data_nef_c16002_2k9u 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 GLY start . false 2 A 2 ILE middle . . 3 A 3 PRO middle . false 4 A 4 GLU middle . . 5 A 5 PHE middle . . 6 A 6 PHE middle . . 7 A 7 GLN middle . . 8 A 8 PHE middle . . 9 A 9 THR middle . . 10 A 10 VAL middle . . 11 A 11 GLY middle . false 12 A 12 PRO middle . false 13 A 13 LEU middle . . 14 A 14 GLY middle . false 15 A 15 GLU middle . . 16 A 16 GLY middle . false 17 A 17 GLY middle . false 18 A 18 ALA middle . . 19 A 19 HIS middle . . 20 A 20 LYS middle . . 21 A 21 VAL middle . . 22 A 22 ARG middle . . 23 A 23 ALA middle . . 24 A 24 GLY middle . false 25 A 25 GLY middle . false 26 A 26 THR middle . . 27 A 27 GLY middle . false 28 A 28 LEU middle . . 29 A 29 GLU middle . . 30 A 30 ARG middle . . 31 A 31 GLY middle . false 32 A 32 VAL middle . . 33 A 33 ALA middle . . 34 A 34 GLY middle . false 35 A 35 VAL middle . . 36 A 36 PRO middle . false 37 A 37 ALA middle . . 38 A 38 GLU middle . . 39 A 39 PHE middle . . 40 A 40 SER middle . . 41 A 41 ILE middle . . 42 A 42 TRP middle . . 43 A 43 THR middle . . 44 A 44 ARG middle . . 45 A 45 GLU middle . . 46 A 46 ALA middle . . 47 A 47 GLY middle . false 48 A 48 ALA middle . . 49 A 49 GLY middle . false 50 A 50 GLY middle . false 51 A 51 LEU middle . . 52 A 52 SER middle . . 53 A 53 ILE middle . . 54 A 54 ALA middle . . 55 A 55 VAL middle . . 56 A 56 GLU middle . . 57 A 57 GLY middle . false 58 A 58 PRO middle . false 59 A 59 SER middle . . 60 A 60 LYS middle . . 61 A 61 ALA middle . . 62 A 62 GLU middle . . 63 A 63 ILE middle . . 64 A 64 ALA middle . . 65 A 65 PHE middle . . 66 A 66 GLU middle . . 67 A 67 ASP middle . . 68 A 68 ARG middle . . 69 A 69 LYS middle . . 70 A 70 ASP middle . . 71 A 71 GLY middle . false 72 A 72 SER middle . . 73 A 73 CYS middle . . 74 A 74 GLY middle . false 75 A 75 VAL middle . . 76 A 76 SER middle . . 77 A 77 TYR middle . . 78 A 78 VAL middle . . 79 A 79 VAL middle . . 80 A 80 GLN middle . . 81 A 81 GLU middle . . 82 A 82 PRO middle . false 83 A 83 GLY middle . false 84 A 84 ASP middle . . 85 A 85 TYR middle . . 86 A 86 GLU middle . . 87 A 87 VAL middle . . 88 A 88 SER middle . . 89 A 89 ILE middle . . 90 A 90 LYS middle . . 91 A 91 PHE middle . . 92 A 92 ASN middle . . 93 A 93 ASP middle . . 94 A 94 GLU middle . . 95 A 95 HIS middle . . 96 A 96 ILE middle . . 97 A 97 PRO middle . false 98 A 98 ASP middle . . 99 A 99 SER middle . . 100 A 100 PRO middle . true 101 A 101 PHE middle . . 102 A 102 VAL middle . . 103 A 103 VAL middle . . 104 A 104 PRO middle . false 105 A 105 VAL middle . . 106 A 106 ALA middle . . 107 A 107 SER middle . . 108 A 108 LEU middle . . 109 A 109 SER middle . . 110 A 110 ASP middle . . 111 A 111 ASP middle . . 112 A 112 ALA middle . . 113 A 113 ARG middle . . 114 A 114 ARG middle . . 115 A 115 LEU middle . . 116 A 116 THR middle . . 117 A 117 VAL middle . . 118 A 118 THR middle . . 119 A 119 SER end . . 120 B 1 MET start . . 121 B 2 ALA middle . . 122 B 3 SER middle . . 123 B 4 LYS middle . . 124 B 5 PRO middle . false 125 B 6 GLU middle . . 126 B 7 LYS middle . . 127 B 8 ARG middle . . 128 B 9 VAL middle . . 129 B 10 ALA middle . . 130 B 11 SER middle . . 131 B 12 SER middle . . 132 B 13 VAL middle . . 133 B 14 PHE middle . . 134 B 15 ILE middle . . 135 B 16 THR middle . . 136 B 17 LEU middle . . 137 B 18 ALA middle . . 138 B 19 PRO middle . false 139 B 20 PRO middle . false 140 B 21 ARG middle . . 141 B 22 ARG middle . . 142 B 23 ASP middle . . 143 B 24 VAL end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAy H 1 4.4000 . A 1 GLY HAx H 1 3.7800 . A 1 GLY CA C 13 42.5800 . A 2 ILE H H 1 8.8000 . A 2 ILE N N 15 126.6300 . A 3 PRO HA H 1 4.3600 . A 3 PRO HBx H 1 1.8800 . A 3 PRO HBy H 1 2.2100 . A 3 PRO HDx H 1 3.5500 . A 3 PRO HDy H 1 3.5500 . A 3 PRO HGx H 1 1.9500 . A 3 PRO HGy H 1 1.9500 . A 3 PRO CA C 13 60.6700 . A 3 PRO CB C 13 29.3900 . A 3 PRO CD C 13 47.1800 . A 3 PRO CG C 13 24.4900 . A 4 GLU H H 1 8.2700 . A 4 GLU HA H 1 4.3600 . A 4 GLU HBx H 1 1.8700 . A 4 GLU HBy H 1 2.2200 . A 4 GLU HGx H 1 2.2300 . A 4 GLU HGy H 1 2.2300 . A 4 GLU CA C 13 53.6900 . A 4 GLU CB C 13 29.4300 . A 4 GLU CG C 13 33.5900 . A 4 GLU N N 15 119.2900 . A 5 PHE H H 1 8.8100 . A 5 PHE N N 15 126.6000 . A 6 PHE H H 1 8.0700 . A 6 PHE HA H 1 4.6500 . A 6 PHE HBx H 1 2.9200 . A 6 PHE HBy H 1 3.0800 . A 6 PHE CA C 13 54.9200 . A 6 PHE CB C 13 37.1900 . A 6 PHE N N 15 120.3800 . A 7 GLN H H 1 7.9800 . A 7 GLN HA H 1 4.4300 . A 7 GLN HBx H 1 1.7900 . A 7 GLN HBy H 1 1.7900 . A 7 GLN HGx H 1 2.0900 . A 7 GLN HGy H 1 2.0900 . A 7 GLN CA C 13 54.8600 . A 7 GLN CB C 13 26.5700 . A 7 GLN CG C 13 30.9600 . A 7 GLN N N 15 119.9300 . A 8 PHE H H 1 8.0300 . A 8 PHE HA H 1 4.6300 . A 8 PHE HBx H 1 3.0900 . A 8 PHE HBy H 1 3.0900 . A 8 PHE CA C 13 55.0200 . A 8 PHE CB C 13 36.8400 . A 8 PHE N N 15 119.5600 . A 9 THR H H 1 8.0400 . A 9 THR HA H 1 4.3000 . A 9 THR HB H 1 4.0700 . A 9 THR HG2% H 1 1.1400 . A 9 THR CA C 13 59.4100 . A 9 THR CB C 13 67.4400 . A 9 THR CG2 C 13 18.7000 . A 9 THR N N 15 114.6500 . A 10 VAL H H 1 8.0700 . A 10 VAL HA H 1 4.2100 . A 10 VAL HB H 1 2.0800 . A 10 VAL HGx% H 1 0.9100 . A 10 VAL HGy% H 1 0.9100 . A 10 VAL CA C 13 59.4700 . A 10 VAL CB C 13 30.1800 . A 10 VAL CGx C 13 17.8600 . A 10 VAL N N 15 120.3800 . A 11 GLY H H 1 8.2000 . A 11 GLY HAy H 1 4.0900 . A 11 GLY HAx H 1 4.0000 . A 11 GLY CA C 13 41.4200 . A 11 GLY N N 15 110.9100 . A 12 PRO HA H 1 4.3600 . A 12 PRO HBx H 1 2.2300 . A 12 PRO HBy H 1 2.2300 . A 12 PRO HDx H 1 3.5700 . A 12 PRO HDy H 1 3.5700 . A 12 PRO HGy H 1 2.2200 . A 12 PRO HGx H 1 1.8800 . A 12 PRO CA C 13 60.5900 . A 12 PRO CB C 13 33.6000 . A 12 PRO CD C 13 47.2600 . A 12 PRO CG C 13 29.4400 . A 13 LEU H H 1 8.3600 . A 13 LEU HA H 1 4.3400 . A 13 LEU HBx H 1 1.6000 . A 13 LEU HBy H 1 1.6000 . A 13 LEU HDx% H 1 0.8900 . A 13 LEU HDy% H 1 0.8200 . A 13 LEU HG H 1 1.6300 . A 13 LEU CA C 13 52.8000 . A 13 LEU CB C 13 39.6500 . A 13 LEU CDy C 13 24.4600 . A 13 LEU CDx C 13 20.4700 . A 13 LEU CG C 13 29.3400 . A 13 LEU N N 15 120.3900 . A 14 GLY H H 1 8.2400 . A 14 GLY HAy H 1 3.9600 . A 14 GLY HAx H 1 3.6600 . A 14 GLY CA C 13 40.2400 . A 14 GLY N N 15 107.8600 . A 15 GLU H H 1 8.2500 . A 15 GLU HA H 1 4.3600 . A 15 GLU HBx H 1 2.0800 . A 15 GLU HBy H 1 2.3000 . A 15 GLU HGx H 1 2.2300 . A 15 GLU HGy H 1 2.2300 . A 15 GLU CA C 13 53.9200 . A 15 GLU CB C 13 27.8000 . A 15 GLU CG C 13 33.5900 . A 15 GLU N N 15 118.8000 . A 16 GLY H H 1 8.4600 . A 16 GLY HAy H 1 3.9600 . A 16 GLY HAx H 1 3.8800 . A 16 GLY CA C 13 42.4900 . A 16 GLY N N 15 108.1900 . A 17 GLY H H 1 8.3000 . A 17 GLY HAy H 1 4.4300 . A 17 GLY HAx H 1 3.7800 . A 17 GLY CA C 13 42.5500 . A 17 GLY N N 15 105.7900 . A 18 ALA H H 1 8.8000 . A 18 ALA HA H 1 3.7600 . A 18 ALA HB% H 1 1.6200 . A 18 ALA CA C 13 52.7800 . A 18 ALA CB C 13 16.8100 . A 18 ALA N N 15 120.7700 . A 19 HIS H H 1 8.2300 . A 19 HIS HA H 1 4.4100 . A 19 HIS HBy H 1 3.2100 . A 19 HIS HBx H 1 3.1100 . A 19 HIS CA C 13 54.7400 . A 19 HIS CB C 13 26.2400 . A 19 HIS N N 15 109.4900 . A 20 LYS H H 1 7.5700 . A 20 LYS HA H 1 4.1700 . A 20 LYS HBx H 1 1.3600 . A 20 LYS HBy H 1 1.3600 . A 20 LYS HDx H 1 1.4000 . A 20 LYS HDy H 1 1.5000 . A 20 LYS HEx H 1 2.8800 . A 20 LYS HEy H 1 2.8800 . A 20 LYS HGx H 1 0.8100 . A 20 LYS HGy H 1 1.0100 . A 20 LYS CA C 13 52.1000 . A 20 LYS CB C 13 29.8500 . A 20 LYS CD C 13 25.4700 . A 20 LYS CE C 13 39.6800 . A 20 LYS CG C 13 21.5100 . A 20 LYS N N 15 115.9200 . A 21 VAL H H 1 7.4600 . A 21 VAL HA H 1 4.2700 . A 21 VAL HB H 1 2.1500 . A 21 VAL HGx% H 1 0.9000 . A 21 VAL HGy% H 1 0.9000 . A 21 VAL CA C 13 60.7300 . A 21 VAL CB C 13 29.3400 . A 21 VAL CGx C 13 18.0300 . A 21 VAL CGy C 13 18.0300 . A 21 VAL N N 15 122.0300 . A 22 ARG H H 1 7.8400 . A 22 ARG HA H 1 5.1000 . A 22 ARG HBy H 1 1.9200 . A 22 ARG HBx H 1 1.8200 . A 22 ARG HDy H 1 3.1800 . A 22 ARG HDx H 1 3.1200 . A 22 ARG HGy H 1 1.6200 . A 22 ARG HGx H 1 1.5700 . A 22 ARG CA C 13 51.2300 . A 22 ARG CB C 13 31.9300 . A 22 ARG CD C 13 40.1400 . A 22 ARG CG C 13 24.4600 . A 22 ARG N N 15 121.5200 . A 23 ALA H H 1 8.9200 . A 23 ALA HA H 1 5.5800 . A 23 ALA HB% H 1 1.2000 . A 23 ALA CA C 13 47.8100 . A 23 ALA CB C 13 21.6600 . A 23 ALA N N 15 123.3000 . A 24 GLY H H 1 8.4500 . A 24 GLY HAy H 1 4.2000 . A 24 GLY HAx H 1 4.1600 . A 24 GLY CA C 13 43.5600 . A 24 GLY N N 15 104.2200 . A 25 GLY H H 1 8.7700 . A 25 GLY HAy H 1 4.8800 . A 25 GLY HAx H 1 4.0500 . A 25 GLY CA C 13 42.1100 . A 25 GLY N N 15 109.5900 . A 26 THR H H 1 8.6200 . A 26 THR HA H 1 4.0300 . A 26 THR HB H 1 4.3600 . A 26 THR HG2% H 1 1.4000 . A 26 THR CA C 13 63.2800 . A 26 THR CB C 13 65.9900 . A 26 THR CG2 C 13 19.7800 . A 26 THR N N 15 113.0500 . A 27 GLY H H 1 9.0400 . A 27 GLY HAy H 1 4.2700 . A 27 GLY HAx H 1 3.3900 . A 27 GLY CA C 13 44.2500 . A 27 GLY N N 15 105.1900 . A 28 LEU H H 1 7.4500 . A 28 LEU HA H 1 4.2100 . A 28 LEU HBy H 1 1.1900 . A 28 LEU HBx H 1 1.0400 . A 28 LEU HDx% H 1 -0.7800 . A 28 LEU HDy% H 1 -0.5100 . A 28 LEU HG H 1 0.2400 . A 28 LEU CA C 13 51.1500 . A 28 LEU CB C 13 37.6700 . A 28 LEU CDx C 13 17.3100 . A 28 LEU CDy C 13 21.1700 . A 28 LEU CG C 13 22.9800 . A 28 LEU N N 15 114.9800 . A 29 GLU H H 1 7.9800 . A 29 GLU HA H 1 4.5400 . A 29 GLU HBx H 1 1.8600 . A 29 GLU HBy H 1 1.8600 . A 29 GLU HGx H 1 2.1800 . A 29 GLU HGy H 1 2.3600 . A 29 GLU CA C 13 54.9100 . A 29 GLU CB C 13 29.4300 . A 29 GLU CG C 13 33.1800 . A 29 GLU N N 15 117.8100 . A 30 ARG H H 1 8.3400 . A 30 ARG HA H 1 4.7200 . A 30 ARG HBx H 1 2.1200 . A 30 ARG HBy H 1 2.1200 . A 30 ARG HDx H 1 3.1700 . A 30 ARG HDy H 1 3.1700 . A 30 ARG HGy H 1 1.5900 . A 30 ARG HGx H 1 1.4200 . A 30 ARG CA C 13 53.3500 . A 30 ARG CB C 13 29.4400 . A 30 ARG CD C 13 40.6400 . A 30 ARG CG C 13 23.3900 . A 30 ARG N N 15 112.8900 . A 31 GLY H H 1 8.1000 . A 31 GLY HAy H 1 4.5400 . A 31 GLY HAx H 1 3.6100 . A 31 GLY CA C 13 41.6300 . A 31 GLY N N 15 103.6700 . A 32 VAL H H 1 9.4100 . A 32 VAL HA H 1 4.4500 . A 32 VAL HB H 1 1.6000 . A 32 VAL HGx% H 1 0.8100 . A 32 VAL HGy% H 1 0.8800 . A 32 VAL CA C 13 58.7300 . A 32 VAL CB C 13 32.5600 . A 32 VAL CGy C 13 19.1800 . A 32 VAL CGx C 13 17.9400 . A 32 VAL N N 15 122.1600 . A 33 ALA H H 1 8.5600 . A 33 ALA HA H 1 3.6200 . A 33 ALA HB% H 1 1.0000 . A 33 ALA CA C 13 50.8600 . A 33 ALA CB C 13 14.4500 . A 33 ALA N N 15 129.4900 . A 34 GLY H H 1 8.5900 . A 34 GLY HAy H 1 4.3200 . A 34 GLY HAx H 1 3.4200 . A 34 GLY CA C 13 42.7100 . A 34 GLY N N 15 106.9000 . A 35 VAL H H 1 7.8400 . A 35 VAL HA H 1 4.4500 . A 35 VAL HB H 1 1.9800 . A 35 VAL HGx% H 1 0.8800 . A 35 VAL HGy% H 1 0.7400 . A 35 VAL CA C 13 56.6600 . A 35 VAL CB C 13 32.0300 . A 35 VAL CGy C 13 17.9400 . A 35 VAL CGx C 13 17.1100 . A 35 VAL N N 15 121.5200 . A 36 PRO HA H 1 4.2600 . A 36 PRO HBx H 1 1.9500 . A 36 PRO HBy H 1 1.9500 . A 36 PRO HDx H 1 3.8200 . A 36 PRO HDy H 1 3.8200 . A 36 PRO HGx H 1 1.9300 . A 36 PRO HGy H 1 1.9300 . A 36 PRO CA C 13 60.7200 . A 36 PRO CB C 13 28.7600 . A 36 PRO CD C 13 48.9100 . A 36 PRO CG C 13 24.7200 . A 37 ALA H H 1 8.9200 . A 37 ALA HA H 1 4.4900 . A 37 ALA HB% H 1 0.7400 . A 37 ALA CA C 13 47.5500 . A 37 ALA CB C 13 17.1100 . A 37 ALA N N 15 129.1600 . A 38 GLU H H 1 8.4700 . A 38 GLU HA H 1 4.3300 . A 38 GLU HBx H 1 2.0100 . A 38 GLU HBy H 1 2.0100 . A 38 GLU HGy H 1 2.0100 . A 38 GLU HGx H 1 1.8200 . A 38 GLU CA C 13 52.1500 . A 38 GLU CB C 13 31.0100 . A 38 GLU CG C 13 33.0400 . A 38 GLU N N 15 117.1500 . A 39 PHE H H 1 8.8700 . A 39 PHE HA H 1 4.5200 . A 39 PHE HBx H 1 2.9300 . A 39 PHE HBy H 1 2.9300 . A 39 PHE CA C 13 54.6700 . A 39 PHE CB C 13 37.1700 . A 39 PHE N N 15 115.7400 . A 40 SER H H 1 8.8700 . A 40 SER HA H 1 5.4200 . A 40 SER HBx H 1 2.9500 . A 40 SER HBy H 1 2.9500 . A 40 SER CA C 13 54.8900 . A 40 SER CB C 13 63.7900 . A 40 SER N N 15 113.1400 . A 41 ILE H H 1 8.4100 . A 41 ILE HA H 1 4.6700 . A 41 ILE HB H 1 1.5200 . A 41 ILE HD1% H 1 0.8500 . A 41 ILE HG1x H 1 0.9000 . A 41 ILE HG1y H 1 0.9500 . A 41 ILE HG2% H 1 0.7500 . A 41 ILE CA C 13 57.6400 . A 41 ILE CB C 13 38.2600 . A 41 ILE CD1 C 13 14.0500 . A 41 ILE CG1 C 13 25.0000 . A 41 ILE CG2 C 13 16.1400 . A 41 ILE N N 15 118.0200 . A 42 TRP H H 1 9.5800 . A 42 TRP HA H 1 4.8700 . A 42 TRP HBy H 1 3.3400 . A 42 TRP HBx H 1 3.1200 . A 42 TRP CA C 13 56.2400 . A 42 TRP CB C 13 27.6900 . A 42 TRP N N 15 126.4300 . A 43 THR H H 1 8.3700 . A 43 THR HA H 1 3.8000 . A 43 THR HB H 1 4.0600 . A 43 THR HG2% H 1 1.0900 . A 43 THR CA C 13 59.2100 . A 43 THR CB C 13 67.0700 . A 43 THR CG2 C 13 18.4700 . A 43 THR N N 15 112.4600 . A 44 ARG HA H 1 3.9100 . A 44 ARG HBx H 1 1.8200 . A 44 ARG HBy H 1 1.8200 . A 44 ARG HDx H 1 3.2000 . A 44 ARG HDy H 1 3.2000 . A 44 ARG HGx H 1 1.6000 . A 44 ARG HGy H 1 1.6000 . A 44 ARG CA C 13 57.1900 . A 44 ARG CB C 13 27.7100 . A 44 ARG CD C 13 40.7200 . A 44 ARG CG C 13 24.4600 . A 45 GLU H H 1 8.2600 . A 45 GLU HA H 1 4.1600 . A 45 GLU HBx H 1 1.8100 . A 45 GLU HBy H 1 1.8100 . A 45 GLU HGx H 1 2.2400 . A 45 GLU HGy H 1 2.2400 . A 45 GLU CA C 13 54.5100 . A 45 GLU CB C 13 27.5100 . A 45 GLU CG C 13 34.7500 . A 45 GLU N N 15 113.0800 . A 46 ALA H H 1 7.5500 . A 46 ALA HA H 1 3.8700 . A 46 ALA HB% H 1 0.6100 . A 46 ALA CA C 13 50.3500 . A 46 ALA CB C 13 18.1200 . A 46 ALA N N 15 119.5600 . A 47 GLY H H 1 7.4500 . A 47 GLY HAy H 1 4.1800 . A 47 GLY HAx H 1 3.6300 . A 47 GLY CA C 13 41.9400 . A 47 GLY N N 15 102.8700 . A 48 ALA H H 1 8.2200 . A 48 ALA HA H 1 4.2900 . A 48 ALA HB% H 1 1.3400 . A 48 ALA CA C 13 49.3600 . A 48 ALA CB C 13 16.5900 . A 48 ALA N N 15 120.3900 . A 49 GLY H H 1 8.0000 . A 49 GLY HAx H 1 3.7200 . A 49 GLY HAy H 1 3.7200 . A 49 GLY CA C 13 43.0000 . A 49 GLY N N 15 106.7200 . A 50 GLY H H 1 7.5800 . A 50 GLY N N 15 104.7800 . A 51 LEU HA H 1 5.3000 . A 51 LEU HBx H 1 1.4100 . A 51 LEU HBy H 1 1.4100 . A 51 LEU HDx% H 1 0.8200 . A 51 LEU HG H 1 1.4700 . A 51 LEU CA C 13 50.2700 . A 51 LEU CB C 13 42.9300 . A 51 LEU CDx C 13 22.8600 . A 51 LEU CG C 13 24.3700 . A 52 SER H H 1 9.1100 . A 52 SER HA H 1 5.1800 . A 52 SER HBx H 1 3.6600 . A 52 SER HBy H 1 3.6600 . A 52 SER CA C 13 53.7000 . A 52 SER CB C 13 63.0000 . A 52 SER N N 15 117.2100 . A 53 ILE H H 1 8.3300 . A 53 ILE HA H 1 4.9300 . A 53 ILE HB H 1 1.6200 . A 53 ILE HD1% H 1 0.6500 . A 53 ILE HG1y H 1 1.3900 . A 53 ILE HG1x H 1 1.0000 . A 53 ILE HG2% H 1 0.7400 . A 53 ILE CA C 13 57.2200 . A 53 ILE CB C 13 37.7100 . A 53 ILE CD1 C 13 13.3700 . A 53 ILE CG1 C 13 25.4100 . A 53 ILE CG2 C 13 14.7600 . A 53 ILE N N 15 124.0300 . A 54 ALA H H 1 8.9200 . A 54 ALA HA H 1 5.3900 . A 54 ALA HB% H 1 1.2800 . A 54 ALA CA C 13 47.4400 . A 54 ALA CB C 13 19.8100 . A 54 ALA N N 15 126.5300 . A 55 VAL H H 1 9.0100 . A 55 VAL HA H 1 4.8300 . A 55 VAL HB H 1 1.7000 . A 55 VAL HGx% H 1 0.3300 . A 55 VAL HGy% H 1 0.3300 . A 55 VAL CA C 13 58.4300 . A 55 VAL CB C 13 31.0200 . A 55 VAL CGx C 13 16.6400 . A 55 VAL CGy C 13 16.6400 . A 55 VAL N N 15 119.5900 . A 56 GLU H H 1 9.2700 . A 56 GLU HA H 1 4.6900 . A 56 GLU HBx H 1 2.2100 . A 56 GLU HBy H 1 2.2100 . A 56 GLU HGy H 1 2.3600 . A 56 GLU HGx H 1 2.2300 . A 56 GLU CA C 13 52.0000 . A 56 GLU CB C 13 31.0500 . A 56 GLU CG C 13 33.5900 . A 56 GLU N N 15 127.3600 . A 57 GLY H H 1 8.6200 . A 57 GLY N N 15 108.5400 . A 58 PRO HA H 1 4.4800 . A 58 PRO HBx H 1 1.9300 . A 58 PRO HBy H 1 2.2800 . A 58 PRO HDx H 1 2.9200 . A 58 PRO HDy H 1 2.9200 . A 58 PRO HGx H 1 1.8900 . A 58 PRO HGy H 1 1.8900 . A 58 PRO CA C 13 61.8500 . A 58 PRO CB C 13 29.8200 . A 58 PRO CD C 13 46.9000 . A 58 PRO CG C 13 23.8100 . A 59 SER H H 1 7.2000 . A 59 SER HA H 1 4.6200 . A 59 SER HBx H 1 4.0100 . A 59 SER HBy H 1 4.0100 . A 59 SER CA C 13 55.0500 . A 59 SER CB C 13 63.6500 . A 59 SER N N 15 106.9700 . A 60 LYS H H 1 8.5700 . A 60 LYS HA H 1 4.0000 . A 60 LYS HBx H 1 1.8500 . A 60 LYS HBy H 1 1.8500 . A 60 LYS HDx H 1 1.6800 . A 60 LYS HDy H 1 1.6800 . A 60 LYS HEx H 1 3.0300 . A 60 LYS HEy H 1 3.0300 . A 60 LYS HGx H 1 1.3400 . A 