBy 1.0 1.8 3.5 1196 860 A 65 ASP H A 65 ASP HBx 1.0 1.8 3.5 1197 861 A 66 GLU H A 65 ASP H 1.0 1.8 3.5 1198 862 A 67 VAL H A 65 ASP H 1.0 1.8 6.0 1199 863 A 66 GLU HA A 69 LEU HBy 1.0 1.8 6.0 1200 864 A 66 GLU HA A 69 LEU HBx 1.0 1.8 6.0 1201 865 A 69 LEU HDx% A 66 GLU HA 1.0 1.8 3.5 1202 866 A 66 GLU HA A 69 LEU HG 1.0 1.8 5.0 1203 867 A 69 LEU H A 66 GLU HA 1.0 1.8 5.0 1204 868 A 70 ALA H A 66 GLU HA 1.0 1.8 6.0 1205 869 A 67 VAL HGy% A 66 GLU HBy 1.0 1.8 6.0 1206 869 A 67 VAL HGy% A 66 GLU HBx 1.0 1.8 6.0 1207 870 A 67 VAL H A 66 GLU HBy 1.0 1.8 5.0 1208 871 A 67 VAL H A 66 GLU HBx 1.0 1.8 5.0 1209 872 A 69 LEU HDx% A 66 GLU HGx 1.0 1.8 6.0 1210 872 A 69 LEU HDx% A 66 GLU HGy 1.0 1.8 6.0 1211 873 A 66 GLU H A 66 GLU HGx 1.0 1.8 3.5 1212 873 A 66 GLU HGy A 66 GLU H 1.0 1.8 3.5 1213 874 A 67 VAL HGy% A 66 GLU H 1.0 1.8 5.0 1214 875 A 66 GLU H A 68 LYS H 1.0 1.8 5.0 1215 876 A 67 VAL HGx% A 67 VAL HA 1.0 1.8 3.5 1216 877 A 67 VAL HGy% A 67 VAL HA 1.0 1.8 3.5 1217 878 A 67 VAL HA A 70 ALA HB% 1.0 1.8 5.0 1218 879 A 67 VAL HA A 70 ALA H 1.0 1.8 5.0 1219 880 A 67 VAL HB A 68 LYS H 1.0 1.8 3.5 1220 881 A 67 VAL HGx% A 68 LYS HGx 1.0 1.8 5.0 1221 881 A 67 VAL HGx% A 68 LYS HGy 1.0 1.8 5.0 1222 882 A 67 VAL HGx% A 68 LYS H 1.0 1.8 5.0 1223 883 A 67 VAL HGx% A 70 ALA HB% 1.0 1.8 3.5 1224 884 A 67 VAL HGx% A 70 ALA H 1.0 1.8 6.0 1225 885 A 67 VAL HGx% A 71 LEU HDx% 1.0 1.8 3.5 1226 886 A 67 VAL HGx% A 71 LEU HG 1.0 1.8 3.5 1227 887 A 67 VAL HGx% A 71 LEU H 1.0 1.8 5.0 1228 888 A 67 VAL HGx% A 87 LYS HA 1.0 1.8 5.0 1229 889 A 67 VAL HGx% A 87 LYS HBx 1.0 1.8 6.0 1230 889 A 67 VAL HGx% A 87 LYS HBy 1.0 1.8 6.0 1231 890 A 67 VAL HGx% A 87 LYS HDx 1.0 1.8 5.0 1232 890 A 67 VAL HGx% A 87 LYS HDy 1.0 1.8 5.0 1233 891 A 67 VAL HGx% A 87 LYS HEx 1.0 1.8 5.0 1234 891 A 67 VAL HGx% A 87 LYS HEy 1.0 1.8 5.0 1235 892 A 67 VAL HGx% A 87 LYS HGy 1.0 1.8 3.5 1236 892 A 67 VAL HGx% A 87 LYS HGx 1.0 1.8 3.5 1237 893 A 88 SER H A 67 VAL HGx% 1.0 1.8 5.0 1238 894 A 67 VAL HGy% A 68 LYS H 1.0 1.8 5.0 1239 895 A 67 VAL H A 67 VAL HB 1.0 1.8 3.5 1240 896 A 67 VAL HGx% A 67 VAL H 1.0 1.8 5.0 1241 897 A 67 VAL HGy% A 67 VAL H 1.0 1.8 3.5 1242 898 A 67 VAL H A 68 LYS HBx 1.0 1.8 6.0 1243 898 A 67 VAL H A 68 LYS HBy 1.0 1.8 6.0 1244 899 A 67 VAL H A 68 LYS HGx 1.0 1.8 6.0 1245 899 A 67 VAL H A 68 LYS HGy 1.0 1.8 6.0 1246 900 A 67 VAL H A 68 LYS H 1.0 1.8 3.5 1247 901 A 67 VAL H A 69 LEU H 1.0 1.8 5.0 1248 902 A 68 LYS HA A 68 LYS HDx 1.0 1.8 5.0 1249 902 A 68 LYS HDy A 68 LYS HA 1.0 1.8 5.0 1250 903 A 68 LYS HA A 68 LYS HGx 1.0 1.8 3.5 1251 903 A 68 LYS HGy A 68 LYS HA 1.0 1.8 3.5 1252 904 A 70 ALA H A 68 LYS HA 1.0 1.8 5.0 1253 905 A 68 LYS HA A 71 LEU HBx 1.0 1.8 5.0 1254 905 A 68 LYS HA A 71 LEU HBy 1.0 1.8 5.0 1255 906 A 71 LEU HDx% A 68 LYS HA 1.0 1.8 3.5 1256 907 A 71 LEU H A 68 LYS HA 1.0 1.8 6.0 1257 908 A 69 LEU HDx% A 68 LYS HBx 1.0 1.8 5.0 1258 908 A 69 LEU HDx% A 68 LYS HBy 1.0 1.8 5.0 1259 909 A 68 LYS HEy A 68 LYS HBy 1.0 1.8 6.0 1260 909 A 68 LYS HBy A 68 LYS HEx 1.0 1.8 6.0 1261 910 A 69 LEU H A 68 LYS HBy 1.0 1.8 5.0 1262 911 A 68 LYS HEy A 68 LYS HBx 1.0 1.8 6.0 1263 911 A 68 LYS HBx A 68 LYS HEx 1.0 1.8 6.0 1264 912 A 69 LEU H A 68 LYS HBx 1.0 1.8 5.0 1265 913 A 68 LYS HEx A 68 LYS HGx 1.0 1.8 3.5 1266 913 A 68 LYS HEy A 68 LYS HGx 1.0 1.8 3.5 1267 913 A 68 LYS HGy A 68 LYS HEx 1.0 1.8 3.5 1268 913 A 68 LYS HEy A 68 LYS HGy 1.0 1.8 3.5 1269 914 A 71 LEU HDx% A 68 LYS HGx 1.0 1.8 6.0 1270 914 A 68 LYS HGy A 71 LEU HDx% 1.0 1.8 6.0 1271 915 A 68 LYS H A 68 LYS HBx 1.0 1.8 3.5 1272 915 A 68 LYS H A 68 LYS HBy 1.0 1.8 3.5 1273 916 A 68 LYS H A 68 LYS HDx 1.0 1.8 5.0 1274 916 A 68 LYS HDy A 68 LYS H 1.0 1.8 5.0 1275 917 A 68 LYS H A 68 LYS HEx 1.0 1.8 5.0 1276 917 A 68 LYS HEy A 68 LYS H 1.0 1.8 5.0 1277 918 A 68 LYS H A 68 LYS HGx 1.0 1.8 3.5 1278 918 A 68 LYS HGy A 68 LYS H 1.0 1.8 3.5 1279 919 A 68 LYS H A 69 LEU H 1.0 1.8 3.5 1280 920 A 70 ALA H A 68 LYS H 1.0 1.8 5.0 1281 921 A 69 LEU HDx% A 69 LEU HA 1.0 1.8 5.0 1282 922 A 69 LEU HDy% A 69 LEU HA 1.0 1.8 3.5 1283 923 A 69 LEU HA A 72 LYS HBx 1.0 1.8 5.0 1284 923 A 69 LEU HA A 72 LYS HBy 1.0 1.8 5.0 1285 924 A 69 LEU HA A 72 LYS HDx 1.0 1.8 5.0 1286 924 A 69 LEU HA A 72 LYS HDy 1.0 1.8 5.0 1287 925 A 69 LEU HA A 72 LYS HGx 1.0 1.8 5.0 1288 925 A 69 LEU HA A 72 LYS HGy 1.0 1.8 5.0 1289 926 A 69 LEU HA A 72 LYS H 1.0 1.8 5.0 1290 927 A 69 LEU HDy% A 69 LEU HBx 1.0 1.8 3.5 1291 927 A 69 LEU HDy% A 69 LEU HBy 1.0 1.8 3.5 1292 928 A 70 ALA HA A 69 LEU HBx 1.0 1.8 6.0 1293 928 A 70 ALA HA A 69 LEU HBy 1.0 1.8 6.0 1294 929 A 69 LEU HDx% A 69 LEU HBy 1.0 1.8 3.5 1295 930 A 70 ALA H A 69 LEU HBy 1.0 1.8 5.0 1296 931 A 69 LEU HDx% A 69 LEU HBx 1.0 1.8 3.5 1297 932 A 70 ALA H A 69 LEU HBx 1.0 1.8 5.0 1298 933 A 70 