data_nef_c6188_1st7 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 save_ save_system_Acyl-CoA-binding_protein _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode system_Acyl-CoA-binding_protein loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 VAL start . . 2 A 2 SER middle . . 3 A 3 GLN middle . . 4 A 4 LEU middle . . 5 A 5 PHE middle . . 6 A 6 GLU middle . . 7 A 7 GLU middle . . 8 A 8 LYS middle . . 9 A 9 ALA middle . . 10 A 10 LYS middle . . 11 A 11 ALA middle . . 12 A 12 VAL middle . . 13 A 13 ASN middle . . 14 A 14 GLU middle . . 15 A 15 LEU middle . . 16 A 16 PRO middle . false 17 A 17 THR middle . . 18 A 18 LYS middle . . 19 A 19 PRO middle . false 20 A 20 SER middle . . 21 A 21 THR middle . . 22 A 22 ASP middle . . 23 A 23 GLU middle . . 24 A 24 LEU middle . . 25 A 25 LEU middle . . 26 A 26 GLU middle . . 27 A 27 LEU middle . . 28 A 28 TYR middle . . 29 A 29 ALA middle . . 30 A 30 LEU middle . . 31 A 31 TYR middle . . 32 A 32 LYS middle . . 33 A 33 GLN middle . . 34 A 34 ALA middle . . 35 A 35 THR middle . . 36 A 36 VAL middle . . 37 A 37 GLY middle . false 38 A 38 ASP middle . . 39 A 39 ASN middle . . 40 A 40 ASP middle . . 41 A 41 LYS middle . . 42 A 42 GLU middle . . 43 A 43 LYS middle . . 44 A 44 PRO middle . false 45 A 45 GLY middle . false 46 A 46 ILE middle . . 47 A 47 PHE middle . . 48 A 48 ASN middle . . 49 A 49 MET middle . . 50 A 50 LYS middle . . 51 A 51 ASP middle . . 52 A 52 ARG middle . . 53 A 53 TYR middle . . 54 A 54 LYS middle . . 55 A 55 TRP middle . . 56 A 56 GLU middle . . 57 A 57 ALA middle . . 58 A 58 TRP middle . . 59 A 59 GLU middle . . 60 A 60 ASN middle . . 61 A 61 LEU middle . . 62 A 62 LYS middle . . 63 A 63 GLY middle . false 64 A 64 LYS middle . . 65 A 65 SER middle . . 66 A 66 GLN middle . . 67 A 67 GLU middle . . 68 A 68 ASP middle . . 69 A 69 ALA middle . . 70 A 70 GLU middle . . 71 A 71 LYS middle . . 72 A 72 GLU middle . . 73 A 73 TYR middle . . 74 A 74 ILE middle . . 75 A 75 ALA middle . . 76 A 76 LEU middle . . 77 A 77 VAL middle . . 78 A 78 ASP middle . . 79 A 79 GLN middle . . 80 A 80 LEU middle . . 81 A 81 ILE middle . . 82 A 82 ALA middle . . 83 A 83 LYS middle . . 84 A 84 TYR middle . . 85 A 85 SER middle . . 86 A 86 SER end . . stop_ save_ save_chemical_shift_set_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode chemical_shift_set_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 VAL H1 H 1 7.82 . A 1 VAL HA H 1 3.98 . A 1 VAL HB H 1 1.67 . A 1 VAL HGx% H 1 0.73 . A 1 VAL HGy% H 1 0.14 . A 1 VAL CA C 13 60.50 . A 1 VAL CB C 13 33.44 . A 1 VAL N N 15 119.41 . A 2 SER H H 1 9.40 . A 2 SER HA H 1 4.53 . A 2 SER HBx H 1 3.76 . A 2 SER CA C 13 58.38 . A 2 SER CB C 13 66.00 . A 2 SER N N 15 120.06 . A 3 GLN H H 1 8.82 . A 3 GLN HA H 1 4.25 . A 3 GLN HBx H 1 2.19 . A 3 GLN HE2y H 1 7.80 . A 3 GLN HE2x H 1 6.91 . A 3 GLN HGx H 1 2.55 . A 3 GLN CA C 13 59.39 . A 3 GLN CB C 13 28.54 . A 3 GLN N N 15 121.44 . A 3 GLN NE2 N 15 113.57 . A 4 LEU H H 1 8.16 . A 4 LEU HA H 1 4.28 . A 4 LEU HBx H 1 1.66 . A 4 LEU HBy H 1 1.83 . A 4 LEU HG H 1 1.07 . A 4 LEU CA C 13 57.86 . A 4 LEU CB C 13 42.00 . A 4 LEU CG C 13 26.15 . A 4 LEU N N 15 121.26 . A 5 PHE H H 1 7.86 . A 5 PHE HA H 1 3.97 . A 5 PHE HBx H 1 2.04 . A 5 PHE HBy H 1 2.34 . A 5 PHE HDx H 1 7.08 . A 5 PHE HEx H 1 6.63 . A 5 PHE HZ H 1 6.29 . A 5 PHE CA C 13 62.60 . A 5 PHE CB C 13 39.30 . A 5 PHE CDx C 13 131.13 . A 5 PHE CEx C 13 131.19 . A 5 PHE CZ C 13 129.91 . A 5 PHE N N 15 120.13 . A 6 GLU H H 1 7.69 . A 6 GLU HA H 1 4.11 . A 6 GLU HBx H 1 2.24 . A 6 GLU HGx H 1 2.32 . A 6 GLU CA C 13 59.75 . A 6 GLU CB C 13 29.62 . A 6 GLU CG C 13 37.06 . A 6 GLU N N 15 118.07 . A 7 GLU H H 1 8.53 . A 7 GLU HA H 1 4.11 . A 7 GLU HBx H 1 2.21 . A 7 GLU HBy H 1 2.56 . A 7 GLU HGx H 1 2.36 . A 7 GLU CA C 13 59.58 . A 7 GLU CB C 13 29.80 . A 7 GLU CG C 13 37.06 . A 7 GLU N N 15 121.12 . A 8 LYS H H 1 8.54 . A 8 LYS HA H 1 4.20 . A 8 LYS HBx H 1 1.75 . A 8 LYS HDx H 1 1.78 . A 8 LYS HGx H 1 1.63 . A 8 LYS CA C 13 57.48 . A 8 LYS CB C 13 29.77 . A 8 LYS N N 15 122.76 . A 9 ALA H H 1 8.53 . A 9 ALA HA H 1 4.80 . A 9 ALA HB% H 1 1.37 . A 9 ALA CA C 13 54.64 . A 9 ALA CB C 13 17.69 . A 9 ALA N N 15 122.75 . A 10 LYS H H 1 7.56 . A 10 LYS HA H 1 4.14 . A 10 LYS HBx H 1 1.97 . A 10 LYS HGx H 1 1.63 . A 10 LYS CA C 13 59.37 . A 10 LYS CB C 13 32.82 . A 10 LYS CG C 13 25.56 . A 10 LYS N N 15 118.35 . A 11 ALA H H 1 8.02 . A 11 ALA HA H 1 4.12 . A 11 ALA HB% H 1 1.54 . A 11 ALA CA C 13 54.80 . A 11 ALA CB C 13 18.28 . A 11 ALA N N 15 122.35 . A 12 VAL H H 1 8.16 . A 12 VAL HA H 1 3.75 . A 12 VAL HB H 1 2.21 . A 12 VAL HG1% H 1 1.06 . A 12 VAL HG2% H 1 1.04 . A 12 VAL CA C 13 65.31 . A 12 VAL CB C 13 31.75 . A 12 VAL CGx C 13 20.07 . A 12 VAL CGy C 13 23.17 . A 12 VAL N N 15 118.59 . A 13 ASN H H 1 7.22 . A 13 ASN HA H 1 4.65 . A 13 ASN HBy H 1 2.95 . A 13 ASN HBx H 1 2.90 . A 13 ASN HD2y H 1 7.68 . A 13 ASN HD2x H 1 6.88 . A 13 ASN CA C 13 54.92 . A 13 ASN CB C 13 39.36 . A 13 ASN N N 15 118.21 . A 13 ASN ND2 N 15 114.84 . A 14 GLU H H 1 7.50 . A 14 GLU HA H 1 4.47 . A 14 GLU HBy H 1 2.30 . A 14 GLU HBx H 1 1.96 . A 14 GLU CA C 13 55.31 . A 14 GLU CB C 13 29.89 . A 14 GLU CG C 13 36.06 . A 14 GLU N N 15 117.71 . A 15 LEU H H 1 7.01 . A 15 LEU HA H 1 4.48 . A 15 LEU HBx H 1 1.85 . A 15 LEU HDx% H 1 1.07 . A 15 LEU HG H 1 2.13 . A 15 LEU CA C 13 53.96 . A 15 LEU CB C 13 42.58 . A 15 LEU CDx C 13 24.29 . A 15 LEU CG C 13 26.77 . A 15 LEU N N 15 122.38 . A 16 PRO HA H 1 4.46 . A 16 PRO HBx H 1 2.16 . A 16 PRO HBy H 1 2.40 . A 16 PRO HDx H 1 3.80 . A 16 PRO HDy H 1 3.92 . A 16 PRO HGx H 1 2.22 . A 16 PRO CA C 13 64.54 . A 16 PRO CB C 13 31.80 . A 16 PRO CD C 13 50.85 . A 16 PRO CG C 13 27.58 . A 17 THR H H 1 6.76 . A 17 THR HA H 1 4.28 . A 17 THR HB H 1 3.82 . A 17 THR HG1 H 1 7.04 . A 17 THR HG2% H 1 1.11 . A 17 THR CA C 13 60.72 . A 17 THR CB C 13 71.19 . A 17 THR CG2 C 13 21.47 . A 17 THR N N 15 114.48 . A 18 LYS H H 1 7.91 . A 18 LYS HA H 1 4.37 . A 18 LYS HBx H 1 1.71 . A 18 LYS HGx H 1 1.53 . A 18 LYS HZ1 H 1 7.52 . A 18 LYS HZ2 H 1 7.52 . A 18 LYS HZ3 H 1 7.52 . A 18 LYS CA C 13 54.21 . A 18 LYS CB C 13 32.64 . A 18 LYS CG C 13 24.39 . A 18 LYS N N 15 124.31 . A 19 PRO HA H 1 4.14 . A 19 PRO HBx H 1 2.78 . A 19 PRO HDx H 1 3.35 . A 19 PRO HGx H 1 1.60 . A 19 PRO HGy H 1 1.75 . A 19 PRO CA C 13 61.95 . A 19 PRO CB C 13 32.24 . A 19 PRO CD C 13 51.21 . A 19 PRO CG C 13 27.94 . A 20 SER H H 1 8.48 . A 20 SER HA H 1 4.44 . A 20 SER HBx H 1 4.19 . A 20 SER CA C 13 58.01 . A 20 SER CB C 13 64.99 . A 20 SER N N 15 115.54 . A 21 THR H H 1 8.76 . A 21 THR HA H 1 4.15 . A 21 THR HB H 1 1.28 . A 21 THR CA C 13 67.41 . A 21 THR CB C 13 68.85 . A 21 THR N N 15 117.19 . A 22 ASP H H 1 8.28 . A 22 ASP HA H 1 4.39 . A 22 ASP HBx H 1 2.56 . A 22 ASP CA C 13 57.88 . A 22 ASP CB C 13 40.61 . A 22 ASP N N 15 118.41 . A 23 GLU H H 1 7.53 . A 23 GLU HA H 1 4.16 . A 23 GLU HBx H 1 1.90 . A 23 GLU HGx H 1 2.62 . A 23 GLU CA C 13 59.29 . A 23 GLU CB C 13 30.23 . A 23 GLU N N 15 122.19 . A 24 LEU H H 1 8.76 . A 24 LEU HA H 1 4.13 . A 24 LEU HBx H 1 2.63 . A 24 LEU HDx% H 1 0.85 . A 24 LEU HG H 1 1.72 . A 24 LEU CA C 13 58.20 . A 24 LEU CB C 13 41.62 . A 24 LEU N N 15 119.32 . A 25 LEU H H 1 8.45 . A 25 LEU HA H 1 4.20 . A 25 LEU HBx H 1 2.05 . A 25 LEU HD1% H 1 1.47 . A 25 LEU HD2% H 1 0.91 . A 25 LEU HG H 1 1.95 . A 25 LEU CA C 13 58.30 . A 25 LEU CB C 13 42.58 . A 25 LEU CDx C 13 23.83 . A 25 LEU CG C 13 27.07 . A 25 LEU N N 15 122.25 . A 26 GLU H H 1 7.54 . A 26 GLU HA H 1 4.18 . A 26 GLU HBy H 1 2.25 . A 26 GLU HBx H 1 2.08 . A 26 GLU CA C 13 60.01 . A 26 GLU CB C 13 29.90 . A 26 GLU N N 15 120.63 . A 27 LEU H H 1 8.37 . A 27 LEU HA H 1 4.12 . A 27 LEU HBx H 1 2.04 . A 27 LEU HDx% H 1 0.81 . A 27 LEU HDy% H 1 0.68 . A 27 LEU HG H 1 1.81 . A 27 LEU CA C 13 58.43 . A 27 LEU CB C 13 43.21 . A 27 LEU CDx C 13 26.21 . A 27 LEU CG C 13 26.75 . A 27 LEU N N 15 119.91 . A 28 TYR H H 1 8.37 . A 28 TYR HA H 1 4.14 . A 28 TYR HBx H 1 3.29 . A 28 TYR HBy H 1 3.35 . A 28 TYR HDx H 1 7.13 . A 28 TYR HEx H 1 6.90 . A 28 TYR CA C 13 61.87 . A 28 TYR CB C 13 38.24 . A 28 TYR CDx C 13 132.57 . A 28 TYR CEx C 13 117.49 . A 28 TYR N N 15 119.89 . A 29 ALA H H 1 8.33 . A 29 ALA HA H 1 3.55 . A 29 ALA HB% H 1 1.66 . A 29 ALA CA C 13 55.47 . A 29 ALA CB C 13 18.89 . A 29 ALA N N 15 121.25 . A 30 LEU H H 1 8.12 . A 30 LEU HA H 1 3.97 . A 30 LEU HBx H 1 2.35 . A 30 LEU HD1% H 1 1.03 . A 30 LEU HD2% H 1 1.16 . A 30 LEU HG H 1 2.06 . A 30 LEU CA C 13 59.22 . A 30 LEU CB C 13 44.68 . A 30 LEU CDx C 13 26.17 . A 30 LEU CG C 13 27.59 . A 30 LEU N N 15 117.41 . A 31 TYR H H 1 8.85 . A 31 TYR HA H 1 3.57 . A 31 TYR HBx H 1 3.09 . A 31 TYR HBy H 1 3.25 . A 31 TYR HDx H 1 6.51 . A 31 TYR HEx H 1 6.68 . A 31 TYR CA C 13 61.84 . A 31 TYR CB C 13 38.28 . A 31 TYR CDx C 13 132.70 . A 31 TYR CEx C 13 118.05 . A 31 TYR N N 15 121.22 . A 32 LYS H H 1 8.19 . A 32 LYS HA H 1 3.29 . A 32 LYS HBx H 1 -0.49 . A 32 LYS HBy H 1 0.30 . A 32 LYS HDy H 1 1.17 . A 32 LYS HDx H 1 0.90 . A 32 LYS HEx H 1 2.44 . A 32 LYS HGy H 1 0.57 . A 32 LYS HGx H 1 -0.06 . A 32 LYS CA C 13 56.25 . A 32 LYS CB C 13 26.89 . A 32 LYS CD C 13 26.27 . A 32 LYS CE C 13 41.88 . A 32 LYS CG C 13 22.35 . A 32 LYS N N 15 121.35 . A 33 GLN H H 1 8.47 . A 33 GLN HA H 1 4.24 . A 33 GLN HBx H 1 1.60 . A 33 GLN HBy H 1 1.74 . A 33 GLN HGx H 1 2.17 . A 33 GLN CA C 13 57.82 . A 33 GLN CB C 13 27.42 . A 33 GLN CG C 13 32.33 . A 33 GLN N N 15 122.83 . A 34 ALA H H 1 8.18 . A 34 ALA HA H 1 4.26 . A 34 ALA HB% H 1 1.00 . A 34 ALA CA C 13 54.62 . A 34 ALA CB C 13 20.03 . A 34 ALA N N 15 116.28 . A 35 THR H H 1 7.44 . A 35 THR HA H 1 3.92 . A 35 THR HB H 1 3.79 . A 35 THR HG2% H 1 1.01 . A 35 THR CA C 13 62.90 . A 35 THR CB C 13 70.94 . A 35 THR CG2 C 13 22.53 . A 35 THR N N 15 106.59 . A 36 VAL H H 1 8.68 . A 36 VAL HA H 1 4.26 . A 36 VAL HB H 1 2.40 . A 36 VAL HGx% H 1 1.04 . A 36 VAL HGy% H 1 0.99 . A 36 VAL CA C 13 63.34 . A 36 VAL CB C 13 33.81 . A 36 VAL CGx C 13 21.36 . A 36 VAL N N 15 121.54 . A 37 GLY H H 1 7.81 . A 37 GLY HAy H 1 4.38 . A 37 GLY HAx H 1 4.01 . A 37 GLY CA C 13 43.75 . A 37 GLY N N 15 112.36 . A 38 ASP H H 1 8.21 . A 38 ASP HA H 1 4.48 . A 38 ASP HBx H 1 2.34 . A 38 ASP HBy H 1 2.45 . A 38 ASP CA C 13 54.96 . A 38 ASP CB C 13 41.56 . A 38 ASP N N 15 119.94 . A 39 ASN H H 1 8.38 . A 39 ASN HA H 1 1.92 . A 39 ASN HBx H 1 0.37 . A 39 ASN CA C 13 53.52 . A 39 ASN CB C 13 36.24 . A 39 ASN N N 15 121.09 . A 40 ASP H H 1 7.64 . A 40 ASP HA H 1 4.61 . A 40 ASP HBx H 1 2.45 . A 40 ASP CA C 13 52.54 . A 40 ASP CB C 13 40.96 . A 40 ASP N N 15 127.50 . A 41 LYS H H 1 7.79 . A 41 LYS HA H 1 4.64 . A 41 LYS HBx H 1 2.16 . A 41 LYS HDx H 1 2.68 . A 41 LYS HEx H 1 3.07 . A 41 LYS HGx H 1 1.76 . A 41 LYS HGy H 1 2.10 . A 41 LYS HZ1 H 1 7.99 . A 41 LYS HZ2 H 1 7.99 . A 41 LYS HZ3 H 1 7.99 . A 41 LYS CA C 13 54.68 . A 41 LYS CB C 13 34.24 . A 41 LYS CG C 13 35.12 . A 41 LYS N N 15 120.62 . A 42 GLU H H 1 8.81 . A 42 GLU HA H 1 4.27 . A 42 GLU HBx H 1 1.96 . A 42 GLU HGx H 1 2.32 . A 42 GLU CA C 13 56.45 . A 42 GLU CB C 13 30.37 . A 42 GLU CG C 13 36.28 . A 42 GLU N N 15 124.71 . A 43 LYS H H 1 8.25 . A 43 LYS HA H 1 4.26 . A 43 LYS CA C 13 54.71 . A 43 LYS CB C 13 32.94 . A 43 LYS N N 15 125.86 . A 44 PRO HA H 1 4.39 . A 44 PRO HBx H 1 2.40 . A 44 PRO HDx H 1 3.64 . A 44 PRO HGx H 1 1.72 . A 44 PRO CA C 13 62.62 . A 44 PRO CB C 13 32.47 . A 44 PRO CD C 13 51.54 . A 44 PRO CG C 13 27.41 . A 45 GLY H H 1 8.37 . A 45 GLY HAx H 1 3.74 . A 45 GLY HAy H 1 4.00 . A 45 GLY CA C 13 45.18 . A 45 GLY N N 15 108.13 . A 46 ILE H H 1 7.89 . A 46 ILE HA H 1 3.80 . A 46 ILE HB H 1 1.74 . A 46 ILE HD1% H 1 0.80 . A 46 ILE HG1x H 1 1.05 . A 46 ILE HG1y H 1 1.09 . A 46 ILE HG2% H 1 0.71 . A 46 ILE CA C 13 62.59 . A 46 ILE CB C 13 38.81 . A 46 ILE CD1 C 13 13.54 . A 46 ILE CG1 C 13 27.22 . A 46 ILE CG2 C 13 17.56 . A 46 ILE N N 15 117.41 . A 47 PHE H H 1 7.86 . A 47 PHE HA H 1 4.58 . A 47 PHE HBy H 1 3.22 . A 47 PHE HBx H 1 3.10 . A 47 PHE HDx H 1 7.31 . A 47 PHE HEx H 1 7.41 . A 47 PHE HZ H 1 7.37 . A 47 PHE CA C 13 58.35 . A 47 PHE CB C 13 38.80 . A 47 PHE CDx C 13 131.63 . A 47 PHE CEx C 13 131.26 . A 47 PHE CZ C 13 129.78 . A 47 PHE N N 15 120.10 . A 48 ASN H H 1 7.83 . A 48 ASN HA H 1 4.88 . A 48 ASN HBy H 1 3.07 . A 48 ASN HBx H 1 2.70 . A 48 ASN HD2x H 1 7.05 . A 48 ASN HD2y H 1 7.58 . A 48 ASN CA C 13 52.19 . A 48 ASN CB C 13 38.31 . A 48 ASN N N 15 120.50 . A 48 ASN ND2 N 15 113.46 . A 49 MET H H 1 8.28 . A 49 MET HA H 1 4.38 . A 49 MET HBx H 1 1.72 . A 49 MET HBy H 1 1.95 . A 49 MET CA C 13 59.56 . A 49 MET CB C 13 26.78 . A 49 MET N N 15 121.32 . A 50 LYS H H 1 8.46 . A 50 LYS HA H 1 4.06 . A 50 LYS HBx H 1 1.87 . A 50 LYS HZ1 H 1 7.85 . A 50 LYS HZ2 H 1 7.85 . A 50 LYS HZ3 H 1 7.85 . A 50 LYS CA C 13 60.21 . A 50 LYS CB C 13 31.95 . A 50 LYS N N 15 119.50 . A 51 ASP H H 1 7.83 . A 51 ASP HA H 1 4.58 . A 51 ASP HBx H 1 1.87 . A 51 ASP HBy H 1 2.64 . A 51 ASP CA C 13 57.82 . A 51 ASP CB C 13 39.67 . A 51 ASP N N 15 118.17 . A 52 ARG H H 1 8.16 . A 52 ARG HA H 1 3.94 . A 52 ARG HBx H 1 1.82 . A 52 ARG HDx H 1 3.21 . A 52 ARG HE H 1 7.68 . A 52 ARG HGy H 1 1.61 . A 52 ARG HGx H 1 1.50 . A 52 ARG CA C 13 60.57 . A 52 ARG CB C 13 32.31 . A 52 ARG CG C 13 28.51 . A 52 ARG N N 15 122.75 . A 53 TYR H H 1 8.30 . A 53 TYR HA H 1 4.63 . A 53 TYR HBx H 1 3.22 . A 53 TYR HBy H 1 3.31 . A 53 TYR HDx H 1 7.24 . A 53 TYR HEx H 1 6.92 . A 53 TYR CA C 13 60.55 . A 53 TYR CB C 13 36.98 . A 53 TYR CDx C 13 132.84 . A 53 TYR CEx C 13 118.32 . A 53 TYR N N 15 119.69 . A 54 LYS H H 1 8.15 . A 54 LYS HA H 1 3.94 . A 54 LYS HBx H 1 1.78 . A 54 LYS HDx H 1 1.56 . A 54 LYS HEx H 1 3.23 . A 54 LYS