data_nef_c16517_2kok save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code TargetDB BrabA.00007.a 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 GLY start . false 2 A 2 PRO middle . false 3 A 3 GLY middle . false 4 A 4 SER middle . . 5 A 5 MET middle . . 6 A 6 SER middle . . 7 A 7 VAL middle . . 8 A 8 THR middle . . 9 A 9 ILE middle . . 10 A 10 TYR middle . . 11 A 11 GLY middle . false 12 A 12 ILE middle . . 13 A 13 LYS middle . . 14 A 14 ASN middle . . 15 A 15 CYS middle . . 16 A 16 ASP middle . . 17 A 17 THR middle . . 18 A 18 MET middle . . 19 A 19 LYS middle . . 20 A 20 LYS middle . . 21 A 21 ALA middle . . 22 A 22 ARG middle . . 23 A 23 ILE middle . . 24 A 24 TRP middle . . 25 A 25 LEU middle . . 26 A 26 GLU middle . . 27 A 27 ASP middle . . 28 A 28 HIS middle . . 29 A 29 GLY middle . false 30 A 30 ILE middle . . 31 A 31 ASP middle . . 32 A 32 TYR middle . . 33 A 33 THR middle . . 34 A 34 PHE middle . . 35 A 35 HIS middle . . 36 A 36 ASP middle . . 37 A 37 TYR middle . . 38 A 38 LYS middle . . 39 A 39 LYS middle . . 40 A 40 GLU middle . . 41 A 41 GLY middle . false 42 A 42 LEU middle . . 43 A 43 ASP middle . . 44 A 44 ALA middle . . 45 A 45 GLU middle . . 46 A 46 THR middle . . 47 A 47 LEU middle . . 48 A 48 ASP middle . . 49 A 49 ARG middle . . 50 A 50 PHE middle . . 51 A 51 LEU middle . . 52 A 52 LYS middle . . 53 A 53 THR middle . . 54 A 54 VAL middle . . 55 A 55 PRO middle . false 56 A 56 TRP middle . . 57 A 57 GLU middle . . 58 A 58 GLN middle . . 59 A 59 LEU middle . . 60 A 60 LEU middle . . 61 A 61 ASN middle . . 62 A 62 ARG middle . . 63 A 63 ALA middle . . 64 A 64 GLY middle . false 65 A 65 THR middle . . 66 A 66 THR middle . . 67 A 67 PHE middle . . 68 A 68 ARG middle . . 69 A 69 LYS middle . . 70 A 70 LEU middle . . 71 A 71 PRO middle . false 72 A 72 GLU middle . . 73 A 73 ASP middle . . 74 A 74 VAL middle . . 75 A 75 ARG middle . . 76 A 76 SER middle . . 77 A 77 ASN middle . . 78 A 78 VAL middle . . 79 A 79 ASP middle . . 80 A 80 ALA middle . . 81 A 81 ALA middle . . 82 A 82 SER middle . . 83 A 83 ALA middle . . 84 A 84 ARG middle . . 85 A 85 GLU middle . . 86 A 86 LEU middle . . 87 A 87 MET middle . . 88 A 88 LEU middle . . 89 A 89 ALA middle . . 90 A 90 GLN middle . . 91 A 91 PRO middle . false 92 A 92 SER middle . . 93 A 93 MET middle . . 94 A 94 VAL middle . . 95 A 95 LYS middle . . 96 A 96 ARG middle . . 97 A 97 PRO middle . true 98 A 98 VAL middle . . 99 A 99 LEU middle . . 100 A 100 GLU middle . . 101 A 101 ARG middle . . 102 A 102 ASP middle . . 103 A 103 GLY middle . false 104 A 104 LYS middle . . 105 A 105 LEU middle . . 106 A 106 MET middle . . 107 A 107 VAL middle . . 108 A 108 GLY middle . false 109 A 109 PHE middle . . 110 A 110 LYS middle . . 111 A 111 PRO middle . false 112 A 112 ALA middle . . 113 A 113 GLN middle . . 114 A 114 TYR middle . . 115 A 115 GLU middle . . 116 A 116 ALA middle . . 117 A 117 TYR middle . . 118 A 118 PHE middle . . 119 A 119 LYS middle . . 120 A 120 LEU 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 2 PRO HA H 1 4.50 0.02 A 2 PRO HBy H 1 2.35 0.02 A 2 PRO HBx H 1 2.03 0.02 A 2 PRO HDy H 1 3.63 0.02 A 2 PRO HDx H 1 3.61 0.02 A 2 PRO HGy H 1 2.10 0.02 A 2 PRO HGx H 1 2.06 0.02 A 2 PRO C C 13 177.5 0.2 A 2 PRO CA C 13 63.5 0.2 A 2 PRO CB C 13 32.2 0.2 A 2 PRO CD C 13 49.6 0.2 A 2 PRO CG C 13 27.2 0.2 A 3 GLY H H 1 8.113 0.02 A 3 GLY HAy H 1 4.06 0.02 A 3 GLY HAx H 1 4.03 0.02 A 3 GLY CA C 13 45.3 0.2 A 3 GLY N N 15 110.5 0.2 A 4 SER H H 1 8.28 0.02 A 4 SER HA H 1 4.52 0.02 A 4 SER HBx H 1 4.01 0.02 A 4 SER HBy H 1 4.01 0.02 A 4 SER C C 13 178.1 0.2 A 4 SER CA C 13 58.6 0.2 A 4 SER CB C 13 63.8 0.2 A 4 SER N N 15 115.9 0.2 A 5 MET H H 1 8.68 0.02 A 5 MET HA H 1 4.70 0.02 A 5 MET HBy H 1 2.73 0.02 A 5 MET HBx H 1 2.57 0.02 A 5 MET HGy H 1 2.27 0.02 A 5 MET HGx H 1 2.11 0.02 A 5 MET C C 13 174.8 0.2 A 5 MET CA C 13 54.9 0.2 A 5 MET CB C 13 32.5 0.2 A 5 MET CG C 13 32.5 0.2 A 5 MET N N 15 121.5 0.2 A 6 SER H H 1 8.22 0.02 A 6 SER HA H 1 4.58 0.02 A 6 SER HBy H 1 3.97 0.02 A 6 SER HBx H 1 3.91 0.02 A 6 SER C C 13 174.2 0.2 A 6 SER CA C 13 59.1 0.2 A 6 SER CB C 13 63.8 0.2 A 6 SER N N 15 117.0 0.2 A 7 VAL H H 1 8.75 0.02 A 7 VAL HA H 1 4.84 0.02 A 7 VAL HB H 1 2.58 0.02 A 7 VAL HGx% H 1 1.33 0.02 A 7 VAL HGy% H 1 1.07 0.02 A 7 VAL C C 13 175.8 0.2 A 7 VAL CA C 13 61.8 0.2 A 7 VAL CB C 13 33.8 0.2 A 7 VAL CGx C 13 22.5 0.2 A 7 VAL CGy C 13 22.5 0.2 A 7 VAL N N 15 124.1 0.2 A 8 THR H H 1 8.88 0.02 A 8 THR HA H 1 5.36 0.02 A 8 THR HB H 1 3.98 0.02 A 8 THR HG2% H 1 0.64 0.02 A 8 THR C C 13 172.5 0.2 A 8 THR CA C 13 61.7 0.2 A 8 THR CB C 13 70.6 0.2 A 8 THR CG2 C 13 21.3 0.2 A 8 THR N N 15 124.5 0.2 A 9 ILE H H 1 9.17 0.02 A 9 ILE HA H 1 5.61 0.02 A 9 ILE HB H 1 1.45 0.02 A 9 ILE HD1% H 1 0.54 0.02 A 9 ILE HG1y H 1 1.63 0.02 A 9 ILE HG1x H 1 1.03 0.02 A 9 ILE HG2% H 1 0.87 0.02 A 9 ILE C C 13 172.5 0.2 A 9 ILE CA C 13 58.3 0.2 A 9 ILE CB C 13 42.4 0.2 A 9 ILE CD1 C 13 13.8 0.2 A 9 ILE CG1 C 13 28.9 0.2 A 9 ILE CG2 C 13 17.0 0.2 A 9 ILE N N 15 123.9 0.2 A 10 TYR H H 1 9.74 0.02 A 10 TYR HA H 1 5.41 0.02 A 10 TYR HBy H 1 3.13 0.02 A 10 TYR HBx H 1 3.07 0.02 A 10 TYR HDx H 1 6.95 0.02 A 10 TYR HDy H 1 6.95 0.02 A 10 TYR C C 13 177.5 0.2 A 10 TYR CA C 13 56.5 0.2 A 10 TYR CB C 13 40.3 0.2 A 10 TYR CDx C 13 131.1 0.2 A 10 TYR CDy C 13 131.1 0.2 A 10 TYR N N 15 125.3 0.2 A 11 GLY H H 1 7.88 0.02 A 11 GLY HAx H 1 4.70 0.02 A 11 GLY HAy H 1 4.70 0.02 A 11 GLY C C 13 170.0 0.2 A 11 GLY CA C 13 46.7 0.2 A 11 GLY N N 15 108.6 0.2 A 12 ILE H H 1 6.34 0.02 A 12 ILE HA H 1 5.33 0.02 A 12 ILE HB H 1 2.45 0.02 A 12 ILE HD1% H 1 1.01 0.02 A 12 ILE HG1y H 1 1.26 0.02 A 12 ILE HG1x H 1 0.82 0.02 A 12 ILE HG2% H 1 1.24 0.02 A 12 ILE C C 13 175.1 0.2 A 12 ILE CA C 13 59.3 0.2 A 12 ILE CB C 13 41.0 0.2 A 12 ILE CD1 C 13 13.2 0.2 A 12 ILE CG1 C 13 25.6 0.2 A 12 ILE CG2 C 13 18.5 0.2 A 12 ILE N N 15 113.3 0.2 A 13 LYS H H 1 9.45 0.2 A 13 LYS HA H 1 4.09 0.02 A 13 LYS HBy H 1 1.97 0.02 A 13 LYS HBx H 1 1.71 0.02 A 13 LYS C C 13 177.8 0.2 A 13 LYS CA C 13 59.2 0.2 A 13 LYS CB C 13 33.6 0.2 A 13 LYS CD C 13 29.5 0.2 A 13 LYS N N 15 120.9 0.2 A 14 ASN H H 1 8.70 0.02 A 14 ASN HA H 1 4.69 0.02 A 14 ASN HBy H 1 2.90 0.02 A 14 ASN HBx H 1 2.80 0.02 A 14 ASN HD2y H 1 7.52 0.02 A 14 ASN HD2x H 1 6.82 0.02 A 14 ASN C C 13 173.1 0.2 A 14 ASN CA C 13 52.7 0.2 A 14 ASN CB C 13 36.3 0.2 A 14 ASN N N 15 116.6 0.2 A 14 ASN ND2 N 15 111.9 0.2 A 15 CYS H H 1 7.44 0.02 A 15 CYS HA H 1 4.51 0.02 A 15 CYS HBy H 1 2.72 0.02 A 15 CYS HBx H 1 2.41 0.02 A 15 CYS CA C 13 59.1 0.2 A 15 CYS CB C 13 30.8 0.2 A 15 CYS N N 15 124.4 0.2 A 16 ASP HA H 1 4.46 0.02 A 16 ASP HBy H 1 2.77 0.02 A 16 ASP HBx H 1 2.72 0.02 A 16 ASP C C 13 178.0 0.2 A 16 ASP CA C 13 57.5 0.2 A 16 ASP CB C 13 41.4 0.2 A 17 THR H H 1 9.21 0.02 A 17 THR HA H 1 4.00 0.02 A 17 THR HB H 1 4.24 0.02 A 17 THR HG2% H 1 1.36 0.02 A 17 THR C C 13 176.0 0.2 A 17 THR CA C 13 67.4 0.2 A 17 THR CB C 13 68.2 0.2 A 17 THR CG2 C 13 23.3 0.2 A 17 THR N N 15 122.2 0.2 A 18 MET H H 1 8.94 0.02 A 18 MET HA H 1 3.99 0.02 A 18 MET HE% H 1 1.77 0.02 A 18 MET HGy H 1 3.52 0.02 A 18 MET HGx H 1 3.30 0.02 A 18 MET C C 13 178.3 0.2 A 18 MET CA C 13 56.0 0.2 A 18 MET CB C 13 31.4 0.2 A 18 MET CE C 13 15.5 0.2 A 18 MET CG C 13 31.6 0.2 A 18 MET N N 15 125.3 0.2 A 19 LYS H H 1 8.08 0.02 A 19 LYS HA H 1 3.80 0.02 A 19 LYS HBx H 1 1.93 0.02 A 19 LYS HBy H 1 1.93 0.02 A 19 LYS CA C 13 60.0 0.2 A 19 LYS CB C 13 32.5 0.2 A 19 LYS CD C 13 29.6 0.2 A 19 LYS CE C 13 42.2 0.2 A 19 LYS CG C 13 25.2 0.2 A 19 LYS N N 15 117.9 0.2 A 20 LYS H H 1 7.51 0.2 A 20 LYS HA H 1 3.79 0.2 A 20 LYS HEx H 1 3.07 0.02 A 20 LYS HEy H 1 3.07 0.0 A 20 LYS HGy H 1 1.75 0.02 A 20 LYS HGx H 1 1.50 0.02 A 20 LYS C C 13 178.5 0.2 A 20 LYS CA C 13 59.5 0.2 A 20 LYS CB C 13 32.8 0.2 A 20 LYS CD C 13 29.3 0.2 A 20 LYS CE C 13 42.3 0.2 A 20 LYS CG C 13 26.0 0.2 A 20 LYS N N 15 117.5 0.2 A 21 ALA H H 1 7.73 0.02 A 21 ALA HA H 1 2.54 0.02 A 21 ALA HB% H 1 0.86 0.02 A 21 ALA C C 13 178.7 0.2 A 21 ALA CA C 13 54.4 0.2 A 21 ALA CB C 13 19.0 0.2 A 21 ALA N N 15 123.6 0.2 A 22 ARG H H 1 8.11 0.02 A 22 ARG HA H 1 3.49 0.02 A 22 ARG HBy H 1 2.01 0.02 A 22 ARG HBx H 1 1.69 0.02 A 22 ARG HDy H 1 2.77 0.02 A 22 ARG HDx H 1 2.54 0.02 A 22 ARG HGy H 1 1.84 0.02 A 22 ARG HGx H 1 1.00 0.02 A 22 ARG C C 13 178.2 0.2 A 22 ARG CA C 13 60.5 0.2 A 22 ARG CB C 13 30.7 0.2 A 22 ARG CD C 13 44.1 0.2 A 22 ARG CG C 13 28.2 0.2 A 22 ARG N N 15 116.1 0.2 A 23 ILE H H 1 7.86 0.02 A 23 ILE HA H 1 3.71 0.02 A 23 ILE HB H 1 1.76 0.02 A 23 ILE HD1% H 1 0.82 0.02 A 23 ILE HG1y H 1 1.68 0.02 A 23 ILE HG1x H 1 1.13 0.02 A 23 ILE HG2% H 1 0.92 0.02 A 23 ILE C C 13 177.2 0.2 A 23 ILE CA C 13 65.0 0.2 A 23 ILE CB C 13 38.0 0.2 A 23 ILE CD1 C 13 13.6 0.2 A 23 ILE CG1 C 13 29.8 0.2 A 23 ILE CG2 C 13 17.4 0.2 A 23 ILE N N 15 119.4 0.2 A 24 TRP H H 1 7.88 0.02 A 24 TRP HA H 1 4.27 0.02 A 24 TRP HBy H 1 3.63 0.02 A 24 TRP HBx H 1 3.24 0.02 A 24 TRP HD1 H 1 7.62 0.02 A 24 TRP HE1 H 1 10.90 0.02 A 24 TRP HE3 H 1 7.28 0.02 A 24 TRP HH2 H 1 6.75 0.02 A 24 TRP HZ2 H 1 6.88 0.02 A 24 TRP HZ3 H 1 6.52 0.02 A 24 TRP C C 13 176.1 0.2 A 24 TRP CA C 13 63.1 0.2 A 24 TRP CB C 13 30.2 0.2 A 24 TRP CD1 C 13 126.8 0.2 A 24 TRP CE3 C 13 121.3 0.2 A 24 TRP CH2 C 13 123.5 0.2 A 24 TRP CZ2 C 13 113.9 0.2 A 24 TRP CZ3 C 13 121.2 0.2 A 24 TRP N N 15 121.0 0.2 A 24 TRP NE1 N 15 130.7 0.2 A 25 LEU H H 1 8.69 0.02 A 25 LEU HA H 1 4.00 0.02 A 25 LEU HBx H 1 2.10 0.02 A 25 LEU HBy H 1 2.10 0.02 A 25 LEU HDx% H 1 0.94 0.02 A 25 LEU HDy% H 1 0.94 0.02 A 25 LEU HG H 1 0.36 0.02 A 25 LEU C C 13 178.6 0.2 A 25 LEU CA C 13 59.7 0.2 A 25 LEU CB C 13 41.2 0.2 A 25 LEU CDx C 13 24.2 0.2 A 25 LEU CDy C 13 24.2 0.2 A 25 LEU CG C 13 25.8 0.2 A 25 LEU N N 15 121.8 0.2 A 26 GLU H H 1 8.58 0.02 A 26 GLU HA H 1 4.20 0.02 A 26 GLU HBy H 1 2.18 0.02 A 26 GLU HBx H 1 2.11 0.02 A 26 GLU HGy H 1 2.92 0.02 A 26 GLU HGx H 1 2.67 0.02 A 26 GLU C C 13 181.2 0.2 A 26 GLU CA C 13 59.5 0.2 A 26 GLU CB C 13 28.8 0.2 A 26 GLU CG C 13 37.6 0.2 A 26 GLU N N 15 120.6 0.2 A 27 ASP H H 1 9.36 0.02 A 27 ASP HA H 1 4.27 0.02 A 27 ASP HBy H 1 2.65 0.02 A 27 ASP HBx H 1 2.18 0.02 A 27 ASP C C 13 177.4 0.2 A 27 ASP CA C 13 56.4 0.2 A 27 ASP CB C 13 40.0 0.2 A 27 ASP N N 15 121.8 0.2 A 28 HIS H H 1 7.34 0.02 A 28 HIS HA H 1 4.25 0.02 A 28 HIS HBy H 1 3.19 0.02 A 28 HIS HBx H 1 2.12 0.02 A 28 HIS HD2 H 1 6.96 0.02 A 28 HIS HE1 H 1 7.40 0.02 A 28 HIS C C 13 173.6 0.2 A 28 HIS CA C 13 56.7 0.2 A 28 HIS CB C 13 27.5 0.2 A 28 HIS CD2 C 13 119.4 0.2 A 28 HIS CE1 C 13 134.3 0.2 A 28 HIS N N 15 113.4 0.2 A 29 GLY H H 1 7.79 0.02 A 29 GLY HAx H 1 3.87 0.02 A 29 GLY HAy H 1 3.87 0.02 A 29 GLY C C 13 174.2 0.2 A 29 GLY CA C 13 46.9 0.2 A 29 GLY N N 15 109.4 0.2 A 30 ILE H H 1 8.12 0.02 A 30 ILE HA H 1 4.04 0.02 A 30 ILE HB H 1 1.73 0.02 A 30 ILE HD1% H 1 0.28 0.02 A 30 ILE HG1y H 1 1.05 0.02 A 30 ILE HG1x H 1 0.90 0.02 A 30 ILE HG2% H 1 0.85 0.02 A 30 ILE C C 13 175.5 0.2 A 30 ILE CA C 13 60.0 0.2 A 30 ILE CB C 13 38.1 0.2 A 30 ILE CD1 C 13 12.6 0.2 A 30 ILE CG1 C 13 26.9 0.2 A 30 ILE CG2 C 13 17.9 0.2 A 30 ILE N N 15 121.8 0.2 A 31 ASP H H 1 8.43 0.02 A 31 ASP HA H 1 4.65 0.02 A 31 ASP HBx H 1 2.63 0.02 A 31 ASP HBy H 1 2.63 0.02 A 31 ASP C C 13 175.8 0.2 A 31 ASP CA C 13 54.6 0.2 A 31 ASP CB C 13 41.6 0.2 A 31 ASP N N 15 128.5 0.2 A 32 TYR H H 1 7.92 0.02 A 32 TYR HA H 1 5.50 0.02 A 32 TYR HBy H 1 2.81 0.02 A 32 TYR HBx H 1 2.68 0.02 A 32 TYR HDx H 1 7.02 0.02 A 32 TYR HDy H 1 7.02 0.02 A 32 TYR HEx H 1 6.75 0.02 A 32 TYR HEy H 1 6.75 0.02 A 32 TYR C C 13 173.8 0.2 A 32 TYR CA C 13 56.1 0.2 A 32 TYR CB C 13 41.7 0.2 A 32 TYR CDx C 13 134.4 0.2 A 32 TYR CDy C 13 134.4 0.2 A 32 TYR CEx C 13 117.3 0.2 A 32 TYR CEy C 13 117.3 0.2 A 32 TYR N N 15 117.5 0.2 A 33 THR H H 1 8.90 0.02 A 33 THR HA H 1 4.47 0.02 A 33 THR HB H 1 4.12 0.02 A 33 THR HG2% H 1 1.19 0.02 A 33 THR C C 13 172.9 0.2 A 33 THR CA C 13 61.8 0.2 A 33 THR CB C 13 70.8 0.2 A 33 THR CG2 C 13 21.5 0.2 A 33 THR N N 15 117.1 0.2 A 34 PHE H H 1 9.28 0.02 A 34 PHE HA H 1 5.52 0.02 A 34 PHE HBy H 1 3.21 0.02 A 34 PHE HBx H 1 3.01 0.02 A 34 PHE HDx H 1 7.18 0.02 A 34 PHE HDy H 1 7.18 0.02 A 34 PHE HEx H 1 7.18 0.02 A 34 PHE HEy H 1 7.18 0.02 A 34 PHE HZ H 1 6.59 0.02 A 34 PHE CA C 13 53.9 0.2 A 34 PHE CB C 13 39.9 0.2 A 34 PHE CDx C 13 131.2 0.2 A 34 PHE CDy C 13 131.2 0.2 A 34 PHE CEx C 13 131.2 0.2 A 34 PHE CEy C 13 131.2 0.2 A 34 PHE CZ C 13 127.5 0.2 A 34 PHE N N 15 128.2 0.2 A 35 HIS H H 1 9.21 0.02 A 35 HIS HA H 1 4.24 0.02 A 35 HIS HBy H 1 2.71 0.02 A 35 HIS HBx H 1 2.20 0.02 A 35 HIS HD2 H 1 6.69 0.2 A 35 HIS HE1 H 1 8.15 0.2 A 35 HIS CA C 13 54.9 0.2 A 35 HIS CB C 13 30.7 0.2 A 35 HIS CD2 C 13 116.8 0.2 A 35 HIS CE1 C 13 137.7 0.2 A 35 HIS N N 15 133.9 0.2 A 36 ASP H H 1 7.93 0.02 A 36 ASP HA H 1 4.47 0.02 A 36 ASP HBy H 1 2.74 0.02 A 36 ASP HBx H 1 1.80 0.02 A 36 ASP C C 13 178.5 0.2 A 36 ASP CA C 13 50.9 0.2 A 36 ASP CB C 13 42.2 0.2 A 36 ASP N N 15 127.0 0.2 A 37 TYR H H 1 9.29 0.02 A 37 TYR HBy H 1 3.23 0.02 A 37 TYR HBx H 1 2.65 0.02 A 37 TYR HDx H 1 7.11 0.02 A 37 TYR HDy H 1 7.11 0.02 A 37 TYR HEx H 1 7.16 0.02 A 37 TYR HEy H 1 7.16 0.02 A 37 TYR C C 13 178.7 0.2 A 37 TYR CA C 13 58.7 0.2 A 37 TYR CB C 13 39.1 0.2 A 37 TYR CDx C 13 131.7 0.2 A 37 TYR CDy C 13 131.7 0.2 A 37 TYR CEx C 13 119.3 0.2 A 37 TYR CEy C 13 119.3 0.2 A 37 TYR N N 15 126.4 0.2 A 38 LYS H H 1 8.88 0.02 A 38 LYS HA H 1 4.30 0.02 A 38 LYS HBx H 1 2.09 0.02 A 38 LYS HBy H 1 2.09 0.02 A 38 LYS CA C 13 57.7 0.2 A 38 LYS CB C 13 31.6 0.2 A 38 LYS CD C 13 28.3 0.2 A 38 LYS CE C 13 42.2 0.2 A 38 LYS CG C 13 25.3 0.2 A 38 LYS N N 15 115.8 0.2 A 39 LYS H H 1 7.33 0.02 A 39 LYS HA H 1 4.42 0.02 A 39 LYS HBy H 1 1.82 0.02 A 39 LYS HBx H 1 1.74 0.02 A 39 LYS HEx H 1 3.02 0.02 A 39 LYS HEy H 1 3.02 0.02 A 39 LYS HGy H 1 1.46 0.02 A 39 LYS HGx H 1 1.33 0.02 A 39 LYS CA C 13 57.5 0.2 A 39 LYS CB C 13 34.6 0.2 A 39 LYS CD C 13 28.9 0.2 A 39 LYS CE C 13 42.04 0.2 A 39 LYS CG C 13 24.9 0.2 A 39 LYS N N 15 118.8 0.2 A 40 GLU H H 1 8.57 0.02 A 40 GLU HA H 1 4.28 0.02 A 40 GLU HBy H 1 1.75 0.02 A 40 GLU HBx H 1 1.21 0.02 A 40 GLU HGy H 1 2.10 0.02 A 40 GLU HGx H 1 1.92 0.02 A 40 GLU CA C 13 57.9 0.2 A 40 GLU CB C 13 29.3 0.2 A 40 GLU CG C 13 37.4 0.2 A 40 GLU N N 15 117.6 0.2 A 41 GLY H H 1 7.47 0.02 A 41 GLY HAy H 1 4.31 0.02 A 41 GLY HAx H 1 4.17 0.02 A 41 GLY CA C 13 44.9 0.2 A 41 GLY N N 15 106.3 0.2 A 42 LEU H H 1 8.29 0.2 A 42 LEU HA H 1 4.95 0.02 A 42 LEU HBy H 1 1.70 0.02 A 42 LEU HBx H 1 1.12 0.02 A 42 LEU HDx% H 1 0.74 0.02 A 42 LEU HDy% H 1 0.74 0.02 A 42 LEU HG H 1 0.57 0.02 A 42 LEU C C 13 173.8 0.2 A 42 LEU CA C 13 54.5 0.2 A 42 LEU CB C 13 43.4 0.2 A 42 LEU CDx C 13 22.4 0.2 A 42 LEU CDy C 13 22.4 0.2 A 42 LEU CG C 13 26.3 0.2 A 42 LEU N N 15 121.0 0.2 A 43 ASP H H 1 8.52 0.02 A 43 ASP HA H 1 4.80 0.02 A 43 ASP HBy H 1 3.09 0.02 A 43 ASP HBx H 1 2.77 0.02 A 43 ASP C C 13 175.4 0.2 A 43 ASP CA C 13 51.6 0.2 A 43 ASP CB C 13 42.2 0.2 A 43 ASP N N 15 124.8 0.2 A 44 ALA H H 1 8.64 0.02 A 44 ALA HA H 1 3.78 0.02 A 44 ALA HB% H 1 1.33 0.02 A 44 ALA C C 13 178.1 0.2 A 44 ALA CA C 13 55.4 0.2 A 44 ALA CB C 13 18.1 0.2 A 44 ALA N N 15 122.4 0.2 A 45 GLU H H 1 8.24 0.02 A 45 GLU HA H 1 3.92 0.02 A 45 GLU HBy H 1 2.05 0.02 A 45 GLU HBx H 1 1.90 0.02 A 45 GLU HGy H 1 2.27 0.02 A 45 GLU HGx H 1 2.25 0.02 A 45 GLU C C 13 179.3 0.2 A 45 GLU CA C 13 59.8 0.2 A 45 GLU CB C 13 29.2 0.2 A 45 GLU CG C 13 36.6 0.2 A 45 GLU N N 15 115.6 0.2 A 46 THR H H 1 7.91 0.02 A 46 THR HA H 1 3.50 0.02 A 46 THR HB H 1 3.88 0.02 A 46 THR HG2% H 1 0.30 0.02 A 46 THR C C 13 174.3 0.2 A 46 THR CA C 13 66.6 0.2 A 46 THR CB C 13 67.7 0.2 A 46 THR CG2 C 13 21.5 0.2 A 46 THR N N 15 117.7 0.2 A 47 LEU H H 1 7.71 0.02 A 47 LEU HA H 1 3.51 0.02 A 47 LEU HBy H 1 1.63 0.02 A 47 LEU HBx H 1 1.05 0.02 A 47 LEU HDx% H 1 1.02 0.02 A 47 LEU HDy% H 1 1.02 0.02 A 47 LEU HG H 1 0.90 0.02 A 47 LEU C C 13 178.0 0.2 A 47 LEU CA C 13 57.9 0.2 A 47 LEU CB C 13 41.5 0.2 A 47 LEU CDx C 13 23.1 0.2 A 47 LEU CDy C 13 23.1 0.2 A 47 LEU CG C 13 29.3 0.2 A 47 LEU N N 15 120.4 0.2 A 48 ASP H H 1 9.00 0.02 A 48 ASP HA H 1 4.49 0.02 A 48 ASP HBy H 1 2.69 0.02 A 48 ASP HBx H 1 2.43 0.02 A 48 ASP C C 13 179.1 0.2 A 48 ASP CA C 13 57.5 0.2 A 48 ASP CB C 13 39.1 0.2 A 48 ASP N N 15 116.8 0.2 A 49 ARG H H 1 7.56 0.02 A 49 ARG HA H 1 4.11 0.02 A 49 ARG HBy H 1 2.23 0.02 A 49 ARG HBx H 1 1.86 0.02 A 49 ARG HDy H 1 3.43 0.02 A 49 ARG HDx H 1 3.26 0.02 A 49 ARG HGy H 1 1.71 0.02 A 49 ARG HGx H 1 1.45 0.02 A 49 ARG C C 13 180.1 0.2 A 49 ARG CA C 13 60.3 0.2 A 49 ARG CB C 13 29.6 0.2 A 49 ARG CD C 13 43.4 0.2 A 49 ARG CG C 13 29.6 0.2 A 49 ARG N N 15 122.1 0.2 A 50 PHE H H 1 8.30 0.02 A 50 PHE HA H 1 4.55 0.02 A 50 PHE HBy H 1 3.69 0.02 A 50 PHE HBx H 1 2.98 0.02 A 50 PHE HDx H 1 6.76 0.02 A 50 PHE HDy H 1 6.76 0.02 A 50 PHE HEx H 1 6.78 0.02 A 50 PHE HEy H 1 6.78 0.02 A 50 PHE C C 13 178.4 0.2 A 50 PHE CA C 13 57.5 0.2 A 50 PHE CB C 13 36.9 0.2 A 50 PHE CDx C 13 128.6 0.2 A 50 PHE CDy C 13 128.6 0.2 A 50 PHE CEx C 13 130.7 0.2 A 50 PHE CEy C 13 130.7 0.2 A 50 PHE N N 15 122.1 0.2 A 51 LEU H H 1 8.46 0.02 A 51 LEU HBy H 1 1.95 0.02 A 51 LEU HBx H 1 1.63 0.02 A 51 LEU HDx% H 1 1.11 0.02 A 51 LEU HDy% H 1 1.11 0.02 A 51 LEU HG H 1 0.95 0.02 A 51 LEU CA C 13 55.92 . A 51 LEU CB C 13 42.4 0.2 A 51 LEU CDx C 13 23.9 0.2 A 51 LEU CDy C 13 23.9 0.2 A 51 LEU CG C 13 26.0 0.2 A 51 LEU N N 15 117.0 0.2 A 52 LYS H H 1 7.66 0.02 A 52 LYS HA H 1 4.18 0.02 A 52 LYS HBy H 1 2.12 0.02 A 52 LYS HBx H 1 2.01 0.02 A 52 LYS HDx H 1 1.75 0.02 A 52 LYS HDy H 1 1.75 0.02 A 52 LYS HEx H 1 3.02 0.02 A 52 LYS HEy H 1 3.02 0.02 A 52 LYS HGy H 1 1.82 0.02 A 52 LYS HGx H 1 1.58 0.02 A 52 LYS C C 13 178.3 0.2 A 52 LYS CA C 13 58.7 0.2 A 52 LYS CB C 13 32.7 0.2 A 52 LYS CD C 13 29.2 0.2 A 52 LYS CE C 13 42.2 0.2 A 52 LYS CG C 13 25.3 0.2 A 52 LYS N N 15 119.1 0.2 A 53 THR H H 1 7.43 0.02 A 53 THR HA H 1 4.57 0.02 A 53 THR HB H 1 4.26 0.02 A 53 THR HG2% H 1 0.86 0.02 A 53 THR C C 13 173.8 0.2 A 53 THR CA C 13 62.6 0.2 A 53 THR CB C 13 70.8 0.2 A 53 THR CG2 C 13 22.1 0.2 A 53 THR N N 15 107.4 0.2 A 54 VAL H H 1 8.50 0.02 A 54 VAL HA H 1 4.54 0.02 A 54 VAL HB H 1 1.90 0.02 A 54 VAL HGx% H 1 0.79 0.02 A 54 VAL HGy% H 1 0.79 0.02 A 54 VAL C C 13 179.4 0.2 A 54 VAL CA C 13 59.1 0.2 A 54 VAL CB C 13 33.5 0.2 A 54 VAL CGx C 13 21.1 0.2 A 54 VAL CGy C 13 21.1 0.2 A 54 VAL N N 15 125.2 0.2 A 55 PRO HA H 1 4.59 0.02 A 55 PRO HBy H 1 2.38 0.02 A 55 PRO HBx H 1 1.82 0.02 A 55 PRO HDy H 1 3.80 0.02 A 55 PRO HDx H 1 3.51 0.02 