data_nef_c15864_2k6b save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 1YYB 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 0 GLY start . false 2 A 1 SER middle . . 3 A 2 ALA middle . . 4 A 3 ASP middle . . 5 A 4 GLU middle . . 6 A 5 GLU middle . . 7 A 6 LEU middle . . 8 A 7 GLU middle . . 9 A 8 ALA middle . . 10 A 9 LEU middle . . 11 A 10 ARG middle . . 12 A 11 ARG middle . . 13 A 12 GLN middle . . 14 A 13 ARG middle . . 15 A 14 LEU middle . . 16 A 15 ALA middle . . 17 A 16 GLU middle . . 18 A 17 LEU middle . . 19 A 18 GLN middle . . 20 A 19 ALA middle . . 21 A 20 LYS middle . . 22 A 21 HIS middle . . 23 A 22 GLY middle . false 24 A 23 ASP middle . . 25 A 24 PRO middle . false 26 A 25 GLY middle . false 27 A 26 ASP middle . . 28 A 27 ALA middle . . 29 A 28 ALA middle . . 30 A 29 GLN middle . . 31 A 30 GLN middle . . 32 A 31 GLU middle . . 33 A 32 ALA middle . . 34 A 33 LYS middle . . 35 A 34 HIS middle . . 36 A 35 ARG middle . . 37 A 36 GLU middle . . 38 A 37 ALA middle . . 39 A 38 GLU middle . . 40 A 39 MET middle . . 41 A 40 ARG middle . . 42 A 41 ASN middle . . 43 A 42 SER middle . . 44 A 43 ILE middle . . 45 A 44 LEU middle . . 46 A 45 ALA middle . . 47 A 46 GLN middle . . 48 A 47 VAL middle . . 49 A 48 LEU middle . . 50 A 49 ASP middle . . 51 A 50 GLN middle . . 52 A 51 SER middle . . 53 A 52 ALA middle . . 54 A 53 ARG middle . . 55 A 54 ALA middle . . 56 A 55 ARG middle . . 57 A 56 LEU middle . . 58 A 57 SER middle . . 59 A 58 ASN middle . . 60 A 59 LEU middle . . 61 A 60 ALA middle . . 62 A 61 LEU middle . . 63 A 62 VAL middle . . 64 A 63 LYS middle . . 65 A 64 PRO middle . false 66 A 65 GLU middle . . 67 A 66 LYS middle . . 68 A 67 THR middle . . 69 A 68 LYS middle . . 70 A 69 ALA middle . . 71 A 70 VAL middle . . 72 A 71 GLU middle . . 73 A 72 ASN middle . . 74 A 73 TYR middle . . 75 A 74 LEU middle . . 76 A 75 ILE middle . . 77 A 76 GLN middle . . 78 A 77 MET middle . . 79 A 78 ALA middle . . 80 A 79 ARG middle . . 81 A 80 TYR middle . . 82 A 81 GLY middle . false 83 A 82 GLN middle . . 84 A 83 LEU middle . . 85 A 84 SER middle . . 86 A 85 GLU middle . . 87 A 86 LYS middle . . 88 A 87 VAL middle . . 89 A 88 SER middle . . 90 A 89 GLU middle . . 91 A 90 GLN middle . . 92 A 91 GLY middle . false 93 A 92 LEU middle . . 94 A 93 ILE middle . . 95 A 94 GLU middle . . 96 A 95 ILE middle . . 97 A 96 LEU middle . . 98 A 97 LYS middle . . 99 A 98 LYS middle . . 100 A 99 VAL middle . . 101 A 100 SER middle . . 102 A 101 GLN middle . . 103 A 102 GLN middle . . 104 A 103 THR middle . . 105 A 104 GLU middle . . 106 A 105 LYS middle . . 107 A 106 THR middle . . 108 A 107 THR middle . . 109 A 108 THR middle . . 110 A 109 VAL middle . . 111 A 110 LYS middle . . 112 A 111 PHE middle . . 113 A 112 ASN end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 SER H H 1 8.78 0.02 A 1 SER HA H 1 4.48 0.02 A 1 SER HBx H 1 3.93 0.02 A 1 SER HBy H 1 4 0.02 A 1 SER C C 13 175 0.3 A 1 SER CA C 13 59.1 0.3 A 1 SER CB C 13 63.9 0.3 A 1 SER N N 15 116.6 0.2 A 2 ALA H H 1 8.71 0.02 A 2 ALA HA H 1 4.31 0.02 A 2 ALA HB% H 1 1.44 0.02 A 2 ALA C C 13 178.8 0.3 A 2 ALA CA C 13 53.8 0.3 A 2 ALA CB C 13 18.5 0.3 A 2 ALA N N 15 125.5 0.2 A 3 ASP H H 1 8.19 0.02 A 3 ASP HA H 1 4.5 0.02 A 3 ASP HBy H 1 2.75 0.02 A 3 ASP HBx H 1 2.68 0.02 A 3 ASP C C 13 177.7 0.3 A 3 ASP CA C 13 55.9 0.3 A 3 ASP CB C 13 40.5 0.3 A 3 ASP N N 15 117.8 0.2 A 4 GLU H H 1 8.15 0.02 A 4 GLU HA H 1 4.14 0.02 A 4 GLU HB2 H 1 2.11 0.02 A 4 GLU HB3 H 1 2.11 0.02 A 4 GLU HG2 H 1 2.4 0.02 A 4 GLU HG3 H 1 2.4 0.02 A 4 GLU C C 13 178.6 0.3 A 4 GLU CA C 13 58.6 0.3 A 4 GLU CB C 13 29.1 0.3 A 4 GLU CG C 13 35.4 0.3 A 4 GLU N N 15 120.8 0.2 A 5 GLU H H 1 8.25 0.02 A 5 GLU HA H 1 4.2 0.02 A 5 GLU HB2 H 1 2.12 0.02 A 5 GLU HB3 H 1 2.12 0.02 A 5 GLU HG2 H 1 2.4 0.02 A 5 GLU HG3 H 1 2.4 0.02 A 5 GLU C C 13 178.3 0.3 A 5 GLU CA C 13 58.6 0.3 A 5 GLU CB C 13 28.8 0.3 A 5 GLU CG C 13 35.2 0.3 A 5 GLU N N 15 120.8 0.2 A 6 LEU H H 1 7.99 0.02 A 6 LEU HA H 1 4.17 0.02 A 6 LEU HBy H 1 1.82 0.02 A 6 LEU HBx H 1 1.66 0.02 A 6 LEU HDx% H 1 0.89 0.02 A 6 LEU HDy% H 1 0.92 0.02 A 6 LEU C C 13 179.5 0.3 A 6 LEU CA C 13 57.5 0.3 A 6 LEU CB C 13 41.6 0.3 A 6 LEU CDx C 13 23.5 0.3 A 6 LEU CDy C 13 24.6 0.3 A 6 LEU CG C 13 26.9 0.3 A 6 LEU N N 15 120.9 0.2 A 7 GLU H H 1 8.13 0.02 A 7 GLU HA H 1 4.16 0.02 A 7 GLU HB2 H 1 2.11 0.02 A 7 GLU HB3 H 1 2.11 0.02 A 7 GLU HG2 H 1 2.38 0.02 A 7 GLU HG3 H 1 2.38 0.02 A 7 GLU C C 13 178.3 0.3 A 7 GLU CA C 13 58.8 0.3 A 7 GLU CB C 13 28.8 0.3 A 7 GLU CG C 13 35.3 0.3 A 7 GLU N N 15 120.1 0.2 A 8 ALA H H 1 8.03 0.02 A 8 ALA HA H 1 4.09 0.02 A 8 ALA HB% H 1 1.49 0.02 A 8 ALA C C 13 180.5 0.3 A 8 ALA CA C 13 55.1 0.3 A 8 ALA CB C 13 17.9 0.3 A 8 ALA N N 15 122.1 0.2 A 9 LEU H H 1 7.89 0.02 A 9 LEU HA H 1 4.16 0.02 A 9 LEU HBy H 1 1.84 0.02 A 9 LEU HBx H 1 1.69 0.02 A 9 LEU HDx% H 1 0.88 0.02 A 9 LEU HDy% H 1 0.92 0.02 A 9 LEU C C 13 179.2 0.3 A 9 LEU CA C 13 57.5 0.3 A 9 LEU CB C 13 41.8 0.3 A 9 LEU CDx C 13 23.5 0.3 A 9 LEU CDy C 13 24.6 0.3 A 9 LEU CG C 13 26.9 0.3 A 9 LEU N N 15 119.5 0.2 A 10 ARG H H 1 8.08 0.02 A 10 ARG HA H 1 4.01 0.02 A 10 ARG HBx H 1 1.77 0.02 A 10 ARG HBy H 1 1.96 0.02 A 10 ARG HD2 H 1 3.23 0.02 A 10 ARG HD3 H 1 3.23 0.02 A 10 ARG HG2 H 1 1.57 0.02 A 10 ARG HG3 H 1 1.57 0.02 A 10 ARG C C 13 178.9 0.3 A 10 ARG CA C 13 59.4 0.3 A 10 ARG CB C 13 30.1 0.3 A 10 ARG CD C 13 43.2 0.3 A 10 ARG CG C 13 27.4 0.3 A 10 ARG N N 15 120.4 0.2 A 11 ARG H H 1 8.17 0.02 A 11 ARG HA H 1 4.04 0.02 A 11 ARG HBx H 1 1.62 0.02 A 11 ARG HBy H 1 1.95 0.02 A 11 ARG HDy H 1 3.25 0.02 A 11 ARG HDx H 1 3.2 0.02 A 11 ARG HG2 H 1 1.44 0.02 A 11 ARG HG3 H 1 1.44 0.02 A 11 ARG C C 13 178.9 0.3 A 11 ARG CA C 13 59.3 0.3 A 11 ARG CB C 13 30 0.3 A 11 ARG CD C 13 43.2 0.3 A 11 ARG CG C 13 27.4 0.3 A 11 ARG N N 15 118.4 0.2 A 12 GLN H H 1 8.06 0.02 A 12 GLN HA H 1 4.15 0.02 A 12 GLN HB2 H 1 2.21 0.02 A 12 GLN HB3 H 1 2.21 0.02 A 12 GLN HGy H 1 2.49 0.02 A 12 GLN HGx H 1 2.38 0.02 A 12 GLN C C 13 177.9 0.3 A 12 GLN CA C 13 58.6 0.3 A 12 GLN CB C 13 28.5 0.3 A 12 GLN CG C 13 33.6 0.3 A 12 GLN N N 15 120.4 0.2 A 13 ARG H H 1 8.18 0.02 A 13 ARG HA H 1 4.16 0.02 A 13 ARG HB2 H 1 1.95 0.02 A 13 ARG HB3 H 1 1.95 0.02 A 13 ARG HD2 H 1 3.24 0.02 A 13 ARG HD3 H 1 3.24 0.02 A 13 ARG HG2 H 1 1.71 0.02 A 13 ARG HG3 H 1 1.71 0.02 A 13 ARG C C 13 178.6 0.3 A 13 ARG CA C 13 58.6 0.3 A 13 ARG CB C 13 29.9 0.3 A 13 ARG CD C 13 43.2 0.3 A 13 ARG CG C 13 27.4 0.3 A 13 ARG N N 15 119.9 0.2 A 14 LEU H H 1 7.98 0.02 A 14 LEU HA H 1 4.18 0.02 A 14 LEU HBy H 1 1.78 0.02 A 14 LEU HBx H 1 1.65 0.02 A 14 LEU HDx% H 1 0.92 0.02 A 14 LEU HDy% H 1 0.89 0.02 A 14 LEU C C 13 178.8 0.3 A 14 LEU CA C 13 57.3 0.3 A 14 LEU CB C 13 41.7 0.3 A 14 LEU CDx C 13 23.6 0.3 A 14 LEU CDy C 13 24.6 0.3 A 14 LEU CG C 13 26.9 0.3 A 14 LEU N N 15 119.9 0.2 A 15 ALA H H 1 7.93 0.02 A 15 ALA HA H 1 4.19 0.02 A 15 ALA HB% H 1 1.49 0.02 A 15 ALA C C 13 180.1 0.3 A 15 ALA CA C 13 54.5 0.3 A 15 ALA CB C 13 18 0.3 A 15 ALA N N 15 122 0.2 A 16 GLU H H 1 8.01 0.02 A 16 GLU HA H 1 4.16 0.02 A 16 GLU HB2 H 1 2.15 0.02 A 16 GLU HB3 H 1 2.15 0.02 A 16 GLU HGx H 1 2.36 0.02 A 16 GLU HGy H 1 2.52 0.02 A 16 GLU C C 13 178.1 0.3 A 16 GLU CA C 13 58.1 0.3 A 16 GLU CB C 13 28.9 0.3 A 16 GLU CG C 13 35.3 0.3 A 16 GLU N N 15 118.5 0.2 A 17 LEU H H 1 7.89 0.02 A 17 LEU HA H 1 4.2 0.02 A 17 LEU HBy H 1 1.83 0.02 A 17 LEU HBx H 1 1.66 0.02 A 17 LEU HDx% H 1 0.92 0.02 A 17 LEU HDy% H 1 0.89 0.02 A 17 LEU HG H 1 1.39 0.02 A 17 LEU C C 13 178.7 0.3 A 17 LEU CA C 13 56.9 0.3 A 17 LEU CB C 13 42.1 0.3 A 17 LEU CDy C 13 24.7 0.3 A 17 LEU CDx C 13 23.5 0.3 A 17 LEU CG C 13 26.9 0.3 A 17 LEU N N 15 120.4 0.2 A 18 GLN H H 1 8.02 0.02 A 18 GLN HA H 1 4.2 0.02 A 18 GLN HB2 H 1 2.12 0.02 A 18 GLN HB3 H 1 2.12 0.02 A 18 GLN HGy H 1 2.47 0.02 A 18 GLN HGx H 1 2.4 0.02 A 18 GLN C C 13 176.7 0.3 A 18 GLN CA C 13 56.9 0.3 A 18 GLN CB C 13 28.8 0.3 A 18 GLN CG C 13 33.8 0.3 A 18 GLN N N 15 118.5 0.2 A 19 ALA H H 1 7.85 0.02 A 19 ALA HA H 1 4.24 0.02 A 19 ALA HB% H 1 1.42 0.02 A 19 ALA C C 13 178 0.3 A 19 ALA CA C 13 53.1 0.3 A 19 ALA CB C 13 18.7 0.3 A 19 ALA N N 15 122.7 0.2 A 20 LYS H H 1 7.95 0.02 A 20 LYS HA H 1 4.26 0.02 A 20 LYS HBy H 1 1.8 0.02 A 20 LYS HBx H 1 1.7 0.02 A 20 LYS HE2 H 1 2.99 0.02 A 20 LYS HE3 H 1 2.99 0.02 A 20 LYS HGy H 1 1.49 0.02 A 20 LYS HGx H 1 1.42 0.02 A 20 LYS C C 13 176.6 0.3 A 20 LYS CA C 13 56.5 0.3 A 20 LYS CB C 13 32.6 0.3 A 20 LYS CD C 13 28.8 0.3 A 20 LYS CE C 13 41.8 0.3 A 20 LYS CG C 13 24.7 0.3 A 20 LYS N N 15 118.8 0.2 A 21 HIS H H 1 8.32 0.02 A 21 HIS HA H 1 4.73 0.02 A 21 HIS HBy H 1 3.34 0.02 A 21 HIS HBx H 1 3.22 0.02 A 21 HIS C C 13 174.8 0.3 A 21 HIS CA C 13 55.4 0.3 A 21 HIS CB C 13 28.8 0.3 A 21 HIS N N 15 118.6 0.2 A 22 GLY H H 1 8.36 0.02 A 22 GLY HA2 H 1 3.96 0.02 A 22 GLY HA3 H 1 3.96 0.02 A 22 GLY C C 13 173.2 0.3 A 22 GLY CA C 13 45 0.3 A 22 GLY N N 15 109.6 0.2 A 23 ASP H H 1 8.32 0.02 A 23 ASP HA H 1 4.94 0.02 A 23 ASP HBy H 1 2.77 0.02 A 23 ASP HBx H 1 2.6 0.02 A 23 ASP C C 13 174.9 0.3 A 23 ASP CA C 13 52.2 0.3 A 23 ASP CB C 13 41.3 0.3 A 23 ASP N N 15 121.6 0.2 A 24 PRO HA H 1 4.43 0.02 A 24 PRO HBy H 1 2.3 0.02 A 24 PRO HBx H 1 2 0.02 A 24 PRO HDy H 1 3.89 0.02 A 24 PRO HDx H 1 3.82 0.02 A 24 PRO HG2 H 1 2.05 0.02 A 24 PRO HG3 H 1 2.04 0.02 A 24 PRO C C 13 177.8 0.3 A 24 PRO CA C 13 64.1 0.3 A 24 PRO CB C 13 31.9 0.3 A 24 PRO CD C 13 50.8 0.3 A 24 PRO CG C 13 27.2 0.3 A 25 GLY H H 1 8.52 0.02 A 25 GLY HA2 H 1 3.94 0.02 A 25 GLY HA3 H 1 3.94 0.02 A 25 GLY C C 13 174.4 0.3 A 25 GLY CA C 13 45.5 0.3 A 25 GLY N N 15 108.3 0.2 A 26 ASP H H 1 8.1 0.02 A 26 ASP HA H 1 4.61 0.02 A 26 ASP HB2 H 1 2.77 0.02 A 26 ASP HB3 H 1 2.77 0.02 A 26 ASP C C 13 176.9 0.3 A 26 ASP CA C 13 54.8 0.3 A 26 ASP CB C 13 40.8 0.3 A 26 ASP N N 15 120.7 0.2 A 27 ALA H H 1 8.32 0.02 A 27 ALA HA H 1 4.18 0.02 A 27 ALA HB% H 1 1.44 0.02 A 27 ALA C C 13 179.3 0.3 A 27 ALA CA C 13 54.6 0.3 A 27 ALA CB C 13 18.4 0.3 A 27 ALA N N 15 124.1 0.2 A 28 ALA H H 1 8.25 0.02 A 28 ALA HA H 1 4.23 0.02 A 28 ALA HB% H 1 1.47 0.02 A 28 ALA C C 13 180 0.3 A 28 ALA CA C 13 54.3 0.3 A 28 ALA CB C 13 18.2 0.3 A 28 ALA N N 15 121.2 0.2 A 29 GLN H H 1 8.12 0.02 A 29 GLN HA H 1 4.23 0.02 A 29 GLN HB2 H 1 2.16 0.02 A 29 GLN HB3 H 1 2.16 0.02 A 29 GLN HG2 H 1 2.43 0.02 A 29 GLN HG3 H 1 2.43 0.02 A 29 GLN C C 13 177.9 0.3 A 29 GLN CA C 13 57.8 0.3 A 29 GLN CB C 13 28.6 0.3 A 29 GLN CG C 13 33.7 0.3 A 29 GLN N N 15 118.8 0.2 A 30 GLN H H 1 8.24 0.02 A 30 GLN HA H 1 4.12 0.02 A 30 GLN HB2 H 1 2.11 0.02 A 30 GLN HB3 H 1 2.11 0.02 A 30 GLN HG2 H 1 2.43 0.02 A 30 GLN HG3 H 1 2.43 0.02 A 30 GLN C C 13 178.1 0.3 A 30 GLN CA C 13 58 0.3 A 30 GLN CB C 13 28.5 0.3 A 30 GLN CG C 13 33.7 0.3 A 30 GLN N N 15 119.6 0.2 A 31 GLU H H 1 8.3 0.02 A 31 GLU HA H 1 4.19 0.02 A 31 GLU HB2 H 1 2.11 0.02 A 31 GLU HB3 H 1 2.11 0.02 A 31 GLU HG2 H 1 2.38 0.02 A 31 GLU HG3 H 1 2.38 0.02 A 31 GLU C C 13 178.1 0.3 A 31 GLU CA C 13 58.6 0.3 A 31 GLU CB C 13 28.8 0.3 A 31 GLU CG C 13 35.2 0.3 A 31 GLU N N 15 120.8 0.2 A 32 ALA H H 1 8.07 0.02 A 32 ALA HA H 1 4.16 0.02 A 32 ALA HB% H 1 1.5 0.02 A 32 ALA C C 13 179.9 0.3 A 32 ALA CA C 13 54.9 0.3 A 32 ALA CB C 13 18.2 0.3 A 32 ALA N N 15 123 0.2 A 33 LYS H H 1 8.05 0.02 A 33 LYS HA H 1 4.15 0.02 A 33 LYS HB2 H 1 1.9 0.02 A 33 LYS HB3 H 1 1.9 0.02 A 33 LYS HD2 H 1 1.67 0.02 A 33 LYS HD3 H 1 1.67 0.02 A 33 LYS HE2 H 1 2.97 0.02 A 33 LYS HE3 H 1 2.97 0.02 A 33 LYS HGx H 1 1.46 0.02 A 33 LYS HGy H 1 1.57 0.02 A 33 LYS C C 13 178.9 0.3 A 33 LYS CA C 13 58.6 0.3 A 33 LYS CB C 13 32.3 0.3 A 33 LYS CD C 13 28.8 0.3 A 33 LYS CE C 13 41.8 0.3 A 33 LYS CG C 13 24.9 0.3 A 33 LYS N N 15 118.6 0.2 A 34 HIS H H 1 8.24 0.02 A 34 HIS HA H 1 4.58 0.02 A 34 HIS HBy H 1 3.41 0.02 A 34 HIS HBx H 1 3.36 0.02 A 34 HIS C C 13 176.3 0.3 A 34 HIS CA C 13 57.8 0.3 A 34 HIS CB C 13 28.3 0.3 A 34 HIS N N 15 119.1 0.2 A 35 ARG H H 1 8.39 0.02 A 35 ARG HA H 1 4.16 0.02 A 35 ARG HB2 H 1 1.96 0.02 A 35 ARG HB3 H 1 1.96 0.02 A 35 ARG HD2 H 1 3.25 0.02 A 35 ARG HD3 H 1 3.25 0.02 A 35 ARG HG2 H 1 1.83 0.02 A 35 ARG HG3 H 1 1.83 0.02 A 35 ARG C C 13 178.5 0.3 A 35 ARG CA C 13 58.8 0.3 A 35 ARG CB C 13 29.2 0.3 A 35 ARG CD C 13 43.5 0.3 A 35 ARG CG C 13 35.5 0.3 A 35 ARG N N 15 120.6 0.2 A 36 GLU H H 1 8.24 0.02 A 36 GLU HA H 1 4.08 0.02 A 36 GLU HB2 H 1 2.12 0.02 A 36 GLU HB3 H 1 2.12 0.02 A 36 GLU HGy H 1 2.4 0.02 A 36 GLU HGx H 1 2.31 0.02 A 36 GLU C C 13 178.2 0.3 A 36 GLU CA C 13 59.1 0.3 A 36 GLU CB C 13 29.1 0.3 A 36 GLU CG C 13 35.5 0.3 A 36 GLU N N 15 120.4 0.2 A 37 ALA H H 1 7.98 0.02 A 37 ALA HA H 1 4.1 0.02 A 37 ALA HB% H 1 1.51 0.02 A 37 ALA C C 13 179.8 0.3 A 37 ALA CA C 13 55.1 0.3 A 37 ALA CB C 13 18 0.3 A 37 ALA N N 15 122 0.2 A 38 GLU H H 1 8.05 0.02 A 38 GLU HA H 1 4.12 0.02 A 38 GLU HB2 H 1 2.08 0.02 A 38 GLU HB3 H 1 2.08 0.02 A 38 GLU HG2 H 1 2.28 0.02 A 38 GLU HG3 H 1 2.27 0.02 A 38 GLU C C 13 179 0.3 A 38 GLU CA C 13 58.8 0.3 A 38 GLU CB C 13 29.1 0.3 A 38 GLU CG C 13 35.5 0.3 A 38 GLU N N 15 118.2 0.2 A 39 MET H H 1 8.13 0.02 A 39 MET HA H 1 4.2 0.02 A 39 MET HB2 H 1 2.08 0.02 A 39 MET HB3 H 1 2.08 0.02 A 39 MET HG2 H 1 2.39 0.02 A 39 MET HG3 H 1 2.39 0.02 A 39 MET C C 13 178.2 0.3 A 39 MET CA C 13 58.1 0.3 A 39 MET CB C 13 32.3 0.3 A 39 MET CG C 13 29.8 0.3 A 39 MET N N 15 120.3 0.2 A 40 ARG HA H 1 3.89 0.02 A 40 ARG HB2 H 1 1.85 0.02 A 40 ARG HB3 H 1 1.85 0.02 A 40 ARG HD2 H 1 3.21 0.02 A 40 ARG HD3 H 1 3.21 0.02 A 40 ARG HG2 H 1 1.47 0.02 A 40 ARG HG3 H 1 1.47 0.02 A 40 ARG C C 13 177.7 0.3 A 40 ARG CA C 13 59.5 0.3 A 40 ARG CB C 13 30.3 0.3 A 41 ASN H H 1 8.19 0.02 A 41 ASN HA H 1 4.44 0.02 A 41 ASN HBy H 1 2.95 0.02 A 41 ASN HBx H 1 2.86 0.02 A 41 ASN HD2x H 1 6.9 0.02 A 41 ASN HD2y H 1 7.63 0.02 A 41 ASN C C 13 177.7 0.3 A 41 ASN CA C 13 55.9 0.3 A 41 ASN CB C 13 38.1 0.3 A 41 ASN N N 15 116.3 0.2 A 41 ASN ND2 N 15 112.6 0.2 A 42 SER H H 1 8.13 0.02 A 42 SER HA H 1 4.3 0.02 A 42 SER HBx H 1 4.04 0.02 A 42 SER HBy H 1 4.1 0.02 A 42 SER C C 13 176.6 0.3 A 42 SER CA C 13 61.2 0.3 A 42 SER CB C 13 63.1 0.3 A 42 SER N N 15 116.3 0.2 A 43 ILE H H 1 7.94 0.02 A 43 ILE HA H 1 3.86 0.02 A 43 ILE HB H 1 1.89 0.02 A 43 ILE HD1% H 1 0.82 0.02 A 43 ILE HG1y H 1 1.71 0.02 A 43 ILE HG1x H 1 1.11 0.02 A 43 ILE HG2% H 1 0.84 0.02 A 43 ILE C C 13 178.4 0.3 A 43 ILE CA C 13 64.5 0.3 A 43 ILE CB C 13 37.9 0.3 A 43 ILE CD1 C 13 13.3 0.3 A 43 ILE CG1 C 13 28.7 0.3 A 43 ILE CG2 C 13 18.1 0.3 A 43 ILE N N 15 122.5 0.2 A 44 LEU H H 1 8.07 0.02 A 44 LEU HA H 1 3.94 0.02 A 44 LEU HBy H 1 1.9 0.02 A 44 LEU HBx H 1 1.3 0.02 A 44 LEU HDx% H 1 0.85 0.02 A 44 LEU HDy% H 1 0.8 0.02 A 44 LEU HG H 1 1.83 0.02 A 44 LEU C C 13 178.2 0.3 A 44 LEU CA C 13 58.1 0.3 A 44 LEU CB C 13 41.1 0.3 A 44 LEU CDy C 13 25.3 0.3 A 44 LEU CDx C 13 23.3 0.3 A 44 LEU CG C 13 26.9 0.3 A 44 LEU N N 15 119.1 0.2 A 45 ALA H H 1 7.76 0.02 A 45 ALA HA H 1 4.1 0.02 A 45 ALA HB% H 1 1.49 0.02 A 45 ALA C C 13 178.7 0.3 A 45 ALA CA C 13 54.1 0.3 A 45 ALA CB C 13 18.1 0.3 A 45 ALA N N 15 117.6 0.2 A 46 GLN H H 1 7.57 0.02 A 46 GLN HA H 1 4.27 0.02 A 46 GLN HB2 H 1 2.25 0.02 A 46 GLN HB3 H 1 2.25 0.02 A 46 GLN HGx H 1 2.41 0.02 A 46 GLN HGy H 1 2.54 0.02 A 46 GLN C C 13 177.8 0.3 A 46 GLN CA C 13 57.3 0.3 A 46 GLN CB C 13 29.5 0.3 A 46 GLN CG C 13 33.8 0.3 A 46 GLN N N 15 114.3 0.2 A 47 VAL H H 1 7.69 0.02 A 47 VAL HA H 1 4.38 0.02 A 47 VAL HB H 1 2.31 0.02 A 47 VAL HG1% H 1 0.96 0.02 A 47 VAL HG2% H 1 0.96 0.02 A 47 VAL C C 13 174.4 0.3 A 47 VAL CA C 13 62.6 0.3 A 47 VAL CB C 13 32.8 0.3 A 47 VAL CGy C 13 21.7 0.3 A 47 VAL CGx C 13 20.2 0.3 A 47 VAL N N 15 111.9 0.2 A 48 LEU H H 1 7.48 0.02 A 48 LEU HA H 1 4.91 0.02 A 48 LEU HBy H 1 1.88 0.02 A 48 LEU HBx H 1 1.51 0.02 A 48 LEU HDx% H 1 0.82 0.02 A 48 LEU HDy% H 1 0.82 0.02 A 48 LEU HG H 1 1.83 0.02 A 48 LEU C C 13 177 0.3 A 48 LEU CA C 13 53.7 0.3 A 48 LEU CB C 13 44.5 0.3 A 48 LEU CDx C 13 23.8 0.3 A 48 LEU CDy C 13 27 0.3 A 48 LEU CG C 13 27.2 0.3 A 48 LEU N N 15 119.6 0.2 A 49 ASP H H 1 8.43 0.02 A 49 ASP HA H 1 4.63 0.02 A 49 ASP HBy H 1 3.22 0.02 A 49 ASP HBx H 1 2.55 0.02 A 49 ASP C C 13 176 0.3 A 49 ASP CA C 13 53 0.3 A 49 ASP CB C 13 40.2 0.3 A 49 ASP N N 15 121.2 0.2 A 50 GLN H H 1 8.58 0.02 A 50 GLN HA H 1 3.95 0.02 A 50 GLN HBy H 1 2.17 0.02 A 50 GLN HBx H 1 2.13 0.02 A 50 GLN HG2 H 1 2.48 0.02 A 50 GLN HG3 H 1 2.48 0.02 A 50 GLN C C 13 178.8 0.3 A 50 GLN CA C 13 60.2 0.3 A 50 GLN CB C 13 28.3 0.3 A 50 GLN CG C 13 33.6 0.3 A 50 GLN N N 15 118.2 0.2 A 51 SER H H 1 8.43 0.02 A 51 SER HA H 1 4.32 0.02 A 51 SER HBx H 1 4.05 0.02 A 51 SER HBy H 1 4.11 0.02 A 51 SER C C 13 177.2 0.3 A 51 SER CA C 13 61.5 0.3 A 51 SER CB C 13 62.4 0.3 A 51 SER N N 15 117 0.2 A 52 ALA H H 1 8.76 0.02 A 52 ALA HA H 1 3.96 0.02 A 52 ALA HB% H 1 1.42 0.02 A 52 ALA C C 13 178.9 0.3 A 52 ALA CA C 13 55.4 0.3 A 52 ALA CB C 13 19.2 0.3 A 52 ALA N N 15 127.4 0.2 A 53 ARG H H 1 8.64 0.02 A 53 ARG HA H 1 3.88 0.02 A 53 ARG HBx H 1 1.84 0.02 A 53 ARG HBy H 1 1.97 0.02 A 53 ARG HDy H 1 3.26 0.02 A 53 ARG HDx H 1 3.18 0.02 A 53 ARG HGx H 1 1.63 0.02 A 53 ARG HGy H 1 1.72 0.02 A 53 ARG C C 13 179 0.3 A 53 ARG CA C 13 59.7 0.3 A 53 ARG CB C 13 29.9 0.3 A 53 ARG CD C 13 43.4 0.3 A 53 ARG CG C 13 27.9 0.3 A 53 ARG N N 15 118.2 0.2 A 54 ALA H H 1 7.96 0.02 A 54 ALA HA H 1 4.19 0.02 A 54 ALA HB% H 1 1.5 0.02 A 54 ALA C C 13 180.1 0.3 A 54 ALA CA C 13 55.1 0.3 A 54 ALA CB C 13 17.7 0.3 A 54 ALA N N 15 122.2 0.2 A 55 ARG H H 1 7.8 0.02 A 55 ARG HA H 1 4.16 0.02 A 55 ARG HB2 H 1 1.94 0.02 A 55 ARG HB3 H 1 1.94 0.02 A 55 ARG HDy H 1 3.32 0.02 A 55 ARG HDx H 1 3.22 0.02 A 55 ARG HGy H 1 1.78 0.02 A 55 ARG HGx H 1 1.68 0.02 A 55 ARG C C 13 178.9 0.3 A 55 ARG CA C 13 58.3 0.3 A 55 ARG CB C 13 29.1 0.3 A 55 ARG CD C 13 43.2 0.3 A 55 ARG CG C 13 24.8 0.3 A 55 ARG N N 15 119.1 0.2 A 56 LEU H H 1 8.39 0.02 A 56 LEU HA H 1 4.06 0.02 A 56 LEU HBy H 1 1.92 0.02 A 56 LEU HBx H 1 1.59 0.02 A 56 LEU HDx% H 1 0.95 0.02 A 56 LEU HDy% H 1 0.89 0.02 A 56 LEU C C 13 178.1 0.3 A 56 LEU CA C 13 57.8 0.3 A 56 LEU CB C 13 41.6 0.3 A 56 LEU CDx C 13 24.4 0.3 A 56 LEU CDy C 13 25.9 0.3 A 56 LEU CG C 13 25.6 0.3 A 56 LEU N N 15 120.6 0.2 A 57 SER H H 1 8.15 0.02 A 57 SER HA H 1 4.21 0.02 A 57 SER HBy H 1 3.99 0.02 A 57 SER HBx H 1 3.95 0.02 A 57 SER C C 13 176.5 0.3 A 57 SER CA C 13 61.8 0.3 A 57 SER CB C 13 62.6 0.3 A 57 SER N N 15 114.1 0.2 A 58 ASN H H 1 7.7 0.02 A 58 ASN HA H 1 4.58 0.02 A 58 ASN HBy H 1 2.89 0.02 A 58 ASN HBx H 1 2.82 0.02 A 58 ASN HD2x H 1 6.92 0.02 A 58 ASN HD2y H 1 7.56 0.02 A 58 ASN C C 13 178 0.3 A 58 ASN CA C 13 56.2 0.3 A 58 ASN CB C 13 38.7 0.3 A 58 ASN N N 15 119.5 0.2 A 58 ASN ND2 N 15 112.4 0.2 A 59 LEU H H 1 8.25 0.02 A 59 LEU HA H 1 4.07 0.02 A 59 LEU HBx H 1 1.66 0.02 A 59 LEU HBy H 1 1.83 0.02 A 59 LEU HDx% H 1 0.89 0.02 A 59 LEU HDy% H 1 0.82 0.02 A 59 LEU C C 13 178.4 0.3 A 59 LEU CA C 13 57.5 0.3 A 59 LEU CB C 13 42.1 0.3 A 59 LEU CDy C 13 24.6 0.3 A 59 LEU CDx C 13 23.5 0.3 A 59 LEU CG C 13 26.9 0.3 A 59 LEU N N 15 123 0.2 A 60 ALA H H 1 8.07 0.02 A 60 ALA HA H 1 3.91 0.02 A 60 ALA HB% H 1 1.49 0.02 A 60 ALA C C 13 178.4 0.3 A 60 ALA CA C 13 54.6 0.3 A 60 ALA CB C 13 18.2 0.3 A 60 ALA N N 15 120.7 0.2 A 61 LEU H H 1 7.17 0.02 A 61 LEU HA H 1 4.2 0.02 A 61 LEU HBx H 1 1.65 0.02 A 61 LEU HBy H 1 1.92 0.02 A 61 LEU HDx% H 1 0.97 0.02 A 61 LEU HG H 1 1.76 0.02 A 61 LEU C C 13 178.3 0.3 A 61 LEU CA C 13 56.5 0.3 A 61 LEU CB C 13 42.1 0.3 A 61 LEU CDy C 13 24.8 0.3 A 61 LEU CDx C 13 23.5 0.3 A 61 LEU CG C 13 26.9 0.3 A 61 LEU N N 15 113.7 0.2 A 62 VAL H H 1 7.33 0.02 A 62 VAL HA H 1 4.38 0.02 A 62 VAL HB H 1 2.17 0.02 A 62 VAL HGx% H 1 1.01 0.02 A 62 VAL HGy% H 1 1.03 0.02 A 62 VAL C C 13 176.2 0.3 A 62 VAL CA C 13 62.8 0.3 A 62 VAL CB C 13 33.9 0.3 A 62 VAL CGy C 13 21.7 0.3 A 62 VAL CGx C 13 20 0.3 A 62 VAL N N 15 112.5 0.2 A 63 LYS H H 1 8.71 0.02 A 63 LYS HA H 1 5 0.02 A 63 LYS HBx H 1 1.72 0.02 A 63 LYS HBy H 1 1.94 0.02 A 63 LYS HD2 H 1 1.65 0.02 A 63 LYS HD3 H 1 1.65 0.02 A 63 LYS HE2 H 1 2.99 0.02 A 63 LYS HE3 H 1 2.99 0.02 A 63 LYS HG2 H 1 1.44 0.02 A 63 LYS HG3 H 1 1.44 0.02 A 63 LYS C C 13 174.2 0.3 A 63 LYS