data_nef_c17079_2l1b save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17072 BMRB 17071 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 2 8 ARG C 2 9 M3L N 2 9 M3L C 2 10 SER N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 GLU middle . . 3 A 3 GLN middle . . 4 A 4 VAL middle . . 5 A 5 PHE middle . . 6 A 6 ALA middle . . 7 A 7 VAL middle . . 8 A 8 GLU middle . . 9 A 9 SER middle . . 10 A 10 ILE middle . . 11 A 11 ARG middle . . 12 A 12 LYS middle . . 13 A 13 LYS middle . . 14 A 14 ARG middle . . 15 A 15 VAL middle . . 16 A 16 ARG middle . . 17 A 17 LYS middle . . 18 A 18 GLY middle . false 19 A 19 LYS middle . . 20 A 20 VAL middle . . 21 A 21 GLU middle . . 22 A 22 TYR middle . . 23 A 23 LEU middle . . 24 A 24 VAL middle . . 25 A 25 LYS middle . . 26 A 26 TRP middle . . 27 A 27 LYS middle . . 28 A 28 GLY middle . false 29 A 29 TRP middle . . 30 A 30 PRO middle . false 31 A 31 PRO middle . false 32 A 32 LYS middle . . 33 A 33 TYR middle . . 34 A 34 SER middle . . 35 A 35 THR middle . . 36 A 36 TRP middle . . 37 A 37 GLU middle . . 38 A 38 PRO middle . false 39 A 39 GLU middle . . 40 A 40 GLU middle . . 41 A 41 HIS middle . . 42 A 42 ILE middle . . 43 A 43 LEU middle . . 44 A 44 ASP middle . . 45 A 45 PRO middle . false 46 A 46 ARG middle . . 47 A 47 LEU middle . . 48 A 48 VAL middle . . 49 A 49 MET middle . . 50 A 50 ALA middle . . 51 A 51 TYR middle . . 52 A 52 GLU middle . . 53 A 53 GLU middle . . 54 A 54 LYS middle . . 55 A 55 GLU middle . . 56 A 56 GLU end . . 57 B 19 GLN start . . 58 B 20 LEU middle . . 59 B 21 ALA middle . . 60 B 22 THR middle . . 61 B 23 LYS middle . . 62 B 24 ALA middle . . 63 B 25 ALA middle . . 64 B 26 ARG middle -OXT . 65 B 27 M3L middle -H2,-OXT . 66 B 28 SER middle -H2 . 67 B 29 ALA middle . . 68 B 30 PRO middle . false 69 B 31 ALA middle . . 70 B 32 THR middle . . 71 B 33 GLY end . false 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 4.18 0.0300 A 3 GLN HBy H 1 2.00 0.0300 A 3 GLN HBx H 1 1.91 0.0300 A 3 GLN HE2x H 1 6.76 0.0300 A 3 GLN HE2y H 1 7.36 0.0300 A 3 GLN HGy H 1 2.23 0.0300 A 3 GLN HGx H 1 2.17 0.0300 A 3 GLN C C 13 178.35 0.4000 A 3 GLN CA C 13 55.61 0.4000 A 3 GLN CB C 13 29.68 0.4000 A 3 GLN CG C 13 33.99 0.4000 A 3 GLN NE2 N 15 112.16 0.4000 A 4 VAL H H 1 7.50 0.0300 A 4 VAL HA H 1 4.38 0.0300 A 4 VAL HB H 1 1.66 0.0300 A 4 VAL HG1% H 1 0.68 0.0300 A 4 VAL HG2% H 1 0.68 0.0300 A 4 VAL C C 13 177.19 0.4000 A 4 VAL CA C 13 61.29 0.4000 A 4 VAL CB C 13 33.30 0.4000 A 4 VAL CG1 C 13 22.21 0.4000 A 4 VAL CG2 C 13 20.95 0.4000 A 4 VAL N N 15 119.99 0.4000 A 5 PHE H H 1 8.83 0.0300 A 5 PHE HA H 1 4.79 0.0300 A 5 PHE HBy H 1 3.11 0.0300 A 5 PHE HBx H 1 2.70 0.0300 A 5 PHE HD1 H 1 6.95 0.0300 A 5 PHE HD2 H 1 6.95 0.0300 A 5 PHE HE1 H 1 7.04 0.0300 A 5 PHE HE2 H 1 7.04 0.0300 A 5 PHE HZ H 1 7.08 0.0300 A 5 PHE C C 13 177.94 0.4000 A 5 PHE CA C 13 56.41 0.4000 A 5 PHE CB C 13 43.89 0.4000 A 5 PHE CD1 C 13 132.38 0.4000 A 5 PHE CE1 C 13 129.75 0.4000 A 5 PHE CZ C 13 131.25 0.4000 A 5 PHE N N 15 123.77 0.4000 A 6 ALA H H 1 8.62 0.0300 A 6 ALA HA H 1 4.75 0.0300 A 6 ALA HB% H 1 1.56 0.0300 A 6 ALA C C 13 174.22 0.4000 A 6 ALA CA C 13 52.29 0.4000 A 6 ALA CB C 13 19.97 0.4000 A 6 ALA N N 15 122.27 0.4000 A 7 VAL H H 1 9.06 0.0300 A 7 VAL HA H 1 3.69 0.0300 A 7 VAL HB H 1 1.64 0.0300 A 7 VAL HGx% H 1 0.65 0.0300 A 7 VAL HGy% H 1 0.41 0.0300 A 7 VAL C C 13 177.25 0.4000 A 7 VAL CA C 13 62.83 0.4000 A 7 VAL CB C 13 34.23 0.4000 A 7 VAL CG1 C 13 23.77 0.4000 A 7 VAL CG2 C 13 22.53 0.4000 A 7 VAL N N 15 125.81 0.4000 A 8 GLU H H 1 8.96 0.0300 A 8 GLU HA H 1 4.29 0.0300 A 8 GLU HBy H 1 1.82 0.0300 A 8 GLU HBx H 1 1.67 0.0300 A 8 GLU HGy H 1 2.22 0.0300 A 8 GLU HGx H 1 2.06 0.0300 A 8 GLU C C 13 176.69 0.4000 A 8 GLU CA C 13 57.84 0.4000 A 8 GLU CB C 13 31.65 0.4000 A 8 GLU CG C 13 36.14 0.4000 A 8 GLU N N 15 127.56 0.4000 A 9 SER H H 1 7.64 0.0300 A 9 SER HA H 1 4.21 0.0300 A 9 SER HBy H 1 3.78 0.0300 A 9 SER HBx H 1 3.64 0.0300 A 9 SER C C 13 174.20 0.4000 A 9 SER CA C 13 57.65 0.4000 A 9 SER CB C 13 64.87 0.4000 A 9 SER N N 15 109.51 0.4000 A 10 ILE H H 1 8.21 0.0300 A 10 ILE HA H 1 4.21 0.0300 A 10 ILE HB H 1 1.52 0.0300 A 10 ILE HD1% H 1 0.15 0.0300 A 10 ILE HG1y H 1 1.10 0.0300 A 10 ILE HG1x H 1 0.71 0.0300 A 10 ILE HG2% H 1 0.38 0.0300 A 10 ILE C C 13 176.36 0.4000 A 10 ILE CA C 13 60.06 0.4000 A 10 ILE CB C 13 37.99 0.4000 A 10 ILE CD1 C 13 12.55 0.4000 A 10 ILE CG1 C 13 27.86 0.4000 A 10 ILE CG2 C 13 17.97 0.4000 A 10 ILE N N 15 119.97 0.4000 A 11 ARG H H 1 8.95 0.0300 A 11 ARG HA H 1 4.28 0.0300 A 11 ARG HBy H 1 1.87 0.0300 A 11 ARG HBx H 1 1.24 0.0300 A 11 ARG HDy H 1 2.99 0.0300 A 11 ARG HDx H 1 2.79 0.0300 A 11 ARG HGy H 1 1.53 0.0300 A 11 ARG HGx H 1 1.44 0.0300 A 11 ARG C C 13 176.18 0.4000 A 11 ARG CA C 13 56.35 0.4000 A 11 ARG CB C 13 32.25 0.4000 A 11 ARG CD C 13 42.62 0.4000 A 11 ARG CG C 13 26.04 0.4000 A 11 ARG N N 15 123.59 0.4000 A 12 LYS H H 1 6.99 0.0300 A 12 LYS HA H 1 4.67 0.0300 A 12 LYS HBy H 1 1.89 0.0300 A 12 LYS HBx H 1 1.58 0.0300 A 12 LYS HDy H 1 1.86 0.0300 A 12 LYS HDx H 1 1.75 0.0300 A 12 LYS HE2 H 1 3.03 0.0300 A 12 LYS HE3 H 1 3.03 0.0300 A 12 LYS HGx H 1 1.46 0.0300 A 12 LYS HGy H 1 1.61 0.0300 A 12 LYS C C 13 175.96 0.4000 A 12 LYS CA C 13 55.31 0.4000 A 12 LYS CB C 13 38.14 0.4000 A 12 LYS CD C 13 29.37 0.4000 A 12 LYS CE C 13 42.24 0.4000 A 12 LYS CG C 13 26.06 0.4000 A 12 LYS N N 15 115.30 0.4000 A 13 LYS H H 1 8.13 0.0300 A 13 LYS HA H 1 5.31 0.0300 A 13 LYS HBy H 1 1.72 0.0300 A 13 LYS HBx H 1 1.49 0.0300 A 13 LYS HD2 H 1 1.66 0.0300 A 13 LYS HD3 H 1 1.66 0.0300 A 13 LYS HEy H 1 2.80 0.0300 A 13 LYS HEx H 1 2.76 0.0300 A 13 LYS HGy H 1 1.03 0.0300 A 13 LYS HGx H 1 0.93 0.0300 A 13 LYS C C 13 177.76 0.4000 A 13 LYS CA C 13 54.93 0.4000 A 13 LYS CB C 13 37.40 0.4000 A 13 LYS CD C 13 30.25 0.4000 A 13 LYS CE C 13 42.18 0.4000 A 13 LYS CG C 13 24.64 0.4000 A 13 LYS N N 15 122.33 0.4000 A 14 ARG H H 1 9.30 0.0300 A 14 ARG HA H 1 4.72 0.0300 A 14 ARG HBy H 1 1.56 0.0300 A 14 ARG HBx H 1 1.26 0.0300 A 14 ARG HDy H 1 2.01 0.0300 A 14 ARG HDx H 1 0.70 0.0300 A 14 ARG HGy H 1 1.08 0.0300 A 14 ARG HGx H 1 0.64 0.0300 A 14 ARG C C 13 180.39 0.4000 A 14 ARG CA C 13 54.13 0.4000 A 14 ARG CB C 13 32.94 0.4000 A 14 ARG CD C 13 42.37 0.4000 A 14 ARG CG C 13 25.11 0.4000 A 14 ARG N N 15 123.93 0.4000 A 15 VAL H H 1 8.15 0.0300 A 15 VAL HA H 1 4.63 0.0300 A 15 VAL HB H 1 1.72 0.0300 A 15 VAL HGx% H 1 0.73 0.0300 A 15 VAL HGy% H 1 0.57 0.0300 A 15 VAL C C 13 176.36 0.4000 A 15 VAL CA C 13 60.91 0.4000 A 15 VAL CB C 13 32.71 0.4000 A 15 VAL CG1 C 13 20.89 0.4000 A 15 VAL CG2 C 13 20.74 0.4000 A 15 VAL N N 15 119.44 0.4000 A 16 ARG H H 1 8.91 0.0300 A 16 ARG HA H 1 4.43 0.0300 A 16 ARG HBy H 1 1.47 0.0300 A 16 ARG HBx H 1 1.15 0.0300 A 16 ARG HDy H 1 3.03 0.0300 A 16 ARG HDx H 1 2.70 0.0300 A 16 ARG HGy H 1 1.30 0.0300 A 16 ARG HGx H 1 1.10 0.0300 A 16 ARG CA C 13 54.83 0.4000 A 16 ARG CB C 13 33.14 0.4000 A 16 ARG CD C 13 42.94 0.4000 A 16 ARG CG C 13 27.26 0.4000 A 16 ARG N N 15 128.64 0.4000 A 17 LYS HA H 1 3.77 0.0300 A 17 LYS HBy H 1 1.87 0.0300 A 17 LYS HBx H 1 1.68 0.0300 A 17 LYS HD2 H 1 1.58 0.0300 A 17 LYS HD3 H 1 1.58 0.0300 A 17 LYS HE2 H 1 2.90 0.0300 A 17 LYS HE3 H 1 2.90 0.0300 A 17 LYS HG2 H 1 1.28 0.0300 A 17 LYS HG3 H 1 1.28 0.0300 A 17 LYS C C 13 175.88 0.4000 A 17 LYS CA C 13 56.94 0.4000 A 17 LYS CB C 13 29.87 0.4000 A 17 LYS CD C 13 29.09 0.4000 A 17 LYS CE C 13 42.11 0.4000 A 17 LYS CG C 13 25.19 0.4000 A 18 GLY H H 1 8.22 0.0300 A 18 GLY HAy H 1 4.00 0.0300 A 18 GLY HAx H 1 3.38 0.0300 A 18 GLY C C 13 178.92 0.4000 A 18 GLY CA C 13 45.29 0.4000 A 18 GLY N N 15 103.05 0.4000 A 19 LYS H H 1 7.70 0.0300 A 19 LYS HA H 1 4.55 0.0300 A 19 LYS HBy H 1 1.89 0.0300 A 19 LYS HBx H 1 1.70 0.0300 A 19 LYS HD2 H 1 1.69 0.0300 A 19 LYS HD3 H 1 1.69 0.0300 A 19 LYS HE2 H 1 2.99 0.0300 A 19 LYS HE3 H 1 2.99 0.0300 A 19 LYS HGy H 1 1.40 0.0300 A 19 LYS HGx H 1 1.34 0.0300 A 19 LYS C C 13 177.59 0.4000 A 19 LYS CA C 13 54.29 0.4000 A 19 LYS CB C 13 33.64 0.4000 A 19 LYS CD C 13 28.44 0.4000 A 19 LYS CE C 13 41.84 0.4000 A 19 LYS CG C 13 24.08 0.4000 A 19 LYS N N 15 121.71 0.4000 A 20 VAL H H 1 8.51 0.0300 A 20 VAL HA H 1 4.16 0.0300 A 20 VAL HB H 1 1.73 0.0300 A 20 VAL HGx% H 1 0.87 0.0300 A 20 VAL HGy% H 1 0.42 0.0300 A 20 VAL C C 13 176.68 0.4000 A 20 VAL CA C 13 63.01 0.4000 A 20 VAL CB C 13 31.94 0.4000 A 20 VAL CG1 C 13 22.10 0.4000 A 20 VAL CG2 C 13 21.93 0.4000 A 20 VAL N N 15 124.57 0.4000 A 21 GLU H H 1 8.87 0.0300 A 21 GLU HA H 1 4.95 0.0300 A 21 GLU HBy H 1 1.76 0.0300 A 21 GLU HBx H 1 1.61 0.0300 A 21 GLU HGy H 1 2.04 0.0300 A 21 GLU HGx H 1 1.78 0.0300 A 21 GLU C C 13 178.22 0.4000 A 21 GLU CA C 13 53.68 0.4000 A 21 GLU CB C 13 35.44 0.4000 A 21 GLU CG C 13 36.16 0.4000 A 21 GLU N N 15 126.00 0.4000 A 22 TYR H H 1 9.30 0.0300 A 22 TYR HA H 1 5.28 0.0300 A 22 TYR HBy H 1 2.71 0.0300 A 22 TYR HBx H 1 2.23 0.0300 A 22 TYR HD1 H 1 6.67 0.0300 A 22 TYR HD2 H 1 6.67 0.0300 A 22 TYR HE1 H 1 6.48 0.0300 A 22 TYR HE2 H 1 6.48 0.0300 A 22 TYR C C 13 178.31 0.4000 A 22 TYR CA C 13 56.16 0.4000 A 22 TYR CB C 13 42.46 0.4000 A 22 TYR CD1 C 13 132.73 0.4000 A 22 TYR CE1 C 13 117.15 0.4000 A 22 TYR N N 15 117.63 0.4000 A 23 LEU H H 1 8.00 0.0300 A 23 LEU HA H 1 3.64 0.0300 A 23 LEU HBy H 1 0.81 0.0300 A 23 LEU HBx H 1 -1.51 0.0300 A 23 LEU HDx% H 1 0.30 0.0300 A 23 LEU HDy% H 1 -0.58 0.0300 A 23 LEU HG H 1 0.51 0.0300 A 23 LEU C C 13 178.33 0.4000 A 23 LEU CA C 13 53.43 0.4000 A 23 LEU CB C 13 40.06 0.4000 A 23 LEU CD1 C 13 25.28 0.4000 A 23 LEU CD2 C 13 20.11 0.4000 A 23 LEU CG C 13 26.43 0.4000 A 23 LEU N N 15 126.37 0.4000 A 24 VAL H H 1 8.99 0.0300 A 24 VAL HA H 1 3.37 0.0300 A 24 VAL HB H 1 1.40 0.0300 A 24 VAL HGx% H 1 -0.94 0.0300 A 24 VAL HGy% H 1 0.36 0.0300 A 24 VAL C C 13 179.05 0.4000 A 24 VAL CA C 13 63.07 0.4000 A 24 VAL CB C 13 33.15 0.4000 A 24 VAL CG1 C 13 21.00 0.4000 A 24 VAL CG2 C 13 21.53 0.4000 A 24 VAL N N 15 131.05 0.4000 A 25 LYS H H 1 8.02 0.0300 A 25 LYS HA H 1 4.53 0.0300 A 25 LYS HB2 H 1 2.01 0.0300 A 25 LYS HB3 H 1 2.01 0.0300 A 25 LYS HD2 H 1 1.56 0.0300 A 25 LYS HD3 H 1 1.56 0.0300 A 25 LYS HEy H 1 2.97 0.0300 A 25 LYS HEx H 1 2.79 0.0300 A 25 LYS HG2 H 1 1.28 0.0300 A 25 LYS HG3 H 1 1.28 0.0300 A 25 LYS C C 13 176.77 0.4000 A 25 LYS CA C 13 54.28 0.4000 A 25 LYS CB C 13 32.72 0.4000 A 25 LYS CD C 13 28.87 0.4000 A 25 LYS CE C 13 42.98 0.4000 A 25 LYS CG C 13 25.61 0.4000 A 25 LYS N N 15 125.66 0.4000 A 26 TRP H H 1 8.26 0.0300 A 26 TRP HA H 1 4.51 0.0300 A 26 TRP HBy H 1 3.30 0.0300 A 26 TRP HBx H 1 2.84 0.0300 A 26 TRP HD1 H 1 7.33 0.0300 A 26 TRP HE1 H 1 