ALA H A 69 LEU HDx% 1.0 1.8 6.0 1299 934 A 70 ALA H A 69 LEU HDy% 1.0 1.8 6.0 1300 935 A 69 LEU HDy% A 72 LYS HDx 1.0 1.8 5.0 1301 935 A 69 LEU HDy% A 72 LYS HDy 1.0 1.8 5.0 1302 936 A 69 LEU HDy% A 72 LYS HEx 1.0 1.8 5.0 1303 936 A 69 LEU HDy% A 72 LYS HEy 1.0 1.8 5.0 1304 937 A 69 LEU HDy% A 72 LYS H 1.0 1.8 6.0 1305 938 A 70 ALA H A 69 LEU HG 1.0 1.8 5.0 1306 939 A 69 LEU H A 69 LEU HBx 1.0 1.8 3.5 1307 939 A 69 LEU H A 69 LEU HBy 1.0 1.8 3.5 1308 940 A 69 LEU HDx% A 69 LEU H 1.0 1.8 5.0 1309 941 A 69 LEU HDy% A 69 LEU H 1.0 1.8 5.0 1310 942 A 69 LEU H A 69 LEU HG 1.0 1.8 3.5 1311 943 A 70 ALA HB% A 69 LEU H 1.0 1.8 5.0 1312 944 A 70 ALA H A 69 LEU H 1.0 1.8 3.5 1313 945 A 71 LEU H A 69 LEU H 1.0 1.8 6.0 1314 946 A 70 ALA HA A 73 LYS HBx 1.0 1.8 5.0 1315 946 A 70 ALA HA A 73 LYS HBy 1.0 1.8 5.0 1316 947 A 70 ALA HA A 73 LYS HDx 1.0 1.8 5.0 1317 947 A 70 ALA HA A 73 LYS HDy 1.0 1.8 5.0 1318 948 A 70 ALA HB% A 72 LYS H 1.0 1.8 5.0 1319 949 A 85 VAL HGx% A 70 ALA HB% 1.0 1.8 5.0 1320 950 A 70 ALA HB% A 85 VAL HGy% 1.0 1.8 5.0 1321 951 A 70 ALA HB% A 70 ALA H 1.0 1.8 3.5 1322 952 A 70 ALA H A 72 LYS H 1.0 1.8 5.0 1323 953 A 71 LEU HA A 71 LEU HDy% 1.0 1.8 3.5 1324 954 A 71 LEU HA A 73 LYS H 1.0 1.8 5.0 1325 955 A 71 LEU HA A 85 VAL HB 1.0 1.8 5.0 1326 956 A 85 VAL HGx% A 71 LEU HA 1.0 1.8 3.5 1327 957 A 85 VAL HGy% A 71 LEU HA 1.0 1.8 5.0 1328 958 A 71 LEU HDx% A 71 LEU HBx 1.0 1.8 3.5 1329 958 A 71 LEU HDx% A 71 LEU HBy 1.0 1.8 3.5 1330 959 A 71 LEU HBy A 71 LEU HDy% 1.0 1.8 3.5 1331 960 A 71 LEU HDy% A 71 LEU HBx 1.0 1.8 3.5 1332 961 A 71 LEU HDx% A 72 LYS H 1.0 1.8 5.0 1333 962 A 71 LEU HDx% A 86 PHE HA 1.0 1.8 6.0 1334 963 A 87 LYS HA A 71 LEU HDx% 1.0 1.8 5.0 1335 964 A 71 LEU HDx% A 87 LYS HBx 1.0 1.8 5.0 1336 964 A 71 LEU HDx% A 87 LYS HBy 1.0 1.8 5.0 1337 965 A 71 LEU HDx% A 87 LYS HDx 1.0 1.8 5.0 1338 965 A 71 LEU HDx% A 87 LYS HDy 1.0 1.8 5.0 1339 966 A 71 LEU HDx% A 87 LYS HEx 1.0 1.8 5.0 1340 966 A 71 LEU HDx% A 87 LYS HEy 1.0 1.8 5.0 1341 967 A 71 LEU HDx% A 87 LYS HGy 1.0 1.8 5.0 1342 967 A 87 LYS HGx A 71 LEU HDx% 1.0 1.8 5.0 1343 968 A 71 LEU HDx% A 87 LYS H 1.0 1.8 5.0 1344 969 A 72 LYS H A 71 LEU HDy% 1.0 1.8 6.0 1345 970 A 71 LEU HDy% A 85 VAL HB 1.0 1.8 5.0 1346 971 A 85 VAL HGy% A 71 LEU HDy% 1.0 1.8 6.0 1347 972 A 71 LEU HDy% A 86 PHE HA 1.0 1.8 5.0 1348 973 A 71 LEU HDy% A 86 PHE HBx 1.0 1.8 5.0 1349 973 A 86 PHE HBy A 71 LEU HDy% 1.0 1.8 5.0 1350 974 A 86 PHE H A 71 LEU HDy% 1.0 1.8 5.0 1351 975 A 87 LYS HA A 71 LEU HDy% 1.0 1.8 5.0 1352 976 A 71 LEU HDy% A 87 LYS HBx 1.0 1.8 5.0 1353 976 A 87 LYS HBy A 71 LEU HDy% 1.0 1.8 5.0 1354 977 A 71 LEU HDy% A 87 LYS HGy 1.0 1.8 5.0 1355 977 A 87 LYS HGx A 71 LEU HDy% 1.0 1.8 5.0 1356 978 A 71 LEU HDy% A 87 LYS H 1.0 1.8 5.0 1357 979 A 71 LEU H A 71 LEU HDx% 1.0 1.8 5.0 1358 980 A 71 LEU H A 71 LEU HDy% 1.0 1.8 5.0 1359 981 A 71 LEU H A 71 LEU HG 1.0 1.8 5.0 1360 982 A 71 LEU H A 72 LYS H 1.0 1.8 5.0 1361 983 A 85 VAL HGx% A 71 LEU H 1.0 1.8 5.0 1362 984 A 72 LYS HA A 72 LYS HDx 1.0 1.8 5.0 1363 984 A 72 LYS HDy A 72 LYS HA 1.0 1.8 5.0 1364 985 A 72 LYS HA A 72 LYS HGx 1.0 1.8 3.5 1365 985 A 72 LYS HGy A 72 LYS HA 1.0 1.8 3.5 1366 986 A 73 LYS H A 72 LYS HGx 1.0 1.8 5.0 1367 986 A 72 LYS HGy A 73 LYS H 1.0 1.8 5.0 1368 987 A 72 LYS H A 72 LYS HBx 1.0 1.8 3.5 1369 987 A 72 LYS HBy A 72 LYS H 1.0 1.8 3.5 1370 988 A 72 LYS H A 72 LYS HDx 1.0 1.8 5.0 1371 988 A 72 LYS HDy A 72 LYS H 1.0 1.8 5.0 1372 989 A 72 LYS H A 72 LYS HGx 1.0 1.8 3.5 1373 989 A 72 LYS HGy A 72 LYS H 1.0 1.8 3.5 1374 990 A 72 LYS H A 73 LYS HGx 1.0 1.8 6.0 1375 990 A 73 LYS HGy A 72 LYS H 1.0 1.8 6.0 1376 991 A 72 LYS H A 73 LYS H 1.0 1.8 3.5 1377 992 A 85 VAL HGx% A 72 LYS H 1.0 1.8 6.0 1378 993 A 73 LYS HA A 73 LYS HDx 1.0 1.8 6.0 1379 993 A 73 LYS HDy A 73 LYS HA 1.0 1.8 6.0 1380 994 A 73 LYS HA A 76 GLU HBx 1.0 1.8 5.0 1381 994 A 76 GLU HBy A 73 LYS HA 1.0 1.8 5.0 1382 995 A 73 LYS HA A 76 GLU HGx 1.0 1.8 5.0 1383 995 A 73 LYS HA A 76 GLU HGy 1.0 1.8 5.0 1384 996 A 73 LYS HBx A 73 LYS HDx 1.0 1.8 3.5 1385 996 A 73 LYS HBy A 73 LYS HDx 1.0 1.8 3.5 1386 996 A 73 LYS HDy A 73 LYS HBx 1.0 1.8 3.5 1387 996 A 73 LYS HDy A 73 LYS HBy 1.0 1.8 3.5 1388 997 A 73 LYS HBx A 73 LYS HEx 1.0 1.8 5.0 1389 997 A 73 LYS HBy A 73 LYS HEx 1.0 1.8 5.0 1390 997 A 73 LYS HEy A 73 LYS HBx 1.0 1.8 5.0 1391 997 A 73 LYS HEy A 73 LYS HBy 1.0 1.8 5.0 1392 998 A 85 VAL HGy% A 73 LYS HBx 1.0 1.8 5.0 1393 998 A 85 VAL HGy% A 73 LYS HBy 1.0 1.8 5.0 1394 999 A 85 VAL HGy% A 73 LYS HDx 1.0 1.8 5.0 1395 999 A 85 VAL HGy% A 73 LYS HDy 1.0 1.8 5.0 1396 1000 A 73 LYS HEy A 73 LYS HGx 1.0 1.8 3.5 1397 1000 A 73 LYS HEx A 73 LYS HGx 1.0 1.8 3.5 1398 1000 A 73 LYS HGy A 73 LYS HEx 1.0 1.8 3.5 1399 1000 A 73 LYS HEy A 73 LYS HGy 1.0 1.8 3.5 1400 