A 55 PRO HGy H 1 1.97 0.02 A 55 PRO HGx H 1 1.85 0.02 A 55 PRO C C 13 179.4 0.2 A 55 PRO CA C 13 62.1 0.2 A 55 PRO CB C 13 32.9 0.2 A 55 PRO CD C 13 50.7 0.2 A 55 PRO CG C 13 27.9 0.2 A 56 TRP H H 1 8.69 0.02 A 56 TRP HA H 1 3.99 0.02 A 56 TRP HBy H 1 3.31 0.02 A 56 TRP HBx H 1 3.12 0.02 A 56 TRP HD1 H 1 7.54 0.02 A 56 TRP HE1 H 1 10.08 0.02 A 56 TRP HH2 H 1 6.96 0.02 A 56 TRP HZ2 H 1 7.41 0.02 A 56 TRP HZ3 H 1 6.57 0.02 A 56 TRP C C 13 177.5 0.2 A 56 TRP CA C 13 61.0 0.2 A 56 TRP CB C 13 27.4 0.2 A 56 TRP CD1 C 13 128.0 0.2 A 56 TRP CH2 C 13 124.5 0.2 A 56 TRP CZ2 C 13 114.4 0.2 A 56 TRP CZ3 C 13 120.7 0.2 A 56 TRP N N 15 122.5 0.2 A 56 TRP NE1 N 15 129.8 0.2 A 57 GLU H H 1 8.41 0.02 A 57 GLU HA H 1 3.27 0.02 A 57 GLU HBx H 1 1.20 0.02 A 57 GLU HBy H 1 1.20 0.02 A 57 GLU HGy H 1 1.39 0.02 A 57 GLU HGx H 1 0.38 0.02 A 57 GLU C C 13 178.0 0.2 A 57 GLU CA C 13 60.2 0.2 A 57 GLU CB C 13 28.2 0.2 A 57 GLU CG C 13 35.0 0.2 A 57 GLU N N 15 120.6 0.2 A 58 GLN H H 1 7.60 0.02 A 58 GLN HA H 1 4.17 0.02 A 58 GLN HBy H 1 2.06 0.02 A 58 GLN HBx H 1 1.83 0.02 A 58 GLN HGx H 1 2.24 0.02 A 58 GLN HGy H 1 2.24 0.02 A 58 GLN C C 13 175.5 0.2 A 58 GLN CA C 13 56.0 0.2 A 58 GLN CB C 13 29.6 0.2 A 58 GLN CG C 13 34.1 0.2 A 58 GLN N N 15 114.7 0.2 A 59 LEU H H 1 7.44 0.02 A 59 LEU HA H 1 4.22 0.02 A 59 LEU HBy H 1 1.60 0.02 A 59 LEU HBx H 1 1.42 0.02 A 59 LEU HDx% H 1 0.81 0.02 A 59 LEU HDy% H 1 0.81 0.02 A 59 LEU HG H 1 0.81 0.02 A 59 LEU C C 13 175.1 0.2 A 59 LEU CA C 13 55.6 0.2 A 59 LEU CB C 13 44.7 0.2 A 59 LEU CDx C 13 24.8 0.2 A 59 LEU CDy C 13 24.8 0.2 A 59 LEU CG C 13 25.9 0.2 A 59 LEU N N 15 119.5 0.2 A 60 LEU H H 1 8.12 0.02 A 60 LEU HA H 1 4.41 0.02 A 60 LEU HBy H 1 2.07 0.02 A 60 LEU HBx H 1 1.53 0.02 A 60 LEU HDx% H 1 0.99 0.02 A 60 LEU HDy% H 1 0.99 0.02 A 60 LEU HG H 1 0.90 0.02 A 60 LEU C C 13 176.1 0.2 A 60 LEU CA C 13 55.4 0.2 A 60 LEU CB C 13 42.9 0.2 A 60 LEU CDx C 13 24.2 0.2 A 60 LEU CDy C 13 24.2 0.2 A 60 LEU CG C 13 27.2 0.2 A 60 LEU N N 15 119.3 0.2 A 61 ASN H H 1 9.12 0.02 A 61 ASN HBy H 1 3.28 0.02 A 61 ASN HBx H 1 2.21 0.02 A 61 ASN HD2y H 1 7.98 0.02 A 61 ASN HD2x H 1 7.32 0.02 A 61 ASN C C 13 175.6 0.2 A 61 ASN CA C 13 51.3 0.2 A 61 ASN CB C 13 36.8 0.2 A 61 ASN N N 15 124.9 0.2 A 61 ASN ND2 N 15 111.7 0.2 A 62 ARG H H 1 8.14 0.02 A 62 ARG HA H 1 3.45 0.02 A 62 ARG HBy H 1 1.62 0.02 A 62 ARG HBx H 1 1.49 0.02 A 62 ARG HDx H 1 3.04 0.02 A 62 ARG HDy H 1 3.04 0.02 A 62 ARG HGy H 1 1.13 0.02 A 62 ARG HGx H 1 -0.08 0.02 A 62 ARG C C 13 175.2 0.2 A 62 ARG CA C 13 57.6 0.2 A 62 ARG CB C 13 30.2 0.2 A 62 ARG CD C 13 44.2 0.2 A 62 ARG CG C 13 28.1 0.2 A 62 ARG N N 15 125.5 0.2 A 63 ALA H H 1 7.61 0.2 A 63 ALA HA H 1 4.46 0.02 A 63 ALA HB% H 1 1.47 0.02 A 63 ALA C C 13 178.3 0.2 A 63 ALA CA C 13 51.8 0.2 A 63 ALA CB C 13 19.3 0.2 A 63 ALA N N 15 118.6 0.2 A 64 GLY H H 1 7.15 0.02 A 64 GLY HAy H 1 4.41 0.02 A 64 GLY HAx H 1 4.02 0.02 A 64 GLY C C 13 173.5 0.2 A 64 GLY CA C 13 45.4 0.2 A 64 GLY N N 15 105.7 0.2 A 65 THR H H 1 8.34 0.02 A 65 THR HA H 1 3.88 0.02 A 65 THR HB H 1 4.19 0.02 A 65 THR HG2% H 1 1.34 0.02 A 65 THR C C 13 176.3 0.2 A 65 THR CA C 13 65.5 0.2 A 65 THR CB C 13 69.0 0.2 A 65 THR CG2 C 13 22.3 0.2 A 65 THR N N 15 113.4 0.2 A 66 THR H H 1 7.94 0.02 A 66 THR HA H 1 3.82 0.02 A 66 THR HB H 1 4.01 0.02 A 66 THR HG2% H 1 1.26 0.02 A 66 THR C C 13 176.1 0.2 A 66 THR CA C 13 67.0 0.2 A 66 THR CB C 13 68.0 0.2 A 66 THR CG2 C 13 23.0 0.2 A 66 THR N N 15 116.2 0.2 A 67 PHE H H 1 8.72 0.02 A 67 PHE HA H 1 4.13 0.02 A 67 PHE HBy H 1 3.17 0.02 A 67 PHE HBx H 1 2.98 0.02 A 67 PHE HDx H 1 7.42 0.02 A 67 PHE HDy H 1 7.42 0.02 A 67 PHE HEx H 1 7.28 0.02 A 67 PHE HEy H 1 7.28 0.02 A 67 PHE C C 13 176.9 0.2 A 67 PHE CA C 13 61.5 0.2 A 67 PHE CB C 13 39.8 0.2 A 67 PHE CDx C 13 133.6 0.2 A 67 PHE CDy C 13 133.6 0.2 A 67 PHE CEx C 13 130.6 0.2 A 67 PHE CEy C 13 130.6 0.2 A 67 PHE N N 15 122.4 0.2 A 68 ARG H H 1 7.75 0.02 A 68 ARG HA H 1 3.79 0.02 A 68 ARG HBy H 1 1.98 0.02 A 68 ARG HBx H 1 1.85 0.02 A 68 ARG HDy H 1 3.22 0.02 A 68 ARG HDx H 1 3.18 0.02 A 68 ARG HGy H 1 2.10 0.02 A 68 ARG HGx H 1 1.77 0.02 A 68 ARG C C 13 176.8 0.2 A 68 ARG CA C 13 59.2 0.2 A 68 ARG CB C 13 30.2 0.2 A 68 ARG CD C 13 43.7 0.2 A 68 ARG CG C 13 28.9 0.2 A 68 ARG N N 15 114.4 0.2 A 69 LYS H H 1 7.36 0.02 A 69 LYS HA H 1 4.19 0.02 A 69 LYS HBy H 1 1.95 0.02 A 69 LYS HBx H 1 1.85 0.02 A 69 LYS C C 13 177.4 0.2 A 69 LYS CA C 13 56.7 0.2 A 69 LYS CB C 13 33.0 0.2 A 69 LYS CD C 13 29.1 0.2 A 69 LYS CE C 13 42.0 0.2 A 69 LYS CG C 13 25.3 0.2 A 69 LYS N N 15 115.6 0.2 A 70 LEU H H 1 7.44 0.02 A 70 LEU HA H 1 4.35 0.02 A 70 LEU HBy H 1 1.51 0.02 A 70 LEU HBx H 1 0.98 0.02 A 70 LEU CA C 13 53.8 0.2 A 70 LEU CB C 13 41.0 0.2 A 70 LEU N N 15 121.4 0.2 A 71 PRO HA H 1 4.46 0.02 A 71 PRO HBy H 1 2.50 0.02 A 71 PRO HBx H 1 1.94 0.02 A 71 PRO HDy H 1 3.92 0.02 A 71 PRO HDx H 1 3.31 0.02 A 71 PRO HGy H 1 2.14 0.02 A 71 PRO HGx H 1 2.11 0.02 A 71 PRO C C 13 177.5 0.2 A 71 PRO CA C 13 62.8 0.2 A 71 PRO CB C 13 32.6 0.2 A 71 PRO CD C 13 50.3 0.2 A 71 PRO CG C 13 28.0 0.2 A 72 GLU H H 1 9.01 0.02 A 72 GLU HA H 1 3.65 0.02 A 72 GLU HBy H 1 2.10 0.02 A 72 GLU HBx H 1 2.03 0.02 A 72 GLU HGx H 1 2.29 0.02 A 72 GLU HGy H 1 2.29 0.02 A 72 GLU C C 13 177.6 0.2 A 72 GLU CA C 13 60.5 0.2 A 72 GLU CB C 13 29.9 0.2 A 72 GLU CG C 13 36.2 0.2 A 72 GLU N N 15 124.1 0.2 A 73 ASP H H 1 8.86 0.02 A 73 ASP HA H 1 4.29 0.02 A 73 ASP HBy H 1 2.66 0.02 A 73 ASP HBx H 1 2.60 0.02 A 73 ASP C C 13 177.6 0.2 A 73 ASP CA C 13 56.7 0.2 A 73 ASP CB C 13 39.3 0.2 A 73 ASP N N 15 116.2 0.2 A 74 VAL H H 1 7.12 0.02 A 74 VAL HA H 1 3.74 0.02 A 74 VAL HB H 1 1.99 0.02 A 74 VAL HGx% H 1 0.99 0.02 A 74 VAL HGy% H 1 0.90 0.02 A 74 VAL C C 13 178.2 0.2 A 74 VAL CA C 13 65.0 0.2 A 74 VAL CB C 13 32.1 0.2 A 74 VAL CGy C 13 21.9 0.2 A 74 VAL CGx C 13 21.6 0.2 A 74 VAL N N 15 120.4 0.2 A 75 ARG H H 1 7.70 0.02 A 75 ARG HA H 1 3.79 0.02 A 75 ARG HBx H 1 1.75 0.02 A 75 ARG HBy H 1 1.75 0.02 A 75 ARG HDy H 1 3.28 0.02 A 75 ARG HDx H 1 2.91 0.02 A 75 ARG HGy H 1 1.27 0.02 A 75 ARG HGx H 1 0.64 0.02 A 75 ARG C C 13 178.5 0.2 A 75 ARG CA C 13 59.6 0.2 A 75 ARG CB C 13 31.1 0.2 A 75 ARG CD C 13 43.2 0.2 A 75 ARG CG C 13 28.7 0.2 A 75 ARG N N 15 115.9 0.2 A 76 SER H H 1 8.26 0.02 A 76 SER HA H 1 4.38 0.02 A 76 SER HBx H 1 3.97 0.02 A 76 SER HBy H 1 3.97 0.02 A 76 SER C C 13 174.7 0.2 A 76 SER CA C 13 60.5 0.2 A 76 SER CB C 13 63.5 0.2 A 76 SER N N 15 111.8 0.2 A 77 ASN H H 1 7.38 0.02 A 77 ASN HA H 1 5.01 0.02 A 77 ASN HBy H 1 2.92 0.02 A 77 ASN HBx H 1 2.61 0.02 A 77 ASN HD2y H 1 7.84 0.02 A 77 ASN HD2x H 1 6.95 0.02 A 77 ASN C C 13 174.3 0.2 A 77 ASN CA C 13 52.6 0.2 A 77 ASN CB C 13 39.8 0.2 A 77 ASN N N 15 118.0 0.2 A 77 ASN ND2 N 15 114.7 0.2 A 78 VAL H H 1 7.30 0.02 A 78 VAL HA H 1 3.85 0.02 A 78 VAL HB H 1 2.13 0.02 A 78 VAL HGx% H 1 1.07 0.02 A 78 VAL HGy% H 1 0.87 0.02 A 78 VAL C C 13 173.2 0.2 A 78 VAL CA C 13 63.6 0.2 A 78 VAL CB C 13 32.1 0.2 A 78 VAL CGx C 13 22.2 0.2 A 78 VAL CGy C 13 22.2 0.2 A 78 VAL N N 15 121.2 0.2 A 79 ASP H H 1 7.66 0.02 A 79 ASP HA H 1 4.38 0.02 A 79 ASP HBy H 1 3.01 0.02 A 79 ASP HBx H 1 2.71 0.02 A 79 ASP C C 13 173.7 0.2 A 79 ASP CA C 13 51.5 0.2 A 79 ASP CB C 13 41.8 0.2 A 79 ASP N N 15 127.0 0.2 A 80 ALA H H 1 8.11 0.02 A 80 ALA HA H 1 2.42 0.02 A 80 ALA HB% H 1 1.36 0.02 A 80 ALA C C 13 178.7 0.2 A 80 ALA CA C 13 55.6 0.2 A 80 ALA CB C 13 18.6 0.2 A 80 ALA N N 15 119.9 0.2 A 81 ALA H H 1 7.76 0.02 A 81 ALA HA H 1 4.03 0.02 A 81 ALA HB% H 1 1.41 0.02 A 81 ALA C C 13 180.7 0.2 A 81 ALA CA C 13 54.8 0.2 A 81 ALA CB C 13 18.3 0.2 A 81 ALA N N 15 118.5 0.2 A 82 SER H H 1 8.48 0.02 A 82 SER HA H 1 4.24 0.02 A 82 SER HBx H 1 3.92 0.02 A 82 SER HBy H 1 3.92 0.02 A 82 SER C C 13 177.2 0.2 A 82 SER CA C 13 60.3 0.2 A 82 SER CB C 13 62.7 0.2 A 82 SER N N 15 115.3 0.2 A 83 ALA H H 1 8.97 0.02 A 83 ALA HA H 1 3.82 0.02 A 83 ALA HB% H 1 1.01 0.02 A 83 ALA C C 13 178.6 0.2 A 83 ALA CA C 13 55.6 0.2 A 83 ALA CB C 13 19.4 0.2 A 83 ALA N N 15 124.7 0.2 A 84 ARG H H 1 7.25 0.02 A 84 ARG HA H 1 3.74 0.02 A 84 ARG HBx H 1 1.86 0.02 A 84 ARG HBy H 1 1.86 0.02 A 84 ARG HDy H 1 3.14 0.02 A 84 ARG HDx H 1 2.98 0.02 A 84 ARG HGy H 1 1.41 0.02 A 84 ARG HGx H 1 1.37 0.02 A 84 ARG C C 13 176.6 0.2 A 84 ARG CA C 13 60.1 0.2 A 84 ARG CB C 13 29.9 0.2 A 84 ARG CD C 13 43.0 0.2 A 84 ARG CG C 13 27.8 0.2 A 84 ARG N N 15 116.5 0.2 A 85 GLU H H 1 7.24 0.02 A 85 GLU HA H 1 3.89 0.02 A 85 GLU HBx H 1 2.08 0.02 A 85 GLU HBy H 1 2.08 0.02 A 85 GLU HGy H 1 2.38 0.02 A 85 GLU HGx H 1 2.31 0.02 A 85 GLU C C 13 179.8 0.2 A 85 GLU CA C 13 59.2 0.2 A 85 GLU CB C 13 29.3 0.2 A 85 GLU CG C 13 35.8 0.2 A 85 GLU N N 15 115.6 0.2 A 86 LEU H H 1 8.62 0.02 A 86 LEU HA H 1 4.03 0.02 A 86 LEU HBy H 1 2.01 0.02 A 86 LEU HBx H 1 1.55 0.02 A 86 LEU HDx% H 1 0.86 0.02 A 86 LEU HDy% H 1 0.86 0.02 A 86 LEU HG H 1 0.82 0.02 A 86 LEU C C 13 178.6 0.2 A 86 LEU CA C 13 58.1 0.2 A 86 LEU CB C 13 42.2 0.2 A 86 LEU CDy C 13 22.9 0.2 A 86 LEU CDx C 13 22.87 0.2 A 86 LEU CG C 13 25.4 0.2 A 86 LEU N N 15 120.8 0.2 A 87 MET H H 1 7.84 0.02 A 87 MET HA H 1 3.68 0.02 A 87 MET HBy H 1 2.19 0.02 A 87 MET HBx H 1 1.56 0.02 A 87 MET HE% H 1 2.11 0.02 A 87 MET HGy H 1 2.96 0.02 A 87 MET HGx H 1 1.92 0.02 A 87 MET C C 13 175.6 0.2 A 87 MET CA C 13 60.0 0.2 A 87 MET CB C 13 34.3 0.2 A 87 MET CE C 13 18.2 0.2 A 87 MET CG C 13 34.9 0.2 A 87 MET N N 15 116.7 0.2 A 88 LEU H H 1 7.49 0.02 A 88 LEU HA H 1 3.89 0.02 A 88 LEU HBy H 1 1.67 0.02 A 88 LEU HBx H 1 1.43 0.02 A 88 LEU HDx% H 1 0.62 0.02 A 88 LEU HDy% H 1 0.62 0.02 A 88 LEU HG H 1 0.72 0.02 A 88 LEU C C 13 179.2 0.2 A 88 LEU CA C 13 57.0 0.2 A 88 LEU CB C 13 41.8 0.2 A 88 LEU CDx C 13 23.2 0.2 A 88 LEU CDy C 13 23.2 0.2 A 88 LEU CG C 13 24.7 0.2 A 88 LEU N N 15 113.4 0.2 A 89 ALA H H 1 7.69 0.02 A 89 ALA HA H 1 4.21 0.02 A 89 ALA HB% H 1 1.53 0.02 A 89 ALA C C 13 179.1 0.2 A 89 ALA CA C 13 54.1 0.2 A 89 ALA CB C 13 19.2 0.2 A 89 ALA N N 15 119.1 0.2 A 90 GLN H H 1 8.10 0.02 A 90 GLN HBy H 1 2.13 0.02 A 90 GLN HBx H 1 2.00 0.02 A 90 GLN HE2y H 1 7.77 0.02 A 90 GLN HE2x H 1 6.69 0.02 A 90 GLN HGx H 1 2.27 0.02 A 90 GLN HGy H 1 2.27 0.02 A 90 GLN CA C 13 53.4 0.2 A 90 GLN CB C 13 30.9 0.2 A 90 GLN N N 15 115.1 0.2 A 90 GLN NE2 N 15 111.3 0.2 A 91 PRO HA H 1 4.53 0.02 A 91 PRO HBy H 1 1.81 0.02 A 91 PRO HBx H 1 1.37 0.02 A 91 PRO HDy H 1 3.66 0.02 A 91 PRO HDx H 1 3.43 0.02 A 91 PRO HGy H 1 2.00 0.02 A 91 PRO HGx H 1 1.85 0.02 A 91 PRO C C 13 178.3 0.2 A 91 PRO CA C 13 64.3 0.2 A 91 PRO CB C 13 31.8 0.2 A 91 PRO CD C 13 50.2 0.2 A 91 PRO CG C 13 27.6 0.2 A 92 SER H H 1 8.51 0.02 A 92 SER HA H 1 4.31 0.02 A 92 SER HBx H 1 4.14 0.02 A 92 SER HBy H 1 4.14 0.02 A 92 SER C C 13 174.2 0.2 A 92 SER CA C 13 62.0 0.2 A 92 SER CB C 13 62.5 0.2 A 92 SER N N 15 115.0 0.2 A 93 MET H H 1 8.79 0.02 A 93 MET HA H 1 4.56 0.02 A 93 MET HBy H 1 2.26 0.02 A 93 MET HBx H 1 2.10 0.02 A 93 MET HGy H 1 2.87 0.02 A 93 MET HGx H 1 2.57 0.02 A 93 MET C C 13 174.9 0.2 A 93 MET CA C 13 56.9 0.2 A 93 MET CB C 13 35.0 0.2 A 93 MET CG C 13 33.1 0.2 A 93 MET N N 15 118.4 0.2 A 94 VAL H H 1 7.54 0.02 A 94 VAL HA H 1 4.08 0.02 A 94 VAL HB H 1 2.18 0.02 A 94 VAL HGx% H 1 1.28 0.02 A 94 VAL HGy% H 1 0.91 0.02 A 94 VAL C C 13 178.0 0.2 A 94 VAL CA C 13 63.1 0.2 A 94 VAL CB C 13 31.7 0.2 A 94 VAL CGx C 13 21.1 0.2 A 94 VAL CGy C 13 22.7 0.2 A 94 VAL N N 15 121.0 0.2 A 95 LYS H H 1 9.55 0.02 A 95 LYS HA H 1 3.94 0.02 A 95 LYS HBy H 1 1.65 0.02 A 95 LYS HBx H 1 1.57 0.02 A 95 LYS CA C 13 58.8 0.2 A 95 LYS CB C 13 33.5 0.2 A 95 LYS CD C 13 28.9 0.2 A 95 LYS CE C 13 42.2 0.2 A 95 LYS CG C 13 26.1 0.2 A 95 LYS N N 15 131.2 0.2 A 96 ARG H H 1 8.26 0.02 A 96 ARG HBy H 1 2.04 0.02 A 96 ARG HBx H 1 1.75 0.02 A 96 ARG CA C 13 52.7 0.2 A 96 ARG CB C 13 34.4 0.2 A 96 ARG N N 15 117.1 0.2 A 97 PRO HBy H 1 2.40 0.02 A 97 PRO HBx H 1 1.95 0.02 A 97 PRO HDy H 1 3.52 0.02 A 97 PRO HDx H 1 2.93 0.02 A 97 PRO HGy H 1 1.93 0.02 A 97 PRO HGx H 1 1.59 0.02 A 97 PRO C C 13 176.6 0.2 A 97 PRO CA C 13 62.4 0.2 A 97 PRO CB C 13 34.7 0.2 A 97 PRO CD C 13 49.0 0.2 A 97 PRO CG C 13 26.0 0.2 A 98 VAL H H 1 7.54 0.02 A 98 VAL HA H 1 4.46 0.02 A 98 VAL HB H 1 1.71 0.02 A 98 VAL HGx% H 1 0.80 0.02 A 98 VAL HGy% H 1 -0.10 0.02 A 98 VAL C C 13 173.5 0.2 A 98 VAL CA C 13 64.0 0.2 A 98 VAL CB C 13 33.6 0.2 A 98 VAL CGy C 13 22.1 0.2 A 98 VAL CGx C 13 21.6 0.2 A 98 VAL N N 15 117.8 0.2 A 99 LEU H H 1 9.03 0.02 A 99 LEU HA H 1 5.41 0.02 A 99 LEU HBy H 1 1.41 0.02 A 99 LEU HBx H 1 1.26 0.02 A 99 LEU HDx% H 1 0.32 0.02 A 99 LEU HDy% H 1 0.32 0.02 A 99 LEU HG H 1 0.70 0.02 A 99 LEU C C 13 173.8 0.2 A 99 LEU CA C 13 54.3 0.2 A 99 LEU CB C 13 45.8 0.2 A 99 LEU CDx C 13 25.0 0.2 A 99 LEU CDy C 13 25.0 0.2 A 99 LEU CG C 13 27.2 0.2 A 99 LEU N N 15 131.4 0.2 A 100 GLU H H 1 9.39 0.02 A 100 GLU HA H 1 5.05 0.02 A 100 GLU HBy H 1 2.37 0.02 A 100 GLU HBx H 1 1.82 0.02 A 100 GLU HGy H 1 2.25 0.02 A 100 GLU HGx H 1 2.04 0.02 A 100 GLU C C 13 174.2 0.2 A 100 GLU CA C 13 55.3 0.2 A 100 GLU CB C 13 35.6 0.2 A 100 GLU CG C 13 36.8 0.2 A 100 GLU N N 15 125.8 0.2 A 101 ARG H H 1 7.61 0.02 A 101 ARG C C 13 175.9 0.2 A 101 ARG CA C 13 56.7 0.2 A 101 ARG CB C 13 32.5 0.2 A 101 ARG CD C 13 44.1 0.2 A 101 ARG CG C 13 26.0 0.2 A 101 ARG N N 15 125.1 0.2 A 102 ASP H H 1 10.08 0.02 A 102 ASP HA H 1 4.45 0.02 A 102 ASP HBy H 1 3.06 0.02 A 102 ASP HBx H 1 2.60 0.02 A 102 ASP C C 13 175.7 0.2 A 102 ASP CA C 13 55.3 0.2 A 102 ASP CB C 13 40.5 0.02 A 102 ASP N N 15 132.0 0.2 A 103 GLY H H 1 8.87 0.02 A 103 GLY HAy H 1 4.12 0.02 A 103 GLY HAx H 1 3.83 0.02 A 103 GLY C C 13 174.0 0.2 A 103 GLY CA C 13 45.6 0.2 A 103 GLY N N 15 102.9 0.2 A 104 LYS H H 1 8.13 0.02 A 104 LYS HA H 1 4.65 0.02 A 104 LYS HBx H 1 1.95 0.02 A 104 LYS HBy H 1 1.95 0.02 A 104 LYS C C 13 176.5 0.2 A 104 LYS CA C 13 55.5 0.2 A 104 LYS CB C 13 32.6 0.2 A 104 LYS CD C 13 28.9 0.2 A 104 LYS CE C 13 42.2 0.2 A 104 LYS CG C 13 24.7 0.2 A 104 LYS N N 15 122.4 0.2 A 105 LEU H H 1 8.92 0.02 A 105 LEU HA H 1 5.42 0.02 A 105 LEU HBy H 1 1.60 0.02 A 105 LEU HBx H 1 1.11 0.02 A 105 LEU HDx% H 1 0.58 0.02 A 105 LEU HDy% H 1 0.58 0.02 A 105 LEU HG H 1 1.52 0.02 A 105 LEU C C 13 177.2 0.2 A 105 LEU CA C 13 54.3 0.2 A 105 LEU CB C 13 45.4 0.2 A 105 LEU CDx C 13 25.1 0.2 A 105 LEU CDy C 13 25.1 0.2 A 105 LEU CG C 13 28.2 0.2 A 105 LEU N N 15 129.2 0.2 A 106 MET H H 1 8.86 0.02 A 106 MET HA H 1 4.58 0.02 A 106 MET HBy H 1 1.58 0.02 A 106 MET HBx H 1 1.47 0.02 A 106 MET HGy H 1 2.14 0.02 A 106 MET HGx H 1 2.07 0.02 A 106 MET C C 13 174.5 0.2 A 106 MET CA C 13 55.3 0.2 A 106 MET CB C 13 36.5 0.2 A 106 MET CG C 13 30.1 0.2 A 106 MET N N 15 121.5 0.2 A 107 VAL H H 1 9.18 0.02 A 107 VAL HA H 1 4.69 0.02 A 107 VAL HB H 1 1.89 0.02 A 107 VAL HGx% H 1 0.85 0.02 A 107 VAL HGy% H 1 0.78 0.02 A 107 VAL C C 13 176.2 0.2 A 107 VAL CA C 13 61.4 0.2 A 107 VAL CB C 13 33.4 0.2 A 107 VAL CGx C 13 21.6 0.2 A 107 VAL CGy C 13 21.6 0.2 A 107 VAL N N 15 129.5 0.2 A 108 GLY H H 1 8.73 0.02 A 108 GLY HAy H 1 4.43 0.02 A 108 GLY HAx H 1 3.85 0.02 A 108 GLY CA C 13 43.8 0.2 A 108 GLY N N 15 113.6 0.2 A 109 PHE HBy H 1 2.56 0.02 A 109 PHE HBx H 1 2.31 0.02 A 109 PHE HDx H 1 5.90 0.02 A 109 PHE HDy H 1 5.90 0.02 A 109 PHE HEx H 1 6.43 0.02 A 109 PHE HEy H 1 6.43 0.02 A 109 PHE HZ H 1 6.99 0.02 A 109 PHE C C 13 172.7 0.2 A 109 PHE CA C 13 58.9 0.2 A 109 PHE CB C 13 42.1 0.2 A 109 PHE CDx C 13 131.8 0.2 A 109 PHE CDy C 13 131.8 0.2 A 109 PHE CEx C 13 130.4 0.2 A 109 PHE CEy C 13 130.4 0.2 A 109 PHE CZ C 13 128.5 0.2 A 110 LYS H H 1 6.51 0.2 A 110 LYS HBy H 1 1.71 0.02 A 110 LYS HBx H 1 1.44 0.02 A 110 LYS CA C 13 53.5 0.2 A 110 LYS CB C 13 34.8 0.2 A 110 LYS N N 15 126.6 0.2 A 111 PRO HA H 1 3.36 0.02 A 111 PRO HBy H 1 2.62 0.02 A 111 PRO HBx H 1 2.10 0.02 A 111 PRO HDy H 1 3.58 0.02 A 111 PRO HDx H 1 3.05 0.02 A 111 PRO HGy H 1 2.25 0.02 A 111 PRO HGx H 1 2.07 0.02 A 111 PRO C C 13 177.1 0.2 A 111 PRO CA C 13 66.6 0.2 A 111 PRO CB C 13 31.7 0.2 A 111 PRO CD C 13 50.1 0.2 A 111 PRO CG C 13 27.5 0.2 A 112 ALA H H 1 8.45 0.02 A 112 ALA HA H 1 4.14 0.02 A 112 ALA HB% H 1 1.38 0.02 A 112 ALA C C 13 180.3 0.2 A 112 ALA CA C 13 54.9 0.2 A 112 ALA CB C 13 18.8 0.2 A 112 ALA N N 15 116.2 0.2 A 113 GLN H H 1 6.88 0.02 A 113 GLN HA H 1 4.13 0.02 A 113 GLN HBy H 1 2.37 0.02 A 113 GLN HBx H 1 1.96 0.02 A 113 GLN HE2y H 1 7.12 0.02 A 113 GLN HE2x H 1 6.48 0.02 A 113 GLN HGy H 1 2.49 0.02 A 113 GLN HGx H 1 2.38 0.02 A 113 GLN C C 13 178.4 0.2 A 113 GLN CA C 13 60.1 0.2 A 113 GLN CB C 13 29.1 0.2 A 113 GLN CG C 13 33.2 0.2 A 113 GLN N N 15 118.2 0.2 A 113 GLN NE2 N 15 108.9 0.2 A 114 TYR H H 1 7.60 0.02 A 114 TYR HA H 1 3.80 0.02 A 114 TYR HBy H 1 1.71 0.02 A 114 TYR HBx H 1 0.93 0.02 A 114 TYR HDx H 1 6.81 0.02 A 114 TYR HDy H 1 6.81 0.02 A 114 TYR HEx H 1 6.72 0.02 A 114 TYR HEy H 1 6.72 0.02 A 114 TYR C C 13 177.1 0.2 A 114 TYR CA C 13 61.7 0.2 A 114 TYR CB C 13 33.2 0.2 A 114 TYR CDx C 13 131.0 0.2 A 114 TYR CDy C 13 131.0 0.2 A 114 TYR CEx C 13 118.6 0.2 A 114 TYR CEy C 13 118.6 0.2 A 114 TYR N N 15 124.9 0.2 A 115 GLU H H 1 8.61 0.02 A 115 GLU HA H 1 4.16 0.02 A 115 GLU HBy H 1 2.34 0.02 A 115 GLU HBx H 1 2.20 0.02 A 115 GLU HGy H 1 2.67 0.02 A 115 GLU HGx H 1 2.51 0.02 A 115 GLU C C 13 178.8 0.2 A 115 GLU CA C 13 60.1 0.2 A 115 GLU CB C 13 30.0 0.2 A 115 GLU CG C 13 36.7 0.2 A 115 GLU N N 15 119.3 0.2 A 116 ALA H H 1 7.39 0.02 A 116 ALA HA H 1 4.21 0.02 A 116 ALA HB% H 1 1.52 0.02 A 116 ALA C C 13 179.7 0.2 A 116 ALA CA C 13 54.6 0.2 A 116 ALA CB C 13 18.2 0.2 A 116 ALA N N 15 118.2 0.2 A 117 TYR H H 1 7.78 0.02 A 117 TYR HA H 1 3.89 0.02 A 117 TYR HBy H 1 2.98 0.02 A 117 TYR HBx H 1 2.48 0.02 A 117 TYR HDx H 1 5.77 0.02 A 117 TYR HDy H 1 5.77 0.02 A 117 TYR HEx H 1 5.91 0.02 A 117 TYR HEy H 1 5.92 0.02 A 117 TYR C C 13 177.3 0.2 A 117 TYR CA C 13 61.1 0.2 A 117 TYR CB C 13 39.2 0.2 A 117 TYR CDx C 13 133.7 0.2 A 117 TYR CDy C 13 133.7 0.2 A 117 TYR CEx C 13 116.8 0.2 A 117 TYR CEy C 13 116.8 0.2 A 117 TYR N N 15 120.2 0.2 A 118 PHE H H 1 7.96 0.02 A 118 PHE HBy H 1 3.60 0.02 A 118 PHE HBx H 1 3.00 0.02 A 118 PHE HDx H 1 7.67 0.02 A 118 PHE HDy H 1 7.67 0.02 A 118 PHE HEx H 1 6.95 0.02 A 118 PHE HEy H 1 6.95 0.02 A 118 PHE C C 13 174.9 0.2 A 118 PHE CA C 13 57.85 . A 118 PHE CB C 13 39.1 0.2 A 118 PHE CDx C 13 133.0 0.2 A 118 PHE CDy C 13 133.0 0.2 A 118 PHE CEx C 13 130.9 0.2 A 118 PHE CEy C 13 130.9 0.2 A 118 PHE N N 15 113.1 0.2 A 119 LYS H H 1 7.67 0.02 A 119 LYS HA H 1 4.21 0.02 A 119 LYS HBy H 1 2.02 0.02 A 119 LYS HBx H 1 1.96 0.02 A 119 LYS HDx H 1 1.69 0.02 A 119 LYS HDy H 1 1.69 0.02 A 119 LYS HEx H 1 2.99 0.02 A 119 LYS HEy H 1 2.99 0.02 A 119 LYS HGx H 1 1.50 0.02 A 119 LYS HGy H 1 1.50 0.02 A 119 LYS CA C 13 57.3 0.2 A 119 LYS CB C 13 31.2 0.2 A 119 LYS CD C 13 29.1 0.2 A 119 LYS CE C 13 42.2 0.2 A 119 LYS CG C 13 24.8 0.2 A 119 LYS N N 15 120.2 0.2 A 120 LEU H H 1 8.00 0.02 A 120 LEU HA H 1 4.30 0.02 A 120 LEU HBx H 1 1.68 0.02 A 120 LEU HBy H 1 1.68 0.02 A 120 LEU CA C 13 56.5 0.2 A 120 LEU CB C 13 43.6 0.2 A 120 LEU N N 15 127.4 0.2 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 97 PRO HBx A 9 ILE HG1x 1.0 . 