60 LYS HGy H 1 1.3400 . A 60 LYS CA C 13 54.0900 . A 60 LYS CB C 13 30.4800 . A 60 LYS CD C 13 26.5200 . A 60 LYS CE C 13 39.3500 . A 60 LYS CG C 13 22.2600 . A 60 LYS N N 15 118.8900 . A 61 ALA H H 1 8.8300 . A 61 ALA HA H 1 4.9300 . A 61 ALA HB% H 1 1.1100 . A 61 ALA CA C 13 47.9800 . A 61 ALA CB C 13 17.5000 . A 61 ALA N N 15 127.1300 . A 62 GLU H H 1 8.4400 . A 62 GLU HA H 1 4.6100 . A 62 GLU HBx H 1 1.8600 . A 62 GLU HBy H 1 1.8600 . A 62 GLU HGx H 1 2.1900 . A 62 GLU HGy H 1 2.1900 . A 62 GLU CA C 13 52.8000 . A 62 GLU CB C 13 27.6200 . A 62 GLU CG C 13 32.9700 . A 62 GLU N N 15 121.9800 . A 63 ILE H H 1 8.7100 . A 63 ILE HA H 1 4.7100 . A 63 ILE HB H 1 1.5500 . A 63 ILE HD1% H 1 0.6400 . A 63 ILE HG1x H 1 1.4400 . A 63 ILE HG1y H 1 1.4400 . A 63 ILE HG2% H 1 0.7300 . A 63 ILE CA C 13 58.4800 . A 63 ILE CB C 13 37.8200 . A 63 ILE CD1 C 13 11.4400 . A 63 ILE CG1 C 13 23.2200 . A 63 ILE CG2 C 13 15.4100 . A 63 ILE N N 15 125.4000 . A 64 ALA H H 1 9.3500 . A 64 ALA HA H 1 5.4000 . A 64 ALA HB% H 1 1.2800 . A 64 ALA CA C 13 47.4400 . A 64 ALA CB C 13 19.7500 . A 64 ALA N N 15 130.1800 . A 65 PHE H H 1 8.1200 . A 65 PHE HA H 1 5.4100 . A 65 PHE HBx H 1 2.7000 . A 65 PHE HBy H 1 2.7000 . A 65 PHE CA C 13 53.2100 . A 65 PHE CB C 13 40.4900 . A 65 PHE N N 15 115.8000 . A 66 GLU H H 1 8.3600 . A 66 GLU HA H 1 4.7000 . A 66 GLU HBx H 1 2.1200 . A 66 GLU HBy H 1 2.1200 . A 66 GLU HGy H 1 2.3600 . A 66 GLU HGx H 1 2.2400 . A 66 GLU CA C 13 52.1000 . A 66 GLU CB C 13 30.2800 . A 66 GLU CG C 13 33.5400 . A 66 GLU N N 15 120.3900 . A 67 ASP H H 1 8.8800 . A 67 ASP HA H 1 5.1200 . A 67 ASP HBx H 1 1.9200 . A 67 ASP HBy H 1 2.1300 . A 67 ASP CA C 13 51.0700 . A 67 ASP CB C 13 38.3100 . A 67 ASP N N 15 124.8600 . A 68 ARG H H 1 8.3300 . A 68 ARG HA H 1 4.1700 . A 68 ARG HBx H 1 2.0800 . A 68 ARG HBy H 1 2.0800 . A 68 ARG HDx H 1 3.2600 . A 68 ARG HDy H 1 3.2600 . A 68 ARG CA C 13 54.1700 . A 68 ARG CB C 13 27.7400 . A 68 ARG N N 15 125.0100 . A 69 LYS H H 1 7.9800 . A 69 LYS HA H 1 4.0300 . A 69 LYS HBy H 1 2.1700 . A 69 LYS HBx H 1 1.9500 . A 69 LYS HDx H 1 1.7100 . A 69 LYS HDy H 1 1.7100 . A 69 LYS HEx H 1 2.9500 . A 69 LYS HEy H 1 2.9500 . A 69 LYS HGx H 1 1.3400 . A 69 LYS HGy H 1 1.8500 . A 69 LYS CA C 13 55.5300 . A 69 LYS CB C 13 26.2200 . A 69 LYS CD C 13 30.6400 . A 69 LYS CE C 13 40.0700 . A 69 LYS CG C 13 22.3800 . A 69 LYS N N 15 118.1100 . A 70 ASP H H 1 7.9300 . A 70 ASP HA H 1 4.3300 . A 70 ASP HBx H 1 1.5700 . A 70 ASP HBy H 1 1.6200 . A 70 ASP CA C 13 52.5400 . A 70 ASP CB C 13 40.0200 . A 70 ASP N N 15 116.3800 . A 71 GLY H H 1 9.0800 . A 71 GLY HAy H 1 4.2000 . A 71 GLY HAx H 1 3.6300 . A 71 GLY CA C 13 42.4800 . A 71 GLY N N 15 108.2400 . A 72 SER H H 1 8.4000 . A 72 SER HA H 1 5.4700 . A 72 SER HBx H 1 3.7300 . A 72 SER HBy H 1 3.7300 . A 72 SER CA C 13 54.4400 . A 72 SER CB C 13 65.1300 . A 72 SER N N 15 116.9800 . A 73 CYS H H 1 8.8100 . A 73 CYS HA H 1 5.2100 . A 73 CYS HBx H 1 2.5900 . A 73 CYS HBy H 1 2.5900 . A 73 CYS CA C 13 53.2400 . A 73 CYS CB C 13 28.5200 . A 73 CYS N N 15 114.1400 . A 74 GLY H H 1 8.8800 . A 74 GLY HAy H 1 4.5400 . A 74 GLY HAx H 1 3.6100 . A 74 GLY CA C 13 41.6300 . A 74 GLY N N 15 110.0100 . A 75 VAL H H 1 8.4800 . A 75 VAL HA H 1 4.5500 . A 75 VAL HB H 1 1.9300 . A 75 VAL HGx% H 1 0.4000 . A 75 VAL HGy% H 1 0.5500 . A 75 VAL CA C 13 57.8600 . A 75 VAL CB C 13 30.5300 . A 75 VAL CGx C 13 19.2800 . A 75 VAL CGy C 13 19.3800 . A 75 VAL N N 15 122.5100 . A 76 SER H H 1 8.7000 . A 76 SER HA H 1 5.5400 . A 76 SER HBx H 1 3.4800 . A 76 SER HBy H 1 3.4800 . A 76 SER CA C 13 53.3600 . A 76 SER CB C 13 63.1900 . A 76 SER N N 15 118.9100 . A 77 TYR H H 1 8.9600 . A 77 TYR HA H 1 4.4200 . A 77 TYR HBx H 1 2.5800 . A 77 TYR HBy H 1 2.5800 . A 77 TYR CA C 13 52.7800 . A 77 TYR CB C 13 39.9500 . A 77 TYR N N 15 118.0600 . A 78 VAL H H 1 8.1600 . A 78 VAL HA H 1 4.3200 . A 78 VAL HB H 1 1.7000 . A 78 VAL HGx% H 1 0.6500 . A 78 VAL HGy% H 1 0.6500 . A 78 VAL CA C 13 57.5100 . A 78 VAL CB C 13 32.6200 . A 78 VAL CGx C 13 18.1000 . A 78 VAL CGy C 13 18.1000 . A 78 VAL N N 15 116.8000 . A 79 VAL H H 1 8.7300 . A 79 VAL HA H 1 4.7600 . A 79 VAL HB H 1 1.9300 . A 79 VAL HGx% H 1 0.4100 . A 79 VAL HGy% H 1 0.2700 . A 79 VAL CA C 13 55.7500 . A 79 VAL CB C 13 30.5300 . A 79 VAL CGy C 13 19.3400 . A 79 VAL CGx C 13 15.9600 . A 79 VAL N N 15 119.7300 . A 80 GLN H H 1 8.0300 . A 80 GLN HA H 1 4.2400 . A 80 GLN HBx H 1 1.8500 . A 80 GLN HBy H 1 2.2400 . A 80 GLN HGx H 1 2.4100 . A 80 GLN HGy H 1 2.4100 . A 80 GLN CA C 13 53.9100 . A 80 GLN CB C 13 27.1300 . A 80 GLN CG C 13 30.6400 . A 80 GLN N N 15 116.1500 . A 81 GLU H H 1 7.0700 . A 81 GLU HA H 1 5.0100 . A 81 GLU HBx H 1 2.2800 . A 81 GLU HBy H 1 2.2800 . A 81 GLU HGy H 1 2.3100 . A 81 GLU HGx H 1 2.1800 . A 81 GLU CA C 13 49.6000 . A 81 GLU CB C 13 29.4100 . A 81 GLU CG C 13 32.4100 . A 81 GLU N N 15 113.9900 . A 82 PRO HA H 1 5.0400 . A 82 PRO HBx H 1 1.9900 . A 82 PRO HBy H 1 2.2800 . A 82 PRO HDx H 1 3.7800 . A 82 PRO HDy H 1 4.3300 . A 82 PRO HGy H 1 2.3900 . A 82 PRO HGx H 1 2.0800 . A 82 PRO CA C 13 59.9100 . A 82 PRO CB C 13 29.2800 . A 82 PRO CD C 13 48.5900 . A 82 PRO CG C 13 24.8500 . A 83 GLY H H 1 8.8400 . A 83 GLY CA C 13 41.7800 . A 83 GLY N N 15 104.9100 . A 84 ASP H H 1 8.2500 . A 84 ASP HA H 1 5.2600 . A 84 ASP HBy H 1 2.3700 . A 84 ASP HBx H 1 2.2200 . A 84 ASP CA C 13 51.5400 . A 84 ASP CB C 13 38.7000 . A 84 ASP N N 15 118.8000 . A 85 TYR H H 1 8.8100 . A 85 TYR HA H 1 3.9700 . A 85 TYR HBy H 1 2.9000 . A 85 TYR HBx H 1 2.6600 . A 85 TYR CA C 13 53.9300 . A 85 TYR CB C 13 37.7600 . A 85 TYR N N 15 121.6300 . A 86 GLU H H 1 9.3200 . A 86 GLU HA H 1 5.2600 . A 86 GLU HBx H 1 2.0400 . A 86 GLU HBy H 1 2.0400 . A 86 GLU HGy H 1 2.0800 . A 86 GLU HGx H 1 1.9500 . A 86 GLU CA C 13 52.3500 . A 86 GLU CB C 13 30.0700 . A 86 GLU CG C 13 35.1700 . A 86 GLU N N 15 120.4200 . A 87 VAL H H 1 9.8100 . A 87 VAL HA H 1 4.9900 . A 87 VAL HB H 1 1.9500 . A 87 VAL HGx% H 1 0.6100 . A 87 VAL HGy% H 1 0.4900 . A 87 VAL CA C 13 58.5900 . A 87 VAL CB C 13 30.2100 . A 87 VAL CGy C 13 17.2100 . A 87 VAL CGx C 13 16.8500 . A 87 VAL N N 15 129.2000 . A 88 SER H H 1 9.5600 . A 88 SER HA H 1 5.1700 . A 88 SER HBx H 1 3.8000 . A 88 SER HBy H 1 3.8000 . A 88 SER CA C 13 55.1700 . A 88 SER CB C 13 62.7900 . A 88 SER N N 15 121.7300 . A 89 ILE H H 1 9.5700 . A 89 ILE HA H 1 4.9200 . A 89 ILE HB H 1 1.6300 . A 89 ILE HD1% H 1 0.6600 . A 89 ILE HG1y H 1 1.3800 . A 89 ILE HG1x H 1 1.0000 . A 89 ILE HG2% H 1 0.7800 . A 89 ILE CA C 13 57.0200 . A 89 ILE CB C 13 38.1200 . A 89 ILE CD1 C 13 13.1000 . A 89 ILE CG1 C 13 25.9700 . A 89 ILE CG2 C 13 15.2500 . A 89 ILE N N 15 125.6500 . A 90 LYS H H 1 8.7600 . A 90 LYS HA H 1 5.1300 . A 90 LYS HBy H 1 1.5300 . A 90 LYS HBx H 1 1.0200 . A 90 LYS HDx H 1 2.1300 . A 90 LYS HDy H 1 2.1300 . A 90 LYS HEy H 1 2.1400 . A 90 LYS HEx H 1 1.9300 . A 90 LYS HGy H 1 0.9500 . A 90 LYS HGx H 1 0.1700 . A 90 LYS CA C 13 50.9800 . A 90 LYS CB C 13 33.8500 . A 90 LYS CD C 13 26.1500 . A 90 LYS CE C 13 38.4700 . A 90 LYS CG C 13 21.4600 . A 90 LYS N N 15 122.1700 . A 91 PHE H H 1 9.0400 . A 91 PHE HA H 1 5.3300 . A 91 PHE HBx H 1 2.8300 . A 91 PHE HBy H 1 2.8300 . A 91 PHE CA C 13 53.1900 . A 91 PHE CB C 13 40.2000 . A 91 PHE N N 15 120.9900 . A 92 ASN H H 1 9.2100 . A 92 ASN HA H 1 4.2200 . A 92 ASN HBx H 1 2.7200 . A 92 ASN HBy H 1 2.7200 . A 92 ASN CA C 13 51.4800 . A 92 ASN CB C 13 33.6100 . A 92 ASN N N 15 127.0100 . A 93 ASP H H 1 8.7600 . A 93 ASP HA H 1 3.9700 . A 93 ASP HBx H 1 2.6600 . A 93 ASP HBy H 1 2.9000 . A 93 ASP CA C 13 53.9200 . A 93 ASP CB C 13 38.0600 . A 93 ASP N N 15 107.2200 . A 94 GLU H H 1 7.5000 . A 94 GLU HA H 1 4.7000 . A 94 GLU HBx H 1 1.9400 . A 94 GLU HBy H 1 1.9400 . A 94 GLU HGx H 1 2.3700 . A 94 GLU CA C 13 51.9400 . A 94 GLU CB C 13 29.6800 . A 94 GLU CG C 13 33.4100 . A 94 GLU N N 15 117.8300 . A 95 HIS H H 1 8.7700 . A 95 HIS HA H 1 4.4800 . A 95 HIS HBx H 1 3.1700 . A 95 HIS HBy H 1 3.1700 . A 95 HIS CA C 13 56.5300 . A 95 HIS CB C 13 29.6900 . A 95 HIS N N 15 121.9100 . A 96 ILE H H 1 8.1100 . A 96 ILE HA H 1 4.3100 . A 96 ILE HB H 1 1.7000 . A 96 ILE CA C 13 57.5200 . A 96 ILE CB C 13 32.7200 . A 96 ILE N N 15 116.3700 . A 97 PRO CA C 13 63.5000 . A 97 PRO CB C 13 28.6900 . A 97 PRO CD C 13 48.5300 . A 97 PRO CG C 13 18.2800 . A 98 ASP H H 1 7.9400 . A 98 ASP HA H 1 5.0100 . A 98 ASP HBx H 1 2.4700 . A 98 ASP HBy H 1 2.9000 . A 98 ASP CA C 13 54.5100 . A 98 ASP CB C 13 37.7600 . A 98 ASP N N 15 113.4400 . A 99 SER H H 1 7.4700 . A 99 SER HA H 1 4.2300 . A 99 SER HBx H 1 3.6800 . A 99 SER HBy H 1 3.6800 . A 99 SER CA C 13 52.3700 . A 99 SER CB C 13 60.4300 . A 99 SER N N 15 110.6800 . A 100 PRO HA H 1 4.5500 . A 100 PRO HBx H 1 2.0500 . A 100 PRO HBy H 1 2.3200 . A 100 PRO HDx H 1 3.4900 . A 100 PRO HDy H 1 3.4900 . A 100 PRO HGx H 1 1.8500 . A 100 PRO HGy H 1 1.8500 . A 100 PRO CA C 13 59.9200 . A 100 PRO CB C 13 31.8800 . A 100 PRO CD C 13 47.2900 . A 100 PRO CG C 13 21.9800 . A 101 PHE H H 1 9.2700 . A 101 PHE HA H 1 4.5600 . A 101 PHE HBx H 1 2.8700 . A 101 PHE HBy H 1 2.8700 . A 101 PHE CA C 13 54.0600 . A 101 PHE CB C 13 37.9300 . A 101 PHE N N 15 119.1800 . A 102 VAL H H 1 8.7600 . A 102 VAL HA H 1 4.5800 . A 102 VAL HB H 1 1.9500 . A 102 VAL HGx% H 1 0.8800 . A 102 VAL HGy% H 1 0.7800 . A 102 VAL CA C 13 60.4000 . A 102 VAL CB C 13 28.9700 . A 102 VAL CGy C 13 18.5800 . A 102 VAL CGx C 13 18.2300 . A 102 VAL N N 15 123.1200 . A 103 VAL H H 1 9.5200 . A 103 VAL HA H 1 4.3900 . A 103 VAL HB H 1 1.9600 . A 103 VAL HGx% H 1 0.9100 . A 103 VAL HGy% H 1 0.8900 . A 103 VAL CA C 13 57.2000 . A 103 VAL CB C 13 32.0600 . A 103 VAL CGy C 13 17.8600 . A 103 VAL CGx C 13 17.7500 . A 103 VAL N N 15 130.3300 . A 104 PRO HA H 1 4.3700 . A 104 PRO HDx H 1 3.7800 . A 104 PRO HDy H 1 3.7800 . A 104 PRO CA C 13 60.2400 . A 104 PRO CB C 13 29.6600 . A 104 PRO CD C 13 48.5300 . A 104 PRO CG C 13 24.7800 . A 105 VAL H H 1 9.3000 . A 105 VAL HA H 1 4.3000 . A 105 VAL HB H 1 2.3900 . A 105 VAL HGx% H 1 0.5500 . A 105 VAL HGy% H 1 0.6500 . A 105 VAL CA C 13 59.2100 . A 105 VAL CB C 13 28.8400 . A 105 VAL CGy C 13 18.4700 . A 105 VAL CGx C 13 18.3300 . A 105 VAL N N 15 126.3200 . A 106 ALA H H 1 8.3600 . A 106 ALA HA H 1 4.6600 . A 106 ALA HB% H 1 1.5900 . A 106 ALA CA C 13 48.3400 . A 106 ALA CB C 13 18.9600 . A 106 ALA N N 15 130.5500 . A 107 SER H H 1 8.5900 . A 107 SER HA H 1 4.4900 . A 107 SER HBx H 1 3.8200 . A 107 SER HBy H 1 3.8200 . A 107 SER CA C 13 55.5700 . A 107 SER CB C 13 61.7600 . A 107 SER N N 15 112.3400 . A 108 LEU H H 1 8.6600 . A 108 LEU HA H 1 4.3000 . A 108 LEU HBx H 1 1.6100 . A 108 LEU HBy H 1 1.6100 . A 108 LEU HDx% H 1 0.8900 . A 108 LEU HDy% H 1 0.8200 . A 108 LEU HG H 1 1.6000 . A 108 LEU CA C 13 53.2500 . A 108 LEU CB C 13 39.6500 . A 108 LEU CDy C 13 22.1400 . A 108 LEU CDx C 13 20.4700 . A 108 LEU CG C 13 24.2200 . A 108 LEU N N 15 123.2000 . A 109 SER H H 1 8.2100 . A 109 SER HA H 1 4.3700 . A 109 SER HBx H 1 3.8400 . A 109 SER HBy H 1 3.8400 . A 109 SER CA C 13 55.8100 . A 109 SER CB C 13 61.2400 . A 109 SER N N 15 114.7100 . A 110 ASP H H 1 8.2400 . A 110 ASP HA H 1 4.5000 . A 110 ASP HBx H 1 2.6400 . A 110 ASP HBy H 1 2.6400 . A 110 ASP CA C 13 52.7400 . A 110 ASP CB C 13 38.2600 . A 110 ASP N N 15 121.0300 . A 111 ASP H H 1 8.2100 . A 111 ASP HA H 1 4.5000 . A 111 ASP HBx H 1 2.6400 . A 111 ASP HBy H 1 2.6400 . A 111 ASP CA C 13 52.7700 . A 111 ASP CB C 13 38.2900 . A 111 ASP N N 15 118.9100 . A 112 ALA H H 1 8.0500 . A 112 ALA HA H 1 4.1700 . A 112 ALA HB% H 1 1.4000 . A 112 ALA CA C 13 50.7100 . A 112 ALA CB C 13 16.1100 . A 112 ALA N N 15 121.6000 . A 113 ARG H H 1 7.9600 . A 113 ARG HA H 1 4.0300 . A 113 ARG HBx H 1 1.9200 . A 113 ARG HBy H 1 2.1700 . A 113 ARG HDx H 1 2.9600 . A 113 ARG HGx H 1 1.3100 . A 113 ARG HGy H 1 1.3100 . A 113 ARG CA C 13 55.2000 . A 113 ARG CB C 13 27.7300 . A 113 ARG CD C 13 39.3300 . A 113 ARG CG C 13 22.1100 . A 113 ARG N N 15 116.6400 . A 114 ARG H H 1 7.9300 . A 114 ARG HA H 1 4.0000 . A 114 ARG HBy H 1 1.8500 . A 114 ARG HBx H 1 1.7100 . A 114 ARG HDx H 1 3.0400 . A 114 ARG HDy H 1 3.0400 . A 114 ARG HGx H 1 1.3500 . A 114 ARG HGy H 1 1.3500 . A 114 ARG CA C 13 53.9400 . A 114 ARG CB C 13 30.5500 . A 114 ARG CD C 13 39.2600 . A 114 ARG CG C 13 22.3800 . A 114 ARG N N 15 116.3800 . A 115 LEU H H 1 8.0000 . A 115 LEU HA H 1 4.3200 . A 115 LEU HBx H 1 1.6400 . A 115 LEU HBy H 1 1.6400 . A 115 LEU HDx% H 1 0.8800 . A 115 LEU HDy% H 1 0.8100 . A 115 LEU HG H 1 1.6000 . A 115 LEU CA C 13 52.8700 . A 115 LEU CB C 13 39.6400 . A 115 LEU CDy C 13 22.1400 . A 115 LEU CDx C 13 20.4100 . A 115 LEU CG C 13 24.1400 . A 115 LEU N N 15 120.2600 . A 116 THR H H 1 7.9700 . A 116 THR HA H 1 4.3900 . A 116 THR HB H 1 4.2300 . A 116 THR HG2% H 1 1.1500 . A 116 THR CA C 13 59.2700 . A 116 THR CB C 13 67.4200 . A 116 THR CG2 C 13 18.3600 . A 116 THR N N 15 113.2500 . A 117 VAL H H 1 8.0700 . A 117 VAL HA H 1 4.3300 . A 117 VAL HB H 1 2.0800 . A 117 VAL HGy% H 1 0.9200 . A 117 VAL CA C 13 60.2300 . A 117 VAL CB C 13 30.3600 . A 117 VAL CGy C 13 17.9500 . A 117 VAL N N 15 120.9900 . A 118 THR H H 1 8.2100 . A 118 THR HA H 1 4.3800 . A 118 THR HB H 1 4.2300 . A 118 THR HG2% H 1 1.1600 . A 118 THR CA C 13 58.7700 . A 118 THR CB C 13 67.4200 . A 118 THR CG2 C 13 18.3600 . A 118 THR N N 15 116.4200 . A 119 SER H H 1 7.9100 . A 119 SER HA H 1 4.2300 . A 119 SER HBx H 1 3.8000 . A 119 SER CA C 13 57.3900 . A 119 SER CB C 13 62.2500 . A 119 SER N N 15 122.1700 . B 6 GLU H H 1 8.78 . B 6 GLU HA H 1 4.16 . B 6 GLU HBx H 1 2.26 . B 6 GLU HBy H 1 2.26 . B 6 GLU HGx H 1 1.92 . B 6 GLU HGy H 1 1.92 . B 8 ARG H H 1 8.20 . B 8 ARG HA H 1 4.21 . B 8 ARG HBx H 1 1.88 . B 8 ARG HBy H 1 1.88 . B 8 ARG HDx H 1 3.15 . B 8 ARG HGx H 1 1.56 . B 8 ARG HGy H 1 1.75 . B 9 VAL H H 1 9.00 . B 9 VAL HA H 1 4.07 . B 9 VAL HB H 1 2.01 . B 9 VAL HGx% H 1 0.87 . B 9 VAL HGy% H 1 1.28 . B 10 ALA HB% H 1 1.34 . B 11 SER H H 1 8.49 . B 11 SER HBx H 1 3.80 . B 11 SER HBy H 1 3.88 . B 12 SER HA H 1 4.41 . B 12 SER HBx H 1 3.72 . B 12 SER HBy H 1 3.72 . B 13 VAL H H 1 8.80 . B 13 VAL HA H 1 4.01 . B 13 VAL HB H 1 1.92 . B 13 VAL HGx% H 1 0.74 . B 13 VAL HGy% H 1 0.74 . B 14 PHE HA H 1 4.62 . B 14 PHE HBx H 1 2.82 . B 14 PHE HBy H 1 3.08 . B 14 PHE HEx H 1 7.05 . B 14 PHE HEy H 1 7.1700 . B 15 ILE H H 1 8.71 . B 15 ILE HA H 1 4.14 . B 15 ILE HB H 1 1.74 . B 15 ILE HD1% H 1 0.34 . B 15 ILE HG1y H 1 1.2 . B 15 ILE HG1x H 1 1.09 . B 15 ILE HG2% H 1 0.78 . B 16 THR HA H 1 4.22 . B 16 THR HB H 1 4.10 . B 16 THR HG2% H 1 1.13 . B 17 LEU H H 1 8.27 . B 17 LEU HA H 1 4.13 . B 17 LEU HBx H 1 1.72 . B 17 LEU HBy H 1 1.72 . B 17 LEU HDx% H 1 0.74 . B 17 LEU HDy% H 1 0.74 . B 17 LEU HG H 1 1.52 . B 18 ALA HA H 1 4.5 . B 18 ALA HB% H 1 1.27 . B 19 PRO HBx H 1 2.25 . B 19 PRO HBy H 1 2.25 . B 19 PRO HDx H 1 3.60 . B 19 PRO HDy H 1 3.68 . 