data_nef_c16795_2kvv save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ALA middle . . 3 A 3 GLN middle . . 4 A 4 ILE middle . . 5 A 5 ILE middle . . 6 A 6 PHE middle . . 7 A 7 ASN middle . . 8 A 8 GLU middle . . 9 A 9 GLU middle . . 10 A 10 TRP middle . . 11 A 11 MET middle . . 12 A 12 VAL middle . . 13 A 13 GLU middle . . 14 A 14 LYS middle . . 15 A 15 ALA middle . . 16 A 16 LEU middle . . 17 A 17 MET middle . . 18 A 18 VAL middle . . 19 A 19 ARG middle . . 20 A 20 THR middle . . 21 A 21 GLY middle . false 22 A 22 LEU middle . . 23 A 23 GLY middle . false 24 A 24 ALA middle . . 25 A 25 ARG middle . . 26 A 26 GLN middle . . 27 A 27 ILE middle . . 28 A 28 GLU middle . . 29 A 29 SER middle . . 30 A 30 TYR middle . . 31 A 31 ARG middle . . 32 A 32 GLN middle . . 33 A 33 GLY middle . false 34 A 34 ALA middle . . 35 A 35 TRP middle . . 36 A 36 ILE middle . . 37 A 37 GLU middle . . 38 A 38 GLY middle . false 39 A 39 VAL middle . . 40 A 40 HIS middle . . 41 A 41 PHE middle . . 42 A 42 LYS middle . . 43 A 43 ARG middle . . 44 A 44 VAL middle . . 45 A 45 SER middle . . 46 A 46 PRO middle . false 47 A 47 SER middle . . 48 A 48 GLY middle . false 49 A 49 GLU middle . . 50 A 50 LYS middle . . 51 A 51 THR middle . . 52 A 52 LEU middle . . 53 A 53 ARG middle . . 54 A 54 GLY middle . false 55 A 55 THR middle . . 56 A 56 THR middle . . 57 A 57 TRP middle . . 58 A 58 TYR middle . . 59 A 59 ASN middle . . 60 A 60 TYR middle . . 61 A 61 PRO middle . false 62 A 62 GLU middle . . 63 A 63 ILE middle . . 64 A 64 ASN middle . . 65 A 65 LYS middle . . 66 A 66 PHE middle . . 67 A 67 ILE middle . . 68 A 68 ARG middle . . 69 A 69 ASP middle . . 70 A 70 SER middle . . 71 A 71 LEU middle . . 72 A 72 GLU middle . . 73 A 73 HIS middle . . 74 A 74 HIS middle . . 75 A 75 HIS middle . . 76 A 76 HIS middle . . 77 A 77 HIS middle . . 78 A 78 HIS 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 3 GLN HA H 1 4.33 . A 3 GLN HBy H 1 1.97 . A 3 GLN HBx H 1 1.93 . A 3 GLN HE2x H 1 6.81 . A 3 GLN HE2y H 1 7.43 . A 3 GLN HGx H 1 2.25 . A 3 GLN HGy H 1 2.29 . A 3 GLN CA C 13 55.4 . A 3 GLN CB C 13 29.4 . A 3 GLN CG C 13 33.7 . A 3 GLN NE2 N 15 111.4 . A 4 ILE H H 1 8.32 . A 4 ILE HA H 1 4.04 . A 4 ILE HB H 1 1.67 . A 4 ILE HD1% H 1 0.76 . A 4 ILE HG1y H 1 1.37 . A 4 ILE HG1x H 1 1.04 . A 4 ILE HG2% H 1 0.62 . A 4 ILE CA C 13 60.6 . A 4 ILE CB C 13 38.4 . A 4 ILE CD1 C 13 12.2 . A 4 ILE CG1 C 13 26.9 . A 4 ILE CG2 C 13 17.1 . A 4 ILE N N 15 124.1 . A 5 ILE H H 1 8.13 . A 5 ILE HA H 1 4.07 . A 5 ILE HB H 1 1.68 . A 5 ILE HD1% H 1 0.74 . A 5 ILE HG1y H 1 1.32 . A 5 ILE HG1x H 1 1.03 . A 5 ILE HG2% H 1 0.74 . A 5 ILE CA C 13 60.4 . A 5 ILE CB C 13 38.4 . A 5 ILE CD1 C 13 12.6 . A 5 ILE CG1 C 13 26.8 . A 5 ILE CG2 C 13 17.1 . A 5 ILE N N 15 125.8 . A 6 PHE H H 1 8.35 . A 6 PHE HA H 1 4.59 . A 6 PHE HBy H 1 3.03 . A 6 PHE HBx H 1 2.85 . A 6 PHE HDx H 1 7.03 . A 6 PHE HDy H 1 7.03 . A 6 PHE HEx H 1 7.09 . A 6 PHE HEy H 1 7.09 . A 6 PHE HZ H 1 7.09 . A 6 PHE CA C 13 57.2 . A 6 PHE CB C 13 39.5 . A 6 PHE CD1 C 13 131.4 . A 6 PHE CE1 C 13 131.3 . A 6 PHE CZ C 13 129.2 . A 6 PHE N N 15 125.3 . A 7 ASN H H 1 8.39 . A 7 ASN HA H 1 4.66 . A 7 ASN HBx H 1 2.76 . A 7 ASN HBy H 1 2.76 . A 7 ASN HD2x H 1 6.91 . A 7 ASN HD2y H 1 7.59 . A 7 ASN CA C 13 52.8 . A 7 ASN CB C 13 38.8 . A 7 ASN N N 15 121.3 . A 7 ASN ND2 N 15 112.5 . A 8 GLU H H 1 8.30 . A 8 GLU HA H 1 4.32 . A 8 GLU HBy H 1 1.98 . A 8 GLU HBx H 1 1.91 . A 8 GLU HGx H 1 2.22 . A 8 GLU HGy H 1 2.22 . A 8 GLU CA C 13 56.3 . A 8 GLU CB C 13 30.6 . A 8 GLU CG C 13 36.0 . A 8 GLU N N 15 119.5 . A 9 GLU H H 1 8.08 . A 9 GLU HA H 1 4.18 . A 9 GLU HBx H 1 1.89 . A 9 GLU HBy H 1 1.89 . A 9 GLU HGx H 1 2.18 . A 9 GLU HGy H 1 2.18 . A 9 GLU CA C 13 57.6 . A 9 GLU CB C 13 30.3 . A 9 GLU CG C 13 36.0 . A 9 GLU N N 15 122.1 . A 10 TRP H H 1 8.24 . A 10 TRP HA H 1 5.54 . A 10 TRP HBx H 1 3.02 . A 10 TRP HBy H 1 3.09 . A 10 TRP HD1 H 1 7.29 . A 10 TRP HE1 H 1 10.50 . A 10 TRP HE3 H 1 7.27 . A 10 TRP HH2 H 1 6.47 . A 10 TRP HZ2 H 1 7.41 . A 10 TRP HZ3 H 1 6.59 . A 10 TRP CA C 13 55.5 . A 10 TRP CB C 13 30.5 . A 10 TRP CD1 C 13 128.5 . A 10 TRP CE3 C 13 119.6 . A 10 TRP CH2 C 13 123.2 . A 10 TRP CZ2 C 13 115.0 . A 10 TRP CZ3 C 13 121.7 . A 10 TRP N N 15 121.6 . A 10 TRP NE1 N 15 131.1 . A 11 MET H H 1 10.09 . A 11 MET HA H 1 5.37 . A 11 MET HBy H 1 2.36 . A 11 MET HBx H 1 2.09 . A 11 MET HE% H 1 1.75 . A 11 MET HGx H 1 2.41 . A 11 MET HGy H 1 2.76 . A 11 MET CA C 13 54.3 . A 11 MET CB C 13 35.7 . A 11 MET CE C 13 16.7 . A 11 MET CG C 13 30.0 . A 11 MET N N 15 120.3 . A 12 VAL H H 1 8.27 . A 12 VAL HA H 1 4.51 . A 12 VAL HB H 1 2.49 . A 12 VAL HGx% H 1 0.18 . A 12 VAL HGy% H 1 0.94 . A 12 VAL CA C 13 61.0 . A 12 VAL CB C 13 32.1 . A 12 VAL CG1 C 13 20.3 . A 12 VAL CG2 C 13 18.3 . A 12 VAL N N 15 114.1 . A 13 GLU H H 1 9.22 . A 13 GLU HA H 1 3.57 . A 13 GLU HBy H 1 2.51 . A 13 GLU HBx H 1 2.14 . A 13 GLU HGx H 1 1.91 . A 13 GLU HGy H 1 2.10 . A 13 GLU CA C 13 61.3 . A 13 GLU CB C 13 30.9 . A 13 GLU CG C 13 37.1 . A 13 GLU N N 15 121.8 . A 14 LYS H H 1 8.90 . A 14 LYS HA H 1 4.10 . A 14 LYS HBx H 1 1.74 . A 14 LYS HBy H 1 1.86 . A 14 LYS HDy H 1 1.70 . A 14 LYS HDx H 1 1.69 . A 14 LYS HEx H 1 2.95 . A 14 LYS HEy H 1 2.96 . A 14 LYS HGy H 1 1.49 . A 14 LYS HGx H 1 1.44 . A 14 LYS CA C 13 59.7 . A 14 LYS CB C 13 32.0 . A 14 LYS CD C 13 28.9 . A 14 LYS CE C 13 41.8 . A 14 LYS CG C 13 25.0 . A 14 LYS N N 15 116.9 . A 15 ALA H H 1 6.57 . A 15 ALA HA H 1 4.17 . A 15 ALA HB% H 1 1.56 . A 15 ALA CA C 13 54.0 . A 15 ALA CB C 13 18.7 . A 15 ALA N N 15 120.5 . A 16 LEU H H 1 8.24 . A 16 LEU HA H 1 4.08 . A 16 LEU HBy H 1 1.92 . A 16 LEU HBx H 1 1.22 . A 16 LEU HDx% H 1 0.60 . A 16 LEU HDy% H 1 0.99 . A 16 LEU HG H 1 1.56 . A 16 LEU CA C 13 57.6 . A 16 LEU CB C 13 41.7 . A 16 LEU CD1 C 13 25.0 . A 16 LEU CD2 C 13 23.5 . A 16 LEU CG C 13 26.1 . A 16 LEU N N 15 120.2 . A 17 MET H H 1 8.75 . A 17 MET HA H 1 3.91 . A 17 MET HBy H 1 2.24 . A 17 MET HBx H 1 2.21 . A 17 MET HE% H 1 2.12 . A 17 MET HGy H 1 2.55 . A 17 MET HGx H 1 2.51 . A 17 MET CA C 13 60.5 . A 17 MET CB C 13 33.6 . A 17 MET CE C 13 16.7 . A 17 MET CG C 13 31.8 . A 17 MET N N 15 122.1 . A 18 VAL H H 1 7.50 . A 18 VAL HA H 1 3.71 . A 18 VAL HB H 1 2.14 . A 18 VAL HGx% H 1 0.93 . A 18 VAL HGy% H 1 1.10 . A 18 VAL CA C 13 65.8 . A 18 VAL CB C 13 31.7 . A 18 VAL CG1 C 13 20.8 . A 18 VAL CG2 C 13 22.1 . A 18 VAL N N 15 118.6 . A 19 ARG H H 1 7.63 . A 19 ARG HA H 1 4.12 . A 19 ARG HBx H 1 1.61 . A 19 ARG HBy H 1 1.67 . A 19 ARG HDx H 1 2.59 . A 19 ARG HDy H 1 2.75 . A 19 ARG HGx H 1 1.37 . A 19 ARG HGy H 1 1.37 . A 19 ARG CA C 13 57.3 . A 19 ARG CB C 13 30.6 . A 19 ARG CD C 13 41.6 . A 19 ARG CG C 13 26.9 . A 19 ARG N N 15 116.3 . A 20 THR H H 1 7.98 . A 20 THR HA H 1 4.66 . A 20 THR HB H 1 4.20 . A 20 THR HG1 H 1 4.36 . A 20 THR HG2% H 1 1.41 . A 20 THR CA C 13 62.0 . A 20 THR CB C 13 72.6 . A 20 THR CG2 C 13 21.8 . A 20 THR N N 15 103.7 . A 21 GLY H H 1 8.30 . A 21 GLY HAy H 1 4.22 . A 21 GLY HAx H 1 3.83 . A 21 GLY CA C 13 45.4 . A 21 GLY N N 15 111.8 . A 22 LEU H H 1 7.76 . A 22 LEU HA H 1 4.32 . A 22 LEU HBy H 1 1.62 . A 22 LEU HBx H 1 1.32 . A 22 LEU HDx% H 1 1.00 . A 22 LEU HDy% H 1 1.01 . A 22 LEU HG H 1 1.66 . A 22 LEU CA C 13 54.5 . A 22 LEU CB C 13 43.6 . A 22 LEU CD1 C 13 23.2 . A 22 LEU CD2 C 13 25.4 . A 22 LEU CG C 13 27.0 . A 22 LEU N N 15 120.1 . A 23 GLY H H 1 8.38 . A 23 GLY HAy H 1 4.38 . A 23 GLY HAx H 1 3.87 . A 23 GLY CA C 13 43.4 . A 23 GLY N N 15 106.3 . A 24 ALA H H 1 8.71 . A 24 ALA HA H 1 3.82 . A 24 ALA HB% H 1 1.39 . A 24 ALA CA C 13 55.8 . A 24 ALA CB C 13 18.2 . A 24 ALA N N 15 123.6 . A 25 ARG H H 1 8.60 . A 25 ARG HA H 1 4.02 . A 25 ARG HBx H 1 1.74 . A 25 ARG HBy H 1 1.78 . A 25 ARG HDx H 1 3.12 . A 25 ARG HDy H 1 3.12 . A 25 ARG HGy H 1 1.61 . A 25 ARG HGx H 1 1.59 . A 25 ARG CA C 13 58.3 . A 25 ARG CB C 13 29.1 . A 25 ARG CD C 13 42.9 . A 25 ARG CG C 13 26.8 . A 25 ARG N N 15 116.9 . A 26 GLN H H 1 7.33 . A 26 GLN HA H 1 3.66 . A 26 GLN HBx H 1 1.73 . A 26 GLN HBy H 1 1.73 . A 26 GLN HE2x H 1 7.00 . A 26 GLN HE2y H 1 7.19 . A 26 GLN HGx H 1 2.14 . A 26 GLN HGy H 1 2.25 . A 26 GLN CA C 13 58.4 . A 26 GLN CB C 13 29.0 . A 26 GLN CG C 13 34.8 . A 26 GLN N N 15 119.6 . A 26 GLN NE2 N 15 113.0 . A 27 ILE H H 1 7.84 . A 27 ILE HA H 1 3.18 . A 27 ILE HB H 1 1.67 . A 27 ILE HD1% H 1 0.55 . A 27 ILE HG1y H 1 1.73 . A 27 ILE HG1x H 1 0.73 . A 27 ILE HG2% H 1 0.75 . A 27 ILE CA C 13 65.9 . A 27 ILE CB C 13 37.7 . A 27 ILE CD1 C 13 14.8 . A 27 ILE CG1 C 13 30.9 . A 27 ILE CG2 C 13 17.3 . A 27 ILE N N 15 119.2 . A 28 GLU H H 1 7.70 . A 28 GLU HA H 1 3.63 . A 28 GLU HBx H 1 1.96 . A 28 GLU HBy H 1 1.96 . A 28 GLU HGy H 1 2.10 . A 28 GLU HGx H 1 2.00 . A 28 GLU CA C 13 59.4 . A 28 GLU CB C 13 29.2 . A 28 GLU CG C 13 35.7 . A 28 GLU N N 15 118.5 . A 29 SER H H 1 7.59 . A 29 SER HA H 1 3.97 . A 29 SER HBy H 1 3.62 . A 29 SER HBx H 1 3.55 . A 29 SER CA C 13 60.9 . A 29 SER CB C 13 62.3 . A 29 SER N N 15 113.1 . A 30 TYR H H 1 7.79 . A 30 TYR HA H 1 4.07 . A 30 TYR HBy H 1 0.84 . A 30 TYR HBx H 1 0.10 . A 30 TYR HDx H 1 6.50 . A 30 TYR HDy H 1 6.50 . A 30 TYR HEx H 1 6.74 . A 30 TYR HEy H 1 6.74 . A 30 TYR CA C 13 58.3 . A 30 TYR CB C 13 33.6 . A 30 TYR CD1 C 13 131.5 . A 30 TYR CE1 C 13 117.3 . A 30 TYR N N 15 121.2 . A 31 ARG H H 1 8.21 . A 31 ARG HA H 1 3.75 . A 31 ARG HBx H 1 1.64 . A 31 ARG HBy H 1 1.64 . A 31 ARG HDy H 1 2.98 . A 31 ARG HDx H 1 2.66 . A 31 ARG HGx H 1 0.75 . A 31 ARG HGy H 1 0.80 . A 31 ARG CA C 13 59.7 . A 31 ARG CB C 13 29.9 . A 31 ARG CD C 13 43.1 . A 31 ARG CG C 13 26.8 . A 31 ARG N N 15 120.0 . A 32 GLN H H 1 7.44 . A 32 GLN HA H 1 4.26 . A 32 GLN HBx H 1 1.97 . A 32 GLN HBy H 1 2.16 . A 32 GLN HE2x H 1 6.81 . A 32 GLN HE2y H 1 7.39 . A 32 GLN HGx H 1 2.34 . A 32 GLN HGy H 1 2.48 . A 32 GLN CA C 13 56.0 . A 32 GLN CB C 13 28.6 . A 32 GLN CG C 13 33.9 . A 32 GLN N N 15 114.2 . A 32 GLN NE2 N 15 111.0 . A 33 GLY H H 1 7.50 . A 33 GLY HAy H 1 4.32 . A 33 GLY HAx H 1 3.82 . A 33 GLY CA C 13 46.2 . A 33 GLY N N 15 107.2 . A 34 ALA H H 1 8.50 . A 34 ALA HA H 1 4.49 . A 34 ALA HB% H 1 1.43 . A 34 ALA CA C 13 53.5 . A 34 ALA CB C 13 21.2 . A 34 ALA N N 15 125.2 . A 35 TRP H H 1 7.92 . A 35 TRP HA H 1 4.58 . A 35 TRP HBx H 1 3.23 . A 35 TRP HBy H 1 3.23 . A 35 TRP HD1 H 1 7.03 . A 35 TRP HE3 H 1 7.12 . A 35 TRP HH2 H 1 6.79 . A 35 TRP HZ2 H 1 6.69 . A 35 TRP HZ3 H 1 7.05 . A 35 TRP CA C 13 53.4 . A 35 TRP CB C 13 31.0 . A 35 TRP CD1 C 13 126.0 . A 35 TRP CE3 C 13 118.5 . A 35 TRP CH2 C 13 123.1 . A 35 TRP CZ2 C 13 114.8 . A 35 TRP CZ3 C 13 122.4 . A 35 TRP N N 15 116.7 . A 36 ILE H H 1 11.20 . A 36 ILE HA H 1 4.45 . A 36 ILE HB H 1 1.90 . A 36 ILE HD1% H 1 1.02 . A 36 ILE HG1x H 1 1.28 . A 36 ILE HG1y H 1 1.84 . A 36 ILE HG2% H 1 0.94 . A 36 ILE CA C 13 60.2 . A 36 ILE CB C 13 40.6 . A 36 ILE CD1 C 13 13.0 . A 36 ILE CG1 C 13 26.9 . A 36 ILE CG2 C 13 17.0 . A 36 ILE N N 15 124.5 . A 37 GLU H H 1 9.25 . A 37 GLU HA H 1 2.78 . A 37 GLU HBy H 1 1.83 . A 37 GLU HBx H 1 1.78 . A 37 GLU HGx H 1 2.12 . A 37 GLU HGy H 1 2.12 . A 37 GLU CA C 13 57.7 . A 37 GLU CB C 13 28.2 . A 37 GLU CG C 13 35.9 . A 37 GLU N N 15 134.5 . A 38 GLY H H 1 9.34 . A 38 GLY HAy H 1 4.49 . A 38 GLY HAx H 1 3.41 . A 38 GLY CA C 13 44.7 . A 38 GLY N N 15 115.6 . A 39 VAL H H 1 7.87 . A 39 VAL HA H 1 4.01 . A 39 VAL HB H 1 1.74 . A 39 VAL HGx% H 1 0.17 . A 39 VAL HGy% H 1 0.73 . A 39 VAL CA C 13 63.8 . A 39 VAL CB C 13 33.2 . A 39 VAL CG1 C 13 18.8 . A 39 VAL CG2 C 13 20.5 . A 39 VAL N N 15 121.1 . A 40 HIS H H 1 8.18 . A 40 HIS HA H 1 3.93 . A 40 HIS HBx H 1 2.36 . A 40 HIS HBy H 1 2.80 . A 40 HIS HD2 H 1 5.88 . A 40 HIS CA C 13 60.0 . A 40 HIS CB C 13 32.7 . A 40 HIS CD2 C 13 113.9 . A 40 HIS N N 15 112.4 . A 41 PHE H H 1 7.39 . A 41 PHE HA H 1 6.09 . A 41 PHE HBx H 1 2.70 . A 41 PHE HBy H 1 3.02 . A 41 PHE HDx H 1 7.02 . A 41 PHE HDy H 1 7.02 . A 41 PHE HEx H 1 7.33 . A 41 PHE HEy H 1 7.33 . A 41 PHE HZ H 1 7.58 . A 41 PHE CA C 13 55.3 . A 41 PHE CB C 13 42.0 . A 41 PHE CD1 C 13 131.0 . A 41 PHE CE1 C 13 131.2 . A 41 PHE CZ C 13 131.4 . A 41 PHE N N 15 111.0 . A 42 LYS H H 1 9.59 . A 42 LYS HA H 1 4.63 . A 42 LYS HBx H 1 1.49 . A 42 LYS HBy H 1 1.51 . A 42 LYS HDx H 1 0.49 . A 42 LYS HDy H 1 0.86 . A 42 LYS HEy H 1 1.82 . A 42 LYS HEx H 1 1.12 . A 42 LYS HGx H 1 0.79 . A 42 LYS HGy H 1 0.79 . A 42 LYS CA C 13 55.3 . A 42 LYS CB C 13 35.5 . A 42 LYS CD C 13 29.1 . A 42 LYS CE C 13 40.9 . A 42 LYS CG C 13 23.3 . A 42 LYS N N 15 119.3 . A 43 ARG H H 1 9.36 . A 43 ARG HA H 1 5.04 . A 43 ARG HBx H 1 1.74 . A 43 ARG HBy H 1 1.82 . A 43 ARG HDx H 1 3.20 . A 43 ARG HDy H 1 3.20 . A 43 ARG HGx H 1 1.56 . A 43 ARG HGy H 1 1.56 . A 43 ARG CA C 13 55.4 . A 43 ARG CB C 13 31.1 . A 43 ARG CD C 13 43.4 . A 43 ARG CG C 13 27.5 . A 43 ARG N N 15 123.3 . A 44 VAL H H 1 8.31 . A 44 VAL HA H 1 4.33 . A 44 VAL HB H 1 1.87 . A 44 VAL HGx% H 1 0.66 . A 44 VAL HGy% H 1 0.53 . A 44 VAL CA C 13 60.6 . A 44 VAL CB C 13 33.7 . A 44 VAL CG1 C 13 20.8 . A 44 VAL CG2 C 13 20.2 . A 44 VAL N N 15 121.4 . A 45 SER H H 1 8.64 . A 45 SER HA H 1 4.52 . A 45 SER HBx H 1 3.80 . A 45 SER HBy H 1 3.80 . A 45 SER CA C 13 55.9 . A 45 SER CB C 13 63.2 . A 45 SER N N 15 122.1 . A 46 PRO HA H 1 4.31 . A 46 PRO HBy H 1 2.21 . A 46 PRO HBx H 1 1.87 . A 46 PRO HDx H 1 3.50 . A 46 PRO