CA C 13 53.6 0.3 A 63 LYS CB C 13 33.4 0.3 A 63 LYS CD C 13 29.5 0.3 A 63 LYS CE C 13 42.1 0.3 A 63 LYS CG C 13 24.8 0.3 A 63 LYS N N 15 120.4 0.2 A 64 PRO HA H 1 4.36 0.02 A 64 PRO HBy H 1 2.54 0.02 A 64 PRO HBx H 1 2.01 0.02 A 64 PRO HDx H 1 3.31 0.02 A 64 PRO HDy H 1 3.77 0.02 A 64 PRO HG2 H 1 2.13 0.02 A 64 PRO HG3 H 1 2.13 0.02 A 64 PRO C C 13 179.4 0.3 A 64 PRO CA C 13 66 0.3 A 64 PRO CB C 13 31.4 0.3 A 64 PRO CD C 13 50.4 0.3 A 64 PRO CG C 13 27.4 0.3 A 65 GLU H H 1 8.92 0.02 A 65 GLU HA H 1 4.2 0.02 A 65 GLU HB2 H 1 2.12 0.02 A 65 GLU HB3 H 1 2.12 0.02 A 65 GLU HGx H 1 2.34 0.02 A 65 GLU HGy H 1 2.39 0.02 A 65 GLU C C 13 179.6 0.3 A 65 GLU CA C 13 59.4 0.3 A 65 GLU CB C 13 28.3 0.3 A 65 GLU CG C 13 35.2 0.3 A 65 GLU N N 15 118.7 0.2 A 66 LYS H H 1 8 0.02 A 66 LYS HA H 1 4.16 0.02 A 66 LYS HBy H 1 1.94 0.02 A 66 LYS HBx H 1 1.78 0.02 A 66 LYS HD2 H 1 1.67 0.02 A 66 LYS HD3 H 1 1.67 0.02 A 66 LYS HE2 H 1 3.22 0.02 A 66 LYS HE3 H 1 3.22 0.02 A 66 LYS HG2 H 1 1.46 0.02 A 66 LYS HG3 H 1 1.46 0.02 A 66 LYS C C 13 178.4 0.3 A 66 LYS CA C 13 58.5 0.3 A 66 LYS CB C 13 32.3 0.3 A 66 LYS CD C 13 27.1 0.3 A 66 LYS CE C 13 41.8 0.3 A 66 LYS CG C 13 23.6 0.3 A 66 LYS N N 15 121.3 0.2 A 67 THR H H 1 7.96 0.02 A 67 THR HA H 1 4.13 0.02 A 67 THR HB H 1 3.65 0.02 A 67 THR HG2% H 1 1.13 0.02 A 67 THR C C 13 176.2 0.3 A 67 THR CA C 13 67.8 0.3 A 67 THR CB C 13 67.8 0.3 A 67 THR CG2 C 13 22 0.3 A 67 THR N N 15 114.2 0.2 A 68 LYS H H 1 7.77 0.02 A 68 LYS HA H 1 3.99 0.02 A 68 LYS HB2 H 1 1.91 0.02 A 68 LYS HB3 H 1 1.91 0.02 A 68 LYS HD2 H 1 1.57 0.02 A 68 LYS HD3 H 1 1.57 0.02 A 68 LYS HE2 H 1 2.97 0.02 A 68 LYS HE3 H 1 2.97 0.02 A 68 LYS HG2 H 1 1.46 0.02 A 68 LYS HG3 H 1 1.46 0.02 A 68 LYS C C 13 178.1 0.3 A 68 LYS CA C 13 59.4 0.3 A 68 LYS CB C 13 31.7 0.3 A 68 LYS CD C 13 28.7 0.3 A 68 LYS CE C 13 41.8 0.3 A 68 LYS CG C 13 24.8 0.3 A 68 LYS N N 15 122 0.2 A 69 ALA H H 1 7.48 0.02 A 69 ALA HA H 1 4.24 0.02 A 69 ALA HB% H 1 1.54 0.02 A 69 ALA C C 13 181.2 0.3 A 69 ALA CA C 13 55.2 0.3 A 69 ALA CB C 13 17.9 0.3 A 69 ALA N N 15 120.3 0.2 A 70 VAL H H 1 8.16 0.02 A 70 VAL HA H 1 3.62 0.02 A 70 VAL HB H 1 2.31 0.02 A 70 VAL HGx% H 1 1 0.02 A 70 VAL HGy% H 1 0.92 0.02 A 70 VAL C C 13 177.4 0.3 A 70 VAL CA C 13 66.6 0.3 A 70 VAL CB C 13 31.5 0.3 A 70 VAL CGy C 13 23.8 0.3 A 70 VAL CGx C 13 21.7 0.3 A 70 VAL N N 15 120.3 0.2 A 71 GLU H H 1 8.69 0.02 A 71 GLU HA H 1 3.8 0.02 A 71 GLU HBx H 1 1.92 0.02 A 71 GLU HBy H 1 2.32 0.02 A 71 GLU HGx H 1 2.12 0.02 A 71 GLU HGy H 1 2.71 0.02 A 71 GLU C C 13 178 0.3 A 71 GLU CA C 13 60.4 0.3 A 71 GLU CB C 13 29.2 0.3 A 71 GLU CG C 13 36.1 0.3 A 71 GLU N N 15 119.3 0.2 A 72 ASN H H 1 8.46 0.02 A 72 ASN HA H 1 4.44 0.02 A 72 ASN HBy H 1 2.95 0.02 A 72 ASN HBx H 1 2.85 0.02 A 72 ASN HD2x H 1 6.9 0.02 A 72 ASN HD2y H 1 7.67 0.02 A 72 ASN C C 13 177.6 0.3 A 72 ASN CA C 13 56.2 0.3 A 72 ASN CB C 13 37.6 0.3 A 72 ASN N N 15 115.9 0.2 A 72 ASN ND2 N 15 111.6 0.2 A 73 TYR H H 1 7.94 0.02 A 73 TYR HA H 1 4.2 0.02 A 73 TYR HBx H 1 3.12 0.02 A 73 TYR HBy H 1 3.27 0.02 A 73 TYR HD1 H 1 6.98 0.02 A 73 TYR HD2 H 1 6.98 0.02 A 73 TYR HE1 H 1 6.8 0.02 A 73 TYR HE2 H 1 6.8 0.02 A 73 TYR C C 13 177.6 0.3 A 73 TYR CA C 13 61.5 0.3 A 73 TYR CB C 13 38.4 0.3 A 73 TYR CD1 C 13 133 0.3 A 73 TYR CD2 C 13 133 0.3 A 73 TYR CE1 C 13 118 0.3 A 73 TYR CE2 C 13 118 0.3 A 73 TYR N N 15 122.4 0.2 A 74 LEU H H 1 8.41 0.02 A 74 LEU HA H 1 3.93 0.02 A 74 LEU HBy H 1 2.12 0.02 A 74 LEU HBx H 1 1.21 0.02 A 74 LEU HDx% H 1 0.83 0.02 A 74 LEU HDy% H 1 0.95 0.02 A 74 LEU HG H 1 2.07 0.02 A 74 LEU C C 13 178.5 0.3 A 74 LEU CA C 13 58.1 0.3 A 74 LEU CB C 13 42.6 0.3 A 74 LEU CDy C 13 27.2 0.3 A 74 LEU CDx C 13 23.4 0.3 A 74 LEU CG C 13 27.2 0.3 A 74 LEU N N 15 119.5 0.2 A 75 ILE H H 1 8.4 0.02 A 75 ILE HA H 1 3.57 0.02 A 75 ILE HB H 1 1.94 0.02 A 75 ILE HG1x H 1 1.76 0.02 A 75 ILE HG1y H 1 1.76 0.02 A 75 ILE HG2% H 1 0.89 0.02 A 75 ILE C C 13 178.1 0.3 A 75 ILE CA C 13 65.2 0.3 A 75 ILE CB C 13 37.8 0.3 A 75 ILE CD1 C 13 13 0.3 A 75 ILE CG1 C 13 29.5 0.3 A 75 ILE CG2 C 13 17.1 0.3 A 75 ILE N N 15 118.6 0.2 A 76 GLN H H 1 7.83 0.02 A 76 GLN HA H 1 3.92 0.02 A 76 GLN HB2 H 1 2.11 0.02 A 76 GLN HB3 H 1 2.11 0.02 A 76 GLN HG2 H 1 2.31 0.02 A 76 GLN HG3 H 1 2.31 0.02 A 76 GLN C C 13 178.1 0.3 A 76 GLN CA C 13 59.1 0.3 A 76 GLN CB C 13 28 0.3 A 76 GLN CG C 13 33.7 0.3 A 76 GLN N N 15 119.3 0.2 A 77 MET H H 1 8.06 0.02 A 77 MET HA H 1 4.04 0.02 A 77 MET HBx H 1 2.2 0.02 A 77 MET HBy H 1 2.32 0.02 A 77 MET C C 13 178.7 0.3 A 77 MET CA C 13 58.6 0.3 A 77 MET CB C 13 33 0.3 A 77 MET CG C 13 28.5 0.3 A 77 MET N N 15 117.6 0.2 A 78 ALA H H 1 8.21 0.02 A 78 ALA HA H 1 4.19 0.02 A 78 ALA HB% H 1 1.44 0.02 A 78 ALA C C 13 180.6 0.3 A 78 ALA CA C 13 54.1 0.3 A 78 ALA CB C 13 18.4 0.3 A 78 ALA N N 15 121.4 0.2 A 79 ARG H H 1 8.12 0.02 A 79 ARG HA H 1 3.96 0.02 A 79 ARG HBx H 1 1.6 0.02 A 79 ARG HBy H 1 1.75 0.02 A 79 ARG HD2 H 1 3 0.02 A 79 ARG HD3 H 1 3 0.02 A 79 ARG HG2 H 1 1.35 0.02 A 79 ARG HG3 H 1 1.35 0.02 A 79 ARG C C 13 177.9 0.3 A 79 ARG CA C 13 58.8 0.3 A 79 ARG CB C 13 29.9 0.3 A 79 ARG CD C 13 43.4 0.3 A 79 ARG CG C 13 27.2 0.3 A 79 ARG N N 15 119.1 0.2 A 80 TYR H H 1 7.8 0.02 A 80 TYR HA H 1 4.71 0.02 A 80 TYR HBx H 1 2.86 0.02 A 80 TYR HBy H 1 3.38 0.02 A 80 TYR HD1 H 1 7.18 0.02 A 80 TYR HD2 H 1 7.18 0.02 A 80 TYR HE1 H 1 6.79 0.02 A 80 TYR HE2 H 1 6.79 0.02 A 80 TYR C C 13 176.5 0.3 A 80 TYR CA C 13 57.5 0.3 A 80 TYR CB C 13 38.1 0.3 A 80 TYR CD1 C 13 132.7 0.3 A 80 TYR CD2 C 13 132.7 0.3 A 80 TYR CE1 C 13 118 0.3 A 80 TYR CE2 C 13 118 0.3 A 80 TYR N N 15 115.9 0.2 A 81 GLY H H 1 7.85 0.02 A 81 GLY HA2 H 1 4.03 0.02 A 81 GLY HA3 H 1 4.03 0.02 A 81 GLY C C 13 174.9 0.3 A 81 GLY CA C 13 46.3 0.3 A 81 GLY N N 15 108.5 0.2 A 82 GLN H H 1 8.2 0.02 A 82 GLN HA H 1 4.31 0.02 A 82 GLN HB2 H 1 1.94 0.02 A 82 GLN HB3 H 1 1.94 0.02 A 82 GLN HG2 H 1 2.32 0.02 A 82 GLN HG3 H 1 2.31 0.02 A 82 GLN C C 13 175.5 0.3 A 82 GLN CA C 13 55.7 0.3 A 82 GLN CB C 13 29.4 0.3 A 82 GLN CG C 13 34.1 0.3 A 82 GLN N N 15 116.9 0.2 A 83 LEU H H 1 7.99 0.02 A 83 LEU HA H 1 4.61 0.02 A 83 LEU HB2 H 1 1.56 0.02 A 83 LEU HB3 H 1 1.56 0.02 A 83 LEU HDx% H 1 0.94 0.02 A 83 LEU HDy% H 1 0.9 0.02 A 83 LEU HG H 1 1.5 0.02 A 83 LEU C C 13 176.5 0.3 A 83 LEU CA C 13 54.3 0.3 A 83 LEU CB C 13 42.6 0.3 A 83 LEU CDy C 13 25.4 0.3 A 83 LEU CDx C 13 24.1 0.3 A 83 LEU CG C 13 26.8 0.3 A 83 LEU N N 15 121.4 0.2 A 84 SER H H 1 8.63 0.02 A 84 SER HA H 1 4.41 0.02 A 84 SER HBx H 1 3.84 0.02 A 84 SER HBy H 1 3.92 0.02 A 84 SER C C 13 173.7 0.3 A 84 SER CA C 13 59.4 0.3 A 84 SER CB C 13 63.9 0.3 A 84 SER N N 15 118.4 0.2 A 85 GLU H H 1 7.69 0.02 A 85 GLU HA H 1 4.53 0.02 A 85 GLU HBx H 1 1.94 0.02 A 85 GLU HBy H 1 2.13 0.02 A 85 GLU HG2 H 1 2.31 0.02 A 85 GLU HG3 H 1 2.31 0.02 A 85 GLU C C 13 175.4 0.3 A 85 GLU CA C 13 54.9 0.3 A 85 GLU CB C 13 31.2 0.3 A 85 GLU CG C 13 34.7 0.3 A 85 GLU N N 15 119.4 0.2 A 86 LYS H H 1 8.38 0.02 A 86 LYS HA H 1 4.23 0.02 A 86 LYS HBy H 1 1.72 0.02 A 86 LYS HBx H 1 1.64 0.02 A 86 LYS HE2 H 1 2.96 0.02 A 86 LYS HE3 H 1 2.96 0.02 A 86 LYS HG2 H 1 1.49 0.02 A 86 LYS HG3 H 1 1.49 0.02 A 86 LYS C C 13 176.9 0.3 A 86 LYS CA C 13 57 0.3 A 86 LYS CB C 13 33.3 0.3 A 86 LYS CD C 13 28.9 0.3 A 86 LYS CE C 13 41.9 0.3 A 86 LYS CG C 13 24.6 0.3 A 86 LYS N N 15 120.4 0.2 A 87 VAL H H 1 8.96 0.02 A 87 VAL HA H 1 3.97 0.02 A 87 VAL HB H 1 2.08 0.02 A 87 VAL HGx% H 1 1.01 0.02 A 87 VAL HGy% H 1 0.97 0.02 A 87 VAL C C 13 174.7 0.3 A 87 VAL CA C 13 63.3 0.3 A 87 VAL CB C 13 32.4 0.3 A 87 VAL CGx C 13 21.2 0.3 A 87 VAL N N 15 125.2 0.2 A 88 SER H H 1 8.19 0.02 A 88 SER HA H 1 4.99 0.02 A 88 SER HBy H 1 4.42 0.02 A 88 SER HBx H 1 4.03 0.02 A 88 SER C C 13 175.7 0.3 A 88 SER CA C 13 56.2 0.3 A 88 SER CB C 13 66.6 0.3 A 88 SER N N 15 121.7 0.2 A 89 GLU H H 1 9.23 0.02 A 89 GLU HA H 1 3.72 0.02 A 89 GLU HBy H 1 2.07 0.02 A 89 GLU HBx H 1 1.97 0.02 A 89 GLU HGy H 1 2.26 0.02 A 89 GLU HGx H 1 2.13 0.02 A 89 GLU C C 13 177.7 0.3 A 89 GLU CA C 13 61.2 0.3 A 89 GLU CB C 13 29.1 0.3 A 89 GLU CG C 13 36.3 0.3 A 89 GLU N N 15 121.6 0.2 A 90 GLN H H 1 8.43 0.02 A 90 GLN HA H 1 4.04 0.02 A 90 GLN HB2 H 1 2.03 0.02 A 90 GLN HB3 H 1 2.02 0.02 A 90 GLN HE21 H 1 7.61 0.02 A 90 GLN HE22 H 1 6.85 0.02 A 90 GLN HG2 H 1 2.44 0.02 A 90 GLN HG3 H 1 2.44 0.02 A 90 GLN C C 13 178.9 0.3 A 90 GLN CA C 13 59.1 0.3 A 90 GLN CB C 13 27.8 0.3 A 90 GLN CG C 13 33.6 0.3 A 90 GLN N N 15 117.1 0.2 A 90 GLN NE2 N 15 112.5 0.2 A 91 GLY H H 1 8.08 0.02 A 91 GLY HA2 H 1 3.89 0.02 A 91 GLY HA3 H 1 3.89 0.02 A 91 GLY C C 13 176.6 0.3 A 91 GLY CA C 13 46.9 0.3 A 91 GLY N N 15 109.4 0.2 A 92 LEU H H 1 8.61 0.02 A 92 LEU HA H 1 4 0.02 A 92 LEU HBy H 1 2.12 0.02 A 92 LEU HBx H 1 1.51 0.02 A 92 LEU HDx% H 1 0.96 0.02 A 92 LEU HDy% H 1 0.93 0.02 A 92 LEU HG H 1 1.66 0.02 A 92 LEU C C 13 178 0.3 A 92 LEU CA C 13 57.5 0.3 A 92 LEU CB C 13 41.8 0.3 A 92 LEU CDy C 13 26.7 0.3 A 92 LEU CDx C 13 24.3 0.3 A 92 LEU CG C 13 26.6 0.3 A 92 LEU N N 15 123.7 0.2 A 93 ILE H H 1 7.97 0.02 A 93 ILE HA H 1 3.64 0.02 A 93 ILE HB H 1 2.11 0.02 A 93 ILE HD1% H 1 0.82 0.02 A 93 ILE HG1y H 1 1.68 0.02 A 93 ILE HG1x H 1 1.32 0.02 A 93 ILE HG2% H 1 0.93 0.02 A 93 ILE C C 13 178.5 0.3 A 93 ILE CA C 13 64.8 0.3 A 93 ILE CB C 13 37.1 0.3 A 93 ILE CD1 C 13 11.9 0.3 A 93 ILE CG1 C 13 28.9 0.3 A 93 ILE CG2 C 13 17.2 0.3 A 93 ILE N N 15 119.9 0.2 A 94 GLU H H 1 7.61 0.02 A 94 GLU HA H 1 4.09 0.02 A 94 GLU HB2 H 1 2.19 0.02 A 94 GLU HB3 H 1 2.19 0.02 A 94 GLU HG2 H 1 2.39 0.02 A 94 GLU HG3 H 1 2.39 0.02 A 94 GLU C C 13 179.4 0.3 A 94 GLU CA C 13 59.2 0.3 A 94 GLU CB C 13 28.8 0.3 A 94 GLU CG C 13 35.5 0.3 A 94 GLU N N 15 118.8 0.2 A 95 ILE H H 1 7.84 0.02 A 95 ILE HA H 1 3.52 0.02 A 95 ILE HB H 1 2 0.02 A 95 ILE HD1% H 1 0.9 0.02 A 95 ILE HG1y H 1 1.83 0.02 A 95 ILE HG1x H 1 1.05 0.02 A 95 ILE HG2% H 1 0.73 0.02 A 95 ILE C C 13 177.5 0.3 A 95 ILE CA C 13 65.5 0.3 A 95 ILE CB C 13 37.9 0.3 A 95 ILE CD1 C 13 13.8 0.3 A 95 ILE CG1 C 13 29.3 0.3 A 95 ILE CG2 C 13 18.2 0.3 A 95 ILE N N 15 121.6 0.2 A 96 LEU H H 1 8.62 0.02 A 96 LEU HA H 1 3.8 0.02 A 96 LEU HB2 H 1 1.73 0.02 A 96 LEU HB3 H 1 1.73 0.02 A 96 LEU HDx% H 1 0.81 0.02 A 96 LEU HG H 1 1.65 0.02 A 96 LEU C C 13 179.4 0.3 A 96 LEU CA C 13 58.6 0.3 A 96 LEU CB C 13 41.5 0.3 A 96 LEU CDx C 13 24.8 0.3 A 96 LEU CG C 13 27.3 0.3 A 96 LEU N N 15 120.4 0.2 A 97 LYS H H 1 7.75 0.02 A 97 LYS HA H 1 3.99 0.02 A 97 LYS HB2 H 1 1.92 0.02 A 97 LYS HB3 H 1 1.92 0.02 A 97 LYS HD2 H 1 1.68 0.02 A 97 LYS HD3 H 1 1.68 0.02 A 97 LYS HE2 H 1 2.9 0.02 A 97 LYS HE3 H 1 2.9 0.02 A 97 LYS HG2 H 1 1.38 0.02 A 97 LYS HG3 H 1 1.38 0.02 A 97 LYS C C 13 178.6 0.3 A 97 LYS CA C 13 59.4 0.3 A 97 LYS CB C 13 32.3 0.3 A 97 LYS CE C 13 41.8 0.3 A 97 LYS CG C 13 24.9 0.3 A 97 LYS N N 15 119 0.2 A 98 LYS H H 1 7.71 0.02 A 98 LYS HA H 1 4.11 0.02 A 98 LYS HB2 H 1 1.88 0.02 A 98 LYS HB3 H 1 1.88 0.02 A 98 LYS HDx H 1 1.57 0.02 A 98 LYS HDy H 1 1.68 0.02 A 98 LYS HE2 H 1 2.97 0.02 A 98 LYS HE3 H 1 2.97 0.02 A 98 LYS HGy H 1 1.46 0.02 A 98 LYS HGx H 1 1.42 0.02 A 98 LYS C C 13 179.1 0.3 A 98 LYS CA C 13 59.1 0.3 A 98 LYS CB C 13 32.5 0.3 A 98 LYS CD C 13 28.9 0.3 A 98 LYS CE C 13 41.9 0.3 A 98 LYS CG C 13 24.8 0.3 A 98 LYS N N 15 119.5 0.2 A 99 VAL H H 1 8.21 0.02 A 99 VAL HA H 1 3.92 0.02 A 99 VAL HB H 1 2.09 0.02 A 99 VAL HGx% H 1 0.79 0.02 A 99 VAL C C 13 177.6 0.3 A 99 VAL CA C 13 64.2 0.3 A 99 VAL CB C 13 31.5 0.3 A 99 VAL CGx C 13 21.2 0.3 A 99 VAL N N 15 115.8 0.2 A 100 SER H H 1 7.9 0.02 A 100 SER HA H 1 4.34 0.02 A 100 SER HBy H 1 3.97 0.02 A 100 SER HBx H 1 3.92 0.02 A 100 SER C C 13 174.6 0.3 A 100 SER CA C 13 60.4 0.3 A 100 SER CB C 13 63.6 0.3 A 100 SER N N 15 116.5 0.2 A 101 GLN H H 1 7.86 0.02 A 101 GLN HA H 1 4.28 0.02 A 101 GLN HB2 H 1 2.12 0.02 A 101 GLN HB3 H 1 2.12 0.02 A 101 GLN HG2 H 1 2.4 0.02 A 101 GLN HG3 H 1 2.4 0.02 A 101 GLN C C 13 176.4 0.3 A 101 GLN CA C 13 56.8 0.3 A 101 GLN CB C 13 28.9 0.3 A 101 GLN CG C 13 33.8 0.3 A 101 GLN N N 15 120.1 0.2 A 102 GLN H H 1 8.08 0.02 A 102 GLN HA H 1 4.36 0.02 A 102 GLN HB2 H 1 2.11 0.02 A 102 GLN HB3 H 1 2.11 0.02 A 102 GLN HGy H 1 2.47 0.02 A 102 GLN HGx H 1 2.4 0.02 A 102 GLN C C 13 176.5 0.3 A 102 GLN CA C 13 56.7 0.3 A 102 GLN CB C 13 29 0.3 A 102 GLN CG C 13 33.8 0.3 A 102 GLN N N 15 119.7 0.2 A 103 THR H H 1 8.07 0.02 A 103 THR HA H 1 4.35 0.02 A 103 THR HB H 1 4.27 0.02 A 103 THR HG2% H 1 1.22 0.02 A 103 THR C C 13 174.7 0.3 A 103 THR CA C 13 62.5 0.3 A 103 THR CB C 13 69.8 0.3 A 103 THR CG2 C 13 21.7 0.3 A 103 THR N N 15 113.9 0.2 A 104 GLU H H 1 8.29 0.02 A 104 GLU HA H 1 4.35 0.02 A 104 GLU HBx H 1 2 0.02 A 104 GLU HBy H 1 2.09 0.02 A 104 GLU HG2 H 1 2.34 0.02 A 104 GLU HG3 H 1 2.34 0.02 A 104 GLU C C 13 176.3 0.3 A 104 GLU CA C 13 56.7 0.3 A 104 GLU CB C 13 29.9 0.3 A 104 GLU CG C 13 35.4 0.3 A 104 GLU N N 15 122.9 0.2 A 105 LYS H H 1 8.32 0.02 A 105 LYS HA H 1 4.39 0.02 A 105 LYS HB2 H 1 1.81 0.02 A 105 LYS HB3 H 1 1.81 0.02 A 105 LYS HD2 H 1 1.68 0.02 A 105 LYS HD3 H 1 1.68 0.02 A 105 LYS HE2 H 1 2.99 0.02 A 105 LYS HE3 H 1 2.99 0.02 A 105 LYS HGy H 1 1.48 0.02 A 105 LYS HGx H 1 1.42 0.02 A 105 LYS C C 13 176.8 0.3 A 105 LYS CA C 13 56.7 0.3 A 105 LYS CB C 13 32.8 0.3 A 105 LYS CD C 13 28.8 0.3 A 105 LYS CE C 13 41.9 0.3 A 105 LYS CG C 13 24.7 0.3 A 105 LYS N N 15 121.9 0.2 A 106 THR H H 1 8.15 0.02 A 106 THR HA H 1 4.43 0.02 A 106 THR HB H 1 4.25 0.02 A 106 THR HG2% H 1 1.21 0.02 A 106 THR C C 13 174.6 0.3 A 106 THR CA C 13 62 0.3 A 106 THR CB C 13 70 0.3 A 106 THR CG2 C 13 21.4 0.3 A 106 THR N N 15 115 0.2 A 107 THR H H 1 8.19 0.02 A 107 THR HA H 1 4.44 0.02 A 107 THR HB H 1 4.25 0.02 A 107 THR HG2% H 1 1.21 0.02 A 107 THR C C 13 174.5 0.3 A 107 THR CA C 13 62 0.3 A 107 THR CB C 13 69.8 0.3 A 107 THR CG2 C 13 21.4 0.3 A 107 THR N N 15 116.5 0.2 A 108 THR H H 1 8.17 0.02 A 108 THR HA H 1 4.35 0.02 A 108 THR HB H 1 4.17 0.02 A 108 THR HG2% H 1 1.17 0.02 A 108 THR C C 13 174.2 0.3 A 108 THR CA C 13 62 0.3 A 108 THR CB C 13 69.8 0.3 A 108 THR CG2 C 13 21.5 0.3 A 108 THR N N 15 117.2 0.2 A 109 VAL H H 1 8.1 0.02 A 109 VAL HA H 1 4.04 0.02 A 109 VAL HB H 1 1.95 0.02 A 109 VAL HGx% H 1 0.76 0.02 A 109 VAL HGy% H 1 0.86 0.02 A 109 VAL C C 13 175.2 0.3 A 109 VAL CA C 13 62.3 0.3 A 109 VAL CB C 13 32.6 0.3 A 109 VAL CGx C 13 20.8 0.3 A 109 VAL N N 15 123.1 0.2 A 110 LYS H H 1 8.2 0.02 A 110 LYS HA H 1 4.31 0.02 A 110 LYS HBx H 1 1.64 0.02 A 110 LYS HBy H 1 1.73 0.02 A 110 LYS HD2 H 1 1.63 0.02 A 110 LYS HD3 H 1 1.63 0.02 A 110 LYS HE2 H 1 2.96 0.02 A 110 LYS HE3 H 1 2.96 0.02 A 110 LYS HGy H 1 1.35 0.02 A 110 LYS HGx H 1 1.3 0.02 A 110 LYS C C 13 175.7 0.3 A 110 LYS CA C 13 55.7 0.3 A 110 LYS CB C 13 33.3 0.3 A 110 LYS CD C 13 28.8 0.3 A 110 LYS CE C 13 41.8 0.3 A 110 LYS CG C 13 24.6 0.3 A 110 LYS N N 15 125.2 0.2 A 111 PHE H H 1 8.31 0.02 A 111 PHE HA H 1 4.65 0.02 A 111 PHE HBx H 1 2.94 0.02 A 111 PHE HBy H 1 3.18 0.02 A 111 PHE C C 13 174.5 0.3 A 111 PHE CA C 13 57.5 0.3 A 111 PHE CB C 13 39.7 0.3 A 111 PHE N N 15 122.1 0.2 A 112 ASN H H 1 7.96 0.02 A 112 ASN HA H 1 4.43 0.02 A 112 ASN HBy H 1 2.74 0.02 A 112 ASN HBx H 1 2.68 0.02 A 112 ASN HD2x H 1 6.75 0.02 A 112 ASN HD2y H 1 7.47 0.02 A 112 ASN C C 13 179.1 0.3 A 112 ASN CA C 13 54.7 0.3 A 112 ASN CB C 13 40.2 0.3 A 112 ASN N N 15 124.8 0.2 A 112 ASN ND2 N 15 112.4 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 74 LEU HDy% A 73 TYR HD% 1.0 1.8 5.5 2 2 A 93 ILE HD1% A 55 ARG HDx 1.0 1.8 5.5 3 3 A 93 ILE HD1% A 55 ARG HDy 1.0 1.8 5.5 4 4 A 93 ILE HD1% A 90 GLN HG2 1.0 1.8 5.5 5 4 A 93 ILE HD1% A 90 GLN HG3 1.0 1.8 5.5 6 5 A 48 LEU HBy A 47 VAL HG1% 1.0 1.8 5.5 7 5 A 48 LEU HBy A 47 VAL HG2% 1.0 1.8 5.5 8 6 A 46 GLN HGx A 47 VAL HG1% 1.0 1.8 5.5 9 6 A 47 VAL HG2% A 46 GLN HGx 1.0 1.8 5.5 10 7 A 80 TYR HE% A 76 GLN HG2 1.0 1.8 5.5 11 7 A 76 GLN HG3 A 80 TYR HE% 1.0 1.8 5.5 12 8 A 100 SER HA A 66 LYS HD2 1.0 1.8 5.5 13 8 A 100 SER HA A 66 LYS HD3 1.0 1.8 5.5 14 9 A 41 ASN HA A 45 ALA HB% 1.0 1.8 5.5 15 10 A 75 ILE HA A 47 VAL HG1% 1.0 1.8 5.5 16 10 A 47 VAL HG2% A 75 ILE HA 1.0 1.8 5.5 17 11 A 95 ILE HG2% A 73 TYR HBy 1.0 1.8 5.5 18 12 A 43 ILE HG2% A 46 GLN HB2 1.0 1.8 5.5 19 12 A 43 ILE HG2% A 46 GLN HB3 1.0 1.8 5.5 20 13 A 93 ILE HG2% A 94 GLU HG2 1.0 1.8 5.5 21 13 A 93 ILE HG2% A 94 GLU HG3 1.0 1.8 5.5 22 14 A 80 TYR HBx A 80 TYR HD% 1.0 1.8 5.5 23 15 A 80 TYR HD% A 80 TYR HBy 1.0 1.8 5.5 24 16 A 73 TYR HD% A 95 ILE HD1% 1.0 1.8 5.5 25 17 A 73 TYR HD% A 73 TYR HBy 1.0 1.8 5.5 26 18 A 73 TYR HD% A 99 VAL HGx% 1.0 1.8 5.5 27 19 A 73 TYR HD% A 95 ILE HG2% 1.0 1.8 5.5 28 20 A 95 ILE HD1% A 73 TYR HE% 1.0 1.8 5.5 29 21 A 95 ILE HG2% A 73 TYR HE% 1.0 1.8 5.5 30 22 A 63 LYS HA A 63 LYS HG2 1.0 1.8 5.5 31 22 A 63 LYS HG3 A 63 LYS HA 1.0 1.8 5.5 32 23 A 52 ALA HB% A 88 SER HA 1.0 1.8 5.5 33 24 A 48 LEU HA A 47 VAL HG1% 1.0 1.8 5.5 34 24 A 47 VAL HG2% A 48 LEU HA 1.0 1.8 5.5 35 25 A 52 ALA HB% A 48 LEU HA 1.0 1.8 5.5 36 26 A 83 LEU HDx% A 83 LEU HA 1.0 1.8 5.5 37 27 A 61 LEU HDx% A 58 ASN HA 1.0 1.8 5.5 38 28 A 26 ASP HA A 25 GLY HA2 1.0 1.8 5.5 39 28 A 26 ASP HA A 25 GLY HA3 1.0 1.8 5.5 40 29 A 41 ASN HA A 44 LEU HDx% 1.0 1.8 5.5 41 30 A 75 ILE HG2% A 72 ASN HA 1.0 1.8 5.5 42 31 A 24 PRO HA A 24 PRO HG2 1.0 1.8 5.5 43 31 A 24 PRO HG3 A 24 PRO HA 1.0 1.8 5.5 44 32 A 83 LEU HDy% A 47 VAL HA 1.0 1.8 5.5 45 33 A 105 LYS HA A 105 LYS HB2 1.0 1.8 5.5 46 33 A 105 LYS HB3 A 105 LYS HA 1.0 1.8 5.5 47 34 A 47 VAL HA A 47 VAL HG1% 1.0 1.8 5.5 48 34 A 47 VAL HG2% A 47 VAL HA 1.0 1.8 5.5 49 35 A 47 VAL HA A 47 VAL HG1% 1.0 1.8 5.5 50 35 A 47 VAL HG2% A 47 VAL HA 1.0 1.8 5.5 51 36 A 108 THR HG2% A 108 THR HA 1.0 1.8 5.5 52 37 A 62 VAL HGy% A 62 VAL HA 1.0 1.8 5.5 53 38 A 99 VAL HGx% A 103 THR HA 1.0 1.8 5.5 54 39 A 99 VAL HGx% A 69 ALA HA 1.0 1.8 5.5 55 40 A 62 VAL HGx% A 61 LEU HA 1.0 1.8 5.5 56 41 A 78 ALA HA A 47 VAL HG1% 1.0 1.8 5.5 57 41 A 47 VAL HG2% A 78 ALA HA 1.0 1.8 5.5 58 42 A 65 GLU HA A 68 LYS HE2 1.0 1.8 5.5 59 42 A 68 LYS HE3 A 65 GLU HA 1.0 1.8 5.5 60 43 A 67 THR HB A 67 THR HA 1.0 1.8 5.5 61 44 A 96 LEU HDx% A 56 LEU HA 1.0 1.8 5.5 62 45 A 93 ILE HD1% A 90 GLN HA 1.0 1.8 5.5 63 46 A 81 GLY HA3 A 82 GLN HG2 1.0 1.8 5.5 64 46 A 81 GLY HA2 A 82 GLN HG2 1.0 1.8 5.5 65 46 A 82 GLN HG3 A 81 GLY HA2 1.0 1.8 5.5 66 46 A 82 GLN HG3 A 81 GLY HA3 1.0 1.8 5.5 67 47 A 56 LEU HA A 56 LEU HDy% 1.0 1.8 5.5 68 48 A 109 VAL HGy% A 109 VAL HA 1.0 1.8 5.5 69 49 A 97 LYS HA A 97 LYS HG2 1.0 1.8 5.5 70 49 A 97 LYS HG3 A 97 LYS HA 1.0 1.8 5.5 71 50 A 68 LYS HA A 68 LYS HE2 1.0 1.8 5.5 72 50 A 68 LYS HE3 A 68 LYS HA 1.0 1.8 5.5 73 51 A 92 LEU HDx% A 92 LEU HA 1.0 1.8 5.5 74 52 A 68 LYS HA A 68 LYS HG2 1.0 1.8 4.5 75 52 A 68 LYS HA A 68 LYS HG3 1.0 1.8 4.5 76 53 A 79 ARG HA A 79 ARG HD2 1.0 1.8 5.5 77 53 A 79 ARG HD3 A 79 ARG HA 1.0 1.8 5.5 78 54 A 83 LEU HDx% A 84 SER HBx 1.0 1.8 5.5 79 55 A 44 LEU HA A 48 LEU HDx% 1.0 1.8 5.5 80 56 A 44 LEU HA A 47 VAL HG1% 1.0 1.8 5.5 81 56 A 47 VAL HG2% A 44 LEU HA 1.0 1.8 5.5 82 57 A 44 LEU HDx% A 44 LEU HA 1.0 1.8 5.5 83 58 A 75 ILE HG2% A 76 GLN HA 1.0 1.8 5.5 84 59 A 74 LEU HDx% A 74 LEU HA 1.0 1.8 5.5 85 60 A 43 ILE HA A 46 GLN HB2 1.0 1.8 5.5 86 60 A 46 GLN HB3 A 43 ILE HA 1.0 1.8 5.5 87 61 A 70 VAL HGx% A 96 LEU HA 1.0 1.8 5.5 88 62 A 44 LEU HDy% A 71 GLU HA 1.0 1.8 5.5 89 63 A 71 GLU HA A 70 VAL HGy% 1.0 1.8 5.5 90 64 A 52 ALA HB% A 89 GLU HA 1.0 1.8 5.5 91 65 A 93 ILE HD1% A 93 ILE HA 1.0 1.8 5.5 92 66 A 93 ILE HA A 96 LEU HB2 1.0 1.8 5.5 93 66 A 93 ILE HA A 96 LEU HB3 1.0 1.8 5.5 94 67 A 93 ILE HA A 92 LEU HDy% 1.0 1.8 5.5 95 68 A 75 ILE HA A 78 ALA HB% 1.0 1.8 5.5 96 69 A 75 ILE HA A 43 ILE HG2% 1.0 1.8 5.5 97 70 A 95 ILE HD1% A 95 ILE HA 1.0 1.8 5.5 98 71 A 95 ILE HG2% A 95 ILE HA 1.0 1.8 5.5 99 72 A 80 TYR HBx A 82 GLN HG2 1.0 1.8 5.5 100 72 A 80 TYR HBx A 82 GLN HG3 1.0 1.8 5.5 101 73 A 99 VAL HGx% A 73 TYR HBx 1.0 1.8 5.5 102 74 A 10 ARG HD2 A 10 ARG HG2 1.0 1.8 5.5 103 74 A 10 ARG HG3 A 10 ARG HD2 1.0 1.8 5.5 104 74 A 10 ARG HG3 A 10 ARG HD3 1.0 1.8 5.5 105 74 A 10 ARG HD3 A 10 ARG HG2 1.0 1.8 5.5 106 75 A 45 ALA HB% A 53 ARG HDx 1.0 1.8 5.5 107 76 A 73 TYR HBy A 99 VAL HGx% 1.0 1.8 5.5 108 77 A 79 ARG HD2 A 79 ARG HG2 