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 2 ILE H A 3 PRO HA 1.0 1.8 3.9 2 2 A 2 ILE H A 3 PRO HDx 1.0 1.8 4.0 3 2 A 2 ILE H A 3 PRO HDy 1.0 1.8 4.0 4 3 A 2 ILE H A 4 GLU H 1.0 1.8 5.3 5 4 A 3 PRO HA A 3 PRO HDx 1.0 1.8 5.5 6 4 A 3 PRO HA A 3 PRO HDy 1.0 1.8 5.5 7 5 A 3 PRO HBx A 3 PRO HDx 1.0 1.8 5.5 8 5 A 3 PRO HDy A 3 PRO HBx 1.0 1.8 5.5 9 6 A 3 PRO HA A 3 PRO HGx 1.0 1.8 5.5 10 6 A 3 PRO HA A 3 PRO HGy 1.0 1.8 5.5 11 7 A 3 PRO HBy A 3 PRO HDx 1.0 1.8 5.5 12 7 A 3 PRO HDy A 3 PRO HBy 1.0 1.8 5.5 13 8 A 3 PRO HA A 4 GLU H 1.0 1.8 3.5 14 9 A 4 GLU H A 3 PRO HDx 1.0 1.8 5.5 15 9 A 3 PRO HDy A 4 GLU H 1.0 1.8 5.5 16 10 A 4 GLU H A 3 PRO HBx 1.0 1.8 5.0 17 11 A 3 PRO HA A 5 PHE HBx 1.0 1.8 2.7 18 11 A 3 PRO HA A 5 PHE HBy 1.0 1.8 2.7 19 12 A 3 PRO HGy A 5 PHE HBx 1.0 1.8 5.5 20 12 A 3 PRO HGx A 5 PHE HBx 1.0 1.8 5.5 21 12 A 5 PHE HBy A 3 PRO HGx 1.0 1.8 5.5 22 12 A 3 PRO HGy A 5 PHE HBy 1.0 1.8 5.5 23 13 A 4 GLU H A 6 PHE HA 1.0 1.8 3.8 24 14 A 4 GLU H A 8 PHE H 1.0 1.8 5.3 25 15 A 6 PHE H A 5 PHE HBx 1.0 1.8 5.0 26 15 A 5 PHE HBy A 6 PHE H 1.0 1.8 5.0 27 16 A 6 PHE H A 6 PHE HBy 1.0 1.8 3.5 28 17 A 6 PHE H A 6 PHE HBx 1.0 1.8 5.0 29 18 A 6 PHE HBy A 7 GLN H 1.0 1.8 3.5 30 19 A 6 PHE HA A 7 GLN H 1.0 1.8 2.9 31 20 A 8 PHE H A 6 PHE HBy 1.0 1.8 4.5 32 21 A 6 PHE HA A 8 PHE H 1.0 1.8 2.9 33 22 A 6 PHE HBx A 8 PHE HA 1.0 1.8 5.8 34 23 A 6 PHE HBy A 9 THR H 1.0 1.8 5.0 35 24 A 6 PHE HA A 9 THR H 1.0 1.8 2.9 36 25 A 6 PHE HBy A 9 THR HG2% 1.0 1.8 6.5 37 26 A 6 PHE HBy A 10 VAL H 1.0 1.8 5.0 38 27 A 6 PHE HA A 10 VAL H 1.0 1.8 3.3 39 28 A 6 PHE HA A 10 VAL HB 1.0 1.8 5.0 40 29 A 6 PHE HBx A 10 VAL HB 1.0 1.8 5.0 41 30 A 7 GLN H A 7 GLN HGx 1.0 1.8 5.5 42 30 A 7 GLN H A 7 GLN HGy 1.0 1.8 5.5 43 31 A 7 GLN H A 7 GLN HBx 1.0 1.8 4.0 44 31 A 7 GLN H A 7 GLN HBy 1.0 1.8 4.0 45 32 A 8 PHE H A 7 GLN HA 1.0 1.8 3.5 46 33 A 7 GLN H A 8 PHE HA 1.0 1.8 4.7 47 34 A 8 PHE H A 7 GLN HBx 1.0 1.8 4.0 48 34 A 8 PHE H A 7 GLN HBy 1.0 1.8 4.0 49 35 A 7 GLN H A 9 THR H 1.0 1.8 3.5 50 36 A 7 GLN H A 10 VAL HA 1.0 1.8 3.4 51 37 A 7 GLN H A 10 VAL HB 1.0 1.8 5.0 52 38 A 10 VAL HGx% A 7 GLN HBx 1.0 1.8 6.2 53 38 A 7 GLN HBy A 10 VAL HGx% 1.0 1.8 6.2 54 39 A 8 PHE H A 8 PHE HBx 1.0 1.8 5.5 55 39 A 8 PHE H A 8 PHE HBy 1.0 1.8 5.5 56 40 A 8 PHE H A 9 THR H 1.0 1.8 3.0 57 41 A 9 THR H A 8 PHE HBx 1.0 1.8 5.5 58 41 A 9 THR H A 8 PHE HBy 1.0 1.8 5.5 59 42 A 8 PHE HA A 9 THR H 1.0 1.8 3.4 60 43 A 8 PHE HA A 10 VAL HB 1.0 1.8 5.0 61 44 A 8 PHE HA A 10 VAL H 1.0 1.8 3.5 62 45 A 8 PHE H A 10 VAL HA 1.0 1.8 4.4 63 46 A 8 PHE H A 10 VAL HB 1.0 1.8 5.0 64 47 A 8 PHE HA A 11 GLY H 1.0 1.8 4.9 65 48 A 9 THR H A 9 THR HB 1.0 1.8 5.0 66 49 A 9 THR HG2% A 9 THR HA 1.0 1.8 3.2 67 50 A 9 THR H A 9 THR HG2% 1.0 1.8 5.5 68 51 A 10 VAL H A 9 THR HB 1.0 1.8 3.5 69 52 A 9 THR HG2% A 10 VAL H 1.0 1.8 5.5 70 53 A 10 VAL H A 9 THR HA 1.0 1.8 3.3 71 54 A 9 THR H A 10 VAL HGx% 1.0 1.8 5.0 72 55 A 9 THR HG2% A 11 GLY H 1.0 1.8 5.5 73 56 A 10 VAL H A 10 VAL HB 1.0 1.8 3.5 74 57 A 10 VAL H A 10 VAL HGx% 1.0 1.8 3.4 75 58 A 10 VAL HA A 10 VAL HGx% 1.0 1.8 5.5 76 59 A 10 VAL HA A 11 GLY H 1.0 1.8 3.5 77 60 A 10 VAL HB A 11 GLY H 1.0 1.8 3.9 78 61 A 10 VAL HGx% A 11 GLY H 1.0 1.8 4.0 79 62 A 10 VAL H A 11 GLY H 1.0 1.8 2.9 80 63 A 10 VAL HGx% A 12 PRO HDx 1.0 1.8 4.3 81 63 A 10 VAL HGx% A 12 PRO HDy 1.0 1.8 4.3 82 64 A 10 VAL HB A 14 GLY HAy 1.0 1.8 5.0 83 65 A 11 GLY H A 12 PRO HDx 1.0 1.8 5.5 84 65 A 11 GLY H A 12 PRO HDy 1.0 1.8 5.5 85 66 A 11 GLY HAy A 12 PRO HDx 1.0 1.8 4.0 86 66 A 12 PRO HDy A 11 GLY HAy 1.0 1.8 4.0 87 67 A 11 GLY HAx A 12 PRO HDx 1.0 1.8 3.2 88 67 A 12 PRO HDy A 11 GLY HAx 1.0 1.8 3.2 89 68 A 11 GLY HAx A 13 LEU H 1.0 1.8 5.0 90 69 A 11 GLY HAy A 13 LEU H 1.0 1.8 5.0 91 70 A 11 GLY H A 14 GLY H 1.0 1.8 3.8 92 71 A 12 PRO HA A 12 PRO HDx 1.0 1.8 5.5 93 71 A 12 PRO HDy A 12 PRO HA 1.0 1.8 5.5 94 72 A 12 PRO HBx A 12 PRO HDx 1.0 1.8 6.0 95 72 A 12 PRO HBy A 12 PRO HDx 1.0 1.8 6.0 96 72 A 12 PRO HDy A 12 PRO HBx 1.0 1.8 6.0 97 72 A 12 PRO HDy A 12 PRO HBy 1.0 1.8 6.0 98 73 A 12 PRO HA A 13 LEU HG 1.0 1.8 3.7 99 74 A 13 LEU H A 12 PRO HGx 1.0 1.8 5.3 100 75 A 13 LEU H A 12 PRO HDx 1.0 1.8 5.5 101 75 A 12 PRO HDy A 13 LEU H 1.0 1.8 5.5 102 76 A 13 LEU H A 12 PRO HGy 1.0 1.8 4.5 103 77 A 13 LEU H A 12 PRO HA 1.0 1.8 2.9 104 78 A 13 LEU HA A 12 PRO HBx 1.0 1.8 6.2 105 78 A 12 PRO HBy A 13 LEU HA 1.0 1.8 6.2 106 79 A 14 GLY H A 12 PRO HGy 1.0 1.8 5.0 107 80 A 13 LEU HA A 13 LEU HDy% 1.0 1.8 4.2 108 81 A 13 LEU H A 13 LEU HDy% 1.0 1.8 5.5 109 82 A 13 LEU H A 13 LEU HBx 1.0 1.8 4.1 110 82 A 13 LEU H A 13 LEU HBy 1.0 1.8 4.1 111 83 A 13 LEU HDx% A 13 LEU HBx 1.0 1.8 3.7 112 83 A 13 LEU HBy A 13 LEU HDx% 1.0 1.8 3.7 113 84 A 13 LEU HG A 13 LEU HA 1.0 1.8 5.0 114 85 A 13 LEU HDy% A 13 LEU HBx 1.0 1.8 3.7 115 85 A 13 LEU HDy% A 13 LEU HBy 1.0 1.8 3.7 116 86 A 13 LEU H A 13 LEU HG 1.0 1.8 3.4 117 87 A 13 LEU HA A 13 LEU HDx% 1.0 1.8 5.5 118 88 A 14 GLY H A 13 LEU HBx 1.0 1.8 5.5 119 88 A 14 GLY H A 13 LEU HBy 1.0 1.8 5.5 120 89 A 14 GLY H A 13 LEU HA 1.0 1.8 2.9 121 90 A 14 GLY H A 13 LEU HDy% 1.0 1.8 5.8 122 91 A 15 GLU H A 13 LEU HBx 1.0 1.8 5.5 123 91 A 13 LEU HBy A 15 GLU H 1.0 1.8 5.5 124 92 A 13 LEU HG A 15 GLU HBx 1.0 1.8 3.7 125 93 A 15 GLU HA A 13 LEU HBx 1.0 1.8 5.3 126 93 A 13 LEU HBy A 15 GLU HA 1.0 1.8 5.3 127 94 A 13 LEU HA A 15 GLU H 1.0 1.8 4.2 128 95 A 15 GLU H A 14 GLY HAx 1.0 1.8 2.9 129 96 A 14 GLY HAx A 15 GLU HBy 1.0 1.8 5.0 130 97 A 14 GLY HAy A 15 GLU HBy 1.0 1.8 5.0 131 98 A 14 GLY H A 15 GLU H 1.0 1.8 3.2 132 99 A 14 GLY H A 15 GLU HBx 1.0 1.8 5.0 133 100 A 14 GLY HAx A 16 GLY HAy 1.0 1.8 4.4 134 101 A 15 GLU H A 15 GLU HBx 1.0 1.8 3.3 135 102 A 15 GLU H A 15 GLU HBy 1.0 1.8 3.7 136 103 A 15 GLU H A 15 GLU HGx 1.0 1.8 5.1 137 103 A 15 GLU H A 15 GLU HGy 1.0 1.8 5.1 138 104 A 15 GLU HA A 15 GLU HGx 1.0 1.8 3.8 139 104 A 15 GLU HA A 15 GLU HGy 1.0 1.8 3.8 140 105 A 15 GLU HA A 16 GLY HAy 1.0 1.8 5.1 141 106 A 15 GLU HA A 16 GLY H 1.0 1.8 3.5 142 107 A 15 GLU H A 16 GLY H 1.0 1.8 5.0 143 108 A 16 GLY HAx A 15 GLU HGx 1.0 1.8 6.1 144 108 A 15 GLU HGy A 16 GLY HAx 1.0 1.8 6.1 145 109 A 15 GLU HBy A 16 GLY H 1.0 1.8 5.0 146 110 A 16 GLY H A 15 GLU HGx 1.0 1.8 5.5 147 110 A 15 GLU HGy A 16 GLY H 1.0 1.8 5.5 148 111 A 15 GLU HBx A 16 GLY H 1.0 1.8 5.0 149 112 A 15 GLU H A 16 GLY HAy 1.0 1.8 5.1 150 113 A 15 GLU HA A 18 ALA H 1.0 1.8 5.6 151 114 A 18 ALA HB% A 15 GLU HGx 1.0 1.8 4.3 152 114 A 15 GLU HGy A 18 ALA HB% 1.0 1.8 4.3 153 115 A 16 GLY HAy A 17 GLY H 1.0 1.8 3.5 154 116 A 16 GLY H A 17 GLY H 1.0 1.8 5.0 155 117 A 16 GLY HAx A 17 GLY H 1.0 1.8 3.5 156 118 A 16 GLY HAy A 18 ALA H 1.0 1.8 4.3 157 119 A 17 GLY HAx A 18 ALA HA 1.0 1.8 4.5 158 120 A 18 ALA H A 17 GLY H 1.0 1.8 3.5 159 121 A 18 ALA H A 17 GLY HAx 1.0 1.8 3.3 160 122 A 18 ALA HB% A 17 GLY HAy 1.0 1.8 5.6 161 123 A 18 ALA H A 17 GLY HAy 1.0 1.8 3.5 162 124 A 18 ALA HB% A 17 GLY H 1.0 1.8 5.5 163 125 A 17 GLY HAy A 19 HIS H 1.0 1.8 3.5 164 126 A 17 GLY HAx A 20 LYS HGy 1.0 1.8 5.0 165 127 A 17 GLY HAy A 20 LYS HGy 1.0 1.8 5.0 166 128 A 17 GLY HAy A 20 LYS H 1.0 1.8 5.1 167 129 A 17 GLY H A 20 LYS HGy 1.0 1.8 5.0 168 130 A 17 GLY H A 20 LYS HGx 1.0 1.8 5.0 169 131 A 17 GLY HAy A 20 LYS HBx 1.0 1.8 5.5 170 131 A 17 GLY HAy A 20 LYS HBy 1.0 1.8 5.5 171 132 A 17 GLY H A 46 ALA HA 1.0 1.8 5.7 172 133 A 17 GLY HAx A 46 ALA HB% 1.0 1.8 5.5 173 134 A 17 GLY H A 46 ALA HB% 1.0 1.8 6.0 174 135 A 17 GLY HAy A 46 ALA HB% 1.0 1.8 6.0 175 136 A 17 GLY HAy A 91 PHE HBx 1.0 1.8 6.0 176 136 A 17 GLY HAy A 91 PHE HBy 1.0 1.8 6.0 177 137 A 17 GLY H A 91 PHE HEy 1.0 1.8 6.0 178 138 A 17 GLY HAy A 94 GLU HBx 1.0 1.8 6.2 179 138 A 17 GLY HAy A 94 GLU HBy 1.0 1.8 6.2 180 139 A 18 ALA H A 18 ALA HB% 1.0 1.8 3.4 181 140 A 18 ALA HA A 19 HIS H 1.0 1.8 5.0 182 141 A 18 ALA H A 19 HIS HBx 1.0 1.8 5.0 183 142 A 18 ALA H A 19 HIS H 1.0 1.8 3.5 184 143 A 18 ALA HB% A 19 HIS HBy 1.0 1.8 5.5 185 144 A 18 ALA HB% A 19 HIS H 1.0 1.8 4.0 186 145 A 18 ALA HA A 19 HIS HA 1.0 1.8 4.6 187 146 A 18 ALA HB% A 19 HIS HBx 1.0 1.8 5.5 188 147 A 18 ALA H A 20 LYS H 1.0 1.8 5.0 189 148 A 18 ALA HB% A 20 LYS H 1.0 1.8 5.8 190 149 A 18 ALA H A 20 LYS HGy 1.0 1.8 5.0 191 150 A 18 ALA HA A 21 VAL HGx% 1.0 1.8 5.5 192 151 A 18 ALA HA A 21 VAL H 1.0 1.8 5.0 193 152 A 18 ALA HA A 21 VAL HB 1.0 1.8 5.5 194 153 A 18 ALA H A 21 VAL H 1.0 1.8 6.0 195 154 A 18 ALA HB% A 21 VAL H 1.0 1.8 6.4 196 155 A 18 ALA H A 21 VAL HB 1.0 1.8 5.0 197 156 A 18 ALA H A 46 ALA HB% 1.0 1.8 5.9 198 157 A 18 ALA HA A 91 PHE HBx 1.0 1.8 5.5 199 157 A 18 ALA HA A 91 PHE HBy 1.0 1.8 5.5 200 158 A 18 ALA HB% A 91 PHE H 1.0 1.8 6.0 201 159 A 18 ALA H A 91 PHE HDy 1.0 1.8 5.1 202 160 A 18 ALA H A 91 PHE HBx 1.0 1.8 5.7 203 160 A 18 ALA H A 91 PHE HBy 1.0 1.8 5.7 204 161 A 18 ALA HA A 91 PHE H 1.0 1.8 5.4 205 162 A 18 ALA HB% A 91 PHE HBx 1.0 1.8 6.4 206 162 A 18 ALA HB% A 91 PHE HBy 1.0 1.8 6.4 207 163 A 18 ALA H A 91 PHE H 1.0 1.8 5.4 208 164 A 18 ALA HA A 94 GLU HBx 1.0 1.8 5.5 209 164 A 18 ALA HA A 94 GLU HBy 1.0 1.8 5.5 210 165 A 18 ALA HA A 94 GLU HGy 1.0 1.8 5.0 211 166 A 18 ALA H A 94 GLU HGy 1.0 1.8 5.0 212 167 A 18 ALA H A 94 GLU HA 1.0 1.8 5.0 213 168 A 18 ALA H A 94 GLU HBx 1.0 1.8 5.5 214 168 A 18 ALA H A 94 GLU HBy 1.0 1.8 5.5 215 169 A 18 ALA HB% A 94 GLU HGy 1.0 1.8 5.5 216 170 A 18 ALA HB% A 94 GLU HBx 1.0 1.8 4.3 217 170 A 18 ALA HB% A 94 GLU HBy 1.0 1.8 4.3 218 171 A 18 ALA HB% A 94 GLU H 1.0 1.8 6.4 219 172 A 18 ALA H A 94 GLU H 1.0 1.8 5.7 220 173 A 18 ALA HB% A 95 HIS H 1.0 1.8 5.9 221 174 A 18 ALA HA A 96 ILE H 1.0 1.8 5.4 222 175 A 19 HIS H A 19 HIS HBx 1.0 1.8 5.0 223 176 A 19 HIS H A 19 HIS HBy 1.0 1.8 5.0 224 177 A 20 LYS H A 19 HIS HA 1.0 1.8 5.0 225 178 A 20 LYS H A 19 HIS HBx 1.0 1.8 5.0 226 179 A 19 HIS H A 20 LYS H 1.0 1.8 3.5 227 180 A 19 HIS H A 20 LYS HGy 1.0 1.8 5.0 228 181 A 19 HIS H A 20 LYS HGx 1.0 1.8 5.0 229 182 A 19 HIS H A 20 LYS HA 1.0 1.8 5.4 230 183 A 20 LYS HGy A 19 HIS HBx 1.0 1.8 5.0 231 184 A 19 HIS HA A 20 LYS HA 1.0 1.8 5.0 232 185 A 19 HIS HBx A 20 LYS HA 1.0 1.8 5.0 233 186 A 19 HIS H A 21 VAL H 1.0 1.8 5.0 234 187 A 19 HIS HBx A 21 VAL H 1.0 1.8 5.3 235 188 A 19 HIS HA A 21 VAL H 1.0 1.8 5.0 236 189 A 19 HIS H A 21 VAL HB 1.0 1.8 5.0 237 190 A 20 LYS HA A 20 LYS HEx 1.0 1.8 6.5 238 190 A 20 LYS HA A 20 LYS HEy 1.0 1.8 6.5 239 191 A 20 LYS HA A 20 LYS HDx 1.0 1.8 4.2 240 192 A 20 LYS HA A 20 LYS HDy 1.0 1.8 4.8 241 193 A 20 LYS HGy A 20 LYS HA 1.0 1.8 3.7 242 194 A 20 LYS HGy A 20 LYS HEx 1.0 1.8 3.8 243 194 A 20 LYS HGy A 20 LYS HEy 1.0 1.8 3.8 244 195 A 20 LYS H A 20 LYS HBx 1.0 1.8 4.0 245 195 A 20 LYS H A 20 LYS HBy 1.0 1.8 4.0 246 196 A 20 LYS H A 20 LYS HEx 1.0 1.8 5.5 247 196 A 20 LYS H A 20 LYS HEy 1.0 1.8 5.5 248 197 A 20 LYS HGy A 20 LYS H 1.0 1.8 3.5 249 198 A 20 LYS HDy A 20 LYS HBx 1.0 1.8 5.5 250 198 A 20 LYS HBy A 20 LYS HDy 1.0 1.8 5.5 251 199 A 20 LYS H A 20 LYS HDy 1.0 1.8 6.0 252 200 A 20 LYS H A 20 LYS HDx 1.0 1.8 5.0 253 201 A 20 LYS HGx A 20 LYS HEx 1.0 1.8 5.5 254 201 A 20 LYS HGx A 20 LYS HEy 1.0 1.8 5.5 255 202 A 20 LYS HGx A 20 LYS HA 1.0 1.8 5.0 256 203 A 20 LYS H A 20 LYS HGx 1.0 1.8 3.5 257 204 A 21 VAL H A 20 LYS HA 1.0 1.8 5.0 258 205 A 21 VAL H A 20 LYS HBx 1.0 1.8 5.5 259 205 A 20 LYS HBy A 21 VAL H 1.0 1.8 5.5 260 206 A 20 LYS H A 21 VAL H 1.0 1.8 2.9 261 207 A 20 LYS HGy A 21 VAL H 1.0 1.8 3.5 262 208 A 20 LYS HA A 22 ARG H 1.0 1.8 5.3 263 209 A 20 LYS HDy A 45 GLU HA 1.0 1.8 5.0 264 210 A 20 LYS HBy A 45 GLU HGx 1.0 1.8 6.0 265 210 A 20 LYS HBx A 45 GLU HGx 1.0 1.8 6.0 266 210 A 45 GLU HGy A 20 LYS HBx 1.0 1.8 6.0 267 210 A 20 LYS HBy A 45 GLU HGy 1.0 1.8 6.0 268 211 A 20 LYS HGx A 45 GLU HGx 1.0 1.8 6.2 269 211 A 20 LYS HGx A 45 GLU HGy 1.0 1.8 6.2 270 212 A 46 ALA HA A 20 LYS HBx 1.0 1.8 5.9 271 212 A 20 LYS HBy A 46 ALA HA 1.0 1.8 5.9 272 213 A 20 LYS H A 46 ALA H 1.0 1.8 5.5 273 214 A 46 ALA H A 20 LYS HBx 1.0 1.8 5.5 274 214 A 20 LYS HBy A 46 ALA H 1.0 1.8 5.5 275 215 A 46 ALA HA A 20 LYS HEx 1.0 1.8 5.5 276 215 A 46 ALA HA A 20 LYS HEy 1.0 1.8 5.5 277 216 A 20 LYS H A 46 ALA HB% 1.0 1.8 5.5 278 217 A 46 ALA HA A 20 LYS HDy 1.0 1.8 5.0 279 218 A 20 LYS HGy A 46 ALA HA 1.0 1.8 5.3 280 219 A 46 ALA HB% A 20 LYS HBx 1.0 1.8 6.0 281 219 A 20 LYS HBy A 46 ALA HB% 1.0 1.8 6.0 282 220 A 20 LYS HGx A 46 ALA HA 1.0 1.8 5.0 283 221 A 20 LYS HGy A 46 ALA H 1.0 1.8 5.0 284 222 A 20 LYS HDy A 46 ALA H 1.0 1.8 5.0 285 223 A 21 VAL HGx% A 21 VAL H 1.0 1.8 4.5 286 224 A 21 VAL H A 21 VAL HB 1.0 1.8 5.0 287 225 A 21 VAL HGx% A 21 VAL HA 1.0 1.8 3.8 288 226 A 21 VAL HA A 22 ARG HBx 1.0 1.8 4.5 289 227 A 21 VAL H A 22 ARG H 1.0 1.8 5.0 290 228 A 21 VAL HGx% A 22 ARG HA 1.0 1.8 5.5 291 229 A 21 VAL HA A 22 ARG HBy 1.0 1.8 5.0 292 230 A 21 VAL HGx% A 23 ALA H 1.0 1.8 5.3 293 231 A 22 ARG HA A 22 ARG HDx 1.0 1.8 5.0 294 232 A 22 ARG HA A 22 ARG HGx 1.0 1.8 5.0 295 233 A 22 ARG H A 22 ARG HDx 1.0 1.8 5.0 296 234 A 22 ARG H A 22 ARG HBx 1.0 1.8 2.9 297 235 A 22 ARG HA A 22 ARG HDy 1.0 1.8 5.0 298 236 A 22 ARG HBx A 22 ARG HDx 1.0 1.8 5.0 299 237 A 22 ARG HBy A 22 ARG HDy 1.0 1.8 5.0 300 238 A 22 ARG HA A 22 ARG HGy 1.0 1.8 5.0 301 239 A 22 ARG H A 22 ARG HBy 1.0 1.8 5.0 302 240 A 22 ARG HBx A 22 ARG HDy 1.0 1.8 5.0 303 241 A 22 ARG HBy A 22 ARG HDx 1.0 1.8 5.0 304 242 A 23 ALA H A 22 ARG HGx 1.0 1.8 5.0 305 243 A 22 ARG H A 23 ALA H 1.0 1.8 5.0 306 244 A 22 ARG HBx A 23 ALA H 1.0 1.8 4.4 307 245 A 22 ARG HA A 23 ALA H 1.0 1.8 2.9 308 246 A 23 ALA H A 22 ARG HDx 1.0 1.8 5.0 309 247 A 22 ARG HGx A 23 ALA HA 1.0 1.8 5.0 310 248 A 22 ARG HA A 23 ALA HB% 1.0 1.8 5.5 311 249 A 22 ARG HBy A 23 ALA H 1.0 1.8 5.0 312 250 A 22 ARG HGx A 23 ALA HB% 1.0 1.8 5.5 313 251 A 22 ARG HA A 24 GLY H 1.0 1.8 5.8 314 252 A 22 ARG HGx A 24 GLY HAx 1.0 1.8 4.5 315 253 A 22 ARG HGx A 24 GLY H 1.0 1.8 5.0 316 254 A 22 ARG H A 41 ILE HG2% 1.0 1.8 4.7 317 255 A 22 ARG H A 41 ILE HA 1.0 1.8 5.0 318 256 A 22 ARG HGx A 41 ILE HA 1.0 1.8 5.3 319 257 A 22 ARG H A 42 TRP H 1.0 1.8 5.0 320 258 A 22 ARG HGy A 42 TRP H 1.0 1.8 5.0 321 259 A 22 ARG HGx A 42 TRP H 1.0 1.8 5.0 322 260 A 22 ARG HA A 42 TRP H 1.0 1.8 5.0 323 261 A 23 ALA H A 23 ALA HB% 1.0 1.8 4.0 324 262 A 23 ALA H A 24 GLY H 1.0 1.8 5.0 325 263 A 23 ALA HA A 24 GLY H 1.0 1.8 3.5 326 264 A 23 ALA HB% A 24 GLY HAy 1.0 1.8 5.5 327 265 A 23 ALA HB% A 24 GLY H 1.0 1.8 4.0 328 266 A 23 ALA HB% A 28 LEU HDx% 1.0 1.8 4.3 329 267 A 23 ALA HB% A 28 LEU HDy% 1.0 1.8 5.4 330 268 A 23 ALA HA A 41 ILE HD1% 1.0 1.8 5.5 331 269 A 23 ALA HA A 41 ILE HA 1.0 1.8 5.0 332 270 A 23 ALA HA A 41 ILE H 1.0 1.8 5.0 333 271 A 23 ALA HB% A 41 ILE HD1% 1.0 1.8 4.3 334 272 A 23 ALA HB% A 41 ILE HA 1.0 1.8 5.5 335 273 A 23 ALA HA A 41 ILE HG2% 1.0 1.8 5.5 336 274 A 23 ALA HA A 42 TRP H 1.0 1.8 5.0 337 275 A 23 ALA HB% A 42 TRP H 1.0 1.8 5.5 338 276 A 24 GLY H A 25 GLY H 1.0 1.8 5.0 339 277 A 24 GLY HAy A 25 GLY H 1.0 1.8 2.9 340 278 A 24 GLY HAx A 25 GLY H 1.0 1.8 3.5 341 279 A 24 GLY H A 40 SER H 1.0 1.8 4.9 342 280 A 24 GLY H A 40 SER HBx 1.0 1.8 5.5 343 280 A 24 GLY H A 40 SER HBy 1.0 1.8 5.5 344 281 A 24 GLY H A 41 ILE H 1.0 1.8 5.2 345 282 A 24 GLY H A 41 ILE HA 1.0 1.8 5.0 346 283 A 24 GLY H A 42 TRP H 1.0 1.8 5.0 347 284 A 25 GLY HAx A 26 THR HA 1.0 1.8 5.0 348 285 A 26 THR HA A 25 GLY HAy 1.0 1.8 4.6 349 286 A 25 GLY H A 26 THR H 1.0 1.8 5.0 350 287 A 25 GLY HAx A 26 THR H 1.0 1.8 5.0 351 288 A 25 GLY HAy A 26 THR H 1.0 1.8 3.5 352 289 A 25 GLY HAx A 26 THR HG2% 1.0 1.8 6.5 353 290 A 25 GLY HAx A 27 GLY H 1.0 1.8 5.0 354 291 A 25 GLY H A 28 LEU HBx 1.0 1.8 5.0 355 292 A 28 LEU HDy% A 25 GLY H 1.0 1.8 6.1 356 293 A 25 GLY H A 28 LEU H 1.0 1.8 5.0 357 294 A 25 GLY H A 28 LEU HG 1.0 1.8 6.0 358 295 A 28 LEU HDx% A 25 GLY H 1.0 1.8 6.5 359 296 A 25 GLY HAx A 28 LEU H 1.0 1.8 5.0 360 297 A 25 GLY H A 28 LEU HBy 1.0 1.8 5.0 361 298 A 25 GLY H A 29 GLU HGx 1.0 1.8 5.0 362 299 A 25 GLY HAx A 39 PHE HA 1.0 1.8 5.0 363 300 A 40 SER H A 25 GLY HAx 1.0 1.8 5.0 364 301 A 40 SER H A 25 GLY HAy 1.0 1.8 5.4 365 302 A 26 THR H A 26 THR HB 1.0 1.8 5.0 366 303 A 26 THR HA A 26 THR HG2% 1.0 1.8 3.8 367 304 A 26 THR H A 26 THR HG2% 1.0 1.8 5.5 368 305 A 27 GLY H A 26 THR HB 1.0 1.8 5.0 369 306 A 26 THR HA A 27 GLY H 1.0 1.8 5.0 370 307 A 26 THR H A 27 GLY H 1.0 1.8 5.0 371 308 A 26 THR HG2% A 27 GLY H 1.0 1.8 5.5 372 309 A 28 LEU H A 26 THR HB 1.0 1.8 5.0 373 310 A 26 THR HA A 28 LEU H 1.0 1.8 5.0 374 311 A 26 THR HA A 29 GLU HGy 1.0 1.8 3.3 375 312 A 26 THR HA A 29 GLU H 1.0 1.8 5.0 376 313 A 26 THR H A 29 GLU HGy 1.0 1.8 5.0 377 314 A 26 THR HG2% A 29 GLU HGy 1.0 1.8 5.5 378 315 A 26 THR HA A 30 ARG H 1.0 1.8 5.0 379 316 A 26 THR HG2% A 30 ARG H 1.0 1.8 6.2 380 317 A 26 THR H A 39 PHE HA 1.0 1.8 3.4 381 318 A 28 LEU H A 27 GLY HAy 1.0 1.8 5.0 382 319 A 27 GLY H A 28 LEU H 1.0 1.8 5.0 383 320 A 27 GLY H A 28 LEU HG 1.0 1.8 5.0 384 321 A 28 LEU HDx% A 27 GLY H 1.0 1.8 5.5 385 322 A 27 GLY H A 28 LEU HBx 1.0 1.8 6.0 386 323 A 29 GLU H A 27 GLY HAy 1.0 1.8 5.0 387 324 A 27 GLY H A 29 GLU H 1.0 1.8 5.0 388 325 A 27 GLY H A 30 ARG H 1.0 1.8 6.0 389 326 A 27 GLY HAx A 37 ALA HB% 1.0 1.8 5.5 390 327 A 27 GLY HAy A 37 ALA HB% 1.0 1.8 4.4 391 