data_nef_c15543_2jx2 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_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLY middle . false 3 A 3 SER middle . . 4 A 4 SER middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 HIS middle . . 10 A 10 HIS middle . . 11 A 11 SER middle . . 12 A 12 SER middle . . 13 A 13 GLY middle . false 14 A 14 LEU middle . . 15 A 15 VAL middle . . 16 A 16 PRO middle . false 17 A 17 ARG middle . . 18 A 18 GLY middle . false 19 A 19 SER middle . . 20 A 20 HIS middle . . 21 A 21 MET middle . . 22 A 22 GLY middle . false 23 A 23 PRO middle . false 24 A 24 PHE middle . . 25 A 25 ARG middle . . 26 A 26 ARG middle . . 27 A 27 SER middle . . 28 A 28 ASP middle . . 29 A 29 SER middle . . 30 A 30 PHE middle . . 31 A 31 PRO middle . false 32 A 32 GLU middle . . 33 A 33 ARG middle . . 34 A 34 ARG middle . . 35 A 35 ALA middle . . 36 A 36 PRO middle . false 37 A 37 ARG middle . . 38 A 38 LYS middle . . 39 A 39 GLY middle . false 40 A 40 ASN middle . . 41 A 41 THR middle . . 42 A 42 LEU middle . . 43 A 43 TYR middle . . 44 A 44 VAL middle . . 45 A 45 TYR middle . . 46 A 46 GLY middle . false 47 A 47 GLU middle . . 48 A 48 ASP middle . . 49 A 49 MET middle . . 50 A 50 THR middle . . 51 A 51 PRO middle . false 52 A 52 THR middle . . 53 A 53 LEU middle . . 54 A 54 LEU middle . . 55 A 55 ARG middle . . 56 A 56 GLY middle . false 57 A 57 ALA middle . . 58 A 58 PHE middle . . 59 A 59 SER middle . . 60 A 60 PRO middle . false 61 A 61 PHE middle . . 62 A 62 GLY middle . false 63 A 63 ASN middle . . 64 A 64 ILE middle . . 65 A 65 ILE middle . . 66 A 66 ASP middle . . 67 A 67 LEU middle . . 68 A 68 SER middle . . 69 A 69 MET middle . . 70 A 70 ASP middle . . 71 A 71 PRO middle . false 72 A 72 PRO middle . false 73 A 73 ARG middle . . 74 A 74 ASN middle . . 75 A 75 CYS middle . . 76 A 76 ALA middle . . 77 A 77 PHE middle . . 78 A 78 VAL middle . . 79 A 79 THR middle . . 80 A 80 TYR middle . . 81 A 81 GLU middle . . 82 A 82 LYS middle . . 83 A 83 MET middle . . 84 A 84 GLU middle . . 85 A 85 SER middle . . 86 A 86 ALA middle . . 87 A 87 ASP middle . . 88 A 88 GLN middle . . 89 A 89 ALA middle . . 90 A 90 VAL middle . . 91 A 91 ALA middle . . 92 A 92 GLU middle . . 93 A 93 LEU middle . . 94 A 94 ASN middle . . 95 A 95 GLY middle . false 96 A 96 THR middle . . 97 A 97 GLN middle . . 98 A 98 VAL middle . . 99 A 99 GLU middle . . 100 A 100 SER middle . . 101 A 101 VAL middle . . 102 A 102 GLN middle . . 103 A 103 LEU middle . . 104 A 104 LYS middle . . 105 A 105 VAL middle . . 106 A 106 ASN middle . . 107 A 107 ILE middle . . 108 A 108 ALA middle . . 109 A 109 ARG middle . . 110 A 110 LYS middle . . 111 A 111 GLN middle . . 112 A 112 PRO middle . false 113 A 113 MET middle . . 114 A 114 LEU middle . . 115 A 115 ASP middle . . 116 A 116 ALA middle . . 117 A 117 ALA middle . . 118 A 118 THR middle . . 119 A 119 GLY middle . false 120 A 120 LYS middle . . 121 A 121 SER end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 GLY H H 1 8.08 0.03 A 2 GLY N N 15 109.84 0.20 A 13 GLY H H 1 8.33 0.03 A 13 GLY N N 15 110.49 0.20 A 17 ARG H H 1 8.39 0.03 A 17 ARG N N 15 121.87 0.20 A 22 GLY H H 1 7.93 0.03 A 22 GLY N N 15 109.99 0.20 A 29 SER H H 1 7.95 0.03 A 29 SER N N 15 114.81 0.20 A 30 PHE H H 1 8.08 0.03 A 30 PHE N N 15 122.33 0.20 A 32 GLU H H 1 8.47 0.03 A 32 GLU N N 15 120.56 0.20 A 35 ALA H H 1 8.24 0.03 A 35 ALA N N 15 126.42 0.20 A 37 ARG H H 1 8.37 0.03 A 37 ARG N N 15 121.03 0.20 A 38 LYS H H 1 8.15 0.03 A 38 LYS HA H 1 4.75 0.03 A 38 LYS HBx H 1 1.80 0.03 A 38 LYS HBy H 1 2.01 0.03 A 38 LYS HEy H 1 3.09 0.03 A 38 LYS HGy H 1 1.51 0.03 A 38 LYS CA C 13 54.19 0.30 A 38 LYS CB C 13 35.04 0.30 A 38 LYS N N 15 119.86 0.20 A 39 GLY H H 1 8.71 0.03 A 39 GLY HAy H 1 4.05 0.03 A 39 GLY CA C 13 45.46 0.30 A 39 GLY N N 15 107.99 0.20 A 40 ASN H H 1 8.30 0.03 A 40 ASN HA H 1 4.85 0.03 A 40 ASN HBx H 1 2.74 0.03 A 40 ASN HBy H 1 3.31 0.03 A 40 ASN HD21 H 1 7.47 0.03 A 40 ASN HD22 H 1 6.36 0.03 A 40 ASN CA C 13 54.11 0.30 A 40 ASN CB C 13 37.84 0.30 A 40 ASN N N 15 115.65 0.20 A 40 ASN ND2 N 15 109.33 0.20 A 41 THR HA H 1 5.40 0.03 A 41 THR HB H 1 4.15 0.03 A 41 THR HG2% H 1 1.51 0.03 A 41 THR CA C 13 63.41 0.30 A 41 THR CB C 13 69.93 0.30 A 41 THR CG2 C 13 23.10 0.30 A 42 LEU H H 1 9.90 0.03 A 42 LEU HA H 1 5.09 0.03 A 42 LEU HBx H 1 1.40 0.03 A 42 LEU HBy H 1 1.72 0.03 A 42 LEU HDx% H 1 1.17 0.03 A 42 LEU HDy% H 1 1.03 0.03 A 42 LEU HG H 1 1.91 0.03 A 42 LEU CA C 13 53.26 0.30 A 42 LEU CB C 13 43.59 0.30 A 42 LEU CDy C 13 27.72 0.30 A 42 LEU CDx C 13 25.86 0.30 A 42 LEU CG C 13 27.04 0.30 A 42 LEU N N 15 127.87 0.20 A 43 TYR H H 1 9.19 0.03 A 43 TYR HA H 1 4.42 0.03 A 43 TYR HBx H 1 2.58 0.03 A 43 TYR HBy H 1 2.86 0.03 A 43 TYR CB C 13 40.31 0.30 A 43 TYR N N 15 124.14 0.20 A 44 VAL H H 1 7.98 0.03 A 44 VAL HA H 1 4.81 0.03 A 44 VAL HB H 1 1.42 0.03 A 44 VAL HGx% H 1 0.81 0.03 A 44 VAL HGy% H 1 0.54 0.03 A 44 VAL CA C 13 59.32 0.30 A 44 VAL CB C 13 34.36 0.30 A 44 VAL CGy C 13 22.40 0.30 A 44 VAL CGx C 13 22.06 0.30 A 44 VAL N N 15 127.36 0.20 A 45 TYR H H 1 9.02 0.03 A 45 TYR HA H 1 4.98 0.03 A 45 TYR HBy H 1 2.81 0.03 A 45 TYR HD1 H 1 7.10 0.03 A 45 TYR HD2 H 1 7.10 0.03 A 45 TYR HE1 H 1 6.89 0.03 A 45 TYR HE2 H 1 6.89 0.03 A 45 TYR CA C 13 55.68 0.30 A 45 TYR CB C 13 42.21 0.30 A 45 TYR N N 15 126.39 0.20 A 46 GLY H H 1 7.51 0.03 A 46 GLY HAx H 1 3.83 0.03 A 46 GLY HAy H 1 3.83 0.03 A 46 GLY CA C 13 45.36 0.30 A 46 GLY N N 15 114.22 0.20 A 47 GLU H H 1 8.75 0.03 A 47 GLU HA H 1 3.99 0.03 A 47 GLU HBy H 1 1.96 0.03 A 47 GLU HBx H 1 1.88 0.03 A 47 GLU HGx H 1 2.19 0.03 A 47 GLU HGy H 1 2.29 0.03 A 47 GLU CA C 13 56.72 0.30 A 47 GLU CB C 13 30.46 0.30 A 47 GLU CG C 13 36.79 0.30 A 47 GLU N N 15 123.88 0.20 A 48 ASP H H 1 8.54 0.03 A 48 ASP HA H 1 4.25 0.03 A 48 ASP HBx H 1 2.70 0.03 A 48 ASP HBy H 1 2.90 0.03 A 48 ASP CA C 13 55.21 0.30 A 48 ASP CB C 13 39.15 0.30 A 48 ASP N N 15 117.20 0.20 A 49 MET H H 1 8.19 0.03 A 49 MET HA H 1 4.12 0.03 A 49 MET HBx H 1 1.46 0.03 A 49 MET HBy H 1 2.04 0.03 A 49 MET HE% H 1 1.61 0.03 A 49 MET CA C 13 57.51 0.30 A 49 MET CB C 13 34.62 0.30 A 49 MET CE C 13 14.68 0.30 A 49 MET N N 15 114.56 0.20 A 50 THR H H 1 6.51 0.03 A 50 THR HA H 1 5.02 0.03 A 50 THR HB H 1 4.71 0.03 A 50 THR HG2% H 1 1.33 0.03 A 50 THR CA C 13 57.96 0.30 A 50 THR CB C 13 70.15 0.30 A 50 THR CG2 C 13 21.55 0.30 A 50 THR N N 15 108.06 0.20 A 51 PRO HA H 1 4.34 0.03 A 51 PRO HBx H 1 2.12 0.03 A 51 PRO HBy H 1 2.46 0.03 A 51 PRO HDy H 1 4.15 0.03 A 51 PRO HGy H 1 2.34 0.03 A 51 PRO HGx H 1 2.19 0.03 A 51 PRO CA C 13 65.79 0.30 A 51 PRO CB C 13 31.78 0.30 A 51 PRO CD C 13 50.69 0.30 A 51 PRO CG C 13 27.89 0.30 A 52 THR H H 1 7.64 0.03 A 52 THR HA H 1 3.98 0.03 A 52 THR HB H 1 4.10 0.03 A 52 THR HG2% H 1 1.31 0.03 A 52 THR CA C 13 66.16 0.30 A 52 THR CB C 13 68.43 0.30 A 52 THR CG2 C 13 21.77 0.30 A 52 THR N N 15 111.52 0.20 A 53 LEU H H 1 7.81 0.03 A 53 LEU HA H 1 4.13 0.03 A 53 LEU HBx H 1 1.77 0.03 A 53 LEU HBy H 1 1.95 0.03 A 53 LEU HDx% H 1 1.03 0.03 A 53 LEU HDy% H 1 0.92 0.03 A 53 LEU HG H 1 1.66 0.03 A 53 LEU CA C 13 58.36 0.30 A 53 LEU CB C 13 42.97 0.30 A 53 LEU CDy C 13 25.95 0.30 A 53 LEU CDx C 13 25.60 0.30 A 53 LEU CG C 13 27.47 0.30 A 53 LEU N N 15 125.41 0.20 A 54 LEU H H 1 7.84 0.03 A 54 LEU HA H 1 4.26 0.03 A 54 LEU HBx H 1 1.20 0.03 A 54 LEU HBy H 1 1.98 0.03 A 54 LEU HDx% H 1 0.93 0.03 A 54 LEU HDy% H 1 0.65 0.03 A 54 LEU HG H 1 1.79 0.03 A 54 LEU CA C 13 57.58 0.30 A 54 LEU CB C 13 42.33 0.30 A 54 LEU CDx C 13 23.15 0.30 A 54 LEU CDy C 13 26.63 0.30 A 54 LEU CG C 13 27.15 0.30 A 54 LEU N N 15 117.15 0.20 A 55 ARG H H 1 9.02 0.03 A 55 ARG HA H 1 3.88 0.03 A 55 ARG HBx H 1 1.95 0.03 A 55 ARG HBy H 1 1.95 0.03 A 55 ARG HDx H 1 3.20 0.03 A 55 ARG HDy H 1 3.30 0.03 A 55 ARG HGx H 1 1.63 0.03 A 55 ARG HGy H 1 1.82 0.03 A 55 ARG CA C 13 60.89 0.30 A 55 ARG CB C 13 29.58 0.30 A 55 ARG CD C 13 42.91 0.30 A 55 ARG CG C 13 28.96 0.30 A 55 ARG N N 15 120.05 0.20 A 56 GLY H H 1 8.18 0.03 A 56 GLY HAx H 1 3.94 0.03 A 56 GLY HAy H 1 4.10 0.03 A 56 GLY CA C 13 47.21 0.30 A 56 GLY N N 15 106.70 0.20 A 57 ALA H H 1 7.83 0.03 A 57 ALA HA H 1 4.36 0.03 A 57 ALA HB% H 1 1.41 0.03 A 57 ALA CA C 13 53.59 0.30 A 57 ALA CB C 13 19.05 0.30 A 57 ALA N N 15 120.27 0.20 A 58 PHE H H 1 8.60 0.03 A 58 PHE HA H 1 4.79 0.03 A 58 PHE HBx H 1 3.11 0.03 A 58 PHE HBy H 1 3.33 0.03 A 58 PHE HE1 H 1 8.02 0.03 A 58 PHE HE2 H 1 8.02 0.03 A 58 PHE HZ H 1 7.08 0.03 A 58 PHE CA C 13 60.21 0.30 A 58 PHE CB C 13 38.39 0.30 A 58 PHE N N 15 110.25 0.20 A 59 SER H H 1 8.61 0.03 A 59 SER HA H 1 4.81 0.03 A 59 SER HBx H 1 4.33 0.03 A 59 SER HBy H 1 4.33 0.03 A 59 SER CA C 13 63.54 0.30 A 59 SER CB C 13 62.91 0.30 A 59 SER N N 15 122.86 0.20 A 60 PRO HA H 1 4.28 0.03 A 60 PRO HBy H 1 2.10 0.03 A 60 PRO HBx H 1 0.58 0.03 A 60 PRO HDx H 1 3.14 0.03 A 60 PRO HDy H 1 3.86 0.03 A 60 PRO HGx H 1 1.82 0.03 A 60 PRO HGy H 1 1.82 0.03 A 60 PRO CA C 13 65.68 0.30 A 60 PRO CB C 13 31.42 0.30 A 60 PRO CD C 13 52.06 0.30 A 60 PRO CG C 13 28.13 0.30 A 61 PHE H H 1 6.85 0.03 A 61 PHE HA H 1 4.51 0.03 A 61 PHE HBx H 1 2.92 0.03 A 61 PHE HBy H 1 3.45 0.03 A 61 PHE HD1 H 1 7.34 0.03 A 61 PHE HD2 H 1 7.34 0.03 A 61 PHE HE1 H 1 7.41 0.03 A 61 PHE HE2 H 1 7.41 0.03 A 61 PHE HZ H 1 7.24 0.03 A 61 PHE CA C 13 58.31 0.30 A 61 PHE CB C 13 38.92 0.30 A 61 PHE N N 15 109.70 0.20 A 62 GLY H H 1 7.80 0.03 A 62 GLY HAx H 1 4.09 0.03 A 62 GLY HAy H 1 4.29 0.03 A 62 GLY CA C 13 45.29 0.30 A 62 GLY N N 15 106.52 0.20 A 63 ASN H H 1 8.52 0.03 A 63 ASN HA H 1 4.92 0.03 A 63 ASN HBx H 1 2.94 0.03 A 63 ASN HBy H 1 2.94 0.03 A 63 ASN HD21 H 1 7.83 0.03 A 63 ASN HD22 H 1 6.95 0.03 A 63 ASN CA C 13 52.93 0.30 A 63 ASN CB C 13 38.63 0.30 A 63 ASN N N 15 117.02 0.20 A 63 ASN ND2 N 15 112.71 0.20 A 64 ILE H H 1 8.75 0.03 A 64 ILE HA H 1 4.10 0.03 A 64 ILE HB H 1 1.77 0.03 A 64 ILE HD1% H 1 0.85 0.03 A 64 ILE HG1x H 1 0.29 0.03 A 64 ILE HG1y H 1 1.92 0.03 A 64 ILE HG2% H 1 0.70 0.03 A 64 ILE CA C 13 61.94 0.30 A 64 ILE CB C 13 38.78 0.30 A 64 ILE CD1 C 13 14.06 0.30 A 64 ILE CG1 C 13 28.06 0.30 A 64 ILE CG2 C 13 17.55 0.30 A 64 ILE N N 15 127.93 0.20 A 65 ILE H H 1 8.91 0.03 A 65 ILE HA H 1 4.49 0.03 A 65 ILE HB H 1 2.00 0.03 A 65 ILE HD1% H 1 0.86 0.03 A 65 ILE HG1x H 1 0.85 0.03 A 65 ILE HG1y H 1 1.16 0.03 A 65 ILE HG2% H 1 0.95 0.03 A 65 ILE CA C 13 61.31 0.30 A 65 ILE CB C 13 38.47 0.30 A 65 ILE CD1 C 13 13.73 0.30 A 65 ILE CG1 C 13 26.70 0.30 A 65 ILE CG2 C 13 17.93 0.30 A 65 ILE N N 15 124.53 0.20 A 66 ASP H H 1 7.52 0.03 A 66 ASP HA H 1 4.70 0.03 A 66 ASP HBx H 1 2.35 0.03 A 66 ASP HBy H 1 2.73 0.03 A 66 ASP CA C 13 55.52 0.30 A 66 ASP CB C 13 45.29 0.30 A 66 ASP N N 15 119.14 0.20 A 67 LEU H H 1 8.23 0.03 A 67 LEU HA H 1 4.98 0.03 A 67 LEU HBx H 1 1.28 0.03 A 67 LEU HBy H 1 1.82 0.03 A 67 LEU HDx% H 1 0.82 0.03 A 67 LEU HDy% H 1 1.45 0.03 A 67 LEU CA C 13 54.98 0.30 A 67 LEU CB C 13 44.44 0.30 A 67 LEU CDx C 13 25.09 0.30 A 67 LEU CDy C 13 28.59 0.30 A 67 LEU N N 15 127.89 0.20 A 68 SER H H 1 8.81 0.03 A 68 SER HA H 1 4.97 0.03 A 68 SER HBx H 1 3.96 0.03 A 68 SER HBy H 1 4.05 0.03 A 68 SER CA C 13 57.17 0.30 A 68 SER CB C 13 65.32 0.30 A 68 SER N N 15 122.56 0.20 A 69 MET H H 1 9.05 0.03 A 69 MET HA H 1 4.74 0.03 A 69 MET HE% H 1 1.79 0.03 A 69 MET HGx H 1 2.43 0.03 A 69 MET HGy H 1 2.63 0.03 A 69 MET CA C 13 54.52 0.30 A 69 MET CE C 13 15.87 0.30 A 69 MET CG C 13 31.91 0.30 A 69 MET N N 15 122.42 0.20 A 70 ASP H H 1 8.62 0.03 A 70 ASP HA H 1 5.14 0.03 A 70 ASP HBx H 1 2.28 0.03 A 70 ASP HBy H 1 3.59 0.03 A 70 ASP CA C 13 51.41 0.30 A 70 ASP CB C 13 40.93 0.30 A 70 ASP N N 15 120.62 0.20 A 71 PRO HA H 1 4.76 0.03 A 71 PRO HDx H 1 3.61 0.03 A 71 PRO HDy H 1 3.85 0.03 A 71 PRO CA C 13 66.38 0.30 A 71 PRO CD C 13 49.73 0.30 A 72 PRO HA H 1 4.52 0.03 A 72 PRO HBx H 1 1.77 0.03 A 72 PRO HBy H 1 2.51 0.03 A 72 PRO HDx H 1 3.75 0.03 A 72 PRO HDy H 1 4.02 0.03 A 72 PRO HGx H 1 2.17 0.03 A 72 PRO HGy H 1 2.17 0.03 A 72 PRO CA C 13 65.75 0.30 A 72 PRO CB C 13 31.57 0.30 A 72 PRO CD C 13 50.22 0.30 A 73 ARG H H 1 7.36 0.03 A 73 ARG HA H 1 4.57 0.03 A 73 ARG HBx H 1 1.66 0.03 A 73 ARG HBy H 1 1.84 0.03 A 73 ARG HDx H 1 3.36 0.03 A 73 ARG HDy H 1 3.42 0.03 A 73 ARG HGy H 1 2.40 0.03 A 73 ARG CA C 13 55.16 0.30 A 73 ARG CB C 13 29.00 0.30 A 73 ARG CD C 13 43.10 0.30 A 73 ARG CG C 13 31.25 0.30 A 73 ARG N N 15 114.56 0.20 A 74 ASN H H 1 8.44 0.03 A 74 ASN HA H 1 4.27 0.03 A 74 ASN HBx H 1 2.44 0.03 A 74 ASN HBy H 1 2.79 0.03 A 74 ASN HD21 H 1 7.18 0.03 A 74 ASN HD22 H 1 6.99 0.03 A 74 ASN CA C 13 53.83 0.30 A 74 ASN CB C 13 37.50 0.30 A 74 ASN N N 15 115.46 0.20 A 74 ASN ND2 N 15 112.83 0.20 A 75 CYS H H 1 7.27 0.03 A 75 CYS HA H 1 5.73 0.03 A 75 CYS HBy H 1 2.52 0.03 A 75 CYS CA C 13 55.42 0.30 A 75 CYS CB C 13 32.64 0.30 A 75 CYS N N 15 127.18 0.20 A 76 ALA H H 1 8.59 0.03 A 76 ALA HB% H 1 1.01 0.03 A 76 ALA CB C 13 24.40 0.30 A 76 ALA N N 15 122.12 0.20 A 77 PHE H H 1 8.78 0.03 A 77 PHE HA H 1 5.62 0.03 A 77 PHE CA C 13 55.85 0.30 A 77 PHE N N 15 115.39 0.20 A 78 VAL H H 1 8.58 0.03 A 78 VAL HA H 1 4.30 0.03 A 78 VAL HB H 1 1.45 0.03 A 78 VAL HGx% H 1 0.24 0.03 A 78 VAL HGy% H 1 0.06 0.03 A 78 VAL CA C 13 60.96 0.30 A 78 VAL CB C 13 34.36 0.30 A 78 VAL CGy C 13 20.42 0.30 A 78 VAL CGx C 13 19.33 0.30 A 78 VAL N N 15 126.44 0.20 A 79 THR H H 1 8.96 0.03 A 79 THR HA H 1 5.33 0.03 A 79 THR HB H 1 3.90 0.03 A 79 THR HG2% H 1 1.22 0.03 A 79 THR CA C 13 61.94 0.30 A 79 THR CB C 13 69.91 0.30 A 79 THR CG2 C 13 22.18 0.30 A 79 THR N N 15 123.99 0.20 A 80 TYR H H 1 8.88 0.03 A 80 TYR HA H 1 5.40 0.03 A 80 TYR HBx H 1 2.79 0.03 A 80 TYR HBy H 1 3.70 0.03 A 80 TYR CA C 13 57.66 0.30 A 80 TYR CB C 13 42.22 0.30 A 80 TYR N N 15 126.67 0.20 A 81 GLU H H 1 8.49 0.03 A 81 GLU HA H 1 4.11 0.03 A 81 GLU HBx H 1 2.27 0.03 A 81 GLU HBy H 1 2.33 0.03 A 81 GLU HGx H 1 2.37 0.03 A 81 GLU HGy H 1 2.52 0.03 A 81 GLU CA C 13 59.29 0.30 A 81 GLU CB C 13 31.21 0.30 A 81 GLU CG C 13 36.41 0.30 A 81 GLU N N 15 119.69 0.20 A 82 LYS H H 1 8.46 0.03 A 82 LYS HA H 1 5.02 0.03 A 82 LYS HBy H 1 2.26 0.03 A 82 LYS HDy H 1 1.86 0.03 A 82 LYS HEy H 1 3.12 0.03 A 82 LYS HGx H 1 1.61 0.03 A 82 LYS HGy H 1 1.65 0.03 A 82 LYS CA C 13 54.14 0.30 A 82 LYS CB C 13 34.42 0.30 A 82 LYS CD C 13 29.06 0.30 A 82 LYS CE C 13 41.95 0.30 A 82 LYS CG C 13 25.00 0.30 A 82 LYS N N 15 113.92 0.20 A 83 MET H H 1 9.10 0.03 A 83 MET HA H 1 4.07 0.03 A 83 MET HBy H 1 2.17 0.03 A 83 MET HGx H 1 2.38 0.03 A 83 MET HGy H 1 2.75 0.03 A 83 MET CA C 13 59.57 0.30 A 83 MET CB C 13 32.42 0.30 A 83 MET CG C 13 32.85 0.30 A 83 MET N N 15 122.53 0.20 A 84 GLU H H 1 9.69 0.03 A 84 GLU HA H 1 4.24 0.03 A 84 GLU HBy H 1 2.14 0.03 A 84 GLU HGx H 1 2.43 0.03 A 84 GLU HGy H 1 2.55 0.03 A 84 GLU CA C 13 60.04 0.30 A 84 GLU CB C 13 28.64 0.30 A 84 GLU CG C 13 36.78 0.30 A 84 GLU N N 15 117.94 0.20 A 85 SER H H 1 7.11 0.03 A 85 SER HA H 1 4.13 0.03 A 85 SER HBx H 1 2.54 0.03 A 85 SER HBy H 1 3.50 0.03 A 85 SER CA C 13 61.84 0.30 A 85 SER CB C 13 62.40 0.30 A 85 SER N N 15 115.50 0.20 A 86 ALA H H 1 6.86 0.03 A 86 ALA HA H 1 4.08 0.03 A 86 ALA HB% H 1 1.77 0.03 A 86 ALA CA C 13 55.21 0.30 A 86 ALA CB C 13 18.07 0.30 A 86 ALA N N 15 122.76 0.20 A 87 ASP H H 1 7.68 0.03 A 87 ASP HA H 1 4.39 0.03 A 87 ASP HBx H 1 2.74 0.03 A 87 ASP HBy H 1 2.81 0.03 A 87 ASP CA C 13 57.47 0.30 A 87 ASP CB C 13 40.85 0.30 A 87 ASP N N 15 115.98 0.20 A 88 GLN H H 1 7.67 0.03 A 88 GLN HA H 1 4.04 0.03 A 88 GLN HBx H 1 2.14 0.03 A 88 GLN HBy H 1 2.22 0.03 A 88 GLN HE21 H 1 7.82 0.03 A 88 GLN HE22 H 1 6.88 0.03 A 88 GLN HGx H 1 2.43 0.03 A 88 GLN HGy H 1 2.62 