1.0 1.8 5.5 109 77 A 79 ARG HD3 A 79 ARG HG2 1.0 1.8 5.5 110 77 A 79 ARG HG3 A 79 ARG HD2 1.0 1.8 5.5 111 77 A 79 ARG HD3 A 79 ARG HG3 1.0 1.8 5.5 112 78 A 79 ARG HA A 79 ARG HD2 1.0 1.8 5.5 113 78 A 79 ARG HD3 A 79 ARG HA 1.0 1.8 5.5 114 79 A 96 LEU HDx% A 63 LYS HE2 1.0 1.8 5.5 115 79 A 96 LEU HDx% A 63 LYS HE3 1.0 1.8 5.5 116 80 A 33 LYS HA A 33 LYS HE2 1.0 1.8 5.5 117 80 A 33 LYS HA A 33 LYS HE3 1.0 1.8 5.5 118 81 A 99 VAL HGx% A 98 LYS HE2 1.0 1.8 5.5 119 81 A 99 VAL HGx% A 98 LYS HE3 1.0 1.8 5.5 120 82 A 33 LYS HB3 A 33 LYS HE2 1.0 1.8 5.5 121 82 A 33 LYS HB2 A 33 LYS HE2 1.0 1.8 5.5 122 82 A 33 LYS HE3 A 33 LYS HB2 1.0 1.8 5.5 123 82 A 33 LYS HE3 A 33 LYS HB3 1.0 1.8 5.5 124 83 A 69 ALA HB% A 72 ASN HBx 1.0 1.8 5.5 125 84 A 93 ILE HG2% A 97 LYS HE2 1.0 1.8 5.5 126 84 A 93 ILE HG2% A 97 LYS HE3 1.0 1.8 5.5 127 85 A 45 ALA HB% A 41 ASN HBy 1.0 1.8 5.5 128 86 A 67 THR HG2% A 71 GLU HGx 1.0 1.8 5.5 129 87 A 60 ALA HB% A 64 PRO HBx 1.0 1.8 5.5 130 88 A 50 GLN HA A 50 GLN HG2 1.0 1.8 5.5 131 88 A 50 GLN HA A 50 GLN HG3 1.0 1.8 5.5 132 89 A 27 ALA HA A 30 GLN HG2 1.0 1.8 5.5 133 89 A 27 ALA HA A 30 GLN HG3 1.0 1.8 5.5 134 90 A 11 ARG HDy A 7 GLU HG2 1.0 1.8 5.5 135 90 A 11 ARG HDy A 7 GLU HG3 1.0 1.8 5.5 136 91 A 45 ALA HB% A 46 GLN HGy 1.0 1.8 5.5 137 92 A 16 GLU HGy A 13 ARG HD2 1.0 1.8 6.0 138 92 A 13 ARG HD3 A 16 GLU HGy 1.0 1.8 6.0 139 93 A 65 GLU HGy A 68 LYS HE2 1.0 1.8 5.5 140 93 A 68 LYS HE3 A 65 GLU HGy 1.0 1.8 5.5 141 94 A 83 LEU HDx% A 47 VAL HB 1.0 1.8 5.5 142 95 A 96 LEU HDx% A 70 VAL HB 1.0 1.8 5.5 143 96 A 83 LEU HDy% A 47 VAL HB 1.0 1.8 5.5 144 97 A 74 LEU HDy% A 70 VAL HB 1.0 1.8 5.5 145 98 A 44 LEU HDy% A 71 GLU HBx 1.0 1.8 5.5 146 99 A 67 THR HG2% A 71 GLU HBx 1.0 1.8 5.5 147 100 A 47 VAL HB A 47 VAL HG1% 1.0 1.8 5.5 148 100 A 47 VAL HG2% A 47 VAL HB 1.0 1.8 5.5 149 101 A 47 VAL HB A 47 VAL HG1% 1.0 1.8 5.5 150 101 A 47 VAL HG2% A 47 VAL HB 1.0 1.8 5.5 151 102 A 93 ILE HD1% A 89 GLU HGx 1.0 1.8 5.5 152 103 A 26 ASP HA A 29 GLN HB2 1.0 1.8 5.5 153 103 A 26 ASP HA A 29 GLN HB3 1.0 1.8 5.5 154 104 A 74 LEU HBx A 47 VAL HG1% 1.0 1.8 5.5 155 104 A 47 VAL HG2% A 74 LEU HBx 1.0 1.8 5.5 156 105 A 64 PRO HDx A 64 PRO HG2 1.0 1.8 5.5 157 105 A 64 PRO HDx A 64 PRO HG3 1.0 1.8 5.5 158 106 A 31 GLU HB2 A 35 ARG HD2 1.0 1.8 5.5 159 106 A 35 ARG HD3 A 31 GLU HB2 1.0 1.8 5.5 160 106 A 35 ARG HD3 A 31 GLU HB3 1.0 1.8 5.5 161 106 A 31 GLU HB3 A 35 ARG HD2 1.0 1.8 5.5 162 107 A 66 LYS HE2 A 65 GLU HB2 1.0 1.8 5.5 163 107 A 66 LYS HE2 A 65 GLU HB3 1.0 1.8 5.5 164 108 A 92 LEU HDx% A 92 LEU HBx 1.0 1.8 5.5 165 109 A 56 LEU HDy% A 71 GLU HGy 1.0 1.8 5.5 166 110 A 83 LEU HDx% A 87 VAL HB 1.0 1.8 5.5 167 111 A 44 LEU HDx% A 71 GLU HGy 1.0 1.8 5.5 168 112 A 1 SER HA A 4 GLU HB2 1.0 1.8 5.5 169 112 A 1 SER HA A 4 GLU HB3 1.0 1.8 5.5 170 113 A 96 LEU HDx% A 99 VAL HB 1.0 1.8 5.5 171 114 A 83 LEU HDy% A 74 LEU HBx 1.0 1.8 5.5 172 115 A 70 VAL HGx% A 99 VAL HB 1.0 1.8 5.5 173 116 A 67 THR HG2% A 71 GLU HGy 1.0 1.8 5.5 174 117 A 103 THR HG2% A 104 GLU HBx 1.0 1.8 5.5 175 118 A 2 ALA HA A 5 GLU HB2 1.0 1.8 5.5 176 118 A 2 ALA HA A 5 GLU HB3 1.0 1.8 5.5 177 119 A 74 LEU HG A 47 VAL HG1% 1.0 1.8 5.5 178 119 A 47 VAL HG2% A 74 LEU HG 1.0 1.8 5.5 179 120 A 83 LEU HDy% A 82 GLN HB2 1.0 1.8 5.5 180 120 A 83 LEU HDy% A 82 GLN HB3 1.0 1.8 5.5 181 121 A 103 THR HG2% A 104 GLU HBy 1.0 1.8 5.5 182 122 A 52 ALA HB% A 53 ARG HBx 1.0 1.8 5.5 183 123 A 92 LEU HDx% A 95 ILE HB 1.0 1.8 5.5 184 124 A 109 VAL HGx% A 109 VAL HB 1.0 1.8 5.5 185 125 A 109 VAL HGy% A 109 VAL HB 1.0 1.8 5.5 186 126 A 68 LYS HB3 A 68 LYS HE2 1.0 1.8 5.5 187 126 A 68 LYS HB2 A 68 LYS HE2 1.0 1.8 5.5 188 126 A 68 LYS HE3 A 68 LYS HB2 1.0 1.8 5.5 189 126 A 68 LYS HE3 A 68 LYS HB3 1.0 1.8 5.5 190 127 A 97 LYS HB2 A 97 LYS HE2 1.0 1.8 5.5 191 127 A 97 LYS HB3 A 97 LYS HE2 1.0 1.8 5.5 192 127 A 97 LYS HE3 A 97 LYS HB2 1.0 1.8 5.5 193 127 A 97 LYS HE3 A 97 LYS HB3 1.0 1.8 5.5 194 128 A 97 LYS HB3 A 97 LYS HG2 1.0 1.8 5.5 195 128 A 97 LYS HB2 A 97 LYS HG2 1.0 1.8 5.5 196 128 A 97 LYS HG3 A 97 LYS HB2 1.0 1.8 5.5 197 128 A 97 LYS HG3 A 97 LYS HB3 1.0 1.8 5.5 198 129 A 62 VAL HGx% A 61 LEU HBx 1.0 1.8 5.5 199 130 A 62 VAL HGy% A 61 LEU HBx 1.0 1.8 5.5 200 131 A 48 LEU HG A 47 VAL HG1% 1.0 1.8 5.5 201 131 A 47 VAL HG2% A 48 LEU HG 1.0 1.8 5.5 202 132 A 99 VAL HGx% A 98 LYS HB2 1.0 1.8 5.5 203 132 A 99 VAL HGx% A 98 LYS HB3 1.0 1.8 5.5 204 133 A 48 LEU HG A 47 VAL HG1% 1.0 1.8 5.5 205 133 A 47 VAL HG2% A 48 LEU HG 1.0 1.8 5.5 206 134 A 52 ALA HB% A 48 LEU HG 1.0 1.8 5.5 207 135 A 78 ALA HB% A 43 ILE HB 1.0 1.8 5.5 208 136 A 75 ILE HG2% A 75 ILE HG1x 1.0 1.8 5.5 209 136 A 75 ILE HG2% A 75 ILE HG1y 1.0 1.8 5.5 210 137 A 43 ILE HG2% A 43 ILE HG1x 1.0 1.8 5.5 211 138 A 70 VAL HGx% A 92 LEU HG 1.0 1.8 5.5 212 139 A 110 LYS HA A 110 LYS HBx 1.0 1.8 5.5 213 139 A 110 LYS HA A 110 LYS HBy 1.0 1.8 5.5 214 140 A 70 VAL HGy% A 59 LEU HBy 1.0 1.8 5.5 215 141 A 62 VAL HGy% A 63 LYS HD2 1.0 1.8 5.5 216 141 A 62 VAL HGy% A 63 LYS HD3 1.0 1.8 5.5 217 142 A 56 LEU HBy A 48 LEU HDy% 1.0 1.8 5.5 218 142 A 48 LEU HDx% A 56 LEU HBy 1.0 1.8 5.5 219 143 A 110 LYS HGy A 110 LYS HBx 1.0 1.8 5.5 220 143 A 110 LYS HBy A 110 LYS HGy 1.0 1.8 5.5 221 144 A 62 VAL HGx% A 61 LEU HBy 1.0 1.8 5.5 222 145 A 56 LEU HDy% A 56 LEU HBy 1.0 1.8 5.5 223 146 A 83 LEU HDx% A 83 LEU HB2 1.0 1.8 5.5 224 146 A 83 LEU HDx% A 83 LEU HB3 1.0 1.8 5.5 225 147 A 70 VAL HGx% A 69 ALA HB% 1.0 1.8 5.5 226 148 A 99 VAL HGx% A 69 ALA HB% 1.0 1.8 5.5 227 149 A 12 GLN HGx A 15 ALA HB% 1.0 1.8 5.5 228 150 A 60 ALA HB% A 64 PRO HA 1.0 1.8 5.5 229 151 A 57 SER HBx A 54 ALA HB% 1.0 1.8 5.5 230 152 A 60 ALA HB% A 57 SER HA 1.0 1.8 5.5 231 153 A 48 LEU HBy A 48 LEU HDy% 1.0 1.8 5.5 232 154 A 67 THR HG2% A 60 ALA HB% 1.0 1.8 5.5 233 155 A 27 ALA HB% A 25 GLY HA2 1.0 1.8 5.5 234 155 A 25 GLY HA3 A 27 ALA HB% 1.0 1.8 5.5 235 156 A 45 ALA HB% A 46 GLN HGy 1.0 1.8 5.5 236 157 A 40 ARG HB2 A 40 ARG HG2 1.0 1.8 5.5 237 157 A 40 ARG HB3 A 40 ARG HG2 1.0 1.8 5.5 238 157 A 40 ARG HG3 A 40 ARG HB2 1.0 1.8 5.5 239 157 A 40 ARG HB3 A 40 ARG HG3 1.0 1.8 5.5 240 158 A 48 LEU HBy A 56 LEU HDy% 1.0 1.8 5.5 241 159 A 75 ILE HA A 78 ALA HB% 1.0 1.8 5.5 242 160 A 61 LEU HDx% A 60 ALA HB% 1.0 1.8 5.5 243 161 A 62 VAL HGx% A 63 LYS HG2 1.0 1.8 5.5 244 161 A 63 LYS HG3 A 62 VAL HGx% 1.0 1.8 5.5 245 162 A 48 LEU HBy A 47 VAL HG1% 1.0 1.8 5.5 246 162 A 48 LEU HBy A 47 VAL HG2% 1.0 1.8 5.5 247 163 A 62 VAL HGy% A 63 LYS HG2 1.0 1.8 5.5 248 163 A 63 LYS HG3 A 62 VAL HGy% 1.0 1.8 5.5 249 164 A 43 ILE HG2% A 78 ALA HB% 1.0 1.8 5.5 250 165 A 75 ILE HG2% A 40 ARG HG2 1.0 1.8 5.5 251 165 A 75 ILE HG2% A 40 ARG HG3 1.0 1.8 5.5 252 166 A 52 ALA HB% A 89 GLU HA 1.0 1.8 5.5 253 167 A 52 ALA HB% A 48 LEU HDy% 1.0 1.8 5.5 254 168 A 52 ALA HB% A 92 LEU HDx% 1.0 1.8 5.5 255 169 A 52 ALA HB% A 48 LEU HDx% 1.0 1.8 5.5 256 170 A 52 ALA HB% A 88 SER HA 1.0 1.8 5.5 257 171 A 97 LYS HE2 A 97 LYS HG2 1.0 1.8 5.5 258 171 A 97 LYS HE3 A 97 LYS HG2 1.0 1.8 5.5 259 171 A 97 LYS HG3 A 97 LYS HE2 1.0 1.8 5.5 260 171 A 97 LYS HG3 A 97 LYS HE3 1.0 1.8 5.5 261 172 A 79 ARG HD2 A 79 ARG HG2 1.0 1.8 5.5 262 172 A 79 ARG HD3 A 79 ARG HG2 1.0 1.8 5.5 263 172 A 79 ARG HG3 A 79 ARG HD2 1.0 1.8 5.5 264 172 A 79 ARG HD3 A 79 ARG HG3 1.0 1.8 5.5 265 173 A 93 ILE HG2% A 93 ILE HG1y 1.0 1.8 5.5 266 174 A 44 LEU HDx% A 44 LEU HBy 1.0 1.8 5.5 267 175 A 44 LEU HDy% A 44 LEU HBy 1.0 1.8 5.5 268 176 A 44 LEU HBy A 47 VAL HG1% 1.0 1.8 5.5 269 176 A 47 VAL HG2% A 44 LEU HBy 1.0 1.8 5.5 270 177 A 74 LEU HDx% A 74 LEU HBy 1.0 1.8 5.5 271 178 A 74 LEU HDy% A 74 LEU HBy 1.0 1.8 5.5 272 179 A 74 LEU HBy A 47 VAL HG1% 1.0 1.8 5.5 273 179 A 47 VAL HG2% A 74 LEU HBy 1.0 1.8 5.5 274 180 A 108 THR HG2% A 108 THR HB 1.0 1.8 5.5 275 181 A 67 THR HB A 67 THR HG2% 1.0 1.8 5.5 276 182 A 67 THR HG2% A 60 ALA HA 1.0 1.8 5.5 277 183 A 67 THR HG2% A 60 ALA HB% 1.0 1.8 5.5 278 184 A 75 ILE HG2% A 43 ILE HG1y 1.0 1.8 5.5 279 185 A 62 VAL HGy% A 63 LYS HG2 1.0 1.8 5.5 280 185 A 63 LYS HG3 A 62 VAL HGy% 1.0 1.8 5.5 281 186 A 62 VAL HGy% A 63 LYS HE2 1.0 1.8 5.5 282 186 A 62 VAL HGy% A 63 LYS HE3 1.0 1.8 5.5 283 187 A 70 VAL HGx% A 70 VAL HA 1.0 1.8 5.5 284 188 A 70 VAL HGx% A 96 LEU HA 1.0 1.8 5.5 285 189 A 61 LEU HDx% A 58 ASN HA 1.0 1.8 5.5 286 190 A 99 VAL HGx% A 70 VAL HGx% 1.0 1.8 5.5 287 191 A 70 VAL HGx% A 69 ALA HB% 1.0 1.8 5.5 288 192 A 87 VAL HGx% A 91 GLY HA2 1.0 1.8 5.5 289 192 A 91 GLY HA3 A 87 VAL HGx% 1.0 1.8 5.5 290 193 A 46 GLN HB2 A 47 VAL HG1% 1.0 1.8 5.5 291 193 A 46 GLN HB3 A 47 VAL HG1% 1.0 1.8 5.5 292 193 A 47 VAL HG2% A 46 GLN HB2 1.0 1.8 5.5 293 193 A 47 VAL HG2% A 46 GLN HB3 1.0 1.8 5.5 294 194 A 3 ASP HA A 6 LEU HDx% 1.0 1.8 5.5 295 195 A 67 THR HG2% A 56 LEU HDx% 1.0 1.8 5.5 296 196 A 92 LEU HDy% A 52 ALA HA 1.0 1.8 5.5 297 197 A 48 LEU HA A 87 VAL HGy% 1.0 1.8 5.5 298 198 A 52 ALA HB% A 92 LEU HDy% 1.0 1.8 5.5 299 199 A 19 ALA HB% A 17 LEU HDx% 1.0 1.8 5.5 300 200 A 93 ILE HG2% A 97 LYS HE2 1.0 1.8 5.5 301 200 A 93 ILE HG2% A 97 LYS HE3 1.0 1.8 5.5 302 201 A 92 LEU HDy% A 55 ARG HB2 1.0 1.8 5.5 303 201 A 92 LEU HDy% A 55 ARG HB3 1.0 1.8 5.5 304 202 A 9 LEU HDx% A 5 GLU HB2 1.0 1.8 5.5 305 202 A 5 GLU HB3 A 9 LEU HDx% 1.0 1.8 5.5 306 203 A 93 ILE HG2% A 93 ILE HG1y 1.0 1.8 5.5 307 204 A 95 ILE HD1% A 95 ILE HA 1.0 1.8 5.5 308 205 A 93 ILE HG2% A 94 GLU HB2 1.0 1.8 5.5 309 205 A 93 ILE HG2% A 94 GLU HB3 1.0 1.8 5.5 310 206 A 75 ILE HG2% A 79 ARG HD2 1.0 1.8 5.5 311 206 A 75 ILE HG2% A 79 ARG HD3 1.0 1.8 5.5 312 207 A 44 LEU HDx% A 71 GLU HBx 1.0 1.8 5.5 313 208 A 109 VAL HGy% A 109 VAL HA 1.0 1.8 5.5 314 209 A 48 LEU HDx% A 48 LEU HBx 1.0 1.8 5.5 315 210 A 48 LEU HBy A 48 LEU HDy% 1.0 1.8 5.5 316 211 A 74 LEU HDx% A 74 LEU HBy 1.0 1.8 5.5 317 212 A 96 LEU HDx% A 66 LYS HE2 1.0 1.8 5.5 318 213 A 96 LEU HDx% A 66 LYS HE3 1.0 1.8 5.5 319 214 A 44 LEU HDx% A 71 GLU HGy 1.0 1.8 5.5 320 215 A 74 LEU HDx% A 47 VAL HB 1.0 1.8 5.5 321 216 A 43 ILE HG2% A 46 GLN HB2 1.0 1.8 5.5 322 216 A 43 ILE HG2% A 46 GLN HB3 1.0 1.8 5.5 323 217 A 74 LEU HDx% A 74 LEU HG 1.0 1.8 5.5 324 218 A 74 LEU HDx% A 47 VAL HG1% 1.0 1.8 5.5 325 218 A 47 VAL HG2% A 74 LEU HDx% 1.0 1.8 5.5 326 219 A 52 ALA HB% A 48 LEU HDx% 1.0 1.8 5.5 327 220 A 99 VAL HGx% A 98 LYS HE2 1.0 1.8 5.5 328 220 A 99 VAL HGx% A 98 LYS HE3 1.0 1.8 5.5 329 221 A 73 TYR HBy A 99 VAL HGx% 1.0 1.8 5.5 330 222 A 100 SER HA A 99 VAL HGx% 1.0 1.8 5.5 331 223 A 99 VAL HGx% A 98 LYS HGx 1.0 1.8 5.5 332 224 A 74 LEU HDy% A 44 LEU HDy% 1.0 1.8 5.5 333 225 A 99 VAL HGx% A 69 ALA HB% 1.0 1.8 5.5 334 226 A 109 VAL HGx% A 109 VAL HB 1.0 1.8 5.5 335 227 A 109 VAL HA A 109 VAL HGx% 1.0 1.8 5.5 336 228 A 95 ILE HG2% A 95 ILE HD1% 1.0 1.8 5.5 337 229 A 95 ILE HG2% A 95 ILE HG1x 1.0 1.8 5.5 338 230 A 95 ILE HG2% A 95 ILE HG1y 1.0 1.8 5.5 339 231 A 95 ILE HD1% A 92 LEU HG 1.0 1.8 5.5 340 232 A 91 GLY HA3 A 94 GLU HB2 1.0 1.8 5.5 341 232 A 91 GLY HA2 A 94 GLU HB2 1.0 1.8 5.5 342 232 A 94 GLU HB3 A 91 GLY HA2 1.0 1.8 5.5 343 232 A 91 GLY HA3 A 94 GLU HB3 1.0 1.8 5.5 344 233 A 90 GLN HG3 A 91 GLY HA2 1.0 1.8 5.5 345 233 A 90 GLN HG2 A 91 GLY HA2 1.0 1.8 5.5 346 233 A 91 GLY HA3 A 90 GLN HG2 1.0 1.8 5.5 347 233 A 90 GLN HG3 A 91 GLY HA3 1.0 1.8 5.5 348 234 A 93 ILE HD1% A 89 GLU HBy 1.0 1.8 5.5 349 235 A 48 LEU HA A 48 LEU HBx 1.0 1.8 5.5 350 236 A 48 LEU HBy A 48 LEU HA 1.0 1.8 5.5 351 237 A 56 LEU HDy% A 53 ARG HDx 1.0 1.8 5.5 352 238 A 78 ALA HA A 83 LEU HB2 1.0 1.8 5.5 353 238 A 78 ALA HA A 83 LEU HB3 1.0 1.8 5.5 354 239 A 71 GLU HA A 74 LEU HBx 1.0 1.8 5.5 355 240 A 74 LEU HA A 74 LEU HBy 1.0 1.8 5.5 356 241 A 44 LEU HA A 44 LEU HBy 1.0 1.8 5.5 357 242 A 41 ASN HA A 44 LEU HBy 1.0 1.8 5.5 358 243 A 41 ASN HA A 44 LEU HBx 1.0 1.8 5.5 359 244 A 26 ASP HB2 A 29 GLN HB2 1.0 1.8 5.5 360 244 A 26 ASP HB3 A 29 GLN HB2 1.0 1.8 5.5 361 244 A 29 GLN HB3 A 26 ASP HB2 1.0 1.8 5.5 362 244 A 29 GLN HB3 A 26 ASP HB3 1.0 1.8 5.5 363 245 A 26 ASP HB3 A 29 GLN HG2 1.0 1.8 5.5 364 245 A 26 ASP HB2 A 29 GLN HG2 1.0 1.8 5.5 365 245 A 29 GLN HG3 A 26 ASP HB2 1.0 1.8 5.5 366 245 A 26 ASP HB3 A 29 GLN HG3 1.0 1.8 5.5 367 246 A 23 ASP HBx A 24 PRO HDx 1.0 1.8 5.5 368 247 A 49 ASP HBx A 86 LYS HG2 1.0 1.8 5.5 369 247 A 49 ASP HBx A 86 LYS HG3 1.0 1.8 5.5 370 248 A 49 ASP HBy A 86 LYS HG2 1.0 1.8 5.5 371 248 A 86 LYS HG3 A 49 ASP HBy 1.0 1.8 5.5 372 249 A 73 TYR HBy A 73 TYR HE% 1.0 1.8 5.5 373 250 A 73 TYR HE% A 73 TYR HBx 1.0 1.8 5.5 374 251 A 99 VAL HGx% A 73 TYR HBx 1.0 1.8 5.5 375 252 A 73 TYR HBy A 70 VAL HA 1.0 1.8 5.5 376 253 A 74 LEU HDy% A 73 TYR HBx 1.0 1.8 5.5 377 254 A 74 LEU HDy% A 73 TYR HBy 1.0 1.8 5.5 378 255 A 80 TYR HBx A 82 GLN HG2 1.0 1.8 5.5 379 255 A 80 TYR HBx A 82 GLN HG3 1.0 1.8 5.5 380 256 A 80 TYR HBx A 77 MET HA 1.0 1.8 5.5 381 257 A 95 ILE HA A 95 ILE HB 1.0 1.8 5.5 382 258 A 44 LEU HDx% A 41 ASN HBy 1.0 1.8 5.5 383 259 A 72 ASN HBy A 71 GLU HBy 1.0 1.8 5.5 384 260 A 93 ILE HA A 93 ILE HB 1.0 1.8 5.5 385 261 A 44 LEU HDx% A 71 GLU HGx 1.0 1.8 5.5 386 262 A 71 GLU HA A 71 GLU HGx 1.0 1.8 5.5 387 263 A 67 THR HB A 71 GLU HGy 1.0 1.8 5.5 388 264 A 68 LYS HA A 71 GLU HGy 1.0 1.8 5.5 389 265 A 70 VAL HGy% A 71 GLU HGy 1.0 1.8 5.5 390 266 A 68 LYS HA A 71 GLU HGx 1.0 1.8 5.5 391 267 A 67 THR HG2% A 71 GLU HGx 1.0 1.8 5.5 392 268 A 67 THR HG2% A 71 GLU HGy 1.0 1.8 5.5 393 269 A 67 THR HB A 56 LEU HDx% 1.0 1.8 6.0 394 270 A 67 THR HB A 71 GLU HBx 1.0 1.8 5.5 395 271 A 67 THR HA A 70 VAL HGy% 1.0 1.8 5.5 396 272 A 67 THR HA A 60 ALA HB% 1.0 1.8 5.5 397 273 A 46 GLN HGy A 47 VAL HG1% 1.0 1.8 5.5 398 273 A 47 VAL HG2% A 46 GLN HGy 1.0 1.8 5.5 399 274 A 75 ILE HG2% A 76 GLN HG2 1.0 1.8 5.5 400 274 A 76 GLN HG3 A 75 ILE HG2% 1.0 1.8 5.5 401 275 A 93 ILE HD1% A 90 GLN HG2 1.0 1.8 5.5 402 275 A 93 ILE HD1% A 90 GLN HG3 1.0 1.8 5.5 403 276 A 62 VAL HB A 63 LYS HG2 1.0 1.8 5.5 404 276 A 63 LYS HG3 A 62 VAL HB 1.0 1.8 5.5 405 277 A 67 THR HA A 60 ALA HA 1.0 1.8 5.5 406 278 A 67 THR HA A 64 PRO HA 1.0 1.8 5.5 407 279 A 80 TYR HD% A 76 GLN HG2 1.0 1.8 5.5 408 279 A 76 GLN HG3 A 80 TYR HD% 1.0 1.8 5.5 409 280 A 63 LYS HA A 63 LYS HBx 1.0 1.8 5.5 410 281 A 63 LYS HA A 63 LYS HBy 1.0 1.8 5.5 411 282 A 86 LYS HBx A 86 LYS HE2 1.0 1.8 5.5 412 282 A 86 LYS HBx A 86 LYS HE3 1.0 1.8 5.5 413 283 A 73 TYR HD% A 70 VAL HA 1.0 1.8 5.5 414 284 A 73 TYR HBy A 70 VAL HA 1.0 1.8 5.5 415 285 A 70 VAL HB A 70 VAL HA 1.0 1.8 5.5 416 286 A 109 VAL HGy% A 109 VAL HB 1.0 1.8 5.5 417 287 A 67 THR HG2% A 64 PRO HA 1.0 1.8 5.5 418 288 A 64 PRO HA A 64 PRO HDy 1.0 1.8 5.5 419 289 A 73 TYR HD% A 95 ILE HG2% 1.0 1.8 5.5 420 290 A 73 TYR HD% A 95 ILE HD1% 1.0 1.8 5.5 421 291 A 73 TYR HD% A 73 TYR HBy 1.0 1.8 5.5 422 292 A 73 TYR HD% A 73 TYR HBx 1.0 1.8 5.5 423 293 A 73 TYR HD% A 73 TYR HA 1.0 1.8 5.5 424 294 A 73 TYR HD% A 76 GLN HB2 1.0 1.8 5.5 425 294 A 73 TYR HD% A 76 GLN HB3 1.0 1.8 5.5 426 295 A 99 VAL HGx% A 70 VAL HB 1.0 1.8 5.5 427 296 A 70 VAL HGx% A 99 VAL HB 1.0 1.8 5.5 428 297 A 69 ALA HB% A 99 VAL HB 1.0 1.8 5.5 429 298 A 93 ILE HA A 93 ILE HG1y 1.0 1.8 5.5 430 299 A 43 ILE HA A 47 VAL HG1% 1.0 1.8 5.5 431 299 A 47 VAL HG2% A 43 ILE HA 1.0 1.8 5.5 432 300 A 43 ILE HA A 46 GLN HB2 1.0 1.8 5.5 433 300 A 46 GLN HB3 A 43 ILE HA 1.0 1.8 5.5 434 301 A 4 GLU HG3 A 1 SER HBy 1.0 1.8 5.5 435 301 A 1 SER HBy A 4 GLU HG2 1.0 1.8 5.5 436 302 A 55 ARG HDy A 55 ARG HB2 1.0 1.8 5.5 437 302 A 55 ARG HDy A 55 ARG HB3 1.0 1.8 5.5 438 303 A 54 ALA HB% A 51 SER HBx 1.0 1.8 5.5 439 304 A 99 VAL HGx% A 73 TYR HA 1.0 1.8 5.5 440 305 A 57 SER HA A 56 LEU HDx% 1.0 1.8 5.5 441 306 A 73 TYR HA A 76 GLN HG2 1.0 1.8 5.5 442 306 A 76 GLN HG3 A 73 TYR HA 1.0 1.8 5.5 443 307 A 89 GLU HA A 92 LEU HDy% 1.0 1.8 5.5 444 308 A 74 LEU HDx% A 71 GLU HA 1.0 1.8 5.5 445 309 A 48 LEU HA A 48 LEU HDy% 1.0 1.8 5.5 446 310 A 65 GLU HA A 64 PRO HG2 1.0 1.8 5.5 447 310 A 65 GLU HA A 64 PRO HG3 1.0 1.8 5.5 448 311 A 74 LEU HDx% A 47 VAL HB 1.0 1.8 5.5 449 312 A 92 LEU HDx% A 89 GLU HA 1.0 1.8 6.0 450 313 A 71 GLU HA A 74 LEU HBy 1.0 1.8 5.5 451 314 A 71 GLU HA A 70 VAL HGy% 1.0 1.8 5.5 452 315 A 92 LEU HDx% A 48 LEU HG 1.0 1.8 5.5 453 316 A 92 LEU HDx% A 92 LEU HBy 1.0 1.8 5.5 454 317 A 56 LEU HDy% A 71 GLU HGx 1.0 1.8 5.5 455 318 A 56 LEU HDy% A 70 VAL HB 1.0 1.8 5.5 456 319 A 44 LEU HDx% A 71 GLU HBx 1.0 1.8 5.5 457 320 A 44 LEU HDx% A 71 GLU HGx 1.0 1.8 5.5 458 321 A 44 LEU HDx% A 41 ASN HBy 1.0 1.8 5.5 459 322 A 44 LEU HDx% A 40 ARG HG2 1.0 1.8 5.5 460 322 A 44 LEU HDx% A 40 ARG HG3 1.0 1.8 5.5 461 323 A 44 LEU HDx% A 43 ILE HG1y 1.0 1.8 5.5 462 324 A 83 LEU HDx% A 78 ALA HA 1.0 1.8 5.5 463 325 A 83 LEU HDx% A 47 VAL HA 1.0 1.8 5.5 464 326 A 83 LEU HDx% A 85 GLU HBy 1.0 1.8 5.5 465 327 A 62 VAL HA A 63 LYS HG2 1.0 1.8 5.5 466 327 A 63 LYS HG3 A 62 VAL HA 1.0 1.8 5.5 467 328 A 55 ARG HA A 59 LEU HDy% 1.0 1.8 5.5 468 329 A 66 LYS HA A 59 LEU HDx% 1.0 1.8 6.0 469 330 A 59 LEU HDx% A 63 LYS HE2 1.0 1.8 5.5 470 330 A 63 LYS HE3 A 59 LEU HDx% 1.0 1.8 5.5 471 331 A 70 VAL HA A 56 LEU HDx% 1.0 1.8 5.5 472 332 A 70 VAL HB A 56 LEU HDx% 1.0 1.8 5.5 473 333 A 80 TYR HE% A 80 TYR HA 1.0 1.8 5.5 474 334 A 67 THR HA A 70 VAL HGx% 1.0 1.8 5.5 475 335 A 70 VAL HGx% A 66 LYS HBy 1.0 1.8 5.5 476 336 A 46 GLN HA A 86 LYS HE2 1.0 1.8 5.5 477 336 A 86 LYS HE3 A 46 GLN HA 1.0 1.8 5.5 478 337 A 75 ILE HA A 44 LEU HDy% 1.0 1.8 5.5 479 338 A 44 LEU HDy% A 71 GLU HGx 1.0 1.8 5.5 480 339 A 41 ASN HA A 44 LEU HDy% 1.0 1.8 5.5 481 340 A 48 LEU HBy A 44 LEU HDy% 1.0 1.8 5.5 482 341 A 104 GLU HA A 104 GLU HG2 1.0 1.8 5.5 483 341 A 104 GLU HA A 104 GLU HG3 1.0 1.8 5.5 484 342 A 105 LYS HA A 105 LYS HB2 1.0 1.8 5.5 485 342 A 105 LYS HB3 A 105 LYS HA 1.0 1.8 5.5 486 343 A 110 LYS HA A 110 LYS HD2 1.0 1.8 5.5 487 343 A 110 LYS HA A 110 LYS HD3 1.0 1.8 5.5 488 344 A 41 ASN HA A 44 LEU HBy 1.0 1.8 5.5 489 345 A 72 ASN HA A 75 ILE HG1x 1.0 1.8 5.5 490 345 A 72 ASN HA A 75 ILE HG1y 1.0 1.8 5.5 491 346 A 109 VAL HGy% A 110 LYS HA 1.0 1.8 5.5 492 347 A 62 VAL HGx% A 59 LEU HA 1.0 1.8 5.5 493 348 A 67 THR HG2% A 56 LEU HBx 1.0 1.8 5.5 494 349 A 83 LEU HG A 47 VAL HG1% 1.0 1.8 5.5 495 349 A 47 VAL HG2% A 83 LEU HG 1.0 1.8 5.5 496 350 A 70 VAL HGy% A 71 GLU HBy 1.0 1.8 5.5 497 351 A 70 VAL HGy% A 59 LEU HBx 1.0 1.8 5.5 498 352 A 37 ALA HA A 36 GLU HB2 1.0 1.8 5.5 499 352 A 37 ALA HA A 36 GLU HB3 1.0 1.8 5.5 500 353 A 89 GLU HGx A 52 ALA HA 1.0 1.8 5.5 501 354 A 52 ALA HA A 55 ARG HGy 1.0 1.8 5.5 502 355 A 52 ALA HA A 48 LEU HDy% 1.0 1.8 5.5 503 356 A 99 VAL HGx% A 69 ALA HA 1.0 1.8 5.5 504 357 A 46 GLN HA A 47 VAL HG1% 1.0 1.8 5.5 505 357 A 47 VAL HG2% A 46 GLN HA 1.0 1.8 5.5 506 358 A 99 VAL HGx% A 73 TYR HE% 1.0 1.8 5.5 507 359 A 99 VAL HGx% A 66 LYS HA 1.0 1.8 5.5 508 360 A 99 VAL HGx% A 70 VAL HB 1.0 1.8 5.5 509 361 A 67 THR HA A 60 ALA HA 1.0 1.8 5.5 510 362 A 78 ALA HA A 47 VAL HG1% 1.0 1.8 5.5 511 362 A 47 VAL HG2% A 78 ALA HA 1.0 1.8 5.5 512 363 A 52 ALA HB% A 48 LEU HA 1.0 1.8 5.5 513 364 A 63 LYS HA A 64 PRO HG2 1.0 1.8 5.5 514 364 A 63 LYS HA A 64 PRO HG3 1.0 1.8 5.5 515 365 A 62 VAL HGy% A 63 LYS HE2 1.0 1.8 5.5 516 365 A 62 VAL HGy% A 63 LYS HE3 1.0 1.8 5.5 517 366 A 62 VAL HGy% A 63 LYS HBy 1.0 1.8 5.5 518 367 A 86 LYS HBx A 49 ASP HA 1.0 1.8 5.5 519 368 A 49 ASP HA A 86 LYS HE2 1.0 1.8 5.5 520 368 A 86 LYS HE3 A 49 ASP HA 1.0 1.8 5.5 521 369 A 50 GLN HA A 49 ASP HA 1.0 1.8 5.5 522 370 A 52 ALA HB% A 92 LEU HG 1.0 1.8 5.5 523 371 A 23 ASP HA A 24 PRO HG2 1.0 1.8 5.5 524 371 A 24 PRO HG3 A 23 ASP HA 1.0 1.8 5.5 525 372 A 95 ILE HG2% A 73 TYR HBx 1.0 1.8 5.5 526 373 A 95 ILE HG2% A 70 VAL HA 1.0 1.8 5.5 527 374 A 95 ILE HG2% A 96 LEU HA 1.0 1.8 5.5 528 375 A 95 ILE HG2% A 92 LEU HA 1.0 1.8 5.5 529 376 A 95 ILE HG2% A 70 VAL HB 1.0 1.8 5.5 530 377 A 95 ILE HG2% A 92 LEU HG 1.0 1.8 5.5 531 378 A 43 ILE HG2% A 47 VAL HG1% 1.0 1.8 5.5 532 378 A 47 VAL HG2% A 43 ILE HG2% 1.0 1.8 5.5 533 379 A 93 ILE HG2% A 90 GLN HA 1.0 1.8 5.5 534 380 A 24 PRO HA A 24 PRO HDy 1.0 1.8 5.5 535 381 A 24 PRO HA A 24 PRO HDx 1.0 1.8 5.5 536 382 A 23 ASP HBx A 24 PRO HDy 1.0 1.8 5.5 537 383 A 23 ASP HBx A 24 PRO HDx 1.0 1.8 5.5 538 384 A 24 PRO HDx A 23 ASP HBy 1.0 1.8 5.5 539 385 A 24 PRO HDy A 23 ASP HBy 1.0 1.8 5.5 540 386 A 24 PRO HDy A 24 PRO HBx 1.0 1.8 