10.60 0.0300 A 26 TRP HE3 H 1 7.43 0.0300 A 26 TRP HH2 H 1 6.84 0.0300 A 26 TRP HZ2 H 1 7.51 0.0300 A 26 TRP HZ3 H 1 7.13 0.0300 A 26 TRP C C 13 175.67 0.4000 A 26 TRP CA C 13 56.27 0.4000 A 26 TRP CB C 13 30.13 0.4000 A 26 TRP CD1 C 13 127.94 0.4000 A 26 TRP CE3 C 13 121.00 0.4000 A 26 TRP CH2 C 13 125.22 0.4000 A 26 TRP CZ2 C 13 114.23 0.4000 A 26 TRP CZ3 C 13 124.03 0.4000 A 26 TRP N N 15 132.02 0.4000 A 26 TRP NE1 N 15 130.74 0.4000 A 27 LYS H H 1 8.63 0.0300 A 27 LYS HA H 1 4.22 0.0300 A 27 LYS HB2 H 1 1.87 0.0300 A 27 LYS HB3 H 1 1.87 0.0300 A 27 LYS HDy H 1 1.72 0.0300 A 27 LYS HDx H 1 1.60 0.0300 A 27 LYS HE2 H 1 2.95 0.0300 A 27 LYS HE3 H 1 2.95 0.0300 A 27 LYS HG2 H 1 1.39 0.0300 A 27 LYS HG3 H 1 1.39 0.0300 A 27 LYS CA C 13 58.01 0.4000 A 27 LYS CB C 13 32.92 0.4000 A 27 LYS CD C 13 29.48 0.4000 A 27 LYS CE C 13 42.16 0.4000 A 27 LYS CG C 13 24.82 0.4000 A 27 LYS N N 15 126.10 0.4000 A 28 GLY HAy H 1 4.09 0.0300 A 28 GLY HAx H 1 3.61 0.0300 A 28 GLY C C 13 178.95 0.4000 A 28 GLY CA C 13 45.40 0.4000 A 29 TRP H H 1 7.66 0.0300 A 29 TRP HA H 1 4.86 0.0300 A 29 TRP HBy H 1 3.09 0.0300 A 29 TRP HBx H 1 2.97 0.0300 A 29 TRP HD1 H 1 7.04 0.0300 A 29 TRP HE1 H 1 10.18 0.0300 A 29 TRP HE3 H 1 6.74 0.0300 A 29 TRP HH2 H 1 7.02 0.0300 A 29 TRP HZ2 H 1 7.33 0.0300 A 29 TRP HZ3 H 1 6.67 0.0300 A 29 TRP CA C 13 54.54 0.4000 A 29 TRP CB C 13 31.13 0.4000 A 29 TRP CD1 C 13 127.17 0.4000 A 29 TRP CE3 C 13 120.06 0.4000 A 29 TRP CH2 C 13 124.87 0.4000 A 29 TRP CZ2 C 13 114.74 0.4000 A 29 TRP CZ3 C 13 122.26 0.4000 A 29 TRP N N 15 120.00 0.4000 A 29 TRP NE1 N 15 130.23 0.4000 A 30 PRO HA H 1 4.88 0.0300 A 30 PRO HBy H 1 2.67 0.0300 A 30 PRO HBx H 1 2.22 0.0300 A 30 PRO HD2 H 1 3.91 0.0300 A 30 PRO HD3 H 1 3.91 0.0300 A 30 PRO HG2 H 1 2.25 0.0300 A 30 PRO HG3 H 1 2.25 0.0300 A 30 PRO CA C 13 62.18 0.4000 A 30 PRO CB C 13 31.31 0.4000 A 30 PRO CD C 13 51.25 0.4000 A 30 PRO CG C 13 27.42 0.4000 A 31 PRO HA H 1 4.17 0.0300 A 31 PRO HBy H 1 2.33 0.0300 A 31 PRO HBx H 1 2.00 0.0300 A 31 PRO HD2 H 1 3.93 0.0300 A 31 PRO HD3 H 1 3.93 0.0300 A 31 PRO HGy H 1 2.21 0.0300 A 31 PRO HGx H 1 1.90 0.0300 A 31 PRO CA C 13 65.95 0.4000 A 31 PRO CB C 13 31.86 0.4000 A 31 PRO CD C 13 51.10 0.4000 A 31 PRO CG C 13 27.85 0.4000 A 32 LYS HA H 1 4.18 0.0300 A 32 LYS HBy H 1 1.79 0.0300 A 32 LYS HBx H 1 1.56 0.0300 A 32 LYS HD2 H 1 1.45 0.0300 A 32 LYS HD3 H 1 1.45 0.0300 A 32 LYS HE2 H 1 2.73 0.0300 A 32 LYS HE3 H 1 2.73 0.0300 A 32 LYS HGy H 1 0.96 0.0300 A 32 LYS HGx H 1 0.56 0.0300 A 32 LYS C C 13 175.65 0.4000 A 32 LYS CA C 13 58.54 0.4000 A 32 LYS CB C 13 31.26 0.4000 A 32 LYS CD C 13 29.28 0.4000 A 32 LYS CE C 13 41.96 0.4000 A 32 LYS CG C 13 23.90 0.4000 A 33 TYR H H 1 8.27 0.0300 A 33 TYR HA H 1 4.56 0.0300 A 33 TYR HBy H 1 3.16 0.0300 A 33 TYR HBx H 1 2.96 0.0300 A 33 TYR HD1 H 1 7.22 0.0300 A 33 TYR HD2 H 1 7.22 0.0300 A 33 TYR HE1 H 1 6.93 0.0300 A 33 TYR HE2 H 1 6.93 0.0300 A 33 TYR C C 13 177.10 0.4000 A 33 TYR CA C 13 58.27 0.4000 A 33 TYR CB C 13 38.38 0.4000 A 33 TYR CD1 C 13 133.24 0.4000 A 33 TYR CE1 C 13 118.46 0.4000 A 33 TYR N N 15 117.73 0.4000 A 34 SER H H 1 7.71 0.0300 A 34 SER HA H 1 4.94 0.0300 A 34 SER HBy H 1 3.57 0.0300 A 34 SER HBx H 1 3.39 0.0300 A 34 SER C C 13 178.06 0.4000 A 34 SER CA C 13 60.77 0.4000 A 34 SER CB C 13 63.49 0.4000 A 34 SER N N 15 116.43 0.4000 A 35 THR H H 1 8.02 0.0300 A 35 THR HA H 1 4.73 0.0300 A 35 THR HB H 1 4.30 0.0300 A 35 THR HG2% H 1 1.25 0.0300 A 35 THR C C 13 178.89 0.4000 A 35 THR CA C 13 59.22 0.4000 A 35 THR CB C 13 71.30 0.4000 A 35 THR CG2 C 13 23.89 0.4000 A 35 THR N N 15 113.52 0.4000 A 36 TRP H H 1 8.48 0.0300 A 36 TRP HA H 1 4.91 0.0300 A 36 TRP HBy H 1 2.86 0.0300 A 36 TRP HBx H 1 2.64 0.0300 A 36 TRP HD1 H 1 7.11 0.0300 A 36 TRP HE1 H 1 9.94 0.0300 A 36 TRP HE3 H 1 6.83 0.0300 A 36 TRP HH2 H 1 6.64 0.0300 A 36 TRP HZ2 H 1 7.31 0.0300 A 36 TRP HZ3 H 1 6.56 0.0300 A 36 TRP C C 13 175.45 0.4000 A 36 TRP CA C 13 56.28 0.4000 A 36 TRP CB C 13 29.24 0.4000 A 36 TRP CD1 C 13 127.64 0.4000 A 36 TRP CE3 C 13 120.04 0.4000 A 36 TRP CH2 C 13 122.89 0.4000 A 36 TRP CZ2 C 13 114.61 0.4000 A 36 TRP CZ3 C 13 121.78 0.4000 A 36 TRP N N 15 122.88 0.4000 A 36 TRP NE1 N 15 129.37 0.4000 A 37 GLU H H 1 9.68 0.0300 A 37 GLU HA H 1 5.38 0.0300 A 37 GLU HB2 H 1 1.61 0.0300 A 37 GLU HB3 H 1 1.61 0.0300 A 37 GLU HGy H 1 2.56 0.0300 A 37 GLU HGx H 1 2.53 0.0300 A 37 GLU CA C 13 51.45 0.4000 A 37 GLU CB C 13 31.35 0.4000 A 37 GLU CG C 13 34.16 0.4000 A 37 GLU N N 15 124.07 0.4000 A 38 PRO HA H 1 4.75 0.0300 A 38 PRO HBy H 1 2.27 0.0300 A 38 PRO HBx H 1 2.02 0.0300 A 38 PRO HDy H 1 3.59 0.0300 A 38 PRO HDx H 1 3.43 0.0300 A 38 PRO HGy H 1 1.59 0.0300 A 38 PRO HGx H 1 1.07 0.0300 A 38 PRO C C 13 180.72 0.4000 A 38 PRO CA C 13 62.02 0.4000 A 38 PRO CB C 13 32.42 0.4000 A 38 PRO CD C 13 50.23 0.4000 A 38 PRO CG C 13 26.00 0.4000 A 39 GLU H H 1 8.21 0.0300 A 39 GLU HA H 1 4.05 0.0300 A 39 GLU HB2 H 1 2.27 0.0300 A 39 GLU HB3 H 1 2.27 0.0300 A 39 GLU HGy H 1 2.41 0.0300 A 39 GLU HGx H 1 2.30 0.0300 A 39 GLU C C 13 174.19 0.4000 A 39 GLU CA C 13 60.16 0.4000 A 39 GLU CB C 13 30.05 0.4000 A 39 GLU CG C 13 35.56 0.4000 A 39 GLU N N 15 119.81 0.4000 A 40 GLU H H 1 9.79 0.0300 A 40 GLU HA H 1 4.29 0.0300 A 40 GLU HB2 H 1 2.12 0.0300 A 40 GLU HB3 H 1 2.12 0.0300 A 40 GLU HGy H 1 2.39 0.0300 A 40 GLU HGx H 1 2.23 0.0300 A 40 GLU C C 13 174.60 0.4000 A 40 GLU CA C 13 58.69 0.4000 A 40 GLU CB C 13 28.43 0.4000 A 40 GLU CG C 13 35.96 0.4000 A 40 GLU N N 15 118.58 0.4000 A 41 HIS H H 1 8.53 0.0300 A 41 HIS HA H 1 4.63 0.0300 A 41 HIS HBy H 1 3.93 0.0300 A 41 HIS HBx H 1 3.56 0.0300 A 41 HIS C C 13 176.85 0.4000 A 41 HIS CA C 13 55.76 0.4000 A 41 HIS CB C 13 29.46 0.4000 A 41 HIS N N 15 118.17 0.4000 A 42 ILE H H 1 7.92 0.0300 A 42 ILE HA H 1 3.96 0.0300 A 42 ILE HB H 1 2.33 0.0300 A 42 ILE HD1% H 1 0.43 0.0300 A 42 ILE HG1y H 1 1.67 0.0300 A 42 ILE HG1x H 1 1.09 0.0300 A 42 ILE HG2% H 1 0.73 0.0300 A 42 ILE C C 13 176.63 0.4000 A 42 ILE CA C 13 60.37 0.4000 A 42 ILE CB C 13 34.08 0.4000 A 42 ILE CD1 C 13 9.63 0.4000 A 42 ILE CG1 C 13 26.93 0.4000 A 42 ILE CG2 C 13 19.31 0.4000 A 42 ILE N N 15 119.90 0.4000 A 43 LEU H H 1 7.84 0.0300 A 43 LEU HA H 1 4.34 0.0300 A 43 LEU HBy H 1 1.64 0.0300 A 43 LEU HBx H 1 1.60 0.0300 A 43 LEU HDx% H 1 0.79 0.0300 A 43 LEU HDy% H 1 0.77 0.0300 A 43 LEU HG H 1 1.73 0.0300 A 43 LEU C C 13 176.25 0.4000 A 43 LEU CA C 13 56.08 0.4000 A 43 LEU CB C 13 41.24 0.4000 A 43 LEU CD1 C 13 26.08 0.4000 A 43 LEU CD2 C 13 21.95 0.4000 A 43 LEU CG C 13 26.96 0.4000 A 43 LEU N N 15 126.04 0.4000 A 44 ASP H H 1 6.79 0.0300 A 44 ASP HA H 1 5.20 0.0300 A 44 ASP HBy H 1 2.95 0.0300 A 44 ASP HBx H 1 2.77 0.0300 A 44 ASP CA C 13 49.79 0.4000 A 44 ASP CB C 13 42.29 0.4000 A 44 ASP N N 15 116.27 0.4000 A 45 PRO HA H 1 4.28 0.0300 A 45 PRO HBy H 1 2.39 0.0300 A 45 PRO HBx H 1 1.95 0.0300 A 45 PRO HDx H 1 3.94 0.0300 A 45 PRO HDy H 1 4.01 0.0300 A 45 PRO HGy H 1 2.04 0.0300 A 45 PRO HGx H 1 2.01 0.0300 A 45 PRO C C 13 173.30 0.4000 A 45 PRO CA C 13 64.13 0.4000 A 45 PRO CB C 13 32.30 0.4000 A 45 PRO CD C 13 51.37 0.4000 A 45 PRO CG C 13 26.96 0.4000 A 46 ARG H H 1 8.40 0.0300 A 46 ARG HA H 1 4.02 0.0300 A 46 ARG HBy H 1 1.90 0.0300 A 46 ARG HBx H 1 1.84 0.0300 A 46 ARG HDy H 1 3.23 0.0300 A 46 ARG HDx H 1 3.18 0.0300 A 46 ARG HG2 H 1 1.72 0.0300 A 46 ARG HG3 H 1 1.72 0.0300 A 46 ARG C C 13 172.81 0.4000 A 46 ARG CA C 13 58.65 0.4000 A 46 ARG CB C 13 29.34 0.4000 A 46 ARG CD C 13 43.10 0.4000 A 46 ARG CG C 13 27.20 0.4000 A 46 ARG N N 15 118.37 0.4000 A 47 LEU H H 1 7.79 0.0300 A 47 LEU HA H 1 3.94 0.0300 A 47 LEU HBy H 1 1.79 0.0300 A 47 LEU HBx H 1 1.09 0.0300 A 47 LEU HDx% H 1 0.77 0.0300 A 47 LEU HDy% H 1 0.69 0.0300 A 47 LEU C C 13 173.34 0.4000 A 47 LEU CA C 13 57.16 0.4000 A 47 LEU CB C 13 42.90 0.4000 A 47 LEU CD1 C 13 26.24 0.4000 A 47 LEU CD2 C 13 22.89 0.4000 A 47 LEU N N 15 117.86 0.4000 A 48 VAL H H 1 6.74 0.0300 A 48 VAL HA H 1 3.47 0.0300 A 48 VAL HB H 1 2.08 0.0300 A 48 VAL HGx% H 1 0.73 0.0300 A 48 VAL HGy% H 1 0.60 0.0300 A 48 VAL C C 13 174.95 0.4000 A 48 VAL CA C 13 64.76 0.4000 A 48 VAL CB C 13 31.89 0.4000 A 48 VAL CG1 C 13 21.52 0.4000 A 48 VAL CG2 C 13 21.38 0.4000 A 48 VAL N N 15 116.55 0.4000 A 49 MET H H 1 7.60 0.0300 A 49 MET HA H 1 4.09 0.0300 A 49 MET HBy H 1 2.08 0.0300 A 49 MET HBx H 1 1.94 0.0300 A 49 MET HGy H 1 2.55 0.0300 A 49 MET HGx H 1 2.52 0.0300 A 49 MET C C 13 174.70 0.4000 A 49 MET CA C 13 58.54 0.4000 A 49 MET CB C 13 32.85 0.4000 A 49 MET CG C 13 31.87 0.4000 A 49 MET N N 15 119.63 0.4000 A 50 ALA H H 1 7.82 0.0300 A 50 ALA HA H 1 4.11 0.0300 A 50 ALA HB% H 1 1.35 0.0300 A 50 ALA C C 13 173.27 0.4000 A 50 ALA CA C 13 53.97 0.4000 A 50 ALA CB C 13 18.33 0.4000 A 50 ALA N N 15 119.20 0.4000 A 51 TYR H H 1 7.18 0.0300 A 51 TYR HA H 1 4.23 0.0300 A 51 TYR HB2 H 1 3.00 0.0300 A 51 TYR HB3 H 1 3.00 0.0300 A 51 TYR HD1 H 1 6.98 0.0300 A 51 TYR HD2 H 1 6.98 0.0300 A 51 TYR HE1 H 1 6.65 0.0300 A 51 TYR HE2 H 1 6.65 0.0300 A 51 TYR C C 13 175.70 0.4000 A 51 TYR CA C 13 60.35 0.4000 A 51 TYR CB C 13 38.40 0.4000 A 51 TYR CD1 C 13 133.09 0.4000 A 51 TYR CE1 C 13 118.15 0.4000 A 51 TYR N N 15 118.57 0.4000 A 52 GLU H H 1 8.08 0.0300 A 52 GLU HA H 1 3.85 0.0300 A 52 GLU HBy H 1 1.99 0.0300 A 52 GLU HBx H 1 1.92 0.0300 A 52 GLU HGy H 1 2.44 0.0300 A 52 GLU HGx H 1 2.29 0.0300 A 52 GLU C C 13 174.99 0.4000 A 52 GLU CA C 13 57.51 0.4000 A 52 GLU CB C 13 30.02 0.4000 A 52 GLU CG C 13 36.42 0.4000 A 52 GLU N N 15 120.08 0.4000 A 53 GLU H H 1 7.88 0.0300 A 53 GLU HA H 1 4.10 0.0300 A 53 GLU HB2 H 1 1.95 0.0300 A 53 GLU HB3 H 1 1.95 0.0300 A 53 GLU HGy H 1 2.30 0.0300 A 53 GLU HGx H 1 2.21 0.0300 A 53 GLU C C 13 175.73 0.4000 A 53 GLU CA C 13 56.98 0.4000 A 53 GLU CB C 13 29.82 0.4000 A 53 GLU CG C 13 36.32 0.4000 A 53 GLU N N 15 118.98 0.4000 A 54 LYS H H 1 7.64 0.0300 A 54 LYS HA H 1 4.23 0.0300 A 54 LYS HBy H 1 1.78 0.0300 A 54 LYS HBx H 1 1.72 0.0300 A 54 LYS HD2 H 1 1.61 0.0300 A 54 LYS HD3 H 1 1.61 0.0300 A 54 LYS HE2 H 1 2.94 0.0300 A 54 LYS HE3 H 1 2.94 0.0300 A 54 LYS HGy H 1 1.39 0.0300 A 54 LYS HGx H 1 1.35 0.0300 A 54 LYS C C 13 176.08 0.4000 A 54 LYS CA C 13 56.59 0.4000 A 54 LYS CB C 13 33.08 0.4000 A 54 LYS CD C 13 28.99 0.4000 A 54 LYS CE C 13 42.17 0.4000 A 54 LYS CG C 13 24.49 0.4000 A 54 LYS N N 15 120.47 0.4000 A 55 GLU H H 1 8.50 0.0300 A 55 GLU HA H 1 4.20 0.0300 A 55 GLU HBy H 1 2.00 0.0300 A 55 GLU HBx H 1 1.78 0.0300 A 55 GLU HGy H 1 2.20 0.0300 A 55 GLU HGx H 1 2.15 0.0300 A 55 GLU C C 13 176.76 0.4000 A 55 GLU CA C 13 56.46 0.4000 A 55 GLU CB C 13 30.44 0.4000 A 55 GLU CG C 13 36.26 0.4000 A 55 GLU N N 15 120.81 