HDy H 1 3.52 . A 46 PRO HGx H 1 1.78 . A 46 PRO HGy H 1 1.94 . A 46 PRO CA C 13 63.5 . A 46 PRO CB C 13 31.7 . A 46 PRO CD C 13 50.4 . A 46 PRO CG C 13 27.3 . A 47 SER H H 1 8.15 . A 47 SER HA H 1 4.38 . A 47 SER HBx H 1 3.80 . A 47 SER HBy H 1 3.89 . A 47 SER CA C 13 58.1 . A 47 SER CB C 13 63.5 . A 47 SER N N 15 113.8 . A 48 GLY H H 1 8.29 . A 48 GLY HAx H 1 3.73 . A 48 GLY HAy H 1 4.05 . A 48 GLY CA C 13 45.2 . A 48 GLY N N 15 110.9 . A 49 GLU H H 1 7.97 . A 49 GLU HA H 1 4.29 . A 49 GLU HBy H 1 2.02 . A 49 GLU HBx H 1 1.87 . A 49 GLU HGy H 1 2.19 . A 49 GLU HGx H 1 2.18 . A 49 GLU CA C 13 56.0 . A 49 GLU CB C 13 30.2 . A 49 GLU CG C 13 36.0 . A 49 GLU N N 15 120.4 . A 50 LYS H H 1 8.54 . A 50 LYS HA H 1 4.29 . A 50 LYS HBx H 1 1.78 . A 50 LYS HBy H 1 1.85 . A 50 LYS HDx H 1 1.66 . A 50 LYS HDy H 1 1.66 . A 50 LYS HEx H 1 2.96 . A 50 LYS HEy H 1 2.96 . A 50 LYS HGy H 1 1.47 . A 50 LYS HGx H 1 1.40 . A 50 LYS CA C 13 56.9 . A 50 LYS CB C 13 32.3 . A 50 LYS CD C 13 29.0 . A 50 LYS CE C 13 41.8 . A 50 LYS CG C 13 24.7 . A 50 LYS N N 15 122.5 . A 51 THR H H 1 7.97 . A 51 THR HA H 1 4.38 . A 51 THR HB H 1 4.25 . A 51 THR HG2% H 1 1.17 . A 51 THR CA C 13 61.3 . A 51 THR CB C 13 69.4 . A 51 THR CG2 C 13 21.2 . A 51 THR N N 15 113.7 . A 52 LEU H H 1 8.15 . A 52 LEU HA H 1 4.36 . A 52 LEU HBy H 1 1.67 . A 52 LEU HBx H 1 1.60 . A 52 LEU HDx% H 1 0.89 . A 52 LEU HDy% H 1 0.85 . A 52 LEU HG H 1 1.60 . A 52 LEU CA C 13 55.2 . A 52 LEU CB C 13 42.1 . A 52 LEU CD1 C 13 24.9 . A 52 LEU CD2 C 13 23.2 . A 52 LEU CG C 13 26.5 . A 52 LEU N N 15 123.2 . A 53 ARG H H 1 8.19 . A 53 ARG HA H 1 4.32 . A 53 ARG HBy H 1 1.86 . A 53 ARG HBx H 1 1.76 . A 53 ARG HDx H 1 3.20 . A 53 ARG HDy H 1 3.20 . A 53 ARG HGy H 1 1.65 . A 53 ARG HGx H 1 1.60 . A 53 ARG CA C 13 55.9 . A 53 ARG CB C 13 30.4 . A 53 ARG CD C 13 43.1 . A 53 ARG CG C 13 26.9 . A 53 ARG N N 15 120.0 . A 54 GLY H H 1 8.27 . A 54 GLY HAy H 1 4.05 . A 54 GLY HAx H 1 3.92 . A 54 GLY CA C 13 45.0 . A 54 GLY N N 15 109.3 . A 55 THR H H 1 8.15 . A 55 THR HA H 1 4.39 . A 55 THR HB H 1 4.02 . A 55 THR HG2% H 1 0.85 . A 55 THR CA C 13 62.2 . A 55 THR CB C 13 70.5 . A 55 THR CG2 C 13 21.0 . A 55 THR N N 15 116.7 . A 56 THR H H 1 8.35 . A 56 THR HA H 1 4.79 . A 56 THR HB H 1 3.87 . A 56 THR HG2% H 1 0.82 . A 56 THR CA C 13 62.5 . A 56 THR CB C 13 69.1 . A 56 THR CG2 C 13 22.2 . A 56 THR N N 15 122.4 . A 57 TRP H H 1 9.15 . A 57 TRP HA H 1 4.88 . A 57 TRP HBx H 1 2.72 . A 57 TRP HBy H 1 3.29 . A 57 TRP HD1 H 1 6.95 . A 57 TRP HE1 H 1 10.12 . A 57 TRP HE3 H 1 7.24 . A 57 TRP HH2 H 1 7.19 . A 57 TRP HZ2 H 1 7.39 . A 57 TRP HZ3 H 1 7.11 . A 57 TRP CA C 13 55.2 . A 57 TRP CB C 13 32.7 . A 57 TRP CD1 C 13 125.8 . A 57 TRP CE3 C 13 119.5 . A 57 TRP CH2 C 13 124.4 . A 57 TRP CZ2 C 13 114.4 . A 57 TRP CZ3 C 13 122.3 . A 57 TRP N N 15 126.8 . A 57 TRP NE1 N 15 129.0 . A 58 TYR H H 1 10.13 . A 58 TYR HA H 1 5.27 . A 58 TYR HBy H 1 2.94 . A 58 TYR HBx H 1 2.73 . A 58 TYR HDx H 1 7.15 . A 58 TYR HDy H 1 7.15 . A 58 TYR HEx H 1 6.63 . A 58 TYR HEy H 1 6.63 . A 58 TYR CA C 13 57.8 . A 58 TYR CB C 13 41.9 . A 58 TYR CD1 C 13 133.3 . A 58 TYR CE1 C 13 117.3 . A 58 TYR N N 15 119.6 . A 59 ASN H H 1 8.27 . A 59 ASN HA H 1 4.02 . A 59 ASN HBy H 1 2.47 . A 59 ASN HBx H 1 0.46 . A 59 ASN HD2x H 1 5.61 . A 59 ASN HD2y H 1 6.68 . A 59 ASN CA C 13 51.2 . A 59 ASN CB C 13 36.9 . A 59 ASN N N 15 123.3 . A 59 ASN ND2 N 15 109.4 . A 60 TYR H H 1 8.54 . A 60 TYR HA H 1 4.06 . A 60 TYR HBx H 1 3.13 . A 60 TYR HBy H 1 3.28 . A 60 TYR HDx H 1 6.87 . A 60 TYR HDy H 1 6.87 . A 60 TYR HEx H 1 6.66 . A 60 TYR HEy H 1 6.66 . A 60 TYR CA C 13 62.9 . A 60 TYR CB C 13 35.3 . A 60 TYR CD1 C 13 132.5 . A 60 TYR CE1 C 13 117.7 . A 60 TYR N N 15 125.3 . A 61 PRO HA H 1 3.76 . A 61 PRO HBy H 1 2.12 . A 61 PRO HBx H 1 1.69 . A 61 PRO HDx H 1 3.78 . A 61 PRO HDy H 1 3.99 . A 61 PRO HGx H 1 1.90 . A 61 PRO HGy H 1 1.96 . A 61 PRO CA C 13 66.1 . A 61 PRO CB C 13 30.2 . A 61 PRO CD C 13 49.0 . A 61 PRO CG C 13 28.0 . A 62 GLU H H 1 7.11 . A 62 GLU HA H 1 4.03 . A 62 GLU HBy H 1 1.62 . A 62 GLU HBx H 1 1.44 . A 62 GLU HGx H 1 1.82 . A 62 GLU HGy H 1 1.88 . A 62 GLU CA C 13 57.9 . A 62 GLU CB C 13 28.8 . A 62 GLU CG C 13 34.9 . A 62 GLU N N 15 115.3 . A 63 ILE H H 1 8.16 . A 63 ILE HA H 1 3.40 . A 63 ILE HB H 1 1.68 . A 63 ILE HD1% H 1 0.49 . A 63 ILE HG1y H 1 1.36 . A 63 ILE HG1x H 1 -0.26 . A 63 ILE HG2% H 1 0.87 . A 63 ILE CA C 13 65.3 . A 63 ILE CB C 13 37.6 . A 63 ILE CD1 C 13 15.7 . A 63 ILE CG1 C 13 30.3 . A 63 ILE CG2 C 13 17.2 . A 63 ILE N N 15 123.8 . A 64 ASN H H 1 9.03 . A 64 ASN HA H 1 4.27 . A 64 ASN HBy H 1 2.33 . A 64 ASN HBx H 1 1.97 . A 64 ASN HD2x H 1 6.54 . A 64 ASN HD2y H 1 7.45 . A 64 ASN CA C 13 56.2 . A 64 ASN CB C 13 38.0 . A 64 ASN N N 15 120.0 . A 64 ASN ND2 N 15 112.2 . A 65 LYS H H 1 7.32 . A 65 LYS HA H 1 3.81 . A 65 LYS HBx H 1 1.81 . A 65 LYS HBy H 1 1.88 . A 65 LYS HDx H 1 1.63 . A 65 LYS HDy H 1 1.63 . A 65 LYS HEx H 1 2.91 . A 65 LYS HEy H 1 2.91 . A 65 LYS HGy H 1 1.48 . A 65 LYS HGx H 1 1.35 . A 65 LYS CA C 13 59.5 . A 65 LYS CB C 13 32.2 . A 65 LYS CD C 13 29.3 . A 65 LYS CE C 13 41.8 . A 65 LYS CG C 13 24.6 . A 65 LYS N N 15 118.5 . A 66 PHE H H 1 7.77 . A 66 PHE HA H 1 4.24 . A 66 PHE HBx H 1 3.21 . A 66 PHE HBy H 1 3.50 . A 66 PHE HDx H 1 7.20 . A 66 PHE HDy H 1 7.20 . A 66 PHE HEx H 1 6.90 . A 66 PHE HEy H 1 6.90 . A 66 PHE CA C 13 61.0 . A 66 PHE CB C 13 38.3 . A 66 PHE CD1 C 13 131.4 . A 66 PHE CE1 C 13 131.4 . A 66 PHE N N 15 119.9 . A 67 ILE H H 1 8.78 . A 67 ILE HA H 1 3.52 . A 67 ILE HB H 1 2.06 . A 67 ILE HD1% H 1 1.01 . A 67 ILE HG1x H 1 1.34 . A 67 ILE HG1y H 1 2.03 . A 67 ILE HG2% H 1 0.98 . A 67 ILE CA C 13 64.6 . A 67 ILE CB C 13 37.9 . A 67 ILE CD1 C 13 13.5 . A 67 ILE CG1 C 13 28.1 . A 67 ILE CG2 C 13 16.8 . A 67 ILE N N 15 121.0 . A 68 ARG H H 1 8.05 . A 68 ARG HA H 1 3.95 . A 68 ARG HBy H 1 1.88 . A 68 ARG HBx H 1 1.87 . A 68 ARG HDy H 1 3.14 . A 68 ARG HDx H 1 3.11 . A 68 ARG HGy H 1 1.73 . A 68 ARG HGx H 1 1.56 . A 68 ARG CA C 13 58.9 . A 68 ARG CB C 13 29.7 . A 68 ARG CD C 13 43.0 . A 68 ARG CG C 13 26.7 . A 68 ARG N N 15 120.4 . A 69 ASP H H 1 8.37 . A 69 ASP HA H 1 4.43 . A 69 ASP HBx H 1 2.54 . A 69 ASP HBy H 1 2.62 . A 69 ASP CA C 13 56.1 . A 69 ASP CB C 13 40.4 . A 69 ASP N N 15 118.4 . A 70 SER H H 1 7.84 . A 70 SER HA H 1 4.16 . A 70 SER HBx H 1 3.57 . A 70 SER HBy H 1 3.58 . A 70 SER CA C 13 59.9 . A 70 SER CB C 13 62.9 . A 70 SER N N 15 114.9 . A 71 LEU H H 1 7.70 . A 71 LEU HA H 1 4.19 . A 71 LEU HBx H 1 1.52 . A 71 LEU HBy H 1 1.74 . A 71 LEU HDx% H 1 0.80 . A 71 LEU HDy% H 1 0.88 . A 71 LEU HG H 1 1.64 . A 71 LEU CA C 13 56.0 . A 71 LEU CB C 13 41.9 . A 71 LEU CD1 C 13 23.0 . A 71 LEU CD2 C 13 24.9 . A 71 LEU CG C 13 27.0 . A 71 LEU N N 15 122.1 . A 72 GLU H H 1 7.92 . A 72 GLU HA H 1 4.09 . A 72 GLU HBx H 1 1.89 . A 72 GLU HBy H 1 1.89 . A 72 GLU HGx H 1 2.10 . A 72 GLU HGy H 1 2.20 . A 72 GLU CA C 13 56.9 . A 72 GLU CB C 13 29.5 . A 72 GLU CG C 13 36.0 . A 72 GLU N N 15 118.9 . A 73 HIS H H 1 7.96 . A 73 HIS HA H 1 4.51 . A 73 HIS HBx H 1 2.98 . A 73 HIS HBy H 1 2.98 . A 73 HIS CA C 13 55.5 . A 73 HIS CB C 13 29.9 . A 73 HIS N N 15 117.8 . A 74 HIS H H 1 8.06 . A 74 HIS N N 15 125.3 . stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 GLN HA A 4 ILE H 1.0 1.8 2.99 2 2 A 4 ILE H A 3 GLN HBy 1.0 1.8 4.83 3 3 A 4 ILE H A 3 GLN HBx 1.0 1.8 4.83 4 4 A 4 ILE H A 4 ILE HB 1.0 1.8 3.54 5 5 A 4 ILE H A 4 ILE HG1y 1.0 1.8 4.55 6 6 A 4 ILE H A 4 ILE HG1x 1.0 1.8 4.55 7 7 A 4 ILE HA A 5 ILE H 1.0 1.8 3.01 8 8 A 5 ILE H A 4 ILE HG2% 1.0 1.8 4.04 9 9 A 5 ILE H A 5 ILE HG1x 1.0 1.8 4.86 10 10 A 5 ILE H A 5 ILE HB 1.0 1.8 3.60 11 11 A 5 ILE H A 5 ILE HD1% 1.0 1.8 4.63 12 12 A 5 ILE H A 5 ILE HG1y 1.0 1.8 4.86 13 13 A 4 ILE H A 5 ILE H 1.0 1.8 5.33 14 14 A 5 ILE H A 6 PHE H 1.0 1.8 5.08 15 15 A 6 PHE H A 5 ILE HA 1.0 1.8 3.12 16 16 A 5 ILE HB A 6 PHE H 1.0 1.8 6.03 17 17 A 6 PHE H A 5 ILE HG2% 1.0 1.8 3.69 18 18 A 6 PHE H A 6 PHE HBy 1.0 1.8 4.32 19 19 A 6 PHE H A 6 PHE HBx 1.0 1.8 4.32 20 20 A 6 PHE HA A 7 ASN H 1.0 1.8 3.73 21 21 A 7 ASN H A 8 GLU H 1.0 1.8 4.79 22 22 A 8 GLU H A 8 GLU HBy 1.0 1.8 4.47 23 23 A 8 GLU H A 8 GLU HBx 1.0 1.8 4.47 24 24 A 8 GLU H A 8 GLU HGx 1.0 1.8 4.85 25 25 A 8 GLU H A 8 GLU HGy 1.0 1.8 4.85 26 26 A 8 GLU H A 9 GLU H 1.0 1.8 5.18 27 27 A 9 GLU H A 8 GLU HA 1.0 1.8 3.78 28 28 A 9 GLU H A 8 GLU HGx 1.0 1.8 6.60 29 29 A 9 GLU H A 8 GLU HGy 1.0 1.8 6.60 30 30 A 9 GLU H A 10 TRP H 1.0 1.8 4.75 31 31 A 10 TRP H A 9 GLU HA 1.0 1.8 3.81 32 32 A 10 TRP H A 10 TRP HBx 1.0 1.8 4.14 33 33 A 10 TRP H A 10 TRP HBy 1.0 1.8 4.14 34 34 A 10 TRP H A 10 TRP HD1 1.0 1.8 4.27 35 35 A 10 TRP H A 11 MET H 1.0 1.8 6.08 36 36 A 11 MET H A 12 VAL H 1.0 1.8 6.43 37 37 A 11 MET H A 10 TRP HA 1.0 1.8 3.36 38 38 A 11 MET H A 10 TRP HE3 1.0 1.8 5.47 39 39 A 11 MET H A 11 MET HGx 1.0 1.8 4.65 40 40 A 11 MET H A 11 MET HGy 1.0 1.8 4.65 41 41 A 12 VAL H A 11 MET HA 1.0 1.8 3.36 42 42 A 12 VAL H A 11 MET HBx 1.0 1.8 4.76 43 43 A 12 VAL H A 12 VAL HB 1.0 1.8 4.58 44 44 A 12 VAL H A 12 VAL HGx% 1.0 1.8 3.50 45 45 A 12 VAL H A 12 VAL HGy% 1.0 1.8 3.25 46 46 A 12 VAL H A 13 GLU H 1.0 1.8 6.60 47 47 A 12 VAL HB A 13 GLU H 1.0 1.8 3.49 48 48 A 13 GLU H A 13 GLU HBx 1.0 1.8 4.07 49 49 A 13 GLU H A 16 LEU HBy 1.0 1.8 6.60 50 50 A 13 GLU H A 13 GLU HGy 1.0 1.8 5.24 51 51 A 13 GLU H A 14 LYS H 1.0 1.8 4.16 52 52 A 12 VAL HB A 14 LYS H 1.0 1.8 3.99 53 53 A 14 LYS H A 13 GLU HBy 1.0 1.8 4.51 54 54 A 13 GLU HBx A 14 LYS H 1.0 1.8 3.45 55 55 A 14 LYS H A 13 GLU HGx 1.0 1.8 4.06 56 56 A 14 LYS H A 17 MET HE% 1.0 1.8 4.28 57 57 A 14 LYS H A 14 LYS HBy 1.0 1.8 3.31 58 58 A 14 LYS H A 14 LYS HBx 1.0 1.8 3.16 59 59 A 14 LYS H A 14 LYS HGy 1.0 1.8 4.86 60 60 A 14 LYS H A 14 LYS HGx 1.0 1.8 4.99 61 61 A 14 LYS H A 14 LYS HDy 1.0 1.8 5.25 62 62 A 14 LYS H A 15 ALA H 1.0 1.8 3.72 63 63 A 14 LYS HBy A 15 ALA H 1.0 1.8 3.92 64 64 A 14 LYS HBx A 15 ALA H 1.0 1.8 4.63 65 65 A 14 LYS HGy A 15 ALA H 1.0 1.8 5.69 66 66 A 14 LYS HGx A 15 ALA H 1.0 1.8 6.60 67 67 A 14 LYS HDy A 15 ALA H 1.0 1.8 4.11 68 68 A 15 ALA H A 15 ALA HB% 1.0 1.8 3.08 69 69 A 15 ALA H A 16 LEU H 1.0 1.8 3.37 70 70 A 16 LEU HBy A 16 LEU H 1.0 1.8 3.81 71 71 A 16 LEU H A 16 LEU HBx 1.0 1.8 4.03 72 72 A 15 ALA HB% A 16 LEU H 1.0 1.8 3.45 73 73 A 16 LEU H A 16 LEU HDy% 1.0 1.8 5.01 74 74 A 16 LEU H A 17 MET H 1.0 1.8 3.98 75 75 A 17 MET H A 14 LYS HA 1.0 1.8 4.27 76 76 A 16 LEU HBy A 17 MET H 1.0 1.8 4.27 77 77 A 16 LEU HBx A 17 MET H 1.0 1.8 5.20 78 78 A 15 ALA HB% A 17 MET H 1.0 1.8 5.90 79 79 A 17 MET H A 16 LEU HG 1.0 1.8 6.24 80 80 A 16 LEU HDy% A 17 MET H 1.0 1.8 6.60 81 81 A 17 MET H A 17 MET HBx 1.0 1.8 3.42 82 82 A 17 MET H A 17 MET HGy 1.0 1.8 4.03 83 83 A 17 MET H A 17 MET HGx 1.0 1.8 4.03 84 84 A 17 MET H A 18 VAL H 1.0 1.8 3.92 85 85 A 17 MET HBx A 18 VAL H 1.0 1.8 4.83 86 86 A 18 VAL H A 17 MET HBy 1.0 1.8 5.24 87 87 A 18 VAL H A 18 VAL HB 1.0 1.8 3.22 88 88 A 18 VAL H A 19 ARG H 1.0 1.8 3.64 89 89 A 18 VAL HB A 19 ARG H 1.0 1.8 3.66 90 90 A 19 ARG H A 18 VAL HGx% 1.0 1.8 4.29 91 91 A 19 ARG H A 19 ARG HBx 1.0 1.8 3.96 92 92 A 19 ARG H A 19 ARG HBy 1.0 1.8 3.96 93 93 A 19 ARG H A 20 THR H 1.0 1.8 3.58 94 94 A 20 THR H A 19 ARG HBx 1.0 1.8 4.68 95 95 A 20 THR H A 19 ARG HBy 1.0 1.8 4.68 96 96 A 20 THR H A 20 THR HG2% 1.0 1.8 3.81 97 97 A 20 THR H A 21 GLY H 1.0 1.8 3.32 98 98 A 20 THR HG2% A 21 GLY H 1.0 1.8 6.00 99 99 A 21 GLY H A 22 LEU H 1.0 1.8 3.67 100 100 A 22 LEU H A 22 LEU HBy 1.0 1.8 3.43 101 101 A 22 LEU H A 22 LEU HDx% 1.0 1.8 3.63 102 102 A 66 PHE H A 69 ASP H 1.0 1.8 6.60 103 103 A 22 LEU H A 23 GLY H 1.0 1.8 6.60 104 104 A 23 GLY H A 22 LEU HA 1.0 1.8 3.17 105 105 A 22 LEU HBy A 23 GLY H 1.0 1.8 5.12 106 106 A 23 GLY H A 22 LEU HG 1.0 1.8 5.19 107 107 A 23 GLY H A 22 LEU HDy% 1.0 1.8 4.31 108 108 A 23 GLY H A 24 ALA H 1.0 1.8 4.98 109 109 A 24 ALA H A 23 GLY HAy 1.0 1.8 3.23 110 110 A 24 ALA H A 23 GLY HAx 1.0 1.8 3.23 111 111 A 24 ALA H A 24 ALA HB% 1.0 1.8 2.87 112 112 A 24 ALA H A 25 ARG H 1.0 1.8 6.46 113 113 A 25 ARG H A 25 ARG HGy 1.0 1.8 6.60 114 114 A 25 ARG H A 25 ARG HGx 1.0 1.8 6.60 115 115 A 25 ARG H A 26 GLN H 1.0 1.8 6.60 116 116 A 26 GLN H A 25 ARG HGy 1.0 1.8 6.60 117 117 A 26 GLN H A 25 ARG HGx 1.0 1.8 6.60 118 118 A 26 GLN H A 26 GLN HBx 1.0 1.8 4.28 119 119 A 26 GLN H A 26 GLN HBy 1.0 1.8 4.28 120 120 A 26 GLN H A 26 GLN HGx 1.0 1.8 5.21 121 121 A 26 GLN H A 26 GLN HGy 1.0 1.8 5.21 122 122 A 26 GLN H A 27 ILE H 1.0 1.8 4.00 123 123 A 17 MET HE% A 27 ILE H 1.0 1.8 6.20 124 124 A 27 ILE H A 27 ILE HB 1.0 1.8 3.40 125 125 A 27 ILE H A 27 ILE HD1% 1.0 1.8 4.14 126 126 A 27 ILE H A 28 GLU H 1.0 1.8 3.52 127 127 A 27 ILE HB A 28 GLU H 1.0 1.8 3.51 128 128 A 28 GLU H A 27 ILE HG2% 1.0 1.8 3.90 129 129 A 27 ILE HD1% A 28 GLU H 1.0 1.8 5.18 130 130 A 28 GLU H A 28 GLU HBy 1.0 1.8 2.93 131 131 A 28 GLU H A 28 GLU HGx 1.0 1.8 4.00 132 132 A 28 GLU H A 28 GLU HGy 1.0 1.8 3.34 133 133 A 28 GLU H A 29 SER H 1.0 1.8 3.37 134 134 A 28 GLU HGx A 29 SER H 1.0 1.8 4.69 135 135 A 28 GLU HGy A 29 SER H 1.0 1.8 3.64 136 136 A 29 SER H A 29 SER HBx 1.0 1.8 3.27 137 137 A 29 SER H A 29 SER HBy 1.0 1.8 3.47 138 138 A 29 SER H A 30 TYR H 1.0 1.8 3.59 139 139 A 29 SER HBx A 30 TYR H 1.0 1.8 3.76 140 140 A 29 SER HBy A 30 TYR H 1.0 1.8 4.03 141 141 A 30 TYR H A 30 TYR HBy 1.0 1.8 