data_nef_c16913_2kxg save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 PRO middle . false 3 A 3 GLY middle . false 4 A 4 PRO middle . false 5 A 5 ALA middle . . 6 A 6 ILE middle . . 7 A 7 GLY middle . false 8 A 8 GLU middle . . 9 A 9 VAL middle . . 10 A 10 ILE middle . . 11 A 11 GLY middle . false 12 A 12 ILE middle . . 13 A 13 SER middle . . 14 A 14 VAL middle . . 15 A 15 ASN middle . . 16 A 16 ASP middle . . 17 A 17 PRO middle . false 18 A 18 ARG middle . . 19 A 19 VAL middle . . 20 A 20 LYS middle . . 21 A 21 GLU middle . . 22 A 22 ILE middle . . 23 A 23 ALA middle . . 24 A 24 GLU middle . . 25 A 25 PHE middle . . 26 A 26 ALA middle . . 27 A 27 LEU middle . . 28 A 28 LYS middle . . 29 A 29 GLN middle . . 30 A 30 HIS middle . . 31 A 31 ALA middle . . 32 A 32 GLU middle . . 33 A 33 GLN middle . . 34 A 34 ASN middle . . 35 A 35 LEU middle . . 36 A 36 ILE middle . . 37 A 37 LEU middle . . 38 A 38 ALA middle . . 39 A 39 GLY middle . false 40 A 40 VAL middle . . 41 A 41 ASP middle . . 42 A 42 ALA middle . . 43 A 43 GLY middle . false 44 A 44 GLN middle . . 45 A 45 ILE middle . . 46 A 46 ILE middle . . 47 A 47 LYS middle . . 48 A 48 GLY middle . false 49 A 49 ILE middle . . 50 A 50 PRO middle . false 51 A 51 HIS middle . . 52 A 52 TRP middle . . 53 A 53 ASP middle . . 54 A 54 ASN middle . . 55 A 55 TYR middle . . 56 A 56 TYR middle . . 57 A 57 ASN middle . . 58 A 58 LEU middle . . 59 A 59 ILE middle . . 60 A 60 LEU middle . . 61 A 61 SER middle . . 62 A 62 ALA middle . . 63 A 63 LYS middle . . 64 A 64 HIS middle . . 65 A 65 SER middle . . 66 A 66 PRO middle . false 67 A 67 HIS middle . . 68 A 68 GLU middle . . 69 A 69 PHE middle . . 70 A 70 SER middle . . 71 A 71 LYS middle . . 72 A 72 PHE middle . . 73 A 73 TYR middle . . 74 A 74 ASN middle . . 75 A 75 VAL middle . . 76 A 76 VAL middle . . 77 A 77 VAL middle . . 78 A 78 LEU middle . . 79 A 79 GLU middle . . 80 A 80 LYS middle . . 81 A 81 ALA middle . . 82 A 82 SER middle . . 83 A 83 ASP middle . . 84 A 84 ASN middle . . 85 A 85 SER middle . . 86 A 86 LEU middle . . 87 A 87 LYS middle . . 88 A 88 LEU middle . . 89 A 89 VAL middle . . 90 A 90 ALA middle . . 91 A 91 PHE middle . . 92 A 92 VAL middle . . 93 A 93 PRO middle . false 94 A 94 LEU middle . . 95 A 95 PHE end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY H1 H 1 8.29 0.02 A 1 GLY HAx H 1 4.16 0.02 A 1 GLY HAy H 1 4.16 0.02 A 1 GLY CA C 13 45.07 0.2 A 2 PRO HA H 1 4.59 0.02 A 2 PRO HBx H 1 2.01 0.02 A 2 PRO HBy H 1 2.25 0.02 A 2 PRO HDx H 1 3.62 0.02 A 2 PRO HDy H 1 3.62 0.02 A 2 PRO HGx H 1 1.98 0.02 A 2 PRO HGy H 1 1.98 0.02 A 2 PRO C C 13 177.15 0.2 A 2 PRO CA C 13 63.21 0.2 A 2 PRO CB C 13 34.78 0.2 A 2 PRO CD C 13 49.96 0.2 A 2 PRO CG C 13 27.13 0.2 A 3 GLY H H 1 8.35 0.02 A 3 GLY HAx H 1 4.12 0.02 A 3 GLY HAy H 1 4.12 0.02 A 3 GLY CA C 13 44.8 0.2 A 4 PRO HA H 1 4.42 0.02 A 4 PRO HBx H 1 1.89 0.02 A 4 PRO HBy H 1 2.22 0.02 A 4 PRO HDx H 1 3.55 0.02 A 4 PRO HDy H 1 3.55 0.02 A 4 PRO HGx H 1 1.98 0.02 A 4 PRO HGy H 1 1.98 0.02 A 4 PRO C C 13 176.84 0.2 A 4 PRO CA C 13 63.51 0.2 A 4 PRO CB C 13 32.37 0.2 A 4 PRO CD C 13 50.03 0.2 A 4 PRO CG C 13 27.2 0.2 A 5 ALA H H 1 8.19 0.02 A 5 ALA HA H 1 4.4 0.02 A 5 ALA HB% H 1 1.39 0.02 A 5 ALA C C 13 177.77 0.2 A 5 ALA CA C 13 52.76 0.2 A 5 ALA CB C 13 19.45 0.2 A 6 ILE H H 1 7.99 0.02 A 6 ILE HA H 1 4.31 0.02 A 6 ILE HB H 1 1.88 0.02 A 6 ILE HD1% H 1 0.71 0.02 A 6 ILE HG1x H 1 1.12 0.02 A 6 ILE HG1y H 1 1.35 0.02 A 6 ILE HG2% H 1 0.77 0.02 A 6 ILE C C 13 176.33 0.2 A 6 ILE CA C 13 61.57 0.2 A 6 ILE CB C 13 39.27 0.2 A 6 ILE CD1 C 13 13.79 0.2 A 6 ILE CG1 C 13 27.02 0.2 A 6 ILE CG2 C 13 17.82 0.2 A 7 GLY H H 1 8.02 0.02 A 7 GLY HAx H 1 4.31 0.02 A 7 GLY HAy H 1 4.31 0.02 A 7 GLY C C 13 172.83 0.2 A 7 GLY CA C 13 46.01 0.2 A 8 GLU H H 1 8.86 0.02 A 8 GLU HA H 1 4.7 0.02 A 8 GLU HBx H 1 1.9 0.02 A 8 GLU HBy H 1 2.1 0.02 A 8 GLU HGx H 1 2.33 0.02 A 8 GLU HGy H 1 2.44 0.02 A 8 GLU C C 13 173.33 0.2 A 8 GLU CA C 13 54.87 0.2 A 8 GLU CB C 13 31.84 0.2 A 8 GLU CG C 13 35.06 0.2 A 9 VAL H H 1 8.03 0.02 A 9 VAL HA H 1 4.76 0.02 A 9 VAL HB H 1 1.87 0.02 A 9 VAL HG1% H 1 0.46 0.02 A 9 VAL HG2% H 1 0.58 0.02 A 9 VAL C C 13 175.5 0.2 A 9 VAL CA C 13 61.5 0.2 A 9 VAL CB C 13 33.5 0.2 A 9 VAL CGy C 13 22.36 0.2 A 9 VAL CGx C 13 21.71 0.2 A 10 ILE H H 1 9.1 0.02 A 10 ILE HA H 1 4.56 0.02 A 10 ILE HB H 1 1.74 0.02 A 10 ILE HD1% H 1 0.77 0.02 A 10 ILE HG12 H 1 1.36 0.02 A 10 ILE HG13 H 1 1.36 0.02 A 10 ILE HG2% H 1 0.92 0.02 A 10 ILE C C 13 175.73 0.2 A 10 ILE CA C 13 59.54 0.2 A 10 ILE CB C 13 42.1 0.2 A 10 ILE CD1 C 13 13.66 0.2 A 10 ILE CG1 C 13 26.84 0.2 A 10 ILE CG2 C 13 17.59 0.2 A 11 GLY H H 1 8.64 0.02 A 11 GLY HA2 H 1 3.89 0.02 A 11 GLY HAx H 1 3.89 0.02 A 11 GLY HAy H 1 4.45 0.02 A 11 GLY C C 13 174.45 0.2 A 11 GLY CA C 13 45.91 0.2 A 12 ILE H H 1 7.44 0.02 A 12 ILE HA H 1 4.5 0.02 A 12 ILE HB H 1 1.87 0.02 A 12 ILE HD1% H 1 0.59 0.02 A 12 ILE HG12 H 1 1.12 0.02 A 12 ILE HG13 H 1 1.12 0.02 A 12 ILE HG2% H 1 0.76 0.02 A 12 ILE C C 13 176.36 0.2 A 12 ILE CA C 13 60.01 0.2 A 12 ILE CB C 13 40.72 0.2 A 12 ILE CD1 C 13 15.25 0.2 A 12 ILE CG1 C 13 26.33 0.2 A 12 ILE CG2 C 13 19.47 0.2 A 13 SER H H 1 8.48 0.02 A 13 SER HA H 1 4.88 0.02 A 13 SER HBx H 1 3.94 0.02 A 13 SER HBy H 1 3.94 0.02 A 13 SER C C 13 176.73 0.2 A 13 SER CA C 13 56.79 0.2 A 13 SER CB C 13 63.94 0.2 A 14 VAL H H 1 8.35 0.02 A 14 VAL HA H 1 3.74 0.02 A 14 VAL HB H 1 2.35 0.02 A 14 VAL HG1% H 1 0.83 0.02 A 14 VAL HG2% H 1 0.91 0.02 A 14 VAL C C 13 175.48 0.2 A 14 VAL CA C 13 64.76 0.2 A 14 VAL CB C 13 30.95 0.2 A 14 VAL CGy C 13 21.69 0.2 A 14 VAL CGx C 13 18.25 0.2 A 15 ASN H H 1 7.88 0.02 A 15 ASN HA H 1 4.82 0.02 A 15 ASN HBx H 1 2.65 0.02 A 15 ASN HBy H 1 2.94 0.02 A 15 ASN C C 13 175.19 0.2 A 15 ASN CA C 13 52.67 0.2 A 15 ASN CB C 13 39.22 0.2 A 16 ASP H H 1 7.39 0.02 A 16 ASP HA H 1 4.8 0.02 A 16 ASP HBx H 1 2.89 0.02 A 16 ASP HBy H 1 2.98 0.02 A 16 ASP CA C 13 52.35 0.2 A 16 ASP CB C 13 42.49 0.2 A 17 PRO HA H 1 4.25 0.02 A 17 PRO HBx H 1 2 0.02 A 17 PRO HBy H 1 2.42 0.02 A 17 PRO HDx H 1 4.05 0.02 A 17 PRO HDy H 1 4.08 0.02 A 17 PRO HGx H 1 2.12 0.02 A 17 PRO HGy H 1 2.12 0.02 A 17 PRO C C 13 175.48 0.2 A 17 PRO CA C 13 65.61 0.2 A 17 PRO CB C 13 32.5 0.2 A 17 PRO CD C 13 51.59 0.2 A 17 PRO CG C 13 27.62 0.2 A 18 ARG H H 1 8.44 0.02 A 18 ARG HA H 1 4.06 0.02 A 18 ARG HBx H 1 1.93 0.02 A 18 ARG HBy H 1 1.93 0.02 A 18 ARG HDx H 1 3.15 0.02 A 18 ARG HDy H 1 3.27 0.02 A 18 ARG HGx H 1 1.55 0.02 A 18 ARG HGy H 1 1.73 0.02 A 18 ARG C C 13 178.99 0.2 A 18 ARG CA C 13 58.34 0.2 A 18 ARG CB C 13 29.84 0.2 A 18 ARG CD C 13 43.25 0.2 A 18 ARG CG C 13 26.77 0.2 A 19 VAL H H 1 7.39 0.02 A 19 VAL HA H 1 3.34 0.02 A 19 VAL HB H 1 2.39 0.02 A 19 VAL HG1% H 1 0.97 0.02 A 19 VAL HG2% H 1 1.19 0.02 A 19 VAL C C 13 177.63 0.2 A 19 VAL CA C 13 66.81 0.2 A 19 VAL CB C 13 31.67 0.2 A 19 VAL CGx C 13 22.87 0.2 A 19 VAL CGy C 13 23.74 0.2 A 20 LYS H H 1 7.49 0.02 A 20 LYS HA H 1 3.72 0.02 A 20 LYS HBx H 1 1.88 0.02 A 20 LYS HBy H 1 1.88 0.02 A 20 LYS HDx H 1 1.69 0.02 A 20 LYS HDy H 1 1.69 0.02 A 20 LYS HEx H 1 2.93 0.02 A 20 LYS HEy H 1 2.93 0.02 A 20 LYS HGx H 1 1.3 0.02 A 20 LYS HGy H 1 1.42 0.02 A 20 LYS C C 13 178.36 0.2 A 20 LYS CA C 13 60.74 0.2 A 20 LYS CB C 13 32.03 0.2 A 20 LYS CD C 13 29.63 0.2 A 20 LYS CE C 13 42.15 0.2 A 20 LYS CG C 13 25.7 0.2 A 21 GLU H H 1 7.61 0.02 A 21 GLU HA H 1 4.04 0.02 A 21 GLU HBx H 1 2.09 0.02 A 21 GLU HBy H 1 2.23 0.02 A 21 GLU HGx H 1 2.42 0.02 A 21 GLU HGy H 1 2.6 0.02 A 21 GLU CA C 13 58.82 0.2 A 21 GLU CB C 13 28.14 0.2 A 21 GLU CG C 13 33.53 0.2 A 22 ILE H H 1 7.94 0.02 A 22 ILE HA H 1 3.49 0.02 A 22 ILE HB H 1 1.71 0.02 A 22 ILE HD1% H 1 -0.15 0.02 A 22 ILE HG1x H 1 0.81 0.02 A 22 ILE HG1y H 1 0.91 0.02 A 22 ILE HG2% H 1 0.55 0.02 A 22 ILE CA C 13 64.95 0.2 A 22 ILE CB C 13 36.83 0.2 A 22 ILE CD1 C 13 11.27 0.2 A 22 ILE CG1 C 13 28.91 0.2 A 22 ILE CG2 C 13 17.45 0.2 A 23 ALA H H 1 8.21 0.02 A 23 ALA HA H 1 3.77 0.02 A 23 ALA HB% H 1 1.42 0.02 A 23 ALA CA C 13 55.77 0.2 A 23 ALA CB C 13 20.23 0.2 A 24 GLU H H 1 8.31 0.02 A 24 GLU HA H 1 4.01 0.02 A 24 GLU HBx H 1 2.08 0.02 A 24 GLU HBy H 1 2.19 0.02 A 24 GLU HGx H 1 2.49 0.02 A 24 GLU HGy H 1 2.63 0.02 A 24 GLU CA C 13 59.25 0.2 A 24 GLU CB C 13 28.18 0.2 A 24 GLU CG C 13 34.25 0.2 A 25 PHE H H 1 8.16 0.02 A 25 PHE HA H 1 4.14 0.02 A 25 PHE HBx H 1 3.21 0.02 A 25 PHE HBy H 1 3.34 0.02 A 25 PHE HDx H 1 7.13 0.02 A 25 PHE HDy H 1 7.13 0.02 A 25 PHE HEx H 1 6.82 0.02 A 25 PHE HEy H 1 6.82 0.02 A 25 PHE CA C 13 61.51 0.2 A 25 PHE CB C 13 38.68 0.2 A 25 PHE CDx C 13 132.32 0.2 A 25 PHE CDy C 13 132.32 0.2 A 25 PHE CEx C 13 131.63 0.2 A 25 PHE CEy C 13 131.63 0.2 A 26 ALA H H 1 8.11 0.02 A 26 ALA HA H 1 3.63 0.02 A 26 ALA HB% H 1 1.5 0.02 A 26 ALA CA C 13 55.51 0.2 A 26 ALA CB C 13 19.04 0.2 A 27 LEU H H 1 7.51 0.02 A 27 LEU HA H 1 3.82 0.02 A 27 LEU HBx H 1 1.46 0.02 A 27 LEU HBy H 1 1.79 0.02 A 27 LEU HD1% H 1 0.54 0.02 A 27 LEU HD2% H 1 0.69 0.02 A 27 LEU HG H 1 1.83 0.02 A 27 LEU CA C 13 57.98 0.2 A 27 LEU CB C 13 41.17 0.2 A 27 LEU CDx C 13 23.2 0.2 A 27 LEU CDy C 13 26.72 0.2 A 27 LEU CG C 13 26.52 0.2 A 28 LYS H H 1 7.98 0.02 A 28 LYS HA H 1 4.05 0.02 A 28 LYS HBx H 1 1.8 0.02 A 28 LYS HBy H 1 1.8 0.02 A 28 LYS HDx H 1 1.66 0.02 A 28 LYS HDy H 1 1.66 0.02 A 28 LYS HEx H 1 2.97 0.02 A 28 LYS HEy H 1 2.97 0.02 A 28 LYS HGx H 1 1.4 0.02 A 28 LYS HGy H 1 1.47 0.02 A 28 LYS CA C 13 58.56 0.2 A 28 LYS CB C 13 32.4 0.2 A 28 LYS CD C 13 29.28 0.2 A 28 LYS CE C 13 42.34 0.2 A 28 LYS CG C 13 25.28 0.2 A 29 GLN H H 1 7.69 0.02 A 29 GLN HA H 1 3.87 0.02 A 29 GLN HBx H 1 1.61 0.02 A 29 GLN HBy H 1 1.86 0.02 A 29 GLN HGx H 1 1.86 0.02 A 29 GLN HGy H 1 1.86 0.02 A 29 GLN CA C 13 56.45 0.2 A 29 GLN CB C 13 28.56 0.2 A 29 GLN CG C 13 33.77 0.2 A 30 HIS H H 1 7.5 0.02 A 30 HIS HA H 1 4.38 0.02 A 30 HIS HBx H 1 2.25 0.02 A 30 HIS HBy H 1 2.87 0.02 A 30 HIS HD2 H 1 6.5 0.02 A 30 HIS HE1 H 1 8.68 0.02 A 30 HIS CA C 13 55.75 0.2 A 30 HIS CB C 13 28.06 0.2 A 30 HIS CD2 C 13 119.5 0.2 A 30 HIS CE1 C 13 136.75 0.2 A 31 ALA H H 1 7.59 0.02 A 31 ALA HA H 1 4.08 0.02 A 31 ALA HB% H 1 1.3 0.02 A 31 ALA C C 13 177.99 0.2 A 31 ALA CA C 13 53.86 0.2 A 31 ALA CB C 13 19.07 0.2 A 32 GLU H H 1 8.32 0.02 A 32 GLU HA H 1 4.09 0.02 A 32 GLU HBx H 1 1.9 0.02 A 32 GLU HBy H 1 2.02 0.02 A 32 GLU HGx H 1 2.35 0.02 A 32 GLU HGy H 1 2.35 0.02 A 32 GLU C C 13 176.38 0.2 A 32 GLU CA C 13 57.94 0.2 A 32 GLU CB C 13 27.87 0.2 A 32 GLU CG C 13 33.49 0.2 A 33 GLN H H 1 7.79 0.02 A 33 GLN HA H 1 4.3 0.02 A 33 GLN HBy H 1 2.09 0.02 A 33 GLN HBx H 1 1.96 0.02 A 33 GLN HGx H 1 2.31 0.02 A 33 GLN HGy H 1 2.31 0.02 A 33 GLN C C 13 175.48 0.2 A 33 GLN CA C 13 56.44 0.2 A 33 GLN CB C 13 30.05 0.2 A 33 GLN CG C 13 34.44 0.2 A 34 ASN H H 1 8.39 0.02 A 34 ASN HA H 1 4.51 0.02 A 34 ASN HBx H 1 2.79 0.02 A 34 ASN HBy H 1 2.88 0.02 A 34 ASN C C 13 174.38 0.2 A 34 ASN CA C 13 54.5 0.2 A 34 ASN CB