5.5 541 387 A 24 PRO HDx A 24 PRO HBx 1.0 1.8 5.5 542 388 A 75 ILE HG2% A 76 GLN HG2 1.0 1.8 5.5 543 388 A 76 GLN HG3 A 75 ILE HG2% 1.0 1.8 5.5 544 389 A 64 PRO HBx A 64 PRO HDx 1.0 1.8 5.5 545 390 A 64 PRO HDx A 63 LYS HG2 1.0 1.8 5.5 546 390 A 63 LYS HG3 A 64 PRO HDx 1.0 1.8 5.5 547 391 A 64 PRO HDy A 63 LYS HG2 1.0 1.8 6.0 548 391 A 63 LYS HG3 A 64 PRO HDy 1.0 1.8 6.0 549 392 A 63 LYS HBy A 64 PRO HDy 1.0 1.8 5.5 550 393 A 64 PRO HDx A 63 LYS HBy 1.0 1.8 5.5 551 394 A 64 PRO HDx A 64 PRO HA 1.0 1.8 5.5 552 395 A 64 PRO HA A 64 PRO HDy 1.0 1.8 5.5 553 396 A 71 GLU HA A 71 GLU HGx 1.0 1.8 5.5 554 397 A 80 TYR HD% A 80 TYR HA 1.0 1.8 4.5 555 398 A 80 TYR HE% A 80 TYR HD% 1.0 1.8 4.5 556 399 A 73 TYR HD% A 73 TYR HBx 1.0 1.8 4.5 557 400 A 73 TYR HD% A 73 TYR HA 1.0 1.8 4.5 558 401 A 73 TYR HD% A 73 TYR HE% 1.0 1.8 4.5 559 402 A 73 TYR HD% A 73 TYR HE% 1.0 1.8 4.5 560 403 A 80 TYR HE% A 80 TYR HD% 1.0 1.8 4.5 561 404 A 88 SER HA A 88 SER HBx 1.0 1.8 3.5 562 405 A 88 SER HA A 88 SER HBy 1.0 1.8 3.5 563 406 A 63 LYS HA A 64 PRO HG2 1.0 1.8 4.5 564 406 A 63 LYS HA A 64 PRO HG3 1.0 1.8 4.5 565 407 A 63 LYS HA A 64 PRO HDx 1.0 1.8 3.5 566 408 A 63 LYS HA A 64 PRO HDy 1.0 1.8 4.5 567 409 A 23 ASP HBx A 23 ASP HA 1.0 1.8 4.5 568 410 A 23 ASP HA A 23 ASP HBy 1.0 1.8 4.5 569 411 A 24 PRO HDx A 23 ASP HA 1.0 1.8 3.5 570 412 A 23 ASP HA A 24 PRO HDy 1.0 1.8 3.5 571 413 A 48 LEU HA A 48 LEU HDx% 1.0 1.8 4.5 572 414 A 21 HIS HBx A 21 HIS HA 1.0 1.8 4.5 573 415 A 21 HIS HA A 21 HIS HBy 1.0 1.8 4.5 574 416 A 80 TYR HBx A 80 TYR HA 1.0 1.8 3.5 575 417 A 80 TYR HBy A 80 TYR HA 1.0 1.8 3.5 576 418 A 83 LEU HA A 83 LEU HB2 1.0 1.8 4.5 577 418 A 83 LEU HA A 83 LEU HB3 1.0 1.8 4.5 578 419 A 49 ASP HBy A 49 ASP HA 1.0 1.8 3.5 579 420 A 49 ASP HBx A 49 ASP HA 1.0 1.8 3.5 580 421 A 83 LEU HA A 83 LEU HDy% 1.0 1.8 4.5 581 422 A 26 ASP HA A 26 ASP HB2 1.0 1.8 4.5 582 422 A 26 ASP HA A 26 ASP HB3 1.0 1.8 4.5 583 423 A 58 ASN HA A 58 ASN HBx 1.0 1.8 3.5 584 424 A 58 ASN HA A 58 ASN HBy 1.0 1.8 3.5 585 425 A 34 HIS HBx A 34 HIS HA 1.0 1.8 3.5 586 426 A 34 HIS HA A 34 HIS HBy 1.0 1.8 3.5 587 427 A 85 GLU HA A 85 GLU HG2 1.0 1.8 4.5 588 427 A 85 GLU HG3 A 85 GLU HA 1.0 1.8 4.5 589 428 A 85 GLU HA A 85 GLU HBx 1.0 1.8 4.5 590 429 A 85 GLU HBy A 85 GLU HA 1.0 1.8 4.5 591 430 A 3 ASP HA A 3 ASP HBy 1.0 1.8 4.5 592 431 A 1 SER HA A 1 SER HBx 1.0 1.8 4.5 593 432 A 41 ASN HA A 41 ASN HBy 1.0 1.8 3.5 594 433 A 72 ASN HA A 75 ILE HB 1.0 1.8 4.5 595 434 A 72 ASN HA A 72 ASN HBx 1.0 1.8 4.5 596 435 A 107 THR HB A 107 THR HA 1.0 1.8 3.5 597 436 A 24 PRO HA A 24 PRO HBx 1.0 1.8 3.5 598 437 A 88 SER HA A 88 SER HBx 1.0 1.8 2.8 599 438 A 47 VAL HA A 47 VAL HB 1.0 1.8 3.5 600 439 A 84 SER HBx A 84 SER HA 1.0 1.8 3.5 601 440 A 84 SER HA A 84 SER HBy 1.0 1.8 3.5 602 441 A 47 VAL HA A 86 LYS HA 1.0 1.8 4.5 603 442 A 108 THR HA A 108 THR HB 1.0 1.8 4.5 604 443 A 62 VAL HA A 62 VAL HB 1.0 1.8 3.5 605 444 A 64 PRO HBx A 64 PRO HA 1.0 1.8 4.5 606 445 A 64 PRO HA A 64 PRO HBy 1.0 1.8 3.5 607 446 A 64 PRO HA A 64 PRO HG2 1.0 1.8 4.5 608 446 A 64 PRO HG3 A 64 PRO HA 1.0 1.8 4.5 609 447 A 62 VAL HA A 62 VAL HGx% 1.0 1.8 4.5 610 448 A 103 THR HA A 103 THR HG2% 1.0 1.8 4.5 611 449 A 64 PRO HA A 60 ALA HA 1.0 1.8 4.5 612 450 A 104 GLU HA A 104 GLU HG2 1.0 1.8 4.5 613 450 A 104 GLU HA A 104 GLU HG3 1.0 1.8 4.5 614 451 A 104 GLU HBy A 104 GLU HA 1.0 1.8 3.5 615 452 A 51 SER HBx A 51 SER HA 1.0 1.8 3.5 616 453 A 82 GLN HA A 82 GLN HG2 1.0 1.8 4.5 617 453 A 82 GLN HG3 A 82 GLN HA 1.0 1.8 4.5 618 454 A 82 GLN HA A 82 GLN HB2 1.0 1.8 4.5 619 454 A 82 GLN HB3 A 82 GLN HA 1.0 1.8 4.5 620 455 A 42 SER HBy A 42 SER HA 1.0 1.8 3.5 621 456 A 46 GLN HGx A 46 GLN HA 1.0 1.8 4.5 622 457 A 18 GLN HGy A 18 GLN HA 1.0 1.8 2.8 623 458 A 20 LYS HBx A 20 LYS HA 1.0 1.8 3.5 624 459 A 46 GLN HA A 46 GLN HB2 1.0 1.8 3.5 625 459 A 46 GLN HB3 A 46 GLN HA 1.0 1.8 3.5 626 460 A 106 THR HG2% A 106 THR HB 1.0 1.8 3.5 627 461 A 69 ALA HA A 72 ASN HBx 1.0 1.8 4.5 628 462 A 69 ALA HA A 72 ASN HBy 1.0 1.8 4.5 629 463 A 86 LYS HBx A 86 LYS HA 1.0 1.8 4.5 630 464 A 106 THR HB A 106 THR HA 1.0 1.8 2.8 631 465 A 61 LEU HA A 61 LEU HBx 1.0 1.8 4.5 632 466 A 73 TYR HBx A 73 TYR HA 1.0 1.8 4.5 633 467 A 73 TYR HBy A 73 TYR HA 1.0 1.8 4.5 634 468 A 12 GLN HGx A 12 GLN HA 1.0 1.8 3.5 635 469 A 73 TYR HA A 76 GLN HG2 1.0 1.8 4.5 636 469 A 76 GLN HG3 A 73 TYR HA 1.0 1.8 4.5 637 470 A 57 SER HA A 57 SER HBy 1.0 1.8 3.5 638 471 A 34 HIS HBy A 31 GLU HA 1.0 1.8 4.5 639 472 A 34 HIS HBx A 31 GLU HA 1.0 1.8 4.5 640 473 A 66 LYS HE2 A 66 LYS HA 1.0 1.8 4.5 641 474 A 66 LYS HE3 A 66 LYS HA 1.0 1.8 4.5 642 475 A 9 LEU HBx A 9 LEU HA 1.0 1.8 3.3 643 476 A 14 LEU HBy A 14 LEU HA 1.0 1.8 2.8 644 477 A 55 ARG HA A 58 ASN HBx 1.0 1.8 4.5 645 478 A 36 GLU HGy A 36 GLU HA 1.0 1.8 2.8 646 479 A 66 LYS HA A 66 LYS HBy 1.0 1.8 3.5 647 480 A 13 ARG HA A 13 ARG HB2 1.0 1.8 2.8 648 480 A 13 ARG HB3 A 13 ARG HA 1.0 1.8 2.8 649 481 A 7 GLU HA A 7 GLU HB2 1.0 1.8 2.8 650 481 A 7 GLU HB3 A 7 GLU HA 1.0 1.8 2.8 651 482 A 12 GLN HA A 12 GLN HB2 1.0 1.8 2.8 652 482 A 12 GLN HA A 12 GLN HB3 1.0 1.8 2.8 653 483 A 61 LEU HA A 61 LEU HG 1.0 1.8 3.5 654 484 A 33 LYS HA A 33 LYS HGy 1.0 1.8 3.5 655 485 A 9 LEU HA A 9 LEU HDy% 1.0 1.8 4.5 656 486 A 17 LEU HDy% A 17 LEU HA 1.0 1.8 3.5 657 487 A 27 ALA HA A 27 ALA HB% 1.0 1.8 2.8 658 488 A 55 ARG HDy A 55 ARG HA 1.0 1.8 3.5 659 489 A 67 THR HA A 64 PRO HA 1.0 1.8 5.0 660 490 A 33 LYS HA A 33 LYS HB2 1.0 1.8 2.8 661 490 A 33 LYS HA A 33 LYS HB3 1.0 1.8 2.8 662 491 A 33 LYS HA A 33 LYS HD2 1.0 1.8 3.5 663 491 A 33 LYS HA A 33 LYS HD3 1.0 1.8 3.5 664 492 A 33 LYS HGx A 30 GLN HA 1.0 1.8 4.5 665 493 A 67 THR HA A 67 THR HG2% 1.0 1.8 4.5 666 494 A 53 ARG HDy A 45 ALA HA 1.0 1.8 4.5 667 495 A 41 ASN HBy A 37 ALA HA 1.0 1.8 4.5 668 496 A 98 LYS HGy A 98 LYS HA 1.0 1.8 4.5 669 497 A 32 ALA HB% A 32 ALA HA 1.0 1.8 2.8 670 498 A 59 LEU HDx% A 59 LEU HA 1.0 1.8 4.5 671 499 A 62 VAL HGy% A 59 LEU HA 1.0 1.8 4.5 672 500 A 14 LEU HBx A 11 ARG HA 1.0 1.8 4.5 673 501 A 14 LEU HBy A 11 ARG HA 1.0 1.8 4.5 674 502 A 90 GLN HA A 93 ILE HB 1.0 1.8 4.5 675 503 A 42 SER HBy A 42 SER HA 1.0 1.8 2.8 676 504 A 56 LEU HA A 56 LEU HDx% 1.0 1.8 4.5 677 505 A 95 ILE HD1% A 92 LEU HA 1.0 1.8 4.5 678 506 A 90 GLN HA A 90 GLN HG2 1.0 1.8 4.5 679 506 A 90 GLN HG3 A 90 GLN HA 1.0 1.8 4.5 680 507 A 11 ARG HA A 11 ARG HBx 1.0 1.8 3.3 681 508 A 10 ARG HA A 10 ARG HG2 1.0 1.8 4.5 682 508 A 10 ARG HG3 A 10 ARG HA 1.0 1.8 4.5 683 509 A 1 SER HA A 1 SER HBx 1.0 1.8 4.5 684 510 A 92 LEU HDy% A 52 ALA HA 1.0 1.8 4.5 685 511 A 88 SER HA A 88 SER HBy 1.0 1.8 3.5 686 512 A 68 LYS HA A 68 LYS HB2 1.0 1.8 2.8 687 512 A 68 LYS HA A 68 LYS HB3 1.0 1.8 2.8 688 513 A 50 GLN HA A 50 GLN HG2 1.0 1.8 4.5 689 513 A 50 GLN HA A 50 GLN HG3 1.0 1.8 4.5 690 514 A 79 ARG HA A 79 ARG HBx 1.0 1.8 3.5 691 515 A 79 ARG HA A 79 ARG HBy 1.0 1.8 3.5 692 516 A 4 GLU HB3 A 1 SER HBy 1.0 1.8 4.5 693 516 A 1 SER HBy A 4 GLU HB2 1.0 1.8 4.5 694 517 A 57 SER HA A 57 SER HBy 1.0 1.8 3.5 695 518 A 50 GLN HA A 50 GLN HBy 1.0 1.8 3.5 696 519 A 89 GLU HA A 52 ALA HA 1.0 1.8 4.5 697 520 A 79 ARG HA A 79 ARG HG2 1.0 1.8 4.5 698 520 A 79 ARG HA A 79 ARG HG3 1.0 1.8 4.5 699 521 A 100 SER HA A 100 SER HBy 1.0 1.8 3.3 700 522 A 44 LEU HA A 44 LEU HDy% 1.0 1.8 4.5 701 523 A 44 LEU HA A 47 VAL HG1% 1.0 1.8 4.5 702 523 A 47 VAL HG2% A 44 LEU HA 1.0 1.8 4.5 703 524 A 52 ALA HB% A 52 ALA HA 1.0 1.8 3.5 704 525 A 76 GLN HA A 76 GLN HG2 1.0 1.8 4.5 705 525 A 76 GLN HG3 A 76 GLN HA 1.0 1.8 4.5 706 526 A 64 PRO HA A 60 ALA HA 1.0 1.8 4.5 707 527 A 99 VAL HB A 99 VAL HA 1.0 1.8 3.5 708 528 A 1 SER HA A 1 SER HBy 1.0 1.8 4.5 709 529 A 84 SER HBx A 84 SER HA 1.0 1.8 3.3 710 530 A 74 LEU HDy% A 74 LEU HA 1.0 1.8 4.5 711 531 A 67 THR HG2% A 60 ALA HA 1.0 1.8 4.5 712 532 A 99 VAL HGx% A 99 VAL HA 1.0 1.8 3.5 713 533 A 60 ALA HB% A 60 ALA HA 1.0 1.8 3.5 714 534 A 43 ILE HA A 43 ILE HD1% 1.0 1.8 4.5 715 535 A 53 ARG HDy A 53 ARG HA 1.0 1.8 4.5 716 536 A 24 PRO HDx A 24 PRO HBx 1.0 1.8 4.5 717 537 A 53 ARG HA A 53 ARG HBy 1.0 1.8 3.5 718 538 A 24 PRO HDx A 23 ASP HA 1.0 1.8 2.8 719 539 A 43 ILE HA A 43 ILE HB 1.0 1.8 4.5 720 540 A 43 ILE HA A 43 ILE HG1x 1.0 1.8 4.5 721 541 A 43 ILE HA A 43 ILE HG1y 1.0 1.8 4.5 722 542 A 43 ILE HG2% A 43 ILE HA 1.0 1.8 4.5 723 543 A 24 PRO HDy A 24 PRO HG2 1.0 1.8 4.5 724 543 A 24 PRO HG3 A 24 PRO HDy 1.0 1.8 4.5 725 544 A 84 SER HA A 84 SER HBy 1.0 1.8 3.5 726 545 A 96 LEU HA A 96 LEU HB2 1.0 1.8 4.5 727 545 A 96 LEU HA A 96 LEU HB3 1.0 1.8 4.5 728 546 A 64 PRO HDx A 64 PRO HG2 1.0 1.8 4.5 729 546 A 64 PRO HDx A 64 PRO HG3 1.0 1.8 4.5 730 547 A 96 LEU HDx% A 96 LEU HA 1.0 1.8 4.5 731 548 A 99 VAL HGx% A 96 LEU HA 1.0 1.8 4.5 732 549 A 63 LYS HA A 64 PRO HDx 1.0 1.8 4.5 733 550 A 89 GLU HA A 89 GLU HBy 1.0 1.8 4.5 734 551 A 89 GLU HA A 52 ALA HA 1.0 1.8 4.5 735 552 A 67 THR HB A 67 THR HA 1.0 1.8 4.5 736 553 A 67 THR HB A 67 THR HG2% 1.0 1.8 4.5 737 554 A 70 VAL HB A 70 VAL HA 1.0 1.8 4.5 738 555 A 96 LEU HDx% A 93 ILE HA 1.0 1.8 4.5 739 556 A 70 VAL HGx% A 70 VAL HA 1.0 1.8 4.5 740 557 A 70 VAL HGy% A 70 VAL HA 1.0 1.8 4.5 741 558 A 99 VAL HGx% A 70 VAL HA 1.0 1.8 4.5 742 559 A 93 ILE HG2% A 93 ILE HA 1.0 1.8 4.5 743 560 A 75 ILE HA A 75 ILE HG2% 1.0 1.8 4.5 744 561 A 34 HIS HBx A 31 GLU HA 1.0 1.8 2.8 745 562 A 34 HIS HA A 34 HIS HBy 1.0 1.8 2.8 746 563 A 80 TYR HBx A 80 TYR HA 1.0 1.8 3.5 747 564 A 21 HIS HBx A 21 HIS HA 1.0 1.8 4.5 748 565 A 64 PRO HDy A 64 PRO HG2 1.0 1.8 4.5 749 565 A 64 PRO HG3 A 64 PRO HDy 1.0 1.8 4.5 750 566 A 63 LYS HA A 64 PRO HDy 1.0 1.8 4.5 751 567 A 73 TYR HBx A 73 TYR HA 1.0 1.8 4.5 752 568 A 13 ARG HB3 A 13 ARG HD2 1.0 1.8 3.5 753 568 A 13 ARG HD3 A 13 ARG HB2 1.0 1.8 3.5 754 568 A 13 ARG HD3 A 13 ARG HB3 1.0 1.8 3.5 755 568 A 13 ARG HB2 A 13 ARG HD2 1.0 1.8 3.5 756 569 A 66 LYS HE3 A 66 LYS HD2 1.0 1.8 2.8 757 569 A 66 LYS HD3 A 66 LYS HE3 1.0 1.8 2.8 758 570 A 10 ARG HA A 10 ARG HD2 1.0 1.8 4.5 759 570 A 10 ARG HD3 A 10 ARG HA 1.0 1.8 4.5 760 571 A 13 ARG HA A 13 ARG HD2 1.0 1.8 4.5 761 571 A 13 ARG HD3 A 13 ARG HA 1.0 1.8 4.5 762 572 A 21 HIS HA A 21 HIS HBy 1.0 1.8 4.5 763 573 A 49 ASP HBx A 49 ASP HA 1.0 1.8 3.5 764 574 A 53 ARG HDy A 53 ARG HA 1.0 1.8 4.5 765 575 A 73 TYR HBy A 73 TYR HA 1.0 1.8 3.5 766 576 A 79 ARG HBx A 79 ARG HD2 1.0 1.8 4.5 767 576 A 79 ARG HD3 A 79 ARG HBx 1.0 1.8 4.5 768 577 A 98 LYS HDx A 98 LYS HE2 1.0 1.8 3.5 769 577 A 98 LYS HE3 A 98 LYS HDx 1.0 1.8 3.5 770 578 A 68 LYS HE2 A 68 LYS HG2 1.0 1.8 4.5 771 578 A 68 LYS HE3 A 68 LYS HG2 1.0 1.8 4.5 772 578 A 68 LYS HG3 A 68 LYS HE2 1.0 1.8 4.5 773 578 A 68 LYS HE3 A 68 LYS HG3 1.0 1.8 4.5 774 579 A 69 ALA HA A 72 ASN HBx 1.0 1.8 4.5 775 580 A 55 ARG HA A 58 ASN HBx 1.0 1.8 4.5 776 581 A 58 ASN HA A 58 ASN HBx 1.0 1.8 3.5 777 582 A 80 TYR HBy A 82 GLN HG2 1.0 1.8 4.5 778 582 A 80 TYR HBy A 82 GLN HG3 1.0 1.8 4.5 779 583 A 80 TYR HBy A 80 TYR HA 1.0 1.8 4.5 780 584 A 72 ASN HA A 72 ASN HBy 1.0 1.8 4.5 781 585 A 55 ARG HA A 58 ASN HBy 1.0 1.8 4.5 782 586 A 58 ASN HA A 58 ASN HBy 1.0 1.8 3.5 783 587 A 26 ASP HA A 26 ASP HB2 1.0 1.8 4.5 784 587 A 26 ASP HA A 26 ASP HB3 1.0 1.8 4.5 785 588 A 23 ASP HBx A 23 ASP HA 1.0 1.8 4.5 786 589 A 3 ASP HA A 3 ASP HBx 1.0 1.8 3.5 787 590 A 23 ASP HA A 23 ASP HBy 1.0 1.8 4.5 788 591 A 64 PRO HBx A 64 PRO HA 1.0 1.8 3.5 789 592 A 46 GLN HGx A 46 GLN HA 1.0 1.8 4.5 790 593 A 49 ASP HBy A 49 ASP HA 1.0 1.8 3.5 791 594 A 46 GLN HGx A 46 GLN HB2 1.0 1.8 4.5 792 594 A 46 GLN HGx A 46 GLN HB3 1.0 1.8 4.5 793 595 A 16 GLU HA A 16 GLU HGx 1.0 1.8 3.5 794 596 A 90 GLN HA A 90 GLN HG2 1.0 1.8 4.5 795 596 A 90 GLN HG3 A 90 GLN HA 1.0 1.8 4.5 796 597 A 18 GLN HGy A 18 GLN HA 1.0 1.8 3.5 797 598 A 102 GLN HA A 102 GLN HGx 1.0 1.8 3.5 798 599 A 36 GLU HGx A 33 LYS HD2 1.0 1.8 4.5 799 599 A 33 LYS HD3 A 36 GLU HGx 1.0 1.8 4.5 800 600 A 94 GLU HB2 A 94 GLU HG2 1.0 1.8 2.8 801 600 A 94 GLU HB3 A 94 GLU HG2 1.0 1.8 2.8 802 600 A 94 GLU HG3 A 94 GLU HB2 1.0 1.8 2.8 803 600 A 94 GLU HG3 A 94 GLU HB3 1.0 1.8 2.8 804 601 A 94 GLU HA A 94 GLU HG2 1.0 1.8 4.5 805 601 A 94 GLU HG3 A 94 GLU HA 1.0 1.8 4.5 806 602 A 101 GLN HA A 101 GLN HG2 1.0 1.8 4.5 807 602 A 101 GLN HA A 101 GLN HG3 1.0 1.8 4.5 808 603 A 102 GLN HGy A 102 GLN HB2 1.0 1.8 2.8 809 603 A 102 GLN HB3 A 102 GLN HGy 1.0 1.8 2.8 810 604 A 31 GLU HA A 31 GLU HG2 1.0 1.8 3.5 811 604 A 31 GLU HA A 31 GLU HG3 1.0 1.8 3.5 812 605 A 12 GLN HA A 12 GLN HGy 1.0 1.8 3.5 813 606 A 101 GLN HB2 A 101 GLN HG2 1.0 1.8 2.8 814 606 A 101 GLN HB3 A 101 GLN HG2 1.0 1.8 2.8 815 606 A 101 GLN HG3 A 101 GLN HB2 1.0 1.8 2.8 816 606 A 101 GLN HG3 A 101 GLN HB3 1.0 1.8 2.8 817 607 A 47 VAL HA A 47 VAL HB 1.0 1.8 3.5 818 608 A 71 GLU HA A 71 GLU HBx 1.0 1.8 4.5 819 609 A 68 LYS HA A 71 GLU HBx 1.0 1.8 4.5 820 610 A 70 VAL HGx% A 70 VAL HB 1.0 1.8 4.5 821 611 A 70 VAL HGy% A 70 VAL HB 1.0 1.8 4.5 822 612 A 71 GLU HBx A 72 ASN HBy 1.0 1.8 4.5 823 613 A 85 GLU HBx A 85 GLU HG2 1.0 1.8 3.5 824 613 A 85 GLU HG3 A 85 GLU HBx 1.0 1.8 3.5 825 614 A 85 GLU HBy A 85 GLU HG2 1.0 1.8 4.5 826 614 A 85 GLU HBy A 85 GLU HG3 1.0 1.8 4.5 827 615 A 24 PRO HA A 24 PRO HBx 1.0 1.8 3.5 828 616 A 24 PRO HBx A 24 PRO HG2 1.0 1.8 2.8 829 616 A 24 PRO HG3 A 24 PRO HBx 1.0 1.8 2.8 830 617 A 76 GLN HA A 76 GLN HG2 1.0 1.8 4.5 831 617 A 76 GLN HG3 A 76 GLN HA 1.0 1.8 4.5 832 618 A 82 GLN HA A 82 GLN HG2 1.0 1.8 3.5 833 618 A 82 GLN HG3 A 82 GLN HA 1.0 1.8 3.5 834 619 A 85 GLU HA A 85 GLU HG2 1.0 1.8 4.5 835 619 A 85 GLU HG3 A 85 GLU HA 1.0 1.8 4.5 836 620 A 46 GLN HA A 46 GLN HB2 1.0 1.8 2.8 837 620 A 46 GLN HB3 A 46 GLN HA 1.0 1.8 2.8 838 621 A 102 GLN HGx A 102 GLN HB2 1.0 1.8 2.8 839 621 A 102 GLN HGx A 102 GLN HB3 1.0 1.8 2.8 840 622 A 64 PRO HBx A 64 PRO HG2 1.0 1.8 3.5 841 622 A 64 PRO HBx A 64 PRO HG3 1.0 1.8 3.5 842 623 A 62 VAL HA A 62 VAL HB 1.0 1.8 3.5 843 624 A 50 GLN HA A 50 GLN HBy 1.0 1.8 3.5 844 625 A 62 VAL HGx% A 62 VAL HB 1.0 1.8 4.5 845 626 A 62 VAL HGy% A 62 VAL HB 1.0 1.8 4.5 846 627 A 104 GLU HBx A 98 LYS HE2 1.0 1.8 4.5 847 627 A 98 LYS HE3 A 104 GLU HBx 1.0 1.8 4.5 848 628 A 18 GLN HGy A 18 GLN HB2 1.0 1.8 2.8 849 628 A 18 GLN HGy A 18 GLN HB3 1.0 1.8 2.8 850 629 A 64 PRO HA A 64 PRO HG2 1.0 1.8 4.5 851 629 A 64 PRO HG3 A 64 PRO HA 1.0 1.8 4.5 852 630 A 36 GLU HA A 36 GLU HB2 1.0 1.8 2.8 853 630 A 36 GLU HB3 A 36 GLU HA 1.0 1.8 2.8 854 631 A 92 LEU HA A 92 LEU HBx 1.0 1.8 4.5 855 632 A 101 GLN HA A 101 GLN HB2 1.0 1.8 3.5 856 632 A 101 GLN HA A 101 GLN HB3 1.0 1.8 3.5 857 633 A 85 GLU HA A 85 GLU HBx 1.0 1.8 3.5 858 634 A 64 PRO HDy A 64 PRO HG2 1.0 1.8 4.5 859 634 A 64 PRO HG3 A 64 PRO HDy 1.0 1.8 4.5 860 635 A 93 ILE HD1% A 93 ILE HB 1.0 1.8 4.5 861 636 A 99 VAL HB A 66 LYS HE3 1.0 1.8 4.5 862 637 A 65 GLU HGy A 65 GLU HB2 1.0 1.8 2.8 863 637 A 65 GLU HGy A 65 GLU HB3 1.0 1.8 2.8 864 638 A 76 GLN HB2 A 76 GLN HG2 1.0 1.8 3.5 865 638 A 76 GLN HB3 A 76 GLN HG2 1.0 1.8 3.5 866 638 A 76 GLN HG3 A 76 GLN HB2 1.0 1.8 3.5 867 638 A 76 GLN HG3 A 76 GLN HB3 1.0 1.8 3.5 868 639 A 93 ILE HA A 93 ILE HB 1.0 1.8 4.5 869 640 A 99 VAL HB A 99 VAL HA 1.0 1.8 3.5 870 641 A 71 GLU HBx A 71 GLU HGy 1.0 1.8 2.8 871 642 A 93 ILE HB A 93 ILE HG1x 1.0 1.8 2.8 872 643 A 93 ILE HG1y A 93 ILE HB 1.0 1.8 4.5 873 644 A 73 TYR HA A 76 GLN HB2 1.0 1.8 4.5 874 644 A 73 TYR HA A 76 GLN HB3 1.0 1.8 4.5 875 645 A 89 GLU HA A 89 GLU HGy 1.0 1.8 4.5 876 646 A 65 GLU HB2 A 66 LYS HD2 1.0 1.8 4.5 877 646 A 65 GLU HB3 A 66 LYS HD2 1.0 1.8 4.5 878 646 A 66 LYS HD3 A 65 GLU HB2 1.0 1.8 4.5 879 646 A 66 LYS HD3 A 65 GLU HB3 1.0 1.8 4.5 880 647 A 90 GLN HA A 93 ILE HB 1.0 1.8 2.8 881 648 A 76 GLN HA A 76 GLN HB2 1.0 1.8 3.5 882 648 A 76 GLN HA A 76 GLN HB3 1.0 1.8 3.5 883 649 A 31 GLU HA A 31 GLU HB2 1.0 1.8 2.8 884 649 A 31 GLU HB3 A 31 GLU HA 1.0 1.8 2.8 885 650 A 33 LYS HA A 36 GLU HB2 1.0 1.8 2.8 886 650 A 33 LYS HA A 36 GLU HB3 1.0 1.8 2.8 887 651 A 18 GLN HA A 18 GLN HB2 1.0 1.8 4.5 888 651 A 18 GLN HA A 18 GLN HB3 1.0 1.8 4.5 889 652 A 44 LEU HDy% A 74 LEU HG 1.0 1.8 4.5 890 653 A 102 GLN HA A 102 GLN HB2 1.0 1.8 3.5 891 653 A 102 GLN HA A 102 GLN HB3 1.0 1.8 3.5 892 654 A 70 VAL HGy% A 71 GLU HGy 1.0 1.8 4.5 893 655 A 52 ALA HA A 89 GLU HBx 1.0 1.8 4.5 894 656 A 99 VAL HGx% A 99 VAL HB 1.0 1.8 3.5 895 657 A 27 ALA HA A 30 GLN HB2 1.0 1.8 4.5 896 657 A 27 ALA HA A 30 GLN HB3 1.0 1.8 4.5 897 658 A 28 ALA HA A 31 GLU HB2 1.0 1.8 4.5 898 658 A 31 GLU HB3 A 28 ALA HA 1.0 1.8 4.5 899 659 A 52 ALA HB% A 92 LEU HBx 1.0 1.8 4.5 900 660 A 93 ILE HG2% A 93 ILE HB 1.0 1.8 4.5 901 661 A 74 LEU HDx% A 74 LEU HG 1.0 1.8 4.5 902 662 A 74 LEU HG A 48 LEU HDx% 1.0 1.8 4.5 903 663 A 74 LEU HDy% A 74 LEU HG 1.0 1.8 4.5 904 664 A 24 PRO HDx A 24 PRO HG2 1.0 1.8 4.5 905 664 A 24 PRO HG3 A 24 PRO HDx 1.0 1.8 4.5 906 665 A 24 PRO HDy A 24 PRO HG2 1.0 1.8 4.5 907 665 A 24 PRO HG3 A 24 PRO HDy 1.0 1.8 4.5 908 666 A 95 ILE HD1% A 95 ILE HB 1.0 1.8 4.5 909 667 A 64 PRO HA A 64 PRO HBy 1.0 1.8 3.5 910 668 A 24 PRO HA A 24 PRO HBy 1.0 1.8 3.5 911 669 A 92 LEU HA A 95 ILE HB 1.0 1.8 4.5 912 670 A 95 ILE HG2% A 95 ILE HB 1.0 1.8 4.5 913 671 A 89 GLU HBy A 89 GLU HGy 1.0 1.8 3.5 914 672 A 109 VAL HA A 109 VAL HB 1.0 1.8 4.5 915 673 A 89 GLU HA A 89 GLU HBy 1.0 1.8 4.5 916 674 A 10 ARG HBx A 10 ARG HD2 1.0 1.8 2.8 917 674 A 10 ARG HD3 A 10 ARG HBx 1.0 1.8 2.8 918 675 A 85 GLU HBy A 85 GLU HG2 1.0 1.8 3.5 919 675 A 85 GLU HBy A 85 GLU HG3 1.0 1.8 3.5 920 676 A 82 GLN HB2 A 82 GLN HG2 1.0 1.8 4.5 921 676 A 82 GLN HB3 A 82 GLN HG2 1.0 1.8 4.5 922 676 A 82 GLN HG3 A 82 GLN HB2 1.0 1.8 4.5 923 676 A 82 GLN HG3 A 82 GLN HB3 1.0 1.8 4.5 924 677 A 75 ILE HA A 75 ILE HB 1.0 1.8 4.5 925 678 A 89 GLU HGx A 89 GLU HBy 1.0 1.8 2.8 926 679 A 10 ARG HBx A 10 ARG HG2 1.0 1.8 3.5 927 679 A 10 ARG HG3 A 10 ARG HBx 1.0 1.8 3.5 928 680 A 66 LYS HBx A 66 LYS HD2 1.0 1.8 3.5 929 680 A 66 LYS HD3 A 66 LYS HBx 1.0 1.8 3.5 930 681 A 10 ARG HA A 10 ARG HBx 1.0 1.8 2.8 931 682 A 55 ARG HA A 55 ARG HB2 1.0 1.8 2.8 932 682 A 55 ARG HB3 A 55 ARG HA 1.0 1.8 2.8 933 683 A 82 GLN HA A 82 GLN HB2 1.0 1.8 3.5 934 683 A 82 GLN HB3 A 82 GLN HA 1.0 1.8 3.5 935 684 A 52 ALA HA A 55 ARG HB2 1.0 1.8 4.5 936 684 A 52 ALA HA A 55 ARG HB3 1.0 1.8 4.5 937 685 A 85 GLU HBy A 85 GLU HA 1.0 1.8 3.5 938 686 A 32 ALA HA A 35 ARG HB2 1.0 1.8 4.5 939 686 A 32 ALA HA A 35 ARG HB3 1.0 1.8 4.5 940 687 A 75 ILE HG2% A 75 ILE HB 1.0 1.8 4.5 941 688 A 71 GLU HA A 71 GLU HBy 1.0 1.8 4.5 942 689 A 56 LEU HDy% A 56 LEU HBx 1.0 1.8 4.5 943 690 A 72 ASN HA A 75 ILE HB 1.0 1.8 3.5 944 691 A 11 ARG HBx A 8 ALA HA 1.0 1.8 3.5 945 692 A 60 ALA HB% A 61 LEU HBx 1.0 1.8 4.5 946 693 A 98 LYS HDx A 98 LYS HB2 1.0 1.8 3.5 947 693 A 98 LYS HB3 A 98 LYS HDx 1.0 1.8 3.5 948 694 A 53 ARG HBy A 53 ARG HGy 1.0 1.8 2.8 949 695 A 33 LYS HGx A 33 LYS HB2 1.0 1.8 3.5 950 695 A 33 LYS HB3 A 33 LYS HGx 1.0 1.8 3.5 951 696 A 68 LYS HB2 A 68 LYS HG2 1.0 1.8 3.5 952 696 A 68 LYS HB3 A 68 LYS HG2 1.0 1.8 3.5 953 696 A 68 LYS HG3 A 68 LYS HB2 1.0 1.8 3.5 954 696 A 68 LYS HG3 A 68 LYS HB3 1.0 1.8 3.5 955 697 A 56 LEU HDx% A 59 LEU HBx 1.0 1.8 4.5 956 698 A 58 ASN HA A 61 LEU HBx 1.0 1.8 4.5 957 699 A 43 ILE HG2% A 43 ILE HB 1.0 1.8 4.5 958 700 A 95 ILE HD1% A 95 ILE HG1x 1.0 1.8 4.5 959 701 A 95 ILE HA A 98 LYS HB2 1.0 1.8 4.5 960 701 A 95 ILE HA A 98 LYS HB3 1.0 1.8 4.5 961 702 A 40 ARG HA A 40 ARG HB2 1.0 1.8 2.8 962 702 A 40 ARG HB3 A 40 ARG HA 1.0 1.8 2.8 963 703 A 44 LEU HA A 44 LEU HG 1.0 1.8 3.5 964 704 A 44 LEU HDy% A 44 LEU HG 1.0 1.8 3.5 965 705 A 95 ILE HG2% A 95 ILE HG1x 1.0 1.8 4.5 966 706 A 48 LEU HG A 48 LEU HDy% 1.0 1.8 4.5 967 707 A 59 LEU HA A 59 LEU HBx 1.0 1.8 3.5 968 708 A 48 LEU HG A 48 LEU HDx% 1.0 1.8 4.5 969 709 A 6 LEU HA A 6 LEU HBx 1.0 1.8 4.5 970 710 A 20 LYS HBx A 20 LYS HA 1.0 1.8 3.5 971 711 A 3 ASP HA A 6 LEU HBx 1.0 1.8 4.5 972 712 A 10 ARG HBy A 10 ARG HD2 1.0 1.8 2.8 973 712 A 10 ARG HD3 A 10 ARG HBy 1.0 1.8 2.8 974 713 A 13 ARG HB3 A 13 ARG HG2 1.0 1.8 3.5 975 713 A 13 ARG HB2 A 13 ARG HG2 1.0 1.8 3.5 976 713 A 13 ARG HG3 A 13 ARG HB2 1.0 1.8 3.5 977 713 A 13 ARG HB3 A 13 ARG HG3 1.0 1.8 3.5 978 714 A 67 THR HG2% A 59 LEU HBx 1.0 1.8 4.5 979 715 A 79 ARG HBx A 79 ARG HD2 1.0 