3.84 142 142 A 30 TYR H A 30 TYR HBx 1.0 1.8 4.23 143 143 A 30 TYR H A 30 TYR HD% 1.0 1.8 4.32 144 144 A 30 TYR H A 30 TYR HE% 1.0 1.8 6.60 145 145 A 30 TYR H A 31 ARG H 1.0 1.8 3.58 146 146 A 30 TYR HBy A 31 ARG H 1.0 1.8 3.55 147 147 A 30 TYR HBx A 31 ARG H 1.0 1.8 4.59 148 148 A 30 TYR HD% A 31 ARG H 1.0 1.8 5.69 149 149 A 31 ARG H A 31 ARG HBx 1.0 1.8 3.03 150 150 A 27 ILE HG2% A 31 ARG H 1.0 1.8 5.44 151 151 A 31 ARG H A 32 GLN H 1.0 1.8 3.73 152 152 A 31 ARG HBx A 32 GLN H 1.0 1.8 3.98 153 153 A 32 GLN H A 32 GLN HBx 1.0 1.8 3.95 154 154 A 32 GLN H A 32 GLN HBy 1.0 1.8 3.95 155 155 A 32 GLN H A 32 GLN HGx 1.0 1.8 4.16 156 156 A 32 GLN H A 32 GLN HGy 1.0 1.8 4.16 157 157 A 40 HIS HBy A 41 PHE H 1.0 1.8 6.60 158 158 A 32 GLN H A 33 GLY H 1.0 1.8 3.19 159 159 A 33 GLY H A 32 GLN HBx 1.0 1.8 4.58 160 160 A 33 GLY H A 32 GLN HBy 1.0 1.8 4.58 161 161 A 33 GLY H A 33 GLY HAx 1.0 1.8 3.13 162 162 A 33 GLY H A 34 ALA H 1.0 1.8 3.69 163 163 A 33 GLY HAx A 34 ALA H 1.0 1.8 3.78 164 164 A 34 ALA H A 34 ALA HB% 1.0 1.8 3.11 165 165 A 34 ALA H A 35 TRP H 1.0 1.8 3.50 166 166 A 34 ALA HB% A 35 TRP H 1.0 1.8 3.48 167 167 A 35 TRP H A 35 TRP HBx 1.0 1.8 3.52 168 168 A 35 TRP H A 36 ILE H 1.0 1.8 6.60 169 169 A 36 ILE H A 35 TRP HA 1.0 1.8 3.81 170 170 A 36 ILE H A 35 TRP HBy 1.0 1.8 5.02 171 171 A 36 ILE H A 36 ILE HG1y 1.0 1.8 4.66 172 172 A 36 ILE HA A 37 GLU H 1.0 1.8 3.06 173 173 A 37 GLU H A 36 ILE HB 1.0 1.8 4.60 174 174 A 37 GLU H A 36 ILE HG2% 1.0 1.8 3.66 175 175 A 37 GLU H A 37 GLU HBy 1.0 1.8 4.11 176 176 A 37 GLU H A 37 GLU HBx 1.0 1.8 4.11 177 177 A 37 GLU H A 38 GLY H 1.0 1.8 5.15 178 178 A 38 GLY H A 37 GLU HA 1.0 1.8 3.17 179 179 A 38 GLY H A 39 VAL H 1.0 1.8 3.65 180 180 A 39 VAL H A 39 VAL HB 1.0 1.8 3.53 181 181 A 39 VAL H A 39 VAL HGy% 1.0 1.8 3.50 182 182 A 39 VAL H A 40 HIS H 1.0 1.8 3.26 183 183 A 39 VAL HB A 40 HIS H 1.0 1.8 3.41 184 184 A 40 HIS H A 39 VAL HGx% 1.0 1.8 3.73 185 185 A 39 VAL HGy% A 40 HIS H 1.0 1.8 4.10 186 186 A 40 HIS H A 40 HIS HBx 1.0 1.8 4.31 187 187 A 41 PHE HA A 42 LYS H 1.0 1.8 3.49 188 188 A 42 LYS H A 42 LYS HGx 1.0 1.8 4.85 189 189 A 42 LYS H A 42 LYS HGy 1.0 1.8 4.85 190 190 A 38 GLY H A 42 LYS H 1.0 1.8 6.60 191 191 A 42 LYS H A 43 ARG H 1.0 1.8 6.60 192 192 A 43 ARG H A 42 LYS HA 1.0 1.8 3.25 193 193 A 43 ARG H A 42 LYS HGx 1.0 1.8 5.97 194 194 A 43 ARG H A 42 LYS HGy 1.0 1.8 5.97 195 195 A 43 ARG H A 43 ARG HBx 1.0 1.8 4.09 196 196 A 43 ARG H A 43 ARG HBy 1.0 1.8 4.09 197 197 A 43 ARG H A 43 ARG HDx 1.0 1.8 6.09 198 198 A 43 ARG H A 43 ARG HDy 1.0 1.8 6.09 199 199 A 43 ARG H A 44 VAL H 1.0 1.8 5.48 200 200 A 44 VAL H A 43 ARG HA 1.0 1.8 3.29 201 201 A 44 VAL H A 44 VAL HB 1.0 1.8 3.84 202 202 A 44 VAL H A 44 VAL HGy% 1.0 1.8 3.73 203 203 A 44 VAL H A 44 VAL HGx% 1.0 1.8 5.29 204 204 A 44 VAL HA A 45 SER H 1.0 1.8 3.63 205 205 A 44 VAL HB A 45 SER H 1.0 1.8 5.58 206 206 A 44 VAL HGy% A 45 SER H 1.0 1.8 6.28 207 207 A 48 GLY H A 49 GLU H 1.0 1.8 4.69 208 208 A 49 GLU H A 49 GLU HBy 1.0 1.8 4.09 209 209 A 49 GLU H A 49 GLU HBx 1.0 1.8 4.09 210 210 A 49 GLU HA A 50 LYS H 1.0 1.8 3.52 211 211 A 50 LYS H A 49 GLU HGy 1.0 1.8 6.60 212 212 A 50 LYS H A 49 GLU HGx 1.0 1.8 6.60 213 213 A 50 LYS H A 50 LYS HGy 1.0 1.8 6.60 214 214 A 50 LYS H A 50 LYS HGx 1.0 1.8 6.60 215 215 A 50 LYS H A 50 LYS HDx 1.0 1.8 6.60 216 216 A 50 LYS H A 50 LYS HDy 1.0 1.8 6.60 217 217 A 49 GLU H A 50 LYS H 1.0 1.8 5.84 218 218 A 50 LYS H A 51 THR H 1.0 1.8 6.31 219 219 A 51 THR H A 50 LYS HA 1.0 1.8 3.27 220 220 A 51 THR H A 51 THR HB 1.0 1.8 3.77 221 221 A 51 THR H A 52 LEU H 1.0 1.8 5.15 222 222 A 52 LEU H A 51 THR HA 1.0 1.8 3.76 223 223 A 52 LEU H A 52 LEU HBx 1.0 1.8 4.41 224 224 A 52 LEU H A 52 LEU HBy 1.0 1.8 3.83 225 225 A 52 LEU H A 53 ARG H 1.0 1.8 3.29 226 226 A 53 ARG H A 53 ARG HBx 1.0 1.8 4.39 227 227 A 52 LEU HBy A 53 ARG H 1.0 1.8 4.03 228 228 A 53 ARG H A 54 GLY H 1.0 1.8 3.94 229 229 A 52 LEU HBx A 54 GLY H 1.0 1.8 6.60 230 230 A 52 LEU HBy A 54 GLY H 1.0 1.8 6.60 231 231 A 55 THR H A 55 THR HB 1.0 1.8 4.28 232 232 A 55 THR H A 55 THR HG2% 1.0 1.8 5.73 233 233 A 55 THR H A 56 THR H 1.0 1.8 6.60 234 234 A 56 THR H A 55 THR HA 1.0 1.8 3.18 235 235 A 56 THR H A 56 THR HB 1.0 1.8 3.79 236 236 A 55 THR HG2% A 56 THR H 1.0 1.8 3.48 237 237 A 56 THR HA A 57 TRP H 1.0 1.8 3.52 238 238 A 57 TRP H A 56 THR HG2% 1.0 1.8 3.62 239 239 A 57 TRP H A 57 TRP HD1 1.0 1.8 5.09 240 240 A 58 TYR H A 58 TYR HD% 1.0 1.8 4.87 241 241 A 58 TYR HA A 59 ASN H 1.0 1.8 3.70 242 242 A 58 TYR HD% A 59 ASN H 1.0 1.8 4.95 243 243 A 59 ASN H A 59 ASN HBy 1.0 1.8 4.27 244 244 A 59 ASN H A 59 ASN HBx 1.0 1.8 4.27 245 245 A 59 ASN HA A 60 TYR H 1.0 1.8 3.52 246 246 A 60 TYR H A 60 TYR HBx 1.0 1.8 4.29 247 247 A 60 TYR H A 60 TYR HD% 1.0 1.8 5.96 248 248 A 62 GLU H A 62 GLU HBy 1.0 1.8 4.10 249 249 A 62 GLU H A 62 GLU HGx 1.0 1.8 4.83 250 250 A 62 GLU H A 62 GLU HGy 1.0 1.8 4.83 251 251 A 62 GLU H A 63 ILE H 1.0 1.8 4.21 252 252 A 63 ILE H A 62 GLU HBx 1.0 1.8 5.43 253 253 A 62 GLU HBy A 63 ILE H 1.0 1.8 5.82 254 254 A 63 ILE H A 63 ILE HB 1.0 1.8 3.75 255 255 A 63 ILE H A 64 ASN H 1.0 1.8 4.19 256 256 A 63 ILE HB A 64 ASN H 1.0 1.8 5.05 257 257 A 64 ASN H A 64 ASN HBy 1.0 1.8 3.95 258 258 A 64 ASN H A 64 ASN HBx 1.0 1.8 3.95 259 259 A 64 ASN H A 65 LYS H 1.0 1.8 4.26 260 260 A 65 LYS H A 64 ASN HBy 1.0 1.8 4.73 261 261 A 65 LYS H A 64 ASN HBx 1.0 1.8 4.73 262 262 A 65 LYS H A 65 LYS HBx 1.0 1.8 3.54 263 263 A 65 LYS H A 65 LYS HBy 1.0 1.8 3.54 264 264 A 66 PHE H A 65 LYS H 1.0 1.8 3.89 265 265 A 66 PHE H A 65 LYS HBx 1.0 1.8 4.55 266 266 A 66 PHE H A 65 LYS HBy 1.0 1.8 4.55 267 267 A 66 PHE H A 65 LYS HGy 1.0 1.8 6.60 268 268 A 66 PHE H A 65 LYS HGx 1.0 1.8 6.60 269 269 A 66 PHE H A 66 PHE HBx 1.0 1.8 3.81 270 270 A 66 PHE H A 66 PHE HBy 1.0 1.8 3.81 271 271 A 66 PHE H A 67 ILE H 1.0 1.8 4.15 272 272 A 67 ILE H A 67 ILE HB 1.0 1.8 3.49 273 273 A 67 ILE H A 67 ILE HG1x 1.0 1.8 4.29 274 274 A 67 ILE H A 67 ILE HG1y 1.0 1.8 3.55 275 275 A 67 ILE H A 67 ILE HG2% 1.0 1.8 4.63 276 276 A 67 ILE H A 67 ILE HD1% 1.0 1.8 4.82 277 277 A 67 ILE H A 68 ARG H 1.0 1.8 4.27 278 278 A 67 ILE HB A 68 ARG H 1.0 1.8 3.99 279 279 A 67 ILE HG1x A 68 ARG H 1.0 1.8 6.60 280 280 A 67 ILE HG1y A 68 ARG H 1.0 1.8 4.77 281 281 A 67 ILE HG2% A 68 ARG H 1.0 1.8 4.50 282 282 A 68 ARG H A 68 ARG HBy 1.0 1.8 3.88 283 283 A 68 ARG H A 68 ARG HBx 1.0 1.8 3.88 284 284 A 68 ARG H A 68 ARG HGy 1.0 1.8 5.08 285 285 A 69 ASP H A 68 ARG H 1.0 1.8 4.18 286 286 A 69 ASP H A 68 ARG HBy 1.0 1.8 4.59 287 287 A 69 ASP H A 68 ARG HBx 1.0 1.8 4.59 288 288 A 69 ASP H A 69 ASP HBx 1.0 1.8 3.75 289 289 A 69 ASP H A 69 ASP HBy 1.0 1.8 3.75 290 290 A 69 ASP H A 70 SER H 1.0 1.8 3.98 291 291 A 70 SER H A 69 ASP HBy 1.0 1.8 5.33 292 292 A 70 SER H A 70 SER HBx 1.0 1.8 3.93 293 293 A 70 SER H A 70 SER HBy 1.0 1.8 3.93 294 294 A 70 SER H A 71 LEU H 1.0 1.8 3.98 295 295 A 71 LEU H A 70 SER HBx 1.0 1.8 5.16 296 296 A 71 LEU H A 70 SER HBy 1.0 1.8 5.16 297 297 A 71 LEU H A 71 LEU HBx 1.0 1.8 4.10 298 298 A 71 LEU H A 71 LEU HBy 1.0 1.8 4.10 299 299 A 71 LEU H A 71 LEU HDx% 1.0 1.8 4.75 300 300 A 71 LEU H A 71 LEU HDy% 1.0 1.8 4.72 301 301 A 71 LEU H A 72 GLU H 1.0 1.8 3.73 302 302 A 73 HIS H A 72 GLU HBx 1.0 1.8 6.60 303 303 A 73 HIS H A 72 GLU HBy 1.0 1.8 6.60 304 304 A 4 ILE HG2% A 6 PHE H 1.0 1.8 5.36 305 305 A 12 VAL H A 57 TRP HZ3 1.0 1.8 5.57 306 306 A 12 VAL H A 15 ALA HB% 1.0 1.8 4.03 307 307 A 13 GLU H A 58 TYR HE% 1.0 1.8 5.30 308 308 A 12 VAL HGy% A 14 LYS H 1.0 1.8 3.51 309 309 A 14 LYS H A 17 MET H 1.0 1.8 5.43 310 310 A 14 LYS H A 16 LEU H 1.0 1.8 5.78 311 311 A 15 ALA H A 18 VAL HGy% 1.0 1.8 6.24 312 312 A 12 VAL HGy% A 15 ALA H 1.0 1.8 3.13 313 313 A 15 ALA H A 17 MET H 1.0 1.8 5.32 314 314 A 16 LEU H A 18 VAL H 1.0 1.8 5.36 315 315 A 16 LEU HDy% A 20 THR H 1.0 1.8 6.60 316 316 A 20 THR H A 20 THR HG1 1.0 1.8 3.84 317 317 A 20 THR H A 22 LEU H 1.0 1.8 5.09 318 318 A 19 ARG H A 21 GLY H 1.0 1.8 5.05 319 319 A 21 GLY H A 20 THR HG1 1.0 1.8 4.22 320 320 A 22 LEU H A 17 MET HA 1.0 1.8 4.63 321 321 A 23 GLY H A 25 ARG H 1.0 1.8 5.22 322 322 A 24 ALA H A 26 GLN H 1.0 1.8 5.43 323 323 A 23 GLY H A 26 GLN HBx 1.0 1.8 6.01 324 324 A 23 GLY H A 26 GLN HBy 1.0 1.8 6.01 325 325 A 17 MET HBy A 23 GLY H 1.0 1.8 5.04 326 326 A 17 MET HE% A 24 ALA H 1.0 1.8 3.48 327 327 A 22 LEU HDx% A 26 GLN HE2x 1.0 1.8 5.30 328 328 A 22 LEU HDy% A 27 ILE H 1.0 1.8 5.47 329 329 A 28 GLU H A 31 ARG H 1.0 1.8 5.43 330 330 A 26 GLN H A 28 GLU H 1.0 1.8 5.62 331 331 A 29 SER H A 31 ARG HBx 1.0 1.8 5.51 332 332 A 28 GLU H A 25 ARG HA 1.0 1.8 4.57 333 333 A 30 TYR H A 31 ARG HBx 1.0 1.8 5.31 334 334 A 30 TYR H A 32 GLN H 1.0 1.8 4.72 335 335 A 31 ARG H A 34 ALA H 1.0 1.8 6.03 336 336 A 32 GLN H A 29 SER HA 1.0 1.8 5.54 337 337 A 33 GLY H A 30 TYR HA 1.0 1.8 5.02 338 338 A 34 ALA H A 30 TYR HA 1.0 1.8 4.71 339 339 A 36 ILE H A 39 VAL H 1.0 1.8 5.96 340 340 A 38 GLY H A 40 HIS H 1.0 1.8 5.28 341 341 A 38 GLY H A 42 LYS HBx 1.0 1.8 6.47 342 342 A 38 GLY H A 42 LYS HBy 1.0 1.8 6.47 343 343 A 37 GLU HA A 39 VAL H 1.0 1.8 4.59 344 344 A 36 ILE HG2% A 40 HIS H 1.0 1.8 5.03 345 345 A 36 ILE HB A 40 HIS H 1.0 1.8 4.49 346 346 A 41 PHE H A 39 VAL H 1.0 1.8 4.08 347 347 A 41 PHE H A 40 HIS H 1.0 1.8 3.51 348 348 A 41 PHE H A 41 PHE HD% 1.0 1.8 4.57 349 349 A 41 PHE H A 40 HIS HBx 1.0 1.8 4.09 350 350 A 41 PHE H A 39 VAL HB 1.0 1.8 4.88 351 351 A 42 LYS H A 10 TRP HZ3 1.0 1.8 4.96 352 352 A 42 LYS H A 57 TRP H 1.0 1.8 4.19 353 353 A 43 ARG H A 44 VAL HGy% 1.0 1.8 5.84 354 354 A 31 ARG H A 27 ILE HA 1.0 1.8 5.87 355 355 A 55 THR HB A 57 TRP HE1 1.0 1.8 4.68 356 356 A 44 VAL HB A 57 TRP HE1 1.0 1.8 4.82 357 357 A 55 THR HG2% A 57 TRP HE1 1.0 1.8 4.03 358 358 A 44 VAL HGy% A 57 TRP HE1 1.0 1.8 4.41 359 359 A 43 ARG HA A 57 TRP H 1.0 1.8 5.25 360 360 A 41 PHE HA A 59 ASN H 1.0 1.8 5.37 361 361 A 10 TRP HA A 60 TYR H 1.0 1.8 4.57 362 362 A 59 ASN H A 40 HIS HA 1.0 1.8 4.89 363 363 A 60 TYR H A 9 GLU HBx 1.0 1.8 6.60 364 364 A 60 TYR H A 9 GLU HBy 1.0 1.8 6.60 365 365 A 60 TYR H A 11 MET HE% 1.0 1.8 5.13 366 366 A 65 LYS H A 62 GLU HA 1.0 1.8 5.25 367 367 A 59 ASN H A 62 GLU HBy 1.0 1.8 6.60 368 368 A 58 TYR H A 12 VAL HA 1.0 1.8 6.60 369 369 A 10 TRP HE1 A 8 GLU HGx 1.0 1.8 6.60 370 370 A 10 TRP HE1 A 8 GLU HGy 1.0 1.8 6.60 371 371 A 10 TRP HE1 A 8 GLU HBy 1.0 1.8 5.28 372 372 A 10 TRP HE1 A 8 GLU HBx 1.0 1.8 5.28 373 373 A 11 MET H A 10 TRP HBx 1.0 1.8 6.60 374 374 A 12 VAL H A 15 ALA H 1.0 1.8 5.85 375 375 A 17 MET H A 20 THR HG1 1.0 1.8 6.60 376 376 A 17 MET H A 13 GLU HA 1.0 1.8 5.21 377 377 A 17 MET HE% A 16 LEU H 1.0 1.8 6.60 378 378 A 16 LEU H A 18 VAL HB 1.0 1.8 6.60 379 379 A 17 MET H A 27 ILE HD1% 1.0 1.8 4.85 380 380 A 21 GLY H A 18 VAL HA 1.0 1.8 4.96 381 381 A 20 THR HG2% A 22 LEU H 1.0 1.8 4.89 382 382 A 24 ALA H A 27 ILE HD1% 1.0 1.8 6.60 383 383 A 32 GLN H A 28 GLU HA 1.0 1.8 6.60 384 384 A 29 SER HBx A 32 GLN H 1.0 1.8 6.60 385 385 A 22 LEU HDy% A 30 TYR H 1.0 1.8 6.60 386 386 A 28 GLU HGy A 30 TYR H 1.0 1.8 6.60 387 387 A 30 TYR H A 27 ILE HA 1.0 1.8 6.40 388 388 A 34 ALA H A 31 ARG HA 1.0 1.8 6.60 389 389 A 35 TRP H A 31 ARG HA 1.0 1.8 4.50 390 390 A 33 GLY HAx A 35 TRP H 1.0 1.8 5.03 391 391 A 41 PHE H A 38 GLY H 1.0 1.8 4.17 392 392 A 33 GLY H A 35 TRP H 1.0 1.8 6.43 393 393 A 44 VAL H A 56 THR HA 1.0 1.8 6.60 394 394 A 11 MET H A 59 ASN HA 1.0 1.8 6.60 395 395 A 35 TRP H A 35 TRP HZ3 1.0 1.8 6.60 396 396 A 35 TRP H A 41 PHE HD% 1.0 1.8 6.60 397 397 A 10 TRP H A 9 GLU HGx 1.0 1.8 6.60 398 398 A 10 TRP H A 9 GLU HGy 1.0 1.8 6.60 399 399 A 36 ILE H A 40 HIS HBx 1.0 1.8 6.51 400 400 A 36 ILE H A 40 HIS H 1.0 1.8 4.82 401 401 A 67 ILE H A 63 ILE HG2% 1.0 1.8 6.60 402 402 A 41 PHE H A 39 VAL HGy% 1.0 1.8 5.96 403 403 A 44 VAL H A 55 THR H 1.0 1.8 5.58 404 404 A 66 PHE H A 63 ILE HA 1.0 1.8 4.46 405 405 A 66 PHE H A 68 ARG H 1.0 1.8 5.41 406 406 A 69 ASP H A 66 PHE HA 1.0 1.8 6.60 407 407 A 3 GLN HA A 3 GLN HGx 1.0 1.8 4.10 408 408 A 3 GLN HA A 3 GLN HGy 1.0 1.8 4.10 409 409 A 4 ILE H A 3 GLN HGy 1.0 1.8 6.60 410 410 A 4 ILE H A 4 ILE HG2% 1.0 1.8 5.05 411 411 A 4 ILE HA A 4 ILE HG2% 1.0 1.8 3.73 412 412 A 4 ILE HG2% A 4 ILE HD1% 1.0 1.8 3.22 413 413 A 4 ILE HG2% A 4 ILE HG1y 1.0 1.8 4.13 414 414 A 4 ILE HG2% A 4 ILE HG1x 1.0 1.8 4.13 415 415 A 4 ILE H A 4 ILE HD1% 1.0 1.8 4.39 416 416 A 4 ILE HA A 4 ILE HD1% 1.0 1.8 3.81 417 417 A 4 ILE HB A 4 ILE HD1% 1.0 1.8 3.60 418 418 A 5 ILE H A 4 ILE HD1% 1.0 1.8 4.94 419 419 A 5 ILE HA A 5 ILE HG2% 1.0 1.8 3.54 420 420 A 5 ILE HD1% A 5 ILE HA 1.0 1.8 4.07 421 421 A 5 ILE HB A 5 ILE HD1% 1.0 1.8 3.50 422 422 A 5 ILE H A 5 ILE HG2% 1.0 1.8 4.70 423 423 A 5 ILE HG2% A 5 ILE HG1y 1.0 1.8 3.54 424 424 A 5 ILE HG2% A 5 ILE HG1x 1.0 1.8 3.54 425 425 A 5 ILE HA A 5 ILE HG1y 1.0 1.8 4.60 426 426 A 5 ILE HA A 5 ILE HG1x 1.0 1.8 4.60 427 427 A 4 ILE H A 5 ILE HD1% 1.0 1.8 6.27 428 428 A 5 ILE HD1% A 6 PHE H 1.0 1.8 6.60 429 429 A 6 PHE HA A 6 PHE HD% 1.0 1.8 3.63 430 430 A 8 GLU H A 7 ASN HA 1.0 1.8 3.51 431 431 A 8 GLU H A 7 ASN HBx 1.0 1.8 5.48 432 432 A 8 GLU H A 7 ASN HBy 1.0 1.8 5.48 433 433 A 8 GLU HA A 8 GLU HGx 1.0 1.8 4.68 434 434 A 8 GLU HA A 8 GLU HGy 1.0 1.8 4.68 435 435 A 9 GLU H A 9 GLU HGx 1.0 1.8 5.82 436 436 A 9 GLU H A 9 GLU HGy 1.0 1.8 5.82 437 437 A 10 TRP HA A 10 TRP HE3 1.0 1.8 4.94 438 438 A 11 MET H A 10 TRP