data_nef_c16154_2ken 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 PDB 2kbn stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLU middle . . 3 A 3 PRO middle . false 4 A 4 GLN middle . . 5 A 5 LEU middle . . 6 A 6 THR middle . . 7 A 7 LYS middle . . 8 A 8 ILE middle . . 9 A 9 VAL middle . . 10 A 10 ASP middle . . 11 A 11 ILE middle . . 12 A 12 VAL middle . . 13 A 13 GLU middle . . 14 A 14 ASN middle . . 15 A 15 GLY middle . false 16 A 16 GLN middle . . 17 A 17 TRP middle . . 18 A 18 ALA middle . . 19 A 19 ASN middle . . 20 A 20 LEU middle . . 21 A 21 LYS middle . . 22 A 22 ALA middle . . 23 A 23 LYS middle . . 24 A 24 VAL middle . . 25 A 25 ILE middle . . 26 A 26 GLN middle . . 27 A 27 LEU middle . . 28 A 28 TRP middle . . 29 A 29 GLU middle . . 30 A 30 ASN middle . . 31 A 31 THR middle . . 32 A 32 HIS middle . . 33 A 33 GLU middle . . 34 A 34 SER middle . . 35 A 35 ILE middle . . 36 A 36 SER middle . . 37 A 37 GLN middle . . 38 A 38 VAL middle . . 39 A 39 GLY middle . false 40 A 40 LEU middle . . 41 A 41 LEU middle . . 42 A 42 GLY middle . false 43 A 43 ASP middle . . 44 A 44 GLU middle . . 45 A 45 THR middle . . 46 A 46 GLY middle . false 47 A 47 ILE middle . . 48 A 48 ILE middle . . 49 A 49 LYS middle . . 50 A 50 PHE middle . . 51 A 51 THR middle . . 52 A 52 ILE middle . . 53 A 53 TRP middle . . 54 A 54 LYS middle . . 55 A 55 ASN middle . . 56 A 56 ALA middle . . 57 A 57 GLU middle . . 58 A 58 LEU middle . . 59 A 59 PRO middle . false 60 A 60 LEU middle . . 61 A 61 LEU middle . . 62 A 62 GLU middle . . 63 A 63 GLN middle . . 64 A 64 GLY middle . false 65 A 65 GLU middle . . 66 A 66 SER middle . . 67 A 67 TYR middle . . 68 A 68 LEU middle . . 69 A 69 LEU middle . . 70 A 70 ARG middle . . 71 A 71 SER middle . . 72 A 72 VAL middle . . 73 A 73 VAL middle . . 74 A 74 VAL middle . . 75 A 75 GLY middle . false 76 A 76 GLU middle . . 77 A 77 TYR middle . . 78 A 78 ASN middle . . 79 A 79 ASP middle . . 80 A 80 ARG middle . . 81 A 81 PHE middle . . 82 A 82 GLN middle . . 83 A 83 VAL middle . . 84 A 84 GLN middle . . 85 A 85 VAL middle . . 86 A 86 ASN middle . . 87 A 87 LYS middle . . 88 A 88 ASN middle . . 89 A 89 SER middle . . 90 A 90 SER middle . . 91 A 91 ILE middle . . 92 A 92 GLU middle . . 93 A 93 LYS middle . . 94 A 94 LEU middle . . 95 A 95 SER middle . . 96 A 96 GLU middle . . 97 A 97 PRO middle . false 98 A 98 ILE middle . . 99 A 99 GLU middle . . 100 A 100 VAL middle . . 101 A 101 GLY middle . false 102 A 102 LEU middle . . 103 A 103 GLU middle . . 104 A 104 HIS middle . . 105 A 105 HIS middle . . 106 A 106 HIS middle . . 107 A 107 HIS middle . . 108 A 108 HIS middle . . 109 A 109 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 3 PRO HA H 1 4.43 0.02 A 3 PRO HBx H 1 1.78 0.02 A 3 PRO HBy H 1 2.09 0.02 A 3 PRO HDx H 1 3.63 0.02 A 3 PRO HDy H 1 3.71 0.02 A 3 PRO HGy H 1 1.97 0.02 A 3 PRO HGx H 1 1.87 0.02 A 3 PRO C C 13 175.6 0.2 A 3 PRO CA C 13 62.51 0.2 A 3 PRO CB C 13 32 0.2 A 3 PRO CD C 13 50.2 0.2 A 3 PRO CG C 13 27.2 0.2 A 4 GLN H H 1 8.58 0.02 A 4 GLN HA H 1 4.26 0.02 A 4 GLN HBx H 1 2.03 0.02 A 4 GLN HBy H 1 2.03 0.02 A 4 GLN HE2y H 1 7.59 0.02 A 4 GLN HE2x H 1 6.92 0.02 A 4 GLN HGx H 1 2.35 0.02 A 4 GLN HGy H 1 2.35 0.02 A 4 GLN C C 13 176.9 0.2 A 4 GLN CA C 13 55.7 0.2 A 4 GLN CB C 13 29.2 0.2 A 4 GLN CG C 13 33.6 0.2 A 4 GLN N N 15 120 0.2 A 4 GLN NE2 N 15 113.4 0.2 A 5 LEU H H 1 8.92 0.02 A 5 LEU HA H 1 4.66 0.02 A 5 LEU HBx H 1 1.48 0.02 A 5 LEU HBy H 1 1.73 0.02 A 5 LEU HDx% H 1 0.86 0.02 A 5 LEU HDy% H 1 0.62 0.02 A 5 LEU HG H 1 1.68 0.02 A 5 LEU C C 13 176.9 0.2 A 5 LEU CA C 13 54.7 0.2 A 5 LEU CB C 13 43 0.2 A 5 LEU CDy C 13 25.6 0.02 A 5 LEU CDx C 13 23.8 0.02 A 5 LEU CG C 13 26.5 0.2 A 5 LEU N N 15 128.5 0.2 A 6 THR H H 1 8.75 0.02 A 6 THR HA H 1 4.53 0.02 A 6 THR HB H 1 3.66 0.02 A 6 THR HG2% H 1 1.12 0.02 A 6 THR C C 13 173.7 0.2 A 6 THR CA C 13 61.6 0.2 A 6 THR CB C 13 72 0.2 A 6 THR CG2 C 13 20.7 0.2 A 6 THR N N 15 121 0.2 A 7 LYS H H 1 9.08 0.02 A 7 LYS HA H 1 4.43 0.02 A 7 LYS HBx H 1 0.57 0.02 A 7 LYS HBy H 1 1.66 0.02 A 7 LYS HDx H 1 1.53 0.02 A 7 LYS HDy H 1 1.69 0.02 A 7 LYS HEx H 1 2.9 0.02 A 7 LYS HEy H 1 2.95 0.02 A 7 LYS HGx H 1 1.51 0.02 A 7 LYS HGy H 1 1.51 0.02 A 7 LYS C C 13 178.6 0.2 A 7 LYS CA C 13 54.3 0.2 A 7 LYS CB C 13 32.3 0.2 A 7 LYS CD C 13 28.1 0.2 A 7 LYS CE C 13 42.4 0.2 A 7 LYS CG C 13 24.6 0.2 A 7 LYS N N 15 126.3 0.2 A 8 ILE H H 1 9.87 0.02 A 8 ILE HA H 1 3.24 0.02 A 8 ILE HB H 1 1.6 0.02 A 8 ILE HD1% H 1 0.64 0.02 A 8 ILE HG2% H 1 0.49 0.02 A 8 ILE C C 13 178.7 0.2 A 8 ILE CA C 13 66.8 0.2 A 8 ILE CB C 13 36.4 0.2 A 8 ILE CD1 C 13 13.32 0.2 A 8 ILE CG2 C 13 17.7 0.2 A 8 ILE N N 15 124.7 0.2 A 9 VAL H H 1 8.34 0.02 A 9 VAL HA H 1 3.93 0.02 A 9 VAL HB H 1 1.98 0.02 A 9 VAL HGx% H 1 0.77 0.02 A 9 VAL HGy% H 1 1.04 0.02 A 9 VAL C C 13 178.7 0.2 A 9 VAL CA C 13 63.3 0.2 A 9 VAL CB C 13 31.7 0.2 A 9 VAL CGx C 13 18.7 0.02 A 9 VAL CGy C 13 21.7 0.02 A 9 VAL N N 15 119.5 0.2 A 10 ASP H H 1 7.51 0.02 A 10 ASP HA H 1 4.73 0.02 A 10 ASP HBx H 1 2.65 0.02 A 10 ASP HBy H 1 2.91 0.02 A 10 ASP C C 13 174.5 0.2 A 10 ASP CA C 13 54.4 0.2 A 10 ASP CB C 13 41.1 0.2 A 10 ASP N N 15 119.1 0.2 A 11 ILE H H 1 7.46 0.02 A 11 ILE HA H 1 3.8 0.02 A 11 ILE HB H 1 1.99 0.02 A 11 ILE HD1% H 1 0.48 0.02 A 11 ILE HG1x H 1 0.73 0.02 A 11 ILE HG1y H 1 1.42 0.02 A 11 ILE HG2% H 1 0.45 0.02 A 11 ILE C C 13 174.9 0.2 A 11 ILE CA C 13 62.1 0.2 A 11 ILE CB C 13 35.3 0.2 A 11 ILE CD1 C 13 12.8 0.2 A 11 ILE CG1 C 13 27.4 0.2 A 11 ILE CG2 C 13 18.5 0.2 A 11 ILE N N 15 124.2 0.2 A 12 VAL H H 1 8.53 0.02 A 12 VAL HA H 1 4.26 0.02 A 12 VAL HB H 1 2.28 0.02 A 12 VAL HGx% H 1 0.76 0.02 A 12 VAL HGy% H 1 0.69 0.02 A 12 VAL C C 13 174.9 0.2 A 12 VAL CA C 13 60.6 0.2 A 12 VAL CB C 13 35.4 0.2 A 12 VAL CGy C 13 21.2 0.02 A 12 VAL CGx C 13 17.7 0.02 A 12 VAL N N 15 118.4 0.2 A 13 GLU H H 1 7.43 0.02 A 13 GLU HA H 1 4.59 0.02 A 13 GLU HBx H 1 1.77 0.02 A 13 GLU HBy H 1 1.87 0.02 A 13 GLU HGx H 1 2.11 0.02 A 13 GLU HGy H 1 2.21 0.02 A 13 GLU C C 13 173.8 0.2 A 13 GLU CA C 13 54.8 0.2 A 13 GLU CB C 13 33.16 0.2 A 13 GLU CG C 13 35.7 0.2 A 13 GLU N N 15 120.1 0.2 A 14 ASN H H 1 8.8 0.02 A 14 ASN HA H 1 4.11 0.02 A 14 ASN HBx H 1 2.79 0.02 A 14 ASN HBy H 1 2.82 0.02 A 14 ASN HD2y H 1 7.58 0.02 A 14 ASN HD2x H 1 6.89 0.02 A 14 ASN C C 13 176.6 0.2 A 14 ASN CA C 13 54.6 0.2 A 14 ASN CB C 13 38.9 0.2 A 14 ASN N N 15 121.5 0.2 A 14 ASN ND2 N 15 111.7 0.2 A 15 GLY H H 1 8.62 0.02 A 15 GLY HAx H 1 3.46 0.02 A 15 GLY HAy H 1 4.11 0.02 A 15 GLY C C 13 173.1 0.2 A 15 GLY CA C 13 45.3 0.2 A 15 GLY N N 15 114.9 0.2 A 16 GLN H H 1 7.28 0.02 A 16 GLN HA H 1 4.16 0.02 A 16 GLN HBx H 1 1.85 0.02 A 16 GLN HBy H 1 2.19 0.02 A 16 GLN HE2y H 1 7.8 0.02 A 16 GLN HE2x H 1 6.92 0.02 A 16 GLN HGx H 1 2.12 0.02 A 16 GLN HGy H 1 2.45 0.02 A 16 GLN C C 13 174.4 0.2 A 16 GLN CA C 13 56.3 0.2 A 16 GLN CB C 13 30.3 0.2 A 16 GLN CG C 13 32.5 0.2 A 16 GLN N N 15 121.5 0.2 A 16 GLN NE2 N 15 108.5 0.2 A 17 TRP H H 1 8.64 0.02 A 17 TRP HA H 1 5.4 0.02 A 17 TRP HBx H 1 3.02 0.02 A 17 TRP HBy H 1 3.15 0.02 A 17 TRP HD1 H 1 7.33 0.02 A 17 TRP HE1 H 1 9.95 0.02 A 17 TRP HE3 H 1 7.28 0.02 A 17 TRP HH2 H 1 7.14 0.02 A 17 TRP HZ2 H 1 7.42 0.02 A 17 TRP HZ3 H 1 7.07 0.02 A 17 TRP C C 13 176.9 0.2 A 17 TRP CA C 13 56.4 0.2 A 17 TRP CB C 13 30.3 0.2 A 17 TRP CD1 C 13 127.5 0.2 A 17 TRP CE3 C 13 120.7 0.2 A 17 TRP CH2 C 13 123.9 0.2 A 17 TRP CZ2 C 13 114.5 0.2 A 17 TRP CZ3 C 13 121.2 0.2 A 17 TRP N N 15 125.5 0.2 A 17 TRP NE1 N 15 129.2 0.2 A 18 ALA H H 1 9.02 0.02 A 18 ALA HA H 1 4.65 0.02 A 18 ALA HB% H 1 0.99 0.02 A 18 ALA C C 13 174.1 0.2 A 18 ALA CA C 13 51.43 0.2 A 18 ALA CB C 13 22.6 0.2 A 18 ALA N N 15 124 0.2 A 19 ASN H H 1 8.25 0.02 A 19 ASN HA H 1 5.71 0.02 A 19 ASN HBx H 1 2.34 0.02 A 19 ASN HBy H 1 2.96 0.02 A 19 ASN HD2y H 1 7.9 0.02 A 19 ASN HD2x H 1 7.11 0.02 A 19 ASN C C 13 173.5 0.2 A 19 ASN CA C 13 51.6 0.2 A 19 ASN CB C 13 40.1 0.2 A 19 ASN N N 15 116.5 0.2 A 19 ASN ND2 N 15 116.2 0.2 A 20 LEU H H 1 9.28 0.02 A 20 LEU HA H 1 4.93 0.02 A 20 LEU HBx H 1 1.44 0.02 A 20 LEU HBy H 1 1.56 0.02 A 20 LEU HDx% H 1 0.59 0.02 A 20 LEU HDy% H 1 0.59 0.02 A 20 LEU C C 13 174.8 0.2 A 20 LEU CA C 13 54.2 0.2 A 20 LEU CB C 13 46.3 0.2 A 20 LEU CDx C 13 26.0 0.02 A 20 LEU CDy C 13 26.0 0.02 A 20 LEU N N 15 121.8 0.2 A 21 LYS H H 1 8.55 0.02 A 21 LYS HA H 1 5.45 0.02 A 21 LYS HBx H 1 1.62 0.02 A 21 LYS HBy H 1 1.62 0.02 A 21 LYS HDx H 1 1.45 0.02 A 21 LYS HDy H 1 1.65 0.02 A 21 LYS HEy H 1 2.85 0.02 A 21 LYS HEx H 1 2.83 0.02 A 21 LYS HGx H 1 1.18 0.02 A 21 LYS HGy H 1 1.18 0.02 A 21 LYS C C 13 174.8 0.2 A 21 LYS CA C 13 55.35 0.2 A 21 LYS CB C 13 34.3 0.2 A 21 LYS CD C 13 29.9 0.2 A 21 LYS CE C 13 42 0.2 A 21 LYS CG C 13 26.9 0.2 A 21 LYS N N 15 122.5 0.2 A 22 ALA H H 1 9.09 0.02 A 22 ALA HA H 1 4.83 0.02 A 22 ALA HB% H 1 1.17 0.02 A 22 ALA C C 13 173.8 0.2 A 22 ALA CA C 13 51.3 0.2 A 22 ALA CB C 13 24.7 0.2 A 22 ALA N N 15 123.2 0.2 A 23 LYS H H 1 9.19 0.02 A 23 LYS HA H 1 5.08 0.02 A 23 LYS HBx H 1 1.4 0.02 A 23 LYS HBy H 1 1.65 0.02 A 23 LYS HEx H 1 2.83 0.02 A 23 LYS HEy H 1 2.96 0.02 A 23 LYS HGx H 1 1.40 0.02 A 23 LYS HGy H 1 1.65 0.02 A 23 LYS C C 13 176.9 0.2 A 23 LYS CA C 13 54.1 0.2 A 23 LYS CB C 13 35.8 0.2 A 23 LYS CE C 13 41.9 0.2 A 23 LYS CG C 13 35.7 0.2 A 23 LYS N N 15 121.1 0.2 A 24 VAL H H 1 8.62 0.02 A 24 VAL HA H 1 4.11 0.02 A 24 VAL HB H 1 2.49 0.02 A 24 VAL HGx% H 1 0.72 0.02 A 24 VAL HGy% H 1 0.75 0.02 A 24 VAL C C 13 175.8 0.2 A 24 VAL CA C 13 62.75 0.2 A 24 VAL CB C 13 30.5 0.2 A 24 VAL CGx C 13 21.8 0.02 A 24 VAL CGy C 13 22.8 0.02 A 24 VAL N N 15 125.6 0.2 A 25 ILE H H 1 8.43 0.02 A 25 ILE HA H 1 4.21 0.02 A 25 ILE HB H 1 1.79 0.02 A 25 ILE HD1% H 1 0.72 0.02 A 25 ILE HG1x H 1 1.03 0.02 A 25 ILE HG1y H 1 1.29 0.02 A 25 ILE HG2% H 1 0.85 0.02 A 25 ILE C C 13 176.7 0.2 A 25 ILE CA C 13 62.1 0.2 A 25 ILE CB C 13 38.3 0.2 A 25 ILE CD1 C 13 13 0.2 A 25 ILE CG1 C 13 26.9 0.2 A 25 ILE CG2 C 13 17.9 0.2 A 25 ILE N N 15 127.4 0.2 A 26 GLN H H 1 7.59 0.02 A 26 GLN HA H 1 4.56 0.02 A 26 GLN HBx H 1 1.88 0.02 A 26 GLN HBy H 1 1.88 0.02 A 26 GLN HE2y H 1 7.69 0.02 A 26 GLN HE2x H 1 6.95 0.02 A 26 GLN HGx H 1 2.32 0.02 A 26 GLN HGy H 1 2.47 0.02 A 26 GLN C C 13 173.7 0.2 A 26 GLN CA C 13 55.4 0.2 A 26 GLN CB C 13 34.1 0.2 A 26 GLN CG C 13 34.3 0.2 A 26 GLN N N 15 117.1 0.2 A 26 GLN NE2 N 15 111.7 0.2 A 27 LEU H H 1 8.47 0.02 A 27 LEU HA H 1 4.71 0.02 A 27 LEU HBx H 1 1.48 0.02 A 27 LEU HBy H 1 1.79 0.02 A 27 LEU HDx% H 1 0.96 0.02 A 27 LEU HDy% H 1 0.88 0.02 A 27 LEU HG H 1 1.43 0.02 A 27 LEU C C 13 176.2 0.2 A 27 LEU CA C 13 54.1 0.2 A 27 LEU CB C 13 44 0.2 A 27 LEU CDy C 13 25.7 0.02 A 27 LEU CDx C 13 25 0.02 A 27 LEU CG C 13 26.9 0.2 A 27 LEU N N 15 123.6 0.2 A 28 TRP H H 1 8.85 0.02 A 28 TRP HA H 1 5.18 0.02 A 28 TRP HBx H 1 2.9 0.02 A 28 TRP HBy H 1 3.23 0.02 A 28 TRP HD1 H 1 6.9 0.02 A 28 TRP HE1 H 1 10.11 0.02 A 28 TRP HE3 H 1 7.32 0.02 A 28 TRP HH2 H 1 7.06 0.02 A 28 TRP HZ2 H 1 7.25 0.02 A 28 TRP HZ3 H 1 6.77 0.02 A 28 TRP C C 13 175.9 0.2 A 28 TRP CA C 13 53.3 0.2 A 28 TRP CB C 13 31.4 0.2 A 28 TRP CD1 C 13 124 0.2 A 28 TRP CE3 C 13 120.6 0.2 A 28 TRP CH2 C 13 124.4 0.2 A 28 TRP CZ2 C 13 114.4 0.2 A 28 TRP CZ3 C 13 121.2 0.2 A 28 TRP N N 15 123.9 0.2 A 28 TRP NE1 N 15 127.7 0.2 A 29 GLU H H 1 8.62 0.02 A 29 GLU HA H 1 4.25 0.02 A 29 GLU HBx H 1 1.93 0.02 A 29 GLU HBy H 1 1.93 0.02 A 29 GLU HGx H 1 2.24 0.02 A 29 GLU HGy H 1 2.24 0.02 A 29 GLU C C 13 175.7 0.2 A 29 GLU CA C 13 56.8 0.2 A 29 GLU CB C 13 30 0.2 A 29 GLU CG C 13 36.1 0.2 A 29 GLU N N 15 120.7 0.2 A 30 ASN H H 1 8.72 0.02 A 30 ASN HA H 1 4.87 0.02 A 30 ASN HBx H 1 2.63 0.02 A 30 ASN HBy H 1 2.63 0.02 A 30 ASN HD2y H 1 7.54 0.02 A 30 ASN HD2x H 1 7.15 0.02 A 30 ASN C C 13 174.8 0.2 A 30 ASN CA C 13 53.8 0.2 A 30 ASN CB C 13 41.2 0.2 A 30 ASN N N 15 121.4 0.2 A 30 ASN ND2 N 15 118.4 0.2 A 31 THR H H 1 8.3 0.02 A 31 THR HA H 1 4.43 0.02 A 31 THR HB H 1 4.42 0.02 A 31 THR HG2% H 1 1.09 0.02 A 31 THR C C 13 174.2 0.2 A 31 THR CA C 13 61 0.2 A 31 THR CB C 13 69.6 0.2 A 31 THR CG2 C 13 21.3 0.2 A 31 THR N N 15 114.2 0.2 A 32 HIS H H 1 7.84 0.02 A 32 HIS HA H 1 4.56 0.02 A 32 HIS HBx H 1 3.13 0.02 A 32 HIS HBy H 1 3.13 0.02 A 32 HIS HD2 H 1 7.19 0.02 A 32 HIS C C 13 177.3 0.2 A 32 HIS CA C 13 57.6 0.2 A 32 HIS CB C 13 32 0.2 A 32 HIS CD2 C 13 119.1 0.2 A 32 HIS N N 15 122.5 0.2 A 33 GLU H H 1 9.02 0.02 A 33 GLU HA H 1 4.12 0.02 A 33 GLU HBx H 1 2.04 0.02 A 33 GLU HBy H 1 2.04 0.02 A 33 GLU HGx H 1 2.29 0.02 A 33 GLU HGy H 1 2.29 0.02 A 33 GLU C C 13 177.1 0.2 A 33 GLU CA C 13 59 0.2 A 33 GLU CB C 13 29.4 0.2 A 33 GLU CG C 13 35.7 0.2 A 33 GLU N N 15 127.3 0.2 A 34 SER H H 1 9.43 0.02 A 34 SER HA H 1 4.58 0.02 A 34 SER HBx H 1 4.14 0.02 A 34 SER HBy H 1 4.18 0.02 A 34 SER C C 13 174.8 0.2 A 34 SER CA C 13 59.5 0.2 A 34 SER CB C 13 63.6 0.2 A 34 SER N N 15 113.4 0.2 A 35 ILE H H 1 7.92 0.02 A 35 ILE HA H 1 4.08 0.02 A 35 ILE HB H 1 1.84 0.02 A 35 ILE HD1% H 1 0.38 0.02 A 35 ILE HG1x H 1 0.25 0.02 A 35 ILE HG1y H 1 1.32 0.02 A 35 ILE HG2% H 1 0.52 0.02 A 35 ILE C C 13 174.3 0.2 A 35 ILE CA C 13 61.6 0.2 A 35 ILE CB C 13 40.7 0.2 A 35 ILE CD1 C 13 12.5 0.2 A 35 ILE CG1 C 13 28.5 0.2 A 35 ILE CG2 C 13 18.0 0.2 A 35 ILE N N 15 125.8 0.2 A 36 SER H H 1 9.01 0.02 A 36 SER HA H 1 4.48 0.02 A 36 SER HBx H 1 3.56 0.02 A 36 SER HBy H 1 3.56 0.02 A 36 SER C C 13 174.9 0.2 A 36 SER CA C 13 58.8 0.2 A 36 SER CB C 13 64.3 0.2 A 36 SER N N 15 119.1 0.2 A 37 GLN H H 1 7.39 0.02 A 37 GLN HA H 1 4.69 0.02 A 37 GLN HBx H 1 1.81 0.02 A 37 GLN HBy H 1 1.81 0.02 A 37 GLN HE2y H 1 7.88 0.02 A 37 GLN HE2x H 1 7.67 0.02 A 37 GLN HGx H 1 2.31 0.02 A 37 GLN HGy H 1 2.31 0.02 A 37 GLN C C 13 171.8 0.2 A 37 GLN CA C 13 54.9 0.2 A 37 GLN CB C 13 36.2 0.2 A 37 GLN N N 15 116.5 0.2 A 37 GLN NE2 N 15 113.7 0.2 A 38 VAL H H 1 8.64 0.02 A 38 VAL HA H 1 4.16 0.02 A 38 VAL HB H 1 1.74 0.02 A 38 VAL HGx% H 1 0.86 0.02 A 38 VAL HGy% H 1 0.86 0.02 A 38 VAL C C 13 172.4 0.2 A 38 VAL CA C 13 58.5 0.2 A 38 VAL CB C 13 35.3 0.2 A 38 VAL CGx C 13 21.2 0.02 A 38 VAL CGy C 13 21.2 0.02 A 38 VAL N N 15 120.4 0.2 A 39 GLY H H 1 6.44 0.02 A 39 GLY HAy H 1 3.69 0.02 A 39 GLY HAx H 1 1.94 0.02 A 39 GLY C C 13 170.6 0.2 A 39 GLY CA C 13 45.3 0.2 A 39 GLY N N 15 109.6 0.2 A 40 LEU H H 1 8.38 0.02 A 40 LEU HA H 1 4.98 0.02 A 40 LEU HBx H 1 1.23 0.02 A 40 LEU HBy H 1 1.34 0.02 A 40 LEU HDx% H 1 0.73 0.02 A 40 LEU HDy% H 1 0.90 0.02 A 40 LEU C C 13 176.0 0.2 A 40 LEU CA C 13 53.2 0.2 A 40 LEU CB C 13 47.4 0.2 A 40 LEU CDx C 13 23.4 0.02 A 40 LEU CDy C 13 25.3 0.02 A 40 LEU N N 15 119.5 0.2 A 41 LEU H H 1 9.41 0.02 A 41 LEU HA H 1 5.32 0.02 A 41 LEU HBx H 1 1.17 0.02 A 41 LEU HBy H 1 1.69 0.02 A 41 LEU HDx% H 1 0.29 0.02 A 41 LEU HDy% H 1 0.06 0.02 A 41 LEU HG H 1 1.60 0.02 A 41 LEU C C 13 176.7 0.2 A 41 LEU CA C 13 52.4 0.2 A 41 LEU CB C 13 44.9 0.2 A 41 LEU CDy C 13 25.9 0.02 A 41 LEU CDx C 13 22.4 0.02 A 41 LEU CG C 13 25.9 0.2 A 41 LEU N N 15 122.7 0.2 A 42 GLY H H 1 9.21 0.02 A 42 GLY HAx H 1 3.55 0.02 A 42 GLY HAy H 1 5.35 0.02 A 42 GLY C C 13 171.2 0.2 A 42 GLY CA C 13 45.7 0.2 A 42 GLY N N 15 104.6 0.2 A 43 ASP H H 1 8.96 0.02 A 43 ASP HA H 1 4.64 0.02 A 43 ASP HBx H 1 3.04 0.02 A 43 ASP HBy H 1 3.24 0.02 A 43 ASP C C 13 175.6 0.2 A 43 ASP CA C 13 52.7 0.2 A 43 ASP CB C 13 41.6 0.2 A 43 ASP N N 15 121.9 0.2 A 44 GLU H H 1 10.15 0.02 A 44 GLU HA H 1 4.38 0.02 A 44 GLU HBx H 1 2.04 0.02 A 44 GLU HBy H 1 2.17 0.02 A 44 GLU HGx H 1 2.3 0.02 A 44 GLU HGy H 1 2.57 0.02 A 44 GLU C C 13 176.9 0.2 A 44 GLU CA C 13 59.3 0.2 A 44 GLU CB C 13 28.1 0.2 A 44 GLU CG C 13 35.7 0.2 A 44 GLU N N 15 118 0.2 A 45 THR H H 1 9.6 0.02 A 45 THR HA H 1 4.58 0.02 A 45 THR HB H 1 4.2 0.02 A 45 THR HG2% H 1 1.11 0.02 A 45 THR C C 13 174.8 0.2 A 45 THR CA C 13 61.7 0.2 A 45 THR CB C 13 70 0.2 A 45 THR CG2 C 13 23 0.2 A 45 THR N N 15 112 0.2 A 46 GLY H H 1 7.64 0.02 A 46 GLY HAx H 1 3.83 0.02 A 46 GLY HAy H 1 4 0.02 A 46 GLY C C 13 169.4 0.2 A 46 GLY CA C 13 46 0.2 A 46 GLY N N 15 110.6 0.2 A 47 ILE H H 1 8 0.02 A 47 ILE HA H 1 5.45 0.02 A 47 ILE HB H 1 1.71 0.02 A 47 ILE HD1% H 1 0.79 0.02 A 47 ILE HG1x H 1 1.18 0.02 A 47 ILE HG1y H 1 1.46 0.02 A 47 ILE HG2% H 1 0.85 0.02 A 47 ILE C C 13 175.2 0.2 A 47 ILE CA C 13 59.1 0.2 A 47 ILE CB C 13 42.4 0.2 A 47 ILE CD1 C 13 13.9 0.2 A 47 ILE CG1 C 13 26.7 0.2 A 47 ILE CG2 C 13 18.7 0.2 A 47 ILE N N 15 113.9 0.2 A 48 ILE H H 1 9.34 0.02 A 48 ILE HA H 1 4.64 0.02 A 48 ILE HB H 1 1.66 0.02 A 48 ILE HD1% H 1 0.8 0.02 A 48 ILE HG1x H 1 1.7 0.02 A 48 ILE HG1y H 1 1.88 0.02 A 48 ILE HG2% H 1 0.67 0.02 A 48 ILE C C 13 171.5 0.2 A 48 ILE CA C 13 60.6 0.2 A 48 ILE CB C 13 42 0.2 A 48 ILE CD1 C 13 15.6 0.2 A 48 ILE CG1 C 13 29.4 0.2 A 48 ILE CG2 C 13 15.6 0.2 A 48 ILE N N 15 123.6 0.2 A 49 LYS H H 1 8.35 0.02 A 49 LYS HA H 1 4.82 0.02 A 49 LYS HBx H 1 1.51 0.02 A 49 LYS HBy H 1 1.72 0.02 A 49 LYS HDx H 1 0.90 0.02 A 49 LYS HDy H 1 1.29 0.02 A 49 LYS HEx H 1 2.41 0.02 A 49 LYS HEy H 1 2.62 0.02 A 49 LYS HGx H 1 0.96 0.02 A 49 LYS HGy H 1 1.17 0.02 A 49 LYS C C 13 174.7 0.2 A 49 LYS CA C 13 56.4 0.2 A 49 LYS CB C 13 33.8 0.2 A 49 LYS CD C 13 29.9 0.2 A 49 LYS CE C 13 42.6 0.2 A 49 LYS CG C 13 25.5 0.2 A 49 LYS N N 15 129.1 0.2 A 50 PHE H H 1 8.57 0.02 A 50 PHE HA H 1 5.82 0.02 A 50 PHE HBx H 1 2.42 0.02 A 50 PHE HBy H 1 2.56 0.02 A 50 PHE HDx H 1 6.59 0.02 A 50 PHE HDy H 1 