C 13 38.77 0.2 A 35 LEU H H 1 7.87 0.02 A 35 LEU HA H 1 4.59 0.02 A 35 LEU HBx H 1 1.01 0.02 A 35 LEU HBy H 1 1.54 0.02 A 35 LEU HD1% H 1 0.55 0.02 A 35 LEU HD2% H 1 0.52 0.02 A 35 LEU HG H 1 1.39 0.02 A 35 LEU C C 13 175.69 0.2 A 35 LEU CA C 13 54.43 0.2 A 35 LEU CB C 13 45.65 0.2 A 35 LEU CDx C 13 23.15 0.2 A 35 LEU CDy C 13 25.62 0.2 A 35 LEU CG C 13 26.63 0.2 A 36 ILE H H 1 8.89 0.02 A 36 ILE HA H 1 4.12 0.02 A 36 ILE HB H 1 1.53 0.02 A 36 ILE HD1% H 1 0.57 0.02 A 36 ILE HG1x H 1 0.89 0.02 A 36 ILE HG1y H 1 1.36 0.02 A 36 ILE HG2% H 1 0.76 0.02 A 36 ILE C C 13 176.31 0.2 A 36 ILE CA C 13 59.99 0.2 A 36 ILE CB C 13 41.01 0.2 A 36 ILE CD1 C 13 13.64 0.2 A 36 ILE CG1 C 13 27.08 0.2 A 36 ILE CG2 C 13 17.44 0.2 A 37 LEU H H 1 8.62 0.02 A 37 LEU HA H 1 4.01 0.02 A 37 LEU HBx H 1 1.26 0.02 A 37 LEU HBy H 1 1.95 0.02 A 37 LEU HD1% H 1 0.96 0.02 A 37 LEU HD2% H 1 0.96 0.02 A 37 LEU HG H 1 0.86 0.02 A 37 LEU C C 13 175.43 0.2 A 37 LEU CA C 13 56.33 0.2 A 37 LEU CB C 13 42.39 0.2 A 37 LEU CDx C 13 24.27 0.2 A 37 LEU CDy C 13 24.41 0.2 A 37 LEU CG C 13 27.41 0.2 A 38 ALA H H 1 9.07 0.02 A 38 ALA HA H 1 4.64 0.02 A 38 ALA HB% H 1 1.18 0.02 A 38 ALA C C 13 177.63 0.2 A 38 ALA CA C 13 52.31 0.2 A 38 ALA CB C 13 19.89 0.2 A 39 GLY H H 1 7.38 0.02 A 39 GLY HAx H 1 3.91 0.02 A 39 GLY HAy H 1 4.23 0.02 A 39 GLY C C 13 171.36 0.2 A 39 GLY CA C 13 45.87 0.2 A 40 VAL H H 1 8.57 0.02 A 40 VAL HA H 1 4.19 0.02 A 40 VAL HB H 1 2.15 0.02 A 40 VAL HG1% H 1 0.86 0.02 A 40 VAL HG2% H 1 0.88 0.02 A 40 VAL C C 13 175.01 0.2 A 40 VAL CA C 13 63.12 0.2 A 40 VAL CB C 13 32.17 0.2 A 40 VAL CGy C 13 22.09 0.2 A 40 VAL CGx C 13 21.96 0.2 A 41 ASP H H 1 9.08 0.02 A 41 ASP HA H 1 4.83 0.02 A 41 ASP HBx H 1 2.4 0.02 A 41 ASP HBy H 1 2.77 0.02 A 41 ASP C C 13 174.66 0.2 A 41 ASP CA C 13 55.63 0.2 A 41 ASP CB C 13 40.86 0.2 A 42 ALA H H 1 8.01 0.02 A 42 ALA HA H 1 4.45 0.02 A 42 ALA HB% H 1 1.25 0.02 A 42 ALA C C 13 175.19 0.2 A 42 ALA CA C 13 51.86 0.2 A 42 ALA CB C 13 22.35 0.2 A 43 GLY H H 1 8.49 0.02 A 43 GLY HAx H 1 3.96 0.02 A 43 GLY HAy H 1 4.65 0.02 A 43 GLY C C 13 171.59 0.2 A 43 GLY CA C 13 46.77 0.2 A 44 GLN H H 1 9.01 0.02 A 44 GLN HA H 1 5.16 0.02 A 44 GLN HBx H 1 1.73 0.02 A 44 GLN HBy H 1 2.15 0.02 A 44 GLN HGx H 1 1.99 0.02 A 44 GLN HGy H 1 1.99 0.02 A 44 GLN C C 13 174.05 0.2 A 44 GLN CA C 13 54.91 0.2 A 44 GLN CB C 13 33.5 0.2 A 44 GLN CG C 13 33.82 0.2 A 45 ILE H H 1 9.16 0.02 A 45 ILE HA H 1 4.57 0.02 A 45 ILE HB H 1 1.26 0.02 A 45 ILE HD1% H 1 0.56 0.02 A 45 ILE HG12 H 1 1.03 0.02 A 45 ILE HG13 H 1 1.03 0.02 A 45 ILE HG2% H 1 0.36 0.02 A 45 ILE C C 13 174.66 0.2 A 45 ILE CA C 13 59.94 0.2 A 45 ILE CB C 13 40.48 0.2 A 45 ILE CD1 C 13 14.63 0.2 A 45 ILE CG1 C 13 27.55 0.2 A 45 ILE CG2 C 13 17.2 0.2 A 46 ILE H H 1 9.27 0.02 A 46 ILE HA H 1 4.59 0.02 A 46 ILE HB H 1 1.63 0.02 A 46 ILE HG12 H 1 1.05 0.02 A 46 ILE HG13 H 1 1.05 0.02 A 46 ILE HG2% H 1 0.15 0.02 A 46 ILE C C 13 174.92 0.2 A 46 ILE CA C 13 60.87 0.2 A 46 ILE CB C 13 40.96 0.2 A 46 ILE CD1 C 13 17.26 0.2 A 46 ILE CG1 C 13 31.8 0.2 A 46 ILE CG2 C 13 21.57 0.2 A 47 LYS H H 1 8.47 0.02 A 47 LYS HA H 1 5.03 0.02 A 47 LYS HBx H 1 1.65 0.02 A 47 LYS HBy H 1 1.89 0.02 A 47 LYS HDx H 1 1.68 0.02 A 47 LYS HDy H 1 1.68 0.02 A 47 LYS HEx H 1 2.94 0.02 A 47 LYS HEy H 1 2.94 0.02 A 47 LYS HGx H 1 1.44 0.02 A 47 LYS HGy H 1 1.44 0.02 A 47 LYS C C 13 175.55 0.2 A 47 LYS CA C 13 55.13 0.2 A 47 LYS CB C 13 35.45 0.2 A 47 LYS CD C 13 29.5 0.2 A 47 LYS CE C 13 42.26 0.2 A 47 LYS CG C 13 24.17 0.2 A 48 GLY H H 1 8.62 0.02 A 48 GLY HAx H 1 3.41 0.02 A 48 GLY HAy H 1 3.78 0.02 A 48 GLY C C 13 172.24 0.2 A 48 GLY CA C 13 45.79 0.2 A 49 ILE H H 1 7.28 0.02 A 49 ILE HA H 1 3.65 0.02 A 49 ILE HB H 1 1.73 0.02 A 49 ILE HD1% H 1 0.76 0.02 A 49 ILE HG2% H 1 0.91 0.02 A 49 ILE CA C 13 59.97 0.2 A 49 ILE CB C 13 39.1 0.2 A 49 ILE CD1 C 13 13.77 0.2 A 49 ILE CG1 C 13 26.25 0.2 A 49 ILE CG2 C 13 17.74 0.2 A 50 PRO HA H 1 4.49 0.02 A 50 PRO HBx H 1 1.42 0.02 A 50 PRO HBy H 1 2.12 0.02 A 50 PRO HDx H 1 3.44 0.02 A 50 PRO HDy H 1 3.64 0.02 A 50 PRO HGx H 1 1.23 0.02 A 50 PRO HGy H 1 1.86 0.02 A 50 PRO C C 13 177.34 0.2 A 50 PRO CA C 13 63.53 0.2 A 50 PRO CB C 13 34.83 0.2 A 50 PRO CD C 13 50.46 0.2 A 50 PRO CG C 13 24.56 0.2 A 51 HIS H H 1 8.61 0.02 A 51 HIS HA H 1 4.94 0.02 A 51 HIS HBx H 1 3.67 0.02 A 51 HIS HBy H 1 3.67 0.02 A 51 HIS C C 13 173.85 0.2 A 51 HIS CA C 13 56.21 0.2 A 51 HIS CB C 13 29.73 0.2 A 51 HIS CD2 C 13 120.29 0.2 A 52 TRP H H 1 8.03 0.02 A 52 TRP HA H 1 4.3 0.02 A 52 TRP HBx H 1 3.33 0.02 A 52 TRP HBy H 1 3.33 0.02 A 52 TRP HD1 H 1 7.04 0.02 A 52 TRP HE1 H 1 10.09 0.02 A 52 TRP HE3 H 1 7.35 0.02 A 52 TRP HH2 H 1 7.09 0.02 A 52 TRP HZ2 H 1 7.43 0.02 A 52 TRP HZ3 H 1 6.99 0.02 A 52 TRP C C 13 175.22 0.2 A 52 TRP CA C 13 58.46 0.2 A 52 TRP CB C 13 26.67 0.2 A 52 TRP CD1 C 13 127.46 0.2 A 52 TRP CE3 C 13 120.11 0.2 A 52 TRP CH2 C 13 124.55 0.2 A 52 TRP CZ2 C 13 115.23 0.2 A 52 TRP CZ3 C 13 121.94 0.2 A 53 ASP H H 1 7.48 0.02 A 53 ASP HA H 1 4.84 0.02 A 53 ASP HBx H 1 2.51 0.02 A 53 ASP HBy H 1 2.51 0.02 A 53 ASP C C 13 174.69 0.2 A 53 ASP CA C 13 54.64 0.2 A 53 ASP CB C 13 41.63 0.2 A 54 ASN H H 1 8.28 0.02 A 54 ASN HA H 1 5.05 0.02 A 54 ASN HBx H 1 2.11 0.02 A 54 ASN HBy H 1 3.01 0.02 A 54 ASN C C 13 174.03 0.2 A 54 ASN CA C 13 53.11 0.2 A 54 ASN CB C 13 41.45 0.2 A 55 TYR H H 1 9.29 0.02 A 55 TYR HA H 1 5.03 0.02 A 55 TYR HBx H 1 2.33 0.02 A 55 TYR HBy H 1 3.13 0.02 A 55 TYR HDx H 1 6.82 0.02 A 55 TYR HDy H 1 6.82 0.02 A 55 TYR HEx H 1 6.66 0.02 A 55 TYR HEy H 1 6.66 0.02 A 55 TYR C C 13 175.31 0.2 A 55 TYR CA C 13 57.92 0.2 A 55 TYR CB C 13 40.2 0.2 A 55 TYR CDx C 13 133.02 0.2 A 55 TYR CDy C 13 133.02 0.2 A 55 TYR CEx C 13 118.33 0.2 A 55 TYR CEy C 13 118.33 0.2 A 56 TYR H H 1 9.77 0.02 A 56 TYR HA H 1 4.63 0.02 A 56 TYR HBx H 1 2.4 0.02 A 56 TYR HBy H 1 3.06 0.02 A 56 TYR HDx H 1 6.82 0.02 A 56 TYR HDy H 1 6.82 0.02 A 56 TYR HEx H 1 6.58 0.02 A 56 TYR HEy H 1 6.58 0.02 A 56 TYR C C 13 174.71 0.2 A 56 TYR CA C 13 57.97 0.2 A 56 TYR CB C 13 40.31 0.2 A 56 TYR CDx C 13 132.4 0.2 A 56 TYR CDy C 13 132.4 0.2 A 56 TYR CEx C 13 118.48 0.2 A 56 TYR CEy C 13 118.48 0.2 A 57 ASN H H 1 9.24 0.02 A 57 ASN HA H 1 5.61 0.02 A 57 ASN HBx H 1 2.09 0.02 A 57 ASN HBy H 1 2.61 0.02 A 57 ASN C C 13 173.17 0.2 A 57 ASN CA C 13 52.53 0.2 A 57 ASN CB C 13 42.46 0.2 A 58 LEU H H 1 8.84 0.02 A 58 LEU HA H 1 5.23 0.02 A 58 LEU HBx H 1 1.3 0.02 A 58 LEU HBy H 1 1.71 0.02 A 58 LEU HD1% H 1 0.74 0.02 A 58 LEU HD2% H 1 0.95 0.02 A 58 LEU HG H 1 1.56 0.02 A 58 LEU C C 13 175.64 0.2 A 58 LEU CA C 13 53.1 0.2 A 58 LEU CB C 13 46.18 0.2 A 58 LEU CDy C 13 26.41 0.2 A 58 LEU CDx C 13 24.53 0.2 A 58 LEU CG C 13 26.24 0.2 A 59 ILE H H 1 8.59 0.02 A 59 ILE HA H 1 5.16 0.02 A 59 ILE HB H 1 1.88 0.02 A 59 ILE HD1% H 1 0.7 0.02 A 59 ILE HG1x H 1 1.02 0.02 A 59 ILE HG1y H 1 1.3 0.02 A 59 ILE HG2% H 1 0.81 0.02 A 59 ILE C C 13 175.48 0.2 A 59 ILE CA C 13 58.5 0.2 A 59 ILE CB C 13 36.51 0.2 A 59 ILE CD1 C 13 10.09 0.2 A 59 ILE CG1 C 13 26.94 0.2 A 59 ILE CG2 C 13 17.73 0.2 A 60 LEU H H 1 9.45 0.02 A 60 LEU HA H 1 5.21 0.02 A 60 LEU HBx H 1 1.49 0.02 A 60 LEU HBy H 1 1.8 0.02 A 60 LEU HD1% H 1 0.79 0.02 A 60 LEU HD2% H 1 0.86 0.02 A 60 LEU HG H 1 1.72 0.02 A 60 LEU C C 13 175.41 0.2 A 60 LEU CA C 13 53.09 0.2 A 60 LEU CB C 13 45.71 0.2 A 60 LEU CDx C 13 26.45 0.2 A 60 LEU CDy C 13 27.31 0.2 A 60 LEU CG C 13 26.49 0.2 A 61 SER H H 1 8.88 0.02 A 61 SER HA H 1 5.54 0.02 A 61 SER HBx H 1 3.59 0.02 A 61 SER HBy H 1 3.59 0.02 A 61 SER C C 13 174.08 0.2 A 61 SER CA C 13 56.99 0.2 A 61 SER CB C 13 64.98 0.2 A 62 ALA H H 1 9.55 0.02 A 62 ALA HA H 1 5.3 0.02 A 62 ALA HB% H 1 1.22 0.02 A 62 ALA C C 13 175.41 0.2 A 62 ALA CA C 13 51.53 0.2 A 62 ALA CB C 13 23.93 0.2 A 63 LYS H H 1 8.75 0.02 A 63 LYS HA H 1 4.96 0.02 A 63 LYS HBx H 1 1.6 0.02 A 63 LYS HBy H 1 1.84 0.02 A 63 LYS HDx H 1 1.62 0.02 A 63 LYS HDy H 1 1.7 0.02 A 63 LYS HEx H 1 2.81 0.02 A 63 LYS HEy H 1 2.81 0.02 A 63 LYS HGx H 1 1.08 0.02 A 63 LYS HGy H 1 1.08 0.02 A 63 LYS C C 13 175.26 0.2 A 63 LYS CA C 13 54.61 0.2 A 63 LYS CB C 13 36.94 0.2 A 63 LYS CD C 13 29.84 0.2 A 63 LYS CE C 13 42.76 0.2 A 63 LYS CG C 13 24.75 0.2 A 64 HIS H H 1 8.94 0.02 A 64 HIS HA H 1 5.04 0.02 A 64 HIS HBx H 1 3.27 0.02 A 64 HIS HBy H 1 3.4 0.02 A 64 HIS HD2 H 1 7.44 0.02 A 64 HIS HE1 H 1 8.64 0.02 A 64 HIS C C 13 173.68 0.2 A 64 HIS CA C 13 56.71 0.2 A 64 HIS CB C 13 29.34 0.2 A 64 HIS CD2 C 13 120.77 0.2 A 64 HIS CE1 C 13 137.08 0.2 A 65 SER H H 1 7.47 0.02 A 65 SER HA H 1 4.72 0.02 A 65 SER HBx H 1 3.66 0.02 A 65 SER HBy H 1 3.92 0.02 A 65 SER CA C 13 56.22 0.2 A 65 SER CB C 13 64.25 0.2 A 66 PRO HA H 1 4.07 0.02 A 66 PRO HBx H 1 1.48 0.02 A 66 PRO HBy H 1 2.27 0.02 A 66 PRO HDx H 1 3.68 0.02 A 66 PRO HDy H 1 3.68 0.02 A 66 PRO HGx H 1 1.86 0.02 A 66 PRO HGy H 1 1.89 0.02 A 66 PRO C C 13 177.29 0.2 A 66 PRO CA C 13 65.82 0.2 A 66 PRO CB C 13 32.68 0.2 A 66 PRO CD C 13 51.15 0.2 A 66 PRO CG C 13 27.72 0.2 A 67 HIS H H 1 8.06 0.02 A 67 HIS HA H 1 4.79 0.02 A 67 HIS HBx H 1 3.12 0.02 A 67 HIS HBy H 1 3.37 0.02 A 67 HIS HD2 H 1 7.25 0.02 A 67 HIS HE1 H 1 8.78 0.02 A 67 HIS C C 13 174.27 0.2 A 67 HIS CA C 13 54.81 0.2 A 67 HIS CB C 13 28.45 0.2 A 67 HIS CD2 C 13 120.02 0.2 A 67 HIS CE1 C 13 136.61 0.2 A 68 GLU H H 1 7.14 0.02 A 68 GLU HA H 1 4.37 0.02 A 68 GLU HBx H 1 1.97 0.02 A 68 GLU HBy H 1 2.15 0.02 A 68 GLU HGx H 1 2.3 0.02 A 68 GLU HGy H 1 2.49 0.02 A 68 GLU C C 13 175.69 0.2 A 68 GLU CA C 13 55.13 0.2 A 68 GLU CB C 13 32.17 0.2 A 68 GLU CG C 13 35.53 0.2 A 69 PHE H H 1 7.98 0.02 A 69 PHE HA H 1 4.67 0.02 A 69 PHE HBx H 1 2.91 0.02 A 69 PHE HBy H 1 3.16 0.02 A 69 PHE HDx H 1 7.38 0.02 A 69 PHE HDy H 1 7.38 0.02 A 69 PHE HEx H 1 7.34 0.02 A 69 PHE HEy H 1 7.34 0.02 A 69 PHE C C 13 176.71 0.2 A 69 PHE CA C 13 57.33 0.2 A 69 PHE CB C 13 39.36 0.2 A 69 PHE CDx C 13 131.57 0.2 A 69 PHE CDy C 13 131.57 0.2 A 69 PHE CEx C 13 131.57 0.2 A 69 PHE CEy C 13 131.57 0.2 A 70 SER H H 1 8.36 0.02 A 70 SER HA H 1 4.21 0.02 A 70 SER HBx H 1 3.43 0.02 A 70 SER HBy H 1 3.56 0.02 A 70 SER C C 13 172.47 0.2 A 70 SER CA C 13 59.02 0.2 A 70 SER CB C 13 64.78 0.2 A 71 LYS H H 1 8.16 0.02 A 71 LYS HA H 1 4.18 0.02 A 71 LYS HBx H 1 1.25 0.02 A 71 LYS HBy H 1 1.45 0.02 A 71 LYS HDx H 1 0.72 0.02 A 71 LYS HDy H 1 0.72 0.02 A 71 LYS HEx H 1 2.4 0.02 A 71 LYS HEy H 1 2.44 0.02 A 71 LYS HGx H 1 0.96 0.02 A 71 LYS HGy H 1 0.96 0.02 A 71 LYS C C 13 174.98 0.2 A 71 LYS CA C 13 54.53 0.2 A 71 LYS CB C 13 36.2 0.2 A 71 LYS CD C 13 28.4 0.2 A 71 LYS CE C 13 42.46 0.2 A 71 LYS CG C 13 24.8 0.2 A 72 PHE H H 1 8.29 0.02 A 72 PHE HA H 1 5.6 0.02 A 72 PHE HBx H 1 2.72 0.02 A 72 PHE HBy H 1 2.72 0.02 A 72 PHE HDx H 1 7.07 0.02 A 72 PHE HDy H 1 7.07 0.02 A 72 PHE HEx H 1 7.01 0.02 A 72 PHE HEy H 1 7.01 0.02 A 72 PHE C C 13 175.29 0.2 A 72 PHE CA C 13 57.38 0.2 A 72 PHE CB C 13 42.83 0.2 A 72 PHE CDx C 13 132.39 0.2 A 72 PHE CDy C 13 132.39 0.2 A 72 PHE