328 A 27 GLY H A 37 ALA HB% 1.0 1.8 6.1 392 329 A 27 GLY HAy A 38 GLU H 1.0 1.8 5.0 393 330 A 27 GLY H A 38 GLU H 1.0 1.8 5.0 394 331 A 27 GLY H A 38 GLU HGx 1.0 1.8 5.4 395 332 A 27 GLY H A 39 PHE HDy 1.0 1.8 5.0 396 333 A 27 GLY H A 39 PHE HBx 1.0 1.8 5.5 397 333 A 27 GLY H A 39 PHE HBy 1.0 1.8 5.5 398 334 A 28 LEU HDy% A 28 LEU HA 1.0 1.8 5.5 399 335 A 28 LEU HDx% A 28 LEU HA 1.0 1.8 4.5 400 336 A 28 LEU HDy% A 28 LEU HBx 1.0 1.8 5.5 401 337 A 28 LEU HDy% A 28 LEU HBy 1.0 1.8 5.5 402 338 A 28 LEU HBx A 28 LEU H 1.0 1.8 6.0 403 339 A 28 LEU HDx% A 28 LEU HBy 1.0 1.8 5.5 404 340 A 28 LEU HDx% A 28 LEU H 1.0 1.8 5.5 405 341 A 28 LEU HDx% A 28 LEU HBx 1.0 1.8 5.5 406 342 A 28 LEU H A 28 LEU HG 1.0 1.8 3.5 407 343 A 28 LEU HDy% A 28 LEU H 1.0 1.8 5.5 408 344 A 28 LEU HG A 28 LEU HA 1.0 1.8 5.0 409 345 A 28 LEU H A 28 LEU HBy 1.0 1.8 3.5 410 346 A 28 LEU HG A 29 GLU H 1.0 1.8 5.0 411 347 A 28 LEU H A 29 GLU H 1.0 1.8 2.9 412 348 A 28 LEU HDx% A 29 GLU H 1.0 1.8 6.1 413 349 A 28 LEU HBx A 29 GLU H 1.0 1.8 5.0 414 350 A 28 LEU HDy% A 29 GLU H 1.0 1.8 6.3 415 351 A 29 GLU H A 28 LEU HA 1.0 1.8 3.5 416 352 A 28 LEU HBy A 29 GLU HGy 1.0 1.8 5.0 417 353 A 28 LEU H A 29 GLU HGy 1.0 1.8 5.0 418 354 A 28 LEU HBx A 29 GLU HGx 1.0 1.8 5.0 419 355 A 28 LEU H A 30 ARG H 1.0 1.8 5.0 420 356 A 28 LEU HG A 39 PHE HBx 1.0 1.8 6.5 421 356 A 28 LEU HG A 39 PHE HBy 1.0 1.8 6.5 422 357 A 28 LEU HDy% A 39 PHE HDy 1.0 1.8 5.5 423 358 A 28 LEU HDx% A 39 PHE HDy 1.0 1.8 5.5 424 359 A 28 LEU H A 39 PHE HBx 1.0 1.8 6.3 425 359 A 28 LEU H A 39 PHE HBy 1.0 1.8 6.3 426 360 A 28 LEU HDy% A 89 ILE HD1% 1.0 1.8 6.0 427 361 A 28 LEU HDx% A 89 ILE HD1% 1.0 1.8 6.5 428 362 A 29 GLU HGy A 29 GLU H 1.0 1.8 3.5 429 363 A 29 GLU HGx A 29 GLU H 1.0 1.8 5.0 430 364 A 29 GLU HGx A 29 GLU HA 1.0 1.8 5.0 431 365 A 29 GLU HGy A 29 GLU HA 1.0 1.8 3.7 432 366 A 29 GLU H A 29 GLU HBx 1.0 1.8 5.5 433 366 A 29 GLU H A 29 GLU HBy 1.0 1.8 5.5 434 367 A 29 GLU H A 30 ARG H 1.0 1.8 2.9 435 368 A 29 GLU HGx A 30 ARG H 1.0 1.8 5.0 436 369 A 29 GLU HGy A 30 ARG H 1.0 1.8 5.0 437 370 A 29 GLU HBy A 30 ARG HDx 1.0 1.8 6.0 438 370 A 29 GLU HBx A 30 ARG HDx 1.0 1.8 6.0 439 370 A 30 ARG HDy A 29 GLU HBx 1.0 1.8 6.0 440 370 A 29 GLU HBy A 30 ARG HDy 1.0 1.8 6.0 441 371 A 30 ARG HBy A 30 ARG HDx 1.0 1.8 6.0 442 371 A 30 ARG HBx A 30 ARG HDx 1.0 1.8 6.0 443 371 A 30 ARG HDy A 30 ARG HBx 1.0 1.8 6.0 444 371 A 30 ARG HDy A 30 ARG HBy 1.0 1.8 6.0 445 372 A 30 ARG H A 30 ARG HGy 1.0 1.8 5.0 446 373 A 30 ARG HA A 30 ARG HDx 1.0 1.8 5.5 447 373 A 30 ARG HDy A 30 ARG HA 1.0 1.8 5.5 448 374 A 30 ARG H A 30 ARG HDx 1.0 1.8 5.5 449 374 A 30 ARG H A 30 ARG HDy 1.0 1.8 5.5 450 375 A 30 ARG H A 30 ARG HBx 1.0 1.8 3.9 451 375 A 30 ARG H A 30 ARG HBy 1.0 1.8 3.9 452 376 A 30 ARG H A 30 ARG HGx 1.0 1.8 3.5 453 377 A 30 ARG HGy A 30 ARG HA 1.0 1.8 6.0 454 378 A 30 ARG HGy A 31 GLY H 1.0 1.8 5.0 455 379 A 30 ARG HA A 31 GLY H 1.0 1.8 2.9 456 380 A 31 GLY H A 30 ARG HBx 1.0 1.8 4.0 457 380 A 30 ARG HBy A 31 GLY H 1.0 1.8 4.0 458 381 A 31 GLY HAy A 30 ARG HBx 1.0 1.8 5.5 459 381 A 30 ARG HBy A 31 GLY HAy 1.0 1.8 5.5 460 382 A 105 VAL HGx% A 30 ARG HBx 1.0 1.8 6.0 461 382 A 30 ARG HBy A 105 VAL HGx% 1.0 1.8 6.0 462 383 A 30 ARG HA A 105 VAL HGy% 1.0 1.8 5.9 463 384 A 30 ARG HA A 105 VAL HA 1.0 1.8 5.0 464 385 A 31 GLY HAy A 32 VAL H 1.0 1.8 2.9 465 386 A 32 VAL H A 31 GLY HAx 1.0 1.8 2.9 466 387 A 31 GLY H A 32 VAL H 1.0 1.8 5.0 467 388 A 31 GLY H A 32 VAL HB 1.0 1.8 6.0 468 389 A 31 GLY HAy A 32 VAL HA 1.0 1.8 5.0 469 390 A 31 GLY H A 103 VAL HGx% 1.0 1.8 5.1 470 391 A 31 GLY HAy A 103 VAL HGx% 1.0 1.8 6.1 471 392 A 31 GLY HAy A 105 VAL HA 1.0 1.8 5.0 472 393 A 31 GLY HAy A 105 VAL HGy% 1.0 1.8 6.5 473 394 A 31 GLY H A 105 VAL HGy% 1.0 1.8 5.5 474 395 A 31 GLY H A 105 VAL HGx% 1.0 1.8 4.2 475 396 A 31 GLY H A 105 VAL HA 1.0 1.8 2.9 476 397 A 31 GLY H A 105 VAL HB 1.0 1.8 5.0 477 398 A 31 GLY H A 105 VAL H 1.0 1.8 5.0 478 399 A 105 VAL HA A 31 GLY HAx 1.0 1.8 3.3 479 400 A 31 GLY H A 106 ALA H 1.0 1.8 5.0 480 401 A 31 GLY HAy A 106 ALA H 1.0 1.8 5.0 481 402 A 31 GLY H A 106 ALA HB% 1.0 1.8 5.5 482 403 A 32 VAL H A 32 VAL HB 1.0 1.8 3.5 483 404 A 32 VAL H A 32 VAL HGx% 1.0 1.8 4.7 484 405 A 32 VAL HA A 32 VAL HGx% 1.0 1.8 3.2 485 406 A 32 VAL H A 32 VAL HGy% 1.0 1.8 3.9 486 407 A 32 VAL H A 33 ALA H 1.0 1.8 5.0 487 408 A 32 VAL HA A 33 ALA H 1.0 1.8 2.9 488 409 A 32 VAL HGx% A 33 ALA H 1.0 1.8 3.4 489 410 A 32 VAL HB A 33 ALA H 1.0 1.8 4.2 490 411 A 32 VAL HB A 33 ALA HB% 1.0 1.8 6.0 491 412 A 32 VAL HA A 33 ALA HA 1.0 1.8 5.0 492 413 A 32 VAL HGy% A 33 ALA H 1.0 1.8 5.5 493 414 A 32 VAL HA A 33 ALA HB% 1.0 1.8 5.5 494 415 A 32 VAL HA A 34 GLY H 1.0 1.8 5.9 495 416 A 32 VAL H A 35 VAL HB 1.0 1.8 5.0 496 417 A 32 VAL HB A 35 VAL H 1.0 1.8 5.1 497 418 A 32 VAL H A 35 VAL H 1.0 1.8 5.0 498 419 A 32 VAL HGx% A 35 VAL H 1.0 1.8 6.1 499 420 A 105 VAL HGx% A 32 VAL H 1.0 1.8 5.5 500 421 A 105 VAL HA A 32 VAL H 1.0 1.8 5.0 501 422 A 32 VAL HA A 106 ALA H 1.0 1.8 3.5 502 423 A 106 ALA H A 32 VAL HGx% 1.0 1.8 5.5 503 424 A 32 VAL H A 106 ALA H 1.0 1.8 5.0 504 425 A 106 ALA HB% A 32 VAL HGy% 1.0 1.8 4.2 505 426 A 32 VAL HB A 107 SER HA 1.0 1.8 5.3 506 427 A 32 VAL HA A 107 SER HBx 1.0 1.8 6.2 507 427 A 32 VAL HA A 107 SER HBy 1.0 1.8 6.2 508 428 A 32 VAL HA A 107 SER H 1.0 1.8 4.7 509 429 A 32 VAL HGx% A 107 SER H 1.0 1.8 5.5 510 430 A 33 ALA H A 33 ALA HB% 1.0 1.8 3.4 511 431 A 33 ALA H A 34 GLY H 1.0 1.8 4.4 512 432 A 33 ALA HA A 34 GLY HAy 1.0 1.8 5.0 513 433 A 33 ALA HA A 34 GLY H 1.0 1.8 3.5 514 434 A 33 ALA HB% A 34 GLY H 1.0 1.8 4.0 515 435 A 33 ALA HA A 35 VAL H 1.0 1.8 5.0 516 436 A 33 ALA HB% A 35 VAL H 1.0 1.8 5.8 517 437 A 33 ALA H A 79 VAL HGy% 1.0 1.8 6.4 518 438 A 33 ALA HA A 79 VAL HGy% 1.0 1.8 5.5 519 439 A 33 ALA HB% A 79 VAL HGy% 1.0 1.8 6.0 520 440 A 33 ALA HA A 80 GLN HA 1.0 1.8 5.0 521 441 A 33 ALA HB% A 80 GLN HA 1.0 1.8 5.9 522 442 A 33 ALA HA A 81 GLU HA 1.0 1.8 3.3 523 443 A 33 ALA HB% A 81 GLU HA 1.0 1.8 5.5 524 444 A 33 ALA HA A 81 GLU H 1.0 1.8 5.0 525 445 A 33 ALA HB% A 81 GLU H 1.0 1.8 5.9 526 446 A 33 ALA HB% A 81 GLU HGx 1.0 1.8 6.2 527 447 A 33 ALA HA A 81 GLU HGy 1.0 1.8 5.0 528 448 A 33 ALA H A 82 PRO HGy 1.0 1.8 5.0 529 449 A 33 ALA H A 82 PRO HGx 1.0 1.8 5.0 530 450 A 33 ALA HB% A 82 PRO HGy 1.0 1.8 5.5 531 451 A 33 ALA H A 82 PRO HDx 1.0 1.8 4.5 532 452 A 105 VAL HGx% A 33 ALA H 1.0 1.8 3.4 533 453 A 105 VAL HGx% A 33 ALA HA 1.0 1.8 3.8 534 454 A 105 VAL HB A 33 ALA HA 1.0 1.8 6.0 535 455 A 105 VAL HGx% A 33 ALA HB% 1.0 1.8 4.7 536 456 A 105 VAL HGy% A 33 ALA H 1.0 1.8 6.3 537 457 A 105 VAL HGy% A 33 ALA HA 1.0 1.8 6.0 538 458 A 106 ALA H A 33 ALA H 1.0 1.8 5.0 539 459 A 33 ALA H A 106 ALA HA 1.0 1.8 5.0 540 460 A 106 ALA HB% A 33 ALA H 1.0 1.8 5.6 541 461 A 33 ALA H A 107 SER HBx 1.0 1.8 5.5 542 461 A 33 ALA H A 107 SER HBy 1.0 1.8 5.5 543 462 A 33 ALA H A 107 SER H 1.0 1.8 4.2 544 463 A 33 ALA HB% A 107 SER H 1.0 1.8 5.5 545 464 A 33 ALA H A 107 SER HA 1.0 1.8 2.9 546 465 A 33 ALA HB% A 107 SER HBx 1.0 1.8 6.0 547 465 A 33 ALA HB% A 107 SER HBy 1.0 1.8 6.0 548 466 A 33 ALA HB% A 108 LEU H 1.0 1.8 5.5 549 467 A 35 VAL H A 34 GLY HAy 1.0 1.8 3.5 550 468 A 34 GLY H A 35 VAL H 1.0 1.8 3.5 551 469 A 34 GLY H A 35 VAL HB 1.0 1.8 5.0 552 470 A 34 GLY H A 35 VAL HA 1.0 1.8 5.4 553 471 A 79 VAL HGy% A 34 GLY HAx 1.0 1.8 6.0 554 472 A 34 GLY H A 79 VAL HGy% 1.0 1.8 5.5 555 473 A 34 GLY HAy A 80 GLN HA 1.0 1.8 5.0 556 474 A 34 GLY H A 80 GLN HA 1.0 1.8 3.3 557 475 A 34 GLY HAy A 81 GLU H 1.0 1.8 5.8 558 476 A 81 GLU HA A 34 GLY HAx 1.0 1.8 5.9 559 477 A 34 GLY H A 81 GLU H 1.0 1.8 5.0 560 478 A 35 VAL HA A 35 VAL HGx% 1.0 1.8 3.6 561 479 A 35 VAL HB A 35 VAL H 1.0 1.8 3.3 562 480 A 35 VAL H A 35 VAL HGy% 1.0 1.8 5.5 563 481 A 35 VAL HA A 35 VAL HGy% 1.0 1.8 3.8 564 482 A 35 VAL H A 35 VAL HGx% 1.0 1.8 5.5 565 483 A 35 VAL HA A 36 PRO HDx 1.0 1.8 3.2 566 483 A 35 VAL HA A 36 PRO HDy 1.0 1.8 3.2 567 484 A 35 VAL HB A 36 PRO HDx 1.0 1.8 5.5 568 484 A 35 VAL HB A 36 PRO HDy 1.0 1.8 5.5 569 485 A 35 VAL HGx% A 36 PRO HDx 1.0 1.8 4.3 570 485 A 35 VAL HGx% A 36 PRO HDy 1.0 1.8 4.3 571 486 A 35 VAL HGy% A 36 PRO HDx 1.0 1.8 6.0 572 486 A 35 VAL HGy% A 36 PRO HDy 1.0 1.8 6.0 573 487 A 35 VAL HGx% A 36 PRO HGx 1.0 1.8 5.5 574 487 A 35 VAL HGx% A 36 PRO HGy 1.0 1.8 5.5 575 488 A 35 VAL H A 79 VAL HGy% 1.0 1.8 5.5 576 489 A 35 VAL H A 79 VAL HB 1.0 1.8 5.7 577 490 A 36 PRO HBy A 36 PRO HDx 1.0 1.8 3.7 578 490 A 36 PRO HBx A 36 PRO HDx 1.0 1.8 3.7 579 490 A 36 PRO HDy A 36 PRO HBx 1.0 1.8 3.7 580 490 A 36 PRO HDy A 36 PRO HBy 1.0 1.8 3.7 581 491 A 36 PRO HA A 36 PRO HGx 1.0 1.8 5.5 582 491 A 36 PRO HGy A 36 PRO HA 1.0 1.8 5.5 583 492 A 37 ALA H A 36 PRO HBx 1.0 1.8 4.8 584 492 A 36 PRO HBy A 37 ALA H 1.0 1.8 4.8 585 493 A 37 ALA HB% A 37 ALA H 1.0 1.8 3.4 586 494 A 38 GLU H A 37 ALA H 1.0 1.8 5.0 587 495 A 38 GLU H A 37 ALA HA 1.0 1.8 2.9 588 496 A 37 ALA HB% A 38 GLU H 1.0 1.8 4.0 589 497 A 37 ALA H A 76 SER HA 1.0 1.8 5.0 590 498 A 37 ALA H A 76 SER HBx 1.0 1.8 6.2 591 498 A 37 ALA H A 76 SER HBy 1.0 1.8 6.2 592 499 A 37 ALA HB% A 76 SER HA 1.0 1.8 5.9 593 500 A 37 ALA H A 77 TYR HA 1.0 1.8 5.0 594 501 A 37 ALA H A 77 TYR H 1.0 1.8 3.7 595 502 A 37 ALA HA A 77 TYR H 1.0 1.8 5.0 596 503 A 37 ALA HB% A 77 TYR H 1.0 1.8 4.8 597 504 A 37 ALA HB% A 77 TYR HBx 1.0 1.8 6.0 598 504 A 37 ALA HB% A 77 TYR HBy 1.0 1.8 6.0 599 505 A 37 ALA H A 78 VAL HB 1.0 1.8 5.3 600 506 A 38 GLU H A 38 GLU HBx 1.0 1.8 3.8 601 506 A 38 GLU H A 38 GLU HBy 1.0 1.8 3.8 602 507 A 38 GLU HGy A 38 GLU HA 1.0 1.8 5.0 603 508 A 38 GLU HGx A 38 GLU HA 1.0 1.8 5.0 604 509 A 38 GLU H A 38 GLU HGy 1.0 1.8 2.9 605 510 A 38 GLU H A 38 GLU HGx 1.0 1.8 5.0 606 511 A 38 GLU H A 39 PHE H 1.0 1.8 4.7 607 512 A 38 GLU HGx A 39 PHE H 1.0 1.8 3.5 608 513 A 38 GLU HGy A 39 PHE H 1.0 1.8 5.0 609 514 A 38 GLU HA A 39 PHE H 1.0 1.8 3.5 610 515 A 39 PHE H A 38 GLU HBx 1.0 1.8 4.0 611 515 A 38 GLU HBy A 39 PHE H 1.0 1.8 4.0 612 516 A 38 GLU HBy A 39 PHE HBx 1.0 1.8 6.0 613 516 A 39 PHE HBy A 38 GLU HBx 1.0 1.8 6.0 614 516 A 39 PHE HBy A 38 GLU HBy 1.0 1.8 6.0 615 516 A 38 GLU HBx A 39 PHE HBx 1.0 1.8 6.0 616 517 A 38 GLU HGx A 40 SER HA 1.0 1.8 5.4 617 518 A 38 GLU HGx A 76 SER HA 1.0 1.8 5.5 618 519 A 38 GLU HA A 76 SER H 1.0 1.8 4.9 619 520 A 38 GLU H A 77 TYR H 1.0 1.8 5.0 620 521 A 39 PHE H A 39 PHE HBx 1.0 1.8 5.5 621 521 A 39 PHE HBy A 39 PHE H 1.0 1.8 5.5 622 522 A 39 PHE HDy A 39 PHE H 1.0 1.8 5.0 623 523 A 39 PHE HDx A 39 PHE HBx 1.0 1.8 5.5 624 523 A 39 PHE HBy A 39 PHE HDx 1.0 1.8 5.5 625 524 A 39 PHE H A 39 PHE HDx 1.0 1.8 5.0 626 525 A 40 SER H A 39 PHE H 1.0 1.8 4.3 627 526 A 39 PHE H A 40 SER HA 1.0 1.8 4.6 628 527 A 40 SER H A 39 PHE HDy 1.0 1.8 5.2 629 528 A 40 SER H A 39 PHE HDx 1.0 1.8 5.0 630 529 A 39 PHE HEy A 75 VAL HGy% 1.0 1.8 6.5 631 530 A 39 PHE H A 75 VAL H 1.0 1.8 3.5 632 531 A 39 PHE H A 75 VAL HGx% 1.0 1.8 6.2 633 532 A 39 PHE H A 76 SER HBx 1.0 1.8 6.0 634 532 A 76 SER HBy A 39 PHE H 1.0 1.8 6.0 635 533 A 76 SER HA A 39 PHE H 1.0 1.8 3.5 636 534 A 40 SER H A 40 SER HBx 1.0 1.8 5.5 637 534 A 40 SER H A 40 SER HBy 1.0 1.8 5.5 638 535 A 41 ILE H A 40 SER HBx 1.0 1.8 5.5 639 535 A 41 ILE H A 40 SER HBy 1.0 1.8 5.5 640 536 A 41 ILE HA A 40 SER HA 1.0 1.8 5.0 641 537 A 40 SER HA A 41 ILE HB 1.0 1.8 5.4 642 538 A 40 SER HA A 41 ILE HG1y 1.0 1.8 5.0 643 539 A 41 ILE H A 40 SER HA 1.0 1.8 2.9 644 540 A 41 ILE H A 40 SER H 1.0 1.8 5.0 645 541 A 41 ILE HG2% A 40 SER HA 1.0 1.8 6.4 646 542 A 40 SER HBy A 72 SER HBx 1.0 1.8 6.0 647 542 A 40 SER HBx A 72 SER HBx 1.0 1.8 6.0 648 542 A 72 SER HBy A 40 SER HBx 1.0 1.8 6.0 649 542 A 40 SER HBy A 72 SER HBy 1.0 1.8 6.0 650 543 A 74 GLY HAy A 40 SER HBx 1.0 1.8 5.5 651 543 A 40 SER HBy A 74 GLY HAy 1.0 1.8 5.5 652 544 A 40 SER HA A 74 GLY HAx 1.0 1.8 5.0 653 545 A 40 SER HA A 74 GLY H 1.0 1.8 5.0 654 546 A 40 SER HA A 75 VAL H 1.0 1.8 3.9 655 547 A 40 SER H A 75 VAL H 1.0 1.8 5.1 656 548 A 41 ILE H A 41 ILE HB 1.0 1.8 3.5 657 549 A 41 ILE HD1% A 41 ILE H 1.0 1.8 5.3 658 550 A 41 ILE H A 41 ILE HG1y 1.0 1.8 5.0 659 551 A 41 ILE HD1% A 41 ILE HB 1.0 1.8 3.2 660 552 A 42 TRP H A 41 ILE H 1.0 1.8 5.0 661 553 A 41 ILE HA A 42 TRP H 1.0 1.8 3.5 662 554 A 41 ILE HG2% A 42 TRP H 1.0 1.8 4.0 663 555 A 41 ILE H A 42 TRP HBx 1.0 1.8 5.3 664 556 A 41 ILE HG2% A 42 TRP HBx 1.0 1.8 6.1 665 557 A 42 TRP H A 41 ILE HD1% 1.0 1.8 6.3 666 558 A 41 ILE HG2% A 42 TRP HA 1.0 1.8 5.5 667 559 A 41 ILE HG2% A 43 THR H 1.0 1.8 6.1 668 560 A 41 ILE H A 72 SER HA 1.0 1.8 4.8 669 561 A 41 ILE H A 73 CYS HBx 1.0 1.8 5.5 670 561 A 41 ILE H A 73 CYS HBy 1.0 1.8 5.5 671 562 A 41 ILE H A 73 CYS H 1.0 1.8 3.5 672 563 A 41 ILE HB A 73 CYS H 1.0 1.8 5.0 673 564 A 41 ILE HA A 73 CYS H 1.0 1.8 5.0 674 565 A 41 ILE HG2% A 73 CYS H 1.0 1.8 5.5 675 566 A 41 ILE HA A 73 CYS HBx 1.0 1.8 5.9 676 566 A 41 ILE HA A 73 CYS HBy 1.0 1.8 5.9 677 567 A 41 ILE HB A 73 CYS HBx 1.0 1.8 5.5 678 567 A 41 ILE HB A 73 CYS HBy 1.0 1.8 5.5 679 568 A 41 ILE HG2% A 73 CYS HBx 1.0 1.8 4.3 680 568 A 41 ILE HG2% A 73 CYS HBy 1.0 1.8 4.3 681 569 A 41 ILE HD1% A 73 CYS HBx 1.0 1.8 4.8 682 569 A 41 ILE HD1% A 73 CYS HBy 1.0 1.8 4.8 683 570 A 41 ILE H A 74 GLY HAy 1.0 1.8 5.0 684 571 A 41 ILE HB A 74 GLY H 1.0 1.8 5.5 685 572 A 41 ILE H A 74 GLY H 1.0 1.8 5.0 686 573 A 75 VAL H A 41 ILE HB 1.0 1.8 5.5 687 574 A 41 ILE H A 75 VAL H 1.0 1.8 4.2 688 575 A 42 TRP H A 42 TRP HBx 1.0 1.8 5.0 689 576 A 42 TRP H A 42 TRP HBy 1.0 1.8 5.0 690 577 A 42 TRP H A 43 THR H 1.0 1.8 5.0 691 578 A 43 THR H A 42 TRP HBy 1.0 1.8 5.0 692 579 A 42 TRP HA A 43 THR H 1.0 1.8 3.5 693 580 A 42 TRP HBx A 43 THR H 1.0 1.8 5.0 694 581 A 42 TRP HBx A 72 SER HBx 1.0 1.8 5.5 695 581 A 72 SER HBy A 42 TRP HBx 1.0 1.8 5.5 696 582 A 42 TRP HA A 72 SER HA 1.0 1.8 5.0 697 583 A 42 TRP HBx A 72 SER HA 1.0 1.8 5.0 698 584 A 42 TRP HBy A 72 SER H 1.0 1.8 5.0 699 585 A 42 TRP HA A 72 SER H 1.0 1.8 5.3 700 586 A 42 TRP HA A 73 CYS H 1.0 1.8 5.0 701 587 A 42 TRP HBx A 73 CYS H 1.0 1.8 4.9 702 588 A 43 THR H A 43 THR HB 1.0 1.8 5.0 703 589 A 43 THR H A 44 ARG HGx 1.0 1.8 6.4 704 589 A 43 THR H A 44 ARG HGy 1.0 1.8 6.4 705 590 A 43 THR H A 72 SER HA 1.0 1.8 5.0 706 591 A 43 THR H A 73 CYS H 1.0 1.8 5.0 707 592 A 44 ARG HA A 44 ARG HDx 1.0 1.8 5.5 708 592 A 44 ARG HA A 44 ARG HDy 1.0 1.8 5.5 709 593 A 44 ARG HA A 44 ARG HGx 1.0 1.8 3.8 710 593 A 44 ARG HGy A 44 ARG HA 1.0 1.8 3.8 711 594 A 44 ARG HBx A 44 ARG HDx 1.0 1.8 3.7 712 594 A 44 ARG HBy A 44 ARG HDx 1.0 1.8 3.7 713 594 A 44 ARG HDy A 44 ARG HBx 1.0 1.8 3.7 714 594 A 44 ARG HDy A 44 ARG HBy 1.0 1.8 3.7 715 595 A 44 ARG HA A 45 GLU H 1.0 1.8 3.8 716 596 A 45 GLU HA A 44 ARG HBx 1.0 1.8 5.2 717 596 A 45 GLU HA A 44 ARG HBy 1.0 1.8 5.2 718 597 A 45 GLU H A 44 ARG HBx 1.0 1.8 4.7 719 597 A 44 ARG HBy A 45 GLU H 1.0 1.8 4.7 720 598 A 46 ALA H A 44 ARG HA 1.0 1.8 5.8 721 599 A 45 GLU H A 45 GLU HGx 1.0 1.8 4.9 722 599 A 45 GLU HGy A 45 GLU H 1.0 1.8 4.9 723 600 A 45 GLU H A 45 GLU HBx 1.0 1.8 3.4 724 600 A 45 GLU H A 45 GLU HBy 1.0 1.8 3.4 725 601 A 45 GLU HA A 45 GLU HGx 1.0 1.8 3.8 726 601 A 45 GLU HA A 45 GLU HGy 1.0 1.8 3.8 727 602 A 46 ALA HB% A 45 GLU HA 1.0 1.8 5.9 728 603 A 46 ALA HA A 45 GLU H 1.0 1.8 5.5 729 604 A 45 GLU HA A 46 ALA H 1.0 1.8 3.8 730 605 A 46 ALA H A 45 GLU H 1.0 1.8 2.9 731 606 A 46 ALA H A 45 GLU HBx 1.0 1.8 5.5 732 606 A 46 ALA H A 45 GLU HBy 1.0 1.8 5.5 733 607 A 46 ALA HB% A 45 GLU H 1.0 1.8 5.5 734 608 A 46 ALA HA A 45 GLU HA 1.0 1.8 5.0 735 609 A 46 ALA H A 45 GLU HGx 1.0 1.8 5.5 736 609 A 45 GLU HGy A 46 ALA H 1.0 1.8 5.5 737 610 A 45 GLU HA A 47 GLY H 1.0 1.8 5.0 738 611 A 46 ALA HB% A 46 ALA H 1.0 1.8 3.4 739 612 A 46 ALA H A 47 GLY HAy 1.0 1.8 5.0 740 613 A 46 ALA HB% A 47 GLY HAx 1.0 1.8 5.5 741 614 A 46 ALA H A 47 GLY H 1.0 1.8 2.9 742 615 A 46 ALA HB% A 47 GLY H 1.0 1.8 4.0 743 616 A 46 ALA HA A 47 GLY H 1.0 1.8 5.0 744 617 A 46 ALA HA A 47 GLY HAx 1.0 1.8 4.6 745 618 A 46 ALA HB% A 48 ALA H 1.0 1.8 6.5 746 619 A 47 GLY HAy A 48 ALA H 1.0 1.8 2.9 747 620 A 47 GLY H A 48 ALA H 1.0 