6.59 0.02 A 50 PHE HEx H 1 6.73 0.02 A 50 PHE HEy H 1 6.73 0.02 A 50 PHE HZ H 1 6.6 0.02 A 50 PHE C C 13 172.1 0.2 A 50 PHE CA C 13 54.8 0.2 A 50 PHE CB C 13 43.9 0.2 A 50 PHE CDx C 13 131.7 0.02 A 50 PHE CDy C 13 131.7 0.02 A 50 PHE CEx C 13 129.8 0.02 A 50 PHE CEy C 13 129.8 0.02 A 50 PHE CZ C 13 128.6 0.2 A 50 PHE N N 15 122.7 0.2 A 51 THR H H 1 8.19 0.02 A 51 THR HA H 1 4.32 0.02 A 51 THR HB H 1 3.39 0.02 A 51 THR HG2% H 1 0.17 0.02 A 51 THR C C 13 172.9 0.2 A 51 THR CA C 13 61.7 0.2 A 51 THR CB C 13 72.5 0.2 A 51 THR CG2 C 13 21.3 0.2 A 51 THR N N 15 114.4 0.2 A 52 ILE H H 1 8.88 0.02 A 52 ILE HA H 1 4.65 0.02 A 52 ILE HB H 1 1.76 0.02 A 52 ILE HD1% H 1 0.77 0.02 A 52 ILE HG1x H 1 1.65 0.02 A 52 ILE HG1y H 1 1.74 0.02 A 52 ILE HG2% H 1 0.89 0.02 A 52 ILE C C 13 176.0 0.2 A 52 ILE CA C 13 60.5 0.2 A 52 ILE CB C 13 38.9 0.2 A 52 ILE CD1 C 13 13.2 0.2 A 52 ILE CG1 C 13 26.7 0.2 A 52 ILE CG2 C 13 16.8 0.2 A 52 ILE N N 15 123.4 0.2 A 53 TRP H H 1 8.02 0.02 A 53 TRP HA H 1 4.74 0.02 A 53 TRP HBx H 1 3.14 0.02 A 53 TRP HBy H 1 3.69 0.02 A 53 TRP HD1 H 1 7.19 0.02 A 53 TRP HE1 H 1 10.1 0.02 A 53 TRP HE3 H 1 7.69 0.02 A 53 TRP HH2 H 1 7.05 0.02 A 53 TRP HZ2 H 1 7.29 0.02 A 53 TRP HZ3 H 1 6.88 0.02 A 53 TRP C C 13 177.5 0.2 A 53 TRP CA C 13 57.7 0.2 A 53 TRP CB C 13 30.4 0.2 A 53 TRP CD1 C 13 127.4 0.2 A 53 TRP CE3 C 13 121.1 0.2 A 53 TRP CH2 C 13 124.6 0.2 A 53 TRP CZ2 C 13 114.4 0.2 A 53 TRP CZ3 C 13 122.4 0.2 A 53 TRP N N 15 129.5 0.2 A 53 TRP NE1 N 15 128.5 0.2 A 54 LYS H H 1 8.98 0.02 A 54 LYS HA H 1 4.10 0.02 A 54 LYS HBx H 1 1.58 0.02 A 54 LYS HBy H 1 1.82 0.02 A 54 LYS HDx H 1 1.66 0.02 A 54 LYS HDy H 1 1.71 0.02 A 54 LYS HEx H 1 2.93 0.02 A 54 LYS HEy H 1 2.97 0.02 A 54 LYS HGx H 1 1.34 0.02 A 54 LYS HGy H 1 1.41 0.02 A 54 LYS C C 13 177.7 0.2 A 54 LYS CA C 13 59.4 0.2 A 54 LYS CB C 13 32.4 0.2 A 54 LYS CD C 13 29.1 0.2 A 54 LYS CE C 13 41.8 0.2 A 54 LYS CG C 13 25.4 0.2 A 54 LYS N N 15 125.5 0.2 A 55 ASN H H 1 8.6 0.02 A 55 ASN HA H 1 4.51 0.02 A 55 ASN HBx H 1 2.8 0.02 A 55 ASN HBy H 1 3.11 0.02 A 55 ASN HD2y H 1 7.46 0.02 A 55 ASN HD2x H 1 6.62 0.02 A 55 ASN C C 13 175.3 0.2 A 55 ASN CA C 13 53.7 0.2 A 55 ASN CB C 13 37.1 0.2 A 55 ASN N N 15 115.4 0.2 A 55 ASN ND2 N 15 109.4 0.2 A 56 ALA H H 1 7.63 0.02 A 56 ALA HA H 1 3.97 0.02 A 56 ALA HB% H 1 1.33 0.02 A 56 ALA C C 13 176.1 0.2 A 56 ALA CA C 13 53.5 0.2 A 56 ALA CB C 13 18.4 0.2 A 56 ALA N N 15 121.2 0.2 A 57 GLU H H 1 7.88 0.02 A 57 GLU HA H 1 3.94 0.02 A 57 GLU HBx H 1 2.08 0.02 A 57 GLU HBy H 1 2.08 0.02 A 57 GLU HGx H 1 2.16 0.02 A 57 GLU HGy H 1 2.16 0.02 A 57 GLU C C 13 175.4 0.2 A 57 GLU CA C 13 56.7 0.2 A 57 GLU CB C 13 27.3 0.2 A 57 GLU CG C 13 36.3 0.2 A 57 GLU N N 15 112.5 0.2 A 58 LEU H H 1 7.91 0.02 A 58 LEU HA H 1 4.74 0.02 A 58 LEU HBx H 1 1.33 0.02 A 58 LEU HBy H 1 1.33 0.02 A 58 LEU HDx% H 1 0.65 0.02 A 58 LEU HDy% H 1 0.9 0.02 A 58 LEU HG H 1 1.5 0.02 A 58 LEU C C 13 175.4 0.2 A 58 LEU CA C 13 52.3 0.2 A 58 LEU CB C 13 42.9 0.2 A 58 LEU CDy C 13 26.9 0.02 A 58 LEU CDx C 13 23.3 0.02 A 58 LEU CG C 13 26.3 0.2 A 58 LEU N N 15 120 0.2 A 59 PRO HA H 1 4.38 0.02 A 59 PRO HBx H 1 1.73 0.02 A 59 PRO HBy H 1 2.25 0.02 A 59 PRO HDx H 1 3.43 0.02 A 59 PRO HDy H 1 3.78 0.02 A 59 PRO HGx H 1 1.88 0.02 A 59 PRO HGy H 1 1.96 0.02 A 59 PRO CA C 13 62.2 0.2 A 59 PRO CB C 13 32 0.2 A 59 PRO CD C 13 50.6 0.2 A 59 PRO CG C 13 27.3 0.2 A 60 LEU H H 1 7.86 0.02 A 60 LEU HA H 1 3.92 0.02 A 60 LEU HBx H 1 1.29 0.02 A 60 LEU HBy H 1 1.54 0.02 A 60 LEU HDx% H 1 0.88 0.02 A 60 LEU HDy% H 1 0.75 0.02 A 60 LEU HG H 1 1.67 0.02 A 60 LEU C C 13 178.3 0.2 A 60 LEU CA C 13 55 0.2 A 60 LEU CB C 13 41.8 0.2 A 60 LEU CDy C 13 25.5 0.02 A 60 LEU CDx C 13 22.7 0.02 A 60 LEU CG C 13 27.1 0.2 A 60 LEU N N 15 117.5 0.2 A 61 LEU H H 1 9.68 0.02 A 61 LEU HA H 1 4.04 0.02 A 61 LEU HBx H 1 0.96 0.02 A 61 LEU HBy H 1 1.3 0.02 A 61 LEU HDx% H 1 -0.38 0.02 A 61 LEU HDy% H 1 -0.13 0.02 A 61 LEU HG H 1 1.27 0.02 A 61 LEU C C 13 177.3 0.2 A 61 LEU CA C 13 54.1 0.2 A 61 LEU CB C 13 41.3 0.2 A 61 LEU CDx C 13 20.8 0.02 A 61 LEU CDy C 13 25.0 0.02 A 61 LEU CG C 13 26.1 0.2 A 61 LEU N N 15 122.3 0.2 A 62 GLU H H 1 8.39 0.02 A 62 GLU HA H 1 4.43 0.02 A 62 GLU HBx H 1 1.81 0.02 A 62 GLU HBy H 1 1.99 0.02 A 62 GLU HGx H 1 2.16 0.02 A 62 GLU HGy H 1 2.16 0.02 A 62 GLU C C 13 175.6 0.2 A 62 GLU CA C 13 54.8 0.2 A 62 GLU CB C 13 32.2 0.2 A 62 GLU CG C 13 36.3 0.2 A 62 GLU N N 15 120.5 0.2 A 63 GLN H H 1 8.78 0.02 A 63 GLN HA H 1 3.7 0.02 A 63 GLN HBx H 1 2 0.02 A 63 GLN HBy H 1 2 0.02 A 63 GLN HE2y H 1 7.42 0.02 A 63 GLN HE2x H 1 6.88 0.02 A 63 GLN HGx H 1 2.06 0.02 A 63 GLN HGy H 1 2.33 0.02 A 63 GLN C C 13 176.6 0.2 A 63 GLN CA C 13 58.1 0.2 A 63 GLN CB C 13 28.3 0.2 A 63 GLN CG C 13 34 0.2 A 63 GLN N N 15 123.3 0.2 A 63 GLN NE2 N 15 111.4 0.2 A 64 GLY H H 1 9.14 0.02 A 64 GLY HAx H 1 3.58 0.02 A 64 GLY HAy H 1 4.39 0.02 A 64 GLY C C 13 173.9 0.2 A 64 GLY CA C 13 45.3 0.2 A 64 GLY N N 15 115.1 0.2 A 65 GLU H H 1 7.59 0.02 A 65 GLU HA H 1 4.49 0.02 A 65 GLU HBx H 1 1.76 0.02 A 65 GLU HBy H 1 2.22 0.02 A 65 GLU HGx H 1 1.99 0.02 A 65 GLU HGy H 1 2.13 0.02 A 65 GLU C C 13 174.2 0.2 A 65 GLU CA C 13 54.9 0.2 A 65 GLU CB C 13 30.5 0.2 A 65 GLU CG C 13 36.4 0.2 A 65 GLU N N 15 120.3 0.2 A 66 SER H H 1 8.7 0.02 A 66 SER HA H 1 5.33 0.02 A 66 SER HBx H 1 3.48 0.02 A 66 SER HBy H 1 3.57 0.02 A 66 SER C C 13 174.1 0.2 A 66 SER CA C 13 58.3 0.2 A 66 SER CB C 13 65.5 0.2 A 66 SER N N 15 116.5 0.2 A 67 TYR H H 1 9.09 0.02 A 67 TYR HA H 1 5.11 0.02 A 67 TYR HBx H 1 2.18 0.02 A 67 TYR HBy H 1 2.72 0.02 A 67 TYR HDx H 1 6.69 0.02 A 67 TYR HDy H 1 6.69 0.02 A 67 TYR HEx H 1 6.7 0.02 A 67 TYR HEy H 1 6.7 0.02 A 67 TYR C C 13 173.9 0.2 A 67 TYR CA C 13 57.5 0.2 A 67 TYR CB C 13 43.9 0.2 A 67 TYR CDx C 13 133.4 0.02 A 67 TYR CDy C 13 133.4 0.02 A 67 TYR CEx C 13 118.1 0.02 A 67 TYR CEy C 13 118.1 0.02 A 67 TYR N N 15 119 0.2 A 68 LEU H H 1 9.23 0.02 A 68 LEU HA H 1 5 0.02 A 68 LEU HBx H 1 1.35 0.02 A 68 LEU HBy H 1 1.85 0.02 A 68 LEU HDx% H 1 0.68 0.02 A 68 LEU HDy% H 1 0.77 0.02 A 68 LEU HG H 1 1.33 0.02 A 68 LEU C C 13 175.3 0.2 A 68 LEU CA C 13 54.3 0.2 A 68 LEU CB C 13 43.8 0.2 A 68 LEU CDx C 13 23.8 0.02 A 68 LEU CDy C 13 26 0.02 A 68 LEU CG C 13 28.3 0.2 A 68 LEU N N 15 121.8 0.2 A 69 LEU H H 1 9.46 0.02 A 69 LEU HA H 1 5.01 0.02 A 69 LEU HBx H 1 1.16 0.02 A 69 LEU HBy H 1 1.66 0.02 A 69 LEU HDx% H 1 0.58 0.02 A 69 LEU HDy% H 1 0.44 0.02 A 69 LEU HG H 1 1.4 0.02 A 69 LEU C C 13 175.0 0.2 A 69 LEU CA C 13 54.1 0.2 A 69 LEU CB C 13 42.3 0.2 A 69 LEU CDy C 13 26.8 0.02 A 69 LEU CDx C 13 26.5 0.02 A 69 LEU CG C 13 27.9 0.2 A 69 LEU N N 15 128.5 0.2 A 70 ARG H H 1 8.91 0.02 A 70 ARG HA H 1 4.85 0.02 A 70 ARG HBx H 1 1.8 0.02 A 70 ARG HBy H 1 1.8 0.02 A 70 ARG HDx H 1 3.00 0.02 A 70 ARG HDy H 1 3.1 0.02 A 70 ARG HE H 1 7.32 0.02 A 70 ARG HGx H 1 1.23 0.02 A 70 ARG HGy H 1 1.54 0.02 A 70 ARG C C 13 176.4 0.2 A 70 ARG CA C 13 54.9 0.2 A 70 ARG CB C 13 32.3 0.2 A 70 ARG CD C 13 43.4 0.2 A 70 ARG CG C 13 29 0.2 A 70 ARG N N 15 121.5 0.2 A 70 ARG NE N 15 84.7 0.2 A 71 SER H H 1 8.8 0.02 A 71 SER HA H 1 3.87 0.02 A 71 SER HBx H 1 4.06 0.02 A 71 SER HBy H 1 4.1 0.02 A 71 SER C C 13 175.8 0.2 A 71 SER CA C 13 58.6 0.2 A 71 SER CB C 13 62 0.2 A 71 SER N N 15 114.4 0.2 A 72 VAL H H 1 8.75 0.02 A 72 VAL HA H 1 4.61 0.02 A 72 VAL HB H 1 2 0.02 A 72 VAL HGx% H 1 0.72 0.02 A 72 VAL HGy% H 1 0.55 0.02 A 72 VAL C C 13 173.3 0.2 A 72 VAL CA C 13 59.3 0.2 A 72 VAL CB C 13 31.9 0.2 A 72 VAL CGy C 13 23.8 0.02 A 72 VAL CGx C 13 18.2 0.02 A 72 VAL N N 15 115.5 0.2 A 73 VAL H H 1 7.94 0.02 A 73 VAL HA H 1 4.76 0.02 A 73 VAL HB H 1 0.42 0.02 A 73 VAL HGx% H 1 0.52 0.02 A 73 VAL HGy% H 1 0.09 0.02 A 73 VAL C C 13 174.3 0.2 A 73 VAL CA C 13 58.8 0.2 A 73 VAL CB C 13 34.5 0.2 A 73 VAL CGx C 13 20.1 0.02 A 73 VAL CGy C 13 20.9 0.02 A 73 VAL N N 15 118.2 0.2 A 74 VAL H H 1 8.43 0.02 A 74 VAL HA H 1 4.56 0.02 A 74 VAL HB H 1 2.11 0.02 A 74 VAL HGx% H 1 0.68 0.02 A 74 VAL HGy% H 1 0.77 0.02 A 74 VAL C C 13 177.3 0.2 A 74 VAL CA C 13 62.1 0.2 A 74 VAL CB C 13 32.7 0.2 A 74 VAL CGy C 13 22.8 0.02 A 74 VAL CGx C 13 21.5 0.02 A 74 VAL N N 15 127.8 0.2 A 75 GLY H H 1 9.04 0.02 A 75 GLY HAx H 1 3.75 0.02 A 75 GLY HAy H 1 5.12 0.02 A 75 GLY C C 13 172.5 0.2 A 75 GLY CA C 13 43.7 0.2 A 75 GLY N N 15 116 0.2 A 76 GLU H H 1 8.38 0.02 A 76 GLU HA H 1 4.69 0.02 A 76 GLU HBx H 1 1.83 0.02 A 76 GLU HBy H 1 1.93 0.02 A 76 GLU HGx H 1 2.05 0.02 A 76 GLU HGy H 1 2.05 0.02 A 76 GLU C C 13 176.0 0.2 A 76 GLU CA C 13 56.1 0.2 A 76 GLU CB C 13 32 0.2 A 76 GLU CG C 13 36 0.2 A 76 GLU N N 15 120.2 0.2 A 77 TYR H H 1 8.43 0.02 A 77 TYR HA H 1 4.57 0.02 A 77 TYR HBx H 1 2.59 0.02 A 77 TYR HBy H 1 2.7 0.02 A 77 TYR HDx H 1 7 0.02 A 77 TYR HDy H 1 7 0.02 A 77 TYR HEx H 1 6.8 0.02 A 77 TYR HEy H 1 6.8 0.02 A 77 TYR C C 13 174.2 0.2 A 77 TYR CA C 13 56.5 0.2 A 77 TYR CB C 13 39.8 0.2 A 77 TYR CDx C 13 132.9 0.02 A 77 TYR CDy C 13 132.9 0.02 A 77 TYR CEx C 13 118.3 0.02 A 77 TYR CEy C 13 118.3 0.02 A 77 TYR N N 15 124.4 0.2 A 78 ASN H H 1 9.1 0.02 A 78 ASN HA H 1 4 0.02 A 78 ASN HBx H 1 2.39 0.02 A 78 ASN HBy H 1 2.75 0.02 A 78 ASN HD2y H 1 7.1 0.02 A 78 ASN HD2x H 1 6.67 0.02 A 78 ASN C C 13 177.3 0.2 A 78 ASN CA C 13 54.7 0.2 A 78 ASN CB C 13 36.6 0.2 A 78 ASN N N 15 125.8 0.2 A 78 ASN ND2 N 15 112 0.2 A 79 ASP H H 1 8.64 0.02 A 79 ASP HA H 1 4.24 0.02 A 79 ASP HBx H 1 2.69 0.02 A 79 ASP HBy H 1 2.79 0.02 A 79 ASP C C 13 174.6 0.2 A 79 ASP CA C 13 54.9 0.2 A 79 ASP CB C 13 39.7 0.2 A 79 ASP N N 15 115.7 0.2 A 80 ARG H H 1 7.88 0.02 A 80 ARG HA H 1 4.37 0.02 A 80 ARG HBx H 1 1.81 0.02 A 80 ARG HBy H 1 1.93 0.02 A 80 ARG HDx H 1 3.2 0.02 A 80 ARG HDy H 1 3.2 0.02 A 80 ARG HE H 1 7.28 0.02 A 80 ARG HGx H 1 1.66 0.02 A 80 ARG HGy H 1 1.66 0.02 A 80 ARG C C 13 175.0 0.2 A 80 ARG CA C 13 54.2 0.2 A 80 ARG CB C 13 31.8 0.2 A 80 ARG CD C 13 43.4 0.2 A 80 ARG CG C 13 26.3 0.2 A 80 ARG N N 15 119.7 0.2 A 80 ARG NE N 15 85.4 0.2 A 81 PHE H H 1 8.41 0.02 A 81 PHE HA H 1 5.42 0.02 A 81 PHE HBx H 1 2.77 0.02 A 81 PHE HBy H 1 3.06 0.02 A 81 PHE HDx H 1 7.06 0.02 A 81 PHE HDy H 1 7.06 0.02 A 81 PHE HEx H 1 7.09 0.02 A 81 PHE HEy H 1 7.09 0.02 A 81 PHE HZ H 1 7.05 0.02 A 81 PHE C C 13 174.4 0.2 A 81 PHE CA C 13 57.2 0.2 A 81 PHE CB C 13 42 0.2 A 81 PHE CDx C 13 131.1 0.02 A 81 PHE CDy C 13 131.1 0.02 A 81 PHE CEx C 13 130.8 0.02 A 81 PHE CEy C 13 130.8 0.02 A 81 PHE CZ C 13 129.8 0.2 A 81 PHE N N 15 120.7 0.2 A 82 GLN H H 1 8.95 0.02 A 82 GLN HA H 1 5.11 0.02 A 82 GLN HBx H 1 1.76 0.02 A 82 GLN HBy H 1 1.76 0.02 A 82 GLN HE2y H 1 7.55 0.02 A 82 GLN HE2x H 1 6.82 0.02 A 82 GLN HGx H 1 2.08 0.02 A 82 GLN HGy H 1 2.08 0.02 A 82 GLN C C 13 172.4 0.2 A 82 GLN CA C 13 53.5 0.2 A 82 GLN CB C 13 31.9 0.2 A 82 GLN CG C 13 31.1 0.2 A 82 GLN N N 15 115 0.2 A 82 GLN NE2 N 15 111.5 0.2 A 83 VAL H H 1 9.09 0.02 A 83 VAL HA H 1 4.38 0.02 A 83 VAL HB H 1 1.83 0.02 A 83 VAL HGx% H 1 0.66 0.02 A 83 VAL HGy% H 1 0.72 0.02 A 83 VAL C C 13 174.6 0.2 A 83 VAL CA C 13 61.6 0.2 A 83 VAL CB C 13 33.5 0.2 A 83 VAL CGx C 13 21.6 0.02 A 83 VAL CGy C 13 21.6 0.02 A 83 VAL N N 15 118.9 0.2 A 84 GLN H H 1 9.28 0.02 A 84 GLN HA H 1 5.02 0.02 A 84 GLN HBx H 1 1.84 0.02 A 84 GLN HBy H 1 2.2 0.02 A 84 GLN HE2y H 1 7.06 0.02 A 84 GLN HE2x H 1 6.86 0.02 A 84 GLN HGx H 1 2 0.02 A 84 GLN HGy H 1 2.29 0.02 A 84 GLN C C 13 174.5 0.2 A 84 GLN CA C 13 54.4 0.2 A 84 GLN CB C 13 29.9 0.2 A 84 GLN CG C 13 33.7 0.2 A 84 GLN N N 15 124.8 0.2 A 84 GLN NE2 N 15 109.6 0.2 A 85 VAL H H 1 8.68 0.02 A 85 VAL HA H 1 4.3 0.02 A 85 VAL HB H 1 2.26 0.02 A 85 VAL HGx% H 1 0.83 0.02 A 85 VAL HGy% H 1 0.65 0.02 A 85 VAL C C 13 174.5 0.2 A 85 VAL CA C 13 61.7 0.2 A 85 VAL CB C 13 31.7 0.2 A 85 VAL CGy C 13 22.6 0.02 A 85 VAL CGx C 13 19.8 0.02 A 85 VAL N N 15 125.5 0.2 A 86 ASN H H 1 8.74 0.02 A 86 ASN HA H 1 5.24 0.02 A 86 ASN HBx H 1 2.64 0.02 A 86 ASN HBy H 1 3.33 0.02 A 86 ASN HD2y H 1 7.38 0.02 A 86 ASN HD2x H 1 6.36 0.02 A 86 ASN C C 13 175.3 0.2 A 86 ASN CA C 13 51.8 0.2 A 86 ASN CB C 13 42.4 0.2 A 86 ASN N N 15 124 0.2 A 86 ASN ND2 N 15 112.9 0.2 A 87 LYS H H 1 8.53 0.02 A 87 LYS HA H 1 4.21 0.02 A 87 LYS HBx H 1 1.84 0.02 A 87 LYS HBy H 1 1.84 0.02 A 87 LYS HDx H 1 1.65 0.02 A 87 LYS HDy H 1 1.65 0.02 A 87 LYS HEx H 1 2.93 0.02 A 87 LYS HEy H 1 2.93 0.02 A 87 LYS HGx H 1 1.45 0.02 A 87 LYS HGy H 1 1.45 0.02 A 87 LYS C C 13 176.7 0.2 A 87 LYS CA C 13 59.0 0.2 A 87 LYS CB C 13 32.4 0.2 A 87 LYS CD C 13 29.1 0.2 A 87 LYS CE C 13 42.1 0.2 A 87 LYS CG C 13 24.7 0.2 A 87 LYS N N 15 117.6 0.2 A 88 ASN H H 1 8.60 0.02 A 88 ASN HA H 1 4.81 0.02 A 88 ASN HBx H 1 2.94 0.02 A 88 ASN HBy H 1 3.01 0.02 A 88 ASN HD2y H 1 7.35 0.02 A 88 ASN HD2x H 1 6.97 0.02 A 88 ASN C C 13 175.6 0.2 A 88 ASN CA C 13 54.1 0.2 A 88 ASN CB C 13 39.1 0.2 A 88 ASN N N 15 115.5 0.2 A 88 ASN ND2 N 15 113.1 0.2 A 89 SER H H 1 8.15 0.02 A 89 SER HA H 1 5.12 0.02 A 89 SER HBx H 1 3.91 0.02 A 89 SER HBy H 1 3.97 0.02 A 89 SER C C 13 172.4 0.2 A 89 SER CA C 13 58.1 0.2 A 89 SER CB C 13 64 0.2 A 89 SER N N 15 117.5 0.2 A 90 SER H H 1 8.2 0.02 A 90 SER HA H 1 4.68 0.02 A 90 SER HBx H 1 3.82 0.02 A 90 SER HBy H 1 3.82 0.02 A 90 SER C C 13 172.4 0.2 A 90 SER CA C 13 57.7 0.2 A 90 SER CB C 13 65.7 0.2 A 90 SER N N 15 113.2 0.2 A 91 ILE H H 1 8.64 0.02 A 91 ILE HA H 1 5.03 0.02 A 91 ILE HB H 1 1.54 0.02 A 91 ILE HD1% H 1 0.63 0.02 A 91 ILE HG1x H 1 0.85 0.02 A 91 ILE HG1y H 1 1.36 0.02 A 91 ILE HG2% H 1 0.6 0.02 A 91 ILE C C 13 175.3 0.2 A 91 ILE CA C 13 60.2 0.2 A 91 ILE CB C 13 42.2 0.2 A 91 ILE CD1 C 13 14.4 0.2 A 91 ILE CG1 C 13 26.8 0.2 A 91 ILE CG2 C 13 18.7 0.2 A 91 ILE N N 15 119.7 0.2 A 92 GLU H H 1 8.81 0.02 A 92 GLU HA H 1 4.71 0.02 A 92 GLU HBx H 1 1.97 0.02 A 92 GLU HBy H 1 2.02 0.02 A 92 GLU HGx H 1 2.18 0.02 A 92 GLU HGy H 1 2.18 0.02 A 92 GLU C C 13 174.7 0.2 A 92 GLU CA C 13 54.6 0.2 A 92 GLU CB C 13 33.3 0.2 A 92 GLU CG C 13 35.7 0.2 A 92 GLU N N 15 125.9 0.2 A 93 LYS H H 1 9.08 0.02 A 93 LYS HA H 1 4.1 0.02 A 93 LYS HBx H 1 1.69 0.02 A 93 LYS HBy H 1 1.69 0.02 A 93 LYS HDx H 1 1.61 0.02 A 93 LYS HDy H 1 1.61 0.02 A 93 LYS HEx H 1 2.89 0.02 A 93 LYS HEy H 1 2.89 0.02 A 93 LYS HGx H 1 1.07 0.02 A 93 LYS HGy H 1 1.32 0.02 A 93 LYS C C 13 176.4 0.2 A 93 LYS CA C 13 57.5 0.2 A 93 LYS CB C 13 32.9 0.2 A 93 LYS CD C 13 29.2 0.2 A 93 LYS CE C 13 41.9 0.2 A 93 LYS CG C 13 25.0 0.2 A 93 LYS N N 15 127.6 0.2 A 94 LEU H H 1 8.41 0.02 A 94 LEU HA H 1 4.48 0.02 A 94 LEU HBx H 1 1.3 0.02 A 94 LEU HBy H 1 1.49 0.02 A 94 LEU HDx% H 1 0.72 0.02 A 94 LEU HDy% H 1 0.81 0.02 A 94 LEU C C 13 177.3 0.2 A 94 LEU CA C 13 53.9 0.2 A 94 LEU CB C 13 42.9 0.2 A 94 LEU CDx C 13 22.4 0.02 A 94 LEU CDy C 13 22.4 0.02 A 94 LEU CG C 13 26.3 0.2 A 94 LEU N N 15 127.3 0.2 A 95 SER H H 1 8.63 0.02 A 95 SER HA H 1 4.35 0.02 A 95 SER HBx H 1 3.81 0.02 A 95 SER HBy H 1 3.88 0.02 A 95 SER C C 13 173.8 0.2 A 95 SER CA C 13 58.9 0.2 A 95 SER CB C 13 63.4 0.2 A 95 SER N N 15 115.7 0.2 A 96 GLU H H 1 7.23 0.02 A 96 GLU HA H 1 4.75 0.02 A 96 GLU HBx H 1 1.81 0.02 A 96 GLU HBy H 1 1.91 0.02 A 96 GLU HGx H 1 2.13 0.02 A 96 GLU HGy H 1 2.13 0.02 A 96 GLU CA C 13 53 0.2 A 96 GLU CB C 13 30.7 0.2 A 96 GLU CG C 13 35.8 0.2 A 96 GLU N N 15 121.6 0.2 A 97 PRO HA H 1 4.25 0.02 A 97 PRO HBx H 1 1.72 0.02 A 97 PRO HBy H 1 2.18 0.02 A 97 PRO HDx H 1 3.61 0.02 A 97 PRO HDy H 1 3.76 0.02 A 97 PRO HGx H 1 1.95 0.02 A 97 PRO HGy H 1 1.95 0.02 A 97 PRO CA C 13 62.4 0.2 A 97 PRO CB C 13 32.6 0.2 A 97 PRO CD C 13 50.6 0.2 A 97 PRO CG C 13 27.1 0.2 A 98 ILE H H 1 7.92 0.02 A 98 ILE HA H 1 4.07 0.02 A 98 ILE HB H 1 1.74 0.02 A 98 ILE HD1% H 1 0.73 0.02 A 98 ILE HG1x H 1 1.19 0.02 A 98 ILE HG1y H 1 1.23 0.02 A 98 ILE HG2% H 1 0.9 0.02 A 98 ILE C C 13 175.4 0.2 A 98 ILE CA C 13 59.3 0.2 A 98 ILE CB C 13 38.3 0.2 A 98 ILE CD1 C 13 12 0.2 A 98 ILE CG1 C 13 27.2 0.2 A 98 ILE CG2 C 13 17 0.2 A 98 ILE N N 15 122.7 0.2 A 99 GLU H H 1 8.55 0.02 A 99 GLU HA H 1 4.26 0.02 A 99 GLU HBx H 1 1.88 0.02 A 99 GLU HBy H 1 1.88 0.02 A 99 GLU HGx H 1 2.15 0.02 A 99 GLU HGy H 1 2.15 0.02 A 99 GLU C C 13 175.1 0.2 A 99 GLU CA C 13 55.5 0.2 A 99 GLU CB C 13 30 0.2 A 99 GLU CG C 13 35.7 0.2 A 99 GLU N N 15 127.9 0.2 A 100 VAL H H 1 7.97 0.02 A 100 VAL HA H 1 3.98 0.02 A 100 VAL HB H 1 1.92 0.02 A 100 VAL HGx% H 1 0.69 0.02 A 100 VAL HGy% H 1 0.82 0.02 A 100 VAL C C 13 176.7 0.2 A 100 VAL CA C 13 61 0.2 A 100 VAL CB C 13 33 0.2 A 100 VAL CGx C 13 21.3 0.02 A 100 VAL CGy C 13 21.3 0.02 A 100 VAL N N 15 121.1 0.2 A 101 GLY H H 1 8.52 0.02 A 101 GLY HAx H 1 3.83 0.02 A 101 GLY HAy H 1 3.98 0.02 A 101 GLY C C 13 174.2 0.2 A 101 GLY CA C 13 45.8 0.2 A 101 GLY N N 15 114 0.2 A 102 LEU H H 1 8.10 0.02 A 102 LEU HA H 1 4.17 0.02 A 102 LEU HBx H 1 1.52 0.02 A 102 LEU HBy H 1 1.52 0.02 A 102 LEU HDx% H 1 0.83 0.02 A 102 LEU HDy% H 1 0.78 0.02 A 102 LEU C C 13 177.7 0.2 A 102 LEU CA C 13 55.5 0.2 A 102 LEU CB C 13 42.6 0.2 A 102 LEU CDy C 13 25.1 0.02 A 102 LEU CDx C 13 23.6 0.02 A 102 LEU CG C 13 27.1 0.2 A 102 LEU N N 15 121.0 0.2 A 103 GLU H H 1 8.42 0.02 A 103 GLU HA H 1 4.09 0.02 A 103 GLU HBx H 1 1.84 0.02 A 103 GLU HBy H 1 1.84 0.02 A 103 GLU HGx H 1 2.01 0.02 A 103 GLU HGy H 1 2.1 0.02 A 103 GLU C C 13 176.4 0.2 A 103 GLU CA C 13 57.1 0.2 A 103 GLU CB C 13 29.9 0.2 A 103 GLU CG C 13 35.9 0.2 A 103 GLU N N 15 120 0.2 A 104 HIS H H 1 8.18 0.02 A 104 HIS HA H 1 4.58 0.02 A 104 HIS HBx H 1 3.09 0.02 A 104 HIS HBy H 1 3.09 0.02 