1.8 4.5 980 715 A 79 ARG HD3 A 79 ARG HBx 1.0 1.8 4.5 981 716 A 10 ARG HBy A 10 ARG HG2 1.0 1.8 2.8 982 716 A 10 ARG HG3 A 10 ARG HBy 1.0 1.8 2.8 983 717 A 79 ARG HBx A 79 ARG HG2 1.0 1.8 4.5 984 717 A 79 ARG HG3 A 79 ARG HBx 1.0 1.8 4.5 985 718 A 10 ARG HA A 10 ARG HBy 1.0 1.8 3.5 986 719 A 79 ARG HA A 79 ARG HBx 1.0 1.8 3.5 987 720 A 92 LEU HDy% A 55 ARG HGx 1.0 1.8 4.5 988 721 A 59 LEU HDx% A 66 LYS HBy 1.0 1.8 4.5 989 722 A 14 LEU HBy A 14 LEU HDx% 1.0 1.8 3.5 990 723 A 63 LYS HA A 63 LYS HBy 1.0 1.8 4.5 991 724 A 43 ILE HG1x A 43 ILE HD1% 1.0 1.8 4.5 992 725 A 43 ILE HB A 43 ILE HG1x 1.0 1.8 3.5 993 726 A 93 ILE HA A 96 LEU HB2 1.0 1.8 4.5 994 726 A 93 ILE HA A 96 LEU HB3 1.0 1.8 4.5 995 727 A 43 ILE HA A 43 ILE HG1x 1.0 1.8 4.5 996 728 A 96 LEU HDx% A 96 LEU HB2 1.0 1.8 3.5 997 728 A 96 LEU HDx% A 96 LEU HB3 1.0 1.8 3.5 998 729 A 96 LEU HA A 96 LEU HB2 1.0 1.8 4.5 999 729 A 96 LEU HA A 96 LEU HB3 1.0 1.8 4.5 1000 730 A 93 ILE HD1% A 93 ILE HG1x 1.0 1.8 4.5 1001 731 A 98 LYS HDx A 98 LYS HE2 1.0 1.8 2.8 1002 731 A 98 LYS HE3 A 98 LYS HDx 1.0 1.8 2.8 1003 732 A 93 ILE HB A 93 ILE HG1x 1.0 1.8 4.5 1004 733 A 63 LYS HBy A 63 LYS HG2 1.0 1.8 2.8 1005 733 A 63 LYS HG3 A 63 LYS HBy 1.0 1.8 2.8 1006 734 A 59 LEU HBy A 59 LEU HA 1.0 1.8 3.5 1007 735 A 93 ILE HG2% A 93 ILE HG1x 1.0 1.8 4.5 1008 736 A 13 ARG HD2 A 13 ARG HG2 1.0 1.8 4.5 1009 736 A 13 ARG HD3 A 13 ARG HG2 1.0 1.8 4.5 1010 736 A 13 ARG HG3 A 13 ARG HD2 1.0 1.8 4.5 1011 736 A 13 ARG HD3 A 13 ARG HG3 1.0 1.8 4.5 1012 737 A 66 LYS HE2 A 66 LYS HD2 1.0 1.8 4.5 1013 737 A 66 LYS HD3 A 66 LYS HE2 1.0 1.8 4.5 1014 738 A 66 LYS HE3 A 66 LYS HD2 1.0 1.8 4.5 1015 738 A 66 LYS HD3 A 66 LYS HE3 1.0 1.8 4.5 1016 739 A 97 LYS HD3 A 97 LYS HE2 1.0 1.8 4.5 1017 739 A 97 LYS HD2 A 97 LYS HE2 1.0 1.8 4.5 1018 739 A 97 LYS HE3 A 97 LYS HD2 1.0 1.8 4.5 1019 739 A 97 LYS HE3 A 97 LYS HD3 1.0 1.8 4.5 1020 740 A 33 LYS HB3 A 33 LYS HD2 1.0 1.8 3.5 1021 740 A 33 LYS HD3 A 33 LYS HB2 1.0 1.8 3.5 1022 740 A 33 LYS HB3 A 33 LYS HD3 1.0 1.8 3.5 1023 740 A 33 LYS HB2 A 33 LYS HD2 1.0 1.8 3.5 1024 741 A 33 LYS HD2 A 36 GLU HB2 1.0 1.8 4.5 1025 741 A 33 LYS HD3 A 36 GLU HB2 1.0 1.8 4.5 1026 741 A 36 GLU HB3 A 33 LYS HD2 1.0 1.8 4.5 1027 741 A 36 GLU HB3 A 33 LYS HD3 1.0 1.8 4.5 1028 742 A 92 LEU HDx% A 92 LEU HG 1.0 1.8 4.5 1029 743 A 55 ARG HA A 55 ARG HGx 1.0 1.8 2.8 1030 744 A 6 LEU HDy% A 6 LEU HBy 1.0 1.8 3.5 1031 745 A 14 LEU HBy A 14 LEU HA 1.0 1.8 2.8 1032 746 A 13 ARG HA A 13 ARG HG2 1.0 1.8 3.5 1033 746 A 13 ARG HA A 13 ARG HG3 1.0 1.8 3.5 1034 747 A 53 ARG HA A 53 ARG HGy 1.0 1.8 4.5 1035 748 A 11 ARG HA A 11 ARG HBy 1.0 1.8 2.8 1036 749 A 79 ARG HA A 79 ARG HBy 1.0 1.8 3.5 1037 750 A 79 ARG HBy A 79 ARG HD2 1.0 1.8 3.5 1038 750 A 79 ARG HD3 A 79 ARG HBy 1.0 1.8 3.5 1039 751 A 33 LYS HGx A 33 LYS HB2 1.0 1.8 2.8 1040 751 A 33 LYS HB3 A 33 LYS HGx 1.0 1.8 2.8 1041 752 A 79 ARG HBy A 79 ARG HG2 1.0 1.8 3.5 1042 752 A 79 ARG HG3 A 79 ARG HBy 1.0 1.8 3.5 1043 753 A 68 LYS HA A 68 LYS HD2 1.0 1.8 4.5 1044 753 A 68 LYS HA A 68 LYS HD3 1.0 1.8 4.5 1045 754 A 83 LEU HA A 83 LEU HB2 1.0 1.8 3.5 1046 754 A 83 LEU HA A 83 LEU HB3 1.0 1.8 3.5 1047 755 A 83 LEU HDy% A 83 LEU HG 1.0 1.8 3.5 1048 756 A 48 LEU HBy A 53 ARG HDy 1.0 1.8 3.5 1049 757 A 86 LYS HE3 A 86 LYS HG2 1.0 1.8 2.8 1050 757 A 86 LYS HE2 A 86 LYS HG2 1.0 1.8 2.8 1051 757 A 86 LYS HG3 A 86 LYS HE2 1.0 1.8 2.8 1052 757 A 86 LYS HG3 A 86 LYS HE3 1.0 1.8 2.8 1053 758 A 86 LYS HBx A 86 LYS HG2 1.0 1.8 2.8 1054 758 A 86 LYS HG3 A 86 LYS HBx 1.0 1.8 2.8 1055 759 A 20 LYS HBx A 20 LYS HGx 1.0 1.8 3.5 1056 760 A 33 LYS HGy A 36 GLU HB2 1.0 1.8 4.5 1057 760 A 36 GLU HB3 A 33 LYS HGy 1.0 1.8 4.5 1058 761 A 47 VAL HA A 83 LEU HG 1.0 1.8 4.5 1059 762 A 45 ALA HB% A 42 SER HA 1.0 1.8 4.5 1060 763 A 40 ARG HA A 40 ARG HG2 1.0 1.8 4.5 1061 763 A 40 ARG HG3 A 40 ARG HA 1.0 1.8 4.5 1062 764 A 66 LYS HA A 66 LYS HG2 1.0 1.8 3.5 1063 764 A 66 LYS HA A 66 LYS HG3 1.0 1.8 3.5 1064 765 A 34 HIS HA A 37 ALA HB% 1.0 1.8 4.5 1065 766 A 32 ALA HB% A 29 GLN HA 1.0 1.8 4.5 1066 767 A 92 LEU HA A 92 LEU HBy 1.0 1.8 4.5 1067 768 A 86 LYS HA A 86 LYS HG2 1.0 1.8 3.5 1068 768 A 86 LYS HG3 A 86 LYS HA 1.0 1.8 3.5 1069 769 A 8 ALA HA A 8 ALA HB% 1.0 1.8 3.5 1070 770 A 60 ALA HB% A 60 ALA HA 1.0 1.8 4.5 1071 771 A 49 ASP HA A 86 LYS HG2 1.0 1.8 4.5 1072 771 A 86 LYS HG3 A 49 ASP HA 1.0 1.8 4.5 1073 772 A 98 LYS HGx A 98 LYS HB2 1.0 1.8 4.5 1074 772 A 98 LYS HB3 A 98 LYS HGx 1.0 1.8 4.5 1075 773 A 33 LYS HGy A 33 LYS HD2 1.0 1.8 2.8 1076 773 A 33 LYS HGy A 33 LYS HD3 1.0 1.8 2.8 1077 774 A 27 ALA HA A 27 ALA HB% 1.0 1.8 2.8 1078 775 A 28 ALA HA A 28 ALA HB% 1.0 1.8 3.5 1079 776 A 63 LYS HBx A 63 LYS HG2 1.0 1.8 4.5 1080 776 A 63 LYS HG3 A 63 LYS HBx 1.0 1.8 4.5 1081 777 A 40 ARG HG3 A 75 ILE HG1x 1.0 1.8 4.5 1082 777 A 40 ARG HG2 A 75 ILE HG1x 1.0 1.8 4.5 1083 777 A 75 ILE HG1y A 40 ARG HG2 1.0 1.8 4.5 1084 777 A 75 ILE HG1y A 40 ARG HG3 1.0 1.8 4.5 1085 778 A 2 ALA HA A 2 ALA HB% 1.0 1.8 4.5 1086 779 A 63 LYS HA A 63 LYS HG2 1.0 1.8 4.5 1087 779 A 63 LYS HG3 A 63 LYS HA 1.0 1.8 4.5 1088 780 A 52 ALA HB% A 52 ALA HA 1.0 1.8 4.5 1089 781 A 19 ALA HB% A 19 ALA HA 1.0 1.8 4.5 1090 782 A 97 LYS HA A 97 LYS HG2 1.0 1.8 4.5 1091 782 A 97 LYS HG3 A 97 LYS HA 1.0 1.8 4.5 1092 783 A 93 ILE HD1% A 93 ILE HG1y 1.0 1.8 4.5 1093 784 A 79 ARG HBx A 79 ARG HG2 1.0 1.8 4.5 1094 784 A 79 ARG HG3 A 79 ARG HBx 1.0 1.8 4.5 1095 785 A 79 ARG HA A 79 ARG HG2 1.0 1.8 4.5 1096 785 A 79 ARG HA A 79 ARG HG3 1.0 1.8 4.5 1097 786 A 107 THR HB A 107 THR HG2% 1.0 1.8 3.5 1098 787 A 108 THR HG2% A 108 THR HA 1.0 1.8 4.5 1099 788 A 106 THR HG2% A 106 THR HA 1.0 1.8 4.5 1100 789 A 67 THR HA A 67 THR HG2% 1.0 1.8 4.5 1101 790 A 43 ILE HG1y A 43 ILE HD1% 1.0 1.8 4.5 1102 791 A 43 ILE HB A 43 ILE HG1y 1.0 1.8 4.5 1103 792 A 43 ILE HA A 43 ILE HG1y 1.0 1.8 4.5 1104 793 A 43 ILE HG2% A 43 ILE HG1y 1.0 1.8 4.5 1105 794 A 75 ILE HA A 43 ILE HG1y 1.0 1.8 4.5 1106 795 A 43 ILE HG1y A 75 ILE HG1x 1.0 1.8 4.5 1107 795 A 75 ILE HG1y A 43 ILE HG1y 1.0 1.8 4.5 1108 796 A 95 ILE HA A 95 ILE HG1y 1.0 1.8 4.5 1109 797 A 62 VAL HGx% A 62 VAL HB 1.0 1.8 3.5 1110 798 A 62 VAL HA A 62 VAL HGx% 1.0 1.8 4.5 1111 799 A 61 LEU HDx% A 61 LEU HBx 1.0 1.8 4.5 1112 800 A 87 VAL HGy% A 87 VAL HA 1.0 1.8 3.5 1113 801 A 74 LEU HDy% A 74 LEU HBy 1.0 1.8 4.5 1114 802 A 47 VAL HB A 47 VAL HG1% 1.0 1.8 4.5 1115 802 A 47 VAL HG2% A 47 VAL HB 1.0 1.8 4.5 1116 803 A 87 VAL HB A 87 VAL HGy% 1.0 1.8 3.5 1117 804 A 44 LEU HA A 47 VAL HG1% 1.0 1.8 4.5 1118 804 A 47 VAL HG2% A 44 LEU HA 1.0 1.8 4.5 1119 805 A 56 LEU HA A 56 LEU HDx% 1.0 1.8 4.5 1120 806 A 83 LEU HDx% A 83 LEU HB2 1.0 1.8 4.5 1121 806 A 83 LEU HDx% A 83 LEU HB3 1.0 1.8 4.5 1122 807 A 74 LEU HDy% A 74 LEU HBx 1.0 1.8 4.5 1123 808 A 6 LEU HDx% A 6 LEU HBx 1.0 1.8 3.5 1124 809 A 92 LEU HDx% A 92 LEU HBy 1.0 1.8 4.5 1125 810 A 93 ILE HG2% A 93 ILE HB 1.0 1.8 4.5 1126 811 A 70 VAL HGy% A 70 VAL HB 1.0 1.8 4.5 1127 812 A 93 ILE HG2% A 93 ILE HA 1.0 1.8 4.5 1128 813 A 93 ILE HG2% A 93 ILE HG1x 1.0 1.8 4.5 1129 814 A 74 LEU HDy% A 74 LEU HG 1.0 1.8 4.5 1130 815 A 93 ILE HG2% A 90 GLN HA 1.0 1.8 4.5 1131 816 A 92 LEU HDx% A 92 LEU HA 1.0 1.8 4.5 1132 817 A 95 ILE HG2% A 95 ILE HD1% 1.0 1.8 4.5 1133 818 A 14 LEU HBy A 14 LEU HDy% 1.0 1.8 3.5 1134 819 A 95 ILE HD1% A 95 ILE HB 1.0 1.8 4.5 1135 820 A 95 ILE HD1% A 95 ILE HG1x 1.0 1.8 4.5 1136 821 A 83 LEU HDx% A 83 LEU HG 1.0 1.8 4.5 1137 822 A 14 LEU HA A 14 LEU HDy% 1.0 1.8 4.0 1138 823 A 83 LEU HA A 83 LEU HDy% 1.0 1.8 4.5 1139 824 A 75 ILE HG2% A 75 ILE HB 1.0 1.8 4.5 1140 825 A 75 ILE HA A 75 ILE HG2% 1.0 1.8 4.5 1141 826 A 75 ILE HG2% A 75 ILE HG1x 1.0 1.8 4.5 1142 826 A 75 ILE HG2% A 75 ILE HG1y 1.0 1.8 4.5 1143 827 A 59 LEU HDx% A 59 LEU HA 1.0 1.8 4.5 1144 828 A 41 ASN HA A 44 LEU HDx% 1.0 1.8 4.5 1145 829 A 53 ARG HDy A 48 LEU HDy% 1.0 1.8 4.5 1146 830 A 74 LEU HDx% A 74 LEU HBx 1.0 1.8 4.5 1147 831 A 44 LEU HDy% A 44 LEU HBx 1.0 1.8 4.5 1148 832 A 44 LEU HDx% A 44 LEU HBy 1.0 1.8 4.5 1149 833 A 43 ILE HG2% A 43 ILE HB 1.0 1.8 4.5 1150 834 A 43 ILE HG2% A 43 ILE HA 1.0 1.8 4.5 1151 835 A 43 ILE HG1x A 43 ILE HD1% 1.0 1.8 3.5 1152 836 A 43 ILE HG2% A 43 ILE HG1y 1.0 1.8 4.5 1153 837 A 44 LEU HDx% A 44 LEU HG 1.0 1.8 3.5 1154 838 A 44 LEU HDy% A 71 GLU HA 1.0 1.8 4.5 1155 839 A 43 ILE HD1% A 40 ARG HA 1.0 1.8 4.5 1156 840 A 48 LEU HA A 48 LEU HDx% 1.0 1.8 4.5 1157 841 A 83 LEU HDy% A 78 ALA HB% 1.0 1.8 4.5 1158 842 A 96 LEU HDx% A 96 LEU HB2 1.0 1.8 4.5 1159 842 A 96 LEU HDx% A 96 LEU HB3 1.0 1.8 4.5 1160 843 A 93 ILE HD1% A 93 ILE HB 1.0 1.8 4.5 1161 844 A 99 VAL HGx% A 70 VAL HA 1.0 1.8 4.5 1162 845 A 99 VAL HGx% A 99 VAL HB 1.0 1.8 3.5 1163 846 A 93 ILE HD1% A 93 ILE HA 1.0 1.8 4.5 1164 847 A 99 VAL HGx% A 99 VAL HA 1.0 1.8 4.5 1165 848 A 93 ILE HD1% A 93 ILE HG1y 1.0 1.8 4.5 1166 849 A 96 LEU HDx% A 96 LEU HG 1.0 1.8 3.5 1167 850 A 93 ILE HD1% A 90 GLN HA 1.0 1.8 4.5 1168 851 A 96 LEU HDx% A 96 LEU HA 1.0 1.8 4.5 1169 852 A 74 LEU HDx% A 74 LEU HA 1.0 1.8 4.5 1170 853 A 99 VAL HGx% A 70 VAL HGx% 1.0 1.8 4.5 1171 854 A 95 ILE HG2% A 95 ILE HB 1.0 1.8 4.5 1172 855 A 95 ILE HG2% A 95 ILE HA 1.0 1.8 4.5 1173 856 A 93 ILE HD1% A 93 ILE HG2% 1.0 1.8 4.5 1174 857 A 48 LEU HBy A 53 ARG HDx 1.0 1.8 3.5 1175 858 A 74 LEU HA A 74 LEU HBx 1.0 1.8 4.5 1176 859 A 66 LYS HE2 A 66 LYS HBx 1.0 1.8 4.5 1177 860 A 66 LYS HE3 A 66 LYS HBx 1.0 1.8 4.5 1178 861 A 92 LEU HBx A 92 LEU HG 1.0 1.8 4.5 1179 862 A 92 LEU HA A 92 LEU HBy 1.0 1.8 4.5 1180 863 A 44 LEU HA A 44 LEU HBx 1.0 1.8 4.5 1181 864 A 55 ARG HA A 58 ASN HBy 1.0 1.8 4.5 1182 865 A 73 TYR HBx A 70 VAL HA 1.0 1.8 4.5 1183 866 A 95 ILE HB A 95 ILE HG1x 1.0 1.8 4.5 1184 867 A 75 ILE HA A 75 ILE HB 1.0 1.8 4.5 1185 868 A 92 LEU HA A 95 ILE HB 1.0 1.8 4.5 1186 869 A 93 ILE HG1y A 93 ILE HB 1.0 1.8 4.5 1187 870 A 71 GLU HGx A 71 GLU HBy 1.0 1.8 4.5 1188 871 A 71 GLU HGx A 71 GLU HBx 1.0 1.8 4.5 1189 872 A 55 ARG HGy A 89 GLU HGy 1.0 1.8 4.5 1190 873 A 71 GLU HA A 71 GLU HGy 1.0 1.8 4.5 1191 874 A 73 TYR HBx A 70 VAL HA 1.0 1.8 4.5 1192 875 A 70 VAL HGy% A 70 VAL HA 1.0 1.8 4.5 1193 876 A 87 VAL HB A 48 LEU HDy% 1.0 1.8 4.5 1194 877 A 70 VAL HGx% A 70 VAL HB 1.0 1.8 4.5 1195 878 A 43 ILE HA A 43 ILE HB 1.0 1.8 4.5 1196 879 A 87 VAL HB A 87 VAL HA 1.0 1.8 4.5 1197 880 A 95 ILE HA A 95 ILE HG1y 1.0 1.8 4.5 1198 881 A 52 ALA HA A 55 ARG HB2 1.0 1.8 4.5 1199 881 A 52 ALA HA A 55 ARG HB3 1.0 1.8 4.5 1200 882 A 55 ARG HA A 55 ARG HB2 1.0 1.8 4.5 1201 882 A 55 ARG HB3 A 55 ARG HA 1.0 1.8 4.5 1202 883 A 55 ARG HGy A 55 ARG HB2 1.0 1.8 4.5 1203 883 A 55 ARG HB3 A 55 ARG HGy 1.0 1.8 4.5 1204 884 A 11 ARG HDy A 7 GLU HB2 1.0 1.8 4.5 1205 884 A 11 ARG HDy A 7 GLU HB3 1.0 1.8 4.5 1206 885 A 93 ILE HA A 93 ILE HG1y 1.0 1.8 4.5 1207 886 A 93 ILE HA A 93 ILE HG1x 1.0 1.8 4.5 1208 887 A 44 LEU HA A 43 ILE HG1x 1.0 1.8 4.5 1209 888 A 43 ILE HB A 43 ILE HG1y 1.0 1.8 4.5 1210 889 A 89 GLU HGy A 51 SER HBy 1.0 1.8 4.5 1211 890 A 51 SER HBx A 89 GLU HGy 1.0 1.8 4.5 1212 891 A 89 GLU HBy A 51 SER HBx 1.0 1.8 4.5 1213 892 A 89 GLU HA A 89 GLU HGx 1.0 1.8 4.5 1214 893 A 96 LEU HA A 96 LEU HG 1.0 1.8 4.5 1215 894 A 64 PRO HBx A 64 PRO HG2 1.0 1.8 3.5 1216 894 A 64 PRO HBx A 64 PRO HG3 1.0 1.8 3.5 1217 895 A 74 LEU HDy% A 74 LEU HDx% 1.0 1.8 4.5 1218 896 A 92 LEU HDx% A 92 LEU HG 1.0 1.8 4.5 1219 897 A 24 PRO HDx A 24 PRO HG2 1.0 1.8 4.5 1220 897 A 24 PRO HG3 A 24 PRO HDx 1.0 1.8 4.5 1221 898 A 44 LEU HA A 44 LEU HG 1.0 1.8 4.5 1222 899 A 71 GLU HA A 71 GLU HGy 1.0 1.8 4.5 1223 900 A 44 LEU HDx% A 44 LEU HG 1.0 1.8 4.5 1224 901 A 65 GLU HA A 65 GLU HB2 1.0 1.8 2.8 1225 901 A 65 GLU HA A 65 GLU HB3 1.0 1.8 2.8 1226 902 A 65 GLU HA A 68 LYS HB2 1.0 1.8 4.5 1227 902 A 65 GLU HA A 68 LYS HB3 1.0 1.8 4.5 1228 903 A 7 GLU HA A 7 GLU HG2 1.0 1.8 4.5 1229 903 A 7 GLU HG3 A 7 GLU HA 1.0 1.8 4.5 1230 904 A 98 LYS HGy A 98 LYS HA 1.0 1.8 4.5 1231 905 A 33 LYS HA A 33 LYS HGy 1.0 1.8 4.5 1232 906 A 61 LEU HDx% A 61 LEU HBy 1.0 1.8 4.5 1233 907 A 61 LEU HDx% A 61 LEU HBx 1.0 1.8 3.5 1234 908 A 48 LEU HBy A 48 LEU HDx% 1.0 1.8 4.5 1235 909 A 92 LEU HA A 92 LEU HG 1.0 1.8 4.5 1236 910 A 62 VAL HGx% A 59 LEU HA 1.0 1.8 4.5 1237 911 A 17 LEU HA A 17 LEU HBx 1.0 1.8 3.5 1238 912 A 105 LYS HA A 105 LYS HGy 1.0 1.8 4.5 1239 913 A 102 GLN HA A 101 GLN HB2 1.0 1.8 4.5 1240 913 A 102 GLN HA A 101 GLN HB3 1.0 1.8 4.5 1241 914 A 61 LEU HDx% A 61 LEU HA 1.0 1.8 4.5 1242 915 A 17 LEU HDy% A 17 LEU HA 1.0 1.8 3.5 1243 916 A 61 LEU HA A 61 LEU HBy 1.0 1.8 2.8 1244 917 A 41 ASN HA A 41 ASN HBx 1.0 1.8 4.5 1245 918 A 61 LEU HA A 61 LEU HBx 1.0 1.8 3.5 1246 919 A 3 ASP HA A 3 ASP HBy 1.0 1.8 4.5 1247 920 A 3 ASP HA A 6 LEU HBy 1.0 1.8 4.5 1248 921 A 69 ALA HA A 69 ALA HB% 1.0 1.8 3.5 1249 922 A 69 ALA HA A 72 ASN HBy 1.0 1.8 4.5 1250 923 A 107 THR HA A 107 THR HG2% 1.0 1.8 4.5 1251 924 A 53 ARG HDy A 45 ALA HA 1.0 1.8 4.5 1252 925 A 48 LEU HBy A 48 LEU HA 1.0 1.8 4.5 1253 926 A 48 LEU HA A 48 LEU HG 1.0 1.8 4.5 1254 927 A 48 LEU HA A 87 VAL HB 1.0 1.8 4.5 1255 928 A 63 LYS HA A 63 LYS HBx 1.0 1.8 4.5 1256 929 A 52 ALA HB% A 51 SER HBx 1.0 1.8 4.5 1257 930 A 19 ALA HB% A 19 ALA HA 1.0 1.8 3.5 1258 931 A 23 ASP HA A 24 PRO HDy 1.0 1.8 3.5 1259 932 A 64 PRO HBx A 64 PRO HDy 1.0 1.8 4.5 1260 933 A 56 LEU HDx% A 56 LEU HBx 1.0 1.8 4.5 1261 934 A 61 LEU HA A 61 LEU HBy 1.0 1.8 2.8 1262 935 A 75 ILE HA A 75 ILE HG1x 1.0 1.8 4.5 1263 935 A 75 ILE HA A 75 ILE HG1y 1.0 1.8 4.5 1264 936 A 95 ILE HA A 95 ILE HB 1.0 1.8 4.5 1265 937 A 41 ASN HA A 41 ASN HBy 1.0 1.8 3.5 1266 938 A 72 ASN HA A 72 ASN HBy 1.0 1.8 3.5 1267 939 A 50 GLN HA A 50 GLN HBx 1.0 1.8 3.5 1268 940 A 33 LYS HA A 33 LYS HGx 1.0 1.8 4.5 1269 941 A 4 GLU HA A 4 GLU HG2 1.0 1.8 4.5 1270 941 A 4 GLU HG3 A 4 GLU HA 1.0 1.8 4.5 1271 942 A 33 LYS HA A 36 GLU HGy 1.0 1.8 4.0 1272 943 A 18 GLN HA A 18 GLN HGx 1.0 1.8 4.5 1273 944 A 9 LEU HBx A 9 LEU HA 1.0 1.8 3.5 1274 945 A 6 LEU HA A 6 LEU HBx 1.0 1.8 3.5 1275 946 A 17 LEU HA A 17 LEU HBx 1.0 1.8 3.3 1276 947 A 47 VAL HA A 47 VAL HG1% 1.0 1.8 4.5 1277 947 A 47 VAL HG2% A 47 VAL HA 1.0 1.8 4.5 1278 948 A 89 GLU HA A 89 GLU HBx 1.0 1.8 4.5 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 80 TYR HD% A 80 TYR HA 1.0 1.8 4.5 2 2 A 80 TYR HE% A 80 TYR HA 1.0 1.8 5.5 3 3 A 73 TYR HD% A 73 TYR HA 1.0 1.8 4.5 4 4 A 73 TYR HE% A 73 TYR HA 1.0 1.8 5.5 5 5 A 73 TYR HD% A 74 LEU HA 1.0 1.8 5.5 6 6 A 80 TYR HE% A 76 GLN HA 1.0 1.8 5.5 7 7 A 73 TYR HD% A 70 VAL HA 1.0 1.8 5.5 8 8 A 80 TYR HBx A 80 TYR HD% 1.0 1.8 4.5 9 9 A 73 TYR HE% A 73 TYR HBx 1.0 1.8 5.5 10 10 A 73 TYR HBy A 73 TYR HE% 1.0 1.8 5.5 11 11 A 80 TYR HD% A 80 TYR HBy 1.0 1.8 4.5 12 12 A 73 TYR HD% A 70 VAL HB 1.0 1.8 5.5 13 13 A 80 TYR HD% A 77 MET HBx 1.0 1.8 5.5 14 14 A 73 TYR HE% A 77 MET HBx 1.0 1.8 4.5 15 15 A 73 TYR HD% A 76 GLN HB2 1.0 1.8 4.5 16 15 A 73 TYR HD% A 76 GLN HB3 1.0 1.8 4.5 17 16 A 80 TYR HE% A 76 GLN HB2 1.0 1.8 4.5 18 16 A 80 TYR HE% A 76 GLN HB3 1.0 1.8 4.5 19 17 A 73 TYR HE% A 104 GLU HBy 1.0 1.8 4.5 20 18 A 73 TYR HD% A 95 ILE HG1x 1.0 1.8 5.5 21 19 A 73 TYR HE% A 95 ILE HG1x 1.0 1.8 4.5 22 20 A 80 TYR HE% A 79 ARG HBy 1.0 1.8 4.5 23 21 A 73 TYR HD% A 95 ILE HD1% 1.0 1.8 4.5 24 22 A 95 ILE HD1% A 73 TYR HE% 1.0 1.8 4.5 25 23 A 73 TYR HD% A 95 ILE HG2% 1.0 1.8 4.5 26 24 A 95 ILE HG2% A 73 TYR HE% 1.0 1.8 5.5 27 25 A 73 TYR HD% A 95 ILE HB 1.0 1.8 4.5 28 26 A 80 TYR HD% A 77 MET HA 1.0 1.8 5.5 29 27 A 80 TYR HD% A 76 GLN HB2 1.0 1.8 5.5 30 27 A 80 TYR HD% A 76 GLN HB3 1.0 1.8 5.5 31 28 A 80 TYR HD% A 79 ARG HBy 1.0 1.8 5.5 32 29 A 80 TYR HD% A 79 ARG HBx 1.0 1.8 5.5 33 30 A 73 TYR HE% A 77 MET HA 1.0 1.8 5.5 34 31 A 80 TYR HE% A 80 TYR HBy 1.0 1.8 5.5 35 32 A 80 TYR HE% A 80 TYR HBx 1.0 1.8 5.5 36 33 A 73 TYR HD% A 73 TYR HE% 1.0 1.8 2.8 37 34 A 80 TYR HE% A 80 TYR HD% 1.0 1.8 2.8 38 35 A 73 TYR HD% A 73 TYR HE% 1.0 1.8 2.8 39 36 A 80 TYR HE% A 80 TYR HD% 1.0 1.8 3.5 40 37 A 73 TYR HD% A 73 TYR HBx 1.0 1.8 3.5 41 38 A 73 TYR HD% A 73 TYR HBy 1.0 1.8 3.5 42 39 A 1 SER HA A 1 SER H 1.0 1.8 5.5 43 40 A 1 SER H A 4 GLU HB2 1.0 1.8 5.5 44 40 A 4 GLU HB3 A 1 SER H 1.0 1.8 5.5 45 41 A 6 LEU H A 5 GLU HG2 1.0 1.8 5.5 46 41 A 6 LEU H A 5 GLU HG3 1.0 1.8 5.5 47 42 A 10 ARG H A 10 ARG HD2 1.0 1.8 5.5 48 42 A 10 ARG HD3 A 10 ARG H 1.0 1.8 5.5 49 43 A 11 ARG HDy A 11 ARG H 1.0 1.8 5.5 50 44 A 11 ARG H A 11 ARG HDx 1.0 1.8 5.5 51 45 A 11 ARG H A 12 GLN HB2 1.0 1.8 5.5 52 45 A 12 GLN HB3 A 11 ARG H 1.0 1.8 5.5 53 46 A 9 LEU HDy% A 13 ARG H 1.0 1.8 5.5 54 47 A 14 LEU H A 13 ARG HD2 1.0 1.8 5.5 55 47 A 13 ARG HD3 A 14 LEU H 1.0 1.8 5.5 56 48 A 13 ARG H A 15 ALA H 1.0 1.8 5.5 57 49 A 14 LEU HDx% A 15 ALA H 1.0 1.8 5.5 58 50 A 16 GLU HGx A 15 ALA H 1.0 1.8 5.5 59 51 A 16 GLU HGy A 15 ALA H 1.0 1.8 5.5 60 52 A 17 LEU HDy% A 18 GLN H 1.0 1.8 5.5 61 53 A 17 LEU HDy% A 17 LEU H 1.0 1.8 5.5 62 54 A 17 LEU HDx% A 19 ALA H 1.0 1.8 5.5 63 55 A 18 GLN HGx A 19 ALA H 1.0 1.8 5.5 64 56 A 20 LYS HA A 22 GLY H 1.0 1.8 5.5 65 57 A 21 HIS HBx A 22 GLY H 1.0 1.8 5.5 66 58 A 20 LYS HBx A 22 GLY H 1.0 1.8 5.5 67 59 A 23 ASP HBx A 22 GLY H 1.0 1.8 5.5 68 60 A 22 GLY H A 20 LYS HBy 1.0 1.8 5.5 69 61 A 20 LYS HGx A 22 GLY H 1.0 1.8 5.5 70 62 A 25 GLY H A 27 ALA H 1.0 1.8 5.5 71 63 A 23 ASP HA A 25 GLY H 1.0 1.8 5.5 72 64 A 27 ALA H A 29 GLN HG2 1.0 1.8 5.5 73 64 A 29 GLN HG3 A 27 ALA H 1.0 1.8 5.5 74 65 A 5 GLU H A 1 SER HBx 1.0 1.8 5.5 75 66 A 75 ILE HA A 79 ARG H 1.0 1.8 5.5 76 67 A 79 ARG H A 79 ARG HD2 1.0 1.8 5.5 77 67 A 79 ARG HD3 A 79 ARG H 1.0 1.8 5.5 78 68 A 56 LEU H A 53 ARG H 1.0 1.8 5.5 79 69 A 86 LYS H A 86 LYS HE2 1.0 1.8 5.5 80 69 A 86 LYS HE3 A 86 LYS H 1.0 1.8 5.5 81 70 A 35 ARG H A 35 ARG HD2 1.0 1.8 5.5 82 70 A 35 ARG HD3 A 35 ARG H 1.0 1.8 5.5 83 71 A 49 ASP HBy A 86 LYS H 1.0 1.8 6.0 84 72 A 34 HIS HA A 36 GLU H 1.0 1.8 5.5 85 73 A 36 GLU H A 33 LYS HD2 1.0 1.8 5.5 86 73 A 33 LYS HD3 A 36 GLU H 1.0 1.8 5.5 87 74 A 34 HIS HA A 38 GLU H 1.0 1.8 5.5 88 75 A 43 ILE HG2% A 42 SER H 1.0 1.8 5.5 89 76 A 43 ILE HG1y A 42 SER H 1.0 1.8 5.5 90 77 A 45 ALA HB% A 42 SER H 1.0 1.8 5.5 91 78 A 44 LEU H A 46 GLN H 1.0 1.8 5.5 92 79 A 43 ILE HG1y A 44 LEU H 1.0 1.8 5.5 93 80 A 45 ALA H A 43 ILE H 1.0 1.8 5.5 94 81 A 41 ASN HA A 45 ALA H 1.0 1.8 5.5 95 82 A 45 ALA H A 47 VAL HG1% 1.0 1.8 5.5 96 82 A 47 VAL HG2% A 45 ALA H 1.0 1.8 5.5 97 83 A 44 LEU H A 46 GLN H 1.0 1.8 5.5 98 84 A 43 ILE HG2% A 46 GLN H 1.0 1.8 5.5 99 85 A 46 GLN H A 47 VAL HG1% 1.0 1.8 5.5 100 85 A 47 VAL HG2% A 46 GLN H 1.0 1.8 5.5 101 86 A 72 ASN HD2y A 72 ASN H 1.0 1.8 5.5 102 87 A 44 LEU HA A 47 VAL H 1.0 1.8 5.5 103 88 A 45 ALA HA A 47 VAL H 1.0 1.8 5.5 104 89 A 43 ILE HA A 47 VAL H 1.0 1.8 5.5 105 90 A 43 ILE HG2% A 47 VAL H 1.0 1.8 6.0 106 91 A 46 GLN HGx A 47 VAL H 1.0 1.8 5.5 107 92 A 48 LEU H A 47 VAL HG1% 1.0 1.8 5.5 108 92 A 47 VAL HG2% A 48 LEU H 1.0 1.8 5.5 109 93 A 49 ASP H A 87 VAL H 1.0 1.8 5.5 110 94 A 49 ASP H A 88 SER H 1.0 1.8 5.5 111 95 A 86 LYS HA A 49 ASP H 1.0 1.8 5.5 112 96 A 87 VAL HGy% A 49 ASP H 1.0 1.8 5.5 113 97 A 86 LYS HBx A 49 ASP H 1.0 1.8 5.5 114 98 A 50 GLN H A 52 ALA H 1.0 1.8 5.5 115 99 A 50 GLN H A 86 LYS HG2 1.0 1.8 5.5 116 99 A 86 LYS HG3 A 50 GLN H 1.0 1.8 5.5 117 100 A 86 LYS HBx A 50 GLN H 1.0 1.8 5.5 118 101 A 93 ILE HD1% A 90 GLN H 1.0 1.8 5.5 119 102 A 87 VAL HGx% A 90 GLN H 1.0 1.8 5.5 120 103 A 52 ALA HB% A 90 GLN H 1.0 1.8 6.0 121 104 A 54 ALA HB% A 51 SER H 1.0 1.8 6.0 122 105 A 90 GLN H A 93 ILE H 1.0 1.8 5.5 123 106 A 52 ALA H A 54 ALA H 1.0 1.8 5.5 124 107 A 49 ASP HA A 52 ALA H 1.0 1.8 5.5 125 108 A 89 GLU HA A 52 ALA H 1.0 1.8 5.5 126 109 A 52 ALA H A 48 LEU HDy% 1.0 1.8 5.5 127 110 A 92 LEU HDy% A 52 ALA H 1.0 1.8 5.5 128 111 A 48 LEU HBx A 52 ALA H 1.0 1.8 5.5 129 112 A 52 ALA H A 55 ARG HB2 1.0 1.8 5.5 130 112 A 55 ARG HB3 A 52 ALA H 1.0 1.8 5.5 131 113 A 49 ASP HBy A 52 ALA H 1.0 1.8 5.5 132 114 A 49 ASP HBx A 52 ALA H 1.0 1.8 5.5 133 115 A 52 ALA H A 89 GLU H 1.0 1.8 5.5 134 116 A 51 SER HBx A 53 ARG H 1.0 1.8 5.5 135 117 A 53 ARG H A 48 LEU HDy% 1.0 1.8 5.5 136 117 A 48 LEU HDx% A 53 ARG H 1.0 1.8 5.5 137 118 A 53 ARG H A 55 ARG H 1.0 1.8 5.5 138 119 A 55 ARG HDx A 55 ARG H 1.0 1.8 5.5 139 120 A 55 ARG HDy A 