CEx C 13 131.3 0.2 A 72 PHE CEy C 13 131.3 0.2 A 73 TYR H H 1 9.02 0.02 A 73 TYR HA H 1 4.64 0.02 A 73 TYR HBx H 1 1.9 0.02 A 73 TYR HBy H 1 2.16 0.02 A 73 TYR HDx H 1 6.54 0.02 A 73 TYR HDy H 1 6.54 0.02 A 73 TYR HEx H 1 6.69 0.02 A 73 TYR HEy H 1 6.69 0.02 A 73 TYR C C 13 174.54 0.2 A 73 TYR CA C 13 57.03 0.2 A 73 TYR CB C 13 42.57 0.2 A 73 TYR CDx C 13 133.98 0.2 A 73 TYR CDy C 13 133.98 0.2 A 73 TYR CEx C 13 117.76 0.2 A 73 TYR CEy C 13 117.76 0.2 A 74 ASN H H 1 9.08 0.02 A 74 ASN HA H 1 5.49 0.02 A 74 ASN HBx H 1 2.18 0.02 A 74 ASN HBy H 1 2.39 0.02 A 74 ASN C C 13 174.03 0.2 A 74 ASN CA C 13 52.35 0.2 A 74 ASN CB C 13 42.72 0.2 A 75 VAL H H 1 8.89 0.02 A 75 VAL HA H 1 5.11 0.02 A 75 VAL HB H 1 2.02 0.02 A 75 VAL HG1% H 1 0.7 0.02 A 75 VAL HG2% H 1 0.73 0.02 A 75 VAL C C 13 174.54 0.2 A 75 VAL CA C 13 58.84 0.2 A 75 VAL CB C 13 35.24 0.2 A 75 VAL CGy C 13 22.52 0.2 A 75 VAL CGx C 13 20.63 0.2 A 76 VAL H H 1 8.6 0.02 A 76 VAL HA H 1 5.51 0.02 A 76 VAL HB H 1 1.89 0.02 A 76 VAL HG1% H 1 0.89 0.02 A 76 VAL HG2% H 1 0.92 0.02 A 76 VAL C C 13 175.89 0.2 A 76 VAL CA C 13 61.11 0.2 A 76 VAL CB C 13 34.19 0.2 A 76 VAL CGy C 13 22.32 0.2 A 76 VAL CGx C 13 21.84 0.2 A 77 VAL H H 1 9.34 0.02 A 77 VAL HA H 1 4.91 0.02 A 77 VAL HB H 1 1.87 0.02 A 77 VAL HG1% H 1 0.93 0.02 A 77 VAL HG2% H 1 1.085 0.02 A 77 VAL C C 13 173.59 0.2 A 77 VAL CA C 13 60.95 0.2 A 77 VAL CB C 13 36.6 0.2 A 77 VAL CGy C 13 22.8 0.2 A 77 VAL CGx C 13 22.12 0.2 A 78 LEU H H 1 9.31 0.02 A 78 LEU HA H 1 4.49 0.02 A 78 LEU HBx H 1 1.13 0.02 A 78 LEU HBy H 1 1.6 0.02 A 78 LEU HD1% H 1 0.13 0.02 A 78 LEU HD2% H 1 1.03 0.02 A 78 LEU HG H 1 0.65 0.02 A 78 LEU C C 13 174.06 0.2 A 78 LEU CA C 13 54.33 0.2 A 78 LEU CB C 13 44.54 0.2 A 78 LEU CDx C 13 22.81 0.2 A 78 LEU CDy C 13 27.33 0.2 A 78 LEU CG C 13 26 0.2 A 79 GLU H H 1 9.24 0.02 A 79 GLU HA H 1 5.1 0.02 A 79 GLU HBx H 1 1.52 0.02 A 79 GLU HBy H 1 2.45 0.02 A 79 GLU HGx H 1 2.06 0.02 A 79 GLU HGy H 1 2.06 0.02 A 79 GLU C C 13 174.87 0.2 A 79 GLU CA C 13 54.08 0.2 A 79 GLU CB C 13 32.06 0.2 A 79 GLU CG C 13 33.87 0.2 A 80 LYS H H 1 8.63 0.02 A 80 LYS HA H 1 4.28 0.02 A 80 LYS HBx H 1 1.76 0.02 A 80 LYS HBy H 1 1.9 0.02 A 80 LYS HDx H 1 1.65 0.02 A 80 LYS HDy H 1 1.65 0.02 A 80 LYS HEx H 1 2.89 0.02 A 80 LYS HEy H 1 2.89 0.02 A 80 LYS HGx H 1 1.41 0.02 A 80 LYS HGy H 1 1.49 0.02 A 80 LYS C C 13 177.52 0.2 A 80 LYS CA C 13 56.65 0.2 A 80 LYS CB C 13 32.93 0.2 A 80 LYS CD C 13 29.47 0.2 A 80 LYS CE C 13 42.08 0.2 A 80 LYS CG C 13 25.44 0.2 A 81 ALA H H 1 9.11 0.02 A 81 ALA HA H 1 4.18 0.02 A 81 ALA HB% H 1 1.49 0.02 A 81 ALA C C 13 176.31 0.2 A 81 ALA CA C 13 54.71 0.2 A 81 ALA CB C 13 19.02 0.2 A 82 SER H H 1 8.12 0.02 A 82 SER HA H 1 4.09 0.02 A 82 SER HBx H 1 3.75 0.02 A 82 SER HBy H 1 3.82 0.02 A 82 SER C C 13 176.12 0.2 A 82 SER CA C 13 60.45 0.2 A 82 SER CB C 13 62.64 0.2 A 83 ASP H H 1 7.19 0.02 A 83 ASP HA H 1 4.7 0.02 A 83 ASP HBx H 1 2.6 0.02 A 83 ASP HBy H 1 3.03 0.02 A 83 ASP C C 13 175.71 0.2 A 83 ASP CA C 13 53.01 0.2 A 83 ASP CB C 13 40.44 0.2 A 84 ASN H H 1 8.16 0.02 A 84 ASN HA H 1 4.46 0.02 A 84 ASN HBx H 1 2.83 0.02 A 84 ASN HBy H 1 2.98 0.02 A 84 ASN C C 13 174.12 0.2 A 84 ASN CA C 13 55.13 0.2 A 84 ASN CB C 13 37.99 0.2 A 85 SER H H 1 7.92 0.02 A 85 SER HA H 1 4.27 0.02 A 85 SER HBx H 1 3.76 0.02 A 85 SER HBy H 1 3.76 0.02 A 85 SER C C 13 173.66 0.2 A 85 SER CA C 13 64.74 0.2 A 85 SER CB C 13 58.81 0.2 A 86 LEU H H 1 7.75 0.02 A 86 LEU HA H 1 5.22 0.02 A 86 LEU HBx H 1 0.04 0.02 A 86 LEU HBy H 1 0.46 0.02 A 86 LEU HD1% H 1 0.42 0.02 A 86 LEU HD2% H 1 1.32 0.02 A 86 LEU HG H 1 0.25 0.02 A 86 LEU C C 13 177.17 0.2 A 86 LEU CA C 13 53.41 0.2 A 86 LEU CB C 13 44.2 0.2 A 86 LEU CDx C 13 23.33 0.2 A 86 LEU CDy C 13 26.17 0.2 A 86 LEU CG C 13 26.27 0.2 A 87 LYS H H 1 8.68 0.02 A 87 LYS HA H 1 4.73 0.02 A 87 LYS HBx H 1 1.76 0.02 A 87 LYS HBy H 1 1.76 0.02 A 87 LYS HDx H 1 1.5 0.02 A 87 LYS HDy H 1 1.5 0.02 A 87 LYS HEx H 1 3.01 0.02 A 87 LYS HEy H 1 3.01 0.02 A 87 LYS HGx H 1 1.29 0.02 A 87 LYS HGy H 1 1.29 0.02 A 87 LYS C C 13 175.55 0.2 A 87 LYS CA C 13 55.36 0.2 A 87 LYS CB C 13 37.11 0.2 A 87 LYS CD C 13 25.32 0.2 A 87 LYS CE C 13 42.66 0.2 A 87 LYS CG C 13 25.25 0.2 A 88 LEU H H 1 9.66 0.02 A 88 LEU HA H 1 4.69 0.02 A 88 LEU HBx H 1 1.25 0.02 A 88 LEU HBy H 1 2.2 0.02 A 88 LEU HD1% H 1 1.03 0.02 A 88 LEU HD2% H 1 1.2 0.02 A 88 LEU HG H 1 1.6 0.02 A 88 LEU C C 13 175.26 0.2 A 88 LEU CA C 13 56.03 0.2 A 88 LEU CB C 13 42.91 0.2 A 88 LEU CDy C 13 27 0.2 A 88 LEU CDx C 13 24.91 0.2 A 88 LEU CG C 13 27.25 0.2 A 89 VAL H H 1 8.93 0.02 A 89 VAL HA H 1 4.23 0.02 A 89 VAL HB H 1 1.9 0.02 A 89 VAL HG1% H 1 1 0.02 A 89 VAL HG2% H 1 1.08 0.02 A 89 VAL C C 13 175.84 0.2 A 89 VAL CA C 13 63.91 0.2 A 89 VAL CB C 13 33.52 0.2 A 89 VAL CGx C 13 21.48 0.2 A 89 VAL CGy C 13 22.68 0.2 A 90 ALA H H 1 8.04 0.02 A 90 ALA HA H 1 4.75 0.02 A 90 ALA HB% H 1 1.34 0.02 A 90 ALA C C 13 174.94 0.2 A 90 ALA CA C 13 52.53 0.2 A 90 ALA CB C 13 23.43 0.2 A 91 PHE H H 1 8.8 0.02 A 91 PHE HA H 1 4.77 0.02 A 91 PHE HBx H 1 2.64 0.02 A 91 PHE HBy H 1 3.31 0.02 A 91 PHE HDx H 1 6.86 0.02 A 91 PHE HDy H 1 6.86 0.02 A 91 PHE HEx H 1 6.68 0.02 A 91 PHE HEy H 1 6.68 0.02 A 91 PHE C C 13 173.69 0.2 A 91 PHE CA C 13 58.75 0.2 A 91 PHE CB C 13 42.29 0.2 A 91 PHE CDx C 13 130.97 0.2 A 91 PHE CDy C 13 130.97 0.2 A 91 PHE CEx C 13 131.21 0.2 A 91 PHE CEy C 13 131.21 0.2 A 92 VAL H H 1 9.22 0.02 A 92 VAL HA H 1 4.7 0.02 A 92 VAL HB H 1 2.14 0.02 A 92 VAL HG1% H 1 0.83 0.02 A 92 VAL HG2% H 1 0.83 0.02 A 92 VAL CA C 13 59.4 0.2 A 92 VAL CB C 13 35.71 0.2 A 92 VAL CGx C 13 19.86 0.2 A 92 VAL CGy C 13 21.07 0.2 A 93 PRO HA H 1 3.85 0.02 A 93 PRO HBx H 1 0.88 0.02 A 93 PRO HBy H 1 1.48 0.02 A 93 PRO HDy H 1 3.64 0.02 A 93 PRO HDx H 1 3.63 0.02 A 93 PRO HGx H 1 1.87 0.02 A 93 PRO HGy H 1 2.13 0.02 A 93 PRO C C 13 175.87 0.2 A 93 PRO CA C 13 62.98 0.2 A 93 PRO CB C 13 32 0.2 A 93 PRO CD C 13 51.53 0.2 A 93 PRO CG C 13 27.72 0.2 A 94 LEU H H 1 7.97 0.02 A 94 LEU HA H 1 3.88 0.02 A 94 LEU HBx H 1 0.18 0.02 A 94 LEU HBy H 1 1.34 0.02 A 94 LEU HD1% H 1 0.24 0.02 A 94 LEU HD2% H 1 0.35 0.02 A 94 LEU HG H 1 0.55 0.02 A 94 LEU C C 13 174.19 0.2 A 94 LEU CA C 13 51.44 0.2 A 94 LEU CB C 13 38.17 0.2 A 94 LEU CDy C 13 23.89 0.2 A 94 LEU CDx C 13 23.83 0.2 A 94 LEU CG C 13 27.42 0.2 A 95 PHE H H 1 6.51 0.02 A 95 PHE HA H 1 4.49 0.02 A 95 PHE HBx H 1 3.09 0.02 A 95 PHE HBy H 1 3.44 0.02 A 95 PHE HDx H 1 7.01 0.02 A 95 PHE HDy H 1 7.01 0.02 A 95 PHE HEx H 1 6.83 0.02 A 95 PHE HEy H 1 6.83 0.02 A 95 PHE CA C 13 57.86 0.2 A 95 PHE CB C 13 38.09 0.2 A 95 PHE CDx C 13 132.09 0.2 A 95 PHE CDy C 13 132.09 0.2 A 95 PHE CEx C 13 132.98 0.2 A 95 PHE CEy C 13 132.98 0.2 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 1 GLY HAx A 2 PRO HDx 1.0 1.8 3.98 2 1 A 1 GLY HAy A 2 PRO HDx 1.0 1.8 3.98 3 1 A 2 PRO HDy A 1 GLY HAx 1.0 1.8 3.98 4 1 A 1 GLY HAy A 2 PRO HDy 1.0 1.8 3.98 5 2 A 4 PRO HBy A 5 ALA H 1.0 1.8 3.61 6 3 A 5 ALA H A 4 PRO HA 1.0 1.8 2.86 7 4 A 5 ALA HB% A 4 PRO HDx 1.0 1.8 5.50 8 4 A 4 PRO HDy A 5 ALA HB% 1.0 1.8 5.50 9 5 A 5 ALA H A 4 PRO HBx 1.0 1.8 3.98 10 6 A 4 PRO HBy A 7 GLY H 1.0 1.8 4.10 11 7 A 7 GLY H A 4 PRO HGx 1.0 1.8 4.40 12 7 A 7 GLY H A 4 PRO HGy 1.0 1.8 4.40 13 8 A 8 GLU HA A 4 PRO HGx 1.0 1.8 4.89 14 8 A 4 PRO HGy A 8 GLU HA 1.0 1.8 4.89 15 9 A 5 ALA H A 5 ALA HB% 1.0 1.8 3.44 16 10 A 5 ALA HB% A 6 ILE HA 1.0 1.8 4.78 17 11 A 5 ALA HB% A 6 ILE H 1.0 1.8 3.86 18 12 A 6 ILE HA A 6 ILE HG2% 1.0 1.8 3.80 19 13 A 6 ILE HG2% A 6 ILE HG1x 1.0 1.8 3.70 20 14 A 6 ILE H A 6 ILE HG1x 1.0 1.8 3.95 21 15 A 6 ILE H A 6 ILE HB 1.0 1.8 3.53 22 16 A 6 ILE H A 6 ILE HD1% 1.0 1.8 4.41 23 17 A 6 ILE HA A 6 ILE HD1% 1.0 1.8 4.25 24 18 A 7 GLY H A 6 ILE HG2% 1.0 1.8 4.62 25 19 A 8 GLU HGy A 7 GLY HAx 1.0 1.8 4.06 26 19 A 7 GLY HAy A 8 GLU HGy 1.0 1.8 4.06 27 20 A 8 GLU HA A 7 GLY HAx 1.0 1.8 3.88 28 20 A 8 GLU HA A 7 GLY HAy 1.0 1.8 3.88 29 21 A 8 GLU H A 7 GLY HAx 1.0 1.8 3.49 30 21 A 7 GLY HAy A 8 GLU H 1.0 1.8 3.49 31 22 A 8 GLU HGy A 8 GLU H 1.0 1.8 5.05 32 23 A 8 GLU HA A 9 VAL H 1.0 1.8 2.95 33 24 A 9 VAL H A 8 GLU HGx 1.0 1.8 4.85 34 25 A 8 GLU HA A 9 VAL HG2% 1.0 1.8 3.85 35 26 A 8 GLU HGy A 9 VAL H 1.0 1.8 5.47 36 27 A 8 GLU H A 9 VAL HG2% 1.0 1.8 4.80 37 28 A 8 GLU H A 9 VAL H 1.0 1.8 4.64 38 29 A 9 VAL H A 9 VAL HG1% 1.0 1.8 3.99 39 30 A 9 VAL H A 9 VAL HB 1.0 1.8 3.39 40 31 A 9 VAL H A 9 VAL HG2% 1.0 1.8 4.52 41 32 A 9 VAL HG1% A 9 VAL HA 1.0 1.8 3.87 42 33 A 9 VAL HG2% A 9 VAL HA 1.0 1.8 3.55 43 34 A 9 VAL H A 10 ILE HG2% 1.0 1.8 5.27 44 35 A 9 VAL H A 10 ILE H 1.0 1.8 4.83 45 36 A 9 VAL HG2% A 10 ILE H 1.0 1.8 4.24 46 37 A 9 VAL HA A 10 ILE HD1% 1.0 1.8 5.29 47 38 A 9 VAL HA A 10 ILE HG12 1.0 1.8 5.04 48 38 A 9 VAL HA A 10 ILE HG13 1.0 1.8 5.04 49 39 A 9 VAL HG1% A 10 ILE H 1.0 1.8 4.46 50 40 A 9 VAL HA A 10 ILE H 1.0 1.8 3.16 51 41 A 9 VAL HG2% A 10 ILE HG2% 1.0 1.8 4.83 52 42 A 10 ILE HG2% A 10 ILE HA 1.0 1.8 3.87 53 43 A 10 ILE H A 10 ILE HB 1.0 1.8 3.76 54 44 A 10 ILE H A 10 ILE HG12 1.0 1.8 4.55 55 44 A 10 ILE H A 10 ILE HG13 1.0 1.8 4.55 56 45 A 10 ILE H A 10 ILE HD1% 1.0 1.8 4.64 57 46 A 10 ILE HB A 11 GLY H 1.0 1.8 3.91 58 47 A 11 GLY HAy A 10 ILE HG12 1.0 1.8 4.90 59 47 A 10 ILE HG13 A 11 GLY HAy 1.0 1.8 4.90 60 48 A 10 ILE HA A 11 GLY H 1.0 1.8 2.77 61 49 A 10 ILE HG2% A 11 GLY H 1.0 1.8 3.69 62 50 A 10 ILE HB A 11 GLY HAx 1.0 1.8 4.51 63 51 A 11 GLY HAy A 12 ILE HG2% 1.0 1.8 5.00 64 52 A 11 GLY HAy A 12 ILE HD1% 1.0 1.8 4.36 65 53 A 11 GLY HAy A 12 ILE H 1.0 1.8 2.95 66 54 A 11 GLY HAx A 12 ILE H 1.0 1.8 3.18 67 55 A 11 GLY H A 12 ILE H 1.0 1.8 4.45 68 56 A 11 GLY HAy A 43 GLY H 1.0 1.8 3.04 69 57 A 11 GLY HAy A 44 GLN HA 1.0 1.8 4.37 70 58 A 11 GLY HAx A 44 GLN HA 1.0 1.8 4.30 71 59 A 12 ILE HG2% A 12 ILE HA 1.0 1.8 3.34 72 60 A 12 ILE HD1% A 12 ILE HA 1.0 1.8 4.76 73 61 A 12 ILE HD1% A 12 ILE HB 1.0 1.8 3.57 74 62 A 12 ILE H A 12 ILE HG12 1.0 1.8 3.68 75 62 A 12 ILE H A 12 ILE HG13 1.0 1.8 3.68 76 63 A 12 ILE HG2% A 12 ILE H 1.0 1.8 3.67 77 64 A 12 ILE HD1% A 12 ILE H 1.0 1.8 4.36 78 65 A 12 ILE HG2% A 12 ILE HD1% 1.0 1.8 3.22 79 66 A 12 ILE HG2% A 13 SER H 1.0 1.8 3.82 80 67 A 12 ILE HB A 13 SER H 1.0 1.8 3.02 81 68 A 13 SER H A 12 ILE HG12 1.0 1.8 4.26 82 68 A 12 ILE HG13 A 13 SER H 1.0 1.8 4.26 83 69 A 12 ILE H A 13 SER H 1.0 1.8 4.52 84 70 A 12 ILE HA A 13 SER H 1.0 1.8 2.82 85 71 A 16 ASP H A 12 ILE HG12 1.0 1.8 5.00 86 71 A 12 ILE HG13 A 16 ASP H 1.0 1.8 5.00 87 72 A 12 ILE HD1% A 19 VAL HG1% 1.0 1.8 3.79 88 73 A 12 ILE H A 19 VAL HG2% 1.0 1.8 4.58 89 74 A 12 ILE HD1% A 19 VAL H 1.0 1.8 5.28 90 75 A 12 ILE H A 19 VAL HG1% 1.0 1.8 4.41 91 76 A 12 ILE HD1% A 19 VAL HA 1.0 1.8 5.18 92 77 A 12 ILE HB A 19 VAL HG2% 1.0 1.8 3.75 93 78 A 12 ILE H A 43 GLY HAy 1.0 1.8 4.13 94 79 A 12 ILE HD1% A 43 GLY H 1.0 1.8 3.90 95 80 A 12 ILE HD1% A 43 GLY HAy 1.0 1.8 4.58 96 81 A 12 ILE HD1% A 43 GLY HAx 1.0 1.8 4.47 97 82 A 12 ILE H A 43 GLY H 1.0 1.8 4.04 