A 104 HIS C C 13 173.8 0.2 A 104 HIS CA C 13 55.7 0.2 A 104 HIS CB C 13 30.0 0.2 A 104 HIS N N 15 119.0 0.2 A 105 HIS H H 1 8.16 0.02 A 105 HIS HA H 1 4.38 0.02 A 105 HIS HBx H 1 3.05 0.02 A 105 HIS HBy H 1 3.15 0.02 A 105 HIS CA C 13 57.2 0.2 A 105 HIS CB C 13 30.0 0.2 A 105 HIS N N 15 125.4 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 PRO HA A 4 GLN H 1.0 1.8 3.04 2 2 A 3 PRO HBy A 19 ASN HD2y 1.0 1.8 5.00 3 2 A 3 PRO HBy A 19 ASN HD2x 1.0 1.8 5.00 4 2 A 3 PRO HBx A 19 ASN HD2x 1.0 1.8 5.00 5 2 A 19 ASN HD2y A 3 PRO HBx 1.0 1.8 5.00 6 3 A 68 LEU HDy% A 3 PRO HDx 1.0 1.8 5.00 7 3 A 3 PRO HDy A 68 LEU HDy% 1.0 1.8 5.00 8 4 A 4 GLN H A 3 PRO HGx 1.0 1.8 5.07 9 4 A 4 GLN H A 3 PRO HGy 1.0 1.8 5.07 10 5 A 5 LEU HDy% A 3 PRO HGx 1.0 1.8 5.00 11 5 A 3 PRO HGy A 5 LEU HDy% 1.0 1.8 5.00 12 6 A 68 LEU HDx% A 3 PRO HGx 1.0 1.8 5.00 13 6 A 3 PRO HGy A 68 LEU HDx% 1.0 1.8 5.00 14 7 A 68 LEU HDy% A 3 PRO HGx 1.0 1.8 5.00 15 7 A 68 LEU HDy% A 3 PRO HGy 1.0 1.8 5.00 16 8 A 68 LEU HDx% A 3 PRO HGx 1.0 1.8 5.00 17 9 A 3 PRO HGy A 68 LEU HDx% 1.0 1.8 5.00 18 10 A 4 GLN HA A 4 GLN HE2x 1.0 1.8 5.25 19 10 A 4 GLN HA A 4 GLN HE2y 1.0 1.8 5.25 20 11 A 4 GLN HA A 4 GLN HGx 1.0 1.8 3.90 21 11 A 4 GLN HA A 4 GLN HGy 1.0 1.8 3.90 22 12 A 4 GLN HA A 5 LEU H 1.0 1.8 3.11 23 13 A 5 LEU H A 4 GLN HBx 1.0 1.8 4.46 24 13 A 5 LEU H A 4 GLN HBy 1.0 1.8 4.46 25 14 A 5 LEU H A 4 GLN HGx 1.0 1.8 5.04 26 14 A 4 GLN HGy A 5 LEU H 1.0 1.8 5.04 27 15 A 4 GLN H A 4 GLN HBx 1.0 1.8 2.98 28 15 A 4 GLN H A 4 GLN HBy 1.0 1.8 2.98 29 16 A 4 GLN H A 5 LEU H 1.0 1.8 4.81 30 17 A 4 GLN H A 19 ASN HD2y 1.0 1.8 5.00 31 17 A 4 GLN H A 19 ASN HD2x 1.0 1.8 5.00 32 18 A 5 LEU HA A 5 LEU HDx% 1.0 1.8 4.39 33 19 A 5 LEU HDy% A 5 LEU HA 1.0 1.8 3.76 34 20 A 5 LEU HA A 6 THR H 1.0 1.8 3.23 35 21 A 5 LEU HA A 19 ASN HBy 1.0 1.8 5.00 36 21 A 5 LEU HA A 19 ASN HBx 1.0 1.8 5.00 37 22 A 5 LEU HA A 19 ASN HBy 1.0 1.8 5.00 38 23 A 5 LEU HA A 19 ASN HBx 1.0 1.8 5.00 39 24 A 6 THR H A 5 LEU HBy 1.0 1.8 4.07 40 24 A 6 THR H A 5 LEU HBx 1.0 1.8 4.07 41 25 A 5 LEU HDx% A 5 LEU HBy 1.0 1.8 3.69 42 26 A 5 LEU HDy% A 5 LEU HBy 1.0 1.8 3.65 43 27 A 5 LEU HDx% A 5 LEU HBx 1.0 1.8 3.69 44 28 A 5 LEU HDy% A 5 LEU HBx 1.0 1.8 3.65 45 29 A 5 LEU HDx% A 6 THR H 1.0 1.8 5.50 46 30 A 5 LEU HDx% A 21 LYS HBx 1.0 1.8 5.00 47 30 A 5 LEU HDx% A 21 LYS HBy 1.0 1.8 5.00 48 31 A 5 LEU HDx% A 21 LYS HEy 1.0 1.8 5.00 49 31 A 5 LEU HDx% A 21 LYS HEx 1.0 1.8 5.00 50 32 A 68 LEU HDx% A 5 LEU HDx% 1.0 1.8 5.00 51 33 A 5 LEU HDy% A 6 THR H 1.0 1.8 4.06 52 34 A 5 LEU HDy% A 19 ASN HBy 1.0 1.8 5.00 53 34 A 5 LEU HDy% A 19 ASN HBx 1.0 1.8 5.00 54 35 A 5 LEU HDy% A 20 LEU HA 1.0 1.8 5.00 55 36 A 5 LEU HDy% A 21 LYS H 1.0 1.8 6.00 56 37 A 5 LEU H A 5 LEU HBy 1.0 1.8 3.45 57 37 A 5 LEU H A 5 LEU HBx 1.0 1.8 3.45 58 38 A 5 LEU H A 5 LEU HBy 1.0 1.8 4.14 59 39 A 5 LEU H A 5 LEU HBx 1.0 1.8 4.14 60 40 A 5 LEU H A 5 LEU HDx% 1.0 1.8 4.19 61 41 A 5 LEU H A 5 LEU HG 1.0 1.8 4.05 62 42 A 5 LEU H A 6 THR H 1.0 1.8 5.14 63 43 A 6 THR HA A 6 THR HG2% 1.0 1.8 3.38 64 44 A 6 THR HA A 7 LYS H 1.0 1.8 3.15 65 45 A 7 LYS H A 6 THR HB 1.0 1.8 4.83 66 46 A 6 THR HB A 18 ALA HB% 1.0 1.8 5.00 67 47 A 6 THR HB A 20 LEU HDx% 1.0 1.8 5.00 68 47 A 6 THR HB A 20 LEU HDy% 1.0 1.8 5.00 69 48 A 6 THR HG2% A 7 LYS H 1.0 1.8 3.43 70 49 A 6 THR HG2% A 10 ASP HBy 1.0 1.8 5.00 71 49 A 6 THR HG2% A 10 ASP HBx 1.0 1.8 5.00 72 50 A 6 THR HG2% A 10 ASP H 1.0 1.8 5.00 73 51 A 6 THR HG2% A 11 ILE HA 1.0 1.8 5.00 74 52 A 6 THR HG2% A 11 ILE HD1% 1.0 1.8 5.00 75 53 A 6 THR HG2% A 11 ILE HG1y 1.0 1.8 5.00 76 54 A 6 THR HG2% A 11 ILE HG1x 1.0 1.8 5.00 77 55 A 6 THR HG2% A 11 ILE H 1.0 1.8 5.00 78 56 A 6 THR HG2% A 16 GLN HE2y 1.0 1.8 5.00 79 56 A 6 THR HG2% A 16 GLN HE2x 1.0 1.8 5.00 80 57 A 6 THR HG2% A 16 GLN HE2y 1.0 1.8 5.00 81 58 A 6 THR HG2% A 16 GLN HE2x 1.0 1.8 5.00 82 59 A 6 THR HG2% A 18 ALA HB% 1.0 1.8 5.00 83 60 A 6 THR HG2% A 20 LEU HDx% 1.0 1.8 5.00 84 60 A 6 THR HG2% A 20 LEU HDy% 1.0 1.8 5.00 85 61 A 6 THR H A 6 THR HB 1.0 1.8 3.62 86 62 A 6 THR H A 6 THR HG2% 1.0 1.8 4.33 87 63 A 6 THR H A 7 LYS H 1.0 1.8 5.12 88 64 A 6 THR H A 19 ASN HBy 1.0 1.8 5.00 89 64 A 6 THR H A 19 ASN HBx 1.0 1.8 5.00 90 65 A 6 THR H A 19 ASN H 1.0 1.8 5.28 91 66 A 6 THR H A 20 LEU HA 1.0 1.8 5.00 92 67 A 6 THR H A 20 LEU HDx% 1.0 1.8 5.00 93 67 A 6 THR H A 20 LEU HDy% 1.0 1.8 5.00 94 68 A 6 THR H A 21 LYS H 1.0 1.8 5.44 95 69 A 7 LYS HA A 8 ILE H 1.0 1.8 3.77 96 70 A 7 LYS HA A 9 VAL HGx% 1.0 1.8 5.60 97 71 A 7 LYS HA A 9 VAL H 1.0 1.8 4.91 98 72 A 7 LYS HA A 45 THR HG2% 1.0 1.8 5.00 99 73 A 7 LYS HBx A 10 ASP HBy 1.0 1.8 5.00 100 73 A 7 LYS HBy A 10 ASP HBy 1.0 1.8 5.00 101 73 A 10 ASP HBx A 7 LYS HBx 1.0 1.8 5.00 102 73 A 10 ASP HBx A 7 LYS HBy 1.0 1.8 5.00 103 74 A 45 THR HG2% A 7 LYS HBx 1.0 1.8 5.00 104 74 A 45 THR HG2% A 7 LYS HBy 1.0 1.8 5.00 105 75 A 8 ILE H A 7 LYS HBy 1.0 1.8 4.76 106 76 A 8 ILE H A 7 LYS HBx 1.0 1.8 4.76 107 77 A 9 VAL HGx% A 7 LYS HDx 1.0 1.8 5.35 108 77 A 9 VAL HGx% A 7 LYS HDy 1.0 1.8 5.35 109 78 A 45 THR HG2% A 7 LYS HDx 1.0 1.8 5.00 110 78 A 45 THR HG2% A 7 LYS HDy 1.0 1.8 5.00 111 79 A 45 THR HG2% A 7 LYS HEx 1.0 1.8 5.00 112 79 A 45 THR HG2% A 7 LYS HEy 1.0 1.8 5.00 113 80 A 9 VAL HGx% A 7 LYS HGx 1.0 1.8 5.00 114 80 A 9 VAL HGx% A 7 LYS HGy 1.0 1.8 5.00 115 81 A 10 ASP H A 7 LYS HGx 1.0 1.8 7.00 116 81 A 10 ASP H A 7 LYS HGy 1.0 1.8 7.00 117 82 A 45 THR HG2% A 7 LYS HGx 1.0 1.8 5.00 118 82 A 45 THR HG2% A 7 LYS HGy 1.0 1.8 5.00 119 83 A 7 LYS H A 8 ILE H 1.0 1.8 5.08 120 84 A 7 LYS H A 9 VAL HGx% 1.0 1.8 6.00 121 85 A 7 LYS H A 10 ASP HBy 1.0 1.8 5.00 122 85 A 7 LYS H A 10 ASP HBx 1.0 1.8 5.00 123 86 A 7 LYS H A 10 ASP H 1.0 1.8 4.85 124 87 A 8 ILE HA A 8 ILE HD1% 1.0 1.8 4.23 125 88 A 10 ASP H A 8 ILE HA 1.0 1.8 4.79 126 89 A 8 ILE HA A 11 ILE HB 1.0 1.8 4.99 127 90 A 11 ILE HD1% A 8 ILE HA 1.0 1.8 3.59 128 91 A 8 ILE HA A 11 ILE HG1y 1.0 1.8 4.54 129 92 A 8 ILE HA A 11 ILE HG1x 1.0 1.8 4.96 130 93 A 11 ILE H A 8 ILE HA 1.0 1.8 4.58 131 94 A 9 VAL H A 8 ILE HB 1.0 1.8 4.20 132 95 A 10 ASP H A 8 ILE HB 1.0 1.8 6.05 133 96 A 8 ILE HB A 46 GLY H 1.0 1.8 6.00 134 97 A 8 ILE HD1% A 22 ALA HB% 1.0 1.8 5.00 135 98 A 8 ILE HD1% A 43 ASP HBy 1.0 1.8 5.00 136 98 A 8 ILE HD1% A 43 ASP HBx 1.0 1.8 5.00 137 99 A 8 ILE HD1% A 43 ASP H 1.0 1.8 5.00 138 100 A 8 ILE HD1% A 46 GLY H 1.0 1.8 6.00 139 101 A 8 ILE HD1% A 47 ILE HA 1.0 1.8 5.00 140 102 A 8 ILE HD1% A 48 ILE H 1.0 1.8 5.00 141 103 A 8 ILE HD1% A 8 ILE HG2% 1.0 1.8 3.49 142 104 A 9 VAL H A 8 ILE HG2% 1.0 1.8 4.32 143 105 A 8 ILE HG2% A 47 ILE H 1.0 1.8 5.00 144 106 A 8 ILE HG2% A 48 ILE HA 1.0 1.8 5.00 145 107 A 8 ILE HG2% A 48 ILE HB 1.0 1.8 5.00 146 108 A 8 ILE HG2% A 48 ILE HD1% 1.0 1.8 5.00 147 109 A 8 ILE HG2% A 48 ILE HG2% 1.0 1.8 5.00 148 110 A 48 ILE H A 8 ILE HG2% 1.0 1.8 5.00 149 111 A 8 ILE H A 8 ILE HB 1.0 1.8 3.92 150 112 A 8 ILE H A 8 ILE HD1% 1.0 1.8 4.66 151 113 A 8 ILE H A 8 ILE HG2% 1.0 1.8 4.46 152 114 A 8 ILE H A 9 VAL H 1.0 1.8 4.31 153 115 A 10 ASP H A 8 ILE H 1.0 1.8 5.28 154 116 A 8 ILE H A 45 THR H 1.0 1.8 5.82 155 117 A 9 VAL HGx% A 9 VAL HA 1.0 1.8 3.85 156 118 A 9 VAL HA A 9 VAL HGy% 1.0 1.8 3.19 157 119 A 11 ILE H A 9 VAL HA 1.0 1.8 4.81 158 120 A 9 VAL HA A 45 THR HB 1.0 1.8 6.00 159 121 A 10 ASP H A 9 VAL HB 1.0 1.8 5.17 160 122 A 9 VAL HB A 45 THR HA 1.0 1.8 5.00 161 123 A 45 THR HB A 9 VAL HB 1.0 1.8 5.00 162 124 A 45 THR HG2% A 9 VAL HB 1.0 1.8 5.00 163 125 A 10 ASP H A 9 VAL HGx% 1.0 1.8 3.41 164 126 A 9 VAL HGx% A 45 THR HA 1.0 1.8 5.00 165 127 A 9 VAL HGx% A 45 THR HB 1.0 1.8 5.00 166 128 A 9 VAL HGx% A 45 THR HG2% 1.0 1.8 5.00 167 129 A 10 ASP H A 9 VAL HGy% 1.0 1.8 5.12 168 130 A 9 VAL HGy% A 45 THR HB 1.0 1.8 5.00 169 131 A 9 VAL H A 9 VAL HB 1.0 1.8 3.82 170 132 A 9 VAL HGx% A 9 VAL H 1.0 1.8 3.32 171 133 A 9 VAL H A 9 VAL HGy% 1.0 1.8 4.35 172 134 A 10 ASP H A 9 VAL H 1.0 1.8 3.77 173 135 A 11 ILE H A 9 VAL H 1.0 1.8 5.16 174 136 A 9 VAL H A 45 THR HB 1.0 1.8 5.00 175 137 A 9 VAL H A 45 THR HG2% 1.0 1.8 5.00 176 138 A 9 VAL H A 45 THR H 1.0 1.8 6.05 177 139 A 10 ASP HA A 12 VAL HGx% 1.0 1.8 5.00 178 140 A 11 ILE H A 10 ASP HBy 1.0 1.8 4.84 179 141 A 10 ASP HBx A 11 ILE H 1.0 1.8 4.84 180 142 A 10 ASP H A 10 ASP HBy 1.0 1.8 3.42 181 142 A 10 ASP HBx A 10 ASP H 1.0 1.8 3.42 182 143 A 10 ASP H A 10 ASP HBy 1.0 1.8 3.93 183 144 A 10 ASP HBx A 10 ASP H 1.0 1.8 3.93 184 145 A 11 ILE HA A 11 ILE HD1% 1.0 1.8 4.49 185 146 A 11 ILE HA A 11 ILE HG1y 1.0 1.8 4.48 186 147 A 11 ILE HA A 11 ILE HG1x 1.0 1.8 3.74 187 148 A 11 ILE HA A 11 ILE HG2% 1.0 1.8 3.70 188 149 A 11 ILE HA A 12 VAL H 1.0 1.8 3.52 189 150 A 11 ILE HA A 13 GLU H 1.0 1.8 4.47 190 151 A 11 ILE HA A 16 GLN HE2y 1.0 1.8 5.00 191 151 A 11 ILE HA A 16 GLN HE2x 1.0 1.8 5.00 192 152 A 11 ILE HB A 48 ILE HD1% 1.0 1.8 5.00 193 153 A 11 ILE HD1% A 48 ILE HB 1.0 1.8 5.00 194 154 A 11 ILE HD1% A 48 ILE HD1% 1.0 1.8 5.00 195 155 A 11 ILE HD1% A 48 ILE HG2% 1.0 1.8 5.00 196 156 A 11 ILE HD1% A 83 VAL H 1.0 1.8 6.00 197 157 A 83 VAL HGx% A 11 ILE HG1x 1.0 1.8 5.50 198 157 A 11 ILE HG1y A 83 VAL HGx% 1.0 1.8 5.50 199 158 A 11 ILE HG2% A 11 ILE HG1y 1.0 1.8 4.32 200 159 A 11 ILE HG2% A 11 ILE HG1x 1.0 1.8 3.03 201 160 A 11 ILE HG2% A 12 VAL H 1.0 1.8 4.46 202 161 A 16 GLN HE2y A 11 ILE HG2% 1.0 1.8 5.00 203 161 A 16 GLN HE2x A 11 ILE HG2% 1.0 1.8 5.00 204 162 A 48 ILE HD1% A 11 ILE HG2% 1.0 1.8 5.00 205 163 A 11 ILE HG2% A 74 VAL HGx% 1.0 1.8 5.00 206 164 A 11 ILE HG2% A 74 VAL HGy% 1.0 1.8 5.00 207 165 A 11 ILE HG2% A 81 PHE HBy 1.0 1.8 5.00 208 166 A 11 ILE HG2% A 81 PHE HBx 1.0 1.8 5.00 209 167 A 11 ILE HG2% A 81 PHE HD% 1.0 1.8 5.00 210 168 A 11 ILE H A 11 ILE HB 1.0 1.8 3.21 211 169 A 11 ILE HD1% A 11 ILE H 1.0 1.8 3.61 212 170 A 11 ILE H A 11 ILE HG1y 1.0 1.8 3.76 213 171 A 11 ILE H A 11 ILE HG1x 1.0 1.8 4.06 214 172 A 11 ILE H A 11 ILE HG2% 1.0 1.8 4.86 215 173 A 11 ILE H A 12 VAL H 1.0 1.8 5.17 216 174 A 12 VAL HGx% A 12 VAL HA 1.0 1.8 3.32 217 175 A 12 VAL HA A 12 VAL HGy% 1.0 1.8 3.97 218 176 A 81 PHE HD% A 12 VAL HA 1.0 1.8 5.00 219 177 A 12 VAL HA A 81 PHE HE% 1.0 1.8 5.00 220 178 A 13 GLU H A 12 VAL HB 1.0 1.8 4.65 221 179 A 12 VAL HGx% A 13 GLU H 1.0 1.8 4.70 222 180 A 13 GLU H A 12 VAL HGy% 1.0 1.8 4.00 223 181 A 16 GLN HE2y A 12 VAL HGy% 1.0 1.8 5.00 224 181 A 16 GLN HE2x A 12 VAL HGy% 1.0 1.8 5.00 225 182 A 12 VAL HGx% A 12 VAL H 1.0 1.8 4.23 226 183 A 12 VAL H A 12 VAL HGy% 1.0 1.8 3.56 227 184 A 12 VAL H A 13 GLU H 1.0 1.8 6.00 228 185 A 16 GLN HE2y A 12 VAL H 1.0 1.8 5.00 229 185 A 16 GLN HE2x A 12 VAL H 1.0 1.8 5.00 230 186 A 13 GLU HA A 13 GLU HGy 1.0 1.8 4.03 231 187 A 13 GLU HA A 13 GLU HGx 1.0 1.8 4.03 232 188 A 13 GLU HA A 14 ASN H 1.0 1.8 3.15 233 189 A 14 ASN H A 13 GLU HBy 1.0 1.8 4.87 234 190 A 14 ASN H A 13 GLU HBx 1.0 1.8 4.87 235 191 A 14 ASN H A 13 GLU HGy 1.0 1.8 5.54 236 191 A 14 ASN H A 13 GLU HGx 1.0 1.8 5.54 237 192 A 13 GLU H A 13 GLU HBx 1.0 1.8 3.66 238 192 A 13 GLU H A 13 GLU HBy 1.0 1.8 3.66 239 193 A 13 GLU H A 13 GLU HBy 1.0 1.8 4.26 240 194 A 13 GLU H A 13 GLU HBx 1.0 1.8 4.26 241 195 A 13 GLU H A 13 GLU HGy 1.0 1.8 4.32 242 195 A 13 GLU H A 13 GLU HGx 1.0 1.8 4.32 243 196 A 13 GLU H A 14 ASN H 1.0 1.8 4.99 244 197 A 16 GLN HE2y A 13 GLU H 1.0 1.8 4.75 245 197 A 16 GLN HE2x A 13 GLU H 1.0 1.8 4.75 246 198 A 14 ASN HA A 14 ASN HD2y 1.0 1.8 4.93 247 198 A 14 ASN HA A 14 ASN HD2x 1.0 1.8 4.93 248 199 A 14 ASN HA A 14 ASN HD2y 1.0 1.8 5.74 249 200 A 14 ASN HA A 14 ASN HD2x 1.0 1.8 5.74 250 201 A 14 ASN HA A 15 GLY H 1.0 1.8 3.31 251 202 A 14 ASN HA A 74 VAL HB 1.0 1.8 5.00 252 203 A 74 VAL HGx% A 14 ASN HA 1.0 1.8 5.00 253 204 A 14 ASN HD2y A 14 ASN HBx 1.0 1.8 3.87 254 204 A 14 ASN HD2x A 14 ASN HBx 1.0 1.8 3.87 255 205 A 15 GLY H A 14 ASN HBx 1.0 1.8 4.59 256 206 A 14 ASN H A 14 ASN HBy 1.0 1.8 3.42 257 207 A 14 ASN H A 14 ASN HD2y 1.0 1.8 5.37 258 208 A 14 ASN H A 14 ASN HD2x 1.0 1.8 5.50 259 209 A 81 PHE HE% A 14 ASN H 1.0 1.8 5.50 260 210 A 17 TRP HE1 A 15 GLY HAy 1.0 1.8 5.60 261 210 A 15 GLY HAx A 17 TRP HE1 1.0 1.8 5.60 262 211 A 73 VAL HGy% A 15 GLY HAy 1.0 1.8 5.00 263 211 A 15 GLY HAx A 73 VAL HGy% 1.0 1.8 5.00 264 212 A 73 VAL HGy% A 15 GLY HAy 1.0 1.8 5.00 265 213 A 15 GLY HAx A 73 VAL HGy% 1.0 1.8 5.00 266 214 A 15 GLY H A 16 GLN H 1.0 1.8 4.11 267 215 A 15 GLY H A 73 VAL HGy% 1.0 1.8 5.00 268 216 A 15 GLY H A 74 VAL HB 1.0 1.8 5.00 269 217 A 74 VAL HGx% A 15 GLY H 1.0 1.8 5.00 270 218 A 15 GLY H A 74 VAL H 1.0 1.8 4.77 271 219 A 15 GLY H A 75 GLY HAy 1.0 1.8 5.43 272 220 A 16 GLN HA A 16 GLN HGy 1.0 1.8 4.38 273 221 A 16 GLN HA A 16 GLN HGx 1.0 1.8 4.55 274 222 A 16 GLN HA A 17 TRP H 1.0 1.8 3.73 275 223 A 16 GLN HE2y A 16 GLN HBy 1.0 1.8 4.84 276 223 A 16 GLN HE2y A 16 GLN HBx 1.0 1.8 4.84 277 223 A 16 GLN HE2x A 16 GLN HBx 1.0 1.8 4.84 278 223 A 16 GLN HE2x A 16 GLN HBy 1.0 1.8 4.84 279 224 A 74 VAL HGy% A 16 GLN HBx 1.0 1.8 5.00 280 224 A 74 VAL HGy% A 16 GLN HBy 1.0 1.8 5.00 281 225 A 17 TRP H A 16 GLN HBy 1.0 1.8 5.60 282 226 A 17 TRP H A 16 GLN HBx 1.0 1.8 5.60 283 227 A 18 ALA HB% A 16 GLN HE2y 1.0 1.8 5.60 284 227 A 18 ALA HB% A 16 GLN HE2x 1.0 1.8 5.60 285 228 A 18 ALA HB% A 16 GLN HGx 1.0 1.8 5.31 286 228 A 18 ALA HB% A 16 GLN HGy 1.0 1.8 5.31 287 229 A 74 VAL HGy% A 16 GLN HGx 1.0 1.8 5.00 288 229 A 74 VAL HGy% A 16 GLN HGy 1.0 1.8 5.00 289 230 A 16 GLN HE2x A 16 GLN HGy 1.0 1.8 3.94 290 230 A 16 GLN HE2y A 16 GLN HGy 1.0 1.8 3.94 291 231 A 16 GLN HE2y A 16 GLN HGx 1.0 1.8 3.81 292 231 A 16 GLN HE2x A 16 GLN HGx 1.0 1.8 3.81 293 232 A 16 GLN H A 16 GLN HBx 1.0 1.8 3.43 294 232 A 16 GLN H A 16 GLN HBy 1.0 1.8 3.43 295 233 A 16 GLN H A 16 GLN HGy 1.0 1.8 4.99 296 234 A 16 GLN H A 73 VAL HA 1.0 1.8 6.05 297 235 A 74 VAL HB A 16 GLN H 1.0 1.8 5.00 298 236 A 74 VAL HGx% A 16 GLN H 1.0 1.8 5.00 299 237 A 16 GLN H A 74 VAL H 1.0 1.8 4.71 300 238 A 17 TRP HA A 17 TRP HD1 1.0 1.8 4.75 301 239 A 17 TRP HE1 A 17 TRP HA 1.0 1.8 5.84 302 240 A 17 TRP HA A 17 TRP HE3 1.0 1.8 5.64 303 241 A 17 TRP HA A 18 ALA H 1.0 1.8 3.20 304 242 A 17 TRP HA A 72 VAL HGy% 1.0 1.8 5.00 305 243 A 17 TRP HA A 72 VAL H 1.0 1.8 5.18 306 244 A 73 VAL HA A 17 TRP HA 1.0 1.8 3.77 307 245 A 73 VAL HGy% A 17 TRP HA 1.0 1.8 5.00 308 246 A 17 TRP HA A 73 VAL H 1.0 1.8 5.43 309 247 A 74 VAL HGy% A 17 TRP HA 1.0 1.8 5.00 310 248 A 17 TRP HD1 A 17 TRP HBy 1.0 1.8 3.75 311 248 A 17 TRP HD1 A 17 TRP HBx 1.0 1.8 3.75 312 249 A 17 TRP HE1 A 17 TRP HBy 1.0 1.8 5.05 313 249 A 17 TRP HE1 A 17 TRP HBx 1.0 1.8 5.05 314 250 A 18 ALA H A 17 TRP HBy 1.0 1.8 5.35 315 251 A 18 ALA H A 17 TRP HBx 1.0 1.8 5.35 316 252 A 73 VAL HGy% A 17 TRP HD1 1.0 1.8 5.00 317 253 A 17 TRP HE1 A 73 VAL HGy% 1.0 1.8 5.00 318 254 A 17 TRP HE3 A 71 SER HA 1.0 1.8 5.00 319 255 A 17 TRP H A 17 TRP HD1 1.0 1.8 4.25 320 256 A 17 TRP H A 18 ALA H 1.0 1.8 4.84 321 257 A 17 TRP HZ2 A 73 VAL HGx% 1.0 1.8 5.00 322 258 A 19 ASN H A 18 ALA HA 1.0 1.8 3.08 323 259 A 18 ALA HB% A 19 ASN H 1.0 1.8 3.31 324 260 A 18 ALA HB% A 20 LEU HDx% 1.0 1.8 5.08 325 260 A 18 ALA HB% A 20 LEU HDy% 1.0 1.8 5.08 326 261 A 18 ALA HB% A 72 VAL HGy% 1.0 1.8 5.00 327 262 A 18 ALA HB% A 18 ALA H 1.0 1.8 3.54 328 263 A 19 ASN H A 18 ALA H 1.0 1.8 4.89 329 264 A 18 ALA H A 71 SER HA 1.0 1.8 4.93 330 265 A 18 ALA H A 72 VAL HGy% 1.0 1.8 5.00 331 266 A 18 ALA H A 72 VAL H 1.0 1.8 3.88 332 267 A 73 VAL HA A 18 ALA H 1.0 1.8 5.07 333 268 A 19 ASN HA A 20 LEU H 1.0 1.8 3.18 334 269 A 19 ASN HA A 70 ARG HA 1.0 1.8 4.14 335 270 A 19 ASN HA A 71 SER H 1.0 1.8 5.00 336 271 A 19 ASN HA A 72 VAL HGx% 1.0 1.8 5.00 337 272 A 72 VAL H A 19 ASN HA 1.0 1.8 5.00 338 273 A 70 ARG HA A 19 ASN HBy 1.0 1.8 5.00 339 273 A 19 ASN HBx A 70 ARG HA 1.0 1.8 5.00 340 274 A 20 LEU H A 19 ASN HBy 1.0 1.8 4.76 341 275 A 68 LEU HDx% A 19 ASN HBy 1.0 1.8 5.00 342 276 A 19 ASN HBx A 20 LEU H 1.0 1.8 4.76 343 277 A 68 LEU HDx% A 19 ASN HBx 1.0 1.8 5.00 344 278 A 19 ASN H A 19 ASN HD2y 1.0 1.8 4.33 345 278 A 19 ASN H A 19 ASN HD2x 1.0 1.8 4.33 346 279 A 19 ASN H A 19 ASN HD2y 1.0 1.8 5.09 347 280 A 19 ASN H A 20 LEU H 1.0 1.8 5.07 348 281 A 19 ASN H A 71 SER H 1.0 1.8 5.78 349 282 A 20 LEU HA A 21 LYS H 1.0 1.8 3.08 350 283 A 72 VAL HGy% A 20 LEU HBy 1.0 1.8 5.00 351 283 A 72 VAL HGy% A 20 LEU HBx 1.0 1.8 5.00 352 284 A 21 LYS H A 20 LEU HBy 1.0 1.8 4.69 353 285 A 69 LEU HBx A 20 LEU HBy 1.0 1.8 5.00 354 285 A 20 LEU HBy A 69 LEU HBy 1.0 1.8 5.00 355 286 A 69 LEU HDx% A 20 LEU HBy 1.0 1.8 5.00 356 287 A 21 LYS H A 20 LEU HBx 1.0 1.8 4.87 357 288 A 20 LEU HBx A 69 LEU HBx 1.0 1.8 5.00 358 288 A 20 LEU HBx A 69 LEU HBy 1.0 1.8 5.00 359 289 A 20 LEU HBx A 69 LEU HDx% 1.0 1.8 5.00 360 290 A 21 LYS H A 20 LEU HDx% 1.0 1.8 4.48 361 290 A 21 LYS H A 20 LEU HDy% 1.0 1.8 4.48 362 291 A 20 LEU H A 20 LEU HBy 1.0 1.8 4.15 363 292 A 20 LEU H A 20 LEU HBx 1.0 1.8 3.78 364 293 A 20 LEU H A 20 LEU HDx% 1.0 1.8 4.25 365 293 A 20 LEU HDy% A 20 LEU H 1.0 1.8 4.25 366 294 A 21 LYS H A 20 LEU H 1.0 1.8 4.89 367 295 A 20 LEU H A 69 LEU H 1.0 1.8 4.40 368 296 A 20 LEU H A 70 ARG HA 1.0 1.8 5.04 369 297 A 20 LEU H A 71 SER H 1.0 1.8 6.00 370 298 A 21 LYS HA A 21 LYS HDy 1.0 1.8 5.60 371 298 A 21 LYS HA A 21 LYS HDx 1.0 1.8 5.60 372 299 A 21 LYS HA A 22 ALA H 1.0 1.8 2.96 373 300 A 21 LYS HA A 67 TYR H 1.0 1.8 5.00 374 301 A 21 LYS HA A 68 LEU HA 1.0 1.8 4.02 375 302 A 68 LEU HDx% A 21 LYS HA 1.0 1.8 5.00 376 303 A 69 LEU H A 21 LYS HA 1.0 1.8 5.00 377 304 A 68 LEU