1001 A 73 LYS H A 73 LYS HDx 1.0 1.8 6.0 1401 1001 A 73 LYS HDy A 73 LYS H 1.0 1.8 6.0 1402 1002 A 73 LYS H A 73 LYS HGx 1.0 1.8 5.0 1403 1002 A 73 LYS HGy A 73 LYS H 1.0 1.8 5.0 1404 1003 A 73 LYS H A 74 ASP H 1.0 1.8 5.0 1405 1004 A 85 VAL HGy% A 73 LYS H 1.0 1.8 5.0 1406 1005 A 74 ASP HA A 75 ARG HA 1.0 1.8 5.0 1407 1006 A 74 ASP HA A 76 GLU H 1.0 1.8 5.0 1408 1007 A 74 ASP HA A 84 GLU HA 1.0 1.8 5.0 1409 1008 A 85 VAL HB A 74 ASP HA 1.0 1.8 5.0 1410 1009 A 85 VAL HGy% A 74 ASP HA 1.0 1.8 3.5 1411 1010 A 74 ASP HA A 85 VAL H 1.0 1.8 5.0 1412 1011 A 85 VAL HB A 74 ASP HBy 1.0 1.8 5.0 1413 1011 A 85 VAL HB A 74 ASP HBx 1.0 1.8 5.0 1414 1012 A 85 VAL HGx% A 74 ASP HBy 1.0 1.8 5.0 1415 1012 A 85 VAL HGx% A 74 ASP HBx 1.0 1.8 5.0 1416 1013 A 85 VAL H A 74 ASP HBy 1.0 1.8 5.0 1417 1013 A 85 VAL H A 74 ASP HBx 1.0 1.8 5.0 1418 1014 A 85 VAL HGy% A 74 ASP HBy 1.0 1.8 5.0 1419 1015 A 85 VAL HGy% A 74 ASP HBx 1.0 1.8 5.0 1420 1016 A 75 ARG HA A 75 ARG HDx 1.0 1.8 5.0 1421 1016 A 75 ARG HA A 75 ARG HDy 1.0 1.8 5.0 1422 1017 A 75 ARG HBx A 75 ARG HDx 1.0 1.8 3.5 1423 1017 A 75 ARG HBy A 75 ARG HDx 1.0 1.8 3.5 1424 1017 A 75 ARG HDy A 75 ARG HBx 1.0 1.8 3.5 1425 1017 A 75 ARG HDy A 75 ARG HBy 1.0 1.8 3.5 1426 1018 A 75 ARG H A 75 ARG HGy 1.0 1.8 6.0 1427 1019 A 75 ARG H A 75 ARG HGx 1.0 1.8 6.0 1428 1020 A 76 GLU H A 75 ARG H 1.0 1.8 5.0 1429 1021 A 76 GLU HA A 76 GLU HGx 1.0 1.8 3.5 1430 1021 A 76 GLU HGy A 76 GLU HA 1.0 1.8 3.5 1431 1022 A 76 GLU HA A 77 THR H 1.0 1.8 3.5 1432 1023 A 77 THR H A 76 GLU HBx 1.0 1.8 3.5 1433 1023 A 76 GLU HBy A 77 THR H 1.0 1.8 3.5 1434 1024 A 76 GLU H A 76 GLU HBx 1.0 1.8 3.5 1435 1024 A 76 GLU HBy A 76 GLU H 1.0 1.8 3.5 1436 1025 A 76 GLU H A 76 GLU HGx 1.0 1.8 5.0 1437 1025 A 76 GLU HGy A 76 GLU H 1.0 1.8 5.0 1438 1026 A 76 GLU H A 83 VAL H 1.0 1.8 5.0 1439 1027 A 77 THR HA A 77 THR HG2% 1.0 1.8 3.5 1440 1028 A 77 THR HA A 78 MET H 1.0 1.8 3.5 1441 1029 A 77 THR HA A 82 TYR HA 1.0 1.8 5.0 1442 1030 A 83 VAL HGy% A 77 THR HA 1.0 1.8 5.0 1443 1031 A 83 VAL H A 77 THR HA 1.0 1.8 5.0 1444 1032 A 78 MET H A 77 THR HB 1.0 1.8 5.0 1445 1033 A 77 THR HB A 80 HIS HA 1.0 1.8 5.0 1446 1034 A 77 THR HB A 81 ARG H 1.0 1.8 5.0 1447 1035 A 77 THR HG2% A 78 MET H 1.0 1.8 5.0 1448 1036 A 77 THR HG2% A 80 HIS HA 1.0 1.8 5.0 1449 1037 A 77 THR HG2% A 81 ARG H 1.0 1.8 5.0 1450 1038 A 77 THR HG2% A 82 TYR HA 1.0 1.8 3.5 1451 1039 A 77 THR HG2% A 82 TYR HBy 1.0 1.8 5.0 1452 1040 A 77 THR HG2% A 82 TYR HBx 1.0 1.8 5.0 1453 1041 A 77 THR HG2% A 82 TYR HD% 1.0 1.8 5.0 1454 1042 A 77 THR HG2% A 82 TYR HE% 1.0 1.8 5.0 1455 1043 A 83 VAL HGy% A 77 THR HG2% 1.0 1.8 5.0 1456 1044 A 77 THR H A 77 THR HG2% 1.0 1.8 3.5 1457 1045 A 77 THR H A 78 MET H 1.0 1.8 5.0 1458 1046 A 78 MET HA A 78 MET HGx 1.0 1.8 3.5 1459 1046 A 78 MET HA A 78 MET HGy 1.0 1.8 3.5 1460 1047 A 78 MET HE% A 78 MET HBx 1.0 1.8 5.0 1461 1047 A 78 MET HE% A 78 MET HBy 1.0 1.8 5.0 1462 1048 A 83 VAL HB A 78 MET HBx 1.0 1.8 5.0 1463 1048 A 83 VAL HB A 78 MET HBy 1.0 1.8 5.0 1464 1049 A 83 VAL HGy% A 78 MET HBy 1.0 1.8 5.0 1465 1050 A 83 VAL HGy% A 78 MET HBx 1.0 1.8 5.0 1466 1051 A 83 VAL HGx% A 78 MET HE% 1.0 1.8 5.0 1467 1052 A 83 VAL HGy% A 78 MET HE% 1.0 1.8 5.0 1468 1053 A 78 MET HE% A 78 MET HGx 1.0 1.8 3.5 1469 1053 A 78 MET HE% A 78 MET HGy 1.0 1.8 3.5 1470 1054 A 83 VAL HGy% A 78 MET HGx 1.0 1.8 5.0 1471 1054 A 83 VAL HGy% A 78 MET HGy 1.0 1.8 5.0 1472 1055 A 78 MET H A 78 MET HBx 1.0 1.8 3.5 1473 1055 A 78 MET H A 78 MET HBy 1.0 1.8 3.5 1474 1056 A 78 MET H A 78 MET HGx 1.0 1.8 5.0 1475 1056 A 78 MET H A 78 MET HGy 1.0 1.8 5.0 1476 1057 A 78 MET H A 81 ARG H 1.0 1.8 5.0 1477 1058 A 78 MET H A 82 TYR HA 1.0 1.8 5.0 1478 1059 A 83 VAL HGy% A 78 MET H 1.0 1.8 5.0 1479 1060 A 81 ARG HA A 81 ARG HDx 1.0 1.8 5.0 1480 1060 A 81 ARG HA A 81 ARG HDy 1.0 1.8 5.0 1481 1061 A 82 TYR HD% A 81 ARG HA 1.0 1.8 6.0 1482 1062 A 81 ARG HA A 82 TYR H 1.0 1.8 3.5 1483 1063 A 82 TYR H A 81 ARG HBy 1.0 1.8 5.0 1484 1064 A 82 TYR H A 81 ARG HBx 1.0 1.8 5.0 1485 1065 A 82 TYR H A 81 ARG HDx 1.0 1.8 5.0 1486 1065 A 81 ARG HDy A 82 TYR H 1.0 1.8 5.0 1487 1066 A 82 TYR H A 81 ARG HGy 1.0 1.8 5.0 1488 1066 A 82 TYR H A 81 ARG HGx 1.0 1.8 5.0 1489 1067 A 81 ARG H A 81 ARG HBy 1.0 1.8 3.5 1490 1067 A 81 ARG H A 81 ARG HBx 1.0 1.8 3.5 1491 1068 A 81 ARG H A 81 ARG HDx 1.0 1.8 5.0 1492 1068 A 81 ARG H A 81 ARG HDy 1.0 1.8 5.0 1493 1069 A 81 ARG H A 81 ARG HGy 1.0 1.8 5.0 1494 1070 A 81 ARG H A 81 ARG HGx 1.0 1.8 5.0 1495 1071 A 81 ARG H A 82 TYR H 1.0 1.8 5.0 1496 1072 A 82 TYR HA A 82 TYR HD% 1.0 1.8 5.0 1497 1073 A 83 VAL HGy% A 82 TYR HA 1.0 1.8 5.0 1498 1074 A 83 VAL H A 82 TYR HA 1.0 1.8 3.5 1499 1075 A 83 VAL H A 82 TYR HBy 1.0 1.8 5.0 1500 1076 A 83 VAL H A 82 TYR HBx 1.0 1.8 5.0 1501 1077 A 82 