1.8 5.0 748 621 A 47 GLY HAx A 48 ALA H 1.0 1.8 2.9 749 622 A 47 GLY HAy A 48 ALA HB% 1.0 1.8 5.5 750 623 A 91 PHE HEy A 47 GLY HAy 1.0 1.8 5.3 751 624 A 48 ALA H A 48 ALA HB% 1.0 1.8 3.4 752 625 A 48 ALA HA A 49 GLY H 1.0 1.8 3.5 753 626 A 48 ALA H A 49 GLY H 1.0 1.8 5.0 754 627 A 48 ALA HB% A 49 GLY H 1.0 1.8 4.0 755 628 A 50 GLY H A 49 GLY HAx 1.0 1.8 5.5 756 628 A 49 GLY HAy A 50 GLY H 1.0 1.8 5.5 757 629 A 49 GLY H A 50 GLY H 1.0 1.8 5.0 758 630 A 49 GLY HAy A 91 PHE HBx 1.0 1.8 6.0 759 630 A 49 GLY HAx A 91 PHE HBx 1.0 1.8 6.0 760 630 A 91 PHE HBy A 49 GLY HAx 1.0 1.8 6.0 761 630 A 91 PHE HBy A 49 GLY HAy 1.0 1.8 6.0 762 631 A 50 GLY H A 51 LEU HA 1.0 1.8 5.0 763 632 A 50 GLY H A 91 PHE HBx 1.0 1.8 6.5 764 632 A 91 PHE HBy A 50 GLY H 1.0 1.8 6.5 765 633 A 50 GLY H A 91 PHE HEx 1.0 1.8 5.0 766 634 A 50 GLY H A 92 ASN H 1.0 1.8 5.0 767 635 A 50 GLY H A 92 ASN HA 1.0 1.8 2.9 768 636 A 50 GLY H A 93 ASP H 1.0 1.8 5.0 769 637 A 51 LEU HA A 51 LEU HDx% 1.0 1.8 4.4 770 638 A 51 LEU HA A 51 LEU HG 1.0 1.8 5.0 771 639 A 51 LEU HDx% A 51 LEU HBx 1.0 1.8 6.0 772 639 A 51 LEU HDx% A 51 LEU HBy 1.0 1.8 6.0 773 640 A 51 LEU HA A 52 SER H 1.0 1.8 3.5 774 641 A 51 LEU HDx% A 52 SER H 1.0 1.8 5.5 775 642 A 51 LEU HG A 52 SER H 1.0 1.8 3.5 776 643 A 51 LEU HA A 89 ILE HA 1.0 1.8 5.3 777 644 A 51 LEU HA A 90 LYS HEy 1.0 1.8 5.7 778 645 A 51 LEU HA A 91 PHE HDx 1.0 1.8 5.0 779 646 A 51 LEU HA A 91 PHE HBx 1.0 1.8 5.5 780 646 A 91 PHE HBy A 51 LEU HA 1.0 1.8 5.5 781 647 A 51 LEU HDx% A 91 PHE HBx 1.0 1.8 6.0 782 647 A 91 PHE HBy A 51 LEU HDx% 1.0 1.8 6.0 783 648 A 51 LEU HDx% A 91 PHE HDx 1.0 1.8 5.5 784 649 A 51 LEU HA A 92 ASN H 1.0 1.8 5.0 785 650 A 51 LEU HA A 92 ASN HA 1.0 1.8 5.0 786 651 A 52 SER H A 52 SER HBx 1.0 1.8 4.0 787 651 A 52 SER H A 52 SER HBy 1.0 1.8 4.0 788 652 A 53 ILE HA A 52 SER HBx 1.0 1.8 5.5 789 652 A 52 SER HBy A 53 ILE HA 1.0 1.8 5.5 790 653 A 53 ILE H A 52 SER HBx 1.0 1.8 5.5 791 653 A 52 SER HBy A 53 ILE H 1.0 1.8 5.5 792 654 A 52 SER H A 53 ILE H 1.0 1.8 5.0 793 655 A 53 ILE H A 52 SER HA 1.0 1.8 2.9 794 656 A 52 SER HA A 53 ILE HB 1.0 1.8 5.0 795 657 A 52 SER H A 53 ILE HG1y 1.0 1.8 5.5 796 658 A 52 SER H A 53 ILE HA 1.0 1.8 5.2 797 659 A 52 SER H A 89 ILE HA 1.0 1.8 5.0 798 660 A 52 SER H A 90 LYS H 1.0 1.8 3.5 799 661 A 90 LYS HGx A 52 SER HBx 1.0 1.8 6.1 800 661 A 52 SER HBy A 90 LYS HGx 1.0 1.8 6.1 801 662 A 53 ILE H A 53 ILE HG1x 1.0 1.8 5.0 802 663 A 53 ILE H A 53 ILE HG2% 1.0 1.8 4.5 803 664 A 53 ILE H A 53 ILE HG1y 1.0 1.8 5.0 804 665 A 53 ILE H A 53 ILE HB 1.0 1.8 3.5 805 666 A 53 ILE HA A 53 ILE HG2% 1.0 1.8 3.8 806 667 A 53 ILE HA A 53 ILE HG1x 1.0 1.8 5.0 807 668 A 53 ILE HG1y A 54 ALA H 1.0 1.8 5.0 808 669 A 53 ILE HB A 54 ALA H 1.0 1.8 5.0 809 670 A 53 ILE H A 54 ALA H 1.0 1.8 5.0 810 671 A 53 ILE HG2% A 54 ALA H 1.0 1.8 3.6 811 672 A 53 ILE HA A 54 ALA H 1.0 1.8 2.9 812 673 A 53 ILE HA A 54 ALA HA 1.0 1.8 5.0 813 674 A 53 ILE HA A 54 ALA HB% 1.0 1.8 5.5 814 675 A 53 ILE HB A 87 VAL HGy% 1.0 1.8 5.7 815 676 A 53 ILE HB A 88 SER H 1.0 1.8 5.8 816 677 A 53 ILE HA A 89 ILE HG2% 1.0 1.8 5.5 817 678 A 53 ILE HG1x A 89 ILE HG2% 1.0 1.8 5.8 818 679 A 54 ALA H A 54 ALA HB% 1.0 1.8 3.4 819 680 A 54 ALA H A 55 VAL HGy% 1.0 1.8 5.5 820 681 A 54 ALA H A 55 VAL H 1.0 1.8 4.2 821 682 A 54 ALA HA A 55 VAL H 1.0 1.8 5.0 822 683 A 54 ALA HB% A 55 VAL H 1.0 1.8 4.0 823 684 A 54 ALA HB% A 55 VAL HA 1.0 1.8 5.1 824 685 A 54 ALA HA A 55 VAL HGy% 1.0 1.8 5.5 825 686 A 54 ALA HB% A 56 GLU H 1.0 1.8 6.1 826 687 A 54 ALA HB% A 56 GLU HBx 1.0 1.8 6.0 827 687 A 54 ALA HB% A 56 GLU HBy 1.0 1.8 6.0 828 688 A 54 ALA H A 87 VAL HGy% 1.0 1.8 5.5 829 689 A 54 ALA HB% A 88 SER HBx 1.0 1.8 4.7 830 689 A 54 ALA HB% A 88 SER HBy 1.0 1.8 4.7 831 690 A 54 ALA H A 88 SER HA 1.0 1.8 5.0 832 691 A 54 ALA H A 88 SER HBx 1.0 1.8 5.5 833 691 A 54 ALA H A 88 SER HBy 1.0 1.8 5.5 834 692 A 54 ALA H A 88 SER H 1.0 1.8 3.5 835 693 A 54 ALA HB% A 88 SER H 1.0 1.8 5.5 836 694 A 54 ALA H A 89 ILE HG2% 1.0 1.8 5.1 837 695 A 55 VAL H A 55 VAL HB 1.0 1.8 3.5 838 696 A 55 VAL HGy% A 55 VAL H 1.0 1.8 4.0 839 697 A 55 VAL HA A 55 VAL HGx% 1.0 1.8 5.5 840 698 A 55 VAL HGy% A 55 VAL HA 1.0 1.8 3.8 841 699 A 55 VAL HA A 56 GLU H 1.0 1.8 2.9 842 700 A 56 GLU H A 55 VAL HGx% 1.0 1.8 5.5 843 701 A 55 VAL H A 56 GLU H 1.0 1.8 5.0 844 702 A 55 VAL HGy% A 56 GLU H 1.0 1.8 5.5 845 703 A 55 VAL HB A 57 GLY H 1.0 1.8 5.5 846 704 A 55 VAL HB A 61 ALA H 1.0 1.8 5.0 847 705 A 55 VAL HA A 86 GLU H 1.0 1.8 5.0 848 706 A 87 VAL HGy% A 55 VAL HA 1.0 1.8 4.3 849 707 A 55 VAL HGx% A 87 VAL HGx% 1.0 1.8 4.7 850 708 A 88 SER H A 55 VAL HGy% 1.0 1.8 6.5 851 709 A 88 SER H A 55 VAL HA 1.0 1.8 4.1 852 710 A 56 GLU H A 56 GLU HGx 1.0 1.8 5.0 853 711 A 56 GLU HGx A 56 GLU HA 1.0 1.8 5.0 854 712 A 56 GLU HA A 56 GLU HGy 1.0 1.8 4.0 855 713 A 56 GLU H A 56 GLU HGy 1.0 1.8 5.0 856 714 A 56 GLU H A 56 GLU HBx 1.0 1.8 5.5 857 714 A 56 GLU H A 56 GLU HBy 1.0 1.8 5.5 858 715 A 57 GLY H A 56 GLU HBx 1.0 1.8 5.5 859 715 A 56 GLU HBy A 57 GLY H 1.0 1.8 5.5 860 716 A 56 GLU H A 57 GLY H 1.0 1.8 5.0 861 717 A 56 GLU H A 85 TYR HBx 1.0 1.8 5.0 862 718 A 56 GLU H A 85 TYR HEy 1.0 1.8 5.0 863 719 A 56 GLU H A 85 TYR HA 1.0 1.8 5.0 864 720 A 56 GLU H A 86 GLU HGy 1.0 1.8 3.2 865 721 A 86 GLU H A 56 GLU HGx 1.0 1.8 5.0 866 722 A 56 GLU HGx A 86 GLU HGx 1.0 1.8 3.9 867 723 A 56 GLU H A 86 GLU H 1.0 1.8 2.9 868 724 A 86 GLU H A 56 GLU HA 1.0 1.8 4.7 869 725 A 56 GLU H A 86 GLU HGx 1.0 1.8 5.0 870 726 A 56 GLU H A 87 VAL HA 1.0 1.8 4.0 871 727 A 56 GLU H A 87 VAL HB 1.0 1.8 5.0 872 728 A 88 SER H A 56 GLU H 1.0 1.8 5.8 873 729 A 57 GLY H A 58 PRO HDx 1.0 1.8 5.5 874 729 A 57 GLY H A 58 PRO HDy 1.0 1.8 5.5 875 730 A 57 GLY H A 59 SER H 1.0 1.8 5.0 876 731 A 57 GLY H A 86 GLU HGy 1.0 1.8 5.2 877 732 A 58 PRO HA A 58 PRO HDx 1.0 1.8 5.5 878 732 A 58 PRO HDy A 58 PRO HA 1.0 1.8 5.5 879 733 A 58 PRO HBx A 58 PRO HDx 1.0 1.8 5.5 880 733 A 58 PRO HDy A 58 PRO HBx 1.0 1.8 5.5 881 734 A 58 PRO HBy A 58 PRO HDx 1.0 1.8 5.5 882 734 A 58 PRO HDy A 58 PRO HBy 1.0 1.8 5.5 883 735 A 59 SER H A 58 PRO HA 1.0 1.8 5.0 884 736 A 59 SER H A 58 PRO HDx 1.0 1.8 5.5 885 736 A 58 PRO HDy A 59 SER H 1.0 1.8 5.5 886 737 A 59 SER H A 58 PRO HBy 1.0 1.8 4.2 887 738 A 59 SER H A 58 PRO HBx 1.0 1.8 5.0 888 739 A 81 GLU HA A 58 PRO HBx 1.0 1.8 6.0 889 740 A 81 GLU HA A 58 PRO HGx 1.0 1.8 6.3 890 740 A 81 GLU HA A 58 PRO HGy 1.0 1.8 6.3 891 741 A 83 GLY H A 58 PRO HGx 1.0 1.8 5.5 892 741 A 58 PRO HGy A 83 GLY H 1.0 1.8 5.5 893 742 A 84 ASP HA A 58 PRO HDx 1.0 1.8 6.0 894 742 A 58 PRO HDy A 84 ASP HA 1.0 1.8 6.0 895 743 A 84 ASP H A 58 PRO HDx 1.0 1.8 6.1 896 743 A 58 PRO HDy A 84 ASP H 1.0 1.8 6.1 897 744 A 59 SER H A 59 SER HBx 1.0 1.8 5.5 898 744 A 59 SER H A 59 SER HBy 1.0 1.8 5.5 899 745 A 60 LYS H A 59 SER HBx 1.0 1.8 5.5 900 745 A 59 SER HBy A 60 LYS H 1.0 1.8 5.5 901 746 A 60 LYS HA A 59 SER HBx 1.0 1.8 6.0 902 746 A 59 SER HBy A 60 LYS HA 1.0 1.8 6.0 903 747 A 60 LYS H A 59 SER HA 1.0 1.8 2.9 904 748 A 59 SER H A 60 LYS H 1.0 1.8 6.0 905 749 A 59 SER H A 60 LYS HA 1.0 1.8 5.0 906 750 A 80 GLN HBx A 59 SER HBx 1.0 1.8 3.8 907 750 A 59 SER HBy A 80 GLN HBx 1.0 1.8 3.8 908 751 A 80 GLN H A 59 SER HBx 1.0 1.8 5.5 909 751 A 59 SER HBy A 80 GLN H 1.0 1.8 5.5 910 752 A 81 GLU H A 59 SER HBx 1.0 1.8 5.5 911 752 A 81 GLU H A 59 SER HBy 1.0 1.8 5.5 912 753 A 81 GLU H A 59 SER H 1.0 1.8 5.0 913 754 A 59 SER H A 85 TYR HEx 1.0 1.8 3.8 914 755 A 60 LYS H A 60 LYS HGx 1.0 1.8 5.5 915 755 A 60 LYS H A 60 LYS HGy 1.0 1.8 5.5 916 756 A 60 LYS H A 60 LYS HDx 1.0 1.8 5.1 917 756 A 60 LYS H A 60 LYS HDy 1.0 1.8 5.1 918 757 A 60 LYS H A 60 LYS HBx 1.0 1.8 3.4 919 757 A 60 LYS H A 60 LYS HBy 1.0 1.8 3.4 920 758 A 60 LYS HBy A 60 LYS HEx 1.0 1.8 6.0 921 758 A 60 LYS HBx A 60 LYS HEx 1.0 1.8 6.0 922 758 A 60 LYS HEy A 60 LYS HBx 1.0 1.8 6.0 923 758 A 60 LYS HBy A 60 LYS HEy 1.0 1.8 6.0 924 759 A 60 LYS HA A 60 LYS HDx 1.0 1.8 5.5 925 759 A 60 LYS HA A 60 LYS HDy 1.0 1.8 5.5 926 760 A 60 LYS HEx A 60 LYS HGx 1.0 1.8 6.0 927 760 A 60 LYS HEy A 60 LYS HGx 1.0 1.8 6.0 928 760 A 60 LYS HGy A 60 LYS HEx 1.0 1.8 6.0 929 760 A 60 LYS HGy A 60 LYS HEy 1.0 1.8 6.0 930 761 A 60 LYS HA A 60 LYS HGx 1.0 1.8 5.5 931 761 A 60 LYS HA A 60 LYS HGy 1.0 1.8 5.5 932 762 A 61 ALA H A 60 LYS HA 1.0 1.8 2.9 933 763 A 61 ALA H A 60 LYS HBx 1.0 1.8 5.5 934 763 A 61 ALA H A 60 LYS HBy 1.0 1.8 5.5 935 764 A 61 ALA H A 60 LYS H 1.0 1.8 5.0 936 765 A 60 LYS HA A 61 ALA HB% 1.0 1.8 4.7 937 766 A 60 LYS H A 80 GLN HBx 1.0 1.8 5.4 938 767 A 61 ALA H A 61 ALA HB% 1.0 1.8 4.0 939 768 A 61 ALA HA A 62 GLU H 1.0 1.8 2.9 940 769 A 61 ALA HB% A 62 GLU H 1.0 1.8 4.0 941 770 A 61 ALA H A 62 GLU H 1.0 1.8 5.0 942 771 A 61 ALA HA A 62 GLU HBx 1.0 1.8 5.5 943 771 A 61 ALA HA A 62 GLU HBy 1.0 1.8 5.5 944 772 A 61 ALA HB% A 77 TYR HDx 1.0 1.8 6.1 945 773 A 61 ALA HB% A 78 VAL H 1.0 1.8 5.5 946 774 A 61 ALA HA A 78 VAL H 1.0 1.8 5.0 947 775 A 61 ALA H A 79 VAL HA 1.0 1.8 5.0 948 776 A 61 ALA H A 79 VAL HGx% 1.0 1.8 6.1 949 777 A 61 ALA HA A 79 VAL HGx% 1.0 1.8 6.0 950 778 A 61 ALA HB% A 79 VAL HA 1.0 1.8 5.5 951 779 A 79 VAL HB A 61 ALA HB% 1.0 1.8 6.0 952 780 A 61 ALA HB% A 79 VAL HGx% 1.0 1.8 5.5 953 781 A 62 GLU H A 62 GLU HBx 1.0 1.8 4.0 954 781 A 62 GLU H A 62 GLU HBy 1.0 1.8 4.0 955 782 A 62 GLU H A 62 GLU HGx 1.0 1.8 4.8 956 782 A 62 GLU H A 62 GLU HGy 1.0 1.8 4.8 957 783 A 62 GLU HA A 62 GLU HGx 1.0 1.8 5.5 958 783 A 62 GLU HGy A 62 GLU HA 1.0 1.8 5.5 959 784 A 62 GLU H A 63 ILE H 1.0 1.8 5.0 960 785 A 63 ILE H A 62 GLU HBx 1.0 1.8 5.5 961 785 A 62 GLU HBy A 63 ILE H 1.0 1.8 5.5 962 786 A 62 GLU HA A 63 ILE H 1.0 1.8 2.9 963 787 A 63 ILE H A 62 GLU HGx 1.0 1.8 5.5 964 787 A 62 GLU HGy A 63 ILE H 1.0 1.8 5.5 965 788 A 62 GLU HA A 63 ILE HA 1.0 1.8 4.7 966 789 A 62 GLU H A 77 TYR HBx 1.0 1.8 6.4 967 789 A 77 TYR HBy A 62 GLU H 1.0 1.8 6.4 968 790 A 62 GLU HA A 77 TYR HBx 1.0 1.8 6.0 969 790 A 77 TYR HBy A 62 GLU HA 1.0 1.8 6.0 970 791 A 62 GLU H A 78 VAL H 1.0 1.8 5.0 971 792 A 78 VAL H A 62 GLU HA 1.0 1.8 4.4 972 793 A 78 VAL HB A 62 GLU H 1.0 1.8 5.4 973 794 A 62 GLU H A 78 VAL HA 1.0 1.8 5.9 974 795 A 62 GLU H A 79 VAL HGx% 1.0 1.8 6.0 975 796 A 63 ILE H A 63 ILE HB 1.0 1.8 3.8 976 797 A 63 ILE H A 63 ILE HD1% 1.0 1.8 4.6 977 798 A 63 ILE H A 63 ILE HG1x 1.0 1.8 4.5 978 798 A 63 ILE H A 63 ILE HG1y 1.0 1.8 4.5 979 799 A 63 ILE H A 63 ILE HG2% 1.0 1.8 4.5 980 800 A 63 ILE HA A 63 ILE HG2% 1.0 1.8 3.8 981 801 A 63 ILE HG2% A 64 ALA H 1.0 1.8 5.1 982 802 A 63 ILE HD1% A 64 ALA H 1.0 1.8 5.7 983 803 A 63 ILE H A 64 ALA H 1.0 1.8 4.8 984 804 A 63 ILE HA A 64 ALA HB% 1.0 1.8 4.6 985 805 A 63 ILE HA A 64 ALA H 1.0 1.8 2.9 986 806 A 77 TYR HA A 63 ILE H 1.0 1.8 4.0 987 807 A 63 ILE H A 77 TYR HBx 1.0 1.8 6.0 988 807 A 77 TYR HBy A 63 ILE H 1.0 1.8 6.0 989 808 A 77 TYR HA A 63 ILE HB 1.0 1.8 5.6 990 809 A 78 VAL H A 63 ILE HA 1.0 1.8 4.3 991 810 A 64 ALA H A 64 ALA HB% 1.0 1.8 3.4 992 811 A 64 ALA H A 65 PHE H 1.0 1.8 5.0 993 812 A 64 ALA HA A 65 PHE HA 1.0 1.8 4.6 994 813 A 64 ALA HB% A 65 PHE H 1.0 1.8 4.2 995 814 A 64 ALA HB% A 65 PHE HBx 1.0 1.8 6.0 996 814 A 64 ALA HB% A 65 PHE HBy 1.0 1.8 6.0 997 815 A 65 PHE H A 64 ALA HA 1.0 1.8 5.0 998 816 A 75 VAL HGy% A 64 ALA H 1.0 1.8 6.2 999 817 A 64 ALA H A 75 VAL HA 1.0 1.8 3.5 1000 818 A 64 ALA H A 76 SER HBx 1.0 1.8 6.2 1001 818 A 76 SER HBy A 64 ALA H 1.0 1.8 6.2 1002 819 A 64 ALA HB% A 76 SER HBx 1.0 1.8 5.7 1003 819 A 76 SER HBy A 64 ALA HB% 1.0 1.8 5.7 1004 820 A 76 SER H A 64 ALA H 1.0 1.8 5.0 1005 821 A 76 SER H A 64 ALA HB% 1.0 1.8 5.5 1006 822 A 76 SER H A 64 ALA HA 1.0 1.8 5.0 1007 823 A 77 TYR H A 64 ALA H 1.0 1.8 5.0 1008 824 A 77 TYR HA A 64 ALA HA 1.0 1.8 5.8 1009 825 A 77 TYR HA A 64 ALA HB% 1.0 1.8 6.3 1010 826 A 65 PHE H A 65 PHE HBx 1.0 1.8 4.0 1011 826 A 65 PHE H A 65 PHE HBy 1.0 1.8 4.0 1012 827 A 65 PHE H A 65 PHE HEy 1.0 1.8 5.9 1013 828 A 65 PHE H A 65 PHE HDx 1.0 1.8 5.0 1014 829 A 65 PHE H A 65 PHE HEx 1.0 1.8 5.4 1015 830 A 65 PHE H A 65 PHE HDy 1.0 1.8 5.0 1016 831 A 65 PHE HA A 66 GLU H 1.0 1.8 3.5 1017 832 A 65 PHE H A 66 GLU HA 1.0 1.8 5.6 1018 833 A 65 PHE HDy A 67 ASP H 1.0 1.8 5.0 1019 834 A 74 GLY H A 65 PHE HA 1.0 1.8 5.0 1020 835 A 65 PHE HA A 75 VAL HA 1.0 1.8 5.0 1021 836 A 75 VAL HGx% A 65 PHE H 1.0 1.8 6.2 1022 837 A 65 PHE H A 75 VAL HA 1.0 1.8 4.9 1023 838 A 75 VAL HA A 65 PHE HBx 1.0 1.8 6.2 1024 838 A 65 PHE HBy A 75 VAL HA 1.0 1.8 6.2 1025 839 A 76 SER H A 65 PHE H 1.0 1.8 5.0 1026 840 A 76 SER H A 65 PHE HA 1.0 1.8 5.0 1027 841 A 76 SER H A 65 PHE HBx 1.0 1.8 6.4 1028 841 A 76 SER H A 65 PHE HBy 1.0 1.8 6.4 1029 842 A 66 GLU HA A 66 GLU HGx 1.0 1.8 5.0 1030 843 A 66 GLU H A 66 GLU HGx 1.0 1.8 6.0 1031 844 A 66 GLU H A 66 GLU HGy 1.0 1.8 5.0 1032 845 A 66 GLU H A 66 GLU HBx 1.0 1.8 5.5 1033 845 A 66 GLU H A 66 GLU HBy 1.0 1.8 5.5 1034 846 A 66 GLU HA A 67 ASP H 1.0 1.8 5.0 1035 847 A 66 GLU HA A 67 ASP HBy 1.0 1.8 5.4 1036 848 A 67 ASP H A 66 GLU HBx 1.0 1.8 5.5 1037 848 A 67 ASP H A 66 GLU HBy 1.0 1.8 5.5 1038 849 A 66 GLU HGy A 68 ARG HA 1.0 1.8 4.2 1039 850 A 67 ASP H A 67 ASP HBy 1.0 1.8 5.0 1040 851 A 67 ASP H A 67 ASP HBx 1.0 1.8 6.0 1041 852 A 67 ASP H A 68 ARG H 1.0 1.8 5.0 1042 853 A 68 ARG HA A 67 ASP HBx 1.0 1.8 5.4 1043 854 A 68 ARG H A 67 ASP HA 1.0 1.8 5.0 1044 855 A 67 ASP HBy A 68 ARG H 1.0 1.8 5.0 1045 856 A 74 GLY H A 67 ASP H 1.0 1.8 4.8 1046 857 A 68 ARG H A 68 ARG HBx 1.0 1.8 5.5 1047 857 A 68 ARG H A 68 ARG HBy 1.0 1.8 5.5 1048 858 A 68 ARG H A 69 LYS H 1.0 1.8 5.0 1049 859 A 68 ARG H A 69 LYS HBy 1.0 1.8 5.0 1050 860 A 68 ARG HA A 69 LYS H 1.0 1.8 3.5 1051 861 A 69 LYS HGx A 68 ARG HBx 1.0 1.8 4.5 1052 861 A 68 ARG HBy A 69 LYS HGx 1.0 1.8 4.5 1053 862 A 68 ARG HA A 70 ASP H 1.0 1.8 4.2 1054 863 A 68 ARG H A 71 GLY H 1.0 1.8 5.4 1055 864 A 68 ARG H A 72 SER HBx 1.0 1.8 6.5 1056 864 A 72 SER HBy A 68 ARG H 1.0 1.8 6.5 1057 865 A 68 ARG H A 73 CYS HA 1.0 1.8 5.0 1058 866 A 74 GLY HAx A 68 ARG H 1.0 1.8 5.0 1059 867 A 69 LYS H A 69 LYS HEx 1.0 1.8 6.2 1060 867 A 69 LYS H A 69 LYS HEy 1.0 1.8 6.2 1061 868 A 69 LYS HGx A 69 LYS HA 1.0 1.8 3.7 1062 869 A 69 LYS HA A 69 LYS HDx 1.0 1.8 5.5 1063 869 A 69 LYS HA A 69 LYS HDy 1.0 1.8 5.5 1064 870 A 69 LYS HA A 69 LYS HGy 1.0 1.8 5.0 1065 871 A 69 LYS H A 69 LYS HDx 1.0 1.8 5.5 1066 871 A 69 LYS H A 69 LYS HDy 1.0 1.8 5.5 1067 872 A 69 LYS H A 69 LYS HBx 1.0 1.8 3.8 1068 873 A 69 LYS H A 69 LYS HGx 1.0 1.8 5.0 1069 874 A 69 LYS HBx A 69 LYS HEx 1.0 1.8 5.5 1070 874 A 69 LYS HEy A 69 LYS HBx 1.0 1.8 5.5 1071 875 A 69 LYS HBy A 69 LYS HDx 1.0 1.8 3.8 1072 875 A 69 LYS HBy A 69 LYS HDy 1.0 1.8 3.8 1073 876 A 69 LYS HGy A 69 LYS HEx 1.0 1.8 5.5 1074 876 A 69 LYS HEy A 69 LYS HGy 1.0 1.8 5.5 1075 877 A 69 LYS HGx A 69 LYS HEx 1.0 1.8 5.5 1076 877 A 69 LYS HGx A 69 LYS HEy 1.0 1.8 5.5 1077 878 A 69 LYS H A 70 ASP HBy 1.0 1.8 5.5 1078 879 A 69 LYS H A 70 ASP HBx 1.0 1.8 5.0 1079 880 A 70 ASP H A 69 LYS HA 1.0 1.8 5.0 1080 881 A 71 GLY H A 69 LYS HA 1.0 1.8 5.0 1081 882 A 69 LYS H A 71 GLY H 1.0 1.8 5.0 1082 883 A 69 LYS HBy A 71 GLY HAy 1.0 1.8 5.0 1083 884 A 69 LYS HGy A 72 SER HBx 1.0 1.8 5.5 1084 884 A 72 SER HBy A 69 LYS HGy 1.0 1.8 5.5 1085 885 A 70 ASP H A 70 ASP HBx 1.0 1.8 3.3 1086 886 A 70 ASP H A 71 GLY H 1.0 1.8 3.5 1087 887 A 70 ASP H A 71 GLY HAy 1.0 1.8 5.4 1088 888 A 70 ASP HBy A 71 GLY HAx 1.0 1.8 4.3 1089 889 A 70 ASP HBx A 71 GLY HAx 1.0 1.8 5.6 1090 890 A 72 SER H A 70 ASP HBx 1.0 1.8 5.8 1091 891 A 72 SER H A 70 ASP H 1.0 1.8 5.0 1092 892 A 72 SER H A 71 GLY HAx 1.0 1.8 5.0 1093 893 A 72 SER H A 71 GLY H 1.0 1.8 3.5 1094 894 A 72 SER H A 72 SER HBx 1.0 1.8 6.5 1095 894 A 72 SER HBy A 72 SER H 1.0 1.8 6.5 1096 895 A 73 CYS H A 72 SER H 1.0 1.8 5.0 1097 896 A 72 SER HA A 73 CYS H 1.0 1.8 2.9 1098 897 A 73 CYS H A 72 SER HBx 1.0 1.8 5.5 1099 897 A 72 SER HBy A 73 CYS H 1.0 1.8 5.5 1100 898 A 73 CYS H A 73 CYS HBx 1.0 1.8 4.0 1101 898 A 73 CYS HBy A 73 CYS H 1.0 1.8 4.0 1102 899 A 74 GLY HAy A 73 CYS HA 1.0 1.8 4.5 1103 900 A 74 GLY H A 73 CYS HA 1.0 1.8 5.0 1104 901 A 74 GLY H A 73 CYS