HDx% A 21 LYS HBx 1.0 1.8 5.00 378 304 A 68 LEU HDx% A 21 LYS HBy 1.0 1.8 5.00 379 305 A 68 LEU HDy% A 21 LYS HBx 1.0 1.8 5.00 380 305 A 68 LEU HDy% A 21 LYS HBy 1.0 1.8 5.00 381 306 A 21 LYS HDy A 66 SER HBy 1.0 1.8 5.00 382 306 A 66 SER HBx A 21 LYS HDy 1.0 1.8 5.00 383 306 A 21 LYS HDx A 66 SER HBx 1.0 1.8 5.00 384 306 A 21 LYS HDx A 66 SER HBy 1.0 1.8 5.00 385 307 A 98 ILE HD1% A 21 LYS HDy 1.0 1.8 5.00 386 307 A 21 LYS HDx A 98 ILE HD1% 1.0 1.8 5.00 387 308 A 94 LEU HDy% A 21 LYS HDy 1.0 1.8 5.00 388 308 A 21 LYS HDy A 94 LEU HDx% 1.0 1.8 5.00 389 309 A 21 LYS HDx A 94 LEU HDy% 1.0 1.8 5.00 390 309 A 21 LYS HDx A 94 LEU HDx% 1.0 1.8 5.00 391 310 A 21 LYS HEy A 66 SER HBy 1.0 1.8 5.50 392 310 A 21 LYS HEx A 66 SER HBy 1.0 1.8 5.50 393 310 A 66 SER HBx A 21 LYS HEy 1.0 1.8 5.50 394 310 A 21 LYS HEx A 66 SER HBx 1.0 1.8 5.50 395 311 A 68 LEU HDy% A 21 LYS HEy 1.0 1.8 5.00 396 311 A 68 LEU HDy% A 21 LYS HEx 1.0 1.8 5.00 397 312 A 21 LYS HEy A 94 LEU HDx% 1.0 1.8 5.00 398 312 A 21 LYS HEx A 94 LEU HDx% 1.0 1.8 5.00 399 312 A 94 LEU HDy% A 21 LYS HEy 1.0 1.8 5.00 400 312 A 21 LYS HEx A 94 LEU HDy% 1.0 1.8 5.00 401 313 A 98 ILE HD1% A 21 LYS HEy 1.0 1.8 5.00 402 313 A 21 LYS HEx A 98 ILE HD1% 1.0 1.8 5.00 403 314 A 67 TYR H A 21 LYS HGx 1.0 1.8 6.00 404 314 A 67 TYR H A 21 LYS HGy 1.0 1.8 6.00 405 315 A 68 LEU HA A 21 LYS HGx 1.0 1.8 5.00 406 315 A 68 LEU HA A 21 LYS HGy 1.0 1.8 5.00 407 316 A 68 LEU HDx% A 21 LYS HGx 1.0 1.8 5.00 408 316 A 68 LEU HDx% A 21 LYS HGy 1.0 1.8 5.00 409 317 A 21 LYS H A 21 LYS HBx 1.0 1.8 3.86 410 317 A 21 LYS HBy A 21 LYS H 1.0 1.8 3.86 411 318 A 21 LYS HEx A 21 LYS H 1.0 1.8 6.05 412 319 A 21 LYS H A 21 LYS HGx 1.0 1.8 4.99 413 319 A 21 LYS H A 21 LYS HGy 1.0 1.8 4.99 414 320 A 21 LYS H A 22 ALA H 1.0 1.8 4.71 415 321 A 22 ALA HA A 23 LYS H 1.0 1.8 3.22 416 322 A 22 ALA HA A 44 GLU H 1.0 1.8 7.00 417 323 A 22 ALA HA A 66 SER HA 1.0 1.8 5.59 418 324 A 98 ILE HD1% A 22 ALA HA 1.0 1.8 5.00 419 325 A 22 ALA HA A 98 ILE HG2% 1.0 1.8 5.00 420 326 A 22 ALA HB% A 23 LYS H 1.0 1.8 3.55 421 327 A 22 ALA HB% A 41 LEU HDx% 1.0 1.8 5.00 422 328 A 22 ALA HB% A 41 LEU HDy% 1.0 1.8 5.00 423 329 A 22 ALA HB% A 43 ASP HBy 1.0 1.8 5.00 424 329 A 22 ALA HB% A 43 ASP HBx 1.0 1.8 5.00 425 330 A 22 ALA HB% A 43 ASP H 1.0 1.8 5.00 426 331 A 22 ALA HB% A 98 ILE HG2% 1.0 1.8 5.00 427 332 A 22 ALA HB% A 22 ALA H 1.0 1.8 3.37 428 333 A 22 ALA H A 98 ILE HD1% 1.0 1.8 5.00 429 334 A 23 LYS HA A 24 VAL H 1.0 1.8 3.53 430 335 A 66 SER HA A 23 LYS HA 1.0 1.8 3.83 431 336 A 23 LYS HA A 66 SER H 1.0 1.8 5.50 432 337 A 98 ILE HD1% A 23 LYS HBx 1.0 1.8 5.00 433 337 A 98 ILE HD1% A 23 LYS HBy 1.0 1.8 5.00 434 338 A 98 ILE HG2% A 23 LYS HBx 1.0 1.8 5.00 435 338 A 98 ILE HG2% A 23 LYS HBy 1.0 1.8 5.00 436 339 A 98 ILE H A 23 LYS HBx 1.0 1.8 5.00 437 339 A 23 LYS HBy A 98 ILE H 1.0 1.8 5.00 438 340 A 100 VAL HGy% A 23 LYS HBx 1.0 1.8 5.00 439 340 A 23 LYS HBy A 100 VAL HGy% 1.0 1.8 5.00 440 341 A 23 LYS HEx A 64 GLY HAx 1.0 1.8 5.00 441 341 A 23 LYS HEy A 64 GLY HAx 1.0 1.8 5.00 442 341 A 64 GLY HAy A 23 LYS HEx 1.0 1.8 5.00 443 341 A 23 LYS HEy A 64 GLY HAy 1.0 1.8 5.00 444 342 A 24 VAL H A 23 LYS HGx 1.0 1.8 4.25 445 342 A 24 VAL H A 23 LYS HGy 1.0 1.8 4.25 446 343 A 23 LYS H A 23 LYS HBx 1.0 1.8 3.40 447 343 A 23 LYS H A 23 LYS HBy 1.0 1.8 3.40 448 344 A 23 LYS H A 23 LYS HBy 1.0 1.8 3.94 449 345 A 23 LYS H A 23 LYS HBx 1.0 1.8 3.94 450 346 A 23 LYS H A 42 GLY HAy 1.0 1.8 5.24 451 347 A 23 LYS H A 42 GLY HAx 1.0 1.8 5.47 452 348 A 23 LYS H A 43 ASP HA 1.0 1.8 4.66 453 349 A 23 LYS H A 66 SER HA 1.0 1.8 5.90 454 350 A 98 ILE HD1% A 23 LYS H 1.0 1.8 5.00 455 351 A 23 LYS H A 98 ILE HG2% 1.0 1.8 5.00 456 352 A 24 VAL HA A 24 VAL HGx% 1.0 1.8 3.85 457 353 A 24 VAL HA A 24 VAL HGy% 1.0 1.8 3.73 458 354 A 24 VAL HA A 25 ILE H 1.0 1.8 3.33 459 355 A 24 VAL HA A 26 GLN H 1.0 1.8 4.75 460 356 A 24 VAL HA A 41 LEU HA 1.0 1.8 4.44 461 357 A 41 LEU HDy% A 24 VAL HA 1.0 1.8 5.00 462 358 A 24 VAL HB A 63 GLN HA 1.0 1.8 5.00 463 359 A 24 VAL HB A 64 GLY H 1.0 1.8 5.00 464 360 A 24 VAL HB A 65 GLU H 1.0 1.8 5.00 465 361 A 24 VAL HGx% A 25 ILE H 1.0 1.8 4.11 466 362 A 24 VAL HGx% A 26 GLN HA 1.0 1.8 6.00 467 363 A 24 VAL HGx% A 27 LEU HBy 1.0 1.8 5.01 468 364 A 24 VAL HGx% A 27 LEU HBx 1.0 1.8 5.04 469 365 A 41 LEU HDy% A 24 VAL HGx% 1.0 1.8 5.00 470 366 A 24 VAL HGx% A 50 PHE HE% 1.0 1.8 5.50 471 367 A 24 VAL HGx% A 50 PHE HZ 1.0 1.8 5.50 472 368 A 24 VAL HGx% A 61 LEU HDy% 1.0 1.8 5.00 473 369 A 24 VAL HGx% A 63 GLN HA 1.0 1.8 5.00 474 370 A 24 VAL HGx% A 63 GLN HBx 1.0 1.8 5.00 475 370 A 24 VAL HGx% A 63 GLN HBy 1.0 1.8 5.00 476 371 A 24 VAL HGx% A 63 GLN HGy 1.0 1.8 5.00 477 372 A 24 VAL HGx% A 64 GLY H 1.0 1.8 5.00 478 373 A 41 LEU HDy% A 24 VAL HGy% 1.0 1.8 5.00 479 374 A 24 VAL HGy% A 61 LEU HA 1.0 1.8 6.30 480 375 A 24 VAL HGy% A 61 LEU HBy 1.0 1.8 5.00 481 376 A 24 VAL HGy% A 61 LEU HDx% 1.0 1.8 5.00 482 377 A 24 VAL HGy% A 61 LEU HDy% 1.0 1.8 5.00 483 378 A 24 VAL HGy% A 61 LEU HG 1.0 1.8 5.00 484 379 A 24 VAL HGy% A 62 GLU H 1.0 1.8 5.00 485 380 A 24 VAL HGy% A 65 GLU H 1.0 1.8 5.00 486 381 A 24 VAL HGy% A 67 TYR HD% 1.0 1.8 5.00 487 382 A 24 VAL HGy% A 67 TYR HE% 1.0 1.8 5.00 488 383 A 67 TYR H A 24 VAL HGy% 1.0 1.8 5.00 489 384 A 24 VAL H A 24 VAL HB 1.0 1.8 3.61 490 385 A 24 VAL H A 24 VAL HGx% 1.0 1.8 4.80 491 386 A 24 VAL H A 24 VAL HGy% 1.0 1.8 3.28 492 387 A 41 LEU HDy% A 24 VAL H 1.0 1.8 5.00 493 388 A 24 VAL H A 64 GLY H 1.0 1.8 4.80 494 389 A 24 VAL H A 65 GLU H 1.0 1.8 4.80 495 390 A 66 SER HA A 24 VAL H 1.0 1.8 5.26 496 391 A 25 ILE HA A 25 ILE HD1% 1.0 1.8 3.98 497 392 A 25 ILE HA A 25 ILE HG1x 1.0 1.8 4.44 498 393 A 25 ILE HA A 25 ILE HG2% 1.0 1.8 3.66 499 394 A 26 GLN H A 25 ILE HB 1.0 1.8 3.79 500 395 A 25 ILE HB A 40 LEU HDx% 1.0 1.8 5.00 501 395 A 25 ILE HB A 40 LEU HDy% 1.0 1.8 5.00 502 396 A 25 ILE HD1% A 42 GLY HAy 1.0 1.8 5.00 503 397 A 25 ILE HD1% A 42 GLY HAx 1.0 1.8 5.00 504 398 A 25 ILE HD1% A 42 GLY H 1.0 1.8 5.00 505 399 A 26 GLN H A 25 ILE HG1x 1.0 1.8 5.00 506 399 A 26 GLN H A 25 ILE HG1y 1.0 1.8 5.00 507 400 A 42 GLY H A 25 ILE HG1x 1.0 1.8 5.00 508 400 A 42 GLY H A 25 ILE HG1y 1.0 1.8 5.00 509 401 A 40 LEU HDy% A 25 ILE HG1y 1.0 1.8 5.00 510 401 A 25 ILE HG1y A 40 LEU HDx% 1.0 1.8 5.00 511 402 A 25 ILE HG1y A 47 ILE HG2% 1.0 1.8 5.00 512 403 A 25 ILE HG2% A 25 ILE HG1y 1.0 1.8 3.77 513 404 A 25 ILE HG2% A 25 ILE HG1x 1.0 1.8 4.05 514 405 A 26 GLN H A 25 ILE HG2% 1.0 1.8 4.28 515 406 A 25 ILE H A 25 ILE HB 1.0 1.8 4.14 516 407 A 25 ILE H A 25 ILE HD1% 1.0 1.8 4.41 517 408 A 25 ILE H A 25 ILE HG1y 1.0 1.8 4.60 518 409 A 25 ILE H A 25 ILE HG1x 1.0 1.8 4.07 519 410 A 25 ILE H A 25 ILE HG2% 1.0 1.8 4.30 520 411 A 25 ILE H A 26 GLN H 1.0 1.8 3.29 521 412 A 25 ILE H A 41 LEU HA 1.0 1.8 4.08 522 413 A 41 LEU HDy% A 25 ILE H 1.0 1.8 5.00 523 414 A 25 ILE H A 41 LEU H 1.0 1.8 5.67 524 415 A 25 ILE H A 42 GLY H 1.0 1.8 4.41 525 416 A 26 GLN HA A 26 GLN HE2x 1.0 1.8 5.41 526 416 A 26 GLN HA A 26 GLN HE2y 1.0 1.8 5.41 527 417 A 26 GLN HA A 27 LEU H 1.0 1.8 2.96 528 418 A 26 GLN HA A 63 GLN HE2y 1.0 1.8 5.00 529 419 A 26 GLN HA A 63 GLN HE2x 1.0 1.8 5.00 530 420 A 26 GLN HA A 63 GLN HGy 1.0 1.8 5.00 531 421 A 27 LEU H A 26 GLN HBx 1.0 1.8 4.11 532 421 A 27 LEU H A 26 GLN HBy 1.0 1.8 4.11 533 422 A 26 GLN HBy A 40 LEU HDx% 1.0 1.8 5.00 534 422 A 26 GLN HBx A 40 LEU HDx% 1.0 1.8 5.00 535 422 A 40 LEU HDy% A 26 GLN HBx 1.0 1.8 5.00 536 422 A 40 LEU HDy% A 26 GLN HBy 1.0 1.8 5.00 537 423 A 26 GLN HBy A 40 LEU HDx% 1.0 1.8 5.00 538 423 A 26 GLN HBx A 40 LEU HDx% 1.0 1.8 5.00 539 424 A 40 LEU HDy% A 26 GLN HBy 1.0 1.8 5.00 540 424 A 40 LEU HDy% A 26 GLN HBx 1.0 1.8 5.00 541 425 A 26 GLN HE2y A 26 GLN HGx 1.0 1.8 3.43 542 425 A 26 GLN HE2x A 26 GLN HGx 1.0 1.8 3.43 543 425 A 26 GLN HGy A 26 GLN HE2x 1.0 1.8 3.43 544 425 A 26 GLN HE2y A 26 GLN HGy 1.0 1.8 3.43 545 426 A 27 LEU H A 26 GLN HGx 1.0 1.8 4.48 546 426 A 27 LEU H A 26 GLN HGy 1.0 1.8 4.48 547 427 A 26 GLN H A 26 GLN HBx 1.0 1.8 3.86 548 427 A 26 GLN H A 26 GLN HBy 1.0 1.8 3.86 549 428 A 26 GLN H A 26 GLN HGx 1.0 1.8 4.40 550 428 A 26 GLN H A 26 GLN HGy 1.0 1.8 4.40 551 429 A 26 GLN H A 26 GLN HGy 1.0 1.8 5.01 552 430 A 26 GLN H A 26 GLN HGx 1.0 1.8 5.01 553 431 A 26 GLN H A 27 LEU H 1.0 1.8 4.85 554 432 A 26 GLN H A 40 LEU HDx% 1.0 1.8 5.00 555 432 A 26 GLN H A 40 LEU HDy% 1.0 1.8 5.00 556 433 A 26 GLN H A 41 LEU HA 1.0 1.8 5.08 557 434 A 27 LEU HA A 27 LEU HDx% 1.0 1.8 4.69 558 435 A 27 LEU HA A 27 LEU HDy% 1.0 1.8 4.23 559 436 A 27 LEU HA A 28 TRP H 1.0 1.8 3.63 560 437 A 27 LEU HA A 39 GLY HAx 1.0 1.8 4.99 561 438 A 27 LEU HA A 39 GLY HAy 1.0 1.8 4.99 562 439 A 27 LEU HBy A 27 LEU HDx% 1.0 1.8 3.60 563 440 A 27 LEU HBy A 28 TRP H 1.0 1.8 5.44 564 441 A 27 LEU HBx A 27 LEU HDx% 1.0 1.8 3.77 565 442 A 27 LEU HBx A 27 LEU HDy% 1.0 1.8 4.35 566 443 A 27 LEU HBx A 28 TRP H 1.0 1.8 4.72 567 444 A 27 LEU HDx% A 37 GLN HE2y 1.0 1.8 5.00 568 444 A 27 LEU HDx% A 37 GLN HE2x 1.0 1.8 5.00 569 445 A 27 LEU HDx% A 37 GLN HE2y 1.0 1.8 5.00 570 446 A 27 LEU HDx% A 37 GLN HE2x 1.0 1.8 5.00 571 447 A 27 LEU HDx% A 61 LEU H 1.0 1.8 5.00 572 448 A 27 LEU HDx% A 62 GLU HA 1.0 1.8 5.00 573 449 A 63 GLN HA A 27 LEU HDx% 1.0 1.8 5.00 574 450 A 27 LEU HDx% A 63 GLN HBx 1.0 1.8 5.00 575 450 A 63 GLN HBy A 27 LEU HDx% 1.0 1.8 5.00 576 451 A 63 GLN HGy A 27 LEU HDx% 1.0 1.8 5.00 577 452 A 27 LEU HDx% A 63 GLN H 1.0 1.8 5.00 578 453 A 27 LEU HDy% A 28 TRP H 1.0 1.8 5.10 579 454 A 27 LEU HDy% A 37 GLN HE2y 1.0 1.8 5.00 580 454 A 27 LEU HDy% A 37 GLN HE2x 1.0 1.8 5.00 581 455 A 63 GLN HA A 27 LEU HDy% 1.0 1.8 5.00 582 456 A 27 LEU HDy% A 63 GLN HGx 1.0 1.8 5.00 583 457 A 27 LEU HG A 63 GLN HBx 1.0 1.8 5.00 584 457 A 63 GLN HBy A 27 LEU HG 1.0 1.8 5.00 585 458 A 27 LEU H A 27 LEU HDx% 1.0 1.8 4.63 586 459 A 27 LEU H A 27 LEU HG 1.0 1.8 4.16 587 460 A 27 LEU H A 28 TRP H 1.0 1.8 4.86 588 461 A 28 TRP HA A 28 TRP HE1 1.0 1.8 5.41 589 462 A 28 TRP HA A 29 GLU H 1.0 1.8 3.18 590 463 A 29 GLU H A 28 TRP HBy 1.0 1.8 4.33 591 464 A 28 TRP HBy A 38 VAL HGx% 1.0 1.8 5.00 592 464 A 28 TRP HBy A 38 VAL HGy% 1.0 1.8 5.00 593 465 A 29 GLU H A 28 TRP HBx 1.0 1.8 4.92 594 466 A 28 TRP HBx A 38 VAL HGx% 1.0 1.8 5.00 595 466 A 38 VAL HGy% A 28 TRP HBx 1.0 1.8 5.00 596 467 A 28 TRP HE3 A 38 VAL HGx% 1.0 1.8 5.50 597 467 A 38 VAL HGy% A 28 TRP HE3 1.0 1.8 5.50 598 468 A 28 TRP H A 28 TRP HD1 1.0 1.8 5.86 599 469 A 28 TRP H A 38 VAL HA 1.0 1.8 6.05 600 470 A 28 TRP H A 38 VAL HGx% 1.0 1.8 5.00 601 470 A 28 TRP H A 38 VAL HGy% 1.0 1.8 5.00 602 471 A 28 TRP H A 38 VAL H 1.0 1.8 4.80 603 472 A 28 TRP H A 39 GLY HAx 1.0 1.8 4.49 604 472 A 28 TRP H A 39 GLY HAy 1.0 1.8 4.49 605 473 A 28 TRP H A 39 GLY H 1.0 1.8 6.05 606 474 A 29 GLU HA A 30 ASN H 1.0 1.8 3.04 607 475 A 29 GLU HA A 37 GLN HGx 1.0 1.8 5.00 608 475 A 29 GLU HA A 37 GLN HGy 1.0 1.8 5.00 609 476 A 30 ASN H A 29 GLU HBx 1.0 1.8 3.80 610 476 A 30 ASN H A 29 GLU HBy 1.0 1.8 3.80 611 477 A 30 ASN H A 29 GLU HGx 1.0 1.8 4.50 612 477 A 30 ASN H A 29 GLU HGy 1.0 1.8 4.50 613 478 A 29 GLU H A 29 GLU HBx 1.0 1.8 3.07 614 478 A 29 GLU H A 29 GLU HBy 1.0 1.8 3.07 615 479 A 29 GLU H A 30 ASN H 1.0 1.8 5.90 616 480 A 30 ASN HA A 30 ASN HD2y 1.0 1.8 5.19 617 481 A 30 ASN HA A 38 VAL HGx% 1.0 1.8 5.00 618 481 A 38 VAL HGy% A 30 ASN HA 1.0 1.8 5.00 619 482 A 32 HIS H A 30 ASN HBx 1.0 1.8 4.62 620 482 A 30 ASN HBy A 32 HIS H 1.0 1.8 4.62 621 483 A 35 ILE HG2% A 30 ASN HBx 1.0 1.8 5.00 622 483 A 30 ASN HBy A 35 ILE HG2% 1.0 1.8 5.00 623 484 A 30 ASN HBy A 38 VAL HGx% 1.0 1.8 5.00 624 484 A 30 ASN HBx A 38 VAL HGx% 1.0 1.8 5.00 625 484 A 38 VAL HGy% A 30 ASN HBx 1.0 1.8 5.00 626 484 A 38 VAL HGy% A 30 ASN HBy 1.0 1.8 5.00 627 485 A 30 ASN HD2y A 35 ILE H 1.0 1.8 5.00 628 485 A 35 ILE H A 30 ASN HD2x 1.0 1.8 5.00 629 486 A 30 ASN HD2y A 32 HIS H 1.0 1.8 4.40 630 487 A 30 ASN HD2y A 35 ILE HB 1.0 1.8 5.00 631 488 A 30 ASN HD2y A 35 ILE HG2% 1.0 1.8 5.00 632 489 A 30 ASN HD2x A 32 HIS HBx 1.0 1.8 5.14 633 489 A 30 ASN HD2x A 32 HIS HBy 1.0 1.8 5.14 634 490 A 32 HIS H A 30 ASN HD2x 1.0 1.8 4.16 635 491 A 35 ILE HB A 30 ASN HD2x 1.0 1.8 5.00 636 492 A 35 ILE HG2% A 30 ASN HD2x 1.0 1.8 5.00 637 493 A 30 ASN H A 30 ASN HBx 1.0 1.8 3.66 638 493 A 30 ASN H A 30 ASN HBy 1.0 1.8 3.66 639 494 A 30 ASN H A 30 ASN HD2y 1.0 1.8 5.01 640 495 A 30 ASN H A 31 THR H 1.0 1.8 5.80 641 496 A 31 THR HA A 31 THR HG2% 1.0 1.8 3.11 642 497 A 32 HIS H A 31 THR HB 1.0 1.8 4.68 643 498 A 32 HIS H A 31 THR HG2% 1.0 1.8 5.04 644 499 A 31 THR H A 31 THR HG2% 1.0 1.8 5.10 645 500 A 32 HIS H A 31 THR H 1.0 1.8 4.17 646 501 A 32 HIS HA A 32 HIS HD2 1.0 1.8 5.46 647 502 A 32 HIS HA A 33 GLU H 1.0 1.8 3.53 648 503 A 32 HIS HD2 A 32 HIS HBx 1.0 1.8 3.97 649 503 A 32 HIS HBy A 32 HIS HD2 1.0 1.8 3.97 650 504 A 35 ILE HB A 32 HIS HBx 1.0 1.8 5.00 651 504 A 35 ILE HB A 32 HIS HBy 1.0 1.8 5.00 652 505 A 35 ILE HD1% A 32 HIS HBx 1.0 1.8 5.00 653 505 A 32 HIS HBy A 35 ILE HD1% 1.0 1.8 5.00 654 506 A 32 HIS HBy A 35 ILE HG1x 1.0 1.8 5.00 655 506 A 32 HIS HBx A 35 ILE HG1x 1.0 1.8 5.00 656 506 A 35 ILE HG1y A 32 HIS HBx 1.0 1.8 5.00 657 506 A 32 HIS HBy A 35 ILE HG1y 1.0 1.8 5.00 658 507 A 35 ILE H A 32 HIS HBx 1.0 1.8 5.28 659 507 A 35 ILE H A 32 HIS HBy 1.0 1.8 5.28 660 508 A 32 HIS HD2 A 35 ILE HD1% 1.0 1.8 5.00 661 509 A 32 HIS H A 32 HIS HBx 1.0 1.8 3.12 662 509 A 32 HIS H A 32 HIS HBy 1.0 1.8 3.12 663 510 A 32 HIS H A 33 GLU H 1.0 1.8 5.22 664 511 A 32 HIS H A 35 ILE HB 1.0 1.8 5.40 665 512 A 32 HIS H A 35 ILE HD1% 1.0 1.8 5.70 666 513 A 32 HIS H A 35 ILE HG2% 1.0 1.8 5.70 667 514 A 33 GLU HA A 33 GLU HGx 1.0 1.8 3.74 668 514 A 33 GLU HA A 33 GLU HGy 1.0 1.8 3.74 669 515 A 33 GLU H A 33 GLU HBx 1.0 1.8 3.52 670 515 A 33 GLU H A 33 GLU HBy 1.0 1.8 3.52 671 516 A 33 GLU H A 33 GLU HGx 1.0 1.8 4.28 672 516 A 33 GLU H A 33 GLU HGy 1.0 1.8 4.28 673 517 A 35 ILE H A 33 GLU H 1.0 1.8 5.08 674 518 A 34 SER HA A 54 LYS H 1.0 1.8 5.00 675 519 A 35 ILE H A 34 SER HBy 1.0 1.8 5.13 676 520 A 35 ILE H A 34 SER HBx 1.0 1.8 5.13 677 521 A 35 ILE H A 34 SER H 1.0 1.8 4.21 678 522 A 35 ILE HD1% A 35 ILE HA 1.0 1.8 4.44 679 523 A 35 ILE HA A 36 SER H 1.0 1.8 3.43 680 524 A 35 ILE HA A 37 GLN H 1.0 1.8 4.81 681 525 A 35 ILE HA A 53 TRP HA 1.0 1.8 3.87 682 526 A 35 ILE HA A 53 TRP HE3 1.0 1.8 5.00 683 527 A 35 ILE HB A 38 VAL HGx% 1.0 1.8 5.26 684 527 A 38 VAL HGy% A 35 ILE HB 1.0 1.8 5.26 685 528 A 35 ILE HD1% A 38 VAL HGx% 1.0 1.8 5.00 686 528 A 38 VAL HGy% A 35 ILE HD1% 1.0 1.8 5.00 687 529 A 36 SER H A 35 ILE HG1x 1.0 1.8 5.07 688 529 A 35 ILE HG1y A 36 SER H 1.0 1.8 5.07 689 530 A 51 THR HG2% A 35 ILE HG1x 1.0 1.8 5.50 690 530 A 35 ILE HG1y A 51 THR HG2% 1.0 1.8 5.50 691 531 A 53 TRP HZ3 A 35 ILE HG1x 1.0 1.8 5.00 692 531 A 35 ILE HG1y A 53 TRP HZ3 1.0 1.8 5.00 693 532 A 35 ILE HG1y A 53 TRP HE3 1.0 1.8 5.00 694 533 A 53 TRP HE3 A 35 ILE HG1x 1.0 1.8 5.00 695 534 A 35 ILE HG2% A 36 SER H 1.0 1.8 3.82 696 535 A 35 ILE HG2% A 37 GLN H 1.0 1.8 3.55 697 536 A 38 VAL HA A 35 ILE HG2% 1.0 1.8 5.00 698 537 A 35 ILE HG2% A 38 VAL HB 1.0 1.8 5.00 699 538 A 35 ILE HG2% A 38 VAL HGx% 1.0 1.8 5.00 700 538 A 38 VAL HGy% A 35 ILE HG2% 1.0 1.8 5.00 701 539 A 38 VAL H A 35 ILE HG2% 1.0 1.8 4.76 702 540 A 35 ILE HG2% A 51 THR HG2% 1.0 1.8 5.50 703 541 A 35 ILE HG2% A 52 ILE H 1.0 1.8 5.00 704 542 A 35 ILE H A 35 ILE HB 1.0 1.8 3.33 705 543 A 35 ILE H A 35 ILE HD1% 1.0 1.8 4.60 706 544 A 35 ILE H A 35 ILE HG1x 1.0 1.8 3.77 707 544 A 35 ILE H A 35 ILE HG1y 1.0 1.8 3.77 708 545 A 35 ILE H A 35 ILE HG1y 1.0 1.8 4.65 709 546 A 35 ILE H A 35 ILE HG1x 1.0 1.8 4.65 710 547 A 35 ILE HG2% A 35 ILE H 1.0 1.8 4.48 711 548 A 35 ILE H A 36 SER H 1.0 1.8 5.44 712 549 A 36 SER HA A 54 LYS HGy 1.0 1.8 6.00 713 549 A 36 SER HA A 54 LYS HGx 1.0 1.8 6.00 714 550 A 37 GLN H A 36 SER HBx 1.0 1.8 3.44 715 550 A 37 GLN H A 36 SER HBy 1.0 1.8 3.44 716 551 A 52 ILE HB A 36 SER HBx 1.0 1.8 5.00 717 551 A 36 SER HBy A 52 ILE HB 1.0 1.8 5.00 718 552 A 52 ILE HD1% A 36 SER HBx 1.0 1.8 5.00 719 552 A 36 SER HBy A 52 ILE HD1% 1.0 1.8 5.00 720 553 A 36 SER HBx A 52 ILE HG1x 1.0 1.8 5.30 721 553 A 36 SER HBy A 52 ILE HG1x 1.0 1.8 5.30 722 553 A 52 ILE HG1y A 36 SER HBx 1.0 1.8 5.30 723 553 A 36 SER HBy A 52 ILE HG1y 1.0 1.8 5.30 724 554 A 36 SER HBx A 54 LYS HGy 1.0 1.8 5.00 725 554 A 36 SER HBy A 54 LYS HGy 1.0 1.8 5.00 726 555 A 54 LYS HGx A 36 SER HBy 1.0 1.8 5.00 727 555 A 54 LYS HGx A 36 SER HBx 1.0 1.8 5.00 728 556 A 36 SER H A 36 SER HBx 1.0 1.8 3.59 729 556 A 36 SER H A 36 SER HBy 1.0 1.8 3.59 730 557 A 36 SER H A 37 GLN H 1.0 1.8 3.54 731 558 A 36 SER H A 52 ILE HG2% 1.0 1.8 5.00 732 559 A 36 SER H A 53 TRP HA 1.0 1.8 5.03 733 560 A 38 VAL H A 37 GLN HA 1.0 1.8 3.04 734 561 A 37 GLN HE2y A 37 GLN HBy 1.0 1.8 4.82 735 561 A 37 GLN HE2y A 37 GLN HBx 1.0 1.8 4.82 736 561 A 37 GLN HE2x A 37 GLN HBy 1.0 1.8 4.82 737 561 A 37 GLN HE2x A 37 GLN HBx 1.0 1.8 4.82 738 562 A 38 VAL H A 37 GLN HBx 1.0 1.8 4.04 739 562 A 38 VAL H A 37 GLN HBy 1.0 1.8 4.04 740 563 A 50 PHE HE% A 37 GLN HBx 1.0 1.8 5.00 741 563 A 50 PHE HE% A 37 GLN HBy 1.0 1.8 5.00 742 564 A 50 PHE HZ A 37 GLN HBx 1.0 1.8 5.00 743 564 A 50 PHE HZ A 37 GLN HBy 1.0 1.8 5.00 744 565 A 52 ILE HD1% A 37 GLN HBx 1.0 1.8 5.30 745 565 A 52 ILE HD1% A 37 GLN HBy 1.0 1.8 5.30 746 566 A 60 LEU HDy% A 37 GLN HBx 1.0 1.8 5.00 747 566 A 37 GLN HBy A 60 LEU HDy% 1.0 1.8 5.00 748 567 A 37 