HGx H 1 0.65 . A 54 LYS CA C 13 61.15 . A 54 LYS CB C 13 32.69 . A 54 LYS CG C 13 26.74 . A 54 LYS N N 15 122.36 . A 55 TRP H H 1 8.25 . A 55 TRP HA H 1 4.43 . A 55 TRP HBy H 1 3.70 . A 55 TRP HBx H 1 3.48 . A 55 TRP HD1 H 1 7.40 . A 55 TRP HE1 H 1 9.83 . A 55 TRP HE3 H 1 7.49 . A 55 TRP HH2 H 1 7.24 . A 55 TRP HZ2 H 1 7.44 . A 55 TRP HZ3 H 1 7.24 . A 55 TRP CA C 13 63.06 . A 55 TRP CB C 13 29.99 . A 55 TRP CD1 C 13 126.38 . A 55 TRP CE3 C 13 120.40 . A 55 TRP CH2 C 13 122.17 . A 55 TRP CZ2 C 13 114.90 . A 55 TRP CZ3 C 13 124.66 . A 55 TRP N N 15 120.41 . A 56 GLU H H 1 8.94 . A 56 GLU HA H 1 3.99 . A 56 GLU HGx H 1 2.40 . A 56 GLU CA C 13 59.92 . A 56 GLU CB C 13 30.26 . A 56 GLU N N 15 118.71 . A 57 ALA H H 1 8.18 . A 57 ALA HA H 1 4.28 . A 57 ALA HB% H 1 1.78 . A 57 ALA CA C 13 55.66 . A 57 ALA CB C 13 18.86 . A 57 ALA N N 15 122.65 . A 58 TRP H H 1 8.25 . A 58 TRP HA H 1 4.94 . A 58 TRP HBx H 1 3.34 . A 58 TRP HBy H 1 3.59 . A 58 TRP HD1 H 1 7.69 . A 58 TRP HE1 H 1 10.09 . A 58 TRP HE3 H 1 7.63 . A 58 TRP HH2 H 1 7.14 . A 58 TRP HZ2 H 1 7.23 . A 58 TRP HZ3 H 1 7.20 . A 58 TRP CA C 13 58.15 . A 58 TRP CB C 13 30.30 . A 58 TRP CD1 C 13 127.16 . A 58 TRP CE3 C 13 120.47 . A 58 TRP CH2 C 13 121.39 . A 58 TRP CZ2 C 13 115.30 . A 58 TRP CZ3 C 13 123.42 . A 58 TRP N N 15 120.13 . A 59 GLU H H 1 9.31 . A 59 GLU HA H 1 3.67 . A 59 GLU HBx H 1 0.67 . A 59 GLU HGx H 1 1.47 . A 59 GLU CA C 13 59.13 . A 59 GLU CB C 13 27.89 . A 59 GLU CG C 13 34.09 . A 59 GLU N N 15 125.13 . A 60 ASN H H 1 7.78 . A 60 ASN HA H 1 4.58 . A 60 ASN HBx H 1 2.95 . A 60 ASN HBy H 1 2.99 . A 60 ASN HD2x H 1 7.03 . A 60 ASN HD2y H 1 7.67 . A 60 ASN CA C 13 55.31 . A 60 ASN CB C 13 38.91 . A 60 ASN N N 15 115.65 . A 60 ASN ND2 N 15 113.67 . A 61 LEU H H 1 7.79 . A 61 LEU HA H 1 4.49 . A 61 LEU HBx H 1 2.20 . A 61 LEU HD1% H 1 0.91 . A 61 LEU HD2% H 1 1.04 . A 61 LEU HG H 1 1.55 . A 61 LEU CA C 13 54.02 . A 61 LEU CB C 13 41.97 . A 61 LEU CDx C 13 22.30 . A 61 LEU CG C 13 27.61 . A 61 LEU N N 15 118.29 . A 62 LYS H H 1 7.20 . A 62 LYS HA H 1 4.12 . A 62 LYS HBx H 1 1.93 . A 62 LYS HDx H 1 1.72 . A 62 LYS HEx H 1 3.40 . A 62 LYS HGx H 1 1.29 . A 62 LYS HZ1 H 1 7.81 . A 62 LYS HZ2 H 1 7.81 . A 62 LYS HZ3 H 1 7.81 . A 62 LYS CA C 13 59.44 . A 62 LYS CB C 13 32.11 . A 62 LYS CD C 13 29.28 . A 62 LYS N N 15 121.66 . A 63 GLY H H 1 9.86 . A 63 GLY HAx H 1 3.80 . A 63 GLY HAy H 1 4.43 . A 63 GLY CA C 13 44.81 . A 63 GLY N N 15 117.86 . A 64 LYS H H 1 8.48 . A 64 LYS HA H 1 4.44 . A 64 LYS HBx H 1 1.73 . A 64 LYS HGy H 1 2.09 . A 64 LYS HGx H 1 1.77 . A 64 LYS CA C 13 56.37 . A 64 LYS CB C 13 33.20 . A 64 LYS CG C 13 22.34 . A 64 LYS N N 15 125.58 . A 65 SER H H 1 9.72 . A 65 SER HA H 1 4.43 . A 65 SER HBx H 1 4.20 . A 65 SER HG H 1 6.09 . A 65 SER CA C 13 58.37 . A 65 SER CB C 13 64.44 . A 65 SER N N 15 127.81 . A 66 GLN H H 1 9.09 . A 66 GLN HA H 1 4.16 . A 66 GLN HBy H 1 2.37 . A 66 GLN HBx H 1 2.04 . A 66 GLN HE2x H 1 6.68 . A 66 GLN HE2y H 1 6.78 . A 66 GLN HGx H 1 2.94 . A 66 GLN CA C 13 60.22 . A 66 GLN CB C 13 29.43 . A 66 GLN CG C 13 35.85 . A 66 GLN N N 15 123.34 . A 66 GLN NE2 N 15 110.88 . A 67 GLU H H 1 8.76 . A 67 GLU HA H 1 4.12 . A 67 GLU HBx H 1 2.10 . A 67 GLU HGx H 1 2.39 . A 67 GLU CA C 13 60.23 . A 67 GLU CB C 13 29.40 . A 67 GLU N N 15 118.80 . A 68 ASP H H 1 8.00 . A 68 ASP HA H 1 4.55 . A 68 ASP HBx H 1 2.64 . A 68 ASP HBy H 1 2.75 . A 68 ASP CA C 13 57.41 . A 68 ASP CB C 13 39.72 . A 68 ASP N N 15 122.48 . A 69 ALA H H 1 8.47 . A 69 ALA HA H 1 4.04 . A 69 ALA HB% H 1 1.46 . A 69 ALA CA C 13 55.33 . A 69 ALA CB C 13 17.59 . A 69 ALA N N 15 122.29 . A 70 GLU H H 1 8.44 . A 70 GLU HA H 1 3.99 . A 70 GLU HBx H 1 2.06 . A 70 GLU HGx H 1 2.36 . A 70 GLU CA C 13 60.24 . A 70 GLU CB C 13 29.95 . A 70 GLU CG C 13 37.08 . A 70 GLU N N 15 119.15 . A 71 LYS H H 1 7.69 . A 71 LYS HA H 1 4.11 . A 71 LYS HBx H 1 2.12 . A 71 LYS HDx H 1 1.80 . A 71 LYS HGx H 1 1.62 . A 71 LYS CA C 13 60.26 . A 71 LYS CB C 13 32.80 . A 71 LYS N N 15 118.55 . A 72 GLU H H 1 8.66 . A 72 GLU HA H 1 4.12 . A 72 GLU HBx H 1 2.21 . A 72 GLU HGx H 1 2.50 . A 72 GLU CA C 13 59.69 . A 72 GLU CB C 13 30.44 . A 72 GLU N N 15 121.49 . A 73 TYR H H 1 9.20 . A 73 TYR HA H 1 4.01 . A 73 TYR HBy H 1 3.53 . A 73 TYR HBx H 1 3.26 . A 73 TYR HDx H 1 7.11 . A 73 TYR HEx H 1 6.81 . A 73 TYR HH H 1 9.39 . A 73 TYR CA C 13 62.64 . A 73 TYR CB C 13 39.29 . A 73 TYR CDx C 13 131.99 . A 73 TYR N N 15 124.89 . A 74 ILE H H 1 8.20 . A 74 ILE HA H 1 3.31 . A 74 ILE HB H 1 2.03 . A 74 ILE HG2% H 1 0.98 . A 74 ILE CA C 13 66.70 . A 74 ILE CB C 13 38.99 . A 74 ILE CG2 C 13 17.00 . A 74 ILE N N 15 119.78 . A 75 ALA H H 1 7.73 . A 75 ALA HA H 1 4.26 . A 75 ALA HB% H 1 1.64 . A 75 ALA CA C 13 55.07 . A 75 ALA CB C 13 18.32 . A 75 ALA N N 15 118.87 . A 76 LEU H H 1 8.13 . A 76 LEU HA H 1 4.23 . A 76 LEU HBx H 1 1.49 . A 76 LEU HDx% H 1 0.95 . A 76 LEU HG H 1 1.91 . A 76 LEU CA C 13 57.78 . A 76 LEU CB C 13 41.23 . A 76 LEU CD1 C 13 26.83 . A 76 LEU CG C 13 27.49 . A 76 LEU N N 15 122.38 . A 77 VAL H H 1 8.60 . A 77 VAL HA H 1 3.28 . A 77 VAL HB H 1 1.95 . A 77 VAL HG1% H 1 1.00 . A 77 VAL HG2% H 1 0.37 . A 77 VAL CA C 13 68.91 . A 77 VAL CB C 13 30.51 . A 77 VAL CG1 C 13 23.61 . A 77 VAL CG2 C 13 22.11 . A 77 VAL N N 15 121.09 . A 78 ASP H H 1 8.27 . A 78 ASP HA H 1 4.56 . A 78 ASP HBx H 1 2.77 . A 78 ASP CA C 13 58.39 . A 78 ASP CB C 13 39.78 . A 78 ASP N N 15 119.14 . A 79 GLN H H 1 8.00 . A 79 GLN HA H 1 4.15 . A 79 GLN HBx H 1 2.34 . A 79 GLN HGx H 1 2.57 . A 79 GLN CA C 13 59.30 . A 79 GLN CB C 13 28.75 . A 79 GLN N N 15 122.63 . A 80 LEU H H 1 8.76 . A 80 LEU HA H 1 4.20 . A 80 LEU HBx H 1 2.22 . A 80 LEU HDx% H 1 0.97 . A 80 LEU HDy% H 1 0.93 . A 80 LEU HG H 1 1.48 . A 80 LEU CA C 13 58.03 . A 80 LEU CB C 13 41.34 . A 80 LEU CDx C 13 23.16 . A 80 LEU CG C 13 27.09 . A 80 LEU N N 15 123.04 . A 81 ILE H H 1 9.32 . A 81 ILE HA H 1 3.76 . A 81 ILE HB H 1 1.96 . A 81 ILE HD1% H 1 0.87 . A 81 ILE HG1x H 1 1.07 . A 81 ILE HG2% H 1 0.94 . A 81 ILE CA C 13 65.74 . A 81 ILE CB C 13 38.33 . A 81 ILE CD1 C 13 14.17 . A 81 ILE CG1 C 13 29.55 . A 81 ILE CG2 C 13 16.93 . A 81 ILE N N 15 121.99 . A 82 ALA H H 1 7.54 . A 82 ALA HA H 1 4.17 . A 82 ALA HB% H 1 1.52 . A 82 ALA CA C 13 54.93 . A 82 ALA CB C 13 18.04 . A 82 ALA N N 15 121.84 . A 83 LYS H H 1 7.85 . A 83 LYS HA H 1 3.96 . A 83 LYS HBx H 1 1.65 . A 83 LYS HDx H 1 1.49 . A 83 LYS HEx H 1 2.77 . A 83 LYS HGx H 1 0.23 . A 83 LYS HGy H 1 1.03 . A 83 LYS CA C 13 59.47 . A 83 LYS CB C 13 34.05 . A 83 LYS CD C 13 30.40 . A 83 LYS CG C 13 24.92 . A 83 LYS N N 15 118.86 . A 84 TYR H H 1 8.28 . A 84 TYR HA H 1 4.90 . A 84 TYR HBy H 1 3.44 . A 84 TYR HBx H 1 2.88 . A 84 TYR HDx H 1 7.23 . A 84 TYR HEx H 1 6.89 . A 84 TYR CA C 13 58.92 . A 84 TYR CB C 13 39.03 . A 84 TYR CDx C 13 132.64 . A 84 TYR CEx C 13 118.04 . A 84 TYR N N 15 115.65 . A 85 SER H H 1 7.84 . A 85 SER HA H 1 4.65 . A 85 SER HBy H 1 4.15 . A 85 SER HBx H 1 4.05 . A 85 SER CA C 13 59.44 . A 85 SER CB C 13 64.15 . A 85 SER N N 15 115.92 . A 86 SER H H 1 7.93 . A 86 SER HA H 1 4.35 . A 86 SER HBx H 1 3.83 . A 86 SER HBy H 1 3.96 . A 86 SER CA C 13 60.36 . A 86 SER CB C 13 65.23 . A 86 SER N N 15 123.25 . stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 GLN H A 2 SER H 1.0 1.8 5.0 2 2 A 2 SER H A 3 GLN HA 1.0 1.8 5.0 3 3 A 2 SER H A 4 LEU H 1.0 1.8 5.0 4 4 A 2 SER H A 5 PHE H 1.0 1.8 5.0 5 5 A 2 SER H A 70 GLU HA 1.0 1.8 5.0 6 6 A 2 SER HA A 4 LEU H 1.0 1.8 5.0 7 7 A 2 SER HA A 6 GLU H 1.0 1.8 5.0 8 8 A 2 SER HA A 70 GLU H 1.0 1.8 5.0 9 9 A 3 GLN H A 2 SER HBx 1.0 1.8 3.3 10 9 A 3 GLN H A 2 SER HBy 1.0 1.8 3.3 11 10 A 5 PHE H A 2 SER HBx 1.0 1.8 5.0 12 10 A 5 PHE H A 2 SER HBy 1.0 1.8 5.0 13 11 A 3 GLN H A 4 LEU H 1.0 1.8 5.0 14 12 A 3 GLN H A 4 LEU HBx 1.0 1.8 5.0 15 12 A 3 GLN H A 4 LEU HBy 1.0 1.8 5.0 16 13 A 3 GLN H A 5 PHE H 1.0 1.8 5.0 17 14 A 3 GLN HA A 6 GLU H 1.0 1.8 5.0 18 15 A 3 GLN HBy A 4 LEU HBx 1.0 1.8 5.0 19 15 A 3 GLN HBx A 4 LEU HBx 1.0 1.8 5.0 20 15 A 4 LEU HBy A 3 GLN HBx 1.0 1.8 5.0 21 15 A 4 LEU HBy A 3 GLN HBy 1.0 1.8 5.0 22 16 A 5 PHE H A 3 GLN HBx 1.0 1.8 5.0 23 16 A 5 PHE H A 3 GLN HBy 1.0 1.8 5.0 24 17 A 4 LEU H A 4 LEU HG 1.0 1.8 5.0 25 18 A 4 LEU H A 5 PHE H 1.0 1.8 3.3 26 19 A 4 LEU H A 5 PHE HA 1.0 1.8 5.0 27 20 A 4 LEU H A 6 GLU H 1.0 1.8 5.0 28 21 A 4 LEU H A 7 GLU H 1.0 1.8 5.0 29 22 A 7 GLU H A 4 LEU HA 1.0 1.8 5.0 30 23 A 5 PHE H A 4 LEU HBx 1.0 1.8 3.3 31 23 A 5 PHE H A 4 LEU HBy 1.0 1.8 3.3 32 24 A 5 PHE HA A 4 LEU HBx 1.0 1.8 5.0 33 24 A 4 LEU HBy A 5 PHE HA 1.0 1.8 5.0 34 25 A 6 GLU H A 4 LEU HBx 1.0 1.8 5.0 35 25 A 6 GLU H A 4 LEU HBy 1.0 1.8 5.0 36 26 A 73 TYR HD% A 4 LEU HBx 1.0 1.8 5.0 37 26 A 4 LEU HBy A 73 TYR HD% 1.0 1.8 5.0 38 27 A 74 ILE H A 4 LEU HBx 1.0 1.8 5.0 39 27 A 4 LEU HBy A 74 ILE H 1.0 1.8 5.0 40 28 A 74 ILE HA A 4 LEU HBx 1.0 1.8 5.0 41 28 A 4 LEU HBy A 74 ILE HA 1.0 1.8 5.0 42 29 A 74 ILE HB A 4 LEU HBx 1.0 1.8 5.0 43 29 A 4 LEU HBy A 74 ILE HB 1.0 1.8 5.0 44 30 A 74 ILE HG2% A 4 LEU HBx 1.0 1.8 5.5 45 30 A 4 LEU HBy A 74 ILE HG2% 1.0 1.8 5.5 46 31 A 5 PHE H A 4 LEU HG 1.0 1.8 5.0 47 32 A 4 LEU HG A 5 PHE HA 1.0 1.8 5.0 48 33 A 6 GLU H A 4 LEU HG 1.0 1.8 5.0 49 34 A 4 LEU HG A 7 GLU H 1.0 1.8 5.0 50 35 A 4 LEU HG A 7 GLU HBx 1.0 1.8 5.0 51 35 A 4 LEU HG A 7 GLU HBy 1.0 1.8 5.0 52 36 A 4 LEU HG A 7 GLU HGx 1.0 1.8 5.0 53 36 A 4 LEU HG A 7 GLU HGy 1.0 1.8 5.0 54 37 A 4 LEU HG A 74 ILE H 1.0 1.8 5.0 55 38 A 5 PHE H A 6 GLU H 1.0 1.8 3.3 56 39 A 5 PHE H A 7 GLU H 1.0 1.8 5.0 57 40 A 5 PHE H A 8 LYS H 1.0 1.8 5.0 58 41 A 5 PHE H A 73 TYR HBy 1.0 1.8 5.0 59 41 A 5 PHE H A 73 TYR HBx 1.0 1.8 5.0 60 42 A 5 PHE HA A 7 GLU H 1.0 1.8 5.0 61 43 A 5 PHE HA A 8 LYS H 1.0 1.8 5.0 62 44 A 5 PHE HA A 9 ALA H 1.0 1.8 5.0 63 45 A 5 PHE HA A 74 ILE H 1.0 1.8 5.0 64 46 A 5 PHE HA A 77 VAL HG2% 1.0 1.8 5.5 65 47 A 5 PHE HD% A 6 GLU HA 1.0 1.8 5.0 66 48 A 5 PHE HD% A 6 GLU HGx 1.0 1.8 5.0 67 48 A 5 PHE HD% A 6 GLU HGy 1.0 1.8 5.0 68 49 A 5 PHE HD% A 9 ALA HB% 1.0 1.8 5.5 69 50 A 5 PHE HD% A 30 LEU HBx 1.0 1.8 5.0 70 50 A 5 PHE HD% A 30 LEU HBy 1.0 1.8 5.0 71 51 A 5 PHE HD% A 31 TYR HA 1.0 1.8 5.0 72 52 A 5 PHE HD% A 31 TYR HD% 1.0 1.8 5.0 73 53 A 5 PHE HD% A 31 TYR HE% 1.0 1.8 5.0 74 54 A 5 PHE HD% A 34 ALA H 1.0 1.8 5.0 75 55 A 5 PHE HD% A 69 ALA HB% 1.0 1.8 3.8 76 56 A 5 PHE HD% A 70 GLU HBx 1.0 1.8 5.0 77 56 A 5 PHE HD% A 70 GLU HBy 1.0 1.8 5.0 78 57 A 5 PHE HD% A 73 TYR H 1.0 1.8 5.0 79 58 A 5 PHE HD% A 73 TYR HBy 1.0 1.8 5.0 80 58 A 73 TYR HBx A 5 PHE HD% 1.0 1.8 5.0 81 59 A 5 PHE HE% A 30 LEU HA 1.0 1.8 5.0 82 60 A 5 PHE HE% A 31 TYR H 1.0 1.8 5.0 83 61 A 31 TYR HD% A 5 PHE HE% 1.0 1.8 5.0 84 62 A 5 PHE HE% A 34 ALA HA 1.0 1.8 5.0 85 63 A 5 PHE HE% A 34 ALA HB% 1.0 1.8 3.8 86 64 A 5 PHE HE% A 35 THR HG2% 1.0 1.8 5.5 87 65 A 69 ALA HB% A 5 PHE HE% 1.0 1.8 3.8 88 66 A 5 PHE HE% A 70 GLU HBx 1.0 1.8 5.0 89 66 A 70 GLU HBy A 5 PHE HE% 1.0 1.8 5.0 90 67 A 5 PHE HE% A 73 TYR HBy 1.0 1.8 5.0 91 67 A 73 TYR HBx A 5 PHE HE% 1.0 1.8 5.0 92 68 A 5 PHE HZ A 6 GLU HGx 1.0 1.8 5.0 93 68 A 6 GLU HGy A 5 PHE HZ 1.0 1.8 5.0 94 69 A 9 ALA HB% A 5 PHE HZ 1.0 1.8 5.5 95 70 A 31 TYR HA A 5 PHE HZ 1.0 1.8 5.0 96 71 A 5 PHE HZ A 31 TYR HBx 1.0 1.8 5.0 97 71 A 5 PHE HZ A 31 TYR HBy 1.0 1.8 5.0 98 72 A 31 TYR HD% A 5 PHE HZ 1.0 1.8 3.3 99 73 A 31 TYR HE% A 5 PHE HZ 1.0 1.8 5.0 100 74 A 34 ALA H A 5 PHE HZ 1.0 1.8 5.0 101 75 A 34 ALA HA A 5 PHE HZ 1.0 1.8 5.0 102 76 A 34 ALA HB% A 5 PHE HZ 1.0 1.8 3.8 103 77 A 5 PHE HZ A 35 THR HA 1.0 1.8 5.0 104 78 A 35 THR HG2% A 5 PHE HZ 1.0 1.8 5.5 105 79 A 6 GLU H A 6 GLU HGx 1.0 1.8 3.3 106 79 A 6 GLU H A 6 GLU HGy 1.0 1.8 3.3 107 80 A 6 GLU H A 7 GLU H 1.0 1.8 3.3 108 81 A 6 GLU H A 8 LYS H 1.0 1.8 5.0 109 82 A 6 GLU H A 9 ALA H 1.0 1.8 5.0 110 83 A 6 GLU H A 9 ALA HB% 1.0 1.8 5.5 111 84 A 9 ALA H A 6 GLU HA 1.0 1.8 3.3 112 85 A 6 GLU HA A 31 TYR HD% 1.0 1.8 5.0 113 86 A 6 GLU HA A 31 TYR HE% 1.0 1.8 5.0 114 87 A 10 LYS H A 6 GLU HBx 1.0 1.8 5.0 115 87 A 6 GLU HBy A 10 LYS H 1.0 1.8 5.0 116 88 A 7 GLU H A 6 GLU HGx 1.0 1.8 5.0 117 88 A 7 GLU H A 6 GLU HGy 1.0 1.8 5.0 118 89 A 9 ALA H A 6 GLU HGx 1.0 1.8 5.0 119 89 A 9 ALA H A 6 GLU HGy 1.0 1.8 5.0 120 90 A 10 LYS H A 6 GLU HGx 1.0 1.8 5.0 121 90 A 6 GLU HGy A 10 LYS H 1.0 1.8 5.0 122 91 A 7 GLU H A 7 GLU HGx 1.0 1.8 5.0 123 91 A 7 GLU H A 7 GLU HGy 1.0 1.8 5.0 124 92 A 7 GLU H A 9 ALA HB% 1.0 1.8 5.5 125 93 A 7 GLU H A 10 LYS HBx 1.0 1.8 5.0 126 93 A 7 GLU H A 10 LYS HBy 1.0 1.8 5.0 127 94 A 8 LYS H A 7 GLU HGx 1.0 1.8 3.3 128 94 A 7 GLU HGy A 8 LYS H 1.0 1.8 3.3 129 95 A 7 GLU HGx A 8 LYS HBx 1.0 1.8 5.0 130 95 A 7 GLU HGy A 8 LYS HBx 1.0 1.8 5.0 131 95 A 8 LYS HBy A 7 GLU HGx 1.0 1.8 5.0 132 95 A 7 GLU HGy A 8 LYS HBy 1.0 1.8 5.0 133 96 A 8 LYS H A 8 LYS HDx 1.0 1.8 3.3 134 96 A 8 LYS H A 8 LYS HDy 1.0 1.8 3.3 135 97 A 8 LYS H A 9 ALA HA 1.0 1.8 5.0 136 98 A 9 ALA H A 8 LYS HBx 1.0 1.8 3.3 137 98 A 9 ALA H A 8 LYS HBy 1.0 1.8 3.3 138 99 A 8 LYS HBy A 12 VAL HG1% 1.0 1.8 5.5 139 99 A 12 VAL HG2% A 8 LYS HBx 1.0 1.8 5.5 140 99 A 8 LYS HBy A 12 VAL HG2% 1.0 1.8 5.5 141 99 A 8 LYS HBx A 12 VAL HG1% 1.0 1.8 5.5 142 100 A 9 ALA H A 8 LYS HGx 1.0 1.8 5.0 143 100 A 9 ALA H A 8 LYS HGy 1.0 1.8 5.0 144 101 A 9 ALA H A 10 LYS H 1.0 1.8 2.7 145 102 A 9 ALA H A 10 LYS HBx 1.0 1.8 5.0 146 102 A 9 ALA H A 10 LYS HBy 1.0 1.8 5.0 147 103 A 9 ALA H A 10 LYS HGx 1.0 1.8 5.0 148 103 A 9 ALA H A 10 LYS HGy 1.0 1.8 5.0 149 104 A 9 ALA H A 11 ALA H 1.0 1.8 5.0 150 105 A 9 ALA H A 11 ALA HB% 1.0 1.8 5.5 151 106 A 9 ALA H A 12 VAL H 1.0 1.8 5.0 152 107 A 9 ALA H A 12 VAL HG1% 1.0 1.8 5.5 153 107 A 9 ALA H A 12 VAL HG2% 1.0 1.8 5.5 154 108 A 9 ALA H A 31 TYR HD% 1.0 1.8 5.0 155 109 A 9 ALA H A 31 TYR HE% 1.0 1.8 5.0 156 110 A 9 ALA H A 77 VAL HG2% 