0.03 A 88 GLN CA C 13 58.50 0.30 A 88 GLN CB C 13 28.27 0.30 A 88 GLN CG C 13 33.78 0.30 A 88 GLN N N 15 119.92 0.20 A 88 GLN NE2 N 15 111.45 0.20 A 89 ALA H H 1 7.95 0.03 A 89 ALA HA H 1 2.80 0.03 A 89 ALA HB% H 1 1.54 0.03 A 89 ALA CA C 13 54.93 0.30 A 89 ALA CB C 13 19.34 0.30 A 89 ALA N N 15 121.33 0.20 A 90 VAL H H 1 8.03 0.03 A 90 VAL HA H 1 3.37 0.03 A 90 VAL HB H 1 2.20 0.03 A 90 VAL HGx% H 1 1.13 0.03 A 90 VAL HGy% H 1 1.13 0.03 A 90 VAL CA C 13 67.09 0.30 A 90 VAL CB C 13 32.18 0.30 A 90 VAL CGx C 13 21.32 0.30 A 90 VAL CGy C 13 24.38 0.30 A 90 VAL N N 15 116.63 0.20 A 91 ALA H H 1 7.35 0.03 A 91 ALA HA H 1 4.13 0.03 A 91 ALA HB% H 1 1.57 0.03 A 91 ALA CA C 13 54.81 0.30 A 91 ALA CB C 13 18.33 0.30 A 91 ALA N N 15 119.62 0.20 A 92 GLU H H 1 7.96 0.03 A 92 GLU HA H 1 4.36 0.03 A 92 GLU HBx H 1 1.75 0.03 A 92 GLU HBy H 1 2.16 0.03 A 92 GLU HGx H 1 2.35 0.03 A 92 GLU HGy H 1 2.44 0.03 A 92 GLU CA C 13 57.93 0.30 A 92 GLU CB C 13 30.98 0.30 A 92 GLU CG C 13 36.61 0.30 A 92 GLU N N 15 113.77 0.20 A 93 LEU H H 1 8.31 0.03 A 93 LEU HA H 1 4.62 0.03 A 93 LEU HBx H 1 1.13 0.03 A 93 LEU HBy H 1 1.81 0.03 A 93 LEU HDx% H 1 0.75 0.03 A 93 LEU HDy% H 1 0.05 0.03 A 93 LEU HG H 1 1.41 0.03 A 93 LEU CA C 13 55.81 0.30 A 93 LEU CB C 13 44.13 0.30 A 93 LEU CDx C 13 22.63 0.30 A 93 LEU CDy C 13 25.33 0.30 A 93 LEU CG C 13 26.77 0.30 A 93 LEU N N 15 114.55 0.20 A 94 ASN H H 1 7.91 0.03 A 94 ASN HA H 1 4.43 0.03 A 94 ASN HD21 H 1 7.93 0.03 A 94 ASN HD22 H 1 7.21 0.03 A 94 ASN CA C 13 56.69 0.30 A 94 ASN N N 15 116.84 0.20 A 94 ASN ND2 N 15 115.40 0.20 A 95 GLY H H 1 8.89 0.03 A 95 GLY HAx H 1 3.96 0.03 A 95 GLY HAy H 1 4.29 0.03 A 95 GLY CA C 13 46.09 0.30 A 95 GLY N N 15 116.35 0.20 A 96 THR H H 1 7.86 0.03 A 96 THR HA H 1 4.66 0.03 A 96 THR HB H 1 4.27 0.03 A 96 THR HG2% H 1 1.25 0.03 A 96 THR CA C 13 60.88 0.30 A 96 THR CB C 13 71.09 0.30 A 96 THR CG2 C 13 21.65 0.30 A 96 THR N N 15 113.92 0.20 A 97 GLN H H 1 8.36 0.03 A 97 GLN HA H 1 5.21 0.03 A 97 GLN HBx H 1 1.88 0.03 A 97 GLN HBy H 1 1.95 0.03 A 97 GLN HE21 H 1 7.49 0.03 A 97 GLN HE22 H 1 6.82 0.03 A 97 GLN HGy H 1 2.12 0.03 A 97 GLN CA C 13 54.17 0.30 A 97 GLN CB C 13 30.47 0.30 A 97 GLN CG C 13 33.85 0.30 A 97 GLN N N 15 119.55 0.20 A 97 GLN NE2 N 15 110.85 0.20 A 98 VAL H H 1 8.90 0.03 A 98 VAL HA H 1 4.20 0.03 A 98 VAL HB H 1 1.91 0.03 A 98 VAL HGx% H 1 0.98 0.03 A 98 VAL HGy% H 1 0.91 0.03 A 98 VAL CA C 13 61.35 0.30 A 98 VAL CB C 13 33.60 0.30 A 98 VAL CGy C 13 21.70 0.30 A 98 VAL CGx C 13 21.10 0.30 A 98 VAL N N 15 127.26 0.20 A 99 GLU H H 1 9.16 0.03 A 99 GLU HA H 1 3.82 0.03 A 99 GLU HBy H 1 2.22 0.03 A 99 GLU HGy H 1 2.33 0.03 A 99 GLU CA C 13 57.95 0.30 A 99 GLU CB C 13 27.11 0.30 A 99 GLU CG C 13 36.41 0.30 A 99 GLU N N 15 124.20 0.20 A 100 SER H H 1 8.33 0.03 A 100 SER HA H 1 4.28 0.03 A 100 SER HBx H 1 4.03 0.03 A 100 SER HBy H 1 4.23 0.03 A 100 SER CA C 13 59.78 0.30 A 100 SER CB C 13 63.30 0.30 A 100 SER N N 15 111.66 0.20 A 101 VAL H H 1 8.41 0.03 A 101 VAL HA H 1 4.21 0.03 A 101 VAL HB H 1 2.31 0.03 A 101 VAL HGx% H 1 0.94 0.03 A 101 VAL HGy% H 1 0.82 0.03 A 101 VAL CA C 13 62.08 0.30 A 101 VAL CB C 13 33.20 0.30 A 101 VAL CGx C 13 21.31 0.30 A 101 VAL CGy C 13 21.51 0.30 A 101 VAL N N 15 124.55 0.20 A 102 GLN H H 1 8.51 0.03 A 102 GLN HA H 1 4.59 0.03 A 102 GLN HBx H 1 2.04 0.03 A 102 GLN HBy H 1 2.13 0.03 A 102 GLN HE21 H 1 7.51 0.03 A 102 GLN HE22 H 1 6.73 0.03 A 102 GLN HGx H 1 2.25 0.03 A 102 GLN HGy H 1 2.29 0.03 A 102 GLN CA C 13 55.09 0.30 A 102 GLN CB C 13 28.62 0.30 A 102 GLN CG C 13 33.54 0.30 A 102 GLN N N 15 127.32 0.20 A 102 GLN NE2 N 15 110.98 0.20 A 103 LEU H H 1 8.71 0.03 A 103 LEU HA H 1 5.05 0.03 A 103 LEU HBx H 1 1.16 0.03 A 103 LEU HBy H 1 2.07 0.03 A 103 LEU HDx% H 1 0.75 0.03 A 103 LEU HDy% H 1 0.68 0.03 A 103 LEU HG H 1 1.83 0.03 A 103 LEU CA C 13 54.74 0.30 A 103 LEU CB C 13 44.82 0.30 A 103 LEU CDy C 13 26.42 0.30 A 103 LEU CDx C 13 23.97 0.30 A 103 LEU CG C 13 26.50 0.30 A 103 LEU N N 15 126.61 0.20 A 104 LYS H H 1 8.69 0.03 A 104 LYS HA H 1 5.03 0.03 A 104 LYS HBy H 1 2.13 0.03 A 104 LYS HBx H 1 2.04 0.03 A 104 LYS HDy H 1 1.80 0.03 A 104 LYS HEy H 1 3.08 0.03 A 104 LYS HGy H 1 1.77 0.03 A 104 LYS HGx H 1 1.52 0.03 A 104 LYS CA C 13 55.48 0.30 A 104 LYS CB C 13 34.52 0.30 A 104 LYS CD C 13 29.44 0.30 A 104 LYS CE C 13 41.94 0.30 A 104 LYS CG C 13 24.90 0.30 A 104 LYS N N 15 124.08 0.20 A 105 VAL H H 1 9.05 0.03 A 105 VAL HA H 1 5.19 0.03 A 105 VAL HB H 1 1.94 0.03 A 105 VAL HGx% H 1 1.15 0.03 A 105 VAL HGy% H 1 1.10 0.03 A 105 VAL CA C 13 60.84 0.30 A 105 VAL CB C 13 35.66 0.30 A 105 VAL CGy C 13 24.11 0.30 A 105 VAL CGx C 13 22.61 0.30 A 105 VAL N N 15 123.92 0.20 A 106 ASN H H 1 9.30 0.03 A 106 ASN HA H 1 5.22 0.03 A 106 ASN HBx H 1 2.76 0.03 A 106 ASN HBy H 1 3.05 0.03 A 106 ASN HD21 H 1 7.58 0.03 A 106 ASN HD22 H 1 7.14 0.03 A 106 ASN CA C 13 51.63 0.30 A 106 ASN CB C 13 43.84 0.30 A 106 ASN N N 15 122.78 0.20 A 106 ASN ND2 N 15 112.01 0.20 A 107 ILE H H 1 9.05 0.03 A 107 ILE HA H 1 4.16 0.03 A 107 ILE HB H 1 2.00 0.03 A 107 ILE HD1% H 1 0.88 0.03 A 107 ILE HG1x H 1 1.56 0.03 A 107 ILE HG1y H 1 1.65 0.03 A 107 ILE HG2% H 1 0.92 0.03 A 107 ILE CA C 13 61.67 0.30 A 107 ILE CB C 13 36.14 0.30 A 107 ILE CD1 C 13 10.22 0.30 A 107 ILE CG2 C 13 17.75 0.30 A 107 ILE N N 15 122.98 0.20 A 108 ALA H H 1 8.74 0.03 A 108 ALA HA H 1 4.78 0.03 A 108 ALA HB% H 1 1.85 0.03 A 108 ALA CA C 13 52.62 0.30 A 108 ALA CB C 13 19.57 0.30 A 108 ALA N N 15 131.61 0.20 A 109 ARG HA H 1 4.39 0.03 A 109 ARG HBx H 1 1.83 0.03 A 109 ARG HBy H 1 1.92 0.03 A 109 ARG HDy H 1 3.24 0.03 A 109 ARG CA C 13 56.12 0.30 A 109 ARG CB C 13 31.01 0.30 A 109 ARG CD C 13 43.27 0.30 A 111 GLN HA H 1 4.63 0.03 A 111 GLN HBx H 1 1.94 0.03 A 111 GLN HBy H 1 2.31 0.03 A 111 GLN HGx H 1 2.45 0.03 A 111 GLN HGy H 1 2.55 0.03 A 111 GLN CA C 13 55.16 0.30 A 111 GLN CB C 13 32.90 0.30 A 111 GLN CG C 13 33.05 0.30 A 112 PRO HA H 1 4.37 0.03 A 112 PRO HBy H 1 1.84 0.03 A 112 PRO HDy H 1 3.79 0.03 A 112 PRO HGy H 1 2.12 0.03 A 112 PRO CA C 13 64.09 0.30 A 112 PRO CB C 13 32.65 0.30 A 113 MET HE% H 1 2.09 0.03 A 113 MET CE C 13 17.48 0.30 A 114 LEU H H 1 7.71 0.03 A 114 LEU HA H 1 4.44 0.03 A 114 LEU HBx H 1 1.77 0.03 A 114 LEU HBy H 1 1.84 0.03 A 114 LEU HDx% H 1 1.08 0.03 A 114 LEU HDy% H 1 1.00 0.03 A 114 LEU CB C 13 42.64 0.30 A 114 LEU CDx C 13 24.87 0.30 A 114 LEU CDy C 13 24.98 0.30 A 114 LEU N N 15 123.05 0.20 A 115 ASP H H 1 8.44 0.03 A 115 ASP HA H 1 4.61 0.03 A 115 ASP HBx H 1 2.67 0.03 A 115 ASP HBy H 1 2.77 0.03 A 115 ASP CA C 13 54.62 0.30 A 115 ASP CB C 13 40.72 0.30 A 115 ASP N N 15 119.52 0.20 A 116 ALA H H 1 8.06 0.03 A 116 ALA HA H 1 4.32 0.03 A 116 ALA HB% H 1 1.49 0.03 A 116 ALA CA C 13 53.08 0.30 A 116 ALA CB C 13 19.00 0.30 A 116 ALA N N 15 123.46 0.20 A 117 ALA H H 1 8.11 0.03 A 117 ALA HA H 1 4.64 0.03 A 117 ALA HB% H 1 1.55 0.03 A 117 ALA CA C 13 52.60 0.30 A 117 ALA CB C 13 19.36 0.30 A 117 ALA N N 15 121.13 0.20 A 118 THR H H 1 8.06 0.03 A 118 THR HA H 1 4.43 0.03 A 118 THR HB H 1 4.37 0.03 A 118 THR HG2% H 1 1.33 0.03 A 118 THR CA C 13 62.13 0.30 A 118 THR CB C 13 69.84 0.30 A 118 THR CG2 C 13 21.62 0.30 A 118 THR N N 15 112.10 0.20 A 119 GLY H H 1 8.43 0.03 A 119 GLY N N 15 111.23 0.20 A 120 LYS H H 1 8.20 0.03 A 120 LYS HA H 1 4.51 0.03 A 120 LYS HBx H 1 1.84 0.03 A 120 LYS HBy H 1 1.98 0.03 A 120 LYS HGy H 1 1.53 0.03 A 120 LYS CA C 13 56.11 0.30 A 120 LYS CB C 13 33.27 0.30 A 120 LYS N N 15 121.18 0.20 A 121 SER H H 1 8.09 0.03 A 121 SER N N 15 123.03 0.20 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 83 MET H A 84 GLU H 1.0 0.0 4.0 2 2 A 80 TYR H A 42 LEU H 1.0 0.0 6.0 3 3 A 59 SER H A 80 TYR HH 1.0 0.0 6.0 4 4 A 80 TYR HH A 58 PHE H 1.0 0.0 5.0 5 5 A 80 TYR HH A 62 GLY H 1.0 0.0 5.0 6 6 A 84 GLU H A 85 SER H 1.0 0.0 3.0 7 7 A 84 GLU H A 86 ALA H 1.0 0.0 5.0 8 8 A 42 LEU H A 43 TYR H 1.0 0.0 5.0 9 9 A 43 TYR H A 108 ALA H 1.0 0.0 4.0 10 10 A 43 TYR H A 78 VAL H 1.0 0.0 6.0 11 11 A 107 ILE H A 106 ASN H 1.0 0.0 5.0 12 12 A 98 VAL H A 99 GLU H 1.0 0.0 5.0 13 13 A 104 LYS H A 45 TYR H 1.0 0.0 4.0 14 14 A 45 TYR H A 46 GLY H 1.0 0.0 5.0 15 15 A 45 TYR H A 76 ALA H 1.0 0.0 6.0 16 16 A 99 GLU H A 101 VAL H 1.0 0.0 5.0 17 17 A 99 GLU H A 100 SER H 1.0 0.0 4.0 18 18 A 68 SER H A 69 MET H 1.0 0.0 5.0 19 19 A 69 MET H A 70 ASP H 1.0 0.0 5.0 20 20 A 95 GLY H A 105 VAL H 1.0 0.0 5.0 21 21 A 104 LYS H A 105 VAL H 1.0 0.0 5.0 22 22 A 53 LEU H A 55 ARG H 1.0 0.0 5.0 23 23 A 65 ILE H A 79 THR H 1.0 0.0 5.0 24 24 A 80 TYR H A 79 THR H 1.0 0.0 5.0 25 25 A 83 MET H A 82 LYS H 1.0 0.0 5.0 26 26 A 55 ARG H A 56 GLY H 1.0 0.0 3.0 27 27 A 55 ARG H A 57 ALA H 1.0 0.0 5.0 28 28 A 79 THR H A 66 ASP H 1.0 0.0 4.0 29 29 A 107 ILE H A 106 ASN HD21 1.0 0.0 5.0 30 30 A 83 MET H A 85 SER H 1.0 0.0 5.0 31 31 A 108 ALA H A 107 ILE H 1.0 0.0 5.0 32 32 A 79 THR H A 67 LEU H 1.0 0.0 6.0 33 33 A 70 ASP H A 77 PHE H 1.0 0.0 5.0 34 34 A 98 VAL H A 101 VAL H 1.0 0.0 4.0 35 35 A 98 VAL H A 97 GLN H 1.0 0.0 5.0 36 36 A 98 VAL H A 100 SER H 1.0 0.0 5.0 37 37 A 95 GLY H A 94 ASN H 1.0 0.0 5.0 38 38 A 98 VAL H A 97 GLN HE21 1.0 0.0 5.0 39 39 A 78 VAL H A 77 PHE H 1.0 0.0 5.0 40 40 A 98 VAL H A 102 GLN H 1.0 0.0 6.0 41 41 A 48 ASP H A 47 GLU H 1.0 0.0 5.0 42 42 A 47 GLU H A 49 MET H 1.0 0.0 6.0 43 43 A 65 ILE H A 66 ASP H 1.0 0.0 3.0 44 44 A 76 ALA H A 44 VAL H 1.0 0.0 4.0 45 45 A 63 ASN HD21 A 64 ILE H 1.0 0.0 6.0 46 46 A 76 ALA H A 75 CYS H 1.0 0.0 5.0 47 47 A 98 VAL H A 103 LEU H 1.0 0.0 5.0 48 48 A 102 GLN H A 103 LEU H 1.0 0.0 5.0 49 49 A 103 LEU H A 96 THR H 1.0 0.0 5.0 50 50 A 70 ASP H A 74 ASN H 1.0 0.0 6.0 51 51 A 70 ASP H A 75 CYS H 1.0 0.0 4.0 52 52 A 85 SER H A 82 LYS H 1.0 0.0 5.0 53 53 A 86 ALA H A 82 LYS H 1.0 0.0 6.0 54 54 A 42 LEU H A 78 VAL H 1.0 0.0 3.0 55 55 A 84 GLU H A 82 LYS H 1.0 0.0 5.0 56 56 A 82 LYS H A 40 ASN H 1.0 0.0 6.0 57 57 A 78 VAL H A 68 SER H 1.0 0.0 6.0 58 58 A 78 VAL H A 44 VAL H 1.0 0.0 5.0 59 59 A 58 PHE H A 56 GLY H 1.0 0.0 5.0 60 60 A 58 PHE H A 57 ALA H 1.0 0.0 3.0 61 61 A 65 ILE H A 81 GLU H 1.0 0.0 5.0 62 62 A 80 TYR H A 81 GLU H 1.0 0.0 5.0 63 63 A 101 VAL H A 102 GLN H 1.0 0.0 5.0 64 64 A 48 ASP H A 49 MET H 1.0 0.0 4.0 65 65 A 64 ILE H A 63 ASN H 1.0 0.0 5.0 66 66 A 38 LYS H A 37 ARG H 1.0 0.0 5.0 67 67 A 62 GLY H A 63 ASN H 1.0 0.0 5.0 68 68 A 74 ASN H A 73 ARG H 1.0 0.0 3.0 69 69 A 75 CYS H A 74 ASN H 1.0 0.0 3.0 70 70 A 40 ASN H A 41 THR H 1.0 0.0 5.0 71 71 A 40 ASN H A 39 GLY H 1.0 0.0 5.0 72 72 A 90 VAL H A 93 LEU H 1.0 0.0 5.0 73 73 A 93 LEU H A 92 GLU H 1.0 0.0 3.0 74 74 A 93 LEU H A 89 ALA H 1.0 0.0 6.0 75 75 A 94 ASN H A 93 LEU H 1.0 0.0 3.0 76 76 A 93 LEU H A 91 ALA H 1.0 0.0 5.0 77 77 A 45 TYR H A 44 VAL H 1.0 0.0 5.0 78 78 A 68 SER H A 67 LEU H 1.0 0.0 5.0 79 79 A 59 SER H A 56 GLY H 1.0 0.0 6.0 80 80 A 56 GLY H A 57 ALA H 1.0 0.0 3.0 81 81 A 53 LEU H A 56 GLY H 1.0 0.0 5.0 82 82 A 59 SER H A 58 PHE HD% 1.0 0.0 5.0 83 83 A 57 ALA H A 58 PHE HD% 1.0 0.0 4.0 84 84 A 58 PHE HD% A 61 PHE H 1.0 0.0 6.0 85 85 A 90 VAL H A 87 ASP H 1.0 0.0 5.0 86 86 A 105 VAL H A 94 ASN H 1.0 0.0 6.0 87 87 A 55 ARG H A 54 LEU H 1.0 0.0 3.0 88 88 A 95 GLY H A 96 THR H 1.0 0.0 3.0 89 89 A 59 SER H A 57 ALA H 1.0 0.0 5.0 90 90 A 97 GLN H A 96 THR H 1.0 0.0 5.0 91 91 A 53 LEU H A 52 THR H 1.0 0.0 4.0 92 92 A 85 SER H A 87 ASP H 1.0 0.0 5.0 93 93 A 86 ALA H A 87 ASP H 1.0 0.0 3.0 94 94 A 62 GLY H A 61 PHE H 1.0 0.0 3.0 95 95 A 90 VAL H A 88 GLN H 1.0 0.0 5.0 96 96 A 89 ALA H A 88 GLN H 1.0 0.0 3.0 97 97 A 91 ALA H A 88 GLN H 1.0 0.0 6.0 98 98 A 54 LEU H A 52 THR H 1.0 0.0 6.0 99 99 A 46 GLY H A 76 ALA H 1.0 0.0 6.0 100 100 A 46 GLY H A 47 GLU H 1.0 0.0 5.0 101 101 A 101 VAL H A 97 GLN HE21 1.0 0.0 5.0 102 102 A 66 ASP H A 67 LEU H 1.0 0.0 5.0 103 103 A 66 ASP H A 64 ILE H 1.0 0.0 6.0 104 104 A 44 VAL H A 77 PHE HE% 1.0 0.0 6.0 105 105 A 88 GLN HE21 A 61 PHE HE% 1.0 0.0 5.0 106 106 A 62 GLY H A 61 PHE HD% 1.0 0.0 5.0 107 107 A 41 THR H A 40 ASN HD21 1.0 0.0 6.0 108 108 A 80 TYR H A 40 ASN HD21 1.0 0.0 6.0 109 109 A 59 SER H A 61 PHE HD% 1.0 0.0 6.0 110 110 A 58 PHE H A 61 PHE HD% 1.0 0.0 6.0 111 111 A 92 GLU H A 61 PHE HZ 1.0 0.0 5.0 112 112 A 47 GLU H A 45 TYR HD% 1.0 0.0 6.0 113 113 A 76 ALA H A 45 TYR HD% 1.0 0.0 6.0 114 114 A 104 LYS H A 45 TYR HD% 1.0 0.0 5.0 115 115 A 46 GLY H A 45 TYR HD% 1.0 0.0 4.0 116 116 A 68 SER H A 77 PHE HD% 1.0 0.0 6.0 117 117 A 85 SER H A 86 ALA H 1.0 0.0 3.0 118 118 A 57 ALA H A 58 PHE HE% 1.0 0.0 6.0 119 119 A 106 ASN H A 43 TYR HD% 1.0 0.0 5.0 120 120 A 45 TYR H A 43 TYR HD% 1.0 0.0 5.0 121 121 A 47 GLU H A 45 TYR HE% 1.0 0.0 6.0 122 122 A 76 ALA H A 43 TYR HD% 1.0 0.0 6.0 123 123 A 44 VAL H A 43 TYR HD% 1.0 0.0 4.0 124 124 A 46 GLY H A 45 TYR HE% 1.0 0.0 5.0 125 125 A 65 ILE H A 80 TYR HD% 1.0 0.0 6.0 126 126 A 64 ILE H A 80 TYR HD% 1.0 0.0 5.0 127 127 A 82 LYS H A 80 TYR HD% 1.0 0.0 5.0 128 128 A 81 GLU H A 80 TYR HD% 1.0 0.0 4.0 129 129 A 63 ASN H A 80 TYR HD% 1.0 0.0 4.0 130 130 A 45 TYR H A 43 TYR HE% 1.0 0.0 5.0 131 131 A 76 ALA H A 43 TYR HE% 1.0 0.0 6.0 132 132 A 59 SER H A 61 PHE H 1.0 0.0 5.0 133 133 A 64 ILE H A 80 TYR HE% 1.0 0.0 5.0 134 134 A 58 PHE H A 80 TYR HE% 1.0 0.0 6.0 135 135 A 81 GLU H A 80 TYR HE% 1.0 0.0 6.0 136 136 A 53 LEU H A 50 THR H 1.0 0.0 5.0 137 137 A 49 MET H A 50 THR H 1.0 0.0 5.0 138 138 A 54 LEU H A 50 THR H 1.0 0.0 5.0 139 139 A 45 TYR H A 75 CYS HA 1.0 0.0 5.0 140 140 A 76 ALA H A 75 CYS HA 1.0 0.0 3.0 141 141 A 46 GLY H A 75 CYS HA 1.0 0.0 4.0 142 142 A 42 LEU H A 77 PHE HA 1.0 0.0 5.0 143 143 A 68 SER H A 77 PHE HA 1.0 0.0 5.0 144 144 A 78 VAL H A 77 PHE HA 1.0 0.0 3.0 145 145 A 44 VAL H A 77 PHE HA 1.0 0.0 4.0 146 146 A 65 ILE H A 80 TYR HA 1.0 0.0 5.0 147 147 A 80 TYR H A 41 THR HA 1.0 0.0 4.0 148 148 A 64 ILE H A 80 TYR HA 1.0 0.0 6.0 149 149 A 82 LYS H A 80 TYR HA 1.0 0.0 5.0 150 150 A 81 GLU H A 80 TYR HA 1.0 0.0 3.0 151 151 A 66 ASP H A 80 TYR HA 1.0 0.0 6.0 152 152 A 42 LEU H A 41 THR HA 1.0 0.0 3.0 153 153 A 78 VAL H A 41 THR HA 1.0 0.0 5.0 154 154 A 45 TYR H A 105 VAL HA 1.0 0.0 4.0 155 155 A 106 ASN H A 105 VAL HA 1.0 0.0 3.0 156 156 A 102 GLN H A 97 GLN HA 1.0 0.0 6.0 157 157 A 101 VAL H A 97 GLN HA 1.0 0.0 5.0 158 158 A 98 VAL H A 97 GLN HA 1.0 0.0 3.0 159 159 A 80 TYR H A 79 THR HA 1.0 0.0 3.0 160 160 A 103 LEU H A 97 GLN HA 1.0 0.0 4.0 161 161 A 78 VAL H A 79 THR HA 1.0 0.0 5.0 162 162 A 66 ASP H A 79 THR HA 1.0 0.0 6.0 163 163 A 76 ALA H A 45 TYR HA 1.0 0.0 4.0 164 164 A 46 GLY H A 45 TYR HA 1.0 0.0 3.0 165 165 A 75 CYS H A 45 TYR HA 1.0 0.0 5.0 166 166 A 43 TYR H A 42 LEU HA 1.0 0.0 3.0 167 167 A 95 GLY H A 104 LYS HA 1.0 0.0 4.0 168 168 A 108 ALA H A 42 LEU HA 1.0 0.0 4.0 169 169 A 78 VAL H A 67 LEU HA 1.0 0.0 6.0 170 170 A 96 THR H A 104 LYS HA 1.0 0.0 6.0 171 171 A 104 LYS HA A 94 ASN HD22 1.0 0.0 6.0 172 172 A 79 THR H A 67 LEU HA 1.0 0.0 4.0 173 173 A 68 SER H A 67 LEU HA 1.0 0.0 3.0 174 174 A 53 LEU H A 50 THR HA 1.0 0.0 6.0 175 175 A 52 THR H A 50 THR HA 1.0 0.0 5.0 176 176 A 66 ASP H A 67 LEU HA 1.0 0.0 6.0 177 177 A 84 GLU H A 82 LYS HA 1.0 0.0 4.0 178 178 A 69 MET H A 68 SER HA 1.0 0.0 3.0 179 179 A 81 GLU H A 82 LYS HA 1.0 0.0 6.0 180 180 A 85 SER H A 82 LYS HA 1.0 0.0 5.0 181 181 A 106 ASN H A 44 VAL HA 1.0 0.0 5.0 182 182 A 45 TYR H A 44 VAL HA 1.0 0.0 4.0 183 183 A 80 TYR H A 40 ASN HA 1.0 0.0 5.0 184 184 A 39 GLY H A 40 ASN HA 1.0 0.0 6.0 185 185 A 41 THR H A 40 ASN HA 1.0 0.0 4.0 186 186 A 70 ASP H A 69 MET HA 1.0 0.0 3.0 187 187 A 57 ALA H A 58 PHE HA 1.0 0.0 6.0 188 188 A 75 CYS H A 69 MET HA 1.0 0.0 6.0 189 189 A 77 PHE H A 76 ALA HA 1.0 0.0 3.0 190 190 A 79 THR H A 66 ASP HA 1.0 0.0 6.0 191 191 A 65 ILE H A 66 