GLN HE2y A 38 VAL H 1.0 1.8 5.87 749 567 A 37 GLN HE2x A 38 VAL H 1.0 1.8 5.87 750 568 A 37 GLN HE2y A 60 LEU HDy% 1.0 1.8 5.00 751 568 A 37 GLN HE2x A 60 LEU HDy% 1.0 1.8 5.00 752 569 A 37 GLN HE2y A 61 LEU H 1.0 1.8 5.00 753 569 A 37 GLN HE2x A 61 LEU H 1.0 1.8 5.00 754 570 A 37 GLN HE2y A 60 LEU HBy 1.0 1.8 5.00 755 571 A 37 GLN HE2y A 60 LEU HDy% 1.0 1.8 5.00 756 572 A 37 GLN HE2x A 60 LEU HBy 1.0 1.8 5.00 757 573 A 37 GLN HE2x A 60 LEU HDy% 1.0 1.8 5.00 758 574 A 38 VAL H A 37 GLN HGx 1.0 1.8 3.98 759 574 A 38 VAL H A 37 GLN HGy 1.0 1.8 3.98 760 575 A 37 GLN H A 37 GLN HGx 1.0 1.8 4.86 761 575 A 37 GLN HGy A 37 GLN H 1.0 1.8 4.86 762 576 A 38 VAL H A 37 GLN H 1.0 1.8 4.83 763 577 A 37 GLN H A 51 THR HA 1.0 1.8 5.12 764 578 A 37 GLN H A 52 ILE HB 1.0 1.8 5.00 765 579 A 37 GLN H A 52 ILE H 1.0 1.8 4.17 766 580 A 38 VAL HA A 38 VAL HGx% 1.0 1.8 3.70 767 580 A 38 VAL HGy% A 38 VAL HA 1.0 1.8 3.70 768 581 A 38 VAL HA A 39 GLY H 1.0 1.8 3.06 769 582 A 38 VAL HA A 50 PHE H 1.0 1.8 6.03 770 583 A 38 VAL HA A 51 THR HA 1.0 1.8 4.25 771 584 A 38 VAL HA A 51 THR HG2% 1.0 1.8 5.00 772 585 A 38 VAL HA A 52 ILE H 1.0 1.8 5.38 773 586 A 39 GLY H A 38 VAL HB 1.0 1.8 4.42 774 587 A 39 GLY H A 38 VAL HGx% 1.0 1.8 3.86 775 587 A 38 VAL HGy% A 39 GLY H 1.0 1.8 3.86 776 588 A 51 THR HA A 38 VAL HGx% 1.0 1.8 5.00 777 588 A 38 VAL HGy% A 51 THR HA 1.0 1.8 5.00 778 589 A 51 THR HG2% A 38 VAL HGx% 1.0 1.8 5.00 779 589 A 38 VAL HGy% A 51 THR HG2% 1.0 1.8 5.00 780 590 A 38 VAL H A 38 VAL HGx% 1.0 1.8 3.21 781 590 A 38 VAL HGy% A 38 VAL H 1.0 1.8 3.21 782 591 A 38 VAL H A 39 GLY H 1.0 1.8 5.04 783 592 A 39 GLY H A 40 LEU H 1.0 1.8 4.89 784 593 A 39 GLY H A 50 PHE H 1.0 1.8 4.08 785 594 A 40 LEU HA A 40 LEU HDx% 1.0 1.8 4.43 786 594 A 40 LEU HDy% A 40 LEU HA 1.0 1.8 4.43 787 595 A 41 LEU H A 40 LEU HA 1.0 1.8 3.45 788 596 A 40 LEU HA A 49 LYS HA 1.0 1.8 4.14 789 597 A 40 LEU HA A 49 LYS H 1.0 1.8 5.39 790 598 A 40 LEU HA A 50 PHE HD% 1.0 1.8 5.00 791 599 A 49 LYS HA A 40 LEU HBy 1.0 1.8 5.00 792 599 A 49 LYS HA A 40 LEU HBx 1.0 1.8 5.00 793 600 A 40 LEU HBy A 40 LEU HDx% 1.0 1.8 4.46 794 601 A 40 LEU HDy% A 40 LEU HBy 1.0 1.8 4.46 795 602 A 41 LEU H A 40 LEU HBy 1.0 1.8 4.64 796 603 A 41 LEU H A 40 LEU HBx 1.0 1.8 4.25 797 604 A 41 LEU H A 40 LEU HDx% 1.0 1.8 4.38 798 604 A 40 LEU HDy% A 41 LEU H 1.0 1.8 4.38 799 605 A 40 LEU HDx% A 42 GLY HAy 1.0 1.8 6.00 800 605 A 40 LEU HDy% A 42 GLY HAy 1.0 1.8 6.00 801 605 A 42 GLY HAx A 40 LEU HDx% 1.0 1.8 6.00 802 605 A 40 LEU HDy% A 42 GLY HAx 1.0 1.8 6.00 803 606 A 47 ILE HB A 40 LEU HDx% 1.0 1.8 5.00 804 606 A 40 LEU HDy% A 47 ILE HB 1.0 1.8 5.00 805 607 A 47 ILE HG2% A 40 LEU HDx% 1.0 1.8 5.00 806 607 A 40 LEU HDy% A 47 ILE HG2% 1.0 1.8 5.00 807 608 A 49 LYS HA A 40 LEU HDx% 1.0 1.8 5.00 808 608 A 40 LEU HDy% A 49 LYS HA 1.0 1.8 5.00 809 609 A 41 LEU H A 40 LEU H 1.0 1.8 5.95 810 610 A 50 PHE HE% A 40 LEU H 1.0 1.8 5.00 811 611 A 50 PHE H A 40 LEU H 1.0 1.8 5.61 812 612 A 41 LEU HDx% A 41 LEU HA 1.0 1.8 5.08 813 613 A 41 LEU HDy% A 41 LEU HA 1.0 1.8 3.55 814 614 A 41 LEU HA A 42 GLY H 1.0 1.8 3.38 815 615 A 41 LEU HBy A 43 ASP HBy 1.0 1.8 5.75 816 615 A 43 ASP HBx A 41 LEU HBy 1.0 1.8 5.75 817 615 A 43 ASP HBx A 41 LEU HBx 1.0 1.8 5.75 818 615 A 41 LEU HBx A 43 ASP HBy 1.0 1.8 5.75 819 616 A 48 ILE HG2% A 41 LEU HBy 1.0 1.8 5.00 820 616 A 48 ILE HG2% A 41 LEU HBx 1.0 1.8 5.00 821 617 A 83 VAL HGy% A 41 LEU HBy 1.0 1.8 5.00 822 617 A 41 LEU HBx A 83 VAL HGy% 1.0 1.8 5.00 823 618 A 41 LEU HDx% A 41 LEU HBy 1.0 1.8 4.20 824 619 A 41 LEU HDy% A 41 LEU HBy 1.0 1.8 3.41 825 620 A 42 GLY H A 41 LEU HBy 1.0 1.8 4.11 826 621 A 41 LEU HDx% A 41 LEU HBx 1.0 1.8 3.67 827 622 A 42 GLY H A 41 LEU HBx 1.0 1.8 4.36 828 623 A 41 LEU HDx% A 42 GLY H 1.0 1.8 5.50 829 624 A 48 ILE HG2% A 41 LEU HDx% 1.0 1.8 5.00 830 625 A 41 LEU HDx% A 50 PHE HBx 1.0 1.8 5.00 831 626 A 41 LEU HDx% A 50 PHE HD% 1.0 1.8 5.00 832 627 A 69 LEU HDx% A 41 LEU HDx% 1.0 1.8 5.50 833 628 A 41 LEU HDx% A 69 LEU HDy% 1.0 1.8 5.50 834 629 A 41 LEU HDx% A 83 VAL HGy% 1.0 1.8 5.00 835 630 A 41 LEU HDx% A 85 VAL HGy% 1.0 1.8 5.00 836 631 A 41 LEU HDy% A 42 GLY H 1.0 1.8 4.07 837 632 A 41 LEU HDy% A 50 PHE HD% 1.0 1.8 5.00 838 633 A 41 LEU HDy% A 50 PHE HE% 1.0 1.8 5.00 839 634 A 41 LEU HDy% A 61 LEU HDy% 1.0 1.8 5.00 840 635 A 69 LEU HDx% A 41 LEU HDy% 1.0 1.8 5.50 841 636 A 41 LEU H A 41 LEU HBx 1.0 1.8 4.03 842 637 A 41 LEU HDx% A 41 LEU H 1.0 1.8 4.74 843 638 A 41 LEU HDy% A 41 LEU H 1.0 1.8 4.61 844 639 A 42 GLY H A 41 LEU H 1.0 1.8 5.03 845 640 A 47 ILE HA A 41 LEU H 1.0 1.8 5.78 846 641 A 41 LEU H A 49 LYS HA 1.0 1.8 4.73 847 642 A 41 LEU H A 49 LYS H 1.0 1.8 6.05 848 643 A 41 LEU H A 50 PHE HD% 1.0 1.8 5.00 849 644 A 41 LEU H A 50 PHE H 1.0 1.8 5.22 850 645 A 43 ASP H A 42 GLY HAy 1.0 1.8 3.70 851 646 A 47 ILE HA A 42 GLY HAy 1.0 1.8 5.00 852 647 A 47 ILE HG2% A 42 GLY HAy 1.0 1.8 5.00 853 648 A 100 VAL HGx% A 42 GLY HAy 1.0 1.8 5.00 854 649 A 43 ASP H A 42 GLY HAx 1.0 1.8 3.74 855 650 A 47 ILE HA A 42 GLY HAx 1.0 1.8 5.00 856 651 A 47 ILE HG2% A 42 GLY HAx 1.0 1.8 5.00 857 652 A 42 GLY HAx A 100 VAL HGx% 1.0 1.8 5.00 858 653 A 43 ASP H A 42 GLY H 1.0 1.8 4.71 859 654 A 98 ILE HD1% A 43 ASP HA 1.0 1.8 5.00 860 655 A 98 ILE HG2% A 43 ASP HA 1.0 1.8 5.00 861 656 A 43 ASP HA A 100 VAL HA 1.0 1.8 5.97 862 657 A 43 ASP HA A 100 VAL HGx% 1.0 1.8 5.00 863 658 A 98 ILE HG2% A 43 ASP HBy 1.0 1.8 5.00 864 658 A 43 ASP HBx A 98 ILE HG2% 1.0 1.8 5.00 865 659 A 44 GLU H A 43 ASP HBy 1.0 1.8 4.41 866 660 A 45 THR H A 43 ASP HBy 1.0 1.8 5.31 867 661 A 43 ASP HBx A 44 GLU H 1.0 1.8 4.41 868 662 A 43 ASP HBx A 45 THR H 1.0 1.8 5.31 869 663 A 43 ASP H A 44 GLU H 1.0 1.8 5.32 870 664 A 43 ASP H A 45 THR H 1.0 1.8 4.94 871 665 A 46 GLY H A 43 ASP H 1.0 1.8 3.67 872 666 A 43 ASP H A 47 ILE HA 1.0 1.8 5.06 873 667 A 43 ASP H A 47 ILE HG2% 1.0 1.8 5.00 874 668 A 43 ASP H A 100 VAL HGx% 1.0 1.8 5.00 875 669 A 100 VAL HA A 44 GLU HA 1.0 1.8 4.25 876 670 A 100 VAL HGx% A 44 GLU HA 1.0 1.8 5.00 877 671 A 45 THR H A 44 GLU HBy 1.0 1.8 5.21 878 672 A 45 THR H A 44 GLU HBx 1.0 1.8 5.21 879 673 A 45 THR H A 44 GLU HGy 1.0 1.8 4.92 880 673 A 45 THR H A 44 GLU HGx 1.0 1.8 4.92 881 674 A 44 GLU H A 44 GLU HBx 1.0 1.8 3.71 882 674 A 44 GLU H A 44 GLU HBy 1.0 1.8 3.71 883 675 A 44 GLU H A 44 GLU HBy 1.0 1.8 4.22 884 676 A 44 GLU H A 44 GLU HBx 1.0 1.8 4.22 885 677 A 44 GLU H A 44 GLU HGy 1.0 1.8 4.09 886 677 A 44 GLU H A 44 GLU HGx 1.0 1.8 4.09 887 678 A 44 GLU H A 44 GLU HGy 1.0 1.8 4.74 888 679 A 44 GLU H A 44 GLU HGx 1.0 1.8 4.74 889 680 A 45 THR H A 44 GLU H 1.0 1.8 4.20 890 681 A 46 GLY H A 44 GLU H 1.0 1.8 5.59 891 682 A 44 GLU H A 98 ILE HG2% 1.0 1.8 5.00 892 683 A 45 THR HG2% A 45 THR HA 1.0 1.8 3.45 893 684 A 46 GLY H A 45 THR HB 1.0 1.8 4.49 894 685 A 45 THR HG2% A 46 GLY H 1.0 1.8 4.32 895 686 A 45 THR HG2% A 45 THR H 1.0 1.8 3.58 896 687 A 46 GLY H A 45 THR H 1.0 1.8 3.03 897 688 A 47 ILE H A 46 GLY HAx 1.0 1.8 3.10 898 688 A 47 ILE H A 46 GLY HAy 1.0 1.8 3.10 899 689 A 46 GLY H A 47 ILE H 1.0 1.8 4.96 900 690 A 47 ILE HA A 47 ILE HD1% 1.0 1.8 4.64 901 691 A 47 ILE HA A 47 ILE HG2% 1.0 1.8 3.73 902 692 A 47 ILE HA A 48 ILE H 1.0 1.8 3.50 903 693 A 47 ILE HB A 47 ILE HD1% 1.0 1.8 3.77 904 694 A 48 ILE H A 47 ILE HB 1.0 1.8 4.46 905 695 A 48 ILE H A 47 ILE HG1x 1.0 1.8 5.16 906 695 A 48 ILE H A 47 ILE HG1y 1.0 1.8 5.16 907 696 A 47 ILE HG2% A 47 ILE HG1x 1.0 1.8 3.74 908 696 A 47 ILE HG2% A 47 ILE HG1y 1.0 1.8 3.74 909 697 A 48 ILE H A 47 ILE HG2% 1.0 1.8 4.37 910 698 A 47 ILE H A 47 ILE HB 1.0 1.8 4.29 911 699 A 47 ILE H A 47 ILE HD1% 1.0 1.8 4.63 912 700 A 47 ILE H A 47 ILE HG1x 1.0 1.8 4.19 913 700 A 47 ILE H A 47 ILE HG1y 1.0 1.8 4.19 914 701 A 47 ILE H A 47 ILE HG2% 1.0 1.8 4.16 915 702 A 48 ILE H A 47 ILE H 1.0 1.8 5.28 916 703 A 48 ILE HA A 48 ILE HD1% 1.0 1.8 4.37 917 704 A 48 ILE HA A 48 ILE HG1y 1.0 1.8 3.67 918 705 A 48 ILE HA A 48 ILE HG1x 1.0 1.8 3.92 919 706 A 48 ILE HA A 49 LYS H 1.0 1.8 3.49 920 707 A 48 ILE HB A 49 LYS H 1.0 1.8 5.12 921 708 A 48 ILE HD1% A 49 LYS H 1.0 1.8 4.50 922 709 A 48 ILE HD1% A 81 PHE HBy 1.0 1.8 5.00 923 710 A 48 ILE HD1% A 81 PHE HBx 1.0 1.8 5.00 924 711 A 48 ILE HD1% A 82 GLN HA 1.0 1.8 5.00 925 712 A 48 ILE HD1% A 82 GLN H 1.0 1.8 5.00 926 713 A 48 ILE HD1% A 83 VAL HGx% 1.0 1.8 5.00 927 714 A 48 ILE HD1% A 83 VAL HGy% 1.0 1.8 5.00 928 715 A 48 ILE HD1% A 83 VAL H 1.0 1.8 5.00 929 716 A 49 LYS H A 48 ILE HG1y 1.0 1.8 4.06 930 717 A 49 LYS H A 48 ILE HG1x 1.0 1.8 4.06 931 718 A 48 ILE HD1% A 48 ILE HG2% 1.0 1.8 3.25 932 719 A 48 ILE HG2% A 48 ILE HG1x 1.0 1.8 4.13 933 720 A 48 ILE HG2% A 49 LYS H 1.0 1.8 4.50 934 721 A 48 ILE H A 48 ILE HD1% 1.0 1.8 6.00 935 722 A 48 ILE H A 48 ILE HG2% 1.0 1.8 3.64 936 723 A 48 ILE H A 49 LYS H 1.0 1.8 6.05 937 724 A 49 LYS HA A 49 LYS HDy 1.0 1.8 4.33 938 724 A 49 LYS HA A 49 LYS HDx 1.0 1.8 4.33 939 725 A 49 LYS HA A 49 LYS HDy 1.0 1.8 4.96 940 726 A 49 LYS HA A 49 LYS HDx 1.0 1.8 4.96 941 727 A 49 LYS HA A 49 LYS HEx 1.0 1.8 4.93 942 727 A 49 LYS HA A 49 LYS HEy 1.0 1.8 4.93 943 728 A 50 PHE H A 49 LYS HA 1.0 1.8 3.26 944 729 A 49 LYS HBy A 49 LYS HDy 1.0 1.8 3.62 945 729 A 49 LYS HBx A 49 LYS HDy 1.0 1.8 3.62 946 729 A 49 LYS HDx A 49 LYS HBx 1.0 1.8 3.62 947 729 A 49 LYS HDx A 49 LYS HBy 1.0 1.8 3.62 948 730 A 49 LYS HBx A 49 LYS HEx 1.0 1.8 4.61 949 730 A 49 LYS HEy A 49 LYS HBx 1.0 1.8 4.61 950 730 A 49 LYS HEy A 49 LYS HBy 1.0 1.8 4.61 951 730 A 49 LYS HBy A 49 LYS HEx 1.0 1.8 4.61 952 731 A 50 PHE H A 49 LYS HDy 1.0 1.8 5.56 953 731 A 50 PHE H A 49 LYS HDx 1.0 1.8 5.56 954 732 A 77 TYR HE% A 49 LYS HEx 1.0 1.8 5.00 955 732 A 49 LYS HEy A 77 TYR HE% 1.0 1.8 5.00 956 733 A 49 LYS HEy A 49 LYS HGy 1.0 1.8 3.67 957 733 A 49 LYS HGx A 49 LYS HEx 1.0 1.8 3.67 958 733 A 49 LYS HEy A 49 LYS HGx 1.0 1.8 3.67 959 733 A 49 LYS HEx A 49 LYS HGy 1.0 1.8 3.67 960 734 A 49 LYS H A 49 LYS HDy 1.0 1.8 4.83 961 734 A 49 LYS H A 49 LYS HDx 1.0 1.8 4.83 962 735 A 49 LYS H A 49 LYS HDy 1.0 1.8 5.57 963 736 A 49 LYS H A 49 LYS HDx 1.0 1.8 5.57 964 737 A 49 LYS H A 49 LYS HGy 1.0 1.8 5.31 965 738 A 49 LYS H A 49 LYS HGx 1.0 1.8 5.31 966 739 A 50 PHE H A 49 LYS H 1.0 1.8 5.28 967 740 A 49 LYS H A 82 GLN HA 1.0 1.8 4.99 968 741 A 50 PHE HD% A 50 PHE HA 1.0 1.8 5.01 969 742 A 50 PHE HA A 51 THR H 1.0 1.8 3.42 970 743 A 83 VAL HGy% A 50 PHE HA 1.0 1.8 5.00 971 744 A 83 VAL H A 50 PHE HA 1.0 1.8 5.00 972 745 A 51 THR H A 50 PHE HBy 1.0 1.8 4.32 973 746 A 50 PHE HBx A 51 THR H 1.0 1.8 4.26 974 747 A 50 PHE HD% A 51 THR H 1.0 1.8 4.50 975 748 A 52 ILE HD1% A 50 PHE HD% 1.0 1.8 5.00 976 749 A 50 PHE HD% A 52 ILE HG1x 1.0 1.8 5.00 977 750 A 52 ILE H A 50 PHE HD% 1.0 1.8 5.38 978 751 A 50 PHE HD% A 85 VAL HGy% 1.0 1.8 5.00 979 752 A 50 PHE HE% A 52 ILE HD1% 1.0 1.8 5.00 980 753 A 50 PHE HE% A 52 ILE HG1x 1.0 1.8 5.00 981 754 A 50 PHE HE% A 52 ILE H 1.0 1.8 6.05 982 755 A 50 PHE HE% A 61 LEU HDy% 1.0 1.8 5.00 983 756 A 50 PHE H A 50 PHE HD% 1.0 1.8 3.92 984 757 A 50 PHE HE% A 50 PHE H 1.0 1.8 5.22 985 758 A 50 PHE H A 51 THR H 1.0 1.8 5.02 986 759 A 50 PHE HZ A 61 LEU HDy% 1.0 1.8 5.00 987 760 A 51 THR HG2% A 51 THR HA 1.0 1.8 3.94 988 761 A 52 ILE H A 51 THR HA 1.0 1.8 3.32 989 762 A 52 ILE H A 51 THR HB 1.0 1.8 4.75 990 763 A 51 THR HB A 84 GLN HA 1.0 1.8 5.00 991 764 A 51 THR HG2% A 52 ILE H 1.0 1.8 3.98 992 765 A 53 TRP HA A 51 THR HG2% 1.0 1.8 5.51 993 766 A 51 THR H A 51 THR HB 1.0 1.8 4.02 994 767 A 51 THR HG2% A 51 THR H 1.0 1.8 4.73 995 768 A 52 ILE H A 51 THR H 1.0 1.8 5.07 996 769 A 51 THR H A 84 GLN HA 1.0 1.8 4.16 997 770 A 85 VAL HGy% A 51 THR H 1.0 1.8 5.00 998 771 A 51 THR H A 85 VAL H 1.0 1.8 4.86 999 772 A 52 ILE HD1% A 52 ILE HA 1.0 1.8 5.30 1000 773 A 52 ILE HG2% A 52 ILE HA 1.0 1.8 3.29 1001 774 A 52 ILE HA A 53 TRP H 1.0 1.8 3.42 1002 775 A 52 ILE HA A 85 VAL HB 1.0 1.8 5.00 1003 776 A 52 ILE HA A 85 VAL HGx% 1.0 1.8 5.00 1004 777 A 85 VAL HGy% A 52 ILE HA 1.0 1.8 5.00 1005 778 A 85 VAL H A 52 ILE HA 1.0 1.8 5.00 1006 779 A 61 LEU HDx% A 52 ILE HD1% 1.0 1.8 5.00 1007 780 A 61 LEU HDy% A 52 ILE HD1% 1.0 1.8 5.00 1008 781 A 52 ILE HD1% A 85 VAL HB 1.0 1.8 5.00 1009 782 A 52 ILE HD1% A 85 VAL HGx% 1.0 1.8 5.00 1010 783 A 52 ILE HG1y A 52 ILE HG2% 1.0 1.8 4.32 1011 784 A 52 ILE HG2% A 52 ILE HG1x 1.0 1.8 4.49 1012 785 A 52 ILE HG2% A 53 TRP H 1.0 1.8 4.03 1013 786 A 52 ILE HG2% A 54 LYS HA 1.0 1.8 5.00 1014 787 A 52 ILE HG2% A 58 LEU HBx 1.0 1.8 5.00 1015 787 A 52 ILE HG2% A 58 LEU HBy 1.0 1.8 5.00 1016 788 A 52 ILE HG2% A 58 LEU HDx% 1.0 1.8 5.50 1017 789 A 61 LEU HDx% A 52 ILE HG2% 1.0 1.8 5.00 1018 790 A 52 ILE HG2% A 85 VAL HB 1.0 1.8 5.00 1019 791 A 52 ILE H A 52 ILE HB 1.0 1.8 3.84 1020 792 A 52 ILE H A 52 ILE HD1% 1.0 1.8 4.65 1021 793 A 52 ILE H A 52 ILE HG1x 1.0 1.8 4.36 1022 794 A 52 ILE H A 53 TRP H 1.0 1.8 5.27 1023 795 A 53 TRP HA A 53 TRP HE3 1.0 1.8 4.61 1024 796 A 54 LYS H A 53 TRP HA 1.0 1.8 3.75 1025 797 A 53 TRP HE3 A 53 TRP HBy 1.0 1.8 4.55 1026 798 A 54 LYS H A 53 TRP HBy 1.0 1.8 4.54 1027 799 A 53 TRP HBx A 53 TRP HD1 1.0 1.8 4.11 1028 800 A 53 TRP HBx A 53 TRP HE1 1.0 1.8 5.37 1029 801 A 54 LYS H A 53 TRP HBx 1.0 1.8 4.81 1030 802 A 53 TRP HD1 A 86 ASN HA 1.0 1.8 5.00 1031 803 A 73 VAL HGx% A 53 TRP HE1 1.0 1.8 6.00 1032 804 A 84 GLN HA A 53 TRP HE1 1.0 1.8 5.00 1033 805 A 53 TRP HE1 A 84 GLN HBy 1.0 1.8 5.00 1034 806 A 53 TRP HE1 A 84 GLN HBx 1.0 1.8 5.00 1035 807 A 53 TRP HE1 A 84 GLN HGx 1.0 1.8 5.00 1036 808 A 53 TRP H A 53 TRP HBy 1.0 1.8 4.25 1037 809 A 53 TRP H A 53 TRP HBx 1.0 1.8 3.92 1038 810 A 53 TRP H A 53 TRP HD1 1.0 1.8 4.26 1039 811 A 53 TRP H A 53 TRP HE1 1.0 1.8 5.47 1040 812 A 53 TRP HE3 A 53 TRP H 1.0 1.8 5.71 1041 813 A 54 LYS H A 53 TRP H 1.0 1.8 5.02 1042 814 A 85 VAL H A 53 TRP H 1.0 1.8 5.57 1043 815 A 53 TRP H A 86 ASN HA 1.0 1.8 5.06 1044 816 A 54 LYS HA A 54 LYS HDy 1.0 1.8 5.92 1045 817 A 54 LYS HA A 54 LYS HEy 1.0 1.8 6.05 1046 818 A 54 LYS HA A 54 LYS HEx 1.0 1.8 6.05 1047 819 A 54 LYS HA A 54 LYS HGy 1.0 1.8 4.30 1048 820 A 54 LYS HGx A 54 LYS HA 1.0 1.8 4.49 1049 821 A 54 LYS HA A 55 ASN H 1.0 1.8 3.75 1050 822 A 54 LYS HA A 56 ALA H 1.0 1.8 5.03 1051 823 A 54 LYS HA A 57 GLU H 1.0 1.8 4.58 1052 824 A 54 LYS HA A 58 LEU H 1.0 1.8 5.08 1053 825 A 54 LYS HDy A 54 LYS HBx 1.0 1.8 4.35 1054 825 A 54 LYS HDy A 54 LYS HBy 1.0 1.8 4.35 1055 826 A 54 LYS HDx A 54 LYS HBx 1.0 1.8 4.41 1056 826 A 54 LYS HBy A 54 LYS HDx 1.0 1.8 4.41 1057 827 A 54 LYS HBy A 54 LYS HEx 1.0 1.8 4.85 1058 827 A 54 LYS HBx A 54 LYS HEx 1.0 1.8 4.85 1059 827 A 54 LYS HEy A 54 LYS HBx 1.0 1.8 4.85 1060 827 A 54 LYS HBy A 54 LYS HEy 1.0 1.8 4.85 1061 828 A 56 ALA HB% A 54 LYS HBx 1.0 1.8 6.80 1062 828 A 54 LYS HBy A 56 ALA HB% 1.0 1.8 6.80 1063 829 A 56 ALA H A 54 LYS HBx 1.0 1.8 5.15 1064 829 A 56 ALA H A 54 LYS HBy 1.0 1.8 5.15 1065 830 A 54 LYS HGx A 54 LYS HEy 1.0 1.8 3.99 1066 830 A 54 LYS HGx A 54 LYS HEx 1.0 1.8 3.99 1067 831 A 54 LYS HGx A 54 LYS HEy 1.0 1.8 4.62 1068 832 A 54 LYS HGx A 54 LYS HEx 1.0 1.8 4.62 1069 833 A 54 LYS H A 54 LYS HDy 1.0 1.8 5.44 1070 834 A 54 LYS H A 54 LYS HDx 1.0 1.8 5.61 1071 835 A 54 LYS H A 55 ASN H 1.0 1.8 5.02 1072 836 A 55 ASN HA A 55 ASN HD2y 1.0 1.8 4.91 1073 836 A 55 ASN HA A 55 ASN HD2x 1.0 1.8 4.91 1074 837 A 55 ASN HBy A 55 ASN HD2x 1.0 1.8 3.48 1075 837 A 55 ASN HD2y A 55 ASN HBy 1.0 1.8 3.48 1076 837 A 55 ASN HBx A 55 ASN HD2x 1.0 1.8 3.48 1077 837 A 55 ASN HBx A 55 ASN HD2y 1.0 1.8 3.48 1078 838 A 56 ALA H A 55 ASN HBy 1.0 1.8 5.20 1079 839 A 56 ALA H A 55 ASN HBx 1.0 1.8 5.20 1080 840 A 55 ASN H A 55 ASN HD2y 1.0 1.8 4.98 1081 840 A 55 ASN H A 55 ASN HD2x 1.0 1.8 4.98 1082 841 A 55 ASN H A 55 ASN HD2y 1.0 1.8 5.73 1083 842 A 55 ASN H A 56 ALA H 1.0 1.8 4.17 1084 843 A 55 ASN H A 57 GLU H 1.0 1.8 5.20 1085 844 A 57 GLU H A 56 ALA HB% 1.0 1.8 3.64 1086 845 A 56 ALA HB% A 58 LEU HA 1.0 1.8 5.95 1087 846 A 58 LEU HDx% A 56 ALA HB% 1.0 1.8 5.00 1088 847 A 56 ALA HB% A 58 LEU HDy% 1.0 1.8 5.00 1089 848 A 56 ALA HB% A 58 LEU HG 1.0 1.8 5.00 1090 849 A 56 ALA H A 56 ALA HB% 1.0 1.8 3.01 1091 850 A 56 ALA H A 57 GLU H 1.0 1.8 4.02 1092 851 A 58 LEU HDx% A 56 ALA H 1.0 1.8 6.10 1093 852 A 56 ALA H A 87 LYS HA 1.0 1.8 5.53 1094 853 A 57 GLU HA A 57 GLU HGx 1.0 1.8 3.32 1095 853 A 57 GLU HA A 57 GLU HGy 1.0 1.8 3.32 1096 854 A 58 LEU H A 57 GLU HA 1.0 1.8 3.72 1097 855 A 58 LEU H A 57 GLU HBx 1.0 1.8 4.10 1098 855 A 58 LEU H A 57 GLU HBy 1.0 1.8 4.10 1099 856 A 57 GLU H A 57 GLU HA 1.0 1.8 2.93 1100 857 A 57 GLU H A 57 GLU HGx 1.0 1.8 3.38 1101 857 A 57 GLU H A 57 GLU HGy 1.0 1.8 3.38 1102 858 A 58 LEU HDx% A 58 LEU HA 1.0 1.8 4.40 1103 859 A 58 LEU HA A 58 LEU HDy% 1.0 1.8 3.23 1104 860 A 58 LEU HDx% A 58 LEU HBx 1.0 1.8 3.22 1105 860 A 58 LEU HBy A 58 LEU HDx% 1.0 1.8 3.22 1106 861 A 58 LEU HDy% A 58 LEU HBx 1.0 1.8 3.20 1107 861 A 58 LEU HBy A 58 LEU HDy% 1.0 1.8 3.20 1108 862 A 91 ILE HD1% A 58 LEU HBx 1.0 1.8 5.00 1109 862 A 58 LEU HBy A 91 ILE HD1% 1.0 1.8 5.00 1110 863 A 58 LEU HDx% A 89 SER HBy 1.0 1.8 5.00 1111 863 A 58 LEU HDx% A 89 SER HBx 1.0 1.8 5.00 1112 864 A 58 LEU HDx% A 89 SER H 1.0 1.8 5.00 1113 865 A 58 LEU HDx% A 90 SER HA 1.0 1.8 5.00 1114 866 A 58 LEU HDy% A 90 SER HA 1.0 1.8 5.00 1115 867 A 58 LEU HDy% A 91 ILE HB 1.0 1.8 5.30 1116 868 A 58 LEU HDy% A 91 ILE HD1% 1.0 1.8 5.00 1117 869 A 58 LEU HDy% A 91 ILE H 1.0 1.8 5.00 1118 870 A 58 LEU H A 58 LEU HBx 1.0 1.8 3.00 1119 