4.79 2 2 A 9 ILE HG2% A 9 ILE HG1x 1.0 . 4.18 3 3 A 9 ILE HG2% A 9 ILE HG1y 1.0 . 4.18 4 4 A 97 PRO HBx A 9 ILE HG1y 1.0 . 4.79 5 5 A 9 ILE HA A 10 TYR H 1.0 . 3.54 6 6 A 9 ILE HA A 100 GLU H 1.0 . 4.59 7 7 A 9 ILE HA A 99 LEU HA 1.0 . 3.99 8 8 A 9 ILE HA A 99 LEU HG 1.0 . 4.58 9 9 A 9 ILE HG2% A 35 HIS H 1.0 . 3.48 10 10 A 9 ILE HG2% A 33 THR H 1.0 . 4.68 11 11 A 9 ILE HG2% A 10 TYR H 1.0 . 4.70 12 12 A 9 ILE HG2% A 34 PHE HDx 1.0 . 3.75 13 13 A 9 ILE HG2% A 32 TYR HDy 1.0 . 3.53 14 14 A 9 ILE HG2% A 10 TYR HA 1.0 . 4.37 15 15 A 9 ILE HG2% A 32 TYR HBy 1.0 . 4.53 16 16 A 9 ILE HG2% A 18 MET HE% 1.0 . 3.71 17 17 A 32 TYR HDy A 9 ILE HD1% 1.0 . 4.38 18 18 A 9 ILE HA A 9 ILE HD1% 1.0 . 4.93 19 19 A 9 ILE HD1% A 21 ALA HA 1.0 . 5.50 20 20 A 97 PRO HBx A 9 ILE HD1% 1.0 . 4.05 21 21 A 9 ILE HD1% A 97 PRO HBy 1.0 . 3.79 22 22 A 9 ILE HD1% A 9 ILE HB 1.0 . 3.49 23 23 A 9 ILE HG2% A 9 ILE HD1% 1.0 . 3.07 24 24 A 9 ILE HD1% A 22 ARG HA 1.0 . 4.92 25 25 A 9 ILE HD1% A 97 PRO HDx 1.0 . 5.50 26 26 A 10 TYR HA A 11 GLY H 1.0 . 3.34 27 27 A 98 VAL HB A 10 TYR HBy 1.0 . 4.09 28 28 A 98 VAL HGx% A 10 TYR HBy 1.0 . 4.66 29 29 A 98 VAL HB A 10 TYR HBx 1.0 . 4.09 30 30 A 33 THR H A 8 THR HA 1.0 . 3.61 31 31 A 8 THR HA A 8 THR HG2% 1.0 . 3.39 32 32 A 35 HIS H A 8 THR HG2% 1.0 . 4.23 33 33 A 33 THR H A 8 THR HG2% 1.0 . 4.48 34 34 A 8 THR HG2% A 33 THR HB 1.0 . 3.82 35 35 A 8 THR HG2% A 35 HIS HBy 1.0 . 4.05 36 36 A 8 THR HG2% A 35 HIS HBx 1.0 . 4.05 37 37 A 7 VAL HB A 32 TYR HA 1.0 . 4.98 38 38 A 78 VAL H A 78 VAL HGx% 1.0 . 3.89 39 39 A 5 MET HBx A 5 MET HGx 1.0 . 2.98 40 40 A 5 MET HBy A 5 MET HGy 1.0 . 2.98 41 41 A 5 MET HBx A 5 MET HGy 1.0 . 2.98 42 42 A 5 MET HBy A 5 MET HGx 1.0 . 2.98 43 43 A 12 ILE HA A 12 ILE HG2% 1.0 . 3.40 44 44 A 12 ILE HD1% A 13 LYS H 1.0 . 4.61 45 45 A 12 ILE HA A 12 ILE HD1% 1.0 . 4.89 46 46 A 12 ILE HD1% A 12 ILE HB 1.0 . 3.36 47 47 A 12 ILE HG2% A 12 ILE HD1% 1.0 . 2.96 48 48 A 12 ILE HG2% A 13 LYS H 1.0 . 4.16 49 49 A 12 ILE HG2% A 37 TYR H 1.0 . 4.15 50 50 A 12 ILE HG2% A 12 ILE H 1.0 . 4.52 51 51 A 12 ILE HG2% A 37 TYR HBx 1.0 . 4.43 52 52 A 15 CYS H A 14 ASN HBx 1.0 . 4.90 53 53 A 15 CYS H A 14 ASN HBy 1.0 . 4.90 54 54 A 12 ILE HD1% A 15 CYS HBx 1.0 . 4.65 55 55 A 12 ILE HD1% A 15 CYS HBy 1.0 . 4.65 56 56 A 17 THR H A 16 ASP HBx 1.0 . 4.24 57 57 A 19 LYS HBx A 16 ASP HBx 1.0 . 5.50 58 58 A 16 ASP HBx A 19 LYS HBy 1.0 . 5.50 59 59 A 16 ASP HBy A 19 LYS HBx 1.0 . 5.50 60 60 A 16 ASP HBy A 19 LYS HBy 1.0 . 5.50 61 61 A 17 THR H A 16 ASP HBy 1.0 . 4.24 62 62 A 17 THR HA A 20 LYS H 1.0 . 4.32 63 63 A 17 THR H A 17 THR HG2% 1.0 . 4.33 64 64 A 17 THR HG2% A 18 MET H 1.0 . 4.29 65 65 A 17 THR HA A 17 THR HG2% 1.0 . 3.26 66 66 A 97 PRO HDx A 17 THR HG2% 1.0 . 3.38 67 67 A 17 THR HG2% A 97 PRO HDy 1.0 . 3.78 68 68 A 18 MET HA A 21 ALA H 1.0 . 4.59 69 69 A 97 PRO HBx A 18 MET HA 1.0 . 3.93 70 70 A 18 MET HA A 97 PRO HGx 1.0 . 4.84 71 71 A 18 MET HA A 21 ALA HB% 1.0 . 3.66 72 72 A 18 MET HE% A 18 MET H 1.0 . 4.93 73 73 A 10 TYR H A 18 MET HE% 1.0 . 4.93 74 74 A 18 MET HE% A 22 ARG H 1.0 . 4.70 75 75 A 18 MET HE% A 11 GLY H 1.0 . 4.17 76 76 A 18 MET HE% A 34 PHE HEx 1.0 . 3.52 77 77 A 18 MET HE% A 12 ILE H 1.0 . 3.72 78 78 A 10 TYR HA A 18 MET HE% 1.0 . 4.70 79 79 A 18 MET HE% A 18 MET HA 1.0 . 3.53 80 80 A 18 MET HE% A 18 MET HGy 1.0 . 3.83 81 81 A 18 MET HE% A 18 MET HGx 1.0 . 3.83 82 82 A 97 PRO HBx A 18 MET HE% 1.0 . 3.64 83 83 A 18 MET HE% A 9 ILE HD1% 1.0 . 3.13 84 84 A 20 LYS HA A 23 ILE HB 1.0 . 3.39 85 85 A 74 VAL HGx% A 75 ARG HA 1.0 . 3.56 86 86 A 21 ALA HA A 24 TRP H 1.0 . 4.12 87 87 A 21 ALA HA A 24 TRP HBy 1.0 . 4.28 88 88 A 21 ALA HA A 24 TRP HBx 1.0 . 4.28 89 89 A 97 PRO HDx A 21 ALA HB% 1.0 . 4.30 90 90 A 97 PRO HBy A 21 ALA HB% 1.0 . 3.78 91 91 A 18 MET HE% A 21 ALA HB% 1.0 . 3.87 92 92 A 97 PRO HGx A 21 ALA HB% 1.0 . 3.58 93 93 A 17 THR HG2% A 21 ALA HB% 1.0 . 4.00 94 94 A 9 ILE HD1% A 21 ALA HB% 1.0 . 3.56 95 95 A 22 ARG HA A 25 LEU H 1.0 . 4.56 96 96 A 22 ARG HA A 25 LEU HBx 1.0 . 3.99 97 97 A 22 ARG HA A 22 ARG HGy 1.0 . 4.25 98 98 A 22 ARG HA A 22 ARG HGx 1.0 . 4.25 99 99 A 23 ILE H A 22 ARG HBy 1.0 . 4.90 100 100 A 23 ILE H A 22 ARG HBx 1.0 . 4.90 101 101 A 23 ILE HB A 23 ILE H 1.0 . 3.66 102 102 A 23 ILE HA A 23 ILE HG1x 1.0 . 4.05 103 103 A 23 ILE H A 23 ILE HG1y 1.0 . 3.99 104 104 A 23 ILE HA A 23 ILE HG1y 1.0 . 4.05 105 105 A 23 ILE H A 23 ILE HD1% 1.0 . 3.78 106 106 A 20 LYS HA A 23 ILE HD1% 1.0 . 3.44 107 107 A 24 TRP HA A 27 ASP HBy 1.0 . 4.00 108 108 A 24 TRP HA A 23 ILE HG2% 1.0 . 4.10 109 109 A 25 LEU HA A 28 HIS H 1.0 . 3.95 110 110 A 25 LEU HA A 30 ILE HB 1.0 . 4.03 111 111 A 25 LEU HA A 25 LEU HDx% 1.0 . 3.69 112 112 A 25 LEU HA A 25 LEU HDy% 1.0 . 4.18 113 113 A 25 LEU HBy A 30 ILE H 1.0 . 4.56 114 114 A 25 LEU HBy A 32 TYR HDx 1.0 . 4.32 115 115 A 25 LEU HG A 32 TYR HEy 1.0 . 4.58 116 116 A 22 ARG HA A 25 LEU HG 1.0 . 4.58 117 117 A 9 ILE HD1% A 25 LEU HG 1.0 . 4.29 118 118 A 25 LEU HDx% A 32 TYR HDx 1.0 . 3.90 119 119 A 25 LEU HDy% A 114 TYR HDx 1.0 . 4.67 120 120 A 30 ILE HB A 25 LEU HDx% 1.0 . 3.57 121 121 A 26 GLU HA A 26 GLU HGy 1.0 . 4.13 122 122 A 26 GLU HA A 26 GLU HGx 1.0 . 4.13 123 123 A 27 ASP H A 26 GLU HBy 1.0 . 4.39 124 124 A 23 ILE HA A 26 GLU HBy 1.0 . 4.70 125 125 A 23 ILE HA A 26 GLU HBx 1.0 . 4.70 126 126 A 27 ASP H A 26 GLU HBx 1.0 . 4.39 127 127 A 26 GLU H A 26 GLU HGy 1.0 . 4.08 128 128 A 24 TRP HA A 27 ASP HBx 1.0 . 4.00 129 129 A 28 HIS H A 27 ASP HBx 1.0 . 4.39 130 130 A 27 ASP H A 27 ASP HBx 1.0 . 3.64 131 131 A 30 ILE HA A 30 ILE HG1y 1.0 . 4.01 132 132 A 30 ILE HA A 30 ILE HG1x 1.0 . 4.01 133 133 A 30 ILE H A 30 ILE HG2% 1.0 . 4.17 134 134 A 32 TYR HDx A 30 ILE HG2% 1.0 . 3.61 135 135 A 30 ILE HA A 30 ILE HG2% 1.0 . 3.31 136 136 A 30 ILE HG2% A 31 ASP HBx 1.0 . 5.27 137 137 A 30 ILE HG2% A 31 ASP HBy 1.0 . 5.27 138 138 A 30 ILE HG2% A 30 ILE HD1% 1.0 . 3.11 139 139 A 30 ILE H A 30 ILE HD1% 1.0 . 4.17 140 140 A 28 HIS H A 30 ILE HD1% 1.0 . 5.27 141 141 A 30 ILE HD1% A 24 TRP HZ3 1.0 . 4.06 142 142 A 30 ILE HA A 30 ILE HD1% 1.0 . 3.89 143 143 A 30 ILE HD1% A 28 HIS HBy 1.0 . 4.21 144 144 A 30 ILE HD1% A 28 HIS HBx 1.0 . 4.21 145 145 A 30 ILE HB A 30 ILE HD1% 1.0 . 3.51 146 146 A 32 TYR H A 31 ASP HBx 1.0 . 5.16 147 147 A 32 TYR H A 31 ASP HBy 1.0 . 5.16 148 148 A 33 THR H A 32 TYR HA 1.0 . 3.24 149 149 A 32 TYR HA A 32 TYR HDx 1.0 . 4.29 150 150 A 9 ILE HG2% A 32 TYR HA 1.0 . 5.19 151 151 A 32 TYR HA A 30 ILE HG2% 1.0 . 5.50 152 152 A 9 ILE HG2% A 32 TYR HBx 1.0 . 4.53 153 153 A 25 LEU HG A 32 TYR HBx 1.0 . 4.83 154 154 A 25 LEU HG A 32 TYR HBy 1.0 . 4.83 155 155 A 33 THR H A 32 TYR HBy 1.0 . 4.41 156 156 A 33 THR H A 33 THR HB 1.0 . 3.52 157 157 A 33 THR HB A 32 TYR HA 1.0 . 5.40 158 158 A 33 THR HB A 34 PHE HA 1.0 . 5.50 159 159 A 8 THR HA A 33 THR HB 1.0 . 3.97 160 160 A 33 THR HA A 33 THR HG2% 1.0 . 3.42 161 161 A 33 THR H A 33 THR HG2% 1.0 . 4.06 162 162 A 8 THR HA A 33 THR HG2% 1.0 . 4.51 163 163 A 34 PHE HA A 33 THR HG2% 1.0 . 4.71 164 164 A 8 THR HG2% A 33 THR HG2% 1.0 . 3.24 165 165 A 9 ILE HG2% A 34 PHE HA 1.0 . 4.02 166 166 A 36 ASP HBx A 39 LYS HA 1.0 . 4.57 167 167 A 38 LYS H A 37 TYR HBy 1.0 . 4.59 168 168 A 91 PRO HGy A 37 TYR HBy 1.0 . 4.64 169 169 A 12 ILE HG2% A 37 TYR HBy 1.0 . 4.43 170 170 A 91 PRO HBy A 37 TYR HBx 1.0 . 4.27 171 171 A 91 PRO HGy A 37 TYR HBx 1.0 . 4.64 172 172 A 38 LYS H A 37 TYR HBx 1.0 . 4.59 173 173 A 40 GLU HA A 40 GLU HGy 1.0 . 3.74 174 174 A 40 GLU HA A 40 GLU HGx 1.0 . 3.74 175 175 A 42 LEU H A 41 GLY HAx 1.0 . 3.44 176 176 A 42 LEU HG A 46 THR HB 1.0 . 5.04 177 177 A 44 ALA H A 44 ALA HB% 1.0 . 2.89 178 178 A 44 ALA HB% A 48 ASP H 1.0 . 4.54 179 179 A 44 ALA HB% A 88 LEU HG 1.0 . 3.89 180 180 A 48 ASP H A 45 GLU HA 1.0 . 4.17 181 181 A 45 GLU HA A 48 ASP HBy 1.0 . 3.99 182 182 A 45 GLU HA A 48 ASP HBx 1.0 . 3.99 183 183 A 44 ALA HB% A 45 GLU HA 1.0 . 4.13 184 184 A 45 GLU H A 45 GLU HGy 1.0 . 5.19 185 185 A 45 GLU H A 45 GLU HGx 1.0 . 5.19 186 186 A 43 ASP H A 46 THR HG2% 1.0 . 4.24 187 187 A 46 THR HG2% A 46 THR H 1.0 . 4.15 188 188 A 46 THR HG2% A 46 THR HA 1.0 . 3.24 189 189 A 47 LEU HA A 50 PHE HEx 1.0 . 5.30 190 190 A 49 ARG H A 48 ASP HBx 1.0 . 4.32 191 191 A 49 ARG HA A 49 ARG HGx 1.0 . 3.99 192 192 A 49 ARG H A 49 ARG HGx 1.0 . 4.79 193 193 A 49 ARG H A 49 ARG HGy 1.0 . 4.79 194 194 A 49 ARG HA A 49 ARG HGy 1.0 . 3.99 195 195 A 50 PHE HEx A 50 PHE HBy 1.0 . 4.73 196 196 A 50 PHE HBy A 47 LEU HDx% 1.0 . 5.09 197 197 A 50 PHE HBy A 47 LEU HDy% 1.0 . 5.09 198 198 A 50 PHE HBy A 59 LEU HDx% 1.0 . 4.48 199 199 A 50 PHE HBy A 59 LEU HDy% 1.0 . 4.48 200 200 A 50 PHE HBx A 50 PHE HEy 1.0 . 5.03 201 201 A 52 LYS H A 52 LYS HBx 1.0 . 3.96 202 202 A 52 LYS H A 52 LYS HDx 1.0 . 5.50 203 203 A 52 LYS H A 52 LYS HDy 1.0 . 5.50 204 204 A 52 LYS HA A 52 LYS HDx 1.0 . 5.45 205 205 A 52 LYS HA A 52 LYS HDy 1.0 . 5.45 206 206 A 53 THR HB A 54 VAL H 1.0 . 3.89 207 207 A 53 THR H A 53 THR HG2% 1.0 . 3.87 208 208 A 53 THR HG2% A 53 THR HA 1.0 . 4.11 209 209 A 54 VAL H A 53 THR HG2% 1.0 . 4.20 210 210 A 54 VAL H A 54 VAL HB 1.0 . 3.73 211 211 A 55 PRO HBx A 58 GLN H 1.0 . 4.91 212 212 A 58 GLN H A 55 PRO HGy 1.0 . 4.95 213 213 A 58 GLN H A 55 PRO HGx 1.0 . 4.95 214 214 A 54 VAL HA A 55 PRO HDx 1.0 . 3.85 215 215 A 54 VAL HA A 55 PRO HDy 1.0 . 3.85 216 216 A 58 GLN H A 56 TRP HA 1.0 . 4.30 217 217 A 56 TRP HA A 59 LEU H 1.0 . 4.10 218 218 A 56 TRP HA A 60 LEU H 1.0 . 4.79 219 219 A 56 TRP HA A 55 PRO HBy 1.0 . 5.18 220 220 A 56 TRP HA A 59 LEU HBy 1.0 . 3.71 221 221 A 56 TRP HA A 59 LEU HBx 1.0 . 4.09 222 222 A 56 TRP HA A 60 LEU HDy% 1.0 . 4.09 223 223 A 56 TRP HA A 59 LEU HDx% 1.0 . 4.86 224 224 A 56 TRP HA A 59 LEU HDy% 1.0 . 4.86 225 225 A 59 LEU H A 57 GLU HA 1.0 . 4.52 226 226 A 57 GLU HA A 60 LEU HG 1.0 . 4.61 227 227 A 57 GLU HA A 57 GLU HGx 1.0 . 3.93 228 228 A 57 GLU H A 57 GLU HGy 1.0 . 3.86 229 229 A 59 LEU H A 57 GLU HGy 1.0 . 5.50 230 230 A 57 GLU HA A 57 GLU HGy 1.0 . 3.93 231 231 A 59 LEU H A 57 GLU HGx 1.0 . 5.50 232 232 A 58 GLN H A 57 GLU HGx 1.0 . 4.92 233 233 A 58 GLN HA A 58 GLN HGx 1.0 . 3.54 234 234 A 58 GLN HA A 58 GLN HGy 1.0 . 3.54 235 235 A 58 GLN H A 58 GLN HBx 1.0 . 3.82 236 236 A 58 GLN H A 58 GLN HGx 1.0 . 4.03 237 237 A 58 GLN H A 58 GLN HGy 1.0 . 4.03 238 238 A 59 LEU HA A 59 LEU HG 1.0 . 3.90 239 239 A 60 LEU H A 59 LEU HBy 1.0 . 4.62 240 240 A 60 LEU H A 59 LEU HBx 1.0 . 4.75 241 241 A 59 LEU HBx A 60 LEU HBx 1.0 . 4.54 242 242 A 59 LEU HBy A 59 LEU HDy% 1.0 . 4.21 243 243 A 59 LEU HA A 59 LEU HDx% 1.0 . 4.54 244 244 A 59 LEU HA A 59 LEU HDy% 1.0 . 4.54 245 245 A 59 LEU H A 59 LEU HDx% 1.0 . 5.27 246 246 A 59 LEU H A 59 LEU HDy% 1.0 . 5.27 247 247 A 59 LEU HBy A 59 LEU HDx% 1.0 . 4.21 248 248 A 50 PHE HBx A 59 LEU HG 1.0 . 4.67 249 249 A 60 LEU H A 60 LEU HBy 1.0 . 3.97 250 250 A 60 LEU H A 60 LEU HDy% 1.0 . 4.66 251 251 A 59 LEU H A 60 LEU HDy% 1.0 . 4.07 252 252 A 60 LEU HDx% A 61 ASN HD2y 1.0 . 4.31 253 253 A 60 LEU HDx% A 60 LEU HA 1.0 . 3.71 254 254 A 60 LEU HDy% A 87 MET HE% 1.0 . 3.42 255 255 A 60 LEU HDx% A 87 MET HE% 1.0 . 3.78 256 256 A 60 LEU HBy A 60 LEU HDx% 1.0 . 3.57 257 257 A 61 ASN HBy A 62 ARG HBy 1.0 . 5.50 258 258 A 61 ASN HBy A 66 THR HG2% 1.0 . 5.50 259 259 A 61 ASN HBx A 95 LYS HA 1.0 . 4.41 260 260 A 61 ASN HD2y A 62 ARG HA 1.0 . 4.99 261 261 A 62 ARG HA A 67 PHE HBy 1.0 . 4.16 262 262 A 62 ARG HA A 62 ARG HGy 1.0 . 3.85 263 263 A 62 ARG HA A 62 ARG HGx 1.0 . 3.85 264 264 A 62 ARG HBy A 63 ALA H 1.0 . 4.56 265 265 A 63 ALA H A 62 ARG HBx 1.0 . 4.67 266 266 A 63 ALA H A 63 ALA HB% 1.0 . 2.91 267 267 A 65 THR HA A 68 ARG H 1.0 . 4.07 268 268 A 65 THR HA A 68 ARG HBy 1.0 . 3.47 269 269 A 65 THR HA A 68 ARG HBx 1.0 . 3.71 270 270 A 68 ARG HBy A 65 THR HB 1.0 . 4.78 271 271 A 68 ARG HBx A 65 THR HB 1.0 . 5.50 272 272 A 65 THR H A 65 THR HG2% 1.0 . 4.21 273 273 A 65 THR HA A 65 THR HG2% 1.0 . 3.23 274 274 A 61 ASN HD2x A 66 THR HB 1.0 . 4.31 275 275 A 66 THR HG2% A 93 MET H 1.0 . 4.48 276 276 A 66 THR HG2% A 61 ASN HD2x 1.0 . 4.61 277 277 A 66 THR HG2% A 66 THR HA 1.0 . 3.25 278 278 A 67 PHE HDy A 68 ARG HA 1.0 . 3.73 279 279 A 68 ARG HA A 68 ARG HGy 1.0 . 3.27 280 280 A 68 ARG H A 68 ARG HBx 1.0 . 4.17 281 281 A 68 ARG HBy A 67 PHE HDy 1.0 . 5.07 282 282 A 68 ARG HBx A 67 PHE HDy 1.0 . 5.50 283 283 A 68 ARG H A 68 ARG HGy 1.0 . 4.45 284 284 A 68 ARG HA A 68 ARG HGx 1.0 . 4.09 285 285 A 68 ARG HA A 68 ARG HDy 1.0 . 4.54 286 286 A 68 ARG HA A 68 ARG HDx 1.0 . 4.54 287 287 A 70 LEU HA A 71 PRO HBx 1.0 . 5.08 288 288 A 74 VAL HGx% A 70 LEU HA 1.0 . 4.22 289 289 A 70 LEU HBx A 75 ARG HGx 1.0 . 4.33 290 290 A 70 LEU HA A 71 PRO HDy 1.0 . 3.44 291 291 A 71 PRO HDy A 74 VAL HB 1.0 . 3.81 292 292 A 70 LEU HBx A 71 PRO HDy 1.0 . 3.67 293 293 A 71 PRO HDy A 74 VAL HGy% 1.0 . 4.10 294 294 A 74 VAL HGx% A 71 PRO HDy 1.0 . 3.41 295 295 A 70 LEU HBx A 71 PRO HDx 1.0 . 3.95 296 296 A 74 VAL HB A 71 PRO HDx 1.0 . 3.88 297 297 A 70 LEU HA A 71 PRO HDx 1.0 . 3.62 298 298 A 71 PRO HBy A 73 ASP H 1.0 . 4.42 299 299 A 71 PRO HBy A 74 VAL H 1.0 . 4.41 300 300 A 74 VAL HGy% A 71 PRO HBy 1.0 . 4.07 301 301 A 71 PRO HBx A 74 VAL HGy% 1.0 . 4.53 302 302 A 71 PRO HBx A 74 VAL H 1.0 . 4.66 303 303 A 71 PRO HA A 72 GLU H 1.0 . 3.15 304 304 A 72 GLU HA A 75 ARG H 1.0 . 4.15 305 305 A 72 GLU H A 72 GLU HBy 1.0 . 3.84 306 306 A 73 ASP H A 72 GLU HBy 1.0 . 4.14 307 307 A 72 GLU H A 72 GLU HBx 1.0 . 3.84 308 308 A 72 GLU H A 72 GLU HGx 1.0 . 5.41 309 309 A 72 GLU H A 72 GLU HGy 1.0 . 5.41 310 310 A 73 ASP H A 72 GLU HGx 1.0 . 5.50 311 311 A 73 ASP H A 72 GLU HGy 1.0 . 5.50 312 312 A 73 ASP H A 73 ASP HBy 1.0 . 3.68 313 313 A 74 VAL H A 73 ASP HBy 1.0 . 4.17 314 314 A 74 VAL HGy% A 73 ASP HBy 1.0 . 4.73 315 315 A 74 VAL HGy% A 73 ASP HBx 1.0 . 4.73 316 316 A 73 ASP H A 73 ASP HBx 1.0 . 3.68 317 317 A 70 LEU HBx A 74 VAL HB 1.0 . 3.47 318 318 A 23 ILE HA A 23 ILE HG2% 1.0 . 3.24 319 319 A 74 VAL HGy% A 75 ARG H 1.0 . 4.17 320 320 A 74 VAL HGy% A 74 VAL H 1.0 . 3.12 321 321 A 74 VAL HGy% A 74 VAL HA 1.0 . 2.98 322 322 A 74 VAL HGy% A 71 PRO HDx 1.0 . 3.64 323 323 A 74 VAL HGx% A 74 VAL H 1.0 . 3.85 324 324 A 78 VAL H A 74 VAL HGx% 1.0 . 5.38 325 325 A 74 VAL HGx% A 70 LEU H 1.0 . 5.37 326 326 A 74 VAL HGx% A 74 VAL HA 1.0 . 3.11 327 327 A 74 VAL HGx% A 71 PRO HDx 1.0 . 4.66 328 328 A 70 LEU HBx A 75 ARG HGy 1.0 . 4.33 329 329 A 75 ARG HA A 75 ARG HGy 1.0 . 4.14 330 330 A 70 LEU H A 75 ARG HGy 1.0 . 4.42 331 331 A 67 PHE HEy A 75 ARG HGy 1.0 . 5.02 332 332 A 70 LEU H A 75 ARG HGx 1.0 . 4.42 333 333 A 67 PHE HEy A 75 ARG HGx 1.0 . 5.02 334 334 A 75 ARG HA A 75 ARG HGx 1.0 . 4.14 335 335 A 75 ARG HA A 75 ARG HDx 1.0 . 5.50 336 336 A 75 ARG HA A 75 ARG HDy 1.0 . 5.50 337 337 A 76 SER HA A 75 ARG HBx 1.0 . 5.50 338 338 A 76 SER HA A 75 ARG HBy 1.0 . 5.50 339 339 A 77 ASN H A 77 ASN HBx 1.0 . 3.64 340 340 A 77 ASN HBy A 77 ASN HD2y 1.0 . 3.81 341 341 A 78 VAL HB A 79 ASP H 1.0 . 4.35 342 342 A 79 ASP H A 78 VAL HGx% 1.0 . 3.94 343 343 A 78 VAL HA A 78 VAL HGx% 1.0 . 3.43 344 344 A 78 VAL HA A 78 VAL HGy% 1.0 . 3.43 345 345 A 79 ASP HA A 80 ALA H 1.0 . 3.35 346 346 A 78 VAL HA A 79 ASP HA 1.0 . 4.50 347 347 A 79 ASP HA A 80 ALA HB% 1.0 . 4.49 348 348 A 79 ASP HA A 78 VAL HGx% 1.0 . 5.50 349 349 A 79 ASP HA A 78 VAL HGy% 1.0 . 5.50 350 350 A 80 ALA HB% A 79 ASP HBx 1.0 . 4.48 351 351 A 80 ALA H A 79 ASP HBx 1.0 . 3.45 352 352 A 80 ALA HA A 83 ALA H 1.0 . 4.56 353 353 A 80 ALA HA A 83 ALA HB% 1.0 . 3.55 354 354 A 80 ALA HB% A 56 TRP HE1 1.0 . 3.25 355 355 A 80 ALA H A 80 ALA HB% 1.0 . 2.80 356 356 A 80 ALA HB% A 81 ALA H 1.0 . 3.02 357 357 A 80 ALA HB% A 79 ASP HBy 1.0 . 4.48 358 358 A 81 ALA HA A 84 ARG H 1.0 . 3.94 359 359 A 82 SER HA A 85 GLU H 1.0 . 3.73 360 360 A 82 SER HA A 85 GLU HGy 1.0 . 4.40 361 361 A 82 SER HA A 85 GLU HBx 1.0 . 3.28 362 362 A 82 SER HA A 81 ALA HB% 1.0 . 4.11 363 363 A 85 GLU H A 82 SER HBx 1.0 . 5.50 364 364 A 85 GLU H A 82 SER HBy 1.0 . 5.50 365 365 A 85 GLU HBx A 82 SER HBx 1.0 . 5.50 366 366 A 85 GLU HBx A 82 SER HBy 1.0 . 5.50 367 367 A 81 ALA HB% A 82 SER HBx 1.0 . 5.50 368 368 A 81 ALA HB% A 82 SER HBy 1.0 . 5.50 369 369 A 83 ALA HB% A 84 ARG H 1.0 . 3.33 370 370 A 83 ALA HB% A 56 TRP HZ3 1.0 . 5.03 371 371 A 79 ASP H A 83 ALA HB% 1.0 . 4.60 372 372 A 80 ALA H A 83 ALA HB% 1.0 . 4.70 373 373 A 83 ALA HB% A 56 TRP HBy 1.0 . 3.95 374 374 A 83 ALA HB% A 56 TRP HBx 1.0 . 3.95 375 375 A 51 LEU HG A 84 ARG HBx 1.0 . 5.50 376 376 A 51 LEU HG A 84 ARG HBy 1.0 . 5.50 377 377 A 84 ARG H A 84 ARG HGy 1.0 . 4.31 378 378 A 51 LEU HG A 84 ARG HGx 1.0 . 3.76 379 379 A 51 LEU HG A 84 ARG HGy 1.0 . 3.76 380 380 A 84 ARG H A 84 ARG HDy 1.0 . 5.44 381 381 A 51 LEU HG A 84 ARG HDy 1.0 . 4.25 382 382 A 51 LEU HG A 84 ARG HDx 1.0 . 4.25 383 383 A 84 ARG H A 84 ARG HDx 1.0 . 5.44 384 384 A 85 GLU HA A 88 LEU H 1.0 . 4.06 385 385 A 85 GLU HA A 85 GLU HBy 1.0 . 3.00 386 386 A 85 GLU HA A 88 LEU HBx 1.0 . 3.79 387 387 A 85 GLU HBx A 86 LEU H 1.0 . 3.78 388 388 A 85 GLU HBx A 81 ALA HB% 1.0 . 5.50 389 389 A 85 GLU HBx A 86 LEU HDx% 1.0 . 5.50 390 390 A 85 GLU HBx A 86 LEU HDy% 1.0 . 5.50 391 391 A 85 GLU H A 85 GLU HGy 1.0 . 3.49 392 392 A 86 LEU H A 85 GLU HGy 1.0 . 4.72 393 393 A 86 LEU H A 85 GLU HGx 1.0 . 4.72 394 394 A 82 SER HA A 85 GLU HGx 1.0 . 4.40 395 395 A 81 ALA HB% A 85 GLU HGx 1.0 . 4.55 396 396 A 81 ALA HB% A 85 GLU HGy 1.0 . 4.55 397 397 A 83 ALA HA A 86 LEU HG 1.0 . 4.51 398 398 A 87 MET H A 86 LEU HDy% 1.0 . 5.50 399 399 A 87 MET HE% A 86 LEU HDx% 1.0 . 4.30 400 400 A 87 MET HE% A 86 LEU HDy% 1.0 . 4.30 401 401 A 87 MET HA A 87 MET HGy 1.0 . 3.80 402 402 A 87 MET HA A 87 MET HGx 1.0 . 3.80 403 403 A 87 MET HE% A 87 MET HGy 1.0 . 4.11 404 404 A 60 LEU HDy% A 87 MET HGy 1.0 . 4.19 405 405 A 60 LEU HDy% A 87 MET HGx 1.0 . 4.19 406 406 A 87 MET HE% A 87 MET HGx 1.0 . 4.11 407 407 A 87 MET HE% A 93 MET H 1.0 . 4.75 408 408 A 87 MET HE% A 86 LEU HA 1.0 . 4.09 409 409 A 87 MET HE% A 87 MET HA 1.0 . 4.25 410 410 A 47 LEU HG A 88 LEU HA 1.0 . 4.29 411 411 A 88 LEU HA A 88 LEU HDx% 1.0 . 