HBy 1.0 1.8 6.60 439 439 A 12 VAL H A 11 MET HBy 1.0 1.8 4.76 440 440 A 11 MET H A 11 MET HE% 1.0 1.8 6.39 441 441 A 11 MET HA A 11 MET HE% 1.0 1.8 4.82 442 442 A 11 MET HE% A 11 MET HBy 1.0 1.8 4.16 443 443 A 11 MET HE% A 11 MET HBx 1.0 1.8 4.16 444 444 A 11 MET HE% A 11 MET HGx 1.0 1.8 3.98 445 445 A 11 MET HE% A 11 MET HGy 1.0 1.8 3.98 446 446 A 11 MET HE% A 19 ARG HDy 1.0 1.8 4.87 447 447 A 10 TRP H A 11 MET HE% 1.0 1.8 5.08 448 448 A 12 VAL HGx% A 12 VAL HA 1.0 1.8 3.42 449 449 A 13 GLU H A 12 VAL HA 1.0 1.8 3.83 450 450 A 12 VAL HGx% A 13 GLU H 1.0 1.8 4.76 451 451 A 12 VAL HGy% A 12 VAL HA 1.0 1.8 4.41 452 452 A 12 VAL HGy% A 13 GLU H 1.0 1.8 4.39 453 453 A 13 GLU HGx A 13 GLU HA 1.0 1.8 4.22 454 454 A 16 LEU HBy A 13 GLU HA 1.0 1.8 4.59 455 455 A 13 GLU HGy A 13 GLU HA 1.0 1.8 4.44 456 456 A 13 GLU H A 13 GLU HBy 1.0 1.8 4.33 457 457 A 13 GLU H A 13 GLU HGx 1.0 1.8 6.60 458 458 A 13 GLU HGy A 14 LYS H 1.0 1.8 6.00 459 459 A 14 LYS HGy A 14 LYS HA 1.0 1.8 4.31 460 460 A 14 LYS HDy A 14 LYS HA 1.0 1.8 3.84 461 461 A 14 LYS HA A 14 LYS HDx 1.0 1.8 4.88 462 462 A 14 LYS HGx A 14 LYS HA 1.0 1.8 4.43 463 463 A 14 LYS HGx A 14 LYS HDx 1.0 1.8 3.11 464 464 A 14 LYS HBx A 14 LYS HDy 1.0 1.8 3.93 465 465 A 14 LYS HBy A 14 LYS HDy 1.0 1.8 2.64 466 466 A 14 LYS HGy A 14 LYS HDx 1.0 1.8 2.86 467 467 A 14 LYS HA A 14 LYS HEx 1.0 1.8 6.02 468 468 A 14 LYS HA A 14 LYS HEy 1.0 1.8 6.45 469 469 A 14 LYS HBy A 14 LYS HEy 1.0 1.8 3.08 470 470 A 14 LYS HBx A 14 LYS HEx 1.0 1.8 4.83 471 471 A 14 LYS HGy A 14 LYS HEx 1.0 1.8 3.73 472 472 A 14 LYS HGx A 14 LYS HEx 1.0 1.8 2.92 473 473 A 14 LYS HDy A 14 LYS HEy 1.0 1.8 2.64 474 474 A 15 ALA H A 14 LYS HEy 1.0 1.8 5.30 475 475 A 16 LEU HG A 16 LEU HA 1.0 1.8 4.13 476 476 A 16 LEU HDy% A 16 LEU HA 1.0 1.8 3.55 477 477 A 16 LEU H A 16 LEU HG 1.0 1.8 5.68 478 478 A 16 LEU HDy% A 60 TYR HA 1.0 1.8 4.09 479 479 A 16 LEU HBx A 16 LEU HDy% 1.0 1.8 3.94 480 480 A 16 LEU H A 16 LEU HDx% 1.0 1.8 5.18 481 481 A 16 LEU HA A 16 LEU HDx% 1.0 1.8 6.34 482 482 A 16 LEU HBy A 16 LEU HDx% 1.0 1.8 4.20 483 483 A 16 LEU HBx A 16 LEU HDx% 1.0 1.8 4.53 484 484 A 17 MET H A 16 LEU HDx% 1.0 1.8 6.60 485 485 A 17 MET HA A 17 MET HGy 1.0 1.8 4.38 486 486 A 17 MET HA A 17 MET HGx 1.0 1.8 4.38 487 487 A 17 MET HE% A 17 MET HA 1.0 1.8 4.86 488 488 A 17 MET HE% A 17 MET H 1.0 1.8 3.92 489 489 A 17 MET HE% A 17 MET HBx 1.0 1.8 3.21 490 490 A 17 MET HE% A 18 VAL H 1.0 1.8 6.60 491 491 A 18 VAL HGx% A 18 VAL HA 1.0 1.8 3.52 492 492 A 18 VAL H A 18 VAL HGx% 1.0 1.8 4.19 493 493 A 18 VAL H A 18 VAL HGy% 1.0 1.8 3.19 494 494 A 18 VAL HGy% A 18 VAL HA 1.0 1.8 3.09 495 495 A 19 ARG H A 18 VAL HGy% 1.0 1.8 4.42 496 496 A 19 ARG HA A 19 ARG HDx 1.0 1.8 4.87 497 497 A 19 ARG HA A 19 ARG HDy 1.0 1.8 4.87 498 498 A 20 THR HG2% A 20 THR HA 1.0 1.8 3.87 499 499 A 22 LEU HDx% A 22 LEU HA 1.0 1.8 3.42 500 500 A 22 LEU HDy% A 22 LEU HBx 1.0 1.8 3.86 501 501 A 23 GLY H A 22 LEU HBx 1.0 1.8 5.32 502 502 A 22 LEU H A 22 LEU HG 1.0 1.8 4.58 503 503 A 22 LEU HBy A 22 LEU HDx% 1.0 1.8 3.32 504 504 A 22 LEU HDx% A 22 LEU HBx 1.0 1.8 4.22 505 505 A 22 LEU HDx% A 67 ILE HG1x 1.0 1.8 4.57 506 506 A 22 LEU HDx% A 23 GLY H 1.0 1.8 4.88 507 507 A 22 LEU H A 22 LEU HDy% 1.0 1.8 5.74 508 508 A 22 LEU HA A 22 LEU HDy% 1.0 1.8 4.57 509 509 A 22 LEU HBy A 22 LEU HDy% 1.0 1.8 3.44 510 510 A 24 ALA HB% A 25 ARG H 1.0 1.8 4.85 511 511 A 25 ARG H A 25 ARG HDx 1.0 1.8 6.60 512 512 A 25 ARG H A 25 ARG HDy 1.0 1.8 6.60 513 513 A 25 ARG HA A 25 ARG HDx 1.0 1.8 6.09 514 514 A 25 ARG HA A 25 ARG HDy 1.0 1.8 6.09 515 515 A 26 GLN HA A 26 GLN HGx 1.0 1.8 4.28 516 516 A 26 GLN HA A 26 GLN HGy 1.0 1.8 4.28 517 517 A 27 ILE HD1% A 27 ILE HA 1.0 1.8 4.75 518 518 A 27 ILE H A 27 ILE HG2% 1.0 1.8 4.35 519 519 A 27 ILE HG2% A 27 ILE HA 1.0 1.8 3.83 520 520 A 27 ILE HB A 27 ILE HD1% 1.0 1.8 3.45 521 521 A 27 ILE HD1% A 27 ILE HG2% 1.0 1.8 3.25 522 522 A 28 GLU HGx A 28 GLU HA 1.0 1.8 4.07 523 523 A 28 GLU HGy A 28 GLU HA 1.0 1.8 4.25 524 524 A 29 SER H A 28 GLU HBx 1.0 1.8 4.87 525 525 A 28 GLU HBy A 29 SER H 1.0 1.8 5.22 526 526 A 28 GLU HGx A 28 GLU HBx 1.0 1.8 2.92 527 527 A 28 GLU HBy A 28 GLU HGy 1.0 1.8 2.94 528 528 A 30 TYR HD% A 30 TYR HA 1.0 1.8 3.78 529 529 A 30 TYR HE% A 30 TYR HA 1.0 1.8 4.91 530 530 A 31 ARG HA A 31 ARG HGx 1.0 1.8 4.60 531 531 A 31 ARG HA A 31 ARG HGy 1.0 1.8 4.60 532 532 A 32 GLN H A 31 ARG HBy 1.0 1.8 4.82 533 533 A 32 GLN HA A 32 GLN HGx 1.0 1.8 3.98 534 534 A 32 GLN HA A 32 GLN HGy 1.0 1.8 3.98 535 535 A 35 TRP HA A 35 TRP HE3 1.0 1.8 4.64 536 536 A 35 TRP HBy A 41 PHE HD% 1.0 1.8 5.13 537 537 A 36 ILE HG1y A 36 ILE HA 1.0 1.8 3.73 538 538 A 36 ILE H A 36 ILE HB 1.0 1.8 4.31 539 539 A 36 ILE H A 36 ILE HG2% 1.0 1.8 4.31 540 540 A 36 ILE HA A 36 ILE HG2% 1.0 1.8 3.58 541 541 A 36 ILE HG1y A 36 ILE HG2% 1.0 1.8 3.71 542 542 A 36 ILE HG2% A 36 ILE HD1% 1.0 1.8 2.78 543 543 A 36 ILE H A 36 ILE HG1x 1.0 1.8 4.96 544 544 A 36 ILE HA A 36 ILE HG1x 1.0 1.8 4.26 545 545 A 36 ILE HG2% A 36 ILE HG1x 1.0 1.8 3.77 546 546 A 37 GLU H A 36 ILE HG1x 1.0 1.8 6.60 547 547 A 36 ILE HG1y A 37 GLU H 1.0 1.8 6.37 548 548 A 36 ILE H A 36 ILE HD1% 1.0 1.8 4.70 549 549 A 36 ILE HA A 36 ILE HD1% 1.0 1.8 4.30 550 550 A 36 ILE HB A 36 ILE HD1% 1.0 1.8 3.23 551 551 A 37 GLU H A 36 ILE HD1% 1.0 1.8 5.62 552 552 A 38 GLY H A 37 GLU HGx 1.0 1.8 6.43 553 553 A 38 GLY H A 37 GLU HGy 1.0 1.8 6.43 554 554 A 39 VAL H A 39 VAL HGx% 1.0 1.8 4.43 555 555 A 39 VAL HGx% A 39 VAL HA 1.0 1.8 3.26 556 556 A 39 VAL HGy% A 39 VAL HA 1.0 1.8 3.20 557 557 A 40 HIS HA A 40 HIS HD2 1.0 1.8 5.40 558 558 A 38 GLY H A 42 LYS HA 1.0 1.8 4.08 559 559 A 71 LEU HDx% A 71 LEU HBx 1.0 1.8 3.53 560 560 A 42 LYS HGx A 42 LYS HEy 1.0 1.8 4.66 561 561 A 42 LYS HEy A 42 LYS HGy 1.0 1.8 4.66 562 562 A 42 LYS HGx A 42 LYS HEx 1.0 1.8 4.66 563 563 A 42 LYS HEx A 42 LYS HGy 1.0 1.8 4.66 564 564 A 42 LYS HA A 42 LYS HDx 1.0 1.8 6.60 565 565 A 42 LYS HA A 42 LYS HDy 1.0 1.8 6.60 566 566 A 43 ARG H A 43 ARG HGx 1.0 1.8 5.60 567 567 A 43 ARG H A 43 ARG HGy 1.0 1.8 5.60 568 568 A 43 ARG HA A 43 ARG HDx 1.0 1.8 6.59 569 569 A 43 ARG HA A 43 ARG HDy 1.0 1.8 6.59 570 570 A 44 VAL HGy% A 44 VAL HA 1.0 1.8 3.61 571 571 A 44 VAL HGx% A 44 VAL HA 1.0 1.8 3.62 572 572 A 44 VAL HGx% A 45 SER H 1.0 1.8 5.20 573 573 A 45 SER HA A 46 PRO HDx 1.0 1.8 4.21 574 574 A 45 SER HA A 46 PRO HDy 1.0 1.8 4.21 575 575 A 50 LYS HA A 50 LYS HGx 1.0 1.8 4.50 576 576 A 50 LYS HA A 50 LYS HDx 1.0 1.8 5.96 577 577 A 50 LYS HA A 50 LYS HDy 1.0 1.8 5.96 578 578 A 50 LYS HA A 50 LYS HGy 1.0 1.8 4.50 579 579 A 50 LYS HA A 50 LYS HEx 1.0 1.8 6.04 580 580 A 50 LYS HA A 50 LYS HEy 1.0 1.8 6.04 581 581 A 51 THR HA A 51 THR HG2% 1.0 1.8 3.48 582 582 A 51 THR HB A 51 THR HA 1.0 1.8 3.30 583 583 A 51 THR HB A 52 LEU H 1.0 1.8 5.03 584 584 A 51 THR H A 51 THR HG2% 1.0 1.8 4.36 585 585 A 52 LEU H A 51 THR HG2% 1.0 1.8 5.29 586 586 A 52 LEU HA A 52 LEU HDx% 1.0 1.8 3.76 587 587 A 52 LEU HA A 52 LEU HDy% 1.0 1.8 3.59 588 588 A 53 ARG H A 52 LEU HA 1.0 1.8 3.89 589 589 A 52 LEU HBx A 53 ARG H 1.0 1.8 4.76 590 590 A 52 LEU HBy A 52 LEU HDx% 1.0 1.8 3.69 591 591 A 52 LEU H A 52 LEU HG 1.0 1.8 5.30 592 592 A 52 LEU HA A 52 LEU HG 1.0 1.8 4.29 593 593 A 52 LEU HBx A 52 LEU HG 1.0 1.8 2.64 594 594 A 53 ARG H A 52 LEU HG 1.0 1.8 6.49 595 595 A 52 LEU H A 52 LEU HDx% 1.0 1.8 6.60 596 596 A 51 THR HA A 52 LEU HDy% 1.0 1.8 3.22 597 597 A 52 LEU HBx A 52 LEU HDy% 1.0 1.8 3.69 598 598 A 52 LEU HBy A 52 LEU HDy% 1.0 1.8 3.10 599 599 A 53 ARG HA A 53 ARG HGy 1.0 1.8 4.23 600 600 A 53 ARG HA A 53 ARG HGx 1.0 1.8 4.23 601 601 A 53 ARG H A 53 ARG HBy 1.0 1.8 4.39 602 602 A 22 LEU HA A 22 LEU HG 1.0 1.8 3.94 603 603 A 53 ARG HA A 53 ARG HDx 1.0 1.8 5.49 604 604 A 53 ARG HA A 53 ARG HDy 1.0 1.8 5.49 605 605 A 54 GLY H A 53 ARG HDx 1.0 1.8 6.60 606 606 A 54 GLY H A 53 ARG HDy 1.0 1.8 6.60 607 607 A 55 THR HG2% A 55 THR HA 1.0 1.8 3.52 608 608 A 55 THR HB A 56 THR H 1.0 1.8 5.18 609 609 A 56 THR HB A 57 TRP H 1.0 1.8 6.60 610 610 A 56 THR HA A 56 THR HG2% 1.0 1.8 3.65 611 611 A 57 TRP HD1 A 57 TRP HA 1.0 1.8 3.99 612 612 A 57 TRP HA A 57 TRP HE3 1.0 1.8 4.82 613 613 A 58 TYR H A 57 TRP HA 1.0 1.8 3.16 614 614 A 10 TRP HE3 A 57 TRP HBx 1.0 1.8 5.02 615 615 A 58 TYR H A 57 TRP HBx 1.0 1.8 6.60 616 616 A 58 TYR H A 57 TRP HBy 1.0 1.8 6.60 617 617 A 58 TYR HD% A 58 TYR HA 1.0 1.8 4.79 618 618 A 60 TYR HD% A 60 TYR HA 1.0 1.8 4.58 619 619 A 62 GLU HA A 62 GLU HGx 1.0 1.8 4.10 620 620 A 62 GLU HA A 62 GLU HGy 1.0 1.8 4.10 621 621 A 63 ILE HG2% A 63 ILE HA 1.0 1.8 4.25 622 622 A 63 ILE HA A 63 ILE HG1y 1.0 1.8 4.63 623 623 A 63 ILE HA A 63 ILE HG1x 1.0 1.8 4.63 624 624 A 63 ILE HA A 63 ILE HD1% 1.0 1.8 4.55 625 625 A 63 ILE HB A 63 ILE HD1% 1.0 1.8 3.86 626 626 A 63 ILE H A 63 ILE HG2% 1.0 1.8 5.48 627 627 A 63 ILE HG2% A 63 ILE HG1y 1.0 1.8 4.28 628 628 A 63 ILE HG2% A 63 ILE HG1x 1.0 1.8 4.28 629 629 A 64 ASN H A 63 ILE HG2% 1.0 1.8 6.60 630 630 A 63 ILE H A 63 ILE HD1% 1.0 1.8 5.01 631 631 A 63 ILE HG2% A 63 ILE HD1% 1.0 1.8 3.34 632 632 A 64 ASN H A 63 ILE HD1% 1.0 1.8 6.60 633 633 A 65 LYS HA A 65 LYS HGy 1.0 1.8 4.49 634 634 A 65 LYS HA A 65 LYS HGx 1.0 1.8 4.49 635 635 A 65 LYS HA A 65 LYS HDx 1.0 1.8 5.73 636 636 A 65 LYS HA A 65 LYS HDy 1.0 1.8 5.73 637 637 A 66 PHE H A 65 LYS HDx 1.0 1.8 6.60 638 638 A 66 PHE H A 65 LYS HDy 1.0 1.8 6.60 639 639 A 65 LYS HBx A 65 LYS HEx 1.0 1.8 5.80 640 640 A 65 LYS HBx A 65 LYS HEy 1.0 1.8 5.80 641 641 A 65 LYS HEx A 65 LYS HBy 1.0 1.8 5.80 642 642 A 65 LYS HBy A 65 LYS HEy 1.0 1.8 5.80 643 643 A 66 PHE HA A 66 PHE HD% 1.0 1.8 5.46 644 644 A 67 ILE HG2% A 67 ILE HA 1.0 1.8 4.09 645 645 A 67 ILE HG1y A 67 ILE HG2% 1.0 1.8 3.76 646 646 A 67 ILE HG1x A 67 ILE HA 1.0 1.8 4.63 647 647 A 67 ILE HG1x A 67 ILE HG2% 1.0 1.8 3.93 648 648 A 67 ILE HD1% A 67 ILE HA 1.0 1.8 4.68 649 649 A 67 ILE HB A 67 ILE HD1% 1.0 1.8 3.60 650 650 A 67 ILE HD1% A 68 ARG H 1.0 1.8 5.96 651 651 A 68 ARG H A 68 ARG HGx 1.0 1.8 5.08 652 652 A 70 SER H A 69 ASP HBx 1.0 1.8 5.33 653 653 A 71 LEU HA A 71 LEU HG 1.0 1.8 4.55 654 654 A 71 LEU HDy% A 71 LEU HBx 1.0 1.8 3.59 655 655 A 72 GLU H A 71 LEU HBx 1.0 1.8 5.18 656 656 A 72 GLU H A 71 LEU HBy 1.0 1.8 5.18 657 657 A 71 LEU H A 71 LEU HG 1.0 1.8 6.60 658 658 A 72 GLU H A 71 LEU HG 1.0 1.8 6.60 659 659 A 71 LEU HDx% A 71 LEU HA 1.0 1.8 3.11 660 660 A 71 LEU HDx% A 71 LEU HBy 1.0 1.8 3.53 661 661 A 71 LEU HDx% A 72 GLU H 1.0 1.8 6.60 662 662 A 71 LEU HDy% A 71 LEU HA 1.0 1.8 4.50 663 663 A 71 LEU HDy% A 71 LEU HBy 1.0 1.8 3.59 664 664 A 52 LEU HBx A 52 LEU HDx% 1.0 1.8 3.44 665 665 A 71 LEU HDy% A 72 GLU H 1.0 1.8 6.60 666 666 A 72 GLU HA A 72 GLU HGx 1.0 1.8 4.37 667 667 A 72 GLU H A 72 GLU HGx 1.0 1.8 4.50 668 668 A 72 GLU H A 72 GLU HGy 1.0 1.8 4.50 669 669 A 72 GLU HA A 72 GLU HGy 1.0 1.8 4.37 670 670 A 41 PHE HD% A 35 TRP HE3 1.0 1.8 6.60 671 671 A 3 GLN HA A 4 ILE HD1% 1.0 1.8 4.86 672 672 A 5 ILE HD1% A 3 GLN HBy 1.0 1.8 5.29 673 673 A 5 ILE HD1% A 3 GLN HBx 1.0 1.8 5.29 674 674 A 16 LEU HBx A 27 ILE HG2% 1.0 1.8 4.97 675 675 A 16 LEU HG A 27 ILE HG2% 1.0 1.8 4.92 676 676 A 27 ILE HG2% A 28 GLU HBy 1.0 1.8 5.19 677 677 A 13 GLU HGy A 27 ILE HG2% 1.0 1.8 4.50 678 678 A 5 ILE HD1% A 3 GLN HGx 1.0 1.8 6.16 679 679 A 5 ILE HD1% A 3 GLN HGy 1.0 1.8 6.16 680 680 A 11 MET HA A 15 ALA HB% 1.0 1.8 4.70 681 681 A 15 ALA HB% A 11 MET HBx 1.0 1.8 4.49 682 682 A 15 ALA HB% A 11 MET HGy 1.0 1.8 6.43 683 683 A 15 ALA HB% A 11 MET HGx 1.0 1.8 6.43 684 684 A 15 ALA HB% A 11 MET HE% 1.0 1.8 4.13 685 685 A 20 THR HG2% A 11 MET HE% 1.0 1.8 5.39 686 686 A 11 MET HE% A 19 ARG HDx 1.0 1.8 4.87 687 687 A 60 TYR HBx A 11 MET HE% 1.0 1.8 4.08 688 688 A 11 MET HE% A 60 TYR HBy 1.0 1.8 4.07 689 689 A 11 MET HE% A 16 LEU HA 1.0 1.8 5.07 690 690 A 11 MET HE% A 60 TYR HA 1.0 1.8 5.36 691 691 A 9 GLU HA A 11 MET HE% 1.0 1.8 6.60 692 692 A 60 TYR HD% A 11 MET HE% 1.0 1.8 4.39 693 693 A 11 MET HA A 57 TRP HZ3 1.0 1.8 4.26 694 694 A 11 MET HA A 57 TRP HE3 1.0 1.8 4.41 695 695 A 9 GLU H A 11 MET HE% 1.0 1.8 6.47 696 696 A 12 VAL HGy% A 17 MET H 1.0 1.8 6.27 697 697 A 12 VAL HGy% A 57 TRP HZ2 1.0 1.8 6.60 698 698 A 12 VAL HGx% A 57 TRP HZ2 1.0 1.8 6.35 699 699 A 12 VAL HGx% A 58 TYR HD% 1.0 1.8 6.60 700 700 A 11 MET HA A 12 VAL HGy% 1.0 1.8 5.20 701 701 A 11 MET HA A 12 VAL HGx% 1.0 1.8 5.22 702 702 A 12 VAL HGy% A 14 LYS HGx 1.0 1.8 5.49 703 703 A 12 VAL HGy% A 15 ALA HB% 1.0 1.8 3.47 704 704 A 12 VAL HGy% A 14 LYS HBy 1.0 1.8 4.13 705 705 A 12 VAL HGy% A 14 LYS HBx 1.0 1.8 4.60 706 706 A 12 VAL HGx% A 55 THR HG2% 1.0 1.8 3.99 707 707 A 58 TYR HD% A 13 GLU HA 1.0 1.8 5.44 708 708 A 58 TYR HE% A 13 GLU HA 1.0 1.8 5.49 709 709 A 13 GLU HBy A 58 TYR HE% 1.0 1.8 4.29 710 710 A 13 GLU HBx A 58 TYR HE% 1.0 1.8 4.70 711 711 A 13 GLU HGx A 58 TYR HE% 1.0 1.8 6.60 712 712 A 27 ILE HD1% A 13 GLU HA 1.0 1.8 5.74 713 713 A 13 GLU HBy A 27 ILE HD1% 1.0 1.8 5.85 714 714 A 13 GLU HGx A 27 ILE HG2% 1.0 1.8 6.08 715 715 A 14 LYS HA A 17 MET HBx 1.0 1.8 4.54 716 716 A 18 VAL HGy% A 15 ALA HA 1.0 1.8 3.84 717 717 A 12 VAL HGy% A 15 ALA HA 1.0 1.8 4.35 718 718 A 15 ALA HB% A 19 ARG HGx 1.0 1.8 5.22 719 719 A 15 ALA HB% A 19 ARG HGy 1.0 1.8 5.22 720 720 A 15 ALA HB% A 16 LEU HBx 1.0 1.8 5.64 721 721 A 15 ALA HB% A 18 VAL HGy% 1.0 1.8 5.86 722 722 A 15 ALA HB% A 11 MET HBy 1.0 1.8 4.49 723 723 A 18 VAL HB A 15 ALA HA 1.0 