HBx 1.0 1.8 5.5 1105 901 A 74 GLY H A 73 CYS HBy 1.0 1.8 5.5 1106 902 A 75 VAL H A 73 CYS HBx 1.0 1.8 6.4 1107 902 A 75 VAL H A 73 CYS HBy 1.0 1.8 6.4 1108 903 A 75 VAL H A 74 GLY H 1.0 1.8 4.4 1109 904 A 75 VAL H A 74 GLY HAx 1.0 1.8 3.3 1110 905 A 75 VAL H A 75 VAL HB 1.0 1.8 3.9 1111 906 A 75 VAL H A 75 VAL HGx% 1.0 1.8 4.5 1112 907 A 75 VAL HGx% A 75 VAL HA 1.0 1.8 5.5 1113 908 A 75 VAL HGy% A 75 VAL HA 1.0 1.8 3.8 1114 909 A 75 VAL HGy% A 75 VAL H 1.0 1.8 5.5 1115 910 A 76 SER HA A 75 VAL HGy% 1.0 1.8 6.4 1116 911 A 76 SER HA A 75 VAL HA 1.0 1.8 5.0 1117 912 A 76 SER H A 75 VAL HGx% 1.0 1.8 4.9 1118 913 A 76 SER H A 75 VAL HB 1.0 1.8 5.0 1119 914 A 76 SER H A 75 VAL HGy% 1.0 1.8 5.0 1120 915 A 76 SER H A 75 VAL HA 1.0 1.8 2.9 1121 916 A 76 SER H A 76 SER HBx 1.0 1.8 5.5 1122 916 A 76 SER HBy A 76 SER H 1.0 1.8 5.5 1123 917 A 77 TYR H A 76 SER HBx 1.0 1.8 5.5 1124 917 A 76 SER HBy A 77 TYR H 1.0 1.8 5.5 1125 918 A 76 SER HA A 77 TYR HBx 1.0 1.8 6.5 1126 918 A 76 SER HA A 77 TYR HBy 1.0 1.8 6.5 1127 919 A 76 SER HA A 77 TYR H 1.0 1.8 3.5 1128 920 A 77 TYR H A 76 SER H 1.0 1.8 5.0 1129 921 A 76 SER H A 77 TYR HBx 1.0 1.8 5.9 1130 921 A 77 TYR HBy A 76 SER H 1.0 1.8 5.9 1131 922 A 77 TYR H A 77 TYR HDy 1.0 1.8 3.5 1132 923 A 77 TYR H A 77 TYR HBx 1.0 1.8 5.5 1133 923 A 77 TYR H A 77 TYR HBy 1.0 1.8 5.5 1134 924 A 77 TYR HDx A 77 TYR HBx 1.0 1.8 6.5 1135 924 A 77 TYR HBy A 77 TYR HDx 1.0 1.8 6.5 1136 925 A 77 TYR H A 78 VAL H 1.0 1.8 5.0 1137 926 A 77 TYR HA A 78 VAL H 1.0 1.8 3.5 1138 927 A 78 VAL H A 77 TYR HBx 1.0 1.8 4.6 1139 927 A 77 TYR HBy A 78 VAL H 1.0 1.8 4.6 1140 928 A 77 TYR HDx A 78 VAL H 1.0 1.8 5.0 1141 929 A 78 VAL HB A 78 VAL H 1.0 1.8 3.5 1142 930 A 78 VAL H A 79 VAL HA 1.0 1.8 4.9 1143 931 A 78 VAL HB A 79 VAL H 1.0 1.8 5.0 1144 932 A 78 VAL HA A 79 VAL H 1.0 1.8 2.9 1145 933 A 78 VAL H A 79 VAL H 1.0 1.8 5.0 1146 934 A 78 VAL H A 79 VAL HGx% 1.0 1.8 5.9 1147 935 A 79 VAL HGy% A 78 VAL HA 1.0 1.8 5.5 1148 936 A 79 VAL HGx% A 78 VAL HA 1.0 1.8 5.5 1149 937 A 79 VAL HGy% A 79 VAL H 1.0 1.8 4.0 1150 938 A 79 VAL HB A 79 VAL H 1.0 1.8 5.0 1151 939 A 79 VAL HGy% A 79 VAL HA 1.0 1.8 5.5 1152 940 A 79 VAL HA A 79 VAL HGx% 1.0 1.8 3.8 1153 941 A 79 VAL HGx% A 79 VAL H 1.0 1.8 4.0 1154 942 A 79 VAL HGy% A 80 GLN HA 1.0 1.8 5.5 1155 943 A 80 GLN H A 79 VAL H 1.0 1.8 5.0 1156 944 A 80 GLN H A 79 VAL HGx% 1.0 1.8 4.2 1157 945 A 80 GLN H A 79 VAL HA 1.0 1.8 2.9 1158 946 A 79 VAL HGy% A 80 GLN H 1.0 1.8 5.5 1159 947 A 81 GLU HA A 79 VAL HB 1.0 1.8 5.0 1160 948 A 81 GLU H A 79 VAL HA 1.0 1.8 5.0 1161 949 A 81 GLU H A 79 VAL HB 1.0 1.8 3.5 1162 950 A 79 VAL HGy% A 81 GLU H 1.0 1.8 5.5 1163 951 A 79 VAL HGy% A 82 PRO HA 1.0 1.8 6.3 1164 952 A 79 VAL HGy% A 85 TYR HEx 1.0 1.8 5.5 1165 953 A 105 VAL HGy% A 79 VAL H 1.0 1.8 5.8 1166 954 A 105 VAL HB A 79 VAL HGy% 1.0 1.8 5.5 1167 955 A 105 VAL HGy% A 79 VAL HGy% 1.0 1.8 3.7 1168 956 A 105 VAL HGx% A 79 VAL HGy% 1.0 1.8 3.7 1169 957 A 80 GLN HA A 80 GLN HGx 1.0 1.8 3.8 1170 957 A 80 GLN HA A 80 GLN HGy 1.0 1.8 3.8 1171 958 A 80 GLN H A 80 GLN HBy 1.0 1.8 2.9 1172 959 A 80 GLN H A 80 GLN HGx 1.0 1.8 4.7 1173 959 A 80 GLN H A 80 GLN HGy 1.0 1.8 4.7 1174 960 A 80 GLN HBx A 80 GLN H 1.0 1.8 3.5 1175 961 A 80 GLN HA A 81 GLU H 1.0 1.8 5.0 1176 962 A 81 GLU H A 80 GLN H 1.0 1.8 3.5 1177 963 A 81 GLU HA A 80 GLN H 1.0 1.8 5.0 1178 964 A 81 GLU HGy A 80 GLN H 1.0 1.8 5.0 1179 965 A 80 GLN HA A 81 GLU HBx 1.0 1.8 5.9 1180 965 A 80 GLN HA A 81 GLU HBy 1.0 1.8 5.9 1181 966 A 81 GLU H A 81 GLU HGy 1.0 1.8 3.5 1182 967 A 81 GLU H A 81 GLU HGx 1.0 1.8 5.0 1183 968 A 81 GLU HA A 81 GLU HGx 1.0 1.8 5.0 1184 969 A 81 GLU HA A 81 GLU HGy 1.0 1.8 5.0 1185 970 A 81 GLU HA A 82 PRO HGy 1.0 1.8 5.0 1186 971 A 81 GLU HA A 82 PRO HDy 1.0 1.8 5.0 1187 972 A 81 GLU HGx A 82 PRO HDy 1.0 1.8 5.4 1188 973 A 82 PRO HDx A 82 PRO HA 1.0 1.8 5.0 1189 974 A 82 PRO HA A 82 PRO HDy 1.0 1.8 5.0 1190 975 A 82 PRO HDx A 82 PRO HBy 1.0 1.8 5.0 1191 976 A 82 PRO HDy A 82 PRO HBx 1.0 1.8 5.0 1192 977 A 82 PRO HGx A 82 PRO HA 1.0 1.8 6.0 1193 978 A 82 PRO HGy A 82 PRO HA 1.0 1.8 5.0 1194 979 A 83 GLY H A 82 PRO HA 1.0 1.8 4.9 1195 980 A 82 PRO HGy A 83 GLY H 1.0 1.8 5.6 1196 981 A 83 GLY H A 82 PRO HDy 1.0 1.8 5.4 1197 982 A 105 VAL H A 82 PRO HA 1.0 1.8 3.5 1198 983 A 105 VAL HGx% A 82 PRO HA 1.0 1.8 5.5 1199 984 A 105 VAL HGx% A 82 PRO HDy 1.0 1.8 5.5 1200 985 A 105 VAL HB A 82 PRO HGx 1.0 1.8 4.9 1201 986 A 105 VAL HGy% A 82 PRO HA 1.0 1.8 5.5 1202 987 A 105 VAL HGx% A 82 PRO HDx 1.0 1.8 5.5 1203 988 A 105 VAL H A 82 PRO HBy 1.0 1.8 5.0 1204 989 A 106 ALA H A 82 PRO HBy 1.0 1.8 5.0 1205 990 A 82 PRO HGx A 106 ALA HA 1.0 1.8 5.0 1206 991 A 107 SER H A 82 PRO HGy 1.0 1.8 3.5 1207 992 A 82 PRO HDx A 107 SER HBx 1.0 1.8 4.3 1208 992 A 107 SER HBy A 82 PRO HDx 1.0 1.8 4.3 1209 993 A 82 PRO HGy A 107 SER HBx 1.0 1.8 3.8 1210 993 A 107 SER HBy A 82 PRO HGy 1.0 1.8 3.8 1211 994 A 107 SER H A 82 PRO HDy 1.0 1.8 3.8 1212 995 A 82 PRO HGy A 108 LEU H 1.0 1.8 5.9 1213 996 A 83 GLY H A 84 ASP H 1.0 1.8 5.0 1214 997 A 83 GLY H A 85 TYR HEx 1.0 1.8 5.7 1215 998 A 83 GLY H A 104 PRO HA 1.0 1.8 5.0 1216 999 A 105 VAL H A 83 GLY H 1.0 1.8 3.5 1217 1000 A 105 VAL HA A 83 GLY H 1.0 1.8 5.5 1218 1001 A 105 VAL HB A 83 GLY H 1.0 1.8 5.0 1219 1002 A 105 VAL HGy% A 83 GLY H 1.0 1.8 5.0 1220 1003 A 105 VAL HGx% A 83 GLY H 1.0 1.8 6.1 1221 1004 A 84 ASP H A 84 ASP HBx 1.0 1.8 3.9 1222 1005 A 84 ASP H A 84 ASP HBy 1.0 1.8 3.8 1223 1006 A 84 ASP HA A 85 TYR HDx 1.0 1.8 6.0 1224 1007 A 84 ASP HA A 85 TYR H 1.0 1.8 2.9 1225 1008 A 84 ASP H A 85 TYR H 1.0 1.8 5.0 1226 1009 A 84 ASP H A 85 TYR HBy 1.0 1.8 5.7 1227 1010 A 84 ASP HBy A 102 VAL HGy% 1.0 1.8 5.5 1228 1011 A 84 ASP HA A 102 VAL HGy% 1.0 1.8 5.0 1229 1012 A 84 ASP HBx A 102 VAL HGy% 1.0 1.8 5.5 1230 1013 A 84 ASP HBx A 103 VAL H 1.0 1.8 5.4 1231 1014 A 84 ASP HBy A 103 VAL H 1.0 1.8 5.9 1232 1015 A 84 ASP HA A 103 VAL H 1.0 1.8 5.0 1233 1016 A 84 ASP HA A 104 PRO HDx 1.0 1.8 5.8 1234 1016 A 84 ASP HA A 104 PRO HDy 1.0 1.8 5.8 1235 1017 A 105 VAL H A 84 ASP HA 1.0 1.8 5.0 1236 1018 A 105 VAL HGy% A 84 ASP HA 1.0 1.8 6.1 1237 1019 A 85 TYR HBx A 85 TYR H 1.0 1.8 5.0 1238 1020 A 85 TYR HDx A 85 TYR H 1.0 1.8 5.0 1239 1021 A 85 TYR HEx A 85 TYR H 1.0 1.8 5.9 1240 1022 A 85 TYR H A 85 TYR HBy 1.0 1.8 5.0 1241 1023 A 86 GLU H A 85 TYR H 1.0 1.8 5.0 1242 1024 A 86 GLU H A 85 TYR HBx 1.0 1.8 5.0 1243 1025 A 86 GLU H A 85 TYR HDy 1.0 1.8 5.0 1244 1026 A 86 GLU H A 85 TYR HEy 1.0 1.8 5.5 1245 1027 A 85 TYR H A 86 GLU HA 1.0 1.8 5.3 1246 1028 A 85 TYR HBx A 87 VAL HB 1.0 1.8 5.0 1247 1029 A 85 TYR H A 103 VAL H 1.0 1.8 5.0 1248 1030 A 85 TYR HBx A 103 VAL H 1.0 1.8 5.0 1249 1031 A 85 TYR HBx A 103 VAL HB 1.0 1.8 5.0 1250 1032 A 85 TYR HBy A 103 VAL HGy% 1.0 1.8 5.5 1251 1033 A 85 TYR H A 104 PRO HDx 1.0 1.8 5.3 1252 1033 A 85 TYR H A 104 PRO HDy 1.0 1.8 5.3 1253 1034 A 105 VAL H A 85 TYR HDx 1.0 1.8 5.0 1254 1035 A 105 VAL H A 85 TYR HEx 1.0 1.8 5.4 1255 1036 A 105 VAL H A 85 TYR H 1.0 1.8 5.0 1256 1037 A 105 VAL HGy% A 85 TYR H 1.0 1.8 5.2 1257 1038 A 105 VAL HB A 85 TYR HEx 1.0 1.8 5.0 1258 1039 A 105 VAL HGy% A 85 TYR HEx 1.0 1.8 5.5 1259 1040 A 105 VAL HGy% A 85 TYR HBx 1.0 1.8 5.5 1260 1041 A 86 GLU HGy A 86 GLU HA 1.0 1.8 3.6 1261 1042 A 86 GLU H A 86 GLU HGx 1.0 1.8 5.0 1262 1043 A 86 GLU H A 86 GLU HGy 1.0 1.8 2.9 1263 1044 A 86 GLU HGx A 86 GLU HA 1.0 1.8 5.0 1264 1045 A 86 GLU H A 86 GLU HBx 1.0 1.8 3.7 1265 1045 A 86 GLU H A 86 GLU HBy 1.0 1.8 3.7 1266 1046 A 86 GLU HA A 87 VAL H 1.0 1.8 2.9 1267 1047 A 86 GLU H A 87 VAL HA 1.0 1.8 5.0 1268 1048 A 87 VAL HGx% A 86 GLU HA 1.0 1.8 5.5 1269 1049 A 86 GLU H A 87 VAL H 1.0 1.8 5.0 1270 1050 A 86 GLU H A 87 VAL HB 1.0 1.8 5.3 1271 1051 A 87 VAL HGx% A 86 GLU HBx 1.0 1.8 6.0 1272 1051 A 87 VAL HGx% A 86 GLU HBy 1.0 1.8 6.0 1273 1052 A 87 VAL HA A 86 GLU HA 1.0 1.8 5.0 1274 1053 A 86 GLU HGx A 87 VAL H 1.0 1.8 5.9 1275 1054 A 86 GLU HGy A 87 VAL H 1.0 1.8 5.2 1276 1055 A 87 VAL HB A 86 GLU HA 1.0 1.8 5.0 1277 1056 A 87 VAL HA A 86 GLU HBx 1.0 1.8 5.5 1278 1056 A 87 VAL HA A 86 GLU HBy 1.0 1.8 5.5 1279 1057 A 100 PRO HBy A 86 GLU HBx 1.0 1.8 6.5 1280 1057 A 86 GLU HBy A 100 PRO HBy 1.0 1.8 6.5 1281 1058 A 86 GLU HA A 101 PHE H 1.0 1.8 4.8 1282 1059 A 86 GLU HA A 102 VAL H 1.0 1.8 5.0 1283 1060 A 86 GLU HA A 102 VAL HA 1.0 1.8 5.0 1284 1061 A 102 VAL HGy% A 86 GLU HA 1.0 1.8 5.5 1285 1062 A 86 GLU H A 102 VAL HA 1.0 1.8 5.0 1286 1063 A 86 GLU HA A 102 VAL HGx% 1.0 1.8 6.3 1287 1064 A 86 GLU HA A 102 VAL HB 1.0 1.8 5.0 1288 1065 A 103 VAL H A 86 GLU HA 1.0 1.8 5.0 1289 1066 A 86 GLU H A 103 VAL H 1.0 1.8 5.0 1290 1067 A 86 GLU H A 103 VAL HB 1.0 1.8 5.0 1291 1068 A 87 VAL HB A 87 VAL H 1.0 1.8 2.9 1292 1069 A 87 VAL HGx% A 87 VAL H 1.0 1.8 4.0 1293 1070 A 87 VAL HGx% A 87 VAL HA 1.0 1.8 5.5 1294 1071 A 87 VAL HGy% A 87 VAL HA 1.0 1.8 3.8 1295 1072 A 87 VAL HGy% A 87 VAL H 1.0 1.8 5.5 1296 1073 A 88 SER H A 87 VAL H 1.0 1.8 5.0 1297 1074 A 87 VAL HA A 88 SER HBx 1.0 1.8 5.5 1298 1074 A 88 SER HBy A 87 VAL HA 1.0 1.8 5.5 1299 1075 A 88 SER H A 87 VAL HA 1.0 1.8 3.5 1300 1076 A 87 VAL HGy% A 88 SER H 1.0 1.8 4.0 1301 1077 A 88 SER H A 87 VAL HB 1.0 1.8 5.0 1302 1078 A 87 VAL HGy% A 88 SER HA 1.0 1.8 5.5 1303 1079 A 87 VAL HGy% A 88 SER HBx 1.0 1.8 6.0 1304 1079 A 87 VAL HGy% A 88 SER HBy 1.0 1.8 6.0 1305 1080 A 88 SER H A 87 VAL HGx% 1.0 1.8 5.5 1306 1081 A 87 VAL HGy% A 89 ILE HB 1.0 1.8 6.0 1307 1082 A 87 VAL H A 101 PHE HDx 1.0 1.8 5.9 1308 1083 A 87 VAL H A 101 PHE HBx 1.0 1.8 6.2 1309 1083 A 87 VAL H A 101 PHE HBy 1.0 1.8 6.2 1310 1084 A 87 VAL H A 101 PHE H 1.0 1.8 5.0 1311 1085 A 87 VAL HGx% A 101 PHE H 1.0 1.8 5.5 1312 1086 A 87 VAL HB A 101 PHE H 1.0 1.8 5.4 1313 1087 A 87 VAL HGy% A 101 PHE H 1.0 1.8 6.0 1314 1088 A 87 VAL HGx% A 101 PHE HBx 1.0 1.8 6.0 1315 1088 A 87 VAL HGx% A 101 PHE HBy 1.0 1.8 6.0 1316 1089 A 87 VAL H A 102 VAL HA 1.0 1.8 5.0 1317 1090 A 87 VAL H A 102 VAL H 1.0 1.8 6.0 1318 1091 A 103 VAL H A 87 VAL H 1.0 1.8 5.0 1319 1092 A 87 VAL HGx% A 103 VAL H 1.0 1.8 6.0 1320 1093 A 87 VAL HGx% A 103 VAL HB 1.0 1.8 5.6 1321 1094 A 103 VAL HGx% A 87 VAL HB 1.0 1.8 6.4 1322 1095 A 88 SER H A 88 SER HBx 1.0 1.8 5.5 1323 1095 A 88 SER H A 88 SER HBy 1.0 1.8 5.5 1324 1096 A 89 ILE H A 88 SER HBx 1.0 1.8 5.5 1325 1096 A 88 SER HBy A 89 ILE H 1.0 1.8 5.5 1326 1097 A 88 SER H A 89 ILE H 1.0 1.8 4.7 1327 1098 A 88 SER HA A 89 ILE H 1.0 1.8 3.5 1328 1099 A 88 SER HA A 89 ILE HB 1.0 1.8 5.7 1329 1100 A 89 ILE HG2% A 88 SER HBx 1.0 1.8 6.0 1330 1100 A 89 ILE HG2% A 88 SER HBy 1.0 1.8 6.0 1331 1101 A 90 LYS H A 88 SER HBx 1.0 1.8 6.5 1332 1101 A 90 LYS H A 88 SER HBy 1.0 1.8 6.5 1333 1102 A 90 LYS HEx A 88 SER HBx 1.0 1.8 5.5 1334 1102 A 88 SER HBy A 90 LYS HEx 1.0 1.8 5.5 1335 1103 A 90 LYS HEy A 88 SER HBx 1.0 1.8 6.2 1336 1103 A 90 LYS HEy A 88 SER HBy 1.0 1.8 6.2 1337 1104 A 88 SER HA A 90 LYS HEx 1.0 1.8 6.0 1338 1105 A 88 SER HA A 99 SER HA 1.0 1.8 5.0 1339 1106 A 88 SER HBy A 100 PRO HDx 1.0 1.8 4.9 1340 1106 A 88 SER HBx A 100 PRO HDx 1.0 1.8 4.9 1341 1106 A 100 PRO HDy A 88 SER HBx 1.0 1.8 4.9 1342 1106 A 88 SER HBy A 100 PRO HDy 1.0 1.8 4.9 1343 1107 A 88 SER HA A 101 PHE H 1.0 1.8 5.0 1344 1108 A 88 SER HA A 101 PHE HDx 1.0 1.8 5.4 1345 1109 A 88 SER H A 101 PHE H 1.0 1.8 5.6 1346 1110 A 89 ILE HB A 89 ILE H 1.0 1.8 5.0 1347 1111 A 89 ILE HG2% A 89 ILE H 1.0 1.8 4.0 1348 1112 A 89 ILE HA A 89 ILE HG1x 1.0 1.8 5.0 1349 1113 A 89 ILE HD1% A 89 ILE HA 1.0 1.8 5.5 1350 1114 A 89 ILE HD1% A 89 ILE H 1.0 1.8 4.9 1351 1115 A 89 ILE H A 89 ILE HG1x 1.0 1.8 5.0 1352 1116 A 89 ILE HA A 89 ILE HG1y 1.0 1.8 5.0 1353 1117 A 89 ILE HA A 89 ILE HG2% 1.0 1.8 5.5 1354 1118 A 89 ILE HD1% A 89 ILE HB 1.0 1.8 3.8 1355 1119 A 90 LYS H A 89 ILE HG1y 1.0 1.8 4.5 1356 1120 A 90 LYS H A 89 ILE H 1.0 1.8 5.0 1357 1121 A 89 ILE HD1% A 90 LYS H 1.0 1.8 5.9 1358 1122 A 89 ILE HA A 90 LYS H 1.0 1.8 3.5 1359 1123 A 89 ILE H A 95 HIS HA 1.0 1.8 5.4 1360 1124 A 96 ILE H A 89 ILE HG1x 1.0 1.8 4.0 1361 1125 A 96 ILE H A 89 ILE HG1y 1.0 1.8 4.1 1362 1126 A 89 ILE H A 99 SER HA 1.0 1.8 5.0 1363 1127 A 101 PHE H A 89 ILE H 1.0 1.8 5.4 1364 1128 A 90 LYS H A 90 LYS HBx 1.0 1.8 3.5 1365 1129 A 90 LYS H A 90 LYS HGy 1.0 1.8 5.0 1366 1130 A 90 LYS H A 90 LYS HBy 1.0 1.8 3.8 1367 1131 A 90 LYS HEy A 90 LYS H 1.0 1.8 3.4 1368 1132 A 90 LYS H A 90 LYS HEx 1.0 1.8 5.0 1369 1133 A 90 LYS H A 90 LYS HGx 1.0 1.8 4.0 1370 1134 A 90 LYS HGx A 90 LYS HA 1.0 1.8 5.0 1371 1135 A 90 LYS HGy A 90 LYS HA 1.0 1.8 6.0 1372 1136 A 90 LYS HGx A 90 LYS HEx 1.0 1.8 5.0 1373 1137 A 90 LYS HEx A 90 LYS HBx 1.0 1.8 5.0 1374 1138 A 90 LYS HEy A 90 LYS HGx 1.0 1.8 3.6 1375 1139 A 90 LYS HEy A 90 LYS HA 1.0 1.8 5.8 1376 1140 A 90 LYS HEy A 90 LYS HGy 1.0 1.8 5.0 1377 1141 A 90 LYS HEy A 90 LYS HBx 1.0 1.8 5.0 1378 1142 A 90 LYS HEx A 90 LYS HGy 1.0 1.8 5.0 1379 1143 A 91 PHE H A 90 LYS HGy 1.0 1.8 5.0 1380 1144 A 91 PHE H A 90 LYS HA 1.0 1.8 2.9 1381 1145 A 91 PHE H A 90 LYS HGx 1.0 1.8 5.2 1382 1146 A 90 LYS HGx A 93 ASP HA 1.0 1.8 3.3 1383 1147 A 90 LYS HBx A 93 ASP HBy 1.0 1.8 5.5 1384 1148 A 90 LYS HBx A 93 ASP HA 1.0 1.8 5.0 1385 1149 A 93 ASP H A 90 LYS HEy 1.0 1.8 5.3 1386 1150 A 93 ASP H A 90 LYS H 1.0 1.8 4.9 1387 1151 A 93 ASP H A 90 LYS HBy 1.0 1.8 5.0 1388 1152 A 93 ASP H A 90 LYS HBx 1.0 1.8 5.6 1389 1153 A 94 GLU H A 90 LYS HGy 1.0 1.8 5.0 1390 1154 A 94 GLU H A 90 LYS HBx 1.0 1.8 5.0 1391 1155 A 94 GLU H A 90 LYS HA 1.0 1.8 5.0 1392 1156 A 94 GLU H A 90 LYS HBy 1.0 1.8 3.5 1393 1157 A 94 GLU H A 90 LYS H 1.0 1.8 5.4 1394 1158 A 94 GLU H A 90 LYS HGx 1.0 1.8 4.3 1395 1159 A 95 HIS HA A 90 LYS HBx 1.0 1.8 3.3 1396 1160 A 95 HIS HA A 90 LYS HA 1.0 1.8 5.0 1397 1161 A 95 HIS HA A 90 LYS HDx 1.0 1.8 6.3 1398 1161 A 95 HIS HA A 90 LYS HDy 1.0 1.8 6.3 1399 1162 A 90 LYS H A 95 HIS HA 1.0 1.8 4.9 1400 1163 A 95 HIS H A 90 LYS HA 1.0 1.8 4.5 1401 1164 A 96 ILE H A 90 LYS HA 1.0 1.8 5.0 1402 1165 A 96 ILE H A 90 LYS H 1.0 1.8 5.7 1403 1166 A 96 ILE H A 90 LYS HBx 1.0 1.8 4.4 1404 1167 A 91 PHE H A 91 PHE HBx 1.0 1.8 5.5 1405 1167 A 91 PHE HBy A 91 PHE H 1.0 1.8 5.5 1406 1168 A 91 PHE H A 91 PHE HDx 1.0 1.8 5.0 1407 1169 A 92 ASN H A 91 PHE HA 1.0 1.8 2.9 1408 1170 A 92 ASN HA A 91 PHE HA 1.0 1.8 5.0 1409 1171 A 92 ASN HA A 91 PHE HBx 1.0 1.8 6.3 1410 1171 A 91 PHE HBy A 92 ASN HA 1.0 1.8 6.3 1411 1172 A 91 PHE H A 92 ASN H 1.0 1.8 4.7 1412 1173 A 93 ASP H A 91 PHE HA 1.0 1.8 5.0 1413 1174 A 91 PHE H A 93 ASP H 1.0 1.8 5.0 1414 1175 A 91 PHE H A 94 GLU H 1.0 1.8 3.5 1415 1176 A 91 PHE H A 94 GLU HGy 1.0 1.8 5.0 1416 1177 A 91 PHE H A 94 GLU HBx 1.0 1.8 5.5 1417 1177 A 94 GLU HBy A 91 PHE H 1.0 1.8 5.5 1418 1178 A 94 GLU H A 91 PHE HA 1.0 1.8 5.0 1419 1179 A 91 PHE H A 95 HIS HA 1.0 1.8 5.0 1420 1180 A 91 PHE H A 96 ILE H 1.0 1.8 5.0 1421 1181 A 92 ASN H A 92 ASN HBx 1.0 1.8 5.5 1422 1181 A 92 ASN H A 92 ASN HBy 1.0 1.8 5.5 1423 1182 A 92 ASN H A 93 ASP H 1.0 1.8 3.5 1424 1183 A 92 ASN H A 93 ASP HA 1.0 1.8 5.0 1425 1184 A 92 ASN HA A 93 ASP HA 1.0 1.8 5.0 1426 1185 A 93 ASP HBx A 92 ASN HBx 1.0 1.8 5.9 1427 1185 A 92 ASN HBy A 93 ASP HBx 1.0 1.8 5.9 1428 1186 A 92 ASN HA A 93 ASP H 1.0 1.8 3.5 1429 1187 A 94 GLU H A 92 ASN HA 1.0 1.8 5.0 1430 1188 A 94 GLU H A 92 ASN HBx 1.0 1.8 5.5 1431 1188 A 94 GLU H A 92 ASN HBy 1.0 1.8 5.5 1432 1189 A 94 GLU H A 92 ASN H 1.0 1.8 5.0 1433 1190 A 93 ASP H A 93 ASP HBy 1.0 1.8 5.0 1434 1191 A 93 ASP H A 93 ASP HBx 1.0 1.8 5.0 1435 1192 A 94 GLU H A 93 ASP HA 1.0 1.8 5.0 1436 1193 A 94 GLU H A 93 ASP H 1.0 1.8 3.5 1437 1194 A 94 GLU H A 93 ASP HBx 1.0 1.8 5.0 1438 1195 A 94 GLU H A 93 ASP HBy 1.0 1.8 5.0 1439 1196 A 94 GLU HA A 93 ASP HBy 1.0 1.8 5.0 1440 1197 A 93 ASP H A 94 GLU HBx 1.0 1.8 5.9 1441 1197 A 94 GLU HBy A 93 ASP H 1.0 1.8 5.9 1442 1198 A 94 GLU H A 94 GLU HBx 1.0 1.8 3.4 1443 1198 A 94 GLU HBy A 94 GLU H 1.0 1.8 3.4 1444 1199 A 94 GLU HGy A 94 GLU H 1.0 1.8 3.5 1445 1200 A 94 GLU HGy A 94 GLU HA 1.0 1.8 5.0 1446 1201 A 94 GLU HGy A 95 HIS H 1.0 1.8 5.0 1447 1202 A 94 GLU H A 95 HIS H 1.0 1.8 5.0 1448 1203 