4.25 412 412 A 88 LEU HA A 88 LEU HDy% 1.0 . 4.25 413 413 A 88 LEU HBx A 89 ALA H 1.0 . 4.59 414 414 A 88 LEU HG A 88 LEU HA 1.0 . 3.84 415 415 A 88 LEU H A 88 LEU HDx% 1.0 . 4.99 416 416 A 88 LEU H A 88 LEU HDy% 1.0 . 4.99 417 417 A 89 ALA HB% A 90 GLN H 1.0 . 3.18 418 418 A 89 ALA H A 89 ALA HB% 1.0 . 2.82 419 419 A 88 LEU H A 89 ALA HB% 1.0 . 4.76 420 420 A 86 LEU HA A 89 ALA HB% 1.0 . 3.87 421 421 A 89 ALA HB% A 90 GLN HGx 1.0 . 4.43 422 422 A 89 ALA HB% A 90 GLN HGy 1.0 . 4.43 423 423 A 90 GLN H A 91 PRO HDy 1.0 . 4.46 424 424 A 87 MET HA A 91 PRO HA 1.0 . 4.21 425 425 A 42 LEU HG A 91 PRO HBx 1.0 . 3.71 426 426 A 87 MET HA A 91 PRO HBx 1.0 . 5.07 427 427 A 91 PRO HBy A 37 TYR HBy 1.0 . 4.27 428 428 A 91 PRO HBy A 42 LEU HG 1.0 . 4.10 429 429 A 42 LEU HG A 91 PRO HGx 1.0 . 3.98 430 430 A 91 PRO HGy A 42 LEU HG 1.0 . 4.35 431 431 A 12 ILE HG2% A 92 SER HA 1.0 . 4.42 432 432 A 12 ILE HD1% A 92 SER HA 1.0 . 4.71 433 433 A 12 ILE HG2% A 92 SER HBx 1.0 . 5.24 434 434 A 12 ILE HG2% A 92 SER HBy 1.0 . 5.24 435 435 A 66 THR HG2% A 93 MET HBx 1.0 . 4.90 436 436 A 66 THR HG2% A 93 MET HBy 1.0 . 4.90 437 437 A 93 MET H A 93 MET HGy 1.0 . 4.50 438 438 A 93 MET H A 93 MET HGx 1.0 . 4.50 439 439 A 66 THR HG2% A 93 MET HGy 1.0 . 4.03 440 440 A 66 THR HG2% A 93 MET HGx 1.0 . 4.03 441 441 A 94 VAL HA A 95 LYS H 1.0 . 3.25 442 442 A 94 VAL HA A 94 VAL HGx% 1.0 . 3.58 443 443 A 94 VAL HA A 94 VAL HGy% 1.0 . 3.58 444 444 A 95 LYS H A 94 VAL HGy% 1.0 . 4.36 445 445 A 95 LYS H A 94 VAL HGx% 1.0 . 4.36 446 446 A 95 LYS HA A 96 ARG HBy 1.0 . 5.50 447 447 A 95 LYS HA A 96 ARG HBx 1.0 . 5.50 448 448 A 97 PRO HDy A 21 ALA HB% 1.0 . 4.28 449 449 A 21 ALA HA A 97 PRO HGy 1.0 . 5.50 450 450 A 21 ALA HB% A 97 PRO HGy 1.0 . 3.92 451 451 A 97 PRO HBx A 21 ALA HB% 1.0 . 4.47 452 452 A 9 ILE HG2% A 97 PRO HBy 1.0 . 5.13 453 453 A 98 VAL HA A 98 VAL HGy% 1.0 . 3.75 454 454 A 98 VAL HGx% A 98 VAL HA 1.0 . 3.61 455 455 A 98 VAL HGy% A 99 LEU H 1.0 . 4.01 456 456 A 10 TYR HA A 98 VAL HGy% 1.0 . 5.50 457 457 A 98 VAL HGx% A 50 PHE HEy 1.0 . 4.25 458 458 A 98 VAL HGx% A 10 TYR HBx 1.0 . 4.66 459 459 A 99 LEU HA A 9 ILE HB 1.0 . 3.90 460 460 A 99 LEU HA A 98 VAL HGx% 1.0 . 4.75 461 461 A 98 VAL HGx% A 105 LEU HA 1.0 . 4.80 462 462 A 99 LEU HA A 98 VAL HGy% 1.0 . 5.50 463 463 A 98 VAL HGx% A 100 GLU HGy 1.0 . 5.43 464 464 A 98 VAL HGx% A 100 GLU HGx 1.0 . 5.43 465 465 A 101 ARG H A 100 GLU HGx 1.0 . 4.84 466 466 A 101 ARG H A 100 GLU HGy 1.0 . 4.84 467 467 A 98 VAL HGy% A 105 LEU HG 1.0 . 4.72 468 468 A 106 MET H A 105 LEU HDx% 1.0 . 4.93 469 469 A 106 MET H A 105 LEU HDy% 1.0 . 4.93 470 470 A 50 PHE HEy A 105 LEU HDx% 1.0 . 4.55 471 471 A 50 PHE HEy A 105 LEU HDy% 1.0 . 4.55 472 472 A 98 VAL HGx% A 105 LEU HDx% 1.0 . 3.37 473 473 A 98 VAL HGx% A 105 LEU HDy% 1.0 . 3.37 474 474 A 108 GLY H A 107 VAL HGy% 1.0 . 4.54 475 475 A 97 PRO HDy A 108 GLY HAy 1.0 . 4.30 476 476 A 97 PRO HDy A 108 GLY HAx 1.0 . 4.30 477 477 A 110 LYS H A 111 PRO HDy 1.0 . 4.77 478 478 A 111 PRO HDy A 110 LYS HBx 1.0 . 4.04 479 479 A 111 PRO HDy A 112 ALA HB% 1.0 . 4.25 480 480 A 112 ALA HB% A 111 PRO HDx 1.0 . 5.39 481 481 A 110 LYS HBx A 111 PRO HDx 1.0 . 4.23 482 482 A 112 ALA H A 111 PRO HBy 1.0 . 4.31 483 483 A 112 ALA H A 111 PRO HBx 1.0 . 4.31 484 484 A 24 TRP HD1 A 111 PRO HA 1.0 . 4.34 485 485 A 111 PRO HA A 113 GLN H 1.0 . 4.53 486 486 A 111 PRO HA A 114 TYR HBx 1.0 . 4.16 487 487 A 111 PRO HA A 114 TYR HBy 1.0 . 4.69 488 488 A 112 ALA HA A 115 GLU H 1.0 . 4.24 489 489 A 112 ALA HA A 115 GLU HGy 1.0 . 4.54 490 490 A 112 ALA HA A 115 GLU HBy 1.0 . 3.56 491 491 A 114 TYR HBx A 115 GLU HA 1.0 . 4.15 492 492 A 115 GLU HA A 118 PHE HDx 1.0 . 4.64 493 493 A 113 GLN H A 113 GLN HBy 1.0 . 3.81 494 494 A 110 LYS HBy A 113 GLN HBy 1.0 . 4.38 495 495 A 110 LYS HBy A 113 GLN HBx 1.0 . 4.38 496 496 A 113 GLN H A 113 GLN HBx 1.0 . 3.81 497 497 A 115 GLU HGy A 116 ALA H 1.0 . 4.47 498 498 A 115 GLU HGy A 115 GLU HA 1.0 . 3.69 499 499 A 114 TYR HBx A 115 GLU HGy 1.0 . 4.45 500 500 A 115 GLU HGx A 116 ALA HB% 1.0 . 5.50 501 501 A 114 TYR HBx A 115 GLU HGx 1.0 . 4.84 502 502 A 112 ALA HA A 115 GLU HGx 1.0 . 3.64 503 503 A 116 ALA H A 115 GLU HGx 1.0 . 4.42 504 504 A 115 GLU H A 115 GLU HGx 1.0 . 3.90 505 505 A 114 TYR HA A 114 TYR HDy 1.0 . 3.45 506 506 A 114 TYR HA A 117 TYR H 1.0 . 4.35 507 507 A 114 TYR HA A 117 TYR HBy 1.0 . 4.11 508 508 A 114 TYR HA A 117 TYR HBx 1.0 . 4.11 509 509 A 114 TYR H A 113 GLN HGy 1.0 . 4.87 510 510 A 113 GLN H A 113 GLN HGy 1.0 . 4.05 511 511 A 110 LYS H A 113 GLN HGy 1.0 . 4.48 512 512 A 113 GLN HA A 113 GLN HGy 1.0 . 4.05 513 513 A 110 LYS HBy A 113 GLN HGy 1.0 . 4.61 514 514 A 110 LYS HBy A 113 GLN HGx 1.0 . 4.61 515 515 A 113 GLN HA A 113 GLN HGx 1.0 . 4.05 516 516 A 110 LYS H A 113 GLN HGx 1.0 . 4.48 517 517 A 114 TYR H A 113 GLN HGx 1.0 . 4.87 518 518 A 112 ALA HB% A 115 GLU HBy 1.0 . 4.52 519 519 A 24 TRP HZ2 A 115 GLU HBx 1.0 . 4.49 520 520 A 116 ALA HA A 119 LYS HBy 1.0 . 4.32 521 521 A 116 ALA HA A 119 LYS H 1.0 . 4.21 522 522 A 116 ALA HB% A 117 TYR H 1.0 . 3.37 523 523 A 116 ALA H A 116 ALA HB% 1.0 . 2.77 524 524 A 116 ALA HB% A 117 TYR HA 1.0 . 4.07 525 525 A 116 ALA HB% A 117 TYR HBy 1.0 . 5.06 526 526 A 116 ALA HB% A 117 TYR HBx 1.0 . 5.06 527 527 A 116 ALA HA A 119 LYS HBx 1.0 . 4.32 528 528 A 119 LYS H A 119 LYS HBx 1.0 . 4.17 529 529 A 115 GLU HGx A 24 TRP HE1 1.0 . 4.87 530 530 A 115 GLU HGy A 24 TRP HE1 1.0 . 4.94 531 531 A 114 TYR HBy A 114 TYR H 1.0 . 4.05 532 532 A 32 TYR HDy A 99 LEU HDx% 1.0 . 5.50 533 533 A 32 TYR HDy A 99 LEU HDy% 1.0 . 5.50 534 534 A 99 LEU HG A 32 TYR HDy 1.0 . 4.43 535 535 A 99 LEU HG A 9 ILE HB 1.0 . 3.93 536 536 A 60 LEU HG A 61 ASN HD2y 1.0 . 4.92 537 537 A 59 LEU H A 60 LEU HG 1.0 . 4.28 538 538 A 60 LEU HG A 62 ARG HDx 1.0 . 5.01 539 539 A 60 LEU HG A 62 ARG HDy 1.0 . 5.01 540 540 A 51 LEU H A 51 LEU HDy% 1.0 . 4.48 541 541 A 47 LEU HG A 44 ALA HA 1.0 . 4.42 542 542 A 47 LEU HG A 88 LEU HBy 1.0 . 3.06 543 543 A 88 LEU HBy A 47 LEU HDx% 1.0 . 4.15 544 544 A 88 LEU HBy A 47 LEU HDy% 1.0 . 4.15 545 545 A 46 THR HB A 42 LEU HDx% 1.0 . 4.63 546 546 A 46 THR HB A 42 LEU HDy% 1.0 . 4.63 547 547 A 35 HIS HA A 36 ASP HBy 1.0 . 4.63 548 548 A 8 THR HG2% A 35 HIS HA 1.0 . 4.95 549 549 A 33 THR HG2% A 35 HIS HA 1.0 . 5.15 550 550 A 113 GLN H A 110 LYS HBy 1.0 . 4.43 551 551 A 28 HIS HA A 28 HIS HD2 1.0 . 4.24 552 552 A 79 ASP HA A 56 TRP HZ2 1.0 . 4.32 553 553 A 80 ALA HB% A 56 TRP HZ2 1.0 . 5.05 554 554 A 24 TRP HA A 24 TRP HD1 1.0 . 4.55 555 555 A 24 TRP HD1 A 111 PRO HBy 1.0 . 4.24 556 556 A 24 TRP HD1 A 111 PRO HBx 1.0 . 4.24 557 557 A 56 TRP H A 56 TRP HD1 1.0 . 3.36 558 558 A 56 TRP HD1 A 55 PRO HA 1.0 . 4.50 559 559 A 80 ALA HA A 56 TRP HD1 1.0 . 3.79 560 560 A 80 ALA HB% A 56 TRP HD1 1.0 . 3.72 561 561 A 117 TYR HDx A 118 PHE H 1.0 . 5.50 562 562 A 118 PHE H A 117 TYR HDy 1.0 . 5.50 563 563 A 117 TYR HA A 117 TYR HDx 1.0 . 4.94 564 564 A 117 TYR HA A 117 TYR HDy 1.0 . 5.28 565 565 A 50 PHE HA A 50 PHE HDy 1.0 . 3.42 566 566 A 47 LEU HA A 50 PHE HDx 1.0 . 4.25 567 567 A 32 TYR HDx A 31 ASP HA 1.0 . 4.32 568 568 A 32 TYR HDy A 25 LEU HG 1.0 . 4.22 569 569 A 34 PHE HDx A 34 PHE HA 1.0 . 3.85 570 570 A 67 PHE HA A 67 PHE HDx 1.0 . 4.07 571 571 A 62 ARG HA A 67 PHE HDx 1.0 . 3.87 572 572 A 67 PHE HBy A 67 PHE HDx 1.0 . 3.62 573 573 A 67 PHE HDy A 67 PHE HBx 1.0 . 3.53 574 574 A 67 PHE HDy A 68 ARG HGx 1.0 . 3.99 575 575 A 67 PHE HDy A 68 ARG HGy 1.0 . 4.42 576 576 A 118 PHE HDx A 118 PHE H 1.0 . 5.33 577 577 A 118 PHE H A 118 PHE HDy 1.0 . 5.50 578 578 A 24 TRP HZ3 A 118 PHE HDx 1.0 . 4.92 579 579 A 12 ILE HG2% A 37 TYR HDx 1.0 . 3.99 580 580 A 114 TYR HDx A 115 GLU H 1.0 . 5.50 581 581 A 115 GLU H A 114 TYR HDy 1.0 . 5.50 582 582 A 114 TYR HDy A 114 TYR H 1.0 . 3.99 583 583 A 114 TYR HDx A 24 TRP HZ3 1.0 . 3.70 584 584 A 114 TYR HDx A 24 TRP HE3 1.0 . 3.92 585 585 A 9 ILE HG2% A 32 TYR HEy 1.0 . 4.97 586 586 A 115 GLU H A 24 TRP HZ2 1.0 . 4.35 587 587 A 115 GLU HA A 24 TRP HZ2 1.0 . 3.38 588 588 A 115 GLU HGy A 24 TRP HZ2 1.0 . 3.72 589 589 A 115 GLU HGx A 24 TRP HZ2 1.0 . 3.92 590 590 A 115 GLU HBy A 24 TRP HZ2 1.0 . 4.93 591 591 A 79 ASP HA A 56 TRP HH2 1.0 . 5.05 592 592 A 118 PHE HDx A 24 TRP HH2 1.0 . 3.95 593 593 A 115 GLU HA A 24 TRP HH2 1.0 . 4.22 594 594 A 25 LEU HDx% A 24 TRP HZ3 1.0 . 4.39 595 595 A 25 LEU HDy% A 24 TRP HZ3 1.0 . 4.77 596 596 A 25 LEU HA A 24 TRP HE3 1.0 . 3.96 597 597 A 25 LEU HDy% A 24 TRP HE3 1.0 . 3.87 598 598 A 67 PHE HEy A 67 PHE HBx 1.0 . 4.77 599 599 A 67 PHE HEx A 78 VAL HGx% 1.0 . 4.34 600 600 A 67 PHE HEx A 78 VAL HGy% 1.0 . 4.34 601 601 A 12 ILE HG2% A 37 TYR HEx 1.0 . 3.95 602 602 A 13 LYS H A 34 PHE HZ 1.0 . 5.46 603 603 A 12 ILE HA A 34 PHE HZ 1.0 . 4.89 604 604 A 34 PHE HZ A 13 LYS HA 1.0 . 4.86 605 605 A 18 MET HE% A 34 PHE HZ 1.0 . 4.69 606 606 A 6 SER H A 7 VAL H 1.0 . 4.61 607 607 A 6 SER H A 5 MET HA 1.0 . 3.53 608 608 A 6 SER H A 5 MET HGy 1.0 . 4.81 609 609 A 6 SER H A 5 MET HGx 1.0 . 4.81 610 610 A 32 TYR HA A 7 VAL H 1.0 . 4.54 611 611 A 7 VAL H A 6 SER HA 1.0 . 3.10 612 612 A 7 VAL HB A 7 VAL H 1.0 . 3.57 613 613 A 7 VAL H A 7 VAL HGx% 1.0 . 4.49 614 614 A 7 VAL H A 7 VAL HGy% 1.0 . 4.49 615 615 A 8 THR H A 8 THR HB 1.0 . 3.80 616 616 A 7 VAL HB A 8 THR H 1.0 . 4.77 617 617 A 8 THR H A 100 GLU HBy 1.0 . 5.43 618 618 A 8 THR H A 100 GLU HBx 1.0 . 5.43 619 619 A 8 THR H A 7 VAL HGx% 1.0 . 4.48 620 620 A 8 THR H A 7 VAL HGy% 1.0 . 4.48 621 621 A 8 THR HG2% A 8 THR H 1.0 . 4.72 622 622 A 33 THR H A 9 ILE H 1.0 . 4.43 623 623 A 8 THR HA A 9 ILE H 1.0 . 3.26 624 624 A 9 ILE HG2% A 9 ILE H 1.0 . 3.81 625 625 A 10 TYR H A 10 TYR HDx 1.0 . 5.50 626 626 A 10 TYR H A 10 TYR HDy 1.0 . 5.50 627 627 A 10 TYR H A 9 ILE HB 1.0 . 4.52 628 628 A 11 GLY H A 37 TYR H 1.0 . 4.22 629 629 A 11 GLY H A 34 PHE HEx 1.0 . 4.74 630 630 A 11 GLY H A 36 ASP HA 1.0 . 4.71 631 631 A 12 ILE H A 18 MET HGy 1.0 . 4.71 632 632 A 12 ILE H A 18 MET HGx 1.0 . 4.71 633 633 A 12 ILE H A 12 ILE HG1y 1.0 . 4.14 634 634 A 12 ILE HD1% A 12 ILE H 1.0 . 4.56 635 635 A 12 ILE H A 12 ILE HG1x 1.0 . 4.14 636 636 A 13 LYS H A 12 ILE HB 1.0 . 3.88 637 637 A 15 CYS H A 14 ASN HA 1.0 . 3.13 638 638 A 15 CYS H A 13 LYS HA 1.0 . 5.13 639 639 A 15 CYS H A 15 CYS HBy 1.0 . 3.79 640 640 A 15 CYS H A 15 CYS HBx 1.0 . 3.79 641 641 A 12 ILE HD1% A 15 CYS H 1.0 . 5.24 642 642 A 17 THR H A 18 MET H 1.0 . 3.46 643 643 A 17 THR H A 19 LYS H 1.0 . 4.94 644 644 A 17 THR H A 17 THR HB 1.0 . 3.57 645 645 A 18 MET H A 19 LYS H 1.0 . 4.04 646 646 A 18 MET H A 17 THR HB 1.0 . 4.00 647 647 A 18 MET H A 18 MET HGy 1.0 . 4.44 648 648 A 18 MET H A 18 MET HGx 1.0 . 4.44 649 649 A 19 LYS H A 16 ASP HA 1.0 . 4.93 650 650 A 20 LYS H A 19 LYS H 1.0 . 4.28 651 651 A 20 LYS H A 19 LYS HBx 1.0 . 4.47 652 652 A 20 LYS H A 19 LYS HBy 1.0 . 4.47 653 653 A 21 ALA H A 22 ARG H 1.0 . 3.59 654 654 A 20 LYS H A 21 ALA H 1.0 . 3.56 655 655 A 17 THR HA A 21 ALA H 1.0 . 4.84 656 656 A 21 ALA H A 21 ALA HB% 1.0 . 3.13 657 657 A 22 ARG H A 23 ILE H 1.0 . 3.68 658 658 A 18 MET HA A 22 ARG H 1.0 . 4.83 659 659 A 22 ARG H A 19 LYS HA 1.0 . 4.33 660 660 A 22 ARG H A 22 ARG HDy 1.0 . 4.97 661 661 A 22 ARG H A 22 ARG HDx 1.0 . 4.97 662 662 A 22 ARG H A 22 ARG HBy 1.0 . 3.86 663 663 A 22 ARG H A 22 ARG HBx 1.0 . 3.86 664 664 A 22 ARG H A 22 ARG HGy 1.0 . 4.00 665 665 A 22 ARG H A 22 ARG HGx 1.0 . 4.00 666 666 A 21 ALA HB% A 22 ARG H 1.0 . 3.54 667 667 A 9 ILE HD1% A 22 ARG H 1.0 . 4.90 668 668 A 23 ILE H A 23 ILE HG1x 1.0 . 3.99 669 669 A 23 ILE H A 23 ILE HG2% 1.0 . 4.06 670 670 A 24 TRP H A 24 TRP HBy 1.0 . 3.61 671 671 A 24 TRP H A 24 TRP HBx 1.0 . 3.61 672 672 A 23 ILE HB A 24 TRP H 1.0 . 3.82 673 673 A 24 TRP H A 23 ILE HG2% 1.0 . 4.21 674 674 A 24 TRP H A 25 LEU HDy% 1.0 . 4.80 675 675 A 24 TRP H A 25 LEU H 1.0 . 3.84 676 676 A 25 LEU H A 24 TRP HE3 1.0 . 4.88 677 677 A 25 LEU H A 25 LEU HBx 1.0 . 3.65 678 678 A 25 LEU H A 25 LEU HDy% 1.0 . 4.10 679 679 A 25 LEU H A 25 LEU HG 1.0 . 4.33 680 680 A 23 ILE HA A 26 GLU H 1.0 . 4.34 681 681 A 26 GLU H A 26 GLU HGx 1.0 . 4.08 682 682 A 25 LEU HG A 26 GLU H 1.0 . 5.37 683 683 A 27 ASP H A 26 GLU H 1.0 . 3.58 684 684 A 28 HIS H A 27 ASP H 1.0 . 3.62 685 685 A 23 ILE HA A 27 ASP H 1.0 . 4.61 686 686 A 27 ASP H A 27 ASP HBy 1.0 . 3.64 687 687 A 23 ILE HG2% A 27 ASP H 1.0 . 4.59 688 688 A 28 HIS H A 28 HIS HBy 1.0 . 4.03 689 689 A 28 HIS H A 27 ASP HBy 1.0 . 4.39 690 690 A 28 HIS H A 28 HIS HBx 1.0 . 4.03 691 691 A 28 HIS H A 25 LEU HDx% 1.0 . 5.50 692 692 A 28 HIS H A 25 LEU HDy% 1.0 . 5.50 693 693 A 27 ASP H A 29 GLY H 1.0 . 4.75 694 694 A 28 HIS H A 29 GLY H 1.0 . 3.27 695 695 A 30 ILE HB A 29 GLY H 1.0 . 5.09 696 696 A 30 ILE H A 29 GLY H 1.0 . 3.43 697 697 A 28 HIS H A 30 ILE H 1.0 . 4.52 698 698 A 30 ILE H A 26 GLU HA 1.0 . 4.38 699 699 A 30 ILE HB A 30 ILE H 1.0 . 3.18 700 700 A 30 ILE H A 30 ILE HG1y 1.0 . 4.00 701 701 A 30 ILE H A 30 ILE HG1x 1.0 . 4.00 702 702 A 30 ILE HA A 31 ASP H 1.0 . 2.81 703 703 A 30 ILE HB A 31 ASP H 1.0 . 4.95 704 704 A 30 ILE HG2% A 31 ASP H 1.0 . 3.46 705 705 A 30 ILE HD1% A 31 ASP H 1.0 . 5.10 706 706 A 32 TYR H A 31 ASP H 1.0 . 4.50 707 707 A 32 TYR HDx A 32 TYR H 1.0 . 4.02 708 708 A 32 TYR H A 31 ASP HA 1.0 . 2.77 709 709 A 30 ILE HG2% A 32 TYR H 1.0 . 5.18 710 710 A 33 THR H A 32 TYR HBx 1.0 . 4.41 711 711 A 33 THR HA A 34 PHE H 1.0 . 3.11 712 712 A 33 THR HB A 34 PHE H 1.0 . 4.76 713 713 A 34 PHE H A 34 PHE HBy 1.0 . 3.76 714 714 A 34 PHE H A 34 PHE HBx 1.0 . 3.76 715 715 A 33 THR HG2% A 34 PHE H 1.0 . 3.75 716 716 A 35 HIS H A 33 THR HB 1.0 . 5.50 717 717 A 35 HIS H A 34 PHE HA 1.0 . 3.35 718 718 A 35 HIS H A 34 PHE HDx 1.0 . 4.28 719 719 A 35 HIS H A 11 GLY H 1.0 . 5.22 720 720 A 37 TYR H A 36 ASP H 1.0 . 4.90 721 721 A 36 ASP H A 40 GLU H 1.0 . 5.05 722 722 A 36 ASP HBx A 36 ASP H 1.0 . 3.54 723 723 A 36 ASP HBy A 36 ASP H 1.0 . 3.57 724 724 A 37 TYR H A 38 LYS H 1.0 . 3.99 725 725 A 37 TYR H A 37 TYR HDx 1.0 . 4.71 726 726 A 12 ILE HA A 37 TYR H 1.0 . 4.75 727 727 A 37 TYR H A 36 ASP HA 1.0 . 3.14 728 728 A 37 TYR H A 36 ASP HBy 1.0 . 4.53 729 729 A 38 LYS H A 39 LYS H 1.0 . 3.72 730 730 A 38 LYS H A 38 LYS HBx 1.0 . 4.14 731 731 A 38 LYS H A 38 LYS HBy 1.0 . 4.14 732 732 A 38 LYS H A 91 PRO HGy 1.0 . 5.50 733 733 A 38 LYS H A 39 LYS HBy 1.0 . 4.69 734 734 A 12 ILE HG2% A 38 LYS H 1.0 . 4.71 735 735 A 38 LYS H A 36 ASP HA 1.0 . 5.27 736 736 A 36 ASP HBx A 39 LYS H 1.0 . 4.89 737 737 A 39 LYS H A 39 LYS HBy 1.0 . 3.99 738 738 A 40 GLU H A 39 LYS H 1.0 . 3.44 739 739 A 36 ASP HBx A 40 GLU H 1.0 . 4.56 740 740 A 40 GLU H A 39 LYS HBx 1.0 . 3.47 741 741 A 40 GLU H A 39 LYS HBy 1.0 . 4.03 742 742 A 40 GLU H A 41 GLY H 1.0 . 3.41 743 743 A 39 LYS HBx A 41 GLY H 1.0 . 5.35 744 744 A 42 LEU H A 41 GLY H 1.0 . 4.60 745 745 A 42 LEU H A 41 GLY HAy 1.0 . 3.44 746 746 A 42 LEU H A 91 PRO HGx 1.0 . 5.02 747 747 A 42 LEU H A 42 LEU HBy 1.0 . 3.96 748 748 A 42 LEU H A 42 LEU HBx 1.0 . 3.96 749 749 A 42 LEU H A 42 LEU HDx% 1.0 . 5.44 750 750 A 42 LEU H A 42 LEU HDy% 1.0 . 5.44 751 751 A 42 LEU H A 42 LEU HG 1.0 . 5.05 752 752 A 43 ASP H A 42 LEU HA 1.0 . 3.02 753 753 A 46 THR HB A 43 ASP H 1.0 . 4.01 754 754 A 43 ASP H A 43 ASP HBy 1.0 . 4.11 755 755 A 43 ASP H A 43 ASP HBx 1.0 . 4.11 756 756 A 42 LEU HG A 43 ASP H 1.0 . 5.17 757 757 A 44 ALA H A 43 ASP HBy 1.0 . 3.80 758 758 A 44 ALA H A 43 ASP HBx 1.0 . 3.80 759 759 A 44 ALA H A 88 LEU HDx% 1.0 . 5.02 760 760 A 44 ALA H A 88 LEU HDy% 1.0 . 5.02 761 761 A 44 ALA H A 45 GLU H 1.0 . 3.47 762 762 A 45 GLU H A 46 THR H 1.0 . 3.32 763 763 A 45 GLU H A 43 ASP HBy 1.0 . 4.77 764 764 A 45 GLU H A 43 ASP HBx 1.0 . 4.77 765 765 A 45 GLU H A 45 GLU HBy 1.0 . 3.19 766 766 A 45 GLU H A 45 GLU HBx 1.0 . 3.19 767 767 A 44 ALA HB% A 45 GLU H 1.0 . 3.16 768 768 A 46 THR H A 45 GLU HBx 1.0 . 4.11 769 769 A 46 THR H A 45 GLU HBy 1.0 . 4.11 770 770 A 46 THR H A 45 GLU HGy 1.0 . 5.31 771 771 A 46 THR H A 45 GLU HGx 1.0 . 5.31 772 772 A 46 THR HB A 46 THR H 1.0 . 3.48 773 773 A 45 GLU H A 47 LEU H 1.0 . 5.01 774 774 A 46 THR HB A 47 LEU H 1.0 . 3.54 775 775 A 47 LEU H A 47 LEU HBy 1.0 . 3.43 776 776 A 44 ALA HB% A 47 LEU H 1.0 . 4.89 777 777 A 47 LEU H A 47 LEU HBx 1.0 . 3.43 778 778 A 47 LEU HG A 47 LEU H 1.0 . 4.62 779 779 A 46 THR HG2% A 47 LEU H 1.0 . 4.26 780 780 A 48 ASP H A 47 LEU H 1.0 . 3.59 781 781 A 48 ASP H A 49 ARG H 1.0 . 3.56 782 782 A 48 ASP H A 44 ALA HA 1.0 . 4.34 783 783 A 48 ASP H A 48 ASP HBy 1.0 . 3.62 784 784 A 48 ASP H A 48 ASP HBx 1.0 . 3.62 785 785 A 48 ASP H A 47 LEU HBy 1.0 . 4.14 786 786 A 48 ASP H A 47 LEU HBx 1.0 . 4.14 787 787 A 45 GLU HA A 49 ARG H 1.0 . 4.94 788 788 A 46 THR HA A 49 ARG H 1.0 . 4.06 789 789 A 49 ARG H A 48 ASP HBy 1.0 . 4.32 790 790 A 49 ARG H A 49 ARG HBy 1.0 . 3.62 791 791 A 49 ARG H A 49 ARG HBx 1.0 . 3.62 792 792 A 49 ARG H A 50 PHE H 1.0 . 3.39 793 793 A 50 PHE HDx A 50 PHE H 1.0 . 3.54 794 794 A 50 PHE HBx A 50 PHE H 1.0 . 3.75 795 795 A 47 LEU HA A 50 PHE H 1.0 . 3.89 796 796 A 50 PHE HBy A 50 PHE H 1.0 . 3.83 797 797 A 50 PHE H A 49 ARG HBy 1.0 . 3.87 798 798 A 50 PHE H A 49 ARG HBx 1.0 . 3.87 799 799 A 50 PHE H A 47 LEU HDx% 1.0 . 5.50 800 800 A 50 PHE H A 47 LEU HDy% 1.0 . 5.50 801 801 A 52 LYS H A 51 LEU H 1.0 . 3.87 802 802 A 50 PHE HBx A 51 LEU H 1.0 . 3.92 803 803 A 50 PHE HBy A 51 LEU H 1.0 . 4.19 804 804 A 51 LEU H A 51 LEU HBy 1.0 . 3.63 805 805 A 51 LEU H A 51 LEU HBx 1.0 . 3.63 806 806 A 51 LEU H A 51 LEU HDx% 1.0 . 4.48 807 807 A 51 LEU HG A 51 LEU H 1.0 . 4.69 808 808 A 52 LYS H A 52 LYS HBy 1.0 . 3.96 809 809 A 54 VAL H A 53 THR H 1.0 . 2.96 810 810 A 52 LYS H A 53 THR H 1.0 . 3.42 811 811 A 53 THR HB A 53 THR H 1.0 . 3.60 812 812 A 57 GLU H A 56 TRP H 1.0 . 3.98 813 813 A 56 TRP H A 55 PRO HA 1.0 . 3.12 814 814 A 55 PRO HBx A 56 TRP H 1.0 . 4.10 815 815 A 55 PRO HBy A 56 TRP H 1.0 . 4.17 816 816 A 58 GLN H A 57 GLU H 1.0 . 3.28 817 817 A 59 LEU H A 57 GLU H 1.0 . 4.31 818 818 A 57 GLU H A 55 PRO HA 1.0 . 4.83 819 819 A 55 PRO HBx A 57 GLU H 1.0 . 4.52 820 820 A 55 PRO HBy A 57 GLU H 1.0 . 3.56 821 821 A 57 GLU H A 57 GLU HGx 1.0 . 3.86 822 822 A 58 GLN H A 59 LEU H 1.0 . 3.11 823 823 A 58 GLN H A 58 GLN HBy 1.0 . 3.82 824 824 A 58 GLN H A 55 PRO HBy 1.0 . 3.50 825 825 A 58 GLN H A 57 GLU HGy 1.0 . 4.92 826 826 A 58 GLN H A 57 GLU HBx 1.0 . 4.71 827 827 A 58 GLN H A 57 GLU HBy 1.0 . 4.71 828 828 A 59 LEU H A 60 LEU HBx 1.0 . 4.90 829 829 A 59 LEU H A 59 LEU HBy 1.0 . 3.57 830 830 A 59 LEU H A 59 LEU HBx 1.0 . 3.46 831 831 A 59 LEU H A 59 LEU HG 1.0 . 5.19 832 832 A 59 LEU H A 60 LEU H 1.0 . 