1.0 1.8 5.5 157 111 A 9 ALA HA A 12 VAL H 1.0 1.8 5.0 158 112 A 9 ALA HA A 13 ASN H 1.0 1.8 5.0 159 113 A 9 ALA HA A 13 ASN HD2x 1.0 1.8 4.9 160 113 A 9 ALA HA A 13 ASN HD2y 1.0 1.8 4.9 161 114 A 9 ALA HB% A 10 LYS H 1.0 1.8 3.2 162 115 A 9 ALA HB% A 11 ALA H 1.0 1.8 5.5 163 116 A 9 ALA HB% A 12 VAL H 1.0 1.8 5.5 164 117 A 9 ALA HB% A 12 VAL HG1% 1.0 1.8 5.5 165 117 A 9 ALA HB% A 12 VAL HG2% 1.0 1.8 5.5 166 118 A 9 ALA HB% A 31 TYR HD% 1.0 1.8 3.8 167 119 A 9 ALA HB% A 31 TYR HE% 1.0 1.8 3.2 168 120 A 10 LYS H A 10 LYS HBx 1.0 1.8 2.7 169 120 A 10 LYS H A 10 LYS HBy 1.0 1.8 2.7 170 121 A 10 LYS H A 10 LYS HGx 1.0 1.8 3.3 171 121 A 10 LYS H A 10 LYS HGy 1.0 1.8 3.3 172 122 A 10 LYS H A 11 ALA H 1.0 1.8 2.7 173 123 A 10 LYS H A 12 VAL H 1.0 1.8 5.0 174 124 A 10 LYS H A 12 VAL HG1% 1.0 1.8 5.5 175 124 A 10 LYS H A 12 VAL HG2% 1.0 1.8 5.5 176 125 A 10 LYS H A 13 ASN H 1.0 1.8 5.0 177 126 A 13 ASN H A 10 LYS HA 1.0 1.8 5.0 178 127 A 10 LYS HA A 13 ASN HD2x 1.0 1.8 4.9 179 127 A 13 ASN HD2y A 10 LYS HA 1.0 1.8 4.9 180 128 A 11 ALA H A 10 LYS HBx 1.0 1.8 5.0 181 128 A 10 LYS HBy A 11 ALA H 1.0 1.8 5.0 182 129 A 12 VAL H A 10 LYS HBx 1.0 1.8 5.0 183 129 A 10 LYS HBy A 12 VAL H 1.0 1.8 5.0 184 130 A 13 ASN H A 10 LYS HBx 1.0 1.8 5.0 185 130 A 10 LYS HBy A 13 ASN H 1.0 1.8 5.0 186 131 A 10 LYS HBx A 13 ASN HBy 1.0 1.8 5.0 187 131 A 10 LYS HBy A 13 ASN HBy 1.0 1.8 5.0 188 131 A 13 ASN HBx A 10 LYS HBx 1.0 1.8 5.0 189 131 A 10 LYS HBy A 13 ASN HBx 1.0 1.8 5.0 190 132 A 31 TYR HE% A 10 LYS HBx 1.0 1.8 5.0 191 132 A 31 TYR HE% A 10 LYS HBy 1.0 1.8 5.0 192 133 A 11 ALA H A 10 LYS HGx 1.0 1.8 5.0 193 133 A 10 LYS HGy A 11 ALA H 1.0 1.8 5.0 194 134 A 35 THR HG2% A 10 LYS HGx 1.0 1.8 5.5 195 134 A 35 THR HG2% A 10 LYS HGy 1.0 1.8 5.5 196 135 A 11 ALA H A 12 VAL H 1.0 1.8 3.3 197 136 A 11 ALA H A 12 VAL HA 1.0 1.8 5.0 198 137 A 11 ALA H A 13 ASN H 1.0 1.8 5.0 199 138 A 12 VAL HA A 11 ALA HA 1.0 1.8 5.0 200 139 A 13 ASN H A 11 ALA HA 1.0 1.8 5.0 201 140 A 11 ALA HA A 14 GLU H 1.0 1.8 5.0 202 141 A 11 ALA HA A 14 GLU HBy 1.0 1.8 5.0 203 141 A 11 ALA HA A 14 GLU HBx 1.0 1.8 5.0 204 142 A 11 ALA HA A 15 LEU HA 1.0 1.8 5.0 205 143 A 11 ALA HB% A 12 VAL H 1.0 1.8 3.2 206 144 A 11 ALA HB% A 12 VAL HA 1.0 1.8 5.5 207 145 A 11 ALA HB% A 12 VAL HB 1.0 1.8 5.5 208 146 A 11 ALA HB% A 12 VAL HG1% 1.0 1.8 5.5 209 146 A 12 VAL HG2% A 11 ALA HB% 1.0 1.8 5.5 210 147 A 11 ALA HB% A 13 ASN H 1.0 1.8 5.5 211 148 A 11 ALA HB% A 14 GLU H 1.0 1.8 5.5 212 149 A 11 ALA HB% A 15 LEU HG 1.0 1.8 5.5 213 150 A 11 ALA HB% A 84 TYR HBy 1.0 1.8 5.5 214 150 A 11 ALA HB% A 84 TYR HBx 1.0 1.8 5.5 215 151 A 12 VAL H A 12 VAL HB 1.0 1.8 3.3 216 152 A 12 VAL H A 13 ASN H 1.0 1.8 2.7 217 153 A 12 VAL H A 14 GLU H 1.0 1.8 5.0 218 154 A 12 VAL H A 15 LEU H 1.0 1.8 5.0 219 155 A 77 VAL HG2% A 12 VAL H 1.0 1.8 5.5 220 156 A 12 VAL H A 81 ILE HD1% 1.0 1.8 5.4 221 157 A 12 VAL HA A 14 GLU H 1.0 1.8 5.0 222 158 A 12 VAL HA A 15 LEU H 1.0 1.8 3.3 223 159 A 12 VAL HA A 15 LEU HA 1.0 1.8 5.0 224 160 A 12 VAL HA A 15 LEU HG 1.0 1.8 5.0 225 161 A 12 VAL HA A 19 PRO HGx 1.0 1.8 5.0 226 161 A 12 VAL HA A 19 PRO HGy 1.0 1.8 5.0 227 162 A 77 VAL HG2% A 12 VAL HA 1.0 1.8 5.5 228 163 A 13 ASN H A 12 VAL HB 1.0 1.8 5.0 229 164 A 12 VAL HB A 13 ASN HA 1.0 1.8 5.0 230 165 A 12 VAL HB A 19 PRO HA 1.0 1.8 5.0 231 166 A 12 VAL HB A 19 PRO HBx 1.0 1.8 5.0 232 166 A 12 VAL HB A 19 PRO HBy 1.0 1.8 5.0 233 167 A 12 VAL HB A 77 VAL HA 1.0 1.8 5.0 234 168 A 12 VAL HB A 77 VAL HG1% 1.0 1.8 5.5 235 169 A 77 VAL HG2% A 12 VAL HB 1.0 1.8 5.5 236 170 A 12 VAL HB A 84 TYR HBy 1.0 1.8 5.0 237 170 A 12 VAL HB A 84 TYR HBx 1.0 1.8 5.0 238 171 A 13 ASN H A 12 VAL HG1% 1.0 1.8 3.2 239 171 A 12 VAL HG2% A 13 ASN H 1.0 1.8 3.2 240 172 A 13 ASN HA A 12 VAL HG1% 1.0 1.8 5.5 241 172 A 12 VAL HG2% A 13 ASN HA 1.0 1.8 5.5 242 173 A 12 VAL HG2% A 13 ASN HBy 1.0 1.8 5.5 243 173 A 13 ASN HBx A 12 VAL HG1% 1.0 1.8 5.5 244 173 A 12 VAL HG2% A 13 ASN HBx 1.0 1.8 5.5 245 173 A 12 VAL HG1% A 13 ASN HBy 1.0 1.8 5.5 246 174 A 12 VAL HG1% A 13 ASN HD2x 1.0 1.8 5.4 247 174 A 12 VAL HG2% A 13 ASN HD2x 1.0 1.8 5.4 248 174 A 13 ASN HD2y A 12 VAL HG1% 1.0 1.8 5.4 249 174 A 12 VAL HG2% A 13 ASN HD2y 1.0 1.8 5.4 250 175 A 14 GLU H A 12 VAL HG1% 1.0 1.8 5.5 251 175 A 12 VAL HG2% A 14 GLU H 1.0 1.8 5.5 252 176 A 12 VAL HG1% A 16 PRO HDx 1.0 1.8 5.5 253 176 A 16 PRO HDy A 12 VAL HG1% 1.0 1.8 5.5 254 176 A 12 VAL HG2% A 16 PRO HDy 1.0 1.8 5.5 255 176 A 12 VAL HG2% A 16 PRO HDx 1.0 1.8 5.5 256 177 A 12 VAL HG2% A 19 PRO HDx 1.0 1.8 5.5 257 177 A 12 VAL HG1% A 19 PRO HDx 1.0 1.8 5.5 258 177 A 19 PRO HDy A 12 VAL HG1% 1.0 1.8 5.5 259 177 A 12 VAL HG2% A 19 PRO HDy 1.0 1.8 5.5 260 178 A 27 LEU HG A 12 VAL HG1% 1.0 1.8 5.5 261 178 A 12 VAL HG2% A 27 LEU HG 1.0 1.8 5.5 262 179 A 12 VAL HG1% A 27 LEU HDx% 1.0 1.8 5.5 263 179 A 27 LEU HDy% A 12 VAL HG1% 1.0 1.8 5.5 264 179 A 12 VAL HG2% A 27 LEU HDy% 1.0 1.8 5.5 265 179 A 12 VAL HG2% A 27 LEU HDx% 1.0 1.8 5.5 266 180 A 31 TYR HA A 12 VAL HG1% 1.0 1.8 5.5 267 180 A 31 TYR HA A 12 VAL HG2% 1.0 1.8 5.5 268 181 A 77 VAL HA A 12 VAL HG1% 1.0 1.8 5.5 269 181 A 12 VAL HG2% A 77 VAL HA 1.0 1.8 5.5 270 182 A 77 VAL HG2% A 12 VAL HG1% 1.0 1.8 5.5 271 182 A 77 VAL HG2% A 12 VAL HG2% 1.0 1.8 5.5 272 183 A 80 LEU HA A 12 VAL HG1% 1.0 1.8 5.5 273 183 A 12 VAL HG2% A 80 LEU HA 1.0 1.8 5.5 274 184 A 12 VAL HG2% A 84 TYR HBy 1.0 1.8 5.5 275 184 A 12 VAL HG1% A 84 TYR HBy 1.0 1.8 5.5 276 184 A 84 TYR HBx A 12 VAL HG1% 1.0 1.8 5.5 277 184 A 12 VAL HG2% A 84 TYR HBx 1.0 1.8 5.5 278 185 A 13 ASN H A 13 ASN HD2x 1.0 1.8 4.9 279 185 A 13 ASN H A 13 ASN HD2y 1.0 1.8 4.9 280 186 A 13 ASN H A 14 GLU H 1.0 1.8 2.7 281 187 A 13 ASN H A 15 LEU H 1.0 1.8 5.0 282 188 A 13 ASN H A 15 LEU HDx% 1.0 1.8 5.5 283 188 A 13 ASN H A 15 LEU HD21 1.0 1.8 5.5 284 189 A 15 LEU H A 13 ASN HA 1.0 1.8 5.0 285 190 A 13 ASN HA A 15 LEU HBx 1.0 1.8 5.0 286 190 A 13 ASN HA A 15 LEU HBy 1.0 1.8 5.0 287 191 A 14 GLU H A 13 ASN HBy 1.0 1.8 3.3 288 191 A 13 ASN HBx A 14 GLU H 1.0 1.8 3.3 289 192 A 14 GLU H A 15 LEU H 1.0 1.8 2.7 290 193 A 14 GLU H A 19 PRO HGx 1.0 1.8 5.0 291 193 A 14 GLU H A 19 PRO HGy 1.0 1.8 5.0 292 194 A 15 LEU HG A 15 LEU H 1.0 1.8 5.0 293 195 A 15 LEU H A 15 LEU HDx% 1.0 1.8 3.8 294 195 A 15 LEU H A 15 LEU HD21 1.0 1.8 3.8 295 196 A 15 LEU H A 16 PRO HDx 1.0 1.8 5.0 296 196 A 15 LEU H A 16 PRO HDy 1.0 1.8 5.0 297 197 A 15 LEU H A 17 THR H 1.0 1.8 5.0 298 198 A 15 LEU H A 18 LYS HGx 1.0 1.8 5.0 299 198 A 15 LEU H A 18 LYS HGy 1.0 1.8 5.0 300 199 A 15 LEU HA A 17 THR H 1.0 1.8 5.0 301 200 A 15 LEU HA A 18 LYS HGx 1.0 1.8 5.0 302 200 A 15 LEU HA A 18 LYS HGy 1.0 1.8 5.0 303 201 A 15 LEU HBx A 16 PRO HBx 1.0 1.8 5.0 304 201 A 15 LEU HBy A 16 PRO HBx 1.0 1.8 5.0 305 201 A 16 PRO HBy A 15 LEU HBx 1.0 1.8 5.0 306 201 A 15 LEU HBy A 16 PRO HBy 1.0 1.8 5.0 307 202 A 15 LEU HBx A 16 PRO HDx 1.0 1.8 3.3 308 202 A 15 LEU HBy A 16 PRO HDx 1.0 1.8 3.3 309 202 A 16 PRO HDy A 15 LEU HBx 1.0 1.8 3.3 310 202 A 16 PRO HDy A 15 LEU HBy 1.0 1.8 3.3 311 203 A 17 THR H A 15 LEU HBx 1.0 1.8 3.3 312 203 A 15 LEU HBy A 17 THR H 1.0 1.8 3.3 313 204 A 17 THR HB A 15 LEU HBx 1.0 1.8 5.0 314 204 A 15 LEU HBy A 17 THR HB 1.0 1.8 5.0 315 205 A 18 LYS H A 15 LEU HBx 1.0 1.8 5.0 316 205 A 15 LEU HBy A 18 LYS H 1.0 1.8 5.0 317 206 A 15 LEU HBy A 18 LYS HGx 1.0 1.8 5.0 318 206 A 15 LEU HBx A 18 LYS HGx 1.0 1.8 5.0 319 206 A 18 LYS HGy A 15 LEU HBx 1.0 1.8 5.0 320 206 A 15 LEU HBy A 18 LYS HGy 1.0 1.8 5.0 321 207 A 15 LEU HBx A 84 TYR HBy 1.0 1.8 5.0 322 207 A 15 LEU HBy A 84 TYR HBy 1.0 1.8 5.0 323 207 A 84 TYR HBx A 15 LEU HBx 1.0 1.8 5.0 324 207 A 84 TYR HBx A 15 LEU HBy 1.0 1.8 5.0 325 208 A 15 LEU HD21 A 16 PRO HBx 1.0 1.8 5.5 326 208 A 15 LEU HDx% A 16 PRO HBx 1.0 1.8 5.5 327 208 A 16 PRO HBy A 15 LEU HDx% 1.0 1.8 5.5 328 208 A 15 LEU HD21 A 16 PRO HBy 1.0 1.8 5.5 329 209 A 15 LEU HDx% A 16 PRO HGx 1.0 1.8 5.5 330 209 A 15 LEU HD21 A 16 PRO HGx 1.0 1.8 5.5 331 209 A 16 PRO HGy A 15 LEU HDx% 1.0 1.8 5.5 332 209 A 15 LEU HD21 A 16 PRO HGy 1.0 1.8 5.5 333 210 A 17 THR HB A 15 LEU HDx% 1.0 1.8 3.8 334 210 A 15 LEU HD21 A 17 THR HB 1.0 1.8 3.8 335 211 A 15 LEU HDx% A 18 LYS HGx 1.0 1.8 5.5 336 211 A 15 LEU HD21 A 18 LYS HGx 1.0 1.8 5.5 337 211 A 18 LYS HGy A 15 LEU HDx% 1.0 1.8 5.5 338 211 A 15 LEU HD21 A 18 LYS HGy 1.0 1.8 5.5 339 212 A 19 PRO HA A 15 LEU HDx% 1.0 1.8 5.5 340 212 A 19 PRO HA A 15 LEU HD21 1.0 1.8 5.5 341 213 A 15 LEU HDx% A 19 PRO HGx 1.0 1.8 5.5 342 213 A 19 PRO HGy A 15 LEU HDx% 1.0 1.8 5.5 343 213 A 19 PRO HGy A 15 LEU HD21 1.0 1.8 5.5 344 213 A 15 LEU HD21 A 19 PRO HGx 1.0 1.8 5.5 345 214 A 15 LEU HD21 A 19 PRO HDx 1.0 1.8 5.5 346 214 A 15 LEU HDx% A 19 PRO HDx 1.0 1.8 5.5 347 214 A 19 PRO HDy A 15 LEU HDx% 1.0 1.8 5.5 348 214 A 19 PRO HDy A 15 LEU HD21 1.0 1.8 5.5 349 215 A 77 VAL HG2% A 15 LEU HDx% 1.0 1.8 5.5 350 215 A 77 VAL HG2% A 15 LEU HD21 1.0 1.8 5.5 351 216 A 82 ALA H A 15 LEU HDx% 1.0 1.8 5.5 352 216 A 15 LEU HD21 A 82 ALA H 1.0 1.8 5.5 353 217 A 84 TYR H A 15 LEU HDx% 1.0 1.8 3.8 354 217 A 15 LEU HD21 A 84 TYR H 1.0 1.8 3.8 355 218 A 15 LEU HD21 A 84 TYR HBy 1.0 1.8 3.8 356 218 A 15 LEU HDx% A 84 TYR HBy 1.0 1.8 3.8 357 218 A 84 TYR HBx A 15 LEU HDx% 1.0 1.8 3.8 358 218 A 84 TYR HBx A 15 LEU HD21 1.0 1.8 3.8 359 219 A 85 SER H A 15 LEU HDx% 1.0 1.8 3.8 360 219 A 15 LEU HD21 A 85 SER H 1.0 1.8 3.8 361 220 A 17 THR HG2% A 16 PRO HBx 1.0 1.8 5.5 362 220 A 16 PRO HBy A 17 THR HG2% 1.0 1.8 5.5 363 221 A 18 LYS H A 16 PRO HBx 1.0 1.8 5.0 364 221 A 16 PRO HBy A 18 LYS H 1.0 1.8 5.0 365 222 A 16 PRO HBx A 18 LYS HGx 1.0 1.8 5.0 366 222 A 16 PRO HBy A 18 LYS HGx 1.0 1.8 5.0 367 222 A 18 LYS HGy A 16 PRO HBx 1.0 1.8 5.0 368 222 A 18 LYS HGy A 16 PRO HBy 1.0 1.8 5.0 369 223 A 17 THR H A 16 PRO HGx 1.0 1.8 3.3 370 223 A 17 THR H A 16 PRO HGy 1.0 1.8 3.3 371 224 A 17 THR HB A 16 PRO HGx 1.0 1.8 5.0 372 224 A 17 THR HB A 16 PRO HGy 1.0 1.8 5.0 373 225 A 16 PRO HGy A 84 TYR HBy 1.0 1.8 5.0 374 225 A 16 PRO HGx A 84 TYR HBy 1.0 1.8 5.0 375 225 A 84 TYR HBx A 16 PRO HGx 1.0 1.8 5.0 376 225 A 84 TYR HBx A 16 PRO HGy 1.0 1.8 5.0 377 226 A 86 SER H A 16 PRO HGx 1.0 1.8 5.0 378 226 A 16 PRO HGy A 86 SER H 1.0 1.8 5.0 379 227 A 86 SER HA A 16 PRO HGx 1.0 1.8 5.0 380 227 A 16 PRO HGy A 86 SER HA 1.0 1.8 5.0 381 228 A 18 LYS H A 16 PRO HDx 1.0 1.8 5.0 382 228 A 16 PRO HDy A 18 LYS H 1.0 1.8 5.0 383 229 A 16 PRO HDy A 18 LYS HGx 1.0 1.8 5.0 384 229 A 16 PRO HDx A 18 LYS HGx 1.0 1.8 5.0 385 229 A 18 LYS HGy A 16 PRO HDx 1.0 1.8 5.0 386 229 A 16 PRO HDy A 18 LYS HGy 1.0 1.8 5.0 387 230 A 16 PRO HDy A 84 TYR HBy 1.0 1.8 5.0 388 230 A 16 PRO HDx A 84 TYR HBy 1.0 1.8 5.0 389 230 A 84 TYR HBx A 16 PRO HDx 1.0 1.8 5.0 390 230 A 84 TYR HBx A 16 PRO HDy 1.0 1.8 5.0 391 231 A 17 THR H A 17 THR HB 1.0 1.8 2.7 392 232 A 17 THR H A 17 THR HG2% 1.0 1.8 3.8 393 233 A 17 THR H A 17 THR HG1 1.0 1.8 5.0 394 234 A 17 THR H A 18 LYS H 1.0 1.8 5.0 395 235 A 17 THR H A 18 LYS HGx 1.0 1.8 5.0 396 235 A 17 THR H A 18 LYS HGy 1.0 1.8 5.0 397 236 A 17 THR H A 84 TYR HBy 1.0 1.8 5.0 398 236 A 84 TYR HBx A 17 THR H 1.0 1.8 5.0 399 237 A 17 THR H A 84 TYR HD% 1.0 1.8 5.0 400 238 A 17 THR H A 86 SER HA 1.0 1.8 5.0 401 239 A 18 LYS H A 17 THR HA 1.0 1.8 3.3 402 240 A 17 THR HB A 18 LYS H 1.0 1.8 5.0 403 241 A 17 THR HB A 84 TYR HBy 1.0 1.8 5.0 404 241 A 84 TYR HBx A 17 THR HB 1.0 1.8 5.0 405 242 A 17 THR HB A 84 TYR HD% 1.0 1.8 5.0 406 243 A 17 THR HB A 85 SER H 1.0 1.8 5.0 407 244 A 18 LYS H A 17 THR HG2% 1.0 1.8 5.5 408 245 A 17 THR HG2% A 18 LYS HBx 1.0 1.8 5.5 409 245 A 17 THR HG2% A 18 LYS HBy 1.0 1.8 5.5 410 246 A 17 THR HG2% A 83 LYS H 1.0 1.8 5.5 411 247 A 84 TYR H A 17 THR HG2% 1.0 1.8 5.5 412 248 A 17 THR HG2% A 84 TYR HBy 1.0 1.8 3.8 413 248 A 84 TYR HBx A 17 THR HG2% 1.0 1.8 3.8 414 249 A 17 THR HG2% A 84 TYR HD% 1.0 1.8 3.2 415 250 A 17 THR HG2% A 84 TYR HE% 1.0 1.8 3.8 416 251 A 17 THR HG2% A 86 SER HA 1.0 1.8 5.5 417 252 A 18 LYS H A 18 LYS HGx 1.0 1.8 3.3 418 252 A 18 LYS HGy A 18 LYS H 1.0 1.8 3.3 419 253 A 18 LYS H A 19 PRO HDx 1.0 1.8 5.0 420 253 A 19 PRO HDy A 18 LYS H 1.0 1.8 5.0 421 254 A 18 LYS HA A 19 PRO HGx 1.0 1.8 5.0 422 254 A 19 PRO HGy A 18 LYS HA 1.0 1.8 5.0 423 255 A 18 LYS HBy A 19 PRO HBx 1.0 1.8 5.0 424 255 A 18 LYS HBx A 19 PRO HBx 1.0 1.8 5.0 425 255 A 19 PRO HBy A 18 LYS HBx 1.0 1.8 5.0 426 255 A 19 PRO HBy A 18 LYS HBy 1.0 1.8 5.0 427 256 A 18 LYS HBx A 19 PRO HDx 1.0 1.8 5.0 428 256 A 18 LYS HBy A 19 PRO HDx 1.0 1.8 5.0 429 256 A 19 PRO HDy A 18 LYS HBx 1.0 1.8 5.0 430 256 A 19 PRO HDy A 18 LYS HBy 1.0 1.8 5.0 431 257 A 18 LYS HGy A 19 PRO HDx 1.0 1.8 5.0 432 257 A 18 LYS HGx A 19 PRO HDx 1.0 1.8 5.0 433 257 A 19 PRO HDy A 18 LYS HGx 1.0 1.8 5.0 434 257 A 19 PRO HDy A 18 LYS HGy 1.0 1.8 5.0 435 258 A 19 PRO HA A 20 SER H 1.0 1.8 3.3 436 259 A 19 PRO HA A 24 LEU HDx% 1.0 1.8 5.5 437 259 A 19 PRO HA A 24 LEU HD21 1.0 1.8 5.5 438 260 A 19 PRO HA A 84 TYR HBy 1.0 1.8 5.0 439 260 A 84 TYR HBx A 19 PRO HA 1.0 1.8 5.0 440 261 A 19 PRO HA A 84 TYR HE% 1.0 1.8 5.0 441 262 A 20 SER H A 19 PRO HBx 1.0 1.8 3.3 442 262 A 19 PRO HBy A 20 SER H 1.0 1.8 3.3 443 263 A 24 LEU H A 19 PRO HBx 1.0 1.8 5.0 444 263 A 19 PRO HBy A 24 LEU H 1.0 1.8 5.0 445 264 A 19 PRO HGx A 24 LEU HDx% 1.0 1.8 5.5 446 264 A 19 PRO HGy A 24 LEU HDx% 1.0 1.8 5.5 447 264 A 24 LEU HD21 A 19 PRO HGx 1.0 1.8 5.5 448 264 A 19 PRO HGy A 24 LEU HD21 1.0 1.8 5.5 449 265 A 84 TYR HD% A 19 PRO HGx 1.0 1.8 5.0 450 265 A 19 PRO HGy A 84 TYR HD% 1.0 1.8 5.0 451 266 A 84 TYR HE% A 19 PRO HGx 1.0 1.8 5.0 452 266 A 19 PRO HGy A 84 TYR HE% 1.0 1.8 5.0 453 267 A 19 PRO HDx A 24 LEU HDx% 1.0 1.8 5.5 454 267 A 19 PRO HDy A 24 LEU HDx% 1.0 1.8 5.5 455 267 A 24 LEU HD21 A 19 PRO HDx 1.0 1.8 5.5 456 267 A 19 PRO HDy A 24 LEU HD21 1.0 1.8 5.5 457 268 A 