ASP HA 1.0 0.0 5.0 192 192 A 78 VAL H A 43 TYR HA 1.0 0.0 5.0 193 193 A 67 LEU H A 66 ASP HA 1.0 0.0 3.0 194 194 A 53 LEU H A 50 THR HB 1.0 0.0 4.0 195 195 A 52 THR H A 50 THR HB 1.0 0.0 4.0 196 196 A 97 GLN H A 96 THR HA 1.0 0.0 3.0 197 197 A 37 ARG H A 38 LYS HA 1.0 0.0 6.0 198 198 A 92 GLU H A 93 LEU HA 1.0 0.0 6.0 199 199 A 98 VAL H A 102 GLN HA 1.0 0.0 4.0 200 200 A 103 LEU H A 102 GLN HA 1.0 0.0 3.0 201 201 A 39 GLY H A 38 LYS HA 1.0 0.0 4.0 202 202 A 101 VAL H A 102 GLN HA 1.0 0.0 5.0 203 203 A 75 CYS H A 73 ARG HA 1.0 0.0 6.0 204 204 A 37 ARG H A 36 PRO HA 1.0 0.0 4.0 205 205 A 89 ALA H A 61 PHE HA 1.0 0.0 6.0 206 206 A 88 GLN HE21 A 61 PHE HA 1.0 0.0 6.0 207 207 A 62 GLY H A 61 PHE HA 1.0 0.0 4.0 208 208 A 105 VAL H A 94 ASN HA 1.0 0.0 4.0 209 209 A 95 GLY H A 94 ASN HA 1.0 0.0 3.0 210 210 A 96 THR H A 94 ASN HA 1.0 0.0 4.0 211 211 A 66 ASP H A 65 ILE HA 1.0 0.0 4.0 212 212 A 113 MET H A 112 PRO HA 1.0 0.0 4.0 213 213 A 38 LYS H A 37 ARG HA 1.0 0.0 4.0 214 214 A 93 LEU H A 92 GLU HA 1.0 0.0 4.0 215 215 A 90 VAL H A 87 ASP HA 1.0 0.0 4.0 216 216 A 89 ALA H A 87 ASP HA 1.0 0.0 5.0 217 217 A 88 GLN H A 87 ASP HA 1.0 0.0 4.0 218 218 A 73 ARG H A 74 ASN HA 1.0 0.0 5.0 219 219 A 75 CYS H A 74 ASN HA 1.0 0.0 3.0 220 220 A 86 ALA H A 87 ASP HA 1.0 0.0 6.0 221 221 A 79 THR H A 78 VAL HA 1.0 0.0 3.0 222 222 A 68 SER H A 78 VAL HA 1.0 0.0 4.0 223 223 A 67 LEU H A 78 VAL HA 1.0 0.0 6.0 224 224 A 53 LEU H A 51 PRO HA 1.0 0.0 5.0 225 225 A 46 GLY H A 74 ASN HA 1.0 0.0 5.0 226 226 A 66 ASP H A 78 VAL HA 1.0 0.0 6.0 227 227 A 55 ARG H A 51 PRO HA 1.0 0.0 4.0 228 228 A 81 GLU H A 62 GLY HAy 1.0 0.0 6.0 229 229 A 63 ASN H A 62 GLY HAy 1.0 0.0 3.0 230 230 A 97 GLN H A 96 THR HB 1.0 0.0 3.0 231 231 A 49 MET H A 48 ASP HA 1.0 0.0 3.0 232 232 A 97 GLN HE21 A 100 SER HA 1.0 0.0 3.0 233 233 A 100 SER HA A 97 GLN HE22 1.0 0.0 4.0 234 234 A 43 TYR H A 107 ILE HA 1.0 0.0 4.0 235 235 A 47 GLU H A 101 VAL HA 1.0 0.0 6.0 236 236 A 108 ALA H A 107 ILE HA 1.0 0.0 3.0 237 237 A 102 GLN H A 101 VAL HA 1.0 0.0 3.0 238 238 A 87 ASP H A 84 GLU HA 1.0 0.0 4.0 239 239 A 99 GLU H A 98 VAL HA 1.0 0.0 4.0 240 240 A 59 SER H A 56 GLY HAy 1.0 0.0 5.0 241 241 A 93 LEU H A 91 ALA HA 1.0 0.0 5.0 242 242 A 92 GLU H A 91 ALA HA 1.0 0.0 4.0 243 243 A 57 ALA H A 56 GLY HAy 1.0 0.0 4.0 244 244 A 65 ILE H A 64 ILE HA 1.0 0.0 3.0 245 245 A 40 ASN H A 83 MET HA 1.0 0.0 6.0 246 246 A 66 ASP H A 64 ILE HA 1.0 0.0 4.0 247 247 A 74 ASN HD21 A 47 GLU HA 1.0 0.0 6.0 248 248 A 47 GLU HA A 74 ASN HD22 1.0 0.0 6.0 249 249 A 61 PHE H A 62 GLY HAx 1.0 0.0 6.0 250 250 A 40 ASN HD22 A 86 ALA HA 1.0 0.0 6.0 251 251 A 42 LEU H A 41 THR HB 1.0 0.0 5.0 252 252 A 84 GLU H A 83 MET HA 1.0 0.0 4.0 253 253 A 48 ASP H A 47 GLU HA 1.0 0.0 3.0 254 254 A 74 ASN H A 72 PRO HDy 1.0 0.0 5.0 255 255 A 101 VAL H A 100 SER HBx 1.0 0.0 5.0 256 255 A 101 VAL H A 100 SER HBy 1.0 0.0 5.0 257 256 A 97 GLN HE22 A 100 SER HBx 1.0 0.0 6.0 258 256 A 97 GLN HE22 A 100 SER HBy 1.0 0.0 6.0 259 257 A 54 LEU H A 52 THR HA 1.0 0.0 6.0 260 258 A 53 LEU H A 52 THR HA 1.0 0.0 4.0 261 259 A 73 ARG H A 72 PRO HDy 1.0 0.0 4.0 262 260 A 69 MET H A 68 SER HBx 1.0 0.0 4.0 263 260 A 69 MET H A 68 SER HBy 1.0 0.0 4.0 264 261 A 77 PHE H A 68 SER HBx 1.0 0.0 5.0 265 261 A 77 PHE H A 68 SER HBy 1.0 0.0 5.0 266 262 A 47 GLU H A 46 GLY HAx 1.0 0.0 3.0 267 262 A 47 GLU H A 46 GLY HAy 1.0 0.0 3.0 268 263 A 104 LYS H A 46 GLY HAx 1.0 0.0 5.0 269 263 A 104 LYS H A 46 GLY HAy 1.0 0.0 5.0 270 264 A 49 MET H A 46 GLY HAx 1.0 0.0 6.0 271 264 A 49 MET H A 46 GLY HAy 1.0 0.0 6.0 272 265 A 54 LEU H A 51 PRO HDx 1.0 0.0 6.0 273 266 A 50 THR H A 51 PRO HDx 1.0 0.0 6.0 274 267 A 80 TYR H A 79 THR HB 1.0 0.0 5.0 275 268 A 62 GLY H A 60 PRO HDy 1.0 0.0 6.0 276 269 A 66 ASP H A 79 THR HB 1.0 0.0 3.0 277 270 A 101 VAL H A 99 GLU HA 1.0 0.0 6.0 278 271 A 100 SER H A 99 GLU HA 1.0 0.0 4.0 279 272 A 74 ASN H A 72 PRO HDx 1.0 0.0 6.0 280 273 A 73 ARG H A 72 PRO HDx 1.0 0.0 5.0 281 274 A 82 LYS H A 80 TYR HBy 1.0 0.0 3.0 282 275 A 113 MET H A 112 PRO HDy 1.0 0.0 5.0 283 275 A 113 MET H A 112 PRO HDx 1.0 0.0 5.0 284 276 A 81 GLU H A 80 TYR HBy 1.0 0.0 4.0 285 277 A 35 ALA H A 36 PRO HDx 1.0 0.0 6.0 286 278 A 85 SER H A 80 TYR HBy 1.0 0.0 5.0 287 279 A 86 ALA H A 80 TYR HBy 1.0 0.0 5.0 288 280 A 73 ARG H A 70 ASP HBy 1.0 0.0 5.0 289 281 A 75 CYS H A 70 ASP HBy 1.0 0.0 4.0 290 282 A 84 GLU H A 85 SER HBy 1.0 0.0 6.0 291 283 A 80 TYR H A 85 SER HBy 1.0 0.0 6.0 292 284 A 82 LYS H A 85 SER HBy 1.0 0.0 4.0 293 285 A 81 GLU H A 85 SER HBy 1.0 0.0 6.0 294 286 A 87 ASP H A 85 SER HBy 1.0 0.0 6.0 295 287 A 92 GLU H A 90 VAL HA 1.0 0.0 5.0 296 288 A 91 ALA H A 90 VAL HA 1.0 0.0 4.0 297 289 A 95 GLY H A 94 ASN HBy 1.0 0.0 5.0 298 290 A 59 SER H A 58 PHE HBy 1.0 0.0 5.0 299 291 A 93 LEU H A 94 ASN HBy 1.0 0.0 6.0 300 292 A 56 GLY H A 55 ARG HDy 1.0 0.0 6.0 301 293 A 95 GLY H A 94 ASN HBx 1.0 0.0 5.0 302 294 A 93 LEU H A 94 ASN HBx 1.0 0.0 5.0 303 295 A 84 GLU H A 40 ASN HBy 1.0 0.0 6.0 304 296 A 83 MET H A 40 ASN HBy 1.0 0.0 5.0 305 297 A 59 SER H A 58 PHE HBx 1.0 0.0 4.0 306 298 A 57 ALA H A 58 PHE HBx 1.0 0.0 5.0 307 299 A 62 GLY H A 58 PHE HBx 1.0 0.0 6.0 308 300 A 41 THR H A 40 ASN HBy 1.0 0.0 5.0 309 301 A 39 GLY H A 40 ASN HBy 1.0 0.0 6.0 310 302 A 86 ALA H A 40 ASN HBy 1.0 0.0 6.0 311 303 A 64 ILE H A 63 ASN HBx 1.0 0.0 4.0 312 303 A 64 ILE H A 63 ASN HBy 1.0 0.0 4.0 313 304 A 82 LYS H A 63 ASN HBx 1.0 0.0 6.0 314 304 A 82 LYS H A 63 ASN HBy 1.0 0.0 6.0 315 305 A 44 VAL H A 43 TYR HBy 1.0 0.0 5.0 316 306 A 104 LYS H A 45 TYR HBx 1.0 0.0 4.0 317 306 A 104 LYS H A 45 TYR HBy 1.0 0.0 4.0 318 307 A 49 MET H A 48 ASP HBy 1.0 0.0 5.0 319 308 A 89 ALA H A 61 PHE HBx 1.0 0.0 5.0 320 309 A 62 GLY H A 61 PHE HBx 1.0 0.0 4.0 321 310 A 83 MET H A 40 ASN HBx 1.0 0.0 6.0 322 311 A 44 VAL H A 43 TYR HBx 1.0 0.0 5.0 323 312 A 107 ILE H A 106 ASN HBx 1.0 0.0 4.0 324 313 A 108 ALA H A 106 ASN HBx 1.0 0.0 6.0 325 314 A 68 SER H A 77 PHE HBx 1.0 0.0 4.0 326 314 A 68 SER H A 77 PHE HBy 1.0 0.0 4.0 327 315 A 78 VAL H A 77 PHE HBx 1.0 0.0 4.0 328 315 A 78 VAL H A 77 PHE HBy 1.0 0.0 4.0 329 316 A 47 GLU H A 48 ASP HBx 1.0 0.0 6.0 330 317 A 76 ALA H A 75 CYS HBy 1.0 0.0 4.0 331 318 A 93 LEU H A 89 ALA HA 1.0 0.0 4.0 332 319 A 49 MET H A 48 ASP HBx 1.0 0.0 5.0 333 320 A 92 GLU H A 89 ALA HA 1.0 0.0 4.0 334 321 A 46 GLY H A 75 CYS HBx 1.0 0.0 5.0 335 322 A 61 PHE H A 89 ALA HA 1.0 0.0 6.0 336 323 A 84 GLU H A 83 MET HGx 1.0 0.0 5.0 337 323 A 84 GLU H A 83 MET HGy 1.0 0.0 5.0 338 324 A 65 ILE H A 66 ASP HBy 1.0 0.0 5.0 339 325 A 67 LEU H A 66 ASP HBy 1.0 0.0 5.0 340 326 A 77 PHE H A 69 MET HGy 1.0 0.0 5.0 341 327 A 70 ASP H A 69 MET HGy 1.0 0.0 6.0 342 328 A 92 GLU H A 88 GLN HGy 1.0 0.0 6.0 343 329 A 87 ASP H A 85 SER HBx 1.0 0.0 6.0 344 330 A 62 GLY H A 85 SER HBx 1.0 0.0 5.0 345 331 A 46 GLY H A 74 ASN HBx 1.0 0.0 4.0 346 332 A 86 ALA H A 85 SER HBx 1.0 0.0 4.0 347 333 A 83 MET H A 84 GLU HGy 1.0 0.0 6.0 348 334 A 82 LYS H A 81 GLU HGy 1.0 0.0 6.0 349 335 A 54 LEU H A 51 PRO HBy 1.0 0.0 6.0 350 336 A 52 THR H A 51 PRO HBy 1.0 0.0 4.0 351 337 A 89 ALA H A 88 GLN HGx 1.0 0.0 5.0 352 338 A 79 THR H A 66 ASP HBx 1.0 0.0 5.0 353 339 A 70 ASP H A 73 ARG HBx 1.0 0.0 6.0 354 339 A 70 ASP H A 73 ARG HBy 1.0 0.0 6.0 355 340 A 74 ASN H A 73 ARG HBx 1.0 0.0 5.0 356 340 A 74 ASN H A 73 ARG HBy 1.0 0.0 5.0 357 341 A 93 LEU H A 92 GLU HGx 1.0 0.0 5.0 358 342 A 67 LEU H A 66 ASP HBx 1.0 0.0 5.0 359 343 A 53 LEU H A 51 PRO HGx 1.0 0.0 6.0 360 344 A 52 THR H A 51 PRO HGx 1.0 0.0 4.0 361 345 A 75 CYS H A 73 ARG HBx 1.0 0.0 4.0 362 345 A 75 CYS H A 73 ARG HBy 1.0 0.0 4.0 363 346 A 48 ASP H A 49 MET HGy 1.0 0.0 6.0 364 347 A 63 ASN H A 81 GLU HBx 1.0 0.0 5.0 365 348 A 63 ASN HD21 A 81 GLU HBx 1.0 0.0 6.0 366 349 A 97 GLN HE22 A 102 GLN HGx 1.0 0.0 6.0 367 349 A 97 GLN HE22 A 102 GLN HGy 1.0 0.0 6.0 368 350 A 100 SER H A 99 GLU HBx 1.0 0.0 4.0 369 350 A 100 SER H A 99 GLU HBy 1.0 0.0 4.0 370 351 A 74 ASN HD21 A 47 GLU HGx 1.0 0.0 6.0 371 352 A 85 SER H A 82 LYS HBx 1.0 0.0 4.0 372 353 A 74 ASN HD22 A 47 GLU HGx 1.0 0.0 6.0 373 354 A 88 GLN H A 90 VAL HB 1.0 0.0 6.0 374 355 A 40 ASN HD21 A 83 MET HBy 1.0 0.0 6.0 375 356 A 55 ARG H A 51 PRO HBx 1.0 0.0 6.0 376 357 A 98 VAL H A 97 GLN HGx 1.0 0.0 3.0 377 357 A 98 VAL H A 97 GLN HGy 1.0 0.0 3.0 378 358 A 101 VAL H A 97 GLN HGx 1.0 0.0 4.0 379 358 A 101 VAL H A 97 GLN HGy 1.0 0.0 4.0 380 359 A 53 LEU H A 51 PRO HBx 1.0 0.0 6.0 381 360 A 52 THR H A 51 PRO HBx 1.0 0.0 4.0 382 361 A 73 ARG H A 72 PRO HGx 1.0 0.0 5.0 383 362 A 102 GLN HE22 A 97 GLN HGx 1.0 0.0 6.0 384 362 A 97 GLN HGy A 102 GLN HE22 1.0 0.0 6.0 385 363 A 77 PHE H A 69 MET HBx 1.0 0.0 5.0 386 363 A 77 PHE H A 69 MET HBy 1.0 0.0 5.0 387 364 A 70 ASP H A 69 MET HBx 1.0 0.0 4.0 388 364 A 70 ASP H A 69 MET HBy 1.0 0.0 4.0 389 365 A 37 ARG H A 36 PRO HGx 1.0 0.0 5.0 390 365 A 37 ARG H A 36 PRO HGy 1.0 0.0 5.0 391 366 A 96 THR H A 103 LEU HBy 1.0 0.0 5.0 392 367 A 85 SER H A 82 LYS HBy 1.0 0.0 4.0 393 368 A 86 ALA H A 82 LYS HBy 1.0 0.0 6.0 394 369 A 106 ASN H A 105 VAL HB 1.0 0.0 5.0 395 370 A 79 THR H A 64 ILE HG1y 1.0 0.0 6.0 396 371 A 95 GLY H A 105 VAL HB 1.0 0.0 6.0 397 372 A 108 ALA H A 107 ILE HB 1.0 0.0 5.0 398 373 A 39 GLY H A 38 LYS HBy 1.0 0.0 4.0 399 374 A 81 GLU H A 64 ILE HG1y 1.0 0.0 6.0 400 375 A 96 THR H A 97 GLN HBx 1.0 0.0 6.0 401 376 A 57 ALA H A 55 ARG HBy 1.0 0.0 6.0 402 377 A 52 THR H A 53 LEU HBy 1.0 0.0 6.0 403 378 A 43 TYR H A 42 LEU HG 1.0 0.0 6.0 404 379 A 99 GLU H A 98 VAL HB 1.0 0.0 4.0 405 380 A 80 TYR H A 42 LEU HG 1.0 0.0 6.0 406 381 A 78 VAL H A 42 LEU HG 1.0 0.0 5.0 407 382 A 100 SER H A 98 VAL HB 1.0 0.0 4.0 408 383 A 102 GLN H A 103 LEU HG 1.0 0.0 6.0 409 384 A 46 GLY H A 49 MET HGx 1.0 0.0 5.0 410 385 A 61 PHE H A 60 PRO HGx 1.0 0.0 5.0 411 385 A 61 PHE H A 60 PRO HGy 1.0 0.0 5.0 412 386 A 68 SER H A 67 LEU HBy 1.0 0.0 5.0 413 387 A 65 ILE H A 64 ILE HB 1.0 0.0 5.0 414 388 A 74 ASN H A 72 PRO HBx 1.0 0.0 6.0 415 389 A 73 ARG H A 72 PRO HBx 1.0 0.0 4.0 416 390 A 91 ALA H A 92 GLU HBx 1.0 0.0 6.0 417 391 A 77 PHE H A 49 MET HE% 1.0 0.0 6.0 418 392 A 47 GLU H A 49 MET HE% 1.0 0.0 6.0 419 393 A 80 TYR H A 86 ALA HB% 1.0 0.0 5.0 420 394 A 76 ALA H A 49 MET HE% 1.0 0.0 4.0 421 395 A 108 ALA H A 107 ILE HG1y 1.0 0.0 6.0 422 396 A 70 ASP H A 49 MET HE% 1.0 0.0 5.0 423 397 A 78 VAL H A 42 LEU HBy 1.0 0.0 4.0 424 398 A 40 ASN H A 86 ALA HB% 1.0 0.0 5.0 425 399 A 90 VAL H A 86 ALA HB% 1.0 0.0 5.0 426 400 A 87 ASP H A 86 ALA HB% 1.0 0.0 3.0 427 401 A 88 GLN H A 86 ALA HB% 1.0 0.0 5.0 428 402 A 46 GLY H A 49 MET HE% 1.0 0.0 3.0 429 403 A 40 ASN HD21 A 86 ALA HB% 1.0 0.0 5.0 430 404 A 75 CYS H A 49 MET HE% 1.0 0.0 5.0 431 405 A 41 THR H A 86 ALA HB% 1.0 0.0 6.0 432 406 A 56 GLY H A 55 ARG HGx 1.0 0.0 5.0 433 407 A 81 GLU H A 82 LYS HGx 1.0 0.0 6.0 434 408 A 92 GLU H A 91 ALA HB% 1.0 0.0 3.0 435 409 A 94 ASN H A 91 ALA HB% 1.0 0.0 6.0 436 410 A 43 TYR H A 108 ALA HB% 1.0 0.0 5.0 437 411 A 45 TYR H A 44 VAL HB 1.0 0.0 5.0 438 412 A 88 GLN H A 89 ALA HB% 1.0 0.0 5.0 439 413 A 77 PHE H A 67 LEU HDy% 1.0 0.0 6.0 440 414 A 39 GLY H A 38 LYS HDx 1.0 0.0 6.0 441 414 A 39 GLY H A 38 LYS HDy 1.0 0.0 6.0 442 415 A 90 VAL H A 89 ALA HB% 1.0 0.0 3.0 443 416 A 87 ASP H A 89 ALA HB% 1.0 0.0 5.0 444 417 A 62 GLY H A 89 ALA HB% 1.0 0.0 6.0 445 418 A 61 PHE H A 89 ALA HB% 1.0 0.0 5.0 446 419 A 55 ARG H A 57 ALA HB% 1.0 0.0 6.0 447 420 A 79 THR H A 78 VAL HB 1.0 0.0 5.0 448 421 A 106 ASN H A 42 LEU HBx 1.0 0.0 5.0 449 422 A 59 SER H A 57 ALA HB% 1.0 0.0 5.0 450 423 A 58 PHE H A 57 ALA HB% 1.0 0.0 4.0 451 424 A 56 GLY H A 57 ALA HB% 1.0 0.0 5.0 452 425 A 92 GLU H A 93 LEU HG 1.0 0.0 6.0 453 426 A 94 ASN H A 93 LEU HG 1.0 0.0 5.0 454 427 A 49 MET H A 50 THR HG2% 1.0 0.0 6.0 455 428 A 42 LEU H A 41 THR HG2% 1.0 0.0 3.0 456 429 A 55 ARG H A 54 LEU HBx 1.0 0.0 4.0 457 430 A 95 GLY H A 103 LEU HBx 1.0 0.0 6.0 458 431 A 77 PHE H A 41 THR HG2% 1.0 0.0 6.0 459 432 A 108 ALA H A 41 THR HG2% 1.0 0.0 5.0 460 433 A 78 VAL H A 41 THR HG2% 1.0 0.0 4.0 461 434 A 97 GLN H A 96 THR HG2% 1.0 0.0 5.0 462 435 A 81 GLU H A 79 THR HG2% 1.0 0.0 5.0 463 436 A 40 ASN H A 79 THR HG2% 1.0 0.0 4.0 464 437 A 67 LEU H A 65 ILE HG1y 1.0 0.0 6.0 465 438 A 40 ASN HD21 A 42 LEU HDx% 1.0 0.0 5.0 466 439 A 104 LYS H A 103 LEU HBx 1.0 0.0 5.0 467 440 A 40 ASN HD22 A 42 LEU HDx% 1.0 0.0 5.0 468 441 A 69 MET H A 76 ALA HB% 1.0 0.0 5.0 469 442 A 77 PHE H A 76 ALA HB% 1.0 0.0 3.0 470 443 A 68 SER H A 76 ALA HB% 1.0 0.0 5.0 471 444 A 70 ASP H A 76 ALA HB% 1.0 0.0 4.0 472 445 A 88 GLN H A 90 VAL HGy% 1.0 0.0 6.0 473 446 A 41 THR H A 107 ILE HG2% 1.0 0.0 6.0 474 447 A 86 ALA H A 42 LEU HDy% 1.0 0.0 5.0 475 448 A 108 ALA H A 107 ILE HG2% 1.0 0.0 3.0 476 449 A 40 ASN H A 65 ILE HG2% 1.0 0.0 6.0 477 450 A 97 GLN H A 98 VAL HGy% 1.0 0.0 5.0 478 451 A 63 ASN HD21 A 65 ILE HG2% 1.0 0.0 6.0 479 452 A 45 TYR H A 44 VAL HGx% 1.0 0.0 3.0 480 453 A 76 ALA H A 44 VAL HGx% 1.0 0.0 5.0 481 454 A 104 LYS H A 101 VAL HGy% 1.0 0.0 6.0 482 455 A 77 PHE H A 67 LEU HDx% 1.0 0.0 5.0 483 456 A 80 TYR H A 65 ILE HD1% 1.0 0.0 6.0 484 457 A 59 SER H A 64 ILE HD1% 1.0 0.0 4.0 485 458 A 58 PHE H A 64 ILE HD1% 1.0 0.0 4.0 486 459 A 102 GLN H A 101 VAL HGy% 1.0 0.0 3.0 487 460 A 40 ASN H A 65 ILE HD1% 1.0 0.0 5.0 488 461 A 49 MET H A 101 VAL HGy% 1.0 0.0 6.0 489 462 A 62 GLY H A 64 ILE HD1% 1.0 0.0 6.0 490 463 A 69 MET H A 67 LEU HDx% 1.0 0.0 6.0 491 464 A 55 ARG H A 67 LEU HDx% 1.0 0.0 5.0 492 465 A 68 SER H A 67 LEU HDx% 1.0 0.0 4.0 493 466 A 98 VAL H A 103 LEU HDy% 1.0 0.0 6.0 494 467 A 92 GLU H A 93 LEU HDx% 1.0 0.0 6.0 495 468 A 94 ASN H A 93 LEU HDx% 1.0 0.0 5.0 496 469 A 104 LYS H A 103 LEU HDy% 1.0 0.0 5.0 497 470 A 101 VAL H A 103 LEU HDy% 1.0 0.0 6.0 498 471 A 50 THR H A 54 LEU HDy% 1.0 0.0 6.0 499 472 A 55 ARG H A 54 LEU HDy% 1.0 0.0 5.0 500 473 A 79 THR H A 64 ILE HG2% 1.0 0.0 3.0 501 474 A 65 ILE H A 64 ILE HG2% 1.0 0.0 3.0 502 475 A 81 GLU H A 64 ILE HG2% 1.0 0.0 6.0 503 476 A 67 LEU H A 64 ILE HG2% 1.0 0.0 5.0 504 477 A 66 ASP H A 64 ILE HG2% 1.0 0.0 3.0 505 478 A 106 ASN H A 44 VAL HGy% 1.0 0.0 5.0 506 479 A 45 TYR H A 44 VAL HGy% 1.0 0.0 5.0 507 480 A 76 ALA H A 44 VAL HGy% 1.0 0.0 5.0 508 481 A 78 VAL H A 44 VAL HGy% 1.0 0.0 4.0 509 482 A 62 GLY H A 60 PRO HBy 1.0 0.0 6.0 510 483 A 61 PHE H A 60 PRO HBy 1.0 0.0 4.0 511 484 A 65 ILE H A 78 VAL HGx% 1.0 0.0 6.0 512 485 A 59 SER H A 78 VAL HGx% 1.0 0.0 6.0 513 486 A 79 THR H A 78 VAL HGx% 1.0 0.0 3.0 514 487 A 80 TYR H A 78 VAL HGx% 1.0 0.0 5.0 515 488 A 58 PHE H A 78 VAL HGx% 1.0 0.0 5.0 516 489 A 66 ASP H A 78 VAL HGx% 1.0 0.0 5.0 517 490 A 79 THR H A 78 VAL HGy% 1.0 0.0 5.0 518 491 A 77 PHE H A 78 VAL HGy% 1.0 0.0 5.0 519 492 A 68 SER H A 78 VAL HGy% 1.0 0.0 5.0 520 493 A 58 PHE H A 93 LEU HDy% 1.0 0.0 5.0 521 494 A 92 GLU H A 93 LEU HDy% 1.0 0.0 6.0 522 495 A 89 ALA H A 93 LEU HDy% 1.0 0.0 6.0 523 496 A 94 ASN H A 93 LEU HDy% 1.0 0.0 6.0 524 497 A 57 ALA H A 93 LEU HDy% 1.0 0.0 6.0 525 498 A 106 ASN H A 106 ASN HD21 1.0 0.0 6.0 526 499 A 58 PHE H A 58 PHE HD% 1.0 0.0 3.0 527 500 A 77 PHE H A 77 PHE HE% 1.0 0.0 5.0 528 501 A 61 PHE H A 61 PHE HD% 1.0 0.0 3.0 529 502 A 40 ASN H A 40 ASN HD21 1.0 0.0 6.0 530 503 A 45 TYR H A 45 TYR HD% 1.0 0.0 5.0 531 504 A 77 PHE H A 77 PHE HD% 1.0 0.0 3.0 532 505 A 58 PHE H A 58 PHE HE% 1.0 0.0 5.0 533 506 A 74 ASN H A 74 ASN HD22 1.0 0.0 6.0 534 507 A 43 TYR H A 43 TYR HD% 1.0 0.0 5.0 535 508 A 80 TYR H A 80 TYR HD% 1.0 0.0 5.0 536 509 A 80 TYR H A 80 TYR HE% 1.0 0.0 6.0 537 510 A 75 CYS H A 75 CYS HA 1.0 0.0 4.0 538 511 A 77 PHE H A 77 PHE HA 1.0 0.0 4.0 539 512 A 41 THR H A 41 THR HA 1.0 0.0 4.0 540 513 A 105 VAL H A 105 VAL HA 