3.27 833 833 A 58 GLN H A 60 LEU H 1.0 . 4.44 834 834 A 60 LEU H A 57 GLU HA 1.0 . 4.80 835 835 A 60 LEU H A 60 LEU HBx 1.0 . 3.21 836 836 A 60 LEU H A 60 LEU HG 1.0 . 4.12 837 837 A 95 LYS H A 61 ASN H 1.0 . 4.56 838 838 A 60 LEU HA A 61 ASN H 1.0 . 3.10 839 839 A 94 VAL HA A 61 ASN H 1.0 . 4.40 840 840 A 61 ASN HBy A 61 ASN H 1.0 . 3.56 841 841 A 61 ASN HBx A 61 ASN H 1.0 . 3.63 842 842 A 60 LEU HBy A 61 ASN H 1.0 . 4.32 843 843 A 60 LEU HDx% A 61 ASN H 1.0 . 3.52 844 844 A 62 ARG HBy A 62 ARG H 1.0 . 3.77 845 845 A 62 ARG HBx A 62 ARG H 1.0 . 4.14 846 846 A 63 ALA HB% A 62 ARG H 1.0 . 4.49 847 847 A 63 ALA H A 64 GLY H 1.0 . 3.24 848 848 A 62 ARG HA A 64 GLY H 1.0 . 4.79 849 849 A 63 ALA HB% A 64 GLY H 1.0 . 3.79 850 850 A 66 THR HG2% A 66 THR H 1.0 . 5.19 851 851 A 63 ALA H A 62 ARG H 1.0 . 3.67 852 852 A 60 LEU H A 61 ASN H 1.0 . 5.11 853 853 A 61 ASN H A 62 ARG H 1.0 . 5.50 854 854 A 66 THR H A 67 PHE H 1.0 . 4.49 855 855 A 67 PHE HDx A 67 PHE H 1.0 . 5.34 856 856 A 67 PHE HDy A 67 PHE H 1.0 . 5.50 857 857 A 66 THR HB A 67 PHE H 1.0 . 3.62 858 858 A 67 PHE HBy A 67 PHE H 1.0 . 3.58 859 859 A 67 PHE HBx A 67 PHE H 1.0 . 3.62 860 860 A 68 ARG HGx A 67 PHE H 1.0 . 5.17 861 861 A 68 ARG HBy A 67 PHE H 1.0 . 4.86 862 862 A 66 THR HG2% A 67 PHE H 1.0 . 4.46 863 863 A 68 ARG H A 67 PHE H 1.0 . 3.63 864 864 A 68 ARG H A 69 LYS H 1.0 . 3.51 865 865 A 67 PHE HBy A 68 ARG H 1.0 . 4.18 866 866 A 68 ARG H A 67 PHE HBx 1.0 . 3.79 867 867 A 68 ARG H A 68 ARG HGx 1.0 . 3.53 868 868 A 68 ARG H A 68 ARG HBy 1.0 . 3.26 869 869 A 66 THR HA A 69 LYS H 1.0 . 5.10 870 870 A 68 ARG HA A 70 LEU H 1.0 . 4.63 871 871 A 70 LEU H A 70 LEU HBy 1.0 . 3.34 872 872 A 70 LEU HBx A 70 LEU H 1.0 . 3.71 873 873 A 73 ASP H A 75 ARG H 1.0 . 4.77 874 874 A 73 ASP H A 72 GLU HBx 1.0 . 4.14 875 875 A 74 VAL HGy% A 73 ASP H 1.0 . 4.93 876 876 A 73 ASP H A 74 VAL H 1.0 . 3.56 877 877 A 74 VAL H A 75 ARG H 1.0 . 3.15 878 878 A 74 VAL H A 73 ASP HBx 1.0 . 4.17 879 879 A 74 VAL HB A 74 VAL H 1.0 . 3.01 880 880 A 74 VAL HB A 75 ARG H 1.0 . 3.59 881 881 A 75 ARG H A 75 ARG HGy 1.0 . 4.01 882 882 A 74 VAL HGx% A 75 ARG H 1.0 . 3.97 883 883 A 75 ARG H A 75 ARG HGx 1.0 . 4.01 884 884 A 75 ARG H A 76 SER H 1.0 . 3.43 885 885 A 77 ASN H A 76 SER H 1.0 . 3.34 886 886 A 74 VAL H A 76 SER H 1.0 . 4.52 887 887 A 76 SER H A 76 SER HBx 1.0 . 3.48 888 888 A 76 SER H A 76 SER HBy 1.0 . 3.48 889 889 A 77 ASN HBy A 76 SER H 1.0 . 4.85 890 890 A 76 SER H A 75 ARG HGy 1.0 . 5.50 891 891 A 74 VAL HGx% A 76 SER H 1.0 . 5.17 892 892 A 76 SER H A 75 ARG HGx 1.0 . 5.50 893 893 A 77 ASN H A 76 SER HBx 1.0 . 4.90 894 894 A 77 ASN H A 76 SER HBy 1.0 . 4.90 895 895 A 75 ARG HA A 77 ASN H 1.0 . 4.33 896 896 A 77 ASN H A 77 ASN HBy 1.0 . 3.40 897 897 A 74 VAL HGx% A 77 ASN H 1.0 . 4.94 898 898 A 78 VAL H A 76 SER H 1.0 . 4.94 899 899 A 78 VAL H A 77 ASN HA 1.0 . 3.46 900 900 A 78 VAL H A 76 SER HA 1.0 . 4.57 901 901 A 78 VAL H A 77 ASN HBx 1.0 . 4.57 902 902 A 78 VAL H A 77 ASN HBy 1.0 . 4.49 903 903 A 78 VAL H A 78 VAL HB 1.0 . 2.90 904 904 A 78 VAL H A 78 VAL HGy% 1.0 . 3.89 905 905 A 79 ASP H A 82 SER H 1.0 . 4.17 906 906 A 79 ASP H A 78 VAL HA 1.0 . 2.91 907 907 A 79 ASP H A 78 VAL HGy% 1.0 . 3.94 908 908 A 80 ALA H A 79 ASP HBy 1.0 . 3.45 909 909 A 83 ALA H A 81 ALA H 1.0 . 4.61 910 910 A 81 ALA H A 82 SER H 1.0 . 3.15 911 911 A 80 ALA H A 81 ALA H 1.0 . 3.65 912 912 A 81 ALA H A 79 ASP HBy 1.0 . 4.78 913 913 A 81 ALA H A 79 ASP HBx 1.0 . 4.78 914 914 A 81 ALA H A 81 ALA HB% 1.0 . 2.65 915 915 A 83 ALA H A 82 SER H 1.0 . 3.11 916 916 A 84 ARG H A 82 SER H 1.0 . 4.69 917 917 A 82 SER H A 82 SER HBx 1.0 . 3.68 918 918 A 82 SER H A 82 SER HBy 1.0 . 3.68 919 919 A 81 ALA HB% A 82 SER H 1.0 . 3.07 920 920 A 83 ALA HB% A 82 SER H 1.0 . 4.50 921 921 A 79 ASP H A 83 ALA H 1.0 . 3.87 922 922 A 83 ALA H A 84 ARG H 1.0 . 3.39 923 923 A 83 ALA H A 85 GLU HBx 1.0 . 5.50 924 924 A 80 ALA HB% A 83 ALA H 1.0 . 5.37 925 925 A 83 ALA H A 83 ALA HB% 1.0 . 2.93 926 926 A 84 ARG H A 82 SER HA 1.0 . 5.11 927 927 A 84 ARG H A 85 GLU HBx 1.0 . 5.29 928 928 A 84 ARG H A 84 ARG HGx 1.0 . 4.31 929 929 A 83 ALA H A 85 GLU H 1.0 . 5.15 930 930 A 85 GLU H A 86 LEU H 1.0 . 3.49 931 931 A 85 GLU H A 85 GLU HGx 1.0 . 3.49 932 932 A 85 GLU H A 85 GLU HBx 1.0 . 2.98 933 933 A 85 GLU H A 84 ARG HBx 1.0 . 4.03 934 934 A 85 GLU H A 84 ARG HBy 1.0 . 4.03 935 935 A 85 GLU H A 81 ALA HB% 1.0 . 5.13 936 936 A 86 LEU H A 87 MET H 1.0 . 3.61 937 937 A 87 MET H A 87 MET HBy 1.0 . 4.11 938 938 A 87 MET H A 87 MET HBx 1.0 . 4.11 939 939 A 87 MET H A 86 LEU HDx% 1.0 . 5.50 940 940 A 88 LEU H A 87 MET H 1.0 . 3.64 941 941 A 88 LEU H A 88 LEU HBy 1.0 . 3.08 942 942 A 88 LEU H A 88 LEU HBx 1.0 . 3.67 943 943 A 88 LEU H A 47 LEU HG 1.0 . 3.87 944 944 A 88 LEU HG A 88 LEU H 1.0 . 4.68 945 945 A 88 LEU H A 89 ALA H 1.0 . 3.31 946 946 A 86 LEU HA A 89 ALA H 1.0 . 4.03 947 947 A 85 GLU HA A 89 ALA H 1.0 . 4.19 948 948 A 89 ALA H A 88 LEU HBy 1.0 . 3.88 949 949 A 47 LEU HG A 89 ALA H 1.0 . 5.32 950 950 A 88 LEU H A 90 GLN H 1.0 . 4.70 951 951 A 89 ALA H A 90 GLN H 1.0 . 3.18 952 952 A 86 LEU HA A 90 GLN H 1.0 . 4.57 953 953 A 87 MET HA A 90 GLN H 1.0 . 3.84 954 954 A 90 GLN H A 91 PRO HDx 1.0 . 4.46 955 955 A 90 GLN H A 90 GLN HGx 1.0 . 4.77 956 956 A 90 GLN H A 90 GLN HGy 1.0 . 4.77 957 957 A 90 GLN H A 90 GLN HBy 1.0 . 4.09 958 958 A 90 GLN H A 90 GLN HBx 1.0 . 4.09 959 959 A 93 MET H A 92 SER H 1.0 . 3.51 960 960 A 91 PRO HGy A 92 SER H 1.0 . 4.43 961 961 A 12 ILE HG2% A 92 SER H 1.0 . 4.98 962 962 A 93 MET H A 92 SER HBx 1.0 . 5.26 963 963 A 93 MET H A 92 SER HBy 1.0 . 5.26 964 964 A 93 MET H A 93 MET HBy 1.0 . 3.78 965 965 A 93 MET H A 93 MET HBx 1.0 . 3.78 966 966 A 93 MET H A 94 VAL H 1.0 . 3.43 967 967 A 92 SER HA A 94 VAL H 1.0 . 5.14 968 968 A 94 VAL H A 94 VAL HB 1.0 . 3.67 969 969 A 94 VAL H A 94 VAL HGx% 1.0 . 4.01 970 970 A 94 VAL H A 94 VAL HGy% 1.0 . 4.01 971 971 A 59 LEU HG A 95 LYS H 1.0 . 4.93 972 972 A 95 LYS H A 96 ARG H 1.0 . 4.92 973 973 A 95 LYS HA A 96 ARG H 1.0 . 2.94 974 974 A 10 TYR H A 98 VAL H 1.0 . 4.00 975 975 A 97 PRO HBx A 98 VAL H 1.0 . 4.15 976 976 A 97 PRO HBy A 98 VAL H 1.0 . 3.99 977 977 A 98 VAL HB A 98 VAL H 1.0 . 3.71 978 978 A 98 VAL HGx% A 98 VAL H 1.0 . 3.91 979 979 A 98 VAL HGy% A 98 VAL H 1.0 . 4.78 980 980 A 98 VAL HA A 99 LEU H 1.0 . 3.24 981 981 A 99 LEU H A 99 LEU HBy 1.0 . 3.93 982 982 A 99 LEU H A 99 LEU HBx 1.0 . 3.93 983 983 A 98 VAL HGx% A 99 LEU H 1.0 . 4.01 984 984 A 100 GLU H A 8 THR H 1.0 . 3.86 985 985 A 100 GLU H A 99 LEU HA 1.0 . 3.11 986 986 A 100 GLU H A 100 GLU HBy 1.0 . 4.20 987 987 A 100 GLU H A 100 GLU HBx 1.0 . 4.20 988 988 A 100 GLU H A 99 LEU HDx% 1.0 . 5.37 989 989 A 100 GLU H A 99 LEU HDy% 1.0 . 5.37 990 990 A 101 ARG H A 104 LYS H 1.0 . 4.18 991 991 A 113 GLN H A 114 TYR H 1.0 . 3.54 992 992 A 101 ARG H A 100 GLU HA 1.0 . 3.21 993 993 A 114 TYR H A 113 GLN HBy 1.0 . 3.94 994 994 A 114 TYR HBx A 114 TYR H 1.0 . 3.76 995 995 A 114 TYR H A 113 GLN HBx 1.0 . 3.94 996 996 A 115 GLU H A 114 TYR H 1.0 . 3.59 997 997 A 113 GLN H A 115 GLU H 1.0 . 4.95 998 998 A 115 GLU H A 115 GLU HGy 1.0 . 3.69 999 999 A 115 GLU H A 115 GLU HBy 1.0 . 3.39 1000 1000 A 115 GLU H A 115 GLU HBx 1.0 . 3.67 1001 1001 A 114 TYR HBx A 115 GLU H 1.0 . 4.22 1002 1002 A 115 GLU H A 116 ALA HB% 1.0 . 5.14 1003 1003 A 112 ALA HB% A 115 GLU H 1.0 . 5.21 1004 1004 A 114 TYR HBy A 115 GLU H 1.0 . 4.45 1005 1005 A 115 GLU H A 116 ALA H 1.0 . 3.72 1006 1006 A 115 GLU HBy A 116 ALA H 1.0 . 3.67 1007 1007 A 116 ALA H A 115 GLU HBx 1.0 . 3.67 1008 1008 A 116 ALA H A 117 TYR H 1.0 . 3.55 1009 1009 A 117 TYR H A 118 PHE H 1.0 . 3.58 1010 1010 A 117 TYR H A 117 TYR HDx 1.0 . 5.25 1011 1011 A 117 TYR H A 117 TYR HDy 1.0 . 5.50 1012 1012 A 117 TYR H A 117 TYR HBy 1.0 . 3.43 1013 1013 A 117 TYR H A 117 TYR HBx 1.0 . 3.43 1014 1014 A 119 LYS H A 118 PHE H 1.0 . 3.31 1015 1015 A 116 ALA HA A 118 PHE H 1.0 . 5.44 1016 1016 A 118 PHE H A 119 LYS HA 1.0 . 5.50 1017 1017 A 118 PHE H A 118 PHE HBy 1.0 . 3.94 1018 1018 A 118 PHE H A 118 PHE HBx 1.0 . 3.94 1019 1019 A 116 ALA HB% A 118 PHE H 1.0 . 5.31 1020 1020 A 119 LYS H A 119 LYS HBy 1.0 . 4.17 1021 1021 A 119 LYS H A 119 LYS HGx 1.0 . 5.18 1022 1022 A 119 LYS H A 119 LYS HGy 1.0 . 5.18 1023 1023 A 119 LYS HA A 120 LEU H 1.0 . 2.87 1024 1024 A 120 LEU H A 120 LEU HBx 1.0 . 3.56 1025 1025 A 120 LEU H A 120 LEU HBy 1.0 . 3.56 1026 1026 A 120 LEU H A 119 LYS HGx 1.0 . 5.50 1027 1027 A 120 LEU H A 119 LYS HGy 1.0 . 5.50 1028 1028 A 102 ASP H A 103 GLY H 1.0 . 4.13 1029 1029 A 104 LYS H A 103 GLY H 1.0 . 3.85 1030 1030 A 103 GLY H A 102 ASP HA 1.0 . 3.54 1031 1031 A 103 GLY H A 102 ASP HBy 1.0 . 5.11 1032 1032 A 103 GLY H A 102 ASP HBx 1.0 . 5.11 1033 1033 A 104 LYS HA A 105 LEU H 1.0 . 3.01 1034 1034 A 105 LEU H A 105 LEU HBy 1.0 . 3.89 1035 1035 A 105 LEU H A 105 LEU HBx 1.0 . 3.89 1036 1036 A 105 LEU HA A 106 MET H 1.0 . 3.05 1037 1037 A 105 LEU HG A 106 MET H 1.0 . 3.64 1038 1038 A 98 VAL HGx% A 106 MET H 1.0 . 4.26 1039 1039 A 106 MET H A 99 LEU HDx% 1.0 . 5.50 1040 1040 A 106 MET H A 99 LEU HDy% 1.0 . 5.50 1041 1041 A 98 VAL HGy% A 106 MET H 1.0 . 5.30 1042 1042 A 106 MET HA A 107 VAL H 1.0 . 3.10 1043 1043 A 107 VAL H A 107 VAL HB 1.0 . 3.74 1044 1044 A 108 GLY H A 107 VAL HA 1.0 . 3.18 1045 1045 A 97 PRO HDx A 108 GLY H 1.0 . 5.48 1046 1046 A 97 PRO HDy A 108 GLY H 1.0 . 4.18 1047 1047 A 97 PRO HGy A 108 GLY H 1.0 . 5.02 1048 1048 A 108 GLY H A 107 VAL HB 1.0 . 5.33 1049 1049 A 97 PRO HGx A 108 GLY H 1.0 . 5.50 1050 1050 A 108 GLY H A 107 VAL HGx% 1.0 . 4.54 1051 1051 A 112 ALA H A 113 GLN H 1.0 . 4.00 1052 1052 A 111 PRO HDy A 112 ALA H 1.0 . 4.81 1053 1053 A 110 LYS HBx A 112 ALA H 1.0 . 4.63 1054 1054 A 112 ALA HB% A 112 ALA H 1.0 . 3.15 1055 1055 A 113 GLN H A 113 GLN HGx 1.0 . 4.05 1056 1056 A 110 LYS HBx A 113 GLN H 1.0 . 4.11 1057 1057 A 112 ALA HB% A 113 GLN H 1.0 . 3.54 1058 1058 A 77 ASN HD2y A 73 ASP HA 1.0 . 5.08 1059 1059 A 77 ASN HBy A 77 ASN HD2x 1.0 . 3.81 1060 1060 A 73 ASP HA A 77 ASN HD2x 1.0 . 5.08 1061 1061 A 61 ASN HD2y A 66 THR HB 1.0 . 5.06 1062 1062 A 80 ALA H A 56 TRP HE1 1.0 . 4.52 1063 1063 A 79 ASP HA A 56 TRP HE1 1.0 . 5.50 1064 1064 A 80 ALA HA A 56 TRP HE1 1.0 . 4.05 1065 1065 A 111 PRO HA A 24 TRP HE1 1.0 . 4.21 1066 1066 A 24 TRP HE1 A 111 PRO HBy 1.0 . 4.30 1067 1067 A 24 TRP HE1 A 111 PRO HBx 1.0 . 4.30 1068 1068 A 120 LEU H A 119 LYS HEx 1.0 . 5.50 1069 1069 A 120 LEU H A 119 LYS HEy 1.0 . 5.50 1070 1070 A 44 ALA H A 43 ASP HA 1.0 . 3.05 1071 1071 A 8 THR H A 7 VAL HA 1.0 . 3.12 1072 1072 A 5 MET H A 5 MET HGx 1.0 . 4.71 1073 1072 A 5 MET H A 5 MET HGy 1.0 . 4.71 1074 1073 A 6 SER H A 6 SER HBy 1.0 . 3.22 1075 1073 A 6 SER H A 6 SER HBx 1.0 . 3.22 1076 1074 A 7 VAL H A 7 VAL HGy% 1.0 . 3.55 1077 1074 A 7 VAL H A 7 VAL HGx% 1.0 . 3.55 1078 1075 A 8 THR H A 7 VAL HGy% 1.0 . 3.58 1079 1075 A 8 THR H A 7 VAL HGx% 1.0 . 3.58 1080 1076 A 32 TYR HA A 7 VAL HGy% 1.0 . 4.57 1081 1076 A 32 TYR HA A 7 VAL HGx% 1.0 . 4.57 1082 1077 A 7 VAL HGy% A 32 TYR HBx 1.0 . 3.98 1083 1077 A 7 VAL HGx% A 32 TYR HBx 1.0 . 3.98 1084 1077 A 32 TYR HBy A 7 VAL HGy% 1.0 . 3.98 1085 1077 A 7 VAL HGx% A 32 TYR HBy 1.0 . 3.98 1086 1078 A 33 THR H A 7 VAL HGy% 1.0 . 4.89 1087 1078 A 33 THR H A 7 VAL HGx% 1.0 . 4.89 1088 1079 A 99 LEU HG A 7 VAL HGy% 1.0 . 3.59 1089 1079 A 99 LEU HG A 7 VAL HGx% 1.0 . 3.59 1090 1080 A 7 VAL HGy% A 99 LEU HDy% 1.0 . 3.37 1091 1080 A 7 VAL HGx% A 99 LEU HDy% 1.0 . 3.37 1092 1080 A 99 LEU HDx% A 7 VAL HGy% 1.0 . 3.37 1093 1080 A 7 VAL HGx% A 99 LEU HDx% 1.0 . 3.37 1094 1081 A 100 GLU H A 7 VAL HGy% 1.0 . 4.53 1095 1081 A 100 GLU H A 7 VAL HGx% 1.0 . 4.53 1096 1082 A 8 THR H A 100 GLU HBy 1.0 . 4.76 1097 1082 A 8 THR H A 100 GLU HBx 1.0 . 4.76 1098 1083 A 8 THR HB A 100 GLU HBy 1.0 . 4.26 1099 1083 A 8 THR HB A 100 GLU HBx 1.0 . 4.26 1100 1084 A 8 THR HG2% A 35 HIS HBy 1.0 . 3.53 1101 1084 A 8 THR HG2% A 35 HIS HBx 1.0 . 3.53 1102 1085 A 8 THR HG2% A 100 GLU HBy 1.0 . 4.56 1103 1085 A 8 THR HG2% A 100 GLU HBx 1.0 . 4.56 1104 1086 A 9 ILE H A 9 ILE HG1y 1.0 . 4.28 1105 1086 A 9 ILE H A 9 ILE HG1x 1.0 . 4.28 1106 1087 A 9 ILE HB A 99 LEU HDy% 1.0 . 4.00 1107 1087 A 9 ILE HB A 99 LEU HDx% 1.0 . 4.00 1108 1088 A 9 ILE HG2% A 32 TYR HBx 1.0 . 3.94 1109 1088 A 9 ILE HG2% A 32 TYR HBy 1.0 . 3.94 1110 1089 A 9 ILE HG2% A 34 PHE HBx 1.0 . 4.18 1111 1089 A 9 ILE HG2% A 34 PHE HBy 1.0 . 4.18 1112 1090 A 9 ILE HG2% A 35 HIS HBy 1.0 . 4.43 1113 1090 A 9 ILE HG2% A 35 HIS HBx 1.0 . 4.43 1114 1091 A 10 TYR H A 9 ILE HG1y 1.0 . 4.63 1115 1091 A 10 TYR H A 9 ILE HG1x 1.0 . 4.63 1116 1092 A 18 MET HE% A 9 ILE HG1y 1.0 . 3.17 1117 1092 A 18 MET HE% A 9 ILE HG1x 1.0 . 3.17 1118 1093 A 97 PRO HBy A 9 ILE HG1y 1.0 . 4.25 1119 1093 A 97 PRO HBy A 9 ILE HG1x 1.0 . 4.25 1120 1094 A 97 PRO HBx A 9 ILE HG1y 1.0 . 4.17 1121 1094 A 97 PRO HBx A 9 ILE HG1x 1.0 . 4.17 1122 1095 A 9 ILE HD1% A 22 ARG HDx 1.0 . 5.34 1123 1095 A 9 ILE HD1% A 22 ARG HDy 1.0 . 5.34 1124 1096 A 10 TYR HA A 35 HIS HBy 1.0 . 4.61 1125 1096 A 10 TYR HA A 35 HIS HBx 1.0 . 4.61 1126 1097 A 98 VAL H A 10 TYR HBx 1.0 . 4.31 1127 1097 A 98 VAL H A 10 TYR HBy 1.0 . 4.31 1128 1098 A 98 VAL HGx% A 10 TYR HBx 1.0 . 4.02 1129 1098 A 98 VAL HGx% A 10 TYR HBy 1.0 . 4.02 1130 1099 A 11 GLY H A 35 HIS HBy 1.0 . 4.74 1131 1099 A 11 GLY H A 35 HIS HBx 1.0 . 4.74 1132 1100 A 12 ILE H A 12 ILE HG1y 1.0 . 3.61 1133 1100 A 12 ILE H A 12 ILE HG1x 1.0 . 3.61 1134 1101 A 12 ILE H A 15 CYS HBx 1.0 . 4.88 1135 1101 A 12 ILE H A 15 CYS HBy 1.0 . 4.88 1136 1102 A 12 ILE H A 18 MET HGx 1.0 . 3.87 1137 1102 A 12 ILE H A 18 MET HGy 1.0 . 3.87 1138 1103 A 12 ILE HG2% A 37 TYR HBx 1.0 . 3.56 1139 1103 A 12 ILE HG2% A 37 TYR HBy 1.0 . 3.56 1140 1104 A 12 ILE HG2% A 92 SER HBx 1.0 . 4.40 1141 1104 A 12 ILE HG2% A 92 SER HBy 1.0 . 4.40 1142 1105 A 13 LYS H A 12 ILE HG1y 1.0 . 5.18 1143 1105 A 13 LYS H A 12 ILE HG1x 1.0 . 5.18 1144 1106 A 15 CYS H A 12 ILE HG1y 1.0 . 4.16 1145 1106 A 15 CYS H A 12 ILE HG1x 1.0 . 4.16 1146 1107 A 12 ILE HG1x A 15 CYS HBx 1.0 . 3.92 1147 1107 A 12 ILE HG1y A 15 CYS HBx 1.0 . 3.92 1148 1107 A 15 CYS HBy A 12 ILE HG1y 1.0 . 3.92 1149 1107 A 12 ILE HG1x A 15 CYS HBy 1.0 . 3.92 1150 1108 A 12 ILE HD1% A 14 ASN HBx 1.0 . 5.15 1151 1108 A 12 ILE HD1% A 14 ASN HBy 1.0 . 5.15 1152 1109 A 12 ILE HD1% A 92 SER HBx 1.0 . 4.41 1153 1109 A 12 ILE HD1% A 92 SER HBy 1.0 . 4.41 1154 1110 A 15 CYS H A 13 LYS HBy 1.0 . 5.34 1155 1110 A 15 CYS H A 13 LYS HBx 1.0 . 5.34 1156 1111 A 15 CYS H A 15 CYS HBx 1.0 . 3.27 1157 1111 A 15 CYS H A 15 CYS HBy 1.0 . 3.27 1158 1112 A 17 THR H A 15 CYS HBx 1.0 . 4.78 1159 1112 A 17 THR H A 15 CYS HBy 1.0 . 4.78 1160 1113 A 18 MET H A 15 CYS HBx 1.0 . 3.65 1161 1113 A 18 MET H A 15 CYS HBy 1.0 . 3.65 1162 1114 A 15 CYS HBx A 18 MET HGx 1.0 . 4.08 1163 1114 A 15 CYS HBy A 18 MET HGx 1.0 . 4.08 1164 1114 A 18 MET HGy A 15 CYS HBx 1.0 . 4.08 1165 1114 A 15 CYS HBy A 18 MET HGy 1.0 . 4.08 1166 1115 A 19 LYS H A 15 CYS HBx 1.0 . 5.27 1167 1115 A 19 LYS H A 15 CYS HBy 1.0 . 5.27 1168 1116 A 17 THR H A 16 ASP HBx 1.0 . 3.66 1169 1116 A 17 THR H A 16 ASP HBy 1.0 . 3.66 1170 1117 A 16 ASP HBy A 19 LYS HBy 1.0 . 4.28 1171 1117 A 19 LYS HBx A 16 ASP HBx 1.0 . 4.28 1172 1117 A 16 ASP HBy A 19 LYS HBx 1.0 . 4.28 1173 1117 A 16 ASP HBx A 19 LYS HBy 1.0 . 4.28 1174 1118 A 16 ASP HBy A 20 LYS HGy 1.0 . 4.36 1175 1118 A 16 ASP HBx A 20 LYS HGy 1.0 . 4.36 1176 1118 A 20 LYS HGx A 16 ASP HBx 1.0 . 4.36 1177 1118 A 16 ASP HBy A 20 LYS HGx 1.0 . 4.36 1178 1119 A 17 THR H A 20 LYS HGy 1.0 . 5.12 1179 1119 A 17 THR H A 20 LYS HGx 1.0 . 5.12 1180 1120 A 17 THR HA A 20 LYS HGy 1.0 . 3.51 1181 1120 A 17 THR HA A 20 LYS HGx 1.0 . 3.51 1182 1121 A 18 MET H A 18 MET HGx 1.0 . 3.73 1183 1121 A 18 MET H A 18 MET HGy 1.0 . 3.73 1184 1122 A 18 MET H A 19 LYS HBy 1.0 . 4.75 1185 1122 A 18 MET H A 19 LYS HBx 1.0 . 4.75 1186 1123 A 18 MET HE% A 18 MET HGx 1.0 . 3.21 1187 1123 A 18 MET HE% A 18 MET HGy 1.0 . 3.21 1188 1124 A 18 MET HGx A 96 ARG HBx 1.0 . 4.45 1189 1124 A 18 MET HGy A 96 ARG HBx 1.0 . 4.45 1190 1124 A 96 ARG HBy A 18 MET HGx 1.0 . 4.45 1191 1124 A 18 MET HGy A 96 ARG HBy 1.0 . 4.45 1192 1125 A 18 MET HE% A 22 ARG HDx 1.0 . 3.72 1193 1125 A 18 MET HE% A 22 ARG HDy 1.0 . 3.72 1194 1126 A 19 LYS H A 19 LYS HBy 1.0 . 3.41 1195 1126 A 19 LYS H A 19 LYS HBx 1.0 . 3.41 1196 1127 A 19 LYS H A 20 LYS HGy 1.0 . 4.46 1197 1127 A 19 LYS H A 20 LYS HGx 1.0 . 4.46 1198 1128 A 19 LYS HA A 22 ARG HBx 1.0 . 3.80 1199 1128 A 19 LYS HA A 22 ARG HBy 1.0 . 3.80 1200 1129 A 20 LYS H A 19 LYS HBy 1.0 . 3.79 1201 1129 A 20 LYS H A 19 LYS HBx 1.0 . 3.79 1202 1130 A 20 LYS H A 20 LYS HGy 1.0 . 3.29 1203 1130 A 20 LYS H A 20 LYS HGx 1.0 . 3.29 1204 1131 A 21 ALA H A 20 LYS HGy 1.0 . 4.14 1205 1131 A 21 ALA H A 20 LYS HGx 1.0 . 4.14 1206 1132 A 21 ALA HA A 24 TRP HBx 1.0 . 3.67 1207 1132 A 21 ALA HA A 24 TRP HBy 1.0 . 3.67 1208 1133 A 21 ALA HB% A 22 ARG HGx 1.0 . 4.26 1209 1133 A 21 ALA HB% A 22 ARG HGy 1.0 . 4.26 1210 1134 A 22 ARG H A 22 ARG HBx 1.0 . 3.21 1211 1134 A 22 ARG H A 22 ARG HBy 1.0 . 3.21 1212 1135 A 22 ARG H A 22 ARG HGx 1.0 . 3.36 1213 1135 A 22 ARG H A 22 ARG HGy 1.0 . 3.36 1214 1136 A 22 ARG H A 22 ARG HDx 1.0 . 4.33 1215 1136 A 22 ARG H A 22 ARG HDy 1.0 . 4.33 1216 1137 A 22 ARG HA A 22 ARG HGx 1.0 . 3.61 1217 1137 A 22 ARG HA A 22 ARG HGy 1.0 . 3.61 1218 1138 A 34 PHE HDx A 22 ARG HDx 1.0 . 5.34 1219 1138 A 34 PHE HDx A 22 ARG HDy 1.0 . 5.34 1220 1139 A 23 ILE HA A 23 ILE HG1y 1.0 . 3.56 1221 1139 A 23 ILE HA A 23 ILE HG1x 1.0 . 3.56 1222 1140 A 23 ILE HA A 26 GLU HBy 1.0 . 3.84 1223 1140 A 23 ILE HA A 26 GLU HBx 1.0 . 3.84 1224 1141 A 23 ILE HG2% A 27 ASP HBx 1.0 . 4.45 1225 1141 A 23 ILE HG2% A 27 ASP HBy 1.0 . 4.45 1226 1142 A 24 TRP HA A 27 ASP HBx 1.0 . 3.39 1227 1142 A 24 TRP HA A 27 ASP HBy 1.0 . 3.39 1228 1143 A 24 TRP HD1 A 24 TRP HBx 1.0 . 3.42 1229 1143 A 24 TRP HD1 A 24 TRP HBy 1.0 . 3.42 1230 1144 A 25 LEU H A 24 TRP HBx 1.0 . 3.77 1231 1144 A 25 LEU H A 24 TRP HBy 1.0 . 3.77 1232 1145 A 24 TRP HE1 A 111 PRO HBx 1.0 . 3.69 1233 1145 A 24 TRP HE1 A 111 PRO HBy 1.0 . 3.69 1234 1146 A 24 TRP HH2 A 118 PHE HBx 1.0 . 4.11 1235 1146 A 24 TRP HH2 A 118 PHE HBy 1.0 . 4.11 1236 1147 A 25 LEU HDx% A 28 HIS HBy 1.0 . 3.85 1237 1147 A 25 LEU HDx% A 28 HIS HBx 1.0 . 3.85 1238 1148 A 25 LEU HDy% A 28 HIS HBy 1.0 . 5.31 1239 1148 A 25 LEU HDy% A 28 HIS HBx 1.0 . 5.31 1240 1149 A 26 GLU H A 26 GLU HBy 1.0 . 3.12 1241 1149 A 26 GLU H A 26 GLU HBx 1.0 . 3.12 1242 1150 A 26 GLU H A 26 GLU HGx 1.0 . 3.49 1243 1150 A 26 GLU H A 26 GLU HGy 1.0 . 