84 TYR HD% A 19 PRO HDx 1.0 1.8 5.0 458 268 A 19 PRO HDy A 84 TYR HD% 1.0 1.8 5.0 459 269 A 84 TYR HE% A 19 PRO HDx 1.0 1.8 5.0 460 269 A 19 PRO HDy A 84 TYR HE% 1.0 1.8 5.0 461 270 A 20 SER H A 21 THR H 1.0 1.8 5.0 462 271 A 20 SER H A 23 GLU H 1.0 1.8 5.0 463 272 A 20 SER H A 24 LEU HDx% 1.0 1.8 5.5 464 272 A 20 SER H A 24 LEU HD21 1.0 1.8 5.5 465 273 A 20 SER H A 80 LEU HDx% 1.0 1.8 5.5 466 273 A 20 SER H A 80 LEU HDy% 1.0 1.8 5.5 467 274 A 84 TYR HD% A 20 SER H 1.0 1.8 5.0 468 275 A 84 TYR HE% A 20 SER H 1.0 1.8 5.0 469 276 A 21 THR H A 20 SER HA 1.0 1.8 2.7 470 277 A 23 GLU H A 20 SER HA 1.0 1.8 5.0 471 278 A 24 LEU H A 20 SER HA 1.0 1.8 5.0 472 279 A 22 ASP H A 20 SER HBx 1.0 1.8 5.0 473 279 A 20 SER HBy A 22 ASP H 1.0 1.8 5.0 474 280 A 21 THR H A 22 ASP H 1.0 1.8 3.3 475 281 A 21 THR H A 23 GLU H 1.0 1.8 5.0 476 282 A 21 THR H A 24 LEU HBx 1.0 1.8 5.0 477 282 A 21 THR H A 24 LEU HBy 1.0 1.8 5.0 478 283 A 21 THR H A 24 LEU HDx% 1.0 1.8 5.5 479 283 A 24 LEU HD21 A 21 THR H 1.0 1.8 5.5 480 284 A 24 LEU H A 21 THR HA 1.0 1.8 5.0 481 285 A 23 GLU H A 22 ASP H 1.0 1.8 3.3 482 286 A 22 ASP H A 24 LEU HBx 1.0 1.8 5.0 483 286 A 22 ASP H A 24 LEU HBy 1.0 1.8 5.0 484 287 A 24 LEU H A 22 ASP HA 1.0 1.8 5.0 485 288 A 22 ASP HA A 25 LEU H 1.0 1.8 5.0 486 289 A 22 ASP HA A 26 GLU H 1.0 1.8 5.0 487 290 A 23 GLU H A 23 GLU HGx 1.0 1.8 3.3 488 290 A 23 GLU H A 23 GLU HGy 1.0 1.8 3.3 489 291 A 24 LEU H A 23 GLU H 1.0 1.8 3.3 490 292 A 23 GLU H A 25 LEU HBx 1.0 1.8 5.0 491 292 A 23 GLU H A 25 LEU HBy 1.0 1.8 5.0 492 293 A 23 GLU H A 25 LEU HD1% 1.0 1.8 5.5 493 293 A 23 GLU H A 25 LEU HD2% 1.0 1.8 5.5 494 294 A 24 LEU H A 24 LEU HG 1.0 1.8 5.0 495 295 A 24 LEU H A 24 LEU HDx% 1.0 1.8 3.2 496 295 A 24 LEU HD21 A 24 LEU H 1.0 1.8 3.2 497 296 A 24 LEU H A 25 LEU H 1.0 1.8 3.3 498 297 A 24 LEU H A 27 LEU H 1.0 1.8 5.0 499 298 A 26 GLU H A 24 LEU HBx 1.0 1.8 5.0 500 298 A 24 LEU HBy A 26 GLU H 1.0 1.8 5.0 501 299 A 27 LEU H A 24 LEU HBx 1.0 1.8 5.0 502 299 A 24 LEU HBy A 27 LEU H 1.0 1.8 5.0 503 300 A 24 LEU HBy A 27 LEU HDx% 1.0 1.8 5.5 504 300 A 24 LEU HBx A 27 LEU HDx% 1.0 1.8 5.5 505 300 A 27 LEU HDy% A 24 LEU HBx 1.0 1.8 5.5 506 300 A 27 LEU HDy% A 24 LEU HBy 1.0 1.8 5.5 507 301 A 24 LEU HG A 28 TYR HBx 1.0 1.8 5.0 508 301 A 24 LEU HG A 28 TYR HBy 1.0 1.8 5.0 509 302 A 25 LEU H A 25 LEU HBx 1.0 1.8 2.7 510 302 A 25 LEU H A 25 LEU HBy 1.0 1.8 2.7 511 303 A 25 LEU H A 25 LEU HG 1.0 1.8 3.3 512 304 A 25 LEU H A 25 LEU HD1% 1.0 1.8 3.2 513 304 A 25 LEU H A 25 LEU HD2% 1.0 1.8 3.2 514 305 A 25 LEU H A 26 GLU H 1.0 1.8 3.3 515 306 A 25 LEU H A 54 LYS HEx 1.0 1.8 5.0 516 306 A 25 LEU H A 54 LYS HEy 1.0 1.8 5.0 517 307 A 29 ALA H A 25 LEU HBx 1.0 1.8 5.0 518 307 A 25 LEU HBy A 29 ALA H 1.0 1.8 5.0 519 308 A 26 GLU H A 25 LEU HD1% 1.0 1.8 3.8 520 308 A 26 GLU H A 25 LEU HD2% 1.0 1.8 3.8 521 309 A 27 LEU H A 25 LEU HD1% 1.0 1.8 5.5 522 309 A 25 LEU HD2% A 27 LEU H 1.0 1.8 5.5 523 310 A 25 LEU HD1% A 27 LEU HDx% 1.0 1.8 5.5 524 310 A 25 LEU HD2% A 27 LEU HDx% 1.0 1.8 5.5 525 310 A 27 LEU HDy% A 25 LEU HD1% 1.0 1.8 5.5 526 310 A 27 LEU HDy% A 25 LEU HD2% 1.0 1.8 5.5 527 311 A 28 TYR HD% A 25 LEU HD1% 1.0 1.8 5.5 528 311 A 25 LEU HD2% A 28 TYR HD% 1.0 1.8 5.5 529 312 A 28 TYR HE% A 25 LEU HD1% 1.0 1.8 5.5 530 312 A 25 LEU HD2% A 28 TYR HE% 1.0 1.8 5.5 531 313 A 29 ALA H A 25 LEU HD1% 1.0 1.8 5.5 532 313 A 25 LEU HD2% A 29 ALA H 1.0 1.8 5.5 533 314 A 26 GLU H A 27 LEU H 1.0 1.8 3.3 534 315 A 26 GLU H A 29 ALA H 1.0 1.8 5.0 535 316 A 26 GLU H A 57 ALA HB% 1.0 1.8 5.5 536 317 A 29 ALA H A 26 GLU HA 1.0 1.8 5.0 537 318 A 27 LEU HG A 27 LEU H 1.0 1.8 5.0 538 319 A 27 LEU H A 27 LEU HDx% 1.0 1.8 5.5 539 319 A 27 LEU HDy% A 27 LEU H 1.0 1.8 5.5 540 320 A 27 LEU H A 28 TYR HBx 1.0 1.8 5.0 541 320 A 27 LEU H A 28 TYR HBy 1.0 1.8 5.0 542 321 A 27 LEU H A 29 ALA HB% 1.0 1.8 5.5 543 322 A 27 LEU H A 30 LEU H 1.0 1.8 5.0 544 323 A 30 LEU H A 27 LEU HA 1.0 1.8 5.0 545 324 A 27 LEU HBx A 28 TYR HBx 1.0 1.8 5.0 546 324 A 27 LEU HBy A 28 TYR HBx 1.0 1.8 5.0 547 324 A 28 TYR HBy A 27 LEU HBx 1.0 1.8 5.0 548 324 A 28 TYR HBy A 27 LEU HBy 1.0 1.8 5.0 549 325 A 27 LEU HBy A 76 LEU HBx 1.0 1.8 5.0 550 325 A 27 LEU HBx A 76 LEU HBx 1.0 1.8 5.0 551 325 A 76 LEU HBy A 27 LEU HBx 1.0 1.8 5.0 552 325 A 27 LEU HBy A 76 LEU HBy 1.0 1.8 5.0 553 326 A 77 VAL HA A 27 LEU HG 1.0 1.8 5.0 554 327 A 27 LEU HG A 80 LEU HDx% 1.0 1.8 3.8 555 327 A 27 LEU HG A 80 LEU HDy% 1.0 1.8 3.8 556 328 A 27 LEU HG A 84 TYR HE% 1.0 1.8 5.0 557 329 A 30 LEU HD2% A 27 LEU HDx% 1.0 1.8 5.5 558 329 A 27 LEU HDy% A 30 LEU HD2% 1.0 1.8 5.5 559 330 A 27 LEU HDy% A 76 LEU HBx 1.0 1.8 5.5 560 330 A 27 LEU HDx% A 76 LEU HBx 1.0 1.8 5.5 561 330 A 76 LEU HBy A 27 LEU HDx% 1.0 1.8 5.5 562 330 A 27 LEU HDy% A 76 LEU HBy 1.0 1.8 5.5 563 331 A 77 VAL HA A 27 LEU HDx% 1.0 1.8 3.8 564 331 A 77 VAL HA A 27 LEU HDy% 1.0 1.8 3.8 565 332 A 77 VAL HG2% A 27 LEU HDx% 1.0 1.8 5.5 566 332 A 77 VAL HG2% A 27 LEU HDy% 1.0 1.8 5.5 567 333 A 80 LEU H A 27 LEU HDx% 1.0 1.8 5.5 568 333 A 27 LEU HDy% A 80 LEU H 1.0 1.8 5.5 569 334 A 84 TYR HE% A 27 LEU HDx% 1.0 1.8 5.5 570 334 A 27 LEU HDy% A 84 TYR HE% 1.0 1.8 5.5 571 335 A 28 TYR H A 28 TYR HBx 1.0 1.8 2.7 572 335 A 28 TYR HBy A 28 TYR H 1.0 1.8 2.7 573 336 A 31 TYR H A 28 TYR HA 1.0 1.8 5.0 574 337 A 28 TYR HA A 31 TYR HBx 1.0 1.8 3.3 575 337 A 31 TYR HBy A 28 TYR HA 1.0 1.8 3.3 576 338 A 29 ALA HA A 28 TYR HBx 1.0 1.8 5.0 577 338 A 28 TYR HBy A 29 ALA HA 1.0 1.8 5.0 578 339 A 29 ALA HB% A 28 TYR HBx 1.0 1.8 5.5 579 339 A 28 TYR HBy A 29 ALA HB% 1.0 1.8 5.5 580 340 A 31 TYR HD% A 28 TYR HBx 1.0 1.8 5.0 581 340 A 31 TYR HD% A 28 TYR HBy 1.0 1.8 5.0 582 341 A 28 TYR HBx A 32 LYS HBx 1.0 1.8 5.0 583 341 A 28 TYR HBy A 32 LYS HBx 1.0 1.8 5.0 584 341 A 32 LYS HBy A 28 TYR HBx 1.0 1.8 5.0 585 341 A 28 TYR HBy A 32 LYS HBy 1.0 1.8 5.0 586 342 A 28 TYR HBy A 32 LYS HGy 1.0 1.8 5.0 587 342 A 28 TYR HBx A 32 LYS HGy 1.0 1.8 5.0 588 342 A 32 LYS HGx A 28 TYR HBx 1.0 1.8 5.0 589 342 A 28 TYR HBy A 32 LYS HGx 1.0 1.8 5.0 590 343 A 28 TYR HBx A 32 LYS HDy 1.0 1.8 5.0 591 343 A 28 TYR HBy A 32 LYS HDy 1.0 1.8 5.0 592 343 A 32 LYS HDx A 28 TYR HBx 1.0 1.8 5.0 593 343 A 28 TYR HBy A 32 LYS HDx 1.0 1.8 5.0 594 344 A 28 TYR HD% A 29 ALA HA 1.0 1.8 3.3 595 345 A 28 TYR HD% A 29 ALA HB% 1.0 1.8 5.5 596 346 A 31 TYR HD% A 28 TYR HD% 1.0 1.8 5.0 597 347 A 28 TYR HD% A 32 LYS H 1.0 1.8 5.0 598 348 A 28 TYR HD% A 32 LYS HBx 1.0 1.8 5.0 599 348 A 28 TYR HD% A 32 LYS HBy 1.0 1.8 5.0 600 349 A 28 TYR HD% A 32 LYS HGy 1.0 1.8 5.0 601 349 A 28 TYR HD% A 32 LYS HGx 1.0 1.8 5.0 602 350 A 28 TYR HD% A 32 LYS HDy 1.0 1.8 5.0 603 350 A 28 TYR HD% A 32 LYS HDx 1.0 1.8 5.0 604 351 A 28 TYR HD% A 32 LYS HEx 1.0 1.8 5.0 605 351 A 28 TYR HD% A 32 LYS HEy 1.0 1.8 5.0 606 352 A 28 TYR HD% A 55 TRP HA 1.0 1.8 5.0 607 353 A 28 TYR HD% A 57 ALA HB% 1.0 1.8 5.5 608 354 A 28 TYR HD% A 58 TRP HBx 1.0 1.8 3.3 609 354 A 28 TYR HD% A 58 TRP HBy 1.0 1.8 3.3 610 355 A 28 TYR HD% A 58 TRP HE3 1.0 1.8 5.0 611 356 A 29 ALA H A 28 TYR HE% 1.0 1.8 5.0 612 357 A 28 TYR HE% A 29 ALA HA 1.0 1.8 5.0 613 358 A 28 TYR HE% A 32 LYS HBx 1.0 1.8 5.0 614 358 A 28 TYR HE% A 32 LYS HBy 1.0 1.8 5.0 615 359 A 28 TYR HE% A 32 LYS HGy 1.0 1.8 5.0 616 359 A 28 TYR HE% A 32 LYS HGx 1.0 1.8 5.0 617 360 A 28 TYR HE% A 32 LYS HDy 1.0 1.8 5.0 618 360 A 28 TYR HE% A 32 LYS HDx 1.0 1.8 5.0 619 361 A 28 TYR HE% A 55 TRP HA 1.0 1.8 5.0 620 362 A 28 TYR HE% A 57 ALA HB% 1.0 1.8 5.5 621 363 A 28 TYR HE% A 58 TRP HBx 1.0 1.8 5.0 622 363 A 28 TYR HE% A 58 TRP HBy 1.0 1.8 5.0 623 364 A 28 TYR HE% A 58 TRP HD1 1.0 1.8 5.0 624 365 A 28 TYR HE% A 58 TRP HE3 1.0 1.8 3.3 625 366 A 28 TYR HE% A 58 TRP HZ3 1.0 1.8 5.0 626 367 A 29 ALA H A 29 ALA HA 1.0 1.8 2.7 627 368 A 29 ALA H A 30 LEU H 1.0 1.8 3.3 628 369 A 29 ALA H A 30 LEU HBx 1.0 1.8 5.0 629 369 A 30 LEU HBy A 29 ALA H 1.0 1.8 5.0 630 370 A 31 TYR H A 29 ALA H 1.0 1.8 5.0 631 371 A 29 ALA H A 57 ALA HB% 1.0 1.8 5.5 632 372 A 29 ALA H A 58 TRP HA 1.0 1.8 5.0 633 373 A 30 LEU HA A 29 ALA HA 1.0 1.8 5.0 634 374 A 29 ALA HA A 30 LEU HD1% 1.0 1.8 5.5 635 375 A 31 TYR H A 29 ALA HA 1.0 1.8 5.0 636 376 A 29 ALA HA A 32 LYS H 1.0 1.8 5.0 637 377 A 29 ALA HA A 32 LYS HBx 1.0 1.8 5.0 638 377 A 29 ALA HA A 32 LYS HBy 1.0 1.8 5.0 639 378 A 29 ALA HA A 32 LYS HGy 1.0 1.8 5.0 640 378 A 29 ALA HA A 32 LYS HGx 1.0 1.8 5.0 641 379 A 29 ALA HA A 33 GLN H 1.0 1.8 5.0 642 380 A 29 ALA HA A 58 TRP HA 1.0 1.8 5.0 643 381 A 29 ALA HA A 58 TRP HD1 1.0 1.8 5.0 644 382 A 29 ALA HB% A 30 LEU HD1% 1.0 1.8 5.5 645 383 A 29 ALA HB% A 57 ALA HA 1.0 1.8 5.5 646 384 A 29 ALA HB% A 58 TRP H 1.0 1.8 5.5 647 385 A 29 ALA HB% A 58 TRP HA 1.0 1.8 5.5 648 386 A 29 ALA HB% A 58 TRP HBx 1.0 1.8 5.5 649 386 A 29 ALA HB% A 58 TRP HBy 1.0 1.8 5.5 650 387 A 29 ALA HB% A 58 TRP HD1 1.0 1.8 5.5 651 388 A 30 LEU H A 30 LEU HG 1.0 1.8 5.0 652 389 A 30 LEU H A 30 LEU HD1% 1.0 1.8 3.8 653 390 A 30 LEU H A 30 LEU HD2% 1.0 1.8 5.5 654 391 A 31 TYR H A 30 LEU H 1.0 1.8 5.0 655 392 A 30 LEU H A 31 TYR HBx 1.0 1.8 5.0 656 392 A 31 TYR HBy A 30 LEU H 1.0 1.8 5.0 657 393 A 30 LEU HA A 30 LEU HD1% 1.0 1.8 3.8 658 394 A 30 LEU HA A 33 GLN H 1.0 1.8 5.0 659 395 A 30 LEU HA A 33 GLN HBx 1.0 1.8 3.3 660 395 A 30 LEU HA A 33 GLN HBy 1.0 1.8 3.3 661 396 A 30 LEU HA A 61 LEU HBx 1.0 1.8 5.0 662 396 A 30 LEU HA A 61 LEU HBy 1.0 1.8 5.0 663 397 A 31 TYR H A 30 LEU HBx 1.0 1.8 5.0 664 397 A 30 LEU HBy A 31 TYR H 1.0 1.8 5.0 665 398 A 30 LEU HBx A 33 GLN HBx 1.0 1.8 5.0 666 398 A 30 LEU HBy A 33 GLN HBx 1.0 1.8 5.0 667 398 A 33 GLN HBy A 30 LEU HBx 1.0 1.8 5.0 668 398 A 30 LEU HBy A 33 GLN HBy 1.0 1.8 5.0 669 399 A 34 ALA H A 30 LEU HBx 1.0 1.8 5.0 670 399 A 30 LEU HBy A 34 ALA H 1.0 1.8 5.0 671 400 A 73 TYR H A 30 LEU HBx 1.0 1.8 5.0 672 400 A 30 LEU HBy A 73 TYR H 1.0 1.8 5.0 673 401 A 73 TYR HA A 30 LEU HBx 1.0 1.8 5.0 674 401 A 30 LEU HBy A 73 TYR HA 1.0 1.8 5.0 675 402 A 30 LEU HBx A 73 TYR HBy 1.0 1.8 3.3 676 402 A 30 LEU HBy A 73 TYR HBy 1.0 1.8 3.3 677 402 A 73 TYR HBx A 30 LEU HBx 1.0 1.8 3.3 678 402 A 73 TYR HBx A 30 LEU HBy 1.0 1.8 3.3 679 403 A 31 TYR H A 30 LEU HG 1.0 1.8 5.0 680 404 A 30 LEU HG A 33 GLN HBx 1.0 1.8 5.0 681 404 A 30 LEU HG A 33 GLN HBy 1.0 1.8 5.0 682 405 A 73 TYR H A 30 LEU HG 1.0 1.8 5.0 683 406 A 30 LEU HG A 73 TYR HBy 1.0 1.8 5.0 684 406 A 73 TYR HBx A 30 LEU HG 1.0 1.8 5.0 685 407 A 31 TYR H A 30 LEU HD1% 1.0 1.8 5.5 686 408 A 69 ALA HB% A 30 LEU HD1% 1.0 1.8 5.5 687 409 A 73 TYR H A 30 LEU HD1% 1.0 1.8 5.5 688 410 A 30 LEU HD1% A 73 TYR HA 1.0 1.8 3.8 689 411 A 31 TYR H A 30 LEU HD2% 1.0 1.8 5.5 690 412 A 30 LEU HD2% A 33 GLN H 1.0 1.8 5.5 691 413 A 30 LEU HD2% A 72 GLU HBx 1.0 1.8 3.8 692 413 A 30 LEU HD2% A 72 GLU HBy 1.0 1.8 3.8 693 414 A 31 TYR H A 31 TYR HBx 1.0 1.8 2.7 694 414 A 31 TYR H A 31 TYR HBy 1.0 1.8 2.7 695 415 A 31 TYR H A 32 LYS H 1.0 1.8 3.3 696 416 A 31 TYR H A 32 LYS HBx 1.0 1.8 5.0 697 416 A 31 TYR H A 32 LYS HBy 1.0 1.8 5.0 698 417 A 31 TYR H A 32 LYS HGy 1.0 1.8 5.0 699 417 A 31 TYR H A 32 LYS HGx 1.0 1.8 5.0 700 418 A 31 TYR H A 33 GLN H 1.0 1.8 5.0 701 419 A 34 ALA H A 31 TYR H 1.0 1.8 5.0 702 420 A 73 TYR HD% A 31 TYR H 1.0 1.8 5.0 703 421 A 31 TYR HA A 34 ALA H 1.0 1.8 5.0 704 422 A 31 TYR HA A 35 THR H 1.0 1.8 5.0 705 423 A 31 TYR HA A 69 ALA HB% 1.0 1.8 5.5 706 424 A 32 LYS H A 31 TYR HBx 1.0 1.8 3.3 707 424 A 31 TYR HBy A 32 LYS H 1.0 1.8 3.3 708 425 A 31 TYR HBy A 32 LYS HBx 1.0 1.8 5.0 709 425 A 31 TYR HBx A 32 LYS HBx 1.0 1.8 5.0 710 425 A 32 LYS HBy A 31 TYR HBx 1.0 1.8 5.0 711 425 A 31 TYR HBy A 32 LYS HBy 1.0 1.8 5.0 712 426 A 33 GLN H A 31 TYR HBx 1.0 1.8 5.0 713 426 A 31 TYR HBy A 33 GLN H 1.0 1.8 5.0 714 427 A 31 TYR HD% A 32 LYS H 1.0 1.8 3.3 715 428 A 31 TYR HD% A 32 LYS HA 1.0 1.8 5.0 716 429 A 31 TYR HD% A 32 LYS HGy 1.0 1.8 5.0 717 429 A 31 TYR HD% A 32 LYS HGx 1.0 1.8 5.0 718 430 A 31 TYR HD% A 32 LYS HDy 1.0 1.8 3.3 719 430 A 31 TYR HD% A 32 LYS HDx 1.0 1.8 3.3 720 431 A 31 TYR HD% A 32 LYS HEx 1.0 1.8 5.0 721 431 A 31 TYR HD% A 32 LYS HEy 1.0 1.8 5.0 722 432 A 31 TYR HD% A 35 THR HA 1.0 1.8 5.0 723 433 A 77 VAL HG2% A 31 TYR HD% 1.0 1.8 5.5 724 434 A 31 TYR HE% A 32 LYS H 1.0 1.8 5.0 725 435 A 31 TYR HE% A 32 LYS HGy 1.0 1.8 5.0 726 435 A 31 TYR HE% A 32 LYS HGx 1.0 1.8 5.0 727 436 A 31 TYR HE% A 32 LYS HDy 1.0 1.8 5.0 728 436 A 31 TYR HE% A 32 LYS HDx 1.0 1.8 5.0 729 437 A 31 TYR HE% A 35 THR H 1.0 1.8 5.0 730 438 A 31 TYR HE% A 35 THR HA 1.0 1.8 5.0 731 439 A 32 LYS H A 32 LYS HGy 1.0 1.8 3.3 732 439 A 32 LYS HGx A 32 LYS H 1.0 1.8 3.3 733 440 A 32 LYS H A 32 LYS HDy 1.0 1.8 5.0 734 440 A 32 LYS HDx A 32 LYS H 1.0 1.8 5.0 735 441 A 32 LYS H A 32 LYS HEx 1.0 1.8 5.0 736 441 A 32 LYS H A 32 LYS HEy 1.0 1.8 5.0 737 442 A 32 LYS H A 33 GLN H 1.0 1.8 2.7 738 443 A 32 LYS HA A 32 LYS HDy 1.0 1.8 3.3 739 443 A 32 LYS HDx A 32 LYS HA 1.0 1.8 3.3 740 444 A 32 LYS HA A 32 LYS HEx 1.0 1.8 5.0 741 444 A 32 LYS HEy A 32 LYS HA 1.0 1.8 5.0 742 445 A 32 LYS HA A 33 GLN HA 1.0 1.8 5.0 743 446 A 35 THR H A 32 LYS HA 1.0 1.8 5.0 744 447 A 32 LYS HA A 36 VAL H 1.0 1.8 5.0 745 448 A 32 LYS HA A 58 TRP HH2 1.0 1.8 5.0 746 449 A 32 LYS HBy A 32 LYS HEx 1.0 1.8 5.0 747 449 A 32 LYS HBx A 32 LYS HEx 1.0 1.8 5.0 748 449 A 32 LYS HEy A 32 LYS HBx 1.0 1.8 5.0 749 449 A 32 LYS HBy A 32 LYS HEy 1.0 1.8 5.0 750 450 A 33 GLN H A 32 LYS HBx 1.0 1.8 5.0 751 450 A 32 LYS HBy A 33 GLN H 1.0 1.8 5.0 752 451 A 33 GLN HA A 32 LYS HBx 1.0 1.8 5.0 753 451 A 32 LYS HBy A 33 GLN HA 1.0 1.8 5.0 754 452 A 55 TRP HE1 A 32 LYS HBx 1.0 1.8 5.0 755 452 A 32 LYS HBy A 55 TRP HE1 1.0 1.8 5.0 756 453 A 58 TRP HD1 A 32 LYS HBx 1.0 1.8 5.0 757 453 A 32 LYS HBy A 58 TRP HD1 1.0 1.8 5.0 758 454 A 58 TRP HZ3 A 32 LYS HBx 1.0 1.8 5.0 759 454 A 32 LYS HBy A 58 TRP HZ3 1.0 1.8 5.0 760 455 A 