1.0 0.0 4.0 541 514 A 79 THR H A 79 THR HA 1.0 0.0 4.0 542 515 A 97 GLN H A 97 GLN HA 1.0 0.0 4.0 543 516 A 70 ASP H A 70 ASP HA 1.0 0.0 4.0 544 517 A 106 ASN HD21 A 106 ASN HA 1.0 0.0 5.0 545 518 A 106 ASN HA A 106 ASN HD22 1.0 0.0 5.0 546 519 A 42 LEU H A 42 LEU HA 1.0 0.0 4.0 547 520 A 67 LEU H A 67 LEU HA 1.0 0.0 4.0 548 521 A 82 LYS H A 82 LYS HA 1.0 0.0 4.0 549 522 A 63 ASN H A 63 ASN HA 1.0 0.0 4.0 550 523 A 40 ASN H A 40 ASN HA 1.0 0.0 4.0 551 524 A 76 ALA H A 76 ALA HA 1.0 0.0 4.0 552 525 A 43 TYR H A 43 TYR HA 1.0 0.0 4.0 553 526 A 66 ASP H A 66 ASP HA 1.0 0.0 4.0 554 527 A 50 THR H A 50 THR HB 1.0 0.0 6.0 555 528 A 96 THR H A 96 THR HA 1.0 0.0 4.0 556 529 A 102 GLN H A 102 GLN HA 1.0 0.0 4.0 557 530 A 38 LYS H A 38 LYS HA 1.0 0.0 4.0 558 531 A 113 MET H A 113 MET HA 1.0 0.0 4.0 559 532 A 65 ILE H A 65 ILE HA 1.0 0.0 4.0 560 533 A 108 ALA H A 108 ALA HA 1.0 0.0 4.0 561 534 A 94 ASN HA A 94 ASN HD21 1.0 0.0 5.0 562 535 A 94 ASN H A 94 ASN HA 1.0 0.0 4.0 563 536 A 94 ASN HD22 A 94 ASN HA 1.0 0.0 5.0 564 537 A 74 ASN H A 74 ASN HA 1.0 0.0 3.0 565 538 A 37 ARG H A 37 ARG HA 1.0 0.0 4.0 566 539 A 92 GLU H A 92 GLU HA 1.0 0.0 4.0 567 540 A 87 ASP H A 87 ASP HA 1.0 0.0 3.0 568 541 A 74 ASN HA A 74 ASN HD22 1.0 0.0 5.0 569 542 A 78 VAL H A 78 VAL HA 1.0 0.0 4.0 570 543 A 74 ASN HA A 74 ASN HD21 1.0 0.0 5.0 571 544 A 48 ASP H A 48 ASP HA 1.0 0.0 3.0 572 545 A 100 SER H A 100 SER HA 1.0 0.0 4.0 573 546 A 84 GLU H A 84 GLU HA 1.0 0.0 3.0 574 547 A 107 ILE H A 107 ILE HA 1.0 0.0 4.0 575 548 A 49 MET H A 49 MET HA 1.0 0.0 4.0 576 549 A 52 THR H A 52 THR HB 1.0 0.0 3.0 577 550 A 91 ALA H A 91 ALA HA 1.0 0.0 4.0 578 551 A 85 SER H A 85 SER HA 1.0 0.0 3.0 579 552 A 64 ILE H A 64 ILE HA 1.0 0.0 4.0 580 553 A 62 GLY H A 62 GLY HAx 1.0 0.0 3.0 581 554 A 83 MET H A 83 MET HA 1.0 0.0 3.0 582 555 A 41 THR H A 41 THR HB 1.0 0.0 3.0 583 556 A 100 SER H A 100 SER HBx 1.0 0.0 4.0 584 556 A 100 SER H A 100 SER HBy 1.0 0.0 4.0 585 557 A 88 GLN HE21 A 88 GLN HA 1.0 0.0 6.0 586 558 A 52 THR H A 52 THR HA 1.0 0.0 3.0 587 559 A 95 GLY H A 95 GLY HAx 1.0 0.0 4.0 588 560 A 55 ARG H A 55 ARG HA 1.0 0.0 3.0 589 561 A 68 SER H A 68 SER HBx 1.0 0.0 3.0 590 561 A 68 SER H A 68 SER HBy 1.0 0.0 3.0 591 562 A 46 GLY H A 46 GLY HAx 1.0 0.0 3.0 592 562 A 46 GLY H A 46 GLY HAy 1.0 0.0 3.0 593 563 A 79 THR H A 79 THR HB 1.0 0.0 3.0 594 564 A 99 GLU H A 99 GLU HA 1.0 0.0 3.0 595 565 A 80 TYR H A 80 TYR HBy 1.0 0.0 4.0 596 566 A 70 ASP H A 70 ASP HBy 1.0 0.0 4.0 597 567 A 85 SER H A 85 SER HBy 1.0 0.0 3.0 598 568 A 61 PHE H A 61 PHE HBy 1.0 0.0 4.0 599 569 A 90 VAL H A 90 VAL HA 1.0 0.0 3.0 600 570 A 58 PHE H A 58 PHE HBy 1.0 0.0 4.0 601 571 A 94 ASN HBy A 94 ASN HD21 1.0 0.0 3.0 602 572 A 94 ASN H A 94 ASN HBy 1.0 0.0 3.0 603 573 A 55 ARG H A 55 ARG HDy 1.0 0.0 5.0 604 574 A 55 ARG H A 55 ARG HDx 1.0 0.0 6.0 605 575 A 94 ASN HBx A 94 ASN HD21 1.0 0.0 4.0 606 576 A 94 ASN H A 94 ASN HBx 1.0 0.0 3.0 607 577 A 94 ASN HD22 A 94 ASN HBx 1.0 0.0 4.0 608 578 A 58 PHE H A 58 PHE HBx 1.0 0.0 3.0 609 579 A 40 ASN H A 40 ASN HBy 1.0 0.0 4.0 610 580 A 40 ASN HD21 A 40 ASN HBy 1.0 0.0 3.0 611 581 A 40 ASN HD22 A 40 ASN HBy 1.0 0.0 4.0 612 582 A 63 ASN H A 63 ASN HBx 1.0 0.0 3.0 613 582 A 63 ASN H A 63 ASN HBy 1.0 0.0 3.0 614 583 A 63 ASN HD21 A 63 ASN HBx 1.0 0.0 3.0 615 583 A 63 ASN HD21 A 63 ASN HBy 1.0 0.0 3.0 616 584 A 63 ASN HD22 A 63 ASN HBx 1.0 0.0 4.0 617 584 A 63 ASN HBy A 63 ASN HD22 1.0 0.0 4.0 618 585 A 106 ASN HD22 A 106 ASN HBy 1.0 0.0 4.0 619 586 A 45 TYR H A 45 TYR HBx 1.0 0.0 3.0 620 586 A 45 TYR H A 45 TYR HBy 1.0 0.0 3.0 621 587 A 48 ASP H A 48 ASP HBy 1.0 0.0 4.0 622 588 A 74 ASN H A 74 ASN HBy 1.0 0.0 4.0 623 589 A 40 ASN HD21 A 40 ASN HBx 1.0 0.0 3.0 624 590 A 74 ASN HD21 A 74 ASN HBy 1.0 0.0 4.0 625 591 A 74 ASN HD22 A 74 ASN HBy 1.0 0.0 4.0 626 592 A 40 ASN HD22 A 40 ASN HBx 1.0 0.0 4.0 627 593 A 106 ASN H A 106 ASN HBx 1.0 0.0 4.0 628 594 A 106 ASN HD21 A 106 ASN HBx 1.0 0.0 4.0 629 595 A 106 ASN HBx A 106 ASN HD22 1.0 0.0 4.0 630 596 A 77 PHE H A 77 PHE HBx 1.0 0.0 3.0 631 596 A 77 PHE H A 77 PHE HBy 1.0 0.0 3.0 632 597 A 80 TYR H A 80 TYR HBx 1.0 0.0 3.0 633 598 A 48 ASP H A 48 ASP HBx 1.0 0.0 4.0 634 599 A 83 MET H A 83 MET HGx 1.0 0.0 4.0 635 599 A 83 MET H A 83 MET HGy 1.0 0.0 4.0 636 600 A 75 CYS H A 75 CYS HBx 1.0 0.0 4.0 637 601 A 69 MET H A 69 MET HGy 1.0 0.0 4.0 638 602 A 88 GLN HE21 A 88 GLN HGy 1.0 0.0 4.0 639 603 A 88 GLN HGy A 88 GLN HE22 1.0 0.0 5.0 640 604 A 74 ASN H A 74 ASN HBx 1.0 0.0 5.0 641 605 A 74 ASN HD22 A 74 ASN HBx 1.0 0.0 4.0 642 606 A 84 GLU H A 84 GLU HGy 1.0 0.0 4.0 643 607 A 81 GLU H A 81 GLU HGy 1.0 0.0 5.0 644 608 A 84 GLU H A 84 GLU HGx 1.0 0.0 4.0 645 609 A 69 MET H A 69 MET HGx 1.0 0.0 5.0 646 610 A 88 GLN H A 88 GLN HGx 1.0 0.0 5.0 647 611 A 73 ARG H A 73 ARG HBx 1.0 0.0 4.0 648 611 A 73 ARG H A 73 ARG HBy 1.0 0.0 4.0 649 612 A 92 GLU H A 92 GLU HGx 1.0 0.0 5.0 650 613 A 66 ASP H A 66 ASP HBx 1.0 0.0 4.0 651 614 A 81 GLU H A 81 GLU HBx 1.0 0.0 3.0 652 615 A 49 MET H A 49 MET HGy 1.0 0.0 4.0 653 616 A 102 GLN HE22 A 102 GLN HGx 1.0 0.0 4.0 654 616 A 102 GLN HGy A 102 GLN HE22 1.0 0.0 4.0 655 617 A 99 GLU H A 99 GLU HBx 1.0 0.0 3.0 656 617 A 99 GLU H A 99 GLU HBy 1.0 0.0 3.0 657 618 A 90 VAL H A 90 VAL HB 1.0 0.0 3.0 658 619 A 97 GLN H A 97 GLN HGx 1.0 0.0 5.0 659 619 A 97 GLN H A 97 GLN HGy 1.0 0.0 5.0 660 620 A 88 GLN HE22 A 88 GLN HBx 1.0 0.0 6.0 661 621 A 97 GLN HE22 A 97 GLN HGx 1.0 0.0 4.0 662 621 A 97 GLN HE22 A 97 GLN HGy 1.0 0.0 4.0 663 622 A 69 MET H A 69 MET HBx 1.0 0.0 3.0 664 622 A 69 MET H A 69 MET HBy 1.0 0.0 3.0 665 623 A 103 LEU H A 103 LEU HBy 1.0 0.0 4.0 666 624 A 49 MET H A 49 MET HBy 1.0 0.0 4.0 667 625 A 102 GLN H A 102 GLN HBx 1.0 0.0 3.0 668 626 A 82 LYS H A 82 LYS HBy 1.0 0.0 4.0 669 627 A 105 VAL H A 105 VAL HB 1.0 0.0 3.0 670 628 A 107 ILE H A 107 ILE HB 1.0 0.0 3.0 671 629 A 53 LEU H A 53 LEU HBy 1.0 0.0 3.0 672 630 A 97 GLN HE22 A 97 GLN HBx 1.0 0.0 5.0 673 631 A 42 LEU H A 42 LEU HG 1.0 0.0 4.0 674 632 A 47 GLU H A 47 GLU HBx 1.0 0.0 4.0 675 633 A 64 ILE H A 64 ILE HG1y 1.0 0.0 4.0 676 634 A 97 GLN H A 97 GLN HBy 1.0 0.0 3.0 677 635 A 103 LEU H A 103 LEU HG 1.0 0.0 5.0 678 636 A 49 MET H A 49 MET HGx 1.0 0.0 3.0 679 637 A 64 ILE H A 64 ILE HB 1.0 0.0 3.0 680 638 A 93 LEU H A 93 LEU HBy 1.0 0.0 3.0 681 639 A 92 GLU H A 92 GLU HBx 1.0 0.0 3.0 682 640 A 37 ARG H A 37 ARG HGx 1.0 0.0 4.0 683 640 A 37 ARG H A 37 ARG HGy 1.0 0.0 4.0 684 641 A 49 MET H A 49 MET HE% 1.0 0.0 5.0 685 642 A 107 ILE H A 107 ILE HG1y 1.0 0.0 4.0 686 643 A 86 ALA H A 86 ALA HB% 1.0 0.0 3.0 687 644 A 55 ARG H A 55 ARG HGx 1.0 0.0 5.0 688 645 A 104 LYS H A 104 LYS HGy 1.0 0.0 5.0 689 646 A 91 ALA H A 91 ALA HB% 1.0 0.0 3.0 690 647 A 108 ALA H A 108 ALA HB% 1.0 0.0 3.0 691 648 A 38 LYS H A 38 LYS HDx 1.0 0.0 5.0 692 648 A 38 LYS H A 38 LYS HDy 1.0 0.0 5.0 693 649 A 49 MET H A 49 MET HBx 1.0 0.0 4.0 694 650 A 67 LEU H A 67 LEU HDy% 1.0 0.0 5.0 695 651 A 89 ALA H A 89 ALA HB% 1.0 0.0 3.0 696 652 A 107 ILE H A 107 ILE HG1x 1.0 0.0 4.0 697 653 A 57 ALA H A 57 ALA HB% 1.0 0.0 3.0 698 654 A 67 LEU H A 67 LEU HBx 1.0 0.0 4.0 699 655 A 41 THR H A 41 THR HG2% 1.0 0.0 4.0 700 656 A 54 LEU H A 54 LEU HBx 1.0 0.0 4.0 701 657 A 96 THR H A 96 THR HG2% 1.0 0.0 3.0 702 658 A 103 LEU H A 103 LEU HBx 1.0 0.0 4.0 703 659 A 76 ALA H A 76 ALA HB% 1.0 0.0 3.0 704 660 A 42 LEU H A 42 LEU HDy% 1.0 0.0 4.0 705 661 A 107 ILE H A 107 ILE HG2% 1.0 0.0 4.0 706 662 A 98 VAL H A 98 VAL HGy% 1.0 0.0 3.0 707 663 A 44 VAL H A 44 VAL HGx% 1.0 0.0 4.0 708 664 A 67 LEU H A 67 LEU HDx% 1.0 0.0 5.0 709 665 A 103 LEU H A 103 LEU HDy% 1.0 0.0 4.0 710 666 A 93 LEU H A 93 LEU HDx% 1.0 0.0 4.0 711 667 A 54 LEU H A 54 LEU HDy% 1.0 0.0 4.0 712 668 A 64 ILE H A 64 ILE HG2% 1.0 0.0 4.0 713 669 A 44 VAL H A 44 VAL HGy% 1.0 0.0 4.0 714 670 A 64 ILE H A 64 ILE HG1x 1.0 0.0 4.0 715 671 A 78 VAL H A 78 VAL HGx% 1.0 0.0 4.0 716 672 A 78 VAL H A 78 VAL HGy% 1.0 0.0 3.0 717 673 A 93 LEU H A 93 LEU HDy% 1.0 0.0 4.0 718 674 A 42 LEU H A 79 THR HA 1.0 0.0 4.0 719 675 A 80 TYR HH A 61 PHE HA 1.0 0.0 5.0 720 676 A 80 TYR HH A 58 PHE HBy 1.0 0.0 3.0 721 677 A 80 TYR HH A 61 PHE HBx 1.0 0.0 3.0 722 678 A 84 GLU H A 82 LYS HBx 1.0 0.0 4.0 723 679 A 84 GLU H A 83 MET HBx 1.0 0.0 6.0 724 680 A 84 GLU H A 83 MET HBy 1.0 0.0 4.0 725 681 A 80 TYR HH A 89 ALA HB% 1.0 0.0 5.0 726 682 A 80 TYR HH A 64 ILE HD1% 1.0 0.0 5.0 727 683 A 43 TYR H A 108 ALA HA 1.0 0.0 6.0 728 684 A 43 TYR H A 42 LEU HBx 1.0 0.0 3.0 729 685 A 106 ASN H A 42 LEU HDy% 1.0 0.0 6.0 730 686 A 105 VAL H A 104 LYS HA 1.0 0.0 3.0 731 687 A 69 MET H A 76 ALA HA 1.0 0.0 5.0 732 688 A 105 VAL H A 94 ASN HBy 1.0 0.0 5.0 733 689 A 55 ARG H A 54 LEU HA 1.0 0.0 4.0 734 690 A 55 ARG H A 52 THR HA 1.0 0.0 5.0 735 691 A 55 ARG H A 54 LEU HBy 1.0 0.0 3.0 736 692 A 55 ARG H A 52 THR HG2% 1.0 0.0 5.0 737 693 A 107 ILE H A 90 VAL HGx% 1.0 0.0 6.0 738 694 A 55 ARG H A 54 LEU HDx% 1.0 0.0 5.0 739 695 A 107 ILE H A 106 ASN HA 1.0 0.0 3.0 740 696 A 107 ILE H A 106 ASN HBy 1.0 0.0 3.0 741 697 A 79 THR H A 66 ASP HBy 1.0 0.0 6.0 742 698 A 79 THR H A 42 LEU HDy% 1.0 0.0 6.0 743 699 A 95 GLY H A 96 THR HA 1.0 0.0 6.0 744 700 A 98 VAL H A 102 GLN HGx 1.0 0.0 5.0 745 700 A 98 VAL H A 102 GLN HGy 1.0 0.0 5.0 746 701 A 95 GLY H A 105 VAL HGy% 1.0 0.0 5.0 747 702 A 95 GLY H A 96 THR HG2% 1.0 0.0 6.0 748 703 A 47 GLU H A 101 VAL HGy% 1.0 0.0 4.0 749 704 A 64 ILE H A 63 ASN HA 1.0 0.0 3.0 750 705 A 76 ALA H A 43 TYR HA 1.0 0.0 5.0 751 706 A 80 TYR H A 40 ASN HBy 1.0 0.0 4.0 752 707 A 80 TYR H A 40 ASN HBx 1.0 0.0 5.0 753 708 A 76 ALA H A 75 CYS HBx 1.0 0.0 5.0 754 709 A 47 GLU H A 49 MET HGy 1.0 0.0 5.0 755 710 A 103 LEU H A 102 GLN HGx 1.0 0.0 5.0 756 710 A 103 LEU H A 102 GLN HGy 1.0 0.0 5.0 757 711 A 104 LYS H A 105 VAL HGy% 1.0 0.0 5.0 758 712 A 108 ALA H A 107 ILE HD1% 1.0 0.0 5.0 759 713 A 70 ASP H A 69 MET HGx 1.0 0.0 6.0 760 714 A 82 LYS H A 81 GLU HBy 1.0 0.0 4.0 761 715 A 59 SER H A 55 ARG HA 1.0 0.0 5.0 762 716 A 59 SER H A 60 PRO HDy 1.0 0.0 4.0 763 717 A 59 SER H A 60 PRO HDx 1.0 0.0 4.0 764 718 A 82 LYS H A 81 GLU HGx 1.0 0.0 6.0 765 719 A 81 GLU H A 62 GLY HAy 1.0 0.0 6.0 766 719 A 81 GLU H A 62 GLY HAx 1.0 0.0 6.0 767 720 A 81 GLU H A 64 ILE HA 1.0 0.0 4.0 768 721 A 81 GLU H A 63 ASN HBx 1.0 0.0 5.0 769 721 A 81 GLU H A 63 ASN HBy 1.0 0.0 5.0 770 722 A 81 GLU H A 80 TYR HBx 1.0 0.0 5.0 771 723 A 48 ASP H A 47 GLU HGx 1.0 0.0 5.0 772 724 A 48 ASP H A 47 GLU HBy 1.0 0.0 6.0 773 725 A 48 ASP H A 47 GLU HBx 1.0 0.0 4.0 774 726 A 81 GLU H A 65 ILE HG2% 1.0 0.0 5.0 775 727 A 40 ASN H A 39 GLY HAx 1.0 0.0 3.0 776 727 A 40 ASN H A 39 GLY HAy 1.0 0.0 3.0 777 728 A 36 PRO HA A 35 ALA H 1.0 0.0 6.0 778 729 A 100 SER H A 99 GLU HGy 1.0 0.0 6.0 779 730 A 100 SER H A 99 GLU HGx 1.0 0.0 5.0 780 731 A 40 ASN H A 42 LEU HDy% 1.0 0.0 5.0 781 732 A 93 LEU H A 92 GLU HGy 1.0 0.0 5.0 782 733 A 93 LEU H A 92 GLU HBy 1.0 0.0 4.0 783 734 A 93 LEU H A 91 ALA HB% 1.0 0.0 5.0 784 735 A 44 VAL H A 43 TYR HA 1.0 0.0 3.0 785 736 A 93 LEU H A 92 GLU HBx 1.0 0.0 3.0 786 737 A 56 GLY H A 55 ARG HA 1.0 0.0 4.0 787 738 A 56 GLY H A 55 ARG HBy 1.0 0.0 5.0 788 739 A 44 VAL H A 54 LEU HDx% 1.0 0.0 6.0 789 740 A 56 GLY H A 53 LEU HDy% 1.0 0.0 6.0 790 741 A 44 VAL H A 78 VAL HGy% 1.0 0.0 5.0 791 742 A 56 GLY H A 55 ARG HGy 1.0 0.0 5.0 792 743 A 56 GLY H A 52 THR HG2% 1.0 0.0 5.0 793 744 A 58 PHE HD% A 57 ALA HA 1.0 0.0 5.0 794 745 A 58 PHE HD% A 54 LEU HA 1.0 0.0 4.0 795 746 A 58 PHE HD% A 57 ALA HB% 1.0 0.0 4.0 796 747 A 58 PHE HD% A 54 LEU HDx% 1.0 0.0 4.0 797 748 A 58 PHE HD% A 44 VAL HGx% 1.0 0.0 6.0 798 749 A 58 PHE HD% A 64 ILE HD1% 1.0 0.0 4.0 799 750 A 58 PHE HD% A 44 VAL HGy% 1.0 0.0 5.0 800 751 A 58 PHE HD% A 78 VAL HGx% 1.0 0.0 4.0 801 752 A 89 ALA H A 86 ALA HB% 1.0 0.0 5.0 802 753 A 90 VAL H A 42 LEU HDy% 1.0 0.0 6.0 803 754 A 54 LEU H A 50 THR HA 1.0 0.0 6.0 804 755 A 89 ALA H A 86 ALA HA 1.0 0.0 4.0 805 756 A 89 ALA H A 88 GLN HBx 1.0 0.0 5.0 806 757 A 94 ASN H A 93 LEU HA 1.0 0.0 4.0 807 758 A 94 ASN H A 105 VAL HGy% 1.0 0.0 4.0 808 759 A 57 ALA H A 53 LEU HDy% 1.0 0.0 6.0 809 760 A 96 THR H A 95 GLY HAy 1.0 0.0 4.0 810 761 A 53 LEU H A 52 THR HB 1.0 0.0 4.0 811 762 A 87 ASP H A 86 ALA HA 1.0 0.0 4.0 812 763 A 96 THR H A 95 GLY HAx 1.0 0.0 4.0 813 764 A 57 ALA H A 56 GLY HAx 1.0 0.0 4.0 814 765 A 63 ASN HD21 A 81 GLU HBy 1.0 0.0 6.0 815 766 A 62 GLY H A 60 PRO HA 1.0 0.0 5.0 816 767 A 62 GLY H A 61 PHE HBy 1.0 0.0 6.0 817 768 A 88 GLN H A 85 SER HA 1.0 0.0 4.0 818 769 A 88 GLN H A 87 ASP HBx 1.0 0.0 4.0 819 770 A 88 GLN H A 87 ASP HBy 1.0 0.0 4.0 820 771 A 88 GLN H A 91 ALA HB% 1.0 0.0 6.0 821 772 A 66 ASP H A 65 ILE HB 1.0 0.0 5.0 822 773 A 66 ASP H A 65 ILE HD1% 1.0 0.0 5.0 823 774 A 66 ASP H A 79 THR HG2% 1.0 0.0 4.0 824 775 A 66 ASP H A 65 ILE HG2% 1.0 0.0 5.0 825 776 A 77 PHE HE% A 108 ALA HA 1.0 0.0 6.0 826 777 A 73 ARG H A 72 PRO HBy 1.0 0.0 5.0 827 778 A 61 PHE HE% A 92 GLU HGy 1.0 0.0 4.0 828 779 A 91 ALA H A 88 GLN HGx 1.0 0.0 6.0 829 780 A 61 PHE HE% A 92 GLU HGx 1.0 0.0 4.0 830 781 A 61 PHE HE% A 93 LEU HG 1.0 0.0 4.0 831 782 A 61 PHE HE% A 93 LEU HDx% 1.0 0.0 4.0 832 783 A 91 ALA H A 87 ASP HA 1.0 0.0 5.0 833 784 A 61 PHE HD% A 60 PRO HDx 1.0 0.0 5.0 834 785 A 91 ALA H A 90 VAL HB 1.0 0.0 4.0 835 786 A 91 ALA H A 90 VAL HGy% 1.0 0.0 5.0 836 787 A 91 ALA H A 90 VAL HGx% 1.0 0.0 5.0 837 788 A 61 PHE HZ A 92 GLU HA 1.0 0.0 5.0 838 789 A 61 PHE HZ A 92 GLU HGy 1.0 0.0 5.0 839 790 A 61 PHE HZ A 92 GLU HBy 1.0 0.0 4.0 840 791 A 61 PHE HZ A 92 GLU HBx 1.0 0.0 3.0 841 792 A 61 PHE HZ A 93 LEU HDx% 1.0 0.0 4.0 842 793 A 45 TYR HD% A 75 CYS HA 1.0 0.0 4.0 843 794 A 45 TYR HD% A 46 GLY HAx 1.0 0.0 4.0 844 794 A 45 TYR HD% A 46 GLY HAy 1.0 0.0 4.0 845 795 A 45 TYR HD% A 104 LYS HEx 1.0 0.0 6.0 846 795 A 45 TYR HD% A 104 LYS HEy 1.0 0.0 6.0 847 796 A 45 TYR HD% A 75 CYS HBy 1.0 0.0 4.0 848 797 A 45 TYR HD% A 75 CYS HBx 1.0 0.0 4.0 849 798 A 45 TYR HD% A 104 LYS HBy 1.0 0.0 4.0 850 799 A 77 PHE HD% A 69 MET HA 1.0 0.0 6.0 851 800 A 77 PHE HD% A 76 ALA HA 1.0 0.0 5.0 852 801 A 77 PHE HD% A 43 TYR HA 1.0 0.0 4.0 853 802 A 77 PHE HD% A 68 SER HBx 1.0 0.0 4.0 854 802 A 77 PHE HD% A 68 SER HBy 1.0 0.0 4.0 855 803 A 85 SER H A 84 GLU HGy 1.0 0.0 5.0 856 804 A 58 PHE HE% A 54 LEU HA 1.0 0.0 4.0 857 805 A 85 SER H A 84 GLU HGx 1.0 0.0 6.0 858 806 A 58 PHE HE% A 89 ALA HB% 1.0 0.0 4.0 859 807 A 58 PHE HE% A 57 ALA HB% 1.0 0.0 4.0 860 808 A 58 PHE HE% A 105 VAL HGx% 1.0 0.0 4.0 861 809 A 58 PHE HE% A 42 LEU HDx% 1.0 0.0 3.0 862 810 A 58 PHE HE% A 105 VAL HGy% 1.0 0.0 5.0 863 811 A 58 PHE HE% A 42 LEU HDy% 1.0 0.0 5.0 864 812 A 58 PHE HE% A 54 LEU HDx% 1.0 0.0 3.0 865 813 A 58 PHE HE% A 44 VAL HGx% 1.0 0.0 5.0 866 814 A 58 PHE HE% A 93 LEU HDx% 1.0 0.0 5.0 867 815 A 58 PHE HE% A 103 LEU HDy% 1.0 0.0 6.0 868 816 A 58 PHE HE% A 54 LEU HDy% 1.0 0.0 6.0 869 817 A 58 PHE HE% A 44 VAL HGy% 1.0 0.0 3.0 870 818 A 58 PHE HE% A 78 VAL HGx% 1.0 0.0 5.0 871 819 A 58 PHE HE% A 78 VAL HGy% 1.0 0.0 4.0 872 820 A 45 TYR HE% A 46 GLY HAx 1.0 0.0 5.0 873 820 A 45 TYR HE% A 46 GLY HAy 1.0 0.0 5.0 874 821 A 45 TYR HE% A 104 LYS HEx 1.0 0.0 6.0 875 821 A 45 TYR HE% A 104 LYS HEy 1.0 0.0 6.0 876 822 A 45 TYR HE% A 47 GLU HGy 1.0 0.0 6.0 877 823 A 80 TYR HD% A 79 THR HA 1.0 0.0 6.0 878 824 A 80 TYR HD% A 62 GLY HAy 1.0 0.0 6.0 879 824 A 80 TYR HD% A 62 GLY HAx 1.0 0.0 6.0 880 825 A 80 TYR HD% A 64 ILE HA 1.0 0.0 4.0 881 826 A 80 TYR HD% A 42 LEU HDx% 1.0 0.0 4.0 882 827 A 80 TYR HD% A 90 VAL HGy% 1.0 0.0 6.0 883 828 A 80 TYR HD% A 42 LEU HDy% 1.0 0.0 5.0 884 829 A 80 TYR HD% A 78 VAL HGx% 1.0 0.0 4.0 885 830 A 61 PHE H A 60 PRO HA 1.0 0.0 4.0 886 