1.8 3.93 724 724 A 18 VAL H A 15 ALA HA 1.0 1.8 4.48 725 725 A 22 LEU HDx% A 26 GLN HE2y 1.0 1.8 5.30 726 726 A 16 LEU HDy% A 58 TYR HD% 1.0 1.8 5.59 727 727 A 16 LEU HDy% A 60 TYR HD% 1.0 1.8 3.86 728 728 A 58 TYR HD% A 16 LEU HDx% 1.0 1.8 4.59 729 729 A 16 LEU HDx% A 35 TRP HH2 1.0 1.8 4.71 730 730 A 58 TYR HE% A 16 LEU HDx% 1.0 1.8 5.84 731 731 A 18 VAL H A 16 LEU HA 1.0 1.8 6.06 732 732 A 16 LEU HDx% A 58 TYR HBy 1.0 1.8 5.10 733 733 A 16 LEU HBy A 11 MET HE% 1.0 1.8 6.14 734 734 A 27 ILE HG2% A 16 LEU HDx% 1.0 1.8 3.81 735 735 A 16 LEU HDx% A 63 ILE HD1% 1.0 1.8 3.37 736 736 A 22 LEU HBy A 17 MET HA 1.0 1.8 5.70 737 737 A 20 THR HG2% A 17 MET HA 1.0 1.8 5.18 738 738 A 27 ILE HD1% A 17 MET HGy 1.0 1.8 4.88 739 739 A 17 MET HE% A 18 VAL HGy% 1.0 1.8 4.98 740 740 A 12 VAL HGy% A 17 MET HE% 1.0 1.8 6.18 741 741 A 17 MET HE% A 27 ILE HD1% 1.0 1.8 3.85 742 742 A 17 MET HE% A 24 ALA HA 1.0 1.8 4.19 743 743 A 17 MET HE% A 14 LYS HA 1.0 1.8 3.78 744 744 A 20 THR H A 17 MET HA 1.0 1.8 5.41 745 745 A 16 LEU H A 17 MET HA 1.0 1.8 5.82 746 746 A 17 MET HBx A 21 GLY H 1.0 1.8 6.60 747 747 A 17 MET HE% A 25 ARG H 1.0 1.8 5.78 748 748 A 17 MET HE% A 23 GLY H 1.0 1.8 6.02 749 749 A 17 MET HE% A 28 GLU H 1.0 1.8 6.60 750 750 A 17 MET H A 18 VAL HGy% 1.0 1.8 4.92 751 751 A 20 THR H A 18 VAL HA 1.0 1.8 6.18 752 752 A 14 LYS HA A 18 VAL HGy% 1.0 1.8 4.07 753 753 A 18 VAL HGy% A 14 LYS HEx 1.0 1.8 5.46 754 754 A 18 VAL HGy% A 14 LYS HEy 1.0 1.8 5.72 755 755 A 18 VAL HGy% A 14 LYS HDx 1.0 1.8 4.16 756 756 A 14 LYS HDy A 18 VAL HGy% 1.0 1.8 4.41 757 757 A 14 LYS HGy A 18 VAL HGy% 1.0 1.8 4.16 758 758 A 17 MET HBx A 18 VAL HGy% 1.0 1.8 5.21 759 759 A 18 VAL HA A 19 ARG HA 1.0 1.8 5.52 760 760 A 18 VAL HGx% A 19 ARG HA 1.0 1.8 4.20 761 761 A 16 LEU HDy% A 20 THR HG2% 1.0 1.8 3.21 762 762 A 20 THR HG2% A 63 ILE HG2% 1.0 1.8 4.41 763 763 A 20 THR HG2% A 16 LEU HDx% 1.0 1.8 5.33 764 764 A 16 LEU HG A 20 THR HG2% 1.0 1.8 4.29 765 765 A 20 THR HG2% A 63 ILE HB 1.0 1.8 4.06 766 766 A 22 LEU HBy A 20 THR HB 1.0 1.8 4.73 767 767 A 22 LEU HDx% A 20 THR HB 1.0 1.8 4.03 768 768 A 20 THR HG2% A 60 TYR HA 1.0 1.8 5.12 769 769 A 20 THR HG2% A 20 THR HG1 1.0 1.8 3.95 770 770 A 20 THR HG2% A 60 TYR HE% 1.0 1.8 4.02 771 771 A 20 THR HG2% A 60 TYR HD% 1.0 1.8 3.86 772 772 A 20 THR HG2% A 58 TYR HD% 1.0 1.8 6.60 773 773 A 20 THR H A 21 GLY HAy 1.0 1.8 5.01 774 774 A 20 THR H A 21 GLY HAx 1.0 1.8 5.47 775 775 A 22 LEU HDx% A 30 TYR HE% 1.0 1.8 4.41 776 776 A 22 LEU HBy A 21 GLY HAy 1.0 1.8 5.98 777 777 A 27 ILE HD1% A 22 LEU HBx 1.0 1.8 5.37 778 778 A 22 LEU HDx% A 63 ILE HG2% 1.0 1.8 3.94 779 779 A 20 THR HG2% A 22 LEU HDy% 1.0 1.8 4.58 780 780 A 24 ALA HB% A 23 GLY HAx 1.0 1.8 5.25 781 781 A 27 ILE HB A 24 ALA HA 1.0 1.8 4.16 782 782 A 27 ILE HD1% A 24 ALA HA 1.0 1.8 3.88 783 783 A 24 ALA HB% A 23 GLY HAy 1.0 1.8 5.25 784 784 A 27 ILE H A 24 ALA HA 1.0 1.8 4.72 785 785 A 28 GLU H A 24 ALA HA 1.0 1.8 5.02 786 786 A 26 GLN H A 24 ALA HA 1.0 1.8 6.60 787 787 A 22 LEU HDy% A 27 ILE HA 1.0 1.8 5.09 788 788 A 22 LEU HDy% A 27 ILE HG2% 1.0 1.8 4.13 789 789 A 22 LEU HDy% A 27 ILE HG1x 1.0 1.8 4.70 790 790 A 24 ALA HB% A 27 ILE HD1% 1.0 1.8 4.85 791 791 A 22 LEU HBy A 27 ILE HD1% 1.0 1.8 4.22 792 792 A 13 GLU HGx A 27 ILE HD1% 1.0 1.8 4.20 793 793 A 13 GLU HGy A 27 ILE HD1% 1.0 1.8 4.22 794 794 A 17 MET HBx A 27 ILE HD1% 1.0 1.8 5.14 795 795 A 27 ILE HD1% A 17 MET HA 1.0 1.8 5.87 796 796 A 27 ILE HG2% A 24 ALA HA 1.0 1.8 5.44 797 797 A 27 ILE HG2% A 58 TYR HE% 1.0 1.8 4.26 798 798 A 5 ILE HG2% A 6 PHE HD% 1.0 1.8 4.84 799 799 A 30 TYR HD% A 27 ILE HA 1.0 1.8 4.75 800 800 A 30 TYR HE% A 27 ILE HA 1.0 1.8 6.60 801 801 A 26 GLN H A 27 ILE HB 1.0 1.8 6.42 802 802 A 63 ILE HB A 65 LYS H 1.0 1.8 6.60 803 803 A 31 ARG H A 28 GLU HA 1.0 1.8 5.21 804 804 A 31 ARG HBx A 28 GLU HA 1.0 1.8 4.21 805 805 A 27 ILE HG2% A 28 GLU HA 1.0 1.8 5.18 806 806 A 28 GLU HGy A 25 ARG HA 1.0 1.8 6.60 807 807 A 28 GLU H A 29 SER HA 1.0 1.8 6.11 808 808 A 30 TYR HBy A 34 ALA HB% 1.0 1.8 5.14 809 809 A 30 TYR HBx A 34 ALA HB% 1.0 1.8 4.85 810 810 A 30 TYR HE% A 66 PHE HE% 1.0 1.8 4.28 811 811 A 22 LEU HDy% A 30 TYR HE% 1.0 1.8 3.58 812 812 A 30 TYR HE% A 63 ILE HG2% 1.0 1.8 5.98 813 813 A 35 TRP HBx A 31 ARG HA 1.0 1.8 4.23 814 814 A 35 TRP HE3 A 31 ARG HGy 1.0 1.8 6.60 815 815 A 31 ARG HA A 35 TRP HE3 1.0 1.8 4.54 816 816 A 31 ARG HA A 41 PHE HE% 1.0 1.8 6.02 817 817 A 30 TYR HD% A 34 ALA HB% 1.0 1.8 4.09 818 818 A 33 GLY HAx A 34 ALA HB% 1.0 1.8 5.08 819 819 A 34 ALA HB% A 30 TYR HA 1.0 1.8 3.98 820 820 A 35 TRP HBy A 41 PHE HE% 1.0 1.8 5.58 821 821 A 36 ILE HB A 39 VAL H 1.0 1.8 4.91 822 822 A 36 ILE HG2% A 39 VAL H 1.0 1.8 4.44 823 823 A 40 HIS H A 36 ILE HD1% 1.0 1.8 5.71 824 824 A 41 PHE H A 36 ILE HD1% 1.0 1.8 6.60 825 825 A 36 ILE HG2% A 39 VAL HB 1.0 1.8 3.83 826 826 A 39 VAL HGx% A 36 ILE HD1% 1.0 1.8 3.96 827 827 A 39 VAL HB A 36 ILE HD1% 1.0 1.8 4.04 828 828 A 36 ILE HG2% A 37 GLU HA 1.0 1.8 5.56 829 829 A 41 PHE H A 37 GLU HA 1.0 1.8 4.70 830 830 A 26 GLN H A 28 GLU HGx 1.0 1.8 6.60 831 831 A 41 PHE H A 39 VAL HGx% 1.0 1.8 6.60 832 832 A 36 ILE HB A 39 VAL HGy% 1.0 1.8 3.76 833 833 A 36 ILE HB A 39 VAL HGx% 1.0 1.8 3.65 834 834 A 36 ILE HB A 39 VAL HB 1.0 1.8 3.88 835 835 A 36 ILE HG2% A 39 VAL HGy% 1.0 1.8 3.16 836 836 A 40 HIS HBy A 35 TRP HBy 1.0 1.8 6.30 837 837 A 35 TRP HBy A 40 HIS HBx 1.0 1.8 5.07 838 838 A 41 PHE HA A 56 THR HG2% 1.0 1.8 5.78 839 839 A 41 PHE HA A 58 TYR HA 1.0 1.8 4.43 840 840 A 41 PHE HA A 58 TYR HE% 1.0 1.8 6.60 841 841 A 58 TYR HE% A 41 PHE HBx 1.0 1.8 6.27 842 842 A 43 ARG HA A 44 VAL HGy% 1.0 1.8 3.78 843 843 A 44 VAL HB A 57 TRP HD1 1.0 1.8 5.03 844 844 A 44 VAL HGy% A 57 TRP HD1 1.0 1.8 3.85 845 845 A 44 VAL HGx% A 57 TRP HH2 1.0 1.8 6.60 846 846 A 44 VAL HGx% A 57 TRP HD1 1.0 1.8 5.42 847 847 A 43 ARG HA A 44 VAL HB 1.0 1.8 6.60 848 848 A 44 VAL HGx% A 55 THR HB 1.0 1.8 5.39 849 849 A 44 VAL HGy% A 55 THR HB 1.0 1.8 6.04 850 850 A 44 VAL HB A 55 THR HG2% 1.0 1.8 6.00 851 851 A 44 VAL HB A 56 THR HG2% 1.0 1.8 6.60 852 852 A 51 THR HB A 52 LEU HDy% 1.0 1.8 4.73 853 853 A 51 THR HA A 52 LEU HDx% 1.0 1.8 4.70 854 854 A 51 THR HB A 52 LEU HDx% 1.0 1.8 5.84 855 855 A 49 GLU HA A 48 GLY HAy 1.0 1.8 5.54 856 856 A 55 THR HG2% A 57 TRP HD1 1.0 1.8 4.74 857 857 A 55 THR HG2% A 57 TRP HA 1.0 1.8 4.98 858 858 A 55 THR HG2% A 57 TRP HZ2 1.0 1.8 5.60 859 859 A 55 THR HB A 57 TRP HD1 1.0 1.8 5.36 860 860 A 56 THR HG2% A 41 PHE HBy 1.0 1.8 4.16 861 861 A 56 THR HG2% A 41 PHE HBx 1.0 1.8 4.16 862 862 A 56 THR HG2% A 57 TRP HA 1.0 1.8 4.61 863 863 A 43 ARG HA A 56 THR HG2% 1.0 1.8 6.01 864 864 A 56 THR HG2% A 58 TYR HD% 1.0 1.8 4.77 865 865 A 56 THR HG2% A 41 PHE HD% 1.0 1.8 3.81 866 866 A 56 THR HB A 58 TYR HE% 1.0 1.8 5.71 867 867 A 42 LYS H A 56 THR HG2% 1.0 1.8 5.13 868 868 A 16 LEU HDx% A 58 TYR HBx 1.0 1.8 5.10 869 869 A 58 TYR HE% A 41 PHE HBy 1.0 1.8 6.27 870 870 A 27 ILE HB A 58 TYR HE% 1.0 1.8 6.60 871 871 A 58 TYR HE% A 31 ARG HBy 1.0 1.8 6.60 872 872 A 10 TRP HE3 A 59 ASN HA 1.0 1.8 5.51 873 873 A 10 TRP HA A 59 ASN HA 1.0 1.8 4.41 874 874 A 16 LEU HBy A 60 TYR HBx 1.0 1.8 6.60 875 875 A 63 ILE HG2% A 60 TYR HA 1.0 1.8 6.12 876 876 A 62 GLU HA A 61 PRO HA 1.0 1.8 6.60 877 877 A 62 GLU HBy A 40 HIS HA 1.0 1.8 5.29 878 878 A 39 VAL HGx% A 62 GLU HBy 1.0 1.8 6.60 879 879 A 28 GLU HBy A 25 ARG HA 1.0 1.8 4.40 880 880 A 63 ILE HA A 40 HIS HD2 1.0 1.8 4.93 881 881 A 59 ASN H A 63 ILE HD1% 1.0 1.8 4.50 882 882 A 58 TYR HD% A 63 ILE HD1% 1.0 1.8 3.97 883 883 A 63 ILE HD1% A 35 TRP HH2 1.0 1.8 5.16 884 884 A 58 TYR HE% A 63 ILE HD1% 1.0 1.8 6.30 885 885 A 58 TYR HA A 63 ILE HD1% 1.0 1.8 6.43 886 886 A 63 ILE HG2% A 35 TRP HZ2 1.0 1.8 4.14 887 887 A 63 ILE HG2% A 66 PHE HD% 1.0 1.8 5.89 888 888 A 63 ILE HB A 35 TRP HZ3 1.0 1.8 6.60 889 889 A 63 ILE HG2% A 35 TRP HH2 1.0 1.8 5.40 890 890 A 63 ILE HB A 60 TYR HA 1.0 1.8 4.69 891 891 A 13 GLU HGx A 27 ILE HB 1.0 1.8 5.56 892 892 A 63 ILE HD1% A 58 TYR HBy 1.0 1.8 4.26 893 893 A 63 ILE HD1% A 58 TYR HBx 1.0 1.8 4.26 894 894 A 40 HIS HBy A 63 ILE HD1% 1.0 1.8 5.30 895 895 A 16 LEU HA A 63 ILE HD1% 1.0 1.8 6.20 896 896 A 60 TYR HA A 63 ILE HD1% 1.0 1.8 6.40 897 897 A 16 LEU HDy% A 63 ILE HD1% 1.0 1.8 3.56 898 898 A 16 LEU HG A 63 ILE HD1% 1.0 1.8 5.90 899 899 A 16 LEU HDy% A 63 ILE HB 1.0 1.8 4.33 900 900 A 63 ILE HG2% A 16 LEU HDx% 1.0 1.8 3.71 901 901 A 22 LEU HDy% A 63 ILE HG2% 1.0 1.8 3.19 902 902 A 67 ILE HD1% A 63 ILE HG2% 1.0 1.8 3.59 903 903 A 67 ILE HG1y A 63 ILE HG2% 1.0 1.8 5.14 904 904 A 68 ARG H A 65 LYS HA 1.0 1.8 5.39 905 905 A 62 GLU HA A 65 LYS HBx 1.0 1.8 5.12 906 906 A 62 GLU HA A 65 LYS HBy 1.0 1.8 5.12 907 907 A 66 PHE HA A 69 ASP HBy 1.0 1.8 5.09 908 908 A 66 PHE H A 66 PHE HD% 1.0 1.8 5.95 909 909 A 66 PHE HD% A 67 ILE HA 1.0 1.8 6.08 910 910 A 67 ILE HG1x A 66 PHE HD% 1.0 1.8 5.72 911 911 A 67 ILE HG1y A 66 PHE HD% 1.0 1.8 5.61 912 912 A 67 ILE HG1y A 66 PHE HE% 1.0 1.8 6.09 913 913 A 67 ILE HD1% A 66 PHE HD% 1.0 1.8 5.59 914 914 A 67 ILE HB A 64 ASN HA 1.0 1.8 4.92 915 915 A 67 ILE HD1% A 20 THR HB 1.0 1.8 4.43 916 916 A 67 ILE HG2% A 68 ARG HA 1.0 1.8 6.60 917 917 A 11 MET HE% A 60 TYR HE% 1.0 1.8 6.60 918 918 A 10 TRP HE3 A 57 TRP HBy 1.0 1.8 5.02 919 919 A 12 VAL HGx% A 14 LYS H 1.0 1.8 6.60 920 920 A 12 VAL HGx% A 15 ALA H 1.0 1.8 6.60 921 921 A 12 VAL HA A 13 GLU HA 1.0 1.8 6.60 922 922 A 13 GLU HBy A 12 VAL HA 1.0 1.8 6.60 923 923 A 13 GLU HBx A 12 VAL HA 1.0 1.8 6.60 924 924 A 16 LEU H A 13 GLU HA 1.0 1.8 6.60 925 925 A 13 GLU HGy A 58 TYR HE% 1.0 1.8 6.60 926 926 A 27 ILE HD1% A 17 MET HGx 1.0 1.8 4.88 927 927 A 18 VAL HGx% A 14 LYS HDx 1.0 1.8 6.50 928 928 A 14 LYS HDy A 18 VAL HGx% 1.0 1.8 6.60 929 929 A 16 LEU HBx A 13 GLU HA 1.0 1.8 6.60 930 930 A 16 LEU HG A 13 GLU HA 1.0 1.8 6.60 931 931 A 13 GLU HA A 16 LEU HDx% 1.0 1.8 6.60 932 932 A 19 ARG H A 15 ALA HA 1.0 1.8 5.30 933 933 A 18 VAL HGx% A 15 ALA HA 1.0 1.8 4.84 934 934 A 20 THR HG2% A 16 LEU HA 1.0 1.8 4.04 935 935 A 19 ARG H A 16 LEU HA 1.0 1.8 6.60 936 936 A 21 GLY H A 17 MET HA 1.0 1.8 6.60 937 937 A 20 THR HG1 A 17 MET HA 1.0 1.8 4.36 938 938 A 20 THR HB A 21 GLY HAx 1.0 1.8 5.62 939 939 A 20 THR HG1 A 16 LEU HA 1.0 1.8 5.39 940 940 A 16 LEU HBy A 63 ILE HD1% 1.0 1.8 6.60 941 941 A 16 LEU HBx A 63 ILE HD1% 1.0 1.8 6.60 942 942 A 60 TYR HD% A 16 LEU HDx% 1.0 1.8 6.60 943 943 A 21 GLY H A 22 LEU HDx% 1.0 1.8 5.01 944 944 A 16 LEU HDy% A 59 ASN H 1.0 1.8 5.54 945 945 A 16 LEU HDy% A 63 ILE H 1.0 1.8 6.60 946 946 A 4 ILE H A 3 GLN HGx 1.0 1.8 6.60 947 947 A 17 MET HBy A 21 GLY H 1.0 1.8 6.60 948 948 A 17 MET HE% A 24 ALA HB% 1.0 1.8 3.19 949 949 A 16 LEU HDy% A 17 MET HA 1.0 1.8 6.60 950 950 A 22 LEU HDx% A 17 MET HA 1.0 1.8 6.60 951 951 A 13 GLU HGx A 17 MET HE% 1.0 1.8 3.62 952 952 A 27 ILE HD1% A 16 LEU HA 1.0 1.8 6.60 953 953 A 27 ILE HD1% A 20 THR HG1 1.0 1.8 6.60 954 954 A 22 LEU HDx% A 21 GLY HAy 1.0 1.8 5.22 955 955 A 22 LEU HDy% A 16 LEU HDx% 1.0 1.8 3.93 956 956 A 22 LEU HDy% A 63 ILE HD1% 1.0 1.8 4.99 957 957 A 22 LEU HDy% A 27 ILE HG1y 1.0 1.8 4.70 958 958 A 16 LEU HDy% A 11 MET HE% 1.0 1.8 4.19 959 959 A 22 LEU HDy% A 67 ILE HG1y 1.0 1.8 6.60 960 960 A 17 MET HBy A 22 LEU HDy% 1.0 1.8 6.60 961 961 A 22 LEU HDy% A 20 THR HB 1.0 1.8 6.60 962 962 A 17 MET HA A 22 LEU HBx 1.0 1.8 6.60 963 963 A 22 LEU HA A 17 MET HA 1.0 1.8 5.31 964 964 A 24 ALA HB% A 28 GLU H 1.0 1.8 6.60 965 965 A 28 GLU HGx A 25 ARG HA 1.0 1.8 4.71 966 966 A 22 LEU HDy% A 27 ILE HD1% 1.0 1.8 4.00 967 967 A 27 ILE HB A 28 GLU HBy 1.0 1.8 5.18 968 968 A 31 ARG HBx A 28 GLU HBx 1.0 1.8 5.54 969 969 A 30 TYR H A 28 GLU HA 1.0 1.8 6.29 970 970 A 29 SER HBy A 28 GLU HBx 1.0 1.8 6.60 971 971 A 28 GLU HBy A 29 SER HBy 1.0 1.8 6.60 972 972 A 33 GLY HAx A 30 TYR HA 1.0 1.8 6.60 973 973 A 22 LEU HDy% A 30 TYR HBx 1.0 1.8 6.60 974 974 A 30 TYR HE% A 34 ALA HB% 1.0 1.8 5.10 975 975 A 33 GLY H A 31 ARG HA 1.0 1.8 6.53 976 976 A 34 ALA HB% A 31 ARG HA 1.0 1.8 6.60 977 977 A 35 TRP H A 33 GLY HAy 1.0 1.8 5.44 978 978 A 33 GLY H A 34 ALA HB% 1.0 1.8 5.92 979 979 A 41 PHE HA A 41 PHE HD% 1.0 1.8 6.60 980 980 A 41 PHE HA A 58 TYR HD% 1.0 1.8 6.60 981 981 A 43 ARG HA A 56 THR HA 1.0 1.8 4.94 982 982 A 12 VAL HA A 57 TRP HA 1.0 1.8 4.79 983 983 A 27 ILE HG2% A 35 TRP HE3 1.0 1.8 6.60 984 984 A 35 TRP HE3 A 31 ARG HGx 1.0 1.8 6.60 985 985 A 31 ARG HA A 35 TRP HD1 1.0 1.8 5.91 986 986 A 34 ALA HB% A 35 TRP HA 1.0 1.8 4.39 987 987 A 30 TYR HD% A 35 TRP HZ2 1.0 1.8 6.02 988 988 A 27 ILE HA A 35 TRP HZ2 1.0 1.8 5.33 989 989 A 16 LEU HDy% A 35 TRP HZ2 1.0 1.8 6.35 990 990 A 22 LEU HDy% A 35 TRP HH2 1.0 1.8 6.60 991 991 A 10 TRP HE3 A 57 TRP HD1 1.0 1.8 6.60 992 992 A 36 ILE HG2% A 39 VAL HGx% 1.0 1.8 4.33 993 993 A 39 VAL HGy% A 36 ILE HD1% 1.0 1.8 3.60 994 994 A 36 ILE HG2% A 39 VAL HA 1.0 1.8 6.60 995 995 A 37 GLU H A 39 VAL HGx% 1.0 1.8 6.60 996 996 A 35 TRP HE3 A 36 ILE HD1% 1.0 1.8 6.60 997 997 A 36 ILE HG1y A 39 VAL HGy% 1.0 1.8 6.60 998 998 A 36 ILE HA A 37 GLU HA 1.0 1.8 6.60 999 999 A 39 VAL HGx% A 40 HIS HA 1.0 1.8 4.66 1000 1000 A 39 VAL HGy% A 40 HIS HA 1.0 1.8 6.11 1001 1001 A 12 VAL HGy% A 57 TRP HZ3 1.0 1.8 6.60 1002 1002 A 12 VAL HGy% A 58 TYR HD% 1.0 1.8 6.60 1003 1003 A 30 TYR HBx A 27 ILE HA 1.0 1.8 6.60 1004 1004 A 35 TRP HA A 36 ILE HD1% 1.0 1.8 5.42 1005 1005 A 39 VAL HGy% A 36 ILE HG1x 1.0 1.8 5.15 1006 1006 