870 A 58 LEU HBy A 58 LEU H 1.0 1.8 3.00 1120 871 A 58 LEU HDx% A 58 LEU H 1.0 1.8 4.55 1121 872 A 58 LEU H A 58 LEU HDy% 1.0 1.8 4.96 1122 873 A 58 LEU H A 58 LEU HG 1.0 1.8 4.26 1123 874 A 59 PRO HA A 60 LEU H 1.0 1.8 2.78 1124 875 A 60 LEU H A 59 PRO HBx 1.0 1.8 3.82 1125 875 A 60 LEU H A 59 PRO HBy 1.0 1.8 3.82 1126 876 A 91 ILE HD1% A 59 PRO HDx 1.0 1.8 5.00 1127 877 A 60 LEU HA A 60 LEU HDx% 1.0 1.8 4.35 1128 878 A 60 LEU HDy% A 60 LEU HA 1.0 1.8 3.20 1129 879 A 61 LEU H A 60 LEU HA 1.0 1.8 3.26 1130 880 A 60 LEU HBy A 60 LEU HDx% 1.0 1.8 3.97 1131 881 A 60 LEU HDy% A 60 LEU HBy 1.0 1.8 3.75 1132 882 A 61 LEU H A 60 LEU HBy 1.0 1.8 3.94 1133 883 A 60 LEU HDx% A 60 LEU HBx 1.0 1.8 3.59 1134 884 A 60 LEU HDy% A 60 LEU HBx 1.0 1.8 3.92 1135 885 A 61 LEU H A 60 LEU HBx 1.0 1.8 4.60 1136 886 A 61 LEU H A 60 LEU HDx% 1.0 1.8 5.05 1137 887 A 61 LEU H A 60 LEU HDy% 1.0 1.8 3.83 1138 888 A 61 LEU H A 60 LEU HG 1.0 1.8 5.80 1139 889 A 60 LEU HBy A 60 LEU H 1.0 1.8 4.04 1140 890 A 60 LEU H A 60 LEU HDx% 1.0 1.8 4.32 1141 891 A 60 LEU HDy% A 60 LEU H 1.0 1.8 3.63 1142 892 A 60 LEU H A 60 LEU HG 1.0 1.8 3.03 1143 893 A 61 LEU H A 60 LEU H 1.0 1.8 5.14 1144 894 A 61 LEU HA A 61 LEU HDx% 1.0 1.8 3.53 1145 895 A 61 LEU HDy% A 61 LEU HA 1.0 1.8 4.64 1146 896 A 61 LEU HA A 61 LEU HG 1.0 1.8 4.05 1147 897 A 61 LEU HA A 62 GLU H 1.0 1.8 3.34 1148 898 A 61 LEU HBy A 61 LEU HDx% 1.0 1.8 3.95 1149 899 A 61 LEU HDy% A 61 LEU HBy 1.0 1.8 3.88 1150 900 A 61 LEU HBy A 62 GLU H 1.0 1.8 4.04 1151 901 A 61 LEU HBy A 67 TYR HE% 1.0 1.8 5.00 1152 902 A 61 LEU HDx% A 61 LEU HBx 1.0 1.8 3.81 1153 903 A 61 LEU HDy% A 61 LEU HBx 1.0 1.8 3.97 1154 904 A 62 GLU H A 61 LEU HBx 1.0 1.8 4.69 1155 905 A 61 LEU HDx% A 62 GLU H 1.0 1.8 4.98 1156 906 A 61 LEU HDx% A 69 LEU HDy% 1.0 1.8 5.50 1157 907 A 61 LEU HDx% A 91 ILE HB 1.0 1.8 5.00 1158 908 A 61 LEU HDx% A 91 ILE HD1% 1.0 1.8 5.00 1159 909 A 61 LEU HDx% A 91 ILE HG1x 1.0 1.8 5.00 1160 909 A 61 LEU HDx% A 91 ILE HG1y 1.0 1.8 5.00 1161 910 A 61 LEU HDx% A 91 ILE HG2% 1.0 1.8 5.00 1162 911 A 61 LEU HDy% A 62 GLU H 1.0 1.8 4.85 1163 912 A 69 LEU HDx% A 61 LEU HDy% 1.0 1.8 5.50 1164 913 A 61 LEU HDy% A 69 LEU HDy% 1.0 1.8 5.50 1165 914 A 61 LEU HDy% A 85 VAL HGy% 1.0 1.8 5.00 1166 915 A 61 LEU HDy% A 91 ILE HD1% 1.0 1.8 5.00 1167 916 A 61 LEU HDy% A 91 ILE HG2% 1.0 1.8 5.00 1168 917 A 61 LEU HG A 62 GLU H 1.0 1.8 4.95 1169 918 A 61 LEU H A 61 LEU HBx 1.0 1.8 4.06 1170 919 A 61 LEU HDx% A 61 LEU H 1.0 1.8 4.33 1171 920 A 61 LEU HDy% A 61 LEU H 1.0 1.8 4.54 1172 921 A 61 LEU HG A 61 LEU H 1.0 1.8 4.60 1173 922 A 62 GLU H A 61 LEU H 1.0 1.8 5.21 1174 923 A 62 GLU HA A 62 GLU HGx 1.0 1.8 3.64 1175 923 A 62 GLU HA A 62 GLU HGy 1.0 1.8 3.64 1176 924 A 62 GLU HA A 63 GLN H 1.0 1.8 2.97 1177 925 A 63 GLN H A 62 GLU HBy 1.0 1.8 5.06 1178 926 A 63 GLN H A 62 GLU HBx 1.0 1.8 5.06 1179 927 A 63 GLN H A 62 GLU HGx 1.0 1.8 4.60 1180 927 A 63 GLN H A 62 GLU HGy 1.0 1.8 4.60 1181 928 A 62 GLU H A 62 GLU HBx 1.0 1.8 3.69 1182 928 A 62 GLU H A 62 GLU HBy 1.0 1.8 3.69 1183 929 A 62 GLU H A 62 GLU HGx 1.0 1.8 4.77 1184 929 A 62 GLU H A 62 GLU HGy 1.0 1.8 4.77 1185 930 A 62 GLU H A 63 GLN H 1.0 1.8 5.07 1186 931 A 65 GLU H A 62 GLU H 1.0 1.8 6.05 1187 932 A 62 GLU H A 67 TYR HE% 1.0 1.8 5.00 1188 933 A 63 GLN HA A 63 GLN HE2y 1.0 1.8 5.56 1189 934 A 63 GLN HA A 63 GLN HGy 1.0 1.8 4.21 1190 935 A 63 GLN HA A 63 GLN HGx 1.0 1.8 4.27 1191 936 A 63 GLN HA A 64 GLY H 1.0 1.8 3.12 1192 937 A 63 GLN HA A 65 GLU H 1.0 1.8 4.07 1193 938 A 63 GLN HE2x A 63 GLN HBx 1.0 1.8 4.98 1194 938 A 63 GLN HBy A 63 GLN HE2x 1.0 1.8 4.98 1195 939 A 64 GLY H A 63 GLN HBx 1.0 1.8 4.55 1196 939 A 64 GLY H A 63 GLN HBy 1.0 1.8 4.55 1197 940 A 64 GLY H A 63 GLN HE2y 1.0 1.8 5.85 1198 940 A 64 GLY H A 63 GLN HE2x 1.0 1.8 5.85 1199 941 A 64 GLY H A 63 GLN HGy 1.0 1.8 4.89 1200 942 A 64 GLY H A 63 GLN HGx 1.0 1.8 4.09 1201 943 A 63 GLN HGy A 63 GLN H 1.0 1.8 5.08 1202 944 A 63 GLN H A 63 GLN HGx 1.0 1.8 5.06 1203 945 A 64 GLY H A 63 GLN H 1.0 1.8 5.17 1204 946 A 65 GLU H A 63 GLN H 1.0 1.8 5.73 1205 947 A 64 GLY H A 65 GLU H 1.0 1.8 3.58 1206 948 A 65 GLU HA A 65 GLU HGx 1.0 1.8 3.95 1207 948 A 65 GLU HA A 65 GLU HGy 1.0 1.8 3.95 1208 949 A 66 SER H A 65 GLU HA 1.0 1.8 3.22 1209 950 A 66 SER H A 65 GLU HBy 1.0 1.8 3.73 1210 951 A 67 TYR HE% A 65 GLU HBy 1.0 1.8 5.00 1211 952 A 65 GLU HBy A 93 LYS HGy 1.0 1.8 5.00 1212 952 A 65 GLU HBy A 93 LYS HGx 1.0 1.8 5.00 1213 953 A 67 TYR HE% A 65 GLU HBx 1.0 1.8 5.00 1214 954 A 66 SER H A 65 GLU HGx 1.0 1.8 5.82 1215 954 A 66 SER H A 65 GLU HGy 1.0 1.8 5.82 1216 955 A 65 GLU H A 65 GLU HBx 1.0 1.8 3.42 1217 956 A 65 GLU H A 65 GLU HGx 1.0 1.8 4.30 1218 956 A 65 GLU H A 65 GLU HGy 1.0 1.8 4.30 1219 957 A 66 SER H A 65 GLU H 1.0 1.8 4.82 1220 958 A 65 GLU H A 67 TYR HD% 1.0 1.8 6.00 1221 959 A 65 GLU H A 67 TYR HE% 1.0 1.8 6.10 1222 960 A 67 TYR H A 66 SER HA 1.0 1.8 3.29 1223 961 A 98 ILE HD1% A 66 SER HA 1.0 1.8 5.00 1224 962 A 67 TYR H A 66 SER HBy 1.0 1.8 4.10 1225 962 A 67 TYR H A 66 SER HBx 1.0 1.8 4.10 1226 963 A 94 LEU HBx A 66 SER HBy 1.0 1.8 5.00 1227 963 A 66 SER HBx A 94 LEU HBx 1.0 1.8 5.00 1228 964 A 97 PRO HA A 66 SER HBy 1.0 1.8 5.00 1229 964 A 66 SER HBx A 97 PRO HA 1.0 1.8 5.00 1230 965 A 98 ILE HD1% A 66 SER HBy 1.0 1.8 5.00 1231 965 A 66 SER HBx A 98 ILE HD1% 1.0 1.8 5.00 1232 966 A 66 SER HBx A 98 ILE HG1x 1.0 1.8 5.00 1233 966 A 66 SER HBy A 98 ILE HG1x 1.0 1.8 5.00 1234 966 A 98 ILE HG1y A 66 SER HBy 1.0 1.8 5.00 1235 966 A 66 SER HBx A 98 ILE HG1y 1.0 1.8 5.00 1236 967 A 98 ILE H A 66 SER HBy 1.0 1.8 5.00 1237 967 A 66 SER HBx A 98 ILE H 1.0 1.8 5.00 1238 968 A 94 LEU HBx A 66 SER HBy 1.0 1.8 5.00 1239 969 A 98 ILE HD1% A 66 SER HBy 1.0 1.8 5.00 1240 970 A 98 ILE H A 66 SER HBy 1.0 1.8 5.00 1241 971 A 66 SER HBx A 94 LEU HBx 1.0 1.8 5.00 1242 972 A 66 SER HBx A 98 ILE HD1% 1.0 1.8 5.00 1243 973 A 66 SER HBx A 98 ILE H 1.0 1.8 5.00 1244 974 A 67 TYR H A 66 SER H 1.0 1.8 5.15 1245 975 A 66 SER H A 93 LYS HGy 1.0 1.8 6.00 1246 975 A 66 SER H A 93 LYS HGx 1.0 1.8 6.00 1247 976 A 66 SER H A 94 LEU H 1.0 1.8 5.05 1248 977 A 66 SER H A 97 PRO HBy 1.0 1.8 6.00 1249 977 A 66 SER H A 97 PRO HBx 1.0 1.8 6.00 1250 978 A 67 TYR HD% A 67 TYR HA 1.0 1.8 4.57 1251 979 A 67 TYR HA A 68 LEU H 1.0 1.8 3.33 1252 980 A 67 TYR HA A 93 LYS HA 1.0 1.8 4.29 1253 981 A 67 TYR HA A 94 LEU HDx% 1.0 1.8 5.00 1254 981 A 94 LEU HDy% A 67 TYR HA 1.0 1.8 5.00 1255 982 A 94 LEU H A 67 TYR HA 1.0 1.8 5.00 1256 983 A 68 LEU H A 67 TYR HBy 1.0 1.8 4.28 1257 984 A 69 LEU HDx% A 67 TYR HBy 1.0 1.8 5.47 1258 985 A 69 LEU HDy% A 67 TYR HBy 1.0 1.8 5.00 1259 986 A 67 TYR HBy A 69 LEU HG 1.0 1.8 5.12 1260 987 A 91 ILE HG2% A 67 TYR HBy 1.0 1.8 5.00 1261 988 A 93 LYS HA A 67 TYR HBy 1.0 1.8 5.00 1262 989 A 68 LEU H A 67 TYR HBx 1.0 1.8 4.58 1263 990 A 69 LEU HDx% A 67 TYR HBx 1.0 1.8 5.00 1264 991 A 69 LEU HDy% A 67 TYR HBx 1.0 1.8 5.00 1265 992 A 69 LEU HG A 67 TYR HBx 1.0 1.8 5.12 1266 993 A 91 ILE HG2% A 67 TYR HBx 1.0 1.8 5.00 1267 994 A 67 TYR HD% A 68 LEU H 1.0 1.8 4.57 1268 995 A 69 LEU HDx% A 67 TYR HD% 1.0 1.8 6.05 1269 996 A 67 TYR HD% A 69 LEU HDy% 1.0 1.8 5.30 1270 997 A 67 TYR HD% A 91 ILE HG2% 1.0 1.8 5.00 1271 998 A 67 TYR HD% A 93 LYS HA 1.0 1.8 5.00 1272 999 A 67 TYR HE% A 91 ILE HG2% 1.0 1.8 5.00 1273 1000 A 67 TYR HE% A 93 LYS HA 1.0 1.8 5.00 1274 1001 A 67 TYR HE% A 93 LYS HBx 1.0 1.8 5.00 1275 1001 A 67 TYR HE% A 93 LYS HBy 1.0 1.8 5.00 1276 1002 A 67 TYR HE% A 93 LYS H 1.0 1.8 5.00 1277 1003 A 67 TYR H A 67 TYR HBy 1.0 1.8 4.16 1278 1004 A 67 TYR H A 67 TYR HBx 1.0 1.8 4.27 1279 1005 A 67 TYR H A 67 TYR HD% 1.0 1.8 4.47 1280 1006 A 67 TYR H A 68 LEU H 1.0 1.8 4.97 1281 1007 A 67 TYR H A 93 LYS HA 1.0 1.8 5.68 1282 1008 A 67 TYR H A 94 LEU H 1.0 1.8 5.65 1283 1009 A 68 LEU HDx% A 68 LEU HA 1.0 1.8 3.55 1284 1010 A 68 LEU HDy% A 68 LEU HA 1.0 1.8 4.47 1285 1011 A 69 LEU H A 68 LEU HA 1.0 1.8 3.25 1286 1012 A 68 LEU HDx% A 68 LEU HBy 1.0 1.8 4.09 1287 1013 A 68 LEU HDy% A 68 LEU HBy 1.0 1.8 3.71 1288 1014 A 69 LEU H A 68 LEU HBy 1.0 1.8 5.63 1289 1015 A 68 LEU HBy A 92 GLU H 1.0 1.8 5.00 1290 1016 A 68 LEU HBy A 94 LEU HDx% 1.0 1.8 5.00 1291 1016 A 94 LEU HDy% A 68 LEU HBy 1.0 1.8 5.00 1292 1017 A 68 LEU HDx% A 68 LEU HBx 1.0 1.8 4.47 1293 1018 A 68 LEU HDy% A 68 LEU HBx 1.0 1.8 3.65 1294 1019 A 69 LEU H A 68 LEU HBx 1.0 1.8 5.37 1295 1020 A 68 LEU HBx A 92 GLU HGx 1.0 1.8 5.00 1296 1020 A 68 LEU HBx A 92 GLU HGy 1.0 1.8 5.00 1297 1021 A 92 GLU H A 68 LEU HBx 1.0 1.8 5.00 1298 1022 A 68 LEU HBx A 94 LEU HDx% 1.0 1.8 5.00 1299 1022 A 94 LEU HDy% A 68 LEU HBx 1.0 1.8 5.00 1300 1023 A 68 LEU HDx% A 69 LEU H 1.0 1.8 3.69 1301 1024 A 68 LEU HDx% A 70 ARG HBx 1.0 1.8 5.37 1302 1024 A 68 LEU HDx% A 70 ARG HBy 1.0 1.8 5.37 1303 1025 A 68 LEU HDx% A 70 ARG HDy 1.0 1.8 5.00 1304 1025 A 68 LEU HDx% A 70 ARG HDx 1.0 1.8 5.00 1305 1026 A 68 LEU HDx% A 70 ARG HDy 1.0 1.8 5.00 1306 1027 A 68 LEU HDx% A 70 ARG HDx 1.0 1.8 4.94 1307 1028 A 68 LEU HDx% A 70 ARG HGy 1.0 1.8 5.09 1308 1029 A 68 LEU HDx% A 70 ARG HGx 1.0 1.8 4.95 1309 1030 A 68 LEU HDy% A 69 LEU H 1.0 1.8 5.51 1310 1031 A 68 LEU HDy% A 70 ARG HGy 1.0 1.8 5.01 1311 1032 A 68 LEU HDy% A 70 ARG HGx 1.0 1.8 5.58 1312 1033 A 68 LEU HDy% A 92 GLU HGx 1.0 1.8 5.00 1313 1033 A 68 LEU HDy% A 92 GLU HGy 1.0 1.8 5.00 1314 1034 A 68 LEU HDy% A 94 LEU HDx% 1.0 1.8 5.00 1315 1034 A 68 LEU HDy% A 94 LEU HDy% 1.0 1.8 5.00 1316 1035 A 68 LEU HG A 70 ARG HDy 1.0 1.8 5.06 1317 1035 A 70 ARG HDx A 68 LEU HG 1.0 1.8 5.06 1318 1036 A 68 LEU HG A 70 ARG HDy 1.0 1.8 6.02 1319 1037 A 70 ARG HDx A 68 LEU HG 1.0 1.8 6.02 1320 1038 A 68 LEU HG A 70 ARG HE 1.0 1.8 6.05 1321 1039 A 68 LEU HG A 94 LEU HDx% 1.0 1.8 5.00 1322 1039 A 94 LEU HDy% A 68 LEU HG 1.0 1.8 5.00 1323 1040 A 68 LEU H A 68 LEU HBy 1.0 1.8 3.74 1324 1041 A 68 LEU H A 68 LEU HBx 1.0 1.8 3.78 1325 1042 A 68 LEU HDy% A 68 LEU H 1.0 1.8 4.89 1326 1043 A 68 LEU H A 92 GLU H 1.0 1.8 4.04 1327 1044 A 68 LEU H A 93 LYS H 1.0 1.8 5.79 1328 1045 A 68 LEU H A 94 LEU HDx% 1.0 1.8 5.00 1329 1045 A 94 LEU HDy% A 68 LEU H 1.0 1.8 5.00 1330 1046 A 94 LEU H A 68 LEU H 1.0 1.8 5.65 1331 1047 A 69 LEU HDx% A 69 LEU HA 1.0 1.8 4.44 1332 1048 A 69 LEU HDy% A 69 LEU HA 1.0 1.8 3.89 1333 1049 A 69 LEU HG A 69 LEU HA 1.0 1.8 4.15 1334 1050 A 69 LEU HA A 70 ARG H 1.0 1.8 3.13 1335 1051 A 72 VAL HGx% A 69 LEU HA 1.0 1.8 4.71 1336 1052 A 69 LEU HDx% A 69 LEU HBy 1.0 1.8 3.70 1337 1053 A 69 LEU HDy% A 69 LEU HBy 1.0 1.8 4.07 1338 1054 A 70 ARG H A 69 LEU HBy 1.0 1.8 4.81 1339 1055 A 72 VAL HGx% A 69 LEU HBy 1.0 1.8 5.08 1340 1056 A 72 VAL HGy% A 69 LEU HBy 1.0 1.8 5.53 1341 1057 A 85 VAL HGx% A 69 LEU HBy 1.0 1.8 5.50 1342 1058 A 85 VAL HGy% A 69 LEU HBy 1.0 1.8 5.50 1343 1059 A 69 LEU HBx A 69 LEU HDx% 1.0 1.8 3.45 1344 1060 A 69 LEU HBx A 69 LEU HDy% 1.0 1.8 3.76 1345 1061 A 72 VAL HGx% A 69 LEU HBx 1.0 1.8 5.00 1346 1062 A 72 VAL HGx% A 69 LEU HDx% 1.0 1.8 5.03 1347 1063 A 69 LEU HDx% A 85 VAL HGy% 1.0 1.8 5.00 1348 1064 A 69 LEU HDy% A 70 ARG H 1.0 1.8 5.03 1349 1065 A 72 VAL HGx% A 69 LEU HDy% 1.0 1.8 5.01 1350 1066 A 69 LEU HDy% A 85 VAL HGx% 1.0 1.8 5.00 1351 1067 A 69 LEU HDy% A 85 VAL HGy% 1.0 1.8 5.00 1352 1068 A 69 LEU HDy% A 91 ILE HA 1.0 1.8 5.00 1353 1069 A 69 LEU HDy% A 91 ILE HD1% 1.0 1.8 5.00 1354 1070 A 69 LEU HDy% A 91 ILE HG1x 1.0 1.8 5.00 1355 1071 A 69 LEU HDy% A 91 ILE HG2% 1.0 1.8 5.00 1356 1072 A 69 LEU H A 69 LEU HBy 1.0 1.8 4.05 1357 1073 A 69 LEU HDx% A 69 LEU H 1.0 1.8 3.76 1358 1074 A 69 LEU H A 69 LEU HDy% 1.0 1.8 4.82 1359 1075 A 69 LEU H A 69 LEU HG 1.0 1.8 3.96 1360 1076 A 69 LEU H A 70 ARG H 1.0 1.8 5.08 1361 1077 A 70 ARG HA A 70 ARG HDy 1.0 1.8 4.65 1362 1077 A 70 ARG HA A 70 ARG HDx 1.0 1.8 4.65 1363 1078 A 70 ARG HA A 70 ARG HDy 1.0 1.8 5.47 1364 1079 A 70 ARG HA A 70 ARG HDx 1.0 1.8 5.47 1365 1080 A 70 ARG HA A 70 ARG HGx 1.0 1.8 4.35 1366 1081 A 70 ARG HA A 71 SER H 1.0 1.8 3.41 1367 1082 A 70 ARG HA A 72 VAL HGx% 1.0 1.8 5.05 1368 1083 A 70 ARG HBx A 70 ARG HDy 1.0 1.8 3.87 1369 1083 A 70 ARG HBy A 70 ARG HDy 1.0 1.8 3.87 1370 1084 A 70 ARG HDx A 70 ARG HBx 1.0 1.8 3.87 1371 1084 A 70 ARG HBy A 70 ARG HDx 1.0 1.8 3.87 1372 1085 A 70 ARG HE A 70 ARG HBx 1.0 1.8 4.75 1373 1085 A 70 ARG HBy A 70 ARG HE 1.0 1.8 4.75 1374 1086 A 71 SER H A 70 ARG HBx 1.0 1.8 4.19 1375 1086 A 71 SER H A 70 ARG HBy 1.0 1.8 4.19 1376 1087 A 70 ARG HBx A 90 SER HBx 1.0 1.8 5.00 1377 1087 A 70 ARG HBy A 90 SER HBx 1.0 1.8 5.00 1378 1087 A 90 SER HBy A 70 ARG HBx 1.0 1.8 5.00 1379 1087 A 70 ARG HBy A 90 SER HBy 1.0 1.8 5.00 1380 1088 A 90 SER H A 70 ARG HBx 1.0 1.8 5.00 1381 1088 A 70 ARG HBy A 90 SER H 1.0 1.8 5.00 1382 1089 A 70 ARG HDx A 90 SER HBx 1.0 1.8 5.00 1383 1089 A 70 ARG HDy A 90 SER HBx 1.0 1.8 5.00 1384 1089 A 90 SER HBy A 70 ARG HDy 1.0 1.8 5.00 1385 1089 A 70 ARG HDx A 90 SER HBy 1.0 1.8 5.00 1386 1090 A 71 SER H A 70 ARG HGy 1.0 1.8 5.89 1387 1091 A 71 SER H A 70 ARG HGx 1.0 1.8 5.06 1388 1092 A 70 ARG H A 70 ARG HBx 1.0 1.8 3.64 1389 1092 A 70 ARG HBy A 70 ARG H 1.0 1.8 3.64 1390 1093 A 70 ARG H A 70 ARG HDy 1.0 1.8 5.39 1391 1093 A 70 ARG HDx A 70 ARG H 1.0 1.8 5.39 1392 1094 A 70 ARG HGy A 70 ARG H 1.0 1.8 4.26 1393 1095 A 70 ARG HGx A 70 ARG H 1.0 1.8 4.55 1394 1096 A 70 ARG H A 90 SER HBx 1.0 1.8 5.00 1395 1096 A 70 ARG H A 90 SER HBy 1.0 1.8 5.00 1396 1097 A 72 VAL H A 71 SER HA 1.0 1.8 3.41 1397 1098 A 89 SER HA A 71 SER HBy 1.0 1.8 5.00 1398 1098 A 71 SER HBx A 89 SER HA 1.0 1.8 5.00 1399 1099 A 72 VAL H A 71 SER HBy 1.0 1.8 5.76 1400 1100 A 72 VAL H A 71 SER HBx 1.0 1.8 5.76 1401 1101 A 72 VAL HGx% A 72 VAL HA 1.0 1.8 3.72 1402 1102 A 72 VAL HGy% A 72 VAL HA 1.0 1.8 4.17 1403 1103 A 73 VAL H A 72 VAL HA 1.0 1.8 3.28 1404 1104 A 72 VAL HA A 85 VAL HA 1.0 1.8 4.42 1405 1105 A 72 VAL HA A 86 ASN H 1.0 1.8 5.36 1406 1106 A 73 VAL H A 72 VAL HB 1.0 1.8 3.41 1407 1107 A 85 VAL HGy% A 72 VAL HB 1.0 1.8 5.00 1408 1108 A 73 VAL H A 72 VAL HGx% 1.0 1.8 4.58 1409 1109 A 72 VAL HGx% A 85 VAL HA 1.0 1.8 5.00 1410 1110 A 72 VAL HGx% A 85 VAL HGy% 1.0 1.8 5.00 1411 1111 A 72 VAL HGx% A 89 SER HBy 1.0 1.8 5.00 1412 1112 A 72 VAL HGx% A 89 SER HBx 1.0 1.8 5.00 1413 1113 A 72 VAL HGy% A 73 VAL H 1.0 1.8 4.73 1414 1114 A 72 VAL HGy% A 83 VAL HB 1.0 1.8 5.00 1415 1115 A 83 VAL HGx% A 72 VAL HGy% 1.0 1.8 5.00 1416 1116 A 72 VAL HGy% A 84 GLN H 1.0 1.8 6.00 1417 1117 A 72 VAL HGy% A 85 VAL HA 1.0 1.8 5.50 1418 1118 A 72 VAL H A 72 VAL HGx% 1.0 1.8 3.62 1419 1119 A 72 VAL HGy% A 72 VAL H 1.0 1.8 3.13 1420 1120 A 72 VAL H A 73 VAL H 1.0 1.8 5.05 1421 1121 A 73 VAL HA A 73 VAL HGx% 1.0 1.8 4.07 1422 1122 A 73 VAL HGy% A 73 VAL HA 1.0 1.8 3.88 1423 1123 A 74 VAL H A 73 VAL HA 1.0 1.8 3.44 1424 1124 A 74 VAL H A 73 VAL HGx% 1.0 1.8 4.50 1425 1125 A 73 VAL HGx% A 75 GLY H 1.0 1.8 6.05 1426 1126 A 73 VAL HGx% A 84 GLN HA 1.0 1.8 5.00 1427 1127 A 73 VAL HGx% A 84 GLN HBy 1.0 1.8 5.00 1428 1128 A 73 VAL HGx% A 84 GLN HBx 1.0 1.8 5.00 1429 1129 A 73 VAL HGx% A 84 GLN HE2x 1.0 1.8 5.00 1430 1129 A 73 VAL HGx% A 84 GLN HE2y 1.0 1.8 5.00 1431 1130 A 73 VAL HGx% A 84 GLN HGx 1.0 1.8 5.00 1432 1130 A 73 VAL HGx% A 84 GLN HGy 1.0 1.8 5.00 1433 1131 A 73 VAL HGx% A 84 GLN H 1.0 1.8 5.00 1434 1132 A 73 VAL HGx% A 86 ASN HD2y 1.0 1.8 5.00 1435 1133 A 73 VAL HGx% A 86 ASN HD2x 1.0 1.8 5.00 1436 1134 A 73 VAL HGy% A 74 VAL H 1.0 1.8 4.02 1437 1135 A 73 VAL H A 73 VAL HB 1.0 1.8 4.26 1438 1136 A 73 VAL H A 73 VAL HGx% 1.0 1.8 3.38 1439 1137 A 73 VAL HGy% A 73 VAL H 1.0 1.8 4.25 1440 1138 A 74 VAL H A 73 VAL H 1.0 1.8 5.24 1441 1139 A 73 VAL H A 84 GLN HBx 1.0 1.8 5.00 1442 1140 A 73 VAL H A 84 GLN H 1.0 1.8 4.75 1443 1141 A 73 VAL H A 85 VAL HA 1.0 1.8 4.88 1444 1142 A 73 VAL H A 86 ASN HD2y 1.0 1.8 5.00 1445 1143 A 73 VAL H A 86 ASN H 1.0 1.8 5.90 1446 1144 A 74 VAL HGx% A 74 VAL HA 1.0 1.8 3.58 1447 1145 A 74 VAL HGy% A 74 VAL HA 1.0 1.8 3.94 1448 1146 A 75 GLY H A 74 VAL HA 1.0 1.8 3.36 1449 1147 A 82 GLN H A 74 VAL HA 1.0 1.8 5.79 1450 1148 A 83 VAL H A 74 VAL HA 1.0 1.8 5.86 1451 1149 A 84 GLN H A 74 VAL HA 1.0 1.8 5.00 1452 1150 A 74 VAL HB A 75 GLY H 1.0 1.8 5.32 1453 1151 A 74 VAL HGx% A 75 GLY H 1.0 1.8 3.66 1454 1152 A 74 VAL HGx% A 81 PHE HBy 1.0 1.8 5.00 1455 1153 A 74 VAL HGx% A 81 PHE HBx 1.0 1.8 5.00 1456 1154 A 74 VAL HGx% A 81 PHE HD% 1.0 1.8 5.00 1457 1155 A 74 VAL HGx% A 82 GLN H 1.0 1.8 6.00 1458 1156 A 74 VAL HGy% A 83 VAL HA 1.0 1.8 5.00 1459 1157 A 74 VAL HGy% A 84 GLN H 1.0 1.8 6.00 1460 1158 A 74 VAL HB A 74 VAL H 1.0 1.8 3.71 1461 1159 A 74 VAL HGx% A 74 VAL H 1.0 1.8 4.48 1462 1160 A 75 GLY HAy A 76 GLU H 1.0 1.8 3.45 1463 1161 A 76 GLU H A 75 GLY HAx 1.0 1.8 3.42 1464 1162 A 75 GLY H A 76 GLU H 1.0 1.8 4.86 1465 1163 A 82 GLN H A 75 GLY H 1.0 1.8 4.00 1466 1164 A 75 GLY H A 83 VAL HA 1.0 1.8 5.01 1467 1165 A 76 GLU HA A 77 TYR H 1.0 1.8 3.33 1468 1166 A 76 GLU HA A 81 PHE HA 1.0 1.8 4.22 1469 1167 A 82 GLN H A 76 GLU HA 1.0 1.8 5.14 1470 1168 A 77 TYR H A 76 GLU HBy 1.0 1.8 5.12 1471 1169 A 77 TYR H A 76 GLU HBx 1.0 1.8 5.12 1472 1170 A 77 TYR H A 76 GLU HGx 1.0 1.8 4.29 1473 1170 A 77 TYR H A 76 GLU HGy 1.0 1.8 4.29 1474 1171 A 77 TYR HA A 77 TYR HD% 1.0 1.8 3.65 1475 1172 A 77 TYR HE% A 77 TYR HA 1.0 1.8 5.03 1476 1173 A 77 TYR HA A 78 ASN H 1.0 1.8 3.44 1477 1174 A 77 TYR HBy A 80 ARG HBx 1.0 1.8 5.00 1478 1174 A 77 TYR HBx A 80 ARG HBx 1.0 1.8 5.00 1479 1174 A 80 ARG HBy A 77 TYR HBx 1.0 1.8 