831 A 86 ALA H A 83 MET HA 1.0 0.0 4.0 887 832 A 61 PHE H A 60 PRO HDy 1.0 0.0 5.0 888 833 A 61 PHE H A 60 PRO HDx 1.0 0.0 5.0 889 834 A 43 TYR HE% A 75 CYS HBy 1.0 0.0 3.0 890 835 A 86 ALA H A 87 ASP HBy 1.0 0.0 6.0 891 836 A 86 ALA H A 84 GLU HBx 1.0 0.0 5.0 892 836 A 86 ALA H A 84 GLU HBy 1.0 0.0 5.0 893 837 A 61 PHE H A 60 PRO HBx 1.0 0.0 5.0 894 838 A 80 TYR HD% A 79 THR HG2% 1.0 0.0 6.0 895 839 A 43 TYR HE% A 75 CYS HA 1.0 0.0 5.0 896 840 A 43 TYR HE% A 45 TYR HA 1.0 0.0 5.0 897 841 A 80 TYR HE% A 59 SER HA 1.0 0.0 5.0 898 842 A 80 TYR HE% A 62 GLY HAy 1.0 0.0 6.0 899 842 A 80 TYR HE% A 62 GLY HAx 1.0 0.0 6.0 900 843 A 80 TYR HE% A 86 ALA HA 1.0 0.0 4.0 901 844 A 80 TYR HE% A 89 ALA HB% 1.0 0.0 4.0 902 845 A 80 TYR HE% A 42 LEU HDx% 1.0 0.0 3.0 903 846 A 80 TYR HE% A 42 LEU HDy% 1.0 0.0 5.0 904 847 A 80 TYR HE% A 64 ILE HD1% 1.0 0.0 4.0 905 848 A 80 TYR HE% A 78 VAL HGx% 1.0 0.0 4.0 906 849 A 80 TYR HE% A 63 ASN HA 1.0 0.0 4.0 907 850 A 80 TYR HE% A 58 PHE HA 1.0 0.0 6.0 908 851 A 50 THR H A 54 LEU HA 1.0 0.0 6.0 909 852 A 50 THR H A 49 MET HA 1.0 0.0 3.0 910 853 A 50 THR H A 53 LEU HBy 1.0 0.0 4.0 911 854 A 50 THR H A 53 LEU HBx 1.0 0.0 3.0 912 855 A 50 THR H A 53 LEU HG 1.0 0.0 6.0 913 856 A 50 THR H A 49 MET HBx 1.0 0.0 5.0 914 857 A 50 THR H A 53 LEU HDx% 1.0 0.0 6.0 915 858 A 50 THR H A 53 LEU HDy% 1.0 0.0 4.0 916 859 A 75 CYS HA A 45 TYR HA 1.0 0.0 3.0 917 860 A 75 CYS HA A 44 VAL HGx% 1.0 0.0 6.0 918 861 A 77 PHE HA A 43 TYR HA 1.0 0.0 4.0 919 862 A 77 PHE HA A 78 VAL HB 1.0 0.0 5.0 920 863 A 77 PHE HA A 44 VAL HGy% 1.0 0.0 5.0 921 864 A 77 PHE HA A 78 VAL HGy% 1.0 0.0 5.0 922 865 A 77 PHE HA A 76 ALA HA 1.0 0.0 5.0 923 866 A 80 TYR HA A 81 GLU HA 1.0 0.0 5.0 924 867 A 80 TYR HA A 64 ILE HA 1.0 0.0 3.0 925 868 A 80 TYR HA A 65 ILE HG2% 1.0 0.0 5.0 926 869 A 41 THR HA A 78 VAL HGx% 1.0 0.0 5.0 927 870 A 41 THR HA A 79 THR HA 1.0 0.0 3.0 928 871 A 41 THR HA A 79 THR HG2% 1.0 0.0 4.0 929 872 A 105 VAL HA A 104 LYS HA 1.0 0.0 5.0 930 873 A 105 VAL HA A 106 ASN HBx 1.0 0.0 6.0 931 874 A 105 VAL HA A 44 VAL HGy% 1.0 0.0 4.0 932 875 A 97 GLN HA A 102 GLN HBx 1.0 0.0 6.0 933 876 A 97 GLN HA A 96 THR HA 1.0 0.0 5.0 934 877 A 97 GLN HA A 98 VAL HA 1.0 0.0 5.0 935 878 A 97 GLN HA A 102 GLN HGx 1.0 0.0 5.0 936 878 A 97 GLN HA A 102 GLN HGy 1.0 0.0 5.0 937 879 A 70 ASP HA A 72 PRO HGy 1.0 0.0 5.0 938 880 A 45 TYR HA A 75 CYS HBy 1.0 0.0 4.0 939 881 A 45 TYR HA A 75 CYS HBx 1.0 0.0 4.0 940 882 A 42 LEU HA A 43 TYR HA 1.0 0.0 5.0 941 883 A 42 LEU HA A 108 ALA HB% 1.0 0.0 5.0 942 884 A 101 VAL HGy% A 103 LEU HA 1.0 0.0 5.0 943 885 A 104 LYS HA A 94 ASN HA 1.0 0.0 4.0 944 886 A 103 LEU HA A 102 GLN HGx 1.0 0.0 6.0 945 886 A 102 GLN HGy A 103 LEU HA 1.0 0.0 6.0 946 887 A 50 THR HA A 69 MET HBx 1.0 0.0 6.0 947 887 A 50 THR HA A 69 MET HBy 1.0 0.0 6.0 948 888 A 42 LEU HA A 44 VAL HGy% 1.0 0.0 6.0 949 889 A 67 LEU HA A 78 VAL HA 1.0 0.0 3.0 950 890 A 50 THR HA A 51 PRO HDy 1.0 0.0 3.0 951 891 A 50 THR HA A 51 PRO HGy 1.0 0.0 5.0 952 892 A 67 LEU HA A 64 ILE HG2% 1.0 0.0 6.0 953 893 A 67 LEU HA A 78 VAL HGx% 1.0 0.0 4.0 954 894 A 67 LEU HA A 78 VAL HGy% 1.0 0.0 5.0 955 895 A 75 CYS HA A 44 VAL HA 1.0 0.0 6.0 956 896 A 80 TYR HA A 63 ASN HA 1.0 0.0 6.0 957 897 A 41 THR HA A 40 ASN HA 1.0 0.0 5.0 958 898 A 105 VAL HA A 44 VAL HA 1.0 0.0 3.0 959 899 A 79 THR HA A 40 ASN HA 1.0 0.0 5.0 960 900 A 45 TYR HA A 44 VAL HA 1.0 0.0 5.0 961 901 A 82 LYS HA A 81 GLU HA 1.0 0.0 5.0 962 902 A 64 ILE HA A 63 ASN HA 1.0 0.0 5.0 963 903 A 63 ASN HA A 62 GLY HAy 1.0 0.0 5.0 964 903 A 63 ASN HA A 62 GLY HAx 1.0 0.0 5.0 965 904 A 40 ASN HA A 83 MET HA 1.0 0.0 6.0 966 905 A 40 ASN HA A 41 THR HB 1.0 0.0 5.0 967 906 A 44 VAL HA A 45 TYR HBx 1.0 0.0 5.0 968 906 A 44 VAL HA A 45 TYR HBy 1.0 0.0 5.0 969 907 A 44 VAL HA A 75 CYS HBy 1.0 0.0 6.0 970 908 A 40 ASN HA A 80 TYR HBx 1.0 0.0 6.0 971 909 A 82 LYS HA A 81 GLU HGy 1.0 0.0 6.0 972 910 A 82 LYS HA A 81 GLU HGx 1.0 0.0 6.0 973 911 A 64 ILE HB A 63 ASN HA 1.0 0.0 5.0 974 912 A 40 ASN HA A 41 THR HG2% 1.0 0.0 6.0 975 913 A 40 ASN HA A 79 THR HG2% 1.0 0.0 5.0 976 914 A 44 VAL HA A 105 VAL HGx% 1.0 0.0 4.0 977 915 A 44 VAL HA A 105 VAL HGy% 1.0 0.0 5.0 978 916 A 40 ASN HA A 42 LEU HDy% 1.0 0.0 5.0 979 917 A 44 VAL HA A 103 LEU HDy% 1.0 0.0 6.0 980 918 A 64 ILE HG2% A 63 ASN HA 1.0 0.0 6.0 981 919 A 44 VAL HA A 78 VAL HGy% 1.0 0.0 6.0 982 920 A 40 ASN HA A 86 ALA HB% 1.0 0.0 5.0 983 921 A 69 MET HA A 70 ASP HA 1.0 0.0 5.0 984 922 A 69 MET HA A 70 ASP HBy 1.0 0.0 6.0 985 923 A 58 PHE HA A 57 ALA HB% 1.0 0.0 5.0 986 924 A 69 MET HA A 54 LEU HDx% 1.0 0.0 6.0 987 925 A 50 THR HB A 51 PRO HDy 1.0 0.0 3.0 988 926 A 76 ALA HA A 68 SER HBx 1.0 0.0 6.0 989 926 A 76 ALA HA A 68 SER HBy 1.0 0.0 6.0 990 927 A 43 TYR HA A 108 ALA HB% 1.0 0.0 5.0 991 928 A 38 LYS HA A 37 ARG HBx 1.0 0.0 6.0 992 928 A 38 LYS HA A 37 ARG HBy 1.0 0.0 6.0 993 929 A 102 GLN HA A 97 GLN HBy 1.0 0.0 6.0 994 930 A 97 GLN HA A 102 GLN HA 1.0 0.0 3.0 995 931 A 73 ARG HA A 74 ASN HA 1.0 0.0 6.0 996 932 A 102 GLN HA A 101 VAL HA 1.0 0.0 5.0 997 933 A 73 ARG HA A 72 PRO HGy 1.0 0.0 5.0 998 934 A 102 GLN HA A 97 GLN HGx 1.0 0.0 4.0 999 934 A 102 GLN HA A 97 GLN HGy 1.0 0.0 4.0 1000 935 A 93 LEU HA A 105 VAL HGy% 1.0 0.0 5.0 1001 936 A 61 PHE HA A 85 SER HA 1.0 0.0 5.0 1002 937 A 61 PHE HA A 62 GLY HAy 1.0 0.0 6.0 1003 937 A 61 PHE HA A 62 GLY HAx 1.0 0.0 6.0 1004 938 A 43 TYR HBy A 108 ALA HA 1.0 0.0 5.0 1005 939 A 43 TYR HBx A 108 ALA HA 1.0 0.0 5.0 1006 940 A 61 PHE HA A 89 ALA HB% 1.0 0.0 5.0 1007 941 A 94 ASN HA A 105 VAL HB 1.0 0.0 4.0 1008 942 A 94 ASN HA A 105 VAL HGx% 1.0 0.0 5.0 1009 943 A 94 ASN HA A 105 VAL HGy% 1.0 0.0 3.0 1010 944 A 65 ILE HA A 64 ILE HG2% 1.0 0.0 6.0 1011 945 A 92 GLU HA A 91 ALA HA 1.0 0.0 5.0 1012 946 A 87 ASP HA A 86 ALA HA 1.0 0.0 5.0 1013 947 A 78 VAL HA A 79 THR HB 1.0 0.0 5.0 1014 948 A 92 GLU HA A 89 ALA HA 1.0 0.0 6.0 1015 949 A 74 ASN HA A 49 MET HGx 1.0 0.0 6.0 1016 950 A 87 ASP HA A 86 ALA HB% 1.0 0.0 5.0 1017 951 A 87 ASP HA A 90 VAL HGx% 1.0 0.0 6.0 1018 952 A 87 ASP HA A 107 ILE HD1% 1.0 0.0 6.0 1019 953 A 55 ARG HA A 59 SER HBx 1.0 0.0 5.0 1020 953 A 55 ARG HA A 59 SER HBy 1.0 0.0 5.0 1021 954 A 60 PRO HDy A 59 SER HBx 1.0 0.0 3.0 1022 954 A 60 PRO HDy A 59 SER HBy 1.0 0.0 3.0 1023 955 A 60 PRO HDx A 59 SER HBx 1.0 0.0 4.0 1024 955 A 60 PRO HDx A 59 SER HBy 1.0 0.0 4.0 1025 956 A 89 ALA HB% A 57 ALA HA 1.0 0.0 6.0 1026 957 A 78 VAL HA A 44 VAL HGy% 1.0 0.0 6.0 1027 958 A 96 THR HA A 95 GLY HAy 1.0 0.0 5.0 1028 959 A 100 SER HA A 99 GLU HBx 1.0 0.0 5.0 1029 959 A 100 SER HA A 99 GLU HBy 1.0 0.0 5.0 1030 960 A 100 SER HA A 97 GLN HGx 1.0 0.0 4.0 1031 960 A 100 SER HA A 97 GLN HGy 1.0 0.0 4.0 1032 961 A 96 THR HG2% A 95 GLY HAy 1.0 0.0 5.0 1033 962 A 107 ILE HA A 106 ASN HA 1.0 0.0 5.0 1034 963 A 42 LEU HA A 107 ILE HA 1.0 0.0 4.0 1035 964 A 107 ILE HA A 108 ALA HA 1.0 0.0 5.0 1036 965 A 101 VAL HA A 100 SER HBx 1.0 0.0 5.0 1037 965 A 101 VAL HA A 100 SER HBy 1.0 0.0 5.0 1038 966 A 84 GLU HA A 87 ASP HBx 1.0 0.0 4.0 1039 967 A 84 GLU HA A 87 ASP HBy 1.0 0.0 4.0 1040 968 A 107 ILE HA A 108 ALA HB% 1.0 0.0 5.0 1041 969 A 98 VAL HA A 99 GLU HA 1.0 0.0 5.0 1042 970 A 98 VAL HA A 99 GLU HGy 1.0 0.0 6.0 1043 971 A 98 VAL HA A 99 GLU HBx 1.0 0.0 6.0 1044 971 A 98 VAL HA A 99 GLU HBy 1.0 0.0 6.0 1045 972 A 101 VAL HA A 102 GLN HBx 1.0 0.0 5.0 1046 973 A 40 ASN HA A 39 GLY HAx 1.0 0.0 5.0 1047 973 A 40 ASN HA A 39 GLY HAy 1.0 0.0 5.0 1048 974 A 91 ALA HA A 90 VAL HGx% 1.0 0.0 6.0 1049 975 A 82 LYS HA A 83 MET HA 1.0 0.0 6.0 1050 976 A 88 GLN HA A 92 GLU HGy 1.0 0.0 6.0 1051 977 A 64 ILE HA A 79 THR HG2% 1.0 0.0 5.0 1052 978 A 65 ILE HG2% A 81 GLU HA 1.0 0.0 4.0 1053 979 A 83 MET HA A 40 ASN HBy 1.0 0.0 3.0 1054 980 A 83 MET HA A 40 ASN HBx 1.0 0.0 4.0 1055 981 A 88 GLN HA A 87 ASP HBy 1.0 0.0 6.0 1056 982 A 47 GLU HA A 49 MET HGx 1.0 0.0 6.0 1057 983 A 72 PRO HDy A 70 ASP HA 1.0 0.0 4.0 1058 984 A 52 THR HA A 55 ARG HDy 1.0 0.0 6.0 1059 985 A 52 THR HA A 55 ARG HGy 1.0 0.0 5.0 1060 986 A 94 ASN HA A 95 GLY HAx 1.0 0.0 5.0 1061 987 A 45 TYR HA A 46 GLY HAx 1.0 0.0 5.0 1062 987 A 45 TYR HA A 46 GLY HAy 1.0 0.0 5.0 1063 988 A 50 THR HA A 51 PRO HDx 1.0 0.0 3.0 1064 989 A 67 LEU HA A 68 SER HBx 1.0 0.0 5.0 1065 989 A 67 LEU HA A 68 SER HBy 1.0 0.0 5.0 1066 990 A 50 THR HB A 51 PRO HDx 1.0 0.0 4.0 1067 991 A 102 GLN HA A 46 GLY HAx 1.0 0.0 6.0 1068 991 A 102 GLN HA A 46 GLY HAy 1.0 0.0 6.0 1069 992 A 60 PRO HDy A 57 ALA HA 1.0 0.0 5.0 1070 993 A 68 SER HBx A 77 PHE HBx 1.0 0.0 3.0 1071 993 A 68 SER HBy A 77 PHE HBx 1.0 0.0 3.0 1072 993 A 77 PHE HBy A 68 SER HBx 1.0 0.0 3.0 1073 993 A 68 SER HBy A 77 PHE HBy 1.0 0.0 3.0 1074 994 A 49 MET HGy A 46 GLY HAx 1.0 0.0 5.0 1075 994 A 46 GLY HAy A 49 MET HGy 1.0 0.0 5.0 1076 995 A 103 LEU HDy% A 46 GLY HAx 1.0 0.0 4.0 1077 995 A 46 GLY HAy A 103 LEU HDy% 1.0 0.0 4.0 1078 996 A 79 THR HB A 66 ASP HBy 1.0 0.0 4.0 1079 997 A 69 MET HGy A 68 SER HBx 1.0 0.0 6.0 1080 997 A 68 SER HBy A 69 MET HGy 1.0 0.0 6.0 1081 998 A 79 THR HB A 66 ASP HBx 1.0 0.0 3.0 1082 999 A 79 THR HB A 65 ILE HG2% 1.0 0.0 5.0 1083 1000 A 79 THR HB A 78 VAL HGx% 1.0 0.0 5.0 1084 1001 A 66 ASP HA A 79 THR HB 1.0 0.0 5.0 1085 1002 A 100 SER HA A 99 GLU HA 1.0 0.0 6.0 1086 1003 A 99 GLU HA A 98 VAL HGx% 1.0 0.0 5.0 1087 1004 A 80 TYR HBy A 86 ALA HB% 1.0 0.0 5.0 1088 1005 A 80 TYR HBy A 89 ALA HB% 1.0 0.0 6.0 1089 1006 A 80 TYR HBy A 79 THR HG2% 1.0 0.0 6.0 1090 1007 A 80 TYR HBy A 85 SER HBy 1.0 0.0 4.0 1091 1008 A 90 VAL HA A 89 ALA HB% 1.0 0.0 5.0 1092 1009 A 91 ALA HA A 90 VAL HA 1.0 0.0 5.0 1093 1010 A 94 ASN HBy A 105 VAL HGx% 1.0 0.0 5.0 1094 1011 A 58 PHE HBy A 42 LEU HDx% 1.0 0.0 5.0 1095 1012 A 94 ASN HBy A 90 VAL HGx% 1.0 0.0 5.0 1096 1013 A 104 LYS HA A 94 ASN HBy 1.0 0.0 6.0 1097 1014 A 94 ASN HBy A 105 VAL HB 1.0 0.0 4.0 1098 1015 A 94 ASN HBy A 91 ALA HB% 1.0 0.0 6.0 1099 1016 A 94 ASN HBy A 105 VAL HGy% 1.0 0.0 4.0 1100 1017 A 58 PHE HBy A 78 VAL HGy% 1.0 0.0 5.0 1101 1018 A 55 ARG HDx A 52 THR HG2% 1.0 0.0 5.0 1102 1019 A 94 ASN HBx A 105 VAL HGx% 1.0 0.0 6.0 1103 1020 A 94 ASN HBx A 105 VAL HGy% 1.0 0.0 5.0 1104 1021 A 58 PHE HBx A 59 SER HA 1.0 0.0 5.0 1105 1022 A 58 PHE HBx A 57 ALA HA 1.0 0.0 6.0 1106 1023 A 94 ASN HBx A 90 VAL HGy% 1.0 0.0 6.0 1107 1024 A 58 PHE HBx A 55 ARG HA 1.0 0.0 4.0 1108 1025 A 45 TYR HBx A 104 LYS HEx 1.0 0.0 5.0 1109 1025 A 45 TYR HBy A 104 LYS HEx 1.0 0.0 5.0 1110 1025 A 104 LYS HEy A 45 TYR HBx 1.0 0.0 5.0 1111 1025 A 45 TYR HBy A 104 LYS HEy 1.0 0.0 5.0 1112 1026 A 82 LYS HEx A 84 GLU HBx 1.0 0.0 6.0 1113 1026 A 84 GLU HBy A 82 LYS HEx 1.0 0.0 6.0 1114 1027 A 40 ASN HBy A 86 ALA HB% 1.0 0.0 5.0 1115 1028 A 58 PHE HBx A 57 ALA HB% 1.0 0.0 5.0 1116 1029 A 40 ASN HBy A 79 THR HG2% 1.0 0.0 5.0 1117 1030 A 58 PHE HBx A 64 ILE HD1% 1.0 0.0 3.0 1118 1031 A 58 PHE HBx A 78 VAL HGy% 1.0 0.0 5.0 1119 1032 A 43 TYR HBy A 41 THR HG2% 1.0 0.0 6.0 1120 1033 A 104 LYS HA A 45 TYR HBx 1.0 0.0 5.0 1121 1033 A 104 LYS HA A 45 TYR HBy 1.0 0.0 5.0 1122 1034 A 82 LYS HA A 40 ASN HBx 1.0 0.0 6.0 1123 1035 A 73 ARG HA A 74 ASN HBy 1.0 0.0 5.0 1124 1036 A 61 PHE HBx A 85 SER HA 1.0 0.0 6.0 1125 1037 A 81 GLU HA A 63 ASN HBx 1.0 0.0 6.0 1126 1037 A 63 ASN HBy A 81 GLU HA 1.0 0.0 6.0 1127 1038 A 81 GLU HGx A 63 ASN HBx 1.0 0.0 6.0 1128 1038 A 63 ASN HBy A 81 GLU HGx 1.0 0.0 6.0 1129 1039 A 81 GLU HBx A 63 ASN HBx 1.0 0.0 4.0 1130 1039 A 63 ASN HBy A 81 GLU HBx 1.0 0.0 4.0 1131 1040 A 81 GLU HBy A 63 ASN HBx 1.0 0.0 4.0 1132 1040 A 63 ASN HBy A 81 GLU HBy 1.0 0.0 4.0 1133 1041 A 104 LYS HBx A 45 TYR HBx 1.0 0.0 6.0 1134 1041 A 45 TYR HBy A 104 LYS HBx 1.0 0.0 6.0 1135 1042 A 104 LYS HBy A 45 TYR HBx 1.0 0.0 3.0 1136 1042 A 45 TYR HBy A 104 LYS HBy 1.0 0.0 3.0 1137 1043 A 40 ASN HBx A 42 LEU HDy% 1.0 0.0 6.0 1138 1044 A 48 ASP HBy A 101 VAL HGx% 1.0 0.0 6.0 1139 1045 A 44 VAL HGx% A 45 TYR HBx 1.0 0.0 6.0 1140 1045 A 45 TYR HBy A 44 VAL HGx% 1.0 0.0 6.0 1141 1046 A 40 ASN HBx A 79 THR HG2% 1.0 0.0 6.0 1142 1047 A 78 VAL HGy% A 77 PHE HBx 1.0 0.0 5.0 1143 1047 A 77 PHE HBy A 78 VAL HGy% 1.0 0.0 5.0 1144 1048 A 79 THR HA A 80 TYR HBx 1.0 0.0 5.0 1145 1049 A 89 ALA HA A 92 GLU HGx 1.0 0.0 6.0 1146 1050 A 89 ALA HA A 92 GLU HBx 1.0 0.0 4.0 1147 1051 A 48 ASP HBx A 101 VAL HGy% 1.0 0.0 5.0 1148 1052 A 89 ALA HA A 93 LEU HDx% 1.0 0.0 5.0 1149 1053 A 89 ALA HA A 92 GLU HBy 1.0 0.0 5.0 1150 1054 A 66 ASP HBy A 79 THR HG2% 1.0 0.0 5.0 1151 1055 A 66 ASP HBy A 65 ILE HG2% 1.0 0.0 6.0 1152 1056 A 66 ASP HBy A 65 ILE HD1% 1.0 0.0 6.0 1153 1057 A 67 LEU HA A 69 MET HGy 1.0 0.0 6.0 1154 1058 A 51 PRO HDx A 69 MET HGy 1.0 0.0 6.0 1155 1059 A 69 MET HGy A 51 PRO HGx 1.0 0.0 6.0 1156 1060 A 88 GLN HGy A 91 ALA HB% 1.0 0.0 6.0 1157 1061 A 69 MET HGy A 76 ALA HB% 1.0 0.0 5.0 1158 1062 A 85 SER HBx A 62 GLY HAy 1.0 0.0 6.0 1159 1062 A 85 SER HBx A 62 GLY HAx 1.0 0.0 6.0 1160 1063 A 84 GLU HGy A 83 MET HBy 1.0 0.0 5.0 1161 1064 A 81 GLU HGy A 63 ASN HBx 1.0 0.0 6.0 1162 1064 A 63 ASN HBy A 81 GLU HGy 1.0 0.0 6.0 1163 1065 A 84 GLU HGy A 83 MET HGx 1.0 0.0 6.0 1164 1065 A 83 MET HGy A 84 GLU HGy 1.0 0.0 6.0 1165 1066 A 85 SER HBx A 86 ALA HB% 1.0 0.0 6.0 1166 1067 A 81 GLU HGy A 65 ILE HG2% 1.0 0.0 5.0 1167 1068 A 81 GLU HGy A 65 ILE HD1% 1.0 0.0 5.0 1168 1069 A 88 GLN HGx A 91 ALA HB% 1.0 0.0 5.0 1169 1070 A 93 LEU HDx% A 92 GLU HGy 1.0 0.0 6.0 1170 1071 A 70 ASP HA A 73 ARG HBx 1.0 0.0 6.0 1171 1071 A 73 ARG HBy A 70 ASP HA 1.0 0.0 6.0 1172 1072 A 50 THR HA A 51 PRO HGx 1.0 0.0 5.0 1173 1073 A 72 PRO HDy A 73 ARG HBx 1.0 0.0 6.0 1174 1073 A 72 PRO HDy A 73 ARG HBy 1.0 0.0 6.0 1175 1074 A 70 ASP HBy A 73 ARG HBx 1.0 0.0 4.0 1176 1074 A 70 ASP HBy A 73 ARG HBy 1.0 0.0 4.0 1177 1075 A 98 VAL HB A 101 VAL HB 1.0 0.0 4.0 1178 1076 A 92 GLU HGx A 91 ALA HB% 1.0 0.0 6.0 1179 1077 A 80 TYR HA A 81 GLU HBx 1.0 0.0 5.0 1180 1078 A 48 ASP HA A 49 MET HGy 1.0 0.0 6.0 1181 1079 A 99 GLU HGx A 100 SER HBx 1.0 0.0 6.0 1182 1079 A 100 SER HBy A 99 GLU HGx 1.0 0.0 6.0 1183 1080 A 97 GLN HBx A 102 GLN HGx 1.0 0.0 5.0 1184 1080 A 102 GLN HGy A 97 GLN HBx 1.0 0.0 5.0 1185 1081 A 49 MET HGy A 54 LEU HDx% 1.0 0.0 5.0 1186 1082 A 49 MET HGy A 54 LEU HDy% 1.0 0.0 6.0 1187 1083 A 82 LYS HA A 83 MET HBx 1.0 0.0 6.0 1188 1084 A 50 THR HA A 51 PRO HBx 1.0 0.0 6.0 1189 1085 A 91 ALA HA A 90 VAL HB 1.0 0.0 6.0 1190 1086 A 90 VAL HB A 88 GLN HA 1.0 0.0 6.0 1191 1087 A 88 GLN HGy A 92 GLU HBy 1.0 0.0 6.0 1192 1088 A 88 GLN HGx A 92 GLU HBy 1.0 0.0 6.0 1193 1089 A 90 VAL HB A 42 LEU HDx% 1.0 0.0 5.0 1194 1090 A 90 VAL HB A 107 ILE HD1% 1.0 0.0 6.0 1195 1091 A 104 LYS HA A 103 LEU HBy 1.0 0.0 5.0 1196 1092 A 68 SER HA A 69 MET HBx 1.0 0.0 5.0 1197 1092 A 68 SER HA A 69 MET HBy 1.0 0.0 5.0 1198 1093 A 50 THR HB A 51 PRO HBx 1.0 0.0 6.0 1199 1094 A 96 THR HA A 97 GLN HGx 1.0 0.0 6.0 1200 1094 A 96 THR HA A 97 GLN HGy 1.0 0.0 6.0 1201 1095 A 102 GLN HBx A 97 GLN HGx 1.0 0.0 6.0 1202 1095 A 97 GLN HGy A 102 GLN HBx 1.0 0.0 6.0 1203 1096 A 98 VAL HB A 97 GLN HGx 1.0 0.0 5.0 1204 1096 A 97 GLN HGy A 98 VAL HB 1.0 0.0 5.0 1205 1097 A 103 LEU HBy A 96 THR HG2% 1.0 0.0 6.0 1206 1098 A 93 LEU HDx% A 92 GLU HBy 1.0 0.0 6.0 1207 1099 A 103 LEU HBy A 44 VAL HGy% 1.0 0.0 6.0 1208 1100 A 105 VAL HA A 104 LYS HBy 1.0 0.0 6.0 1209 1101 A 70 ASP HA A 69 MET HBx 1.0 0.0 5.0 1210 1101 A 69 MET HBy A 70 ASP HA 1.0 0.0 5.0 1211 1102 A 61 PHE HA A 60 PRO HBx 1.0 0.0 6.0 1212 1103 A 37 ARG HA A 36 PRO HGx 1.0 0.0 6.0 1213 1103 A 37 ARG HA A 36 PRO HGy 1.0 0.0 6.0 1214 1104 A 105 VAL HGy% A 104 LYS HBy 1.0 0.0 6.0 1215 1105 A 80 TYR HA A 64 ILE HG1y 1.0 0.0 5.0 1216 1106 A 50 THR HA A 53 LEU HBy 1.0 0.0 6.0 1217 1107 A 64 ILE HG1y A 