A 36 ILE HG1y A 39 VAL HGx% 1.0 1.8 6.60 1007 1007 A 36 ILE H A 40 HIS HA 1.0 1.8 6.60 1008 1008 A 40 HIS HBy A 36 ILE H 1.0 1.8 6.60 1009 1009 A 36 ILE H A 40 HIS HD2 1.0 1.8 6.60 1010 1010 A 40 HIS HBy A 41 PHE HD% 1.0 1.8 6.60 1011 1011 A 44 VAL HGx% A 57 TRP HE1 1.0 1.8 6.60 1012 1012 A 11 MET H A 58 TYR HA 1.0 1.8 6.13 1013 1013 A 62 GLU HBx A 59 ASN HBx 1.0 1.8 6.60 1014 1014 A 62 GLU HBx A 59 ASN HBy 1.0 1.8 6.60 1015 1015 A 40 HIS HA A 62 GLU HGx 1.0 1.8 6.60 1016 1016 A 40 HIS HA A 62 GLU HGy 1.0 1.8 6.60 1017 1017 A 67 ILE HG1x A 63 ILE HG2% 1.0 1.8 6.60 1018 1018 A 67 ILE HG2% A 71 LEU HDy% 1.0 1.8 3.51 1019 1019 A 63 ILE HG2% A 67 ILE HA 1.0 1.8 6.60 1020 1020 A 71 LEU HDy% A 67 ILE HA 1.0 1.8 6.60 1021 1021 A 71 LEU HDy% A 68 ARG HA 1.0 1.8 6.17 1022 1022 A 40 HIS HBy A 35 TRP HZ3 1.0 1.8 6.00 1023 1023 A 40 HIS HBx A 35 TRP HZ3 1.0 1.8 6.60 1024 1024 A 35 TRP HA A 40 HIS HBx 1.0 1.8 6.60 1025 1025 A 44 VAL H A 43 ARG HGx 1.0 1.8 6.60 1026 1026 A 44 VAL H A 43 ARG HGy 1.0 1.8 6.60 1027 1027 A 44 VAL HGy% A 56 THR HA 1.0 1.8 4.38 1028 1028 A 44 VAL HGx% A 56 THR HA 1.0 1.8 5.79 1029 1029 A 44 VAL H A 56 THR HG2% 1.0 1.8 6.60 1030 1030 A 44 VAL HGy% A 57 TRP HZ2 1.0 1.8 6.60 1031 1031 A 49 GLU HA A 48 GLY HAx 1.0 1.8 5.54 1032 1032 A 61 PRO HA A 64 ASN HA 1.0 1.8 6.60 1033 1033 A 67 ILE HD1% A 64 ASN HA 1.0 1.8 4.39 1034 1034 A 53 ARG H A 51 THR HG2% 1.0 1.8 4.85 1035 1035 A 51 THR HB A 52 LEU HBy 1.0 1.8 5.62 1036 1036 A 10 TRP HE3 A 42 LYS HGx 1.0 1.8 6.60 1037 1037 A 10 TRP HE3 A 42 LYS HGy 1.0 1.8 6.60 1038 1038 A 56 THR H A 58 TYR HE% 1.0 1.8 6.11 1039 1039 A 59 ASN HA A 62 GLU HBy 1.0 1.8 4.80 1040 1040 A 35 TRP HZ3 A 63 ILE HD1% 1.0 1.8 6.40 1041 1041 A 40 HIS HD2 A 63 ILE HD1% 1.0 1.8 6.60 1042 1042 A 27 ILE HG2% A 63 ILE HD1% 1.0 1.8 5.02 1043 1043 A 67 ILE H A 66 PHE HD% 1.0 1.8 6.60 1044 1044 A 22 LEU HDy% A 66 PHE HD% 1.0 1.8 6.60 1045 1045 A 67 ILE HG1x A 64 ASN HA 1.0 1.8 6.60 1046 1046 A 20 THR HG2% A 67 ILE HD1% 1.0 1.8 4.35 1047 1047 A 66 PHE HA A 69 ASP HBx 1.0 1.8 5.09 1048 1048 A 27 ILE HG2% A 35 TRP HH2 1.0 1.8 6.60 1049 1049 A 35 TRP HA A 35 TRP HD1 1.0 1.8 6.60 1050 1050 A 58 TYR H A 57 TRP HE3 1.0 1.8 6.60 1051 1051 A 41 PHE HA A 10 TRP HZ3 1.0 1.8 5.72 1052 1052 A 22 LEU HDy% A 30 TYR HD% 1.0 1.8 4.54 1053 1053 A 58 TYR HE% A 35 TRP HD1 1.0 1.8 4.15 1054 1054 A 58 TYR HD% A 35 TRP HD1 1.0 1.8 4.69 1055 1055 A 56 THR HG2% A 58 TYR HE% 1.0 1.8 4.40 1056 1056 A 60 TYR HD% A 9 GLU HBx 1.0 1.8 6.60 1057 1057 A 60 TYR HD% A 9 GLU HBy 1.0 1.8 6.60 1058 1058 A 16 LEU HDy% A 60 TYR HE% 1.0 1.8 6.60 1059 1059 A 67 ILE HD1% A 60 TYR HE% 1.0 1.8 6.60 1060 1060 A 67 ILE HG2% A 66 PHE HD% 1.0 1.8 6.60 1061 1061 A 27 ILE HG2% A 35 TRP HZ3 1.0 1.8 6.00 1062 1062 A 22 LEU HDy% A 35 TRP HZ2 1.0 1.8 5.04 1063 1063 A 58 TYR HD% A 35 TRP HZ2 1.0 1.8 6.60 1064 1064 A 22 LEU HBy A 30 TYR HD% 1.0 1.8 6.60 1065 1065 A 40 HIS HBx A 41 PHE HD% 1.0 1.8 6.34 1066 1066 A 44 VAL H A 57 TRP HD1 1.0 1.8 5.93 1067 1067 A 36 ILE HG1y A 40 HIS HD2 1.0 1.8 6.60 1068 1068 A 62 GLU HBx A 40 HIS HD2 1.0 1.8 5.72 1069 1069 A 12 VAL HGx% A 57 TRP HD1 1.0 1.8 6.59 1070 1070 A 12 VAL HGy% A 57 TRP HH2 1.0 1.8 6.39 1071 1071 A 27 ILE HG2% A 58 TYR HD% 1.0 1.8 6.60 1072 1072 A 13 GLU HBy A 58 TYR HD% 1.0 1.8 6.60 1073 1073 A 22 LEU HDx% A 66 PHE HE% 1.0 1.8 6.60 1074 1074 A 67 ILE HG2% A 66 PHE HE% 1.0 1.8 6.60 1075 1075 A 67 ILE HD1% A 66 PHE HE% 1.0 1.8 6.60 1076 1076 A 3 GLN HA A 4 ILE HG1x 1.0 1.8 6.02 1077 1076 A 3 GLN HA A 4 ILE HG1y 1.0 1.8 6.02 1078 1077 A 4 ILE H A 3 GLN HBy 1.0 1.8 3.96 1079 1077 A 4 ILE H A 3 GLN HBx 1.0 1.8 3.96 1080 1078 A 5 ILE HD1% A 3 GLN HBy 1.0 1.8 4.38 1081 1078 A 5 ILE HD1% A 3 GLN HBx 1.0 1.8 4.38 1082 1079 A 5 ILE HD1% A 3 GLN HGx 1.0 1.8 5.36 1083 1079 A 5 ILE HD1% A 3 GLN HGy 1.0 1.8 5.36 1084 1080 A 5 ILE HG2% A 3 GLN HE2y 1.0 1.8 6.39 1085 1080 A 5 ILE HG2% A 3 GLN HE2x 1.0 1.8 6.39 1086 1081 A 5 ILE HD1% A 3 GLN HE2y 1.0 1.8 5.10 1087 1081 A 5 ILE HD1% A 3 GLN HE2x 1.0 1.8 5.10 1088 1082 A 4 ILE H A 4 ILE HG1x 1.0 1.8 3.83 1089 1082 A 4 ILE H A 4 ILE HG1y 1.0 1.8 3.83 1090 1083 A 4 ILE HA A 4 ILE HG1x 1.0 1.8 3.99 1091 1083 A 4 ILE HA A 4 ILE HG1y 1.0 1.8 3.99 1092 1084 A 4 ILE HG2% A 4 ILE HG1x 1.0 1.8 3.47 1093 1084 A 4 ILE HG2% A 4 ILE HG1y 1.0 1.8 3.47 1094 1085 A 5 ILE H A 4 ILE HG1x 1.0 1.8 5.95 1095 1085 A 5 ILE H A 4 ILE HG1y 1.0 1.8 5.95 1096 1086 A 5 ILE H A 5 ILE HG1x 1.0 1.8 4.09 1097 1086 A 5 ILE H A 5 ILE HG1y 1.0 1.8 4.09 1098 1087 A 5 ILE HA A 5 ILE HG1x 1.0 1.8 3.86 1099 1087 A 5 ILE HA A 5 ILE HG1y 1.0 1.8 3.86 1100 1088 A 5 ILE HA A 6 PHE HBx 1.0 1.8 5.52 1101 1088 A 5 ILE HA A 6 PHE HBy 1.0 1.8 5.52 1102 1089 A 5 ILE HG2% A 5 ILE HG1x 1.0 1.8 3.03 1103 1089 A 5 ILE HG2% A 5 ILE HG1y 1.0 1.8 3.03 1104 1090 A 5 ILE HG2% A 6 PHE HBx 1.0 1.8 5.61 1105 1090 A 5 ILE HG2% A 6 PHE HBy 1.0 1.8 5.61 1106 1091 A 6 PHE H A 6 PHE HBx 1.0 1.8 3.53 1107 1091 A 6 PHE H A 6 PHE HBy 1.0 1.8 3.53 1108 1092 A 6 PHE HA A 7 ASN HBy 1.0 1.8 5.70 1109 1092 A 6 PHE HA A 7 ASN HBx 1.0 1.8 5.70 1110 1093 A 6 PHE HBy A 7 ASN HBy 1.0 1.8 5.26 1111 1093 A 6 PHE HBx A 7 ASN HBy 1.0 1.8 5.26 1112 1093 A 7 ASN HBx A 6 PHE HBx 1.0 1.8 5.26 1113 1093 A 6 PHE HBy A 7 ASN HBx 1.0 1.8 5.26 1114 1094 A 7 ASN H A 7 ASN HBy 1.0 1.8 4.07 1115 1094 A 7 ASN H A 7 ASN HBx 1.0 1.8 4.07 1116 1095 A 7 ASN HA A 7 ASN HD2y 1.0 1.8 4.62 1117 1095 A 7 ASN HA A 7 ASN HD2x 1.0 1.8 4.62 1118 1096 A 8 GLU H A 7 ASN HBy 1.0 1.8 4.81 1119 1096 A 8 GLU H A 7 ASN HBx 1.0 1.8 4.81 1120 1097 A 8 GLU H A 8 GLU HGy 1.0 1.8 4.18 1121 1097 A 8 GLU H A 8 GLU HGx 1.0 1.8 4.18 1122 1098 A 8 GLU HA A 8 GLU HGy 1.0 1.8 3.96 1123 1098 A 8 GLU HA A 8 GLU HGx 1.0 1.8 3.96 1124 1099 A 10 TRP HE1 A 8 GLU HBx 1.0 1.8 4.42 1125 1099 A 10 TRP HE1 A 8 GLU HBy 1.0 1.8 4.42 1126 1100 A 9 GLU H A 8 GLU HGy 1.0 1.8 5.69 1127 1100 A 9 GLU H A 8 GLU HGx 1.0 1.8 5.69 1128 1101 A 9 GLU H A 9 GLU HBy 1.0 1.8 3.79 1129 1101 A 9 GLU H A 9 GLU HBx 1.0 1.8 3.79 1130 1102 A 9 GLU H A 9 GLU HGy 1.0 1.8 4.96 1131 1102 A 9 GLU H A 9 GLU HGx 1.0 1.8 4.96 1132 1103 A 9 GLU H A 61 PRO HGx 1.0 1.8 4.69 1133 1103 A 9 GLU H A 61 PRO HGy 1.0 1.8 4.69 1134 1104 A 9 GLU H A 61 PRO HDx 1.0 1.8 5.09 1135 1104 A 9 GLU H A 61 PRO HDy 1.0 1.8 5.09 1136 1105 A 9 GLU HA A 61 PRO HDx 1.0 1.8 5.09 1137 1105 A 9 GLU HA A 61 PRO HDy 1.0 1.8 5.09 1138 1106 A 10 TRP H A 9 GLU HBy 1.0 1.8 4.52 1139 1106 A 10 TRP H A 9 GLU HBx 1.0 1.8 4.52 1140 1107 A 11 MET HE% A 9 GLU HBy 1.0 1.8 3.54 1141 1107 A 11 MET HE% A 9 GLU HBx 1.0 1.8 3.54 1142 1108 A 60 TYR HD% A 9 GLU HBy 1.0 1.8 5.68 1143 1108 A 60 TYR HD% A 9 GLU HBx 1.0 1.8 5.68 1144 1109 A 9 GLU HBy A 61 PRO HDx 1.0 1.8 4.05 1145 1109 A 9 GLU HBx A 61 PRO HDx 1.0 1.8 4.05 1146 1109 A 61 PRO HDy A 9 GLU HBy 1.0 1.8 4.05 1147 1109 A 9 GLU HBx A 61 PRO HDy 1.0 1.8 4.05 1148 1110 A 9 GLU HGy A 61 PRO HDx 1.0 1.8 5.70 1149 1110 A 9 GLU HGx A 61 PRO HDx 1.0 1.8 5.70 1150 1110 A 61 PRO HDy A 9 GLU HGy 1.0 1.8 5.70 1151 1110 A 9 GLU HGx A 61 PRO HDy 1.0 1.8 5.70 1152 1111 A 10 TRP H A 11 MET HGy 1.0 1.8 6.39 1153 1111 A 10 TRP H A 11 MET HGx 1.0 1.8 6.39 1154 1112 A 10 TRP HA A 11 MET HGy 1.0 1.8 6.39 1155 1112 A 10 TRP HA A 11 MET HGx 1.0 1.8 6.39 1156 1113 A 10 TRP HA A 59 ASN HD2y 1.0 1.8 6.39 1157 1113 A 10 TRP HA A 59 ASN HD2x 1.0 1.8 6.39 1158 1114 A 57 TRP HE3 A 10 TRP HBy 1.0 1.8 6.39 1159 1114 A 57 TRP HE3 A 10 TRP HBx 1.0 1.8 6.39 1160 1115 A 10 TRP HE3 A 42 LYS HDx 1.0 1.8 6.39 1161 1115 A 10 TRP HE3 A 42 LYS HDy 1.0 1.8 6.39 1162 1116 A 11 MET H A 11 MET HGy 1.0 1.8 3.78 1163 1116 A 11 MET H A 11 MET HGx 1.0 1.8 3.78 1164 1117 A 11 MET HE% A 11 MET HBx 1.0 1.8 3.27 1165 1117 A 11 MET HE% A 11 MET HBy 1.0 1.8 3.27 1166 1118 A 12 VAL H A 11 MET HBx 1.0 1.8 3.96 1167 1118 A 12 VAL H A 11 MET HBy 1.0 1.8 3.96 1168 1119 A 12 VAL HGy% A 11 MET HBx 1.0 1.8 4.69 1169 1119 A 12 VAL HGy% A 11 MET HBy 1.0 1.8 4.69 1170 1120 A 15 ALA H A 11 MET HBx 1.0 1.8 6.39 1171 1120 A 15 ALA H A 11 MET HBy 1.0 1.8 6.39 1172 1121 A 15 ALA HB% A 11 MET HBx 1.0 1.8 3.62 1173 1121 A 15 ALA HB% A 11 MET HBy 1.0 1.8 3.62 1174 1122 A 57 TRP HE3 A 11 MET HBx 1.0 1.8 6.39 1175 1122 A 57 TRP HE3 A 11 MET HBy 1.0 1.8 6.39 1176 1123 A 12 VAL H A 11 MET HGy 1.0 1.8 5.29 1177 1123 A 12 VAL H A 11 MET HGx 1.0 1.8 5.29 1178 1124 A 15 ALA HB% A 11 MET HGy 1.0 1.8 5.60 1179 1124 A 15 ALA HB% A 11 MET HGx 1.0 1.8 5.60 1180 1125 A 16 LEU HA A 11 MET HGy 1.0 1.8 6.39 1181 1125 A 16 LEU HA A 11 MET HGx 1.0 1.8 6.39 1182 1126 A 16 LEU HBy A 11 MET HGy 1.0 1.8 6.39 1183 1126 A 16 LEU HBy A 11 MET HGx 1.0 1.8 6.39 1184 1127 A 16 LEU HG A 11 MET HGy 1.0 1.8 6.39 1185 1127 A 16 LEU HG A 11 MET HGx 1.0 1.8 6.39 1186 1128 A 16 LEU HDy% A 11 MET HGy 1.0 1.8 5.91 1187 1128 A 16 LEU HDy% A 11 MET HGx 1.0 1.8 5.91 1188 1129 A 58 TYR HD% A 11 MET HGy 1.0 1.8 5.68 1189 1129 A 58 TYR HD% A 11 MET HGx 1.0 1.8 5.68 1190 1130 A 11 MET HE% A 19 ARG HGy 1.0 1.8 4.28 1191 1130 A 11 MET HE% A 19 ARG HGx 1.0 1.8 4.28 1192 1131 A 11 MET HE% A 19 ARG HDy 1.0 1.8 4.17 1193 1131 A 11 MET HE% A 19 ARG HDx 1.0 1.8 4.17 1194 1132 A 13 GLU HGx A 17 MET HGx 1.0 1.8 6.39 1195 1132 A 13 GLU HGx A 17 MET HGy 1.0 1.8 6.39 1196 1133 A 14 LYS HA A 17 MET HGx 1.0 1.8 4.73 1197 1133 A 14 LYS HA A 17 MET HGy 1.0 1.8 4.73 1198 1134 A 14 LYS HGy A 17 MET HGx 1.0 1.8 6.39 1199 1134 A 14 LYS HGy A 17 MET HGy 1.0 1.8 6.39 1200 1135 A 15 ALA HA A 19 ARG HGy 1.0 1.8 4.75 1201 1135 A 15 ALA HA A 19 ARG HGx 1.0 1.8 4.75 1202 1136 A 15 ALA HB% A 19 ARG HGy 1.0 1.8 4.52 1203 1136 A 15 ALA HB% A 19 ARG HGx 1.0 1.8 4.52 1204 1137 A 16 LEU HA A 19 ARG HBx 1.0 1.8 4.32 1205 1137 A 16 LEU HA A 19 ARG HBy 1.0 1.8 4.32 1206 1138 A 16 LEU HBx A 58 TYR HBx 1.0 1.8 6.01 1207 1138 A 16 LEU HBx A 58 TYR HBy 1.0 1.8 6.01 1208 1139 A 16 LEU HG A 58 TYR HBx 1.0 1.8 6.39 1209 1139 A 16 LEU HG A 58 TYR HBy 1.0 1.8 6.39 1210 1140 A 16 LEU HDx% A 27 ILE HG1x 1.0 1.8 5.07 1211 1140 A 16 LEU HDx% A 27 ILE HG1y 1.0 1.8 5.07 1212 1141 A 16 LEU HDx% A 58 TYR HBx 1.0 1.8 4.42 1213 1141 A 16 LEU HDx% A 58 TYR HBy 1.0 1.8 4.42 1214 1142 A 16 LEU HDy% A 58 TYR HBx 1.0 1.8 4.81 1215 1142 A 16 LEU HDy% A 58 TYR HBy 1.0 1.8 4.81 1216 1143 A 16 LEU HDy% A 61 PRO HDx 1.0 1.8 5.71 1217 1143 A 16 LEU HDy% A 61 PRO HDy 1.0 1.8 5.71 1218 1144 A 17 MET H A 17 MET HGx 1.0 1.8 3.30 1219 1144 A 17 MET H A 17 MET HGy 1.0 1.8 3.30 1220 1145 A 17 MET HA A 17 MET HGx 1.0 1.8 3.81 1221 1145 A 17 MET HA A 17 MET HGy 1.0 1.8 3.81 1222 1146 A 17 MET HBy A 23 GLY HAx 1.0 1.8 6.39 1223 1146 A 17 MET HBy A 23 GLY HAy 1.0 1.8 6.39 1224 1147 A 17 MET HBy A 27 ILE HG1x 1.0 1.8 6.39 1225 1147 A 17 MET HBy A 27 ILE HG1y 1.0 1.8 6.39 1226 1148 A 17 MET HBx A 27 ILE HG1x 1.0 1.8 4.66 1227 1148 A 17 MET HBx A 27 ILE HG1y 1.0 1.8 4.66 1228 1149 A 17 MET HE% A 17 MET HGx 1.0 1.8 3.66 1229 1149 A 17 MET HE% A 17 MET HGy 1.0 1.8 3.66 1230 1150 A 18 VAL HGy% A 17 MET HGx 1.0 1.8 6.39 1231 1150 A 18 VAL HGy% A 17 MET HGy 1.0 1.8 6.39 1232 1151 A 27 ILE HD1% A 17 MET HGx 1.0 1.8 4.10 1233 1151 A 27 ILE HD1% A 17 MET HGy 1.0 1.8 4.10 1234 1152 A 17 MET HE% A 23 GLY HAx 1.0 1.8 4.44 1235 1152 A 17 MET HE% A 23 GLY HAy 1.0 1.8 4.44 1236 1153 A 17 MET HE% A 27 ILE HG1x 1.0 1.8 5.85 1237 1153 A 17 MET HE% A 27 ILE HG1y 1.0 1.8 5.85 1238 1154 A 19 ARG H A 19 ARG HBx 1.0 1.8 3.39 1239 1154 A 19 ARG H A 19 ARG HBy 1.0 1.8 3.39 1240 1155 A 19 ARG H A 19 ARG HGy 1.0 1.8 3.71 1241 1155 A 19 ARG H A 19 ARG HGx 1.0 1.8 3.71 1242 1156 A 19 ARG HA A 19 ARG HGy 1.0 1.8 3.73 1243 1156 A 19 ARG HA A 19 ARG HGx 1.0 1.8 3.73 1244 1157 A 19 ARG HA A 19 ARG HDy 1.0 1.8 3.98 1245 1157 A 19 ARG HA A 19 ARG HDx 1.0 1.8 3.98 1246 1158 A 20 THR H A 19 ARG HBx 1.0 1.8 4.05 1247 1158 A 20 THR H A 19 ARG HBy 1.0 1.8 4.05 1248 1159 A 20 THR HG2% A 19 ARG HBx 1.0 1.8 3.72 1249 1159 A 20 THR HG2% A 19 ARG HBy 1.0 1.8 3.72 1250 1160 A 21 GLY H A 19 ARG HBx 1.0 1.8 5.43 1251 1160 A 21 GLY H A 19 ARG HBy 1.0 1.8 5.43 1252 1161 A 60 TYR HD% A 19 ARG HBx 1.0 1.8 6.39 1253 1161 A 60 TYR HD% A 19 ARG HBy 1.0 1.8 6.39 1254 1162 A 60 TYR HE% A 19 ARG HBx 1.0 1.8 6.23 1255 1162 A 60 TYR HE% A 19 ARG HBy 1.0 1.8 6.23 1256 1163 A 20 THR H A 19 ARG HGy 1.0 1.8 5.27 1257 1163 A 20 THR H A 19 ARG HGx 1.0 1.8 5.27 1258 1164 A 60 TYR HD% A 19 ARG HGy 1.0 1.8 6.06 1259 1164 A 60 TYR HD% A 19 ARG HGx 1.0 1.8 6.06 1260 1165 A 22 LEU HBy A 27 ILE HG1x 1.0 1.8 4.93 1261 1165 A 22 LEU HBy A 27 ILE HG1y 1.0 1.8 4.93 1262 1166 A 22 LEU HBx A 26 GLN HBx 1.0 1.8 5.28 1263 1166 A 22 LEU HBx A 26 GLN HBy 1.0 1.8 5.28 1264 1167 A 22 LEU HBx A 27 ILE HG1x 1.0 1.8 5.03 1265 1167 A 22 LEU HBx A 27 ILE HG1y 1.0 1.8 5.03 1266 1168 A 22 LEU HG A 26 GLN HBx 1.0 1.8 3.43 1267 1168 A 22 LEU HG A 26 GLN HBy 1.0 1.8 3.43 1268 1169 A 22 LEU HG A 26 GLN HGx 1.0 1.8 4.94 1269 1169 A 22 LEU HG A 26 GLN HGy 1.0 1.8 4.94 1270 1170 A 22 LEU HDx% A 26 GLN HGx 1.0 1.8 6.39 1271 1170 A 22 LEU HDx% A 26 GLN HGy 1.0 1.8 6.39 1272 1171 A 22 LEU HDx% A 26 GLN HE2x 1.0 1.8 4.59 1273 1171 A 22 LEU HDx% A 26 GLN HE2y 1.0 1.8 4.59 1274 1172 A 22 LEU HDy% A 26 GLN HBx 1.0 1.8 4.26 1275 1172 A 22 LEU HDy% A 26 GLN HBy 1.0 1.8 4.26 1276 1173 A 22 LEU HDy% A 26 GLN HGx 1.0 1.8 4.27 1277 1173 A 22 LEU HDy% A 26 GLN HGy 1.0 1.8 4.27 1278 1174 A 22 LEU HDy% A 26 GLN HE2x 1.0 1.8 5.35 1279 1174 A 22 LEU HDy% A 26 GLN HE2y 1.0 1.8 5.35 1280 