55 ARG H 1.0 1.8 5.5 140 121 A 92 LEU HDy% A 55 ARG H 1.0 1.8 5.5 141 122 A 51 SER HA A 55 ARG H 1.0 1.8 5.5 142 123 A 62 VAL HGx% A 59 LEU H 1.0 1.8 5.5 143 124 A 67 THR HG2% A 60 ALA H 1.0 1.8 5.5 144 125 A 60 ALA H A 62 VAL H 1.0 1.8 5.5 145 126 A 64 PRO HA A 60 ALA H 1.0 1.8 5.5 146 127 A 61 LEU H A 63 LYS H 1.0 1.8 5.5 147 128 A 59 LEU HA A 61 LEU H 1.0 1.8 5.5 148 129 A 60 ALA HA A 61 LEU H 1.0 1.8 5.5 149 130 A 58 ASN HA A 61 LEU H 1.0 1.8 5.5 150 131 A 60 ALA HB% A 61 LEU H 1.0 1.8 5.5 151 132 A 59 LEU HDx% A 61 LEU H 1.0 1.8 5.5 152 133 A 60 ALA HB% A 62 VAL H 1.0 1.8 5.5 153 134 A 61 LEU HBy A 62 VAL H 1.0 1.8 5.5 154 135 A 59 LEU HDx% A 62 VAL H 1.0 1.8 5.5 155 136 A 60 ALA HA A 62 VAL H 1.0 1.8 5.5 156 137 A 59 LEU HDx% A 63 LYS H 1.0 1.8 5.5 157 138 A 63 LYS H A 63 LYS HE2 1.0 1.8 5.5 158 138 A 63 LYS HE3 A 63 LYS H 1.0 1.8 5.5 159 139 A 61 LEU HA A 63 LYS H 1.0 1.8 5.5 160 140 A 60 ALA HA A 63 LYS H 1.0 1.8 5.5 161 141 A 63 LYS HA A 65 GLU H 1.0 1.8 5.5 162 142 A 60 ALA HA A 65 GLU H 1.0 1.8 6.0 163 143 A 64 PRO HDy A 65 GLU H 1.0 1.8 5.5 164 144 A 65 GLU H A 63 LYS HG2 1.0 1.8 5.5 165 144 A 63 LYS HG3 A 65 GLU H 1.0 1.8 5.5 166 145 A 63 LYS H A 65 GLU H 1.0 1.8 5.5 167 146 A 65 GLU H A 68 LYS H 1.0 1.8 5.5 168 147 A 65 GLU H A 69 ALA H 1.0 1.8 6.5 169 148 A 83 LEU HDx% A 83 LEU H 1.0 1.8 5.5 170 149 A 69 ALA H A 67 THR H 1.0 1.8 5.5 171 150 A 65 GLU H A 67 THR H 1.0 1.8 5.5 172 151 A 60 ALA HA A 67 THR H 1.0 1.8 5.5 173 152 A 67 THR HG2% A 67 THR H 1.0 1.8 5.5 174 153 A 67 THR H A 65 GLU HB2 1.0 1.8 5.5 175 153 A 65 GLU HB3 A 67 THR H 1.0 1.8 5.5 176 154 A 96 LEU HDx% A 67 THR H 1.0 1.8 6.0 177 155 A 70 VAL HGx% A 67 THR H 1.0 1.8 5.5 178 156 A 68 LYS H A 68 LYS HE2 1.0 1.8 5.5 179 156 A 68 LYS HE3 A 68 LYS H 1.0 1.8 5.5 180 157 A 67 THR HG2% A 68 LYS H 1.0 1.8 5.5 181 158 A 68 LYS H A 68 LYS HG2 1.0 1.8 5.5 182 158 A 68 LYS HG3 A 68 LYS H 1.0 1.8 5.5 183 159 A 71 GLU HGy A 68 LYS H 1.0 1.8 5.5 184 160 A 70 VAL HGy% A 68 LYS H 1.0 1.8 5.5 185 161 A 69 ALA H A 67 THR H 1.0 1.8 5.5 186 162 A 67 THR HA A 69 ALA H 1.0 1.8 5.5 187 163 A 69 ALA H A 68 LYS HE2 1.0 1.8 5.5 188 163 A 68 LYS HE3 A 69 ALA H 1.0 1.8 5.5 189 164 A 71 GLU HBx A 69 ALA H 1.0 1.8 5.5 190 165 A 99 VAL HGx% A 69 ALA H 1.0 1.8 5.5 191 166 A 70 VAL HGx% A 69 ALA H 1.0 1.8 5.5 192 167 A 69 ALA H A 66 LYS HD2 1.0 1.8 6.0 193 167 A 66 LYS HD3 A 69 ALA H 1.0 1.8 6.0 194 168 A 69 ALA H A 71 GLU H 1.0 1.8 5.5 195 169 A 69 ALA HA A 71 GLU H 1.0 1.8 5.5 196 170 A 72 ASN HA A 71 GLU H 1.0 1.8 5.5 197 171 A 69 ALA HB% A 71 GLU H 1.0 1.8 5.5 198 172 A 67 THR HG2% A 71 GLU H 1.0 1.8 5.5 199 173 A 72 ASN HBx A 71 GLU H 1.0 1.8 5.5 200 174 A 73 TYR HBy A 72 ASN H 1.0 1.8 5.5 201 175 A 70 VAL HA A 72 ASN H 1.0 1.8 5.5 202 176 A 73 TYR HBx A 72 ASN H 1.0 1.8 5.5 203 177 A 44 LEU HDy% A 72 ASN H 1.0 1.8 5.5 204 178 A 72 ASN H A 75 ILE HG1x 1.0 1.8 5.5 205 178 A 75 ILE HG1y A 72 ASN H 1.0 1.8 5.5 206 179 A 70 VAL HB A 74 LEU H 1.0 1.8 5.5 207 180 A 70 VAL HA A 74 LEU H 1.0 1.8 5.5 208 181 A 71 GLU HA A 74 LEU H 1.0 1.8 5.5 209 182 A 72 ASN HA A 74 LEU H 1.0 1.8 5.5 210 183 A 78 ALA HB% A 75 ILE H 1.0 1.8 5.5 211 184 A 71 GLU HA A 75 ILE H 1.0 1.8 5.5 212 185 A 73 TYR HA A 75 ILE H 1.0 1.8 5.5 213 186 A 76 GLN H A 75 ILE HG1x 1.0 1.8 5.5 214 186 A 75 ILE HG1y A 76 GLN H 1.0 1.8 5.5 215 187 A 75 ILE H A 77 MET H 1.0 1.8 5.5 216 188 A 80 TYR HD% A 80 TYR H 1.0 1.8 5.5 217 189 A 80 TYR H A 82 GLN HG2 1.0 1.8 5.5 218 189 A 82 GLN HG3 A 80 TYR H 1.0 1.8 5.5 219 190 A 78 ALA HB% A 80 TYR H 1.0 1.8 5.5 220 191 A 80 TYR H A 82 GLN HB2 1.0 1.8 5.5 221 191 A 82 GLN HB3 A 80 TYR H 1.0 1.8 5.5 222 192 A 80 TYR H A 77 MET HBy 1.0 1.8 5.5 223 193 A 78 ALA HA A 80 TYR H 1.0 1.8 5.5 224 194 A 87 VAL H A 88 SER H 1.0 1.8 5.5 225 195 A 82 GLN HA A 81 GLY H 1.0 1.8 5.5 226 196 A 81 GLY H A 82 GLN HG2 1.0 1.8 5.5 227 196 A 82 GLN HG3 A 81 GLY H 1.0 1.8 5.5 228 197 A 81 GLY H A 82 GLN HB2 1.0 1.8 5.5 229 197 A 82 GLN HB3 A 81 GLY H 1.0 1.8 5.5 230 198 A 87 VAL H A 88 SER H 1.0 1.8 5.5 231 199 A 87 VAL HA A 87 VAL H 1.0 1.8 5.5 232 200 A 47 VAL HA A 87 VAL H 1.0 1.8 5.5 233 201 A 48 LEU HA A 87 VAL H 1.0 1.8 5.5 234 202 A 87 VAL H A 86 LYS HG2 1.0 1.8 5.5 235 202 A 86 LYS HG3 A 87 VAL H 1.0 1.8 5.5 236 203 A 86 LYS HBx A 87 VAL H 1.0 1.8 5.5 237 204 A 87 VAL H A 48 LEU HDy% 1.0 1.8 5.5 238 205 A 89 GLU HGx A 89 GLU H 1.0 1.8 5.5 239 206 A 87 VAL HGx% A 89 GLU H 1.0 1.8 6.0 240 207 A 93 ILE HD1% A 89 GLU H 1.0 1.8 5.5 241 208 A 52 ALA HB% A 89 GLU H 1.0 1.8 5.5 242 209 A 88 SER HBx A 91 GLY H 1.0 1.8 5.5 243 210 A 87 VAL HGx% A 91 GLY H 1.0 1.8 5.5 244 211 A 91 GLY H A 90 GLN HG2 1.0 1.8 5.5 245 211 A 90 GLN HG3 A 91 GLY H 1.0 1.8 5.5 246 212 A 92 LEU H A 94 GLU H 1.0 1.8 5.5 247 213 A 90 GLN H A 92 LEU H 1.0 1.8 5.5 248 214 A 94 GLU H A 91 GLY HA2 1.0 1.8 5.5 249 214 A 91 GLY HA3 A 94 GLU H 1.0 1.8 5.5 250 215 A 93 ILE HG1y A 94 GLU H 1.0 1.8 5.5 251 216 A 93 ILE HD1% A 94 GLU H 1.0 1.8 5.5 252 217 A 95 ILE H A 91 GLY HA2 1.0 1.8 5.5 253 217 A 91 GLY HA3 A 95 ILE H 1.0 1.8 5.5 254 218 A 95 ILE H A 94 GLU HG2 1.0 1.8 5.5 255 218 A 94 GLU HG3 A 95 ILE H 1.0 1.8 5.5 256 219 A 95 ILE HA A 96 LEU H 1.0 1.8 5.5 257 220 A 93 ILE HB A 96 LEU H 1.0 1.8 6.0 258 221 A 93 ILE HA A 97 LYS H 1.0 1.8 5.5 259 222 A 96 LEU HDx% A 97 LYS H 1.0 1.8 5.5 260 223 A 93 ILE HG2% A 97 LYS H 1.0 1.8 5.5 261 224 A 95 ILE HA A 99 VAL H 1.0 1.8 5.5 262 225 A 70 VAL HGx% A 99 VAL H 1.0 1.8 5.5 263 226 A 98 LYS HGy A 99 VAL H 1.0 1.8 5.5 264 227 A 96 LEU HA A 100 SER H 1.0 1.8 5.5 265 228 A 66 LYS HBx A 100 SER H 1.0 1.8 5.5 266 229 A 96 LEU HG A 100 SER H 1.0 1.8 5.5 267 230 A 100 SER H A 97 LYS HG2 1.0 1.8 6.0 268 230 A 97 LYS HG3 A 100 SER H 1.0 1.8 6.0 269 231 A 99 VAL H A 101 GLN H 1.0 1.8 5.5 270 232 A 98 LYS HA A 103 THR H 1.0 1.8 6.0 271 233 A 103 THR HG2% A 104 GLU H 1.0 1.8 5.5 272 234 A 105 LYS H A 104 GLU HG2 1.0 1.8 5.5 273 234 A 104 GLU HG3 A 105 LYS H 1.0 1.8 5.5 274 235 A 111 PHE H A 110 LYS HBx 1.0 1.8 5.5 275 235 A 110 LYS HBy A 111 PHE H 1.0 1.8 5.5 276 236 A 111 PHE H A 112 ASN H 1.0 1.8 5.5 277 237 A 112 ASN H A 111 PHE HBx 1.0 1.8 5.5 278 238 A 112 ASN H A 112 ASN HBy 1.0 1.8 5.5 279 239 A 110 LYS H A 110 LYS HGx 1.0 1.8 5.5 280 240 A 110 LYS H A 110 LYS HD2 1.0 1.8 5.5 281 240 A 110 LYS HD3 A 110 LYS H 1.0 1.8 5.5 282 241 A 109 VAL HGx% A 110 LYS H 1.0 1.8 5.5 283 242 A 109 VAL HGy% A 110 LYS H 1.0 1.8 5.5 284 243 A 109 VAL HGx% A 109 VAL H 1.0 1.8 5.5 285 244 A 109 VAL HGy% A 109 VAL H 1.0 1.8 5.5 286 245 A 108 THR HG2% A 109 VAL H 1.0 1.8 5.5 287 246 A 108 THR HG2% A 108 THR H 1.0 1.8 5.5 288 247 A 106 THR HG2% A 106 THR H 1.0 1.8 5.5 289 248 A 106 THR H A 105 LYS HGx 1.0 1.8 5.5 290 249 A 88 SER HA A 52 ALA H 1.0 1.8 5.5 291 250 A 27 ALA H A 30 GLN HB2 1.0 1.8 5.5 292 250 A 30 GLN HB3 A 27 ALA H 1.0 1.8 5.5 293 251 A 27 ALA H A 25 GLY HA2 1.0 1.8 5.5 294 251 A 25 GLY HA3 A 27 ALA H 1.0 1.8 5.5 295 252 A 92 LEU H A 48 LEU HDy% 1.0 1.8 5.5 296 253 A 99 VAL HB A 69 ALA H 1.0 1.8 6.0 297 254 A 96 LEU H A 97 LYS HG2 1.0 1.8 5.5 298 254 A 97 LYS HG3 A 96 LEU H 1.0 1.8 5.5 299 255 A 46 GLN HA A 48 LEU H 1.0 1.8 5.5 300 256 A 45 ALA HA A 48 LEU H 1.0 1.8 5.5 301 257 A 44 LEU HA A 48 LEU H 1.0 1.8 5.5 302 258 A 73 TYR HD% A 74 LEU H 1.0 1.8 5.5 303 259 A 65 GLU H A 63 LYS HE2 1.0 1.8 5.5 304 259 A 63 LYS HE3 A 65 GLU H 1.0 1.8 5.5 305 260 A 74 LEU HBy A 75 ILE H 1.0 1.8 5.5 306 261 A 45 ALA H A 46 GLN HB2 1.0 1.8 6.0 307 261 A 46 GLN HB3 A 45 ALA H 1.0 1.8 6.0 308 262 A 46 GLN HGx A 45 ALA H 1.0 1.8 5.5 309 263 A 41 ASN HBy A 45 ALA H 1.0 1.8 6.0 310 264 A 45 ALA H A 53 ARG HGx 1.0 1.8 6.0 311 265 A 53 ARG HDy A 45 ALA H 1.0 1.8 5.5 312 266 A 43 ILE HG1y A 45 ALA H 1.0 1.8 5.5 313 267 A 80 TYR H A 79 ARG HD2 1.0 1.8 5.5 314 267 A 79 ARG HD3 A 80 TYR H 1.0 1.8 5.5 315 268 A 80 TYR HE% A 80 TYR H 1.0 1.8 6.0 316 269 A 92 LEU HBy A 91 GLY H 1.0 1.8 5.5 317 270 A 89 GLU H A 91 GLY H 1.0 1.8 5.5 318 271 A 83 LEU HDy% A 81 GLY H 1.0 1.8 5.5 319 272 A 78 ALA HB% A 81 GLY H 1.0 1.8 5.5 320 273 A 81 GLY H A 83 LEU HB2 1.0 1.8 5.5 321 273 A 83 LEU HB3 A 81 GLY H 1.0 1.8 5.5 322 274 A 2 ALA H A 5 GLU HB2 1.0 1.8 5.5 323 274 A 5 GLU HB3 A 2 ALA H 1.0 1.8 5.5 324 275 A 2 ALA H A 5 GLU HG2 1.0 1.8 5.5 325 275 A 5 GLU HG3 A 2 ALA H 1.0 1.8 5.5 326 276 A 52 ALA HB% A 87 VAL H 1.0 1.8 5.5 327 277 A 17 LEU HBx A 19 ALA H 1.0 1.8 5.5 328 278 A 19 ALA H A 17 LEU HBy 1.0 1.8 5.5 329 279 A 73 TYR HD% A 73 TYR H 1.0 1.8 5.5 330 280 A 71 GLU HBx A 68 LYS H 1.0 1.8 5.5 331 281 A 88 SER H A 89 GLU H 1.0 1.8 5.5 332 282 A 89 GLU H A 92 LEU H 1.0 1.8 5.5 333 283 A 52 ALA H A 89 GLU H 1.0 1.8 5.5 334 284 A 48 LEU H A 49 ASP H 1.0 1.8 5.5 335 285 A 47 VAL HA A 49 ASP H 1.0 1.8 5.5 336 286 A 74 LEU HG A 48 LEU H 1.0 1.8 5.5 337 287 A 73 TYR HBx A 71 GLU H 1.0 1.8 6.0 338 288 A 73 TYR HBy A 71 GLU H 1.0 1.8 6.0 339 289 A 95 ILE HA A 94 GLU H 1.0 1.8 5.5 340 290 A 72 ASN HA A 72 ASN HD2x 1.0 1.8 5.5 341 291 A 28 ALA HB% A 25 GLY H 1.0 1.8 5.5 342 292 A 23 ASP HBy A 25 GLY H 1.0 1.8 5.5 343 293 A 20 LYS HGx A 21 HIS H 1.0 1.8 5.5 344 294 A 1 SER H A 1 SER HBy 1.0 1.8 4.5 345 295 A 1 SER H A 1 SER HBx 1.0 1.8 4.5 346 296 A 2 ALA H A 3 ASP H 1.0 1.8 4.5 347 297 A 2 ALA HB% A 2 ALA H 1.0 1.8 4.5 348 298 A 2 ALA HA A 2 ALA H 1.0 1.8 4.5 349 299 A 2 ALA H A 1 SER HBx 1.0 1.8 4.5 350 300 A 1 SER HA A 2 ALA H 1.0 1.8 3.5 351 301 A 2 ALA H A 1 SER HBy 1.0 1.8 5.5 352 302 A 2 ALA H A 3 ASP H 1.0 1.8 4.5 353 303 A 2 ALA HA A 3 ASP H 1.0 1.8 3.5 354 304 A 3 ASP H A 1 SER HBx 1.0 1.8 5.5 355 304 A 3 ASP H A 1 SER HBy 1.0 1.8 5.5 356 305 A 2 ALA HB% A 3 ASP H 1.0 1.8 5.5 357 306 A 3 ASP HBx A 3 ASP H 1.0 1.8 3.5 358 307 A 3 ASP HBy A 3 ASP H 1.0 1.8 3.5 359 308 A 5 GLU H A 3 ASP H 1.0 1.8 4.5 360 309 A 5 GLU H A 4 GLU H 1.0 1.8 3.5 361 310 A 6 LEU H A 4 GLU H 1.0 1.8 4.5 362 311 A 4 GLU HA A 4 GLU H 1.0 1.8 3.5 363 312 A 3 ASP HA A 4 GLU H 1.0 1.8 3.5 364 313 A 4 GLU H A 4 GLU HG2 1.0 1.8 4.5 365 313 A 4 GLU HG3 A 4 GLU H 1.0 1.8 4.5 366 314 A 3 ASP HBy A 4 GLU H 1.0 1.8 4.5 367 315 A 3 ASP HBx A 4 GLU H 1.0 1.8 4.5 368 316 A 3 ASP HA A 5 GLU H 1.0 1.8 5.5 369 317 A 36 GLU H A 36 GLU HB2 1.0 1.8 3.5 370 317 A 36 GLU HB3 A 36 GLU H 1.0 1.8 3.5 371 318 A 5 GLU H A 5 GLU HG2 1.0 1.8 4.5 372 318 A 5 GLU HG3 A 5 GLU H 1.0 1.8 4.5 373 319 A 6 LEU H A 5 GLU H 1.0 1.8 3.5 374 320 A 3 ASP HA A 6 LEU H 1.0 1.8 4.5 375 321 A 6 LEU H A 5 GLU HB2 1.0 1.8 4.5 376 321 A 5 GLU HB3 A 6 LEU H 1.0 1.8 4.5 377 322 A 6 LEU HDy% A 6 LEU H 1.0 1.8 4.5 378 323 A 6 LEU HBy A 7 GLU H 1.0 1.8 4.5 379 324 A 7 GLU HA A 8 ALA H 1.0 1.8 3.5 380 325 A 8 ALA H A 7 GLU HB2 1.0 1.8 3.5 381 325 A 7 GLU HB3 A 8 ALA H 1.0 1.8 3.5 382 326 A 8 ALA HB% A 8 ALA H 1.0 1.8 3.5 383 327 A 8 ALA H A 7 GLU HG2 1.0 1.8 5.5 384 327 A 7 GLU HG3 A 8 ALA H 1.0 1.8 5.5 385 328 A 9 LEU HDy% A 9 LEU H 1.0 1.8 4.5 386 329 A 8 ALA HB% A 9 LEU H 1.0 1.8 4.5 387 330 A 10 ARG H A 10 ARG HG2 1.0 1.8 5.5 388 330 A 10 ARG HG3 A 10 ARG H 1.0 1.8 5.5 389 331 A 9 LEU HBx A 10 ARG H 1.0 1.8 3.5 390 332 A 10 ARG HBy A 10 ARG H 1.0 1.8 4.5 391 333 A 9 LEU HDx% A 10 ARG H 1.0 1.8 5.5 392 334 A 11 ARG H A 9 LEU H 1.0 1.8 5.5 393 335 A 7 GLU HA A 11 ARG H 1.0 1.8 4.5 394 336 A 11 ARG HBy A 11 ARG H 1.0 1.8 4.5 395 337 A 12 GLN HGx A 12 GLN H 1.0 1.8 4.5 396 338 A 12 GLN HGy A 12 GLN H 1.0 1.8 4.5 397 339 A 11 ARG HBx A 12 GLN H 1.0 1.8 3.5 398 340 A 11 ARG HA A 12 GLN H 1.0 1.8 4.5 399 341 A 13 ARG H A 14 LEU H 1.0 1.8 3.5 400 342 A 13 ARG H A 13 ARG HD2 1.0 1.8 4.5 401 342 A 13 ARG HD3 A 13 ARG H 1.0 1.8 4.5 402 343 A 13 ARG H A 12 GLN HB2 1.0 1.8 3.5 403 343 A 12 GLN HB3 A 13 ARG H 1.0 1.8 3.5 404 344 A 13 ARG H A 13 ARG HG2 1.0 1.8 4.5 405 344 A 13 ARG HG3 A 13 ARG H 1.0 1.8 4.5 406 345 A 10 ARG HA A 13 ARG H 1.0 1.8 4.5 407 346 A 12 GLN HGy A 13 ARG H 1.0 1.8 4.5 408 347 A 13 ARG H A 14 LEU H 1.0 1.8 3.5 409 348 A 11 ARG HA A 14 LEU H 1.0 1.8 3.5 410 349 A 14 LEU H A 13 ARG HB2 1.0 1.8 4.5 411 349 A 13 ARG HB3 A 14 LEU H 1.0 1.8 4.5 412 350 A 14 LEU HDx% A 14 LEU H 1.0 1.8 4.5 413 351 A 93 ILE H A 94 GLU H 1.0 1.8 4.5 414 352 A 93 ILE H A 92 LEU H 1.0 1.8 4.5 415 353 A 93 ILE HA A 93 ILE H 1.0 1.8 4.5 416 354 A 93 ILE HG1y A 93 ILE H 1.0 1.8 4.5 417 355 A 92 LEU HBy A 93 ILE H 1.0 1.8 4.5 418 356 A 93 ILE HD1% A 93 ILE H 1.0 1.8 4.5 419 357 A 11 ARG HA A 15 ALA H 1.0 1.8 5.5 420 358 A 15 ALA HB% A 15 ALA H 1.0 1.8 3.5 421 359 A 14 LEU HBx A 15 ALA H 1.0 1.8 3.5 422 360 A 14 LEU HBy A 15 ALA H 1.0 1.8 4.5 423 361 A 15 ALA HB% A 16 GLU H 1.0 1.8 4.5 424 362 A 16 GLU HGy A 16 GLU H 1.0 1.8 4.5 425 363 A 18 GLN H A 17 LEU HBy 1.0 1.8 4.5 426 364 A 17 LEU HBx A 18 GLN H 1.0 1.8 3.5 427 365 A 17 LEU H A 17 LEU HBy 1.0 1.8 3.5 428 366 A 17 LEU H A 16 GLU HB2 1.0 1.8 4.5 429 366 A 17 LEU H A 16 GLU HB3 1.0 1.8 4.5 430 367 A 16 GLU HGx A 17 LEU H 1.0 1.8 4.5 431 368 A 17 LEU H A 17 LEU HG 1.0 1.8 5.5 432 369 A 19 ALA HB% A 19 ALA H 1.0 1.8 4.5 433 370 A 19 ALA H A 18 GLN HB2 1.0 1.8 4.5 434 370 A 18 GLN HB3 A 19 ALA H 1.0 1.8 4.5 435 371 A 21 HIS H A 20 LYS H 1.0 1.8 4.5 436 372 A 19 ALA H A 20 LYS H 1.0 1.8 4.5 437 373 A 20 LYS HBy A 20 LYS H 1.0 1.8 4.5 438 374 A 20 LYS HGx A 20 LYS H 1.0 1.8 4.5 439 375 A 19 ALA HB% A 20 LYS H 1.0 1.8 4.5 440 376 A 21 HIS H A 20 LYS H 1.0 1.8 4.5 441 377 A 21 HIS HBx A 21 HIS H 1.0 1.8 4.5 442 378 A 21 HIS HBy A 21 HIS H 1.0 1.8 4.5 443 379 A 21 HIS HA A 21 HIS H 1.0 1.8 4.5 444 380 A 21 HIS H A 20 LYS HGy 1.0 1.8 5.5 445 381 A 20 LYS HBx A 21 HIS H 1.0 1.8 4.5 446 382 A 22 GLY H A 22 GLY HA2 1.0 1.8 3.5 447 382 A 22 GLY H A 22 GLY HA3 1.0 1.8 3.5 448 383 A 21 HIS HA A 22 GLY H 1.0 1.8 4.5 449 384 A 21 HIS HBy A 22 GLY H 1.0 1.8 5.5 450 385 A 23 ASP HA A 23 ASP H 1.0 1.8 4.5 451 386 A 21 HIS HA A 23 ASP H 1.0 1.8 4.5 452 387 A 23 ASP H A 22 GLY HA2 1.0 1.8 3.5 453 387 A 22 GLY HA3 A 23 ASP H 1.0 1.8 3.5 454 388 A 23 ASP HBy A 23 ASP H 1.0 1.8 4.5 455 389 A 23 ASP HBx A 23 ASP H 1.0 1.8 3.5 456 390 A 105 LYS HGy A 105 LYS H 1.0 1.8 4.5 457 391 A 25 GLY H A 26 ASP H 1.0 1.8 4.5 458 392 A 24 PRO HDy A 25 GLY H 1.0 1.8 4.5 459 393 A 24 PRO HA A 25 GLY H 1.0 1.8 4.5 460 394 A 24 PRO HBy A 25 GLY H 1.0 1.8 4.5 461 395 A 24 PRO HBx A 25 GLY H 1.0 1.8 5.5 462 396 A 23 ASP HBx A 25 GLY H 1.0 1.8 5.5 463 397 A 25 GLY H A 26 ASP H 1.0 1.8 4.5 464 398 A 27 ALA H A 26 ASP H 1.0 1.8 4.5 465 399 A 26 ASP HA A 26 ASP H 1.0 1.8 3.5 466 400 A 26 ASP H A 26 ASP HB2 1.0 1.8 3.5 467 400 A 26 ASP HB3 A 26 ASP H 1.0 1.8 3.5 468 401 A 27 ALA H A 26 ASP H 1.0 1.8 4.5 469 402 A 27 ALA HA A 27 ALA H 1.0 1.8 3.5 470 403 A 26 ASP HA A 27 ALA H 1.0 1.8 3.5 471 404 A 27 ALA HB% A 27 ALA H 1.0 1.8 4.5 472 405 A 27 ALA H A 26 ASP HB2 1.0 1.8 4.5 473 405 A 26 ASP HB3 A 27 ALA H 1.0 1.8 4.5 474 406 A 26 ASP HA A 28 ALA H 1.0 1.8 4.5 475 407 A 26 ASP HA A 29 GLN H 1.0 1.8 5.5 476 408 A 29 GLN H A 29 GLN HG2 1.0 1.8 4.5 477 408 A 29 GLN HG3 A 29 GLN H 1.0 1.8 4.5 478 409 A 28 ALA HB% A 29 GLN H 1.0 1.8 3.5 479 410 A 79 ARG H A 80 TYR H 1.0 1.8 4.5 480 411 A 79 ARG HBx A 79 ARG H 1.0 1.8 3.5 481 412 A 79 ARG HBy A 79 ARG H 1.0 1.8 3.5 482 413 A 79 ARG H A 79 ARG HG2 1.0 1.8 5.5 483 413 A 79 ARG HG3 A 79 ARG H 1.0 1.8 5.5 484 414 A 78 ALA HB% A 79 ARG H 1.0 1.8 4.5 485 415 A 36 GLU H A 37 ALA H 1.0 1.8 3.5 486 416 A 30 GLN HA A 30 GLN H 1.0 1.8 3.5 487 417 A 29 GLN HA A 30 GLN H 1.0 1.8 3.5 488 418 A 30 GLN H A 29 GLN HG2 1.0 1.8 4.5 489 418 A 29 GLN HG3 A 30 GLN H 1.0 1.8 4.5 490 419 A 35 ARG H A 34 HIS H 1.0 1.8 3.5 491 420 A 34 HIS HA A 34 HIS H 1.0 1.8 3.5 492 421 A 33 LYS HA A 34 HIS H 1.0 1.8 4.5 493 422 A 34 HIS HBy A 34 HIS H 1.0 1.8 3.5 494 423 A 34 HIS H A 33 LYS HB2 1.0 1.8 4.5 495 423 A 33 LYS HB3 A 34 HIS H 1.0 1.8 4.5 496 424 A 33 LYS HGy A 34 HIS H 1.0 1.8 4.5 497 425 A 31 GLU H A 30 GLN HG2 1.0 1.8 4.5 498 425 A 30 GLN HG3 A 31 GLU H 1.0 1.8 4.5 499 426 A 31 GLU H A 32 ALA H 1.0 1.8 3.5 500 427 A 32 ALA HB% A 32 ALA H 1.0 1.8 3.5 501 428 A 32 ALA H A 31 GLU HB2 1.0 1.8 4.5 502 428 A 31 GLU HB3 A 32 ALA H 1.0 1.8 4.5 503 429 A 32 ALA H A 31 GLU HG2 1.0 1.8 5.5 504 429 A 31 GLU HG3 A 32 ALA H 1.0 1.8 5.5 505 430 A 34 HIS H A 33 LYS H 1.0 1.8 3.5 506 431 A 33 LYS H A 33 LYS HB2 1.0 1.8 3.5 507 431 A 33 LYS HB3 A 33 LYS H 1.0 1.8 3.5 508 432 A 32 ALA HB% A 33 LYS H 1.0 1.8 4.5 509 433 A 35 ARG H A 33 LYS H 1.0 1.8 4.5 510 434 A 34 HIS HBx A 35 ARG H 1.0 1.8 3.5 511 435 A 35 ARG H A 35 ARG HA 1.0 1.8 3.5 512 436 A 56 LEU H A 58 ASN H 1.0 1.8 4.5 513 437 A 56 LEU H A 55 ARG H 1.0 1.8 4.5 514 438 A 86 LYS H A 87 VAL H 1.0 1.8 5.5 515 439 A 52 ALA HA A 56 LEU H 1.0 1.8 4.5 516 440 A 92 LEU HDy% A 56 LEU H 1.0 1.8 4.5 517 441 A 86 LYS H A 85 GLU HG2 1.0 1.8 4.5 518 441 A 85 GLU HG3 A 86 LYS H 1.0 1.8 4.5 519 442 A 47 VAL HA A 86 LYS H 1.0 1.8 6.0 520 443 A 34 HIS HA A 35 ARG H 1.0 1.8 4.5 521 444 A 86 LYS HBx A 86 LYS H 1.0 1.8 3.5 522 445 A 35 ARG H A 35 ARG HG2 1.0 1.8 4.5 523 445 A 35 ARG H A 35 ARG HG3 1.0 1.8 4.5 524 446 A 35 ARG H A 36 GLU H 1.0 1.8 4.5 525 447 A 33 LYS HA A 36 GLU H 1.0 1.8 3.5 526 448 A 2 ALA HA A 5 GLU H 1.0 1.8 5.5 527 449 A 36 GLU H A 35 ARG HB2 1.0 1.8 4.5 528 449 A 35 ARG HB3 A 36 GLU H 1.0 1.8 4.5 529 450 A 5 GLU H A 5 GLU HB2 1.0 1.8 3.5 530 450 A 5 GLU HB3 A 5 GLU H 1.0 1.8 3.5 531 451 A 36 GLU HGx A 36 GLU H 1.0 1.8 4.5 532 452 A 33 LYS HGy A 36 GLU H 1.0 1.8 5.0 533 453 A 36 GLU H A 37 ALA H 1.0 1.8 4.5 534 454 A 34 HIS HA A 37 ALA H 1.0 1.8 5.5 535 455 A 37 ALA H A 36 GLU HB2 1.0 1.8 3.5 536 455 A 36 GLU HB3 A 37 ALA H 1.0 1.8 3.5 537 456 A 37 ALA HB% A 37 ALA H 1.0 1.8 3.5 538 457 A 36 GLU HGx A 37 ALA H 1.0 1.8 5.5 539 458 A 29 GLN HA A 33 LYS H 1.0 1.8 4.5 540 459 A 38 GLU H A 38 GLU HG2 1.0 1.8 4.5 541 459 A 38 GLU H A 38 GLU HG3 1.0 1.8 4.5 542 460 A 37 ALA HB% A 38 GLU H 1.0 1.8 4.5 543 461 A 69 ALA H A 70 VAL H 1.0 1.8 4.5 544 462 A 71 GLU H A 70 VAL H 1.0 1.8 4.5 545 463 A 70 VAL HA A 70 VAL H 1.0 1.8 4.5 546 464 A 70 VAL HB A 70 VAL H 1.0 1.8 4.0 547 465 A 7 GLU H A 7 GLU HG2 1.0 1.8 4.5 548 465 A 7 GLU HG3 A 7 GLU H 1.0 1.8 4.5 549 466 A 96 LEU HDx% A 70 VAL H 1.0 1.8 4.5 550 467 A 70 VAL HGx% A 70 VAL H 1.0 1.8 4.5 551 468 A 69 ALA HB% A 70 VAL H 1.0 1.8 4.5 552 469 A 41 ASN HBx A 41 ASN H 1.0 1.8 4.5 553 470 A 107 THR HG2% A 107 THR H 1.0 1.8 5.5 554 471 A 82 GLN H A 82 GLN HG2 1.0 1.8 3.5 555 471 A 82 GLN HG3 A 82 GLN H 1.0 1.8 3.5 556 472 A 82 GLN H A 82 GLN HB2 1.0 1.8 4.5 557 472 A 82 GLN HB3 A 82 GLN H 1.0 1.8 4.5 558 473 A 81 GLY H A 82 GLN H 1.0 1.8 3.5 559 474 A 40 ARG HA A 41 ASN H 1.0 1.8 4.5 560 475 A 82 GLN HA A 82 GLN H 1.0 1.8 4.5 561 476 A 82 GLN H A 81 GLY HA2 1.0 1.8 3.5 562 476 A 81 GLY HA3 A 82 GLN H 1.0 1.8 3.5 563 477 A 78 ALA HA A 82 GLN H 1.0 1.8 4.5 564 478 A 37 ALA HA A 41 ASN H 1.0 1.8 4.5 565 479 A 41 ASN H A 40 ARG HG2 1.0 1.8 4.5 566 479 A 40 ARG HG3 A 41 ASN H 1.0 1.8 4.5 567 480 A 41 ASN H A 40 ARG HB2 1.0 1.8 4.5 568 480 A 40 ARG HB3 A 41 ASN H 1.0 1.8 4.5 569 481 A 44 LEU HDx% A 41 ASN H 1.0 1.8 5.5 570 482 A 42 SER H A 43 ILE H 1.0 1.8 4.5 571 483 A 41 ASN HA A 42 SER H 1.0 1.8 4.5 572 484 A 41 ASN HBy A 42 SER H 1.0 1.8 4.5 573 485 A 42 SER H A 43 ILE H 1.0 1.8 3.5 574 486 A 43 ILE HA A 43 ILE H 1.0 1.8 3.5 575 487 A 43 ILE HG2% A 43 ILE H 1.0 1.8 4.5 576 488 A 43 ILE HG1y A 43 ILE H 1.0 1.8 4.5 577 489 A 43 ILE HG1x A 43 ILE H 1.0 1.8 4.0 578 490 A 43 ILE HB A 43 ILE H 1.0 1.8 4.5 579 491 A 42 SER HBy A 43 ILE H 1.0 1.8 4.5 580 492 A 73 TYR HBy A 73 TYR H 1.0 1.8 3.5 581 493 A 73 TYR HBx A 73 TYR H 1.0 1.8 3.5 582 494 A 72 ASN HBy A 73 TYR H 1.0 1.8 4.5 583 495 A 72 ASN HBx A 73 TYR H 1.0 1.8 4.5 584 496 A 74 LEU H A 73 TYR H 1.0 1.8 3.5 585 497 A 53 ARG H A 54 ALA H 1.0 1.8 4.5 586 498 A 54 ALA HB% A 54 ALA H 1.0 1.8 3.5 587 499 A 53 ARG HBx A 54 ALA H 1.0 1.8 3.5 588 500 A 70 VAL HA A 73 TYR H 1.0 1.8 4.5 589 501 A 72 ASN HA A 73 TYR H 1.0 1.8 4.5 590 502 A 42 SER HA A 43 ILE H 1.0 1.8 4.5 591 503 A 52 ALA H A 54 ALA H 1.0 1.8 4.5 592 504 A 52 ALA HA A 54 ALA H 1.0 1.8 4.5 593 505 A 51 SER HA A 54 ALA H 1.0 1.8 4.5 594 506 A 14 LEU HDx% A 15 ALA H 1.0 1.8 4.5 595 507 A 44 LEU H A 45 ALA H 1.0 1.8 4.5 596 508 A 44 LEU H A 43 ILE H 1.0 1.8 3.5 597 509 A 44 LEU