63 ASN HA 1.0 0.0 5.0 1218 1108 A 56 GLY HAy A 55 ARG HBy 1.0 0.0 6.0 1219 1109 A 53 LEU HBy A 52 THR HB 1.0 0.0 5.0 1220 1110 A 64 ILE HG1y A 62 GLY HAy 1.0 0.0 6.0 1221 1110 A 64 ILE HG1y A 62 GLY HAx 1.0 0.0 6.0 1222 1111 A 56 GLY HAx A 55 ARG HBy 1.0 0.0 5.0 1223 1112 A 94 ASN HBx A 105 VAL HB 1.0 0.0 6.0 1224 1113 A 98 VAL HB A 99 GLU HBx 1.0 0.0 4.0 1225 1113 A 99 GLU HBy A 98 VAL HB 1.0 0.0 4.0 1226 1114 A 79 THR HG2% A 65 ILE HB 1.0 0.0 5.0 1227 1115 A 105 VAL HB A 90 VAL HGy% 1.0 0.0 4.0 1228 1116 A 105 VAL HB A 44 VAL HGy% 1.0 0.0 5.0 1229 1117 A 64 ILE HG1y A 59 SER HA 1.0 0.0 6.0 1230 1118 A 96 THR HA A 97 GLN HBy 1.0 0.0 5.0 1231 1119 A 100 SER HA A 98 VAL HB 1.0 0.0 6.0 1232 1120 A 48 ASP HA A 47 GLU HBx 1.0 0.0 5.0 1233 1121 A 86 ALA HA A 42 LEU HG 1.0 0.0 5.0 1234 1122 A 47 GLU HBx A 46 GLY HAx 1.0 0.0 6.0 1235 1122 A 46 GLY HAy A 47 GLU HBx 1.0 0.0 6.0 1236 1123 A 42 LEU HG A 86 ALA HB% 1.0 0.0 4.0 1237 1124 A 42 LEU HG A 41 THR HG2% 1.0 0.0 6.0 1238 1125 A 98 VAL HB A 53 LEU HDy% 1.0 0.0 6.0 1239 1126 A 50 THR HA A 54 LEU HG 1.0 0.0 6.0 1240 1127 A 55 ARG HGy A 59 SER HBx 1.0 0.0 6.0 1241 1127 A 55 ARG HGy A 59 SER HBy 1.0 0.0 6.0 1242 1128 A 49 MET HA A 54 LEU HG 1.0 0.0 5.0 1243 1129 A 104 LYS HGx A 45 TYR HBx 1.0 0.0 4.0 1244 1129 A 45 TYR HBy A 104 LYS HGx 1.0 0.0 4.0 1245 1130 A 64 ILE HB A 63 ASN HBx 1.0 0.0 6.0 1246 1130 A 63 ASN HBy A 64 ILE HB 1.0 0.0 6.0 1247 1131 A 93 LEU HBy A 105 VAL HGy% 1.0 0.0 3.0 1248 1132 A 72 PRO HBx A 73 ARG HBx 1.0 0.0 5.0 1249 1132 A 73 ARG HBy A 72 PRO HBx 1.0 0.0 5.0 1250 1133 A 86 ALA HB% A 87 ASP HBy 1.0 0.0 6.0 1251 1134 A 42 LEU HBy A 44 VAL HGx% 1.0 0.0 6.0 1252 1135 A 42 LEU HBy A 44 VAL HGy% 1.0 0.0 4.0 1253 1136 A 83 MET HA A 86 ALA HB% 1.0 0.0 3.0 1254 1137 A 40 ASN HBx A 86 ALA HB% 1.0 0.0 4.0 1255 1138 A 86 ALA HB% A 87 ASP HBx 1.0 0.0 5.0 1256 1139 A 57 ALA HB% A 53 LEU HG 1.0 0.0 6.0 1257 1140 A 53 LEU HG A 98 VAL HGx% 1.0 0.0 6.0 1258 1141 A 81 GLU HGy A 82 LYS HGy 1.0 0.0 6.0 1259 1142 A 55 ARG HGx A 64 ILE HD1% 1.0 0.0 4.0 1260 1143 A 92 GLU HA A 91 ALA HB% 1.0 0.0 4.0 1261 1144 A 91 ALA HB% A 88 GLN HA 1.0 0.0 6.0 1262 1145 A 41 THR HB A 108 ALA HB% 1.0 0.0 3.0 1263 1146 A 43 TYR HBy A 108 ALA HB% 1.0 0.0 5.0 1264 1147 A 43 TYR HBx A 108 ALA HB% 1.0 0.0 5.0 1265 1148 A 91 ALA HB% A 92 GLU HGy 1.0 0.0 6.0 1266 1149 A 90 VAL HB A 91 ALA HB% 1.0 0.0 5.0 1267 1150 A 91 ALA HB% A 92 GLU HBy 1.0 0.0 5.0 1268 1151 A 89 ALA HB% A 88 GLN HBx 1.0 0.0 6.0 1269 1152 A 89 ALA HB% A 57 ALA HB% 1.0 0.0 5.0 1270 1153 A 91 ALA HB% A 90 VAL HGx% 1.0 0.0 6.0 1271 1154 A 103 LEU HDy% A 49 MET HBx 1.0 0.0 6.0 1272 1155 A 86 ALA HA A 89 ALA HB% 1.0 0.0 4.0 1273 1156 A 61 PHE HBx A 89 ALA HB% 1.0 0.0 3.0 1274 1157 A 69 MET HGy A 67 LEU HG 1.0 0.0 5.0 1275 1158 A 89 ALA HB% A 105 VAL HGy% 1.0 0.0 5.0 1276 1159 A 67 LEU HA A 78 VAL HB 1.0 0.0 6.0 1277 1160 A 78 VAL HB A 54 LEU HDx% 1.0 0.0 6.0 1278 1161 A 57 ALA HB% A 54 LEU HA 1.0 0.0 3.0 1279 1162 A 92 GLU HGx A 93 LEU HG 1.0 0.0 6.0 1280 1163 A 93 LEU HG A 92 GLU HBy 1.0 0.0 5.0 1281 1164 A 92 GLU HBx A 93 LEU HG 1.0 0.0 6.0 1282 1165 A 57 ALA HB% A 98 VAL HGx% 1.0 0.0 6.0 1283 1166 A 57 ALA HB% A 103 LEU HDy% 1.0 0.0 5.0 1284 1167 A 78 VAL HA A 67 LEU HBx 1.0 0.0 6.0 1285 1168 A 52 THR HG2% A 53 LEU HA 1.0 0.0 4.0 1286 1169 A 64 ILE HG2% A 67 LEU HBx 1.0 0.0 5.0 1287 1170 A 50 THR HG2% A 49 MET HA 1.0 0.0 5.0 1288 1171 A 50 THR HG2% A 51 PRO HDy 1.0 0.0 3.0 1289 1172 A 51 PRO HDx A 50 THR HG2% 1.0 0.0 6.0 1290 1173 A 77 PHE HA A 41 THR HG2% 1.0 0.0 4.0 1291 1174 A 93 LEU HA A 96 THR HG2% 1.0 0.0 4.0 1292 1175 A 41 THR HG2% A 77 PHE HBx 1.0 0.0 3.0 1293 1175 A 77 PHE HBy A 41 THR HG2% 1.0 0.0 3.0 1294 1176 A 108 ALA HB% A 41 THR HG2% 1.0 0.0 4.0 1295 1177 A 105 VAL HGy% A 103 LEU HA 1.0 0.0 6.0 1296 1178 A 78 VAL HA A 42 LEU HDx% 1.0 0.0 6.0 1297 1179 A 40 ASN HBy A 42 LEU HDx% 1.0 0.0 6.0 1298 1180 A 103 LEU HBx A 98 VAL HGy% 1.0 0.0 5.0 1299 1181 A 75 CYS HA A 76 ALA HB% 1.0 0.0 5.0 1300 1182 A 77 PHE HA A 76 ALA HB% 1.0 0.0 5.0 1301 1183 A 104 LYS HA A 105 VAL HGy% 1.0 0.0 4.0 1302 1184 A 69 MET HA A 76 ALA HB% 1.0 0.0 3.0 1303 1185 A 106 ASN HBy A 90 VAL HGx% 1.0 0.0 6.0 1304 1186 A 106 ASN HBx A 90 VAL HGx% 1.0 0.0 6.0 1305 1187 A 76 ALA HB% A 69 MET HGx 1.0 0.0 5.0 1306 1188 A 76 ALA HB% A 49 MET HBx 1.0 0.0 4.0 1307 1189 A 107 ILE HG2% A 108 ALA HA 1.0 0.0 5.0 1308 1190 A 86 ALA HA A 42 LEU HDy% 1.0 0.0 4.0 1309 1191 A 99 GLU HBy A 98 VAL HGx% 1.0 0.0 4.0 1310 1191 A 98 VAL HGx% A 99 GLU HBx 1.0 0.0 4.0 1311 1192 A 65 ILE HG2% A 39 GLY HAx 1.0 0.0 5.0 1312 1192 A 65 ILE HG2% A 39 GLY HAy 1.0 0.0 5.0 1313 1193 A 48 ASP HBx A 101 VAL HGx% 1.0 0.0 4.0 1314 1194 A 99 GLU HGy A 98 VAL HGx% 1.0 0.0 6.0 1315 1195 A 99 GLU HGx A 98 VAL HGx% 1.0 0.0 5.0 1316 1196 A 66 ASP HA A 65 ILE HG2% 1.0 0.0 6.0 1317 1197 A 102 GLN HA A 98 VAL HGy% 1.0 0.0 6.0 1318 1198 A 65 ILE HG2% A 63 ASN HBx 1.0 0.0 4.0 1319 1198 A 63 ASN HBy A 65 ILE HG2% 1.0 0.0 4.0 1320 1199 A 81 GLU HGy A 65 ILE HG1x 1.0 0.0 6.0 1321 1200 A 105 VAL HA A 44 VAL HGx% 1.0 0.0 4.0 1322 1201 A 45 TYR HA A 44 VAL HGx% 1.0 0.0 4.0 1323 1202 A 106 ASN HA A 107 ILE HD1% 1.0 0.0 5.0 1324 1203 A 86 ALA HB% A 107 ILE HD1% 1.0 0.0 6.0 1325 1204 A 44 VAL HGx% A 49 MET HBx 1.0 0.0 5.0 1326 1205 A 44 VAL HGx% A 93 LEU HDx% 1.0 0.0 6.0 1327 1206 A 68 SER HA A 67 LEU HDx% 1.0 0.0 5.0 1328 1207 A 64 ILE HD1% A 59 SER HA 1.0 0.0 4.0 1329 1208 A 64 ILE HD1% A 59 SER HBx 1.0 0.0 5.0 1330 1208 A 64 ILE HD1% A 59 SER HBy 1.0 0.0 5.0 1331 1209 A 101 VAL HGy% A 46 GLY HAx 1.0 0.0 4.0 1332 1209 A 46 GLY HAy A 101 VAL HGy% 1.0 0.0 4.0 1333 1210 A 67 LEU HDx% A 55 ARG HA 1.0 0.0 5.0 1334 1211 A 55 ARG HDy A 67 LEU HDx% 1.0 0.0 6.0 1335 1212 A 67 LEU HDx% A 55 ARG HDx 1.0 0.0 6.0 1336 1213 A 67 LEU HDx% A 55 ARG HBy 1.0 0.0 6.0 1337 1214 A 89 ALA HB% A 64 ILE HD1% 1.0 0.0 6.0 1338 1215 A 67 LEU HDx% A 64 ILE HG2% 1.0 0.0 4.0 1339 1216 A 67 LEU HDx% A 78 VAL HGx% 1.0 0.0 5.0 1340 1217 A 69 MET HGy A 67 LEU HDx% 1.0 0.0 4.0 1341 1218 A 67 LEU HDx% A 69 MET HGx 1.0 0.0 5.0 1342 1219 A 67 LEU HDx% A 51 PRO HGy 1.0 0.0 6.0 1343 1220 A 51 PRO HBx A 67 LEU HDx% 1.0 0.0 4.0 1344 1221 A 67 LEU HDx% A 55 ARG HGy 1.0 0.0 6.0 1345 1222 A 53 LEU HDx% A 103 LEU HDx% 1.0 0.0 6.0 1346 1223 A 67 LEU HDx% A 78 VAL HGy% 1.0 0.0 5.0 1347 1224 A 93 LEU HDx% A 57 ALA HA 1.0 0.0 5.0 1348 1225 A 92 GLU HGx A 93 LEU HDx% 1.0 0.0 6.0 1349 1226 A 92 GLU HBx A 93 LEU HDx% 1.0 0.0 4.0 1350 1227 A 89 ALA HB% A 93 LEU HDx% 1.0 0.0 6.0 1351 1228 A 96 THR HG2% A 93 LEU HDx% 1.0 0.0 5.0 1352 1229 A 76 ALA HA A 54 LEU HDy% 1.0 0.0 5.0 1353 1230 A 54 LEU HDy% A 69 MET HGx 1.0 0.0 4.0 1354 1231 A 80 TYR HA A 64 ILE HG2% 1.0 0.0 5.0 1355 1232 A 66 ASP HA A 64 ILE HG2% 1.0 0.0 4.0 1356 1233 A 78 VAL HA A 64 ILE HG2% 1.0 0.0 4.0 1357 1234 A 65 ILE HG2% A 64 ILE HG2% 1.0 0.0 5.0 1358 1235 A 64 ILE HG2% A 78 VAL HGx% 1.0 0.0 3.0 1359 1236 A 78 VAL HB A 44 VAL HGy% 1.0 0.0 4.0 1360 1237 A 42 LEU HBx A 44 VAL HGy% 1.0 0.0 4.0 1361 1238 A 44 VAL HGy% A 105 VAL HGx% 1.0 0.0 3.0 1362 1239 A 42 LEU HDx% A 44 VAL HGy% 1.0 0.0 5.0 1363 1240 A 44 VAL HGy% A 105 VAL HGy% 1.0 0.0 5.0 1364 1241 A 44 VAL HGy% A 78 VAL HGy% 1.0 0.0 3.0 1365 1242 A 80 TYR HA A 64 ILE HG1x 1.0 0.0 4.0 1366 1243 A 64 ILE HA A 78 VAL HGx% 1.0 0.0 5.0 1367 1244 A 64 ILE HB A 78 VAL HGx% 1.0 0.0 4.0 1368 1245 A 58 PHE HBy A 78 VAL HGx% 1.0 0.0 3.0 1369 1246 A 58 PHE HBx A 78 VAL HGx% 1.0 0.0 3.0 1370 1247 A 78 VAL HGx% A 67 LEU HG 1.0 0.0 6.0 1371 1248 A 42 LEU HDx% A 78 VAL HGx% 1.0 0.0 4.0 1372 1249 A 64 ILE HD1% A 78 VAL HGx% 1.0 0.0 3.0 1373 1250 A 93 LEU HDy% A 54 LEU HDx% 1.0 0.0 5.0 1374 1251 A 64 ILE HD1% A 93 LEU HDy% 1.0 0.0 6.0 1375 1252 A 64 ILE HG2% A 78 VAL HGy% 1.0 0.0 6.0 1376 1253 A 58 PHE HA A 93 LEU HDy% 1.0 0.0 6.0 1377 1254 A 93 LEU HDy% A 57 ALA HA 1.0 0.0 5.0 1378 1255 A 89 ALA HA A 93 LEU HDy% 1.0 0.0 4.0 1379 1256 A 89 ALA HB% A 93 LEU HDy% 1.0 0.0 4.0 1380 1257 A 57 ALA HB% A 93 LEU HDy% 1.0 0.0 4.0 1381 1258 A 93 LEU HDy% A 105 VAL HGx% 1.0 0.0 4.0 1382 1259 A 93 LEU HDy% A 105 VAL HGy% 1.0 0.0 5.0 1383 1260 A 84 GLU H A 84 GLU HBx 1.0 0.0 3.0 1384 1260 A 84 GLU H A 84 GLU HBy 1.0 0.0 3.0 1385 1261 A 42 LEU H A 42 LEU HBy 1.0 0.0 3.0 1386 1262 A 42 LEU H A 42 LEU HBx 1.0 0.0 4.0 1387 1263 A 43 TYR H A 43 TYR HBy 1.0 0.0 4.0 1388 1264 A 43 TYR H A 43 TYR HBx 1.0 0.0 3.0 1389 1265 A 45 TYR H A 45 TYR HA 1.0 0.0 4.0 1390 1266 A 106 ASN H A 106 ASN HA 1.0 0.0 4.0 1391 1267 A 106 ASN H A 106 ASN HBy 1.0 0.0 4.0 1392 1268 A 99 GLU H A 99 GLU HGy 1.0 0.0 6.0 1393 1269 A 99 GLU H A 99 GLU HGx 1.0 0.0 4.0 1394 1270 A 105 VAL H A 105 VAL HGx% 1.0 0.0 4.0 1395 1271 A 105 VAL H A 105 VAL HGy% 1.0 0.0 3.0 1396 1272 A 83 MET H A 83 MET HBy 1.0 0.0 4.0 1397 1273 A 55 ARG H A 55 ARG HBy 1.0 0.0 4.0 1398 1274 A 55 ARG H A 55 ARG HGy 1.0 0.0 5.0 1399 1275 A 79 THR H A 79 THR HG2% 1.0 0.0 4.0 1400 1276 A 107 ILE H A 107 ILE HD1% 1.0 0.0 5.0 1401 1277 A 98 VAL H A 98 VAL HA 1.0 0.0 4.0 1402 1278 A 98 VAL H A 98 VAL HB 1.0 0.0 4.0 1403 1279 A 95 GLY H A 95 GLY HAy 1.0 0.0 3.0 1404 1280 A 68 SER H A 68 SER HA 1.0 0.0 4.0 1405 1281 A 47 GLU H A 47 GLU HGx 1.0 0.0 4.0 1406 1282 A 65 ILE H A 65 ILE HB 1.0 0.0 5.0 1407 1283 A 65 ILE H A 65 ILE HG1y 1.0 0.0 6.0 1408 1284 A 64 ILE H A 64 ILE HD1% 1.0 0.0 4.0 1409 1285 A 104 LYS H A 104 LYS HBy 1.0 0.0 4.0 1410 1286 A 82 LYS H A 82 LYS HGy 1.0 0.0 5.0 1411 1287 A 59 SER H A 59 SER HA 1.0 0.0 4.0 1412 1288 A 59 SER H A 59 SER HBx 1.0 0.0 3.0 1413 1288 A 59 SER H A 59 SER HBy 1.0 0.0 3.0 1414 1289 A 78 VAL H A 78 VAL HB 1.0 0.0 3.0 1415 1290 A 81 GLU H A 81 GLU HBy 1.0 0.0 3.0 1416 1291 A 102 GLN H A 102 GLN HGx 1.0 0.0 4.0 1417 1291 A 102 GLN H A 102 GLN HGy 1.0 0.0 4.0 1418 1292 A 101 VAL H A 101 VAL HB 1.0 0.0 3.0 1419 1293 A 40 ASN H A 40 ASN HBx 1.0 0.0 4.0 1420 1294 A 93 LEU H A 93 LEU HBx 1.0 0.0 4.0 1421 1295 A 93 LEU H A 93 LEU HA 1.0 0.0 3.0 1422 1296 A 93 LEU H A 93 LEU HG 1.0 0.0 3.0 1423 1297 A 56 GLY H A 56 GLY HAy 1.0 0.0 5.0 1424 1298 A 56 GLY H A 56 GLY HAx 1.0 0.0 3.0 1425 1299 A 67 LEU H A 67 LEU HBy 1.0 0.0 3.0 1426 1300 A 58 PHE HD% A 58 PHE HBy 1.0 0.0 3.0 1427 1301 A 58 PHE HD% A 58 PHE HBx 1.0 0.0 3.0 1428 1302 A 92 GLU H A 92 GLU HGy 1.0 0.0 5.0 1429 1303 A 92 GLU H A 92 GLU HBy 1.0 0.0 4.0 1430 1304 A 54 LEU H A 54 LEU HA 1.0 0.0 3.0 1431 1305 A 88 GLN HE21 A 88 GLN HGx 1.0 0.0 4.0 1432 1306 A 54 LEU H A 54 LEU HDx% 1.0 0.0 4.0 1433 1307 A 63 ASN HD21 A 63 ASN HA 1.0 0.0 5.0 1434 1308 A 57 ALA H A 57 ALA HA 1.0 0.0 4.0 1435 1309 A 87 ASP H A 87 ASP HBy 1.0 0.0 4.0 1436 1310 A 62 GLY H A 62 GLY HAy 1.0 0.0 6.0 1437 1310 A 62 GLY H A 62 GLY HAx 1.0 0.0 6.0 1438 1311 A 88 GLN H A 88 GLN HA 1.0 0.0 6.0 1439 1312 A 88 GLN H A 88 GLN HGy 1.0 0.0 6.0 1440 1313 A 66 ASP H A 66 ASP HBy 1.0 0.0 4.0 1441 1314 A 73 ARG H A 73 ARG HA 1.0 0.0 4.0 1442 1315 A 106 ASN HD21 A 106 ASN HBy 1.0 0.0 5.0 1443 1316 A 61 PHE HD% A 61 PHE HA 1.0 0.0 3.0 1444 1317 A 61 PHE HD% A 61 PHE HBy 1.0 0.0 6.0 1445 1318 A 61 PHE HD% A 61 PHE HBx 1.0 0.0 3.0 1446 1319 A 45 TYR HD% A 45 TYR HA 1.0 0.0 3.0 1447 1320 A 94 ASN HD22 A 94 ASN HBy 1.0 0.0 4.0 1448 1321 A 45 TYR HD% A 45 TYR HBx 1.0 0.0 3.0 1449 1321 A 45 TYR HD% A 45 TYR HBy 1.0 0.0 3.0 1450 1322 A 77 PHE HD% A 77 PHE HA 1.0 0.0 3.0 1451 1323 A 77 PHE HD% A 77 PHE HBx 1.0 0.0 3.0 1452 1323 A 77 PHE HD% A 77 PHE HBy 1.0 0.0 3.0 1453 1324 A 85 SER H A 85 SER HBx 1.0 0.0 4.0 1454 1325 A 63 ASN HA A 63 ASN HD22 1.0 0.0 5.0 1455 1326 A 43 TYR HD% A 43 TYR HA 1.0 0.0 3.0 1456 1327 A 43 TYR HD% A 43 TYR HBy 1.0 0.0 3.0 1457 1328 A 43 TYR HD% A 43 TYR HBx 1.0 0.0 3.0 1458 1329 A 80 TYR HD% A 80 TYR HA 1.0 0.0 3.0 1459 1330 A 80 TYR HD% A 80 TYR HBy 1.0 0.0 3.0 1460 1331 A 80 TYR HD% A 80 TYR HBx 1.0 0.0 3.0 1461 1332 A 88 GLN HGx A 88 GLN HE22 1.0 0.0 4.0 1462 1333 A 61 PHE H A 61 PHE HA 1.0 0.0 3.0 1463 1334 A 61 PHE H A 61 PHE HBx 1.0 0.0 3.0 1464 1335 A 40 ASN HA A 40 ASN HD22 1.0 0.0 5.0 1465 1336 A 50 THR H A 50 THR HA 1.0 0.0 4.0 1466 1337 A 50 THR H A 50 THR HG2% 1.0 0.0 4.0 1467 1338 A 75 CYS HA A 75 CYS HBy 1.0 0.0 3.0 1468 1339 A 75 CYS HA A 75 CYS HBx 1.0 0.0 3.0 1469 1340 A 77 PHE HA A 77 PHE HBx 1.0 0.0 3.0 1470 1340 A 77 PHE HA A 77 PHE HBy 1.0 0.0 3.0 1471 1341 A 80 TYR HA A 80 TYR HBy 1.0 0.0 3.0 1472 1342 A 80 TYR HA A 80 TYR HBx 1.0 0.0 4.0 1473 1343 A 41 THR HA A 41 THR HB 1.0 0.0 4.0 1474 1344 A 41 THR HA A 41 THR HG2% 1.0 0.0 5.0 1475 1345 A 105 VAL HA A 105 VAL HB 1.0 0.0 4.0 1476 1346 A 105 VAL HA A 105 VAL HGx% 1.0 0.0 3.0 1477 1347 A 105 VAL HA A 105 VAL HGy% 1.0 0.0 3.0 1478 1348 A 79 THR HA A 79 THR HB 1.0 0.0 4.0 1479 1349 A 97 GLN HA A 97 GLN HGx 1.0 0.0 3.0 1480 1349 A 97 GLN HA A 97 GLN HGy 1.0 0.0 3.0 1481 1350 A 79 THR HA A 79 THR HG2% 1.0 0.0 3.0 1482 1351 A 70 ASP HBy A 70 ASP HA 1.0 0.0 3.0 1483 1352 A 45 TYR HA A 45 TYR HBx 1.0 0.0 3.0 1484 1352 A 45 TYR HA A 45 TYR HBy 1.0 0.0 3.0 1485 1353 A 106 ASN HA A 106 ASN HBy 1.0 0.0 3.0 1486 1354 A 42 LEU HA A 42 LEU HBy 1.0 0.0 4.0 1487 1355 A 42 LEU HA A 42 LEU HDx% 1.0 0.0 4.0 1488 1356 A 42 LEU HA A 42 LEU HBx 1.0 0.0 3.0 1489 1357 A 42 LEU HA A 42 LEU HDy% 1.0 0.0 4.0 1490 1358 A 50 THR HA A 50 THR HB 1.0 0.0 3.0 1491 1359 A 67 LEU HA A 67 LEU HBy 1.0 0.0 3.0 1492 1360 A 50 THR HA A 50 THR HG2% 1.0 0.0 3.0 1493 1361 A 68 SER HA A 68 SER HBx 1.0 0.0 3.0 1494 1361 A 68 SER HA A 68 SER HBy 1.0 0.0 3.0 1495 1362 A 82 LYS HA A 82 LYS HBx 1.0 0.0 3.0 1496 1363 A 82 LYS HA A 82 LYS HGy 1.0 0.0 3.0 1497 1364 A 63 ASN HA A 63 ASN HBx 1.0 0.0 3.0 1498 1364 A 63 ASN HBy A 63 ASN HA 1.0 0.0 3.0 1499 1365 A 44 VAL HA A 44 VAL HGy% 1.0 0.0 4.0 1500 1366 A 69 MET HA A 69 MET HGy 1.0 0.0 4.0 1501 1367 A 69 MET HA A 69 MET HGx 1.0 0.0 4.0 1502 1368 A 69 MET HA A 69 MET HBx 1.0 0.0 3.0 1503 1368 A 69 MET HA A 69 MET HBy 1.0 0.0 3.0 1504 1369 A 43 TYR HA A 43 TYR HBy 1.0 0.0 3.0 1505 1370 A 43 TYR HA A 43 TYR HBx 1.0 0.0 4.0 1506 1371 A 66 ASP HA A 66 ASP HBy 1.0 0.0 3.0 1507 1372 A 66 ASP HA A 66 ASP HBx 1.0 0.0 4.0 1508 1373 A 102 GLN HA A 102 GLN HGx 1.0 0.0 4.0 1509 1373 A 102 GLN HA A 102 GLN HGy 1.0 0.0 4.0 1510 1374 A 102 GLN HA A 102 GLN HBx 1.0 0.0 4.0 1511 1375 A 38 LYS HA A 38 LYS HBy 1.0 0.0 3.0 1512 1376 A 93 LEU HA A 93 LEU HBy 1.0 0.0 4.0 1513 1377 A 93 LEU HA A 93 LEU HBx 1.0 0.0 3.0 1514 1378 A 93 LEU HA A 93 LEU HDx% 1.0 0.0 3.0 1515 1379 A 72 PRO HDy A 72 PRO HA 1.0 0.0 5.0 1516 1380 A 72 PRO HBy A 72 PRO HA 1.0 0.0 3.0 1517 1381 A 72 PRO HGx A 72 PRO HA 1.0 0.0 5.0 1518 1382 A 112 PRO HA A 112 PRO HDy 1.0 0.0 4.0 1519 1382 A 112 PRO HA A 112 PRO HDx 1.0 0.0 4.0 1520 1383 A 94 ASN HA A 94 ASN HBy 1.0 0.0 3.0 1521 1384 A 36 PRO HA A 36 PRO HBx 1.0 0.0 5.0 1522 1385 A 65 ILE HA A 65 ILE HB 1.0 0.0 4.0 1523 1386 A 65 ILE HA A 65 ILE HG2% 1.0 0.0 3.0 1524 1387 A 65 ILE HA A 65 ILE HD1% 1.0 0.0 5.0 1525 1388 A 94 ASN HA A 94 ASN HBx 1.0 0.0 3.0 1526 1389 A 112 PRO HA A 112 PRO HBy 1.0 0.0 3.0 1527 1390 A 112 PRO HA A 112 PRO HBx 1.0 0.0 5.0 1528 1391 A 87 ASP HA A 87 ASP HBx 1.0 0.0 4.0 1529 1392 A 87 ASP HA A 87 ASP HBy 1.0 0.0 3.0 1530 1393 A 37 ARG HA A 37 ARG HBx 1.0 0.0 5.0 1531 1393 A 37 ARG HA A 37 ARG HBy 1.0 0.0 5.0 1532 1394 A 92 GLU HA A 92 GLU HBx 1.0 0.0 4.0 1533 1395 A 59 SER HA A 59 SER HBx 1.0 0.0 3.0 1534 1395 A 59 SER HA A 59 SER HBy 1.0 0.0 3.0 1535 1396 A 92 GLU HA A 92 GLU HGy 1.0 0.0 4.0 1536 1397 A 92 GLU HA A 92 GLU HGx 1.0 0.0 4.0 1537 1398 A 51 PRO HA A 51 PRO HGx 1.0 0.0 5.0 1538 1399 A 92 GLU HA A 92 GLU HBy 1.0 0.0 3.0 1539 1400 A 78 VAL HA A 78 VAL HGx% 1.0 0.0 3.0 1540 1401 A 78 VAL HA A 78 VAL HGy% 1.0 0.0 3.0 1541 1402 A 51 