TYR H A 82 TYR HBx 1.0 1.8 3.5 1502 1077 A 82 TYR H A 82 TYR HBy 1.0 1.8 3.5 1503 1078 A 82 TYR HD% A 82 TYR H 1.0 1.8 5.0 1504 1079 A 83 VAL H A 82 TYR H 1.0 1.8 5.0 1505 1080 A 83 VAL HGx% A 83 VAL HA 1.0 1.8 3.5 1506 1081 A 83 VAL HGy% A 83 VAL HA 1.0 1.8 3.5 1507 1082 A 84 GLU H A 83 VAL HA 1.0 1.8 3.5 1508 1083 A 83 VAL HGx% A 84 GLU HA 1.0 1.8 6.0 1509 1084 A 83 VAL HGx% A 84 GLU H 1.0 1.8 5.0 1510 1085 A 85 VAL HGy% A 83 VAL HGx% 1.0 1.8 3.5 1511 1086 A 83 VAL HGy% A 83 VAL H 1.0 1.8 3.5 1512 1087 A 86 PHE HZ A 84 GLU HBy 1.0 1.8 5.0 1513 1087 A 84 GLU HBx A 86 PHE HZ 1.0 1.8 5.0 1514 1088 A 86 PHE HE% A 84 GLU HBy 1.0 1.8 5.0 1515 1089 A 86 PHE HE% A 84 GLU HBx 1.0 1.8 5.0 1516 1090 A 84 GLU H A 84 GLU HBy 1.0 1.8 3.5 1517 1090 A 84 GLU H A 84 GLU HBx 1.0 1.8 3.5 1518 1091 A 84 GLU H A 84 GLU HGy 1.0 1.8 5.0 1519 1092 A 84 GLU H A 84 GLU HGx 1.0 1.8 5.0 1520 1093 A 85 VAL HGx% A 85 VAL HA 1.0 1.8 3.5 1521 1094 A 85 VAL HGy% A 85 VAL HA 1.0 1.8 3.5 1522 1095 A 86 PHE H A 85 VAL HA 1.0 1.8 3.5 1523 1096 A 86 PHE H A 85 VAL HB 1.0 1.8 5.0 1524 1097 A 85 VAL HGx% A 86 PHE HD% 1.0 1.8 6.0 1525 1098 A 85 VAL HGx% A 86 PHE H 1.0 1.8 5.0 1526 1099 A 86 PHE H A 85 VAL HGy% 1.0 1.8 5.0 1527 1100 A 85 VAL HGy% A 85 VAL H 1.0 1.8 5.0 1528 1101 A 86 PHE HD% A 86 PHE HA 1.0 1.8 5.0 1529 1102 A 86 PHE HA A 87 LYS H 1.0 1.8 3.5 1530 1103 A 86 PHE HBy A 87 LYS H 1.0 1.8 5.0 1531 1104 A 87 LYS H A 86 PHE HBx 1.0 1.8 5.0 1532 1105 A 86 PHE HD% A 87 LYS H 1.0 1.8 5.0 1533 1106 A 86 PHE H A 86 PHE HD% 1.0 1.8 5.0 1534 1107 A 87 LYS HA A 87 LYS HDx 1.0 1.8 5.0 1535 1107 A 87 LYS HA A 87 LYS HDy 1.0 1.8 5.0 1536 1108 A 88 SER H A 87 LYS HA 1.0 1.8 3.5 1537 1109 A 88 SER H A 87 LYS HBy 1.0 1.8 5.0 1538 1110 A 88 SER H A 87 LYS HBx 1.0 1.8 5.0 1539 1111 A 87 LYS HEx A 87 LYS HGy 1.0 1.8 3.5 1540 1111 A 87 LYS HEy A 87 LYS HGy 1.0 1.8 3.5 1541 1111 A 87 LYS HGx A 87 LYS HEx 1.0 1.8 3.5 1542 1111 A 87 LYS HGx A 87 LYS HEy 1.0 1.8 3.5 1543 1112 A 88 SER H A 87 LYS HGy 1.0 1.8 5.0 1544 1113 A 88 SER H A 87 LYS HGx 1.0 1.8 5.0 1545 1114 A 87 LYS HBy A 87 LYS H 1.0 1.8 3.5 1546 1115 A 87 LYS H A 87 LYS HBx 1.0 1.8 3.5 1547 1116 A 87 LYS H A 87 LYS HGy 1.0 1.8 5.0 1548 1116 A 87 LYS HGx A 87 LYS H 1.0 1.8 5.0 1549 1117 A 88 SER H A 87 LYS H 1.0 1.8 5.0 1550 1118 A 89 ASN H A 88 SER HBy 1.0 1.8 5.0 1551 1119 A 88 SER HBx A 89 ASN H 1.0 1.8 5.0 1552 1120 A 90 ASN H A 89 ASN HBx 1.0 1.8 3.5 1553 1120 A 90 ASN H A 89 ASN HBy 1.0 1.8 3.5 1554 1121 A 91 VAL HGy% A 89 ASN HBx 1.0 1.8 6.0 1555 1121 A 89 ASN HBy A 91 VAL HGy% 1.0 1.8 6.0 1556 1122 A 91 VAL H A 89 ASN HBx 1.0 1.8 5.0 1557 1122 A 89 ASN HBy A 91 VAL H 1.0 1.8 5.0 1558 1123 A 89 ASN H A 92 GLU HBx 1.0 1.8 5.0 1559 1123 A 89 ASN H A 92 GLU HBy 1.0 1.8 5.0 1560 1124 A 89 ASN H A 93 MET H 1.0 1.8 5.0 1561 1125 A 90 ASN HA A 93 MET HBx 1.0 1.8 5.0 1562 1125 A 90 ASN HA A 93 MET HBy 1.0 1.8 5.0 1563 1126 A 90 ASN HA A 93 MET HE% 1.0 1.8 3.5 1564 1127 A 90 ASN HA A 93 MET H 1.0 1.8 5.0 1565 1128 A 91 VAL HGy% A 90 ASN HBx 1.0 1.8 5.0 1566 1128 A 90 ASN HBy A 91 VAL HGy% 1.0 1.8 5.0 1567 1129 A 90 ASN H A 91 VAL HGy% 1.0 1.8 6.0 1568 1130 A 90 ASN H A 91 VAL H 1.0 1.8 5.0 1569 1131 A 91 VAL HA A 91 VAL HGx% 1.0 1.8 3.5 1570 1132 A 91 VAL HGy% A 91 VAL HA 1.0 1.8 3.5 1571 1133 A 91 VAL HA A 94 ASP HBy 1.0 1.8 5.0 1572 1133 A 91 VAL HA A 94 ASP HBx 1.0 1.8 5.0 1573 1134 A 91 VAL HA A 94 ASP H 1.0 1.8 5.0 1574 1135 A 91 VAL HA A 95 TRP H 1.0 1.8 5.0 1575 1136 A 91 VAL HB A 92 GLU H 1.0 1.8 3.5 1576 1137 A 91 VAL HGx% A 92 GLU HA 1.0 1.8 5.0 1577 1138 A 91 VAL HGx% A 92 GLU H 1.0 1.8 5.0 1578 1139 A 91 VAL HGy% A 92 GLU H 1.0 1.8 5.0 1579 1140 A 91 VAL H A 91 VAL HB 1.0 1.8 3.5 1580 1141 A 91 VAL H A 91 VAL HGx% 1.0 1.8 5.0 1581 1142 A 91 VAL HGy% A 91 VAL H 1.0 1.8 3.5 1582 1143 A 91 VAL H A 92 GLU H 1.0 1.8 3.5 1583 1144 A 93 MET H A 91 VAL H 1.0 1.8 5.0 1584 1145 A 92 GLU HA A 95 TRP HA 1.0 1.8 6.0 1585 1146 A 92 GLU HA A 95 TRP HBx 1.0 1.8 5.0 1586 1146 A 92 GLU HA A 95 TRP HBy 1.0 1.8 5.0 1587 1147 A 95 TRP H A 92 GLU HA 1.0 1.8 5.0 1588 1148 A 96 VAL HGy% A 92 GLU HA 1.0 1.8 5.0 1589 1149 A 92 GLU HA A 96 VAL H 1.0 1.8 5.0 1590 1150 A 96 VAL HGy% A 92 GLU HGy 1.0 1.8 3.5 1591 1150 A 92 GLU HGx A 96 VAL HGy% 1.0 1.8 3.5 1592 1151 A 92 GLU H A 92 GLU HGy 1.0 1.8 5.0 1593 1152 A 92 GLU HGx A 92 GLU H 1.0 1.8 5.0 1594 1153 A 93 MET H A 92 GLU H 1.0 1.8 5.0 1595 1154 A 94 ASP H A 92 GLU H 1.0 1.8 5.0 1596 1155 A 96 VAL HB A 93 MET HA 1.0 1.8 5.0 1597 1156 A 93 MET HA A 96 VAL HGy% 1.0 1.8 5.0 1598 1157 A 93 MET HA A 96 VAL H 1.0 1.8 5.0 1599 1158 A 93 MET HA A 97 LEU H 1.0 1.8 6.0 1600 1159 A 93 MET HE% A 93 MET HBx 1.0 1.8 3.5 1601 1159 A 93 MET HBy A 93 MET HE% 1.0 1.8 3.5 1602 1160 A 93 MET HBy A 94 ASP H 1.0 1.8 5.0 