0.4000 A 56 GLU H H 1 7.88 0.0300 A 56 GLU HA H 1 4.06 0.0300 A 56 GLU HBy H 1 1.99 0.0300 A 56 GLU HBx H 1 1.83 0.0300 A 56 GLU HG2 H 1 2.15 0.0300 A 56 GLU HG3 H 1 2.15 0.0300 A 56 GLU CA C 13 57.98 0.4000 A 56 GLU CB C 13 31.22 0.4000 A 56 GLU CG C 13 36.67 0.4000 A 56 GLU N N 15 126.98 0.4000 B 19 GLN HA H 1 4.36 0.0300 B 19 GLN HB3 H 1 2.03 0.0300 B 19 GLN HGy H 1 2.51 0.0300 B 19 GLN HGx H 1 2.40 0.0300 B 20 LEU HA H 1 4.33 0.0300 B 20 LEU HB2 H 1 1.61 0.0300 B 20 LEU HDx% H 1 0.88 0.0300 B 20 LEU HDy% H 1 0.87 0.0300 B 20 LEU HG H 1 1.56 0.0300 B 22 THR HA H 1 4.40 0.0300 B 22 THR HB H 1 4.08 0.0300 B 22 THR HG2% H 1 1.29 0.0300 B 23 LYS HA H 1 4.27 0.0300 B 23 LYS HBy H 1 1.82 0.0300 B 23 LYS HBx H 1 1.74 0.0300 B 23 LYS HD2 H 1 1.66 0.0300 B 23 LYS HD3 H 1 1.66 0.0300 B 23 LYS HE2 H 1 2.97 0.0300 B 23 LYS HG2 H 1 1.41 0.0300 B 24 ALA HA H 1 4.20 0.0300 B 24 ALA HB% H 1 1.18 0.0300 B 25 ALA HA H 1 4.60 0.0300 B 25 ALA HB% H 1 1.34 0.0300 B 26 ARG H H 1 8.05 0.0300 B 26 ARG HA H 1 4.33 0.0300 B 26 ARG HBy H 1 1.84 0.0300 B 26 ARG HBx H 1 1.78 0.0300 B 26 ARG HD2 H 1 3.30 0.0300 B 26 ARG HD3 H 1 3.30 0.0300 B 26 ARG HGy H 1 1.43 0.0300 B 26 ARG HGx H 1 1.39 0.0300 B 27 M3L HA H 1 4.61 0.0300 B 27 M3L HBy H 1 2.15 0.0300 B 27 M3L HBx H 1 1.92 0.0300 B 27 M3L HD3 H 1 1.81 0.0300 B 27 M3L HEy H 1 3.55 0.0300 B 27 M3L HEx H 1 3.47 0.0300 B 28 SER HA H 1 4.43 0.0300 B 28 SER HBy H 1 4.40 0.0300 B 28 SER HBx H 1 3.83 0.0300 B 30 PRO HA H 1 4.40 0.0300 B 30 PRO HBy H 1 2.27 0.0300 B 30 PRO HBx H 1 1.99 0.0300 B 30 PRO HDy H 1 3.77 0.0300 B 30 PRO HDx H 1 3.62 0.0300 B 30 PRO HG2 H 1 1.90 0.0300 B 31 ALA HA H 1 4.74 0.0300 B 31 ALA HB% H 1 1.54 0.0300 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 36 TRP HZ2 A 23 LEU HDy% 1.0 1.8 5.0 2 2 A 36 TRP HZ2 A 23 LEU HDx% 1.0 1.8 5.0 3 3 A 10 ILE HG2% A 51 TYR HE% 1.0 1.8 5.0 4 4 A 10 ILE HG2% A 51 TYR HD% 1.0 1.8 5.0 5 5 A 10 ILE HG2% A 22 TYR HD% 1.0 1.8 3.5 6 6 A 20 VAL HGx% A 22 TYR HE% 1.0 1.8 5.0 7 7 A 33 TYR HD% A 32 LYS HGx 1.0 1.8 5.0 8 8 A 33 TYR HD% A 32 LYS HGy 1.0 1.8 5.0 9 9 A 26 TRP HD1 A 35 THR HG2% 1.0 1.8 5.0 10 10 A 26 TRP HZ2 B 25 ALA HB% 1.0 1.8 5.0 11 11 A 22 TYR HD% A 13 LYS HBy 1.0 1.8 5.0 12 12 A 51 TYR HE% A 13 LYS HBy 1.0 1.8 5.0 13 13 A 22 TYR HE% A 13 LYS HBy 1.0 1.8 5.0 14 14 A 36 TRP HH2 A 12 LYS HBx 1.0 1.8 5.0 15 15 A 36 TRP HE3 A 21 GLU HBx 1.0 1.8 5.0 16 16 A 22 TYR HE% A 13 LYS HD2 1.0 1.8 3.5 17 16 A 22 TYR HE% A 13 LYS HD3 1.0 1.8 3.5 18 17 A 51 TYR HE% A 13 LYS HBx 1.0 1.8 5.0 19 18 A 22 TYR HD% A 13 LYS HD2 1.0 1.8 5.0 20 18 A 22 TYR HD% A 13 LYS HD3 1.0 1.8 5.0 21 19 A 36 TRP HE3 A 21 GLU HBy 1.0 1.8 5.0 22 20 A 36 TRP HH2 A 12 LYS HBy 1.0 1.8 5.0 23 21 A 33 TYR HD% A 30 PRO HG2 1.0 1.8 5.0 24 21 A 33 TYR HD% A 30 PRO HG3 1.0 1.8 5.0 25 22 A 33 TYR HE% A 30 PRO HG2 1.0 1.8 5.0 26 22 A 30 PRO HG3 A 33 TYR HE% 1.0 1.8 5.0 27 23 A 22 TYR HE% A 39 GLU HB2 1.0 1.8 5.0 28 23 A 22 TYR HE% A 39 GLU HB3 1.0 1.8 5.0 29 24 A 51 TYR HD% A 52 GLU HGx 1.0 1.8 5.0 30 25 A 26 TRP HE3 A 5 PHE HBx 1.0 1.8 5.0 31 26 A 26 TRP HD1 A 29 TRP HBy 1.0 1.8 5.0 32 27 A 33 TYR HD% A 29 TRP HBx 1.0 1.8 5.0 33 28 A 26 TRP HE3 A 5 PHE HBy 1.0 1.8 5.0 34 29 A 26 TRP HE3 A 7 VAL HA 1.0 1.8 5.0 35 30 A 51 TYR HD% A 52 GLU HA 1.0 1.8 5.0 36 31 A 33 TYR HD% A 30 PRO HD2 1.0 1.8 3.5 37 31 A 33 TYR HD% A 30 PRO HD3 1.0 1.8 3.5 38 32 A 33 TYR HE% A 30 PRO HD2 1.0 1.8 5.0 39 32 A 33 TYR HE% A 30 PRO HD3 1.0 1.8 5.0 40 33 A 51 TYR HD% A 51 TYR HA 1.0 1.8 3.5 41 34 A 26 TRP HZ2 A 35 THR HB 1.0 1.8 6.0 42 35 A 26 TRP HE3 A 26 TRP HA 1.0 1.8 5.0 43 36 A 33 TYR HD% A 33 TYR HA 1.0 1.8 5.0 44 37 A 26 TRP HD1 A 25 LYS HA 1.0 1.8 5.0 45 38 A 26 TRP HD1 A 26 TRP HA 1.0 1.8 6.0 46 39 A 5 PHE HA A 5 PHE HD% 1.0 1.8 5.0 47 40 A 36 TRP HE3 A 21 GLU HA 1.0 1.8 6.0 48 41 A 26 TRP HD1 A 34 SER HA 1.0 1.8 5.0 49 42 A 22 TYR HD% A 22 TYR HA 1.0 1.8 5.0 50 43 A 22 TYR HE% A 13 LYS HA 1.0 1.8 5.0 51 44 A 22 TYR HE% A 22 TYR HA 1.0 1.8 6.0 52 45 A 5 PHE HD% A 5 PHE HZ 1.0 1.8 5.0 53 46 A 26 TRP HZ2 B 26 ARG H 1.0 1.8 6.0 54 47 A 19 LYS HBx A 19 LYS HE2 1.0 1.8 5.0 55 47 A 19 LYS HBx A 19 LYS HE3 1.0 1.8 5.0 56 48 A 11 ARG HA A 11 ARG HGx 1.0 1.8 5.0 57 49 A 11 ARG HA A 11 ARG HGy 1.0 1.8 5.0 58 50 A 43 LEU HA A 43 LEU HG 1.0 1.8 5.0 59 51 A 55 GLU HA A 55 GLU HGy 1.0 1.8 5.0 60 52 A 54 LYS HA A 53 GLU HB2 1.0 1.8 5.0 61 52 A 53 GLU HB3 A 54 LYS HA 1.0 1.8 5.0 62 53 A 55 GLU HA A 55 GLU HGx 1.0 1.8 5.0 63 54 A 17 LYS HA A 17 LYS HG2 1.0 1.8 3.5 64 54 A 17 LYS HA A 17 LYS HG3 1.0 1.8 3.5 65 55 A 17 LYS HE3 A 17 LYS HG2 1.0 1.8 5.0 66 55 A 17 LYS HE2 A 17 LYS HG2 1.0 1.8 5.0 67 55 A 17 LYS HG3 A 17 LYS HE2 1.0 1.8 5.0 68 55 A 17 LYS HG3 A 17 LYS HE3 1.0 1.8 5.0 69 56 A 46 ARG HA A 50 ALA H 1.0 1.8 6.0 70 57 A 46 ARG HA A 46 ARG HG2 1.0 1.8 3.5 71 57 A 46 ARG HA A 46 ARG HG3 1.0 1.8 3.5 72 58 A 46 ARG HA A 49 MET HBx 1.0 1.8 5.0 73 59 A 46 ARG HA A 49 MET HBy 1.0 1.8 5.0 74 60 A 46 ARG HBx A 46 ARG HDx 1.0 1.8 5.0 75 61 A 46 ARG HBy A 46 ARG HDx 1.0 1.8 5.0 76 62 A 46 ARG HBx A 46 ARG HDy 1.0 1.8 5.0 77 63 A 46 ARG HDy A 46 ARG HBy 1.0 1.8 5.0 78 64 A 29 TRP HBy A 30 PRO HD2 1.0 1.8 5.0 79 64 A 29 TRP HBy A 30 PRO HD3 1.0 1.8 5.0 80 65 A 37 GLU HA A 38 PRO HBx 1.0 1.8 5.0 81 66 A 24 VAL HGy% A 37 GLU HGx 1.0 1.8 5.0 82 67 A 24 VAL HGy% A 37 GLU HGy 1.0 1.8 5.0 83 68 A 42 ILE HD1% A 37 GLU HB2 1.0 1.8 5.0 84 68 A 37 GLU HB3 A 42 ILE HD1% 1.0 1.8 5.0 85 69 A 24 VAL HGy% A 37 GLU HB2 1.0 1.8 5.0 86 69 A 24 VAL HGy% A 37 GLU HB3 1.0 1.8 5.0 87 70 A 55 GLU HA A 56 GLU HG2 1.0 1.8 5.0 88 70 A 55 GLU HA A 56 GLU HG3 1.0 1.8 5.0 89 71 A 37 GLU HA A 38 PRO HDy 1.0 1.8 3.5 90 72 A 38 PRO HDy A 37 GLU HB2 1.0 1.8 5.0 91 72 A 37 GLU HB3 A 38 PRO HDy 1.0 1.8 5.0 92 73 A 37 GLU HA A 38 PRO HDx 1.0 1.8 5.0 93 74 A 38 PRO HBx A 39 GLU H 1.0 1.8 5.0 94 75 A 31 PRO HA A 25 LYS HG2 1.0 1.8 5.0 95 75 A 25 LYS HG3 A 31 PRO HA 1.0 1.8 5.0 96 76 A 31 PRO HA A 25 LYS HD2 1.0 1.8 5.0 97 76 A 31 PRO HA A 25 LYS HD3 1.0 1.8 5.0 98 77 A 31 PRO HA A 25 LYS HEx 1.0 1.8 5.0 99 78 A 31 PRO HA A 25 LYS HEy 1.0 1.8 5.0 100 79 A 31 PRO HA A 33 TYR H 1.0 1.8 5.0 101 80 A 29 TRP HE3 A 30 PRO HD2 1.0 1.8 5.0 102 80 A 30 PRO HD3 A 29 TRP HE3 1.0 1.8 5.0 103 81 A 29 TRP HA A 30 PRO HD2 1.0 1.8 3.5 104 81 A 30 PRO HD3 A 29 TRP HA 1.0 1.8 3.5 105 82 A 31 PRO HD3 A 25 LYS HEx 1.0 1.8 5.0 106 82 A 25 LYS HEx A 31 PRO HD2 1.0 1.8 5.0 107 83 A 31 PRO HD3 A 25 LYS HEy 1.0 1.8 5.0 108 83 A 25 LYS HEy A 31 PRO HD2 1.0 1.8 5.0 109 84 A 29 TRP HBx A 30 PRO HD2 1.0 1.8 5.0 110 84 A 29 TRP HBx A 30 PRO HD3 1.0 1.8 5.0 111 85 A 30 PRO HBy A 31 PRO HD2 1.0 1.8 3.5 112 85 A 31 PRO HD3 A 30 PRO HBy 1.0 1.8 3.5 113 86 A 40 GLU HA A 40 GLU HGy 1.0 1.8 5.0 114 87 A 40 GLU HA A 40 GLU HGx 1.0 1.8 5.0 115 88 A 40 GLU HA A 40 GLU HB2 1.0 1.8 3.5 116 88 A 40 GLU HA A 40 GLU HB3 1.0 1.8 3.5 117 89 A 39 GLU H A 38 PRO HA 1.0 1.8 5.0 118 90 A 38 PRO HA A 41 HIS H 1.0 1.8 5.0 119 91 A 25 LYS HB3 A 25 LYS HD2 1.0 1.8 5.0 120 91 A 25 LYS HB2 A 25 LYS HD2 1.0 1.8 5.0 121 91 A 25 LYS HD3 A 25 LYS HB2 1.0 1.8 5.0 122 91 A 25 LYS HD3 A 25 LYS HB3 1.0 1.8 5.0 123 92 A 29 TRP HA A 30 PRO HG2 1.0 1.8 5.0 124 92 A 30 PRO HG3 A 29 TRP HA 1.0 1.8 5.0 125 93 A 30 PRO HA A 31 PRO HD2 1.0 1.8 3.5 126 93 A 31 PRO HD3 A 30 PRO HA 1.0 1.8 3.5 127 94 A 30 PRO HA A 25 LYS HEx 1.0 1.8 5.0 128 95 A 30 PRO HA A 25 LYS HEy 1.0 1.8 5.0 129 96 A 30 PRO HBx A 31 PRO HD2 1.0 1.8 5.0 130 96 A 31 PRO HD3 A 30 PRO HBx 1.0 1.8 5.0 131 97 A 30 PRO HBy A 32 LYS HBx 1.0 1.8 5.0 132 98 A 33 TYR HE% A 30 PRO HBy 1.0 1.8 6.0 133 99 A 33 TYR HD% A 30 PRO HBy 1.0 1.8 5.0 134 100 A 8 GLU H A 27 LYS HB2 1.0 1.8 5.0 135 100 A 8 GLU H A 27 LYS HB3 1.0 1.8 5.0 136 101 A 6 ALA HB% A 27 LYS HB2 1.0 1.8 5.0 137 101 A 27 LYS HB3 A 6 ALA HB% 1.0 1.8 5.0 138 102 A 8 GLU HA A 27 LYS HB2 1.0 1.8 5.0 139 102 A 27 LYS HB3 A 8 GLU HA 1.0 1.8 5.0 140 103 A 27 LYS HE2 A 27 LYS HG2 1.0 1.8 3.5 141 103 A 27 LYS HE3 A 27 LYS HG2 1.0 1.8 3.5 142 103 A 27 LYS HG3 A 27 LYS HE2 1.0 1.8 3.5 143 103 A 27 LYS HG3 A 27 LYS HE3 1.0 1.8 3.5 144 104 A 54 LYS H A 54 LYS HE2 1.0 1.8 5.0 145 104 A 54 LYS H A 54 LYS HE3 1.0 1.8 5.0 146 105 A 44 ASP HA A 45 PRO HGy 1.0 1.8 6.0 147 106 A 44 ASP HA A 45 PRO HGx 1.0 1.8 6.0 148 107 A 45 PRO HA A 48 VAL H 1.0 1.8 5.0 149 108 A 46 ARG H A 45 PRO HDy 1.0 1.8 5.0 150 109 A 44 ASP HA A 45 PRO HDy 1.0 1.8 3.5 151 110 A 44 ASP HA A 45 PRO HDx 1.0 1.8 3.5 152 111 A 50 ALA HA A 53 GLU HB2 1.0 1.8 5.0 153 111 A 53 GLU HB3 A 50 ALA HA 1.0 1.8 5.0 154 112 A 50 ALA HA A 53 GLU HGy 1.0 1.8 5.0 155 113 A 51 TYR HD% A 50 ALA HB% 1.0 1.8 6.0 156 114 A 50 ALA HB% A 47 LEU HA 1.0 1.8 5.0 157 115 A 50 ALA HB% A 51 TYR HB2 1.0 1.8 5.0 158 115 A 50 ALA HB% A 51 TYR HB3 1.0 1.8 5.0 159 116 A 42 ILE HD1% A 39 GLU HA 1.0 1.8 5.0 160 117 A 39 GLU HA A 42 ILE HG1x 1.0 1.8 5.0 161 118 A 39 GLU HA A 42 ILE HG1y 1.0 1.8 5.0 162 119 A 22 TYR HD% A 39 GLU HA 1.0 1.8 5.0 163 120 A 22 TYR HE% A 39 GLU HA 1.0 1.8 5.0 164 121 A 22 TYR HD% A 39 GLU HB2 1.0 1.8 5.0 165 121 A 22 TYR HD% A 39 GLU HB3 1.0 1.8 5.0 166 122 A 20 VAL HB A 39 GLU HB2 1.0 1.8 5.0 167 122 A 39 GLU HB3 A 20 VAL HB 1.0 1.8 5.0 168 123 A 20 VAL HGx% A 39 GLU HB2 1.0 1.8 5.0 169 123 A 20 VAL HGx% A 39 GLU HB3 1.0 1.8 5.0 170 124 A 42 ILE HD1% A 39 GLU HB2 1.0 1.8 6.0 171 124 A 39 GLU HB3 A 42 ILE HD1% 1.0 1.8 6.0 172 125 A 38 PRO HBy A 39 GLU HGy 1.0 1.8 5.0 173 126 A 20 VAL HB A 39 GLU HGy 1.0 1.8 6.0 174 127 A 22 TYR HE% A 39 GLU HGy 1.0 1.8 5.0 175 128 A 40 GLU H A 39 GLU HGx 1.0 1.8 5.0 176 129 A 22 TYR HE% A 39 GLU HGx 1.0 1.8 5.0 177 130 A 38 PRO HBy A 39 GLU HGx 1.0 1.8 5.0 178 131 A 52 GLU HBx A 53 GLU H 1.0 1.8 5.0 179 132 A 51 TYR HD% A 52 GLU HGy 1.0 1.8 5.0 180 133 A 53 GLU HA A 53 GLU HGy 1.0 1.8 5.0 181 134 A 53 GLU H A 49 MET HA 1.0 1.8 6.0 182 135 A 49 MET HA A 52 GLU HBy 1.0 1.8 5.0 183 136 A 13 LYS H A 14 ARG HBx 1.0 1.8 6.0 184 137 A 45 PRO HA A 48 VAL HB 1.0 1.8 6.0 185 138 A 51 TYR HD% A 48 VAL HA 1.0 1.8 5.0 186 139 A 48 VAL HA A 51 TYR HB2 1.0 1.8 5.0 187 139 A 51 TYR HB3 A 48 VAL HA 1.0 1.8 5.0 188 140 A 48 VAL HA A 48 VAL HGx% 1.0 1.8 3.5 189 141 A 48 VAL HA A 10 ILE HD1% 1.0 1.8 5.0 190 142 A 48 VAL HA A 48 VAL HGy% 1.0 1.8 3.5 191 143 A 48 VAL H A 48 VAL HGy% 1.0 1.8 5.0 192 144 A 22 TYR HE% A 48 VAL HGy% 1.0 1.8 5.0 193 145 A 22 TYR HE% A 48 VAL HGx% 1.0 1.8 5.0 194 146 A 48 VAL H A 48 VAL HGx% 1.0 1.8 5.0 195 147 A 8 GLU HA A 27 LYS HG2 1.0 1.8 5.0 196 147 A 8 GLU HA A 27 LYS HG3 1.0 1.8 5.0 197 148 A 8 GLU HA A 8 GLU HGy 1.0 1.8 5.0 198 149 A 8 GLU HA A 8 GLU HGx 1.0 1.8 5.0 199 150 A 8 GLU HA A 7 VAL HGy% 1.0 1.8 6.0 200 151 A 50 ALA HA A 53 GLU HGx 1.0 1.8 5.0 201 152 A 9 SER