HA A 44 LEU H 1.0 1.8 4.5 598 510 A 41 ASN HA A 44 LEU H 1.0 1.8 4.5 599 511 A 44 LEU HBx A 44 LEU H 1.0 1.8 4.0 600 512 A 44 LEU HBy A 44 LEU H 1.0 1.8 3.5 601 513 A 44 LEU HDx% A 44 LEU H 1.0 1.8 4.5 602 514 A 44 LEU HBy A 44 LEU H 1.0 1.8 4.5 603 515 A 46 GLN H A 45 ALA H 1.0 1.8 4.5 604 516 A 44 LEU H A 45 ALA H 1.0 1.8 4.5 605 517 A 45 ALA HA A 45 ALA H 1.0 1.8 3.5 606 518 A 45 ALA HB% A 45 ALA H 1.0 1.8 4.5 607 519 A 44 LEU HBx A 45 ALA H 1.0 1.8 4.5 608 520 A 44 LEU HA A 45 ALA H 1.0 1.8 4.5 609 521 A 42 SER HA A 45 ALA H 1.0 1.8 4.5 610 522 A 44 LEU HBy A 45 ALA H 1.0 1.8 4.5 611 523 A 44 LEU HDx% A 45 ALA H 1.0 1.8 5.5 612 524 A 46 GLN H A 47 VAL H 1.0 1.8 4.5 613 525 A 46 GLN H A 45 ALA H 1.0 1.8 4.5 614 526 A 46 GLN H A 48 LEU H 1.0 1.8 4.5 615 527 A 45 ALA HB% A 46 GLN H 1.0 1.8 5.5 616 528 A 46 GLN HGx A 46 GLN H 1.0 1.8 4.5 617 529 A 46 GLN HGy A 46 GLN H 1.0 1.8 4.5 618 530 A 46 GLN H A 46 GLN HB2 1.0 1.8 4.5 619 530 A 46 GLN HB3 A 46 GLN H 1.0 1.8 4.5 620 531 A 46 GLN HA A 46 GLN H 1.0 1.8 4.5 621 532 A 45 ALA HA A 46 GLN H 1.0 1.8 4.5 622 533 A 43 ILE HA A 46 GLN H 1.0 1.8 5.5 623 534 A 46 GLN HA A 47 VAL H 1.0 1.8 4.5 624 535 A 47 VAL HA A 47 VAL H 1.0 1.8 4.5 625 536 A 47 VAL H A 47 VAL HG1% 1.0 1.8 5.5 626 536 A 47 VAL HG2% A 47 VAL H 1.0 1.8 5.5 627 537 A 47 VAL H A 46 GLN HB2 1.0 1.8 4.5 628 537 A 46 GLN HB3 A 47 VAL H 1.0 1.8 4.5 629 538 A 47 VAL HB A 47 VAL H 1.0 1.8 4.5 630 539 A 48 LEU HBy A 47 VAL H 1.0 1.8 5.0 631 540 A 43 ILE HB A 47 VAL H 1.0 1.8 5.5 632 541 A 47 VAL H A 48 LEU H 1.0 1.8 4.5 633 542 A 48 LEU HA A 48 LEU H 1.0 1.8 5.5 634 543 A 48 LEU HBy A 48 LEU H 1.0 1.8 3.5 635 544 A 48 LEU HDx% A 48 LEU H 1.0 1.8 4.5 636 545 A 48 LEU HBx A 48 LEU H 1.0 1.8 4.5 637 546 A 48 LEU HG A 48 LEU H 1.0 1.8 4.5 638 547 A 49 ASP H A 50 GLN H 1.0 1.8 4.5 639 548 A 49 ASP HA A 49 ASP H 1.0 1.8 4.5 640 549 A 48 LEU HA A 49 ASP H 1.0 1.8 3.5 641 550 A 49 ASP HBy A 49 ASP H 1.0 1.8 4.5 642 551 A 49 ASP HBx A 49 ASP H 1.0 1.8 4.5 643 552 A 87 VAL HA A 49 ASP H 1.0 1.8 5.5 644 553 A 49 ASP H A 48 LEU HDy% 1.0 1.8 5.5 645 554 A 52 ALA HB% A 49 ASP H 1.0 1.8 5.5 646 555 A 48 LEU HBy A 49 ASP H 1.0 1.8 4.5 647 556 A 48 LEU HBx A 49 ASP H 1.0 1.8 4.5 648 557 A 87 VAL HB A 49 ASP H 1.0 1.8 4.5 649 558 A 49 ASP H A 50 GLN H 1.0 1.8 4.5 650 559 A 50 GLN HA A 50 GLN H 1.0 1.8 4.5 651 560 A 49 ASP HA A 50 GLN H 1.0 1.8 3.5 652 561 A 49 ASP HBx A 50 GLN H 1.0 1.8 4.5 653 562 A 49 ASP HBy A 50 GLN H 1.0 1.8 4.5 654 563 A 50 GLN H A 50 GLN HG2 1.0 1.8 4.5 655 563 A 50 GLN HG3 A 50 GLN H 1.0 1.8 4.5 656 564 A 52 ALA H A 51 SER H 1.0 1.8 4.5 657 565 A 50 GLN H A 51 SER H 1.0 1.8 4.5 658 566 A 90 GLN H A 91 GLY H 1.0 1.8 4.5 659 567 A 90 GLN H A 89 GLU H 1.0 1.8 4.5 660 568 A 51 SER H A 50 GLN HG2 1.0 1.8 4.5 661 568 A 50 GLN HG3 A 51 SER H 1.0 1.8 4.5 662 569 A 90 GLN H A 90 GLN HB2 1.0 1.8 3.5 663 569 A 90 GLN H A 90 GLN HB3 1.0 1.8 3.5 664 570 A 50 GLN HBx A 51 SER H 1.0 1.8 3.5 665 571 A 49 ASP HBx A 51 SER H 1.0 1.8 5.5 666 572 A 89 GLU HA A 90 GLN H 1.0 1.8 4.5 667 573 A 51 SER HA A 51 SER H 1.0 1.8 3.5 668 574 A 88 SER HBx A 90 GLN H 1.0 1.8 5.0 669 575 A 49 ASP HA A 51 SER H 1.0 1.8 5.5 670 576 A 88 SER HA A 90 GLN H 1.0 1.8 6.0 671 577 A 93 ILE HG1x A 90 GLN H 1.0 1.8 5.5 672 578 A 48 LEU HBx A 51 SER H 1.0 1.8 6.0 673 579 A 52 ALA H A 51 SER H 1.0 1.8 4.5 674 580 A 53 ARG H A 52 ALA H 1.0 1.8 4.5 675 581 A 51 SER HBx A 52 ALA H 1.0 1.8 4.5 676 582 A 52 ALA HA A 52 ALA H 1.0 1.8 4.5 677 583 A 51 SER HA A 52 ALA H 1.0 1.8 5.5 678 584 A 89 GLU HGy A 52 ALA H 1.0 1.8 4.5 679 585 A 52 ALA HB% A 52 ALA H 1.0 1.8 4.5 680 586 A 53 ARG H A 51 SER H 1.0 1.8 4.5 681 587 A 53 ARG H A 52 ALA H 1.0 1.8 4.5 682 588 A 53 ARG H A 54 ALA H 1.0 1.8 4.5 683 589 A 84 SER H A 85 GLU H 1.0 1.8 3.5 684 590 A 53 ARG HA A 53 ARG H 1.0 1.8 4.5 685 591 A 84 SER HBx A 84 SER H 1.0 1.8 3.5 686 592 A 53 ARG HDy A 53 ARG H 1.0 1.8 5.5 687 593 A 53 ARG HBy A 53 ARG H 1.0 1.8 4.5 688 594 A 53 ARG HBx A 53 ARG H 1.0 1.8 4.5 689 595 A 53 ARG H A 53 ARG HGx 1.0 1.8 4.5 690 596 A 52 ALA HB% A 53 ARG H 1.0 1.8 4.5 691 597 A 84 SER H A 83 LEU HB2 1.0 1.8 4.5 692 597 A 83 LEU HB3 A 84 SER H 1.0 1.8 4.5 693 598 A 84 SER HA A 84 SER H 1.0 1.8 4.5 694 599 A 83 LEU HDx% A 84 SER H 1.0 1.8 5.5 695 600 A 54 ALA H A 55 ARG H 1.0 1.8 4.5 696 601 A 56 LEU H A 55 ARG H 1.0 1.8 4.5 697 602 A 55 ARG HA A 55 ARG H 1.0 1.8 3.5 698 603 A 55 ARG HGx A 55 ARG H 1.0 1.8 4.5 699 604 A 55 ARG HGy A 55 ARG H 1.0 1.8 4.5 700 605 A 54 ALA HB% A 55 ARG H 1.0 1.8 4.5 701 606 A 55 ARG H A 55 ARG HB2 1.0 1.8 4.5 702 606 A 55 ARG HB3 A 55 ARG H 1.0 1.8 4.5 703 607 A 89 GLU HGy A 55 ARG H 1.0 1.8 4.5 704 608 A 52 ALA HA A 55 ARG H 1.0 1.8 4.5 705 609 A 58 ASN H A 57 SER H 1.0 1.8 4.5 706 610 A 56 LEU H A 57 SER H 1.0 1.8 4.5 707 611 A 57 SER HBy A 57 SER H 1.0 1.8 3.5 708 612 A 56 LEU HDx% A 57 SER H 1.0 1.8 5.5 709 613 A 57 SER H A 56 LEU HBx 1.0 1.8 4.5 710 613 A 57 SER H A 56 LEU HBy 1.0 1.8 4.5 711 614 A 60 ALA H A 58 ASN H 1.0 1.8 4.5 712 615 A 99 VAL H A 98 LYS H 1.0 1.8 4.5 713 616 A 99 VAL H A 100 SER H 1.0 1.8 3.5 714 617 A 59 LEU H A 60 ALA H 1.0 1.8 4.5 715 618 A 59 LEU H A 58 ASN H 1.0 1.8 4.5 716 619 A 86 LYS H A 85 GLU H 1.0 1.8 4.5 717 620 A 84 SER H A 85 GLU H 1.0 1.8 3.5 718 621 A 85 GLU H A 85 GLU HG2 1.0 1.8 4.5 719 621 A 85 GLU HG3 A 85 GLU H 1.0 1.8 4.5 720 622 A 85 GLU HBx A 85 GLU H 1.0 1.8 3.5 721 623 A 95 ILE HA A 98 LYS H 1.0 1.8 4.5 722 624 A 84 SER HBy A 85 GLU H 1.0 1.8 4.5 723 625 A 98 LYS HA A 98 LYS H 1.0 1.8 3.5 724 626 A 99 VAL HGx% A 98 LYS H 1.0 1.8 5.5 725 627 A 83 LEU HDx% A 85 GLU H 1.0 1.8 5.5 726 628 A 98 LYS HGy A 98 LYS H 1.0 1.8 4.5 727 629 A 85 GLU H A 83 LEU HB2 1.0 1.8 4.5 728 629 A 83 LEU HB3 A 85 GLU H 1.0 1.8 4.5 729 630 A 58 ASN H A 58 ASN HBx 1.0 1.8 4.5 730 630 A 58 ASN H A 58 ASN HBy 1.0 1.8 4.5 731 631 A 98 LYS HDx A 98 LYS H 1.0 1.8 4.5 732 632 A 98 LYS H A 97 LYS HB2 1.0 1.8 4.5 733 632 A 97 LYS HB3 A 98 LYS H 1.0 1.8 4.5 734 633 A 98 LYS H A 98 LYS HB2 1.0 1.8 3.5 735 633 A 98 LYS HB3 A 98 LYS H 1.0 1.8 3.5 736 634 A 84 SER HA A 85 GLU H 1.0 1.8 4.5 737 635 A 58 ASN HA A 58 ASN H 1.0 1.8 3.5 738 636 A 57 SER HA A 58 ASN H 1.0 1.8 4.5 739 637 A 59 LEU HA A 59 LEU H 1.0 1.8 3.5 740 638 A 55 ARG HA A 59 LEU H 1.0 1.8 5.5 741 639 A 58 ASN HA A 59 LEU H 1.0 1.8 4.5 742 640 A 59 LEU H A 58 ASN HBx 1.0 1.8 4.5 743 640 A 59 LEU H A 58 ASN HBy 1.0 1.8 4.5 744 641 A 59 LEU HBy A 59 LEU H 1.0 1.8 3.5 745 642 A 59 LEU HBx A 59 LEU H 1.0 1.8 3.5 746 643 A 59 LEU HDy% A 59 LEU H 1.0 1.8 5.5 747 644 A 59 LEU HA A 60 ALA H 1.0 1.8 3.5 748 645 A 57 SER HA A 60 ALA H 1.0 1.8 3.5 749 646 A 59 LEU HDx% A 60 ALA H 1.0 1.8 5.5 750 647 A 60 ALA HB% A 60 ALA H 1.0 1.8 4.5 751 648 A 59 LEU HBy A 60 ALA H 1.0 1.8 4.0 752 649 A 59 LEU HBx A 60 ALA H 1.0 1.8 3.5 753 650 A 59 LEU H A 60 ALA H 1.0 1.8 4.5 754 651 A 60 ALA H A 61 LEU H 1.0 1.8 5.5 755 652 A 62 VAL H A 61 LEU H 1.0 1.8 4.5 756 653 A 60 ALA H A 61 LEU H 1.0 1.8 5.5 757 654 A 61 LEU HA A 61 LEU H 1.0 1.8 4.5 758 655 A 61 LEU HBy A 61 LEU H 1.0 1.8 4.5 759 656 A 61 LEU HBx A 61 LEU H 1.0 1.8 3.5 760 657 A 62 VAL HGy% A 61 LEU H 1.0 1.8 5.5 761 658 A 62 VAL H A 61 LEU H 1.0 1.8 4.5 762 659 A 62 VAL H A 63 LYS H 1.0 1.8 4.5 763 660 A 62 VAL HA A 62 VAL H 1.0 1.8 4.5 764 661 A 62 VAL HGy% A 62 VAL H 1.0 1.8 4.5 765 662 A 62 VAL HB A 62 VAL H 1.0 1.8 4.5 766 663 A 61 LEU HBx A 62 VAL H 1.0 1.8 4.5 767 664 A 61 LEU HBy A 62 VAL H 1.0 1.8 4.5 768 665 A 61 LEU HA A 62 VAL H 1.0 1.8 5.5 769 666 A 59 LEU HA A 62 VAL H 1.0 1.8 5.5 770 667 A 62 VAL H A 63 LYS H 1.0 1.8 4.5 771 668 A 61 LEU H A 63 LYS H 1.0 1.8 5.5 772 669 A 63 LYS HA A 63 LYS H 1.0 1.8 4.5 773 670 A 63 LYS H A 63 LYS HG2 1.0 1.8 4.5 774 670 A 63 LYS HG3 A 63 LYS H 1.0 1.8 4.5 775 671 A 63 LYS HBx A 63 LYS H 1.0 1.8 4.5 776 672 A 62 VAL HB A 63 LYS H 1.0 1.8 4.5 777 673 A 63 LYS HBy A 63 LYS H 1.0 1.8 4.5 778 674 A 63 LYS H A 63 LYS HD2 1.0 1.8 5.5 779 674 A 63 LYS HD3 A 63 LYS H 1.0 1.8 5.5 780 675 A 62 VAL HGx% A 63 LYS H 1.0 1.8 4.5 781 676 A 64 PRO HDx A 63 LYS H 1.0 1.8 5.5 782 677 A 62 VAL HA A 63 LYS H 1.0 1.8 4.5 783 678 A 59 LEU HA A 63 LYS H 1.0 1.8 5.5 784 679 A 65 GLU HA A 65 GLU H 1.0 1.8 4.5 785 680 A 64 PRO HBy A 65 GLU H 1.0 1.8 4.5 786 681 A 65 GLU H A 65 GLU HB2 1.0 1.8 3.5 787 681 A 65 GLU HB3 A 65 GLU H 1.0 1.8 3.5 788 682 A 65 GLU H A 65 GLU HGx 1.0 1.8 4.5 789 683 A 65 GLU HGy A 65 GLU H 1.0 1.8 4.5 790 684 A 64 PRO HBx A 65 GLU H 1.0 1.8 4.5 791 685 A 64 PRO HA A 65 GLU H 1.0 1.8 5.5 792 686 A 64 PRO HDx A 65 GLU H 1.0 1.8 5.5 793 687 A 63 LYS HBy A 65 GLU H 1.0 1.8 5.5 794 688 A 65 GLU H A 66 LYS H 1.0 1.8 4.5 795 689 A 65 GLU H A 66 LYS H 1.0 1.8 4.5 796 690 A 83 LEU H A 84 SER H 1.0 1.8 4.5 797 691 A 83 LEU H A 81 GLY H 1.0 1.8 4.5 798 692 A 83 LEU H A 82 GLN H 1.0 1.8 4.5 799 693 A 83 LEU HA A 83 LEU H 1.0 1.8 4.5 800 694 A 83 LEU HDy% A 83 LEU H 1.0 1.8 4.5 801 695 A 66 LYS H A 66 LYS HG2 1.0 1.8 4.5 802 695 A 66 LYS HG3 A 66 LYS H 1.0 1.8 4.5 803 696 A 83 LEU H A 83 LEU HB2 1.0 1.8 3.5 804 696 A 83 LEU HB3 A 83 LEU H 1.0 1.8 3.5 805 697 A 66 LYS HA A 66 LYS H 1.0 1.8 4.5 806 698 A 83 LEU H A 81 GLY HA2 1.0 1.8 5.5 807 698 A 81 GLY HA3 A 83 LEU H 1.0 1.8 5.5 808 699 A 66 LYS HBy A 66 LYS H 1.0 1.8 3.5 809 700 A 66 LYS HBx A 66 LYS H 1.0 1.8 4.5 810 701 A 66 LYS H A 65 GLU HB2 1.0 1.8 4.5 811 701 A 65 GLU HB3 A 66 LYS H 1.0 1.8 4.5 812 702 A 83 LEU H A 82 GLN HG2 1.0 1.8 4.5 813 702 A 82 GLN HG3 A 83 LEU H 1.0 1.8 4.5 814 703 A 82 GLN HA A 83 LEU H 1.0 1.8 3.5 815 704 A 68 LYS H A 67 THR H 1.0 1.8 4.5 816 705 A 67 THR HB A 67 THR H 1.0 1.8 4.5 817 706 A 67 THR HA A 67 THR H 1.0 1.8 3.5 818 707 A 64 PRO HA A 67 THR H 1.0 1.8 5.5 819 708 A 67 THR H A 66 LYS HG2 1.0 1.8 5.5 820 708 A 66 LYS HG3 A 67 THR H 1.0 1.8 5.5 821 709 A 66 LYS HBy A 67 THR H 1.0 1.8 4.5 822 710 A 66 LYS HBx A 67 THR H 1.0 1.8 4.5 823 711 A 68 LYS H A 69 ALA H 1.0 1.8 4.5 824 712 A 68 LYS H A 67 THR H 1.0 1.8 5.5 825 713 A 67 THR HB A 68 LYS H 1.0 1.8 5.5 826 714 A 68 LYS HA A 68 LYS H 1.0 1.8 4.5 827 715 A 67 THR HA A 68 LYS H 1.0 1.8 4.5 828 716 A 68 LYS H A 68 LYS HD2 1.0 1.8 4.5 829 716 A 68 LYS HD3 A 68 LYS H 1.0 1.8 4.5 830 717 A 68 LYS H A 68 LYS HB2 1.0 1.8 4.5 831 717 A 68 LYS HB3 A 68 LYS H 1.0 1.8 4.5 832 718 A 68 LYS H A 69 ALA H 1.0 1.8 4.5 833 719 A 69 ALA H A 70 VAL H 1.0 1.8 4.5 834 720 A 68 LYS HA A 69 ALA H 1.0 1.8 5.5 835 721 A 69 ALA HA A 69 ALA H 1.0 1.8 3.5 836 722 A 69 ALA HB% A 69 ALA H 1.0 1.8 4.5 837 723 A 69 ALA H A 68 LYS HB2 1.0 1.8 4.5 838 723 A 68 LYS HB3 A 69 ALA H 1.0 1.8 4.5 839 724 A 72 ASN H A 71 GLU H 1.0 1.8 4.5 840 725 A 71 GLU H A 70 VAL H 1.0 1.8 4.5 841 726 A 71 GLU HA A 71 GLU H 1.0 1.8 4.5 842 727 A 70 VAL HA A 71 GLU H 1.0 1.8 5.5 843 728 A 68 LYS HA A 71 GLU H 1.0 1.8 5.5 844 729 A 71 GLU HBx A 71 GLU H 1.0 1.8 4.5 845 730 A 71 GLU HGx A 71 GLU H 1.0 1.8 4.5 846 731 A 71 GLU HGy A 71 GLU H 1.0 1.8 4.5 847 732 A 71 GLU HBy A 71 GLU H 1.0 1.8 4.5 848 733 A 70 VAL HGx% A 71 GLU H 1.0 1.8 4.5 849 734 A 44 LEU HDy% A 71 GLU H 1.0 1.8 5.5 850 735 A 72 ASN H A 73 TYR H 1.0 1.8 4.5 851 736 A 72 ASN H A 71 GLU H 1.0 1.8 4.5 852 737 A 72 ASN H A 70 VAL H 1.0 1.8 4.5 853 738 A 72 ASN HA A 72 ASN H 1.0 1.8 4.5 854 739 A 72 ASN HBy A 72 ASN H 1.0 1.8 4.5 855 740 A 72 ASN HBx A 72 ASN H 1.0 1.8 4.5 856 741 A 71 GLU HGx A 72 ASN H 1.0 1.8 5.5 857 742 A 69 ALA HA A 72 ASN H 1.0 1.8 4.5 858 743 A 68 LYS HA A 72 ASN H 1.0 1.8 4.5 859 744 A 71 GLU HA A 72 ASN H 1.0 1.8 5.5 860 745 A 71 GLU HGy A 72 ASN H 1.0 1.8 4.5 861 746 A 71 GLU HBx A 72 ASN H 1.0 1.8 4.5 862 747 A 71 GLU HBy A 72 ASN H 1.0 1.8 4.5 863 748 A 74 LEU H A 73 TYR H 1.0 1.8 4.5 864 749 A 74 LEU HA A 74 LEU H 1.0 1.8 4.5 865 750 A 74 LEU HBx A 74 LEU H 1.0 1.8 4.5 866 751 A 74 LEU HBy A 74 LEU H 1.0 1.8 4.5 867 752 A 74 LEU HDy% A 74 LEU H 1.0 1.8 4.5 868 753 A 74 LEU HDx% A 74 LEU H 1.0 1.8 5.5 869 754 A 73 TYR HBy A 74 LEU H 1.0 1.8 4.5 870 755 A 73 TYR HBx A 74 LEU H 1.0 1.8 4.5 871 756 A 73 TYR HA A 74 LEU H 1.0 1.8 5.5 872 757 A 75 ILE H A 76 GLN H 1.0 1.8 4.5 873 758 A 75 ILE H A 77 MET H 1.0 1.8 5.5 874 759 A 75 ILE HA A 75 ILE H 1.0 1.8 4.5 875 760 A 75 ILE HG2% A 75 ILE H 1.0 1.8 4.5 876 761 A 75 ILE H A 75 ILE HG1x 1.0 1.8 5.5 877 761 A 75 ILE HG1y A 75 ILE H 1.0 1.8 5.5 878 762 A 75 ILE HB A 75 ILE H 1.0 1.8 4.5 879 763 A 74 LEU HBx A 75 ILE H 1.0 1.8 4.5 880 764 A 74 LEU HA A 75 ILE H 1.0 1.8 5.5 881 765 A 72 ASN HA A 75 ILE H 1.0 1.8 5.5 882 766 A 76 GLN H A 77 MET H 1.0 1.8 4.5 883 767 A 75 ILE H A 76 GLN H 1.0 1.8 4.5 884 768 A 76 GLN HA A 76 GLN H 1.0 1.8 3.5 885 769 A 75 ILE HA A 76 GLN H 1.0 1.8 4.5 886 770 A 72 ASN HA A 76 GLN H 1.0 1.8 5.5 887 771 A 75 ILE HG2% A 76 GLN H 1.0 1.8 4.5 888 772 A 75 ILE HB A 76 GLN H 1.0 1.8 3.5 889 773 A 76 GLN H A 76 GLN HB2 1.0 1.8 3.5 890 773 A 76 GLN HB3 A 76 GLN H 1.0 1.8 3.5 891 774 A 76 GLN H A 76 GLN HG2 1.0 1.8 4.5 892 774 A 76 GLN HG3 A 76 GLN H 1.0 1.8 4.5 893 775 A 76 GLN H A 77 MET H 1.0 1.8 4.5 894 776 A 77 MET H A 78 ALA H 1.0 1.8 4.5 895 777 A 77 MET HA A 77 MET H 1.0 1.8 3.5 896 778 A 76 GLN HA A 77 MET H 1.0 1.8 4.5 897 779 A 73 TYR HA A 77 MET H 1.0 1.8 5.5 898 780 A 77 MET H A 76 GLN HB2 1.0 1.8 3.5 899 780 A 76 GLN HB3 A 77 MET H 1.0 1.8 3.5 900 781 A 77 MET HBx A 77 MET H 1.0 1.8 3.5 901 782 A 79 ARG H A 80 TYR H 1.0 1.8 4.5 902 783 A 80 TYR HA A 80 TYR H 1.0 1.8 4.5 903 784 A 80 TYR HBy A 80 TYR H 1.0 1.8 4.5 904 785 A 80 TYR HBx A 80 TYR H 1.0 1.8 4.5 905 786 A 79 ARG HBx A 80 TYR H 1.0 1.8 4.5 906 787 A 79 ARG HBy A 80 TYR H 1.0 1.8 4.5 907 788 A 77 MET HA A 80 TYR H 1.0 1.8 4.5 908 789 A 79 ARG HA A 80 TYR H 1.0 1.8 4.5 909 790 A 78 ALA HB% A 78 ALA H 1.0 1.8 4.5 910 791 A 87 VAL HB A 88 SER H 1.0 1.8 4.5 911 792 A 78 ALA HA A 78 ALA H 1.0 1.8 4.5 912 793 A 76 GLN H A 78 ALA H 1.0 1.8 4.5 913 794 A 79 ARG H A 78 ALA H 1.0 1.8 3.5 914 795 A 88 SER HA A 88 SER H 1.0 1.8 4.5 915 796 A 88 SER HBx A 88 SER H 1.0 1.8 4.5 916 797 A 75 ILE HA A 78 ALA H 1.0 1.8 5.5 917 798 A 77 MET HBx A 78 ALA H 1.0 1.8 4.5 918 799 A 87 VAL HGx% A 88 SER H 1.0 1.8 4.5 919 800 A 88 SER H A 90 GLN H 1.0 1.8 5.5 920 801 A 83 LEU H A 81 GLY H 1.0 1.8 4.5 921 802 A 81 GLY H A 82 GLN H 1.0 1.8 3.5 922 803 A 78 ALA HA A 81 GLY H 1.0 1.8 4.5 923 804 A 80 TYR HA A 81 GLY H 1.0 1.8 4.5 924 805 A 80 TYR HBx A 81 GLY H 1.0 1.8 5.5 925 806 A 80 TYR HBy A 81 GLY H 1.0 1.8 5.5 926 807 A 86 LYS HA A 87 VAL H 1.0 1.8 4.5 927 808 A 87 VAL HB A 87 VAL H 1.0 1.8 5.5 928 809 A 87 VAL HGx% A 87 VAL H 1.0 1.8 5.5 929 810 A 90 GLN H A 89 GLU H 1.0 1.8 4.5 930 811 A 89 GLU HA A 89 GLU H 1.0 1.8 4.5 931 812 A 89 GLU HGy A 89 GLU H 1.0 1.8 4.5 932 813 A 89 GLU HBx A 89 GLU H 1.0 1.8 4.5 933 814 A 89 GLU HBy A 89 GLU H 1.0 1.8 4.5 934 815 A 88 SER HBy A 89 GLU H 1.0 1.8 4.5 935 816 A 88 SER HBx A 89 GLU H 1.0 1.8 4.5 936 817 A 88 SER HA A 89 GLU H 1.0 1.8 4.5 937 818 A 90 GLN H A 91 GLY H 1.0 1.8 4.5 938 819 A 91 GLY H A 92 LEU H 1.0 1.8 4.5 939 820 A 90 GLN HA A 91 GLY H 1.0 1.8 4.5 940 821 A 91 GLY H A 91 GLY HA2 1.0 1.8 3.5 941 821 A 91 GLY HA3 A 91 GLY H 1.0 1.8 3.5 942 822 A 91 GLY H A 90 GLN HB2 1.0 1.8 4.5 943 822 A 91 GLY H A 90 GLN HB3 1.0 1.8 4.5 944 823 A 93 ILE H A 92 LEU H 1.0 1.8 4.5 945 824 A 91 GLY H A 92 LEU H 1.0 1.8 4.5 946 825 A 92 LEU HA A 92 LEU H 1.0 1.8 4.5 947 826 A 89 GLU HA A 92 LEU H 1.0 1.8 4.5 948 827 A 92 LEU H A 91 GLY HA2 1.0 1.8 5.5 949 827 A 91 GLY HA3 A 92 LEU H 1.0 1.8 5.5 950 828 A 92 LEU HBx A 92 LEU H 1.0 1.8 3.5 951 829 A 92 LEU HBy A 92 LEU H 1.0 1.8 4.5 952 830 A 92 LEU HG A 92 LEU H 1.0 1.8 4.5 953 831 A 92 LEU HDy% A 92 LEU H 1.0 1.8 4.5 954 832 A 94 GLU H A 95 ILE H 1.0 1.8 4.5 955 833 A 93 ILE H A 94 GLU H 1.0 1.8 4.5 956 834 A 94 GLU H A 96 LEU H 1.0 1.8 5.5 957 835 A 93 ILE HA A 94 GLU H 1.0 1.8 5.5 958 836 A 94 GLU HA A 94 GLU H 1.0 1.8 4.5 959 837 A 94 GLU H A 94 GLU HG2 1.0 1.8 4.5 960 837 A 94 GLU HG3 A 94 GLU H 1.0 1.8 4.5 961 838 A 94 GLU H A 94 GLU HB2 1.0 1.8 3.5 962 838 A 94 GLU HB3 A 94 GLU H 1.0 1.8 3.5 963 839 A 93 ILE HG1x A 94 GLU H 1.0 1.8 4.5 964 840 A 95 ILE HG1x A 94 GLU H 1.0 1.8 5.5 965 841 A 93 ILE HG2% A 94 GLU H 1.0 1.8 5.5 966 842 A 94 GLU H A 95 ILE H 1.0 1.8 4.5 967 843 A 95 ILE H A 96 LEU H 1.0 1.8 4.5 968 844 A 95 ILE HA A 95 ILE H 1.0 1.8 4.5 969 845 A 92 LEU HA A 95 ILE H 1.0 1.8 4.5 970 846 A 95 ILE HG2% A 95 ILE H 1.0 1.8 5.5 971 847 A 95 ILE HD1% A 95 ILE H 1.0 1.8 4.5 972 848 A 95 ILE HG1y A 95 ILE H 1.0 1.8 4.5 973 849 A 92 LEU HG A 95 ILE H 1.0 1.8 6.0 974 850 A 95 ILE HG1x A 95 ILE H 1.0 1.8 3.5 975 851 A 95 ILE HB A 95 ILE H 1.0 1.8 4.5 976 852 A 95 ILE H A 94 GLU HB2 1.0 1.8 4.5 977 852 A 94 GLU HB3 A 95 ILE H 1.0 1.8 4.5 978 853 A 96 LEU H A 97 LYS H 1.0 1.8 4.5 979 854 A 95 ILE H A 96 LEU H 1.0 1.8 4.5 980 855 A 96 LEU HA A 96 LEU H 1.0 1.8 4.5 981 856 A 92 LEU HA A 96 LEU H 1.0 1.8 4.5 982 857 A 93 ILE HA A 96 LEU H 1.0 1.8 5.5 983 858 A 96 LEU HDx% A 96 LEU H 1.0 1.8 5.0 984 859 A 70 VAL HGx% A 96 LEU H 1.0 1.8 6.0 985 860 A 95 ILE HG1y A 96 LEU H 1.0 1.8 5.5 986 861 A 95 ILE HB A 96 LEU H 1.0 1.8 4.5 987 862 A 96 LEU HG A 96 LEU H 1.0 1.8 4.5 988 863 A 96 LEU H A 96 LEU HB2 1.0 1.8 4.5 989 863 A 96 LEU HB3 A 96 LEU H 1.0 1.8 4.5 990 864 A 96 LEU H A 97 LYS H 1.0 1.8 4.5 991 865 A 96 LEU HA A 97 LYS H 1.0 1.8 5.5 992 866 A 94 GLU HA A 97 LYS H 1.0 1.8 4.5 993 867 A 97 LYS HA A 97 LYS H 1.0 1.8 4.5 994 868 A 97 LYS H A 97 LYS HG2 1.0 1.8 5.5 995 868 A 97 LYS HG3 A 97 LYS H 1.0 1.8 5.5 996 869 A 97 LYS H A 97 LYS HB2 1.0 1.8 4.5 997 869 A 97 LYS HB3 A 97 LYS H 1.0 1.8 4.5 998 870 A 97 LYS H A 96 LEU HB2 1.0 1.8 4.5 999 870 A 96 LEU HB3 A 97 LYS H 1.0 1.8 4.5 1000 871 A 96 LEU HG A 97 LYS H 1.0 1.8 4.5 1001 872 A 99 VAL HA A 99 VAL H 1.0 1.8 3.5 1002 873 A 96 LEU HA A 99 VAL H 1.0 1.8 5.5 1003 874 A 98 LYS HA A 99 VAL H 1.0 1.8 4.5 1004 875 A 99 VAL HGx% A 99 VAL H 1.0 1.8 4.5 1005 876 A 99 VAL HB A 99 VAL H 1.0 1.8 5.0 1006 877 A 99 VAL H A 98 LYS HB2 1.0 1.8 4.5 1007 877 A 98 LYS HB3 A 99 VAL H 1.0 1.8 4.5 1008 878 A 99 VAL H A 98 LYS HDy 1.0 1.8 5.5 1009 879 A 99 VAL H A 100 SER H 1.0 1.8 4.5 1010 880 A 100 SER H A 102 GLN H 1.0 1.8 5.5 1011 881 A 100 SER H A 98 LYS H 1.0 1.8 4.5 1012 882 A 100 SER HA A 100 SER H 1.0 1.8 3.5 1013 883 A 98 LYS HA A 100 SER H 1.0 1.8 5.5 1014 884 A 99 VAL HGx% A 100 SER H 1.0 1.8 4.5 1015 885 A 99 VAL HB A 100 SER H 1.0 1.8 4.5 1016 886 A 101 GLN H A 102 GLN H 1.0 1.8 4.5 1017 887 A 101 GLN H A 100 SER HBx 1.0 1.8 4.5 1018 888 A 101 GLN H A 101 GLN HB2 1.0 1.8 3.5 1019 888 A 101 GLN HB3 A 101 GLN H 1.0 1.8 3.5 1020 889 A 101 GLN H A 101 GLN HG2 1.0 1.8 4.5 1021 889 A 101 GLN HG3 A 101 GLN H 1.0 1.8 4.5 1022 890 A 98 LYS HA A 101 GLN H 1.0 1.8 5.5 1023 891 A 99 VAL HA A 102 GLN H 1.0 1.8 4.5 1024 892 A 102 GLN H A 102 GLN HB2 1.0 1.8 3.5 1025 892 A 102 GLN HB3 A 102 GLN H 1.0 1.8 3.5 1026 893 A 102 GLN HGy A 102 GLN H 1.0 1.8 4.5 1027 894 A 102 GLN HGx A 102 GLN H 1.0 1.8 4.5 1028 895 A 103 THR H A 104 GLU H 1.0 1.8 3.5 1029 896 A 101 GLN H A 103 THR H 1.0 1.8 5.5 1030 897 A 103 THR H A 103 THR HB 1.0 1.8 3.5 1031 898 A 103 THR HG2% A 103 THR H 1.0 1.8 5.5 1032 899 A 102 GLN HGx A 103 THR H 1.0 1.8 4.5 1033 900 A 103 THR H A 102 GLN HB2 1.0 1.8 4.5 1034 900 A 102 GLN HB3 A 103 THR H 1.0 1.8 4.5 1035 901 A 103 THR H A 104 GLU H 1.0 1.8 3.5 1036 902 A 104 GLU H A 104 GLU HG2 1.0 1.8 4.5 1037 902 A 104 GLU HG3 A 104 GLU H 1.0 1.8 4.5 1038 903 A 104 GLU HBx A 104 GLU H 1.0 1.8 4.5 1039 904 A 104 GLU HBy A 104 GLU H 1.0 1.8 4.5 1040 905 A 111 PHE H A 111 PHE HA 1.0 1.8 4.5 1041 906 A 111 PHE H A 111 PHE HBy 1.0 1.8 4.5 1042 907 A 111 PHE H A 111 PHE HBx 1.0 1.8 5.5 1043 908 A 104 GLU HBx A 105 LYS H 1.0 1.8 4.5 1044 909 A 105 LYS H A 105 LYS HB2 1.0 1.8 4.5 1045 909 A 105 LYS HB3 A 105 LYS H 1.0 1.8 4.5 1046 910 A 112 ASN H A 111 PHE HA 1.0 1.8 4.5 1047 911 A 112 ASN H A 112 ASN HA 1.0 1.8 5.5 1048 912 A 110 LYS HA A 110 LYS H 1.0 1.8 4.5 1049 913 A 109 VAL HA A 110 LYS H 1.0 1.8 3.5 1050 914 A 109 VAL HB A 110 LYS H 1.0 1.8 5.5 1051 915 A 110 LYS H A 110 LYS HBx 1.0 1.8 5.5 1052 915 A 110 LYS HBy A 110 LYS H 1.0 1.8 5.5 1053 916 A 109 