1603 1161 A 94 ASP H A 93 MET HBx 1.0 1.8 5.0 1604 1162 A 93 MET HE% A 97 LEU HDx% 1.0 1.8 5.0 1605 1163 A 93 MET HE% A 93 MET HGy 1.0 1.8 3.5 1606 1163 A 93 MET HE% A 93 MET HGx 1.0 1.8 3.5 1607 1164 A 94 ASP H A 93 MET HGy 1.0 1.8 5.0 1608 1164 A 93 MET HGx A 94 ASP H 1.0 1.8 5.0 1609 1165 A 97 LEU HG A 93 MET HGy 1.0 1.8 5.0 1610 1165 A 93 MET HGx A 97 LEU HG 1.0 1.8 5.0 1611 1166 A 97 LEU HDx% A 93 MET HGy 1.0 1.8 5.0 1612 1167 A 97 LEU HDx% A 93 MET HGx 1.0 1.8 5.0 1613 1168 A 93 MET HBy A 93 MET H 1.0 1.8 3.5 1614 1169 A 93 MET H A 93 MET HBx 1.0 1.8 3.5 1615 1170 A 93 MET H A 93 MET HGy 1.0 1.8 5.0 1616 1170 A 93 MET H A 93 MET HGx 1.0 1.8 5.0 1617 1171 A 93 MET H A 94 ASP H 1.0 1.8 5.0 1618 1172 A 96 VAL H A 94 ASP HA 1.0 1.8 6.0 1619 1173 A 94 ASP HA A 97 LEU HBx 1.0 1.8 5.0 1620 1173 A 94 ASP HA A 97 LEU HBy 1.0 1.8 5.0 1621 1174 A 97 LEU HDx% A 94 ASP HA 1.0 1.8 5.0 1622 1175 A 97 LEU H A 94 ASP HA 1.0 1.8 5.0 1623 1176 A 94 ASP HA A 98 LYS H 1.0 1.8 5.0 1624 1177 A 95 TRP H A 94 ASP HBy 1.0 1.8 5.0 1625 1178 A 94 ASP HBx A 95 TRP H 1.0 1.8 5.0 1626 1179 A 94 ASP H A 94 ASP HBy 1.0 1.8 3.5 1627 1179 A 94 ASP HBx A 94 ASP H 1.0 1.8 3.5 1628 1180 A 94 ASP H A 96 VAL H 1.0 1.8 6.0 1629 1181 A 94 ASP H A 97 LEU H 1.0 1.8 6.0 1630 1182 A 95 TRP HA A 98 LYS HBy 1.0 1.8 5.0 1631 1183 A 95 TRP HA A 98 LYS HBx 1.0 1.8 5.0 1632 1184 A 95 TRP HA A 98 LYS HDx 1.0 1.8 6.0 1633 1184 A 95 TRP HA A 98 LYS HDy 1.0 1.8 6.0 1634 1185 A 95 TRP HA A 98 LYS H 1.0 1.8 5.0 1635 1186 A 95 TRP HA A 99 HIS H 1.0 1.8 6.0 1636 1187 A 95 TRP HE1 A 95 TRP HBx 1.0 1.8 5.0 1637 1187 A 95 TRP HBy A 95 TRP HE1 1.0 1.8 5.0 1638 1188 A 95 TRP HE3 A 95 TRP HBx 1.0 1.8 5.0 1639 1188 A 95 TRP HBy A 95 TRP HE3 1.0 1.8 5.0 1640 1189 A 96 VAL HGy% A 95 TRP HBx 1.0 1.8 5.0 1641 1189 A 96 VAL HGy% A 95 TRP HBy 1.0 1.8 5.0 1642 1190 A 96 VAL HGy% A 95 TRP HD1 1.0 1.8 6.0 1643 1191 A 96 VAL H A 95 TRP HD1 1.0 1.8 6.0 1644 1192 A 96 VAL HGy% A 95 TRP HE3 1.0 1.8 6.0 1645 1193 A 95 TRP H A 95 TRP HBx 1.0 1.8 3.5 1646 1193 A 95 TRP H A 95 TRP HBy 1.0 1.8 3.5 1647 1194 A 95 TRP H A 95 TRP HD1 1.0 1.8 5.0 1648 1195 A 96 VAL HGy% A 95 TRP H 1.0 1.8 5.0 1649 1196 A 95 TRP H A 96 VAL H 1.0 1.8 5.0 1650 1197 A 95 TRP H A 97 LEU H 1.0 1.8 5.0 1651 1198 A 95 TRP H A 98 LYS H 1.0 1.8 6.0 1652 1199 A 96 VAL HGy% A 96 VAL HA 1.0 1.8 3.5 1653 1200 A 98 LYS H A 96 VAL HA 1.0 1.8 6.0 1654 1201 A 99 HIS H A 96 VAL HA 1.0 1.8 5.0 1655 1202 A 96 VAL HB A 97 LEU H 1.0 1.8 5.0 1656 1203 A 96 VAL HGx% A 97 LEU HA 1.0 1.8 5.0 1657 1204 A 96 VAL HGx% A 97 LEU H 1.0 1.8 5.0 1658 1205 A 96 VAL HGx% A 98 LYS H 1.0 1.8 6.0 1659 1206 A 96 VAL HGx% A 99 HIS H 1.0 1.8 5.0 1660 1207 A 96 VAL HGy% A 97 LEU H 1.0 1.8 5.0 1661 1208 A 96 VAL HB A 96 VAL H 1.0 1.8 3.5 1662 1209 A 96 VAL HGx% A 96 VAL H 1.0 1.8 5.0 1663 1210 A 96 VAL HGy% A 96 VAL H 1.0 1.8 3.5 1664 1211 A 96 VAL H A 97 LEU H 1.0 1.8 5.0 1665 1212 A 96 VAL H A 98 LYS H 1.0 1.8 5.0 1666 1213 A 97 LEU HDx% A 97 LEU HA 1.0 1.8 5.0 1667 1214 A 97 LEU HDy% A 97 LEU HA 1.0 1.8 3.5 1668 1215 A 99 HIS H A 97 LEU HA 1.0 1.8 6.0 1669 1216 A 97 LEU HDx% A 97 LEU HBx 1.0 1.8 3.5 1670 1216 A 97 LEU HDx% A 97 LEU HBy 1.0 1.8 3.5 1671 1217 A 98 LYS H A 97 LEU HBx 1.0 1.8 3.5 1672 1217 A 97 LEU HBy A 98 LYS H 1.0 1.8 3.5 1673 1218 A 97 LEU HDx% A 97 LEU H 1.0 1.8 6.0 1674 1219 A 97 LEU H A 97 LEU HG 1.0 1.8 5.0 1675 1220 A 97 LEU H A 98 LYS H 1.0 1.8 5.0 1676 1221 A 97 LEU H A 99 HIS H 1.0 1.8 5.0 1677 1222 A 98 LYS HA A 98 LYS HDx 1.0 1.8 5.0 1678 1222 A 98 LYS HDy A 98 LYS HA 1.0 1.8 5.0 1679 1223 A 98 LYS HA A 98 LYS HGx 1.0 1.8 3.5 1680 1223 A 98 LYS HA A 98 LYS HGy 1.0 1.8 3.5 1681 1224 A 99 HIS H A 98 LYS HBy 1.0 1.8 5.0 1682 1225 A 99 HIS H A 98 LYS HBx 1.0 1.8 5.0 1683 1226 A 99 HIS H A 98 LYS HDx 1.0 1.8 6.0 1684 1226 A 98 LYS HDy A 99 HIS H 1.0 1.8 6.0 1685 1227 A 98 LYS HEx A 98 LYS HGx 1.0 1.8 3.5 1686 1227 A 98 LYS HEy A 98 LYS HGx 1.0 1.8 3.5 1687 1227 A 98 LYS HGy A 98 LYS HEx 1.0 1.8 3.5 1688 1227 A 98 LYS HGy A 98 LYS HEy 1.0 1.8 3.5 1689 1228 A 98 LYS H A 98 LYS HBx 1.0 1.8 3.5 1690 1228 A 98 LYS H A 98 LYS HBy 1.0 1.8 3.5 1691 1229 A 98 LYS H A 98 LYS HDx 1.0 1.8 6.0 1692 1229 A 98 LYS H A 98 LYS HDy 1.0 1.8 6.0 1693 1230 A 98 LYS H A 98 LYS HGx 1.0 1.8 5.0 1694 1230 A 98 LYS H A 98 LYS HGy 1.0 1.8 5.0 1695 1231 A 100 THR HG2% A 99 HIS H 1.0 1.8 5.0 1696 1232 A 99 HIS H A 100 THR H 1.0 1.8 3.5 1697 1233 A 99 HIS H A 99 HIS HBx 1.0 1.8 3.5 1698 1233 A 99 HIS H A 99 HIS HBy 1.0 1.8 3.5 1699 1234 A 100 THR HG2% A 100 THR HA 1.0 1.8 3.5 1700 1235 A 100 THR HA A 101 GLY H 1.0 1.8 3.5 1701 1236 A 100 THR HB A 101 GLY H 1.0 1.8 5.0 1702 1237 A 100 THR HG2% A 101 GLY H 1.0 1.8 5.0 1703 1238 A 100 THR HG2% A 100 THR H 1.0 1.8 5.0 1704 1239 A 100 THR