1175 A 22 LEU HDy% A 27 ILE HG1x 1.0 1.8 3.86 1281 1175 A 22 LEU HDy% A 27 ILE HG1y 1.0 1.8 3.86 1282 1176 A 23 GLY H A 26 GLN HBx 1.0 1.8 5.18 1283 1176 A 23 GLY H A 26 GLN HBy 1.0 1.8 5.18 1284 1177 A 23 GLY H A 26 GLN HGx 1.0 1.8 4.60 1285 1177 A 23 GLY H A 26 GLN HGy 1.0 1.8 4.60 1286 1178 A 27 ILE HD1% A 23 GLY HAx 1.0 1.8 6.39 1287 1178 A 27 ILE HD1% A 23 GLY HAy 1.0 1.8 6.39 1288 1179 A 24 ALA HA A 27 ILE HG1x 1.0 1.8 5.61 1289 1179 A 24 ALA HA A 27 ILE HG1y 1.0 1.8 5.61 1290 1180 A 25 ARG H A 25 ARG HGx 1.0 1.8 5.70 1291 1180 A 25 ARG H A 25 ARG HGy 1.0 1.8 5.70 1292 1181 A 25 ARG HA A 25 ARG HGx 1.0 1.8 3.82 1293 1181 A 25 ARG HA A 25 ARG HGy 1.0 1.8 3.82 1294 1182 A 25 ARG HA A 25 ARG HDy 1.0 1.8 5.22 1295 1182 A 25 ARG HA A 25 ARG HDx 1.0 1.8 5.22 1296 1183 A 25 ARG HBx A 25 ARG HGx 1.0 1.8 2.55 1297 1183 A 25 ARG HGy A 25 ARG HBx 1.0 1.8 2.55 1298 1183 A 25 ARG HGy A 25 ARG HBy 1.0 1.8 2.55 1299 1183 A 25 ARG HBy A 25 ARG HGx 1.0 1.8 2.55 1300 1184 A 25 ARG HBx A 25 ARG HDy 1.0 1.8 3.26 1301 1184 A 25 ARG HBy A 25 ARG HDy 1.0 1.8 3.26 1302 1184 A 25 ARG HDx A 25 ARG HBx 1.0 1.8 3.26 1303 1184 A 25 ARG HDx A 25 ARG HBy 1.0 1.8 3.26 1304 1185 A 26 GLN H A 25 ARG HBx 1.0 1.8 4.23 1305 1185 A 26 GLN H A 25 ARG HBy 1.0 1.8 4.23 1306 1186 A 26 GLN H A 25 ARG HGx 1.0 1.8 5.64 1307 1186 A 26 GLN H A 25 ARG HGy 1.0 1.8 5.64 1308 1187 A 26 GLN H A 26 GLN HBx 1.0 1.8 3.63 1309 1187 A 26 GLN H A 26 GLN HBy 1.0 1.8 3.63 1310 1188 A 26 GLN H A 26 GLN HGx 1.0 1.8 4.39 1311 1188 A 26 GLN H A 26 GLN HGy 1.0 1.8 4.39 1312 1189 A 26 GLN HA A 26 GLN HGx 1.0 1.8 3.60 1313 1189 A 26 GLN HA A 26 GLN HGy 1.0 1.8 3.60 1314 1190 A 27 ILE H A 26 GLN HBx 1.0 1.8 3.55 1315 1190 A 27 ILE H A 26 GLN HBy 1.0 1.8 3.55 1316 1191 A 26 GLN HE2y A 26 GLN HGx 1.0 1.8 3.42 1317 1191 A 26 GLN HE2x A 26 GLN HGy 1.0 1.8 3.42 1318 1191 A 26 GLN HE2y A 26 GLN HGy 1.0 1.8 3.42 1319 1191 A 26 GLN HE2x A 26 GLN HGx 1.0 1.8 3.42 1320 1192 A 27 ILE H A 26 GLN HGx 1.0 1.8 5.40 1321 1192 A 27 ILE H A 26 GLN HGy 1.0 1.8 5.40 1322 1193 A 30 TYR HE% A 26 GLN HGx 1.0 1.8 5.54 1323 1193 A 30 TYR HE% A 26 GLN HGy 1.0 1.8 5.54 1324 1194 A 27 ILE H A 27 ILE HG1x 1.0 1.8 3.87 1325 1194 A 27 ILE H A 27 ILE HG1y 1.0 1.8 3.87 1326 1195 A 27 ILE HA A 27 ILE HG1x 1.0 1.8 3.86 1327 1195 A 27 ILE HA A 27 ILE HG1y 1.0 1.8 3.86 1328 1196 A 27 ILE HG2% A 27 ILE HG1x 1.0 1.8 3.42 1329 1196 A 27 ILE HG2% A 27 ILE HG1y 1.0 1.8 3.42 1330 1197 A 27 ILE HG2% A 31 ARG HDy 1.0 1.8 4.29 1331 1197 A 27 ILE HG2% A 31 ARG HDx 1.0 1.8 4.29 1332 1198 A 28 GLU HA A 31 ARG HGy 1.0 1.8 5.47 1333 1198 A 28 GLU HA A 31 ARG HGx 1.0 1.8 5.47 1334 1199 A 28 GLU HA A 31 ARG HDy 1.0 1.8 5.62 1335 1199 A 28 GLU HA A 31 ARG HDx 1.0 1.8 5.62 1336 1200 A 29 SER HA A 32 GLN HBx 1.0 1.8 4.52 1337 1200 A 29 SER HA A 32 GLN HBy 1.0 1.8 4.52 1338 1201 A 29 SER HA A 32 GLN HGx 1.0 1.8 5.39 1339 1201 A 29 SER HA A 32 GLN HGy 1.0 1.8 5.39 1340 1202 A 29 SER HBx A 32 GLN HBx 1.0 1.8 6.39 1341 1202 A 29 SER HBx A 32 GLN HBy 1.0 1.8 6.39 1342 1203 A 30 TYR H A 32 GLN HBx 1.0 1.8 6.39 1343 1203 A 30 TYR H A 32 GLN HBy 1.0 1.8 6.39 1344 1204 A 31 ARG H A 31 ARG HGy 1.0 1.8 3.56 1345 1204 A 31 ARG H A 31 ARG HGx 1.0 1.8 3.56 1346 1205 A 31 ARG H A 31 ARG HDy 1.0 1.8 5.67 1347 1205 A 31 ARG H A 31 ARG HDx 1.0 1.8 5.67 1348 1206 A 31 ARG HA A 31 ARG HGy 1.0 1.8 3.94 1349 1206 A 31 ARG HA A 31 ARG HGx 1.0 1.8 3.94 1350 1207 A 31 ARG HBx A 32 GLN HGx 1.0 1.8 6.39 1351 1207 A 31 ARG HBx A 32 GLN HGy 1.0 1.8 6.39 1352 1208 A 31 ARG HBy A 31 ARG HDy 1.0 1.8 4.00 1353 1208 A 31 ARG HBy A 31 ARG HDx 1.0 1.8 4.00 1354 1209 A 31 ARG HBy A 32 GLN HGx 1.0 1.8 6.25 1355 1209 A 31 ARG HBy A 32 GLN HGy 1.0 1.8 6.25 1356 1210 A 35 TRP HE3 A 31 ARG HGy 1.0 1.8 5.74 1357 1210 A 35 TRP HE3 A 31 ARG HGx 1.0 1.8 5.74 1358 1211 A 35 TRP HD1 A 31 ARG HDy 1.0 1.8 5.70 1359 1211 A 35 TRP HD1 A 31 ARG HDx 1.0 1.8 5.70 1360 1212 A 58 TYR HE% A 31 ARG HDy 1.0 1.8 4.08 1361 1212 A 58 TYR HE% A 31 ARG HDx 1.0 1.8 4.08 1362 1213 A 32 GLN H A 32 GLN HBx 1.0 1.8 3.09 1363 1213 A 32 GLN H A 32 GLN HBy 1.0 1.8 3.09 1364 1214 A 32 GLN H A 32 GLN HGx 1.0 1.8 3.32 1365 1214 A 32 GLN H A 32 GLN HGy 1.0 1.8 3.32 1366 1215 A 32 GLN HBy A 32 GLN HE2y 1.0 1.8 4.15 1367 1215 A 32 GLN HBx A 32 GLN HE2y 1.0 1.8 4.15 1368 1215 A 32 GLN HE2x A 32 GLN HBx 1.0 1.8 4.15 1369 1215 A 32 GLN HBy A 32 GLN HE2x 1.0 1.8 4.15 1370 1216 A 33 GLY H A 32 GLN HGx 1.0 1.8 5.41 1371 1216 A 33 GLY H A 32 GLN HGy 1.0 1.8 5.41 1372 1217 A 36 ILE HA A 37 GLU HBx 1.0 1.8 6.39 1373 1217 A 36 ILE HA A 37 GLU HBy 1.0 1.8 6.39 1374 1218 A 37 GLU H A 37 GLU HBx 1.0 1.8 3.31 1375 1218 A 37 GLU H A 37 GLU HBy 1.0 1.8 3.31 1376 1219 A 37 GLU H A 37 GLU HGy 1.0 1.8 5.33 1377 1219 A 37 GLU H A 37 GLU HGx 1.0 1.8 5.33 1378 1220 A 38 GLY H A 37 GLU HBx 1.0 1.8 3.67 1379 1220 A 38 GLY H A 37 GLU HBy 1.0 1.8 3.67 1380 1221 A 37 GLU HBy A 38 GLY HAy 1.0 1.8 4.68 1381 1221 A 37 GLU HBx A 38 GLY HAy 1.0 1.8 4.68 1382 1221 A 38 GLY HAx A 37 GLU HBx 1.0 1.8 4.68 1383 1221 A 37 GLU HBy A 38 GLY HAx 1.0 1.8 4.68 1384 1222 A 41 PHE HE% A 37 GLU HBx 1.0 1.8 6.17 1385 1222 A 41 PHE HE% A 37 GLU HBy 1.0 1.8 6.17 1386 1223 A 41 PHE HZ A 37 GLU HBx 1.0 1.8 5.83 1387 1223 A 37 GLU HBy A 41 PHE HZ 1.0 1.8 5.83 1388 1224 A 38 GLY H A 37 GLU HGy 1.0 1.8 5.59 1389 1224 A 38 GLY H A 37 GLU HGx 1.0 1.8 5.59 1390 1225 A 38 GLY H A 42 LYS HBy 1.0 1.8 5.59 1391 1225 A 38 GLY H A 42 LYS HBx 1.0 1.8 5.59 1392 1226 A 39 VAL HGy% A 38 GLY HAy 1.0 1.8 4.89 1393 1226 A 39 VAL HGy% A 38 GLY HAx 1.0 1.8 4.89 1394 1227 A 38 GLY HAy A 42 LYS HBy 1.0 1.8 5.49 1395 1227 A 38 GLY HAx A 42 LYS HBy 1.0 1.8 5.49 1396 1227 A 42 LYS HBx A 38 GLY HAy 1.0 1.8 5.49 1397 1227 A 38 GLY HAx A 42 LYS HBx 1.0 1.8 5.49 1398 1228 A 39 VAL HGx% A 62 GLU HGy 1.0 1.8 4.87 1399 1228 A 39 VAL HGx% A 62 GLU HGx 1.0 1.8 4.87 1400 1229 A 40 HIS H A 62 GLU HGy 1.0 1.8 6.39 1401 1229 A 40 HIS H A 62 GLU HGx 1.0 1.8 6.39 1402 1230 A 40 HIS HA A 59 ASN HBx 1.0 1.8 4.66 1403 1230 A 40 HIS HA A 59 ASN HBy 1.0 1.8 4.66 1404 1231 A 40 HIS HBy A 62 GLU HGy 1.0 1.8 6.39 1405 1231 A 40 HIS HBy A 62 GLU HGx 1.0 1.8 6.39 1406 1232 A 40 HIS HBy A 63 ILE HG1x 1.0 1.8 5.18 1407 1232 A 40 HIS HBy A 63 ILE HG1y 1.0 1.8 5.18 1408 1233 A 40 HIS HD2 A 62 GLU HGy 1.0 1.8 6.39 1409 1233 A 40 HIS HD2 A 62 GLU HGx 1.0 1.8 6.39 1410 1234 A 40 HIS HD2 A 63 ILE HG1x 1.0 1.8 5.32 1411 1234 A 40 HIS HD2 A 63 ILE HG1y 1.0 1.8 5.32 1412 1235 A 40 HIS HD2 A 66 PHE HBy 1.0 1.8 6.39 1413 1235 A 40 HIS HD2 A 66 PHE HBx 1.0 1.8 6.39 1414 1236 A 41 PHE HA A 42 LYS HGy 1.0 1.8 5.46 1415 1236 A 41 PHE HA A 42 LYS HGx 1.0 1.8 5.46 1416 1237 A 42 LYS H A 41 PHE HBy 1.0 1.8 3.75 1417 1237 A 42 LYS H A 41 PHE HBx 1.0 1.8 3.75 1418 1238 A 56 THR HG2% A 41 PHE HBy 1.0 1.8 3.62 1419 1238 A 56 THR HG2% A 41 PHE HBx 1.0 1.8 3.62 1420 1239 A 58 TYR HA A 41 PHE HBy 1.0 1.8 6.39 1421 1239 A 58 TYR HA A 41 PHE HBx 1.0 1.8 6.39 1422 1240 A 58 TYR HD% A 41 PHE HBy 1.0 1.8 4.39 1423 1240 A 58 TYR HD% A 41 PHE HBx 1.0 1.8 4.39 1424 1241 A 58 TYR HE% A 41 PHE HBy 1.0 1.8 5.50 1425 1241 A 58 TYR HE% A 41 PHE HBx 1.0 1.8 5.50 1426 1242 A 59 ASN H A 41 PHE HBy 1.0 1.8 6.39 1427 1242 A 59 ASN H A 41 PHE HBx 1.0 1.8 6.39 1428 1243 A 42 LYS H A 42 LYS HGy 1.0 1.8 4.16 1429 1243 A 42 LYS H A 42 LYS HGx 1.0 1.8 4.16 1430 1244 A 42 LYS H A 42 LYS HDx 1.0 1.8 4.80 1431 1244 A 42 LYS H A 42 LYS HDy 1.0 1.8 4.80 1432 1245 A 43 ARG H A 42 LYS HBy 1.0 1.8 3.45 1433 1245 A 43 ARG H A 42 LYS HBx 1.0 1.8 3.45 1434 1246 A 57 TRP H A 42 LYS HBy 1.0 1.8 6.39 1435 1246 A 57 TRP H A 42 LYS HBx 1.0 1.8 6.39 1436 1247 A 42 LYS HEy A 42 LYS HGy 1.0 1.8 3.54 1437 1247 A 42 LYS HEx A 42 LYS HGy 1.0 1.8 3.54 1438 1247 A 42 LYS HGx A 42 LYS HEx 1.0 1.8 3.54 1439 1247 A 42 LYS HGx A 42 LYS HEy 1.0 1.8 3.54 1440 1248 A 43 ARG H A 42 LYS HGy 1.0 1.8 5.19 1441 1248 A 43 ARG H A 42 LYS HGx 1.0 1.8 5.19 1442 1249 A 43 ARG H A 42 LYS HDx 1.0 1.8 5.93 1443 1249 A 43 ARG H A 42 LYS HDy 1.0 1.8 5.93 1444 1250 A 43 ARG H A 43 ARG HBx 1.0 1.8 3.53 1445 1250 A 43 ARG H A 43 ARG HBy 1.0 1.8 3.53 1446 1251 A 43 ARG H A 43 ARG HGy 1.0 1.8 4.76 1447 1251 A 43 ARG H A 43 ARG HGx 1.0 1.8 4.76 1448 1252 A 43 ARG H A 43 ARG HDy 1.0 1.8 5.30 1449 1252 A 43 ARG H A 43 ARG HDx 1.0 1.8 5.30 1450 1253 A 43 ARG HA A 43 ARG HDy 1.0 1.8 5.67 1451 1253 A 43 ARG HA A 43 ARG HDx 1.0 1.8 5.67 1452 1254 A 43 ARG HBx A 43 ARG HDy 1.0 1.8 3.49 1453 1254 A 43 ARG HBy A 43 ARG HDy 1.0 1.8 3.49 1454 1254 A 43 ARG HDx A 43 ARG HBx 1.0 1.8 3.49 1455 1254 A 43 ARG HBy A 43 ARG HDx 1.0 1.8 3.49 1456 1255 A 44 VAL H A 43 ARG HBx 1.0 1.8 4.50 1457 1255 A 44 VAL H A 43 ARG HBy 1.0 1.8 4.50 1458 1256 A 44 VAL HGx% A 43 ARG HBx 1.0 1.8 6.36 1459 1256 A 44 VAL HGx% A 43 ARG HBy 1.0 1.8 6.36 1460 1257 A 44 VAL HGy% A 57 TRP HBy 1.0 1.8 6.39 1461 1257 A 44 VAL HGy% A 57 TRP HBx 1.0 1.8 6.39 1462 1258 A 45 SER HA A 46 PRO HDy 1.0 1.8 3.63 1463 1258 A 45 SER HA A 46 PRO HDx 1.0 1.8 3.63 1464 1259 A 45 SER HBy A 46 PRO HDy 1.0 1.8 3.88 1465 1259 A 46 PRO HDx A 45 SER HBx 1.0 1.8 3.88 1466 1259 A 46 PRO HDx A 45 SER HBy 1.0 1.8 3.88 1467 1259 A 45 SER HBx A 46 PRO HDy 1.0 1.8 3.88 1468 1260 A 48 GLY H A 47 SER HBx 1.0 1.8 4.59 1469 1260 A 48 GLY H A 47 SER HBy 1.0 1.8 4.59 1470 1261 A 49 GLU HA A 48 GLY HAy 1.0 1.8 4.75 1471 1261 A 49 GLU HA A 48 GLY HAx 1.0 1.8 4.75 1472 1262 A 49 GLU H A 49 GLU HBx 1.0 1.8 3.20 1473 1262 A 49 GLU H A 49 GLU HBy 1.0 1.8 3.20 1474 1263 A 49 GLU H A 49 GLU HGx 1.0 1.8 3.70 1475 1263 A 49 GLU H A 49 GLU HGy 1.0 1.8 3.70 1476 1264 A 49 GLU HA A 49 GLU HGx 1.0 1.8 3.93 1477 1264 A 49 GLU HA A 49 GLU HGy 1.0 1.8 3.93 1478 1265 A 50 LYS H A 49 GLU HBx 1.0 1.8 4.81 1479 1265 A 50 LYS H A 49 GLU HBy 1.0 1.8 4.81 1480 1266 A 50 LYS H A 50 LYS HBx 1.0 1.8 3.83 1481 1266 A 50 LYS H A 50 LYS HBy 1.0 1.8 3.83 1482 1267 A 50 LYS HA A 50 LYS HGx 1.0 1.8 3.77 1483 1267 A 50 LYS HA A 50 LYS HGy 1.0 1.8 3.77 1484 1268 A 50 LYS HA A 50 LYS HDx 1.0 1.8 5.18 1485 1268 A 50 LYS HA A 50 LYS HDy 1.0 1.8 5.18 1486 1269 A 50 LYS HA A 50 LYS HEy 1.0 1.8 5.29 1487 1269 A 50 LYS HA A 50 LYS HEx 1.0 1.8 5.29 1488 1270 A 50 LYS HBy A 50 LYS HDx 1.0 1.8 2.71 1489 1270 A 50 LYS HBx A 50 LYS HDx 1.0 1.8 2.71 1490 1270 A 50 LYS HDy A 50 LYS HBx 1.0 1.8 2.71 1491 1270 A 50 LYS HBy A 50 LYS HDy 1.0 1.8 2.71 1492 1271 A 50 LYS HBx A 50 LYS HEy 1.0 1.8 3.15 1493 1271 A 50 LYS HBy A 50 LYS HEy 1.0 1.8 3.15 1494 1271 A 50 LYS HEx A 50 LYS HBx 1.0 1.8 3.15 1495 1271 A 50 LYS HBy A 50 LYS HEx 1.0 1.8 3.15 1496 1272 A 51 THR H A 50 LYS HBx 1.0 1.8 4.74 1497 1272 A 51 THR H A 50 LYS HBy 1.0 1.8 4.74 1498 1273 A 50 LYS HDx A 50 LYS HGx 1.0 1.8 2.42 1499 1273 A 50 LYS HDy A 50 LYS HGx 1.0 1.8 2.42 1500 1273 A 50 LYS HGy A 50 LYS HDx 1.0 1.8 2.42 1501 1273 A 50 LYS HGy A 50 LYS HDy 1.0 1.8 2.42 1502 1274 A 50 LYS HEx A 50 LYS HGx 1.0 1.8 3.19 1503 1274 A 50 LYS HEy A 50 LYS HGx 1.0 1.8 3.19 1504 1274 A 50 LYS HGy A 50 LYS HEy 1.0 1.8 3.19 1505 1274 A 50 LYS HGy A 50 LYS HEx 1.0 1.8 3.19 1506 1275 A 50 LYS HDy A 50 LYS HEy 1.0 1.8 2.57 1507 1275 A 50 LYS HDx A 50 LYS HEy 1.0 1.8 2.57 1508 1275 A 50 LYS HEx A 50 LYS HDx 1.0 1.8 2.57 1509 1275 A 50 LYS HDy A 50 LYS HEx 1.0 1.8 2.57 1510 1276 A 51 THR HG2% A 53 ARG HBy 1.0 1.8 4.50 1511 1276 A 51 THR HG2% A 53 ARG HBx 1.0 1.8 4.50 1512 1277 A 51 THR HG2% A 53 ARG HGx 1.0 1.8 4.55 1513 1277 A 51 THR HG2% A 53 ARG HGy 1.0 1.8 4.55 1514 1278 A 52 LEU H A 53 ARG HGx 1.0 1.8 4.70 1515 1278 A 52 LEU H A 53 ARG HGy 1.0 1.8 4.70 1516 1279 A 53 ARG H A 53 ARG HBy 1.0 1.8 3.77 1517 1279 A 53 ARG H A 53 ARG HBx 1.0 1.8 3.77 1518 1280 A 53 ARG H A 53 ARG HGx 1.0 1.8 3.27 1519 1280 A 53 ARG H A 53 ARG HGy 1.0 1.8 3.27 1520 1281 A 53 ARG H A 53 ARG HDy 1.0 1.8 5.43 1521 1281 A 53 ARG H A 53 ARG HDx 1.0 1.8 5.43 1522 1282 A 53 ARG HA A 53 ARG HGx 1.0 1.8 3.44 1523 1282 A 53 ARG HA A 53 ARG HGy 1.0 1.8 3.44 1524 1283 A 53 ARG HA A 53 ARG HDy 1.0 1.8 4.58 1525 1283 A 53 ARG HA A 53 ARG HDx 1.0 1.8 4.58 1526 1284 A 53 ARG HBy A 53 ARG HGx 1.0 1.8 2.54 1527 1284 A 53 ARG HBx A 53 ARG HGx 1.0 1.8 2.54 1528 1284 A 53 ARG HGy A 53 ARG HBy 1.0 1.8 2.54 1529 1284 A 53 ARG HBx A 53 ARG HGy 1.0 1.8 2.54 1530 1285 A 53 ARG HBy A 53 ARG HDy 1.0 1.8 3.08 1531 1285 A 53 ARG HBx A 53 ARG HDy 1.0 1.8 3.08 1532 1285 A 53 ARG HDx A 53 ARG HBy 1.0 1.8 3.08 1533 1285 A 53 ARG HBx A 53 ARG HDx 1.0 1.8 3.08 1534 1286 A 54 GLY H A 53 ARG HBy 1.0 1.8 4.62 1535 1286 A 54 GLY H A 53 ARG HBx 1.0 1.8 4.62 1536 1287 A 54 GLY H A 53 ARG HGx 1.0 1.8 5.39 1537 1287 A 54 GLY H A 53 ARG HGy 1.0 1.8 5.39 1538 1288 A 55 THR H A 54 GLY HAy 1.0 1.8 3.44 1539 1288 A 55 THR H A 54 GLY HAx 1.0 1.8 3.44 1540 1289 A 56 THR HG2% A 57 TRP HBy 1.0 1.8 5.12 1541 1289 A 56 THR HG2% A 57 TRP HBx 1.0 1.8 5.12 1542 1290 A 57 TRP H A 57 TRP HBy 1.0 1.8 4.03 1543 1290 A 57 TRP H A 57 TRP HBx 1.0 1.8 4.03 1544 1291 A 58 TYR H A 58 TYR HBx 1.0 1.8 4.00 1545 1291 A 58 TYR H A 58 TYR HBy 1.0 1.8 4.00 1546 1292 A 63 ILE HD1% A 58 TYR HBx 1.0 1.8 3.65 1547 1292 A 63 ILE HD1% A 58 TYR HBy 1.0 1.8 3.65 1548 1293 A 59 ASN HBx A 62 GLU HGy 1.0 1.8 5.70 1549 1293 A 62 GLU HGx A 59 ASN HBx 1.0 1.8 5.70 1550 1293 A 62 GLU HGx A 59 ASN HBy 1.0 1.8 5.70 1551 1293 A 59 ASN HBy A 62 GLU HGy 1.0 1.8 5.70 1552 1294 A 59 ASN HD2y A 62 GLU HGy 1.0 1.8 4.19 1553 1294 A 59 ASN HD2x A 62 GLU HGy 1.0 1.8 4.19 