98 83 A 12 ILE H A 44 GLN HA 1.0 1.8 3.61 99 84 A 12 ILE HD1% A 44 GLN HA 1.0 1.8 4.66 100 85 A 12 ILE HG2% A 44 GLN HA 1.0 1.8 4.19 101 86 A 12 ILE HD1% A 44 GLN H 1.0 1.8 5.50 102 87 A 12 ILE HD1% A 44 GLN HGx 1.0 1.8 4.07 103 87 A 12 ILE HD1% A 44 GLN HGy 1.0 1.8 4.07 104 88 A 12 ILE HD1% A 45 ILE HD1% 1.0 1.8 2.40 105 89 A 12 ILE HG2% A 45 ILE H 1.0 1.8 4.37 106 90 A 12 ILE HD1% A 45 ILE H 1.0 1.8 4.56 107 91 A 12 ILE HD1% A 56 TYR HD% 1.0 1.8 5.50 108 92 A 58 LEU HD2% A 12 ILE HG12 1.0 1.8 3.20 109 92 A 12 ILE HG13 A 58 LEU HD2% 1.0 1.8 3.20 110 93 A 12 ILE H A 58 LEU HD2% 1.0 1.8 4.02 111 94 A 12 ILE HD1% A 58 LEU HD2% 1.0 1.8 3.39 112 95 A 12 ILE HD1% A 58 LEU HA 1.0 1.8 4.73 113 96 A 12 ILE HD1% A 58 LEU HG 1.0 1.8 4.26 114 97 A 12 ILE HD1% A 59 ILE H 1.0 1.8 5.24 115 98 A 13 SER H A 13 SER HBx 1.0 1.8 2.86 116 98 A 13 SER H A 13 SER HBy 1.0 1.8 2.86 117 99 A 13 SER HA A 13 SER HBx 1.0 1.8 3.04 118 99 A 13 SER HBy A 13 SER HA 1.0 1.8 3.04 119 100 A 14 VAL H A 13 SER HBx 1.0 1.8 3.67 120 100 A 13 SER HBy A 14 VAL H 1.0 1.8 3.67 121 101 A 13 SER HA A 14 VAL HG1% 1.0 1.8 4.24 122 102 A 13 SER HA A 14 VAL H 1.0 1.8 2.60 123 103 A 13 SER HA A 14 VAL HA 1.0 1.8 5.15 124 104 A 15 ASN H A 13 SER HBx 1.0 1.8 3.84 125 104 A 13 SER HBy A 15 ASN H 1.0 1.8 3.84 126 105 A 15 ASN HBy A 13 SER HBx 1.0 1.8 3.27 127 105 A 13 SER HBy A 15 ASN HBy 1.0 1.8 3.27 128 106 A 13 SER HA A 15 ASN H 1.0 1.8 3.90 129 107 A 16 ASP H A 13 SER HBx 1.0 1.8 3.44 130 107 A 16 ASP H A 13 SER HBy 1.0 1.8 3.44 131 108 A 16 ASP HBx A 13 SER HBx 1.0 1.8 4.02 132 108 A 13 SER HBy A 16 ASP HBx 1.0 1.8 4.02 133 109 A 16 ASP HBy A 13 SER HBx 1.0 1.8 4.61 134 109 A 13 SER HBy A 16 ASP HBy 1.0 1.8 4.61 135 110 A 13 SER H A 16 ASP HBx 1.0 1.8 4.61 136 111 A 14 VAL H A 14 VAL HB 1.0 1.8 3.73 137 112 A 14 VAL HG1% A 14 VAL HA 1.0 1.8 3.12 138 113 A 14 VAL HA A 14 VAL HG2% 1.0 1.8 3.61 139 114 A 14 VAL H A 14 VAL HG1% 1.0 1.8 3.11 140 115 A 14 VAL HG2% A 15 ASN HA 1.0 1.8 4.36 141 116 A 14 VAL H A 15 ASN HBx 1.0 1.8 5.50 142 117 A 14 VAL HG2% A 15 ASN HBx 1.0 1.8 5.33 143 118 A 15 ASN H A 14 VAL HB 1.0 1.8 4.45 144 119 A 14 VAL HA A 15 ASN HA 1.0 1.8 5.19 145 120 A 14 VAL H A 15 ASN H 1.0 1.8 3.27 146 121 A 14 VAL H A 15 ASN HA 1.0 1.8 4.93 147 122 A 14 VAL HG1% A 15 ASN HA 1.0 1.8 4.24 148 123 A 14 VAL HG1% A 15 ASN H 1.0 1.8 4.36 149 124 A 14 VAL HA A 15 ASN H 1.0 1.8 3.51 150 125 A 16 ASP H A 14 VAL HA 1.0 1.8 4.21 151 126 A 16 ASP H A 14 VAL HG2% 1.0 1.8 5.37 152 127 A 19 VAL HG2% A 14 VAL HA 1.0 1.8 4.74 153 128 A 19 VAL HG1% A 14 VAL HA 1.0 1.8 3.57 154 129 A 14 VAL HG2% A 20 LYS HGx 1.0 1.8 4.32 155 130 A 14 VAL HG2% A 20 LYS HA 1.0 1.8 3.47 156 131 A 14 VAL HG2% A 20 LYS H 1.0 1.8 4.31 157 132 A 14 VAL HG2% A 20 LYS HEx 1.0 1.8 4.10 158 132 A 14 VAL HG2% A 20 LYS HEy 1.0 1.8 4.10 159 133 A 14 VAL HA A 40 VAL HG1% 1.0 1.8 3.02 160 134 A 15 ASN HBy A 15 ASN HA 1.0 1.8 2.94 161 135 A 15 ASN H A 15 ASN HBy 1.0 1.8 3.20 162 136 A 15 ASN H A 15 ASN HBx 1.0 1.8 3.19 163 137 A 15 ASN H A 16 ASP HBy 1.0 1.8 5.25 164 138 A 16 ASP H A 15 ASN HA 1.0 1.8 3.61 165 139 A 16 ASP H A 15 ASN H 1.0 1.8 2.89 166 140 A 16 ASP H A 15 ASN HBx 1.0 1.8 4.71 167 141 A 16 ASP H A 15 ASN HBy 1.0 1.8 2.60 168 142 A 15 ASN HBy A 17 PRO HDy 1.0 1.8 5.04 169 142 A 15 ASN HBy A 17 PRO HDx 1.0 1.8 5.04 170 143 A 16 ASP H A 16 ASP HBx 1.0 1.8 2.90 171 144 A 16 ASP H A 16 ASP HBy 1.0 1.8 2.89 172 145 A 16 ASP HA A 17 PRO HGx 1.0 1.8 3.69 173 145 A 16 ASP HA A 17 PRO HGy 1.0 1.8 3.69 174 146 A 16 ASP HA A 17 PRO HDy 1.0 1.8 2.94 175 146 A 17 PRO HDx A 16 ASP HA 1.0 1.8 2.94 176 147 A 16 ASP HA A 17 PRO HA 1.0 1.8 4.62 177 148 A 16 ASP H A 17 PRO HDy 1.0 1.8 4.74 178 148 A 16 ASP H A 17 PRO HDx 1.0 1.8 4.74 179 149 A 16 ASP HA A 17 PRO HDy 1.0 1.8 3.82 180 150 A 16 ASP HBx A 18 ARG H 1.0 1.8 5.29 181 151 A 16 ASP HA A 18 ARG H 1.0 1.8 4.59 182 152 A 16 ASP HBy A 19 VAL HB 1.0 1.8 4.07 183 153 A 19 VAL HG2% A 16 ASP HBx 1.0 1.8 4.47 184 154 A 19 VAL HG1% A 16 ASP HBy 1.0 1.8 5.50 185 155 A 19 VAL HG2% A 16 ASP HBy 1.0 1.8 3.88 186 156 A 16 ASP H A 19 VAL HB 1.0 1.8 3.97 187 157 A 16 ASP H A 19 VAL HG2% 1.0 1.8 4.56 188 158 A 16 ASP HA A 19 VAL HB 1.0 1.8 4.60 189 159 A 17 PRO HBx A 18 ARG HA 1.0 1.8 4.03 190 160 A 18 ARG H A 17 PRO HDy 1.0 1.8 4.51 191 160 A 17 PRO HDx A 18 ARG H 1.0 1.8 4.51 192 161 A 18 ARG H A 17 PRO HGx 1.0 1.8 3.93 193 161 A 17 PRO HGy A 18 ARG H 1.0 1.8 3.93 194 162 A 18 ARG H A 17 PRO HDy 1.0 1.8 4.81 195 163 A 18 ARG H A 17 PRO HBy 1.0 1.8 4.31 196 164 A 18 ARG H A 17 PRO HBx 1.0 1.8 3.71 197 165 A 19 VAL H A 17 PRO HGx 1.0 1.8 5.40 198 165 A 19 VAL H A 17 PRO HGy 1.0 1.8 5.40 199 166 A 17 PRO HA A 20 LYS HBx 1.0 1.8 4.01 200 166 A 17 PRO HA A 20 LYS HBy 1.0 1.8 4.01 201 167 A 17 PRO HA A 20 LYS HDx 1.0 1.8 4.93 202 167 A 17 PRO HA A 20 LYS HDy 1.0 1.8 4.93 203 168 A 17 PRO HA A 20 LYS HGy 1.0 1.8 4.50 204 169 A 20 LYS H A 17 PRO HA 1.0 1.8 3.70 205 170 A 20 LYS HGx A 17 PRO HA 1.0 1.8 4.93 206 171 A 18 ARG H A 18 ARG HGx 1.0 1.8 4.01 207 172 A 18 ARG HA A 18 ARG HDy 1.0 1.8 3.63 208 173 A 18 ARG H A 18 ARG HDx 1.0 1.8 4.73 209 174 A 18 ARG HA A 18 ARG HGx 1.0 1.8 4.14 210 175 A 18 ARG H A 18 ARG HBx 1.0 1.8 2.74 211 175 A 18 ARG H A 18 ARG HBy 1.0 1.8 2.74 212 176 A 18 ARG H A 18 ARG HGy 1.0 1.8 4.12 213 177 A 18 ARG HA A 18 ARG HDx 1.0 1.8 3.88 214 178 A 18 ARG HA A 18 ARG HBx 1.0 1.8 2.96 215 178 A 18 ARG HA A 18 ARG HBy 1.0 1.8 2.96 216 179 A 18 ARG HDx A 18 ARG HBx 1.0 1.8 4.17 217 179 A 18 ARG HDx A 18 ARG HBy 1.0 1.8 4.17 218 180 A 18 ARG HA A 18 ARG HGy 1.0 1.8 3.92 219 181 A 19 VAL HA A 18 ARG H 1.0 1.8 5.07 220 182 A 19 VAL H A 18 ARG HGx 1.0 1.8 5.50 221 183 A 19 VAL HA A 18 ARG HBx 1.0 1.8 4.63 222 183 A 19 VAL HA A 18 ARG HBy 1.0 1.8 4.63 223 184 A 18 ARG H A 19 VAL HB 1.0 1.8 4.37 224 185 A 19 VAL H A 18 ARG H 1.0 1.8 2.97 225 186 A 19 VAL HG2% A 18 ARG H 1.0 1.8 4.31 226 187 A 19 VAL H A 18 ARG HGy 1.0 1.8 4.75 227 188 A 19 VAL H A 18 ARG HBx 1.0 1.8 3.22 228 188 A 19 VAL H A 18 ARG HBy 1.0 1.8 3.22 229 189 A 20 LYS H A 18 ARG H 1.0 1.8 4.06 230 190 A 20 LYS HGx A 18 ARG H 1.0 1.8 4.84 231 191 A 18 ARG HA A 21 GLU HGy 1.0 1.8 4.57 232 192 A 18 ARG HA A 21 GLU HGx 1.0 1.8 3.54 233 193 A 18 ARG H A 21 GLU H 1.0 1.8 4.84 234 194 A 18 ARG HDy A 22 ILE HD1% 1.0 1.8 5.37 235 195 A 18 ARG HGx A 22 ILE HD1% 1.0 1.8 4.21 236 196 A 22 ILE HD1% A 18 ARG HBx 1.0 1.8 5.50 237 196 A 18 ARG HBy A 22 ILE HD1% 1.0 1.8 5.50 238 197 A 52 TRP HZ2 A 18 ARG HBx 1.0 1.8 4.53 239 197 A 18 ARG HBy A 52 TRP HZ2 1.0 1.8 4.53 240 198 A 18 ARG HA A 52 TRP HH2 1.0 1.8 5.42 241 199 A 18 ARG HDy A 52 TRP HH2 1.0 1.8 4.34 242 200 A 18 ARG HDx A 52 TRP HH2 1.0 1.8 4.06 243 201 A 18 ARG HGx A 52 TRP HH2 1.0 1.8 4.33 244 202 A 18 ARG HGy A 52 TRP HH2 1.0 1.8 4.15 245 203 A 18 ARG H A 52 TRP HH2 1.0 1.8 5.36 246 204 A 18 ARG HDy A 56 TYR HE% 1.0 1.8 5.24 247 205 A 19 VAL HG1% A 19 VAL H 1.0 1.8 4.62 248 206 A 19 VAL HG2% A 19 VAL HA 1.0 1.8 3.38 249 207 A 19 VAL HG2% A 19 VAL H 1.0 1.8 3.03 250 208 A 19 VAL H A 19 VAL HB 1.0 1.8 2.97 251 209 A 19 VAL HG1% A 19 VAL HA 1.0 1.8 3.45 252 210 A 19 VAL H A 20 LYS HDx 1.0 1.8 5.38 253 210 A 19 VAL H A 20 LYS HDy 1.0 1.8 5.38 254 211 A 19 VAL H A 20 LYS H 1.0 1.8 2.72 255 212 A 20 LYS H A 19 VAL HB 1.0 1.8 3.36 256 213 A 19 VAL HG1% A 20 LYS H 1.0 1.8 3.97 257 214 A 19 VAL HG2% A 20 LYS H 1.0 1.8 4.38 258 215 A 19 VAL H A 20 LYS HGy 1.0 1.8 4.78 259 216 A 19 VAL HG2% A 21 GLU H 1.0 1.8 5.45 260 217 A 19 VAL HA A 21 GLU H 1.0 1.8 4.68 261 218 A 19 VAL HG2% A 22 ILE HD1% 1.0 1.8 5.50 262 219 A 19 VAL HA A 22 ILE HG2% 1.0 1.8 4.81 263 220 A 19 VAL HA A 22 ILE HD1% 1.0 1.8 3.96 264 221 A 19 VAL H A 22 ILE HB 1.0 1.8 4.90 265 222 A 19 VAL H A 22 ILE HD1% 1.0 1.8 5.50 266 223 A 19 VAL HA A 22 ILE H 1.0 1.8 3.78 267 224 A 19 VAL HA A 22 ILE HB 1.0 1.8 3.79 268 225 A 19 VAL HG1% A 22 ILE H 1.0 1.8 4.91 269 226 A 19 VAL HG2% A 22 ILE H 1.0 1.8 5.43 270 227 A 19 VAL HG1% A 23 ALA H 1.0 1.8 4.44 271 228 A 19 VAL HA A 23 ALA HB% 1.0 1.8 5.50 272 229 A 19 VAL HA A 23 ALA H 1.0 1.8 3.92 273 230 A 19 VAL HA A 40 VAL HG2% 1.0 1.8 5.30 274 230 A 19 VAL HA A 40 VAL HG1% 1.0 1.8 5.30 275 231 A 43 GLY H A 19 VAL HG1% 1.0 1.8 4.93 276 232 A 19 VAL HG2% A 45 ILE HG12 1.0 1.8 2.99 277 232 A 19 VAL HG2% A 45 ILE HG13 1.0 1.8 2.99 278 233 A 19 VAL HG2% A 45 ILE HA 1.0 1.8 5.43 279 234 A 19 VAL HG1% A 56 TYR HD% 1.0 1.8 4.10 280 235 A 19 VAL HA A 56 TYR HD% 1.0 1.8 5.08 281 236 A 19 VAL HA A 56 TYR HE% 1.0 1.8 4.69 282 237 A 19 VAL HG1% A 56 TYR HE% 1.0 1.8 4.92 283 238 A 56 TYR HD% A 19 VAL HB 1.0 1.8 5.15 284 239 A 19 VAL HG2% A 56 TYR HD% 1.0 1.8 4.71 285 240 A 19 VAL HG2% A 56 TYR HE% 1.0 1.8 3.92 286 241 A 20 LYS H A 20 LYS HGy 1.0 1.8 3.56 287 242 A 20 LYS HDy A 20 LYS HEx 1.0 1.8 2.96 288 242 A 20 LYS HDx A 20 LYS HEx 1.0 1.8 2.96 289 242 A 20 LYS HEy A 20 LYS HDx 1.0 1.8 2.96 290 242 A 20 LYS HEy A 20 LYS HDy 1.0 1.8 2.96 291 243 A 20 LYS HA A 20 LYS HGy 1.0 1.8 3.60 292 244 A 20 LYS HBy A 20 LYS HEx 1.0 1.8 3.91 293 244 A 20 LYS HBx A 20 LYS HEx 1.0 1.8 3.91 294 244 A 20 LYS HEy A 20 LYS HBx 1.0 1.8 3.91 295 244 A 20 LYS HEy A 20 LYS HBy 1.0 1.8 3.91 296 245 A 20 LYS H A 20 LYS HBx 1.0 1.8 2.82 297 245 A 20 LYS H A 20 LYS HBy 1.0 1.8 2.82 298 246 A 20 LYS HGx A 20 LYS HEx 1.0 1.8 3.93 299 246 A 20 LYS HGx A 20 LYS HEy 1.0 1.8 3.93 300 247 A 20 LYS HGy A 20 LYS HEx 1.0 1.8 3.69 301 247 A 20 LYS HEy A 20 LYS HGy 1.0 1.8 3.69 302 248 A 20 LYS HGx A 20 LYS H 1.0 1.8 4.71 303 249 A 20 LYS HA A 20 LYS HDx 1.0 1.8 4.60 304 249 A 20 LYS HA A 20 LYS HDy 1.0 1.8 4.60 305 250 A 21 GLU H A 20 LYS HBx 1.0 1.8 3.57 306 250 A 20 LYS HBy A 21 GLU H 1.0 1.8 3.57 307 251 A 20 LYS H A 21 GLU H 1.0 1.8 2.85 308 252 A 20 LYS HGy A 21 GLU H 1.0 1.8 4.70 309 253 A 20 LYS HGy A 21 GLU HA 1.0 1.8 4.38 310 254 A 20 LYS HGy A 22 ILE H 1.0 1.8 5.25 311 255 A 20 LYS HA A 23 ALA H 1.0 1.8 3.91 312 256 A 20 LYS HA A 40 VAL HG2% 1.0 1.8 3.41 313 256 A 20 LYS HA A 40 VAL HG1% 1.0 1.8 3.41 314 257 A 20 LYS H A 40 VAL HG2% 1.0 1.8 4.87 315 257 A 20 LYS H A 40 VAL HG1% 1.0 1.8 4.87 316 258 A 21 GLU H A 21 GLU HBx 1.0 1.8 3.58 317 259 A 21 GLU HGx A 21 GLU HA 1.0 1.8 3.76 318 260 A 21 GLU HGx A 21 GLU HBy 1.0 1.8 3.01 319 261 A 21 GLU HGy A 21 GLU H 1.0 1.8 3.45 320 262 A 21 GLU HA A 21 GLU HBx 1.0 1.8 2.78 321 263 A 21 GLU HGx A 21 GLU H 1.0 1.8 3.72 322 264 A 21 GLU H A 21 GLU HBy 1.0 1.8 2.89 323 265 A 21 GLU H A 22 ILE H 1.0 1.8 3.14 324 266 A 21 GLU HBx A 22 ILE HG1y 1.0 1.8 4.31 325 267 A 21 GLU H A 22 ILE HA 1.0 1.8 4.97 326 268 A 21 GLU H A 22 ILE HB 1.0 1.8 4.82 327 269 A 21 GLU HGx A 22 ILE H 1.0 1.8 4.83 328 270 A 22 ILE HD1% A 21 GLU HBx 1.0 1.8 5.50 329 271 A 21 GLU H A 22 ILE HG1y 1.0 1.8 4.59 330 272 A 21 GLU HGy A 22 ILE H 1.0 1.8 5.05 331 273 A 22 ILE H A 21 GLU HBx 1.0 1.8 3.79 332 274 A 22 ILE H A 21 GLU HBy 1.0 1.8 3.77 333 275 A 21 GLU HGy A 22 ILE HG1y 1.0 1.8 3.79 334 276 A 21 GLU