58 TRP HZ2 A 32 LYS HBx 1.0 1.8 5.0 761 455 A 32 LYS HBy A 58 TRP HZ2 1.0 1.8 5.0 762 456 A 58 TRP HH2 A 32 LYS HBx 1.0 1.8 5.0 763 456 A 32 LYS HBy A 58 TRP HH2 1.0 1.8 5.0 764 457 A 33 GLN H A 32 LYS HGy 1.0 1.8 5.0 765 457 A 32 LYS HGx A 33 GLN H 1.0 1.8 5.0 766 458 A 32 LYS HGy A 58 TRP HBx 1.0 1.8 5.0 767 458 A 32 LYS HGx A 58 TRP HBx 1.0 1.8 5.0 768 458 A 58 TRP HBy A 32 LYS HGy 1.0 1.8 5.0 769 458 A 32 LYS HGx A 58 TRP HBy 1.0 1.8 5.0 770 459 A 58 TRP HZ3 A 32 LYS HDy 1.0 1.8 5.0 771 459 A 32 LYS HDx A 58 TRP HZ3 1.0 1.8 5.0 772 460 A 35 THR H A 32 LYS HEx 1.0 1.8 5.0 773 460 A 32 LYS HEy A 35 THR H 1.0 1.8 5.0 774 461 A 58 TRP HE3 A 32 LYS HEx 1.0 1.8 5.0 775 461 A 32 LYS HEy A 58 TRP HE3 1.0 1.8 5.0 776 462 A 58 TRP HZ3 A 32 LYS HEx 1.0 1.8 3.3 777 462 A 32 LYS HEy A 58 TRP HZ3 1.0 1.8 3.3 778 463 A 58 TRP HH2 A 32 LYS HEx 1.0 1.8 5.0 779 463 A 32 LYS HEy A 58 TRP HH2 1.0 1.8 5.0 780 464 A 33 GLN H A 33 GLN HA 1.0 1.8 2.7 781 465 A 33 GLN H A 33 GLN HGx 1.0 1.8 5.0 782 465 A 33 GLN H A 33 GLN HGy 1.0 1.8 5.0 783 466 A 34 ALA H A 33 GLN H 1.0 1.8 3.3 784 467 A 34 ALA HB% A 33 GLN H 1.0 1.8 5.5 785 468 A 33 GLN H A 35 THR H 1.0 1.8 5.0 786 469 A 33 GLN H A 36 VAL HGx% 1.0 1.8 5.5 787 469 A 33 GLN H A 36 VAL HGy% 1.0 1.8 5.5 788 470 A 58 TRP HD1 A 33 GLN H 1.0 1.8 5.0 789 471 A 33 GLN H A 58 TRP HE1 1.0 1.8 5.0 790 472 A 58 TRP HD1 A 33 GLN HA 1.0 1.8 5.0 791 473 A 33 GLN HA A 58 TRP HE1 1.0 1.8 3.3 792 474 A 33 GLN HA A 58 TRP HZ2 1.0 1.8 5.0 793 475 A 34 ALA H A 33 GLN HBx 1.0 1.8 3.3 794 475 A 34 ALA H A 33 GLN HBy 1.0 1.8 3.3 795 476 A 33 GLN HBy A 36 VAL HGx% 1.0 1.8 5.5 796 476 A 36 VAL HGy% A 33 GLN HBx 1.0 1.8 5.5 797 476 A 33 GLN HBy A 36 VAL HGy% 1.0 1.8 5.5 798 476 A 33 GLN HBx A 36 VAL HGx% 1.0 1.8 5.5 799 477 A 33 GLN HBx A 37 GLY HAy 1.0 1.8 5.0 800 477 A 33 GLN HBy A 37 GLY HAy 1.0 1.8 5.0 801 477 A 37 GLY HAx A 33 GLN HBx 1.0 1.8 5.0 802 477 A 33 GLN HBy A 37 GLY HAx 1.0 1.8 5.0 803 478 A 58 TRP HD1 A 33 GLN HBx 1.0 1.8 5.0 804 478 A 58 TRP HD1 A 33 GLN HBy 1.0 1.8 5.0 805 479 A 33 GLN HBx A 68 ASP HBx 1.0 1.8 5.0 806 479 A 33 GLN HBy A 68 ASP HBx 1.0 1.8 5.0 807 479 A 68 ASP HBy A 33 GLN HBx 1.0 1.8 5.0 808 479 A 33 GLN HBy A 68 ASP HBy 1.0 1.8 5.0 809 480 A 69 ALA HA A 33 GLN HBx 1.0 1.8 5.0 810 480 A 33 GLN HBy A 69 ALA HA 1.0 1.8 5.0 811 481 A 34 ALA H A 33 GLN HGx 1.0 1.8 5.0 812 481 A 34 ALA H A 33 GLN HGy 1.0 1.8 5.0 813 482 A 33 GLN HGy A 36 VAL HGx% 1.0 1.8 5.5 814 482 A 33 GLN HGx A 36 VAL HGx% 1.0 1.8 5.5 815 482 A 36 VAL HGy% A 33 GLN HGx 1.0 1.8 5.5 816 482 A 33 GLN HGy A 36 VAL HGy% 1.0 1.8 5.5 817 483 A 33 GLN HGx A 37 GLY HAy 1.0 1.8 5.0 818 483 A 33 GLN HGy A 37 GLY HAy 1.0 1.8 5.0 819 483 A 37 GLY HAx A 33 GLN HGx 1.0 1.8 5.0 820 483 A 33 GLN HGy A 37 GLY HAx 1.0 1.8 5.0 821 484 A 58 TRP HD1 A 33 GLN HGx 1.0 1.8 3.3 822 484 A 58 TRP HD1 A 33 GLN HGy 1.0 1.8 3.3 823 485 A 58 TRP HZ2 A 33 GLN HGx 1.0 1.8 5.0 824 485 A 58 TRP HZ2 A 33 GLN HGy 1.0 1.8 5.0 825 486 A 69 ALA HA A 33 GLN HGx 1.0 1.8 5.0 826 486 A 33 GLN HGy A 69 ALA HA 1.0 1.8 5.0 827 487 A 69 ALA HB% A 33 GLN HGx 1.0 1.8 5.5 828 487 A 69 ALA HB% A 33 GLN HGy 1.0 1.8 5.5 829 488 A 34 ALA H A 35 THR H 1.0 1.8 3.3 830 489 A 34 ALA H A 35 THR HG2% 1.0 1.8 5.5 831 490 A 34 ALA H A 36 VAL H 1.0 1.8 5.0 832 491 A 34 ALA H A 37 GLY H 1.0 1.8 5.0 833 492 A 34 ALA H A 37 GLY HAy 1.0 1.8 5.0 834 492 A 34 ALA H A 37 GLY HAx 1.0 1.8 5.0 835 493 A 34 ALA H A 58 TRP HE1 1.0 1.8 5.0 836 494 A 34 ALA H A 66 GLN HA 1.0 1.8 5.0 837 495 A 34 ALA H A 66 GLN HGx 1.0 1.8 5.0 838 495 A 34 ALA H A 66 GLN HGy 1.0 1.8 5.0 839 496 A 34 ALA H A 69 ALA HB% 1.0 1.8 5.5 840 497 A 70 GLU H A 34 ALA H 1.0 1.8 5.0 841 498 A 34 ALA HA A 36 VAL H 1.0 1.8 5.0 842 499 A 34 ALA HA A 37 GLY H 1.0 1.8 5.0 843 500 A 69 ALA HB% A 34 ALA HA 1.0 1.8 3.8 844 501 A 34 ALA HB% A 66 GLN HBy 1.0 1.8 5.5 845 501 A 34 ALA HB% A 66 GLN HBx 1.0 1.8 5.5 846 502 A 34 ALA HB% A 66 GLN HE2y 1.0 1.8 5.5 847 502 A 34 ALA HB% A 66 GLN HE2x 1.0 1.8 5.5 848 503 A 34 ALA HB% A 69 ALA HA 1.0 1.8 5.5 849 504 A 69 ALA HB% A 34 ALA HB% 1.0 1.8 5.5 850 505 A 70 GLU H A 34 ALA HB% 1.0 1.8 3.8 851 506 A 34 ALA HB% A 70 GLU HBx 1.0 1.8 5.5 852 506 A 70 GLU HBy A 34 ALA HB% 1.0 1.8 5.5 853 507 A 35 THR HG2% A 35 THR H 1.0 1.8 3.8 854 508 A 35 THR H A 36 VAL H 1.0 1.8 3.3 855 509 A 35 THR H A 37 GLY H 1.0 1.8 5.0 856 510 A 69 ALA HB% A 35 THR H 1.0 1.8 5.5 857 511 A 35 THR HB A 36 VAL HGx% 1.0 1.8 5.5 858 511 A 36 VAL HGy% A 35 THR HB 1.0 1.8 5.5 859 512 A 35 THR HG2% A 36 VAL H 1.0 1.8 5.5 860 513 A 36 VAL H A 37 GLY H 1.0 1.8 2.7 861 514 A 36 VAL H A 37 GLY HAy 1.0 1.8 5.0 862 514 A 36 VAL H A 37 GLY HAx 1.0 1.8 5.0 863 515 A 36 VAL H A 38 ASP H 1.0 1.8 5.0 864 516 A 36 VAL H A 40 ASP HBx 1.0 1.8 5.0 865 516 A 36 VAL H A 40 ASP HBy 1.0 1.8 5.0 866 517 A 36 VAL H A 58 TRP HZ2 1.0 1.8 5.0 867 518 A 36 VAL H A 66 GLN HE2y 1.0 1.8 5.0 868 518 A 36 VAL H A 66 GLN HE2x 1.0 1.8 5.0 869 519 A 37 GLY H A 36 VAL HB 1.0 1.8 5.0 870 520 A 36 VAL HB A 37 GLY HAy 1.0 1.8 5.0 871 520 A 37 GLY HAx A 36 VAL HB 1.0 1.8 5.0 872 521 A 58 TRP HZ2 A 36 VAL HB 1.0 1.8 5.0 873 522 A 37 GLY H A 36 VAL HGx% 1.0 1.8 3.8 874 522 A 36 VAL HGy% A 37 GLY H 1.0 1.8 3.8 875 523 A 36 VAL HGy% A 37 GLY HAy 1.0 1.8 5.5 876 523 A 36 VAL HGx% A 37 GLY HAy 1.0 1.8 5.5 877 523 A 37 GLY HAx A 36 VAL HGx% 1.0 1.8 5.5 878 523 A 36 VAL HGy% A 37 GLY HAx 1.0 1.8 5.5 879 524 A 38 ASP H A 36 VAL HGx% 1.0 1.8 3.8 880 524 A 36 VAL HGy% A 38 ASP H 1.0 1.8 3.8 881 525 A 36 VAL HGy% A 41 LYS HBx 1.0 1.8 5.5 882 525 A 36 VAL HGx% A 41 LYS HBx 1.0 1.8 5.5 883 525 A 41 LYS HBy A 36 VAL HGx% 1.0 1.8 5.5 884 525 A 36 VAL HGy% A 41 LYS HBy 1.0 1.8 5.5 885 526 A 36 VAL HGx% A 41 LYS HGx 1.0 1.8 5.5 886 526 A 36 VAL HGy% A 41 LYS HGx 1.0 1.8 5.5 887 526 A 41 LYS HGy A 36 VAL HGx% 1.0 1.8 5.5 888 526 A 36 VAL HGy% A 41 LYS HGy 1.0 1.8 5.5 889 527 A 36 VAL HGx% A 58 TRP HBx 1.0 1.8 5.5 890 527 A 36 VAL HGy% A 58 TRP HBx 1.0 1.8 5.5 891 527 A 58 TRP HBy A 36 VAL HGx% 1.0 1.8 5.5 892 527 A 58 TRP HBy A 36 VAL HGy% 1.0 1.8 5.5 893 528 A 58 TRP HZ3 A 36 VAL HGx% 1.0 1.8 5.5 894 528 A 58 TRP HZ3 A 36 VAL HGy% 1.0 1.8 5.5 895 529 A 58 TRP HZ2 A 36 VAL HGx% 1.0 1.8 3.8 896 529 A 58 TRP HZ2 A 36 VAL HGy% 1.0 1.8 3.8 897 530 A 58 TRP HH2 A 36 VAL HGx% 1.0 1.8 5.5 898 530 A 58 TRP HH2 A 36 VAL HGy% 1.0 1.8 5.5 899 531 A 37 GLY H A 38 ASP H 1.0 1.8 3.3 900 532 A 58 TRP HE1 A 37 GLY H 1.0 1.8 5.0 901 533 A 58 TRP HZ2 A 37 GLY H 1.0 1.8 5.0 902 534 A 37 GLY H A 66 GLN HE2y 1.0 1.8 5.0 903 534 A 37 GLY H A 66 GLN HE2x 1.0 1.8 5.0 904 535 A 66 GLN H A 37 GLY HAy 1.0 1.8 5.0 905 535 A 37 GLY HAx A 66 GLN H 1.0 1.8 5.0 906 536 A 37 GLY HAy A 66 GLN HGx 1.0 1.8 5.0 907 536 A 37 GLY HAx A 66 GLN HGx 1.0 1.8 5.0 908 536 A 66 GLN HGy A 37 GLY HAy 1.0 1.8 5.0 909 536 A 37 GLY HAx A 66 GLN HGy 1.0 1.8 5.0 910 537 A 37 GLY HAy A 66 GLN HE2y 1.0 1.8 5.0 911 537 A 37 GLY HAx A 66 GLN HE2y 1.0 1.8 5.0 912 537 A 66 GLN HE2x A 37 GLY HAy 1.0 1.8 5.0 913 537 A 37 GLY HAx A 66 GLN HE2x 1.0 1.8 5.0 914 538 A 38 ASP H A 39 ASN H 1.0 1.8 5.0 915 539 A 38 ASP H A 40 ASP HBx 1.0 1.8 5.0 916 539 A 38 ASP H A 40 ASP HBy 1.0 1.8 5.0 917 540 A 58 TRP HE1 A 38 ASP H 1.0 1.8 5.0 918 541 A 39 ASN H A 38 ASP HA 1.0 1.8 3.3 919 542 A 58 TRP HZ2 A 38 ASP HBx 1.0 1.8 5.0 920 542 A 58 TRP HZ2 A 38 ASP HBy 1.0 1.8 5.0 921 543 A 39 ASN H A 40 ASP H 1.0 1.8 5.0 922 544 A 58 TRP HE1 A 39 ASN H 1.0 1.8 5.0 923 545 A 39 ASN H A 59 GLU HA 1.0 1.8 5.0 924 546 A 39 ASN H A 62 LYS H 1.0 1.8 5.0 925 547 A 39 ASN H A 62 LYS HA 1.0 1.8 5.0 926 548 A 41 LYS H A 39 ASN HBx 1.0 1.8 5.0 927 548 A 39 ASN HBy A 41 LYS H 1.0 1.8 5.0 928 549 A 59 GLU H A 39 ASN HBx 1.0 1.8 5.0 929 549 A 39 ASN HBy A 59 GLU H 1.0 1.8 5.0 930 550 A 40 ASP H A 40 ASP HBx 1.0 1.8 2.7 931 550 A 40 ASP HBy A 40 ASP H 1.0 1.8 2.7 932 551 A 40 ASP H A 41 LYS H 1.0 1.8 3.3 933 552 A 40 ASP H A 41 LYS HBx 1.0 1.8 5.0 934 552 A 41 LYS HBy A 40 ASP H 1.0 1.8 5.0 935 553 A 58 TRP HZ2 A 40 ASP H 1.0 1.8 3.3 936 554 A 58 TRP HH2 A 40 ASP H 1.0 1.8 5.0 937 555 A 40 ASP HA A 41 LYS HGx 1.0 1.8 5.0 938 555 A 41 LYS HGy A 40 ASP HA 1.0 1.8 5.0 939 556 A 41 LYS H A 40 ASP HBx 1.0 1.8 3.3 940 556 A 40 ASP HBy A 41 LYS H 1.0 1.8 3.3 941 557 A 40 ASP HBx A 41 LYS HGx 1.0 1.8 5.0 942 557 A 40 ASP HBy A 41 LYS HGx 1.0 1.8 5.0 943 557 A 41 LYS HGy A 40 ASP HBx 1.0 1.8 5.0 944 557 A 40 ASP HBy A 41 LYS HGy 1.0 1.8 5.0 945 558 A 41 LYS H A 41 LYS HGx 1.0 1.8 5.0 946 558 A 41 LYS HGy A 41 LYS H 1.0 1.8 5.0 947 559 A 41 LYS H A 41 LYS HEx 1.0 1.8 3.3 948 559 A 41 LYS H A 41 LYS HEy 1.0 1.8 3.3 949 560 A 41 LYS H A 42 GLU H 1.0 1.8 5.0 950 561 A 41 LYS H A 42 GLU HBx 1.0 1.8 5.0 951 561 A 41 LYS H A 42 GLU HBy 1.0 1.8 5.0 952 562 A 41 LYS H A 55 TRP HD1 1.0 1.8 5.0 953 563 A 55 TRP HE1 A 41 LYS H 1.0 1.8 5.0 954 564 A 58 TRP HZ3 A 41 LYS H 1.0 1.8 5.0 955 565 A 58 TRP HH2 A 41 LYS H 1.0 1.8 5.0 956 566 A 42 GLU H A 41 LYS HA 1.0 1.8 3.3 957 567 A 42 GLU H A 41 LYS HBx 1.0 1.8 5.0 958 567 A 41 LYS HBy A 42 GLU H 1.0 1.8 5.0 959 568 A 42 GLU HA A 41 LYS HBx 1.0 1.8 5.0 960 568 A 41 LYS HBy A 42 GLU HA 1.0 1.8 5.0 961 569 A 43 LYS H A 41 LYS HBx 1.0 1.8 5.0 962 569 A 41 LYS HBy A 43 LYS H 1.0 1.8 5.0 963 570 A 41 LYS HBy A 44 PRO HBx 1.0 1.8 5.0 964 570 A 41 LYS HBx A 44 PRO HBx 1.0 1.8 5.0 965 570 A 44 PRO HBy A 41 LYS HBx 1.0 1.8 5.0 966 570 A 41 LYS HBy A 44 PRO HBy 1.0 1.8 5.0 967 571 A 41 LYS HBy A 44 PRO HDx 1.0 1.8 5.0 968 571 A 41 LYS HBx A 44 PRO HDx 1.0 1.8 5.0 969 571 A 44 PRO HDy A 41 LYS HBx 1.0 1.8 5.0 970 571 A 41 LYS HBy A 44 PRO HDy 1.0 1.8 5.0 971 572 A 55 TRP HE1 A 41 LYS HBx 1.0 1.8 3.3 972 572 A 55 TRP HE1 A 41 LYS HBy 1.0 1.8 3.3 973 573 A 55 TRP HZ2 A 41 LYS HBx 1.0 1.8 5.0 974 573 A 41 LYS HBy A 55 TRP HZ2 1.0 1.8 5.0 975 574 A 58 TRP HH2 A 41 LYS HBx 1.0 1.8 5.0 976 574 A 58 TRP HH2 A 41 LYS HBy 1.0 1.8 5.0 977 575 A 55 TRP HD1 A 41 LYS HGx 1.0 1.8 5.0 978 575 A 41 LYS HGy A 55 TRP HD1 1.0 1.8 5.0 979 576 A 58 TRP HZ3 A 41 LYS HGx 1.0 1.8 5.0 980 576 A 58 TRP HZ3 A 41 LYS HGy 1.0 1.8 5.0 981 577 A 58 TRP HH2 A 41 LYS HGx 1.0 1.8 5.0 982 577 A 58 TRP HH2 A 41 LYS HGy 1.0 1.8 5.0 983 578 A 42 GLU H A 42 GLU HBx 1.0 1.8 2.7 984 578 A 42 GLU H A 42 GLU HBy 1.0 1.8 2.7 985 579 A 42 GLU H A 42 GLU HGx 1.0 1.8 5.0 986 579 A 42 GLU H A 42 GLU HGy 1.0 1.8 5.0 987 580 A 42 GLU H A 43 LYS H 1.0 1.8 5.0 988 581 A 55 TRP HE1 A 42 GLU H 1.0 1.8 5.0 989 582 A 42 GLU HA A 55 TRP HZ2 1.0 1.8 5.0 990 583 A 42 GLU HBx A 44 PRO HDx 1.0 1.8 5.0 991 583 A 42 GLU HBy A 44 PRO HDx 1.0 1.8 5.0 992 583 A 44 PRO HDy A 42 GLU HBx 1.0 1.8 5.0 993 583 A 42 GLU HBy A 44 PRO HDy 1.0 1.8 5.0 994 584 A 55 TRP HZ2 A 42 GLU HBx 1.0 1.8 5.0 995 584 A 42 GLU HBy A 55 TRP HZ2 1.0 1.8 5.0 996 585 A 43 LYS H A 42 GLU HGx 1.0 1.8 5.0 997 585 A 43 LYS H A 42 GLU HGy 1.0 1.8 5.0 998 586 A 55 TRP HE3 A 42 GLU HGx 1.0 1.8 5.0 999 586 A 42 GLU HGy A 55 TRP HE3 1.0 1.8 5.0 1000 587 A 55 TRP HZ3 A 42 GLU HGx 1.0 1.8 5.0 1001 587 A 42 GLU HGy A 55 TRP HZ3 1.0 1.8 5.0 1002 588 A 43 LYS H A 44 PRO HDx 1.0 1.8 5.0 1003 588 A 43 LYS H A 44 PRO HDy 1.0 1.8 5.0 1004 589 A 55 TRP HD1 A 43 LYS H 1.0 1.8 5.0 1005 590 A 55 TRP HE1 A 43 LYS H 1.0 1.8 5.0 1006 591 A 43 LYS H A 55 TRP HZ2 1.0 1.8 5.0 1007 592 A 44 PRO HA A 45 GLY H 1.0 1.8 3.3 1008 593 A 44 PRO HA A 45 GLY HAx 1.0 1.8 5.0 1009 593 A 44 PRO HA A 45 GLY HAy 1.0 1.8 5.0 1010 594 A 44 PRO HA A 55 TRP HBy 1.0 1.8 5.0 1011 594 A 44 PRO HA A 55 TRP HBx 1.0 1.8 5.0 1012 595 A 55 TRP HD1 A 44 PRO HA 1.0 1.8 5.0 1013 596 A 44 PRO HBx A 45 GLY HAx 1.0 1.8 5.0 1014 596 A 44 PRO HBy A 45 GLY HAx 1.0 1.8 5.0 1015 596 A 45 GLY HAy A 44 PRO HBx 1.0 1.8 5.0 1016 596 A 44 PRO HBy A 45 GLY HAy 1.0 1.8 5.0 1017 597 A 44 PRO HBy A 48 ASN HBy 1.0 1.8 5.0 1018 597 A 44 PRO HBx A 48 ASN HBy 1.0 1.8 5.0 1019 597 A 48 ASN HBx A 44 PRO HBx 1.0 1.8 5.0 1020 597 A 44 PRO HBy A 48 ASN HBx 1.0 1.8 5.0 1021 598 A 51 ASP H A 44 PRO HBx 1.0 1.8 5.0 1022 598 A 44 PRO HBy A 51 ASP H 1.0 1.8 5.0 1023 599 A 55 TRP H A 44 PRO HBx 1.0 1.8 5.0 1024 599 A 44 PRO HBy A 55 TRP H 1.0 1.8 5.0 1025 600 A 55 TRP HE3 A 44 PRO HBx 1.0 1.8 5.0 1026 600 A 44 PRO HBy A 55 TRP HE3 1.0 1.8 5.0 1027 601 A 44 PRO HGx A 45 GLY HAx 1.0 1.8 5.0 1028 601 A 44 PRO HGy A 45 GLY HAx 1.0 1.8 5.0 1029 601 A 45 GLY HAy A 44 PRO HGx 1.0 1.8 5.0 1030 601 A 45 GLY HAy A 44 PRO HGy 1.0 1.8 5.0 1031 602 A 44 PRO HGx A 48 ASN HBy 1.0 1.8 5.0 1032 602 A 44 PRO HGy A 48 ASN HBy 1.0 1.8 5.0 1033 602 A 48 ASN HBx A 44 PRO HGx 1.0 1.8 5.0 1034 602 A 48 ASN HBx A 44 PRO HGy 1.0 1.8 5.0 1035 603 A 44 PRO HGx A 55 TRP HBy 1.0 1.8 5.0 1036 603 A 44 PRO HGy A 55 TRP HBy 1.0 1.8 5.0 1037 603 A 55 TRP HBx A 44 PRO HGx 1.0 1.8 5.0 1038 603 A 55 TRP HBx A 44 PRO HGy 1.0 1.8 5.0 1039 604 A 55 TRP HD1 A 44 PRO HGx 1.0 1.8 5.0 1040 604 A 55 TRP HD1 A 44 PRO HGy 1.0 1.8 5.0 1041 605 A 44 PRO HDy A 51 ASP HBx 1.0 1.8 5.0 1042 605 A 44 PRO HDx A 51 ASP HBx 1.0 1.8 5.0 1043 605 A 51 ASP HBy A 44 PRO HDx 1.0 1.8 5.0 1044 605 A 44 PRO HDy A 51 ASP HBy 1.0 1.8 5.0 1045 606 A 55 TRP HD1 A 44 PRO HDx 1.0 1.8 5.0 1046 606 A 55 TRP HD1 A 44 PRO HDy 1.0 1.8 5.0 1047 607 A 45 GLY H A 46 ILE H 1.0 1.8 5.0 1048 608 A 45 GLY H A 46 ILE HG2% 1.0 1.8 5.5 1049 609 A 45 GLY H A 48 ASN HA 1.0 1.8 5.0 1050 610 A 45 GLY H A 48 ASN HBy 1.0 1.8 5.0 1051 610 A 45 GLY H A 48 ASN HBx 1.0 1.8 5.0 1052 611 A 45 GLY H A 51 ASP HBx 1.0 1.8 5.0 1053 611 A 45 GLY H A 51 ASP HBy 1.0 1.8 5.0 1054 612 A 46 ILE HA A 45 GLY HAx 1.0 1.8 5.0 1055 612 A 45 GLY HAy A 46 ILE HA 1.0 1.8 5.0 1056 613 A 46 ILE HG2% A 45 GLY HAx 1.0 1.8 5.5 1057 613 A 45 GLY HAy A 46 ILE HG2% 1.0 1.8 5.5 1058 614 A 45 GLY HAx A 46 ILE HG1x 1.0 1.8 5.0 1059 614 A 45 GLY HAy A 46 ILE HG1x 1.0 1.8 5.0 1060 614 A 46 ILE HG1y A 45 GLY