VAL HA A 109 VAL H 1.0 1.8 4.5 1054 917 A 108 THR HB A 109 VAL H 1.0 1.8 4.5 1055 918 A 109 VAL HB A 109 VAL H 1.0 1.8 4.5 1056 919 A 108 THR HB A 108 THR H 1.0 1.8 3.5 1057 920 A 105 LYS H A 106 THR H 1.0 1.8 4.5 1058 921 A 106 THR HB A 106 THR H 1.0 1.8 4.5 1059 922 A 64 PRO HDy A 63 LYS H 1.0 1.8 5.5 1060 923 A 47 VAL HB A 48 LEU H 1.0 1.8 5.5 1061 924 A 47 VAL HA A 48 LEU H 1.0 1.8 5.5 1062 925 A 42 SER H A 40 ARG HB2 1.0 1.8 5.5 1063 925 A 40 ARG HB3 A 42 SER H 1.0 1.8 5.5 1064 926 A 72 ASN H A 72 ASN HD2x 1.0 1.8 4.5 1065 927 A 72 ASN HD2y A 72 ASN H 1.0 1.8 5.5 1066 928 A 57 SER H A 56 LEU HBy 1.0 1.8 4.5 1067 929 A 58 ASN HD2x A 58 ASN HBx 1.0 1.8 4.5 1068 930 A 41 ASN HBy A 41 ASN HD2y 1.0 1.8 4.5 1069 931 A 69 ALA HA A 72 ASN HD2x 1.0 1.8 5.5 1070 932 A 20 LYS HA A 21 HIS H 1.0 1.8 4.0 1071 933 A 74 LEU HG A 74 LEU H 1.0 1.8 4.5 1072 934 A 74 LEU HBx A 78 ALA H 1.0 1.8 4.5 1073 935 A 19 ALA HA A 19 ALA H 1.0 1.8 3.5 1074 936 A 53 ARG HBx A 54 ALA H 1.0 1.8 4.5 1075 937 A 32 ALA HA A 35 ARG H 1.0 1.8 3.5 1076 938 A 63 LYS HBx A 66 LYS H 1.0 1.8 3.5 1077 939 A 83 LEU H A 82 GLN HB2 1.0 1.8 4.5 1078 939 A 82 GLN HB3 A 83 LEU H 1.0 1.8 4.5 1079 940 A 36 GLU HA A 36 GLU H 1.0 1.8 3.5 1080 941 A 31 GLU HA A 34 HIS H 1.0 1.8 3.5 1081 942 A 49 ASP H A 86 LYS HG2 1.0 1.8 4.5 1082 942 A 86 LYS HG3 A 49 ASP H 1.0 1.8 4.5 1083 943 A 3 ASP HA A 3 ASP H 1.0 1.8 3.5 1084 944 A 4 GLU H A 4 GLU HB2 1.0 1.8 3.5 1085 944 A 4 GLU HB3 A 4 GLU H 1.0 1.8 3.5 1086 945 A 6 LEU H A 5 GLU H 1.0 1.8 2.8 1087 946 A 5 GLU H A 4 GLU H 1.0 1.8 3.5 1088 947 A 5 GLU H A 5 GLU HA 1.0 1.8 2.8 1089 948 A 6 LEU H A 7 GLU H 1.0 1.8 3.5 1090 949 A 6 LEU HA A 6 LEU H 1.0 1.8 2.8 1091 950 A 6 LEU HBy A 6 LEU H 1.0 1.8 2.8 1092 951 A 6 LEU HBx A 6 LEU H 1.0 1.8 2.8 1093 952 A 7 GLU H A 8 ALA H 1.0 1.8 2.8 1094 953 A 7 GLU HA A 7 GLU H 1.0 1.8 2.8 1095 954 A 7 GLU H A 7 GLU HB2 1.0 1.8 2.8 1096 954 A 7 GLU HB3 A 7 GLU H 1.0 1.8 2.8 1097 955 A 6 LEU HBx A 7 GLU H 1.0 1.8 3.5 1098 956 A 8 ALA H A 9 LEU H 1.0 1.8 3.5 1099 957 A 7 GLU H A 8 ALA H 1.0 1.8 3.5 1100 958 A 8 ALA HA A 8 ALA H 1.0 1.8 3.5 1101 959 A 10 ARG H A 9 LEU H 1.0 1.8 2.8 1102 960 A 9 LEU HA A 9 LEU H 1.0 1.8 2.8 1103 961 A 9 LEU H A 9 LEU HBy 1.0 1.8 3.5 1104 962 A 9 LEU HBx A 9 LEU H 1.0 1.8 3.5 1105 963 A 10 ARG H A 9 LEU H 1.0 1.8 3.5 1106 964 A 10 ARG HA A 10 ARG H 1.0 1.8 2.8 1107 965 A 10 ARG HBx A 10 ARG H 1.0 1.8 2.8 1108 966 A 11 ARG H A 12 GLN H 1.0 1.8 3.5 1109 967 A 11 ARG HA A 11 ARG H 1.0 1.8 3.5 1110 968 A 11 ARG HBx A 11 ARG H 1.0 1.8 2.8 1111 969 A 10 ARG H A 11 ARG H 1.0 1.8 2.8 1112 970 A 12 GLN HA A 12 GLN H 1.0 1.8 2.8 1113 971 A 12 GLN H A 12 GLN HB2 1.0 1.8 3.5 1114 971 A 12 GLN HB3 A 12 GLN H 1.0 1.8 3.5 1115 972 A 13 ARG H A 13 ARG HB2 1.0 1.8 3.5 1116 972 A 13 ARG HB3 A 13 ARG H 1.0 1.8 3.5 1117 973 A 13 ARG HA A 13 ARG H 1.0 1.8 2.8 1118 974 A 14 LEU H A 15 ALA H 1.0 1.8 2.8 1119 975 A 14 LEU HA A 14 LEU H 1.0 1.8 3.5 1120 976 A 14 LEU HBy A 14 LEU H 1.0 1.8 3.5 1121 977 A 14 LEU HBx A 14 LEU H 1.0 1.8 3.3 1122 978 A 93 ILE HB A 93 ILE H 1.0 1.8 3.5 1123 979 A 15 ALA H A 16 GLU H 1.0 1.8 2.8 1124 980 A 15 ALA H A 15 ALA HA 1.0 1.8 2.8 1125 981 A 17 LEU H A 16 GLU H 1.0 1.8 2.8 1126 982 A 16 GLU HA A 16 GLU H 1.0 1.8 2.8 1127 983 A 16 GLU HGx A 16 GLU H 1.0 1.8 3.5 1128 984 A 16 GLU H A 16 GLU HB2 1.0 1.8 3.5 1129 984 A 16 GLU H A 16 GLU HB3 1.0 1.8 3.5 1130 985 A 18 GLN H A 17 LEU H 1.0 1.8 2.8 1131 986 A 17 LEU HA A 17 LEU H 1.0 1.8 2.8 1132 987 A 17 LEU HBx A 17 LEU H 1.0 1.8 2.8 1133 988 A 18 GLN H A 19 ALA H 1.0 1.8 3.5 1134 989 A 18 GLN HA A 19 ALA H 1.0 1.8 3.5 1135 990 A 19 ALA HA A 20 LYS H 1.0 1.8 3.3 1136 991 A 20 LYS HBx A 20 LYS H 1.0 1.8 3.5 1137 992 A 25 GLY H A 25 GLY HA2 1.0 1.8 3.5 1138 992 A 25 GLY HA3 A 25 GLY H 1.0 1.8 3.5 1139 993 A 26 ASP H A 25 GLY HA2 1.0 1.8 3.5 1140 993 A 25 GLY HA3 A 26 ASP H 1.0 1.8 3.5 1141 994 A 28 ALA H A 29 GLN H 1.0 1.8 3.5 1142 995 A 27 ALA H A 28 ALA H 1.0 1.8 2.8 1143 996 A 28 ALA HA A 28 ALA H 1.0 1.8 2.8 1144 997 A 28 ALA HB% A 28 ALA H 1.0 1.8 3.5 1145 998 A 29 GLN H A 30 GLN H 1.0 1.8 2.8 1146 999 A 29 GLN HA A 29 GLN H 1.0 1.8 2.8 1147 1000 A 29 GLN H A 29 GLN HB2 1.0 1.8 3.5 1148 1000 A 29 GLN HB3 A 29 GLN H 1.0 1.8 3.5 1149 1001 A 79 ARG HA A 79 ARG H 1.0 1.8 3.5 1150 1002 A 30 GLN H A 30 GLN HB2 1.0 1.8 3.5 1151 1002 A 30 GLN HB3 A 30 GLN H 1.0 1.8 3.5 1152 1003 A 34 HIS H A 33 LYS H 1.0 1.8 3.5 1153 1004 A 34 HIS HBx A 34 HIS H 1.0 1.8 3.5 1154 1005 A 31 GLU H A 32 ALA H 1.0 1.8 2.8 1155 1006 A 31 GLU HA A 31 GLU H 1.0 1.8 3.5 1156 1007 A 31 GLU H A 31 GLU HB2 1.0 1.8 3.5 1157 1007 A 31 GLU HB3 A 31 GLU H 1.0 1.8 3.5 1158 1008 A 32 ALA HA A 32 ALA H 1.0 1.8 2.8 1159 1009 A 38 GLU H A 38 GLU HA 1.0 1.8 3.5 1160 1010 A 35 ARG H A 36 GLU H 1.0 1.8 2.8 1161 1011 A 85 GLU HA A 86 LYS H 1.0 1.8 2.8 1162 1012 A 35 ARG H A 35 ARG HB2 1.0 1.8 3.5 1163 1012 A 35 ARG HB3 A 35 ARG H 1.0 1.8 3.5 1164 1013 A 86 LYS H A 86 LYS HG2 1.0 1.8 3.5 1165 1013 A 86 LYS HG3 A 86 LYS H 1.0 1.8 3.5 1166 1014 A 85 GLU HBx A 86 LYS H 1.0 1.8 3.5 1167 1015 A 37 ALA HA A 37 ALA H 1.0 1.8 2.8 1168 1016 A 38 GLU H A 38 GLU HA 1.0 1.8 2.8 1169 1017 A 38 GLU H A 38 GLU HB2 1.0 1.8 3.5 1170 1017 A 38 GLU H A 38 GLU HB3 1.0 1.8 3.5 1171 1018 A 38 GLU HA A 39 MET H 1.0 1.8 3.5 1172 1019 A 41 ASN HA A 41 ASN H 1.0 1.8 2.8 1173 1020 A 41 ASN HBy A 41 ASN H 1.0 1.8 3.5 1174 1021 A 107 THR HB A 107 THR H 1.0 1.8 3.5 1175 1022 A 83 LEU H A 82 GLN H 1.0 1.8 3.5 1176 1023 A 42 SER HA A 42 SER H 1.0 1.8 3.5 1177 1024 A 42 SER HBy A 42 SER H 1.0 1.8 3.5 1178 1025 A 73 TYR HA A 73 TYR H 1.0 1.8 3.5 1179 1026 A 54 ALA H A 55 ARG H 1.0 1.8 3.5 1180 1027 A 46 GLN H A 47 VAL H 1.0 1.8 3.5 1181 1028 A 50 GLN HBx A 50 GLN H 1.0 1.8 3.5 1182 1029 A 51 SER HBx A 51 SER H 1.0 1.8 3.5 1183 1030 A 90 GLN HA A 90 GLN H 1.0 1.8 3.5 1184 1031 A 83 LEU HA A 84 SER H 1.0 1.8 3.5 1185 1032 A 57 SER HA A 57 SER H 1.0 1.8 3.5 1186 1033 A 57 SER HBx A 57 SER H 1.0 1.8 3.5 1187 1034 A 59 LEU H A 58 ASN H 1.0 1.8 3.5 1188 1035 A 57 SER HBx A 58 ASN H 1.0 1.8 3.5 1189 1036 A 85 GLU HA A 85 GLU H 1.0 1.8 3.5 1190 1037 A 60 ALA HA A 60 ALA H 1.0 1.8 3.5 1191 1038 A 87 VAL HA A 88 SER H 1.0 1.8 2.8 1192 1039 A 81 GLY H A 81 GLY HA2 1.0 1.8 3.5 1193 1039 A 81 GLY HA3 A 81 GLY H 1.0 1.8 3.5 1194 1040 A 100 SER H A 100 SER HBx 1.0 1.8 3.5 1195 1041 A 100 SER HBy A 100 SER H 1.0 1.8 3.5 1196 1042 A 101 GLN HA A 101 GLN H 1.0 1.8 3.5 1197 1043 A 101 GLN H A 102 GLN H 1.0 1.8 3.5 1198 1044 A 102 GLN HA A 102 GLN H 1.0 1.8 3.5 1199 1045 A 101 GLN HA A 102 GLN H 1.0 1.8 3.5 1200 1046 A 103 THR HA A 103 THR H 1.0 1.8 3.5 1201 1047 A 103 THR HA A 104 GLU H 1.0 1.8 3.5 1202 1048 A 104 GLU HA A 105 LYS H 1.0 1.8 3.3 1203 1049 A 108 THR HA A 109 VAL H 1.0 1.8 3.5 1204 1050 A 107 THR HA A 108 THR H 1.0 1.8 3.5 1205 1051 A 106 THR HA A 106 THR H 1.0 1.8 3.5 1206 1052 A 102 GLN HA A 103 THR H 1.0 1.8 3.5 1207 1053 A 20 LYS HA A 20 LYS H 1.0 1.8 4.0 1208 1054 A 55 ARG HA A 56 LEU H 1.0 1.8 3.5 1209 1055 A 33 LYS HA A 33 LYS H 1.0 1.8 3.5 1210 1056 A 104 GLU HA A 104 GLU H 1.0 1.8 3.5 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 SER C A 2 ALA N A 2 ALA CA A 2 ALA C 1.0 -91.63 -38.83 PHI 2 2 A 2 ALA C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -77.62 -50.22 PHI 3 3 A 3 ASP C A 4 GLU N A 4 GLU CA A 4 GLU C 1.0 -78.69 -50.05 PHI 4 4 A 4 GLU C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 -83.83 -48.35 PHI 5 5 A 5 GLU C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -76.88 -45.52 PHI 6 6 A 6 LEU C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -78.30 -53.74 PHI 7 7 A 7 GLU C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -80.47 -47.03 PHI 8 8 A 8 ALA C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -75.40 -50.28 PHI 9 9 A 9 LEU C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -81.15 -50.07 PHI 10 10 A 10 ARG C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -79.69 -54.97 PHI 11 11 A 11 ARG C A 12 GLN N A 12 GLN CA A 12 GLN C 1.0 -75.02 -57.38 PHI 12 12 A 12 GLN C A 13 ARG N A 13 ARG CA A 13 ARG C 1.0 -82.49 -46.69 PHI 13 13 A 13 ARG C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -71.88 -47.40 PHI 14 14 A 14 LEU C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -78.94 -47.38 PHI 15 15 A 15 ALA C A 16 GLU N A 16 GLU CA A 16 GLU C 1.0 -82.18 -52.54 PHI 16 16 A 16 GLU C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -85.33 -44.01 PHI 17 17 A 22 GLY C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -159.03 -64.35 PHI 18 18 A 26 ASP C A 27 ALA N A 27 ALA CA A 27 ALA C 1.0 -67.05 -52.73 PHI 19 19 A 27 ALA C A 28 ALA N A 28 ALA CA A 28 ALA C 1.0 -82.15 -50.39 PHI 20 20 A 28 ALA C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -82.68 -47.84 PHI 21 21 A 29 GLN C A 30 GLN N A 30 GLN CA A 30 GLN C 1.0 -77.08 -50.24 PHI 22 22 A 30 GLN C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -77.93 -52.25 PHI 23 23 A 31 GLU C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -81.38 -50.62 PHI 24 24 A 32 ALA C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -76.93 -50.85 PHI 25 25 A 33 LYS C A 34 HIS N A 34 HIS CA A 34 HIS C 1.0 -81.37 -49.77 PHI 26 26 A 34 HIS C A 35 ARG N A 35 ARG CA A 35 ARG C 1.0 -80.93 -49.13 PHI 27 27 A 35 ARG C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -76.62 -53.14 PHI 28 28 A 36 GLU C A 37 ALA N A 37 ALA CA A 37 ALA C 1.0 -79.30 -49.42 PHI 29 29 A 37 ALA C A 38 GLU N A 38 GLU CA A 38 GLU C 1.0 -79.22 -54.22 PHI 30 30 A 38 GLU C A 39 MET N A 39 MET CA A 39 MET C 1.0 -83.64 -49.64 PHI 31 31 A 39 MET C A 40 ARG N A 40 ARG CA A 40 ARG C 1.0 -73.77 -48.97 PHI 32 32 A 40 ARG C A 41 ASN N A 41 ASN CA A 41 ASN C 1.0 -71.31 -57.43 PHI 33 33 A 41 ASN C A 42 SER N A 42 SER CA A 42 SER C 1.0 -78.92 -56.00 PHI 34 34 A 42 SER C A 43 ILE N A 43 ILE CA A 43 ILE C 1.0 -75.36 -55.52 PHI 35 35 A 43 ILE C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -85.20 -46.68 PHI 36 36 A 44 LEU C A 45 ALA N A 45 ALA CA A 45 ALA C 1.0 -92.80 -48.64 PHI 37 37 A 45 ALA C A 46 GLN N A 46 GLN CA A 46 GLN C 1.0 -96.46 -46.46 PHI 38 38 A 46 GLN C A 47 VAL N A 47 VAL CA A 47 VAL C 1.0 -137.01 -70.13 PHI 39 39 A 49 ASP C A 50 GLN N A 50 GLN CA A 50 GLN C 1.0 -70.47 -48.51 PHI 40 40 A 50 GLN C A 51 SER N A 51 SER CA A 51 SER C 1.0 -80.86 -55.14 PHI 41 41 A 51 SER C A 52 ALA N A 52 ALA CA A 52 ALA C 1.0 -75.07 -51.75 PHI 42 42 A 52 ALA C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 -77.40 -55.04 PHI 43 43 A 53 ARG C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -79.59 -46.71 PHI 44 44 A 54 ALA C A 55 ARG N A 55 ARG CA A 55 ARG C 1.0 -82.01 -51.85 PHI 45 45 A 55 ARG C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -73.69 -46.49 PHI 46 46 A 56 LEU C A 57 SER N A 57 SER CA A 57 SER C 1.0 -70.91 -57.59 PHI 47 47 A 57 SER C A 58 ASN N A 58 ASN CA A 58 ASN C 1.0 -80.45 -50.49 PHI 48 48 A 58 ASN C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 -76.13 -50.25 PHI 49 49 A 59 LEU C A 60 ALA N A 60 ALA CA A 60 ALA C 1.0 -85.77 -49.61 PHI 50 50 A 60 ALA C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -111.21 -50.65 PHI 51 51 A 63 LYS C A 64 PRO N A 64 PRO CA A 64 PRO C 1.0 -70.79 -44.15 PHI 52 52 A 64 PRO C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -77.03 -53.23 PHI 53 53 A 65 GLU C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -78.18 -56.74 PHI 54 54 A 66 LYS C A 67 THR N A 67 THR CA A 67 THR C 1.0 -77.04 -54.32 PHI 55 55 A 67 THR C A 68 LYS N A 68 LYS CA A 68 LYS C 1.0 -69.77 -54.25 PHI 56 56 A 68 LYS C A 69 ALA N A 69 ALA CA A 69 ALA C 1.0 -69.72 -58.88 PHI 57 57 A 69 ALA C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -75.42 -55.58 PHI 58 58 A 70 VAL C A 71 GLU N A 71 GLU CA A 71 GLU C 1.0 -67.02 -51.30 PHI 59 59 A 71 GLU C A 72 ASN N A 72 ASN CA A 72 ASN C 1.0 -80.81 -51.93 PHI 60 60 A 72 ASN C A 73 TYR N A 73 TYR CA A 73 TYR C 1.0 -74.14 -57.94 PHI 61 61 A 73 TYR C A 74 LEU N A 74 LEU CA A 74 LEU C 1.0 -66.18 -56.70 PHI 62 62 A 74 LEU C A 75 ILE N A 75 ILE CA A 75 ILE C 1.0 -74.96 -52.32 PHI 63 63 A 75 ILE C A 76 GLN N A 76 GLN CA A 76 GLN C 1.0 -75.34 -47.50 PHI 64 64 A 76 GLN C A 77 MET N A 77 MET CA A 77 MET C 1.0 -68.64 -59.48 PHI 65 65 A 77 MET C A 78 ALA N A 78 ALA CA A 78 ALA C 1.0 -74.53 -48.77 PHI 66 66 A 78 ALA C A 79 ARG N A 79 ARG CA A 79 ARG C 1.0 -82.32 -52.88 PHI 67 67 A 82 GLN C A 83 LEU N A 83 LEU CA A 83 LEU C 1.0 -141.40 -39.80 PHI 68 68 A 85 GLU C A 86 LYS N A 86 LYS CA A 86 LYS C 1.0 -143.59 -29.11 PHI 69 69 A 86 LYS C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -106.18 -49.38 PHI 70 70 A 87 VAL C A 88 SER N A 88 SER CA A 88 SER C 1.0 -126.90 -67.38 PHI 71 71 A 88 SER C A 89 GLU N A 89 GLU CA A 89 GLU C 1.0 -75.67 -49.83 PHI 72 72 A 89 GLU C A 90 GLN N A 90 GLN CA A 90 GLN C 1.0 -70.73 -52.25 PHI 73 73 A 90 GLN C A 91 GLY N A 91 GLY CA A 91 GLY C 1.0 -84.13 -51.93 PHI 74 74 A 91 GLY C A 92 LEU N A 92 LEU CA A 92 LEU C 1.0 -75.34 -57.18 PHI 75 75 A 92 LEU C A 93 ILE N A 93 ILE CA A 93 ILE C 1.0 -72.31 -55.55 PHI 76 76 A 93 ILE C A 94 GLU N A 94 GLU CA A 94 GLU C 1.0 -68.64 -62.88 PHI 77 77 A 94 GLU C A 95 ILE N A 95 ILE CA A 95 ILE C 1.0 -74.33 -54.93 PHI 78 78 A 95 ILE C A 96 LEU N A 96 LEU CA A 96 LEU C 1.0 -70.47 -48.99 PHI 79 79 A 96 LEU C A 97 LYS N A 97 LYS CA A 97 LYS C 1.0 -69.25 -59.05 PHI 80 80 A 97 LYS C A 98 LYS N A 98 LYS CA A 98 LYS C 1.0 -70.60 -53.12 PHI 81 81 A 99 VAL C A 100 SER N A 100 SER CA A 100 SER C 1.0 -85.90 -41.02 PHI 82 82 A 100 SER C A 101 GLN N A 101 GLN CA A 101 GLN C 1.0 -104.68 -41.76 PHI 83 83 A 2 ALA N A 2 ALA CA A 2 ALA C A 3 ASP N 1.0 -77.82 10.14 PSI 84 84 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 GLU N 1.0 -62.36 -21.00 PSI 85 85 A 4 GLU N A 4 GLU CA A 4 GLU C A 5 GLU N 1.0 -53.87 -23.55 PSI 86 86 A 5 GLU N A 5 GLU CA A 5 GLU C A 6 LEU N 1.0 -56.12 -27.16 PSI 87 87 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 GLU N 1.0 -55.62 -24.26 PSI 88 88 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 ALA N 1.0 -55.48 -30.48 PSI 89 89 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 LEU N 1.0 -57.26 -25.86 PSI 90 90 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 ARG N 1.0 -56.38 -27.82 PSI 91 91 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 ARG N 1.0 -51.08 -26.20 PSI 92 92 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 GLN N 1.0 -47.68 -29.64 PSI 93 93 A 12 GLN N A 12 GLN CA A 12 GLN C A 13 ARG N 1.0 -53.49 -31.09 PSI 94 94 A 13 ARG N A 13 ARG CA A 13 ARG C A 14 LEU N 1.0 -55.43 -25.39 PSI 95 95 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 ALA N 1.0 -55.02 -27.30 PSI 96 96 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 GLU N 1.0 -53.32 -25.96 PSI 97 97 A 16 GLU N A 16 GLU CA A 16 GLU C A 17 LEU N 1.0 -57.61 -25.09 PSI 98 98 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 GLN N 1.0 -57.74 -18.06 PSI 99 99 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 PRO N 1.0 58.45 198.53 PSI 100 100 A 27 ALA N A 27 ALA CA A 27 ALA C A 28 ALA N 1.0 -56.94 -24.06 PSI 101 101 A 28 ALA N A 28 ALA CA A 28 ALA C A 29 GLN N 1.0 -54.44 -26.44 PSI 102 102 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 GLN N 1.0 -59.13 -26.01 PSI 103 103 A 30 GLN N A 30 GLN CA A 30 GLN C A 31 GLU N 1.0 -57.88 -22.96 PSI 104 104 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 ALA N 1.0 -55.41 -27.37 PSI 105 105 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 LYS N 1.0 -62.08 -16.88 PSI 106 106 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 HIS N 1.0 -55.81 -16.85 PSI 107 107 A 34 HIS N A 34 HIS CA A 34 HIS C A 35 ARG N 1.0 -58.70 -25.30 PSI 108 108 A 35 ARG N A 35 ARG CA A 35 ARG C A 36 GLU N 1.0 -50.32 -24.88 PSI 109 109 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 ALA N 1.0 -57.32 -27.36 PSI 110 110 A 37 ALA N A 37 ALA CA A 37 ALA C A 38 GLU N 1.0 -58.02 -26.70 PSI 111 111 A 38 GLU N A 38 GLU CA A 38 GLU C A 39 MET N 1.0 -49.15 -31.19 PSI 112 112 A 39 MET N A 39 MET CA A 39 MET C A 40 ARG N 1.0 -49.47 -27.47 PSI 113 113 A 40 ARG N A 40 ARG CA A 40 ARG C A 41 ASN N 1.0 -55.33 -27.29 PSI 114 114 A 41 ASN N A 41 ASN CA A 41 ASN C A 42 SER N 1.0 -47.82 -27.22 PSI 115 115 A 42 SER N A 42 SER CA A 42 SER C A 43 ILE N 1.0 -49.99 -26.99 PSI 116 116 A 43 ILE N A 43 ILE CA A 43 ILE C A 44 LEU N 1.0 -49.52 -38.72 PSI 117 117 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 ALA N 1.0 -55.03 -24.43 PSI 118 118 A 45 ALA N A 45 ALA CA A 45 ALA C A 46 GLN N 1.0 -57.36 -19.24 PSI 119 119 A 46 GLN N A 46 GLN CA A 46 GLN C A 47 VAL N 1.0 -50.68 -19.68 PSI 120 120 A 47 VAL N A 47 VAL CA A 47 VAL C A 48 LEU N 1.0 -44.41 22.51 PSI 121 121 A 50 GLN N A 50 GLN CA A 50 GLN C A 51 SER N 1.0 -50.21 -24.73 PSI 122 122 A 51 SER N A 51 SER CA A 51 SER C A 52 ALA N 1.0 -54.91 -22.99 PSI 123 123 A 52 ALA N A 52 ALA CA A 52 ALA C A 53 ARG N 1.0 -50.72 -35.64 PSI 124 124 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 ALA N 1.0 -51.16 -26.60 PSI 125 125 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 ARG N 1.0 -58.45 -27.97 PSI 126 126 A 55 ARG N A 55 ARG CA A 55 ARG C A 56 LEU N 1.0 -55.84 -24.04 PSI 127 127 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 SER N 1.0 -49.49 -29.37 PSI 128 128 A 57 SER N A 57 SER CA A 57 SER C A 58 ASN N 1.0 -55.27 -25.43 PSI 129 129 A 58 ASN N A 58 ASN CA A 58 ASN C A 59 LEU N 1.0 -57.58 -21.14 PSI 130 130 A 59 LEU N A 59 LEU CA A 59 LEU C A 60 ALA N 1.0 -60.65 -16.25 PSI 131 131 A 60 ALA N A 60 ALA CA A 60 ALA C A 61 LEU N 1.0 -56.76 -21.92 PSI 132 132 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 VAL N 1.0 -56.52 -9.08 PSI 133 133 A 64 PRO N A 64 PRO CA A 64 PRO C A 65 GLU N 1.0 -52.48 -9.60 PSI 134 134 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 LYS N 1.0 -57.14 -22.42 PSI 135 135 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 THR N 1.0 -54.35 -30.31 PSI 136 136 A 67 THR N A 67 THR CA A 67 THR C A 68 LYS N 1.0 -50.88 -31.76 PSI 137 137 A 68 LYS N A 68 LYS CA A 68 LYS C A 69 ALA N 1.0 -55.83 -31.51 PSI 138 138 A 69 ALA N A 69 ALA CA A 69 ALA C A 70 VAL N 1.0 -50.96 -25.80 PSI 139 139 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 GLU N 1.0 -55.36 -35.08 PSI 140 140 A 71 GLU N A 71 GLU CA A 71 GLU C A 72 ASN N 1.0 -54.52 -31.12 PSI 141 141 A 72 ASN N A 72 ASN CA A 72 ASN C A 73 TYR N 1.0 -47.90 -29.82 PSI 142 142 A 73 TYR N A 73 TYR CA A 73 TYR C A 74 LEU N 1.0 -57.64 -31.04 PSI 143 143 A 74 LEU N A 74 LEU CA A 74 LEU C A 75 ILE N 1.0 -46.92 -38.16 PSI 144 144 A 75 ILE N A 75 ILE CA A 75 ILE C A 76 GLN N 1.0 -50.24 -28.72 PSI 145 145 A 76 GLN N A 76 GLN CA A 76 GLN C A 77 MET N 1.0 -50.91 -28.91 PSI 146 146 A 77 MET N A 77 MET CA A 77 MET C A 78 ALA N 1.0 -52.88 -32.76 PSI 147 147 A 78 ALA N A 78 ALA CA A 78 ALA C A 79 ARG N 1.0 -55.68 -31.88 PSI 148 148 A 79 ARG N A 79 ARG CA A 79 ARG C A 80 TYR N 1.0 -54.52 -11.48 PSI 149 149 A 83 LEU N A 83 LEU CA A 83 LEU C A 84 SER N 1.0 91.82 184.90 PSI 150 150 A 86 LYS N A 86 LYS CA A 86 LYS C A 87 VAL N 1.0 118.16 167.44 PSI 151 151 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 SER N 1.0 113.12 150.16 PSI 152 152 A 88 SER N A 88 SER CA A 88 SER C A 89 GLU N 1.0 139.75 189.35 PSI 153 153 A 89 GLU N A 89 GLU CA A 89 GLU C A 90 GLN N 1.0 -48.02 -25.38 PSI 154 154 A 90 GLN N A 90 GLN CA A 90 GLN C A 91 GLY N 1.0 -56.24 -17.04 PSI 155 155 A 91 GLY N A 91 GLY CA A 91 GLY C A 92 LEU N 1.0 -52.11 -25.19 PSI 156 156 A 92 LEU N A 92 LEU CA A 92 LEU C A 93 ILE N 1.0 -63.93 -14.01 PSI 157 157 A 93 ILE N A 93 ILE CA A 93 ILE C A 94 GLU N 1.0 -55.70 -27.54 PSI 158 158 A 94 GLU N A 94 GLU CA A 94 GLU C A 95 ILE N 1.0 -49.62 -26.10 PSI 159 159 A 95 ILE N A 95 ILE CA A 95 ILE C A 96 LEU N 1.0 -53.01 -35.97 PSI 160 160 A 96 LEU N A 96 LEU CA A 96 LEU C A 97 LYS N 1.0 -54.00 -31.88 PSI 161 161 A 97 LYS N A 97 LYS CA A 97 LYS C A 98 LYS N 1.0 -53.58 -32.74 PSI 162 162 A 98 LYS N A 98 LYS CA A 98 LYS C A 99 VAL N 1.0 -59.40 -17.44 PSI 163 163 A 100 SER N A 100 SER CA A 100 SER C A 101 GLN N 1.0 -58.45 -18.45 PSI 164 164 A 101 GLN N A 101 GLN CA A 101 GLN C A 102 GLN N 1.0 -77.85 32.11 PSI stop_ save_