H A 101 GLY H 1.0 1.8 5.0 1705 1240 A 101 GLY HAy A 102 PRO HDx 1.0 1.8 3.5 1706 1240 A 101 GLY HAx A 102 PRO HDx 1.0 1.8 3.5 1707 1240 A 102 PRO HDy A 101 GLY HAx 1.0 1.8 3.5 1708 1240 A 101 GLY HAy A 102 PRO HDy 1.0 1.8 3.5 1709 1241 A 101 GLY H A 102 PRO HDx 1.0 1.8 5.0 1710 1241 A 101 GLY H A 102 PRO HDy 1.0 1.8 5.0 1711 1242 A 102 PRO HA A 103 ASN H 1.0 1.8 3.5 1712 1243 A 103 ASN H A 102 PRO HBy 1.0 1.8 5.0 1713 1244 A 103 ASN H A 102 PRO HBx 1.0 1.8 5.0 1714 1245 A 103 ASN H A 102 PRO HDx 1.0 1.8 5.0 1715 1245 A 102 PRO HDy A 103 ASN H 1.0 1.8 5.0 1716 1246 A 103 ASN H A 102 PRO HGx 1.0 1.8 5.0 1717 1246 A 103 ASN H A 102 PRO HGy 1.0 1.8 5.0 1718 1247 A 103 ASN HBy A 103 ASN HD21 1.0 1.8 3.5 1719 1247 A 103 ASN HBx A 103 ASN HD21 1.0 1.8 3.5 1720 1247 A 103 ASN HD22 A 103 ASN HBy 1.0 1.8 3.5 1721 1247 A 103 ASN HBx A 103 ASN HD22 1.0 1.8 3.5 1722 1248 A 104 SER H A 103 ASN HBy 1.0 1.8 5.0 1723 1249 A 103 ASN HBx A 104 SER H 1.0 1.8 5.0 1724 1250 A 103 ASN H A 103 ASN HBy 1.0 1.8 3.5 1725 1250 A 103 ASN H A 103 ASN HBx 1.0 1.8 3.5 1726 1251 A 103 ASN H A 104 SER HBx 1.0 1.8 6.0 1727 1251 A 103 ASN H A 104 SER HBy 1.0 1.8 6.0 1728 1252 A 103 ASN H A 104 SER H 1.0 1.8 5.0 1729 1253 A 104 SER HA A 105 PRO HDy 1.0 1.8 3.5 1730 1254 A 104 SER HA A 105 PRO HDx 1.0 1.8 3.5 1731 1255 A 104 SER H A 104 SER HBx 1.0 1.8 3.5 1732 1255 A 104 SER H A 104 SER HBy 1.0 1.8 3.5 1733 1256 A 104 SER H A 105 PRO HDy 1.0 1.8 5.0 1734 1256 A 104 SER H A 105 PRO HDx 1.0 1.8 5.0 1735 1257 A 105 PRO HA A 106 ASP H 1.0 1.8 3.5 1736 1258 A 107 THR H A 105 PRO HBx 1.0 1.8 5.0 1737 1258 A 105 PRO HBy A 107 THR H 1.0 1.8 5.0 1738 1259 A 106 ASP H A 105 PRO HDy 1.0 1.8 6.0 1739 1260 A 105 PRO HDx A 106 ASP H 1.0 1.8 6.0 1740 1261 A 107 THR H A 106 ASP HA 1.0 1.8 3.5 1741 1262 A 107 THR H A 106 ASP HBy 1.0 1.8 5.0 1742 1263 A 107 THR H A 106 ASP HBx 1.0 1.8 5.0 1743 1264 A 106 ASP H A 106 ASP HBy 1.0 1.8 3.5 1744 1264 A 106 ASP H A 106 ASP HBx 1.0 1.8 3.5 1745 1265 A 106 ASP H A 107 THR H 1.0 1.8 5.0 1746 1266 A 107 THR HA A 107 THR HG2% 1.0 1.8 3.5 1747 1267 A 107 THR HA A 108 ALA H 1.0 1.8 3.5 1748 1268 A 108 ALA H A 107 THR HB 1.0 1.8 5.0 1749 1269 A 107 THR H A 107 THR HG2% 1.0 1.8 5.0 1750 1270 A 107 THR H A 108 ALA H 1.0 1.8 5.0 1751 1271 A 108 ALA H A 108 ALA HB% 1.0 1.8 3.5 1752 1272 A 109 ASN HA A 110 ASP H 1.0 1.8 2.7 1753 1273 A 110 ASP HBy A 111 GLY H 1.0 1.8 6.0 1754 1274 A 111 GLY H A 110 ASP HBx 1.0 1.8 6.0 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 hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 13 VAL H A 59 VAL O 1.0 1.8 2.3 2 2 A 59 VAL O A 13 VAL N 1.0 2.7 3.3 3 3 A 14 LYS H A 86 PHE O 1.0 1.8 2.3 4 4 A 86 PHE O A 14 LYS N 1.0 2.7 3.3 5 5 A 15 VAL H A 57 ALA O 1.0 1.8 2.3 6 6 A 57 ALA O A 15 VAL N 1.0 2.7 3.3 7 7 A 16 ARG H A 84 GLU O 1.0 1.8 2.3 8 8 A 84 GLU O A 16 ARG N 1.0 2.7 3.3 9 9 A 22 CYS H A 19 PRO O 1.0 1.8 2.3 10 10 A 19 PRO O A 22 CYS N 1.0 2.7 3.3 11 11 A 28 GLN H A 24 ALA O 1.0 1.8 2.3 12 12 A 24 ALA O A 28 GLN N 1.0 2.7 3.3 13 13 A 29 ARG H A 25 ASP O 1.0 1.8 2.3 14 14 A 25 ASP O A 29 ARG N 1.0 2.7 3.3 15 15 A 30 PHE H A 26 GLU O 1.0 1.8 2.3 16 16 A 26 GLU O A 30 PHE N 1.0 2.7 3.3 17 17 A 31 PHE H A 27 VAL O 1.0 1.8 2.3 18 18 A 27 VAL O A 31 PHE N 1.0 2.7 3.3 19 19 A 32 SER H A 29 ARG O 1.0 1.8 2.3 20 20 A 29 ARG O A 32 SER N 1.0 2.7 3.3 21 21 A 37 GLN H A 60 GLU O 1.0 1.8 2.3 22 22 A 60 GLU O A 37 GLN N 1.0 2.7 3.3 23 23 A 39 GLY H A 36 ILE O 1.0 1.8 2.3 24 24 A 36 ILE O A 39 GLY N 1.0 2.7 3.3 25 25 A 41 GLN H A 38 ASN O 1.0 1.8 2.3 26 26 A 38 ASN O A 41 GLN N 1.0 2.7 3.3 27 27 A 42 GLY H A 39 GLY O 1.0 1.8 2.3 28 28 A 39 GLY O A 42 GLY N 1.0 2.7 3.3 29 29 A 44 ARG H A 58 PHE O 1.0 1.8 2.3 30 30 A 58 PHE O A 44 ARG N 1.0 2.7 3.3 31 31 A 46 ILE H A 56 GLU O 1.0 1.8 2.3 32 32 A 56 GLU O A 46 ILE N 1.0 2.7 3.3 33 33 A 48 THR H A 52 ARG O 1.0 1.8 2.3 34 34 A 52 ARG O A 48 THR N 1.0 2.7 3.3 35 35 A 51 GLY H A 48 THR O 1.0 1.8 2.3 36 36 A 48 THR O A 51 GLY N 1.0 2.7 3.3 37 37 A 54 SER H A 46 ILE O 1.0 1.8 2.3 38 38 A 46 ILE O A 54 SER N 1.0 2.7 3.3 39 39 A 57 ALA H A 15 VAL O 1.0 1.8 2.3 40 40 A 15 VAL O A 57 ALA N 1.0 2.7 3.3 41 41 A 58 PHE H A 44 ARG O 1.0 1.8 2.3 42 42 A 44 ARG O A 58 PHE N 1.0 2.7 3.3 43 43 A 59 VAL H A 13 VAL O 1.0 1.8 2.3 44 44 A 13 VAL O A 59 VAL N 1.0 2.7 3.3 45 45 A 60 GLU H A 42 GLY O 1.0 1.8 2.3 46 46 A 42 GLY O A 60 GLU N 1.0 2.7 3.3 47 47 A 61 LEU H A 11 PHE O 1.0 1.8 2.3 48 48 A 11 PHE O A 61 LEU N 1.0 2.7 3.3 49 49 A 62 GLU H A 35 LYS O 1.0 1.8 2.3 50 50 A 35 LYS O A 62 GLU N 1.0 2.7 3.3 51 51 A 68 LYS H A 64 GLU O 1.0 1.8 2.3 52 52 A 64 GLU O A 68 LYS N 1.0 2.7 3.3 53 53 A 71 LEU H A 67 VAL O 1.0 1.8 2.3 54 54 A 67 VAL O A 71 LEU N 1.0 2.7 3.3 55 55 A 73 LYS H A 70 ALA O 1.0 1.8 2.3 56 