HAx 1.0 1.8 5.0 1061 614 A 45 GLY HAy A 46 ILE HG1y 1.0 1.8 5.0 1062 615 A 46 ILE HD1% A 45 GLY HAx 1.0 1.8 5.4 1063 615 A 45 GLY HAy A 46 ILE HD1% 1.0 1.8 5.4 1064 616 A 47 PHE HD% A 45 GLY HAx 1.0 1.8 5.0 1065 616 A 45 GLY HAy A 47 PHE HD% 1.0 1.8 5.0 1066 617 A 46 ILE H A 46 ILE HG2% 1.0 1.8 3.8 1067 618 A 46 ILE H A 46 ILE HG1x 1.0 1.8 3.3 1068 618 A 46 ILE H A 46 ILE HG1y 1.0 1.8 3.3 1069 619 A 46 ILE H A 46 ILE HD1% 1.0 1.8 5.4 1070 620 A 46 ILE H A 47 PHE HBy 1.0 1.8 5.0 1071 620 A 46 ILE H A 47 PHE HBx 1.0 1.8 5.0 1072 621 A 46 ILE H A 47 PHE HD% 1.0 1.8 5.0 1073 622 A 46 ILE H A 48 ASN HA 1.0 1.8 5.0 1074 623 A 46 ILE H A 48 ASN HBy 1.0 1.8 5.0 1075 623 A 48 ASN HBx A 46 ILE H 1.0 1.8 5.0 1076 624 A 46 ILE HA A 48 ASN HBy 1.0 1.8 5.0 1077 624 A 48 ASN HBx A 46 ILE HA 1.0 1.8 5.0 1078 625 A 46 ILE HB A 47 PHE H 1.0 1.8 5.0 1079 626 A 46 ILE HB A 47 PHE HA 1.0 1.8 5.0 1080 627 A 46 ILE HB A 47 PHE HBy 1.0 1.8 5.0 1081 627 A 47 PHE HBx A 46 ILE HB 1.0 1.8 5.0 1082 628 A 47 PHE HD% A 46 ILE HB 1.0 1.8 5.0 1083 629 A 46 ILE HG2% A 47 PHE HD% 1.0 1.8 5.5 1084 630 A 46 ILE HG2% A 47 PHE HE% 1.0 1.8 5.5 1085 631 A 46 ILE HG2% A 47 PHE HZ 1.0 1.8 5.5 1086 632 A 46 ILE HG2% A 48 ASN HBy 1.0 1.8 5.5 1087 632 A 48 ASN HBx A 46 ILE HG2% 1.0 1.8 5.5 1088 633 A 46 ILE HG1x A 47 PHE HBy 1.0 1.8 5.0 1089 633 A 46 ILE HG1y A 47 PHE HBy 1.0 1.8 5.0 1090 633 A 47 PHE HBx A 46 ILE HG1x 1.0 1.8 5.0 1091 633 A 46 ILE HG1y A 47 PHE HBx 1.0 1.8 5.0 1092 634 A 47 PHE HD% A 46 ILE HG1x 1.0 1.8 5.0 1093 634 A 46 ILE HG1y A 47 PHE HD% 1.0 1.8 5.0 1094 635 A 46 ILE HG1y A 48 ASN HBy 1.0 1.8 5.0 1095 635 A 46 ILE HG1x A 48 ASN HBy 1.0 1.8 5.0 1096 635 A 48 ASN HBx A 46 ILE HG1x 1.0 1.8 5.0 1097 635 A 48 ASN HBx A 46 ILE HG1y 1.0 1.8 5.0 1098 636 A 46 ILE HD1% A 47 PHE HBy 1.0 1.8 5.4 1099 636 A 46 ILE HD1% A 47 PHE HBx 1.0 1.8 5.4 1100 637 A 46 ILE HD1% A 47 PHE HD% 1.0 1.8 5.4 1101 638 A 46 ILE HD1% A 47 PHE HZ 1.0 1.8 5.4 1102 639 A 48 ASN HA A 47 PHE H 1.0 1.8 5.0 1103 640 A 47 PHE HD% A 48 ASN HBy 1.0 1.8 5.0 1104 640 A 48 ASN HBx A 47 PHE HD% 1.0 1.8 5.0 1105 641 A 47 PHE HE% A 48 ASN HBy 1.0 1.8 5.0 1106 641 A 48 ASN HBx A 47 PHE HE% 1.0 1.8 5.0 1107 642 A 48 ASN HA A 48 ASN H 1.0 1.8 2.7 1108 643 A 48 ASN H A 48 ASN HD2y 1.0 1.8 4.9 1109 643 A 48 ASN H A 48 ASN HD2x 1.0 1.8 4.9 1110 644 A 48 ASN H A 51 ASP HBx 1.0 1.8 5.0 1111 644 A 51 ASP HBy A 48 ASN H 1.0 1.8 5.0 1112 645 A 48 ASN HA A 48 ASN HD2y 1.0 1.8 3.2 1113 645 A 48 ASN HA A 48 ASN HD2x 1.0 1.8 3.2 1114 646 A 48 ASN HA A 50 LYS HBx 1.0 1.8 5.0 1115 646 A 48 ASN HA A 50 LYS HBy 1.0 1.8 5.0 1116 647 A 51 ASP H A 48 ASN HA 1.0 1.8 5.0 1117 648 A 51 ASP H A 48 ASN HBy 1.0 1.8 5.0 1118 648 A 48 ASN HBx A 51 ASP H 1.0 1.8 5.0 1119 649 A 51 ASP HA A 48 ASN HBy 1.0 1.8 5.0 1120 649 A 48 ASN HBx A 51 ASP HA 1.0 1.8 5.0 1121 650 A 52 ARG H A 48 ASN HBy 1.0 1.8 3.3 1122 650 A 48 ASN HBx A 52 ARG H 1.0 1.8 3.3 1123 651 A 48 ASN HBx A 52 ARG HGy 1.0 1.8 3.3 1124 651 A 52 ARG HGx A 48 ASN HBy 1.0 1.8 3.3 1125 651 A 48 ASN HBx A 52 ARG HGx 1.0 1.8 3.3 1126 651 A 48 ASN HBy A 52 ARG HGy 1.0 1.8 3.3 1127 652 A 48 ASN HD2x A 51 ASP HBx 1.0 1.8 4.9 1128 652 A 48 ASN HD2y A 51 ASP HBx 1.0 1.8 4.9 1129 652 A 51 ASP HBy A 48 ASN HD2y 1.0 1.8 4.9 1130 652 A 51 ASP HBy A 48 ASN HD2x 1.0 1.8 4.9 1131 653 A 51 ASP H A 50 LYS H 1.0 1.8 5.0 1132 654 A 50 LYS H A 51 ASP HBx 1.0 1.8 5.0 1133 654 A 51 ASP HBy A 50 LYS H 1.0 1.8 5.0 1134 655 A 50 LYS HA A 53 TYR H 1.0 1.8 5.0 1135 656 A 53 TYR HD% A 50 LYS HBx 1.0 1.8 5.0 1136 656 A 50 LYS HBy A 53 TYR HD% 1.0 1.8 5.0 1137 657 A 51 ASP H A 52 ARG H 1.0 1.8 3.3 1138 658 A 51 ASP H A 52 ARG HGy 1.0 1.8 5.0 1139 658 A 51 ASP H A 52 ARG HGx 1.0 1.8 5.0 1140 659 A 51 ASP H A 53 TYR H 1.0 1.8 5.0 1141 660 A 51 ASP H A 54 LYS H 1.0 1.8 5.0 1142 661 A 52 ARG H A 51 ASP HBx 1.0 1.8 3.3 1143 661 A 51 ASP HBy A 52 ARG H 1.0 1.8 3.3 1144 662 A 54 LYS H A 51 ASP HBx 1.0 1.8 5.0 1145 662 A 51 ASP HBy A 54 LYS H 1.0 1.8 5.0 1146 663 A 55 TRP H A 51 ASP HBx 1.0 1.8 5.0 1147 663 A 55 TRP H A 51 ASP HBy 1.0 1.8 5.0 1148 664 A 55 TRP HD1 A 51 ASP HBx 1.0 1.8 5.0 1149 664 A 55 TRP HD1 A 51 ASP HBy 1.0 1.8 5.0 1150 665 A 52 ARG H A 52 ARG HA 1.0 1.8 2.7 1151 666 A 52 ARG H A 52 ARG HGy 1.0 1.8 3.3 1152 666 A 52 ARG H A 52 ARG HGx 1.0 1.8 3.3 1153 667 A 52 ARG H A 52 ARG HDx 1.0 1.8 5.0 1154 667 A 52 ARG H A 52 ARG HDy 1.0 1.8 5.0 1155 668 A 52 ARG H A 53 TYR H 1.0 1.8 3.3 1156 669 A 52 ARG H A 55 TRP HBy 1.0 1.8 5.0 1157 669 A 55 TRP HBx A 52 ARG H 1.0 1.8 5.0 1158 670 A 55 TRP H A 52 ARG HA 1.0 1.8 5.0 1159 671 A 53 TYR H A 53 TYR HE% 1.0 1.8 5.0 1160 672 A 53 TYR H A 54 LYS H 1.0 1.8 3.3 1161 673 A 55 TRP H A 53 TYR HA 1.0 1.8 5.0 1162 674 A 53 TYR HA A 56 GLU H 1.0 1.8 5.0 1163 675 A 53 TYR HD% A 54 LYS H 1.0 1.8 5.0 1164 676 A 54 LYS H A 54 LYS HGx 1.0 1.8 5.0 1165 676 A 54 LYS H A 54 LYS HGy 1.0 1.8 5.0 1166 677 A 54 LYS H A 54 LYS HDx 1.0 1.8 3.3 1167 677 A 54 LYS H A 54 LYS HDy 1.0 1.8 3.3 1168 678 A 54 LYS H A 54 LYS HEx 1.0 1.8 5.0 1169 678 A 54 LYS HEy A 54 LYS H 1.0 1.8 5.0 1170 679 A 55 TRP H A 54 LYS H 1.0 1.8 3.3 1171 680 A 55 TRP H A 54 LYS HGx 1.0 1.8 5.0 1172 680 A 55 TRP H A 54 LYS HGy 1.0 1.8 5.0 1173 681 A 55 TRP H A 55 TRP HBy 1.0 1.8 2.7 1174 681 A 55 TRP HBx A 55 TRP H 1.0 1.8 2.7 1175 682 A 55 TRP HD1 A 55 TRP H 1.0 1.8 5.0 1176 683 A 55 TRP HE3 A 55 TRP H 1.0 1.8 5.0 1177 684 A 55 TRP H A 56 GLU H 1.0 1.8 3.3 1178 685 A 57 ALA HB% A 55 TRP H 1.0 1.8 5.5 1179 686 A 55 TRP HA A 55 TRP HD1 1.0 1.8 5.0 1180 687 A 55 TRP HA A 55 TRP HE3 1.0 1.8 5.0 1181 688 A 55 TRP HA A 58 TRP HBx 1.0 1.8 5.0 1182 688 A 55 TRP HA A 58 TRP HBy 1.0 1.8 5.0 1183 689 A 55 TRP HA A 59 GLU H 1.0 1.8 5.0 1184 690 A 56 GLU H A 55 TRP HBy 1.0 1.8 3.3 1185 690 A 55 TRP HBx A 56 GLU H 1.0 1.8 3.3 1186 691 A 58 TRP HE3 A 55 TRP HD1 1.0 1.8 5.0 1187 692 A 58 TRP HH2 A 55 TRP HD1 1.0 1.8 5.0 1188 693 A 55 TRP HE3 A 56 GLU H 1.0 1.8 5.0 1189 694 A 55 TRP HE3 A 56 GLU HA 1.0 1.8 5.0 1190 695 A 55 TRP HE3 A 59 GLU HBx 1.0 1.8 5.0 1191 695 A 55 TRP HE3 A 59 GLU HBy 1.0 1.8 5.0 1192 696 A 55 TRP HE3 A 59 GLU HGx 1.0 1.8 5.0 1193 696 A 55 TRP HE3 A 59 GLU HGy 1.0 1.8 5.0 1194 697 A 55 TRP HZ3 A 56 GLU HA 1.0 1.8 5.0 1195 698 A 59 GLU HA A 55 TRP HZ3 1.0 1.8 5.0 1196 699 A 55 TRP HZ3 A 59 GLU HBx 1.0 1.8 5.0 1197 699 A 55 TRP HZ3 A 59 GLU HBy 1.0 1.8 5.0 1198 700 A 55 TRP HZ3 A 59 GLU HGx 1.0 1.8 5.0 1199 700 A 55 TRP HZ3 A 59 GLU HGy 1.0 1.8 5.0 1200 701 A 58 TRP HE3 A 55 TRP HZ2 1.0 1.8 5.0 1201 702 A 55 TRP HZ2 A 59 GLU HBx 1.0 1.8 5.0 1202 702 A 55 TRP HZ2 A 59 GLU HBy 1.0 1.8 5.0 1203 703 A 55 TRP HZ2 A 59 GLU HGx 1.0 1.8 5.0 1204 703 A 55 TRP HZ2 A 59 GLU HGy 1.0 1.8 5.0 1205 704 A 55 TRP HH2 A 59 GLU HBx 1.0 1.8 5.0 1206 704 A 59 GLU HBy A 55 TRP HH2 1.0 1.8 5.0 1207 705 A 55 TRP HH2 A 59 GLU HGx 1.0 1.8 5.0 1208 705 A 59 GLU HGy A 55 TRP HH2 1.0 1.8 5.0 1209 706 A 56 GLU H A 56 GLU HGx 1.0 1.8 5.0 1210 706 A 56 GLU H A 56 GLU HGy 1.0 1.8 5.0 1211 707 A 56 GLU H A 57 ALA H 1.0 1.8 3.3 1212 708 A 57 ALA HA A 56 GLU H 1.0 1.8 5.0 1213 709 A 57 ALA HB% A 56 GLU H 1.0 1.8 5.5 1214 710 A 56 GLU H A 58 TRP HBx 1.0 1.8 5.0 1215 710 A 58 TRP HBy A 56 GLU H 1.0 1.8 5.0 1216 711 A 59 GLU H A 56 GLU H 1.0 1.8 5.0 1217 712 A 59 GLU H A 56 GLU HA 1.0 1.8 3.3 1218 713 A 56 GLU HA A 59 GLU HBx 1.0 1.8 5.0 1219 713 A 56 GLU HA A 59 GLU HBy 1.0 1.8 5.0 1220 714 A 56 GLU HA A 60 ASN H 1.0 1.8 5.0 1221 715 A 57 ALA H A 56 GLU HGx 1.0 1.8 5.0 1222 715 A 56 GLU HGy A 57 ALA H 1.0 1.8 5.0 1223 716 A 58 TRP HA A 57 ALA H 1.0 1.8 5.0 1224 717 A 59 GLU H A 57 ALA H 1.0 1.8 5.0 1225 718 A 57 ALA H A 60 ASN H 1.0 1.8 5.0 1226 719 A 57 ALA HA A 60 ASN H 1.0 1.8 5.0 1227 720 A 57 ALA HA A 60 ASN HBx 1.0 1.8 5.0 1228 720 A 57 ALA HA A 60 ASN HBy 1.0 1.8 5.0 1229 721 A 57 ALA HA A 61 LEU HD1% 1.0 1.8 5.5 1230 722 A 57 ALA HB% A 58 TRP H 1.0 1.8 3.2 1231 723 A 57 ALA HB% A 59 GLU H 1.0 1.8 5.5 1232 724 A 57 ALA HB% A 60 ASN H 1.0 1.8 5.5 1233 725 A 58 TRP H A 58 TRP HBx 1.0 1.8 2.7 1234 725 A 58 TRP HBy A 58 TRP H 1.0 1.8 2.7 1235 726 A 58 TRP HD1 A 58 TRP H 1.0 1.8 5.0 1236 727 A 58 TRP H A 59 GLU H 1.0 1.8 3.3 1237 728 A 58 TRP H A 59 GLU HBx 1.0 1.8 5.0 1238 728 A 58 TRP H A 59 GLU HBy 1.0 1.8 5.0 1239 729 A 58 TRP H A 60 ASN H 1.0 1.8 5.0 1240 730 A 58 TRP H A 61 LEU H 1.0 1.8 5.0 1241 731 A 58 TRP HD1 A 58 TRP HA 1.0 1.8 5.0 1242 732 A 58 TRP HA A 61 LEU H 1.0 1.8 5.0 1243 733 A 58 TRP HA A 61 LEU HBx 1.0 1.8 5.0 1244 733 A 58 TRP HA A 61 LEU HBy 1.0 1.8 5.0 1245 734 A 58 TRP HBy A 59 GLU HBx 1.0 1.8 5.0 1246 734 A 58 TRP HBx A 59 GLU HBx 1.0 1.8 5.0 1247 734 A 59 GLU HBy A 58 TRP HBx 1.0 1.8 5.0 1248 734 A 58 TRP HBy A 59 GLU HBy 1.0 1.8 5.0 1249 735 A 58 TRP HD1 A 59 GLU H 1.0 1.8 5.0 1250 736 A 58 TRP HD1 A 61 LEU HD1% 1.0 1.8 5.5 1251 737 A 58 TRP HD1 A 61 LEU HD2% 1.0 1.8 5.5 1252 738 A 59 GLU H A 59 GLU HGx 1.0 1.8 5.0 1253 738 A 59 GLU H A 59 GLU HGy 1.0 1.8 5.0 1254 739 A 59 GLU H A 60 ASN H 1.0 1.8 3.3 1255 740 A 59 GLU H A 60 ASN HBx 1.0 1.8 5.0 1256 740 A 59 GLU H A 60 ASN HBy 1.0 1.8 5.0 1257 741 A 59 GLU H A 61 LEU H 1.0 1.8 5.0 1258 742 A 62 LYS H A 59 GLU H 1.0 1.8 5.0 1259 743 A 59 GLU HA A 61 LEU H 1.0 1.8 5.0 1260 744 A 59 GLU HA A 62 LYS H 1.0 1.8 5.0 1261 745 A 59 GLU HBx A 60 ASN HBx 1.0 1.8 5.0 1262 745 A 59 GLU HBy A 60 ASN HBx 1.0 1.8 5.0 1263 745 A 60 ASN HBy A 59 GLU HBx 1.0 1.8 5.0 1264 745 A 59 GLU HBy A 60 ASN HBy 1.0 1.8 5.0 1265 746 A 59 GLU HBx A 62 LYS HBx 1.0 1.8 5.0 1266 746 A 59 GLU HBy A 62 LYS HBx 1.0 1.8 5.0 1267 746 A 62 LYS HBy A 59 GLU HBx 1.0 1.8 5.0 1268 746 A 59 GLU HBy A 62 LYS HBy 1.0 1.8 5.0 1269 747 A 60 ASN H A 59 GLU HGx 1.0 1.8 5.0 1270 747 A 59 GLU HGy A 60 ASN H 1.0 1.8 5.0 1271 748 A 60 ASN H A 60 ASN HBx 1.0 1.8 2.7 1272 748 A 60 ASN H A 60 ASN HBy 1.0 1.8 2.7 1273 749 A 60 ASN H A 60 ASN HD2y 1.0 1.8 4.9 1274 749 A 60 ASN H A 60 ASN HD2x 1.0 1.8 4.9 1275 750 A 60 ASN H A 61 LEU HD1% 1.0 1.8 5.5 1276 751 A 62 LYS H A 60 ASN H 1.0 1.8 5.0 1277 752 A 61 LEU H A 60 ASN HBx 1.0 1.8 3.3 1278 752 A 60 ASN HBy A 61 LEU H 1.0 1.8 3.3 1279 753 A 61 LEU HD2% A 60 ASN HBx 1.0 1.8 5.5 1280 753 A 60 ASN HBy A 61 LEU HD2% 1.0 1.8 5.5 1281 754 A 62 LYS H A 60 ASN HBx 1.0 1.8 5.0 1282 754 A 62 LYS H A 60 ASN HBy 1.0 1.8 5.0 1283 755 A 61 LEU H A 61 LEU HG 1.0 1.8 5.0 1284 756 A 61 LEU HD1% A 61 LEU H 1.0 1.8 3.8 1285 757 A 61 LEU H A 61 LEU HD2% 1.0 1.8 5.5 1286 758 A 62 LYS H A 61 LEU H 1.0 1.8 3.3 1287 759 A 62 LYS HA A 61 LEU H 1.0 1.8 5.0 1288 760 A 61 LEU H A 62 LYS HDx 1.0 1.8 5.0 1289 760 A 61 LEU H A 62 LYS HDy 1.0 1.8 5.0 1290 761 A 61 LEU HD1% A 61 LEU HA 1.0 1.8 3.8 1291 762 A 62 LYS H A 61 LEU HA 1.0 1.8 3.3 1292 763 A 62 LYS H A 61 LEU HBx 1.0 1.8 5.0 1293 763 A 61 LEU HBy A 62 LYS H 1.0 1.8 5.0 1294 764 A 61 LEU HBy A 68 ASP HBx 1.0 1.8 5.0 1295 764 A 61 LEU HBx A 68 ASP HBx 1.0 1.8 5.0 1296 764 A 68 ASP HBy A 61 LEU HBx 1.0 1.8 5.0 1297 764 A 61 LEU HBy A 68 ASP HBy 1.0 1.8 5.0 1298 765 A 69 ALA H A 61 LEU HBx 1.0 1.8 5.0 1299 765 A 61 LEU HBy A 69 ALA H 1.0 1.8 5.0 1300 766 A 62 LYS H A 61 LEU HG 1.0 1.8 5.0 1301 767 A 62 LYS H A 61 LEU HD1% 1.0 1.8 5.5 1302 768 A 61 LEU HD1% A 64 LYS H 1.0 1.8 5.5 1303 769 A 62 LYS H A 61 LEU HD2% 1.0 1.8 5.5 1304 770 A 61 LEU HD2% A 64 LYS H 1.0 1.8 5.5 1305 771 A 61 LEU HD2% A 64 LYS HBx 1.0 1.8 5.5 1306 771 A 61 LEU HD2% A 64 LYS HBy 1.0 1.8 5.5 1307 772 A 62 LYS H A 62 LYS HGx 1.0 1.8 3.3 1308 772 A 62 LYS H A 62 LYS HGy 1.0 1.8 3.3 1309 773 A 62 LYS H A 62 LYS HDx 1.0 1.8 3.3 1310 773 A 62 LYS H A 62 LYS HDy 1.0 1.8 3.3 1311 774 A 62 LYS H A 63 GLY H 1.0 1.8 5.0 1312 775 A 62 LYS H A 64 LYS H 1.0 1.8 5.0 1313 776 A 62 LYS HA A 62 LYS HDx 1.0 1.8 5.0 1314 776 A 62 LYS HA A 62 LYS HDy 1.0 1.8 5.0 1315 777 A 62 LYS HA A 64 LYS H 1.0 1.8 5.0 1316 778 A 63 GLY H A 62 LYS HBx 1.0 1.8 5.0 1317 778 A 62 LYS HBy A 63 GLY H 1.0 1.8 5.0 1318 779 A 63 GLY H A 62 LYS HGx 1.0 1.8 5.0 1319 779 A 62 LYS HGy A 63 GLY H 1.0 1.8 5.0 1320 780 A 64 LYS H A 62 LYS HGx 1.0 1.8 5.0 1321 780 A 64 LYS H A 62 LYS HGy 1.0 1.8 5.0 1322 781 A 63 GLY H A 62 LYS HDx 1.0 1.8 5.0 1323 781 A 62 LYS HDy A 63 GLY H 1.0 1.8 5.0 1324 782 A 64 LYS H A 63 GLY H 1.0 1.8 3.3 1325 783 A 63 GLY H A 64 LYS HGy 1.0 1.8 5.0 1326 783 A 63 GLY H A 64 LYS HGx 1.0 1.8 5.0 1327 784 A 64 LYS H A 64 LYS HGy 1.0 1.8 5.0 1328 784 A 64 LYS H A 64 LYS HGx 1.0 1.8 5.0 1329 785 A 64 LYS H A 65 SER H 1.0 1.8 3.3 1330 786 A 66 GLN H A 64 LYS HA 1.0 1.8 5.0 1331 787 A 64 LYS HA A 66 GLN HBy 1.0 1.8 5.0 1332 787 A 66 GLN HBx A 64 LYS HA 1.0 1.8 5.0 1333 788 A 64 LYS HA A 67 GLU H 1.0 1.8 5.0 1334 789 A 65 SER H A 64 LYS HBx 1.0 1.8 5.0 1335 789 A 64 LYS HBy A 65 SER H 1.0 1.8 5.0 1336 790 A 64 LYS HBx A 67 GLU HBx 1.0 1.8 5.0 1337 790 A 64 LYS HBy A 67 GLU HBx 1.0 1.8 5.0 1338 790 A 67 GLU HBy A 64 LYS HBx 1.0 1.8 5.0 1339 790 A 64 LYS HBy A 67 GLU HBy 1.0 1.8 5.0 1340 791 A 65 SER H A 64 LYS HGy 1.0 1.8 5.0 1341 791 A 64 LYS HGx A 65 SER H 1.0 1.8 5.0 1342 792 A 66 GLN H A 64 LYS HGy 1.0 1.8 5.0 1343 792 A 66 GLN H A 64 LYS HGx 1.0 1.8 5.0 1344 793 A 64 LYS HGy A 67 GLU HBx 1.0 1.8 5.0 1345 793 A 64 LYS HGx A 67 GLU HBx 1.0 1.8 5.0 1346 793 A 67 GLU HBy A 64 LYS HGy 1.0 1.8 5.0 1347 793 A 64 LYS HGx A 67 GLU HBy 1.0 1.8 5.0 1348 794 A 65 SER H A 65 SER HBx 1.0 1.8 2.7 1349 794 A 65 SER H A 65 SER HBy 1.0 1.8 2.7 1350 795 A 66 GLN H A 65 SER H 1.0 1.8 5.0 1351 796 A 65 SER H A 66 GLN HBy 1.0 1.8 5.0 1352 796 A 66 GLN HBx A 65 SER H 1.0 1.8 5.0 1353 797 A 65 SER H A 67 GLU H 1.0 1.8 5.0 1354 798 A 65 SER H A 68 ASP H 1.0 1.8 5.0 1355 799 A 65 SER H A 68 ASP HBx 1.0 1.8 5.0 1356 799 A 68 ASP HBy A 65 SER H 1.0 1.8 5.0 1357 800 A 68 ASP H A 65 SER HA 1.0 1.8 3.3 1358 801 A 66 GLN H A 66 GLN HBy 1.0 1.8 2.7 1359 801 A 66 