H A 23 ALA H 1.0 1.8 4.56 335 277 A 22 ILE H A 22 ILE HG1y 1.0 1.8 3.66 336 278 A 22 ILE HG2% A 22 ILE H 1.0 1.8 4.04 337 279 A 22 ILE HG2% A 22 ILE HA 1.0 1.8 3.68 338 280 A 22 ILE HA A 22 ILE HG1x 1.0 1.8 3.99 339 281 A 22 ILE HD1% A 22 ILE HB 1.0 1.8 3.74 340 282 A 22 ILE HB A 22 ILE H 1.0 1.8 3.06 341 283 A 22 ILE HD1% A 22 ILE HG2% 1.0 1.8 3.51 342 284 A 22 ILE HD1% A 22 ILE HA 1.0 1.8 3.98 343 285 A 22 ILE HD1% A 22 ILE H 1.0 1.8 4.17 344 286 A 22 ILE H A 22 ILE HG1x 1.0 1.8 3.67 345 287 A 22 ILE H A 23 ALA H 1.0 1.8 3.47 346 288 A 22 ILE H A 23 ALA HA 1.0 1.8 5.32 347 289 A 22 ILE HB A 23 ALA H 1.0 1.8 3.32 348 290 A 22 ILE HD1% A 23 ALA H 1.0 1.8 5.30 349 291 A 22 ILE HG2% A 23 ALA H 1.0 1.8 4.03 350 292 A 22 ILE HA A 24 GLU H 1.0 1.8 4.98 351 293 A 22 ILE HG2% A 25 PHE H 1.0 1.8 5.50 352 294 A 22 ILE HA A 25 PHE HBx 1.0 1.8 4.41 353 295 A 22 ILE HG2% A 25 PHE HBy 1.0 1.8 4.85 354 296 A 22 ILE HA A 25 PHE HD% 1.0 1.8 5.36 355 297 A 22 ILE HA A 25 PHE H 1.0 1.8 3.79 356 298 A 22 ILE HA A 26 ALA H 1.0 1.8 4.93 357 299 A 22 ILE HD1% A 56 TYR HBy 1.0 1.8 5.08 358 300 A 22 ILE HD1% A 56 TYR HBx 1.0 1.8 5.34 359 301 A 22 ILE HG2% A 56 TYR HBy 1.0 1.8 4.58 360 302 A 56 TYR HD% A 22 ILE HG2% 1.0 1.8 4.16 361 303 A 22 ILE HD1% A 56 TYR H 1.0 1.8 5.50 362 304 A 22 ILE HG2% A 56 TYR H 1.0 1.8 5.07 363 305 A 22 ILE HG2% A 56 TYR HBx 1.0 1.8 4.41 364 306 A 22 ILE HD1% A 56 TYR HE% 1.0 1.8 3.54 365 307 A 56 TYR HD% A 22 ILE HD1% 1.0 1.8 4.47 366 308 A 22 ILE HD1% A 79 GLU HBx 1.0 1.8 5.26 367 309 A 22 ILE HD1% A 79 GLU HGx 1.0 1.8 5.50 368 309 A 22 ILE HD1% A 79 GLU HGy 1.0 1.8 5.50 369 310 A 22 ILE HD1% A 79 GLU HBy 1.0 1.8 5.43 370 311 A 22 ILE HG2% A 79 GLU HBy 1.0 1.8 4.10 371 312 A 22 ILE HA A 86 LEU HG 1.0 1.8 3.89 372 313 A 22 ILE H A 86 LEU HD1% 1.0 1.8 5.02 373 314 A 22 ILE HD1% A 86 LEU HBy 1.0 1.8 5.11 374 315 A 22 ILE HG1y A 86 LEU HG 1.0 1.8 4.45 375 316 A 22 ILE HD1% A 86 LEU HD1% 1.0 1.8 3.75 376 317 A 22 ILE HA A 86 LEU HD1% 1.0 1.8 5.40 377 318 A 22 ILE HG1y A 86 LEU HD1% 1.0 1.8 3.02 378 319 A 23 ALA H A 23 ALA HB% 1.0 1.8 3.07 379 320 A 23 ALA HB% A 24 GLU H 1.0 1.8 3.40 380 321 A 23 ALA H A 26 ALA HB% 1.0 1.8 4.70 381 322 A 23 ALA HA A 26 ALA HB% 1.0 1.8 3.68 382 323 A 23 ALA HB% A 40 VAL H 1.0 1.8 5.50 383 324 A 23 ALA H A 40 VAL HG2% 1.0 1.8 4.19 384 324 A 23 ALA H A 40 VAL HG1% 1.0 1.8 4.19 385 325 A 23 ALA HB% A 40 VAL HG2% 1.0 1.8 2.94 386 326 A 23 ALA HB% A 60 LEU HD2% 1.0 1.8 3.15 387 327 A 23 ALA HA A 60 LEU HD1% 1.0 1.8 4.26 388 328 A 23 ALA HA A 60 LEU HG 1.0 1.8 5.50 389 329 A 23 ALA HA A 60 LEU HD2% 1.0 1.8 3.92 390 330 A 24 GLU H A 24 GLU HBx 1.0 1.8 3.37 391 331 A 24 GLU H A 24 GLU HGx 1.0 1.8 3.67 392 332 A 24 GLU HGx A 24 GLU HA 1.0 1.8 3.71 393 333 A 24 GLU H A 24 GLU HBy 1.0 1.8 3.23 394 334 A 25 PHE H A 24 GLU HBx 1.0 1.8 3.71 395 335 A 24 GLU H A 25 PHE HBy 1.0 1.8 5.26 396 336 A 24 GLU H A 25 PHE H 1.0 1.8 3.16 397 337 A 25 PHE H A 24 GLU HGy 1.0 1.8 4.77 398 338 A 25 PHE H A 24 GLU HGx 1.0 1.8 4.74 399 339 A 24 GLU H A 26 ALA HB% 1.0 1.8 4.73 400 340 A 24 GLU H A 26 ALA H 1.0 1.8 3.89 401 341 A 24 GLU HA A 27 LEU HBy 1.0 1.8 4.60 402 342 A 24 GLU HA A 27 LEU H 1.0 1.8 3.83 403 343 A 24 GLU HA A 27 LEU HD2% 1.0 1.8 3.59 404 344 A 24 GLU HGx A 28 LYS HGx 1.0 1.8 5.14 405 345 A 24 GLU HGy A 28 LYS HGx 1.0 1.8 4.67 406 346 A 24 GLU H A 40 VAL HG2% 1.0 1.8 4.13 407 346 A 40 VAL HG1% A 24 GLU H 1.0 1.8 4.13 408 347 A 24 GLU HA A 40 VAL HG2% 1.0 1.8 4.98 409 348 A 24 GLU H A 40 VAL HG2% 1.0 1.8 3.84 410 349 A 86 LEU HG A 24 GLU HGx 1.0 1.8 4.73 411 350 A 25 PHE H A 25 PHE HBx 1.0 1.8 3.21 412 351 A 25 PHE HD% A 25 PHE HA 1.0 1.8 3.58 413 352 A 25 PHE H A 25 PHE HBy 1.0 1.8 3.19 414 353 A 25 PHE HA A 25 PHE HE% 1.0 1.8 5.37 415 354 A 25 PHE HBy A 26 ALA H 1.0 1.8 3.65 416 355 A 25 PHE HD% A 26 ALA HB% 1.0 1.8 4.60 417 356 A 25 PHE HBx A 26 ALA H 1.0 1.8 4.00 418 357 A 25 PHE HD% A 26 ALA HA 1.0 1.8 3.98 419 358 A 25 PHE HD% A 26 ALA H 1.0 1.8 3.64 420 359 A 25 PHE H A 28 LYS HGx 1.0 1.8 5.01 421 360 A 25 PHE HA A 28 LYS HBx 1.0 1.8 3.83 422 360 A 25 PHE HA A 28 LYS HBy 1.0 1.8 3.83 423 361 A 25 PHE HD% A 28 LYS HGy 1.0 1.8 4.64 424 362 A 25 PHE HE% A 28 LYS HEx 1.0 1.8 5.34 425 362 A 25 PHE HE% A 28 LYS HEy 1.0 1.8 5.34 426 363 A 25 PHE HA A 28 LYS HEx 1.0 1.8 4.32 427 363 A 25 PHE HA A 28 LYS HEy 1.0 1.8 4.32 428 364 A 25 PHE HD% A 28 LYS HDx 1.0 1.8 4.50 429 364 A 25 PHE HD% A 28 LYS HDy 1.0 1.8 4.50 430 365 A 25 PHE HD% A 29 GLN HBx 1.0 1.8 4.63 431 366 A 25 PHE HE% A 29 GLN HGx 1.0 1.8 3.64 432 366 A 25 PHE HE% A 29 GLN HGy 1.0 1.8 3.64 433 367 A 25 PHE HD% A 29 GLN HGx 1.0 1.8 4.54 434 367 A 25 PHE HD% A 29 GLN HGy 1.0 1.8 4.54 435 368 A 25 PHE HD% A 29 GLN HBy 1.0 1.8 4.36 436 369 A 25 PHE HE% A 29 GLN HBx 1.0 1.8 4.37 437 370 A 25 PHE HE% A 29 GLN H 1.0 1.8 5.06 438 371 A 25 PHE HE% A 29 GLN HA 1.0 1.8 4.43 439 372 A 25 PHE HD% A 77 VAL HG1% 1.0 1.8 3.58 440 373 A 25 PHE HD% A 86 LEU HG 1.0 1.8 3.92 441 374 A 86 LEU HG A 25 PHE HA 1.0 1.8 5.27 442 375 A 25 PHE H A 86 LEU HD2% 1.0 1.8 4.37 443 376 A 25 PHE HD% A 86 LEU HBx 1.0 1.8 4.44 444 377 A 25 PHE HD% A 86 LEU HD1% 1.0 1.8 5.50 445 378 A 25 PHE HBy A 86 LEU HG 1.0 1.8 4.34 446 379 A 25 PHE H A 86 LEU HG 1.0 1.8 4.59 447 380 A 25 PHE HD% A 86 LEU HBy 1.0 1.8 4.50 448 381 A 25 PHE HBx A 86 LEU HG 1.0 1.8 4.03 449 382 A 25 PHE HD% A 87 LYS HBx 1.0 1.8 5.47 450 382 A 25 PHE HD% A 87 LYS HBy 1.0 1.8 5.47 451 383 A 25 PHE HE% A 87 LYS HA 1.0 1.8 4.80 452 384 A 25 PHE HD% A 87 LYS H 1.0 1.8 5.00 453 385 A 25 PHE HD% A 87 LYS HA 1.0 1.8 3.94 454 386 A 25 PHE HE% A 87 LYS HBx 1.0 1.8 4.15 455 386 A 25 PHE HE% A 87 LYS HBy 1.0 1.8 4.15 456 387 A 25 PHE HD% A 88 LEU HD2% 1.0 1.8 4.81 457 388 A 25 PHE HD% A 88 LEU HA 1.0 1.8 4.62 458 389 A 25 PHE HD% A 88 LEU H 1.0 1.8 3.71 459 390 A 25 PHE HD% A 88 LEU HBx 1.0 1.8 4.21 460 391 A 25 PHE HD% A 88 LEU HD1% 1.0 1.8 5.50 461 392 A 25 PHE HD% A 88 LEU HBy 1.0 1.8 4.42 462 393 A 26 ALA H A 26 ALA HB% 1.0 1.8 3.08 463 394 A 26 ALA H A 27 LEU H 1.0 1.8 3.44 464 395 A 26 ALA HB% A 27 LEU H 1.0 1.8 3.49 465 396 A 26 ALA HA A 29 GLN H 1.0 1.8 4.36 466 397 A 26 ALA HA A 75 VAL HG2% 1.0 1.8 4.91 467 398 A 26 ALA HB% A 75 VAL HG2% 1.0 1.8 3.67 468 399 A 26 ALA HB% A 75 VAL HG1% 1.0 1.8 4.06 469 400 A 26 ALA HB% A 75 VAL HG2% 1.0 1.8 3.83 470 400 A 26 ALA HB% A 75 VAL HG1% 1.0 1.8 3.83 471 401 A 26 ALA HA A 77 VAL HG1% 1.0 1.8 4.00 472 402 A 26 ALA H A 86 LEU HG 1.0 1.8 5.44 473 403 A 26 ALA HA A 88 LEU H 1.0 1.8 5.33 474 404 A 26 ALA HA A 88 LEU HD1% 1.0 1.8 4.30 475 405 A 26 ALA H A 88 LEU HD2% 1.0 1.8 5.50 476 406 A 26 ALA HB% A 88 LEU HD2% 1.0 1.8 3.73 477 407 A 26 ALA HA A 88 LEU HD2% 1.0 1.8 3.49 478 408 A 26 ALA HB% A 91 PHE HE% 1.0 1.8 4.58 479 409 A 26 ALA HB% A 91 PHE HD% 1.0 1.8 4.26 480 410 A 27 LEU HA A 27 LEU HD1% 1.0 1.8 3.12 481 411 A 27 LEU H A 27 LEU HD2% 1.0 1.8 4.15 482 412 A 27 LEU H A 27 LEU HG 1.0 1.8 4.15 483 413 A 27 LEU H A 27 LEU HBx 1.0 1.8 3.67 484 414 A 27 LEU HD2% A 27 LEU HBx 1.0 1.8 3.59 485 415 A 27 LEU HD2% A 27 LEU HA 1.0 1.8 4.92 486 416 A 27 LEU H A 27 LEU HD1% 1.0 1.8 4.41 487 417 A 27 LEU HG A 27 LEU HBx 1.0 1.8 3.01 488 418 A 27 LEU HBy A 27 LEU H 1.0 1.8 2.81 489 419 A 27 LEU HA A 27 LEU HG 1.0 1.8 3.74 490 420 A 27 LEU HBy A 28 LYS H 1.0 1.8 4.01 491 421 A 27 LEU HD1% A 28 LYS HA 1.0 1.8 4.05 492 422 A 27 LEU HG A 28 LYS H 1.0 1.8 2.88 493 423 A 27 LEU HBx A 28 LYS H 1.0 1.8 4.37 494 424 A 27 LEU H A 28 LYS H 1.0 1.8 3.27 495 425 A 27 LEU HD2% A 28 LYS H 1.0 1.8 4.40 496 426 A 27 LEU HD2% A 36 ILE HA 1.0 1.8 4.53 497 427 A 27 LEU HBx A 37 LEU H 1.0 1.8 4.26 498 428 A 27 LEU HD1% A 37 LEU HA 1.0 1.8 5.18 499 429 A 27 LEU HD2% A 37 LEU H 1.0 1.8 3.77 500 430 A 27 LEU HA A 37 LEU HD1% 1.0 1.8 4.50 501 430 A 27 LEU HA A 37 LEU HD2% 1.0 1.8 4.50 502 431 A 27 LEU HD2% A 37 LEU HBx 1.0 1.8 3.51 503 432 A 27 LEU HD2% A 37 LEU HA 1.0 1.8 3.88 504 433 A 27 LEU HD2% A 38 ALA H 1.0 1.8 5.07 505 434 A 91 PHE HE% A 27 LEU HA 1.0 1.8 3.90 506 435 A 91 PHE HE% A 27 LEU HD1% 1.0 1.8 3.58 507 436 A 91 PHE HD% A 27 LEU HA 1.0 1.8 5.14 508 437 A 91 PHE HE% A 27 LEU HBx 1.0 1.8 4.03 509 438 A 28 LYS H A 28 LYS HBx 1.0 1.8 3.06 510 438 A 28 LYS HBy A 28 LYS H 1.0 1.8 3.06 511 439 A 28 LYS HGx A 28 LYS HEx 1.0 1.8 3.95 512 439 A 28 LYS HGx A 28 LYS HEy 1.0 1.8 3.95 513 440 A 28 LYS H A 28 LYS HDx 1.0 1.8 4.95 514 440 A 28 LYS HDy A 28 LYS H 1.0 1.8 4.95 515 441 A 28 LYS HGy A 28 LYS HBx 1.0 1.8 2.99 516 441 A 28 LYS HBy A 28 LYS HGy 1.0 1.8 2.99 517 442 A 28 LYS HBy A 28 LYS HEx 1.0 1.8 4.65 518 442 A 28 LYS HEy A 28 LYS HBx 1.0 1.8 4.65 519 442 A 28 LYS HBy A 28 LYS HEy 1.0 1.8 4.65 520 442 A 28 LYS HBx A 28 LYS HEx 1.0 1.8 4.65 521 443 A 28 LYS HGy A 28 LYS HDx 1.0 1.8 2.45 522 443 A 28 LYS HGy A 28 LYS HDy 1.0 1.8 2.45 523 444 A 28 LYS HGx A 28 LYS H 1.0 1.8 4.12 524 445 A 28 LYS HDy A 28 LYS HEx 1.0 1.8 2.97 525 445 A 28 LYS HDx A 28 LYS HEx 1.0 1.8 2.97 526 445 A 28 LYS HEy A 28 LYS HDx 1.0 1.8 2.97 527 445 A 28 LYS HEy A 28 LYS HDy 1.0 1.8 2.97 528 446 A 28 LYS HGx A 28 LYS HDx 1.0 1.8 2.89 529 446 A 28 LYS HGx A 28 LYS HDy 1.0 1.8 2.89 530 447 A 28 LYS HGy A 28 LYS HEx 1.0 1.8 4.18 531 447 A 28 LYS HGy A 28 LYS HEy 1.0 1.8 4.18 532 448 A 28 LYS HGy A 28 LYS H 1.0 1.8 3.82 533 449 A 28 LYS HGy A 28 LYS HA 1.0 1.8 3.91 534 450 A 28 LYS HA A 28 LYS HDx 1.0 1.8 4.52 535 450 A 28 LYS HDy A 28 LYS HA 1.0 1.8 4.52 536 451 A 28 LYS HGx A 28 LYS HA 1.0 1.8 4.13 537 452 A 29 GLN H A 28 LYS H 1.0 1.8 3.32 538 453 A 28 LYS HGy A 29 GLN H 1.0 1.8 5.08 539 454 A 29 GLN HA A 28 LYS HDx 1.0 1.8 4.36 540 454 A 28 LYS HDy A 29 GLN HA 1.0 1.8 4.36 541 455 A 29 GLN HA A 28 LYS HBx 1.0 1.8 4.93 542 455 A 28 LYS HBy A 29 GLN HA 1.0 1.8 4.93 543 456 A 29 GLN H A 28 LYS HBx 1.0 1.8 4.03 544 456 A 28 LYS HBy A 29 GLN H 1.0 1.8 4.03 545 457 A 29 GLN HA A 29 GLN HGx 1.0 1.8 3.12 546 457 A 29 GLN HGy A 29 GLN HA 1.0 1.8 3.12 547 458 A 29 GLN HBx A 29 GLN H 1.0 1.8 3.33 548 459 A 29 GLN H A 29 GLN HGx 1.0 1.8 4.48 549 459 A 29 GLN HGy A 29 GLN H 1.0 1.8 4.48 550 460 A 29 GLN HBy A 29 GLN H 1.0 1.8 2.74 551 461 A 29 GLN H A 30 HIS HBx 1.0 1.8 4.89 552 462 A 29 GLN H A 30 HIS H 1.0 1.8 3.05 553 463 A 29 GLN HBy A 30 HIS H 1.0 1.8 4.03 554 464 A 29 GLN HA A 30 HIS HA 1.0 1.8 4.64 555 465 A 29 GLN HA A 31 ALA HB% 1.0 1.8 5.40 556 466 A 29 GLN H A 31 ALA HB% 1.0 1.8 5.11 557 467 A 29 GLN H A 88 LEU HD1% 1.0 1.8 4.97 558 468 A 29 GLN HA A 88 LEU HD1% 1.0 1.8 5.49 559 469 A 88 LEU H A 29 GLN HGx 1.0 1.8 4.96 560 469 A 29 GLN HGy A 88 LEU H 1.0 1.8 4.96 561 470 A 30 HIS HBx A 30 HIS H 1.0 1.8 3.20 562 471 A 30 HIS HA A 30 HIS HD2 1.0 1.8 5.16 563 472 A 30 HIS H A 30 HIS HBy 1.0 1.8 3.18 564 473 A 31 ALA HB% A 30 HIS HD2 1.0 1.8 4.57 565 474 A 30 HIS HA A 31 ALA HB% 1.0 1.8 4.18 566 475 A 31 ALA HB% A 30 HIS HBy 1.0 1.8 4.59 567 476 A 30 HIS HBy A 31 ALA H 1.0 1.8 3.83 568 477 A 30 HIS HBx A 31 ALA H 1.0 1.8 4.86 569 478 A 30 