HA A 10 ILE HG1y 1.0 1.8 5.0 202 153 A 27 LYS HA A 27 LYS HG2 1.0 1.8 5.0 203 153 A 27 LYS HG3 A 27 LYS HA 1.0 1.8 5.0 204 154 A 9 SER HA A 25 LYS HB2 1.0 1.8 6.0 205 154 A 25 LYS HB3 A 9 SER HA 1.0 1.8 6.0 206 155 A 9 SER HBy A 25 LYS HB2 1.0 1.8 5.0 207 155 A 25 LYS HB3 A 9 SER HBy 1.0 1.8 5.0 208 156 A 3 GLN HA A 4 VAL H 1.0 1.8 3.5 209 157 A 51 TYR HE% A 51 TYR HA 1.0 1.8 6.0 210 158 A 53 GLU HA A 53 GLU HGx 1.0 1.8 5.0 211 159 A 5 PHE HA A 6 ALA H 1.0 1.8 3.5 212 160 A 23 LEU HBy A 12 LYS HBy 1.0 1.8 6.0 213 161 A 13 LYS H A 12 LYS HBy 1.0 1.8 5.0 214 162 A 12 LYS HE3 A 12 LYS HGy 1.0 1.8 5.0 215 162 A 12 LYS HGy A 12 LYS HE2 1.0 1.8 5.0 216 163 A 23 LEU HBy A 12 LYS HBx 1.0 1.8 6.0 217 164 A 36 TRP HH2 A 12 LYS HDx 1.0 1.8 5.0 218 165 A 35 THR HG2% A 35 THR HA 1.0 1.8 3.5 219 166 A 35 THR HB A 35 THR H 1.0 1.8 5.0 220 167 A 10 ILE HG2% A 10 ILE HA 1.0 1.8 3.5 221 168 A 10 ILE HG1y A 10 ILE HA 1.0 1.8 5.0 222 169 A 10 ILE HA A 24 VAL HA 1.0 1.8 5.0 223 170 A 51 TYR HD% A 10 ILE HB 1.0 1.8 5.0 224 171 A 10 ILE HB A 51 TYR HB2 1.0 1.8 5.0 225 171 A 51 TYR HB3 A 10 ILE HB 1.0 1.8 5.0 226 172 A 10 ILE HD1% A 24 VAL HGx% 1.0 1.8 5.0 227 173 A 10 ILE HG2% A 10 ILE HD1% 1.0 1.8 3.5 228 174 A 10 ILE HD1% A 47 LEU HDx% 1.0 1.8 5.0 229 175 A 10 ILE HD1% A 10 ILE HB 1.0 1.8 5.0 230 176 A 10 ILE HD1% A 51 TYR HB2 1.0 1.8 5.0 231 176 A 51 TYR HB3 A 10 ILE HD1% 1.0 1.8 5.0 232 177 A 47 LEU HA A 10 ILE HD1% 1.0 1.8 5.0 233 178 A 22 TYR HD% A 10 ILE HD1% 1.0 1.8 5.0 234 179 A 48 VAL H A 10 ILE HD1% 1.0 1.8 5.0 235 180 A 51 TYR HD% A 10 ILE HD1% 1.0 1.8 5.0 236 181 A 10 ILE HG2% A 22 TYR HE% 1.0 1.8 5.0 237 182 A 10 ILE HG2% A 22 TYR HA 1.0 1.8 5.0 238 183 A 10 ILE HG2% A 22 TYR HBx 1.0 1.8 5.0 239 184 A 10 ILE HG2% A 22 TYR HBy 1.0 1.8 5.0 240 185 A 10 ILE HG2% A 51 TYR HB2 1.0 1.8 5.0 241 185 A 10 ILE HG2% A 51 TYR HB3 1.0 1.8 5.0 242 186 A 10 ILE HG2% A 10 ILE HG1x 1.0 1.8 5.0 243 187 A 10 ILE HG2% A 10 ILE HG1y 1.0 1.8 5.0 244 188 A 25 LYS HA A 34 SER HA 1.0 1.8 5.0 245 189 A 23 LEU HG A 34 SER HBy 1.0 1.8 5.0 246 190 A 23 LEU HG A 34 SER HBx 1.0 1.8 5.0 247 191 A 4 VAL HA A 4 VAL HG2% 1.0 1.8 5.0 248 192 A 4 VAL HA A 4 VAL HG1% 1.0 1.8 5.0 249 193 A 4 VAL H A 4 VAL HG2% 1.0 1.8 5.0 250 194 A 22 TYR HD% A 13 LYS HA 1.0 1.8 5.0 251 195 A 13 LYS HA A 36 TRP HZ3 1.0 1.8 5.0 252 196 A 13 LYS HA A 23 LEU H 1.0 1.8 5.0 253 197 A 13 LYS HBx A 13 LYS H 1.0 1.8 5.0 254 198 A 20 VAL HGx% A 13 LYS HGx 1.0 1.8 5.0 255 199 A 20 VAL HGx% A 13 LYS HGy 1.0 1.8 5.0 256 200 A 13 LYS HEy A 13 LYS HGy 1.0 1.8 5.0 257 201 A 13 LYS HEy A 13 LYS HGx 1.0 1.8 5.0 258 202 A 13 LYS HEx A 13 LYS HGx 1.0 1.8 5.0 259 203 A 13 LYS HEx A 13 LYS HGy 1.0 1.8 5.0 260 204 A 33 TYR HE% A 32 LYS HE2 1.0 1.8 5.0 261 204 A 33 TYR HE% A 32 LYS HE3 1.0 1.8 5.0 262 205 A 51 TYR HE% A 13 LYS HD2 1.0 1.8 5.0 263 205 A 51 TYR HE% A 13 LYS HD3 1.0 1.8 5.0 264 206 A 13 LYS HBy A 13 LYS HD2 1.0 1.8 5.0 265 206 A 13 LYS HBy A 13 LYS HD3 1.0 1.8 5.0 266 207 A 10 ILE HG2% A 13 LYS HD2 1.0 1.8 5.0 267 207 A 10 ILE HG2% A 13 LYS HD3 1.0 1.8 5.0 268 208 A 20 VAL HGx% A 13 LYS HD2 1.0 1.8 5.0 269 208 A 20 VAL HGx% A 13 LYS HD3 1.0 1.8 5.0 270 209 A 23 LEU HA A 36 TRP HA 1.0 1.8 5.0 271 210 A 36 TRP HE3 A 36 TRP HA 1.0 1.8 5.0 272 211 A 25 LYS HA A 25 LYS HG2 1.0 1.8 5.0 273 211 A 25 LYS HA A 25 LYS HG3 1.0 1.8 5.0 274 212 A 19 LYS HA A 19 LYS HGy 1.0 1.8 5.0 275 213 A 19 LYS HA A 19 LYS HD2 1.0 1.8 5.0 276 213 A 19 LYS HA A 19 LYS HD3 1.0 1.8 5.0 277 214 A 25 LYS HA A 25 LYS HD2 1.0 1.8 5.0 278 214 A 25 LYS HA A 25 LYS HD3 1.0 1.8 5.0 279 215 A 27 LYS HB3 A 27 LYS HE2 1.0 1.8 5.0 280 215 A 27 LYS HB2 A 27 LYS HE2 1.0 1.8 5.0 281 215 A 27 LYS HE3 A 27 LYS HB2 1.0 1.8 5.0 282 215 A 27 LYS HB3 A 27 LYS HE3 1.0 1.8 5.0 283 216 A 24 VAL HGy% A 24 VAL HA 1.0 1.8 5.0 284 217 A 24 VAL HA A 24 VAL HGx% 1.0 1.8 5.0 285 218 A 26 TRP HZ2 A 24 VAL HGx% 1.0 1.8 5.0 286 219 A 6 ALA HB% A 27 LYS HE2 1.0 1.8 5.0 287 219 A 6 ALA HB% A 27 LYS HE3 1.0 1.8 5.0 288 220 A 6 ALA HB% A 6 ALA H 1.0 1.8 3.5 289 221 A 6 ALA HB% A 7 VAL H 1.0 1.8 5.0 290 222 A 15 VAL HA A 20 VAL HA 1.0 1.8 5.0 291 223 A 20 VAL HA A 15 VAL HB 1.0 1.8 5.0 292 224 A 20 VAL HA A 15 VAL HGx% 1.0 1.8 5.0 293 225 A 20 VAL HGx% A 20 VAL HA 1.0 1.8 3.5 294 226 A 20 VAL HB A 38 PRO HBy 1.0 1.8 5.0 295 227 A 38 PRO HBx A 20 VAL HB 1.0 1.8 5.0 296 228 A 20 VAL HB A 39 GLU HGx 1.0 1.8 6.0 297 229 A 20 VAL HGx% A 39 GLU H 1.0 1.8 5.0 298 230 A 22 TYR HD% A 20 VAL HGx% 1.0 1.8 5.0 299 231 A 20 VAL HGx% A 13 LYS HEy 1.0 1.8 5.0 300 232 A 20 VAL HGx% A 13 LYS HEx 1.0 1.8 5.0 301 233 A 20 VAL HGx% A 38 PRO HBx 1.0 1.8 6.0 302 234 A 24 VAL HGx% A 7 VAL HGy% 1.0 1.8 3.5 303 235 A 13 LYS HEx A 20 VAL HGy% 1.0 1.8 6.0 304 236 A 13 LYS HEy A 20 VAL HGy% 1.0 1.8 5.0 305 237 A 20 VAL HA A 20 VAL HGy% 1.0 1.8 3.5 306 238 A 19 LYS HA A 20 VAL HGy% 1.0 1.8 5.0 307 239 B 25 ALA HB% A 42 ILE HA 1.0 1.8 5.0 308 240 A 43 LEU HG A 42 ILE HA 1.0 1.8 6.0 309 241 A 42 ILE HA A 43 LEU H 1.0 1.8 3.5 310 242 A 42 ILE HD1% A 37 GLU H 1.0 1.8 5.0 311 243 A 22 TYR HD% A 42 ILE HD1% 1.0 1.8 5.0 312 244 A 42 ILE HD1% A 42 ILE HA 1.0 1.8 5.0 313 245 A 42 ILE HD1% A 38 PRO HDy 1.0 1.8 6.0 314 246 A 42 ILE HD1% A 22 TYR HBy 1.0 1.8 5.0 315 247 A 42 ILE HD1% A 42 ILE HB 1.0 1.8 5.0 316 248 A 42 ILE HD1% A 22 TYR HBx 1.0 1.8 5.0 317 249 A 42 ILE HD1% A 37 GLU HGy 1.0 1.8 6.0 318 250 A 42 ILE HD1% A 37 GLU HGx 1.0 1.8 6.0 319 251 A 42 ILE HD1% A 10 ILE HD1% 1.0 1.8 5.0 320 252 A 42 ILE HD1% A 24 VAL HGx% 1.0 1.8 5.0 321 253 A 10 ILE HD1% A 42 ILE HG2% 1.0 1.8 5.0 322 254 A 42 ILE HD1% A 42 ILE HG2% 1.0 1.8 3.5 323 255 A 42 ILE HG2% A 47 LEU HBy 1.0 1.8 5.0 324 256 A 42 ILE HG2% A 42 ILE HG1y 1.0 1.8 5.0 325 257 A 42 ILE HA A 42 ILE HG2% 1.0 1.8 3.5 326 258 A 45 PRO HA A 42 ILE HG2% 1.0 1.8 5.0 327 259 A 42 ILE HG2% A 44 ASP H 1.0 1.8 5.0 328 260 A 43 LEU H A 42 ILE HG2% 1.0 1.8 5.0 329 261 A 42 ILE HG2% A 42 ILE HG1x 1.0 1.8 5.0 330 262 A 13 LYS HBy A 13 LYS HEx 1.0 1.8 5.0 331 263 A 22 TYR HA A 36 TRP HZ3 1.0 1.8 5.0 332 264 A 10 ILE HG2% A 11 ARG HA 1.0 1.8 5.0 333 265 A 11 ARG HA A 11 ARG HDx 1.0 1.8 5.0 334 266 A 11 ARG HA A 11 ARG HDy 1.0 1.8 5.0 335 267 A 12 LYS HE2 A 12 LYS HGx 1.0 1.8 5.0 336 267 A 12 LYS HE3 A 12 LYS HGx 1.0 1.8 5.0 337 268 A 11 ARG H A 11 ARG HGy 1.0 1.8 5.0 338 269 A 11 ARG H A 11 ARG HGx 1.0 1.8 5.0 339 270 A 7 VAL HA A 26 TRP HA 1.0 1.8 5.0 340 271 A 7 VAL HA A 27 LYS H 1.0 1.8 5.0 341 272 A 7 VAL HA A 7 VAL HGx% 1.0 1.8 5.0 342 273 A 24 VAL HGx% A 7 VAL HGx% 1.0 1.8 3.5 343 274 A 7 VAL HA A 7 VAL HGy% 1.0 1.8 5.0 344 275 A 8 GLU H A 7 VAL HGy% 1.0 1.8 5.0 345 276 A 15 VAL HA A 15 VAL HGy% 1.0 1.8 3.5 346 277 A 20 VAL HA A 15 VAL HGy% 1.0 1.8 5.0 347 278 A 15 VAL HA A 15 VAL HGx% 1.0 1.8 3.5 348 279 A 12 LYS HBy A 23 LEU HBx 1.0 1.8 6.0 349 280 A 12 LYS HBx A 23 LEU HBx 1.0 1.8 6.0 350 281 A 23 LEU HA A 23 LEU HDy% 1.0 1.8 5.0 351 282 A 23 LEU HBy A 23 LEU HDy% 1.0 1.8 5.0 352 283 A 23 LEU HDy% A 23 LEU HBx 1.0 1.8 5.0 353 284 A 23 LEU HA A 23 LEU HDx% 1.0 1.8 5.0 354 285 A 23 LEU HBy A 23 LEU HDx% 1.0 1.8 5.0 355 286 A 23 LEU HBx A 23 LEU HDx% 1.0 1.8 5.0 356 287 A 47 LEU HA A 47 LEU HDy% 1.0 1.8 5.0 357 288 A 47 LEU HA A 47 LEU HDx% 1.0 1.8 5.0 358 289 A 42 ILE HG2% A 47 LEU HBx 1.0 1.8 5.0 359 290 A 10 ILE HD1% A 47 LEU HDy% 1.0 1.8 5.0 360 291 A 47 LEU HDy% A 47 LEU HBx 1.0 1.8 5.0 361 292 B 25 ALA HB% A 47 LEU HDy% 1.0 1.8 3.5 362 293 A 47 LEU HDy% A 47 LEU HBy 1.0 1.8 5.0 363 294 A 47 LEU HDy% B 23 LYS HBy 1.0 1.8 6.0 364 295 B 24 ALA HA A 47 LEU HDx% 1.0 1.8 5.0 365 296 A 47 LEU HBy A 47 LEU HDx% 1.0 1.8 5.0 366 297 B 23 LYS HBy A 47 LEU HDx% 1.0 1.8 6.0 367 298 A 47 LEU HBx A 47 LEU HDx% 1.0 1.8 5.0 368 299 A 21 GLU HA A 39 GLU H 1.0 1.8 5.0 369 300 A 32 LYS HA A 34 SER H 1.0 1.8 5.0 370 301 A 32 LYS HBy A 32 LYS HD2 1.0 1.8 5.0 371 301 A 32 LYS HBy A 32 LYS HD3 1.0 1.8 5.0 372 302 A 36 TRP HH2 A 12 LYS HDy 1.0 1.8 5.0 373 303 A 36 TRP HZ2 A 12 LYS HDy 1.0 1.8 5.0 374 304 A 36 TRP HZ2 A 12 LYS HDx 1.0 1.8 5.0 375 305 A 15 VAL HB A 18 GLY H 1.0 1.8 6.0 376 306 A 18 GLY H A 17 LYS HBx 1.0 1.8 6.0 377 307 A 18 GLY H A 17 LYS HBy 1.0 1.8 6.0 378 308 A 9 SER H A 25 LYS HG2 1.0 1.8 5.0 379 308 A 25 LYS HG3 A 9 SER H 1.0 1.8 5.0 380 309 A 9 SER H A 8 GLU HBy 1.0 1.8 5.0 381 310 A 9 SER H A 8 GLU HBx 1.0 1.8 5.0 382 311 A 9 SER H A 25 LYS HB2 1.0 1.8 3.5 383 311 A 25 LYS HB3 A 9 SER H 1.0 1.8 3.5 384 312 A 9 SER HBy A 9 SER H 1.0 1.8 5.0 385 313 A 7 VAL HA A 9 SER H 1.0 1.8 5.0 386 314 A 9 SER H A 9 SER HBx 1.0 1.8 5.0 387 315 A 25 LYS HA A 9 SER H 1.0 1.8 6.0 388 316 A 26 TRP HA A 9 SER H 1.0 1.8 6.0 389 317 A 9 SER H A 25 LYS H 1.0 1.8 5.0 390 318 A 8 GLU H A 9 SER H 1.0 1.8 3.5 391 319 A 24 VAL HGy% A 35 THR H 1.0 1.8 6.0 392 320 A 35 THR H A 24 VAL HB 1.0 1.8 5.0 393 321 A 35 THR HG2% A 35 THR H 1.0 1.8 5.0 394 322 A 35 THR H A 34 SER HBy 1.0 1.8 5.0 395 323 A 35 THR H A 34 SER HBx 1.0 1.8 5.0 396 324 A 34 SER HA A 35 THR H 1.0 1.8 3.5 397 325 A 26 TRP HD1 A 35 THR H 1.0 1.8 5.0 398 326 A 35 THR H A 24 VAL H 1.0 1.8 5.0 399 327 A 35 THR H A 26 TRP HE1 1.0 1.8 5.0 400 328 A 13 LYS H A 12 LYS H 1.0 1.8 5.0 401 329 A 23 LEU H A 12 LYS H 1.0 1.8 3.5 402 330 A 11 ARG H A 12 LYS H 1.0 1.8 3.5 403 331 A 22 TYR HA A 12 LYS H 1.0 1.8 5.0 404 332 A 10 ILE HA A 12 LYS H 1.0 1.8 5.0 405 333 A 10 ILE HG2% A 12 LYS H 1.0 1.8 3.5 406 334 A 12 LYS H A 23 LEU HDx% 1.0 1.8 6.0 407 335 A 12 LYS H A 23 LEU HBy 1.0 1.8 5.0 408 336 A 12 LYS H A 11 ARG HBx 1.0 1.8 5.0 409 337 A 12 LYS H A 11 ARG HBy 1.0 1.8 5.0 410 338 A 12 LYS H A 23 LEU HBx 1.0 1.8 5.0 411 339 A 12 LYS H A 23 LEU HDy% 1.0 1.8 6.0 412 340 A 42 ILE HA A 44 ASP H 1.0 1.8 6.0 413 341 A 43 LEU H A 44 ASP H 1.0 1.8 5.0 414 342 A 44 ASP H A 43 LEU HBy 1.0 1.8 6.0 415 343 A 44 ASP H A 43 LEU HBx 1.0 1.8 6.0 416 344 A 34 SER H A 34 SER HBy 1.0 1.8 5.0 417 345 A 34 SER H A 34 SER HBx 1.0 1.8 5.0 418 346 A 34 SER H A 33 TYR HBx 1.0 1.8 5.0 419 347 A 34 SER H A 33 TYR HBy 1.0 1.8 5.0 420 348 A 31 PRO HA A 34 SER H 1.0 1.8 5.0 421 349 A 33 TYR H A 34 SER H 1.0 1.8 3.5 422 350 A 48 VAL H A 42 ILE HG2% 1.0 1.8 5.0 423 351 A 48 VAL H A 47 LEU HBx 1.0 1.8 5.0 424 352 A 48 VAL H A 47 LEU HBy 1.0 1.8 5.0 425 353 A 48 VAL H A 48 VAL HB 1.0 1.8 3.5 426 354 A 46 ARG HA A 48 VAL H 1.0 1.8 5.0 427 355 A 48 VAL H A 46 ARG H 1.0 1.8 5.0 428 356 A 37 GLU H A 22 TYR H 1.0 1.8 5.0 429 357 A 22 TYR H A 21 GLU H 1.0 1.8 5.0 430 358 A 22 TYR HD% A 22 TYR H 1.0 1.8 5.0 431 359 A 36 TRP HE3 A 22 TYR H 1.0 1.8 5.0 432 360 A 22 TYR HE% A 22 TYR H 1.0 1.8 6.0 433 361 A 21 GLU HA A 22 TYR H 1.0 1.8 3.5 434 362 A 22 TYR H A 22 TYR HBy 1.0 1.8 5.0 435 363 A 22 TYR H A 22 TYR HBx 1.0 