3.49 1244 1151 A 26 GLU HA A 26 GLU HGx 1.0 . 3.54 1245 1151 A 26 GLU HA A 26 GLU HGy 1.0 . 3.54 1246 1152 A 27 ASP H A 26 GLU HBy 1.0 . 3.85 1247 1152 A 27 ASP H A 26 GLU HBx 1.0 . 3.85 1248 1153 A 27 ASP H A 27 ASP HBx 1.0 . 3.02 1249 1153 A 27 ASP H A 27 ASP HBy 1.0 . 3.02 1250 1154 A 28 HIS H A 27 ASP HBx 1.0 . 3.83 1251 1154 A 28 HIS H A 27 ASP HBy 1.0 . 3.83 1252 1155 A 28 HIS H A 28 HIS HBy 1.0 . 3.31 1253 1155 A 28 HIS H A 28 HIS HBx 1.0 . 3.31 1254 1156 A 28 HIS H A 29 GLY HAx 1.0 . 4.91 1255 1156 A 28 HIS H A 29 GLY HAy 1.0 . 4.91 1256 1157 A 29 GLY H A 28 HIS HBy 1.0 . 4.19 1257 1157 A 29 GLY H A 28 HIS HBx 1.0 . 4.19 1258 1158 A 30 ILE H A 28 HIS HBy 1.0 . 4.59 1259 1158 A 30 ILE H A 28 HIS HBx 1.0 . 4.59 1260 1159 A 30 ILE HG2% A 28 HIS HBy 1.0 . 4.93 1261 1159 A 30 ILE HG2% A 28 HIS HBx 1.0 . 4.93 1262 1160 A 30 ILE HD1% A 28 HIS HBy 1.0 . 3.58 1263 1160 A 30 ILE HD1% A 28 HIS HBx 1.0 . 3.58 1264 1161 A 29 GLY H A 30 ILE HG1y 1.0 . 5.10 1265 1161 A 29 GLY H A 30 ILE HG1x 1.0 . 5.10 1266 1162 A 30 ILE H A 30 ILE HG1y 1.0 . 3.32 1267 1162 A 30 ILE H A 30 ILE HG1x 1.0 . 3.32 1268 1163 A 30 ILE HA A 30 ILE HG1y 1.0 . 3.17 1269 1163 A 30 ILE HA A 30 ILE HG1x 1.0 . 3.17 1270 1164 A 30 ILE HA A 31 ASP HBy 1.0 . 4.33 1271 1164 A 30 ILE HA A 31 ASP HBx 1.0 . 4.33 1272 1165 A 30 ILE HG2% A 31 ASP HBy 1.0 . 4.43 1273 1165 A 30 ILE HG2% A 31 ASP HBx 1.0 . 4.43 1274 1166 A 30 ILE HG2% A 32 TYR HBx 1.0 . 5.13 1275 1166 A 30 ILE HG2% A 32 TYR HBy 1.0 . 5.13 1276 1167 A 31 ASP H A 31 ASP HBy 1.0 . 2.98 1277 1167 A 31 ASP H A 31 ASP HBx 1.0 . 2.98 1278 1168 A 32 TYR HDy A 32 TYR HBx 1.0 . 3.27 1279 1168 A 32 TYR HDy A 32 TYR HBy 1.0 . 3.27 1280 1169 A 33 THR H A 32 TYR HBx 1.0 . 3.62 1281 1169 A 33 THR H A 32 TYR HBy 1.0 . 3.62 1282 1170 A 32 TYR HDy A 99 LEU HDy% 1.0 . 4.83 1283 1170 A 32 TYR HDy A 99 LEU HDx% 1.0 . 4.83 1284 1171 A 34 PHE H A 34 PHE HBx 1.0 . 3.21 1285 1171 A 34 PHE H A 34 PHE HBy 1.0 . 3.21 1286 1172 A 35 HIS H A 35 HIS HBy 1.0 . 3.63 1287 1172 A 35 HIS H A 35 HIS HBx 1.0 . 3.63 1288 1173 A 35 HIS HA A 40 GLU HBy 1.0 . 5.34 1289 1173 A 35 HIS HA A 40 GLU HBx 1.0 . 5.34 1290 1174 A 35 HIS HD2 A 40 GLU HBy 1.0 . 4.82 1291 1174 A 40 GLU HBx A 35 HIS HD2 1.0 . 4.82 1292 1175 A 35 HIS HD2 A 40 GLU HGx 1.0 . 4.40 1293 1175 A 35 HIS HD2 A 40 GLU HGy 1.0 . 4.40 1294 1176 A 36 ASP H A 40 GLU HBy 1.0 . 4.68 1295 1176 A 36 ASP H A 40 GLU HBx 1.0 . 4.68 1296 1177 A 36 ASP H A 40 GLU HGx 1.0 . 4.85 1297 1177 A 36 ASP H A 40 GLU HGy 1.0 . 4.85 1298 1178 A 36 ASP HBx A 39 LYS HGy 1.0 . 5.34 1299 1178 A 36 ASP HBx A 39 LYS HGx 1.0 . 5.34 1300 1179 A 37 TYR H A 37 TYR HBx 1.0 . 3.57 1301 1179 A 37 TYR H A 37 TYR HBy 1.0 . 3.57 1302 1180 A 37 TYR HEx A 37 TYR HBx 1.0 . 4.57 1303 1180 A 37 TYR HEx A 37 TYR HBy 1.0 . 4.57 1304 1181 A 37 TYR HEy A 37 TYR HBx 1.0 . 4.68 1305 1181 A 37 TYR HBy A 37 TYR HEy 1.0 . 4.68 1306 1182 A 91 PRO HBy A 37 TYR HBx 1.0 . 3.74 1307 1182 A 91 PRO HBy A 37 TYR HBy 1.0 . 3.74 1308 1183 A 91 PRO HBx A 37 TYR HBx 1.0 . 4.47 1309 1183 A 91 PRO HBx A 37 TYR HBy 1.0 . 4.47 1310 1184 A 91 PRO HGy A 37 TYR HBx 1.0 . 3.91 1311 1184 A 91 PRO HGy A 37 TYR HBy 1.0 . 3.91 1312 1185 A 38 LYS H A 38 LYS HBy 1.0 . 3.54 1313 1185 A 38 LYS H A 38 LYS HBx 1.0 . 3.54 1314 1186 A 39 LYS H A 38 LYS HBy 1.0 . 4.45 1315 1186 A 39 LYS H A 38 LYS HBx 1.0 . 4.45 1316 1187 A 39 LYS HBy A 38 LYS HBy 1.0 . 4.38 1317 1187 A 39 LYS HBy A 38 LYS HBx 1.0 . 4.38 1318 1188 A 39 LYS HA A 39 LYS HGy 1.0 . 3.72 1319 1188 A 39 LYS HA A 39 LYS HGx 1.0 . 3.72 1320 1189 A 40 GLU H A 40 GLU HBy 1.0 . 3.43 1321 1189 A 40 GLU H A 40 GLU HBx 1.0 . 3.43 1322 1190 A 40 GLU H A 40 GLU HGx 1.0 . 4.21 1323 1190 A 40 GLU H A 40 GLU HGy 1.0 . 4.21 1324 1191 A 40 GLU HA A 40 GLU HGx 1.0 . 3.22 1325 1191 A 40 GLU HA A 40 GLU HGy 1.0 . 3.22 1326 1192 A 41 GLY H A 40 GLU HBy 1.0 . 4.13 1327 1192 A 41 GLY H A 40 GLU HBx 1.0 . 4.13 1328 1193 A 41 GLY H A 42 LEU HBy 1.0 . 4.80 1329 1193 A 41 GLY H A 42 LEU HBx 1.0 . 4.80 1330 1194 A 42 LEU H A 41 GLY HAx 1.0 . 2.99 1331 1194 A 42 LEU H A 41 GLY HAy 1.0 . 2.99 1332 1195 A 42 LEU H A 42 LEU HBy 1.0 . 3.39 1333 1195 A 42 LEU H A 42 LEU HBx 1.0 . 3.39 1334 1196 A 42 LEU H A 42 LEU HDy% 1.0 . 4.74 1335 1196 A 42 LEU H A 42 LEU HDx% 1.0 . 4.74 1336 1197 A 91 PRO HBy A 42 LEU HBy 1.0 . 4.68 1337 1197 A 91 PRO HBy A 42 LEU HBx 1.0 . 4.68 1338 1198 A 91 PRO HBx A 42 LEU HBy 1.0 . 4.16 1339 1198 A 91 PRO HBx A 42 LEU HBx 1.0 . 4.16 1340 1199 A 91 PRO HGy A 42 LEU HBy 1.0 . 4.58 1341 1199 A 91 PRO HGy A 42 LEU HBx 1.0 . 4.58 1342 1200 A 91 PRO HGx A 42 LEU HBy 1.0 . 4.35 1343 1200 A 91 PRO HGx A 42 LEU HBx 1.0 . 4.35 1344 1201 A 42 LEU HG A 94 VAL HGy% 1.0 . 4.53 1345 1201 A 42 LEU HG A 94 VAL HGx% 1.0 . 4.53 1346 1202 A 43 ASP H A 42 LEU HDy% 1.0 . 3.56 1347 1202 A 43 ASP H A 42 LEU HDx% 1.0 . 3.56 1348 1203 A 46 THR H A 42 LEU HDy% 1.0 . 4.78 1349 1203 A 46 THR H A 42 LEU HDx% 1.0 . 4.78 1350 1204 A 46 THR HB A 42 LEU HDy% 1.0 . 3.94 1351 1204 A 46 THR HB A 42 LEU HDx% 1.0 . 3.94 1352 1205 A 46 THR HG2% A 42 LEU HDy% 1.0 . 3.17 1353 1205 A 46 THR HG2% A 42 LEU HDx% 1.0 . 3.17 1354 1206 A 47 LEU H A 42 LEU HDy% 1.0 . 3.90 1355 1206 A 47 LEU H A 42 LEU HDx% 1.0 . 3.90 1356 1207 A 47 LEU HA A 42 LEU HDy% 1.0 . 4.37 1357 1207 A 47 LEU HA A 42 LEU HDx% 1.0 . 4.37 1358 1208 A 91 PRO HBy A 42 LEU HDy% 1.0 . 4.02 1359 1208 A 91 PRO HBy A 42 LEU HDx% 1.0 . 4.02 1360 1209 A 43 ASP H A 43 ASP HBx 1.0 . 3.52 1361 1209 A 43 ASP H A 43 ASP HBy 1.0 . 3.52 1362 1210 A 44 ALA H A 43 ASP HBx 1.0 . 3.11 1363 1210 A 44 ALA H A 43 ASP HBy 1.0 . 3.11 1364 1211 A 44 ALA HB% A 43 ASP HBx 1.0 . 4.39 1365 1211 A 44 ALA HB% A 43 ASP HBy 1.0 . 4.39 1366 1212 A 45 GLU H A 43 ASP HBx 1.0 . 3.95 1367 1212 A 45 GLU H A 43 ASP HBy 1.0 . 3.95 1368 1213 A 44 ALA H A 88 LEU HDy% 1.0 . 4.16 1369 1213 A 44 ALA H A 88 LEU HDx% 1.0 . 4.16 1370 1214 A 44 ALA HA A 88 LEU HDy% 1.0 . 3.07 1371 1214 A 44 ALA HA A 88 LEU HDx% 1.0 . 3.07 1372 1215 A 44 ALA HB% A 45 GLU HBy 1.0 . 4.28 1373 1215 A 44 ALA HB% A 45 GLU HBx 1.0 . 4.28 1374 1216 A 44 ALA HB% A 88 LEU HDy% 1.0 . 3.31 1375 1216 A 44 ALA HB% A 88 LEU HDx% 1.0 . 3.31 1376 1217 A 45 GLU H A 45 GLU HBy 1.0 . 2.76 1377 1217 A 45 GLU H A 45 GLU HBx 1.0 . 2.76 1378 1218 A 45 GLU H A 45 GLU HGx 1.0 . 4.48 1379 1218 A 45 GLU H A 45 GLU HGy 1.0 . 4.48 1380 1219 A 45 GLU HA A 45 GLU HGx 1.0 . 3.24 1381 1219 A 45 GLU HA A 45 GLU HGy 1.0 . 3.24 1382 1220 A 45 GLU HA A 48 ASP HBx 1.0 . 3.38 1383 1220 A 45 GLU HA A 48 ASP HBy 1.0 . 3.38 1384 1221 A 46 THR H A 45 GLU HBy 1.0 . 3.52 1385 1221 A 46 THR H A 45 GLU HBx 1.0 . 3.52 1386 1222 A 46 THR HA A 45 GLU HBy 1.0 . 4.54 1387 1222 A 46 THR HA A 45 GLU HBx 1.0 . 4.54 1388 1223 A 46 THR H A 45 GLU HGx 1.0 . 4.50 1389 1223 A 46 THR H A 45 GLU HGy 1.0 . 4.50 1390 1224 A 46 THR H A 47 LEU HBy 1.0 . 5.34 1391 1224 A 46 THR H A 47 LEU HBx 1.0 . 5.34 1392 1225 A 46 THR HA A 49 ARG HBx 1.0 . 3.84 1393 1225 A 46 THR HA A 49 ARG HBy 1.0 . 3.84 1394 1226 A 47 LEU H A 88 LEU HDy% 1.0 . 5.05 1395 1226 A 47 LEU H A 88 LEU HDx% 1.0 . 5.05 1396 1227 A 47 LEU HA A 47 LEU HDy% 1.0 . 3.30 1397 1227 A 47 LEU HA A 47 LEU HDx% 1.0 . 3.30 1398 1228 A 48 ASP H A 47 LEU HBy 1.0 . 3.34 1399 1228 A 48 ASP H A 47 LEU HBx 1.0 . 3.34 1400 1229 A 50 PHE H A 47 LEU HBy 1.0 . 5.34 1401 1229 A 50 PHE H A 47 LEU HBx 1.0 . 5.34 1402 1230 A 88 LEU HBy A 47 LEU HBy 1.0 . 4.06 1403 1230 A 88 LEU HBy A 47 LEU HBx 1.0 . 4.06 1404 1231 A 47 LEU HG A 87 MET HBx 1.0 . 4.31 1405 1231 A 47 LEU HG A 87 MET HBy 1.0 . 4.31 1406 1232 A 47 LEU HG A 88 LEU HDy% 1.0 . 3.63 1407 1232 A 47 LEU HG A 88 LEU HDx% 1.0 . 3.63 1408 1233 A 48 ASP H A 47 LEU HDy% 1.0 . 4.60 1409 1233 A 48 ASP H A 47 LEU HDx% 1.0 . 4.60 1410 1234 A 50 PHE H A 47 LEU HDy% 1.0 . 4.78 1411 1234 A 50 PHE H A 47 LEU HDx% 1.0 . 4.78 1412 1235 A 50 PHE HBy A 47 LEU HDy% 1.0 . 4.39 1413 1235 A 50 PHE HBy A 47 LEU HDx% 1.0 . 4.39 1414 1236 A 50 PHE HDx A 47 LEU HDy% 1.0 . 3.76 1415 1236 A 50 PHE HDx A 47 LEU HDx% 1.0 . 3.76 1416 1237 A 47 LEU HDy% A 84 ARG HDx 1.0 . 5.28 1417 1237 A 84 ARG HDy A 47 LEU HDy% 1.0 . 5.28 1418 1237 A 47 LEU HDx% A 84 ARG HDy 1.0 . 5.28 1419 1237 A 47 LEU HDx% A 84 ARG HDx 1.0 . 5.28 1420 1238 A 88 LEU HBy A 47 LEU HDy% 1.0 . 3.46 1421 1238 A 88 LEU HBy A 47 LEU HDx% 1.0 . 3.46 1422 1239 A 48 ASP H A 48 ASP HBx 1.0 . 3.08 1423 1239 A 48 ASP H A 48 ASP HBy 1.0 . 3.08 1424 1240 A 49 ARG H A 48 ASP HBx 1.0 . 3.75 1425 1240 A 49 ARG H A 48 ASP HBy 1.0 . 3.75 1426 1241 A 49 ARG H A 49 ARG HBx 1.0 . 3.08 1427 1241 A 49 ARG H A 49 ARG HBy 1.0 . 3.08 1428 1242 A 49 ARG H A 49 ARG HGx 1.0 . 4.04 1429 1242 A 49 ARG H A 49 ARG HGy 1.0 . 4.04 1430 1243 A 49 ARG HA A 49 ARG HGx 1.0 . 3.43 1431 1243 A 49 ARG HA A 49 ARG HGy 1.0 . 3.43 1432 1244 A 49 ARG HBy A 49 ARG HDy 1.0 . 3.31 1433 1244 A 49 ARG HBx A 49 ARG HDy 1.0 . 3.31 1434 1244 A 49 ARG HDx A 49 ARG HBx 1.0 . 3.31 1435 1244 A 49 ARG HBy A 49 ARG HDx 1.0 . 3.31 1436 1245 A 50 PHE H A 49 ARG HBx 1.0 . 3.34 1437 1245 A 50 PHE H A 49 ARG HBy 1.0 . 3.34 1438 1246 A 50 PHE H A 49 ARG HGx 1.0 . 4.99 1439 1246 A 50 PHE H A 49 ARG HGy 1.0 . 4.99 1440 1247 A 50 PHE H A 51 LEU HBy 1.0 . 5.34 1441 1247 A 50 PHE H A 51 LEU HBx 1.0 . 5.34 1442 1248 A 50 PHE HA A 59 LEU HDy% 1.0 . 4.02 1443 1248 A 50 PHE HA A 59 LEU HDx% 1.0 . 4.02 1444 1249 A 50 PHE HBy A 59 LEU HDy% 1.0 . 3.91 1445 1249 A 50 PHE HBy A 59 LEU HDx% 1.0 . 3.91 1446 1250 A 50 PHE HBx A 59 LEU HDy% 1.0 . 3.89 1447 1250 A 50 PHE HBx A 59 LEU HDx% 1.0 . 3.89 1448 1251 A 50 PHE HEy A 105 LEU HDy% 1.0 . 3.76 1449 1251 A 50 PHE HEy A 105 LEU HDx% 1.0 . 3.76 1450 1252 A 50 PHE HDy A 59 LEU HDy% 1.0 . 4.04 1451 1252 A 50 PHE HDy A 59 LEU HDx% 1.0 . 4.04 1452 1253 A 50 PHE HDy A 105 LEU HDy% 1.0 . 4.16 1453 1253 A 50 PHE HDy A 105 LEU HDx% 1.0 . 4.16 1454 1254 A 51 LEU H A 51 LEU HBy 1.0 . 3.17 1455 1254 A 51 LEU H A 51 LEU HBx 1.0 . 3.17 1456 1255 A 51 LEU H A 51 LEU HDy% 1.0 . 3.79 1457 1255 A 51 LEU H A 51 LEU HDx% 1.0 . 3.79 1458 1256 A 51 LEU H A 59 LEU HDy% 1.0 . 4.75 1459 1256 A 51 LEU H A 59 LEU HDx% 1.0 . 4.75 1460 1257 A 51 LEU HBx A 52 LYS HBx 1.0 . 4.82 1461 1257 A 51 LEU HBy A 52 LYS HBx 1.0 . 4.82 1462 1257 A 52 LYS HBy A 51 LEU HBy 1.0 . 4.82 1463 1257 A 51 LEU HBx A 52 LYS HBy 1.0 . 4.82 1464 1258 A 51 LEU HBy A 84 ARG HDx 1.0 . 3.94 1465 1258 A 51 LEU HBx A 84 ARG HDx 1.0 . 3.94 1466 1258 A 84 ARG HDy A 51 LEU HBy 1.0 . 3.94 1467 1258 A 84 ARG HDy A 51 LEU HBx 1.0 . 3.94 1468 1259 A 51 LEU HG A 84 ARG HBy 1.0 . 4.78 1469 1259 A 51 LEU HG A 84 ARG HBx 1.0 . 4.78 1470 1260 A 51 LEU HG A 84 ARG HDx 1.0 . 3.70 1471 1260 A 51 LEU HG A 84 ARG HDy 1.0 . 3.70 1472 1261 A 51 LEU HDx% A 52 LYS HGy 1.0 . 4.12 1473 1261 A 51 LEU HDy% A 52 LYS HGy 1.0 . 4.12 1474 1261 A 52 LYS HGx A 51 LEU HDy% 1.0 . 4.12 1475 1261 A 51 LEU HDx% A 52 LYS HGx 1.0 . 4.12 1476 1262 A 56 TRP H A 51 LEU HDy% 1.0 . 4.00 1477 1262 A 56 TRP H A 51 LEU HDx% 1.0 . 4.00 1478 1263 A 56 TRP HA A 51 LEU HDy% 1.0 . 3.36 1479 1263 A 56 TRP HA A 51 LEU HDx% 1.0 . 3.36 1480 1264 A 51 LEU HDy% A 56 TRP HBx 1.0 . 3.61 1481 1264 A 51 LEU HDx% A 56 TRP HBx 1.0 . 3.61 1482 1264 A 56 TRP HBy A 51 LEU HDy% 1.0 . 3.61 1483 1264 A 51 LEU HDx% A 56 TRP HBy 1.0 . 3.61 1484 1265 A 56 TRP HD1 A 51 LEU HDy% 1.0 . 4.33 1485 1265 A 56 TRP HD1 A 51 LEU HDx% 1.0 . 4.33 1486 1266 A 51 LEU HDy% A 84 ARG HDx 1.0 . 4.74 1487 1266 A 84 ARG HDy A 51 LEU HDy% 1.0 . 4.74 1488 1266 A 84 ARG HDy A 51 LEU HDx% 1.0 . 4.74 1489 1266 A 51 LEU HDx% A 84 ARG HDx 1.0 . 4.74 1490 1267 A 52 LYS H A 52 LYS HBx 1.0 . 3.30 1491 1267 A 52 LYS H A 52 LYS HBy 1.0 . 3.30 1492 1268 A 52 LYS H A 52 LYS HGy 1.0 . 3.78 1493 1268 A 52 LYS H A 52 LYS HGx 1.0 . 3.78 1494 1269 A 52 LYS HA A 52 LYS HGy 1.0 . 3.67 1495 1269 A 52 LYS HA A 52 LYS HGx 1.0 . 3.67 1496 1270 A 52 LYS HA A 52 LYS HDy 1.0 . 4.67 1497 1270 A 52 LYS HA A 52 LYS HDx 1.0 . 4.67 1498 1271 A 53 THR H A 52 LYS HBx 1.0 . 4.01 1499 1271 A 53 THR H A 52 LYS HBy 1.0 . 4.01 1500 1272 A 53 THR H A 54 VAL HGx% 1.0 . 4.49 1501 1272 A 53 THR H A 54 VAL HGy% 1.0 . 4.49 1502 1273 A 53 THR HB A 54 VAL HGx% 1.0 . 3.56 1503 1273 A 53 THR HB A 54 VAL HGy% 1.0 . 3.56 1504 1274 A 54 VAL H A 54 VAL HGx% 1.0 . 3.40 1505 1274 A 54 VAL H A 54 VAL HGy% 1.0 . 3.40 1506 1275 A 54 VAL H A 59 LEU HDy% 1.0 . 4.67 1507 1275 A 54 VAL H A 59 LEU HDx% 1.0 . 4.67 1508 1276 A 54 VAL HB A 59 LEU HDy% 1.0 . 2.72 1509 1276 A 54 VAL HB A 59 LEU HDx% 1.0 . 2.72 1510 1277 A 54 VAL HGy% A 55 PRO HDx 1.0 . 3.95 1511 1277 A 54 VAL HGx% A 55 PRO HDx 1.0 . 3.95 1512 1277 A 55 PRO HDy A 54 VAL HGx% 1.0 . 3.95 1513 1277 A 54 VAL HGy% A 55 PRO HDy 1.0 . 3.95 1514 1278 A 59 LEU H A 54 VAL HGx% 1.0 . 4.85 1515 1278 A 59 LEU H A 54 VAL HGy% 1.0 . 4.85 1516 1279 A 59 LEU HBy A 54 VAL HGx% 1.0 . 3.67 1517 1279 A 59 LEU HBy A 54 VAL HGy% 1.0 . 3.67 1518 1280 A 105 LEU H A 54 VAL HGx% 1.0 . 4.89 1519 1280 A 105 LEU H A 54 VAL HGy% 1.0 . 4.89 1520 1281 A 54 VAL HGy% A 105 LEU HBy 1.0 . 3.68 1521 1281 A 54 VAL HGx% A 105 LEU HBy 1.0 . 3.68 1522 1281 A 105 LEU HBx A 54 VAL HGx% 1.0 . 3.68 1523 1281 A 54 VAL HGy% A 105 LEU HBx 1.0 . 3.68 1524 1282 A 58 GLN H A 55 PRO HGx 1.0 . 4.23 1525 1282 A 58 GLN H A 55 PRO HGy 1.0 . 4.23 1526 1283 A 55 PRO HGx A 58 GLN HGy 1.0 . 4.27 1527 1283 A 55 PRO HGy A 58 GLN HGy 1.0 . 4.27 1528 1283 A 58 GLN HGx A 55 PRO HGx 1.0 . 4.27 1529 1283 A 55 PRO HGy A 58 GLN HGx 1.0 . 4.27 1530 1284 A 56 TRP H A 56 TRP HBx 1.0 . 3.43 1531 1284 A 56 TRP H A 56 TRP HBy 1.0 . 3.43 1532 1285 A 56 TRP HD1 A 56 TRP HBx 1.0 . 3.37 1533 1285 A 56 TRP HD1 A 56 TRP HBy 1.0 . 3.37 1534 1286 A 83 ALA HB% A 56 TRP HBx 1.0 . 3.37 1535 1286 A 83 ALA HB% A 56 TRP HBy 1.0 . 3.37 1536 1287 A 84 ARG H A 56 TRP HBx 1.0 . 5.34 1537 1287 A 84 ARG H A 56 TRP HBy 1.0 . 5.34 1538 1288 A 56 TRP HZ3 A 78 VAL HGy% 1.0 . 4.23 1539 1288 A 56 TRP HZ3 A 78 VAL HGx% 1.0 . 4.23 1540 1289 A 57 GLU H A 57 GLU HBx 1.0 . 3.01 1541 1289 A 57 GLU H A 57 GLU HBy 1.0 . 3.01 1542 1290 A 57 GLU H A 57 GLU HGx 1.0 . 3.27 1543 1290 A 57 GLU H A 57 GLU HGy 1.0 . 3.27 1544 1291 A 57 GLU HBx A 57 GLU HGx 1.0 . 2.35 1545 1291 A 57 GLU HBy A 57 GLU HGx 1.0 . 2.35 1546 1291 A 57 GLU HGy A 57 GLU HBx 1.0 . 2.35 1547 1291 A 57 GLU HBy A 57 GLU HGy 1.0 . 2.35 1548 1292 A 58 GLN H A 57 GLU HBx 1.0 . 4.01 1549 1292 A 58 GLN H A 57 GLU HBy 1.0 . 4.01 1550 1293 A 57 GLU HBy A 58 GLN HGy 1.0 . 4.04 1551 1293 A 57 GLU HBx A 58 GLN HGy 1.0 . 4.04 1552 1293 A 58 GLN HGx A 57 GLU HBx 1.0 . 4.04 1553 1293 A 58 GLN HGx A 57 GLU HBy 1.0 . 4.04 1554 1294 A 58 GLN H A 57 GLU HGx 1.0 . 4.17 1555 1294 A 58 GLN H A 57 GLU HGy 1.0 . 4.17 1556 1295 A 57 GLU HGy A 58 GLN HGy 1.0 . 4.08 1557 1295 A 57 GLU HGx A 58 GLN HGy 1.0 . 4.08 1558 1295 A 58 GLN HGx A 57 GLU HGx 1.0 . 4.08 1559 1295 A 58 GLN HGx A 57 GLU HGy 1.0 . 4.08 1560 1296 A 59 LEU H A 57 GLU HGx 1.0 . 4.82 1561 1296 A 59 LEU H A 57 GLU HGy 1.0 . 4.82 1562 1297 A 58 GLN H A 58 GLN HBx 1.0 . 3.31 1563 1297 A 58 GLN H A 58 GLN HBy 1.0 . 3.31 1564 1298 A 58 GLN H A 58 GLN HGy 1.0 . 3.35 1565 1298 A 58 GLN H A 58 GLN HGx 1.0 . 3.35 1566 1299 A 58 GLN HA A 58 GLN HGy 1.0 . 2.95 1567 1299 A 58 GLN HA A 58 GLN HGx 1.0 . 2.95 1568 1300 A 58 GLN HA A 107 VAL HGy% 1.0 . 4.66 1569 1300 A 58 GLN HA A 107 VAL HGx% 1.0 . 4.66 1570 1301 A 59 LEU H A 58 GLN HBx 1.0 . 4.36 1571 1301 A 59 LEU H A 58 GLN HBy 1.0 . 4.36 1572 1302 A 58 GLN HBx A 107 VAL HGy% 1.0 . 3.67 1573 1302 A 58 GLN HBy A 107 VAL HGy% 1.0 . 3.67 1574 1302 A 107 VAL HGx% A 58 GLN HBx 1.0 . 3.67 1575 1302 A 58 GLN HBy A 107 VAL HGx% 1.0 . 3.67 1576 1303 A 59 LEU H A 58 GLN HGy 1.0 . 4.72 1577 1303 A 59 LEU H A 58 GLN HGx 1.0 . 4.72 1578 1304 A 59 LEU H A 59 LEU HDy% 1.0 . 4.48 1579 1304 A 59 LEU H A 59 LEU HDx% 1.0 . 4.48 1580 1305 A 59 LEU HA A 59 LEU HDy% 1.0 . 3.81 1581 1305 A 59 LEU HA A 59 LEU HDx% 1.0 . 3.81 1582 1306 A 59 LEU HA A 107 VAL HGy% 1.0 . 4.32 1583 1306 A 59 LEU HA A 107 VAL HGx% 1.0 . 4.32 1584 1307 A 59 LEU HG A 94 VAL HGy% 1.0 . 3.83 1585 1307 A 59 LEU HG A 94 VAL HGx% 1.0 . 3.83 1586 1308 A 59 LEU HDy% A 94 VAL HGy% 1.0 . 3.78 1587 1308 A 59 LEU HDx% A 94 VAL HGy% 1.0 . 3.78 1588 1308 A 94 VAL HGx% A 59 LEU HDy% 1.0 . 3.78 1589 1308 A 94 VAL HGx% A 59 LEU HDx% 1.0 . 3.78 1590 1309 A 95 LYS H A 59 LEU HDy% 1.0 . 5.18 1591 1309 A 95 LYS H A 59 LEU HDx% 1.0 . 5.18 1592 1310 A 60 LEU HBy A 93 MET HBx 1.0 . 4.51 1593 1310 A 60 LEU HBy A 93 MET HBy 1.0 . 4.51 1594 1311 A 60 LEU HG A 62 ARG HGx 1.0 . 3.96 1595 1311 A 60 LEU HG A 62 ARG HGy 1.0 . 3.96 1596 1312 A 60 LEU HG A 62 ARG HDy 1.0 . 4.33 1597 1312 A 60 LEU HG A 62 ARG HDx 1.0 . 4.33 1598 1313 A 60 LEU HDx% A 93 MET HBx 1.0 . 3.81 1599 1313 A 60 LEU HDx% A 93 MET HBy 1.0 . 3.81 1600 1314 A 60 LEU HDx% A 93 MET HGx 1.0 . 4.40 1601 1314 A 60 LEU HDx% A 93 MET HGy 1.0 . 4.40 1602 1315 A 60 LEU HDy% A 87 MET HGx 1.0 . 3.66 1603 1315 A 60 LEU HDy% A 87 MET HGy 1.0 . 3.66 1604 1316 A 60 LEU HDy% A 93 MET HBx 1.0 . 5.34 1605 1316 A 60 LEU HDy% A 93 MET HBy 1.0 . 5.34 1606 1317 A 61 ASN HD2y A 62 ARG HGx 1.0 . 5.34 1607 1317 A 61 ASN HD2y A 62 ARG HGy 1.0 . 5.34 1608 1318 A 62 ARG H A 62 ARG HGx 1.0 . 3.70 1609 1318 A 62 ARG H A 62 ARG HGy 1.0 . 3.70 1610 1319 A 62 ARG HA A 62 ARG HGx 1.0 . 3.36 1611 1319 A 62 ARG HA A 62 ARG HGy 1.0 . 3.36 1612 1320 A 62 ARG HA A 62 ARG HDy 1.0 . 3.67 1613 1320 A 62 ARG HA A 62 ARG HDx 1.0 . 3.67 1614 1321 A 62 ARG HBy A 62 ARG HDy 1.0 . 3.62 1615 1321 A 62 ARG HBy A 62 ARG HDx 1.0 . 3.62 1616 1322 A 62 ARG HBx A 62 ARG HDy 1.0 . 3.72 1617 1322 A 62 ARG HBx A 62 ARG HDx 1.0 . 3.72 1618 1323 A 63 ALA H A 62 ARG HDy 1.0 . 4.14 1619 1323 A 63 ALA H A 62 ARG HDx 1.0 . 4.14 1620 1324 A 63 ALA H A 64 GLY HAy 1.0 . 4.91 1621 1324 A 63 ALA H A 64 GLY HAx 1.0 . 4.91 1622 1325 A 65 THR HA A 68 ARG HDx 1.0 . 4.18 1623 1325 A 65 THR HA A 68 ARG HDy 1.0 . 4.18 1624 1326 A 66 THR HB A 93 MET HBx 1.0 . 4.77 1625 1326 A 66 THR HB A 93 MET HBy 1.0 . 4.77 1626 1327 A 66 THR HB A 93 MET HGx 1.0 . 4.28 1627 1327 A 66 THR HB A 93 MET HGy 1.0 . 4.28 1628 1328 A 66 THR HG2% A 90 GLN HE2x 1.0 . 4.60 1629 1328 A 66 THR HG2% A 90 GLN HE2y 1.0 . 4.60 1630 1329 A 66 THR HG2% A 93 MET HBx 1.0 . 4.28 1631 1329 A 66 THR HG2% A 93 MET HBy 1.0 . 4.28 1632 1330 A 66 THR HG2% A 93 MET HGx 1.0 . 3.50 1633 1330 A 66 THR HG2% A 93 MET HGy 1.0 . 3.50 1634 1331 A 67 PHE HEx A 78 VAL HGy% 1.0 . 3.72 1635 1331 A 67 PHE HEx A 78 VAL HGx% 1.0 . 3.72 1636 1332 A 67 PHE HEy A 75 ARG HBy 1.0 . 4.28 1637 1332 A 67 PHE HEy A 75 ARG HBx 1.0 . 4.28 1638 1333 A 67 PHE HEy A 75 ARG HGx 1.0 . 