HIS HD2 A 31 ALA H 1.0 1.8 5.31 570 479 A 30 HIS HBy A 32 GLU H 1.0 1.8 5.41 571 480 A 30 HIS HA A 32 GLU H 1.0 1.8 3.93 572 481 A 30 HIS HD2 A 32 GLU HBy 1.0 1.8 5.22 573 482 A 30 HIS HD2 A 32 GLU H 1.0 1.8 4.87 574 483 A 30 HIS HD2 A 33 GLN H 1.0 1.8 5.20 575 484 A 30 HIS HD2 A 35 LEU HD2% 1.0 1.8 4.41 576 484 A 30 HIS HD2 A 35 LEU HD1% 1.0 1.8 4.41 577 485 A 30 HIS HBy A 35 LEU HD2% 1.0 1.8 4.94 578 486 A 30 HIS HD2 A 35 LEU HD2% 1.0 1.8 4.02 579 487 A 30 HIS HBy A 35 LEU HD2% 1.0 1.8 5.03 580 487 A 30 HIS HBy A 35 LEU HD1% 1.0 1.8 5.03 581 488 A 30 HIS HBx A 35 LEU HD2% 1.0 1.8 5.37 582 489 A 88 LEU HD1% A 30 HIS HA 1.0 1.8 4.46 583 490 A 88 LEU HD1% A 30 HIS HD2 1.0 1.8 4.82 584 491 A 88 LEU HD1% A 30 HIS HBy 1.0 1.8 4.76 585 492 A 88 LEU HD1% A 30 HIS HBx 1.0 1.8 4.66 586 493 A 88 LEU HD1% A 30 HIS H 1.0 1.8 4.69 587 494 A 30 HIS HBx A 91 PHE HBy 1.0 1.8 5.12 588 495 A 30 HIS HA A 91 PHE HBy 1.0 1.8 5.26 589 496 A 31 ALA HB% A 31 ALA H 1.0 1.8 3.07 590 497 A 31 ALA H A 31 ALA HA 1.0 1.8 2.91 591 498 A 31 ALA H A 32 GLU H 1.0 1.8 3.15 592 499 A 31 ALA HB% A 32 GLU H 1.0 1.8 3.66 593 500 A 32 GLU H A 31 ALA HA 1.0 1.8 2.90 594 501 A 31 ALA HB% A 33 GLN H 1.0 1.8 5.04 595 502 A 31 ALA HA A 34 ASN HA 1.0 1.8 4.02 596 503 A 31 ALA HB% A 34 ASN HBx 1.0 1.8 4.83 597 504 A 31 ALA H A 34 ASN H 1.0 1.8 5.22 598 505 A 31 ALA HB% A 34 ASN H 1.0 1.8 4.86 599 506 A 31 ALA HA A 34 ASN H 1.0 1.8 4.25 600 507 A 32 GLU H A 32 GLU HBy 1.0 1.8 3.55 601 508 A 32 GLU H A 32 GLU HBx 1.0 1.8 3.52 602 509 A 32 GLU H A 32 GLU HA 1.0 1.8 2.76 603 510 A 32 GLU H A 32 GLU HGx 1.0 1.8 3.52 604 510 A 32 GLU H A 32 GLU HGy 1.0 1.8 3.52 605 511 A 32 GLU HA A 32 GLU HGx 1.0 1.8 3.67 606 511 A 32 GLU HA A 32 GLU HGy 1.0 1.8 3.67 607 512 A 33 GLN HA A 32 GLU HGx 1.0 1.8 3.35 608 512 A 32 GLU HGy A 33 GLN HA 1.0 1.8 3.35 609 513 A 32 GLU H A 33 GLN H 1.0 1.8 3.53 610 514 A 32 GLU HBy A 33 GLN H 1.0 1.8 3.17 611 515 A 32 GLU HGy A 33 GLN HGx 1.0 1.8 2.40 612 515 A 32 GLU HGx A 33 GLN HGx 1.0 1.8 2.40 613 515 A 33 GLN HGy A 32 GLU HGx 1.0 1.8 2.40 614 515 A 32 GLU HGy A 33 GLN HGy 1.0 1.8 2.40 615 516 A 33 GLN H A 32 GLU HA 1.0 1.8 3.44 616 517 A 33 GLN H A 33 GLN HGx 1.0 1.8 3.72 617 517 A 33 GLN H A 33 GLN HGy 1.0 1.8 3.72 618 518 A 33 GLN H A 33 GLN HBy 1.0 1.8 3.78 619 519 A 33 GLN H A 33 GLN HBx 1.0 1.8 3.51 620 520 A 33 GLN HA A 33 GLN HGx 1.0 1.8 3.42 621 520 A 33 GLN HA A 33 GLN HGy 1.0 1.8 3.42 622 521 A 33 GLN HBy A 33 GLN HGx 1.0 1.8 2.84 623 521 A 33 GLN HGy A 33 GLN HBy 1.0 1.8 2.84 624 522 A 33 GLN HBx A 33 GLN HGx 1.0 1.8 3.01 625 522 A 33 GLN HGy A 33 GLN HBx 1.0 1.8 3.01 626 523 A 34 ASN H A 33 GLN HBx 1.0 1.8 4.88 627 524 A 34 ASN H A 33 GLN HGx 1.0 1.8 4.06 628 524 A 34 ASN H A 33 GLN HGy 1.0 1.8 4.06 629 525 A 33 GLN H A 34 ASN H 1.0 1.8 3.22 630 526 A 34 ASN H A 33 GLN HBy 1.0 1.8 4.00 631 527 A 33 GLN HGy A 35 LEU HD2% 1.0 1.8 4.53 632 527 A 33 GLN HGx A 35 LEU HD2% 1.0 1.8 4.53 633 528 A 33 GLN HGy A 35 LEU HD2% 1.0 1.8 5.50 634 528 A 33 GLN HGx A 35 LEU HD2% 1.0 1.8 5.50 635 528 A 35 LEU HD1% A 33 GLN HGx 1.0 1.8 5.50 636 528 A 35 LEU HD1% A 33 GLN HGy 1.0 1.8 5.50 637 529 A 34 ASN HA A 34 ASN H 1.0 1.8 2.89 638 530 A 34 ASN HBx A 34 ASN H 1.0 1.8 3.26 639 531 A 34 ASN H A 34 ASN HBy 1.0 1.8 3.47 640 532 A 34 ASN HA A 35 LEU HD2% 1.0 1.8 5.49 641 532 A 35 LEU HD1% A 34 ASN HA 1.0 1.8 5.49 642 533 A 34 ASN HBy A 35 LEU H 1.0 1.8 5.50 643 534 A 34 ASN HBx A 35 LEU H 1.0 1.8 4.54 644 535 A 34 ASN HA A 35 LEU H 1.0 1.8 2.93 645 536 A 34 ASN H A 35 LEU H 1.0 1.8 3.61 646 537 A 35 LEU H A 35 LEU HD2% 1.0 1.8 3.84 647 538 A 35 LEU H A 35 LEU HG 1.0 1.8 3.64 648 539 A 35 LEU HD1% A 35 LEU HBx 1.0 1.8 3.42 649 540 A 35 LEU H A 35 LEU HBx 1.0 1.8 3.85 650 541 A 35 LEU H A 35 LEU HD2% 1.0 1.8 3.97 651 541 A 35 LEU HD1% A 35 LEU H 1.0 1.8 3.97 652 542 A 35 LEU HBy A 35 LEU HD2% 1.0 1.8 3.40 653 543 A 35 LEU HG A 35 LEU HA 1.0 1.8 3.95 654 544 A 35 LEU HA A 35 LEU HD2% 1.0 1.8 3.46 655 544 A 35 LEU HD1% A 35 LEU HA 1.0 1.8 3.46 656 545 A 35 LEU H A 35 LEU HBy 1.0 1.8 3.38 657 546 A 35 LEU HA A 36 ILE HG1x 1.0 1.8 3.68 658 547 A 36 ILE HA A 35 LEU HBx 1.0 1.8 5.38 659 548 A 35 LEU HBx A 36 ILE H 1.0 1.8 4.18 660 549 A 36 ILE H A 35 LEU HD2% 1.0 1.8 3.96 661 549 A 35 LEU HD1% A 36 ILE H 1.0 1.8 3.96 662 550 A 35 LEU HA A 36 ILE H 1.0 1.8 3.01 663 551 A 35 LEU HA A 36 ILE HB 1.0 1.8 5.07 664 552 A 35 LEU H A 36 ILE H 1.0 1.8 4.53 665 553 A 35 LEU HD1% A 36 ILE H 1.0 1.8 3.86 666 554 A 35 LEU HA A 36 ILE HG1y 1.0 1.8 4.35 667 555 A 37 LEU H A 35 LEU HG 1.0 1.8 5.09 668 556 A 62 ALA HA A 35 LEU HD2% 1.0 1.8 5.50 669 556 A 35 LEU HD1% A 62 ALA HA 1.0 1.8 5.50 670 557 A 35 LEU HG A 62 ALA HB% 1.0 1.8 3.89 671 558 A 35 LEU HD1% A 62 ALA HA 1.0 1.8 5.50 672 559 A 35 LEU HBx A 62 ALA HB% 1.0 1.8 4.52 673 560 A 35 LEU HD1% A 62 ALA HB% 1.0 1.8 3.36 674 561 A 35 LEU HA A 64 HIS HD2 1.0 1.8 3.33 675 562 A 35 LEU HD1% A 73 TYR HE% 1.0 1.8 4.74 676 563 A 73 TYR HE% A 35 LEU HD2% 1.0 1.8 5.22 677 564 A 73 TYR HD% A 35 LEU HD2% 1.0 1.8 4.17 678 565 A 35 LEU HD1% A 73 TYR HBy 1.0 1.8 4.72 679 566 A 91 PHE HE% A 35 LEU HD2% 1.0 1.8 4.18 680 567 A 36 ILE H A 36 ILE HD1% 1.0 1.8 4.82 681 568 A 36 ILE HG1x A 36 ILE HG2% 1.0 1.8 3.75 682 569 A 36 ILE HA A 36 ILE HG1x 1.0 1.8 4.15 683 570 A 36 ILE H A 36 ILE HG1y 1.0 1.8 3.89 684 571 A 36 ILE H A 36 ILE HB 1.0 1.8 3.26 685 572 A 36 ILE HA A 36 ILE HG1y 1.0 1.8 4.10 686 573 A 36 ILE HA A 36 ILE HG2% 1.0 1.8 3.26 687 574 A 36 ILE HA A 37 LEU H 1.0 1.8 2.77 688 575 A 37 LEU H A 36 ILE HG2% 1.0 1.8 3.54 689 576 A 37 LEU H A 36 ILE HB 1.0 1.8 4.29 690 577 A 36 ILE HA A 37 LEU HBy 1.0 1.8 4.68 691 578 A 36 ILE HA A 37 LEU HBx 1.0 1.8 5.10 692 579 A 36 ILE HG2% A 38 ALA HA 1.0 1.8 4.76 693 580 A 62 ALA HA A 36 ILE HG2% 1.0 1.8 5.18 694 581 A 36 ILE HA A 63 LYS HEx 1.0 1.8 4.83 695 581 A 36 ILE HA A 63 LYS HEy 1.0 1.8 4.83 696 582 A 36 ILE HG2% A 63 LYS H 1.0 1.8 5.22 697 583 A 36 ILE HB A 63 LYS H 1.0 1.8 4.03 698 584 A 36 ILE HB A 63 LYS HEx 1.0 1.8 5.38 699 584 A 36 ILE HB A 63 LYS HEy 1.0 1.8 5.38 700 585 A 36 ILE HD1% A 63 LYS HBx 1.0 1.8 5.13 701 586 A 36 ILE HG2% A 63 LYS HEx 1.0 1.8 4.52 702 586 A 36 ILE HG2% A 63 LYS HEy 1.0 1.8 4.52 703 587 A 36 ILE HD1% A 63 LYS HEx 1.0 1.8 4.74 704 587 A 36 ILE HD1% A 63 LYS HEy 1.0 1.8 4.74 705 588 A 36 ILE HD1% A 63 LYS HA 1.0 1.8 5.04 706 589 A 36 ILE HD1% A 63 LYS H 1.0 1.8 4.56 707 590 A 36 ILE HD1% A 64 HIS HBy 1.0 1.8 4.32 708 591 A 36 ILE HD1% A 64 HIS HA 1.0 1.8 3.64 709 592 A 36 ILE HD1% A 64 HIS H 1.0 1.8 4.61 710 593 A 36 ILE HD1% A 64 HIS HBx 1.0 1.8 4.75 711 594 A 36 ILE H A 64 HIS HD2 1.0 1.8 4.88 712 595 A 36 ILE HD1% A 65 SER HA 1.0 1.8 4.17 713 596 A 36 ILE HD1% A 65 SER H 1.0 1.8 4.82 714 597 A 37 LEU HA A 37 LEU HD1% 1.0 1.8 3.30 715 597 A 37 LEU HA A 37 LEU HD2% 1.0 1.8 3.30 716 598 A 37 LEU H A 37 LEU HD1% 1.0 1.8 4.11 717 598 A 37 LEU H A 37 LEU HD2% 1.0 1.8 4.11 718 599 A 37 LEU H A 37 LEU HBy 1.0 1.8 3.15 719 600 A 37 LEU H A 37 LEU HBx 1.0 1.8 3.14 720 601 A 37 LEU HBx A 37 LEU HD1% 1.0 1.8 4.10 721 601 A 37 LEU HD2% A 37 LEU HBx 1.0 1.8 4.10 722 602 A 37 LEU HA A 37 LEU HG 1.0 1.8 4.09 723 603 A 37 LEU H A 38 ALA H 1.0 1.8 4.88 724 604 A 38 ALA H A 37 LEU HBy 1.0 1.8 4.53 725 605 A 37 LEU HA A 38 ALA HB% 1.0 1.8 4.34 726 606 A 38 ALA H A 37 LEU HD1% 1.0 1.8 3.55 727 606 A 37 LEU HD2% A 38 ALA H 1.0 1.8 3.55 728 607 A 37 LEU HA A 38 ALA H 1.0 1.8 3.04 729 608 A 37 LEU HBx A 39 GLY H 1.0 1.8 4.77 730 609 A 37 LEU HA A 39 GLY H 1.0 1.8 4.15 731 610 A 39 GLY H A 37 LEU HD1% 1.0 1.8 3.20 732 610 A 37 LEU HD2% A 39 GLY H 1.0 1.8 3.20 733 611 A 37 LEU HG A 39 GLY H 1.0 1.8 4.02 734 612 A 60 LEU HBy A 37 LEU HD1% 1.0 1.8 4.27 735 612 A 37 LEU HD2% A 60 LEU HBy 1.0 1.8 4.27 736 613 A 60 LEU HA A 37 LEU HD1% 1.0 1.8 3.88 737 613 A 37 LEU HD2% A 60 LEU HA 1.0 1.8 3.88 738 614 A 61 SER H A 37 LEU HD1% 1.0 1.8 4.17 739 614 A 37 LEU HD2% A 61 SER H 1.0 1.8 4.17 740 615 A 62 ALA HA A 37 LEU HD1% 1.0 1.8 4.74 741 615 A 37 LEU HD2% A 62 ALA HA 1.0 1.8 4.74 742 616 A 37 LEU HA A 62 ALA HA 1.0 1.8 3.85 743 617 A 37 LEU HA A 62 ALA HB% 1.0 1.8 4.15 744 618 A 37 LEU HA A 73 TYR HD% 1.0 1.8 5.30 745 619 A 73 TYR H A 37 LEU HD1% 1.0 1.8 4.46 746 619 A 37 LEU HD2% A 73 TYR H 1.0 1.8 4.46 747 620 A 73 TYR HD% A 37 LEU HD1% 1.0 1.8 5.49 748 620 A 37 LEU HD2% A 73 TYR HD% 1.0 1.8 5.49 749 621 A 73 TYR HBy A 37 LEU HD1% 1.0 1.8 4.37 750 621 A 37 LEU HD2% A 73 TYR HBy 1.0 1.8 4.37 751 622 A 38 ALA H A 38 ALA HB% 1.0 1.8 3.28 752 623 A 38 ALA HB% A 39 GLY HAx 1.0 1.8 5.50 753 624 A 38 ALA HB% A 39 GLY H 1.0 1.8 3.55 754 625 A 38 ALA H A 39 GLY H 1.0 1.8 3.02 755 626 A 38 ALA HB% A 61 SER HBx 1.0 1.8 3.26 756 626 A 38 ALA HB% A 61 SER HBy 1.0 1.8 3.26 757 627 A 38 ALA HB% A 61 SER H 1.0 1.8 5.44 758 628 A 38 ALA HB% A 61 SER HA 1.0 1.8 5.02 759 629 A 38 ALA H A 61 SER HBx 1.0 1.8 4.89 760 629 A 38 ALA H A 61 SER HBy 1.0 1.8 4.89 761 630 A 62 ALA HA A 38 ALA HB% 1.0 1.8 3.86 762 631 A 38 ALA H A 62 ALA HA 1.0 1.8 3.29 763 632 A 38 ALA H A 62 ALA H 1.0 1.8 5.34 764 633 A 38 ALA HB% A 62 ALA H 1.0 1.8 5.11 765 634 A 38 ALA H A 62 ALA HB% 1.0 1.8 4.17 766 635 A 38 ALA H A 63 LYS H 1.0 1.8 4.42 767 636 A 63 LYS H A 38 ALA HB% 1.0 1.8 3.82 768 637 A 38 ALA HB% A 63 LYS HEx 1.0 1.8 3.92 769 637 A 63 LYS HEy A 38 ALA HB% 1.0 1.8 3.92 770 638 A 38 ALA HB% A 70 SER HBx 1.0 1.8 4.11 771 639 A 38 ALA HB% A 70 SER HA 1.0 1.8 5.29 772 640 A 40 VAL H A 39 GLY HAx 1.0 1.8 3.00 773 641 A 39 GLY HAx A 40 VAL HG2% 1.0 1.8 4.44 774 641 A 40 VAL HG1% A 39 GLY HAx 1.0 1.8 4.44 775 642 A 40 VAL H A 39 GLY H 1.0 1.8 4.36 776 643 A 40 VAL H A 39 GLY HAy 1.0 1.8 2.97 777 644 A 39 GLY H A 60 LEU HBy 1.0 1.8 5.23 778 645 A 39 GLY H A 61 SER H 1.0 1.8 3.80 779 646 A 39 GLY H A 61 SER HBx 1.0 1.8 3.60 780 646 A 39 GLY H A 61 SER HBy 1.0 1.8 3.60 781 647 A 62 ALA HA A 39 GLY H 1.0 1.8 4.58 782 648 A 40 VAL H A 40 VAL HG2% 1.0 1.8 3.20 783 649 A 40 VAL H A 40 VAL HG2% 1.0 1.8 3.38 784 649 A 40 VAL HG1% A 40 VAL H 1.0 1.8 3.38 785 650 A 40 VAL H A 40 VAL HB 1.0 1.8 3.13 786 651 A 40 VAL HA A 40 VAL HG2% 1.0 1.8 3.08 787 652 A 40 VAL HA A 40 VAL HG2% 1.0 1.8 3.31 788 652 A 40 VAL HG1% A 40 VAL HA 1.0 1.8 3.31 789 653 A 40 VAL HG1% A 41 ASP HA 1.0 1.8 4.86 790 654 A 41 ASP H A 40 VAL HG2% 1.0 1.8 3.67 791 654 A 40 VAL HG1% A 41 ASP H 1.0 1.8 3.67 792 655 A 40 VAL HG1% A 41 ASP HBx 1.0 1.8 4.64 793 656 A 40 VAL HA A 41 ASP H 1.0 1.8 3.18 794 657 A 40 VAL HG1% A 41 ASP H 1.0 1.8 4.23 795 658 A 40 VAL HA A 42 ALA H 1.0 1.8 5.02 796 659 A 40 VAL HG1% A 42 ALA HA 1.0 1.8 3.83 797 660 A 40 VAL HG1% A 42 ALA H 1.0 1.8 3.39 798 661 A 42 ALA H A 40 VAL HG2% 1.0 1.8 3.45 799 661 A 40 VAL HG1% A 42 ALA H 1.0 1.8 3.45 800 662 A 60 LEU HD2% A 40 VAL HA 1.0 1.8 3.92 801 663 A 60 LEU HA A 40 VAL HA 1.0 1.8 3.32 802 664 A 40 VAL HG1% A 60 LEU HA 1.0 1.8 4.78 803 665 A 40 VAL HG1% A 60 LEU HG 1.0 1.8 4.13 804 666 A 60 LEU HBy A 40 VAL HA 