5.00 1480 1174 A 77 TYR HBy A 80 ARG HBy 1.0 1.8 5.00 1481 1175 A 80 ARG H A 77 TYR HBx 1.0 1.8 4.66 1482 1175 A 77 TYR HBy A 80 ARG H 1.0 1.8 4.66 1483 1176 A 77 TYR HBy A 82 GLN HGx 1.0 1.8 5.00 1484 1176 A 77 TYR HBx A 82 GLN HGx 1.0 1.8 5.00 1485 1176 A 82 GLN HGy A 77 TYR HBx 1.0 1.8 5.00 1486 1176 A 77 TYR HBy A 82 GLN HGy 1.0 1.8 5.00 1487 1177 A 77 TYR HD% A 78 ASN H 1.0 1.8 5.04 1488 1178 A 77 TYR HD% A 80 ARG HDx 1.0 1.8 6.05 1489 1178 A 77 TYR HD% A 80 ARG HDy 1.0 1.8 6.05 1490 1179 A 77 TYR HD% A 80 ARG HGx 1.0 1.8 5.96 1491 1179 A 77 TYR HD% A 80 ARG HGy 1.0 1.8 5.96 1492 1180 A 77 TYR HD% A 82 GLN HBx 1.0 1.8 5.00 1493 1180 A 77 TYR HD% A 82 GLN HBy 1.0 1.8 5.00 1494 1181 A 77 TYR HD% A 82 GLN HE2y 1.0 1.8 5.00 1495 1182 A 77 TYR HD% A 82 GLN HGx 1.0 1.8 5.00 1496 1182 A 77 TYR HD% A 82 GLN HGy 1.0 1.8 5.00 1497 1183 A 77 TYR HE% A 80 ARG HBx 1.0 1.8 5.87 1498 1183 A 77 TYR HE% A 80 ARG HBy 1.0 1.8 5.87 1499 1184 A 77 TYR H A 77 TYR HD% 1.0 1.8 5.12 1500 1185 A 77 TYR H A 78 ASN H 1.0 1.8 5.20 1501 1186 A 77 TYR H A 81 PHE HA 1.0 1.8 4.19 1502 1187 A 82 GLN H A 77 TYR H 1.0 1.8 4.98 1503 1188 A 78 ASN HD2y A 78 ASN HBy 1.0 1.8 3.44 1504 1188 A 78 ASN HD2x A 78 ASN HBy 1.0 1.8 3.44 1505 1188 A 78 ASN HBx A 78 ASN HD2y 1.0 1.8 3.44 1506 1188 A 78 ASN HBx A 78 ASN HD2x 1.0 1.8 3.44 1507 1189 A 80 ARG H A 78 ASN HBy 1.0 1.8 5.80 1508 1189 A 80 ARG H A 78 ASN HBx 1.0 1.8 5.80 1509 1190 A 79 ASP H A 78 ASN HBy 1.0 1.8 4.65 1510 1191 A 78 ASN HBx A 79 ASP H 1.0 1.8 4.65 1511 1192 A 79 ASP H A 78 ASN HD2y 1.0 1.8 5.21 1512 1192 A 79 ASP H A 78 ASN HD2x 1.0 1.8 5.21 1513 1193 A 79 ASP H A 78 ASN HD2y 1.0 1.8 6.05 1514 1194 A 79 ASP H A 78 ASN HD2x 1.0 1.8 6.05 1515 1195 A 78 ASN H A 79 ASP H 1.0 1.8 4.98 1516 1196 A 80 ARG H A 79 ASP H 1.0 1.8 3.67 1517 1197 A 80 ARG HA A 80 ARG HDx 1.0 1.8 4.23 1518 1197 A 80 ARG HDy A 80 ARG HA 1.0 1.8 4.23 1519 1198 A 80 ARG HA A 81 PHE H 1.0 1.8 3.60 1520 1199 A 81 PHE H A 80 ARG HBx 1.0 1.8 3.69 1521 1199 A 80 ARG HBy A 81 PHE H 1.0 1.8 3.69 1522 1200 A 80 ARG HBy A 80 ARG HDy 1.0 1.8 4.35 1523 1200 A 80 ARG HBy A 80 ARG HDx 1.0 1.8 4.35 1524 1201 A 80 ARG HDy A 80 ARG HBx 1.0 1.8 4.35 1525 1201 A 80 ARG HBx A 80 ARG HDx 1.0 1.8 4.35 1526 1202 A 81 PHE H A 80 ARG HDx 1.0 1.8 4.93 1527 1202 A 80 ARG HDy A 81 PHE H 1.0 1.8 4.93 1528 1203 A 81 PHE H A 80 ARG HGx 1.0 1.8 4.28 1529 1203 A 80 ARG HGy A 81 PHE H 1.0 1.8 4.28 1530 1204 A 80 ARG H A 80 ARG HGx 1.0 1.8 4.81 1531 1204 A 80 ARG H A 80 ARG HGy 1.0 1.8 4.81 1532 1205 A 80 ARG H A 81 PHE H 1.0 1.8 5.17 1533 1206 A 81 PHE HD% A 81 PHE HA 1.0 1.8 4.10 1534 1207 A 82 GLN H A 81 PHE HA 1.0 1.8 3.56 1535 1208 A 81 PHE HBy A 82 GLN H 1.0 1.8 4.41 1536 1209 A 81 PHE HBx A 82 GLN H 1.0 1.8 4.15 1537 1210 A 81 PHE HD% A 82 GLN H 1.0 1.8 4.58 1538 1211 A 81 PHE HD% A 81 PHE H 1.0 1.8 4.41 1539 1212 A 82 GLN H A 81 PHE H 1.0 1.8 5.89 1540 1213 A 82 GLN HA A 82 GLN HE2y 1.0 1.8 5.76 1541 1214 A 83 VAL H A 82 GLN HA 1.0 1.8 3.34 1542 1215 A 82 GLN HE2y A 82 GLN HBx 1.0 1.8 4.73 1543 1215 A 82 GLN HBy A 82 GLN HE2y 1.0 1.8 4.73 1544 1216 A 82 GLN HE2x A 82 GLN HBx 1.0 1.8 4.23 1545 1216 A 82 GLN HBy A 82 GLN HE2x 1.0 1.8 4.23 1546 1217 A 83 VAL H A 82 GLN HBx 1.0 1.8 3.80 1547 1217 A 83 VAL H A 82 GLN HBy 1.0 1.8 3.80 1548 1218 A 83 VAL H A 82 GLN HGx 1.0 1.8 4.94 1549 1218 A 83 VAL H A 82 GLN HGy 1.0 1.8 4.94 1550 1219 A 82 GLN H A 82 GLN HGx 1.0 1.8 4.23 1551 1219 A 82 GLN H A 82 GLN HGy 1.0 1.8 4.23 1552 1220 A 83 VAL HGx% A 83 VAL HA 1.0 1.8 3.87 1553 1221 A 83 VAL HGy% A 83 VAL HA 1.0 1.8 4.22 1554 1222 A 84 GLN H A 83 VAL HA 1.0 1.8 3.32 1555 1223 A 83 VAL HB A 84 GLN H 1.0 1.8 4.41 1556 1224 A 85 VAL HGy% A 83 VAL HB 1.0 1.8 5.10 1557 1225 A 83 VAL HGx% A 84 GLN H 1.0 1.8 4.54 1558 1226 A 83 VAL HGy% A 84 GLN H 1.0 1.8 5.24 1559 1227 A 83 VAL H A 83 VAL HGy% 1.0 1.8 4.76 1560 1228 A 84 GLN HA A 84 GLN HGx 1.0 1.8 4.42 1561 1229 A 84 GLN HA A 85 VAL H 1.0 1.8 3.21 1562 1230 A 84 GLN HBy A 84 GLN HE2y 1.0 1.8 4.52 1563 1231 A 85 VAL H A 84 GLN HBy 1.0 1.8 4.11 1564 1232 A 84 GLN HBx A 84 GLN HE2y 1.0 1.8 4.46 1565 1233 A 84 GLN HBx A 84 GLN HE2x 1.0 1.8 5.22 1566 1234 A 85 VAL H A 84 GLN HBx 1.0 1.8 4.41 1567 1235 A 84 GLN H A 84 GLN HE2y 1.0 1.8 5.62 1568 1236 A 84 GLN H A 84 GLN HGy 1.0 1.8 4.13 1569 1237 A 84 GLN H A 84 GLN HGx 1.0 1.8 4.93 1570 1238 A 85 VAL H A 84 GLN H 1.0 1.8 5.15 1571 1239 A 85 VAL HGx% A 85 VAL HA 1.0 1.8 3.67 1572 1240 A 85 VAL HGy% A 85 VAL HA 1.0 1.8 3.64 1573 1241 A 85 VAL HA A 86 ASN H 1.0 1.8 3.26 1574 1242 A 85 VAL HB A 86 ASN H 1.0 1.8 5.03 1575 1243 A 85 VAL HGx% A 86 ASN H 1.0 1.8 3.79 1576 1244 A 85 VAL HGx% A 89 SER HBy 1.0 1.8 5.00 1577 1244 A 85 VAL HGx% A 89 SER HBx 1.0 1.8 5.00 1578 1245 A 85 VAL HGx% A 89 SER HBy 1.0 1.8 5.00 1579 1246 A 85 VAL HGx% A 89 SER HBx 1.0 1.8 5.00 1580 1247 A 85 VAL HGx% A 89 SER H 1.0 1.8 5.00 1581 1248 A 85 VAL HGx% A 91 ILE HD1% 1.0 1.8 5.00 1582 1249 A 85 VAL HGy% A 86 ASN H 1.0 1.8 4.47 1583 1250 A 85 VAL H A 85 VAL HGx% 1.0 1.8 4.37 1584 1251 A 85 VAL HGy% A 85 VAL H 1.0 1.8 3.51 1585 1252 A 86 ASN HA A 87 LYS H 1.0 1.8 3.74 1586 1253 A 87 LYS H A 86 ASN HBy 1.0 1.8 3.65 1587 1254 A 87 LYS H A 86 ASN HBx 1.0 1.8 4.46 1588 1255 A 86 ASN HD2y A 87 LYS H 1.0 1.8 6.05 1589 1256 A 89 SER H A 86 ASN HD2y 1.0 1.8 6.05 1590 1257 A 86 ASN H A 86 ASN HD2y 1.0 1.8 5.13 1591 1258 A 86 ASN H A 86 ASN HD2x 1.0 1.8 5.12 1592 1259 A 86 ASN H A 87 LYS H 1.0 1.8 5.16 1593 1260 A 89 SER HA A 86 ASN H 1.0 1.8 5.72 1594 1261 A 86 ASN H A 89 SER HBy 1.0 1.8 5.00 1595 1261 A 89 SER HBx A 86 ASN H 1.0 1.8 5.00 1596 1262 A 89 SER H A 86 ASN H 1.0 1.8 4.28 1597 1263 A 87 LYS HA A 87 LYS HDx 1.0 1.8 4.48 1598 1263 A 87 LYS HA A 87 LYS HDy 1.0 1.8 4.48 1599 1264 A 87 LYS HA A 87 LYS HGx 1.0 1.8 3.69 1600 1264 A 87 LYS HA A 87 LYS HGy 1.0 1.8 3.69 1601 1265 A 87 LYS HBy A 87 LYS HEx 1.0 1.8 4.61 1602 1265 A 87 LYS HBx A 87 LYS HEx 1.0 1.8 4.61 1603 1265 A 87 LYS HEy A 87 LYS HBx 1.0 1.8 4.61 1604 1265 A 87 LYS HBy A 87 LYS HEy 1.0 1.8 4.61 1605 1266 A 87 LYS H A 87 LYS HBx 1.0 1.8 3.74 1606 1266 A 87 LYS H A 87 LYS HBy 1.0 1.8 3.74 1607 1267 A 88 ASN H A 87 LYS HBx 1.0 1.8 4.61 1608 1267 A 87 LYS HBy A 88 ASN H 1.0 1.8 4.61 1609 1268 A 87 LYS H A 87 LYS HGx 1.0 1.8 4.26 1610 1268 A 87 LYS H A 87 LYS HGy 1.0 1.8 4.26 1611 1269 A 88 ASN H A 87 LYS HGx 1.0 1.8 4.20 1612 1269 A 87 LYS HGy A 88 ASN H 1.0 1.8 4.20 1613 1270 A 87 LYS H A 87 LYS HBx 1.0 1.8 3.87 1614 1270 A 87 LYS H A 87 LYS HBy 1.0 1.8 3.87 1615 1271 A 88 ASN HA A 88 ASN HD2y 1.0 1.8 4.42 1616 1272 A 88 ASN HA A 88 ASN HD2x 1.0 1.8 4.86 1617 1273 A 89 SER H A 88 ASN HBy 1.0 1.8 4.42 1618 1274 A 89 SER H A 88 ASN HBx 1.0 1.8 5.58 1619 1275 A 89 SER H A 88 ASN HD2y 1.0 1.8 6.05 1620 1276 A 88 ASN H A 88 ASN HBy 1.0 1.8 3.95 1621 1277 A 88 ASN H A 88 ASN HBx 1.0 1.8 4.20 1622 1278 A 88 ASN H A 88 ASN HD2y 1.0 1.8 5.49 1623 1279 A 89 SER H A 88 ASN H 1.0 1.8 3.18 1624 1280 A 90 SER H A 89 SER HA 1.0 1.8 3.29 1625 1281 A 90 SER H A 89 SER HBy 1.0 1.8 3.88 1626 1281 A 89 SER HBx A 90 SER H 1.0 1.8 3.88 1627 1282 A 89 SER H A 89 SER HBy 1.0 1.8 3.43 1628 1282 A 89 SER HBx A 89 SER H 1.0 1.8 3.43 1629 1283 A 90 SER HA A 91 ILE H 1.0 1.8 2.98 1630 1284 A 91 ILE H A 90 SER HBx 1.0 1.8 4.00 1631 1284 A 91 ILE H A 90 SER HBy 1.0 1.8 4.00 1632 1285 A 90 SER H A 90 SER HBx 1.0 1.8 3.69 1633 1285 A 90 SER HBy A 90 SER H 1.0 1.8 3.69 1634 1286 A 91 ILE H A 90 SER H 1.0 1.8 5.06 1635 1287 A 91 ILE HD1% A 91 ILE HA 1.0 1.8 4.35 1636 1288 A 91 ILE HG1y A 91 ILE HA 1.0 1.8 4.31 1637 1289 A 91 ILE HA A 91 ILE HG1x 1.0 1.8 4.29 1638 1290 A 91 ILE HG2% A 91 ILE HA 1.0 1.8 3.76 1639 1291 A 92 GLU H A 91 ILE HA 1.0 1.8 3.07 1640 1292 A 91 ILE HD1% A 91 ILE HB 1.0 1.8 3.78 1641 1293 A 91 ILE HB A 92 GLU H 1.0 1.8 5.06 1642 1294 A 92 GLU H A 91 ILE HG1x 1.0 1.8 5.52 1643 1295 A 91 ILE HG1y A 91 ILE HG2% 1.0 1.8 3.87 1644 1296 A 91 ILE HG2% A 91 ILE HG1x 1.0 1.8 3.69 1645 1297 A 91 ILE HG2% A 92 GLU H 1.0 1.8 3.73 1646 1298 A 91 ILE HG2% A 93 LYS HA 1.0 1.8 5.51 1647 1299 A 91 ILE HG2% A 93 LYS H 1.0 1.8 4.95 1648 1300 A 91 ILE HB A 91 ILE H 1.0 1.8 3.49 1649 1301 A 91 ILE HD1% A 91 ILE H 1.0 1.8 5.25 1650 1302 A 91 ILE H A 91 ILE HG1y 1.0 1.8 3.99 1651 1303 A 91 ILE H A 91 ILE HG1x 1.0 1.8 4.86 1652 1304 A 91 ILE H A 91 ILE HG2% 1.0 1.8 4.72 1653 1305 A 92 GLU HA A 92 GLU HGx 1.0 1.8 3.78 1654 1305 A 92 GLU HGy A 92 GLU HA 1.0 1.8 3.78 1655 1306 A 93 LYS H A 92 GLU HA 1.0 1.8 2.87 1656 1307 A 93 LYS H A 92 GLU HBy 1.0 1.8 4.99 1657 1308 A 92 GLU HBx A 92 GLU HGx 1.0 1.8 3.11 1658 1308 A 92 GLU HGy A 92 GLU HBx 1.0 1.8 3.11 1659 1309 A 93 LYS H A 92 GLU HBx 1.0 1.8 4.50 1660 1310 A 93 LYS H A 92 GLU HGx 1.0 1.8 4.89 1661 1310 A 93 LYS H A 92 GLU HGy 1.0 1.8 4.89 1662 1311 A 92 GLU HGy A 94 LEU HDx% 1.0 1.8 5.00 1663 1311 A 92 GLU HGx A 94 LEU HDx% 1.0 1.8 5.00 1664 1311 A 94 LEU HDy% A 92 GLU HGx 1.0 1.8 5.00 1665 1311 A 94 LEU HDy% A 92 GLU HGy 1.0 1.8 5.00 1666 1312 A 92 GLU H A 92 GLU HGx 1.0 1.8 4.11 1667 1312 A 92 GLU H A 92 GLU HGy 1.0 1.8 4.11 1668 1313 A 93 LYS H A 92 GLU H 1.0 1.8 4.94 1669 1314 A 92 GLU H A 94 LEU HDx% 1.0 1.8 5.00 1670 1314 A 94 LEU HDy% A 92 GLU H 1.0 1.8 5.00 1671 1315 A 93 LYS HA A 93 LYS HDx 1.0 1.8 4.75 1672 1315 A 93 LYS HA A 93 LYS HDy 1.0 1.8 4.75 1673 1316 A 93 LYS HA A 93 LYS HGy 1.0 1.8 4.40 1674 1317 A 93 LYS HGx A 93 LYS HA 1.0 1.8 4.40 1675 1318 A 94 LEU H A 93 LYS HA 1.0 1.8 3.65 1676 1319 A 94 LEU H A 93 LYS HDx 1.0 1.8 5.09 1677 1319 A 94 LEU H A 93 LYS HDy 1.0 1.8 5.09 1678 1320 A 94 LEU H A 93 LYS HGy 1.0 1.8 4.07 1679 1320 A 93 LYS HGx A 94 LEU H 1.0 1.8 4.07 1680 1321 A 94 LEU H A 93 LYS HGy 1.0 1.8 4.82 1681 1322 A 93 LYS HGx A 94 LEU H 1.0 1.8 4.82 1682 1323 A 93 LYS H A 93 LYS HBx 1.0 1.8 3.18 1683 1323 A 93 LYS HBy A 93 LYS H 1.0 1.8 3.18 1684 1324 A 93 LYS H A 93 LYS HGy 1.0 1.8 4.49 1685 1324 A 93 LYS HGx A 93 LYS H 1.0 1.8 4.49 1686 1325 A 93 LYS H A 93 LYS HGy 1.0 1.8 5.13 1687 1326 A 93 LYS HGx A 93 LYS H 1.0 1.8 5.13 1688 1327 A 94 LEU H A 93 LYS H 1.0 1.8 5.14 1689 1328 A 94 LEU HA A 94 LEU HDx% 1.0 1.8 3.44 1690 1328 A 94 LEU HDy% A 94 LEU HA 1.0 1.8 3.44 1691 1329 A 94 LEU HA A 95 SER H 1.0 1.8 3.26 1692 1330 A 94 LEU HA A 96 GLU H 1.0 1.8 4.61 1693 1331 A 95 SER H A 94 LEU HBy 1.0 1.8 4.37 1694 1332 A 96 GLU H A 94 LEU HBy 1.0 1.8 3.41 1695 1333 A 94 LEU HBx A 96 GLU H 1.0 1.8 4.51 1696 1334 A 95 SER H A 94 LEU HDx% 1.0 1.8 4.86 1697 1334 A 94 LEU HDy% A 95 SER H 1.0 1.8 4.86 1698 1335 A 94 LEU H A 94 LEU HBy 1.0 1.8 4.15 1699 1336 A 94 LEU HBx A 94 LEU H 1.0 1.8 3.43 1700 1337 A 94 LEU H A 94 LEU HDx% 1.0 1.8 4.19 1701 1337 A 94 LEU HDy% A 94 LEU H 1.0 1.8 4.19 1702 1338 A 94 LEU H A 94 LEU HDx% 1.0 1.8 4.92 1703 1339 A 94 LEU HDy% A 94 LEU H 1.0 1.8 4.92 1704 1340 A 94 LEU H A 95 SER H 1.0 1.8 5.19 1705 1341 A 96 GLU H A 95 SER HA 1.0 1.8 3.88 1706 1342 A 96 GLU H A 95 SER HBx 1.0 1.8 3.88 1707 1342 A 96 GLU H A 95 SER HBy 1.0 1.8 3.88 1708 1343 A 95 SER H A 96 GLU H 1.0 1.8 3.43 1709 1344 A 96 GLU H A 96 GLU HBx 1.0 1.8 3.09 1710 1344 A 96 GLU H A 96 GLU HBy 1.0 1.8 3.09 1711 1345 A 98 ILE H A 97 PRO HA 1.0 1.8 3.12 1712 1346 A 98 ILE H A 97 PRO HBy 1.0 1.8 4.08 1713 1347 A 98 ILE H A 97 PRO HBx 1.0 1.8 3.81 1714 1348 A 98 ILE H A 97 PRO HGx 1.0 1.8 4.70 1715 1348 A 98 ILE H A 97 PRO HGy 1.0 1.8 4.70 1716 1349 A 98 ILE HD1% A 98 ILE HA 1.0 1.8 3.88 1717 1350 A 98 ILE HA A 99 GLU H 1.0 1.8 3.04 1718 1351 A 99 GLU H A 98 ILE HB 1.0 1.8 4.49 1719 1352 A 100 VAL HGy% A 98 ILE HB 1.0 1.8 6.05 1720 1353 A 98 ILE HD1% A 99 GLU H 1.0 1.8 5.25 1721 1354 A 99 GLU H A 98 ILE HG1x 1.0 1.8 4.89 1722 1354 A 98 ILE HG1y A 99 GLU H 1.0 1.8 4.89 1723 1355 A 98 ILE HG1y A 99 GLU H 1.0 1.8 5.65 1724 1356 A 99 GLU H A 98 ILE HG1x 1.0 1.8 5.65 1725 1357 A 98 ILE HD1% A 98 ILE HG2% 1.0 1.8 2.95 1726 1358 A 98 ILE HG2% A 98 ILE HG1x 1.0 1.8 3.69 1727 1358 A 98 ILE HG2% A 98 ILE HG1y 1.0 1.8 3.69 1728 1359 A 98 ILE HG2% A 99 GLU H 1.0 1.8 3.79 1729 1360 A 98 ILE H A 98 ILE HB 1.0 1.8 4.23 1730 1361 A 98 ILE HD1% A 98 ILE H 1.0 1.8 4.07 1731 1362 A 98 ILE H A 98 ILE HG1x 1.0 1.8 3.74 1732 1362 A 98 ILE H A 98 ILE HG1y 1.0 1.8 3.74 1733 1363 A 98 ILE HG2% A 98 ILE H 1.0 1.8 4.03 1734 1364 A 98 ILE H A 99 GLU H 1.0 1.8 4.98 1735 1365 A 99 GLU HA A 99 GLU HGx 1.0 1.8 3.94 1736 1365 A 99 GLU HA A 99 GLU HGy 1.0 1.8 3.94 1737 1366 A 99 GLU HA A 101 GLY H 1.0 1.8 4.82 1738 1367 A 100 VAL H A 99 GLU HBx 1.0 1.8 4.44 1739 1367 A 99 GLU HBy A 100 VAL H 1.0 1.8 4.44 1740 1368 A 101 GLY H A 99 GLU HBx 1.0 1.8 5.19 1741 1368 A 101 GLY H A 99 GLU HBy 1.0 1.8 5.19 1742 1369 A 100 VAL H A 99 GLU HGx 1.0 1.8 5.05 1743 1369 A 99 GLU HGy A 100 VAL H 1.0 1.8 5.05 1744 1370 A 101 GLY H A 99 GLU HGx 1.0 1.8 5.50 1745 1370 A 99 GLU HGy A 101 GLY H 1.0 1.8 5.50 1746 1371 A 99 GLU HGy A 102 LEU HBx 1.0 1.8 6.05 1747 1371 A 99 GLU HGx A 102 LEU HBx 1.0 1.8 6.05 1748 1371 A 102 LEU HBy A 99 GLU HGx 1.0 1.8 6.05 1749 1371 A 99 GLU HGy A 102 LEU HBy 1.0 1.8 6.05 1750 1372 A 99 GLU H A 99 GLU HBx 1.0 1.8 3.56 1751 1372 A 99 GLU H A 99 GLU HBy 1.0 1.8 3.56 1752 1373 A 99 GLU H A 99 GLU HGx 1.0 1.8 5.40 1753 1373 A 99 GLU H A 99 GLU HGy 1.0 1.8 5.40 1754 1374 A 99 GLU H A 100 VAL H 1.0 1.8 5.68 1755 1375 A 100 VAL HGx% A 100 VAL HA 1.0 1.8 3.62 1756 1376 A 100 VAL HGy% A 100 VAL HA 1.0 1.8 3.74 1757 1377 A 100 VAL HA A 101 GLY H 1.0 1.8 3.87 1758 1378 A 101 GLY H A 100 VAL HB 1.0 1.8 4.89 1759 1379 A 100 VAL HGx% A 101 GLY H 1.0 1.8 5.64 1760 1380 A 100 VAL HGy% A 101 GLY H 1.0 1.8 4.67 1761 1381 A 100 VAL H A 100 VAL HB 1.0 1.8 4.09 1762 1382 A 100 VAL HGx% A 100 VAL H 1.0 1.8 4.44 1763 1383 A 100 VAL HGy% A 100 VAL H 1.0 1.8 3.45 1764 1384 A 101 GLY H A 100 VAL H 1.0 1.8 4.21 1765 1385 A 101 GLY H A 102 LEU H 1.0 1.8 4.32 1766 1386 A 102 LEU HA A 102 LEU HDx% 1.0 1.8 3.84 1767 1387 A 102 LEU HA A 102 LEU HDy% 1.0 1.8 4.00 1768 1388 A 102 LEU HDx% A 102 LEU HBx 1.0 1.8 3.16 1769 1388 A 102 LEU HBy A 102 LEU HDx% 1.0 1.8 3.16 1770 1389 A 102 LEU HDy% A 102 LEU HBx 1.0 1.8 3.17 1771 1389 A 102 LEU HBy A 102 LEU HDy% 1.0 1.8 3.17 1772 1390 A 103 GLU H A 102 LEU HBx 1.0 1.8 4.46 1773 1390 A 102 LEU HBy A 103 GLU H 1.0 1.8 4.46 1774 1391 A 102 LEU H A 102 LEU HBx 1.0 1.8 3.42 1775 1391 A 102 LEU HBy A 102 LEU H 1.0 1.8 3.42 1776 1392 A 102 LEU H A 102 LEU HDx% 1.0 1.8 4.48 1777 1393 A 102 LEU H A 102 LEU HDy% 1.0 1.8 4.71 1778 1394 A 102 LEU H A 103 GLU H 1.0 1.8 4.07 1779 1395 A 103 GLU HA A 103 GLU HGy 1.0 1.8 4.31 1780 1396 A 103 GLU HA A 103 GLU HGx 1.0 1.8 4.31 1781 1397 A 104 HIS H A 103 GLU HBx 1.0 1.8 4.59 1782 1397 A 103 GLU HBy A 104 HIS H 1.0 1.8 4.59 1783 1398 A 103 GLU H A 103 GLU HBx 1.0 1.8 3.43 1784 1398 A 103 GLU H A 103 GLU HBy 1.0 1.8 3.43 1785 1399 A 103 GLU H A 103 GLU HGy 1.0 1.8 4.76 1786 1399 A 103 GLU H A 103 GLU HGx 1.0 1.8 4.76 1787 1400 A 103 GLU H A 103 GLU HGy 1.0 1.8 5.54 1788 1401 A 103 GLU H A 103 GLU HGx 1.0 1.8 5.54 1789 1402 A 103 GLU H A 104 HIS H 1.0 1.8 5.06 1790 1403 A 105 HIS H A 104 HIS HBx 1.0 1.8 4.39 1791 1403 A 104 HIS HBy A 105 HIS H 1.0 1.8 4.39 1792 1404 A 105 HIS H A 105 HIS HBx 1.0 1.8 3.64 1793 1404 A 105 HIS H A 105 HIS HBy 1.0 1.8 3.64 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin 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 6 THR H A 19 ASN O 1.0 1.7 2.3 2 2 A 19 ASN O A 6 THR N 1.0 2.7 3.3 3 3 A 10 ASP H A 7 LYS O 1.0 1.7 2.3 4 4 A 7 LYS O A 10 ASP N 1.0 2.7 3.3 5 5 A 11 ILE H A 8 ILE O 1.0 1.7 2.3 6 6 A 8 ILE O A 11 ILE N 1.0 2.7 3.3 7 7 A 15 GLY H A 74 VAL O 1.0 1.7 2.3 8 8 A 74 VAL O A 15 GLY N 1.0 2.7 3.3 9 9 A 18 ALA H A 72 VAL O 1.0 1.7 2.3 10 10 A 72 VAL O A 18 ALA N 1.0 2.7 3.3 11 11 A 19 ASN H A 4 GLN O 1.0 1.7 2.3 12 12 A 4 GLN O A 19 ASN N 1.0 2.7 3.3 13 13 A 20 LEU H A 69 LEU O 1.0 1.7 2.3 14 14 A 69 LEU O A 20 LEU N 1.0 2.7 3.3 15 15 A 22 ALA H A 67 TYR O 1.0 1.7 2.3 16 16 A 67 TYR O A 22 ALA N 1.0 2.7 3.3 17 17 A 23 LYS H A 42 GLY O 1.0 1.7 2.3 18 18 A 42 GLY O A 23 LYS N 1.0 2.7 3.3 19 19 A 24 VAL H A 65 GLU O 1.0 1.7 2.3 20 20 A 65 GLU O A 24 VAL N 1.0 2.7 3.3 21 21 A 28 TRP H A 38 VAL O 1.0 1.7 2.3 22 22 A 38 VAL O A 28 TRP N 1.0 2.7 3.3 23 23 A 30 ASN H A 36 SER O 1.0 1.7 2.3 24 24 A 36 SER O A 30 ASN N 1.0 2.7 3.3 25 25 A 36 SER H A 52 ILE O 1.0 1.7 2.3 26 26 A 52 ILE O A 36 SER N 1.0 2.7 3.3 27 27 A 38 VAL H A 28 TRP O 1.0 1.7 2.3 28 28 A 28 TRP O A 38 VAL N 1.0 2.7 3.3 29 29 A 39 GLY H A 50 PHE O 1.0 1.7 2.3 30 30 A 50 PHE O A 39 GLY N 1.0 2.7 3.3 31 31 A 40 LEU H A 26 GLN O 1.0 1.7 2.3 32 32 A 26 GLN O A 40 LEU N 1.0 2.7 3.3 33 33 A 41 LEU H A 48 ILE O 1.0 1.7 2.3 34 34 A 48 ILE O A 41 LEU N 1.0 2.7 3.3 35 35 A 42 GLY H A 23 LYS O 1.0 1.7 2.3 36 36 A 23 LYS O A 42 GLY N 1.0 2.7 3.3 37 37 A 43 ASP H A 46 GLY O 1.0 2.0 2.6 38 38 A 46 GLY O A 43 ASP N 1.0 2.7 3.3 39 39 A 48 ILE H A 41 LEU O 1.0 1.7 2.3 40 40 A 41 LEU O A 48 ILE N 1.0 2.7 3.3 41 41 A 50 PHE H A 39 GLY O 1.0 1.7 2.3 42 42 A 39 GLY O A 50 PHE N 1.0 2.7 3.3 43 43 A 51 THR H A 83 VAL O 1.0 1.7 2.3 44 44 A 83 VAL O A 51 THR N 1.0 2.7 3.3 45 45 A 52 ILE H A 37 GLN O 1.0 1.7 2.3 46 46 A 37 GLN O A 52 ILE N 1.0 2.7 3.3 47 47 A 53 TRP H A 85 VAL O 1.0 1.7 2.3 48 48 A 85 VAL O A 53 TRP N 1.0 2.7 3.3 49 49 A 64 GLY H A 24 VAL O 1.0 1.7 2.3 50 50 A 24 VAL O A 64 GLY N 1.0 2.7 3.3 51 51 A 68 LEU H A 92 GLU O 1.0 1.7 2.3 52 52 A 92 GLU O A 68 LEU N 1.0 2.7 3.3 