1.8 5.0 436 364 A 22 TYR H A 21 GLU HBy 1.0 1.8 5.0 437 365 A 22 TYR H A 21 GLU HBx 1.0 1.8 5.0 438 366 A 20 VAL HGx% A 22 TYR H 1.0 1.8 6.0 439 367 A 42 ILE HD1% A 22 TYR H 1.0 1.8 6.0 440 368 A 24 VAL HGy% A 22 TYR H 1.0 1.8 6.0 441 369 A 33 TYR H A 32 LYS HGx 1.0 1.8 5.0 442 370 A 33 TYR H A 32 LYS HGy 1.0 1.8 5.0 443 371 A 33 TYR H A 32 LYS HBx 1.0 1.8 5.0 444 372 A 33 TYR H A 32 LYS HBy 1.0 1.8 5.0 445 373 A 33 TYR H A 30 PRO HG2 1.0 1.8 5.0 446 373 A 30 PRO HG3 A 33 TYR H 1.0 1.8 5.0 447 374 A 33 TYR H A 33 TYR HBy 1.0 1.8 5.0 448 375 A 33 TYR H A 33 TYR HBx 1.0 1.8 5.0 449 376 A 33 TYR H A 30 PRO HD2 1.0 1.8 5.0 450 376 A 30 PRO HD3 A 33 TYR H 1.0 1.8 5.0 451 377 A 33 TYR H A 31 PRO HD2 1.0 1.8 6.0 452 377 A 33 TYR H A 31 PRO HD3 1.0 1.8 6.0 453 378 A 33 TYR HD% A 33 TYR H 1.0 1.8 5.0 454 379 A 46 ARG H A 47 LEU H 1.0 1.8 3.5 455 380 A 48 VAL H A 47 LEU H 1.0 1.8 3.5 456 381 A 45 PRO HA A 47 LEU H 1.0 1.8 5.0 457 382 A 47 LEU H A 44 ASP HBx 1.0 1.8 6.0 458 383 A 47 LEU H A 47 LEU HBy 1.0 1.8 5.0 459 384 A 45 PRO HGy A 47 LEU H 1.0 1.8 6.0 460 385 A 48 VAL HB A 47 LEU H 1.0 1.8 6.0 461 386 A 47 LEU H A 47 LEU HBx 1.0 1.8 5.0 462 387 A 42 ILE HG2% A 47 LEU H 1.0 1.8 5.0 463 388 A 47 LEU H A 47 LEU HDx% 1.0 1.8 5.0 464 389 A 47 LEU H A 47 LEU HDy% 1.0 1.8 5.0 465 390 A 38 PRO HBx A 41 HIS H 1.0 1.8 6.0 466 391 A 41 HIS H A 39 GLU HB2 1.0 1.8 6.0 467 391 A 39 GLU HB3 A 41 HIS H 1.0 1.8 6.0 468 392 A 41 HIS H A 40 GLU HB2 1.0 1.8 5.0 469 392 A 40 GLU HB3 A 41 HIS H 1.0 1.8 5.0 470 393 A 41 HIS H A 38 PRO HBy 1.0 1.8 5.0 471 394 A 38 PRO HDy A 41 HIS H 1.0 1.8 5.0 472 395 A 41 HIS H A 39 GLU HA 1.0 1.8 5.0 473 396 A 22 TYR HD% A 41 HIS H 1.0 1.8 6.0 474 397 A 44 ASP HA A 46 ARG H 1.0 1.8 5.0 475 398 A 46 ARG H A 45 PRO HDx 1.0 1.8 5.0 476 399 A 46 ARG H A 46 ARG HG2 1.0 1.8 3.5 477 399 A 46 ARG HG3 A 46 ARG H 1.0 1.8 3.5 478 400 A 45 PRO HGy A 46 ARG H 1.0 1.8 5.0 479 401 A 50 ALA HB% A 51 TYR H 1.0 1.8 3.5 480 402 A 10 ILE HG1y A 51 TYR H 1.0 1.8 5.0 481 403 A 51 TYR H A 54 LYS HD2 1.0 1.8 6.0 482 403 A 51 TYR H A 54 LYS HD3 1.0 1.8 6.0 483 404 A 10 ILE HB A 51 TYR H 1.0 1.8 6.0 484 405 A 52 GLU HBy A 51 TYR H 1.0 1.8 5.0 485 406 A 51 TYR H A 51 TYR HB2 1.0 1.8 3.5 486 406 A 51 TYR HB3 A 51 TYR H 1.0 1.8 3.5 487 407 A 48 VAL HA A 51 TYR H 1.0 1.8 5.0 488 408 A 51 TYR HD% A 51 TYR H 1.0 1.8 5.0 489 409 A 50 ALA H A 51 TYR H 1.0 1.8 3.5 490 410 A 51 TYR H A 52 GLU H 1.0 1.8 3.5 491 411 A 41 HIS H A 40 GLU H 1.0 1.8 5.0 492 412 A 22 TYR HD% A 40 GLU H 1.0 1.8 6.0 493 413 A 40 GLU H A 39 GLU HGy 1.0 1.8 5.0 494 414 A 40 GLU H A 40 GLU HGy 1.0 1.8 5.0 495 415 A 40 GLU H A 39 GLU HB2 1.0 1.8 5.0 496 415 A 39 GLU HB3 A 40 GLU H 1.0 1.8 5.0 497 416 A 40 GLU H A 40 GLU HGx 1.0 1.8 5.0 498 417 A 40 GLU H A 40 GLU HB2 1.0 1.8 3.5 499 417 A 40 GLU HB3 A 40 GLU H 1.0 1.8 3.5 500 418 A 38 PRO HBy A 40 GLU H 1.0 1.8 5.0 501 419 A 53 GLU H A 53 GLU HB2 1.0 1.8 3.5 502 419 A 53 GLU HB3 A 53 GLU H 1.0 1.8 3.5 503 420 A 53 GLU H A 53 GLU HGy 1.0 1.8 5.0 504 421 A 53 GLU H A 53 GLU HGx 1.0 1.8 5.0 505 422 A 53 GLU H A 52 GLU H 1.0 1.8 3.5 506 423 A 50 ALA H A 49 MET HBy 1.0 1.8 5.0 507 424 A 50 ALA H A 49 MET HBx 1.0 1.8 5.0 508 425 A 50 ALA H A 50 ALA HB% 1.0 1.8 3.5 509 426 A 15 VAL H A 15 VAL HGx% 1.0 1.8 5.0 510 427 A 15 VAL H A 15 VAL HGy% 1.0 1.8 5.0 511 428 A 14 ARG HBx A 15 VAL H 1.0 1.8 5.0 512 429 A 15 VAL HB A 15 VAL H 1.0 1.8 3.5 513 430 A 15 VAL H A 14 ARG HBy 1.0 1.8 3.5 514 431 A 15 VAL H A 16 ARG H 1.0 1.8 5.0 515 432 A 15 VAL H A 14 ARG H 1.0 1.8 5.0 516 433 A 50 ALA H A 49 MET H 1.0 1.8 5.0 517 434 A 51 TYR H A 49 MET H 1.0 1.8 5.0 518 435 A 48 VAL H A 49 MET H 1.0 1.8 3.5 519 436 A 46 ARG HA A 49 MET H 1.0 1.8 5.0 520 437 A 49 MET H A 49 MET HGy 1.0 1.8 5.0 521 438 A 49 MET H A 49 MET HGx 1.0 1.8 5.0 522 439 A 48 VAL HB A 49 MET H 1.0 1.8 5.0 523 440 A 49 MET H A 48 VAL HGx% 1.0 1.8 5.0 524 441 A 49 MET H A 48 VAL HGy% 1.0 1.8 5.0 525 442 A 10 ILE HG2% A 10 ILE H 1.0 1.8 5.0 526 443 A 10 ILE HG1y A 10 ILE H 1.0 1.8 5.0 527 444 A 10 ILE HG1x A 10 ILE H 1.0 1.8 5.0 528 445 A 10 ILE HB A 10 ILE H 1.0 1.8 3.5 529 446 A 39 GLU H A 20 VAL HB 1.0 1.8 5.0 530 447 A 39 GLU H A 38 PRO HBy 1.0 1.8 3.5 531 448 A 39 GLU H A 39 GLU HB2 1.0 1.8 3.5 532 448 A 39 GLU HB3 A 39 GLU H 1.0 1.8 3.5 533 449 A 39 GLU H A 39 GLU HGx 1.0 1.8 5.0 534 450 A 39 GLU H A 39 GLU HGy 1.0 1.8 5.0 535 451 A 9 SER HBy A 10 ILE H 1.0 1.8 5.0 536 452 A 9 SER HBx A 10 ILE H 1.0 1.8 3.5 537 453 A 9 SER HA A 10 ILE H 1.0 1.8 3.5 538 454 A 22 TYR HD% A 39 GLU H 1.0 1.8 5.0 539 455 A 22 TYR HE% A 39 GLU H 1.0 1.8 5.0 540 456 A 39 GLU H A 40 GLU H 1.0 1.8 5.0 541 457 A 4 VAL H A 4 VAL HB 1.0 1.8 5.0 542 458 A 4 VAL H A 3 GLN HBy 1.0 1.8 5.0 543 459 A 4 VAL H A 3 GLN HBx 1.0 1.8 5.0 544 460 A 4 VAL H A 4 VAL HG1% 1.0 1.8 5.0 545 461 A 29 TRP HBx A 29 TRP H 1.0 1.8 5.0 546 462 A 29 TRP HBy A 29 TRP H 1.0 1.8 3.5 547 463 A 29 TRP H A 26 TRP HBx 1.0 1.8 5.0 548 464 A 29 TRP H A 26 TRP HBy 1.0 1.8 5.0 549 465 A 29 TRP H A 30 PRO HD2 1.0 1.8 5.0 550 465 A 30 PRO HD3 A 29 TRP H 1.0 1.8 5.0 551 466 A 29 TRP HE3 A 29 TRP H 1.0 1.8 6.0 552 467 A 29 TRP H A 29 TRP HD1 1.0 1.8 5.0 553 468 A 51 TYR HD% A 52 GLU H 1.0 1.8 5.0 554 469 A 49 MET HA A 52 GLU H 1.0 1.8 5.0 555 470 A 48 VAL HA A 52 GLU H 1.0 1.8 5.0 556 471 A 52 GLU H A 51 TYR HB2 1.0 1.8 3.5 557 471 A 51 TYR HB3 A 52 GLU H 1.0 1.8 3.5 558 472 A 52 GLU H A 52 GLU HGy 1.0 1.8 5.0 559 473 A 52 GLU H A 52 GLU HGx 1.0 1.8 5.0 560 474 A 52 GLU HBy A 52 GLU H 1.0 1.8 3.5 561 475 A 52 GLU HBx A 52 GLU H 1.0 1.8 5.0 562 476 A 54 LYS H A 54 LYS HGy 1.0 1.8 5.0 563 477 A 54 LYS H A 54 LYS HGx 1.0 1.8 5.0 564 478 A 54 LYS H A 54 LYS HBx 1.0 1.8 5.0 565 479 A 54 LYS H A 54 LYS HBy 1.0 1.8 5.0 566 480 A 54 LYS H A 53 GLU HB2 1.0 1.8 5.0 567 480 A 53 GLU HB3 A 54 LYS H 1.0 1.8 5.0 568 481 A 52 GLU HA A 54 LYS H 1.0 1.8 5.0 569 482 A 54 LYS H A 53 GLU H 1.0 1.8 3.5 570 483 A 16 ARG H A 19 LYS H 1.0 1.8 5.0 571 484 A 18 GLY H A 19 LYS H 1.0 1.8 5.0 572 485 A 19 LYS HBx A 19 LYS H 1.0 1.8 5.0 573 486 A 19 LYS H A 19 LYS HBy 1.0 1.8 3.5 574 487 A 19 LYS HGy A 19 LYS H 1.0 1.8 5.0 575 488 A 19 LYS H A 19 LYS HGx 1.0 1.8 5.0 576 489 A 13 LYS H A 12 LYS HBx 1.0 1.8 5.0 577 490 A 13 LYS HBy A 13 LYS H 1.0 1.8 5.0 578 491 A 36 TRP HH2 A 13 LYS H 1.0 1.8 5.0 579 492 A 51 TYR HE% A 13 LYS H 1.0 1.8 6.0 580 493 A 6 ALA H A 5 PHE HBy 1.0 1.8 5.0 581 494 A 6 ALA H A 5 PHE HBx 1.0 1.8 5.0 582 495 A 35 THR H A 36 TRP H 1.0 1.8 5.0 583 496 A 36 TRP H A 36 TRP HD1 1.0 1.8 5.0 584 497 A 37 GLU H A 36 TRP H 1.0 1.8 5.0 585 498 A 35 THR HB A 36 TRP H 1.0 1.8 3.5 586 499 A 36 TRP H A 36 TRP HBy 1.0 1.8 5.0 587 500 A 36 TRP H A 36 TRP HBx 1.0 1.8 5.0 588 501 A 35 THR HG2% A 36 TRP H 1.0 1.8 5.0 589 502 A 10 ILE HG2% A 11 ARG H 1.0 1.8 5.0 590 503 A 10 ILE HG1y A 11 ARG H 1.0 1.8 6.0 591 504 A 10 ILE HB A 11 ARG H 1.0 1.8 5.0 592 505 A 11 ARG H A 11 ARG HBx 1.0 1.8 5.0 593 506 A 11 ARG H A 11 ARG HBy 1.0 1.8 5.0 594 507 A 24 VAL HA A 11 ARG H 1.0 1.8 5.0 595 508 A 11 ARG H A 11 ARG HDx 1.0 1.8 6.0 596 509 A 11 ARG H A 11 ARG HDy 1.0 1.8 6.0 597 510 A 11 ARG H A 51 TYR HB2 1.0 1.8 6.0 598 510 A 51 TYR HB3 A 11 ARG H 1.0 1.8 6.0 599 511 A 10 ILE HA A 11 ARG H 1.0 1.8 3.5 600 512 A 5 PHE H A 26 TRP HZ3 1.0 1.8 5.0 601 513 A 5 PHE HD% A 5 PHE H 1.0 1.8 5.0 602 514 A 26 TRP HE3 A 5 PHE H 1.0 1.8 6.0 603 515 A 4 VAL HA A 5 PHE H 1.0 1.8 3.5 604 516 A 4 VAL HB A 5 PHE H 1.0 1.8 5.0 605 517 B 25 ALA HB% A 5 PHE H 1.0 1.8 6.0 606 518 A 14 ARG H A 13 LYS HGy 1.0 1.8 5.0 607 519 A 14 ARG H A 14 ARG HGy 1.0 1.8 5.0 608 520 A 14 ARG H A 13 LYS HGx 1.0 1.8 5.0 609 521 A 14 ARG H A 14 ARG HGx 1.0 1.8 5.0 610 522 A 20 VAL HGx% A 14 ARG H 1.0 1.8 5.0 611 523 A 13 LYS HBx A 14 ARG H 1.0 1.8 5.0 612 524 A 13 LYS HBy A 14 ARG H 1.0 1.8 5.0 613 525 A 13 LYS HA A 14 ARG H 1.0 1.8 3.5 614 526 A 36 TRP HZ3 A 14 ARG H 1.0 1.8 5.0 615 527 A 22 TYR HD% A 14 ARG H 1.0 1.8 5.0 616 528 A 36 TRP HE3 A 14 ARG H 1.0 1.8 6.0 617 529 A 13 LYS H A 14 ARG H 1.0 1.8 5.0 618 530 A 37 GLU H A 24 VAL H 1.0 1.8 5.0 619 531 A 36 TRP HE3 A 37 GLU H 1.0 1.8 5.0 620 532 A 36 TRP HA A 37 GLU H 1.0 1.8 3.5 621 533 A 19 LYS H A 20 VAL H 1.0 1.8 5.0 622 534 A 19 LYS HA A 20 VAL H 1.0 1.8 3.5 623 535 A 19 LYS HBx A 20 VAL H 1.0 1.8 5.0 624 536 A 20 VAL HB A 20 VAL H 1.0 1.8 3.5 625 537 A 38 PRO HBx A 20 VAL H 1.0 1.8 5.0 626 538 A 20 VAL HGy% A 20 VAL H 1.0 1.8 3.5 627 539 A 20 VAL HGx% A 20 VAL H 1.0 1.8 5.0 628 540 A 19 LYS HGy A 20 VAL H 1.0 1.8 5.0 629 541 A 11 ARG H A 25 LYS H 1.0 1.8 5.0 630 542 A 10 ILE HA A 25 LYS H 1.0 1.8 5.0 631 543 A 24 VAL HA A 25 LYS H 1.0 1.8 3.5 632 544 A 25 LYS H A 25 LYS HB2 1.0 1.8 5.0 633 544 A 25 LYS HB3 A 25 LYS H 1.0 1.8 5.0 634 545 A 25 LYS H A 25 LYS HD2 1.0 1.8 5.0 635 545 A 25 LYS HD3 A 25 LYS H 1.0 1.8 5.0 636 546 A 13 LYS HBy A 23 LEU H 1.0 1.8 6.0 637 547 A 25 LYS H A 24 VAL HB 1.0 1.8 5.0 638 548 A 25 LYS H A 25 LYS HG2 1.0 1.8 5.0 639 548 A 25 LYS HG3 A 25 LYS H 1.0 1.8 5.0 640 549 A 24 VAL HGx% A 25 LYS H 1.0 1.8 5.0 641 550 A 7 VAL H A 7 VAL HB 1.0 1.8 5.0 642 551 A 21 GLU H A 14 ARG H 1.0 1.8 5.0 643 552 A 21 GLU H A 20 VAL H 1.0 1.8 5.0 644 553 A 21 GLU H A 15 VAL H 1.0 1.8 5.0 645 554 A 20 VAL HA A 21 GLU H 1.0 1.8 3.5 646 555 A 15 VAL HA A 21 GLU H 1.0 1.8 5.0 647 556 A 20 VAL HB A 21 GLU H 1.0 1.8 5.0 648 557 A 20 VAL HGx% A 21 GLU H 1.0 1.8 3.5 649 558 A 21 GLU H A 14 ARG HGx 1.0 1.8 5.0 650 559 A 20 VAL HGy% A 21 GLU H 1.0 1.8 5.0 651 560 A 21 GLU H A 14 ARG HGy 1.0 1.8 5.0 652 561 B 25 ALA HB% A 43 LEU H 1.0 1.8 5.0 653 562 A 43 LEU HG A 43 LEU H 1.0 1.8 5.0 654 563 A 27 LYS H A 27 LYS HB2 1.0 1.8 5.0 655 563 A 27 LYS HB3 A 27 LYS H 1.0 1.8 5.0 656 564 A 6 ALA HB% A 27 LYS H 1.0 1.8 5.0 657 565 A 27 LYS H A 27 LYS HG2 1.0 1.8 5.0 658 565 A 27 LYS HG3 A 27 LYS H 1.0 1.8 5.0 659 566 A 23 LEU H A 23 LEU HBx 1.0 1.8 5.0 660 567 A 23 LEU H A 23 LEU HDy% 1.0 1.8 5.0 661 568 A 10 ILE HG2% A 23 LEU H 1.0 1.8 5.0 662 569 A 23 LEU H A 23 LEU HBy 1.0 1.8 5.0 663 570 A 23 LEU H A 23 LEU HDx% 1.0 1.8 5.0 664 571 A 24 VAL HGy% A 23 LEU H 1.0 1.8 6.0 665 572 A 23 LEU H A 12 LYS HBx 1.0 1.8 5.0 666 573 A 23 LEU H A 12 LYS HBy 1.0 1.8 5.0 667 574 A 23 LEU H A 22 TYR HBx 1.0 1.8 5.0 668 575 A 23 LEU H A 22 TYR HBy 1.0 1.8 5.0 669 576 A 22 TYR HA A 23 LEU H 1.0 1.8 3.5 670 577 A 22 TYR HD% A 23 LEU H 1.0 1.8 5.0 671 578 A 36 TRP HZ3 A 23 LEU H 1.0 1.8 5.0 672 579 A 36 TRP HE3 A 23 LEU H 1.0 1.8 5.0 673 580 A 23 LEU H A 11 ARG H 1.0 1.8 5.0 674 581 A 23 LEU H A 22 TYR H 1.0 1.8 5.0 675 582 A 55 GLU HA A 56 GLU H 1.0 1.8 3.5 676 583 A 56 GLU H A 56 GLU HG2 1.0 1.8 5.0 677 583 A 56 GLU HG3 A 56 GLU H 1.0 1.8 5.0 