1.0 1.8 4.08 805 667 A 60 LEU HBy A 40 VAL HB 1.0 1.8 5.00 806 668 A 40 VAL HA A 60 LEU HBx 1.0 1.8 4.47 807 669 A 61 SER H A 40 VAL HA 1.0 1.8 4.01 808 670 A 41 ASP H A 41 ASP HBx 1.0 1.8 3.45 809 671 A 41 ASP H A 41 ASP HBy 1.0 1.8 4.17 810 672 A 41 ASP H A 42 ALA H 1.0 1.8 3.03 811 673 A 42 ALA H A 41 ASP HBy 1.0 1.8 4.01 812 674 A 41 ASP HBy A 42 ALA HB% 1.0 1.8 5.26 813 675 A 41 ASP HBx A 42 ALA H 1.0 1.8 3.74 814 676 A 41 ASP HBy A 59 ILE HG2% 1.0 1.8 4.32 815 677 A 41 ASP HBx A 59 ILE HB 1.0 1.8 4.28 816 678 A 41 ASP H A 60 LEU H 1.0 1.8 4.87 817 679 A 60 LEU HD2% A 41 ASP H 1.0 1.8 4.51 818 680 A 60 LEU HA A 41 ASP H 1.0 1.8 3.66 819 681 A 60 LEU HBy A 41 ASP H 1.0 1.8 4.99 820 682 A 60 LEU HA A 41 ASP HA 1.0 1.8 4.85 821 683 A 61 SER H A 41 ASP H 1.0 1.8 4.36 822 684 A 42 ALA H A 42 ALA HB% 1.0 1.8 3.67 823 685 A 43 GLY H A 42 ALA H 1.0 1.8 4.59 824 686 A 43 GLY H A 42 ALA HB% 1.0 1.8 3.31 825 687 A 42 ALA H A 59 ILE HG2% 1.0 1.8 4.89 826 688 A 59 ILE H A 42 ALA H 1.0 1.8 3.73 827 689 A 42 ALA H A 59 ILE HB 1.0 1.8 3.49 828 690 A 42 ALA H A 59 ILE HG1x 1.0 1.8 5.32 829 691 A 60 LEU HA A 42 ALA H 1.0 1.8 4.32 830 692 A 60 LEU HD1% A 42 ALA H 1.0 1.8 5.08 831 693 A 43 GLY HAy A 44 GLN HGx 1.0 1.8 4.30 832 693 A 43 GLY HAy A 44 GLN HGy 1.0 1.8 4.30 833 694 A 43 GLY H A 44 GLN HGx 1.0 1.8 4.91 834 694 A 43 GLY H A 44 GLN HGy 1.0 1.8 4.91 835 695 A 43 GLY HAx A 44 GLN H 1.0 1.8 3.53 836 696 A 43 GLY H A 58 LEU HA 1.0 1.8 4.59 837 697 A 43 GLY HAx A 58 LEU HA 1.0 1.8 3.89 838 698 A 43 GLY HAy A 58 LEU HBy 1.0 1.8 5.24 839 699 A 43 GLY H A 58 LEU HD2% 1.0 1.8 4.42 840 700 A 43 GLY HAx A 58 LEU HBy 1.0 1.8 5.24 841 701 A 43 GLY HAy A 58 LEU HD2% 1.0 1.8 3.77 842 702 A 43 GLY HAy A 58 LEU HA 1.0 1.8 4.02 843 703 A 43 GLY HAy A 59 ILE H 1.0 1.8 4.43 844 704 A 43 GLY HAx A 59 ILE H 1.0 1.8 4.75 845 705 A 44 GLN HBx A 44 GLN HGx 1.0 1.8 2.40 846 705 A 44 GLN HGy A 44 GLN HBx 1.0 1.8 2.40 847 706 A 44 GLN H A 44 GLN HGx 1.0 1.8 4.54 848 706 A 44 GLN H A 44 GLN HGy 1.0 1.8 4.54 849 707 A 45 ILE H A 44 GLN HBx 1.0 1.8 5.19 850 708 A 45 ILE H A 44 GLN HBy 1.0 1.8 4.73 851 709 A 45 ILE H A 44 GLN HGx 1.0 1.8 5.22 852 709 A 44 GLN HGy A 45 ILE H 1.0 1.8 5.22 853 710 A 44 GLN HA A 45 ILE H 1.0 1.8 3.20 854 711 A 44 GLN HBy A 57 ASN HBy 1.0 1.8 3.35 855 712 A 44 GLN H A 57 ASN HBy 1.0 1.8 5.03 856 713 A 45 ILE HA A 45 ILE HG2% 1.0 1.8 3.53 857 714 A 45 ILE HD1% A 45 ILE HA 1.0 1.8 3.70 858 715 A 45 ILE HA A 45 ILE HG12 1.0 1.8 3.66 859 715 A 45 ILE HG13 A 45 ILE HA 1.0 1.8 3.66 860 716 A 45 ILE H A 45 ILE HB 1.0 1.8 3.51 861 717 A 45 ILE H A 45 ILE HG2% 1.0 1.8 4.50 862 718 A 45 ILE H A 46 ILE HG12 1.0 1.8 4.23 863 718 A 45 ILE H A 46 ILE HG13 1.0 1.8 4.23 864 719 A 45 ILE HA A 46 ILE H 1.0 1.8 3.06 865 720 A 45 ILE HG2% A 46 ILE HG12 1.0 1.8 4.88 866 720 A 45 ILE HG2% A 46 ILE HG13 1.0 1.8 4.88 867 721 A 45 ILE HG2% A 46 ILE H 1.0 1.8 3.60 868 722 A 45 ILE HG2% A 47 LYS HEx 1.0 1.8 4.89 869 722 A 45 ILE HG2% A 47 LYS HEy 1.0 1.8 4.89 870 723 A 45 ILE HG2% A 47 LYS HDx 1.0 1.8 4.93 871 723 A 45 ILE HG2% A 47 LYS HDy 1.0 1.8 4.93 872 724 A 45 ILE HG2% A 47 LYS HGx 1.0 1.8 4.42 873 724 A 45 ILE HG2% A 47 LYS HGy 1.0 1.8 4.42 874 725 A 45 ILE HG2% A 54 ASN HBx 1.0 1.8 4.03 875 726 A 45 ILE HG2% A 54 ASN HBy 1.0 1.8 4.24 876 727 A 45 ILE HG2% A 55 TYR HBy 1.0 1.8 5.05 877 728 A 45 ILE HG2% A 55 TYR HA 1.0 1.8 5.50 878 729 A 45 ILE HG2% A 55 TYR HBx 1.0 1.8 5.15 879 730 A 45 ILE H A 56 TYR HA 1.0 1.8 5.21 880 731 A 56 TYR HE% A 45 ILE HG2% 1.0 1.8 4.74 881 732 A 56 TYR HD% A 45 ILE HB 1.0 1.8 5.50 882 733 A 45 ILE HA A 56 TYR HA 1.0 1.8 2.95 883 734 A 45 ILE HD1% A 56 TYR HE% 1.0 1.8 3.81 884 735 A 56 TYR H A 45 ILE HG2% 1.0 1.8 5.50 885 736 A 56 TYR HD% A 45 ILE HG12 1.0 1.8 5.16 886 736 A 56 TYR HD% A 45 ILE HG13 1.0 1.8 5.16 887 737 A 45 ILE HG2% A 56 TYR HA 1.0 1.8 4.55 888 738 A 56 TYR HD% A 45 ILE HG2% 1.0 1.8 3.96 889 739 A 46 ILE H A 46 ILE HG2% 1.0 1.8 4.59 890 740 A 46 ILE HG2% A 46 ILE HA 1.0 1.8 3.84 891 741 A 46 ILE H A 46 ILE HG12 1.0 1.8 4.79 892 741 A 46 ILE HG13 A 46 ILE H 1.0 1.8 4.79 893 742 A 46 ILE HA A 46 ILE HG12 1.0 1.8 4.00 894 742 A 46 ILE HG13 A 46 ILE HA 1.0 1.8 4.00 895 743 A 46 ILE H A 46 ILE HB 1.0 1.8 3.73 896 744 A 46 ILE HA A 47 LYS HDx 1.0 1.8 4.22 897 744 A 47 LYS HDy A 46 ILE HA 1.0 1.8 4.22 898 745 A 47 LYS H A 46 ILE HG12 1.0 1.8 5.50 899 745 A 46 ILE HG13 A 47 LYS H 1.0 1.8 5.50 900 746 A 46 ILE HG2% A 47 LYS H 1.0 1.8 4.22 901 747 A 46 ILE HA A 47 LYS H 1.0 1.8 3.28 902 748 A 46 ILE HG2% A 48 GLY H 1.0 1.8 5.19 903 749 A 55 TYR HBy A 46 ILE HB 1.0 1.8 3.98 904 750 A 55 TYR HBy A 46 ILE HG2% 1.0 1.8 5.29 905 751 A 46 ILE HB A 55 TYR HD% 1.0 1.8 5.08 906 752 A 55 TYR HBx A 46 ILE HB 1.0 1.8 4.32 907 753 A 55 TYR HBx A 46 ILE HG2% 1.0 1.8 5.41 908 754 A 47 LYS H A 47 LYS HDx 1.0 1.8 5.00 909 754 A 47 LYS HDy A 47 LYS H 1.0 1.8 5.00 910 755 A 47 LYS HEx A 47 LYS HGx 1.0 1.8 3.33 911 755 A 47 LYS HEy A 47 LYS HGx 1.0 1.8 3.33 912 755 A 47 LYS HGy A 47 LYS HEx 1.0 1.8 3.33 913 755 A 47 LYS HEy A 47 LYS HGy 1.0 1.8 3.33 914 756 A 47 LYS HA A 48 GLY HAy 1.0 1.8 5.50 915 757 A 48 GLY H A 47 LYS HA 1.0 1.8 3.01 916 758 A 48 GLY H A 49 ILE H 1.0 1.8 4.23 917 759 A 48 GLY HAx A 49 ILE HB 1.0 1.8 5.24 918 760 A 49 ILE H A 49 ILE HG2% 1.0 1.8 4.12 919 761 A 49 ILE HA A 49 ILE HD1% 1.0 1.8 4.86 920 762 A 49 ILE HG2% A 49 ILE HA 1.0 1.8 3.92 921 763 A 49 ILE HB A 49 ILE HD1% 1.0 1.8 4.01 922 764 A 49 ILE H A 49 ILE HD1% 1.0 1.8 4.85 923 765 A 49 ILE HG2% A 50 PRO HA 1.0 1.8 4.04 924 766 A 50 PRO HBx A 51 HIS H 1.0 1.8 3.52 925 767 A 51 HIS H A 50 PRO HBy 1.0 1.8 4.74 926 768 A 50 PRO HBx A 52 TRP HE3 1.0 1.8 3.73 927 769 A 51 HIS H A 51 HIS HBx 1.0 1.8 3.76 928 769 A 51 HIS H A 51 HIS HBy 1.0 1.8 3.76 929 770 A 51 HIS H A 52 TRP H 1.0 1.8 3.42 930 771 A 51 HIS H A 53 ASP H 1.0 1.8 4.25 931 772 A 52 TRP HE3 A 52 TRP HBx 1.0 1.8 3.69 932 772 A 52 TRP HE3 A 52 TRP HBy 1.0 1.8 3.69 933 773 A 52 TRP HA A 52 TRP HD1 1.0 1.8 5.11 934 774 A 52 TRP HD1 A 52 TRP HBx 1.0 1.8 3.64 935 774 A 52 TRP HBy A 52 TRP HD1 1.0 1.8 3.64 936 775 A 53 ASP H A 52 TRP HBx 1.0 1.8 4.14 937 775 A 53 ASP H A 52 TRP HBy 1.0 1.8 4.14 938 776 A 52 TRP H A 53 ASP H 1.0 1.8 4.16 939 777 A 54 ASN HBx A 52 TRP HZ3 1.0 1.8 5.02 940 778 A 54 ASN HBy A 52 TRP HZ3 1.0 1.8 4.70 941 779 A 53 ASP H A 53 ASP HBx 1.0 1.8 3.40 942 779 A 53 ASP H A 53 ASP HBy 1.0 1.8 3.40 943 780 A 53 ASP HA A 54 ASN HA 1.0 1.8 4.94 944 781 A 53 ASP HA A 54 ASN H 1.0 1.8 3.31 945 782 A 54 ASN H A 53 ASP HBx 1.0 1.8 4.12 946 782 A 53 ASP HBy A 54 ASN H 1.0 1.8 4.12 947 783 A 53 ASP H A 78 LEU HD1% 1.0 1.8 5.49 948 784 A 78 LEU HD1% A 53 ASP HBx 1.0 1.8 3.75 949 784 A 53 ASP HBy A 78 LEU HD1% 1.0 1.8 3.75 950 785 A 53 ASP HA A 78 LEU HD1% 1.0 1.8 5.04 951 786 A 53 ASP HA A 80 LYS HA 1.0 1.8 4.24 952 787 A 54 ASN HBy A 54 ASN H 1.0 1.8 3.88 953 788 A 54 ASN HBy A 55 TYR H 1.0 1.8 4.42 954 789 A 54 ASN HA A 55 TYR H 1.0 1.8 3.19 955 790 A 55 TYR HD% A 54 ASN HA 1.0 1.8 4.84 956 791 A 54 ASN HBx A 55 TYR H 1.0 1.8 4.28 957 792 A 54 ASN H A 55 TYR H 1.0 1.8 4.85 958 793 A 55 TYR HBx A 54 ASN HA 1.0 1.8 4.20 959 794 A 56 TYR HE% A 54 ASN HBx 1.0 1.8 4.09 960 795 A 56 TYR HD% A 54 ASN HBy 1.0 1.8 4.37 961 796 A 56 TYR HE% A 54 ASN HBy 1.0 1.8 4.46 962 797 A 54 ASN H A 78 LEU HD1% 1.0 1.8 4.50 963 798 A 79 GLU HBx A 54 ASN H 1.0 1.9 4.96 964 799 A 54 ASN HBy A 79 GLU H 1.0 1.8 5.35 965 800 A 79 GLU HBy A 54 ASN H 1.0 1.8 4.57 966 801 A 54 ASN H A 79 GLU H 1.0 1.8 4.64 967 802 A 79 GLU HBx A 54 ASN HBx 1.0 1.8 5.42 968 803 A 79 GLU HBx A 54 ASN HBy 1.0 1.8 4.92 969 804 A 55 TYR HA A 55 TYR HE% 1.0 1.8 5.36 970 805 A 55 TYR HBy A 55 TYR H 1.0 1.8 4.09 971 806 A 55 TYR HA A 55 TYR HD% 1.0 1.8 3.68 972 807 A 55 TYR HBx A 55 TYR H 1.0 1.8 4.14 973 808 A 55 TYR HD% A 55 TYR H 1.0 1.8 3.76 974 809 A 56 TYR HE% A 55 TYR H 1.0 1.8 5.40 975 810 A 56 TYR H A 55 TYR HBx 1.0 1.8 4.81 976 811 A 56 TYR H A 55 TYR HA 1.0 1.8 3.20 977 812 A 56 TYR H A 55 TYR HD% 1.0 1.8 3.81 978 813 A 55 TYR HE% A 76 VAL HG2% 1.0 1.8 4.55 979 813 A 55 TYR HE% A 76 VAL HG1% 1.0 1.8 4.55 980 814 A 55 TYR HA A 76 VAL HG2% 1.0 1.8 5.50 981 814 A 55 TYR HA A 76 VAL HG1% 1.0 1.8 5.50 982 815 A 55 TYR HBx A 78 LEU HD1% 1.0 1.8 5.36 983 816 A 55 TYR HE% A 78 LEU HBy 1.0 1.8 4.91 984 817 A 55 TYR HA A 78 LEU HA 1.0 1.8 3.62 985 818 A 55 TYR HE% A 78 LEU H 1.0 1.8 5.02 986 819 A 55 TYR HE% A 78 LEU HD2% 1.0 1.8 5.41 987 820 A 55 TYR HE% A 78 LEU HG 1.0 1.8 4.11 988 821 A 55 TYR HD% A 78 LEU HD1% 1.0 1.8 4.47 989 822 A 78 LEU HD1% A 55 TYR HE% 1.0 1.8 3.89 990 823 A 55 TYR HE% A 78 LEU HBx 1.0 1.8 3.32 991 824 A 55 TYR HA A 78 LEU HD1% 1.0 1.8 5.07 992 825 A 55 TYR HE% A 78 LEU HA 1.0 1.8 4.43 993 826 A 55 TYR HD% A 78 LEU HBx 1.0 1.8 3.96 994 827 A 55 TYR HD% A 79 GLU H 1.0 1.8 4.25 995 828 A 55 TYR HA A 79 GLU H 1.0 1.8 4.26 996 829 A 55 TYR HE% A 89 VAL HG2% 1.0 1.8 3.71 997 830 A 55 TYR HE% A 89 VAL HG1% 1.0 1.8 4.33 998 831 A 56 TYR HBx A 56 TYR H 1.0 1.8 3.73 999 832 A 56 TYR HE% A 56 TYR HA 1.0 1.8 5.47 1000 833 A 56 TYR HD% A 56 TYR H 1.0 1.8 3.64 1001 834 A 56 TYR HD% A 56 TYR HA 1.0 1.8 4.70 1002 835 A 56 TYR HBy A 56 TYR H 1.0 1.8 3.57 1003 836 A 56 TYR HA A 57 ASN H 1.0 1.8 3.08 1004 837 A 57 ASN HBy A 56 TYR HA 1.0 1.8 4.72 1005 838 A 58 LEU HD2% A 56 TYR HBy 1.0 1.8 5.21 1006 839 A 56 TYR HD% A 58 LEU HD2% 1.0 1.8 4.56 1007 840 A 56 TYR H A 76 VAL HA 1.0 1.8 5.20 1008 841 A 56 TYR H A 76 VAL HG2% 1.0 1.8 4.61 1009 841 A 56 TYR H A 76 VAL HG1% 1.0 1.8 4.61 1010 842 A 56 TYR H A 77 VAL HG1% 1.0 1.8 5.28 1011 843 A 56 TYR HBy A 77 VAL HB 1.0 1.8 4.02 1012 844 A 56 TYR H A 77 VAL H 1.0 1.8 3.85 1013 845 A 56 TYR H A 77 VAL HB 1.0 1.8 4.46 1014 846 A 56 TYR HBy A 77 VAL H 1.0 1.8 4.53 1015 847 A 56 TYR H A 78 LEU HA 1.0 1.8 4.61 1016 848 A 56 TYR H A 78 LEU HBx 1.0 1.8 4.78 1017 849 A 56 TYR H A 79 GLU HBy 1.0 1.8 5.32 1018 850 A 56 TYR HD% A 79 GLU HBx 1.0 1.8 5.14 1019 851 A 56 TYR HE% A 79 GLU HBx 1.0 1.8 3.94 1020 852 A 56 TYR HE% A 79 GLU H 1.0 1.8 4.98 1021 853 A 56 TYR HE% A 79 GLU HGx 1.0 1.8 4.28 1022 853 A 56 TYR HE% A 79 GLU HGy 1.0 1.8 4.28 1023 854 A 56 TYR HD% A 79 GLU H 1.0 1.8 4.68 1024 855 A 56 TYR HE% A 79 GLU HBy 1.0 1.8 4.20 1025 856 A 56 TYR H A 79 GLU H 1.0 1.8 4.41 1026 857 A 57 ASN HBy A 57 ASN H 1.0 1.8 3.93 1027 858 A 57 ASN H A 57 ASN HBx 1.0 1.8 4.19 1028 859 A 57 ASN HA A 58 LEU H 1.0 1.8 3.48 1029 860 A 57 ASN HBy A 58 LEU HD1% 1.0 1.8 4.46 1030 861 A 57 ASN H A 58 LEU HD1% 1.0 1.8 3.94 1031 862 A 58 LEU HD2% A 57 ASN H 1.0 1.8 5.11 1032 863 A 57 ASN HA A 58 LEU HD1% 1.0 1.8 4.61 1033 864 A 57 ASN HA A 76 VAL HG2% 1.0 1.8 4.10 1034 865 A 57 ASN HBx A 76 VAL HG2% 1.0 1.8 4.52 1035 866 A 57 ASN HA A 76 VAL HG2% 1.0 1.8 5.07 1036 866 A 76 VAL HG1% A 57 ASN HA 1.0 1.8 5.07 1037 867 A 58 LEU HBy A 58 LEU HD1% 1.0 1.8 3.62 1038 868 A 58 LEU HD2% A 58 LEU HA 1.0 1.8 3.57 1039 869 A 58 LEU HA A 59 ILE H 