4.42 1639 1333 A 67 PHE HEy A 75 ARG HGy 1.0 . 4.42 1640 1334 A 68 ARG HA A 75 ARG HDx 1.0 . 4.35 1641 1334 A 68 ARG HA A 75 ARG HDy 1.0 . 4.35 1642 1335 A 69 LYS H A 69 LYS HBy 1.0 . 3.37 1643 1335 A 69 LYS H A 69 LYS HBx 1.0 . 3.37 1644 1336 A 70 LEU H A 69 LYS HBy 1.0 . 3.10 1645 1336 A 70 LEU H A 69 LYS HBx 1.0 . 3.10 1646 1337 A 70 LEU H A 75 ARG HDx 1.0 . 4.28 1647 1337 A 70 LEU H A 75 ARG HDy 1.0 . 4.28 1648 1338 A 70 LEU HBy A 75 ARG HGx 1.0 . 3.93 1649 1338 A 70 LEU HBy A 75 ARG HGy 1.0 . 3.93 1650 1339 A 70 LEU HBy A 75 ARG HDx 1.0 . 4.48 1651 1339 A 70 LEU HBy A 75 ARG HDy 1.0 . 4.48 1652 1340 A 74 VAL HB A 71 PRO HGy 1.0 . 3.22 1653 1340 A 74 VAL HB A 71 PRO HGx 1.0 . 3.22 1654 1341 A 74 VAL HGx% A 71 PRO HGy 1.0 . 3.99 1655 1341 A 74 VAL HGx% A 71 PRO HGx 1.0 . 3.99 1656 1342 A 74 VAL HGy% A 71 PRO HGy 1.0 . 3.26 1657 1342 A 74 VAL HGy% A 71 PRO HGx 1.0 . 3.26 1658 1343 A 72 GLU H A 72 GLU HGy 1.0 . 4.66 1659 1343 A 72 GLU H A 72 GLU HGx 1.0 . 4.66 1660 1344 A 72 GLU HA A 72 GLU HGy 1.0 . 3.72 1661 1344 A 72 GLU HA A 72 GLU HGx 1.0 . 3.72 1662 1345 A 72 GLU HA A 75 ARG HBy 1.0 . 3.57 1663 1345 A 72 GLU HA A 75 ARG HBx 1.0 . 3.57 1664 1346 A 72 GLU HA A 75 ARG HGx 1.0 . 4.31 1665 1346 A 72 GLU HA A 75 ARG HGy 1.0 . 4.31 1666 1347 A 73 ASP H A 72 GLU HBy 1.0 . 3.41 1667 1347 A 73 ASP H A 72 GLU HBx 1.0 . 3.41 1668 1348 A 72 GLU HBy A 73 ASP HBx 1.0 . 5.18 1669 1348 A 72 GLU HBx A 73 ASP HBx 1.0 . 5.18 1670 1348 A 73 ASP HBy A 72 GLU HBy 1.0 . 5.18 1671 1348 A 72 GLU HBx A 73 ASP HBy 1.0 . 5.18 1672 1349 A 73 ASP H A 72 GLU HGy 1.0 . 4.85 1673 1349 A 73 ASP H A 72 GLU HGx 1.0 . 4.85 1674 1350 A 77 ASN HD2y A 73 ASP HA 1.0 . 4.40 1675 1350 A 73 ASP HA A 77 ASN HD2x 1.0 . 4.40 1676 1351 A 74 VAL HB A 73 ASP HBx 1.0 . 4.70 1677 1351 A 74 VAL HB A 73 ASP HBy 1.0 . 4.70 1678 1352 A 74 VAL HGy% A 73 ASP HBx 1.0 . 4.12 1679 1352 A 74 VAL HGy% A 73 ASP HBy 1.0 . 4.12 1680 1353 A 75 ARG H A 75 ARG HBy 1.0 . 3.41 1681 1353 A 75 ARG H A 75 ARG HBx 1.0 . 3.41 1682 1354 A 75 ARG H A 75 ARG HGx 1.0 . 3.39 1683 1354 A 75 ARG H A 75 ARG HGy 1.0 . 3.39 1684 1355 A 75 ARG H A 75 ARG HDx 1.0 . 5.00 1685 1355 A 75 ARG H A 75 ARG HDy 1.0 . 5.00 1686 1356 A 75 ARG HA A 75 ARG HGx 1.0 . 3.62 1687 1356 A 75 ARG HA A 75 ARG HGy 1.0 . 3.62 1688 1357 A 75 ARG HA A 75 ARG HDx 1.0 . 4.71 1689 1357 A 75 ARG HA A 75 ARG HDy 1.0 . 4.71 1690 1358 A 76 SER H A 75 ARG HBy 1.0 . 3.41 1691 1358 A 76 SER H A 75 ARG HBx 1.0 . 3.41 1692 1359 A 76 SER HA A 75 ARG HBy 1.0 . 4.76 1693 1359 A 76 SER HA A 75 ARG HBx 1.0 . 4.76 1694 1360 A 76 SER H A 75 ARG HGx 1.0 . 4.65 1695 1360 A 76 SER H A 75 ARG HGy 1.0 . 4.65 1696 1361 A 76 SER H A 76 SER HBx 1.0 . 3.00 1697 1361 A 76 SER H A 76 SER HBy 1.0 . 3.00 1698 1362 A 77 ASN H A 76 SER HBx 1.0 . 4.29 1699 1362 A 77 ASN H A 76 SER HBy 1.0 . 4.29 1700 1363 A 77 ASN HD2y A 76 SER HBy 1.0 . 4.76 1701 1363 A 77 ASN HD2x A 76 SER HBx 1.0 . 4.76 1702 1363 A 77 ASN HD2y A 76 SER HBx 1.0 . 4.76 1703 1363 A 77 ASN HD2x A 76 SER HBy 1.0 . 4.76 1704 1364 A 77 ASN H A 78 VAL HGy% 1.0 . 4.56 1705 1364 A 77 ASN H A 78 VAL HGx% 1.0 . 4.56 1706 1365 A 77 ASN HBy A 77 ASN HD2y 1.0 . 3.26 1707 1365 A 77 ASN HBy A 77 ASN HD2x 1.0 . 3.26 1708 1366 A 77 ASN HBx A 77 ASN HD2y 1.0 . 3.52 1709 1366 A 77 ASN HBx A 77 ASN HD2x 1.0 . 3.52 1710 1367 A 78 VAL H A 78 VAL HGy% 1.0 . 2.82 1711 1367 A 78 VAL H A 78 VAL HGx% 1.0 . 2.82 1712 1368 A 79 ASP H A 78 VAL HGy% 1.0 . 3.41 1713 1368 A 79 ASP H A 78 VAL HGx% 1.0 . 3.41 1714 1369 A 79 ASP HA A 78 VAL HGy% 1.0 . 4.12 1715 1369 A 79 ASP HA A 78 VAL HGx% 1.0 . 4.12 1716 1370 A 82 SER H A 78 VAL HGy% 1.0 . 5.26 1717 1370 A 82 SER H A 78 VAL HGx% 1.0 . 5.26 1718 1371 A 78 VAL HGy% A 82 SER HBx 1.0 . 4.99 1719 1371 A 78 VAL HGx% A 82 SER HBx 1.0 . 4.99 1720 1371 A 82 SER HBy A 78 VAL HGy% 1.0 . 4.99 1721 1371 A 78 VAL HGx% A 82 SER HBy 1.0 . 4.99 1722 1372 A 83 ALA H A 78 VAL HGy% 1.0 . 3.81 1723 1372 A 83 ALA H A 78 VAL HGx% 1.0 . 3.81 1724 1373 A 79 ASP H A 82 SER HBx 1.0 . 3.75 1725 1373 A 79 ASP H A 82 SER HBy 1.0 . 3.75 1726 1374 A 80 ALA H A 79 ASP HBx 1.0 . 2.98 1727 1374 A 80 ALA H A 79 ASP HBy 1.0 . 2.98 1728 1375 A 80 ALA HB% A 79 ASP HBx 1.0 . 3.79 1729 1375 A 80 ALA HB% A 79 ASP HBy 1.0 . 3.79 1730 1376 A 81 ALA H A 79 ASP HBx 1.0 . 4.18 1731 1376 A 81 ALA H A 79 ASP HBy 1.0 . 4.18 1732 1377 A 81 ALA HA A 84 ARG HBy 1.0 . 3.58 1733 1377 A 81 ALA HA A 84 ARG HBx 1.0 . 3.58 1734 1378 A 82 SER H A 82 SER HBx 1.0 . 3.08 1735 1378 A 82 SER H A 82 SER HBy 1.0 . 3.08 1736 1379 A 82 SER H A 86 LEU HDy% 1.0 . 5.44 1737 1379 A 82 SER H A 86 LEU HDx% 1.0 . 5.44 1738 1380 A 82 SER HA A 85 GLU HGx 1.0 . 3.69 1739 1380 A 82 SER HA A 85 GLU HGy 1.0 . 3.69 1740 1381 A 83 ALA H A 82 SER HBx 1.0 . 3.92 1741 1381 A 83 ALA H A 82 SER HBy 1.0 . 3.92 1742 1382 A 84 ARG H A 82 SER HBx 1.0 . 5.34 1743 1382 A 84 ARG H A 82 SER HBy 1.0 . 5.34 1744 1383 A 83 ALA H A 84 ARG HBy 1.0 . 4.99 1745 1383 A 83 ALA H A 84 ARG HBx 1.0 . 4.99 1746 1384 A 83 ALA H A 84 ARG HGx 1.0 . 5.34 1747 1384 A 83 ALA H A 84 ARG HGy 1.0 . 5.34 1748 1385 A 83 ALA H A 86 LEU HDy% 1.0 . 4.32 1749 1385 A 83 ALA H A 86 LEU HDx% 1.0 . 4.32 1750 1386 A 83 ALA HA A 86 LEU HBy 1.0 . 4.49 1751 1386 A 83 ALA HA A 86 LEU HBx 1.0 . 4.49 1752 1387 A 83 ALA HA A 86 LEU HDy% 1.0 . 3.22 1753 1387 A 83 ALA HA A 86 LEU HDx% 1.0 . 3.22 1754 1388 A 84 ARG H A 84 ARG HBy 1.0 . 3.02 1755 1388 A 84 ARG H A 84 ARG HBx 1.0 . 3.02 1756 1389 A 84 ARG H A 84 ARG HGx 1.0 . 3.66 1757 1389 A 84 ARG H A 84 ARG HGy 1.0 . 3.66 1758 1390 A 84 ARG H A 84 ARG HDx 1.0 . 4.63 1759 1390 A 84 ARG H A 84 ARG HDy 1.0 . 4.63 1760 1391 A 84 ARG HA A 84 ARG HGx 1.0 . 3.35 1761 1391 A 84 ARG HGy A 84 ARG HA 1.0 . 3.35 1762 1392 A 84 ARG HBy A 84 ARG HDx 1.0 . 3.32 1763 1392 A 84 ARG HBx A 84 ARG HDx 1.0 . 3.32 1764 1392 A 84 ARG HDy A 84 ARG HBy 1.0 . 3.32 1765 1392 A 84 ARG HDy A 84 ARG HBx 1.0 . 3.32 1766 1393 A 85 GLU H A 84 ARG HBy 1.0 . 3.31 1767 1393 A 85 GLU H A 84 ARG HBx 1.0 . 3.31 1768 1394 A 85 GLU H A 84 ARG HGx 1.0 . 5.34 1769 1394 A 85 GLU H A 84 ARG HGy 1.0 . 5.34 1770 1395 A 85 GLU H A 84 ARG HDx 1.0 . 5.34 1771 1395 A 85 GLU H A 84 ARG HDy 1.0 . 5.34 1772 1396 A 85 GLU H A 86 LEU HDy% 1.0 . 4.67 1773 1396 A 85 GLU H A 86 LEU HDx% 1.0 . 4.67 1774 1397 A 85 GLU HA A 85 GLU HGx 1.0 . 3.49 1775 1397 A 85 GLU HA A 85 GLU HGy 1.0 . 3.49 1776 1398 A 85 GLU HBx A 86 LEU HDy% 1.0 . 4.50 1777 1398 A 85 GLU HBx A 86 LEU HDx% 1.0 . 4.50 1778 1399 A 86 LEU H A 86 LEU HBy 1.0 . 3.44 1779 1399 A 86 LEU H A 86 LEU HBx 1.0 . 3.44 1780 1400 A 86 LEU H A 86 LEU HDy% 1.0 . 3.66 1781 1400 A 86 LEU H A 86 LEU HDx% 1.0 . 3.66 1782 1401 A 86 LEU HA A 86 LEU HDy% 1.0 . 3.15 1783 1401 A 86 LEU HA A 86 LEU HDx% 1.0 . 3.15 1784 1402 A 87 MET H A 86 LEU HBy 1.0 . 3.58 1785 1402 A 87 MET H A 86 LEU HBx 1.0 . 3.58 1786 1403 A 87 MET HE% A 86 LEU HBy 1.0 . 2.94 1787 1403 A 87 MET HE% A 86 LEU HBx 1.0 . 2.94 1788 1404 A 86 LEU HBy A 90 GLN HE2x 1.0 . 5.18 1789 1404 A 86 LEU HBx A 90 GLN HE2x 1.0 . 5.18 1790 1404 A 90 GLN HE2y A 86 LEU HBy 1.0 . 5.18 1791 1404 A 90 GLN HE2y A 86 LEU HBx 1.0 . 5.18 1792 1405 A 87 MET H A 86 LEU HDy% 1.0 . 4.08 1793 1405 A 87 MET H A 86 LEU HDx% 1.0 . 4.08 1794 1406 A 87 MET HE% A 86 LEU HDy% 1.0 . 3.53 1795 1406 A 87 MET HE% A 86 LEU HDx% 1.0 . 3.53 1796 1407 A 87 MET H A 87 MET HBx 1.0 . 3.38 1797 1407 A 87 MET H A 87 MET HBy 1.0 . 3.38 1798 1408 A 87 MET H A 87 MET HGx 1.0 . 3.64 1799 1408 A 87 MET H A 87 MET HGy 1.0 . 3.64 1800 1409 A 87 MET HA A 94 VAL HGy% 1.0 . 3.70 1801 1409 A 87 MET HA A 94 VAL HGx% 1.0 . 3.70 1802 1410 A 88 LEU H A 87 MET HBx 1.0 . 4.11 1803 1410 A 88 LEU H A 87 MET HBy 1.0 . 4.11 1804 1411 A 87 MET HBx A 94 VAL HGy% 1.0 . 3.41 1805 1411 A 87 MET HBy A 94 VAL HGy% 1.0 . 3.41 1806 1411 A 94 VAL HGx% A 87 MET HBx 1.0 . 3.41 1807 1411 A 94 VAL HGx% A 87 MET HBy 1.0 . 3.41 1808 1412 A 87 MET HGx A 94 VAL HGy% 1.0 . 3.76 1809 1412 A 87 MET HGy A 94 VAL HGy% 1.0 . 3.76 1810 1412 A 94 VAL HGx% A 87 MET HGx 1.0 . 3.76 1811 1412 A 94 VAL HGx% A 87 MET HGy 1.0 . 3.76 1812 1413 A 87 MET HE% A 93 MET HGx 1.0 . 3.47 1813 1413 A 87 MET HE% A 93 MET HGy 1.0 . 3.47 1814 1414 A 88 LEU H A 88 LEU HDy% 1.0 . 4.29 1815 1414 A 88 LEU H A 88 LEU HDx% 1.0 . 4.29 1816 1415 A 88 LEU HA A 88 LEU HDy% 1.0 . 3.67 1817 1415 A 88 LEU HA A 88 LEU HDx% 1.0 . 3.67 1818 1416 A 89 ALA HB% A 90 GLN HBx 1.0 . 4.38 1819 1416 A 89 ALA HB% A 90 GLN HBy 1.0 . 4.38 1820 1417 A 89 ALA HB% A 90 GLN HGy 1.0 . 3.89 1821 1417 A 89 ALA HB% A 90 GLN HGx 1.0 . 3.89 1822 1418 A 89 ALA HB% A 90 GLN HE2x 1.0 . 5.34 1823 1418 A 89 ALA HB% A 90 GLN HE2y 1.0 . 5.34 1824 1419 A 90 GLN H A 90 GLN HBx 1.0 . 3.33 1825 1419 A 90 GLN H A 90 GLN HBy 1.0 . 3.33 1826 1420 A 90 GLN H A 90 GLN HGy 1.0 . 4.15 1827 1420 A 90 GLN H A 90 GLN HGx 1.0 . 4.15 1828 1421 A 90 GLN H A 91 PRO HDx 1.0 . 3.79 1829 1421 A 90 GLN H A 91 PRO HDy 1.0 . 3.79 1830 1422 A 90 GLN HBy A 90 GLN HE2x 1.0 . 3.80 1831 1422 A 90 GLN HBx A 90 GLN HE2x 1.0 . 3.80 1832 1422 A 90 GLN HE2y A 90 GLN HBx 1.0 . 3.80 1833 1422 A 90 GLN HE2y A 90 GLN HBy 1.0 . 3.80 1834 1423 A 92 SER H A 90 GLN HBx 1.0 . 4.36 1835 1423 A 92 SER H A 90 GLN HBy 1.0 . 4.36 1836 1424 A 92 SER H A 90 GLN HGy 1.0 . 5.34 1837 1424 A 92 SER H A 90 GLN HGx 1.0 . 5.34 1838 1425 A 91 PRO HA A 94 VAL HGy% 1.0 . 3.56 1839 1425 A 91 PRO HA A 94 VAL HGx% 1.0 . 3.56 1840 1426 A 91 PRO HBy A 94 VAL HGy% 1.0 . 4.46 1841 1426 A 91 PRO HBy A 94 VAL HGx% 1.0 . 4.46 1842 1427 A 91 PRO HBx A 94 VAL HGy% 1.0 . 4.28 1843 1427 A 91 PRO HBx A 94 VAL HGx% 1.0 . 4.28 1844 1428 A 92 SER H A 91 PRO HDx 1.0 . 4.06 1845 1428 A 92 SER H A 91 PRO HDy 1.0 . 4.06 1846 1429 A 92 SER H A 92 SER HBx 1.0 . 3.25 1847 1429 A 92 SER H A 92 SER HBy 1.0 . 3.25 1848 1430 A 92 SER H A 93 MET HBx 1.0 . 5.34 1849 1430 A 92 SER H A 93 MET HBy 1.0 . 5.34 1850 1431 A 93 MET H A 93 MET HBx 1.0 . 3.27 1851 1431 A 93 MET H A 93 MET HBy 1.0 . 3.27 1852 1432 A 93 MET H A 93 MET HGx 1.0 . 3.81 1853 1432 A 93 MET H A 93 MET HGy 1.0 . 3.81 1854 1433 A 93 MET H A 94 VAL HGy% 1.0 . 4.26 1855 1433 A 93 MET H A 94 VAL HGx% 1.0 . 4.26 1856 1434 A 94 VAL H A 94 VAL HGy% 1.0 . 3.09 1857 1434 A 94 VAL H A 94 VAL HGx% 1.0 . 3.09 1858 1435 A 94 VAL HA A 94 VAL HGy% 1.0 . 3.10 1859 1435 A 94 VAL HA A 94 VAL HGx% 1.0 . 3.10 1860 1436 A 95 LYS H A 94 VAL HGy% 1.0 . 3.44 1861 1436 A 95 LYS H A 94 VAL HGx% 1.0 . 3.44 1862 1437 A 95 LYS HA A 94 VAL HGy% 1.0 . 4.36 1863 1437 A 95 LYS HA A 94 VAL HGx% 1.0 . 4.36 1864 1438 A 95 LYS H A 95 LYS HBy 1.0 . 3.50 1865 1438 A 95 LYS H A 95 LYS HBx 1.0 . 3.50 1866 1439 A 95 LYS H A 107 VAL HGy% 1.0 . 5.42 1867 1439 A 95 LYS H A 107 VAL HGx% 1.0 . 5.42 1868 1440 A 95 LYS HA A 96 ARG HBx 1.0 . 4.71 1869 1440 A 95 LYS HA A 96 ARG HBy 1.0 . 4.71 1870 1441 A 95 LYS HBx A 107 VAL HGy% 1.0 . 3.78 1871 1441 A 95 LYS HBy A 107 VAL HGy% 1.0 . 3.78 1872 1441 A 107 VAL HGx% A 95 LYS HBy 1.0 . 3.78 1873 1441 A 107 VAL HGx% A 95 LYS HBx 1.0 . 3.78 1874 1442 A 96 ARG H A 96 ARG HBx 1.0 . 3.70 1875 1442 A 96 ARG H A 96 ARG HBy 1.0 . 3.70 1876 1443 A 97 PRO HGx A 108 GLY HAx 1.0 . 4.49 1877 1443 A 97 PRO HGx A 108 GLY HAy 1.0 . 4.49 1878 1444 A 97 PRO HDy A 108 GLY HAx 1.0 . 3.76 1879 1444 A 97 PRO HDy A 108 GLY HAy 1.0 . 3.76 1880 1445 A 98 VAL HGx% A 100 GLU HGx 1.0 . 4.67 1881 1445 A 98 VAL HGx% A 100 GLU HGy 1.0 . 4.67 1882 1446 A 98 VAL HGx% A 105 LEU HDy% 1.0 . 2.92 1883 1446 A 98 VAL HGx% A 105 LEU HDx% 1.0 . 2.92 1884 1447 A 98 VAL HGy% A 105 LEU HBy 1.0 . 5.14 1885 1447 A 98 VAL HGy% A 105 LEU HBx 1.0 . 5.14 1886 1448 A 98 VAL HGy% A 105 LEU HDy% 1.0 . 3.78 1887 1448 A 98 VAL HGy% A 105 LEU HDx% 1.0 . 3.78 1888 1449 A 99 LEU H A 99 LEU HDy% 1.0 . 5.15 1889 1449 A 99 LEU H A 99 LEU HDx% 1.0 . 5.15 1890 1450 A 106 MET H A 99 LEU HBy 1.0 . 4.59 1891 1450 A 106 MET H A 99 LEU HBx 1.0 . 4.59 1892 1451 A 100 GLU H A 99 LEU HDy% 1.0 . 4.66 1893 1451 A 100 GLU H A 99 LEU HDx% 1.0 . 4.66 1894 1452 A 100 GLU H A 100 GLU HBy 1.0 . 3.62 1895 1452 A 100 GLU H A 100 GLU HBx 1.0 . 3.62 1896 1453 A 100 GLU HBy A 105 LEU HDy% 1.0 . 4.43 1897 1453 A 100 GLU HBx A 105 LEU HDy% 1.0 . 4.43 1898 1453 A 105 LEU HDx% A 100 GLU HBy 1.0 . 4.43 1899 1453 A 100 GLU HBx A 105 LEU HDx% 1.0 . 4.43 1900 1454 A 103 GLY H A 100 GLU HGx 1.0 . 4.23 1901 1454 A 103 GLY H A 100 GLU HGy 1.0 . 4.23 1902 1455 A 100 GLU HGx A 105 LEU HDy% 1.0 . 3.69 1903 1455 A 100 GLU HGy A 105 LEU HDy% 1.0 . 3.69 1904 1455 A 105 LEU HDx% A 100 GLU HGx 1.0 . 3.69 1905 1455 A 105 LEU HDx% A 100 GLU HGy 1.0 . 3.69 1906 1456 A 104 LYS H A 104 LYS HBx 1.0 . 3.48 1907 1456 A 104 LYS H A 104 LYS HBy 1.0 . 3.48 1908 1457 A 105 LEU H A 104 LYS HBx 1.0 . 4.06 1909 1457 A 105 LEU H A 104 LYS HBy 1.0 . 4.06 1910 1458 A 105 LEU H A 105 LEU HBy 1.0 . 3.14 1911 1458 A 105 LEU H A 105 LEU HBx 1.0 . 3.14 1912 1459 A 105 LEU HA A 105 LEU HDy% 1.0 . 3.96 1913 1459 A 105 LEU HA A 105 LEU HDx% 1.0 . 3.96 1914 1460 A 106 MET H A 105 LEU HBy 1.0 . 3.83 1915 1460 A 106 MET H A 105 LEU HBx 1.0 . 3.83 1916 1461 A 106 MET H A 105 LEU HDy% 1.0 . 4.07 1917 1461 A 106 MET H A 105 LEU HDx% 1.0 . 4.07 1918 1462 A 107 VAL H A 106 MET HBy 1.0 . 4.33 1919 1462 A 107 VAL H A 106 MET HBx 1.0 . 4.33 1920 1463 A 107 VAL H A 106 MET HGy 1.0 . 3.98 1921 1463 A 107 VAL H A 106 MET HGx 1.0 . 3.98 1922 1464 A 108 GLY H A 107 VAL HGy% 1.0 . 3.84 1923 1464 A 108 GLY H A 107 VAL HGx% 1.0 . 3.84 1924 1465 A 110 LYS H A 113 GLN HBx 1.0 . 4.19 1925 1465 A 110 LYS H A 113 GLN HBy 1.0 . 4.19 1926 1466 A 110 LYS H A 113 GLN HGx 1.0 . 3.77 1927 1466 A 110 LYS H A 113 GLN HGy 1.0 . 3.77 1928 1467 A 110 LYS HBy A 113 GLN HBx 1.0 . 3.68 1929 1467 A 110 LYS HBy A 113 GLN HBy 1.0 . 3.68 1930 1468 A 110 LYS HBy A 113 GLN HGx 1.0 . 3.93 1931 1468 A 110 LYS HBy A 113 GLN HGy 1.0 . 3.93 1932 1469 A 112 ALA H A 111 PRO HBx 1.0 . 3.71 1933 1469 A 112 ALA H A 111 PRO HBy 1.0 . 3.71 1934 1470 A 112 ALA H A 111 PRO HGy 1.0 . 3.68 1935 1470 A 112 ALA H A 111 PRO HGx 1.0 . 3.68 1936 1471 A 113 GLN H A 113 GLN HBx 1.0 . 3.23 1937 1471 A 113 GLN H A 113 GLN HBy 1.0 . 3.23 1938 1472 A 113 GLN H A 113 GLN HGx 1.0 . 3.26 1939 1472 A 113 GLN H A 113 GLN HGy 1.0 . 3.26 1940 1473 A 113 GLN HA A 113 GLN HGx 1.0 . 3.50 1941 1473 A 113 GLN HA A 113 GLN HGy 1.0 . 3.50 1942 1474 A 113 GLN HBx A 113 GLN HE2x 1.0 . 3.80 1943 1474 A 113 GLN HBy A 113 GLN HE2x 1.0 . 3.80 1944 1474 A 113 GLN HE2y A 113 GLN HBx 1.0 . 3.80 1945 1474 A 113 GLN HBy A 113 GLN HE2y 1.0 . 3.80 1946 1475 A 114 TYR H A 113 GLN HBx 1.0 . 3.44 1947 1475 A 114 TYR H A 113 GLN HBy 1.0 . 3.44 1948 1476 A 113 GLN HE2x A 113 GLN HGx 1.0 . 3.09 1949 1476 A 113 GLN HE2y A 113 GLN HGx 1.0 . 3.09 1950 1476 A 113 GLN HGy A 113 GLN HE2x 1.0 . 3.09 1951 1476 A 113 GLN HGy A 113 GLN HE2y 1.0 . 3.09 1952 1477 A 114 TYR H A 113 GLN HGx 1.0 . 4.17 1953 1477 A 114 TYR H A 113 GLN HGy 1.0 . 4.17 1954 1478 A 114 TYR HA A 117 TYR HBx 1.0 . 3.46 1955 1478 A 114 TYR HA A 117 TYR HBy 1.0 . 3.46 1956 1479 A 114 TYR HDy A 117 TYR HBx 1.0 . 4.58 1957 1479 A 114 TYR HDy A 117 TYR HBy 1.0 . 4.58 1958 1480 A 116 ALA HA A 119 LYS HBx 1.0 . 3.76 1959 1480 A 116 ALA HA A 119 LYS HBy 1.0 . 3.76 1960 1481 A 116 ALA HB% A 117 TYR HBx 1.0 . 4.35 1961 1481 A 116 ALA HB% A 117 TYR HBy 1.0 . 4.35 1962 1482 A 118 PHE H A 117 TYR HBx 1.0 . 3.76 1963 1482 A 118 PHE H A 117 TYR HBy 1.0 . 3.76 1964 1483 A 119 LYS H A 117 TYR HBx 1.0 . 5.13 1965 1483 A 119 LYS H A 117 TYR HBy 1.0 . 5.13 1966 1484 A 118 PHE H A 118 PHE HBx 1.0 . 3.22 1967 1484 A 118 PHE H A 118 PHE HBy 1.0 . 3.22 1968 1485 A 118 PHE HDx A 118 PHE HBx 1.0 . 3.26 1969 1485 A 118 PHE HDx A 118 PHE HBy 1.0 . 3.26 1970 1486 A 119 LYS H A 119 LYS HBx 1.0 . 3.52 1971 1486 A 119 LYS H A 119 LYS HBy 1.0 . 3.52 1972 1487 A 119 LYS HA A 119 LYS HGy 1.0 . 3.74 1973 1487 A 119 LYS HA A 119 LYS HGx 1.0 . 3.74 1974 1488 A 120 LEU H A 119 LYS HBx 1.0 . 4.03 1975 1488 A 120 LEU H A 119 LYS HBy 1.0 . 4.03 1976 1489 A 120 LEU H A 119 LYS HGy 1.0 . 4.78 1977 1489 A 120 LEU H A 119 LYS HGx 1.0 . 4.78 1978 1490 A 120 LEU H A 120 LEU HBx 1.0 . 2.93 1979 1490 A 120 LEU H A 120 LEU HBy 1.0 . 2.93 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 21 ALA H A 17 THR O 1.0 . 2.0 2 2 A 17 THR O A 21 ALA N 1.0 . 3.0 3 3 A 22 ARG H A 18 MET O 1.0 . 2.0 4 4 A 18 MET O A 22 ARG N 1.0 . 3.0 5 5 A 23 ILE H A 19 LYS O 1.0 . 2.0 6 6 A 19 LYS O A 23 ILE N 1.0 . 3.0 7 7 A 24 TRP H A 20 LYS O 1.0 . 2.0 8 8 A 20 LYS O A 24 TRP N 1.0 . 3.0 9 9 A 25 LEU H A 21 ALA O 1.0 . 2.0 10 10 A 21 ALA O A 25 LEU N 1.0 . 3.0 11 11 A 26 GLU H A 22 ARG O 1.0 . 2.0 12 12 A 22 ARG O A 26 GLU N 1.0 . 3.0 13 13 A 27 ASP H A 23 ILE O 1.0 . 2.0 14 14 A 23 ILE O A 27 ASP N 1.0 . 3.0 15 15 A 28 HIS H A 24 TRP O 1.0 . 2.0 16 16 A 24 TRP O A 28 HIS N 1.0 . 3.0 17 17 A 47 LEU H A 43 ASP O 1.0 . 2.0 18 18 A 43 ASP O A 47 LEU N 1.0 . 3.0 19 19 A 48 ASP H A 44 ALA O 1.0 . 2.0 20 20 A 44 ALA O A 48 ASP N 1.0 . 3.0 21 21 A 49 ARG H A 45 GLU O 1.0 . 2.0 22 22 A 45 GLU O A 49 ARG N 1.0 . 3.0 23 23 A 50 PHE H A 46 THR O 1.0 . 2.0 24 24 A 46 THR O A 50 PHE N 1.0 . 3.0 25 25 A 51 LEU H A 47 LEU O 1.0 . 2.0 26 26 A 47 LEU O A 51 LEU N 1.0 . 3.0 27 27 A 52 LYS H A 48 ASP O 1.0 . 2.0 28 28 A 48 ASP O A 52 LYS N 1.0 . 3.0 29 29 A 54 VAL H A 50 PHE O 1.0 . 2.0 30 30 A 50 PHE O A 54 VAL N 1.0 . 3.0 31 31 A 83 ALA H A 79 ASP O 1.0 . 2.0 32 32 A 79 ASP O A 83 ALA N 1.0 . 3.0 33 33 A 84 ARG H A 80 ALA O 1.0 . 2.0 34 34 A 80 ALA O A 84 ARG N 1.0 . 3.0 35 35 A 85 GLU H A 81 ALA O 1.0 . 2.0 36 36 A 81 ALA O A 85 GLU N 1.0 . 3.0 37 37 A 86 LEU H A 82 SER O 1.0 . 2.0 38 38 A 82 SER O A 86 LEU N 1.0 . 3.0 39 39 A 87 MET H A 83 ALA O 1.0 . 2.0 40 40 A 83 ALA O A 87 MET N 1.0 . 3.0 41 41 A 88 LEU H A 84 ARG O 1.0 . 2.0 42 42 A 84 ARG O A 88 LEU N 1.0 . 3.0 43 43 A 89 ALA H A 85 GLU O 1.0 . 2.0 44 44 A 85 GLU O A 89 ALA N 1.0 . 3.0 45 45 A 90 GLN H A 86 LEU O 1.0 . 2.0 46 46 A 86 LEU O A 90 GLN N 1.0 . 3.0 47 47 A 114 TYR H A 110 LYS O 1.0 . 2.0 48 48 A 110 LYS O A 114 TYR N 1.0 . 3.0 49 49 A 115 GLU H A 111 PRO O 1.0 . 2.0 50 50 A 111 PRO O A 115 GLU N 1.0 . 3.0 51 51 A 116 ALA H A 112 ALA O 1.0 . 2.0 52 52 A 112 ALA O A 116 ALA N 1.0 . 3.0 53 53 A 117 TYR H A 113 GLN O 1.0 . 2.0 54 54 A 113 GLN O A 117 TYR N 1.0 . 3.0 55 55 A 118 PHE H A 114 TYR O 1.0 . 2.0 56 56 A 114 TYR O A 118 PHE N 1.0 . 3.0 57 57 A 33 THR H A 7 VAL O 1.0 . 2.0 58 58 A 7 VAL O A 33 THR N 1.0 . 3.0 59 59 A 35 HIS H A 9 ILE O 1.0 . 2.0 60 60 A 9 ILE O A 35 HIS N 1.0 . 3.0 61 61 A 9 ILE H A 33 THR O 1.0 . 2.0 62 62 A 33 THR O A 9 ILE N 1.0 . 3.0 63 63 A 11 GLY H A 35 HIS O 1.0 . 2.0 64 64 A 35 HIS O A 11 GLY N 1.0 . 