GLN HBx A 66 GLN H 1.0 1.8 2.7 1360 802 A 66 GLN H A 66 GLN HGx 1.0 1.8 3.3 1361 802 A 66 GLN HGy A 66 GLN H 1.0 1.8 3.3 1362 803 A 66 GLN H A 66 GLN HE2y 1.0 1.8 5.0 1363 803 A 66 GLN HE2x A 66 GLN H 1.0 1.8 5.0 1364 804 A 66 GLN H A 67 GLU H 1.0 1.8 3.3 1365 805 A 66 GLN H A 67 GLU HGx 1.0 1.8 5.0 1366 805 A 66 GLN H A 67 GLU HGy 1.0 1.8 5.0 1367 806 A 66 GLN H A 68 ASP H 1.0 1.8 5.0 1368 807 A 66 GLN H A 69 ALA H 1.0 1.8 5.0 1369 808 A 69 ALA HB% A 66 GLN H 1.0 1.8 5.5 1370 809 A 69 ALA HB% A 66 GLN HA 1.0 1.8 5.5 1371 810 A 70 GLU H A 66 GLN HA 1.0 1.8 5.0 1372 811 A 66 GLN HA A 70 GLU HGx 1.0 1.8 5.0 1373 811 A 66 GLN HA A 70 GLU HGy 1.0 1.8 5.0 1374 812 A 66 GLN HBy A 66 GLN HE2y 1.0 1.8 5.0 1375 812 A 66 GLN HBx A 66 GLN HE2y 1.0 1.8 5.0 1376 812 A 66 GLN HE2x A 66 GLN HBy 1.0 1.8 5.0 1377 812 A 66 GLN HBx A 66 GLN HE2x 1.0 1.8 5.0 1378 813 A 67 GLU H A 66 GLN HBy 1.0 1.8 3.3 1379 813 A 66 GLN HBx A 67 GLU H 1.0 1.8 3.3 1380 814 A 68 ASP H A 66 GLN HBy 1.0 1.8 5.0 1381 814 A 66 GLN HBx A 68 ASP H 1.0 1.8 5.0 1382 815 A 69 ALA HB% A 66 GLN HBy 1.0 1.8 5.5 1383 815 A 69 ALA HB% A 66 GLN HBx 1.0 1.8 5.5 1384 816 A 66 GLN HBy A 70 GLU HGx 1.0 1.8 5.0 1385 816 A 66 GLN HBx A 70 GLU HGx 1.0 1.8 5.0 1386 816 A 70 GLU HGy A 66 GLN HBy 1.0 1.8 5.0 1387 816 A 66 GLN HBx A 70 GLU HGy 1.0 1.8 5.0 1388 817 A 67 GLU H A 66 GLN HGx 1.0 1.8 5.0 1389 817 A 66 GLN HGy A 67 GLU H 1.0 1.8 5.0 1390 818 A 69 ALA HB% A 66 GLN HGx 1.0 1.8 5.5 1391 818 A 69 ALA HB% A 66 GLN HGy 1.0 1.8 5.5 1392 819 A 70 GLU H A 66 GLN HGx 1.0 1.8 5.0 1393 819 A 70 GLU H A 66 GLN HGy 1.0 1.8 5.0 1394 820 A 66 GLN HGx A 70 GLU HGx 1.0 1.8 5.0 1395 820 A 66 GLN HGy A 70 GLU HGx 1.0 1.8 5.0 1396 820 A 70 GLU HGy A 66 GLN HGx 1.0 1.8 5.0 1397 820 A 66 GLN HGy A 70 GLU HGy 1.0 1.8 5.0 1398 821 A 67 GLU H A 67 GLU HBx 1.0 1.8 2.7 1399 821 A 67 GLU H A 67 GLU HBy 1.0 1.8 2.7 1400 822 A 67 GLU H A 67 GLU HGx 1.0 1.8 2.7 1401 822 A 67 GLU H A 67 GLU HGy 1.0 1.8 2.7 1402 823 A 67 GLU H A 68 ASP H 1.0 1.8 3.3 1403 824 A 67 GLU H A 68 ASP HA 1.0 1.8 5.0 1404 825 A 69 ALA H A 67 GLU H 1.0 1.8 5.0 1405 826 A 69 ALA HB% A 67 GLU H 1.0 1.8 5.5 1406 827 A 70 GLU H A 67 GLU H 1.0 1.8 5.0 1407 828 A 70 GLU H A 67 GLU HA 1.0 1.8 5.0 1408 829 A 69 ALA H A 68 ASP H 1.0 1.8 2.7 1409 830 A 70 GLU H A 68 ASP H 1.0 1.8 5.0 1410 831 A 68 ASP H A 70 GLU HGx 1.0 1.8 5.0 1411 831 A 68 ASP H A 70 GLU HGy 1.0 1.8 5.0 1412 832 A 68 ASP HA A 71 LYS H 1.0 1.8 3.3 1413 833 A 68 ASP HA A 72 GLU H 1.0 1.8 5.0 1414 834 A 69 ALA HB% A 68 ASP HBx 1.0 1.8 5.5 1415 834 A 69 ALA HB% A 68 ASP HBy 1.0 1.8 5.5 1416 835 A 69 ALA H A 70 GLU HGx 1.0 1.8 5.0 1417 835 A 69 ALA H A 70 GLU HGy 1.0 1.8 5.0 1418 836 A 70 GLU H A 70 GLU HBx 1.0 1.8 2.7 1419 836 A 70 GLU H A 70 GLU HBy 1.0 1.8 2.7 1420 837 A 70 GLU H A 70 GLU HGx 1.0 1.8 3.3 1421 837 A 70 GLU H A 70 GLU HGy 1.0 1.8 3.3 1422 838 A 70 GLU H A 71 LYS H 1.0 1.8 3.3 1423 839 A 70 GLU H A 72 GLU H 1.0 1.8 5.0 1424 840 A 70 GLU H A 73 TYR H 1.0 1.8 5.0 1425 841 A 70 GLU H A 73 TYR HBy 1.0 1.8 5.0 1426 841 A 70 GLU H A 73 TYR HBx 1.0 1.8 5.0 1427 842 A 71 LYS H A 70 GLU HGx 1.0 1.8 3.3 1428 842 A 70 GLU HGy A 71 LYS H 1.0 1.8 3.3 1429 843 A 73 TYR H A 70 GLU HGx 1.0 1.8 5.0 1430 843 A 73 TYR H A 70 GLU HGy 1.0 1.8 5.0 1431 844 A 71 LYS H A 71 LYS HGx 1.0 1.8 5.0 1432 844 A 71 LYS H A 71 LYS HGy 1.0 1.8 5.0 1433 845 A 71 LYS H A 71 LYS HDx 1.0 1.8 3.3 1434 845 A 71 LYS H A 71 LYS HDy 1.0 1.8 3.3 1435 846 A 71 LYS H A 72 GLU H 1.0 1.8 3.3 1436 847 A 71 LYS H A 72 GLU HGx 1.0 1.8 5.0 1437 847 A 71 LYS H A 72 GLU HGy 1.0 1.8 5.0 1438 848 A 73 TYR H A 71 LYS H 1.0 1.8 5.0 1439 849 A 71 LYS H A 73 TYR HBy 1.0 1.8 5.0 1440 849 A 73 TYR HBx A 71 LYS H 1.0 1.8 5.0 1441 850 A 74 ILE H A 71 LYS H 1.0 1.8 5.0 1442 851 A 74 ILE HG2% A 71 LYS H 1.0 1.8 5.5 1443 852 A 74 ILE H A 71 LYS HA 1.0 1.8 5.0 1444 853 A 71 LYS HA A 75 ALA H 1.0 1.8 5.0 1445 854 A 72 GLU H A 71 LYS HDx 1.0 1.8 5.0 1446 854 A 72 GLU H A 71 LYS HDy 1.0 1.8 5.0 1447 855 A 72 GLU H A 72 GLU HBx 1.0 1.8 2.7 1448 855 A 72 GLU HBy A 72 GLU H 1.0 1.8 2.7 1449 856 A 72 GLU H A 72 GLU HGx 1.0 1.8 2.7 1450 856 A 72 GLU H A 72 GLU HGy 1.0 1.8 2.7 1451 857 A 73 TYR H A 72 GLU H 1.0 1.8 3.3 1452 858 A 72 GLU H A 73 TYR HBy 1.0 1.8 5.0 1453 858 A 73 TYR HBx A 72 GLU H 1.0 1.8 5.0 1454 859 A 76 LEU HG A 72 GLU HBx 1.0 1.8 5.0 1455 859 A 72 GLU HBy A 76 LEU HG 1.0 1.8 5.0 1456 860 A 73 TYR H A 72 GLU HGx 1.0 1.8 5.0 1457 860 A 73 TYR H A 72 GLU HGy 1.0 1.8 5.0 1458 861 A 74 ILE H A 73 TYR H 1.0 1.8 3.3 1459 862 A 74 ILE HB A 73 TYR H 1.0 1.8 5.0 1460 863 A 73 TYR H A 75 ALA H 1.0 1.8 5.0 1461 864 A 73 TYR H A 76 LEU H 1.0 1.8 5.0 1462 865 A 74 ILE HA A 73 TYR HA 1.0 1.8 5.0 1463 866 A 73 TYR HA A 75 ALA HB% 1.0 1.8 5.5 1464 867 A 73 TYR HA A 76 LEU H 1.0 1.8 5.0 1465 868 A 73 TYR HA A 76 LEU HBx 1.0 1.8 5.0 1466 868 A 76 LEU HBy A 73 TYR HA 1.0 1.8 5.0 1467 869 A 73 TYR HA A 77 VAL HB 1.0 1.8 5.0 1468 870 A 74 ILE H A 73 TYR HBy 1.0 1.8 3.3 1469 870 A 74 ILE H A 73 TYR HBx 1.0 1.8 3.3 1470 871 A 74 ILE HB A 73 TYR HBy 1.0 1.8 5.0 1471 871 A 74 ILE HB A 73 TYR HBx 1.0 1.8 5.0 1472 872 A 73 TYR HD% A 74 ILE HA 1.0 1.8 5.0 1473 873 A 73 TYR HD% A 74 ILE HB 1.0 1.8 5.0 1474 874 A 73 TYR HD% A 74 ILE HG2% 1.0 1.8 5.5 1475 875 A 74 ILE H A 74 ILE HB 1.0 1.8 3.3 1476 876 A 74 ILE H A 74 ILE HG2% 1.0 1.8 3.8 1477 877 A 74 ILE H A 75 ALA H 1.0 1.8 3.3 1478 878 A 74 ILE HA A 75 ALA HA 1.0 1.8 5.0 1479 879 A 74 ILE HA A 75 ALA HB% 1.0 1.8 5.5 1480 880 A 74 ILE HA A 77 VAL H 1.0 1.8 5.0 1481 881 A 74 ILE HA A 77 VAL HB 1.0 1.8 3.3 1482 882 A 74 ILE HA A 77 VAL HG1% 1.0 1.8 5.5 1483 883 A 74 ILE HA A 77 VAL HG2% 1.0 1.8 5.5 1484 884 A 74 ILE HB A 75 ALA H 1.0 1.8 5.0 1485 885 A 74 ILE HG2% A 75 ALA H 1.0 1.8 3.2 1486 886 A 75 ALA H A 76 LEU H 1.0 1.8 2.7 1487 887 A 75 ALA H A 77 VAL H 1.0 1.8 5.0 1488 888 A 75 ALA H A 78 ASP H 1.0 1.8 5.0 1489 889 A 75 ALA H A 78 ASP HBx 1.0 1.8 5.0 1490 889 A 75 ALA H A 78 ASP HBy 1.0 1.8 5.0 1491 890 A 75 ALA HA A 78 ASP H 1.0 1.8 3.3 1492 891 A 75 ALA HB% A 76 LEU HBx 1.0 1.8 5.5 1493 891 A 76 LEU HBy A 75 ALA HB% 1.0 1.8 5.5 1494 892 A 75 ALA HB% A 76 LEU HDx% 1.0 1.8 5.5 1495 892 A 75 ALA HB% A 76 LEU HD21 1.0 1.8 5.5 1496 893 A 75 ALA HB% A 78 ASP H 1.0 1.8 5.5 1497 894 A 76 LEU H A 76 LEU HBx 1.0 1.8 2.7 1498 894 A 76 LEU HBy A 76 LEU H 1.0 1.8 2.7 1499 895 A 76 LEU HG A 76 LEU H 1.0 1.8 3.3 1500 896 A 76 LEU H A 76 LEU HDx% 1.0 1.8 3.2 1501 896 A 76 LEU H A 76 LEU HD21 1.0 1.8 3.2 1502 897 A 76 LEU H A 77 VAL H 1.0 1.8 3.3 1503 898 A 77 VAL HG2% A 76 LEU H 1.0 1.8 5.5 1504 899 A 76 LEU H A 79 GLN H 1.0 1.8 5.0 1505 900 A 79 GLN H A 76 LEU HA 1.0 1.8 5.0 1506 901 A 77 VAL H A 76 LEU HBx 1.0 1.8 3.3 1507 901 A 76 LEU HBy A 77 VAL H 1.0 1.8 3.3 1508 902 A 77 VAL HA A 76 LEU HBx 1.0 1.8 5.0 1509 902 A 77 VAL HA A 76 LEU HBy 1.0 1.8 5.0 1510 903 A 77 VAL HG2% A 76 LEU HBx 1.0 1.8 5.5 1511 903 A 77 VAL HG2% A 76 LEU HBy 1.0 1.8 5.5 1512 904 A 80 LEU H A 76 LEU HBx 1.0 1.8 5.0 1513 904 A 76 LEU HBy A 80 LEU H 1.0 1.8 5.0 1514 905 A 76 LEU HBx A 80 LEU HBx 1.0 1.8 5.0 1515 905 A 76 LEU HBy A 80 LEU HBx 1.0 1.8 5.0 1516 905 A 80 LEU HBy A 76 LEU HBx 1.0 1.8 5.0 1517 905 A 76 LEU HBy A 80 LEU HBy 1.0 1.8 5.0 1518 906 A 76 LEU HBx A 80 LEU HDx% 1.0 1.8 3.8 1519 906 A 76 LEU HBy A 80 LEU HDx% 1.0 1.8 3.8 1520 906 A 80 LEU HDy% A 76 LEU HBx 1.0 1.8 3.8 1521 906 A 80 LEU HDy% A 76 LEU HBy 1.0 1.8 3.8 1522 907 A 77 VAL H A 76 LEU HDx% 1.0 1.8 5.5 1523 907 A 77 VAL H A 76 LEU HD21 1.0 1.8 5.5 1524 908 A 77 VAL HG2% A 76 LEU HDx% 1.0 1.8 3.2 1525 908 A 77 VAL HG2% A 76 LEU HD21 1.0 1.8 3.2 1526 909 A 77 VAL HB A 77 VAL H 1.0 1.8 2.7 1527 910 A 77 VAL HG2% A 77 VAL H 1.0 1.8 3.8 1528 911 A 77 VAL H A 78 ASP H 1.0 1.8 3.3 1529 912 A 77 VAL H A 78 ASP HA 1.0 1.8 5.0 1530 913 A 77 VAL H A 78 ASP HBx 1.0 1.8 5.0 1531 913 A 77 VAL H A 78 ASP HBy 1.0 1.8 5.0 1532 914 A 77 VAL H A 79 GLN H 1.0 1.8 5.0 1533 915 A 80 LEU H A 77 VAL H 1.0 1.8 5.0 1534 916 A 77 VAL H A 80 LEU HBx 1.0 1.8 5.0 1535 916 A 77 VAL H A 80 LEU HBy 1.0 1.8 5.0 1536 917 A 77 VAL HA A 79 GLN H 1.0 1.8 5.0 1537 918 A 77 VAL HA A 80 LEU H 1.0 1.8 5.0 1538 919 A 77 VAL HA A 80 LEU HA 1.0 1.8 5.0 1539 920 A 77 VAL HA A 80 LEU HBx 1.0 1.8 5.0 1540 920 A 77 VAL HA A 80 LEU HBy 1.0 1.8 5.0 1541 921 A 77 VAL HA A 80 LEU HDx% 1.0 1.8 3.8 1542 921 A 77 VAL HA A 80 LEU HDy% 1.0 1.8 3.8 1543 922 A 77 VAL HA A 81 ILE H 1.0 1.8 5.0 1544 923 A 77 VAL HA A 81 ILE HG1x 1.0 1.8 5.0 1545 923 A 77 VAL HA A 81 ILE HG1y 1.0 1.8 5.0 1546 924 A 77 VAL HB A 78 ASP H 1.0 1.8 5.0 1547 925 A 77 VAL HB A 78 ASP HBx 1.0 1.8 5.0 1548 925 A 77 VAL HB A 78 ASP HBy 1.0 1.8 5.0 1549 926 A 77 VAL HB A 80 LEU HBx 1.0 1.8 5.0 1550 926 A 77 VAL HB A 80 LEU HBy 1.0 1.8 5.0 1551 927 A 77 VAL HG1% A 78 ASP H 1.0 1.8 3.8 1552 928 A 77 VAL HG1% A 80 LEU H 1.0 1.8 5.5 1553 929 A 77 VAL HG1% A 80 LEU HA 1.0 1.8 5.5 1554 930 A 77 VAL HG2% A 78 ASP H 1.0 1.8 5.5 1555 931 A 77 VAL HG2% A 80 LEU H 1.0 1.8 5.5 1556 932 A 77 VAL HG2% A 80 LEU HA 1.0 1.8 5.5 1557 933 A 77 VAL HG2% A 80 LEU HBx 1.0 1.8 5.5 1558 933 A 77 VAL HG2% A 80 LEU HBy 1.0 1.8 5.5 1559 934 A 77 VAL HG2% A 81 ILE H 1.0 1.8 5.5 1560 935 A 77 VAL HG2% A 81 ILE HB 1.0 1.8 5.5 1561 936 A 77 VAL HG2% A 81 ILE HG1x 1.0 1.8 5.5 1562 936 A 77 VAL HG2% A 81 ILE HG1y 1.0 1.8 5.5 1563 937 A 78 ASP H A 78 ASP HBx 1.0 1.8 2.7 1564 937 A 78 ASP H A 78 ASP HBy 1.0 1.8 2.7 1565 938 A 78 ASP H A 79 GLN H 1.0 1.8 2.7 1566 939 A 80 LEU H A 78 ASP H 1.0 1.8 5.0 1567 940 A 78 ASP H A 81 ILE H 1.0 1.8 5.0 1568 941 A 80 LEU H A 78 ASP HA 1.0 1.8 5.0 1569 942 A 82 ALA H A 78 ASP HA 1.0 1.8 5.0 1570 943 A 80 LEU H A 78 ASP HBx 1.0 1.8 5.0 1571 943 A 80 LEU H A 78 ASP HBy 1.0 1.8 5.0 1572 944 A 81 ILE H A 78 ASP HBx 1.0 1.8 5.0 1573 944 A 78 ASP HBy A 81 ILE H 1.0 1.8 5.0 1574 945 A 82 ALA H A 78 ASP HBx 1.0 1.8 5.0 1575 945 A 82 ALA H A 78 ASP HBy 1.0 1.8 5.0 1576 946 A 79 GLN H A 79 GLN HGx 1.0 1.8 3.3 1577 946 A 79 GLN H A 79 GLN HGy 1.0 1.8 3.3 1578 947 A 80 LEU H A 79 GLN H 1.0 1.8 2.7 1579 948 A 79 GLN H A 80 LEU HBx 1.0 1.8 5.0 1580 948 A 79 GLN H A 80 LEU HBy 1.0 1.8 5.0 1581 949 A 79 GLN H A 80 LEU HDx% 1.0 1.8 5.5 1582 949 A 80 LEU HDy% A 79 GLN H 1.0 1.8 5.5 1583 950 A 79 GLN H A 81 ILE H 1.0 1.8 5.0 1584 951 A 82 ALA H A 79 GLN H 1.0 1.8 5.0 1585 952 A 79 GLN H A 82 ALA HB% 1.0 1.8 5.5 1586 953 A 80 LEU H A 80 LEU HBx 1.0 1.8 2.7 1587 953 A 80 LEU H A 80 LEU HBy 1.0 1.8 2.7 1588 954 A 80 LEU H A 80 LEU HG 1.0 1.8 5.0 1589 955 A 80 LEU H A 80 LEU HDx% 1.0 1.8 3.8 1590 955 A 80 LEU HDy% A 80 LEU H 1.0 1.8 3.8 1591 956 A 80 LEU H A 81 ILE H 1.0 1.8 5.0 1592 957 A 80 LEU H A 81 ILE HA 1.0 1.8 5.0 1593 958 A 80 LEU H A 81 ILE HB 1.0 1.8 5.0 1594 959 A 80 LEU H A 81 ILE HG1x 1.0 1.8 5.0 1595 959 A 80 LEU H A 81 ILE HG1y 1.0 1.8 5.0 1596 960 A 82 ALA H A 80 LEU H 1.0 1.8 5.0 1597 961 A 80 LEU H A 82 ALA HB% 1.0 1.8 5.5 1598 962 A 83 LYS H A 80 LEU H 1.0 1.8 5.0 1599 963 A 80 LEU HA A 83 LYS H 1.0 1.8 5.0 1600 964 A 80 LEU HA A 84 TYR HD% 1.0 1.8 3.3 1601 965 A 80 LEU HA A 84 TYR HE% 1.0 1.8 3.3 1602 966 A 81 ILE H A 80 LEU HBx 1.0 1.8 3.3 1603 966 A 80 LEU HBy A 81 ILE H 1.0 1.8 3.3 1604 967 A 81 ILE HB A 80 LEU HBx 1.0 1.8 5.0 1605 967 A 80 LEU HBy A 81 ILE HB 1.0 1.8 5.0 1606 968 A 80 LEU HBy A 81 ILE HG1x 1.0 1.8 5.0 1607 968 A 80 LEU HBx A 81 ILE HG1x 1.0 1.8 5.0 1608 968 A 81 ILE HG1y A 80 LEU HBx 1.0 1.8 5.0 1609 968 A 80 LEU HBy A 81 ILE HG1y 1.0 1.8 5.0 1610 969 A 82 ALA H A 80 LEU HBx 1.0 1.8 5.0 1611 969 A 82 ALA H A 80 LEU HBy 1.0 1.8 5.0 1612 970 A 83 LYS H A 80 LEU HBx 1.0 1.8 5.0 1613 970 A 83 LYS H A 80 LEU HBy 1.0 1.8 5.0 1614 971 A 84 TYR H A 80 LEU HBx 1.0 1.8 5.0 1615 971 A 84 TYR H A 80 LEU HBy 1.0 1.8 5.0 1616 972 A 84 TYR HD% A 80 LEU HBx 1.0 1.8 3.3 1617 972 A 84 TYR HD% A 80 LEU HBy 1.0 1.8 3.3 1618 973 A 81 ILE H A 80 LEU HG 1.0 1.8 5.0 1619 974 A 81 ILE H A 80 LEU HDx% 1.0 1.8 5.5 1620 974 A 80 LEU HDy% A 81 ILE H 1.0 1.8 5.5 1621 975 A 81 ILE HA A 80 LEU HDx% 1.0 1.8 5.5 1622 975 A 80 LEU HDy% A 81 ILE HA 1.0 1.8 5.5 1623 976 A 82 ALA H A 80 LEU HDx% 1.0 1.8 5.5 1624 976 A 82 ALA H A 80 LEU HDy% 1.0 1.8 5.5 1625 977 A 83 LYS H A 80 LEU HDx% 1.0 1.8 5.5 1626 977 A 83 LYS H A 80 LEU HDy% 1.0 1.8 5.5 1627 978 A 84 TYR HD% A 80 LEU HDx% 1.0 1.8 5.5 1628 978 A 84 TYR HD% A 80 LEU HDy% 1.0 1.8 5.5 1629 979 A 84 TYR HE% A 80 LEU HDx% 1.0 1.8 3.8 1630 979 A 84 TYR HE% A 80 LEU HDy% 1.0 1.8 3.8 1631 980 A 81 ILE H A 81 ILE HB 1.0 1.8 3.3 1632 981 A 81 ILE H A 81 ILE HG1x 1.0 1.8 5.0 1633 981 A 81 ILE H A 81 ILE HG1y 1.0 1.8 5.0 1634 982 A 82 ALA H A 81 ILE H 1.0 1.8 3.3 1635 983 A 81 ILE H A 82 ALA HB% 1.0 1.8 5.5 1636 984 A 83 LYS H A 81 ILE H 1.0 1.8 5.0 1637 985 A 84 TYR H A 81 ILE H 1.0 1.8 5.0 1638 986 A 81 ILE H A 84 TYR HBy 1.0 1.8 5.0 1639 986 A 84 TYR HBx A 81 ILE H 1.0 1.8 5.0 1640 987 A 84 TYR HD% A 81 ILE H 1.0 1.8 5.0 1641 988 A 82 ALA HB% A 81 ILE HA 1.0 1.8 5.5 1642 989 A 84 TYR H A 81 ILE HA 1.0 1.8 5.0 1643 990 A 85 SER H A 81 ILE HA 1.0 1.8 5.0 1644 991 A 82 ALA H A 81 ILE HB 1.0 1.8 3.3 1645 992 A 81 ILE HB A 82 ALA HA 1.0 1.8 5.0 1646 993 A 81 ILE HB A 82 ALA HB% 1.0 1.8 5.5 1647 994 A 83 LYS H A 81 ILE HB 1.0 1.8 5.0 1648 995 A 84 TYR H A 81 ILE HB 1.0 1.8 5.0 1649 996 A 85 SER H A 81 ILE HB 1.0 1.8 5.0 1650 997 A 82 ALA H A 81 ILE HG2% 1.0 1.8 3.8 1651 998 A 82 ALA HA A 81 ILE HG2% 1.0 1.8 3.8 1652 999 A 82 ALA HB% A 81 ILE HG2% 1.0 1.8 5.5 1653 1000 A 83 LYS H A 81 ILE HG2% 1.0 1.8 5.5 1654 1001 A 81 ILE HG2% A 85 SER HBy 1.0 1.8 5.5 1655 1001 A 81 ILE HG2% A 85 SER HBx 1.0 1.8 5.5 1656 1002 A 82 ALA H A 81 ILE HG1x 1.0 1.8 5.0 1657 1002 A 82 ALA H A 81 ILE HG1y 1.0 1.8 5.0 1658 1003 A 84 TYR H A 81 ILE HG1x 1.0 1.8 5.0 1659 1003 A 84 