53 53 A 69 LEU H A 20 LEU O 1.0 1.7 2.3 54 54 A 20 LEU O A 69 LEU N 1.0 2.7 3.3 55 55 A 70 ARG H A 90 SER O 1.0 1.7 2.3 56 56 A 90 SER O A 70 ARG N 1.0 2.7 3.3 57 57 A 72 VAL H A 18 ALA O 1.0 1.7 2.3 58 58 A 18 ALA O A 72 VAL N 1.0 2.7 3.3 59 59 A 74 VAL H A 16 GLN O 1.0 1.7 2.3 60 60 A 16 GLN O A 74 VAL N 1.0 2.7 3.3 61 61 A 75 GLY H A 82 GLN O 1.0 1.7 2.3 62 62 A 82 GLN O A 75 GLY N 1.0 2.7 3.3 63 63 A 77 TYR H A 80 ARG O 1.0 1.7 2.3 64 64 A 80 ARG O A 77 TYR N 1.0 2.7 3.3 65 65 A 80 ARG H A 77 TYR O 1.0 1.7 2.3 66 66 A 77 TYR O A 80 ARG N 1.0 2.7 3.3 67 67 A 82 GLN H A 75 GLY O 1.0 1.7 2.3 68 68 A 75 GLY O A 82 GLN N 1.0 2.7 3.3 69 69 A 83 VAL H A 49 LYS O 1.0 1.7 2.3 70 70 A 49 LYS O A 83 VAL N 1.0 2.7 3.3 71 71 A 84 GLN H A 73 VAL O 1.0 1.7 2.3 72 72 A 73 VAL O A 84 GLN N 1.0 2.7 3.3 73 73 A 85 VAL H A 51 THR O 1.0 1.7 2.3 74 74 A 51 THR O A 85 VAL N 1.0 2.7 3.3 75 75 A 89 SER H A 86 ASN O 1.0 1.7 2.3 76 76 A 86 ASN O A 89 SER N 1.0 2.7 3.3 77 77 A 90 SER H A 70 ARG O 1.0 1.7 2.3 78 78 A 70 ARG O A 90 SER N 1.0 2.7 3.3 79 79 A 92 GLU H A 68 LEU O 1.0 1.7 2.3 80 80 A 68 LEU O A 92 GLU N 1.0 2.7 3.3 81 81 A 94 LEU H A 66 SER O 1.0 1.7 2.3 82 82 A 66 SER O A 94 LEU N 1.0 2.7 3.3 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 3 PRO C A 4 GLN N A 4 GLN CA A 4 GLN C 1.0 -112.03 -52.03 PHI 2 2 A 4 GLN N A 4 GLN CA A 4 GLN C A 5 LEU N 1.0 91.05 171.05 PSI 3 3 A 4 GLN C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -128.87 -68.87 PHI 4 4 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 THR N 1.0 94.02 174.02 PSI 5 5 A 7 LYS C A 8 ILE N A 8 ILE CA A 8 ILE C 1.0 -90.65 -30.65 PHI 6 6 A 8 ILE N A 8 ILE CA A 8 ILE C A 9 VAL N 1.0 -76.11 3.89 PSI 7 7 A 8 ILE C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -98.77 -38.77 PHI 8 8 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 ASP N 1.0 -62.50 17.50 PSI 9 9 A 9 VAL C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -127.99 -67.99 PHI 10 10 A 10 ASP N A 10 ASP CA A 10 ASP C A 11 ILE N 1.0 -43.63 36.37 PSI 11 11 A 12 VAL C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -173.11 -113.11 PHI 12 12 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 ASN N 1.0 112.37 192.37 PSI 13 13 A 13 GLU C A 14 ASN N A 14 ASN CA A 14 ASN C 1.0 -99.48 -39.48 PHI 14 14 A 14 ASN N A 14 ASN CA A 14 ASN C A 15 GLY N 1.0 93.08 173.08 PSI 15 15 A 14 ASN C A 15 GLY N A 15 GLY CA A 15 GLY C 1.0 65.02 125.02 PHI 16 16 A 15 GLY N A 15 GLY CA A 15 GLY C A 16 GLN N 1.0 -54.19 25.81 PSI 17 17 A 15 GLY C A 16 GLN N A 16 GLN CA A 16 GLN C 1.0 -105.69 -45.69 PHI 18 18 A 16 GLN N A 16 GLN CA A 16 GLN C A 17 TRP N 1.0 97.50 177.50 PSI 19 19 A 17 TRP C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -156.29 -96.29 PHI 20 20 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 ASN N 1.0 114.13 194.13 PSI 21 21 A 19 ASN C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -158.40 -98.40 PHI 22 22 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 LYS N 1.0 98.54 178.54 PSI 23 23 A 20 LEU C A 21 LYS N A 21 LYS CA A 21 LYS C 1.0 -146.57 -86.57 PHI 24 24 A 21 LYS N A 21 LYS CA A 21 LYS C A 22 ALA N 1.0 98.90 178.90 PSI 25 25 A 21 LYS C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -172.48 -112.48 PHI 26 26 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 LYS N 1.0 105.21 185.21 PSI 27 27 A 22 ALA C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -144.41 -84.41 PHI 28 28 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 VAL N 1.0 96.62 176.62 PSI 29 29 A 23 LYS C A 24 VAL N A 24 VAL CA A 24 VAL C 1.0 -104.63 -44.63 PHI 30 30 A 24 VAL N A 24 VAL CA A 24 VAL C A 25 ILE N 1.0 84.57 164.57 PSI 31 31 A 24 VAL C A 25 ILE N A 25 ILE CA A 25 ILE C 1.0 -116.04 -56.04 PHI 32 32 A 25 ILE N A 25 ILE CA A 25 ILE C A 26 GLN N 1.0 -74.12 5.88 PSI 33 33 A 25 ILE C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -182.89 -122.89 PHI 34 34 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 LEU N 1.0 104.94 184.94 PSI 35 35 A 26 GLN C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -141.62 -81.62 PHI 36 36 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 TRP N 1.0 87.41 167.41 PSI 37 37 A 27 LEU C A 28 TRP N A 28 TRP CA A 28 TRP C 1.0 -149.48 -89.48 PHI 38 38 A 28 TRP N A 28 TRP CA A 28 TRP C A 29 GLU N 1.0 107.25 187.25 PSI 39 39 A 28 TRP C A 29 GLU N A 29 GLU CA A 29 GLU C 1.0 -130.04 -70.04 PHI 40 40 A 29 GLU N A 29 GLU CA A 29 GLU C A 30 ASN N 1.0 100.88 180.88 PSI 41 41 A 36 SER C A 37 GLN N A 37 GLN CA A 37 GLN C 1.0 -170.62 -110.62 PHI 42 42 A 37 GLN N A 37 GLN CA A 37 GLN C A 38 VAL N 1.0 117.00 197.00 PSI 43 43 A 37 GLN C A 38 VAL N A 38 VAL CA A 38 VAL C 1.0 -172.76 -112.76 PHI 44 44 A 38 VAL N A 38 VAL CA A 38 VAL C A 39 GLY N 1.0 114.63 194.63 PSI 45 45 A 38 VAL C A 39 GLY N A 39 GLY CA A 39 GLY C 1.0 -187.77 -127.77 PHI 46 46 A 39 GLY N A 39 GLY CA A 39 GLY C A 40 LEU N 1.0 123.95 203.95 PSI 47 47 A 39 GLY C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -159.80 -99.80 PHI 48 48 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 LEU N 1.0 107.50 187.50 PSI 49 49 A 40 LEU C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -155.95 -95.95 PHI 50 50 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 GLY N 1.0 105.38 185.38 PSI 51 51 A 44 GLU C A 45 THR N A 45 THR CA A 45 THR C 1.0 -118.69 -58.69 PHI 52 52 A 45 THR N A 45 THR CA A 45 THR C A 46 GLY N 1.0 -48.44 31.56 PSI 53 53 A 46 GLY C A 47 ILE N A 47 ILE CA A 47 ILE C 1.0 -163.28 -103.28 PHI 54 54 A 47 ILE N A 47 ILE CA A 47 ILE C A 48 ILE N 1.0 111.59 191.59 PSI 55 55 A 47 ILE C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -171.00 -111.00 PHI 56 56 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 LYS N 1.0 89.96 169.96 PSI 57 57 A 48 ILE C A 49 LYS N A 49 LYS CA A 49 LYS C 1.0 -142.46 -82.46 PHI 58 58 A 49 LYS N A 49 LYS CA A 49 LYS C A 50 PHE N 1.0 83.87 163.87 PSI 59 59 A 49 LYS C A 50 PHE N A 50 PHE CA A 50 PHE C 1.0 -160.32 -100.32 PHI 60 60 A 50 PHE N A 50 PHE CA A 50 PHE C A 51 THR N 1.0 115.38 195.38 PSI 61 61 A 50 PHE C A 51 THR N A 51 THR CA A 51 THR C 1.0 -159.53 -99.53 PHI 62 62 A 51 THR N A 51 THR CA A 51 THR C A 52 ILE N 1.0 96.23 176.23 PSI 63 63 A 51 THR C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -134.26 -74.26 PHI 64 64 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 TRP N 1.0 87.57 167.57 PSI 65 65 A 52 ILE C A 53 TRP N A 53 TRP CA A 53 TRP C 1.0 -119.33 -59.33 PHI 66 66 A 53 TRP N A 53 TRP CA A 53 TRP C A 54 LYS N 1.0 98.38 178.38 PSI 67 67 A 53 TRP C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 -96.50 -36.50 PHI 68 68 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 ASN N 1.0 -70.92 9.08 PSI 69 69 A 54 LYS C A 55 ASN N A 55 ASN CA A 55 ASN C 1.0 -119.91 -59.91 PHI 70 70 A 55 ASN N A 55 ASN CA A 55 ASN C A 56 ALA N 1.0 -41.15 38.85 PSI 71 71 A 55 ASN C A 56 ALA N A 56 ALA CA A 56 ALA C 1.0 -112.57 -52.57 PHI 72 72 A 56 ALA N A 56 ALA CA A 56 ALA C A 57 GLU N 1.0 -37.69 42.31 PSI 73 73 A 57 GLU C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -141.94 -81.94 PHI 74 74 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 PRO N 1.0 83.78 163.78 PSI 75 75 A 61 LEU C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -132.20 -72.20 PHI 76 76 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 GLN N 1.0 99.59 179.59 PSI 77 77 A 62 GLU C A 63 GLN N A 63 GLN CA A 63 GLN C 1.0 -93.67 -33.67 PHI 78 78 A 63 GLN N A 63 GLN CA A 63 GLN C A 64 GLY N 1.0 91.33 171.33 PSI 79 79 A 63 GLN C A 64 GLY N A 64 GLY CA A 64 GLY C 1.0 61.28 121.28 PHI 80 80 A 64 GLY N A 64 GLY CA A 64 GLY C A 65 GLU N 1.0 -48.54 31.46 PSI 81 81 A 66 SER C A 67 TYR N A 67 TYR CA A 67 TYR C 1.0 -164.07 -104.07 PHI 82 82 A 67 TYR N A 67 TYR CA A 67 TYR C A 68 LEU N 1.0 110.89 190.89 PSI 83 83 A 67 TYR C A 68 LEU N A 68 LEU CA A 68 LEU C 1.0 -152.50 -92.50 PHI 84 84 A 68 LEU N A 68 LEU CA A 68 LEU C A 69 LEU N 1.0 84.27 164.27 PSI 85 85 A 72 VAL C A 73 VAL N A 73 VAL CA A 73 VAL C 1.0 -157.59 -97.59 PHI 86 86 A 73 VAL N A 73 VAL CA A 73 VAL C A 74 VAL N 1.0 96.60 176.60 PSI 87 87 A 73 VAL C A 74 VAL N A 74 VAL CA A 74 VAL C 1.0 -130.70 -70.70 PHI 88 88 A 74 VAL N A 74 VAL CA A 74 VAL C A 75 GLY N 1.0 79.97 159.97 PSI 89 89 A 74 VAL C A 75 GLY N A 75 GLY CA A 75 GLY C 1.0 -153.06 -93.06 PHI 90 90 A 75 GLY N A 75 GLY CA A 75 GLY C A 76 GLU N 1.0 105.07 185.07 PSI 91 91 A 75 GLY C A 76 GLU N A 76 GLU CA A 76 GLU C 1.0 -142.51 -82.51 PHI 92 92 A 76 GLU N A 76 GLU CA A 76 GLU C A 77 TYR N 1.0 91.47 171.47 PSI 93 93 A 76 GLU C A 77 TYR N A 77 TYR CA A 77 TYR C 1.0 -134.81 -74.81 PHI 94 94 A 77 TYR N A 77 TYR CA A 77 TYR C A 78 ASN N 1.0 78.64 158.64 PSI 95 95 A 79 ASP C A 80 ARG N A 80 ARG CA A 80 ARG C 1.0 -139.84 -79.84 PHI 96 96 A 80 ARG N A 80 ARG CA A 80 ARG C A 81 PHE N 1.0 94.59 174.59 PSI 97 97 A 81 PHE C A 82 GLN N A 82 GLN CA A 82 GLN C 1.0 -166.00 -106.00 PHI 98 98 A 82 GLN N A 82 GLN CA A 82 GLN C A 83 VAL N 1.0 109.92 189.92 PSI 99 99 A 82 GLN C A 83 VAL N A 83 VAL CA A 83 VAL C 1.0 -151.40 -91.40 PHI 100 100 A 83 VAL N A 83 VAL CA A 83 VAL C A 84 GLN N 1.0 80.16 160.16 PSI 101 101 A 83 VAL C A 84 GLN N A 84 GLN CA A 84 GLN C 1.0 -135.54 -75.54 PHI 102 102 A 84 GLN N A 84 GLN CA A 84 GLN C A 85 VAL N 1.0 82.32 162.32 PSI 103 103 A 84 GLN C A 85 VAL N A 85 VAL CA A 85 VAL C 1.0 -133.57 -73.57 PHI 104 104 A 85 VAL N A 85 VAL CA A 85 VAL C A 86 ASN N 1.0 83.24 163.24 PSI 105 105 A 85 VAL C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 -147.67 -87.67 PHI 106 106 A 86 ASN N A 86 ASN CA A 86 ASN C A 87 LYS N 1.0 124.99 204.99 PSI 107 107 A 90 SER C A 91 ILE N A 91 ILE CA A 91 ILE C 1.0 -155.35 -95.35 PHI 108 108 A 91 ILE N A 91 ILE CA A 91 ILE C A 92 GLU N 1.0 98.58 178.58 PSI 109 109 A 91 ILE C A 92 GLU N A 92 GLU CA A 92 GLU C 1.0 -161.76 -101.76 PHI 110 110 A 92 GLU N A 92 GLU CA A 92 GLU C A 93 LYS N 1.0 98.64 178.64 PSI 111 111 A 92 GLU C A 93 LYS N A 93 LYS CA A 93 LYS C 1.0 -113.86 -53.86 PHI 112 112 A 93 LYS N A 93 LYS CA A 93 LYS C A 94 LEU N 1.0 87.08 167.08 PSI 113 113 A 95 SER C A 96 GLU N A 96 GLU CA A 96 GLU C 1.0 -132.68 -72.68 PHI 114 114 A 96 GLU N A 96 GLU CA A 96 GLU C A 97 PRO N 1.0 92.67 172.67 PSI 115 115 A 97 PRO N A 97 PRO CA A 97 PRO C A 98 ILE N 1.0 103.83 183.83 PSI 116 116 A 97 PRO C A 98 ILE N A 98 ILE CA A 98 ILE C 1.0 -127.60 -67.60 PHI 117 117 A 98 ILE N A 98 ILE CA A 98 ILE C A 99 GLU N 1.0 76.98 156.98 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_6 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_6 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 4 GLN N A 4 GLN H 1.0 . . . 2 2 A 5 LEU N A 5 LEU H 1.0 . . . 3 3 A 6 THR N A 6 THR H 1.0 . . . 4 4 A 7 LYS N A 7 LYS H 1.0 . . . 5 5 A 9 VAL N A 9 VAL H 1.0 . . . 6 6 A 10 ASP N A 10 ASP H 1.0 . . . 7 7 A 11 ILE N A 11 ILE H 1.0 . . . 8 8 A 12 VAL N A 12 VAL H 1.0 . . . 9 9 A 13 GLU N A 13 GLU H 1.0 . . . 10 10 A 14 ASN N A 14 ASN H 1.0 . . . 11 11 A 15 GLY N A 15 GLY H 1.0 . . . 12 12 A 16 GLN N A 16 GLN H 1.0 . . . 13 13 A 18 ALA N A 18 ALA H 1.0 . . . 14 14 A 19 ASN N A 19 ASN H 1.0 . . . 15 15 A 20 LEU N A 20 LEU H 1.0 . . . 16 16 A 22 ALA N A 22 ALA H 1.0 . . . 17 17 A 23 LYS N A 23 LYS H 1.0 . . . 18 18 A 24 VAL N A 24 VAL H 1.0 . . . 19 19 A 25 ILE N A 25 ILE H 1.0 . . . 20 20 A 8 ILE N A 9 VAL H 1.0 . . . 21 21 A 26 GLN N A 26 GLN H 1.0 . . . 22 22 A 27 LEU N A 27 LEU H 1.0 . . . 23 23 A 28 TRP N A 28 TRP H 1.0 . . . 24 24 A 29 GLU N A 29 GLU H 1.0 . . . 25 25 A 35 ILE N A 35 ILE H 1.0 . . . 26 26 A 36 SER N A 36 SER H 1.0 . . . 27 27 A 37 GLN N A 37 GLN H 1.0 . . . 28 28 A 38 VAL N A 38 VAL H 1.0 . . . 29 29 A 40 LEU N A 40 LEU H 1.0 . . . 30 30 A 41 LEU N A 41 LEU H 1.0 . . . 31 31 A 42 GLY N A 42 GLY H 1.0 . . . 32 32 A 43 ASP N A 43 ASP H 1.0 . . . 33 33 A 44 GLU N A 44 GLU H 1.0 . . . 34 34 A 45 THR N A 45 THR H 1.0 . . . 35 35 A 46 GLY N A 46 GLY H 1.0 . . . 36 36 A 47 ILE N A 47 ILE H 1.0 . . . 37 37 A 48 ILE N A 48 ILE H 1.0 . . . 38 38 A 49 LYS N A 49 LYS H 1.0 . . . 39 39 A 50 PHE N A 50 PHE H 1.0 . . . 40 40 A 51 THR N A 51 THR H 1.0 . . . 41 41 A 52 ILE N A 52 ILE H 1.0 . . . 42 42 A 53 TRP N A 53 TRP H 1.0 . . . 43 43 A 54 LYS N A 54 LYS H 1.0 . . . 44 44 A 56 ALA N A 56 ALA H 1.0 . . . 45 45 A 57 GLU N A 57 GLU H 1.0 . . . 46 46 A 58 LEU N A 58 LEU H 1.0 . . . 47 47 A 60 LEU N A 60 LEU H 1.0 . . . 48 48 A 61 LEU N A 61 LEU H 1.0 . . . 49 49 A 63 GLN N A 63 GLN H 1.0 . . . 50 50 A 64 GLY N A 64 GLY H 1.0 . . . 51 51 A 65 GLU N A 65 GLU H 1.0 . . . 52 52 A 66 SER N A 66 SER H 1.0 . . . 53 53 A 68 LEU N A 68 LEU H 1.0 . . . 54 54 A 69 LEU N A 69 LEU H 1.0 . . . 55 55 A 70 ARG N A 70 ARG H 1.0 . . . 56 56 A 71 SER N A 71 SER H 1.0 . . . 57 57 A 72 VAL N A 72 VAL H 1.0 . . . 58 58 A 73 VAL N A 73 VAL H 1.0 . . . 59 59 A 74 VAL N A 74 VAL H 1.0 . . . 60 60 A 75 GLY N A 75 GLY H 1.0 . . . 61 61 A 76 GLU N A 76 GLU H 1.0 . . . 62 62 A 77 TYR N A 77 TYR H 1.0 . . . 63 63 A 78 ASN N A 78 ASN H 1.0 . . . 64 64 A 80 ARG N A 80 ARG H 1.0 . . . 65 65 A 82 GLN N A 82 GLN H 1.0 . . . 66 66 A 84 GLN N A 84 GLN H 1.0 . . . 67 67 A 85 VAL N A 85 VAL H 1.0 . . . 68 68 A 86 ASN N A 86 ASN H 1.0 . . . 69 69 A 87 LYS N A 87 LYS H 1.0 . . . 70 70 A 89 SER N A 89 SER H 1.0 . . . 71 71 A 90 SER N A 90 SER H 1.0 . . . 72 72 A 91 ILE N A 91 ILE H 1.0 . . . 73 73 A 92 GLU N A 92 GLU H 1.0 . . . 74 74 A 93 LYS N A 93 LYS H 1.0 . . . 75 75 A 94 LEU N A 94 LEU H 1.0 . . . 76 76 A 96 GLU N A 96 GLU H 1.0 . . . 77 77 A 98 ILE N A 98 ILE H 1.0 . . . 78 78 A 99 GLU N A 99 GLU H 1.0 . . . 79 79 A 100 VAL N A 100 VAL H 1.0 . . . 80 80 A 4 GLN N A 4 GLN H 1.0 . . . 81 81 A 5 LEU N A 5 LEU H 1.0 . . . 82 82 A 6 THR N A 6 THR H 1.0 . . . 83 83 A 7 LYS N A 7 LYS H 1.0 . . . 84 84 A 8 ILE N A 8 ILE H 1.0 . . . 85 85 A 9 VAL N A 9 VAL H 1.0 . . . 86 86 A 10 ASP N A 10 ASP H 1.0 . . . 87 87 A 11 ILE N A 11 ILE H 1.0 . . . 88 88 A 12 VAL N A 12 VAL H 1.0 . . . 89 89 A 13 GLU N A 13 GLU H 1.0 . . . 90 90 A 14 ASN N A 14 ASN H 1.0 . . . 91 91 A 15 GLY N A 15 GLY H 1.0 . . . 92 92 A 16 GLN N A 16 GLN H 1.0 . . . 93 93 A 17 TRP N A 17 TRP H 1.0 . . . 94 94 A 18 ALA N A 18 ALA H 1.0 . . . 95 95 A 19 ASN N A 19 ASN H 1.0 . . . 96 96 A 20 LEU N A 20 LEU H 1.0 . . . 97 97 A 22 ALA N A 22 ALA H 1.0 . . . 98 98 A 23 LYS N A 23 LYS H 1.0 . . . 99 99 A 24 VAL N A 24 VAL H 1.0 . . . 100 100 A 25 ILE N A 25 ILE H 1.0 . . . 101 101 A 26 GLN N A 26 GLN H 1.0 . . . 102 102 A 27 LEU N A 27 LEU H 1.0 . . . 103 103 A 28 TRP N A 28 TRP H 1.0 . . . 104 104 A 29 GLU N A 29 GLU H 1.0 . . . 105 105 A 32 HIS N A 32 HIS H 1.0 . . . 106 106 A 33 GLU N A 33 GLU H 1.0 . . . 107 107 A 35 ILE N A 35 ILE H 1.0 . . . 108 108 A 36 SER N A 36 SER H 1.0 . . . 109 109 A 37 GLN N A 37 GLN H 1.0 . . . 110 110 A 38 VAL N A 38 VAL H 1.0 . . . 111 111 A 40 LEU N A 40 LEU H 1.0 . . . 112 112 A 41 LEU N A 41 LEU H 1.0 . . . 113 113 A 42 GLY N A 42 GLY H 1.0 . . . 114 114 A 43 ASP N A 43 ASP H 1.0 . . . 115 115 A 44 GLU N A 44 GLU H 1.0 . . . 116 116 A 45 THR N A 45 THR H 1.0 . . . 117 117 A 46 GLY N A 46 GLY H 1.0 . . . 118 118 A 48 ILE N A 48 ILE H 1.0 . . . 119 119 A 49 LYS N A 49 LYS H 1.0 . . . 120 120 A 51 THR N A 51 THR H 1.0 . . . 121 121 A 52 ILE N A 52 ILE H 1.0 . . . 122 122 A 53 TRP N A 53 TRP H 1.0 . . . 123 123 A 54 LYS N A 54 LYS H 1.0 . . . 124 124 A 56 ALA N A 56 ALA H 1.0 . . . 125 125 A 57 GLU N A 57 GLU H 1.0 . . . 126 126 A 58 LEU N A 58 LEU H 1.0 . . . 127 127 A 60 LEU N A 60 LEU H 1.0 . . . 128 128 A 61 LEU N A 61 LEU H 1.0 . . . 129 129 A 63 GLN N A 63 GLN H 1.0 . . . 130 130 A 64 GLY N A 64 GLY H 1.0 . . . 131 131 A 65 GLU N A 65 GLU H 1.0 . . . 132 132 A 66 SER N A 66 SER H 1.0 . . . 133 133 A 68 LEU N A 68 LEU H 1.0 . . . 134 134 A 69 LEU N A 69 LEU H 1.0 . . . 135 135 A 70 ARG N A 70 ARG H 1.0 . . . 136 136 A 71 SER N A 71 SER H 1.0 . . . 137 137 A 72 VAL N A 72 VAL H 1.0 . . . 138 138 A 73 VAL N A 73 VAL H 1.0 . . . 139 139 A 74 VAL N A 74 VAL H 1.0 . . . 140 140 A 75 GLY N A 75 GLY H 1.0 . . . 141 141 A 76 GLU N A 76 GLU H 1.0 . . . 142 142 A 77 TYR N A 77 TYR H 1.0 . . . 143 143 A 78 ASN N A 78 ASN H 1.0 . . . 144 144 A 80 ARG N A 80 ARG H 1.0 . . . 145 145 A 82 GLN N A 82 GLN H 1.0 . . . 146 146 A 84 GLN N A 84 GLN H 1.0 . . . 147 147 A 85 VAL N A 85 VAL H 1.0 . . . 148 148 A 86 ASN N A 86 ASN H 1.0 . . . 149 149 A 87 LYS N A 87 LYS H 1.0 . . . 150 150 A 89 SER N A 89 SER H 1.0 . . . 151 151 A 90 SER N A 90 SER H 1.0 . . . 152 152 A 91 ILE N A 91 ILE H 1.0 . . . 153 153 A 92 GLU N A 92 GLU H 1.0 . . . 154 154 A 93 LYS N A 93 LYS H 1.0 . . . 155 155 A 94 LEU N A 94 LEU H 1.0 . . . 156 156 A 96 GLU N A 96 GLU H 1.0 . . . 157 157 A 47 ILE N A 47 ILE H 1.0 . . . 158 158 A 98 ILE N A 98 ILE H 1.0 . . . 159 159 A 99 GLU N A 99 GLU H 1.0 . . . 160 160 A 100 VAL N A 100 VAL H 1.0 . . . stop_ save_ save_N15-noesy _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode N15-noesy _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 2400 2 1H 3836 3 1H 10416 stop_ save_ save_C13-noesy _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode C13-noesy _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 5966 2 1H 10416 3 1H 16666 stop_ save_ save_4D-C13_Noesy _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode 4D-C13_Noesy _nef_nmr_spectrum.num_dimensions 4 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3131 2 13C 3131 3 1H 4197 4 1H 8000 stop_ save_