678 584 A 8 GLU H A 24 VAL HGx% 1.0 1.8 5.0 679 585 A 8 GLU H A 7 VAL HGx% 1.0 1.8 5.0 680 586 A 8 GLU H A 8 GLU HBy 1.0 1.8 5.0 681 587 A 8 GLU H A 8 GLU HBx 1.0 1.8 5.0 682 588 A 8 GLU H A 6 ALA HB% 1.0 1.8 6.0 683 589 A 8 GLU H A 25 LYS HD2 1.0 1.8 6.0 684 589 A 25 LYS HD3 A 8 GLU H 1.0 1.8 6.0 685 590 A 8 GLU H A 27 LYS HG2 1.0 1.8 6.0 686 590 A 8 GLU H A 27 LYS HG3 1.0 1.8 6.0 687 591 A 8 GLU H A 25 LYS HB2 1.0 1.8 6.0 688 591 A 25 LYS HB3 A 8 GLU H 1.0 1.8 6.0 689 592 A 7 VAL HA A 8 GLU H 1.0 1.8 3.5 690 593 A 8 GLU H A 9 SER HA 1.0 1.8 5.0 691 594 A 8 GLU H A 27 LYS HA 1.0 1.8 6.0 692 595 A 26 TRP HA A 8 GLU H 1.0 1.8 5.0 693 596 A 8 GLU H A 27 LYS H 1.0 1.8 5.0 694 597 A 18 GLY H A 16 ARG H 1.0 1.8 5.0 695 598 A 20 VAL HA A 16 ARG H 1.0 1.8 5.0 696 599 A 15 VAL HA A 16 ARG H 1.0 1.8 3.5 697 600 A 16 ARG H A 15 VAL HGx% 1.0 1.8 5.0 698 601 A 16 ARG H A 15 VAL HGy% 1.0 1.8 5.0 699 602 A 16 ARG H A 16 ARG HBx 1.0 1.8 5.0 700 603 A 16 ARG H A 16 ARG HBy 1.0 1.8 5.0 701 604 A 16 ARG H A 19 LYS HGx 1.0 1.8 6.0 702 605 A 15 VAL HB A 16 ARG H 1.0 1.8 5.0 703 606 A 16 ARG H A 19 LYS HBy 1.0 1.8 5.0 704 607 A 19 LYS HBx A 16 ARG H 1.0 1.8 5.0 705 608 A 20 VAL HGy% A 16 ARG H 1.0 1.8 6.0 706 609 A 24 VAL H A 23 LEU HBx 1.0 1.8 6.0 707 610 A 24 VAL HGx% A 24 VAL H 1.0 1.8 5.0 708 611 A 23 LEU HG A 24 VAL H 1.0 1.8 5.0 709 612 A 24 VAL HGy% A 24 VAL H 1.0 1.8 5.0 710 613 A 24 VAL H A 23 LEU HBy 1.0 1.8 6.0 711 614 A 24 VAL HB A 24 VAL H 1.0 1.8 5.0 712 615 A 23 LEU HA A 24 VAL H 1.0 1.8 3.5 713 616 A 10 ILE HA A 24 VAL H 1.0 1.8 6.0 714 617 A 36 TRP HA A 24 VAL H 1.0 1.8 5.0 715 618 A 23 LEU H A 24 VAL H 1.0 1.8 5.0 716 619 A 26 TRP HD1 A 26 TRP H 1.0 1.8 5.0 717 620 A 25 LYS HA A 26 TRP H 1.0 1.8 3.5 718 621 A 34 SER HA A 26 TRP H 1.0 1.8 5.0 719 622 A 29 TRP HBy A 26 TRP H 1.0 1.8 6.0 720 623 A 26 TRP H A 25 LYS HG2 1.0 1.8 5.0 721 623 A 25 LYS HG3 A 26 TRP H 1.0 1.8 5.0 722 624 A 26 TRP H A 25 LYS HD2 1.0 1.8 5.0 723 624 A 25 LYS HD3 A 26 TRP H 1.0 1.8 5.0 724 625 A 24 VAL HGx% A 26 TRP H 1.0 1.8 6.0 725 626 A 24 VAL HGx% A 9 SER H 1.0 1.8 5.0 726 627 A 47 LEU H A 44 ASP HBy 1.0 1.8 6.0 727 628 B 25 ALA HB% A 9 SER H 1.0 1.8 6.0 728 629 A 23 LEU HA A 12 LYS H 1.0 1.8 6.0 729 630 A 10 ILE HG2% A 51 TYR H 1.0 1.8 6.0 730 631 A 36 TRP HE1 A 23 LEU HDx% 1.0 1.8 5.0 731 632 A 36 TRP HE1 A 23 LEU HDy% 1.0 1.8 5.0 732 633 A 24 VAL HB A 26 TRP HE1 1.0 1.8 5.0 733 634 A 35 THR HG2% A 26 TRP HE1 1.0 1.8 5.0 734 635 A 35 THR HB A 26 TRP HE1 1.0 1.8 5.0 735 636 A 34 SER HA A 26 TRP HE1 1.0 1.8 5.0 736 637 A 42 ILE HD1% A 42 ILE H 1.0 1.8 5.0 737 638 A 42 ILE HG2% A 42 ILE H 1.0 1.8 5.0 738 639 A 42 ILE H A 42 ILE HG1x 1.0 1.8 5.0 739 640 A 42 ILE H A 42 ILE HG1y 1.0 1.8 5.0 740 641 A 42 ILE HB A 42 ILE H 1.0 1.8 3.5 741 642 A 42 ILE H A 40 GLU HB2 1.0 1.8 6.0 742 642 A 40 GLU HB3 A 42 ILE H 1.0 1.8 6.0 743 643 A 39 GLU HA A 42 ILE H 1.0 1.8 5.0 744 644 A 40 GLU HA A 42 ILE H 1.0 1.8 5.0 745 645 A 22 TYR HD% A 42 ILE H 1.0 1.8 6.0 746 646 A 41 HIS H A 42 ILE H 1.0 1.8 3.5 747 647 A 40 GLU H A 42 ILE H 1.0 1.8 5.0 748 648 B 25 ALA HB% A 7 VAL HGx% 1.0 1.8 5.0 749 649 A 8 GLU HA A 7 VAL HGx% 1.0 1.8 6.0 750 650 B 25 ALA HB% A 42 ILE HD1% 1.0 1.8 3.5 751 651 A 42 ILE HD1% B 25 ALA HA 1.0 1.8 5.0 752 652 B 25 ALA HB% A 47 LEU HDx% 1.0 1.8 3.5 753 653 B 23 LYS HA A 47 LEU HDx% 1.0 1.8 6.0 754 654 B 23 LYS HA A 47 LEU HDy% 1.0 1.8 6.0 755 655 B 24 ALA HA A 47 LEU HDy% 1.0 1.8 5.0 756 656 B 25 ALA HB% A 24 VAL HGy% 1.0 1.8 3.5 757 657 B 25 ALA HB% A 24 VAL HGx% 1.0 1.8 5.0 758 658 B 25 ALA HA A 7 VAL HGx% 1.0 1.8 6.0 759 659 A 13 LYS HEy A 20 VAL HA 1.0 1.8 6.0 760 660 A 51 TYR HA A 54 LYS HE2 1.0 1.8 6.0 761 660 A 51 TYR HA A 54 LYS HE3 1.0 1.8 6.0 762 661 A 54 LYS HA A 54 LYS HE2 1.0 1.8 5.0 763 661 A 54 LYS HA A 54 LYS HE3 1.0 1.8 5.0 764 662 A 6 ALA HB% A 27 LYS HA 1.0 1.8 6.0 765 663 B 25 ALA HB% A 7 VAL HGy% 1.0 1.8 5.0 766 664 B 25 ALA HA A 7 VAL HGy% 1.0 1.8 6.0 767 665 B 25 ALA HB% A 42 ILE HG2% 1.0 1.8 3.5 768 666 B 25 ALA HB% A 10 ILE HD1% 1.0 1.8 5.0 769 667 A 10 ILE HD1% A 10 ILE HA 1.0 1.8 5.0 770 668 A 26 TRP HZ2 A 24 VAL HB 1.0 1.8 5.0 771 669 A 26 TRP HZ2 B 26 ARG HA 1.0 1.8 5.0 772 670 B 25 ALA HB% A 26 TRP HH2 1.0 1.8 5.0 773 671 B 25 ALA HB% A 26 TRP HE3 1.0 1.8 5.0 774 672 B 25 ALA HB% A 26 TRP HZ3 1.0 1.8 5.0 775 673 A 3 GLN HA A 3 GLN HGy 1.0 1.8 5.0 776 673 A 3 GLN HA A 3 GLN HGx 1.0 1.8 5.0 777 674 A 3 GLN HA A 4 VAL HG2% 1.0 1.8 5.0 778 674 A 3 GLN HA A 4 VAL HG1% 1.0 1.8 5.0 779 675 A 4 VAL H A 3 GLN HBx 1.0 1.8 5.0 780 675 A 4 VAL H A 3 GLN HBy 1.0 1.8 5.0 781 676 A 4 VAL H A 4 VAL HG2% 1.0 1.8 3.5 782 676 A 4 VAL H A 4 VAL HG1% 1.0 1.8 3.5 783 677 A 5 PHE H A 4 VAL HG2% 1.0 1.8 5.0 784 677 A 5 PHE H A 4 VAL HG1% 1.0 1.8 5.0 785 678 A 26 TRP HZ3 A 4 VAL HG2% 1.0 1.8 5.0 786 678 A 26 TRP HZ3 A 4 VAL HG1% 1.0 1.8 5.0 787 679 B 26 ARG HA A 4 VAL HG2% 1.0 1.8 5.0 788 679 B 26 ARG HA A 4 VAL HG1% 1.0 1.8 5.0 789 680 A 4 VAL HG2% B 26 ARG HGy 1.0 1.8 5.0 790 680 A 4 VAL HG1% B 26 ARG HGy 1.0 1.8 5.0 791 680 B 26 ARG HGx A 4 VAL HG2% 1.0 1.8 5.0 792 680 A 4 VAL HG1% B 26 ARG HGx 1.0 1.8 5.0 793 681 A 4 VAL HG2% B 26 ARG HD2 1.0 1.8 5.0 794 681 A 4 VAL HG1% B 26 ARG HD2 1.0 1.8 5.0 795 681 B 26 ARG HD3 A 4 VAL HG2% 1.0 1.8 5.0 796 681 A 4 VAL HG1% B 26 ARG HD3 1.0 1.8 5.0 797 682 A 6 ALA H A 5 PHE HBx 1.0 1.8 5.0 798 682 A 6 ALA H A 5 PHE HBy 1.0 1.8 5.0 799 683 A 26 TRP HE3 A 5 PHE HBx 1.0 1.8 5.0 800 683 A 26 TRP HE3 A 5 PHE HBy 1.0 1.8 5.0 801 684 A 26 TRP HZ3 A 5 PHE HBx 1.0 1.8 5.0 802 684 A 26 TRP HZ3 A 5 PHE HBy 1.0 1.8 5.0 803 685 A 7 VAL H A 7 VAL HGy% 1.0 1.8 5.0 804 685 A 7 VAL H A 7 VAL HGx% 1.0 1.8 5.0 805 686 A 7 VAL HB A 47 LEU HDx% 1.0 1.8 5.0 806 686 A 7 VAL HB A 47 LEU HDy% 1.0 1.8 5.0 807 687 A 8 GLU H A 7 VAL HGy% 1.0 1.8 5.0 808 687 A 8 GLU H A 7 VAL HGx% 1.0 1.8 5.0 809 688 A 8 GLU HA A 7 VAL HGy% 1.0 1.8 5.0 810 688 A 8 GLU HA A 7 VAL HGx% 1.0 1.8 5.0 811 689 A 9 SER H A 7 VAL HGy% 1.0 1.8 3.5 812 689 A 9 SER H A 7 VAL HGx% 1.0 1.8 3.5 813 690 A 9 SER HA A 7 VAL HGy% 1.0 1.8 5.0 814 690 A 9 SER HA A 7 VAL HGx% 1.0 1.8 5.0 815 691 A 24 VAL HGx% A 7 VAL HGy% 1.0 1.8 3.5 816 691 A 24 VAL HGx% A 7 VAL HGx% 1.0 1.8 3.5 817 692 A 25 LYS H A 7 VAL HGy% 1.0 1.8 5.0 818 692 A 25 LYS H A 7 VAL HGx% 1.0 1.8 5.0 819 693 A 26 TRP HA A 7 VAL HGy% 1.0 1.8 5.0 820 693 A 26 TRP HA A 7 VAL HGx% 1.0 1.8 5.0 821 694 A 26 TRP HE3 A 7 VAL HGy% 1.0 1.8 5.0 822 694 A 26 TRP HE3 A 7 VAL HGx% 1.0 1.8 5.0 823 695 A 26 TRP HZ3 A 7 VAL HGy% 1.0 1.8 5.0 824 695 A 26 TRP HZ3 A 7 VAL HGx% 1.0 1.8 5.0 825 696 A 26 TRP HH2 A 7 VAL HGy% 1.0 1.8 5.0 826 696 A 26 TRP HH2 A 7 VAL HGx% 1.0 1.8 5.0 827 697 A 7 VAL HGx% A 47 LEU HDx% 1.0 1.8 3.5 828 697 A 47 LEU HDy% A 7 VAL HGy% 1.0 1.8 3.5 829 697 A 7 VAL HGx% A 47 LEU HDy% 1.0 1.8 3.5 830 697 A 7 VAL HGy% A 47 LEU HDx% 1.0 1.8 3.5 831 698 B 23 LYS HA A 7 VAL HGy% 1.0 1.8 6.0 832 698 B 23 LYS HA A 7 VAL HGx% 1.0 1.8 6.0 833 699 A 7 VAL HGx% B 23 LYS HBx 1.0 1.8 5.0 834 699 A 7 VAL HGy% B 23 LYS HBx 1.0 1.8 5.0 835 699 B 23 LYS HBy A 7 VAL HGy% 1.0 1.8 5.0 836 699 A 7 VAL HGx% B 23 LYS HBy 1.0 1.8 5.0 837 700 B 25 ALA HA A 7 VAL HGy% 1.0 1.8 5.0 838 700 B 25 ALA HA A 7 VAL HGx% 1.0 1.8 5.0 839 701 B 25 ALA HB% A 7 VAL HGy% 1.0 1.8 2.7 840 701 B 25 ALA HB% A 7 VAL HGx% 1.0 1.8 2.7 841 702 A 8 GLU H A 8 GLU HBx 1.0 1.8 3.5 842 702 A 8 GLU H A 8 GLU HBy 1.0 1.8 3.5 843 703 A 8 GLU H A 8 GLU HGx 1.0 1.8 6.0 844 703 A 8 GLU H A 8 GLU HGy 1.0 1.8 6.0 845 704 A 8 GLU HA A 8 GLU HGx 1.0 1.8 3.5 846 704 A 8 GLU HA A 8 GLU HGy 1.0 1.8 3.5 847 705 A 8 GLU HA A 47 LEU HDx% 1.0 1.8 6.0 848 705 A 8 GLU HA A 47 LEU HDy% 1.0 1.8 6.0 849 706 A 9 SER H A 8 GLU HBx 1.0 1.8 3.5 850 706 A 9 SER H A 8 GLU HBy 1.0 1.8 3.5 851 707 A 8 GLU HBx A 25 LYS HG2 1.0 1.8 5.0 852 707 A 8 GLU HBy A 25 LYS HG2 1.0 1.8 5.0 853 707 A 25 LYS HG3 A 8 GLU HBx 1.0 1.8 5.0 854 707 A 25 LYS HG3 A 8 GLU HBy 1.0 1.8 5.0 855 708 A 27 LYS H A 8 GLU HBx 1.0 1.8 5.0 856 708 A 27 LYS H A 8 GLU HBy 1.0 1.8 5.0 857 709 A 27 LYS HA A 8 GLU HBx 1.0 1.8 5.0 858 709 A 27 LYS HA A 8 GLU HBy 1.0 1.8 5.0 859 710 A 8 GLU HBy A 27 LYS HG2 1.0 1.8 5.0 860 710 A 8 GLU HBx A 27 LYS HG2 1.0 1.8 5.0 861 710 A 27 LYS HG3 A 8 GLU HBx 1.0 1.8 5.0 862 710 A 27 LYS HG3 A 8 GLU HBy 1.0 1.8 5.0 863 711 A 9 SER H A 8 GLU HGx 1.0 1.8 5.0 864 711 A 9 SER H A 8 GLU HGy 1.0 1.8 5.0 865 712 A 9 SER HA A 8 GLU HGx 1.0 1.8 6.0 866 712 A 9 SER HA A 8 GLU HGy 1.0 1.8 6.0 867 713 A 9 SER HA A 47 LEU HDx% 1.0 1.8 5.0 868 713 A 9 SER HA A 47 LEU HDy% 1.0 1.8 5.0 869 714 A 10 ILE HG2% A 22 TYR HBx 1.0 1.8 3.5 870 714 A 10 ILE HG2% A 22 TYR HBy 1.0 1.8 3.5 871 715 A 10 ILE HD1% A 22 TYR HBx 1.0 1.8 5.0 872 715 A 10 ILE HD1% A 22 TYR HBy 1.0 1.8 5.0 873 716 A 10 ILE HD1% A 42 ILE HG1x 1.0 1.8 5.0 874 716 A 10 ILE HD1% A 42 ILE HG1y 1.0 1.8 5.0 875 717 A 10 ILE HD1% A 47 LEU HBx 1.0 1.8 5.0 876 717 A 10 ILE HD1% A 47 LEU HBy 1.0 1.8 5.0 877 718 A 10 ILE HD1% A 47 LEU HDx% 1.0 1.8 3.5 878 718 A 10 ILE HD1% A 47 LEU HDy% 1.0 1.8 3.5 879 719 A 10 ILE HD1% A 48 VAL HGy% 1.0 1.8 5.0 880 719 A 10 ILE HD1% A 48 VAL HGx% 1.0 1.8 5.0 881 720 A 11 ARG H A 11 ARG HBy 1.0 1.8 3.5 882 720 A 11 ARG H A 11 ARG HBx 1.0 1.8 3.5 883 721 A 11 ARG H A 11 ARG HGy 1.0 1.8 5.0 884 721 A 11 ARG H A 11 ARG HGx 1.0 1.8 5.0 885 722 A 11 ARG H A 11 ARG HDx 1.0 1.8 5.0 886 722 A 11 ARG H A 11 ARG HDy 1.0 1.8 5.0 887 723 A 11 ARG H A 23 LEU HBx 1.0 1.8 5.0 888 723 A 11 ARG H A 23 LEU HBy 1.0 1.8 5.0 889 724 A 11 ARG H A 23 LEU HDx% 1.0 1.8 5.0 890 724 A 11 ARG H A 23 LEU HDy% 1.0 1.8 5.0 891 725 A 11 ARG HA A 11 ARG HGy 1.0 1.8 5.0 892 725 A 11 ARG HA A 11 ARG HGx 1.0 1.8 5.0 893 726 A 11 ARG HA A 11 ARG HDx 1.0 1.8 5.0 894 726 A 11 ARG HA A 11 ARG HDy 1.0 1.8 5.0 895 727 A 11 ARG HBx A 11 ARG HDx 1.0 1.8 3.5 896 727 A 11 ARG HBy A 11 ARG HDx 1.0 1.8 3.5 897 727 A 11 ARG HDy A 11 ARG HBy 1.0 1.8 3.5 898 727 A 11 ARG HBx A 11 ARG HDy 1.0 1.8 3.5 899 728 A 12 LYS H A 11 ARG HBy 1.0 1.8 3.5 900 728 A 12 LYS H A 11 ARG HBx 1.0 1.8 3.5 901 729 A 11 ARG HBy A 12 LYS HGx 1.0 1.8 5.0 902 729 A 11 ARG HBx A 12 LYS HGx 1.0 1.8 5.0 903 729 A 12 LYS HGy A 11 ARG HBy 1.0 1.8 5.0 904 729 A 11 ARG HBx A 12 LYS HGy 1.0 1.8 5.0 905 730 A 11 ARG HBx A 23 LEU HBx 1.0 1.8 5.0 906 730 A 11 ARG HBy A 23 LEU HBx 1.0 1.8 5.0 907 730 A 23 LEU HBy A 11 ARG HBy 1.0 1.8 5.0 908 730 A 11 ARG HBx A 23 LEU HBy 1.0 1.8 5.0 909 731 A 23 LEU HG A 11 ARG HBy 1.0 1.8 5.0 910 731 A 23 LEU HG A 11 ARG HBx 1.0 1.8 5.0 911 732 A 11 ARG HBy A 23 LEU HDx% 1.0 1.8 3.5 912 732 A 11 ARG HBx A 23 LEU HDx% 1.0 1.8 3.5 913 732 A 23 LEU HDy% A 11 ARG HBy 1.0 1.8 3.5 914 732 A 11 ARG HBx A 23 LEU HDy% 