A 94 GLU HA A 95 HIS H 1.0 1.8 2.9 1449 1204 A 95 HIS H A 94 GLU HBx 1.0 1.8 4.5 1450 1204 A 94 GLU HBy A 95 HIS H 1.0 1.8 4.5 1451 1205 A 94 GLU H A 95 HIS HA 1.0 1.8 5.0 1452 1206 A 94 GLU HA A 96 ILE H 1.0 1.8 5.6 1453 1207 A 95 HIS H A 95 HIS HBx 1.0 1.8 4.0 1454 1207 A 95 HIS H A 95 HIS HBy 1.0 1.8 4.0 1455 1208 A 96 ILE H A 95 HIS HA 1.0 1.8 5.0 1456 1209 A 95 HIS H A 96 ILE H 1.0 1.8 5.0 1457 1210 A 96 ILE H A 95 HIS HBx 1.0 1.8 5.5 1458 1210 A 96 ILE H A 95 HIS HBy 1.0 1.8 5.5 1459 1211 A 95 HIS HBx A 99 SER HBx 1.0 1.8 7.0 1460 1211 A 95 HIS HBy A 99 SER HBx 1.0 1.8 7.0 1461 1211 A 99 SER HBy A 95 HIS HBx 1.0 1.8 7.0 1462 1211 A 95 HIS HBy A 99 SER HBy 1.0 1.8 7.0 1463 1212 A 99 SER H A 95 HIS HBx 1.0 1.8 6.3 1464 1212 A 95 HIS HBy A 99 SER H 1.0 1.8 6.3 1465 1213 A 96 ILE H A 98 ASP HBx 1.0 1.8 5.9 1466 1214 A 96 ILE H A 99 SER H 1.0 1.8 5.8 1467 1215 A 98 ASP HBy A 98 ASP H 1.0 1.8 5.0 1468 1216 A 99 SER H A 98 ASP H 1.0 1.8 3.5 1469 1217 A 99 SER H A 98 ASP HBx 1.0 1.8 5.0 1470 1218 A 99 SER H A 98 ASP HBy 1.0 1.8 4.3 1471 1219 A 98 ASP HA A 101 PHE HEx 1.0 1.8 5.0 1472 1220 A 101 PHE H A 98 ASP HA 1.0 1.8 5.5 1473 1221 A 101 PHE H A 98 ASP HBy 1.0 1.8 5.3 1474 1222 A 98 ASP HBy A 101 PHE HEy 1.0 1.8 5.6 1475 1223 A 99 SER H A 99 SER HBx 1.0 1.8 4.0 1476 1223 A 99 SER HBy A 99 SER H 1.0 1.8 4.0 1477 1224 A 99 SER HA A 100 PRO HBx 1.0 1.8 5.9 1478 1225 A 101 PHE H A 99 SER HA 1.0 1.8 5.5 1479 1226 A 100 PRO HBy A 100 PRO HDx 1.0 1.8 5.5 1480 1226 A 100 PRO HBy A 100 PRO HDy 1.0 1.8 5.5 1481 1227 A 100 PRO HA A 100 PRO HDx 1.0 1.8 5.5 1482 1227 A 100 PRO HDy A 100 PRO HA 1.0 1.8 5.5 1483 1228 A 101 PHE H A 100 PRO HA 1.0 1.8 5.0 1484 1229 A 101 PHE H A 100 PRO HBx 1.0 1.8 5.0 1485 1230 A 101 PHE H A 101 PHE HBx 1.0 1.8 5.5 1486 1230 A 101 PHE H A 101 PHE HBy 1.0 1.8 5.5 1487 1231 A 101 PHE H A 101 PHE HDx 1.0 1.8 3.8 1488 1232 A 101 PHE H A 102 VAL H 1.0 1.8 5.0 1489 1233 A 102 VAL H A 101 PHE HBx 1.0 1.8 4.0 1490 1233 A 102 VAL H A 101 PHE HBy 1.0 1.8 4.0 1491 1234 A 102 VAL H A 101 PHE HA 1.0 1.8 2.9 1492 1235 A 102 VAL H A 101 PHE HDy 1.0 1.8 5.0 1493 1236 A 102 VAL HB A 101 PHE HBx 1.0 1.8 6.4 1494 1236 A 102 VAL HB A 101 PHE HBy 1.0 1.8 6.4 1495 1237 A 102 VAL HGx% A 101 PHE HA 1.0 1.8 4.5 1496 1238 A 102 VAL H A 102 VAL HGx% 1.0 1.8 3.4 1497 1239 A 102 VAL H A 102 VAL HB 1.0 1.8 2.9 1498 1240 A 102 VAL HGy% A 102 VAL HA 1.0 1.8 3.8 1499 1241 A 102 VAL HA A 102 VAL HGx% 1.0 1.8 3.7 1500 1242 A 103 VAL H A 102 VAL H 1.0 1.8 5.0 1501 1243 A 102 VAL HGy% A 103 VAL H 1.0 1.8 4.0 1502 1244 A 103 VAL H A 102 VAL HA 1.0 1.8 2.9 1503 1245 A 103 VAL HGy% A 102 VAL HA 1.0 1.8 4.3 1504 1246 A 102 VAL H A 103 VAL HA 1.0 1.8 5.3 1505 1247 A 102 VAL H A 104 PRO HDx 1.0 1.8 5.9 1506 1247 A 104 PRO HDy A 102 VAL H 1.0 1.8 5.9 1507 1248 A 102 VAL HGy% A 104 PRO HDx 1.0 1.8 6.0 1508 1248 A 102 VAL HGy% A 104 PRO HDy 1.0 1.8 6.0 1509 1249 A 102 VAL HGx% A 104 PRO HDx 1.0 1.8 4.3 1510 1249 A 104 PRO HDy A 102 VAL HGx% 1.0 1.8 4.3 1511 1250 A 103 VAL H A 103 VAL HB 1.0 1.8 2.9 1512 1251 A 103 VAL H A 103 VAL HGy% 1.0 1.8 5.5 1513 1252 A 103 VAL HGy% A 103 VAL HA 1.0 1.8 3.2 1514 1253 A 103 VAL H A 104 PRO HDx 1.0 1.8 5.5 1515 1253 A 103 VAL H A 104 PRO HDy 1.0 1.8 5.5 1516 1254 A 103 VAL HA A 104 PRO HDx 1.0 1.8 3.2 1517 1254 A 104 PRO HDy A 103 VAL HA 1.0 1.8 3.2 1518 1255 A 103 VAL HB A 104 PRO HDx 1.0 1.8 5.5 1519 1255 A 104 PRO HDy A 103 VAL HB 1.0 1.8 5.5 1520 1256 A 105 VAL H A 103 VAL HB 1.0 1.8 5.5 1521 1257 A 103 VAL HGx% A 105 VAL HB 1.0 1.8 6.3 1522 1258 A 105 VAL H A 104 PRO HA 1.0 1.8 5.0 1523 1259 A 105 VAL HGy% A 104 PRO HA 1.0 1.8 5.5 1524 1260 A 105 VAL HGy% A 105 VAL H 1.0 1.8 3.4 1525 1261 A 105 VAL HB A 105 VAL H 1.0 1.8 2.9 1526 1262 A 105 VAL HGx% A 105 VAL HA 1.0 1.8 3.2 1527 1263 A 105 VAL HGy% A 105 VAL HA 1.0 1.8 3.8 1528 1264 A 105 VAL HB A 106 ALA H 1.0 1.8 5.0 1529 1265 A 105 VAL HGx% A 106 ALA H 1.0 1.8 4.0 1530 1266 A 105 VAL H A 106 ALA H 1.0 1.8 5.0 1531 1267 A 105 VAL H A 106 ALA HB% 1.0 1.8 6.4 1532 1268 A 105 VAL HGx% A 106 ALA HB% 1.0 1.8 4.9 1533 1269 A 105 VAL HA A 106 ALA H 1.0 1.8 2.9 1534 1270 A 105 VAL HGy% A 106 ALA H 1.0 1.8 5.1 1535 1271 A 105 VAL HA A 106 ALA HB% 1.0 1.8 4.8 1536 1272 A 105 VAL HGx% A 107 SER H 1.0 1.8 5.9 1537 1273 A 106 ALA H A 106 ALA HB% 1.0 1.8 3.4 1538 1274 A 106 ALA H A 107 SER H 1.0 1.8 5.0 1539 1275 A 106 ALA HA A 107 SER HBx 1.0 1.8 5.5 1540 1275 A 107 SER HBy A 106 ALA HA 1.0 1.8 5.5 1541 1276 A 107 SER H A 106 ALA HA 1.0 1.8 2.9 1542 1277 A 106 ALA HB% A 107 SER H 1.0 1.8 4.1 1543 1278 A 106 ALA HB% A 107 SER HBx 1.0 1.8 6.0 1544 1278 A 106 ALA HB% A 107 SER HBy 1.0 1.8 6.0 1545 1279 A 106 ALA HB% A 107 SER HA 1.0 1.8 4.9 1546 1280 A 106 ALA HB% A 108 LEU HA 1.0 1.8 6.1 1547 1281 A 106 ALA HA A 108 LEU H 1.0 1.8 5.7 1548 1282 A 106 ALA HA A 109 SER H 1.0 1.8 4.4 1549 1283 A 106 ALA HB% A 109 SER HBx 1.0 1.8 6.0 1550 1283 A 106 ALA HB% A 109 SER HBy 1.0 1.8 6.0 1551 1284 A 106 ALA HA A 110 ASP H 1.0 1.8 3.9 1552 1285 A 106 ALA HB% A 110 ASP H 1.0 1.8 4.1 1553 1286 A 106 ALA HB% A 110 ASP HBx 1.0 1.8 6.0 1554 1286 A 106 ALA HB% A 110 ASP HBy 1.0 1.8 6.0 1555 1287 A 106 ALA HB% A 111 ASP H 1.0 1.8 5.5 1556 1288 A 106 ALA HB% A 111 ASP HBx 1.0 1.8 5.0 1557 1288 A 106 ALA HB% A 111 ASP HBy 1.0 1.8 5.0 1558 1289 A 106 ALA HB% A 111 ASP HA 1.0 1.8 4.6 1559 1290 A 106 ALA HA A 112 ALA H 1.0 1.8 4.1 1560 1291 A 106 ALA HB% A 112 ALA HB% 1.0 1.8 3.7 1561 1292 A 107 SER H A 107 SER HBx 1.0 1.8 3.4 1562 1292 A 107 SER HBy A 107 SER H 1.0 1.8 3.4 1563 1293 A 108 LEU H A 107 SER HBx 1.0 1.8 4.6 1564 1293 A 107 SER HBy A 108 LEU H 1.0 1.8 4.6 1565 1294 A 107 SER HA A 108 LEU H 1.0 1.8 2.9 1566 1295 A 107 SER HA A 108 LEU HBx 1.0 1.8 5.5 1567 1295 A 107 SER HA A 108 LEU HBy 1.0 1.8 5.5 1568 1296 A 107 SER H A 108 LEU H 1.0 1.8 4.3 1569 1297 A 107 SER HA A 109 SER H 1.0 1.8 5.0 1570 1298 A 109 SER H A 107 SER HBx 1.0 1.8 5.8 1571 1298 A 107 SER HBy A 109 SER H 1.0 1.8 5.8 1572 1299 A 108 LEU H A 108 LEU HBx 1.0 1.8 3.9 1573 1299 A 108 LEU H A 108 LEU HBy 1.0 1.8 3.9 1574 1300 A 108 LEU H A 108 LEU HG 1.0 1.8 5.0 1575 1301 A 108 LEU H A 108 LEU HDy% 1.0 1.8 5.5 1576 1302 A 108 LEU H A 108 LEU HDx% 1.0 1.8 4.7 1577 1303 A 108 LEU HA A 108 LEU HDy% 1.0 1.8 4.3 1578 1304 A 108 LEU HA A 108 LEU HDx% 1.0 1.8 4.5 1579 1305 A 108 LEU HDx% A 108 LEU HBx 1.0 1.8 3.7 1580 1305 A 108 LEU HBy A 108 LEU HDx% 1.0 1.8 3.7 1581 1306 A 108 LEU H A 109 SER H 1.0 1.8 5.0 1582 1307 A 108 LEU HA A 109 SER H 1.0 1.8 3.5 1583 1308 A 109 SER H A 108 LEU HBx 1.0 1.8 4.6 1584 1308 A 109 SER H A 108 LEU HBy 1.0 1.8 4.6 1585 1309 A 108 LEU HBx A 109 SER HBx 1.0 1.8 6.0 1586 1309 A 108 LEU HBy A 109 SER HBx 1.0 1.8 6.0 1587 1309 A 109 SER HBy A 108 LEU HBx 1.0 1.8 6.0 1588 1309 A 109 SER HBy A 108 LEU HBy 1.0 1.8 6.0 1589 1310 A 109 SER HA A 108 LEU HBx 1.0 1.8 6.1 1590 1310 A 108 LEU HBy A 109 SER HA 1.0 1.8 6.1 1591 1311 A 108 LEU H A 109 SER HBx 1.0 1.8 6.4 1592 1311 A 108 LEU H A 109 SER HBy 1.0 1.8 6.4 1593 1312 A 109 SER H A 108 LEU HDy% 1.0 1.8 6.2 1594 1313 A 110 ASP H A 108 LEU HBx 1.0 1.8 5.9 1595 1313 A 110 ASP H A 108 LEU HBy 1.0 1.8 5.9 1596 1314 A 108 LEU HA A 110 ASP H 1.0 1.8 4.9 1597 1315 A 109 SER H A 109 SER HBx 1.0 1.8 4.0 1598 1315 A 109 SER H A 109 SER HBy 1.0 1.8 4.0 1599 1316 A 109 SER HBy A 110 ASP HBx 1.0 1.8 6.0 1600 1316 A 109 SER HBx A 110 ASP HBx 1.0 1.8 6.0 1601 1316 A 110 ASP HBy A 109 SER HBx 1.0 1.8 6.0 1602 1316 A 109 SER HBy A 110 ASP HBy 1.0 1.8 6.0 1603 1317 A 110 ASP H A 109 SER HA 1.0 1.8 3.5 1604 1318 A 110 ASP H A 109 SER HBx 1.0 1.8 5.5 1605 1318 A 109 SER HBy A 110 ASP H 1.0 1.8 5.5 1606 1319 A 109 SER H A 110 ASP H 1.0 1.8 2.9 1607 1320 A 109 SER H A 111 ASP H 1.0 1.8 4.2 1608 1321 A 112 ALA H A 109 SER HA 1.0 1.8 3.4 1609 1322 A 109 SER H A 112 ALA HB% 1.0 1.8 5.5 1610 1323 A 112 ALA HB% A 109 SER HA 1.0 1.8 5.5 1611 1324 A 112 ALA H A 109 SER HBx 1.0 1.8 5.5 1612 1324 A 109 SER HBy A 112 ALA H 1.0 1.8 5.5 1613 1325 A 110 ASP H A 110 ASP HBx 1.0 1.8 3.4 1614 1325 A 110 ASP H A 110 ASP HBy 1.0 1.8 3.4 1615 1326 A 110 ASP H A 111 ASP H 1.0 1.8 2.9 1616 1327 A 111 ASP H A 110 ASP HA 1.0 1.8 3.3 1617 1328 A 111 ASP H A 110 ASP HBx 1.0 1.8 4.2 1618 1328 A 110 ASP HBy A 111 ASP H 1.0 1.8 4.2 1619 1329 A 110 ASP H A 112 ALA H 1.0 1.8 5.0 1620 1330 A 110 ASP H A 112 ALA HB% 1.0 1.8 5.5 1621 1331 A 112 ALA H A 110 ASP HBx 1.0 1.8 5.5 1622 1331 A 110 ASP HBy A 112 ALA H 1.0 1.8 5.5 1623 1332 A 111 ASP H A 111 ASP HBx 1.0 1.8 3.8 1624 1332 A 111 ASP H A 111 ASP HBy 1.0 1.8 3.8 1625 1333 A 112 ALA H A 111 ASP HBx 1.0 1.8 4.0 1626 1333 A 111 ASP HBy A 112 ALA H 1.0 1.8 4.0 1627 1334 A 111 ASP H A 112 ALA HB% 1.0 1.8 5.5 1628 1335 A 111 ASP H A 112 ALA H 1.0 1.8 3.5 1629 1336 A 112 ALA HA A 111 ASP HBx 1.0 1.8 5.5 1630 1336 A 111 ASP HBy A 112 ALA HA 1.0 1.8 5.5 1631 1337 A 112 ALA H A 112 ALA HB% 1.0 1.8 3.4 1632 1338 A 112 ALA HA A 113 ARG H 1.0 1.8 2.9 1633 1339 A 112 ALA HB% A 113 ARG H 1.0 1.8 4.0 1634 1340 A 112 ALA HA A 113 ARG HBy 1.0 1.8 5.8 1635 1341 A 113 ARG HA A 113 ARG HGx 1.0 1.8 5.5 1636 1341 A 113 ARG HA A 113 ARG HGy 1.0 1.8 5.5 1637 1342 A 113 ARG H A 113 ARG HBy 1.0 1.8 3.5 1638 1343 A 113 ARG H A 114 ARG H 1.0 1.8 6.0 1639 1344 A 113 ARG HA A 114 ARG HBy 1.0 1.8 5.0 1640 1345 A 113 ARG HA A 114 ARG H 1.0 1.8 5.0 1641 1346 A 115 LEU HDy% A 113 ARG HGx 1.0 1.8 6.0 1642 1346 A 113 ARG HGy A 115 LEU HDy% 1.0 1.8 6.0 1643 1347 A 113 ARG HBy A 116 THR H 1.0 1.8 3.5 1644 1348 A 116 THR H A 113 ARG HBx 1.0 1.8 3.5 1645 1349 A 114 ARG HA A 114 ARG HGx 1.0 1.8 5.5 1646 1349 A 114 ARG HA A 114 ARG HGy 1.0 1.8 5.5 1647 1350 A 114 ARG H A 114 ARG HBx 1.0 1.8 2.9 1648 1351 A 114 ARG H A 114 ARG HDx 1.0 1.8 5.5 1649 1351 A 114 ARG H A 114 ARG HDy 1.0 1.8 5.5 1650 1352 A 114 ARG HBx A 115 LEU HA 1.0 1.8 5.0 1651 1353 A 114 ARG HBx A 115 LEU H 1.0 1.8 3.5 1652 1354 A 114 ARG HA A 119 SER HA 1.0 1.8 3.6 1653 1355 A 114 ARG HA A 119 SER HBy 1.0 1.8 5.0 1654 1356 A 115 LEU HDy% A 115 LEU HA 1.0 1.8 3.2 1655 1357 A 115 LEU H A 115 LEU HDx% 1.0 1.8 5.5 1656 1358 A 115 LEU H A 115 LEU HG 1.0 1.8 3.4 1657 1359 A 115 LEU H A 115 LEU HBx 1.0 1.8 3.9 1658 1359 A 115 LEU H A 115 LEU HBy 1.0 1.8 3.9 1659 1360 A 115 LEU HDy% A 115 LEU HBx 1.0 1.8 3.7 1660 1360 A 115 LEU HDy% A 115 LEU HBy 1.0 1.8 3.7 1661 1361 A 115 LEU HA A 115 LEU HDx% 1.0 1.8 4.3 1662 1362 A 115 LEU HDy% A 115 LEU H 1.0 1.8 5.5 1663 1363 A 115 LEU HDx% A 115 LEU HBx 1.0 1.8 3.7 1664 1363 A 115 LEU HDx% A 115 LEU HBy 1.0 1.8 3.7 1665 1364 A 115 LEU HA A 115 LEU HG 1.0 1.8 5.0 1666 1365 A 115 LEU HA A 116 THR HA 1.0 1.8 6.0 1667 1366 A 116 THR H A 115 LEU HA 1.0 1.8 3.5 1668 1367 A 116 THR H A 115 LEU H 1.0 1.8 6.0 1669 1368 A 116 THR H A 115 LEU HBx 1.0 1.8 5.5 1670 1368 A 116 THR H A 115 LEU HBy 1.0 1.8 5.5 1671 1369 A 116 THR H A 115 LEU HDx% 1.0 1.8 6.5 1672 1370 A 116 THR H A 115 LEU HG 1.0 1.8 5.0 1673 1371 A 117 VAL H A 115 LEU HBx 1.0 1.8 5.8 1674 1371 A 115 LEU HBy A 117 VAL H 1.0 1.8 5.8 1675 1372 A 115 LEU H A 117 VAL HB 1.0 1.8 5.0 1676 1373 A 115 LEU H A 118 THR HA 1.0 1.8 3.3 1677 1374 A 116 THR H A 116 THR HB 1.0 1.8 3.5 1678 1375 A 116 THR HB A 117 VAL HGy% 1.0 1.8 4.4 1679 1376 A 117 VAL H A 116 THR HB 1.0 1.8 3.5 1680 1377 A 116 THR HA A 117 VAL H 1.0 1.8 3.5 1681 1378 A 116 THR H A 117 VAL HGy% 1.0 1.8 6.5 1682 1379 A 116 THR HA A 117 VAL HB 1.0 1.8 5.7 1683 1380 A 116 THR H A 118 THR HB 1.0 1.8 4.3 1684 1381 A 117 VAL HGy% A 117 VAL HA 1.0 1.8 5.5 1685 1382 A 117 VAL H A 117 VAL HB 1.0 1.8 5.0 1686 1383 A 117 VAL H A 117 VAL HGy% 1.0 1.8 5.5 1687 1384 A 117 VAL H A 118 THR HG2% 1.0 1.8 6.3 1688 1385 A 117 VAL HA A 118 THR H 1.0 1.8 5.0 1689 1386 A 117 VAL HGy% A 118 THR H 1.0 1.8 5.5 1690 1387 A 119 SER HA A 117 VAL HB 1.0 1.8 5.0 1691 1388 A 118 THR HB A 118 THR H 1.0 1.8 3.5 1692 1389 A 118 THR HA A 118 THR HG2% 1.0 1.8 3.8 1693 1390 A 119 SER HBy A 118 THR HA 1.0 1.8 3.9 1694 1391 A 119 SER HBy A 118 THR H 1.0 1.8 5.7 1695 1392 A 118 THR HA A 119 SER H 1.0 1.8 5.0 1696 1393 A 119 SER HBy A 118 THR HG2% 1.0 1.8 6.4 1697 1394 A 48 ALA HA B 17 LEU HBx 1.0 1.8 6.0 1698 1394 A 48 ALA HA B 17 LEU HBy 1.0 1.8 6.0 1699 1395 A 48 ALA HA B 17 LEU HA 1.0 1.8 6.0 1700 1396 A 48 ALA HA B 17 LEU HG 1.0 1.8 6.0 1701 1397 A 48 ALA HA B 17 LEU HDy% 1.0 1.8 6.3 1702 1398 A 48 ALA HA B 17 LEU HDx% 1.0 1.8 6.0 1703 1399 A 48 ALA HB% B 17 LEU HDx% 1.0 1.8 6.0 1704 1400 A 48 ALA HA B 18 ALA HB% 1.0 1.8 6.0 1705 1401 A 48 ALA HA B 18 ALA HA 1.0 1.8 5.0 1706 1402 A 48 ALA HB% B 18 ALA HA 1.0 1.8 5.5 1707 1403 A 48 ALA HA B 19 PRO HDy 1.0 1.8 5.0 1708 1404 A 48 ALA HA B 19 PRO HDx 1.0 1.8 5.0 1709 1405 A 48 ALA HA B 19 PRO HGy 1.0 1.8 6.0 1710 1406 A 48 ALA HB% B 19 PRO HGy 1.0 1.8 5.5 1711 1407 A 48 ALA HB% B 19 PRO HGx 1.0 1.8 5.5 1712 1408 A 48 ALA HB% B 19 PRO HBy 1.0 1.8 6.9 1713 1409 A 48 ALA HB% B 19 PRO HBx 1.0 1.8 6.2 1714 1410 A 48 ALA HB% B 19 PRO HDy 1.0 1.8 5.5 1715 1411 A 48 ALA HB% B 19 PRO HDx 1.0 1.8 5.5 1716 1412 A 51 LEU HA B 14 PHE HBx 1.0 1.8 6.0 1717 1413 A 51 LEU HA B 15 ILE H 1.0 1.8 6.0 1718 1414 B 15 ILE HB A 51 LEU HBx 1.0 1.8 6.2 1719 1414 A 51 LEU HBy B 15 ILE HB 1.0 1.8 6.2 1720 1415 B 15 ILE HG2% A 51 LEU HBx 1.0 1.8 7.0 1721 1415 A 51 LEU HBy B 15 ILE HG2% 1.0 1.8 7.0 1722 1416 A 51 LEU HG B 15 ILE HD1% 1.0 1.8 6.5 1723 1417 A 51 LEU HA B 17 LEU HDx% 1.0 1.8 6.5 1724 1418 B 17 LEU HG A 51 LEU HBx 1.0 1.8 6.5 1725 1418 A 51 LEU HBy B 17 LEU HG 1.0 1.8 6.5 1726 1419 B 17 LEU HDx% A 51 LEU HBx 1.0 1.8 6.0 1727 1419 A 51 LEU HBy B 17 LEU HDx% 1.0 1.8 6.0 1728 1420 B 17 LEU HDy% A 51 LEU HBx 1.0 1.8 6.0 1729 1420 A 51 LEU HBy B 17 LEU HDy% 1.0 1.8 6.0 1730 1421 A 51 LEU HBy B 17 LEU HBx 1.0 1.8 6.0 1731 1421 A 51 LEU HBx B 17 LEU HBx 1.0 1.8 6.0 1732 1421 B 17 LEU HBy A 51 LEU HBx 1.0 1.8 6.0 1733 1421 A 51 LEU HBy B 17 LEU HBy 1.0 1.8 6.0 1734 1422 A 51 LEU HDx% B 17 LEU HG 1.0 1.8 6.2 1735 1423 B 14 PHE HEy A 52 SER HBx 1.0 1.8 6.2 1736 1423 A 52 SER HBy B 14 PHE HEy 1.0 1.8 6.2 1737 1424 B 14 PHE HEx A 52 SER HBx 1.0 1.8 5.5 1738 1424 A 52 SER HBy B 14 PHE HEx 1.0 1.8 5.5 1739 1425 A 52 SER HA B 14 PHE HEy 1.0 1.8 6.0 1740 1426 A 52 SER HA B 14 PHE HEx 1.0 1.8 5.0 1741 1427 A 52 SER HA B 14 PHE HA 1.0 1.8 5.0 1742 1428 A 52 SER HA B 14 PHE HBy 1.0 1.8 5.0 1743 1429 A 52 SER HA B 14 PHE HBx 1.0 1.8 6.0 1744 1430 A 53 ILE HG2% B 12 SER HA 1.0 1.8 6.5 1745 1431 A 53 ILE HA B 13 VAL HGx% 1.0 1.8 6.5 1746 1432 A 53 ILE HB B 13 VAL HGy% 1.0 1.8 5.3 1747 1433 A 53 ILE HB B 13 VAL HGx% 1.0 1.8 3.8 1748 1434 A 53 ILE HG1x B 13 VAL HGx% 1.0 1.8 6.5 1749 1435 B 13 VAL HGy% A 53 ILE HD1% 1.0 1.8 5.1 1750 1436 B 13 VAL HGx% A 53 ILE HD1% 1.0 1.8 4.4 1751 1437 A 53 ILE HG2% B 14 PHE HA 1.0 1.8 6.5 1752 1438 B 14 PHE HA A 53 ILE HD1% 1.0 1.8 6.5 1753 1439 A 54 ALA HB% B 10 ALA HB% 1.0 2.8 6.5 1754 1440 A 54 ALA HA B 12 SER HBx 1.0 1.8 4.5 1755 1440 A 54 ALA HA B 12 SER HBy 1.0 1.8 4.5 1756 1441 A 54 ALA HA B 12 SER HA 1.0 1.8 5.0 1757 1442 A 54 ALA HB% B 12 SER HBx 1.0 1.8 4.5 1758 1442 A 54 ALA HB% B 12 SER HBy 1.0 1.8 4.5 1759 1443 A 54 ALA HB% B 12 SER HA 1.0 1.8 4.5 1760 1444 A 54 ALA HA B 13 VAL HGx% 1.0 1.8 6.5 1761 1445 A 55 VAL HA B 11 SER HBy 1.0 1.8 6.0 1762 1446 A 55 VAL HB B 11 SER HBy 1.0 1.8 5.0 1763 1447 A 55 VAL HGy% B 11 SER HBx 1.0 1.8 5.5 1764 1448 A 55 VAL HGx% B 11 SER HBx 1.0 1.8 6.5 1765 1449 A 55 VAL HGy% B 11 SER HBy 1.0 1.8 5.5 1766 1450 A 55 VAL HGx% B 11 SER HBy 1.0 1.8 5.5 1767 1451 A 55 VAL HGy% B 12 SER HA 1.0 1.8 6.5 1768 1452 A 55 VAL HGx% B 12 SER HA 1.0 1.8 6.5 1769 1453 A 55 VAL HB B 13 VAL HGx% 1.0 1.8 6.5 1770 1454 A 55 VAL HGy% B 13 VAL HGx% 1.0 1.8 6.0 1771 1455 A 55 VAL HGx% B 13 VAL HGx% 1.0 1.8 6.0 1772 1456 A 56 GLU HGy B 8 ARG HGy 1.0 1.8 5.0 1773 1457 A 56 GLU HGx B 9 VAL HB 1.0 1.8 6.0 1774 1458 A 58 PRO HA B 8 ARG HA 1.0 1.8 5.0 1775 1459 A 58 PRO HBy B 8 ARG HA 1.0 1.8 5.0 1776 1460 A 58 PRO HBy B 9 VAL HB 1.0 1.8 5.0 1777 1461 A 60 LYS HA B 9 VAL HGx% 1.0 1.8 6.5 1778 1462 B 9 VAL HGx% A 60 LYS HEx 1.0 1.8 6.0 