56 A 70 ALA O A 73 LYS N 1.0 2.7 3.3 57 57 A 74 ASP H A 71 LEU O 1.0 1.8 2.3 58 58 A 71 LEU O A 74 ASP N 1.0 2.7 3.3 59 59 A 78 MET H A 81 ARG O 1.0 1.8 2.3 60 60 A 81 ARG O A 78 MET N 1.0 2.7 3.3 61 61 A 83 VAL H A 76 GLU O 1.0 1.8 2.3 62 62 A 76 GLU O A 83 VAL N 1.0 2.7 3.3 63 63 A 84 GLU H A 16 ARG O 1.0 1.8 2.3 64 64 A 16 ARG O A 84 GLU N 1.0 2.7 3.3 65 65 A 86 PHE H A 14 LYS O 1.0 1.8 2.3 66 66 A 14 LYS O A 86 PHE N 1.0 2.7 3.3 67 67 A 88 SER H A 12 VAL O 1.0 1.8 2.3 68 68 A 12 VAL O A 88 SER N 1.0 2.7 3.3 69 69 A 93 MET H A 89 ASN O 1.0 1.8 2.3 70 70 A 89 ASN O A 93 MET N 1.0 2.7 3.3 71 71 A 94 ASP H A 90 ASN O 1.0 1.8 2.3 72 72 A 90 ASN O A 94 ASP N 1.0 2.7 3.3 73 73 A 95 TRP H A 91 VAL O 1.0 1.8 2.3 74 74 A 91 VAL O A 95 TRP N 1.0 2.7 3.3 75 75 A 96 VAL H A 92 GLU O 1.0 1.8 2.3 76 76 A 92 GLU O A 96 VAL N 1.0 2.7 3.3 77 77 A 97 LEU H A 93 MET O 1.0 1.8 2.3 78 78 A 93 MET O A 97 LEU N 1.0 2.7 3.3 79 79 A 98 LYS H A 94 ASP O 1.0 1.8 2.3 80 80 A 94 ASP O A 98 LYS N 1.0 2.7 3.3 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 _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 11 PHE C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -152.6 -91.6 PHI 2 2 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 VAL N 1.0 134.8 174.8 PSI 3 3 A 13 VAL C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -155.7 -85.5 PHI 4 4 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 VAL N 1.0 99.5 162.3 PSI 5 5 A 14 LYS C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -145.3 -105.3 PHI 6 6 A 15 VAL N A 15 VAL CA A 15 VAL C A 16 ARG N 1.0 109.0 175.2 PSI 7 7 A 15 VAL C A 16 ARG N A 16 ARG CA A 16 ARG C 1.0 -149.9 -95.9 PHI 8 8 A 16 ARG N A 16 ARG CA A 16 ARG C A 17 GLY N 1.0 121.0 170.8 PSI 9 9 A 17 GLY C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -133.5 -40.1 PHI 10 10 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 PRO N 1.0 72.5 197.1 PSI 11 11 A 19 PRO C A 20 TRP N A 20 TRP CA A 20 TRP C 1.0 -81.3 -41.3 PHI 12 12 A 20 TRP N A 20 TRP CA A 20 TRP C A 21 SER N 1.0 -46.5 0.7 PSI 13 13 A 20 TRP C A 21 SER N A 21 SER CA A 21 SER C 1.0 -120.7 -65.5 PHI 14 14 A 21 SER N A 21 SER CA A 21 SER C A 22 CYS N 1.0 -33.6 35.2 PSI 15 15 A 23 SER C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -80.8 -40.8 PHI 16 16 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 ASP N 1.0 -58.5 -18.5 PSI 17 17 A 24 ALA C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -84.4 -44.4 PHI 18 18 A 25 ASP N A 25 ASP CA A 25 ASP C A 26 GLU N 1.0 -61.1 -21.1 PSI 19 19 A 25 ASP C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -84.1 -44.1 PHI 20 20 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 VAL N 1.0 -62.0 -22.0 PSI 21 21 A 26 GLU C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -85.3 -45.3 PHI 22 22 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 GLN N 1.0 -62.1 -22.1 PSI 23 23 A 27 VAL C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -81.9 -41.9 PHI 24 24 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 ARG N 1.0 -62.6 -22.6 PSI 25 25 A 28 GLN C A 29 ARG N A 29 ARG CA A 29 ARG C 1.0 -87.5 -47.5 PHI 26 26 A 29 ARG N A 29 ARG CA A 29 ARG C A 30 PHE N 1.0 -58.4 -18.4 PSI 27 27 A 29 ARG C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -84.7 -44.7 PHI 28 28 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 PHE N 1.0 -64.0 -7.2 PSI 29 29 A 39 GLY C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -81.6 -41.6 PHI 30 30 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 GLN N 1.0 -55.9 -3.9 PSI 31 31 A 40 ALA C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -109.8 -59.8 PHI 32 32 A 41 GLN N A 41 GLN CA A 41 GLN C A 42 GLY N 1.0 -19.5 20.5 PSI 33 33 A 43 ILE C A 44 ARG N A 44 ARG CA A 44 ARG C 1.0 -143.9 -59.9 PHI 34 34 A 44 ARG N A 44 ARG CA A 44 ARG C A 45 PHE N 1.0 99.0 151.4 PSI 35 35 A 44 ARG C A 45 PHE N A 45 PHE CA A 45 PHE C 1.0 -150.3 -10.3 PHI 36 36 A 45 PHE N A 45 PHE CA A 45 PHE C A 46 ILE N 1.0 67.5 207.5 PSI 37 37 A 45 PHE C A 46 ILE N A 46 ILE CA A 46 ILE C 1.0 -135.4 -50.2 PHI 38 38 A 46 ILE N A 46 ILE CA A 46 ILE C A 47 TYR N 1.0 84.5 167.1 PSI 39 39 A 46 ILE C A 47 TYR N A 47 TYR CA A 47 TYR C 1.0 -141.7 -70.7 PHI 40 40 A 47 TYR N A 47 TYR CA A 47 TYR C A 48 THR N 1.0 137.0 177.0 PSI 41 41 A 47 TYR C A 48 THR N A 48 THR CA A 48 THR C 1.0 -107.3 -61.7 PHI 42 42 A 48 THR N A 48 THR CA A 48 THR C A 49 ARG N 1.0 148.4 188.4 PSI 43 43 A 48 THR C A 49 ARG N A 49 ARG CA A 49 ARG C 1.0 -79.7 -39.7 PHI 44 44 A 49 ARG N A 49 ARG CA A 49 ARG C A 50 GLU N 1.0 -60.8 4.0 PSI 45 45 A 55 GLY C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -167.0 -105.6 PHI 46 46 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 ALA N 1.0 127.1 183.1 PSI 47 47 A 56 GLU C A 57 ALA N A 57 ALA CA A 57 