1.0 1.8 3.5 915 733 A 11 ARG HDx A 12 LYS HGx 1.0 1.8 5.0 916 733 A 11 ARG HDy A 12 LYS HGx 1.0 1.8 5.0 917 733 A 12 LYS HGy A 11 ARG HDx 1.0 1.8 5.0 918 733 A 11 ARG HDy A 12 LYS HGy 1.0 1.8 5.0 919 734 A 11 ARG HDx A 23 LEU HDx% 1.0 1.8 5.0 920 734 A 11 ARG HDy A 23 LEU HDx% 1.0 1.8 5.0 921 734 A 23 LEU HDy% A 11 ARG HDx 1.0 1.8 5.0 922 734 A 11 ARG HDy A 23 LEU HDy% 1.0 1.8 5.0 923 735 A 12 LYS H A 12 LYS HBx 1.0 1.8 5.0 924 735 A 12 LYS H A 12 LYS HBy 1.0 1.8 5.0 925 736 A 12 LYS H A 12 LYS HGx 1.0 1.8 5.0 926 736 A 12 LYS H A 12 LYS HGy 1.0 1.8 5.0 927 737 A 12 LYS H A 23 LEU HBx 1.0 1.8 3.5 928 737 A 12 LYS H A 23 LEU HBy 1.0 1.8 3.5 929 738 A 12 LYS H A 23 LEU HDx% 1.0 1.8 5.0 930 738 A 12 LYS H A 23 LEU HDy% 1.0 1.8 5.0 931 739 A 12 LYS HBy A 12 LYS HDx 1.0 1.8 3.5 932 739 A 12 LYS HBx A 12 LYS HDx 1.0 1.8 3.5 933 739 A 12 LYS HDy A 12 LYS HBx 1.0 1.8 3.5 934 739 A 12 LYS HBy A 12 LYS HDy 1.0 1.8 3.5 935 740 A 12 LYS HBx A 23 LEU HBx 1.0 1.8 5.0 936 740 A 12 LYS HBy A 23 LEU HBx 1.0 1.8 5.0 937 740 A 23 LEU HBy A 12 LYS HBx 1.0 1.8 5.0 938 740 A 23 LEU HBy A 12 LYS HBy 1.0 1.8 5.0 939 741 A 12 LYS HBx A 23 LEU HDx% 1.0 1.8 5.0 940 741 A 12 LYS HBy A 23 LEU HDx% 1.0 1.8 5.0 941 741 A 23 LEU HDy% A 12 LYS HBx 1.0 1.8 5.0 942 741 A 23 LEU HDy% A 12 LYS HBy 1.0 1.8 5.0 943 742 A 36 TRP HZ2 A 12 LYS HBx 1.0 1.8 5.0 944 742 A 36 TRP HZ2 A 12 LYS HBy 1.0 1.8 5.0 945 743 A 12 LYS HE2 A 12 LYS HGx 1.0 1.8 3.5 946 743 A 12 LYS HE3 A 12 LYS HGx 1.0 1.8 3.5 947 743 A 12 LYS HGy A 12 LYS HE2 1.0 1.8 3.5 948 743 A 12 LYS HE3 A 12 LYS HGy 1.0 1.8 3.5 949 744 A 13 LYS H A 12 LYS HGx 1.0 1.8 5.0 950 744 A 13 LYS H A 12 LYS HGy 1.0 1.8 5.0 951 745 A 12 LYS HGy A 23 LEU HDx% 1.0 1.8 5.0 952 745 A 12 LYS HGx A 23 LEU HDx% 1.0 1.8 5.0 953 745 A 23 LEU HDy% A 12 LYS HGx 1.0 1.8 5.0 954 745 A 23 LEU HDy% A 12 LYS HGy 1.0 1.8 5.0 955 746 A 36 TRP HH2 A 12 LYS HGx 1.0 1.8 5.0 956 746 A 36 TRP HH2 A 12 LYS HGy 1.0 1.8 5.0 957 747 A 12 LYS HDy A 23 LEU HDx% 1.0 1.8 5.0 958 747 A 12 LYS HDx A 23 LEU HDx% 1.0 1.8 5.0 959 747 A 23 LEU HDy% A 12 LYS HDx 1.0 1.8 5.0 960 747 A 23 LEU HDy% A 12 LYS HDy 1.0 1.8 5.0 961 748 A 13 LYS H A 13 LYS HGy 1.0 1.8 5.0 962 748 A 13 LYS H A 13 LYS HGx 1.0 1.8 5.0 963 749 A 13 LYS H A 14 ARG HDy 1.0 1.8 5.0 964 749 A 13 LYS H A 14 ARG HDx 1.0 1.8 5.0 965 750 A 13 LYS HA A 13 LYS HGy 1.0 1.8 5.0 966 750 A 13 LYS HA A 13 LYS HGx 1.0 1.8 5.0 967 751 A 13 LYS HBy A 22 TYR HBx 1.0 1.8 6.0 968 751 A 13 LYS HBy A 22 TYR HBy 1.0 1.8 6.0 969 752 A 13 LYS HEy A 13 LYS HGy 1.0 1.8 5.0 970 752 A 13 LYS HEy A 13 LYS HGx 1.0 1.8 5.0 971 753 A 20 VAL HGx% A 13 LYS HGy 1.0 1.8 5.0 972 753 A 20 VAL HGx% A 13 LYS HGx 1.0 1.8 5.0 973 754 A 22 TYR HE% A 13 LYS HGy 1.0 1.8 5.0 974 754 A 22 TYR HE% A 13 LYS HGx 1.0 1.8 5.0 975 755 A 13 LYS HEy A 15 VAL HGy% 1.0 1.8 5.0 976 755 A 13 LYS HEy A 15 VAL HGx% 1.0 1.8 5.0 977 756 A 14 ARG H A 14 ARG HDy 1.0 1.8 5.0 978 756 A 14 ARG H A 14 ARG HDx 1.0 1.8 5.0 979 757 A 14 ARG H A 15 VAL HGy% 1.0 1.8 6.0 980 757 A 14 ARG H A 15 VAL HGx% 1.0 1.8 6.0 981 758 A 14 ARG H A 21 GLU HBx 1.0 1.8 6.0 982 758 A 14 ARG H A 21 GLU HBy 1.0 1.8 6.0 983 759 A 14 ARG HBy A 15 VAL HGy% 1.0 1.8 5.0 984 759 A 14 ARG HBy A 15 VAL HGx% 1.0 1.8 5.0 985 760 A 15 VAL H A 14 ARG HGy 1.0 1.8 5.0 986 760 A 15 VAL H A 14 ARG HGx 1.0 1.8 5.0 987 761 A 21 GLU H A 14 ARG HGy 1.0 1.8 5.0 988 761 A 21 GLU H A 14 ARG HGx 1.0 1.8 5.0 989 762 A 14 ARG HGx A 21 GLU HBx 1.0 1.8 5.0 990 762 A 14 ARG HGy A 21 GLU HBx 1.0 1.8 5.0 991 762 A 21 GLU HBy A 14 ARG HGy 1.0 1.8 5.0 992 762 A 21 GLU HBy A 14 ARG HGx 1.0 1.8 5.0 993 763 A 15 VAL H A 14 ARG HDy 1.0 1.8 6.0 994 763 A 15 VAL H A 14 ARG HDx 1.0 1.8 6.0 995 764 A 15 VAL H A 15 VAL HGy% 1.0 1.8 3.5 996 764 A 15 VAL H A 15 VAL HGx% 1.0 1.8 3.5 997 765 A 15 VAL H A 21 GLU HGy 1.0 1.8 6.0 998 765 A 15 VAL H A 21 GLU HGx 1.0 1.8 6.0 999 766 A 16 ARG H A 15 VAL HGy% 1.0 1.8 3.5 1000 766 A 16 ARG H A 15 VAL HGx% 1.0 1.8 3.5 1001 767 A 16 ARG HA A 15 VAL HGy% 1.0 1.8 5.0 1002 767 A 15 VAL HGx% A 16 ARG HA 1.0 1.8 5.0 1003 768 A 18 GLY H A 15 VAL HGy% 1.0 1.8 5.0 1004 768 A 18 GLY H A 15 VAL HGx% 1.0 1.8 5.0 1005 769 A 15 VAL HGy% A 18 GLY HAy 1.0 1.8 3.5 1006 769 A 15 VAL HGx% A 18 GLY HAy 1.0 1.8 3.5 1007 769 A 18 GLY HAx A 15 VAL HGy% 1.0 1.8 3.5 1008 769 A 15 VAL HGx% A 18 GLY HAx 1.0 1.8 3.5 1009 770 A 19 LYS H A 15 VAL HGy% 1.0 1.8 3.5 1010 770 A 19 LYS H A 15 VAL HGx% 1.0 1.8 3.5 1011 771 A 20 VAL H A 15 VAL HGy% 1.0 1.8 5.0 1012 771 A 20 VAL H A 15 VAL HGx% 1.0 1.8 5.0 1013 772 A 20 VAL HA A 15 VAL HGy% 1.0 1.8 5.0 1014 772 A 20 VAL HA A 15 VAL HGx% 1.0 1.8 5.0 1015 773 A 20 VAL HGy% A 15 VAL HGy% 1.0 1.8 5.0 1016 773 A 20 VAL HGy% A 15 VAL HGx% 1.0 1.8 5.0 1017 774 A 21 GLU H A 15 VAL HGy% 1.0 1.8 5.0 1018 774 A 21 GLU H A 15 VAL HGx% 1.0 1.8 5.0 1019 775 A 16 ARG H A 16 ARG HBy 1.0 1.8 3.5 1020 775 A 16 ARG H A 16 ARG HBx 1.0 1.8 3.5 1021 776 A 16 ARG H A 16 ARG HGy 1.0 1.8 5.0 1022 776 A 16 ARG H A 16 ARG HGx 1.0 1.8 5.0 1023 777 A 16 ARG HA A 16 ARG HGy 1.0 1.8 5.0 1024 777 A 16 ARG HA A 16 ARG HGx 1.0 1.8 5.0 1025 778 A 20 VAL HB A 39 GLU HGx 1.0 1.8 5.0 1026 778 A 20 VAL HB A 39 GLU HGy 1.0 1.8 5.0 1027 779 A 20 VAL HGx% A 21 GLU HGy 1.0 1.8 5.0 1028 779 A 20 VAL HGx% A 21 GLU HGx 1.0 1.8 5.0 1029 780 A 21 GLU H A 21 GLU HBx 1.0 1.8 5.0 1030 780 A 21 GLU H A 21 GLU HBy 1.0 1.8 5.0 1031 781 A 21 GLU H A 21 GLU HGy 1.0 1.8 5.0 1032 781 A 21 GLU H A 21 GLU HGx 1.0 1.8 5.0 1033 782 A 22 TYR H A 21 GLU HBx 1.0 1.8 3.5 1034 782 A 22 TYR H A 21 GLU HBy 1.0 1.8 3.5 1035 783 A 36 TRP HE3 A 21 GLU HBx 1.0 1.8 5.0 1036 783 A 36 TRP HE3 A 21 GLU HBy 1.0 1.8 5.0 1037 784 A 22 TYR H A 21 GLU HGy 1.0 1.8 6.0 1038 784 A 22 TYR H A 21 GLU HGx 1.0 1.8 6.0 1039 785 A 22 TYR H A 22 TYR HBx 1.0 1.8 3.5 1040 785 A 22 TYR H A 22 TYR HBy 1.0 1.8 3.5 1041 786 A 23 LEU H A 22 TYR HBx 1.0 1.8 5.0 1042 786 A 23 LEU H A 22 TYR HBy 1.0 1.8 5.0 1043 787 A 24 VAL HGy% A 22 TYR HBx 1.0 1.8 5.0 1044 787 A 24 VAL HGy% A 22 TYR HBy 1.0 1.8 5.0 1045 788 A 22 TYR HBy A 37 GLU HGx 1.0 1.8 5.0 1046 788 A 22 TYR HBx A 37 GLU HGx 1.0 1.8 5.0 1047 788 A 37 GLU HGy A 22 TYR HBx 1.0 1.8 5.0 1048 788 A 22 TYR HBy A 37 GLU HGy 1.0 1.8 5.0 1049 789 A 42 ILE HD1% A 22 TYR HBx 1.0 1.8 5.0 1050 789 A 42 ILE HD1% A 22 TYR HBy 1.0 1.8 5.0 1051 790 A 22 TYR HD% A 42 ILE HG1x 1.0 1.8 5.0 1052 790 A 22 TYR HD% A 42 ILE HG1y 1.0 1.8 5.0 1053 791 A 22 TYR HD% A 48 VAL HGy% 1.0 1.8 5.0 1054 791 A 22 TYR HD% A 48 VAL HGx% 1.0 1.8 5.0 1055 792 A 22 TYR HE% A 48 VAL HGy% 1.0 1.8 5.0 1056 792 A 22 TYR HE% A 48 VAL HGx% 1.0 1.8 5.0 1057 793 A 23 LEU H A 23 LEU HBx 1.0 1.8 3.5 1058 793 A 23 LEU H A 23 LEU HBy 1.0 1.8 3.5 1059 794 A 23 LEU H A 23 LEU HDx% 1.0 1.8 5.0 1060 794 A 23 LEU H A 23 LEU HDy% 1.0 1.8 5.0 1061 795 A 23 LEU HA A 23 LEU HDx% 1.0 1.8 3.5 1062 795 A 23 LEU HA A 23 LEU HDy% 1.0 1.8 3.5 1063 796 A 23 LEU HG A 34 SER HBy 1.0 1.8 5.0 1064 796 A 23 LEU HG A 34 SER HBx 1.0 1.8 5.0 1065 797 A 24 VAL H A 23 LEU HDx% 1.0 1.8 5.0 1066 797 A 24 VAL H A 23 LEU HDy% 1.0 1.8 5.0 1067 798 A 34 SER HA A 23 LEU HDx% 1.0 1.8 5.0 1068 798 A 34 SER HA A 23 LEU HDy% 1.0 1.8 5.0 1069 799 A 23 LEU HDy% A 34 SER HBy 1.0 1.8 3.5 1070 799 A 23 LEU HDx% A 34 SER HBy 1.0 1.8 3.5 1071 799 A 34 SER HBx A 23 LEU HDx% 1.0 1.8 3.5 1072 799 A 23 LEU HDy% A 34 SER HBx 1.0 1.8 3.5 1073 800 A 35 THR H A 23 LEU HDx% 1.0 1.8 5.0 1074 800 A 35 THR H A 23 LEU HDy% 1.0 1.8 5.0 1075 801 A 35 THR HG2% A 23 LEU HDx% 1.0 1.8 6.0 1076 801 A 35 THR HG2% A 23 LEU HDy% 1.0 1.8 6.0 1077 802 A 36 TRP H A 23 LEU HDx% 1.0 1.8 5.0 1078 802 A 36 TRP H A 23 LEU HDy% 1.0 1.8 5.0 1079 803 A 36 TRP HA A 23 LEU HDx% 1.0 1.8 5.0 1080 803 A 36 TRP HA A 23 LEU HDy% 1.0 1.8 5.0 1081 804 A 36 TRP HD1 A 23 LEU HDx% 1.0 1.8 5.0 1082 804 A 36 TRP HD1 A 23 LEU HDy% 1.0 1.8 5.0 1083 805 A 36 TRP HE1 A 23 LEU HDx% 1.0 1.8 5.0 1084 805 A 36 TRP HE1 A 23 LEU HDy% 1.0 1.8 5.0 1085 806 A 36 TRP HZ2 A 23 LEU HDx% 1.0 1.8 5.0 1086 806 A 36 TRP HZ2 A 23 LEU HDy% 1.0 1.8 5.0 1087 807 A 26 TRP H A 25 LYS HEx 1.0 1.8 6.0 1088 807 A 26 TRP H A 25 LYS HEy 1.0 1.8 6.0 1089 808 A 30 PRO HA A 25 LYS HEx 1.0 1.8 5.0 1090 808 A 30 PRO HA A 25 LYS HEy 1.0 1.8 5.0 1091 809 A 31 PRO HA A 25 LYS HEx 1.0 1.8 5.0 1092 809 A 31 PRO HA A 25 LYS HEy 1.0 1.8 5.0 1093 810 A 25 LYS HEx A 31 PRO HGy 1.0 1.8 5.0 1094 810 A 25 LYS HEy A 31 PRO HGy 1.0 1.8 5.0 1095 810 A 31 PRO HGx A 25 LYS HEx 1.0 1.8 5.0 1096 810 A 25 LYS HEy A 31 PRO HGx 1.0 1.8 5.0 1097 811 A 25 LYS HEx A 31 PRO HD2 1.0 1.8 5.0 1098 811 A 25 LYS HEy A 31 PRO HD2 1.0 1.8 5.0 1099 811 A 31 PRO HD3 A 25 LYS HEx 1.0 1.8 5.0 1100 811 A 31 PRO HD3 A 25 LYS HEy 1.0 1.8 5.0 1101 812 A 26 TRP H A 26 TRP HBy 1.0 1.8 5.0 1102 812 A 26 TRP H A 26 TRP HBx 1.0 1.8 5.0 1103 813 A 26 TRP HE3 A 26 TRP HBy 1.0 1.8 5.0 1104 813 A 26 TRP HE3 A 26 TRP HBx 1.0 1.8 5.0 1105 814 A 29 TRP H A 26 TRP HBy 1.0 1.8 5.0 1106 814 A 29 TRP H A 26 TRP HBx 1.0 1.8 5.0 1107 815 A 29 TRP HBy A 26 TRP HBy 1.0 1.8 5.0 1108 815 A 29 TRP HBy A 26 TRP HBx 1.0 1.8 5.0 1109 816 A 29 TRP HBx A 26 TRP HBy 1.0 1.8 5.0 1110 816 A 29 TRP HBx A 26 TRP HBx 1.0 1.8 5.0 1111 817 A 29 TRP HD1 A 26 TRP HBy 1.0 1.8 5.0 1112 817 A 29 TRP HD1 A 26 TRP HBx 1.0 1.8 5.0 1113 818 A 26 TRP HZ2 A 37 GLU HGx 1.0 1.8 5.0 1114 818 A 26 TRP HZ2 A 37 GLU HGy 1.0 1.8 5.0 1115 819 A 26 TRP HH2 A 37 GLU HGx 1.0 1.8 6.0 1116 819 A 26 TRP HH2 A 37 GLU HGy 1.0 1.8 6.0 1117 820 A 27 LYS HA A 27 LYS HDy 1.0 1.8 5.0 1118 820 A 27 LYS HA A 27 LYS HDx 1.0 1.8 5.0 1119 821 A 29 TRP HE3 A 33 TYR HBx 1.0 1.8 5.0 1120 821 A 29 TRP HE3 A 33 TYR HBy 1.0 1.8 5.0 1121 822 A 30 PRO HA A 31 PRO HGy 1.0 1.8 5.0 1122 822 A 30 PRO HA A 31 PRO HGx 1.0 1.8 5.0 1123 823 A 30 PRO HBy A 32 LYS HGy 1.0 1.8 5.0 1124 823 A 30 PRO HBy A 32 LYS HGx 1.0 1.8 5.0 1125 824 A 30 PRO HG2 A 32 LYS HGy 1.0 1.8 6.0 1126 824 A 30 PRO HG3 A 32 LYS HGy 1.0 1.8 6.0 1127 824 A 32 LYS HGx A 30 PRO HG2 1.0 1.8 6.0 1128 824 A 30 PRO HG3 A 32 LYS HGx 1.0 1.8 6.0 1129 825 A 30 PRO HD2 A 33 TYR HBx 1.0 1.8 5.0 1130 825 A 30 PRO HD3 A 33 TYR HBx 1.0 1.8 5.0 1131 825 A 33 TYR HBy A 30 PRO HD2 1.0 1.8 5.0 1132 825 A 30 PRO HD3 A 33 TYR HBy 1.0 1.8 5.0 1133 826 A 32 LYS HE2 A 32 LYS HGy 1.0 1.8 5.0 1134 826 A 32 LYS HE3 A 32 LYS HGy 1.0 1.8 5.0 1135 826 A 32 LYS HGx A 32 LYS HE2 1.0 1.8 5.0 1136 826 A 32 LYS HE3 A 32 LYS HGx 1.0 1.8 5.0 1137 827 A 33 TYR H A 32 LYS HGy 1.0 1.8 5.0 1138 827 A 33 TYR H A 32 LYS HGx 1.0 1.8 5.0 1139 828 A 33 TYR HD% A 32 LYS HGy 1.0 1.8 5.0 1140 828 A 33 TYR HD% A 32 LYS HGx 1.0 1.8 5.0 1141 829 A 33 TYR HE% A 32 LYS HGy 1.0 1.8 5.0 1142 829 A 33 TYR HE% A 32 LYS HGx 1.0 1.8 5.0 1143 830 