1779 1462 A 60 LYS HEy B 9 VAL HGx% 1.0 1.8 6.0 1780 1463 B 9 VAL HGx% A 60 LYS HBx 1.0 1.8 4.3 1781 1463 A 60 LYS HBy B 9 VAL HGx% 1.0 1.8 4.3 1782 1464 B 9 VAL HGx% A 60 LYS HDx 1.0 1.8 6.0 1783 1464 A 60 LYS HDy B 9 VAL HGx% 1.0 1.8 6.0 1784 1465 B 9 VAL HGx% A 60 LYS HGx 1.0 1.8 4.3 1785 1465 A 60 LYS HGy B 9 VAL HGx% 1.0 1.8 4.3 1786 1466 B 10 ALA HB% A 60 LYS HEx 1.0 1.8 7.0 1787 1466 A 60 LYS HEy B 10 ALA HB% 1.0 1.8 7.0 1788 1467 B 10 ALA HB% A 60 LYS HDx 1.0 1.8 6.5 1789 1467 A 60 LYS HDy B 10 ALA HB% 1.0 1.8 6.5 1790 1468 A 60 LYS HA B 11 SER HBy 1.0 1.8 6.0 1791 1469 A 60 LYS HEy B 11 SER HBy 1.0 1.8 5.5 1792 1469 A 60 LYS HEx B 11 SER HBy 1.0 1.8 5.5 1793 1469 B 11 SER HBx A 60 LYS HEx 1.0 1.8 5.5 1794 1469 A 60 LYS HEy B 11 SER HBx 1.0 1.8 5.5 1795 1470 A 60 LYS HDy B 11 SER HBy 1.0 1.8 5.5 1796 1470 A 60 LYS HDx B 11 SER HBy 1.0 1.8 5.5 1797 1470 B 11 SER HBx A 60 LYS HDx 1.0 1.8 5.5 1798 1470 A 60 LYS HDy B 11 SER HBx 1.0 1.8 5.5 1799 1471 A 60 LYS HGy B 11 SER HBy 1.0 1.8 6.5 1800 1471 A 60 LYS HGx B 11 SER HBy 1.0 1.8 6.5 1801 1471 B 11 SER HBx A 60 LYS HGx 1.0 1.8 6.5 1802 1471 A 60 LYS HGy B 11 SER HBx 1.0 1.8 6.5 1803 1472 A 61 ALA HB% B 9 VAL HGx% 1.0 1.8 6.5 1804 1473 A 61 ALA HB% B 11 SER HBy 1.0 1.8 4.7 1805 1473 A 61 ALA HB% B 11 SER HBx 1.0 1.8 4.7 1806 1474 A 63 ILE HD1% B 11 SER HBy 1.0 1.8 5.5 1807 1474 A 63 ILE HD1% B 11 SER HBx 1.0 1.8 5.5 1808 1475 A 63 ILE HD1% B 12 SER HA 1.0 1.8 6.5 1809 1476 A 63 ILE HB B 13 VAL HGy% 1.0 1.8 5.3 1810 1477 A 63 ILE HB B 13 VAL HGx% 1.0 1.8 5.0 1811 1478 A 63 ILE HB B 13 VAL HB 1.0 1.8 6.0 1812 1479 A 63 ILE HG2% B 13 VAL HGy% 1.0 1.8 7.0 1813 1480 A 63 ILE HG2% B 13 VAL HGx% 1.0 1.8 7.0 1814 1481 A 63 ILE HD1% B 13 VAL HB 1.0 1.8 5.5 1815 1482 B 17 LEU HDy% A 73 CYS HBx 1.0 1.8 5.3 1816 1482 A 73 CYS HBy B 17 LEU HDy% 1.0 1.8 5.3 1817 1483 B 17 LEU HDx% A 73 CYS HBx 1.0 1.8 5.4 1818 1483 A 73 CYS HBy B 17 LEU HDx% 1.0 1.8 5.4 1819 1484 A 48 ALA H B 19 PRO HGy 1.0 1.8 6.0 1820 1485 A 48 ALA H B 19 PRO HGx 1.0 1.8 6.0 1821 1486 A 49 GLY H B 17 LEU H 1.0 1.8 6.0 1822 1487 A 49 GLY H B 17 LEU HG 1.0 1.8 5.0 1823 1488 B 15 ILE HD1% A 51 LEU HBx 1.0 1.8 6.0 1824 1488 A 51 LEU HBy B 15 ILE HD1% 1.0 1.8 6.0 1825 1489 B 15 ILE HB A 51 LEU HBx 1.0 1.8 6.5 1826 1489 A 51 LEU HBy B 15 ILE HB 1.0 1.8 6.5 1827 1490 A 51 LEU HG B 15 ILE HG1y 1.0 1.8 6.0 1828 1491 B 17 LEU HDy% A 51 LEU HBx 1.0 1.8 7.0 1829 1491 A 51 LEU HBy B 17 LEU HDy% 1.0 1.8 7.0 1830 1492 B 17 LEU HDx% A 51 LEU HBx 1.0 1.8 7.0 1831 1492 A 51 LEU HBy B 17 LEU HDx% 1.0 1.8 7.0 1832 1493 A 52 SER H B 14 PHE HEx 1.0 1.8 6.0 1833 1494 A 53 ILE H B 13 VAL HGy% 1.0 1.8 5.9 1834 1495 A 53 ILE H B 13 VAL HGx% 1.0 1.8 5.5 1835 1496 A 53 ILE H B 13 VAL H 1.0 1.8 6.0 1836 1497 A 53 ILE H B 14 PHE HBx 1.0 1.8 6.0 1837 1498 A 53 ILE H B 14 PHE HEy 1.0 1.8 6.0 1838 1499 A 53 ILE HB B 13 VAL HGx% 1.0 1.8 6.5 1839 1500 A 53 ILE HG1x B 13 VAL HGy% 1.0 1.8 6.5 1840 1501 A 54 ALA HA B 11 SER H 1.0 1.8 6.0 1841 1502 A 54 ALA HA B 11 SER HBy 1.0 1.8 6.0 1842 1503 A 54 ALA HA B 12 SER HBx 1.0 1.8 6.5 1843 1503 A 54 ALA HA B 12 SER HBy 1.0 1.8 6.5 1844 1504 A 54 ALA HB% B 12 SER HBx 1.0 1.8 7.0 1845 1504 A 54 ALA HB% B 12 SER HBy 1.0 1.8 7.0 1846 1505 A 54 ALA HA B 13 VAL H 1.0 1.8 6.0 1847 1506 A 54 ALA HA B 13 VAL HGx% 1.0 1.8 6.5 1848 1507 A 55 VAL H B 11 SER H 1.0 1.8 6.0 1849 1508 A 55 VAL H B 13 VAL HGx% 1.0 1.8 6.5 1850 1509 A 56 GLU HGy B 8 ARG HDy 1.0 1.8 6.0 1851 1510 A 56 GLU HA B 9 VAL HGx% 1.0 1.8 6.5 1852 1511 A 56 GLU HGy B 11 SER H 1.0 1.8 6.0 1853 1512 A 57 GLY H B 8 ARG HGy 1.0 1.8 6.0 1854 1513 A 57 GLY H B 8 ARG H 1.0 1.8 5.3 1855 1514 A 57 GLY H B 8 ARG HGx 1.0 1.8 6.0 1856 1515 A 57 GLY H B 8 ARG HBx 1.0 1.8 6.5 1857 1515 A 57 GLY H B 8 ARG HBy 1.0 1.8 6.5 1858 1516 A 57 GLY H B 9 VAL HGx% 1.0 1.8 5.5 1859 1517 A 57 GLY H B 9 VAL H 1.0 1.8 6.0 1860 1518 A 57 GLY H B 10 ALA HB% 1.0 1.8 6.3 1861 1519 A 58 PRO HA B 8 ARG HGy 1.0 1.8 6.0 1862 1520 A 58 PRO HA B 8 ARG H 1.0 1.8 6.0 1863 1521 A 58 PRO HA B 9 VAL HGx% 1.0 1.8 6.5 1864 1522 A 59 SER H B 8 ARG HDx 1.0 1.8 6.0 1865 1523 A 60 LYS H B 9 VAL HGx% 1.0 1.8 5.5 1866 1524 A 61 ALA H B 9 VAL HGx% 1.0 1.8 5.5 1867 1525 A 63 ILE H B 13 VAL HGx% 1.0 1.8 6.5 1868 1526 B 7 LYS H B 7 LYS HBx 1.0 1.8 3.8 1869 1526 B 7 LYS HBy B 7 LYS H 1.0 1.8 3.8 1870 1527 B 7 LYS H B 7 LYS HGx 1.0 1.8 3.5 1871 1527 B 7 LYS H B 7 LYS HGy 1.0 1.8 3.5 1872 1528 B 7 LYS H B 6 GLU HBx 1.0 1.8 5.0 1873 1528 B 7 LYS H B 6 GLU HBy 1.0 1.8 5.0 1874 1529 B 7 LYS H B 6 GLU HA 1.0 1.8 2.9 1875 1530 B 8 ARG H B 8 ARG HGy 1.0 1.8 4.5 1876 1530 B 8 ARG H B 8 ARG HGx 1.0 1.8 4.5 1877 1531 B 8 ARG H B 7 LYS HA 1.0 1.8 3.5 1878 1532 B 9 VAL HB B 10 ALA H 1.0 1.8 3.9 1879 1533 B 10 ALA H B 9 VAL HA 1.0 1.8 2.9 1880 1534 B 9 VAL HGx% B 10 ALA H 1.0 1.8 5.0 1881 1535 B 10 ALA H B 10 ALA HA 1.0 1.8 3.5 1882 1536 B 8 ARG HA B 9 VAL H 1.0 1.8 3.5 1883 1537 B 10 ALA H B 10 ALA HA 1.0 1.8 3.5 1884 1538 B 10 ALA HB% B 11 SER H 1.0 1.8 5.0 1885 1539 B 11 SER H B 10 ALA HA 1.0 1.8 3.5 1886 1540 B 12 SER HA B 13 VAL H 1.0 1.8 3.5 1887 1541 B 13 VAL H B 12 SER HBx 1.0 1.8 5.0 1888 1541 B 12 SER HBy B 13 VAL H 1.0 1.8 5.0 1889 1542 B 13 VAL HGx% B 13 VAL H 1.0 1.8 3.5 1890 1543 B 13 VAL HB B 13 VAL H 1.0 1.8 3.5 1891 1544 B 13 VAL H B 13 VAL HA 1.0 1.8 2.9 1892 1545 B 13 VAL HGx% B 14 PHE H 1.0 1.8 4.9 1893 1546 B 13 VAL HB B 14 PHE H 1.0 1.8 3.7 1894 1547 B 13 VAL HA B 14 PHE H 1.0 1.8 2.9 1895 1548 B 14 PHE H B 14 PHE HBy 1.0 1.8 4.1 1896 1548 B 14 PHE H B 14 PHE HBx 1.0 1.8 4.1 1897 1549 B 15 ILE H B 15 ILE HD1% 1.0 1.8 5.0 1898 1550 B 15 ILE H B 15 ILE HG2% 1.0 1.8 5.0 1899 1551 B 15 ILE H B 15 ILE HB 1.0 1.8 3.7 1900 1552 B 15 ILE H B 14 PHE HBy 1.0 1.8 4.6 1901 1552 B 15 ILE H B 14 PHE HBx 1.0 1.8 4.6 1902 1553 B 15 ILE H B 15 ILE HA 1.0 1.8 3.5 1903 1554 B 15 ILE HD1% B 16 THR H 1.0 1.8 5.4 1904 1555 B 15 ILE HG2% B 16 THR H 1.0 1.8 5.0 1905 1556 B 16 THR H B 15 ILE HG1x 1.0 1.8 5.0 1906 1556 B 16 THR H B 15 ILE HG1y 1.0 1.8 5.0 1907 1557 B 15 ILE HB B 16 THR H 1.0 1.8 4.5 1908 1558 B 15 ILE HA B 16 THR H 1.0 1.8 3.5 1909 1559 B 16 THR H B 16 THR HA 1.0 1.8 3.5 1910 1560 B 17 LEU HDx% B 17 LEU H 1.0 1.8 4.9 1911 1561 B 17 LEU HG B 17 LEU H 1.0 1.8 4.0 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 22 ARG O A 42 TRP N 1.0 2.4 3.5 2 2 A 42 TRP H A 22 ARG O 1.0 1.5 2.5 3 3 A 24 GLY O A 40 SER N 1.0 2.4 3.5 4 4 A 40 SER H A 24 GLY O 1.0 1.5 2.5 5 5 A 25 GLY O A 28 LEU N 1.0 2.4 3.5 6 6 A 28 LEU H A 25 GLY O 1.0 1.5 2.5 7 7 A 26 THR O A 29 GLU N 1.0 2.4 3.5 8 8 A 29 GLU H A 26 THR O 1.0 1.5 2.5 9 9 A 26 THR O A 30 ARG N 1.0 2.4 3.5 10 10 A 30 ARG H A 26 THR O 1.0 1.5 2.5 11 11 A 32 VAL O A 35 VAL N 1.0 2.4 3.5 12 12 A 35 VAL H A 32 VAL O 1.0 1.5 2.5 13 13 A 37 ALA O A 77 TYR N 1.0 2.4 3.5 14 14 A 77 TYR H A 37 ALA O 1.0 1.5 2.5 15 15 A 38 GLU O A 27 GLY N 1.0 2.4 3.5 16 16 A 27 GLY H A 38 GLU O 1.0 1.5 2.5 17 17 A 39 PHE O A 75 VAL N 1.0 2.4 3.5 18 18 A 75 VAL H A 39 PHE O 1.0 1.5 2.5 19 19 A 40 SER O A 24 GLY N 1.0 2.4 3.5 20 20 A 24 GLY H A 40 SER O 1.0 1.5 2.5 21 21 A 42 TRP O A 22 ARG N 1.0 2.4 3.5 22 22 A 22 ARG H A 42 TRP O 1.0 1.5 2.5 23 23 A 49 GLY O B 17 LEU N 1.0 2.4 3.5 24 24 B 17 LEU H A 49 GLY O 1.0 1.5 2.5 25 25 A 50 GLY O A 92 ASN N 1.0 2.4 3.5 26 26 A 92 ASN H A 50 GLY O 1.0 1.5 2.5 27 27 A 51 LEU O B 15 ILE N 1.0 2.4 3.5 28 28 B 15 ILE H A 51 LEU O 1.0 1.5 2.5 29 29 A 52 SER O A 90 LYS N 1.0 2.4 3.5 30 30 A 90 LYS H A 52 SER O 1.0 1.5 2.5 31 31 A 53 ILE O B 13 VAL N 1.0 2.4 3.5 32 32 B 13 VAL H A 53 ILE O 1.0 1.5 2.5 33 33 A 54 ALA O A 88 SER N 1.0 2.4 3.5 34 34 A 88 SER H A 54 ALA O 1.0 1.5 2.5 35 35 A 55 VAL O B 11 SER N 1.0 2.4 3.5 36 36 B 11 SER H A 55 VAL O 1.0 1.5 2.5 37 37 A 56 GLU O A 86 GLU N 1.0 2.4 3.5 38 38 A 86 GLU H A 56 GLU O 1.0 1.5 2.5 39 39 A 57 GLY O B 9 VAL N 1.0 2.4 3.5 40 40 B 9 VAL H A 57 GLY O 1.0 1.5 2.5 41 41 A 62 GLU O A 78 VAL N 1.0 2.4 3.5 42 42 A 78 VAL H A 62 GLU O 1.0 1.5 2.5 43 43 A 64 ALA O A 76 SER N 1.0 2.4 3.5 44 44 A 76 SER H A 64 ALA O 1.0 1.5 2.5 45 45 A 75 VAL O A 39 PHE N 1.0 2.4 3.5 46 46 A 39 PHE H A 75 VAL O 1.0 1.5 2.5 47 47 A 76 SER O A 64 ALA N 1.0 2.4 3.5 48 48 A 64 ALA H A 76 SER O 1.0 1.5 2.5 49 49 A 77 TYR O A 37 ALA N 1.0 2.4 3.5 50 50 A 37 ALA H A 77 TYR O 1.0 1.5 2.5 51 51 A 78 VAL O A 62 GLU N 1.0 2.4 3.5 52 52 A 62 GLU H A 78 VAL O 1.0 1.5 2.5 53 53 A 79 VAL O A 34 GLY N 1.0 2.4 3.5 54 54 A 34 GLY H A 79 VAL O 1.0 1.5 2.5 55 55 A 83 GLY O A 105 VAL N 1.0 2.4 3.5 56 56 A 105 VAL H A 83 GLY O 1.0 1.5 2.5 57 57 A 85 TYR O A 103 VAL N 1.0 2.4 3.5 58 58 A 103 VAL H A 85 TYR O 1.0 1.5 2.5 59 59 A 86 GLU O A 56 GLU N 1.0 2.4 3.5 60 60 A 56 GLU H A 86 GLU O 1.0 1.5 2.5 61 61 A 87 VAL O A 101 PHE N 1.0 2.4 3.5 62 62 A 101 PHE H A 87 VAL O 1.0 1.5 2.5 63 63 A 88 SER O A 54 ALA N 1.0 2.4 3.5 64 64 A 54 ALA H A 88 SER O 1.0 1.5 2.5 65 65 A 90 LYS O A 52 SER N 1.0 2.4 3.5 66 66 A 52 SER H A 90 LYS O 1.0 1.5 2.5 67 67 A 91 PHE O A 94 GLU N 1.0 2.4 3.5 68 68 A 94 GLU H A 91 PHE O 1.0 1.5 2.5 69 69 A 94 GLU O A 91 PHE N 1.0 2.4 3.5 70 70 A 91 PHE H A 94 GLU O 1.0 1.5 2.5 71 71 A 96 ILE O A 99 SER N 1.0 2.4 3.5 72 72 A 99 SER H A 96 ILE O 1.0 1.5 2.5 73 73 A 101 PHE O A 87 VAL N 1.0 2.4 3.5 74 74 A 87 VAL H A 101 PHE O 1.0 1.5 2.5 75 75 A 103 VAL O A 85 TYR N 1.0 2.4 3.5 76 76 A 85 TYR H A 103 VAL O 1.0 1.5 2.5 77 77 A 104 PRO O A 31 GLY N 1.0 2.4 3.5 78 78 A 31 GLY H A 104 PRO O 1.0 1.5 2.5 79 79 A 105 VAL O A 83 GLY N 1.0 2.4 3.5 80 80 A 83 GLY H A 105 VAL O 1.0 1.5 2.5 81 81 A 106 ALA O A 33 ALA N 1.0 2.4 3.5 82 82 A 33 ALA H A 106 ALA O 1.0 1.5 2.5 83 83 B 9 VAL O A 57 GLY N 1.0 2.4 3.5 84 84 A 57 GLY H B 9 VAL O 1.0 1.5 2.5 85 85 B 11 SER O A 55 VAL N 1.0 2.4 3.5 86 86 A 55 VAL H B 11 SER O 1.0 1.5 2.5 87 87 B 13 VAL O A 53 ILE N 1.0 2.4 3.5 88 88 A 53 ILE H B 13 VAL O 1.0 1.5 2.5 89 89 B 15 ILE O A 51 LEU N 1.0 2.4 3.5 90 90 B 15 ILE O A 51 LEU H 1.0 1.5 2.5 91 91 B 17 LEU O A 49 GLY N 1.0 2.4 3.5 92 92 A 49 GLY H B 17 LEU O 1.0 1.5 2.5 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 18 ALA C A 19 HIS N A 19 HIS CA A 19 HIS C 1.0 -107.0 -47.0 PHI 2 2 A 19 HIS N A 19 HIS CA A 19 HIS C A 20 LYS N 1.0 -52.0 8.0 PSI 3 3 A 21 VAL C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -158.0 -98.0 PHI 4 4 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 ALA N 1.0 121.0 181.0 PSI 5 5 A 22 ARG C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -148.0 -88.0 PHI 6 6 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 GLY N 1.0 114.0 174.0 PSI 7 7 A 24 GLY C A 25 GLY N A 25 GLY CA A 25 GLY C 1.0 -178.0 -38.0 PHI 8 8 A 25 GLY N A 25 GLY CA A 25 GLY C A 26 THR N 1.0 95.0 195.0 PSI 9 9 A 31 GLY C A 32 VAL N A 32 VAL CA A 32 VAL C 1.0 -132.0 -72.0 PHI 10 10 A 32 VAL N A 32 VAL CA A 32 VAL C A 33 ALA N 1.0 96.0 156.0 PSI 11 11 A 34 GLY C A 35 VAL N A 35 VAL CA A 35 VAL C 1.0 -126.0 -66.0 PHI 12 12 A 35 VAL N A 35 VAL CA A 35 VAL C A 36 PRO N 1.0 75.0 175.0 PSI 13 13 A 35 VAL C A 36 PRO N A 36 PRO CA A 36 PRO C 1.0 -146.0 -46.0 PHI 14 14 A 36 PRO N A 36 PRO CA A 36 PRO C A 37 ALA N 1.0 91.0 151.0 PSI 15 15 A 39 PHE C A 40 SER N A 40 SER CA A 40 SER C 1.0 -157.0 -97.0 PHI 16 16 A 40 SER N A 40 SER CA A 40 SER C A 41 ILE N 1.0 118.0 178.0 PSI 17 17 A 47 GLY C A 48 ALA N A 48 ALA CA A 48 ALA C 1.0 -114.0 -54.0 PHI 18 18 A 48 ALA N A 48 ALA CA A 48 ALA C A 49 GLY N 1.0 103.0 163.0 PSI 19 19 A 51 LEU C A 52 SER N A 52 SER CA A 52 SER C 1.0 -144.0 -84.0 PHI 20 20 A 52 SER N A 52 SER CA A 52 SER C A 53 ILE N 1.0 96.0 156.0 PSI 21 21 A 52 SER C A 53 ILE N A 53 ILE CA A 53 ILE C 1.0 -147.0 -87.0 PHI 22 22 A 53 ILE N A 53 ILE CA A 53 ILE C A 54 ALA N 1.0 101.0 161.0 PSI 23 23 A 53 ILE C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -138.0 -78.0 PHI 24 24 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 VAL N 1.0 107.0 167.0 PSI 25 25 A 54 ALA C A 55 VAL N A 55 VAL CA A 55 VAL C 1.0 -128.0 -88.0 PHI 26 26 A 55 VAL N A 55 VAL CA A 55 VAL C A 56 GLU N 1.0 96.0 156.0 PSI 27 27 A 55 VAL C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -141.0 -81.0 PHI 28 28 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 GLY N 1.0 97.0 197.0 PSI 29 29 A 59 SER C A 60 LYS N A 60 LYS CA A 60 LYS C 1.0 -167.0 -27.0 PHI 30 30 A 60 LYS N A 60 LYS CA A 60 LYS C A 61 ALA N 1.0 85.0 185.0 PSI 31 31 A 62 GLU C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -159.0 -59.0 PHI 32 32 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 ALA N 1.0 95.0 155.0 PSI 33 33 A 63 ILE C A 64 ALA N A 64 ALA CA A 64 ALA C 1.0 -149.0 -69.0 PHI 34 34 A 64 ALA N A 64 ALA CA A 64 ALA C A 65 PHE N 1.0 115.0 175.0 PSI 35 35 A 64 ALA C A 65 PHE N A 65 PHE CA A 65 PHE C 1.0 -147.0 -87.0 PHI 36 36 A 65 PHE N A 65 PHE CA A 65 PHE C A 66 GLU N 1.0 116.0 176.0 PSI 37 37 A 65 PHE C A 66 GLU N A 66 GLU CA A 66 GLU C 1.0 -141.0 -81.0 PHI 38 38 A 66 GLU N A 66 GLU CA A 66 GLU C A 67 ASP N 1.0 76.0 176.0 PSI 39 39 A 66 GLU C A 67 ASP N A 67 ASP CA A 67 ASP C 1.0 -134.0 -74.0 PHI 40 40 A 67 ASP N A 67 ASP CA A 67 ASP C A 68 ARG N 1.0 68.0 168.0 PSI 41 41 A 71 GLY C A 72 SER N A 72 SER CA A 72 SER C 1.0 -156.0 -96.0 PHI 42 42 A 72 SER N A 72 SER CA A 72 SER C A 73 CYS N 1.0 89.0 189.0 PSI 43 43 A 72 SER C A 73 CYS N A 73 CYS CA A 73 CYS C 1.0 -157.0 -57.0 PHI 44 44 A 73 CYS N A 73 CYS CA A 73 CYS C A 74 GLY N 1.0 105.0 165.0 PSI 45 45 A 74 GLY C A 75 VAL N A 75 VAL CA A 75 VAL C 1.0 -137.0 -77.0 PHI 46 46 A 75 VAL N A 75 VAL CA A 75 VAL C A 76 SER N 1.0 88.0 148.0 PSI 47 47 A 75 VAL C A 76 SER N A 76 SER CA A 76 SER C 1.0 -136.0 -76.0 PHI 48 48 A 76 SER N A 76 SER CA A 76 SER C A 77 TYR N 1.0 107.0 167.0 PSI 49 49 A 77 TYR C A 78 VAL N A 78 VAL CA A 78 VAL C 1.0 -156.0 -96.0 PHI 50 50 A 78 VAL N A 78 VAL CA A 78 VAL C A 79 VAL N 1.0 89.0 189.0 PSI 51 51 A 78 VAL C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -161.0 -61.0 PHI 52 52 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 GLN N 1.0 87.0 187.0 PSI 53 53 A 80 GLN C A 81 GLU N A 81 GLU CA A 81 GLU C 1.0 -161.0 -61.0 PHI 54 54 A 81 GLU N A 81 GLU CA A 81 GLU C A 82 PRO N 1.0 92.0 192.0 PSI 55 55 A 84 ASP C A 85 TYR N A 85 TYR CA A 85 TYR C 1.0 -147.0 -67.0 PHI 56 56 A 85 TYR N A 85 TYR CA A 85 TYR C A 86 GLU N 1.0 82.0 182.0 PSI 57 57 A 85 TYR C A 86 GLU N A 86 GLU CA A 86 GLU C 1.0 -139.0 -79.0 PHI 58 58 A 86 GLU N A 86 GLU CA A 86 GLU C A 87 VAL N 1.0 90.0 150.0 PSI 59 59 A 86 GLU C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -126.0 -86.0 PHI 60 60 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 SER N 1.0 108.0 148.0 PSI 61 61 A 87 VAL C A 88 SER N A 88 SER CA A 88 SER C 1.0 -158.0 -58.0 PHI 62 62 A 88 SER N A 88 SER CA A 88 SER C A 89 ILE N 1.0 90.0 150.0 PSI 63 63 A 88 SER C A 89 ILE N A 89 ILE CA A 89 ILE C 1.0 -150.0 -90.0 PHI 64 64 A 89 ILE N A 89 ILE CA A 89 ILE C A 90 LYS N 1.0 87.0 187.0 PSI 65 65 A 89 ILE C A 90 LYS N A 90 LYS CA A 90 LYS C 1.0 -147.0 -87.0 PHI 66 66 A 90 LYS N A 90 LYS CA A 90 LYS C A 91 PHE N 1.0 123.0 183.0 PSI 67 67 A 90 LYS C A 91 PHE N A 91 PHE CA A 91 PHE C 1.0 -139.0 -79.0 PHI 68 68 A 91 PHE N A 91 PHE CA A 91 PHE C A 92 ASN N 1.0 94.0 154.0 PSI 69 69 A 98 ASP C A 99 SER N A 99 SER CA A 99 SER C 1.0 -117.0 -57.0 PHI 70 70 A 99 SER N A 99 SER CA A 99 SER C A 100 PRO N 1.0 84.0 184.0 PSI 71 71 A 100 PRO C A 101 PHE N A 101 PHE CA A 101 PHE C 1.0 -138.0 -78.0 PHI 72 72 A 101 PHE N A 101 PHE CA A 101 PHE C A 102 VAL N 1.0 71.0 171.0 PSI 73 73 A 102 VAL C A 103 VAL N A 103 VAL CA A 103 VAL C 1.0 -128.0 -68.0 PHI 74 74 A 103 VAL N A 103 VAL CA A 103 VAL C A 104 PRO N 1.0 78.0 178.0 PSI 75 75 A 103 VAL C A 104 PRO N A 104 PRO CA A 104 PRO C 1.0 -135.0 -35.0 PHI 76 76 A 104 PRO N A 104 PRO CA A 104 PRO C A 105 VAL N 1.0 73.0 173.0 PSI 77 77 A 104 PRO C A 105 VAL N A 105 VAL CA A 105 VAL C 1.0 -135.0 -75.0 PHI 78 78 A 105 VAL N A 105 VAL CA A 105 VAL C A 106 ALA N 1.0 75.0 175.0 PSI 79 79 A 105 VAL C A 106 ALA N A 106 ALA CA A 106 ALA C 1.0 -148.0 -48.0 PHI 80 80 A 106 ALA N A 106 ALA CA A 106 ALA C A 107 SER N 1.0 80.0 180.0 PSI stop_ save_