1554 1294 A 62 GLU HGx A 59 ASN HD2y 1.0 1.8 4.19 1555 1294 A 59 ASN HD2x A 62 GLU HGx 1.0 1.8 4.19 1556 1295 A 60 TYR H A 61 PRO HDx 1.0 1.8 4.86 1557 1295 A 60 TYR H A 61 PRO HDy 1.0 1.8 4.86 1558 1296 A 60 TYR HBx A 61 PRO HDx 1.0 1.8 4.37 1559 1296 A 60 TYR HBx A 61 PRO HDy 1.0 1.8 4.37 1560 1297 A 60 TYR HD% A 61 PRO HDx 1.0 1.8 6.04 1561 1297 A 60 TYR HD% A 61 PRO HDy 1.0 1.8 6.04 1562 1298 A 61 PRO HA A 62 GLU HGy 1.0 1.8 6.39 1563 1298 A 61 PRO HA A 62 GLU HGx 1.0 1.8 6.39 1564 1299 A 61 PRO HA A 64 ASN HBx 1.0 1.8 4.32 1565 1299 A 61 PRO HA A 64 ASN HBy 1.0 1.8 4.32 1566 1300 A 62 GLU H A 61 PRO HBy 1.0 1.8 4.17 1567 1300 A 62 GLU H A 61 PRO HBx 1.0 1.8 4.17 1568 1301 A 62 GLU H A 61 PRO HGx 1.0 1.8 4.28 1569 1301 A 62 GLU H A 61 PRO HGy 1.0 1.8 4.28 1570 1302 A 62 GLU H A 61 PRO HDx 1.0 1.8 4.29 1571 1302 A 62 GLU H A 61 PRO HDy 1.0 1.8 4.29 1572 1303 A 62 GLU H A 64 ASN HBx 1.0 1.8 6.39 1573 1303 A 62 GLU H A 64 ASN HBy 1.0 1.8 6.39 1574 1304 A 62 GLU HA A 62 GLU HGy 1.0 1.8 3.44 1575 1304 A 62 GLU HA A 62 GLU HGx 1.0 1.8 3.44 1576 1305 A 63 ILE H A 62 GLU HGy 1.0 1.8 5.05 1577 1305 A 63 ILE H A 62 GLU HGx 1.0 1.8 5.05 1578 1306 A 63 ILE H A 63 ILE HG1x 1.0 1.8 4.27 1579 1306 A 63 ILE H A 63 ILE HG1y 1.0 1.8 4.27 1580 1307 A 63 ILE HA A 66 PHE HBy 1.0 1.8 4.25 1581 1307 A 63 ILE HA A 66 PHE HBx 1.0 1.8 4.25 1582 1308 A 63 ILE HG2% A 63 ILE HG1x 1.0 1.8 3.61 1583 1308 A 63 ILE HG2% A 63 ILE HG1y 1.0 1.8 3.61 1584 1309 A 63 ILE HG2% A 66 PHE HBy 1.0 1.8 6.37 1585 1309 A 63 ILE HG2% A 66 PHE HBx 1.0 1.8 6.37 1586 1310 A 64 ASN H A 63 ILE HG1x 1.0 1.8 6.39 1587 1310 A 64 ASN H A 63 ILE HG1y 1.0 1.8 6.39 1588 1311 A 64 ASN H A 64 ASN HBx 1.0 1.8 3.43 1589 1311 A 64 ASN H A 64 ASN HBy 1.0 1.8 3.43 1590 1312 A 64 ASN H A 64 ASN HD2y 1.0 1.8 6.09 1591 1312 A 64 ASN H A 64 ASN HD2x 1.0 1.8 6.09 1592 1313 A 64 ASN HBx A 64 ASN HD2y 1.0 1.8 3.47 1593 1313 A 64 ASN HBy A 64 ASN HD2y 1.0 1.8 3.47 1594 1313 A 64 ASN HD2x A 64 ASN HBx 1.0 1.8 3.47 1595 1313 A 64 ASN HBy A 64 ASN HD2x 1.0 1.8 3.47 1596 1314 A 65 LYS H A 64 ASN HBx 1.0 1.8 4.00 1597 1314 A 65 LYS H A 64 ASN HBy 1.0 1.8 4.00 1598 1315 A 65 LYS H A 65 LYS HGx 1.0 1.8 5.03 1599 1315 A 65 LYS H A 65 LYS HGy 1.0 1.8 5.03 1600 1316 A 65 LYS H A 65 LYS HDx 1.0 1.8 4.89 1601 1316 A 65 LYS H A 65 LYS HDy 1.0 1.8 4.89 1602 1317 A 65 LYS HA A 65 LYS HDx 1.0 1.8 4.98 1603 1317 A 65 LYS HA A 65 LYS HDy 1.0 1.8 4.98 1604 1318 A 65 LYS HA A 68 ARG HBy 1.0 1.8 3.88 1605 1318 A 65 LYS HA A 68 ARG HBx 1.0 1.8 3.88 1606 1319 A 65 LYS HBx A 65 LYS HDx 1.0 1.8 3.28 1607 1319 A 65 LYS HBy A 65 LYS HDx 1.0 1.8 3.28 1608 1319 A 65 LYS HDy A 65 LYS HBy 1.0 1.8 3.28 1609 1319 A 65 LYS HDy A 65 LYS HBx 1.0 1.8 3.28 1610 1320 A 65 LYS HBx A 65 LYS HEy 1.0 1.8 4.18 1611 1320 A 65 LYS HBy A 65 LYS HEy 1.0 1.8 4.18 1612 1320 A 65 LYS HEx A 65 LYS HBy 1.0 1.8 4.18 1613 1320 A 65 LYS HBx A 65 LYS HEx 1.0 1.8 4.18 1614 1321 A 66 PHE H A 65 LYS HBy 1.0 1.8 3.87 1615 1321 A 66 PHE H A 65 LYS HBx 1.0 1.8 3.87 1616 1322 A 67 ILE H A 65 LYS HBy 1.0 1.8 6.34 1617 1322 A 67 ILE H A 65 LYS HBx 1.0 1.8 6.34 1618 1323 A 65 LYS HDx A 65 LYS HGx 1.0 1.8 2.56 1619 1323 A 65 LYS HDy A 65 LYS HGx 1.0 1.8 2.56 1620 1323 A 65 LYS HGy A 65 LYS HDx 1.0 1.8 2.56 1621 1323 A 65 LYS HGy A 65 LYS HDy 1.0 1.8 2.56 1622 1324 A 65 LYS HEy A 65 LYS HGx 1.0 1.8 3.15 1623 1324 A 65 LYS HEx A 65 LYS HGx 1.0 1.8 3.15 1624 1324 A 65 LYS HGy A 65 LYS HEy 1.0 1.8 3.15 1625 1324 A 65 LYS HGy A 65 LYS HEx 1.0 1.8 3.15 1626 1325 A 68 ARG H A 65 LYS HGx 1.0 1.8 6.39 1627 1325 A 68 ARG H A 65 LYS HGy 1.0 1.8 6.39 1628 1326 A 66 PHE H A 66 PHE HBy 1.0 1.8 3.32 1629 1326 A 66 PHE H A 66 PHE HBx 1.0 1.8 3.32 1630 1327 A 66 PHE HA A 69 ASP HBy 1.0 1.8 4.42 1631 1327 A 66 PHE HA A 69 ASP HBx 1.0 1.8 4.42 1632 1328 A 67 ILE H A 66 PHE HBy 1.0 1.8 4.31 1633 1328 A 67 ILE H A 66 PHE HBx 1.0 1.8 4.31 1634 1329 A 67 ILE H A 68 ARG HBy 1.0 1.8 6.39 1635 1329 A 67 ILE H A 68 ARG HBx 1.0 1.8 6.39 1636 1330 A 68 ARG H A 68 ARG HBy 1.0 1.8 3.19 1637 1330 A 68 ARG H A 68 ARG HBx 1.0 1.8 3.19 1638 1331 A 68 ARG H A 68 ARG HGx 1.0 1.8 4.46 1639 1331 A 68 ARG H A 68 ARG HGy 1.0 1.8 4.46 1640 1332 A 68 ARG HA A 68 ARG HGx 1.0 1.8 4.10 1641 1332 A 68 ARG HA A 68 ARG HGy 1.0 1.8 4.10 1642 1333 A 68 ARG HA A 68 ARG HDy 1.0 1.8 5.47 1643 1333 A 68 ARG HA A 68 ARG HDx 1.0 1.8 5.47 1644 1334 A 68 ARG HA A 71 LEU HBx 1.0 1.8 4.93 1645 1334 A 68 ARG HA A 71 LEU HBy 1.0 1.8 4.93 1646 1335 A 68 ARG HBx A 68 ARG HDy 1.0 1.8 3.64 1647 1335 A 68 ARG HBy A 68 ARG HDy 1.0 1.8 3.64 1648 1335 A 68 ARG HDx A 68 ARG HBy 1.0 1.8 3.64 1649 1335 A 68 ARG HBx A 68 ARG HDx 1.0 1.8 3.64 1650 1336 A 69 ASP H A 68 ARG HBy 1.0 1.8 3.97 1651 1336 A 69 ASP H A 68 ARG HBx 1.0 1.8 3.97 1652 1337 A 68 ARG HDx A 68 ARG HGx 1.0 1.8 2.52 1653 1337 A 68 ARG HDy A 68 ARG HGx 1.0 1.8 2.52 1654 1337 A 68 ARG HGy A 68 ARG HDy 1.0 1.8 2.52 1655 1337 A 68 ARG HGy A 68 ARG HDx 1.0 1.8 2.52 1656 1338 A 69 ASP H A 68 ARG HGx 1.0 1.8 6.39 1657 1338 A 69 ASP H A 68 ARG HGy 1.0 1.8 6.39 1658 1339 A 69 ASP H A 68 ARG HDy 1.0 1.8 5.42 1659 1339 A 69 ASP H A 68 ARG HDx 1.0 1.8 5.42 1660 1340 A 69 ASP H A 71 LEU HBx 1.0 1.8 6.39 1661 1340 A 69 ASP H A 71 LEU HBy 1.0 1.8 6.39 1662 1341 A 70 SER H A 70 SER HBx 1.0 1.8 3.36 1663 1341 A 70 SER H A 70 SER HBy 1.0 1.8 3.36 1664 1342 A 71 LEU H A 70 SER HBx 1.0 1.8 4.48 1665 1342 A 71 LEU H A 70 SER HBy 1.0 1.8 4.48 1666 1343 A 71 LEU H A 71 LEU HBx 1.0 1.8 3.32 1667 1343 A 71 LEU H A 71 LEU HBy 1.0 1.8 3.32 1668 1344 A 71 LEU HG A 71 LEU HBx 1.0 1.8 2.75 1669 1344 A 71 LEU HG A 71 LEU HBy 1.0 1.8 2.75 1670 1345 A 71 LEU HDx% A 71 LEU HBx 1.0 1.8 3.01 1671 1345 A 71 LEU HDx% A 71 LEU HBy 1.0 1.8 3.01 1672 1346 A 71 LEU HDy% A 71 LEU HBx 1.0 1.8 3.05 1673 1346 A 71 LEU HDy% A 71 LEU HBy 1.0 1.8 3.05 1674 1347 A 72 GLU H A 71 LEU HBx 1.0 1.8 4.46 1675 1347 A 72 GLU H A 71 LEU HBy 1.0 1.8 4.46 1676 1348 A 71 LEU HDy% A 72 GLU HGy 1.0 1.8 6.39 1677 1348 A 71 LEU HDy% A 72 GLU HGx 1.0 1.8 6.39 1678 1349 A 72 GLU H A 72 GLU HBy 1.0 1.8 3.90 1679 1349 A 72 GLU H A 72 GLU HBx 1.0 1.8 3.90 1680 1350 A 72 GLU H A 72 GLU HGy 1.0 1.8 3.86 1681 1350 A 72 GLU H A 72 GLU HGx 1.0 1.8 3.86 1682 1351 A 72 GLU HA A 72 GLU HGy 1.0 1.8 3.76 1683 1351 A 72 GLU HA A 72 GLU HGx 1.0 1.8 3.76 1684 1352 A 72 GLU HBy A 72 GLU HGy 1.0 1.8 2.58 1685 1352 A 72 GLU HBx A 72 GLU HGy 1.0 1.8 2.58 1686 1352 A 72 GLU HGx A 72 GLU HBy 1.0 1.8 2.58 1687 1352 A 72 GLU HGx A 72 GLU HBx 1.0 1.8 2.58 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 GLU C A 10 TRP N A 10 TRP CA A 10 TRP C 1.0 -169.5 -58.0 PHI 2 2 A 10 TRP N A 10 TRP CA A 10 TRP C A 11 MET N 1.0 113.3 179.9 PSI 3 3 A 10 TRP C A 11 MET N A 11 MET CA A 11 MET C 1.0 -173.2 -77.3 PHI 4 4 A 11 MET N A 11 MET CA A 11 MET C A 12 VAL N 1.0 133.4 186.6 PSI 5 5 A 11 MET C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -101.1 -54.9 PHI 6 6 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 GLU N 1.0 146.1 186.1 PSI 7 7 A 12 VAL C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -77.1 -37.1 PHI 8 8 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 LYS N 1.0 -64.8 -24.8 PSI 9 9 A 13 GLU C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -81.2 -41.2 PHI 10 10 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ALA N 1.0 -58.1 -18.1 PSI 11 11 A 14 LYS C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -91.1 -45.5 PHI 12 12 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 LEU N 1.0 -59.2 -19.2 PSI 13 13 A 15 ALA C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -86.0 -46.0 PHI 14 14 A 16 LEU N A 16 LEU CA A 16 LEU C A 17 MET N 1.0 -57.1 -17.1 PSI 15 15 A 16 LEU C A 17 MET N A 17 MET CA A 17 MET C 1.0 -83.0 -43.0 PHI 16 16 A 17 MET N A 17 MET CA A 17 MET C A 18 VAL N 1.0 -64.9 -24.9 PSI 17 17 A 17 MET C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -88.1 -41.9 PHI 18 18 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 ARG N 1.0 -63.6 -23.6 PSI 19 19 A 18 VAL C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -103.8 -48.3 PHI 20 20 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 THR N 1.0 -61.5 12.8 PSI 21 21 A 19 ARG C A 20 THR N A 20 THR CA A 20 THR C 1.0 -143.6 -94.1 PHI 22 22 A 20 THR N A 20 THR CA A 20 THR C A 21 GLY N 1.0 -29.7 16.4 PSI 23 23 A 23 GLY C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -79.0 -39.0 PHI 24 24 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 ARG N 1.0 -58.6 -18.6 PSI 25 25 A 24 ALA C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -85.7 -45.7 PHI 26 26 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 GLN N 1.0 -59.0 -19.0 PSI 27 27 A 25 ARG C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -83.9 -43.9 PHI 28 28 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 ILE N 1.0 -66.7 -26.7 PSI 29 29 A 26 GLN C A 27 ILE N A 27 ILE CA A 27 ILE C 1.0 -83.3 -43.3 PHI 30 30 A 27 ILE N A 27 ILE CA A 27 ILE C A 28 GLU N 1.0 -63.7 -23.7 PSI 31 31 A 27 ILE C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -77.6 -37.6 PHI 32 32 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 SER N 1.0 -62.4 -22.4 PSI 33 33 A 28 GLU C A 29 SER N A 29 SER CA A 29 SER C 1.0 -84.6 -44.6 PHI 34 34 A 29 SER N A 29 SER CA A 29 SER C A 30 TYR N 1.0 -65.2 -25.2 PSI 35 35 A 29 SER C A 30 TYR N A 30 TYR CA A 30 TYR C 1.0 -87.7 -47.7 PHI 36 36 A 30 TYR N A 30 TYR CA A 30 TYR C A 31 ARG N 1.0 -55.7 -15.7 PSI 37 37 A 30 TYR C A 31 ARG N A 31 ARG CA A 31 ARG C 1.0 -80.8 -40.8 PHI 38 38 A 31 ARG N A 31 ARG CA A 31 ARG C A 32 GLN N 1.0 -60.9 -11.8 PSI 39 39 A 31 ARG C A 32 GLN N A 32 GLN CA A 32 GLN C 1.0 -111.0 -58.0 PHI 40 40 A 32 GLN N A 32 GLN CA A 32 GLN C A 33 GLY N 1.0 -42.1 28.1 PSI 41 41 A 34 ALA C A 35 TRP N A 35 TRP CA A 35 TRP C 1.0 -165.7 -72.4 PHI 42 42 A 35 TRP N A 35 TRP CA A 35 TRP C A 36 ILE N 1.0 105.5 174.8 PSI 43 43 A 35 TRP C A 36 ILE N A 36 ILE CA A 36 ILE C 1.0 -151.2 -72.1 PHI 44 44 A 36 ILE N A 36 ILE CA A 36 ILE C A 37 GLU N 1.0 108.9 148.9 PSI 45 45 A 36 ILE C A 37 GLU N A 37 GLU CA A 37 GLU C 1.0 -99.4 -56.6 PHI 46 46 A 37 GLU N A 37 GLU CA A 37 GLU C A 38 GLY N 1.0 112.1 152.1 PSI 47 47 A 41 PHE C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -174.8 -84.1 PHI 48 48 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 ARG N 1.0 99.7 184.2 PSI 49 49 A 42 LYS C A 43 ARG N A 43 ARG CA A 43 ARG C 1.0 -141.2 -74.7 PHI 50 50 A 43 ARG N A 43 ARG CA A 43 ARG C A 44 VAL N 1.0 104.1 167.0 PSI 51 51 A 43 ARG C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -174.2 -34.2 PHI 52 52 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 SER N 1.0 95.3 167.7 PSI 53 53 A 44 VAL C A 45 SER N A 45 SER CA A 45 SER C 1.0 -89.9 -49.9 PHI 54 54 A 45 SER N A 45 SER CA A 45 SER C A 46 PRO N 1.0 103.3 168.9 PSI 55 55 A 54 GLY C A 55 THR N A 55 THR CA A 55 THR C 1.0 -147.9 -51.5 PHI 56 56 A 55 THR N A 55 THR CA A 55 THR C A 56 THR N 1.0 115.3 155.3 PSI 57 57 A 55 THR C A 56 THR N A 56 THR CA A 56 THR C 1.0 -129.7 -68.9 PHI 58 58 A 56 THR N A 56 THR CA A 56 THR C A 57 TRP N 1.0 101.4 147.2 PSI 59 59 A 56 THR C A 57 TRP N A 57 TRP CA A 57 TRP C 1.0 -156.2 -78.9 PHI 60 60 A 57 TRP N A 57 TRP CA A 57 TRP C A 58 TYR N 1.0 100.6 185.9 PSI 61 61 A 57 TRP C A 58 TYR N A 58 TYR CA A 58 TYR C 1.0 -144.1 -80.0 PHI 62 62 A 58 TYR N A 58 TYR CA A 58 TYR C A 59 ASN N 1.0 105.3 157.1 PSI 63 63 A 58 TYR C A 59 ASN N A 59 ASN CA A 59 ASN C 1.0 -122.0 -53.1 PHI 64 64 A 59 ASN N A 59 ASN CA A 59 ASN C A 60 TYR N 1.0 46.3 180.1 PSI 65 65 A 59 ASN C A 60 TYR N A 60 TYR CA A 60 TYR C 1.0 -76.0 -36.0 PHI 66 66 A 60 TYR N A 60 TYR CA A 60 TYR C A 61 PRO N 1.0 -64.0 -24.0 PSI 67 67 A 61 PRO C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -90.1 -50.1 PHI 68 68 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 ILE N 1.0 -55.5 -15.5 PSI 69 69 A 62 GLU C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -86.3 -46.3 PHI 70 70 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 ASN N 1.0 -59.9 -19.9 PSI 71 71 A 63 ILE C A 64 ASN N A 64 ASN CA A 64 ASN C 1.0 -84.0 -44.0 PHI 72 72 A 64 ASN N A 64 ASN CA A 64 ASN C A 65 LYS N 1.0 -64.2 -24.2 PSI 73 73 A 64 ASN C A 65 LYS N A 65 LYS CA A 65 LYS C 1.0 -84.3 -44.3 PHI 74 74 A 65 LYS N A 65 LYS CA A 65 LYS C A 66 PHE N 1.0 -58.6 -18.6 PSI 75 75 A 65 LYS C A 66 PHE N A 66 PHE CA A 66 PHE C 1.0 -84.5 -44.5 PHI 76 76 A 66 PHE N A 66 PHE CA A 66 PHE C A 67 ILE N 1.0 -62.6 -22.6 PSI 77 77 A 66 PHE C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -86.4 -46.4 PHI 78 78 A 67 ILE N A 67 ILE CA A 67 ILE C A 68 ARG N 1.0 -62.4 -22.4 PSI 79 79 A 67 ILE C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -81.9 -41.9 PHI 80 80 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 ASP N 1.0 -67.2 -6.7 PSI 81 81 A 68 ARG C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -92.9 -43.8 PHI 82 82 A 69 ASP N A 69 ASP CA A 69 ASP C A 70 SER N 1.0 -59.1 -19.1 PSI 83 83 A 69 ASP C A 70 SER N A 70 SER CA A 70 SER C 1.0 -83.1 -43.1 PHI 84 84 A 70 SER N A 70 SER CA A 70 SER C A 71 LEU N 1.0 -63.1 -23.1 PSI 85 85 A 70 SER C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -85.5 -45.5 PHI 86 86 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 GLU N 1.0 -62.2 -22.2 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 14085.287916887 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 2513 stop_ save_