A 33 TYR H A 33 TYR HBx 1.0 1.8 3.5 1144 830 A 33 TYR H A 33 TYR HBy 1.0 1.8 3.5 1145 831 A 33 TYR H A 34 SER HBy 1.0 1.8 5.0 1146 831 A 33 TYR H A 34 SER HBx 1.0 1.8 5.0 1147 832 A 34 SER H A 33 TYR HBx 1.0 1.8 5.0 1148 832 A 34 SER H A 33 TYR HBy 1.0 1.8 5.0 1149 833 A 34 SER H A 34 SER HBy 1.0 1.8 3.5 1150 833 A 34 SER H A 34 SER HBx 1.0 1.8 3.5 1151 834 A 35 THR H A 34 SER HBy 1.0 1.8 3.5 1152 834 A 35 THR H A 34 SER HBx 1.0 1.8 3.5 1153 835 A 35 THR HG2% A 34 SER HBy 1.0 1.8 6.0 1154 835 A 35 THR HG2% A 34 SER HBx 1.0 1.8 6.0 1155 836 A 36 TRP H A 36 TRP HBy 1.0 1.8 3.5 1156 836 A 36 TRP H A 36 TRP HBx 1.0 1.8 3.5 1157 837 A 36 TRP HE3 A 36 TRP HBy 1.0 1.8 5.0 1158 837 A 36 TRP HE3 A 36 TRP HBx 1.0 1.8 5.0 1159 838 A 36 TRP HE1 A 36 TRP HBy 1.0 1.8 5.0 1160 838 A 36 TRP HE1 A 36 TRP HBx 1.0 1.8 5.0 1161 839 A 42 ILE HD1% A 37 GLU HGx 1.0 1.8 5.0 1162 839 A 42 ILE HD1% A 37 GLU HGy 1.0 1.8 5.0 1163 840 A 41 HIS H A 38 PRO HGy 1.0 1.8 6.0 1164 840 A 41 HIS H A 38 PRO HGx 1.0 1.8 6.0 1165 841 A 39 GLU HA A 39 GLU HGx 1.0 1.8 5.0 1166 841 A 39 GLU HA A 39 GLU HGy 1.0 1.8 5.0 1167 842 A 39 GLU HA A 42 ILE HG1x 1.0 1.8 5.0 1168 842 A 39 GLU HA A 42 ILE HG1y 1.0 1.8 5.0 1169 843 A 39 GLU HB2 A 48 VAL HGy% 1.0 1.8 5.0 1170 843 A 39 GLU HB3 A 48 VAL HGy% 1.0 1.8 5.0 1171 843 A 48 VAL HGx% A 39 GLU HB2 1.0 1.8 5.0 1172 843 A 39 GLU HB3 A 48 VAL HGx% 1.0 1.8 5.0 1173 844 A 40 GLU H A 39 GLU HGx 1.0 1.8 5.0 1174 844 A 40 GLU H A 39 GLU HGy 1.0 1.8 5.0 1175 845 A 40 GLU H A 40 GLU HGx 1.0 1.8 5.0 1176 845 A 40 GLU H A 40 GLU HGy 1.0 1.8 5.0 1177 846 A 41 HIS H A 40 GLU HGx 1.0 1.8 6.0 1178 846 A 41 HIS H A 40 GLU HGy 1.0 1.8 6.0 1179 847 A 41 HIS H A 41 HIS HBy 1.0 1.8 5.0 1180 847 A 41 HIS H A 41 HIS HBx 1.0 1.8 5.0 1181 848 A 41 HIS H A 42 ILE HG1x 1.0 1.8 6.0 1182 848 A 41 HIS H A 42 ILE HG1y 1.0 1.8 6.0 1183 849 A 42 ILE H A 41 HIS HBy 1.0 1.8 5.0 1184 849 A 42 ILE H A 41 HIS HBx 1.0 1.8 5.0 1185 850 A 42 ILE HD1% A 41 HIS HBy 1.0 1.8 6.0 1186 850 A 42 ILE HD1% A 41 HIS HBx 1.0 1.8 6.0 1187 851 A 42 ILE H A 42 ILE HG1x 1.0 1.8 3.5 1188 851 A 42 ILE H A 42 ILE HG1y 1.0 1.8 3.5 1189 852 A 42 ILE HB A 48 VAL HGy% 1.0 1.8 5.0 1190 852 A 42 ILE HB A 48 VAL HGx% 1.0 1.8 5.0 1191 853 A 42 ILE HG2% A 43 LEU HBx 1.0 1.8 5.0 1192 853 A 42 ILE HG2% A 43 LEU HBy 1.0 1.8 5.0 1193 854 A 42 ILE HG2% A 44 ASP HBx 1.0 1.8 5.0 1194 854 A 42 ILE HG2% A 44 ASP HBy 1.0 1.8 5.0 1195 855 A 42 ILE HG2% A 47 LEU HBx 1.0 1.8 3.5 1196 855 A 42 ILE HG2% A 47 LEU HBy 1.0 1.8 3.5 1197 856 A 42 ILE HG1y A 48 VAL HGy% 1.0 1.8 5.0 1198 856 A 42 ILE HG1x A 48 VAL HGy% 1.0 1.8 5.0 1199 856 A 48 VAL HGx% A 42 ILE HG1x 1.0 1.8 5.0 1200 856 A 42 ILE HG1y A 48 VAL HGx% 1.0 1.8 5.0 1201 857 A 42 ILE HD1% A 47 LEU HDx% 1.0 1.8 5.0 1202 857 A 42 ILE HD1% A 47 LEU HDy% 1.0 1.8 5.0 1203 858 A 43 LEU H A 43 LEU HBx 1.0 1.8 5.0 1204 858 A 43 LEU H A 43 LEU HBy 1.0 1.8 5.0 1205 859 A 43 LEU H A 43 LEU HDx% 1.0 1.8 5.0 1206 859 A 43 LEU H A 43 LEU HDy% 1.0 1.8 5.0 1207 860 A 43 LEU HA A 43 LEU HDx% 1.0 1.8 3.5 1208 860 A 43 LEU HA A 43 LEU HDy% 1.0 1.8 3.5 1209 861 A 43 LEU HBx A 43 LEU HDx% 1.0 1.8 3.5 1210 861 A 43 LEU HBy A 43 LEU HDx% 1.0 1.8 3.5 1211 861 A 43 LEU HDy% A 43 LEU HBx 1.0 1.8 3.5 1212 861 A 43 LEU HBy A 43 LEU HDy% 1.0 1.8 3.5 1213 862 B 24 ALA HB% A 43 LEU HBx 1.0 1.8 5.0 1214 862 A 43 LEU HBy B 24 ALA HB% 1.0 1.8 5.0 1215 863 B 25 ALA HB% A 43 LEU HBx 1.0 1.8 5.0 1216 863 B 25 ALA HB% A 43 LEU HBy 1.0 1.8 5.0 1217 864 A 44 ASP H A 43 LEU HDx% 1.0 1.8 5.0 1218 864 A 44 ASP H A 43 LEU HDy% 1.0 1.8 5.0 1219 865 B 25 ALA HA A 43 LEU HDx% 1.0 1.8 5.0 1220 865 B 25 ALA HA A 43 LEU HDy% 1.0 1.8 5.0 1221 866 A 44 ASP H A 45 PRO HDy 1.0 1.8 6.0 1222 866 A 44 ASP H A 45 PRO HDx 1.0 1.8 6.0 1223 867 A 44 ASP H A 47 LEU HDx% 1.0 1.8 5.0 1224 867 A 44 ASP H A 47 LEU HDy% 1.0 1.8 5.0 1225 868 A 47 LEU H A 44 ASP HBx 1.0 1.8 5.0 1226 868 A 47 LEU H A 44 ASP HBy 1.0 1.8 5.0 1227 869 A 44 ASP HBy A 47 LEU HDx% 1.0 1.8 3.5 1228 869 A 44 ASP HBx A 47 LEU HDx% 1.0 1.8 3.5 1229 869 A 47 LEU HDy% A 44 ASP HBx 1.0 1.8 3.5 1230 869 A 47 LEU HDy% A 44 ASP HBy 1.0 1.8 3.5 1231 870 B 24 ALA HA A 44 ASP HBx 1.0 1.8 6.0 1232 870 B 24 ALA HA A 44 ASP HBy 1.0 1.8 6.0 1233 871 B 25 ALA HB% A 44 ASP HBx 1.0 1.8 5.0 1234 871 B 25 ALA HB% A 44 ASP HBy 1.0 1.8 5.0 1235 872 A 45 PRO HA A 48 VAL HGy% 1.0 1.8 5.0 1236 872 A 45 PRO HA A 48 VAL HGx% 1.0 1.8 5.0 1237 873 A 46 ARG HA A 45 PRO HBy 1.0 1.8 6.0 1238 873 A 46 ARG HA A 45 PRO HBx 1.0 1.8 6.0 1239 874 A 46 ARG H A 45 PRO HDy 1.0 1.8 5.0 1240 874 A 46 ARG H A 45 PRO HDx 1.0 1.8 5.0 1241 875 A 46 ARG H A 46 ARG HBy 1.0 1.8 3.5 1242 875 A 46 ARG H A 46 ARG HBx 1.0 1.8 3.5 1243 876 A 46 ARG H A 46 ARG HDx 1.0 1.8 5.0 1244 876 A 46 ARG H A 46 ARG HDy 1.0 1.8 5.0 1245 877 A 46 ARG HA A 49 MET HBx 1.0 1.8 3.5 1246 877 A 46 ARG HA A 49 MET HBy 1.0 1.8 3.5 1247 878 A 46 ARG HA A 49 MET HGx 1.0 1.8 5.0 1248 878 A 46 ARG HA A 49 MET HGy 1.0 1.8 5.0 1249 879 A 46 ARG HBy A 46 ARG HDx 1.0 1.8 3.5 1250 879 A 46 ARG HBx A 46 ARG HDx 1.0 1.8 3.5 1251 879 A 46 ARG HDy A 46 ARG HBy 1.0 1.8 3.5 1252 879 A 46 ARG HBx A 46 ARG HDy 1.0 1.8 3.5 1253 880 A 47 LEU H A 46 ARG HBy 1.0 1.8 5.0 1254 880 A 47 LEU H A 46 ARG HBx 1.0 1.8 5.0 1255 881 A 47 LEU H A 47 LEU HDx% 1.0 1.8 5.0 1256 881 A 47 LEU H A 47 LEU HDy% 1.0 1.8 5.0 1257 882 A 47 LEU H A 48 VAL HGy% 1.0 1.8 5.0 1258 882 A 47 LEU H A 48 VAL HGx% 1.0 1.8 5.0 1259 883 A 47 LEU HA A 47 LEU HDx% 1.0 1.8 3.5 1260 883 A 47 LEU HA A 47 LEU HDy% 1.0 1.8 3.5 1261 884 A 47 LEU HBy A 47 LEU HDx% 1.0 1.8 3.5 1262 884 A 47 LEU HBx A 47 LEU HDx% 1.0 1.8 3.5 1263 884 A 47 LEU HDy% A 47 LEU HBx 1.0 1.8 3.5 1264 884 A 47 LEU HDy% A 47 LEU HBy 1.0 1.8 3.5 1265 885 A 48 VAL H A 47 LEU HBx 1.0 1.8 5.0 1266 885 A 48 VAL H A 47 LEU HBy 1.0 1.8 5.0 1267 886 A 47 LEU HBy A 48 VAL HGy% 1.0 1.8 5.0 1268 886 A 47 LEU HBx A 48 VAL HGy% 1.0 1.8 5.0 1269 886 A 48 VAL HGx% A 47 LEU HBx 1.0 1.8 5.0 1270 886 A 47 LEU HBy A 48 VAL HGx% 1.0 1.8 5.0 1271 887 B 23 LYS HA A 47 LEU HDx% 1.0 1.8 5.0 1272 887 B 23 LYS HA A 47 LEU HDy% 1.0 1.8 5.0 1273 888 A 47 LEU HDy% B 23 LYS HBx 1.0 1.8 3.5 1274 888 B 23 LYS HBy A 47 LEU HDx% 1.0 1.8 3.5 1275 888 A 47 LEU HDy% B 23 LYS HBy 1.0 1.8 3.5 1276 888 A 47 LEU HDx% B 23 LYS HBx 1.0 1.8 3.5 1277 889 A 47 LEU HDx% B 23 LYS HBx 1.0 1.8 6.0 1278 890 A 47 LEU HDy% B 23 LYS HBx 1.0 1.8 6.0 1279 891 A 47 LEU HDx% B 23 LYS HG2 1.0 1.8 3.5 1280 891 A 47 LEU HDy% B 23 LYS HG2 1.0 1.8 3.5 1281 891 B 23 LYS HGy A 47 LEU HDx% 1.0 1.8 3.5 1282 891 A 47 LEU HDy% B 23 LYS HGy 1.0 1.8 3.5 1283 892 A 47 LEU HDx% B 23 LYS HD2 1.0 1.8 5.0 1284 892 A 47 LEU HDy% B 23 LYS HD2 1.0 1.8 5.0 1285 892 B 23 LYS HD3 A 47 LEU HDx% 1.0 1.8 5.0 1286 892 A 47 LEU HDy% B 23 LYS HD3 1.0 1.8 5.0 1287 893 B 24 ALA HA A 47 LEU HDx% 1.0 1.8 5.0 1288 893 B 24 ALA HA A 47 LEU HDy% 1.0 1.8 5.0 1289 894 B 25 ALA HA A 47 LEU HDx% 1.0 1.8 5.0 1290 894 B 25 ALA HA A 47 LEU HDy% 1.0 1.8 5.0 1291 895 B 25 ALA HB% A 47 LEU HDx% 1.0 1.8 3.5 1292 895 B 25 ALA HB% A 47 LEU HDy% 1.0 1.8 3.5 1293 896 A 48 VAL H A 48 VAL HGy% 1.0 1.8 3.5 1294 896 A 48 VAL H A 48 VAL HGx% 1.0 1.8 3.5 1295 897 A 49 MET HA A 48 VAL HGy% 1.0 1.8 5.0 1296 897 A 49 MET HA A 48 VAL HGx% 1.0 1.8 5.0 1297 898 A 51 TYR HE% A 48 VAL HGy% 1.0 1.8 5.0 1298 898 A 51 TYR HE% A 48 VAL HGx% 1.0 1.8 5.0 1299 899 A 52 GLU H A 48 VAL HGy% 1.0 1.8 5.0 1300 899 A 52 GLU H A 48 VAL HGx% 1.0 1.8 5.0 1301 900 A 48 VAL HGy% A 52 GLU HGx 1.0 1.8 5.0 1302 900 A 48 VAL HGx% A 52 GLU HGx 1.0 1.8 5.0 1303 900 A 52 GLU HGy A 48 VAL HGy% 1.0 1.8 5.0 1304 900 A 48 VAL HGx% A 52 GLU HGy 1.0 1.8 5.0 1305 901 A 49 MET H A 49 MET HBx 1.0 1.8 3.5 1306 901 A 49 MET H A 49 MET HBy 1.0 1.8 3.5 1307 902 A 49 MET H A 49 MET HGx 1.0 1.8 5.0 1308 902 A 49 MET H A 49 MET HGy 1.0 1.8 5.0 1309 903 A 49 MET HA A 49 MET HGx 1.0 1.8 5.0 1310 903 A 49 MET HA A 49 MET HGy 1.0 1.8 5.0 1311 904 A 50 ALA HA A 53 GLU HGx 1.0 1.8 5.0 1312 904 A 50 ALA HA A 53 GLU HGy 1.0 1.8 5.0 1313 905 A 51 TYR HA A 54 LYS HGy 1.0 1.8 5.0 1314 905 A 51 TYR HA A 54 LYS HGx 1.0 1.8 5.0 1315 906 A 51 TYR HD% A 52 GLU HGx 1.0 1.8 5.0 1316 906 A 51 TYR HD% A 52 GLU HGy 1.0 1.8 5.0 1317 907 A 52 GLU HA A 52 GLU HGx 1.0 1.8 3.5 1318 907 A 52 GLU HA A 52 GLU HGy 1.0 1.8 3.5 1319 908 A 53 GLU H A 53 GLU HGx 1.0 1.8 3.5 1320 908 A 53 GLU H A 53 GLU HGy 1.0 1.8 3.5 1321 909 A 53 GLU HA A 53 GLU HGx 1.0 1.8 3.5 1322 909 A 53 GLU HA A 53 GLU HGy 1.0 1.8 3.5 1323 910 A 54 LYS H A 54 LYS HBx 1.0 1.8 3.5 1324 910 A 54 LYS H A 54 LYS HBy 1.0 1.8 3.5 1325 911 A 54 LYS H A 54 LYS HGy 1.0 1.8 5.0 1326 911 A 54 LYS H A 54 LYS HGx 1.0 1.8 5.0 1327 912 A 54 LYS HE3 A 54 LYS HGy 1.0 1.8 5.0 1328 912 A 54 LYS HE2 A 54 LYS HGy 1.0 1.8 5.0 1329 912 A 54 LYS HGx A 54 LYS HE2 1.0 1.8 5.0 1330 912 A 54 LYS HE3 A 54 LYS HGx 1.0 1.8 5.0 1331 913 A 55 GLU HBx A 55 GLU HGx 1.0 1.8 2.7 1332 913 A 55 GLU HGy A 55 GLU HBy 1.0 1.8 2.7 1333 913 A 55 GLU HBx A 55 GLU HGy 1.0 1.8 2.7 1334 913 A 55 GLU HBy A 55 GLU HGx 1.0 1.8 2.7 1335 914 A 56 GLU H A 55 GLU HBy 1.0 1.8 5.0 1336 914 A 56 GLU H A 55 GLU HBx 1.0 1.8 5.0 1337 915 A 56 GLU H A 56 GLU HBy 1.0 1.8 3.5 1338 915 A 56 GLU H A 56 GLU HBx 1.0 1.8 3.5 1339 916 A 56 GLU HBy A 56 GLU HG2 1.0 1.8 2.7 1340 916 A 56 GLU HBx A 56 GLU HG2 1.0 1.8 2.7 1341 916 A 56 GLU HG3 A 56 GLU HBy 1.0 1.8 2.7 1342 916 A 56 GLU HG3 A 56 GLU HBx 1.0 1.8 2.7 1343 917 B 23 LYS HA A 44 ASP HBx 1.0 1.8 3.5 1344 917 B 23 LYS HA A 44 ASP HBy 1.0 1.8 3.5 1345 918 B 24 ALA HB% A 44 ASP HBx 1.0 1.8 4.0 1346 918 A 44 ASP HBy B 24 ALA HB% 1.0 1.8 4.0 1347 919 A 6 ALA HB% B 22 THR HA 1.0 1.8 5.0 1348 920 A 6 ALA HB% B 24 ALA HA 1.0 1.8 5.0 1349 921 A 46 ARG H A 44 ASP HBx 1.0 1.8 5.0 1350 922 A 46 ARG H A 44 ASP HBy 1.0 1.8 5.0 1351 923 A 44 ASP HA A 46 ARG H 1.0 1.8 5.0 1352 924 A 44 ASP HBy B 23 LYS HG2 1.0 1.8 5.0 1353 925 A 44 ASP HBy B 23 LYS HE2 1.0 1.8 5.0 1354 926 B 23 LYS HA A 44 ASP HBy 1.0 1.8 5.0 1355 927 B 23 LYS HA A 44 ASP HBx 1.0 1.8 5.0 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 14084.507 2 1H 11160.714 3 1H 11198.208 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 2594.707 2 1H 11160.714 3 1H 11160.714 stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 6038.647 2 1H 11160.714 3 1H 11198.208 stop_ save_ save_spectral_peak_list_4 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_4 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3000.000 2 1H 5499.794 3 1H 3266.500 stop_ save_ save_spectral_peak_list_5 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_5 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3000.000 2 1H 5499.794 3 1H 2761.144 stop_ save_