ALA C 1.0 -171.9 -108.3 PHI 48 48 A 57 ALA N A 57 ALA CA A 57 ALA C A 58 PHE N 1.0 116.4 180.0 PSI 49 49 A 57 ALA C A 58 PHE N A 58 PHE CA A 58 PHE C 1.0 -173.0 -82.0 PHI 50 50 A 58 PHE N A 58 PHE CA A 58 PHE C A 59 VAL N 1.0 103.9 177.3 PSI 51 51 A 58 PHE C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -159.1 -94.9 PHI 52 52 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 GLU N 1.0 104.2 144.2 PSI 53 53 A 59 VAL C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -142.2 -67.2 PHI 54 54 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 LEU N 1.0 108.9 158.7 PSI 55 55 A 60 GLU C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -150.4 -47.6 PHI 56 56 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 GLU N 1.0 102.8 216.2 PSI 57 57 A 61 LEU C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -92.4 -37.2 PHI 58 58 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 SER N 1.0 -48.8 -2.4 PSI 59 59 A 64 GLU C A 65 ASP N A 65 ASP CA A 65 ASP C 1.0 -85.5 -45.5 PHI 60 60 A 65 ASP N A 65 ASP CA A 65 ASP C A 66 GLU N 1.0 -59.7 -19.7 PSI 61 61 A 65 ASP C A 66 GLU N A 66 GLU CA A 66 GLU C 1.0 -86.5 -46.5 PHI 62 62 A 66 GLU N A 66 GLU CA A 66 GLU C A 67 VAL N 1.0 -62.7 -18.9 PSI 63 63 A 66 GLU C A 67 VAL N A 67 VAL CA A 67 VAL C 1.0 -82.3 -42.3 PHI 64 64 A 67 VAL N A 67 VAL CA A 67 VAL C A 68 LYS N 1.0 -62.1 -22.1 PSI 65 65 A 67 VAL C A 68 LYS N A 68 LYS CA A 68 LYS C 1.0 -79.0 -39.0 PHI 66 66 A 68 LYS N A 68 LYS CA A 68 LYS C A 69 LEU N 1.0 -61.1 -21.1 PSI 67 67 A 68 LYS C A 69 LEU N A 69 LEU CA A 69 LEU C 1.0 -86.3 -46.3 PHI 68 68 A 69 LEU N A 69 LEU CA A 69 LEU C A 70 ALA N 1.0 -59.4 -19.4 PSI 69 69 A 69 LEU C A 70 ALA N A 70 ALA CA A 70 ALA C 1.0 -86.3 -46.3 PHI 70 70 A 70 ALA N A 70 ALA CA A 70 ALA C A 71 LEU N 1.0 -63.2 -23.2 PSI 71 71 A 80 HIS C A 81 ARG N A 81 ARG CA A 81 ARG C 1.0 -178.6 -38.6 PHI 72 72 A 81 ARG N A 81 ARG CA A 81 ARG C A 82 TYR N 1.0 77.6 217.6 PSI 73 73 A 81 ARG C A 82 TYR N A 82 TYR CA A 82 TYR C 1.0 -163.9 -23.9 PHI 74 74 A 82 TYR N A 82 TYR CA A 82 TYR C A 83 VAL N 1.0 72.9 180.5 PSI 75 75 A 82 TYR C A 83 VAL N A 83 VAL CA A 83 VAL C 1.0 -150.1 -71.1 PHI 76 76 A 83 VAL N A 83 VAL CA A 83 VAL C A 84 GLU N 1.0 99.7 165.7 PSI 77 77 A 83 VAL C A 84 GLU N A 84 GLU CA A 84 GLU C 1.0 -151.9 -99.3 PHI 78 78 A 84 GLU N A 84 GLU CA A 84 GLU C A 85 VAL N 1.0 121.4 171.2 PSI 79 79 A 84 GLU C A 85 VAL N A 85 VAL CA A 85 VAL C 1.0 -157.1 -100.5 PHI 80 80 A 85 VAL N A 85 VAL CA A 85 VAL C A 86 PHE N 1.0 104.8 168.6 PSI 81 81 A 85 VAL C A 86 PHE N A 86 PHE CA A 86 PHE C 1.0 -147.6 -104.4 PHI 82 82 A 86 PHE N A 86 PHE CA A 86 PHE C A 87 LYS N 1.0 123.7 182.7 PSI 83 83 A 86 PHE C A 87 LYS N A 87 LYS CA A 87 LYS C 1.0 -110.5 -58.5 PHI 84 84 A 87 LYS N A 87 LYS CA A 87 LYS C A 88 SER N 1.0 105.5 145.5 PSI 85 85 A 89 ASN C A 90 ASN N A 90 ASN CA A 90 ASN C 1.0 -82.4 -42.4 PHI 86 86 A 90 ASN N A 90 ASN CA A 90 ASN C A 91 VAL N 1.0 -58.8 -18.8 PSI 87 87 A 90 ASN C A 91 VAL N A 91 VAL CA A 91 VAL C 1.0 -84.4 -44.4 PHI 88 88 A 91 VAL N A 91 VAL CA A 91 VAL C A 92 GLU N 1.0 -61.5 -21.5 PSI 89 89 A 91 VAL C A 92 GLU N A 92 GLU CA A 92 GLU C 1.0 -83.9 -43.9 PHI 90 90 A 92 GLU N A 92 GLU CA A 92 GLU C A 93 MET N 1.0 -60.7 -20.7 PSI 91 91 A 92 GLU C A 93 MET N A 93 MET CA A 93 MET C 1.0 -83.8 -43.8 PHI 92 92 A 93 MET N A 93 MET CA A 93 MET C A 94 ASP N 1.0 -63.9 -23.9 PSI 93 93 A 93 MET C A 94 ASP N A 94 ASP CA A 94 ASP C 1.0 -83.8 -43.8 PHI 94 94 A 94 ASP N A 94 ASP CA A 94 ASP C A 95 TRP N 1.0 -61.5 -21.5 PSI 95 95 A 94 ASP C A 95 TRP N A 95 TRP CA A 95 TRP C 1.0 -82.3 -42.3 PHI 96 96 A 95 TRP N A 95 TRP CA A 95 TRP C A 96 VAL N 1.0 -63.5 -23.5 PSI 97 97 A 95 TRP C A 96 VAL N A 96 VAL CA A 96 VAL C 1.0 -88.3 -47.1 PHI 98 98 A 96 VAL N A 96 VAL CA A 96 VAL C A 97 LEU N 1.0 -59.6 -19.6 PSI 99 99 A 96 VAL C A 97 LEU N A 97 LEU CA A 97 LEU C 1.0 -83.2 -43.2 PHI 100 100 A 97 LEU N A 97 LEU CA A 97 LEU C A 98 LYS N 1.0 -56.0 -16.0 PSI 101 101 A 97 LEU C A 98 LYS N A 98 LYS CA A 98 LYS C 1.0 -109.9 -59.7 PHI 102 102 A 98 LYS N A 98 LYS CA A 98 LYS C A 99 HIS N 1.0 -37.3 19.5 PSI stop_ save_ save_Nnoesy_peak_list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode Nnoesy_peak_list _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 10204.082 2 15N 1895.375 3 1H 9775.171 stop_ save_ save_Cnoesy_both.list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode Cnoesy_both.list _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 10204.082 2 13C 13888.889 3 1H 9775.171 stop_ save_ save_4D_ccnoesy_d2o.list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode 4D_ccnoesy_d2o.list _nef_nmr_spectrum.num_dimensions 4 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 8000 2 13C 4197.272 3 13C 3121.342 4 1H 3121.342 stop_ save_