TYR H A 81 ILE HG1y 1.0 1.8 5.0 1660 1004 A 81 ILE HG1y A 84 TYR HBy 1.0 1.8 5.0 1661 1004 A 81 ILE HG1x A 84 TYR HBy 1.0 1.8 5.0 1662 1004 A 84 TYR HBx A 81 ILE HG1x 1.0 1.8 5.0 1663 1004 A 84 TYR HBx A 81 ILE HG1y 1.0 1.8 5.0 1664 1005 A 82 ALA H A 83 LYS H 1.0 1.8 3.3 1665 1006 A 82 ALA H A 83 LYS HBx 1.0 1.8 5.0 1666 1006 A 82 ALA H A 83 LYS HBy 1.0 1.8 5.0 1667 1007 A 82 ALA H A 84 TYR H 1.0 1.8 5.0 1668 1008 A 84 TYR H A 82 ALA HA 1.0 1.8 5.0 1669 1009 A 85 SER H A 82 ALA HA 1.0 1.8 5.0 1670 1010 A 84 TYR H A 82 ALA HB% 1.0 1.8 5.5 1671 1011 A 85 SER H A 82 ALA HB% 1.0 1.8 5.5 1672 1012 A 82 ALA HB% A 85 SER HBy 1.0 1.8 5.5 1673 1012 A 82 ALA HB% A 85 SER HBx 1.0 1.8 5.5 1674 1013 A 83 LYS H A 83 LYS HGx 1.0 1.8 5.0 1675 1013 A 83 LYS H A 83 LYS HGy 1.0 1.8 5.0 1676 1014 A 83 LYS H A 83 LYS HDx 1.0 1.8 5.0 1677 1014 A 83 LYS H A 83 LYS HDy 1.0 1.8 5.0 1678 1015 A 84 TYR H A 83 LYS H 1.0 1.8 2.7 1679 1016 A 83 LYS H A 84 TYR HA 1.0 1.8 5.0 1680 1017 A 83 LYS H A 84 TYR HBy 1.0 1.8 5.0 1681 1017 A 84 TYR HBx A 83 LYS H 1.0 1.8 5.0 1682 1018 A 84 TYR HD% A 83 LYS H 1.0 1.8 5.0 1683 1019 A 83 LYS HA A 83 LYS HDx 1.0 1.8 5.0 1684 1019 A 83 LYS HDy A 83 LYS HA 1.0 1.8 5.0 1685 1020 A 83 LYS HBx A 83 LYS HEx 1.0 1.8 3.3 1686 1020 A 83 LYS HBy A 83 LYS HEx 1.0 1.8 3.3 1687 1020 A 83 LYS HEy A 83 LYS HBx 1.0 1.8 3.3 1688 1020 A 83 LYS HBy A 83 LYS HEy 1.0 1.8 3.3 1689 1021 A 84 TYR H A 83 LYS HBx 1.0 1.8 3.3 1690 1021 A 84 TYR H A 83 LYS HBy 1.0 1.8 3.3 1691 1022 A 83 LYS HBy A 84 TYR HBy 1.0 1.8 5.0 1692 1022 A 83 LYS HBx A 84 TYR HBy 1.0 1.8 5.0 1693 1022 A 84 TYR HBx A 83 LYS HBx 1.0 1.8 5.0 1694 1022 A 84 TYR HBx A 83 LYS HBy 1.0 1.8 5.0 1695 1023 A 84 TYR HD% A 83 LYS HBx 1.0 1.8 5.0 1696 1023 A 84 TYR HD% A 83 LYS HBy 1.0 1.8 5.0 1697 1024 A 84 TYR HE% A 83 LYS HBx 1.0 1.8 5.0 1698 1024 A 84 TYR HE% A 83 LYS HBy 1.0 1.8 5.0 1699 1025 A 85 SER H A 83 LYS HBx 1.0 1.8 5.0 1700 1025 A 85 SER H A 83 LYS HBy 1.0 1.8 5.0 1701 1026 A 84 TYR H A 83 LYS HGx 1.0 1.8 5.0 1702 1026 A 84 TYR H A 83 LYS HGy 1.0 1.8 5.0 1703 1027 A 84 TYR HD% A 83 LYS HGx 1.0 1.8 5.0 1704 1027 A 84 TYR HD% A 83 LYS HGy 1.0 1.8 5.0 1705 1028 A 84 TYR HE% A 83 LYS HGx 1.0 1.8 5.0 1706 1028 A 84 TYR HE% A 83 LYS HGy 1.0 1.8 5.0 1707 1029 A 84 TYR HD% A 83 LYS HDx 1.0 1.8 5.0 1708 1029 A 84 TYR HD% A 83 LYS HDy 1.0 1.8 5.0 1709 1030 A 84 TYR HE% A 83 LYS HDx 1.0 1.8 5.0 1710 1030 A 84 TYR HE% A 83 LYS HDy 1.0 1.8 5.0 1711 1031 A 84 TYR H A 84 TYR HE% 1.0 1.8 5.0 1712 1032 A 84 TYR H A 85 SER H 1.0 1.8 2.7 1713 1033 A 84 TYR H A 86 SER H 1.0 1.8 5.0 1714 1034 A 85 SER H A 84 TYR HBy 1.0 1.8 3.3 1715 1034 A 84 TYR HBx A 85 SER H 1.0 1.8 3.3 1716 1035 A 84 TYR HBy A 85 SER HBy 1.0 1.8 5.0 1717 1035 A 84 TYR HBx A 85 SER HBy 1.0 1.8 5.0 1718 1035 A 85 SER HBx A 84 TYR HBy 1.0 1.8 5.0 1719 1035 A 84 TYR HBx A 85 SER HBx 1.0 1.8 5.0 1720 1036 A 85 SER H A 84 TYR HD% 1.0 1.8 5.0 1721 1037 A 85 SER H A 85 SER HBy 1.0 1.8 2.7 1722 1037 A 85 SER H A 85 SER HBx 1.0 1.8 2.7 1723 1038 A 85 SER H A 86 SER H 1.0 1.8 3.3 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 7 GLU H A 3 GLN O 1.0 1.8 2.0 2 2 A 9 ALA H A 5 PHE O 1.0 1.8 2.0 3 3 A 33 GLN H A 29 ALA O 1.0 1.8 2.0 4 4 A 34 ALA H A 30 LEU O 1.0 1.8 2.0 5 5 A 36 VAL H A 32 LYS O 1.0 1.8 2.0 6 6 A 37 GLY H A 33 GLN O 1.0 1.8 2.0 7 7 A 57 ALA H A 53 TYR O 1.0 1.8 2.0 8 8 A 73 TYR H A 69 ALA O 1.0 1.8 2.0 9 9 A 77 VAL H A 73 TYR O 1.0 1.8 2.0 10 10 A 78 ASP H A 74 ILE O 1.0 1.8 2.0 11 11 A 81 ILE H A 77 VAL O 1.0 1.8 2.0 12 12 A 85 SER H A 81 ILE O 1.0 1.8 2.0 13 13 A 39 ASN H A 62 LYS O 1.0 1.8 2.0 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 VAL C A 2 SER N A 2 SER CA A 2 SER C 1.0 -87.0 -27.0 PHI 2 2 A 2 SER C A 3 GLN N A 3 GLN CA A 3 GLN C 1.0 -88.0 -38.0 PHI 3 3 A 4 LEU N A 4 LEU CA A 4 LEU C A 5 PHE N 1.0 -65.0 -15.0 PSI 4 4 A 4 LEU C A 5 PHE N A 5 PHE CA A 5 PHE C 1.0 -94.0 -44.0 PHI 5 5 A 5 PHE N A 5 PHE CA A 5 PHE C A 6 GLU N 1.0 -68.0 -18.0 PSI 6 6 A 5 PHE C A 6 GLU N A 6 GLU CA A 6 GLU C 1.0 -88.0 -38.0 PHI 7 7 A 6 GLU N A 6 GLU CA A 6 GLU C A 7 GLU N 1.0 -62.0 -12.0 PSI 8 8 A 6 GLU C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -92.0 -42.0 PHI 9 9 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 LYS N 1.0 -63.0 -13.0 PSI 10 10 A 7 GLU C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -94.0 -44.0 PHI 11 11 A 8 LYS N A 8 LYS CA A 8 LYS C A 9 ALA N 1.0 -63.0 -13.0 PSI 12 12 A 8 LYS C A 9 ALA N A 9 ALA CA A 9 ALA C 1.0 -89.0 -39.0 PHI 13 13 A 9 ALA N A 9 ALA CA A 9 ALA C A 10 LYS N 1.0 -64.0 -14.0 PSI 14 14 A 9 ALA C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -89.0 -39.0 PHI 15 15 A 10 LYS N A 10 LYS CA A 10 LYS C A 11 ALA N 1.0 -66.0 -16.0 PSI 16 16 A 10 LYS C A 11 ALA N A 11 ALA CA A 11 ALA C 1.0 -90.0 -40.0 PHI 17 17 A 11 ALA N A 11 ALA CA A 11 ALA C A 12 VAL N 1.0 -64.0 -14.0 PSI 18 18 A 11 ALA C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -93.0 -43.0 PHI 19 19 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 ASN N 1.0 -55.0 -5.0 PSI 20 20 A 12 VAL C A 13 ASN N A 13 ASN CA A 13 ASN C 1.0 -82.0 -32.0 PHI 21 21 A 13 ASN C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -180.0 -60.0 PHI 22 22 A 14 GLU C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -77.0 -37.0 PHI 23 23 A 16 PRO C A 17 THR N A 17 THR CA A 17 THR C 1.0 -180.0 -60.0 PHI 24 24 A 17 THR C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -82.0 -32.0 PHI 25 25 A 19 PRO C A 20 SER N A 20 SER CA A 20 SER C 1.0 -82.0 -32.0 PHI 26 26 A 20 SER C A 21 THR N A 21 THR CA A 21 THR C 1.0 -84.0 -34.0 PHI 27 27 A 21 THR N A 21 THR CA A 21 THR C A 22 ASP N 1.0 -65.0 -15.0 PSI 28 28 A 21 THR C A 22 ASP N A 22 ASP CA A 22 ASP C 1.0 -90.0 -40.0 PHI 29 29 A 22 ASP N A 22 ASP CA A 22 ASP C A 23 GLU N 1.0 -63.0 -13.0 PSI 30 30 A 22 ASP C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -92.0 -42.0 PHI 31 31 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 LEU N 1.0 -68.0 -18.0 PSI 32 32 A 23 GLU C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -89.0 -39.0 PHI 33 33 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 LEU N 1.0 -65.0 -15.0 PSI 34 34 A 24 LEU C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -91.0 -41.0 PHI 35 35 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 GLU N 1.0 -64.0 -14.0 PSI 36 36 A 25 LEU C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -93.0 -43.0 PHI 37 37 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 LEU N 1.0 -64.0 -14.0 PSI 38 38 A 26 GLU C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -89.0 -39.0 PHI 39 39 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 TYR N 1.0 -65.0 -15.0 PSI 40 40 A 27 LEU C A 28 TYR N A 28 TYR CA A 28 TYR C 1.0 -91.0 -41.0 PHI 41 41 A 28 TYR N A 28 TYR CA A 28 TYR C A 29 ALA N 1.0 -66.0 -16.0 PSI 42 42 A 28 TYR C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -89.0 -39.0 PHI 43 43 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 LEU N 1.0 -62.0 -12.0 PSI 44 44 A 29 ALA C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -93.0 -43.0 PHI 45 45 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 TYR N 1.0 -64.0 -14.0 PSI 46 46 A 30 LEU C A 31 TYR N A 31 TYR CA A 31 TYR C 1.0 -91.0 -41.0 PHI 47 47 A 31 TYR N A 31 TYR CA A 31 TYR C A 32 LYS N 1.0 -64.0 -14.0 PSI 48 48 A 31 TYR C A 32 LYS N A 32 LYS CA A 32 LYS C 1.0 -92.0 -42.0 PHI 49 49 A 32 LYS N A 32 LYS CA A 32 LYS C A 33 GLN N 1.0 -62.0 -12.0 PSI 50 50 A 32 LYS C A 33 GLN N A 33 GLN CA A 33 GLN C 1.0 -95.0 -45.0 PHI 51 51 A 33 GLN N A 33 GLN CA A 33 GLN C A 34 ALA N 1.0 -61.0 -11.0 PSI 52 52 A 33 GLN C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 -104.0 -54.0 PHI 53 53 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 THR N 1.0 -50.0 0.0 PSI 54 54 A 34 ALA C A 35 THR N A 35 THR CA A 35 THR C 1.0 -180.0 -60.0 PHI 55 55 A 35 THR C A 36 VAL N A 36 VAL CA A 36 VAL C 1.0 -180.0 -60.0 PHI 56 56 A 35 THR C A 36 VAL N A 36 VAL CA A 36 VAL C 1.0 -87.0 -27.0 PHI 57 57 A 37 GLY C A 38 ASP N A 38 ASP CA A 38 ASP C 1.0 -146.0 -26.0 PHI 58 58 A 38 ASP N A 38 ASP CA A 38 ASP C A 39 ASN N 1.0 63.0 183.0 PSI 59 59 A 39 ASN C A 40 ASP N A 40 ASP CA A 40 ASP C 1.0 -180.0 -60.0 PHI 60 60 A 40 ASP C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -152.0 -32.0 PHI 61 61 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 GLU N 1.0 82.0 202.0 PSI 62 62 A 41 LYS C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -146.0 -26.0 PHI 63 63 A 42 GLU C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -160.0 -40.0 PHI 64 64 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 PRO N 1.0 60.0 180.0 PSI 65 65 A 44 PRO C A 45 GLY N A 45 GLY CA A 45 GLY C 1.0 -77.0 -37.0 PHI 66 66 A 45 GLY C A 46 ILE N A 46 ILE CA A 46 ILE C 1.0 -117.0 3.0 PHI 67 67 A 46 ILE C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -117.0 3.0 PHI 68 68 A 48 ASN C A 49 MET N A 49 MET CA A 49 MET C 1.0 -180.0 0.0 PHI 69 69 A 49 MET C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -93.0 -43.0 PHI 70 70 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 ASP N 1.0 -64.0 -14.0 PSI 71 71 A 50 LYS C A 51 ASP N A 51 ASP CA A 51 ASP C 1.0 -89.0 -39.0 PHI 72 72 A 51 ASP N A 51 ASP CA A 51 ASP C A 52 ARG N 1.0 -61.0 -11.0 PSI 73 73 A 51 ASP C A 52 ARG N A 52 ARG CA A 52 ARG C 1.0 -92.0 -42.0 PHI 74 74 A 52 ARG N A 52 ARG CA A 52 ARG C A 53 TYR N 1.0 -68.0 -18.0 PSI 75 75 A 52 ARG C A 53 TYR N A 53 TYR CA A 53 TYR C 1.0 -91.0 -41.0 PHI 76 76 A 53 TYR N A 53 TYR CA A 53 TYR C A 54 LYS N 1.0 -60.0 -10.0 PSI 77 77 A 53 TYR C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 -89.0 -39.0 PHI 78 78 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 TRP N 1.0 -64.0 -14.0 PSI 79 79 A 54 LYS C A 55 TRP N A 55 TRP CA A 55 TRP C 1.0 -95.0 -45.0 PHI 80 80 A 55 TRP N A 55 TRP CA A 55 TRP C A 56 GLU N 1.0 -65.0 -15.0 PSI 81 81 A 55 TRP C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -90.0 -40.0 PHI 82 82 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 ALA N 1.0 -65.0 -15.0 PSI 83 83 A 56 GLU C A 57 ALA N A 57 ALA CA A 57 ALA C 1.0 -87.0 -27.0 PHI 84 84 A 57 ALA C A 58 TRP N A 58 TRP CA A 58 TRP C 1.0 -101.0 -51.0 PHI 85 85 A 58 TRP N A 58 TRP CA A 58 TRP C A 59 GLU N 1.0 -55.0 -5.0 PSI 86 86 A 58 TRP C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -87.0 -27.0 PHI 87 87 A 59 GLU C A 60 ASN N A 60 ASN CA A 60 ASN C 1.0 -100.0 -50.0 PHI 88 88 A 60 ASN N A 60 ASN CA A 60 ASN C A 61 LEU N 1.0 -89.0 31.0 PSI 89 89 A 60 ASN C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -117.0 3.0 PHI 90 90 A 61 LEU C A 62 LYS N A 62 LYS CA A 62 LYS C 1.0 -87.0 -27.0 PHI 91 91 A 63 GLY C A 64 LYS N A 64 LYS CA A 64 LYS C 1.0 -117.0 3.0 PHI 92 92 A 64 LYS C A 65 SER N A 65 SER CA A 65 SER C 1.0 -87.0 -27.0 PHI 93 93 A 65 SER C A 66 GLN N A 66 GLN CA A 66 GLN C 1.0 -89.0 -39.0 PHI 94 94 A 66 GLN N A 66 GLN CA A 66 GLN C A 67 GLU N 1.0 -61.0 -11.0 PSI 95 95 A 66 GLN C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -93.0 -43.0 PHI 96 96 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 ASP N 1.0 -64.0 -14.0 PSI 97 97 A 67 GLU C A 68 ASP N A 68 ASP CA A 68 ASP C 1.0 -93.0 -43.0 PHI 98 98 A 68 ASP N A 68 ASP CA A 68 ASP C A 69 ALA N 1.0 -62.0 -12.0 PSI 99 99 A 68 ASP C A 69 ALA N A 69 ALA CA A 69 ALA C 1.0 -93.0 -43.0 PHI 100 100 A 69 ALA N A 69 ALA CA A 69 ALA C A 70 GLU N 1.0 -62.0 -12.0 PSI 101 101 A 69 ALA C A 70 GLU N A 70 GLU CA A 70 GLU C 1.0 -91.0 -41.0 PHI 102 102 A 70 GLU N A 70 GLU CA A 70 GLU C A 71 LYS N 1.0 -68.0 -18.0 PSI 103 103 A 70 GLU C A 71 LYS N A 71 LYS CA A 71 LYS C 1.0 -88.0 -38.0 PHI 104 104 A 71 LYS N A 71 LYS CA A 71 LYS C A 72 GLU N 1.0 -63.0 -13.0 PSI 105 105 A 71 LYS C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -90.0 -40.0 PHI 106 106 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 TYR N 1.0 -66.0 -16.0 PSI 107 107 A 72 GLU C A 73 TYR N A 73 TYR CA A 73 TYR C 1.0 -100.0 -50.0 PHI 108 108 A 73 TYR N A 73 TYR CA A 73 TYR C A 74 ILE N 1.0 -64.0 -14.0 PSI 109 109 A 73 TYR C A 74 ILE N A 74 ILE CA A 74 ILE C 1.0 -89.0 -39.0 PHI 110 110 A 74 ILE N A 74 ILE CA A 74 ILE C A 75 ALA N 1.0 -68.0 -18.0 PSI 111 111 A 74 ILE C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -90.0 -40.0 PHI 112 112 A 75 ALA N A 75 ALA CA A 75 ALA C A 76 LEU N 1.0 -64.0 -14.0 PSI 113 113 A 75 ALA C A 76 LEU N A 76 LEU CA A 76 LEU C 1.0 -91.0 -41.0 PHI 114 114 A 76 LEU N A 76 LEU CA A 76 LEU C A 77 VAL N 1.0 -67.0 -17.0 PSI 115 115 A 76 LEU C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -93.0 -43.0 PHI 116 116 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 ASP N 1.0 -65.0 -15.0 PSI 117 117 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 ASP N 1.0 -62.0 -12.0 PSI 118 118 A 77 VAL C A 78 ASP N A 78 ASP CA A 78 ASP C 1.0 -89.0 -39.0 PHI 119 119 A 78 ASP C A 79 GLN N A 79 GLN CA A 79 GLN C 1.0 -95.0 -45.0 PHI 120 120 A 79 GLN N A 79 GLN CA A 79 GLN C A 80 LEU N 1.0 -63.0 -13.0 PSI 121 121 A 79 GLN C A 80 LEU N A 80 LEU CA A 80 LEU C 1.0 -91.0 -41.0 PHI 122 122 A 80 LEU N A 80 LEU CA A 80 LEU C A 81 ILE N 1.0 -65.0 -15.0 PSI 123 123 A 80 LEU C A 81 ILE N A 81 ILE CA A 81 ILE C 1.0 -91.0 -41.0 PHI 124 124 A 81 ILE N A 81 ILE CA A 81 ILE C A 82 ALA N 1.0 -64.0 -14.0 PSI 125 125 A 81 ILE C A 82 ALA N A 82 ALA CA A 82 ALA C 1.0 -88.0 -38.0 PHI 126 126 A 82 ALA N A 82 ALA CA A 82 ALA C A 83 LYS N 1.0 -66.0 -16.0 PSI 127 127 A 82 ALA C A 83 LYS N A 83 LYS CA A 83 LYS C 1.0 -87.0 -27.0 PHI 128 128 A 83 LYS C A 84 TYR N A 84 TYR CA A 84 TYR C 1.0 -112.0 -62.0 PHI 129 129 A 84 TYR N A 84 TYR CA A 84 TYR C A 85 SER N 1.0 -37.0 13.0 PSI 130 130 A 84 TYR C A 85 SER N A 85 SER CA A 85 SER C 1.0 -138.0 -18.0 PHI 131 131 A 85 SER N A 85 SER CA A 85 SER C A 86 SER N 1.0 -175.0 -55.0 PSI stop_ save_