PRO HA A 51 PRO HDy 1.0 0.0 5.0 1542 1403 A 48 ASP HA A 48 ASP HBx 1.0 0.0 4.0 1543 1404 A 60 PRO HA A 60 PRO HBx 1.0 0.0 3.0 1544 1405 A 60 PRO HA A 60 PRO HGx 1.0 0.0 4.0 1545 1405 A 60 PRO HGy A 60 PRO HA 1.0 0.0 4.0 1546 1406 A 60 PRO HBy A 60 PRO HA 1.0 0.0 3.0 1547 1407 A 84 GLU HA A 84 GLU HGy 1.0 0.0 4.0 1548 1408 A 84 GLU HA A 84 GLU HGx 1.0 0.0 4.0 1549 1409 A 107 ILE HA A 107 ILE HB 1.0 0.0 4.0 1550 1410 A 54 LEU HA A 54 LEU HDx% 1.0 0.0 3.0 1551 1411 A 52 THR HA A 52 THR HB 1.0 0.0 4.0 1552 1412 A 51 PRO HBy A 51 PRO HDy 1.0 0.0 6.0 1553 1413 A 100 SER HA A 100 SER HBx 1.0 0.0 3.0 1554 1413 A 100 SER HA A 100 SER HBy 1.0 0.0 3.0 1555 1414 A 83 MET HA A 83 MET HGx 1.0 0.0 4.0 1556 1414 A 83 MET HA A 83 MET HGy 1.0 0.0 4.0 1557 1415 A 88 GLN HGy A 88 GLN HA 1.0 0.0 5.0 1558 1416 A 88 GLN HGx A 88 GLN HA 1.0 0.0 3.0 1559 1417 A 88 GLN HA A 88 GLN HBy 1.0 0.0 4.0 1560 1418 A 83 MET HA A 83 MET HBy 1.0 0.0 4.0 1561 1419 A 64 ILE HA A 64 ILE HB 1.0 0.0 4.0 1562 1420 A 52 THR HA A 52 THR HG2% 1.0 0.0 3.0 1563 1421 A 55 ARG HA A 55 ARG HDx 1.0 0.0 6.0 1564 1422 A 36 PRO HBx A 36 PRO HDy 1.0 0.0 6.0 1565 1423 A 60 PRO HDy A 60 PRO HA 1.0 0.0 5.0 1566 1424 A 60 PRO HDy A 60 PRO HBx 1.0 0.0 4.0 1567 1425 A 55 ARG HA A 55 ARG HBy 1.0 0.0 4.0 1568 1426 A 60 PRO HDy A 60 PRO HGx 1.0 0.0 3.0 1569 1426 A 60 PRO HDy A 60 PRO HGy 1.0 0.0 3.0 1570 1427 A 60 PRO HDy A 60 PRO HBy 1.0 0.0 5.0 1571 1428 A 99 GLU HA A 99 GLU HGy 1.0 0.0 6.0 1572 1429 A 99 GLU HA A 99 GLU HGx 1.0 0.0 4.0 1573 1430 A 99 GLU HA A 99 GLU HBx 1.0 0.0 3.0 1574 1430 A 99 GLU HA A 99 GLU HBy 1.0 0.0 3.0 1575 1431 A 72 PRO HDx A 72 PRO HA 1.0 0.0 5.0 1576 1432 A 72 PRO HDx A 72 PRO HBy 1.0 0.0 4.0 1577 1433 A 72 PRO HDx A 72 PRO HGy 1.0 0.0 3.0 1578 1434 A 72 PRO HDx A 72 PRO HBx 1.0 0.0 5.0 1579 1435 A 112 PRO HBy A 112 PRO HDy 1.0 0.0 4.0 1580 1435 A 112 PRO HDx A 112 PRO HBy 1.0 0.0 4.0 1581 1436 A 61 PHE HA A 61 PHE HBy 1.0 0.0 3.0 1582 1437 A 90 VAL HA A 90 VAL HB 1.0 0.0 4.0 1583 1438 A 55 ARG HDy A 55 ARG HA 1.0 0.0 5.0 1584 1439 A 55 ARG HDy A 55 ARG HGx 1.0 0.0 6.0 1585 1440 A 55 ARG HDx A 55 ARG HBy 1.0 0.0 5.0 1586 1441 A 60 PRO HDx A 60 PRO HA 1.0 0.0 5.0 1587 1442 A 40 ASN HA A 40 ASN HBy 1.0 0.0 4.0 1588 1443 A 58 PHE HA A 58 PHE HBx 1.0 0.0 6.0 1589 1444 A 38 LYS HGy A 38 LYS HEx 1.0 0.0 5.0 1590 1445 A 61 PHE HA A 61 PHE HBx 1.0 0.0 4.0 1591 1446 A 48 ASP HA A 48 ASP HBy 1.0 0.0 3.0 1592 1447 A 40 ASN HA A 40 ASN HBx 1.0 0.0 4.0 1593 1448 A 74 ASN HA A 74 ASN HBy 1.0 0.0 4.0 1594 1449 A 106 ASN HBx A 106 ASN HA 1.0 0.0 4.0 1595 1450 A 69 MET HGy A 69 MET HBx 1.0 0.0 3.0 1596 1450 A 69 MET HGy A 69 MET HBy 1.0 0.0 3.0 1597 1451 A 85 SER HBx A 85 SER HA 1.0 0.0 3.0 1598 1452 A 81 GLU HGy A 81 GLU HA 1.0 0.0 3.0 1599 1453 A 81 GLU HGy A 81 GLU HBx 1.0 0.0 3.0 1600 1454 A 72 PRO HGx A 72 PRO HBy 1.0 0.0 3.0 1601 1455 A 81 GLU HGy A 81 GLU HBy 1.0 0.0 4.0 1602 1456 A 73 ARG HA A 73 ARG HBx 1.0 0.0 3.0 1603 1456 A 73 ARG HA A 73 ARG HBy 1.0 0.0 3.0 1604 1457 A 92 GLU HGx A 92 GLU HBy 1.0 0.0 3.0 1605 1458 A 51 PRO HGx A 51 PRO HBx 1.0 0.0 3.0 1606 1459 A 92 GLU HGx A 92 GLU HBx 1.0 0.0 3.0 1607 1460 A 49 MET HGy A 49 MET HA 1.0 0.0 3.0 1608 1461 A 51 PRO HGx A 51 PRO HDy 1.0 0.0 3.0 1609 1462 A 81 GLU HBx A 81 GLU HA 1.0 0.0 3.0 1610 1463 A 51 PRO HDx A 51 PRO HGx 1.0 0.0 6.0 1611 1464 A 102 GLN HBx A 102 GLN HGx 1.0 0.0 3.0 1612 1464 A 102 GLN HGy A 102 GLN HBx 1.0 0.0 3.0 1613 1465 A 49 MET HGy A 49 MET HBx 1.0 0.0 4.0 1614 1466 A 47 GLU HBx A 47 GLU HGx 1.0 0.0 3.0 1615 1467 A 51 PRO HBx A 51 PRO HDy 1.0 0.0 5.0 1616 1468 A 83 MET HBy A 83 MET HGx 1.0 0.0 3.0 1617 1468 A 83 MET HGy A 83 MET HBy 1.0 0.0 3.0 1618 1469 A 97 GLN HBx A 97 GLN HGx 1.0 0.0 4.0 1619 1469 A 97 GLN HGy A 97 GLN HBx 1.0 0.0 4.0 1620 1470 A 97 GLN HBy A 97 GLN HGx 1.0 0.0 3.0 1621 1470 A 97 GLN HGy A 97 GLN HBy 1.0 0.0 3.0 1622 1471 A 49 MET HA A 49 MET HBy 1.0 0.0 3.0 1623 1472 A 60 PRO HDx A 60 PRO HBx 1.0 0.0 4.0 1624 1473 A 69 MET HGx A 69 MET HBx 1.0 0.0 3.0 1625 1473 A 69 MET HBy A 69 MET HGx 1.0 0.0 3.0 1626 1474 A 49 MET HGy A 49 MET HBy 1.0 0.0 4.0 1627 1475 A 60 PRO HBx A 60 PRO HGx 1.0 0.0 3.0 1628 1475 A 60 PRO HGy A 60 PRO HBx 1.0 0.0 3.0 1629 1476 A 53 LEU HBy A 53 LEU HA 1.0 0.0 3.0 1630 1477 A 36 PRO HDx A 36 PRO HBx 1.0 0.0 5.0 1631 1478 A 107 ILE HB A 107 ILE HG1x 1.0 0.0 3.0 1632 1479 A 107 ILE HB A 107 ILE HD1% 1.0 0.0 4.0 1633 1480 A 65 ILE HD1% A 65 ILE HB 1.0 0.0 4.0 1634 1481 A 42 LEU HA A 42 LEU HG 1.0 0.0 4.0 1635 1482 A 64 ILE HG1y A 64 ILE HB 1.0 0.0 3.0 1636 1483 A 64 ILE HG1y A 64 ILE HG1x 1.0 0.0 3.0 1637 1484 A 42 LEU HG A 42 LEU HBy 1.0 0.0 3.0 1638 1485 A 42 LEU HG A 42 LEU HBx 1.0 0.0 3.0 1639 1486 A 72 PRO HDy A 72 PRO HBx 1.0 0.0 5.0 1640 1487 A 55 ARG HA A 55 ARG HGy 1.0 0.0 3.0 1641 1488 A 60 PRO HDx A 60 PRO HGx 1.0 0.0 3.0 1642 1488 A 60 PRO HGy A 60 PRO HDx 1.0 0.0 3.0 1643 1489 A 72 PRO HBx A 72 PRO HGy 1.0 0.0 3.0 1644 1490 A 72 PRO HGx A 72 PRO HBx 1.0 0.0 4.0 1645 1491 A 53 LEU HDy% A 53 LEU HBx 1.0 0.0 3.0 1646 1492 A 93 LEU HDx% A 93 LEU HBy 1.0 0.0 4.0 1647 1493 A 60 PRO HBy A 60 PRO HGx 1.0 0.0 3.0 1648 1493 A 60 PRO HGy A 60 PRO HBy 1.0 0.0 3.0 1649 1494 A 64 ILE HB A 64 ILE HG1x 1.0 0.0 4.0 1650 1495 A 72 PRO HBx A 72 PRO HA 1.0 0.0 4.0 1651 1496 A 92 GLU HBx A 92 GLU HGy 1.0 0.0 3.0 1652 1497 A 38 LYS HGy A 38 LYS HDx 1.0 0.0 4.0 1653 1497 A 38 LYS HDy A 38 LYS HGy 1.0 0.0 4.0 1654 1498 A 37 ARG HA A 37 ARG HGx 1.0 0.0 4.0 1655 1498 A 37 ARG HA A 37 ARG HGy 1.0 0.0 4.0 1656 1499 A 53 LEU HG A 53 LEU HA 1.0 0.0 4.0 1657 1500 A 107 ILE HB A 107 ILE HG1y 1.0 0.0 3.0 1658 1501 A 107 ILE HG1y A 107 ILE HG1x 1.0 0.0 3.0 1659 1502 A 55 ARG HGx A 55 ARG HA 1.0 0.0 3.0 1660 1503 A 82 LYS HBx A 82 LYS HGy 1.0 0.0 3.0 1661 1504 A 104 LYS HGy A 104 LYS HDx 1.0 0.0 4.0 1662 1504 A 104 LYS HGy A 104 LYS HDy 1.0 0.0 4.0 1663 1505 A 104 LYS HA A 104 LYS HGy 1.0 0.0 4.0 1664 1506 A 82 LYS HBy A 82 LYS HGy 1.0 0.0 6.0 1665 1507 A 38 LYS HEx A 38 LYS HDx 1.0 0.0 5.0 1666 1507 A 38 LYS HDy A 38 LYS HEx 1.0 0.0 5.0 1667 1508 A 49 MET HA A 49 MET HBx 1.0 0.0 3.0 1668 1509 A 38 LYS HBy A 38 LYS HDx 1.0 0.0 3.0 1669 1509 A 38 LYS HBy A 38 LYS HDy 1.0 0.0 3.0 1670 1510 A 38 LYS HBx A 38 LYS HDx 1.0 0.0 3.0 1671 1510 A 38 LYS HDy A 38 LYS HBx 1.0 0.0 3.0 1672 1511 A 78 VAL HA A 78 VAL HB 1.0 0.0 3.0 1673 1512 A 67 LEU HBx A 67 LEU HG 1.0 0.0 6.0 1674 1513 A 96 THR HA A 96 THR HG2% 1.0 0.0 3.0 1675 1514 A 54 LEU HBx A 54 LEU HA 1.0 0.0 3.0 1676 1515 A 54 LEU HBx A 54 LEU HDy% 1.0 0.0 6.0 1677 1516 A 103 LEU HG A 103 LEU HBx 1.0 0.0 6.0 1678 1517 A 44 VAL HA A 44 VAL HGx% 1.0 0.0 3.0 1679 1518 A 65 ILE HB A 65 ILE HG1x 1.0 0.0 4.0 1680 1519 A 101 VAL HA A 101 VAL HGy% 1.0 0.0 3.0 1681 1520 A 103 LEU HDy% A 103 LEU HA 1.0 0.0 3.0 1682 1521 A 64 ILE HA A 64 ILE HG2% 1.0 0.0 3.0 1683 1522 A 54 LEU HDy% A 54 LEU HBy 1.0 0.0 3.0 1684 1523 A 64 ILE HG1y A 64 ILE HG2% 1.0 0.0 4.0 1685 1524 A 64 ILE HD1% A 64 ILE HG2% 1.0 0.0 3.0 1686 1525 A 60 PRO HBy A 60 PRO HDx 1.0 0.0 5.0 1687 1526 A 93 LEU HDy% A 93 LEU HBy 1.0 0.0 3.0 1688 1527 A 93 LEU HDy% A 93 LEU HBx 1.0 0.0 3.0 1689 1528 A 80 TYR HH A 58 PHE HD% 1.0 0.0 4.0 1690 1529 A 78 VAL H A 77 PHE HD% 1.0 0.0 5.0 1691 1530 A 74 ASN H A 45 TYR HE% 1.0 0.0 6.0 1692 1531 A 44 VAL H A 77 PHE HD% 1.0 0.0 5.0 1693 1532 A 44 VAL H A 43 TYR HE% 1.0 0.0 6.0 1694 1533 A 58 PHE HD% A 54 LEU H 1.0 0.0 6.0 1695 1534 A 77 PHE HE% A 43 TYR HD% 1.0 0.0 3.0 1696 1535 A 58 PHE HD% A 61 PHE HD% 1.0 0.0 5.0 1697 1536 A 75 CYS H A 77 PHE HE% 1.0 0.0 6.0 1698 1537 A 85 SER H A 80 TYR HD% 1.0 0.0 6.0 1699 1538 A 58 PHE HE% A 80 TYR HE% 1.0 0.0 6.0 1700 1539 A 77 PHE HD% A 43 TYR HD% 1.0 0.0 5.0 1701 1540 A 58 PHE HD% A 80 TYR HE% 1.0 0.0 4.0 1702 1541 A 45 TYR HE% A 75 CYS HA 1.0 0.0 6.0 1703 1542 A 43 TYR HD% A 77 PHE HA 1.0 0.0 6.0 1704 1543 A 43 TYR HD% A 105 VAL HA 1.0 0.0 5.0 1705 1544 A 43 TYR HD% A 44 VAL HA 1.0 0.0 5.0 1706 1545 A 80 TYR HD% A 58 PHE HA 1.0 0.0 6.0 1707 1546 A 45 TYR HE% A 73 ARG HA 1.0 0.0 6.0 1708 1547 A 80 TYR HE% A 61 PHE HA 1.0 0.0 6.0 1709 1548 A 43 TYR HD% A 108 ALA HA 1.0 0.0 5.0 1710 1549 A 61 PHE HD% A 59 SER HBx 1.0 0.0 6.0 1711 1549 A 61 PHE HD% A 59 SER HBy 1.0 0.0 6.0 1712 1550 A 58 PHE HD% A 55 ARG HA 1.0 0.0 5.0 1713 1551 A 61 PHE HD% A 60 PRO HDy 1.0 0.0 6.0 1714 1552 A 77 PHE HE% A 43 TYR HBy 1.0 0.0 5.0 1715 1553 A 77 PHE HD% A 43 TYR HBy 1.0 0.0 5.0 1716 1554 A 58 PHE HD% A 61 PHE HBx 1.0 0.0 6.0 1717 1555 A 58 PHE HD% A 89 ALA HA 1.0 0.0 6.0 1718 1556 A 43 TYR HE% A 75 CYS HBx 1.0 0.0 6.0 1719 1557 A 80 TYR HD% A 85 SER HBx 1.0 0.0 4.0 1720 1558 A 77 PHE HE% A 73 ARG HBx 1.0 0.0 5.0 1721 1558 A 77 PHE HE% A 73 ARG HBy 1.0 0.0 5.0 1722 1559 A 43 TYR HE% A 73 ARG HBx 1.0 0.0 6.0 1723 1559 A 43 TYR HE% A 73 ARG HBy 1.0 0.0 6.0 1724 1560 A 45 TYR HD% A 47 GLU HGy 1.0 0.0 6.0 1725 1561 A 43 TYR HD% A 104 LYS HBy 1.0 0.0 6.0 1726 1562 A 45 TYR HE% A 104 LYS HBy 1.0 0.0 6.0 1727 1563 A 43 TYR HE% A 104 LYS HBy 1.0 0.0 6.0 1728 1564 A 58 PHE HD% A 54 LEU HBy 1.0 0.0 5.0 1729 1565 A 45 TYR HE% A 104 LYS HGx 1.0 0.0 6.0 1730 1566 A 61 PHE HD% A 92 GLU HBx 1.0 0.0 6.0 1731 1567 A 45 TYR HD% A 104 LYS HGx 1.0 0.0 4.0 1732 1568 A 77 PHE HD% A 42 LEU HBy 1.0 0.0 6.0 1733 1569 A 45 TYR HD% A 104 LYS HGy 1.0 0.0 5.0 1734 1570 A 77 PHE HE% A 108 ALA HB% 1.0 0.0 5.0 1735 1571 A 43 TYR HE% A 108 ALA HB% 1.0 0.0 6.0 1736 1572 A 80 TYR HD% A 89 ALA HB% 1.0 0.0 4.0 1737 1573 A 77 PHE HE% A 41 THR HG2% 1.0 0.0 5.0 1738 1574 A 77 PHE HD% A 41 THR HG2% 1.0 0.0 3.0 1739 1575 A 43 TYR HD% A 105 VAL HGx% 1.0 0.0 6.0 1740 1576 A 61 PHE HD% A 42 LEU HDx% 1.0 0.0 6.0 1741 1577 A 43 TYR HD% A 105 VAL HGy% 1.0 0.0 6.0 1742 1578 A 77 PHE HD% A 76 ALA HB% 1.0 0.0 5.0 1743 1579 A 45 TYR HD% A 44 VAL HGx% 1.0 0.0 6.0 1744 1580 A 43 TYR HD% A 44 VAL HGx% 1.0 0.0 6.0 1745 1581 A 43 TYR HE% A 44 VAL HGx% 1.0 0.0 6.0 1746 1582 A 80 TYR HD% A 64 ILE HD1% 1.0 0.0 5.0 1747 1583 A 45 TYR HD% A 103 LEU HDy% 1.0 0.0 6.0 1748 1584 A 80 TYR HD% A 64 ILE HG2% 1.0 0.0 5.0 1749 1585 A 43 TYR HD% A 44 VAL HGy% 1.0 0.0 6.0 1750 1586 A 61 PHE HD% A 60 PRO HBy 1.0 0.0 6.0 1751 1587 A 58 PHE HD% A 93 LEU HDy% 1.0 0.0 4.0 1752 1588 A 80 TYR HH A 80 TYR HE% 1.0 0.0 6.0 1753 1589 A 80 TYR HE% A 80 TYR HA 1.0 0.0 6.0 1754 1590 A 43 TYR HE% A 43 TYR HA 1.0 0.0 6.0 1755 1591 A 80 TYR HE% A 80 TYR HBy 1.0 0.0 6.0 1756 1592 A 43 TYR H A 42 LEU HDx% 1.0 0.0 5.0 1757 1593 A 43 TYR H A 42 LEU HDy% 1.0 0.0 5.0 1758 1594 A 50 THR H A 49 MET HBy 1.0 0.0 5.0 1759 1595 A 53 LEU H A 52 THR HG2% 1.0 0.0 5.0 1760 1596 A 54 LEU H A 53 LEU HBx 1.0 0.0 3.0 1761 1597 A 54 LEU H A 53 LEU HDy% 1.0 0.0 5.0 1762 1598 A 56 GLY H A 55 ARG HBy 1.0 0.0 5.0 1763 1598 A 56 GLY H A 55 ARG HBx 1.0 0.0 5.0 1764 1599 A 58 PHE H A 57 ALA HA 1.0 0.0 5.0 1765 1600 A 63 ASN H A 62 GLY HAy 1.0 0.0 5.0 1766 1600 A 63 ASN H A 62 GLY HAx 1.0 0.0 5.0 1767 1601 A 65 ILE H A 64 ILE HG1x 1.0 0.0 5.0 1768 1602 A 66 ASP H A 65 ILE HG1y 1.0 0.0 4.0 1769 1603 A 68 SER H A 67 LEU HBx 1.0 0.0 5.0 1770 1604 A 73 ARG H A 72 PRO HA 1.0 0.0 4.0 1771 1605 A 74 ASN H A 73 ARG HA 1.0 0.0 5.0 1772 1606 A 80 TYR H A 79 THR HG2% 1.0 0.0 3.0 1773 1607 A 82 LYS H A 81 GLU HA 1.0 0.0 5.0 1774 1608 A 83 MET H A 82 LYS HA 1.0 0.0 3.0 1775 1609 A 83 MET H A 82 LYS HGy 1.0 0.0 5.0 1776 1610 A 85 SER H A 86 ALA HB% 1.0 0.0 5.0 1777 1611 A 86 ALA H A 85 SER HBy 1.0 0.0 4.0 1778 1612 A 89 ALA H A 88 GLN HA 1.0 0.0 4.0 1779 1613 A 89 ALA H A 90 VAL HGy% 1.0 0.0 5.0 1780 1614 A 90 VAL H A 91 ALA H 1.0 0.0 4.0 1781 1615 A 92 GLU H A 91 ALA H 1.0 0.0 4.0 1782 1616 A 99 GLU H A 98 VAL HGy% 1.0 0.0 5.0 1783 1617 A 104 LYS H A 103 LEU HA 1.0 0.0 3.0 1784 1618 A 104 LYS H A 103 LEU HBy 1.0 0.0 5.0 1785 1619 A 57 ALA HB% A 54 LEU HDx% 1.0 0.0 5.0 1786 1620 A 58 PHE H A 55 ARG HA 1.0 0.0 5.0 1787 1621 A 61 PHE H A 59 SER HA 1.0 0.0 5.0 1788 1622 A 62 GLY H A 59 SER HA 1.0 0.0 5.0 1789 1623 A 89 ALA H A 91 ALA H 1.0 0.0 5.0 1790 1624 A 86 ALA HA A 42 LEU HDx% 1.0 0.0 4.0 1791 1625 A 42 LEU HDx% A 78 VAL HGy% 1.0 0.0 5.0 1792 1626 A 79 THR HA A 41 THR HG2% 1.0 0.0 5.0 1793 1627 A 66 ASP HBx A 79 THR HG2% 1.0 0.0 5.0 1794 1628 A 42 LEU H A 78 VAL HB 1.0 0.0 5.0 1795 1629 A 44 VAL H A 76 ALA HB% 1.0 0.0 5.0 1796 1630 A 68 SER H A 77 PHE H 1.0 0.0 4.0 1797 1631 A 69 MET HA A 76 ALA HA 1.0 0.0 4.0 1798 1632 A 58 PHE HD% A 78 VAL HGy% 1.0 0.0 4.0 1799 1633 A 80 TYR HE% A 86 ALA HB% 1.0 0.0 5.0 1800 1634 A 62 GLY H A 80 TYR HE% 1.0 0.0 4.0 1801 1635 A 89 ALA H A 80 TYR HE% 1.0 0.0 5.0 1802 1636 A 89 ALA H A 80 TYR HD% 1.0 0.0 6.0 1803 1637 A 80 TYR HD% A 64 ILE HG1y 1.0 0.0 5.0 1804 1638 A 80 TYR HD% A 64 ILE HG1x 1.0 0.0 4.0 1805 1639 A 59 SER H A 58 PHE H 1.0 0.0 4.0 1806 1640 A 43 TYR H A 106 ASN H 1.0 0.0 4.0 1807 1641 A 80 TYR HE% A 85 SER HA 1.0 0.0 6.0 1808 1642 A 80 TYR HE% A 85 SER HBy 1.0 0.0 5.0 1809 1643 A 61 PHE HZ A 93 LEU HDy% 1.0 0.0 5.0 1810 1644 A 43 TYR HE% A 75 CYS HBy 1.0 0.0 4.0 1811 1644 A 43 TYR HE% A 75 CYS HBx 1.0 0.0 4.0 1812 1645 A 61 PHE HD% A 89 ALA HB% 1.0 0.0 4.0 1813 1646 A 58 PHE HE% A 93 LEU HDy% 1.0 0.0 5.0 1814 1647 A 53 LEU H A 54 LEU H 1.0 0.0 3.0 1815 1648 A 100 SER H A 98 VAL HGy% 1.0 0.0 5.0 1816 1648 A 100 SER H A 98 VAL HGx% 1.0 0.0 5.0 1817 1649 A 101 VAL H A 100 SER H 1.0 0.0 3.0 1818 1650 A 75 CYS HA A 49 MET HE% 1.0 0.0 4.0 1819 1651 A 50 THR H A 69 MET HE% 1.0 0.0 5.0 1820 1652 A 45 TYR HA A 49 MET HE% 1.0 0.0 4.0 1821 1653 A 49 MET HE% A 54 LEU HDy% 1.0 0.0 5.0 1822 1654 A 54 LEU HDy% A 78 VAL HGy% 1.0 0.0 5.0 1823 1655 A 50 THR HA A 69 MET HE% 1.0 0.0 4.0 1824 1656 A 58 PHE HBy A 64 ILE HD1% 1.0 0.0 4.0 1825 1657 A 64 ILE HD1% A 55 ARG HA 1.0 0.0 5.0 1826 1658 A 49 MET HE% A 46 GLY HAx 1.0 0.0 4.0 1827 1658 A 46 GLY HAy A 49 MET HE% 1.0 0.0 4.0 1828 1659 A 49 MET HE% A 44 VAL HGx% 1.0 0.0 4.0 1829 1660 A 74 ASN HA A 49 MET HE% 1.0 0.0 5.0 1830 1661 A 49 MET HE% A 76 ALA HB% 1.0 0.0 4.0 1831 1662 A 42 LEU HBy A 78 VAL HGy% 1.0 0.0 4.0 1832 1663 A 93 LEU H A 90 VAL HA 1.0 0.0 5.0 1833 1664 A 100 SER HA A 98 VAL HGy% 1.0 0.0 6.0 1834 1665 A 80 TYR HH A 58 PHE HBx 1.0 0.0 5.0 1835 1666 A 73 ARG H A 70 ASP HBx 1.0 0.0 5.0 1836 1667 A 76 ALA H A 75 CYS HBy 1.0 0.0 5.0 1837 1667 A 76 ALA H A 75 CYS HBx 1.0 0.0 5.0 1838 1668 A 82 LYS H A 81 GLU H 1.0 0.0 3.0 1839 1669 A 85 SER H A 88 GLN H 1.0 0.0 6.0 1840 1670 A 90 VAL H A 89 ALA H 1.0 0.0 3.0 1841 1671 A 80 TYR HD% A 62 GLY HAy 1.0 0.0 5.0 1842 1672 A 80 TYR HD% A 62 GLY HAx 1.0 0.0 6.0 1843 1673 A 58 PHE HD% A 42 LEU HDx% 1.0 0.0 4.0 1844 1674 A 89 ALA HB% A 42 LEU HDx% 1.0 0.0 4.0 1845 1675 A 86 ALA HB% A 42 LEU HDx% 1.0 0.0 4.0 1846 1676 A 51 PRO HA A 67 LEU HDx% 1.0 0.0 4.0 1847 1677 A 51 PRO HA A 54 LEU HDx% 1.0 0.0 5.0 1848 1678 A 51 PRO HA A 54 LEU HBy 1.0 0.0 5.0 1849 1679 A 51 PRO HA A 54 LEU HBx 1.0 0.0 5.0 1850 1680 A 51 PRO HA A 69 MET HE% 1.0 0.0 4.0 1851 1681 A 51 PRO HDx A 69 MET HE% 1.0 0.0 4.0 1852 1682 A 51 PRO HDy A 69 MET HE% 1.0 0.0 5.0 1853 1683 A 54 LEU HDy% A 69 MET HE% 1.0 0.0 4.0 1854 1684 A 76 ALA HB% A 69 MET HE% 1.0 0.0 4.0 1855 1685 A 49 MET H A 69 MET HE% 1.0 0.0 5.0 1856 1686 A 70 ASP H A 69 MET HE% 1.0 0.0 5.0 1857 1687 A 67 LEU HDy% A 78 VAL HGy% 1.0 0.0 5.0 1858 1688 A 80 TYR HH A 61 PHE H 1.0 0.0 4.0 1859 1689 A 80 TYR HH A 58 PHE HA 1.0 0.0 4.0 1860 1690 A 85 SER H A 84 GLU HA 1.0 0.0 4.0 1861 1691 A 88 GLN H A 84 GLU HA 1.0 0.0 5.0 1862 1692 A 86 ALA H A 84 GLU HA 1.0 0.0 5.0 1863 1693 A 84 GLU HA A 87 ASP HBy 1.0 0.0 4.0 1864 1693 A 84 GLU HA A 87 ASP HBx 1.0 0.0 4.0 1865 1694 A 89 ALA HA A 93 LEU HG 1.0 0.0 5.0 1866 1695 A 93 LEU HDy% A 103 LEU HDx% 1.0 0.0 