3.0 65 65 A 10 TYR H A 98 VAL O 1.0 . 2.0 66 66 A 98 VAL O A 10 TYR N 1.0 . 3.0 67 67 A 106 MET H A 99 LEU O 1.0 . 2.0 68 68 A 99 LEU O A 106 MET N 1.0 . 3.0 69 69 A 99 LEU H A 106 MET O 1.0 . 2.0 70 70 A 106 MET O A 99 LEU N 1.0 . 3.0 71 71 A 100 GLU H A 8 THR O 1.0 . 2.0 72 72 A 8 THR O A 100 GLU N 1.0 . 3.0 73 73 A 30 ILE H A 25 LEU O 1.0 . 2.0 74 74 A 25 LEU O A 30 ILE N 1.0 . 3.0 75 75 A 94 VAL H A 91 PRO O 1.0 . 2.0 76 76 A 91 PRO O A 94 VAL N 1.0 . 3.0 77 77 A 37 TYR H A 11 GLY O 1.0 . 2.0 78 78 A 11 GLY O A 37 TYR N 1.0 . 3.0 79 79 A 58 GLN H A 55 PRO O 1.0 . 2.0 80 80 A 55 PRO O A 58 GLN N 1.0 . 3.0 81 81 A 95 LYS H A 59 LEU O 1.0 . 2.0 82 82 A 59 LEU O A 95 LYS N 1.0 . 3.0 83 83 A 108 GLY H A 97 PRO O 1.0 . 2.0 84 84 A 97 PRO O A 108 GLY N 1.0 . 3.0 85 85 A 21 ALA H A 17 THR O 1.0 . 1.8 86 86 A 17 THR O A 21 ALA N 1.0 . 2.7 87 87 A 22 ARG H A 18 MET O 1.0 . 1.8 88 88 A 18 MET O A 22 ARG N 1.0 . 2.7 89 89 A 23 ILE H A 19 LYS O 1.0 . 1.8 90 90 A 19 LYS O A 23 ILE N 1.0 . 2.7 91 91 A 24 TRP H A 20 LYS O 1.0 . 1.8 92 92 A 20 LYS O A 24 TRP N 1.0 . 2.7 93 93 A 25 LEU H A 21 ALA O 1.0 . 1.8 94 94 A 21 ALA O A 25 LEU N 1.0 . 2.7 95 95 A 26 GLU H A 22 ARG O 1.0 . 1.8 96 96 A 22 ARG O A 26 GLU N 1.0 . 2.7 97 97 A 27 ASP H A 23 ILE O 1.0 . 1.8 98 98 A 23 ILE O A 27 ASP N 1.0 . 2.7 99 99 A 28 HIS H A 24 TRP O 1.0 . 1.8 100 100 A 24 TRP O A 28 HIS N 1.0 . 2.7 101 101 A 47 LEU H A 43 ASP O 1.0 . 1.8 102 102 A 43 ASP O A 47 LEU N 1.0 . 2.7 103 103 A 48 ASP H A 44 ALA O 1.0 . 1.8 104 104 A 44 ALA O A 48 ASP N 1.0 . 2.7 105 105 A 49 ARG H A 45 GLU O 1.0 . 1.8 106 106 A 45 GLU O A 49 ARG N 1.0 . 2.7 107 107 A 50 PHE H A 46 THR O 1.0 . 1.8 108 108 A 46 THR O A 50 PHE N 1.0 . 2.7 109 109 A 51 LEU H A 47 LEU O 1.0 . 1.8 110 110 A 47 LEU O A 51 LEU N 1.0 . 2.7 111 111 A 52 LYS H A 48 ASP O 1.0 . 1.8 112 112 A 48 ASP O A 52 LYS N 1.0 . 2.7 113 113 A 54 VAL H A 50 PHE O 1.0 . 1.8 114 114 A 50 PHE O A 54 VAL N 1.0 . 2.7 115 115 A 83 ALA H A 79 ASP O 1.0 . 1.8 116 116 A 79 ASP O A 83 ALA N 1.0 . 2.7 117 117 A 84 ARG H A 80 ALA O 1.0 . 1.8 118 118 A 80 ALA O A 84 ARG N 1.0 . 2.7 119 119 A 85 GLU H A 81 ALA O 1.0 . 1.8 120 120 A 81 ALA O A 85 GLU N 1.0 . 2.7 121 121 A 86 LEU H A 82 SER O 1.0 . 1.8 122 122 A 82 SER O A 86 LEU N 1.0 . 2.7 123 123 A 87 MET H A 83 ALA O 1.0 . 1.8 124 124 A 83 ALA O A 87 MET N 1.0 . 2.7 125 125 A 88 LEU H A 84 ARG O 1.0 . 1.8 126 126 A 84 ARG O A 88 LEU N 1.0 . 2.7 127 127 A 89 ALA H A 85 GLU O 1.0 . 1.8 128 128 A 85 GLU O A 89 ALA N 1.0 . 2.7 129 129 A 90 GLN H A 86 LEU O 1.0 . 1.8 130 130 A 86 LEU O A 90 GLN N 1.0 . 2.7 131 131 A 114 TYR H A 110 LYS O 1.0 . 1.8 132 132 A 110 LYS O A 114 TYR N 1.0 . 2.7 133 133 A 115 GLU H A 111 PRO O 1.0 . 1.8 134 134 A 111 PRO O A 115 GLU N 1.0 . 2.7 135 135 A 116 ALA H A 112 ALA O 1.0 . 1.8 136 136 A 112 ALA O A 116 ALA N 1.0 . 2.7 137 137 A 117 TYR H A 113 GLN O 1.0 . 1.8 138 138 A 113 GLN O A 117 TYR N 1.0 . 2.7 139 139 A 118 PHE H A 114 TYR O 1.0 . 1.8 140 140 A 114 TYR O A 118 PHE N 1.0 . 2.7 141 141 A 33 THR H A 7 VAL O 1.0 . 1.8 142 142 A 7 VAL O A 33 THR N 1.0 . 2.7 143 143 A 35 HIS H A 9 ILE O 1.0 . 1.8 144 144 A 9 ILE O A 35 HIS N 1.0 . 2.7 145 145 A 9 ILE H A 33 THR O 1.0 . 1.8 146 146 A 33 THR O A 9 ILE N 1.0 . 2.7 147 147 A 11 GLY H A 35 HIS O 1.0 . 1.8 148 148 A 35 HIS O A 11 GLY N 1.0 . 2.7 149 149 A 10 TYR H A 98 VAL O 1.0 . 1.8 150 150 A 98 VAL O A 10 TYR N 1.0 . 2.7 151 151 A 106 MET H A 99 LEU O 1.0 . 1.8 152 152 A 99 LEU O A 106 MET N 1.0 . 2.7 153 153 A 99 LEU H A 106 MET O 1.0 . 1.8 154 154 A 106 MET O A 99 LEU N 1.0 . 2.7 155 155 A 100 GLU H A 8 THR O 1.0 . 1.8 156 156 A 8 THR O A 100 GLU N 1.0 . 2.7 157 157 A 30 ILE H A 25 LEU O 1.0 . 1.8 158 158 A 25 LEU O A 30 ILE N 1.0 . 2.7 159 159 A 94 VAL H A 91 PRO O 1.0 . 1.8 160 160 A 91 PRO O A 94 VAL N 1.0 . 2.7 161 161 A 37 TYR H A 11 GLY O 1.0 . 1.8 162 162 A 11 GLY O A 37 TYR N 1.0 . 2.7 163 163 A 58 GLN H A 55 PRO O 1.0 . 1.8 164 164 A 55 PRO O A 58 GLN N 1.0 . 2.7 165 165 A 95 LYS H A 59 LEU O 1.0 . 1.8 166 166 A 59 LEU O A 95 LYS N 1.0 . 2.7 167 167 A 108 GLY H A 97 PRO O 1.0 . 1.8 168 168 A 97 PRO O A 108 GLY N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 GLY C A 4 SER N A 4 SER CA A 4 SER C 1.0 -90.4 -54.7 PHI 2 2 A 4 SER N A 4 SER CA A 4 SER C A 5 MET N 1.0 -64.6 19.7 PSI 3 3 A 6 SER C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -130.8 -87.1 PHI 4 4 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 THR N 1.0 103.1 174.8 PSI 5 5 A 7 VAL C A 8 THR N A 8 THR CA A 8 THR C 1.0 -131.8 -88.5 PHI 6 6 A 8 THR N A 8 THR CA A 8 THR C A 9 ILE N 1.0 110.9 146.4 PSI 7 7 A 8 THR C A 9 ILE N A 9 ILE CA A 9 ILE C 1.0 -161.8 -114.8 PHI 8 8 A 9 ILE N A 9 ILE CA A 9 ILE C A 10 TYR N 1.0 137.6 175.3 PSI 9 9 A 9 ILE C A 10 TYR N A 10 TYR CA A 10 TYR C 1.0 -157.3 -88.1 PHI 10 10 A 10 TYR N A 10 TYR CA A 10 TYR C A 11 GLY N 1.0 95.8 184.7 PSI 11 11 A 11 GLY C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -166.3 -95.5 PHI 12 12 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 LYS N 1.0 125.5 176.5 PSI 13 13 A 14 ASN C A 15 CYS N A 15 CYS CA A 15 CYS C 1.0 -157.0 -43.9 PHI 14 14 A 15 CYS N A 15 CYS CA A 15 CYS C A 16 ASP N 1.0 93.7 201.8 PSI 15 15 A 16 ASP C A 17 THR N A 17 THR CA A 17 THR C 1.0 -86.5 -44.7 PHI 16 16 A 17 THR N A 17 THR CA A 17 THR C A 18 MET N 1.0 -60.8 -24.0 PSI 17 17 A 17 THR C A 18 MET N A 18 MET CA A 18 MET C 1.0 -80.3 -48.2 PHI 18 18 A 18 MET N A 18 MET CA A 18 MET C A 19 LYS N 1.0 -58.8 -25.8 PSI 19 19 A 18 MET C A 19 LYS N A 19 LYS CA A 19 LYS C 1.0 -70.9 -50.9 PHI 20 20 A 19 LYS N A 19 LYS CA A 19 LYS C A 20 LYS N 1.0 -51.5 -27.8 PSI 21 21 A 19 LYS C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -76.5 -50.0 PHI 22 22 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 ALA N 1.0 -54.7 -24.3 PSI 23 23 A 20 LYS C A 21 ALA N A 21 ALA CA A 21 ALA C 1.0 -73.8 -53.8 PHI 24 24 A 21 ALA N A 21 ALA CA A 21 ALA C A 22 ARG N 1.0 -51.9 -31.4 PSI 25 25 A 21 ALA C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -72.4 -52.4 PHI 26 26 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 ILE N 1.0 -49.1 -28.8 PSI 27 27 A 22 ARG C A 23 ILE N A 23 ILE CA A 23 ILE C 1.0 -75.1 -52.0 PHI 28 28 A 23 ILE N A 23 ILE CA A 23 ILE C A 24 TRP N 1.0 -52.1 -32.1 PSI 29 29 A 23 ILE C A 24 TRP N A 24 TRP CA A 24 TRP C 1.0 -69.3 -49.3 PHI 30 30 A 24 TRP N A 24 TRP CA A 24 TRP C A 25 LEU N 1.0 -55.9 -35.9 PSI 31 31 A 24 TRP C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -77.4 -57.4 PHI 32 32 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 GLU N 1.0 -51.3 -24.5 PSI 33 33 A 25 LEU C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -74.8 -54.9 PHI 34 34 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 ASP N 1.0 -51.4 -29.3 PSI 35 35 A 26 GLU C A 27 ASP N A 27 ASP CA A 27 ASP C 1.0 -80.0 -52.3 PHI 36 36 A 27 ASP N A 27 ASP CA A 27 ASP C A 28 HIS N 1.0 -46.1 -14.5 PSI 37 37 A 27 ASP C A 28 HIS N A 28 HIS CA A 28 HIS C 1.0 -119.0 -61.5 PHI 38 38 A 28 HIS N A 28 HIS CA A 28 HIS C A 29 GLY N 1.0 -16.8 21.0 PSI 39 39 A 28 HIS C A 29 GLY N A 29 GLY CA A 29 GLY C 1.0 30.7 118.3 PHI 40 40 A 29 GLY N A 29 GLY CA A 29 GLY C A 30 ILE N 1.0 -26.5 65.1 PSI 41 41 A 29 GLY C A 30 ILE N A 30 ILE CA A 30 ILE C 1.0 -107.4 -63.6 PHI 42 42 A 30 ILE N A 30 ILE CA A 30 ILE C A 31 ASP N 1.0 106.8 155.6 PSI 43 43 A 31 ASP C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -179.8 -94.4 PHI 44 44 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 THR N 1.0 125.0 178.0 PSI 45 45 A 32 TYR C A 33 THR N A 33 THR CA A 33 THR C 1.0 -154.8 -82.6 PHI 46 46 A 33 THR N A 33 THR CA A 33 THR C A 34 PHE N 1.0 103.9 147.0 PSI 47 47 A 33 THR C A 34 PHE N A 34 PHE CA A 34 PHE C 1.0 -142.9 -77.2 PHI 48 48 A 34 PHE N A 34 PHE CA A 34 PHE C A 35 HIS N 1.0 99.3 141.8 PSI 49 49 A 34 PHE C A 35 HIS N A 35 HIS CA A 35 HIS C 1.0 -137.2 -60.8 PHI 50 50 A 35 HIS N A 35 HIS CA A 35 HIS C A 36 ASP N 1.0 102.9 123.8 PSI 51 51 A 35 HIS C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -108.0 -67.0 PHI 52 52 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 TYR N 1.0 79.2 151.5 PSI 53 53 A 36 ASP C A 37 TYR N A 37 TYR CA A 37 TYR C 1.0 -71.3 -51.3 PHI 54 54 A 37 TYR N A 37 TYR CA A 37 TYR C A 38 LYS N 1.0 -50.5 -14.8 PSI 55 55 A 37 TYR C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -92.7 -49.1 PHI 56 56 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 LYS N 1.0 -67.8 10.8 PSI 57 57 A 38 LYS C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -109.5 -54.2 PHI 58 58 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 GLU N 1.0 -47.5 -6.8 PSI 59 59 A 41 GLY C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -154.9 -58.5 PHI 60 60 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 ASP N 1.0 110.1 148.3 PSI 61 61 A 43 ASP C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -77.9 -40.0 PHI 62 62 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 GLU N 1.0 -62.8 -23.2 PSI 63 63 A 44 ALA C A 45 GLU N A 45 GLU CA A 45 GLU C 1.0 -81.3 -51.4 PHI 64 64 A 45 GLU N A 45 GLU CA A 45 GLU C A 46 THR N 1.0 -51.3 -17.5 PSI 65 65 A 45 GLU C A 46 THR N A 46 THR CA A 46 THR C 1.0 -87.0 -50.2 PHI 66 66 A 46 THR N A 46 THR CA A 46 THR C A 47 LEU N 1.0 -57.0 -25.2 PSI 67 67 A 46 THR C A 47 LEU N A 47 LEU CA A 47 LEU C 1.0 -73.0 -52.5 PHI 68 68 A 47 LEU N A 47 LEU CA A 47 LEU C A 48 ASP N 1.0 -58.1 -31.1 PSI 69 69 A 47 LEU C A 48 ASP N A 48 ASP CA A 48 ASP C 1.0 -72.8 -52.8 PHI 70 70 A 48 ASP N A 48 ASP CA A 48 ASP C A 49 ARG N 1.0 -56.9 -24.0 PSI 71 71 A 48 ASP C A 49 ARG N A 49 ARG CA A 49 ARG C 1.0 -75.2 -55.2 PHI 72 72 A 49 ARG N A 49 ARG CA A 49 ARG C A 50 PHE N 1.0 -54.9 -26.8 PSI 73 73 A 49 ARG C A 50 PHE N A 50 PHE CA A 50 PHE C 1.0 -73.4 -52.9 PHI 74 74 A 50 PHE N A 50 PHE CA A 50 PHE C A 51 LEU N 1.0 -51.7 -23.6 PSI 75 75 A 50 PHE C A 51 LEU N A 51 LEU CA A 51 LEU C 1.0 -71.8 -51.8 PHI 76 76 A 51 LEU N A 51 LEU CA A 51 LEU C A 52 LYS N 1.0 -61.8 -17.2 PSI 77 77 A 51 LEU C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -83.5 -49.9 PHI 78 78 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 THR N 1.0 -50.6 -23.2 PSI 79 79 A 52 LYS C A 53 THR N A 53 THR CA A 53 THR C 1.0 -115.0 -67.6 PHI 80 80 A 53 THR N A 53 THR CA A 53 THR C A 54 VAL N 1.0 -33.1 15.1 PSI 81 81 A 53 THR C A 54 VAL N A 54 VAL CA A 54 VAL C 1.0 -164.6 -46.8 PHI 82 82 A 54 VAL N A 54 VAL CA A 54 VAL C A 55 PRO N 1.0 76.6 182.2 PSI 83 83 A 55 PRO C A 56 TRP N A 56 TRP CA A 56 TRP C 1.0 -72.2 -52.2 PHI 84 84 A 56 TRP N A 56 TRP CA A 56 TRP C A 57 GLU N 1.0 -44.5 -23.6 PSI 85 85 A 56 TRP C A 57 GLU N A 57 GLU CA A 57 GLU C 1.0 -74.4 -44.8 PHI 86 86 A 57 GLU N A 57 GLU CA A 57 GLU C A 58 GLN N 1.0 -54.4 -16.3 PSI 87 87 A 57 GLU C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -123.0 -51.4 PHI 88 88 A 58 GLN N A 58 GLN CA A 58 GLN C A 59 LEU N 1.0 -52.0 29.0 PSI 89 89 A 59 LEU C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -150.2 -50.3 PHI 90 90 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 ASN N 1.0 114.1 149.7 PSI 91 91 A 60 LEU C A 61 ASN N A 61 ASN CA A 61 ASN C 1.0 -133.9 -51.1 PHI 92 92 A 61 ASN N A 61 ASN CA A 61 ASN C A 62 ARG N 1.0 72.3 143.8 PSI 93 93 A 61 ASN C A 62 ARG N A 62 ARG CA A 62 ARG C 1.0 -128.1 -38.2 PHI 94 94 A 62 ARG N A 62 ARG CA A 62 ARG C A 63 ALA N 1.0 -59.1 6.5 PSI 95 95 A 62 ARG C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -103.8 -66.1 PHI 96 96 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 GLY N 1.0 -23.2 29.7 PSI 97 97 A 64 GLY C A 65 THR N A 65 THR CA A 65 THR C 1.0 -81.5 -40.1 PHI 98 98 A 65 THR N A 65 THR CA A 65 THR C A 66 THR N 1.0 -51.9 -31.9 PSI 99 99 A 65 THR C A 66 THR N A 66 THR CA A 66 THR C 1.0 -73.1 -53.1 PHI 100 100 A 66 THR N A 66 THR CA A 66 THR C A 67 PHE N 1.0 -52.0 -32.0 PSI 101 101 A 66 THR C A 67 PHE N A 67 PHE CA A 67 PHE C 1.0 -77.9 -45.1 PHI 102 102 A 67 PHE N A 67 PHE CA A 67 PHE C A 68 ARG N 1.0 -54.9 -34.9 PSI 103 103 A 67 PHE C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -84.2 -45.8 PHI 104 104 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 LYS N 1.0 -49.5 -4.8 PSI 105 105 A 68 ARG C A 69 LYS N A 69 LYS CA A 69 LYS C 1.0 -109.1 -60.9 PHI 106 106 A 69 LYS N A 69 LYS CA A 69 LYS C A 70 LEU N 1.0 -52.6 18.0 PSI 107 107 A 71 PRO C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -71.2 -30.7 PHI 108 108 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 ASP N 1.0 -68.0 -21.2 PSI 109 109 A 72 GLU C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 -73.8 -53.9 PHI 110 110 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 VAL N 1.0 -51.6 -22.9 PSI 111 111 A 73 ASP C A 74 VAL N A 74 VAL CA A 74 VAL C 1.0 -85.7 -51.1 PHI 112 112 A 74 VAL N A 74 VAL CA A 74 VAL C A 75 ARG N 1.0 -56.7 -30.7 PSI 113 113 A 74 VAL C A 75 ARG N A 75 ARG CA A 75 ARG C 1.0 -85.8 -45.8 PHI 114 114 A 75 ARG N A 75 ARG CA A 75 ARG C A 76 SER N 1.0 -59.8 -9.9 PSI 115 115 A 75 ARG C A 76 SER N A 76 SER CA A 76 SER C 1.0 -107.9 -40.5 PHI 116 116 A 76 SER N A 76 SER CA A 76 SER C A 77 ASN N 1.0 -70.9 -1.5 PSI 117 117 A 76 SER C A 77 ASN N A 77 ASN CA A 77 ASN C 1.0 -124.8 -79.0 PHI 118 118 A 77 ASN N A 77 ASN CA A 77 ASN C A 78 VAL N 1.0 -46.5 42.6 PSI 119 119 A 77 ASN C A 78 VAL N A 78 VAL CA A 78 VAL C 1.0 -121.3 -51.8 PHI 120 120 A 78 VAL N A 78 VAL CA A 78 VAL C A 79 ASP N 1.0 107.8 150.3 PSI 121 121 A 78 VAL C A 79 ASP N A 79 ASP CA A 79 ASP C 1.0 -143.1 -80.8 PHI 122 122 A 79 ASP N A 79 ASP CA A 79 ASP C A 80 ALA N 1.0 87.2 225.6 PSI 123 123 A 79 ASP C A 80 ALA N A 80 ALA CA A 80 ALA C 1.0 -77.8 -40.1 PHI 124 124 A 80 ALA N A 80 ALA CA A 80 ALA C A 81 ALA N 1.0 -65.1 -24.2 PSI 125 125 A 80 ALA C A 81 ALA N A 81 ALA CA A 81 ALA C 1.0 -78.0 -50.3 PHI 126 126 A 81 ALA N A 81 ALA CA A 81 ALA C A 82 SER N 1.0 -58.3 -26.3 PSI 127 127 A 81 ALA C A 82 SER N A 82 SER CA A 82 SER C 1.0 -75.5 -53.9 PHI 128 128 A 82 SER N A 82 SER CA A 82 SER C A 83 ALA N 1.0 -51.7 -31.7 PSI 129 129 A 82 SER C A 83 ALA N A 83 ALA CA A 83 ALA C 1.0 -74.5 -51.3 PHI 130 130 A 83 ALA N A 83 ALA CA A 83 ALA C A 84 ARG N 1.0 -60.1 -15.1 PSI 131 131 A 83 ALA C A 84 ARG N A 84 ARG CA A 84 ARG C 1.0 -70.3 -50.3 PHI 132 132 A 84 ARG N A 84 ARG CA A 84 ARG C A 85 GLU N 1.0 -60.3 -34.8 PSI 133 133 A 84 ARG C A 85 GLU N A 85 GLU CA A 85 GLU C 1.0 -76.5 -44.0 PHI 134 134 A 85 GLU N A 85 GLU CA A 85 GLU C A 86 LEU N 1.0 -57.2 -26.8 PSI 135 135 A 85 GLU C A 86 LEU N A 86 LEU CA A 86 LEU C 1.0 -73.3 -53.3 PHI 136 136 A 86 LEU N A 86 LEU CA A 86 LEU C A 87 MET N 1.0 -53.6 -30.2 PSI 137 137 A 86 LEU C A 87 MET N A 87 MET CA A 87 MET C 1.0 -72.2 -52.2 PHI 138 138 A 87 MET N A 87 MET CA A 87 MET C A 88 LEU N 1.0 -55.8 -32.8 PSI 139 139 A 87 MET C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -78.1 -45.9 PHI 140 140 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 ALA N 1.0 -58.4 -22.8 PSI 141 141 A 88 LEU C A 89 ALA N A 89 ALA CA A 89 ALA C 1.0 -81.3 -48.9 PHI 142 142 A 89 ALA N A 89 ALA CA A 89 ALA C A 90 GLN N 1.0 -48.1 -24.8 PSI 143 143 A 92 SER C A 93 MET N A 93 MET CA A 93 MET C 1.0 -130.5 -80.7 PHI 144 144 A 93 MET N A 93 MET CA A 93 MET C A 94 VAL N 1.0 -19.2 31.7 PSI 145 145 A 93 MET C A 94 VAL N A 94 VAL CA A 94 VAL C 1.0 -111.1 -48.3 PHI 146 146 A 94 VAL N A 94 VAL CA A 94 VAL C A 95 LYS N 1.0 80.0 165.4 PSI 147 147 A 95 LYS C A 96 ARG N A 96 ARG CA A 96 ARG C 1.0 -195.3 -96.1 PHI 148 148 A 96 ARG N A 96 ARG CA A 96 ARG C A 97 PRO N 1.0 133.1 183.8 PSI 149 149 A 97 PRO C A 98 VAL N A 98 VAL CA A 98 VAL C 1.0 -178.2 -59.5 PHI 150 150 A 98 VAL N A 98 VAL CA A 98 VAL C A 99 LEU N 1.0 101.6 145.5 PSI 151 151 A 98 VAL C A 99 LEU N A 99 LEU CA A 99 LEU C 1.0 -147.5 -88.7 PHI 152 152 A 99 LEU N A 99 LEU CA A 99 LEU C A 100 GLU N 1.0 106.4 150.6 PSI 153 153 A 99 LEU C A 100 GLU N A 100 GLU CA A 100 GLU C 1.0 -143.9 -94.2 PHI 154 154 A 100 GLU N A 100 GLU CA A 100 GLU C A 101 ARG N 1.0 114.5 146.4 PSI 155 155 A 100 GLU C A 101 ARG N A 101 ARG CA A 101 ARG C 1.0 -175.1 -42.9 PHI 156 156 A 101 ARG N A 101 ARG CA A 101 ARG C A 102 ASP N 1.0 108.9 147.9 PSI 157 157 A 102 ASP C A 103 GLY N A 103 GLY CA A 103 GLY C 1.0 51.4 117.0 PHI 158 158 A 103 GLY N A 103 GLY CA A 103 GLY C A 104 LYS N 1.0 -45.1 35.8 PSI 159 159 A 103 GLY C A 104 LYS N A 104 LYS CA A 104 LYS C 1.0 -119.6 -49.5 PHI 160 160 A 104 LYS N A 104 LYS CA A 104 LYS C A 105 LEU N 1.0 113.0 140.6 PSI 161 161 A 104 LYS C A 105 LEU N A 105 LEU CA A 105 LEU C 1.0 -119.0 -96.6 PHI 162 162 A 105 LEU N A 105 LEU CA A 105 LEU C A 106 MET N 1.0 114.5 154.2 PSI 163 163 A 105 LEU C A 106 MET N A 106 MET CA A 106 MET C 1.0 -146.0 -110.5 PHI 164 164 A 106 MET N A 106 MET CA A 106 MET C A 107 VAL N 1.0 93.8 159.3 PSI 165 165 A 106 MET C A 107 VAL N A 107 VAL CA A 107 VAL C 1.0 -138.6 -91.9 PHI 166 166 A 107 VAL N A 107 VAL CA A 107 VAL C A 108 GLY N 1.0 106.7 156.0 PSI 167 167 A 107 VAL C A 108 GLY N A 108 GLY CA A 108 GLY C 1.0 -176.0 -62.5 PHI 168 168 A 108 GLY N A 108 GLY CA A 108 GLY C A 109 PHE N 1.0 98.6 215.9 PSI 169 169 A 108 GLY C A 109 PHE N A 109 PHE CA A 109 PHE C 1.0 -145.6 -80.2 PHI 170 170 A 109 PHE N A 109 PHE CA A 109 PHE C A 110 LYS N 1.0 106.4 156.0 PSI 171 171 A 109 PHE C A 110 LYS N A 110 LYS CA A 110 LYS C 1.0 -143.0 -34.9 PHI 172 172 A 110 LYS N A 110 LYS CA A 110 LYS C A 111 PRO N 1.0 73.7 191.3 PSI 173 173 A 111 PRO C A 112 ALA N A 112 ALA CA A 112 ALA C 1.0 -73.0 -50.0 PHI 174 174 A 112 ALA N A 112 ALA CA A 112 ALA C A 113 GLN N 1.0 -48.7 -28.7 PSI 175 175 A 112 ALA C A 113 GLN N A 113 GLN CA A 113 GLN C 1.0 -76.0 -56.0 PHI 176 176 A 113 GLN N A 113 GLN CA A 113 GLN C A 114 TYR N 1.0 -53.1 -28.0 PSI 177 177 A 113 GLN C A 114 TYR N A 114 TYR CA A 114 TYR C 1.0 -74.4 -54.4 PHI 178 178 A 114 TYR N A 114 TYR CA A 114 TYR C A 115 GLU N 1.0 -54.2 -28.2 PSI 179 179 A 114 TYR C A 115 GLU N A 115 GLU CA A 115 GLU C 1.0 -70.5 -50.5 PHI 180 180 A 115 GLU N A 115 GLU CA A 115 GLU C A 116 ALA N 1.0 -50.4 -30.4 PSI 181 181 A 115 GLU C A 116 ALA N A 116 ALA CA A 116 ALA C 1.0 -78.8 -58.8 PHI 182 182 A 116 ALA N A 116 ALA CA A 116 ALA C A 117 TYR N 1.0 -54.8 -19.6 PSI 183 183 A 116 ALA C A 117 TYR N A 117 TYR CA A 117 TYR C 1.0 -82.7 -50.0 PHI 184 184 A 117 TYR N A 117 TYR CA A 117 TYR C A 118 PHE N 1.0 -64.1 -16.6 PSI 185 185 A 117 TYR C A 118 PHE N A 118 PHE CA A 118 PHE C 1.0 -118.1 -55.9 PHI 186 186 A 118 PHE N A 118 PHE CA A 118 PHE C A 119 LYS N 1.0 -40.0 30.8 PSI 187 187 A 118 PHE C A 119 LYS N A 119 LYS CA A 119 LYS C 1.0 -99.6 -55.5 PHI 188 188 A 119 LYS N A 119 LYS CA A 119 LYS C A 120 LEU N 1.0 120.7 175.4 PSI stop_ save_