5.0 1867 1696 A 58 PHE HE% A 103 LEU HDx% 1.0 0.0 5.0 1868 1697 A 93 LEU HA A 103 LEU HDx% 1.0 0.0 5.0 1869 1698 A 44 VAL H A 44 VAL HB 1.0 0.0 3.0 1870 1699 A 58 PHE HE% A 44 VAL HB 1.0 0.0 5.0 1871 1700 A 44 VAL HB A 76 ALA HB% 1.0 0.0 4.0 1872 1701 A 43 TYR HA A 44 VAL HB 1.0 0.0 5.0 1873 1702 A 101 VAL H A 101 VAL HGx% 1.0 0.0 4.0 1874 1703 A 90 VAL HA A 105 VAL HB 1.0 0.0 4.0 1875 1704 A 94 ASN H A 105 VAL HB 1.0 0.0 5.0 1876 1705 A 53 LEU H A 53 LEU HBx 1.0 0.0 3.0 1877 1706 A 54 LEU H A 54 LEU HG 1.0 0.0 3.0 1878 1707 A 54 LEU H A 54 LEU HBy 1.0 0.0 3.0 1879 1708 A 79 THR HG2% A 65 ILE HD1% 1.0 0.0 4.0 1880 1709 A 47 GLU H A 103 LEU HDy% 1.0 0.0 5.0 1881 1710 A 50 THR H A 49 MET HGy 1.0 0.0 5.0 1882 1711 A 45 TYR HE% A 74 ASN HBy 1.0 0.0 3.0 1883 1712 A 45 TYR HE% A 74 ASN HBx 1.0 0.0 5.0 1884 1713 A 80 TYR HE% A 64 ILE HG2% 1.0 0.0 5.0 1885 1714 A 80 TYR HE% A 42 LEU HBy 1.0 0.0 6.0 1886 1715 A 80 TYR HE% A 61 PHE HBx 1.0 0.0 4.0 1887 1716 A 80 TYR HE% A 58 PHE HBy 1.0 0.0 5.0 1888 1717 A 80 TYR HE% A 58 PHE HBx 1.0 0.0 5.0 1889 1718 A 80 TYR HE% A 62 GLY HAy 1.0 0.0 5.0 1890 1719 A 80 TYR HE% A 62 GLY HAx 1.0 0.0 5.0 1891 1720 A 45 TYR H A 104 LYS HBy 1.0 0.0 5.0 1892 1721 A 45 TYR H A 104 LYS HBx 1.0 0.0 5.0 1893 1722 A 46 GLY H A 45 TYR HBx 1.0 0.0 5.0 1894 1722 A 46 GLY H A 45 TYR HBy 1.0 0.0 5.0 1895 1723 A 47 GLU H A 47 GLU HBy 1.0 0.0 3.0 1896 1724 A 47 GLU H A 47 GLU HGy 1.0 0.0 4.0 1897 1725 A 52 THR H A 51 PRO HGy 1.0 0.0 5.0 1898 1726 A 52 THR H A 51 PRO HDy 1.0 0.0 4.0 1899 1727 A 56 GLY H A 54 LEU H 1.0 0.0 5.0 1900 1728 A 55 ARG H A 55 ARG HBx 1.0 0.0 3.0 1901 1729 A 58 PHE H A 60 PRO HDx 1.0 0.0 4.0 1902 1730 A 61 PHE H A 58 PHE HA 1.0 0.0 4.0 1903 1731 A 63 ASN H A 62 GLY HAx 1.0 0.0 3.0 1904 1732 A 66 ASP H A 65 ILE HG1x 1.0 0.0 5.0 1905 1733 A 70 ASP H A 76 ALA HA 1.0 0.0 3.0 1906 1734 A 73 ARG H A 72 PRO HGy 1.0 0.0 5.0 1907 1735 A 76 ALA H A 44 VAL HB 1.0 0.0 4.0 1908 1736 A 83 MET H A 82 LYS HBy 1.0 0.0 5.0 1909 1737 A 85 SER H A 84 GLU HBx 1.0 0.0 4.0 1910 1737 A 85 SER H A 84 GLU HBy 1.0 0.0 4.0 1911 1738 A 86 ALA H A 80 TYR HBx 1.0 0.0 5.0 1912 1739 A 86 ALA H A 85 SER HA 1.0 0.0 4.0 1913 1740 A 87 ASP H A 87 ASP HBx 1.0 0.0 3.0 1914 1741 A 87 ASP H A 88 GLN H 1.0 0.0 3.0 1915 1742 A 89 ALA H A 87 ASP H 1.0 0.0 5.0 1916 1743 A 88 GLN H A 88 GLN HBy 1.0 0.0 3.0 1917 1744 A 88 GLN H A 88 GLN HBx 1.0 0.0 3.0 1918 1745 A 86 ALA H A 88 GLN H 1.0 0.0 5.0 1919 1746 A 89 ALA H A 61 PHE HBy 1.0 0.0 5.0 1920 1747 A 89 ALA H A 61 PHE HD% 1.0 0.0 5.0 1921 1748 A 90 VAL H A 89 ALA HA 1.0 0.0 5.0 1922 1749 A 90 VAL H A 88 GLN HA 1.0 0.0 5.0 1923 1750 A 91 ALA H A 88 GLN HA 1.0 0.0 5.0 1924 1751 A 92 GLU H A 88 GLN HA 1.0 0.0 5.0 1925 1752 A 94 ASN H A 92 GLU H 1.0 0.0 5.0 1926 1753 A 98 VAL H A 97 GLN HBy 1.0 0.0 5.0 1927 1754 A 98 VAL H A 100 SER HA 1.0 0.0 6.0 1928 1755 A 99 GLU H A 98 VAL HGx% 1.0 0.0 4.0 1929 1756 A 100 SER H A 98 VAL HGy% 1.0 0.0 5.0 1930 1757 A 101 VAL H A 98 VAL HGy% 1.0 0.0 4.0 1931 1758 A 101 VAL H A 98 VAL HGx% 1.0 0.0 5.0 1932 1759 A 101 VAL H A 98 VAL HB 1.0 0.0 5.0 1933 1760 A 101 VAL H A 100 SER HA 1.0 0.0 4.0 1934 1761 A 102 GLN H A 101 VAL HGx% 1.0 0.0 5.0 1935 1762 A 103 LEU H A 98 VAL HGy% 1.0 0.0 5.0 1936 1763 A 103 LEU H A 102 GLN HBy 1.0 0.0 4.0 1937 1764 A 104 LYS H A 44 VAL HGx% 1.0 0.0 5.0 1938 1765 A 104 LYS H A 103 LEU HG 1.0 0.0 5.0 1939 1766 A 106 ASN H A 105 VAL HGx% 1.0 0.0 4.0 1940 1767 A 106 ASN H A 43 TYR HBy 1.0 0.0 5.0 1941 1768 A 108 ALA H A 109 ARG H 1.0 0.0 5.0 1942 1769 A 90 VAL H A 42 LEU HDx% 1.0 0.0 4.0 1943 1770 A 45 TYR HD% A 104 LYS HBx 1.0 0.0 5.0 1944 1771 A 45 TYR HD% A 104 LYS HDx 1.0 0.0 5.0 1945 1771 A 45 TYR HD% A 104 LYS HDy 1.0 0.0 5.0 1946 1772 A 47 GLU HA A 74 ASN HBx 1.0 0.0 5.0 1947 1773 A 49 MET HBy A 54 LEU HDx% 1.0 0.0 5.0 1948 1774 A 54 LEU HDy% A 49 MET HBy 1.0 0.0 5.0 1949 1775 A 49 MET HBy A 69 MET HE% 1.0 0.0 5.0 1950 1776 A 49 MET HBx A 69 MET HE% 1.0 0.0 5.0 1951 1777 A 49 MET HE% A 69 MET HE% 1.0 0.0 5.0 1952 1778 A 51 PRO HBy A 67 LEU HDx% 1.0 0.0 5.0 1953 1779 A 103 LEU HDy% A 53 LEU HDy% 1.0 0.0 5.0 1954 1780 A 67 LEU HDx% A 54 LEU HBy 1.0 0.0 5.0 1955 1781 A 78 VAL HGy% A 54 LEU HDx% 1.0 0.0 5.0 1956 1782 A 103 LEU HDy% A 54 LEU HDx% 1.0 0.0 4.0 1957 1783 A 67 LEU HDy% A 54 LEU HDy% 1.0 0.0 5.0 1958 1784 A 69 MET HGy A 54 LEU HDy% 1.0 0.0 5.0 1959 1785 A 76 ALA HB% A 54 LEU HDy% 1.0 0.0 4.0 1960 1786 A 57 ALA HB% A 93 LEU HDx% 1.0 0.0 4.0 1961 1787 A 80 TYR HH A 61 PHE HBy 1.0 0.0 5.0 1962 1788 A 89 ALA HB% A 61 PHE HBy 1.0 0.0 5.0 1963 1789 A 85 SER HA A 61 PHE HBy 1.0 0.0 5.0 1964 1790 A 61 PHE HD% A 88 GLN HBy 1.0 0.0 5.0 1965 1791 A 61 PHE HD% A 88 GLN HBx 1.0 0.0 5.0 1966 1792 A 61 PHE HD% A 88 GLN HGy 1.0 0.0 5.0 1967 1793 A 61 PHE HD% A 88 GLN HGx 1.0 0.0 4.0 1968 1794 A 61 PHE HD% A 89 ALA HA 1.0 0.0 5.0 1969 1795 A 85 SER HBx A 62 GLY HAy 1.0 0.0 5.0 1970 1796 A 80 TYR HE% A 64 ILE HG1y 1.0 0.0 5.0 1971 1797 A 65 ILE H A 79 THR HB 1.0 0.0 5.0 1972 1798 A 79 THR HB A 65 ILE HG1y 1.0 0.0 5.0 1973 1799 A 79 THR HB A 65 ILE HD1% 1.0 0.0 5.0 1974 1800 A 65 ILE HD1% A 81 GLU HA 1.0 0.0 4.0 1975 1801 A 67 LEU HDy% A 78 VAL HGx% 1.0 0.0 5.0 1976 1802 A 76 ALA HB% A 69 MET HBx 1.0 0.0 5.0 1977 1802 A 69 MET HBy A 76 ALA HB% 1.0 0.0 5.0 1978 1803 A 106 ASN HA A 90 VAL HGx% 1.0 0.0 5.0 1979 1804 A 61 PHE HE% A 93 LEU HDy% 1.0 0.0 4.0 1980 1805 A 61 PHE HE% A 92 GLU HBy 1.0 0.0 4.0 1981 1806 A 77 PHE HD% A 108 ALA HB% 1.0 0.0 5.0 1982 1807 A 58 PHE HD% A 80 TYR HD% 1.0 0.0 5.0 1983 1808 A 80 TYR HD% A 85 SER HBy 1.0 0.0 5.0 1984 1809 A 80 TYR HD% A 86 ALA HB% 1.0 0.0 4.0 1985 1810 A 93 LEU H A 61 PHE HZ 1.0 0.0 5.0 1986 1811 A 61 PHE HZ A 93 LEU HG 1.0 0.0 5.0 1987 1812 A 61 PHE HZ A 92 GLU HGx 1.0 0.0 5.0 1988 1813 A 58 PHE HD% A 86 ALA HA 1.0 0.0 5.0 1989 1814 A 58 PHE HD% A 54 LEU HG 1.0 0.0 6.0 1990 1815 A 58 PHE HD% A 89 ALA HB% 1.0 0.0 5.0 1991 1816 A 45 TYR HD% A 43 TYR HE% 1.0 0.0 4.0 1992 1817 A 77 PHE HE% A 43 TYR HE% 1.0 0.0 4.0 1993 1818 A 43 TYR HE% A 45 TYR HBx 1.0 0.0 3.0 1994 1818 A 43 TYR HE% A 45 TYR HBy 1.0 0.0 3.0 1995 1819 A 45 TYR HE% A 104 LYS HDx 1.0 0.0 5.0 1996 1819 A 45 TYR HE% A 104 LYS HDy 1.0 0.0 5.0 1997 1820 A 45 TYR HE% A 47 GLU HGx 1.0 0.0 5.0 1998 1820 A 45 TYR HE% A 47 GLU HGy 1.0 0.0 5.0 1999 1821 A 80 TYR HE% A 93 LEU HDy% 1.0 0.0 5.0 2000 1822 A 80 TYR HE% A 85 SER HBx 1.0 0.0 5.0 2001 1823 A 61 PHE HD% A 80 TYR HE% 1.0 0.0 5.0 2002 1824 A 43 TYR HD% A 108 ALA HB% 1.0 0.0 5.0 2003 1825 A 43 TYR HD% A 106 ASN HA 1.0 0.0 5.0 2004 1826 A 61 PHE HD% A 93 LEU HDy% 1.0 0.0 4.0 2005 1827 A 61 PHE HD% A 93 LEU HDx% 1.0 0.0 5.0 2006 1828 A 80 TYR HH A 61 PHE HD% 1.0 0.0 5.0 2007 1829 A 61 PHE HD% A 58 PHE HA 1.0 0.0 5.0 2008 1830 A 61 PHE HE% A 58 PHE HA 1.0 0.0 5.0 2009 1831 A 61 PHE HZ A 89 ALA HA 1.0 0.0 5.0 2010 1832 A 96 THR H A 105 VAL HGy% 1.0 0.0 6.0 2011 1833 A 57 ALA H A 93 LEU HDx% 1.0 0.0 6.0 2012 1834 A 106 ASN H A 44 VAL HGx% 1.0 0.0 6.0 2013 1835 A 68 SER H A 67 LEU HDy% 1.0 0.0 6.0 2014 1836 A 78 VAL H A 67 LEU HDx% 1.0 0.0 6.0 2015 1837 A 49 MET HGy A 53 LEU HDy% 1.0 0.0 6.0 2016 1838 A 54 LEU HA A 103 LEU HDx% 1.0 0.0 6.0 2017 1839 A 85 SER HBx A 88 GLN HBy 1.0 0.0 6.0 2018 1840 A 89 ALA H A 88 GLN HBy 1.0 0.0 6.0 2019 1841 A 103 LEU H A 102 GLN HBx 1.0 0.0 6.0 2020 1842 A 55 ARG HGx A 67 LEU HDx% 1.0 0.0 6.0 2021 1843 A 52 THR HA A 53 LEU HBx 1.0 0.0 6.0 2022 1844 A 47 GLU H A 49 MET HBx 1.0 0.0 6.0 2023 1845 A 106 ASN HA A 107 ILE HG1x 1.0 0.0 6.0 2024 1846 A 85 SER HBy A 86 ALA HB% 1.0 0.0 6.0 2025 1847 A 90 VAL HB A 86 ALA HB% 1.0 0.0 6.0 2026 1848 A 103 LEU HBy A 101 VAL HGy% 1.0 0.0 6.0 2027 1849 A 49 MET HA A 53 LEU HDy% 1.0 0.0 6.0 2028 1850 A 96 THR HB A 93 LEU HDx% 1.0 0.0 6.0 2029 1851 A 54 LEU HDx% A 105 VAL HGx% 1.0 0.0 6.0 2030 1852 A 104 LYS HA A 44 VAL HA 1.0 0.0 6.0 2031 1853 A 103 LEU HBy A 103 LEU HDx% 1.0 0.0 6.0 2032 1854 A 81 GLU HBy A 81 GLU HA 1.0 0.0 6.0 2033 1855 A 38 LYS HA A 38 LYS HBx 1.0 0.0 6.0 2034 1856 A 72 PRO HDy A 72 PRO HGx 1.0 0.0 6.0 2035 1857 A 103 LEU HBy A 103 LEU HA 1.0 0.0 6.0 2036 1858 A 81 GLU H A 81 GLU HA 1.0 0.0 6.0 2037 1859 A 104 LYS HGx A 104 LYS HEx 1.0 0.0 6.0 2038 1859 A 104 LYS HEy A 104 LYS HGx 1.0 0.0 6.0 2039 1860 A 80 TYR HD% A 40 ASN HBy 1.0 0.0 6.0 2040 1861 A 108 ALA H A 90 VAL HGy% 1.0 0.0 6.0 2041 1862 A 61 PHE H A 64 ILE HD1% 1.0 0.0 6.0 2042 1863 A 96 THR H A 93 LEU HDx% 1.0 0.0 6.0 2043 1864 A 49 MET H A 54 LEU HDy% 1.0 0.0 6.0 2044 1865 A 74 ASN H A 72 PRO HGx 1.0 0.0 6.0 2045 1866 A 70 ASP H A 77 PHE HBx 1.0 0.0 6.0 2046 1866 A 70 ASP H A 77 PHE HBy 1.0 0.0 6.0 2047 1867 A 106 ASN H A 42 LEU HBy 1.0 0.0 6.0 2048 1868 A 59 SER H A 60 PRO HBy 1.0 0.0 6.0 2049 1869 A 83 MET H A 40 ASN HD21 1.0 0.0 5.0 2050 1870 A 57 ALA HB% A 103 LEU HDx% 1.0 0.0 6.0 2051 1871 A 104 LYS HA A 94 ASN HD21 1.0 0.0 6.0 2052 1872 A 96 THR HG2% A 98 VAL HGy% 1.0 0.0 6.0 2053 1873 A 51 PRO HBx A 50 THR HG2% 1.0 0.0 6.0 2054 1874 A 83 MET HA A 84 GLU HGy 1.0 0.0 6.0 2055 1875 A 65 ILE HB A 81 GLU HA 1.0 0.0 6.0 2056 1876 A 98 VAL HA A 98 VAL HGy% 1.0 0.0 3.0 2057 1877 A 88 GLN HGx A 88 GLN HBy 1.0 0.0 3.0 2058 1878 A 80 TYR HD% A 81 GLU HBy 1.0 0.0 5.0 2059 1879 A 65 ILE HD1% A 113 MET HE% 1.0 0.0 3.0 2060 1880 A 79 THR HG2% A 113 MET HE% 1.0 0.0 3.0 2061 1881 A 113 MET HE% A 116 ALA HB% 1.0 0.0 5.0 2062 1882 A 83 MET HE1 A 118 THR HG2% 1.0 0.0 4.0 2063 1883 A 83 MET HE1 A 117 ALA HB% 1.0 0.0 3.0 2064 1884 A 82 LYS HA A 117 ALA HB% 1.0 0.0 3.0 2065 1885 A 83 MET HGy A 117 ALA HB% 1.0 0.0 3.0 2066 1886 A 116 ALA HB% A 111 GLN HGy 1.0 0.0 5.0 2067 1887 A 116 ALA HB% A 111 GLN HGx 1.0 0.0 5.0 2068 1888 A 79 THR HG2% A 111 GLN HGx 1.0 0.0 4.0 2069 1889 A 79 THR HG2% A 111 GLN HGy 1.0 0.0 4.0 2070 1890 A 65 ILE HD1% A 111 GLN HGy 1.0 0.0 6.0 2071 1891 A 117 ALA HB% A 114 LEU HDx% 1.0 0.0 5.0 2072 1892 A 83 MET HE1 A 114 LEU HDx% 1.0 0.0 4.0 2073 1893 A 117 ALA HB% A 118 THR HB 1.0 0.0 6.0 2074 1894 A 117 ALA HB% A 118 THR HA 1.0 0.0 4.0 2075 1895 A 111 GLN HGy A 114 LEU HBy 1.0 0.0 5.0 2076 1896 A 111 GLN HGy A 114 LEU HBx 1.0 0.0 5.0 2077 1897 A 112 PRO HA A 115 ASP HA 1.0 0.0 6.0 2078 1898 A 112 PRO HA A 113 MET HE% 1.0 0.0 5.0 2079 1899 A 113 MET HE% A 112 PRO HDy 1.0 0.0 5.0 2080 1900 A 115 ASP HA A 116 ALA HA 1.0 0.0 5.0 2081 1901 A 65 ILE HD1% A 116 ALA HA 1.0 0.0 5.0 2082 1902 A 118 THR H A 117 ALA HA 1.0 0.0 4.0 2083 1903 A 117 ALA HB% A 118 THR H 1.0 0.0 5.0 2084 1904 A 116 ALA H A 115 ASP H 1.0 0.0 4.0 2085 1905 A 40 ASN HA A 116 ALA H 1.0 0.0 5.0 2086 1906 A 40 ASN HA A 116 ALA HB% 1.0 0.0 6.0 2087 1907 A 115 ASP HA A 116 ALA H 1.0 0.0 3.0 2088 1908 A 115 ASP H A 114 LEU HA 1.0 0.0 3.0 2089 1909 A 114 LEU HBy A 115 ASP H 1.0 0.0 4.0 2090 1910 A 115 ASP H A 114 LEU H 1.0 0.0 4.0 2091 1911 A 115 ASP HA A 117 ALA H 1.0 0.0 5.0 2092 1912 A 116 ALA HB% A 117 ALA HA 1.0 0.0 4.0 2093 1913 A 117 ALA HB% A 116 ALA HA 1.0 0.0 4.0 2094 1914 A 79 THR HG2% A 111 GLN HBy 1.0 0.0 4.0 2095 1915 A 79 THR HG2% A 111 GLN HBx 1.0 0.0 4.0 2096 1916 A 39 GLY H A 38 LYS HA 1.0 0.0 3.0 2097 1917 A 39 GLY H A 38 LYS HBy 1.0 0.0 3.0 2098 1918 A 39 GLY H A 38 LYS HBx 1.0 0.0 3.0 2099 1919 A 112 PRO HA A 115 ASP H 1.0 0.0 3.0 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 56 GLY H A 52 THR O 1.0 0.0 2.3 2 2 A 52 THR O A 56 GLY N 1.0 0.0 3.3 3 3 A 57 ALA H A 53 LEU O 1.0 0.0 2.3 4 4 A 53 LEU O A 57 ALA N 1.0 0.0 3.3 5 5 A 58 PHE H A 54 LEU O 1.0 0.0 2.3 6 6 A 54 LEU O A 58 PHE N 1.0 0.0 3.3 7 7 A 59 SER H A 55 ARG O 1.0 0.0 2.3 8 8 A 55 ARG O A 59 SER N 1.0 0.0 3.3 9 9 A 87 ASP H A 83 MET O 1.0 0.0 2.3 10 10 A 83 MET O A 87 ASP N 1.0 0.0 3.3 11 11 A 88 GLN H A 84 GLU O 1.0 0.0 2.3 12 12 A 84 GLU O A 88 GLN N 1.0 0.0 3.3 13 13 A 89 ALA H A 85 SER O 1.0 0.0 2.3 14 14 A 85 SER O A 89 ALA N 1.0 0.0 3.3 15 15 A 90 VAL H A 86 ALA O 1.0 0.0 2.3 16 16 A 86 ALA O A 90 VAL N 1.0 0.0 3.3 17 17 A 91 ALA H A 87 ASP O 1.0 0.0 2.3 18 18 A 87 ASP O A 91 ALA N 1.0 0.0 3.3 19 19 A 92 GLU H A 88 GLN O 1.0 0.0 2.3 20 20 A 88 GLN O A 92 GLU N 1.0 0.0 3.3 21 21 A 44 VAL H A 76 ALA O 1.0 0.0 2.3 22 22 A 76 ALA O A 44 VAL N 1.0 0.0 3.3 23 23 A 76 ALA H A 44 VAL O 1.0 0.0 2.3 24 24 A 44 VAL O A 76 ALA N 1.0 0.0 3.3 25 25 A 42 LEU H A 78 VAL O 1.0 0.0 2.3 26 26 A 78 VAL O A 42 LEU N 1.0 0.0 3.3 27 27 A 78 VAL H A 42 LEU O 1.0 0.0 2.3 28 28 A 42 LEU O A 78 VAL N 1.0 0.0 3.3 29 29 A 40 ASN H A 80 TYR O 1.0 0.0 2.3 30 30 A 80 TYR O A 40 ASN N 1.0 0.0 3.3 31 31 A 80 TYR H A 40 ASN O 1.0 0.0 2.3 32 32 A 40 ASN O A 80 TYR N 1.0 0.0 3.3 33 33 A 103 LEU H A 96 THR O 1.0 0.0 2.3 34 34 A 96 THR O A 103 LEU N 1.0 0.0 3.3 35 35 A 68 SER H A 77 PHE O 1.0 0.0 2.3 36 36 A 77 PHE O A 68 SER N 1.0 0.0 3.3 37 37 A 77 PHE H A 68 SER O 1.0 0.0 2.3 38 38 A 68 SER O A 77 PHE N 1.0 0.0 3.3 39 39 A 75 CYS H A 70 ASP O 1.0 0.0 2.3 40 40 A 70 ASP O A 75 CYS N 1.0 0.0 3.3 41 41 A 43 TYR H A 106 ASN O 1.0 0.0 2.3 42 42 A 106 ASN O A 43 TYR N 1.0 0.0 3.3 43 43 A 106 ASN H A 43 TYR O 1.0 0.0 2.3 44 44 A 43 TYR O A 106 ASN N 1.0 0.0 3.3 45 45 A 45 TYR H A 104 LYS O 1.0 0.0 2.3 46 46 A 104 LYS O A 45 TYR N 1.0 0.0 3.3 47 47 A 104 LYS H A 45 TYR O 1.0 0.0 2.3 48 48 A 45 TYR O A 104 LYS N 1.0 0.0 3.3 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 41 THR C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -160.0 -80.0 PHI 2 2 A 42 LEU C A 43 TYR N A 43 TYR CA A 43 TYR C 1.0 -160.0 -80.0 PHI 3 3 A 43 TYR C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -160.0 -80.0 PHI 4 4 A 44 VAL C A 45 TYR N A 45 TYR CA A 45 TYR C 1.0 -160.0 -80.0 PHI 5 5 A 51 PRO C A 52 THR N A 52 THR CA A 52 THR C 1.0 -80.0 -40.0 PHI 6 6 A 52 THR C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -80.0 -40.0 PHI 7 7 A 53 LEU C A 54 LEU N A 54 LEU CA A 54 LEU C 1.0 -80.0 -40.0 PHI 8 8 A 54 LEU C A 55 ARG N A 55 ARG CA A 55 ARG C 1.0 -80.0 -40.0 PHI 9 9 A 56 GLY C A 57 ALA N A 57 ALA CA A 57 ALA C 1.0 -80.0 -40.0 PHI 10 10 A 58 PHE C A 59 SER N A 59 SER CA A 59 SER C 1.0 -80.0 -40.0 PHI 11 11 A 67 LEU C A 68 SER N A 68 SER CA A 68 SER C 1.0 -160.0 -80.0 PHI 12 12 A 68 SER C A 69 MET N A 69 MET CA A 69 MET C 1.0 -160.0 -80.0 PHI 13 13 A 69 MET C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -160.0 -80.0 PHI 14 14 A 74 ASN C A 75 CYS N A 75 CYS CA A 75 CYS C 1.0 -160.0 -80.0 PHI 15 15 A 76 ALA C A 77 PHE N A 77 PHE CA A 77 PHE C 1.0 -160.0 -80.0 PHI 16 16 A 78 VAL C A 79 THR N A 79 THR CA A 79 THR C 1.0 -160.0 -80.0 PHI 17 17 A 79 THR C A 80 TYR N A 80 TYR CA A 80 TYR C 1.0 -160.0 -80.0 PHI 18 18 A 82 LYS C A 83 MET N A 83 MET CA A 83 MET C 1.0 -80.0 -40.0 PHI 19 19 A 83 MET C A 84 GLU N A 84 GLU CA A 84 GLU C 1.0 -80.0 -40.0 PHI 20 20 A 84 GLU C A 85 SER N A 85 SER CA A 85 SER C 1.0 -80.0 -40.0 PHI 21 21 A 85 SER C A 86 ALA N A 86 ALA CA A 86 ALA C 1.0 -80.0 -40.0 PHI 22 22 A 86 ALA C A 87 ASP N A 87 ASP CA A 87 ASP C 1.0 -80.0 -40.0 PHI 23 23 A 87 ASP C A 88 GLN N A 88 GLN CA A 88 GLN C 1.0 -80.0 -40.0 PHI 24 24 A 88 GLN C A 89 ALA N A 89 ALA CA A 89 ALA C 1.0 -80.0 -40.0 PHI 25 25 A 89 ALA C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -80.0 -40.0 PHI 26 26 A 90 VAL C A 91 ALA N A 91 ALA CA A 91 ALA C 1.0 -80.0 -40.0 PHI 27 27 A 95 GLY C A 96 THR N A 96 THR CA A 96 THR C 1.0 -160.0 -80.0 PHI 28 28 A 96 THR C A 97 GLN N A 97 GLN CA A 97 GLN C 1.0 -160.0 -80.0 PHI 29 29 A 97 GLN C A 98 VAL N A 98 VAL CA A 98 VAL C 1.0 -160.0 -80.0 PHI 30 30 A 100 SER C A 101 VAL N A 101 VAL CA A 101 VAL C 1.0 -160.0 -80.0 PHI 31 31 A 102 GLN C A 103 LEU N A 103 LEU CA A 103 LEU C 1.0 -160.0 -80.0 PHI 32 32 A 103 LEU C A 104 LYS N A 104 LYS CA A 104 LYS C 1.0 -160.0 -80.0 PHI stop_ save_