1.0 1.8 3.00 1040 870 A 59 ILE H A 58 LEU HBy 1.0 1.8 5.24 1041 871 A 58 LEU HD2% A 59 ILE H 1.0 1.8 3.90 1042 872 A 59 ILE H A 58 LEU HBx 1.0 1.8 4.49 1043 873 A 60 LEU HD1% A 58 LEU HBy 1.0 1.8 3.49 1044 874 A 59 ILE HG2% A 59 ILE HG1x 1.0 1.8 3.64 1045 875 A 59 ILE HA A 59 ILE HD1% 1.0 1.8 3.55 1046 876 A 59 ILE HG2% A 59 ILE HG1y 1.0 1.8 3.61 1047 877 A 59 ILE HG2% A 59 ILE HA 1.0 1.8 3.59 1048 878 A 59 ILE H A 59 ILE HB 1.0 1.8 3.79 1049 879 A 59 ILE H A 59 ILE HD1% 1.0 1.8 5.50 1050 880 A 59 ILE H A 59 ILE HG1x 1.0 1.8 4.76 1051 881 A 59 ILE H A 59 ILE HG1y 1.0 1.8 3.76 1052 882 A 59 ILE H A 59 ILE HG2% 1.0 1.8 4.47 1053 883 A 60 LEU HA A 59 ILE HG2% 1.0 1.8 5.09 1054 884 A 59 ILE H A 60 LEU H 1.0 1.8 4.96 1055 885 A 59 ILE HB A 60 LEU H 1.0 1.8 4.75 1056 886 A 59 ILE HG2% A 60 LEU H 1.0 1.8 3.95 1057 887 A 60 LEU H A 59 ILE HD1% 1.0 1.8 4.36 1058 888 A 60 LEU H A 59 ILE HA 1.0 1.8 3.08 1059 889 A 59 ILE H A 60 LEU HD1% 1.0 1.8 5.26 1060 890 A 59 ILE HG2% A 72 PHE HE% 1.0 1.8 5.18 1061 891 A 59 ILE HG2% A 72 PHE HD% 1.0 1.8 4.09 1062 892 A 59 ILE HG2% A 72 PHE HBx 1.0 1.8 4.66 1063 892 A 59 ILE HG2% A 72 PHE HBy 1.0 1.8 4.66 1064 893 A 59 ILE HG2% A 72 PHE HA 1.0 1.8 4.81 1065 894 A 59 ILE HG2% A 72 PHE H 1.0 1.8 4.98 1066 895 A 73 TYR H A 59 ILE HG2% 1.0 1.8 4.91 1067 896 A 73 TYR HD% A 59 ILE HG2% 1.0 1.8 5.50 1068 897 A 73 TYR H A 59 ILE HA 1.0 1.8 4.81 1069 898 A 59 ILE HG2% A 73 TYR HA 1.0 1.8 5.09 1070 899 A 59 ILE HA A 74 ASN HA 1.0 1.8 3.98 1071 900 A 59 ILE HA A 74 ASN H 1.0 1.8 4.50 1072 901 A 59 ILE HD1% A 74 ASN HA 1.0 1.8 3.81 1073 902 A 59 ILE HG2% A 74 ASN HA 1.0 1.8 5.05 1074 903 A 59 ILE HG1y A 74 ASN HA 1.0 1.8 5.12 1075 904 A 59 ILE HD1% A 75 VAL H 1.0 1.8 5.39 1076 905 A 59 ILE HG2% A 94 LEU HG 1.0 1.8 3.25 1077 906 A 59 ILE HD1% A 94 LEU HD2% 1.0 1.8 4.11 1078 907 A 59 ILE HG2% A 94 LEU HBx 1.0 1.8 4.20 1079 908 A 60 LEU HD2% A 60 LEU HBx 1.0 1.8 3.56 1080 909 A 60 LEU HD1% A 60 LEU HBy 1.0 1.8 3.75 1081 910 A 60 LEU HG A 60 LEU H 1.0 1.8 3.81 1082 911 A 60 LEU HD1% A 60 LEU H 1.0 1.8 3.49 1083 912 A 60 LEU HD2% A 60 LEU HBy 1.0 1.8 3.54 1084 913 A 60 LEU HBy A 60 LEU H 1.0 1.8 3.81 1085 914 A 60 LEU HD1% A 60 LEU HBx 1.0 1.8 3.58 1086 915 A 60 LEU HD1% A 60 LEU HA 1.0 1.8 4.63 1087 916 A 60 LEU HD2% A 60 LEU H 1.0 1.8 4.40 1088 917 A 60 LEU HD2% A 60 LEU HA 1.0 1.8 3.75 1089 918 A 60 LEU HG A 61 SER H 1.0 1.8 4.86 1090 919 A 60 LEU HA A 61 SER HBx 1.0 1.8 5.15 1091 919 A 60 LEU HA A 61 SER HBy 1.0 1.8 5.15 1092 920 A 60 LEU HA A 61 SER H 1.0 1.8 2.97 1093 921 A 60 LEU HBy A 61 SER H 1.0 1.8 3.90 1094 922 A 60 LEU HD2% A 61 SER H 1.0 1.8 4.19 1095 923 A 61 SER H A 60 LEU H 1.0 1.8 4.44 1096 924 A 61 SER H A 60 LEU HBx 1.0 1.8 3.91 1097 925 A 73 TYR HD% A 60 LEU HBx 1.0 1.8 4.76 1098 926 A 73 TYR H A 60 LEU HBx 1.0 1.8 4.97 1099 927 A 73 TYR HBy A 60 LEU H 1.0 1.8 4.83 1100 928 A 60 LEU HD1% A 73 TYR HBy 1.0 1.8 4.43 1101 929 A 60 LEU HD1% A 73 TYR HBx 1.0 1.8 4.10 1102 930 A 60 LEU HD1% A 73 TYR HD% 1.0 1.8 4.50 1103 931 A 60 LEU HD1% A 73 TYR H 1.0 1.8 5.29 1104 932 A 73 TYR H A 60 LEU H 1.0 1.8 3.78 1105 933 A 60 LEU H A 74 ASN HA 1.0 1.8 4.79 1106 934 A 60 LEU HD1% A 75 VAL H 1.0 1.8 4.55 1107 935 A 61 SER H A 61 SER HBx 1.0 1.8 3.17 1108 935 A 61 SER H A 61 SER HBy 1.0 1.8 3.17 1109 936 A 62 ALA HB% A 61 SER HA 1.0 1.8 4.75 1110 937 A 62 ALA HB% A 61 SER HBx 1.0 1.8 4.99 1111 937 A 62 ALA HB% A 61 SER HBy 1.0 1.8 4.99 1112 938 A 61 SER HA A 62 ALA H 1.0 1.8 3.09 1113 939 A 61 SER H A 62 ALA H 1.0 1.8 5.15 1114 940 A 70 SER HBy A 61 SER HBx 1.0 1.8 2.40 1115 940 A 61 SER HBy A 70 SER HBy 1.0 1.8 2.40 1116 941 A 61 SER HA A 70 SER HBx 1.0 1.8 4.59 1117 942 A 61 SER HA A 71 LYS H 1.0 1.8 4.94 1118 943 A 61 SER HA A 72 PHE HD% 1.0 1.8 5.15 1119 944 A 72 PHE HD% A 61 SER HBx 1.0 1.8 5.50 1120 944 A 61 SER HBy A 72 PHE HD% 1.0 1.8 5.50 1121 945 A 61 SER HA A 72 PHE HE% 1.0 1.8 5.46 1122 946 A 73 TYR HD% A 61 SER HA 1.0 1.8 5.21 1123 947 A 62 ALA HB% A 62 ALA H 1.0 1.8 3.79 1124 948 A 62 ALA HA A 63 LYS HGx 1.0 1.8 4.42 1125 948 A 62 ALA HA A 63 LYS HGy 1.0 1.8 4.42 1126 949 A 62 ALA HA A 63 LYS HBy 1.0 1.8 5.24 1127 950 A 62 ALA HA A 63 LYS H 1.0 1.8 3.04 1128 951 A 62 ALA HB% A 63 LYS HA 1.0 1.8 4.66 1129 952 A 63 LYS H A 62 ALA H 1.0 1.8 4.86 1130 953 A 62 ALA HB% A 63 LYS H 1.0 1.8 3.47 1131 954 A 62 ALA H A 70 SER HA 1.0 1.8 4.30 1132 955 A 62 ALA H A 70 SER HBx 1.0 1.8 4.31 1133 956 A 62 ALA HA A 70 SER HA 1.0 1.8 4.80 1134 957 A 62 ALA H A 70 SER HBy 1.0 1.8 3.59 1135 958 A 62 ALA H A 71 LYS H 1.0 1.8 3.65 1136 959 A 62 ALA HA A 73 TYR HE% 1.0 1.8 5.30 1137 960 A 73 TYR HD% A 62 ALA H 1.0 1.8 4.38 1138 961 A 73 TYR HE% A 62 ALA H 1.0 1.8 4.07 1139 962 A 62 ALA HB% A 73 TYR HD% 1.0 1.8 3.88 1140 963 A 62 ALA HB% A 73 TYR HE% 1.0 1.8 3.30 1141 964 A 63 LYS HBy A 63 LYS HEx 1.0 1.8 5.06 1142 964 A 63 LYS HEy A 63 LYS HBy 1.0 1.8 5.06 1143 965 A 63 LYS H A 63 LYS HDx 1.0 1.8 4.08 1144 966 A 63 LYS HEx A 63 LYS HGx 1.0 1.8 3.68 1145 966 A 63 LYS HEy A 63 LYS HGx 1.0 1.8 3.68 1146 966 A 63 LYS HGy A 63 LYS HEx 1.0 1.8 3.68 1147 966 A 63 LYS HEy A 63 LYS HGy 1.0 1.8 3.68 1148 967 A 63 LYS H A 63 LYS HGx 1.0 1.8 3.66 1149 967 A 63 LYS H A 63 LYS HGy 1.0 1.8 3.66 1150 968 A 63 LYS HA A 63 LYS HDx 1.0 1.8 3.97 1151 969 A 63 LYS HBx A 63 LYS HDx 1.0 1.8 2.72 1152 970 A 63 LYS HA A 63 LYS HDy 1.0 1.8 5.34 1153 971 A 64 HIS H A 63 LYS HBy 1.0 1.8 4.13 1154 972 A 63 LYS HA A 64 HIS H 1.0 1.8 2.92 1155 973 A 64 HIS H A 63 LYS HDx 1.0 1.8 3.90 1156 974 A 63 LYS HBx A 64 HIS H 1.0 1.8 3.69 1157 975 A 63 LYS HBx A 65 SER H 1.0 1.8 3.66 1158 976 A 63 LYS HA A 65 SER H 1.0 1.8 4.20 1159 977 A 65 SER H A 63 LYS HDy 1.0 1.8 4.33 1160 978 A 63 LYS H A 65 SER H 1.0 1.8 5.04 1161 979 A 65 SER H A 63 LYS HBy 1.0 1.8 4.40 1162 980 A 65 SER H A 63 LYS HGx 1.0 1.8 4.46 1163 980 A 65 SER H A 63 LYS HGy 1.0 1.8 4.46 1164 981 A 63 LYS HDy A 66 PRO HA 1.0 1.8 3.87 1165 982 A 69 PHE HA A 63 LYS HGx 1.0 1.8 4.59 1166 982 A 63 LYS HGy A 69 PHE HA 1.0 1.8 4.59 1167 983 A 70 SER HBy A 63 LYS HGx 1.0 1.8 4.77 1168 983 A 70 SER HBy A 63 LYS HGy 1.0 1.8 4.77 1169 984 A 70 SER HBx A 63 LYS HGx 1.0 1.8 5.22 1170 984 A 70 SER HBx A 63 LYS HGy 1.0 1.8 5.22 1171 985 A 63 LYS HA A 70 SER HA 1.0 1.8 4.57 1172 986 A 70 SER HA A 63 LYS HBy 1.0 1.8 3.79 1173 987 A 71 LYS H A 63 LYS HBy 1.0 1.8 5.07 1174 988 A 63 LYS HA A 71 LYS H 1.0 1.8 4.93 1175 989 A 64 HIS HBy A 64 HIS H 1.0 1.8 3.54 1176 990 A 64 HIS HD2 A 64 HIS HA 1.0 1.8 4.25 1177 991 A 64 HIS H A 64 HIS HBx 1.0 1.8 3.43 1178 992 A 64 HIS HD2 A 64 HIS HBy 1.0 1.8 3.95 1179 993 A 64 HIS H A 65 SER H 1.0 1.8 2.98 1180 994 A 64 HIS HBx A 65 SER H 1.0 1.8 3.64 1181 995 A 65 SER H A 65 SER HBy 1.0 1.8 3.76 1182 996 A 65 SER H A 65 SER HBx 1.0 1.8 3.86 1183 997 A 65 SER HA A 66 PRO HDx 1.0 1.8 3.01 1184 997 A 65 SER HA A 66 PRO HDy 1.0 1.8 3.01 1185 998 A 65 SER H A 66 PRO HA 1.0 1.8 5.19 1186 999 A 65 SER HBx A 66 PRO HDx 1.0 1.8 2.40 1187 999 A 65 SER HBx A 66 PRO HDy 1.0 1.8 2.40 1188 1000 A 65 SER HBx A 67 HIS H 1.0 1.8 3.71 1189 1001 A 65 SER HBx A 68 GLU HGx 1.0 1.8 5.48 1190 1002 A 65 SER HBx A 68 GLU HBx 1.0 1.8 5.29 1191 1003 A 65 SER HBx A 68 GLU HGy 1.0 1.8 4.98 1192 1004 A 67 HIS H A 66 PRO HBx 1.0 1.8 3.94 1193 1005 A 67 HIS H A 66 PRO HBy 1.0 1.8 4.22 1194 1006 A 67 HIS H A 66 PRO HDx 1.0 1.8 4.03 1195 1006 A 66 PRO HDy A 67 HIS H 1.0 1.8 4.03 1196 1007 A 66 PRO HBy A 67 HIS HD2 1.0 1.8 5.29 1197 1008 A 67 HIS H A 66 PRO HGy 1.0 1.8 5.20 1198 1008 A 67 HIS H A 66 PRO HGx 1.0 1.8 5.20 1199 1009 A 66 PRO HBx A 67 HIS HA 1.0 1.8 4.75 1200 1010 A 67 HIS HD2 A 66 PRO HGy 1.0 1.8 4.69 1201 1011 A 66 PRO HA A 68 GLU H 1.0 1.8 4.70 1202 1012 A 67 HIS H A 67 HIS HBy 1.0 1.8 3.68 1203 1013 A 67 HIS H A 67 HIS HD2 1.0 1.8 3.72 1204 1014 A 67 HIS H A 67 HIS HBx 1.0 1.8 3.33 1205 1015 A 67 HIS HA A 68 GLU H 1.0 1.8 3.54 1206 1016 A 68 GLU HGy A 67 HIS HA 1.0 1.8 5.15 1207 1017 A 68 GLU HGy A 67 HIS HBy 1.0 1.8 5.47 1208 1018 A 67 HIS H A 68 GLU H 1.0 1.8 3.01 1209 1019 A 68 GLU H A 67 HIS HBx 1.0 1.8 4.40 1210 1020 A 68 GLU H A 67 HIS HBy 1.0 1.8 4.71 1211 1021 A 67 HIS H A 68 GLU HGy 1.0 1.8 5.05 1212 1022 A 68 GLU HGy A 68 GLU H 1.0 1.8 4.28 1213 1023 A 68 GLU H A 68 GLU HBy 1.0 1.8 3.85 1214 1024 A 68 GLU HGy A 68 GLU HA 1.0 1.8 3.99 1215 1025 A 68 GLU HBx A 68 GLU H 1.0 1.8 3.34 1216 1026 A 68 GLU HGx A 68 GLU H 1.0 1.8 4.62 1217 1027 A 68 GLU HGx A 68 GLU HA 1.0 1.8 4.07 1218 1028 A 68 GLU HGx A 69 PHE H 1.0 1.8 4.77 1219 1029 A 68 GLU HBx A 69 PHE HD% 1.0 1.8 5.50 1220 1030 A 68 GLU HA A 69 PHE H 1.0 1.8 2.74 1221 1031 A 68 GLU HGy A 69 PHE H 1.0 1.8 4.72 1222 1032 A 68 GLU HGy A 69 PHE HD% 1.0 1.8 5.32 1223 1033 A 68 GLU HBy A 69 PHE H 1.0 1.8 3.50 1224 1034 A 68 GLU HGx A 69 PHE HD% 1.0 1.8 5.50 1225 1035 A 68 GLU HBx A 69 PHE H 1.0 1.8 3.78 1226 1036 A 68 GLU HA A 69 PHE HBx 1.0 1.8 5.29 1227 1037 A 69 PHE H A 69 PHE HBx 1.0 1.8 3.24 1228 1038 A 69 PHE H A 69 PHE HBy 1.0 1.8 3.97 1229 1039 A 69 PHE HA A 69 PHE HE% 1.0 1.8 4.75 1230 1040 A 69 PHE HE% A 70 SER H 1.0 1.8 5.40 1231 1041 A 69 PHE HBy A 70 SER H 1.0 1.8 3.68 1232 1042 A 69 PHE HBx A 70 SER H 1.0 1.8 3.94 1233 1043 A 69 PHE HA A 70 SER H 1.0 1.8 2.88 1234 1044 A 69 PHE HD% A 70 SER H 1.0 1.8 4.48 1235 1045 A 69 PHE HBx A 71 LYS HGx 1.0 1.8 5.08 1236 1045 A 69 PHE HBx A 71 LYS HGy 1.0 1.8 5.08 1237 1046 A 69 PHE HE% A 71 LYS HDx 1.0 1.8 5.32 1238 1046 A 69 PHE HE% A 71 LYS HDy 1.0 1.8 5.32 1239 1047 A 69 PHE HBx A 71 LYS HDx 1.0 1.8 4.93 1240 1047 A 69 PHE HBx A 71 LYS HDy 1.0 1.8 4.93 1241 1048 A 69 PHE HD% A 71 LYS HDx 1.0 1.8 4.80 1242 1048 A 69 PHE HD% A 71 LYS HDy 1.0 1.8 4.80 1243 1049 A 69 PHE HBy A 71 LYS HDx 1.0 1.8 4.11 1244 1049 A 69 PHE HBy A 71 LYS HDy 1.0 1.8 4.11 1245 1050 A 70 SER HBx A 70 SER H 1.0 1.8 3.66 1246 1051 A 70 SER HBy A 70 SER H 1.0 1.8 3.98 1247 1052 A 70 SER HA A 71 LYS H 1.0 1.8 3.00 1248 1053 A 70 SER H A 71 LYS HDx 1.0 1.8 4.54 1249 1053 A 70 SER H A 71 LYS HDy 1.0 1.8 4.54 1250 1054 A 70 SER H A 71 LYS HDy 1.0 1.8 4.85 1251 1055 A 70 SER HBx A 71 LYS H 1.0 1.8 3.86 1252 1056 A 70 SER HBy A 71 LYS H 1.0 1.8 3.82 1253 1057 A 70 SER H A 71 LYS HGx 1.0 1.8 4.94 1254 1057 A 70 SER H A 71 LYS HGy 1.0 1.8 4.94 1255 1058 A 71 LYS HA A 71 LYS HDx 1.0 1.8 4.99 1256 1058 A 71 LYS HDy A 71 LYS HA 1.0 1.8 4.99 1257 1059 A 71 LYS H A 71 LYS HBx 1.0 1.8 3.99 1258 1060 A 71 LYS HEx A 71 LYS HGx 1.0 1.8 3.59 1259 1060 A 71 LYS HGy A 71 LYS HEx 1.0 1.8 3.59 1260 1061 A 71 LYS HBx A 71 LYS HEy 1.0 1.8 5.50 1261 1062 A 71 LYS H A 71 LYS HGx 1.0 1.8 5.04 1262 1062 A 71 LYS H A 71 LYS HGy 1.0 1.8 5.04 1263 1063 A 72 PHE H A 71 LYS HBy 1.0 1.8 4.35 1264 1064 A 72 PHE HD% A 71 LYS HDx 1.0 1.8 5.50 1265 1064 A 72 PHE HD% A 71 LYS HDy 1.0 1.8 5.50 1266 1065 A 72 PHE H A 71 LYS HGx 1.0 1.8 5.36 1267 1065 A 72 PHE H A 71 LYS HGy 1.0 1.8 5.36 1268 1066 A 72 PHE H A 71 LYS HBx 1.0 1.8 4.46 1269 1067 A 72 PHE H A 71 LYS HA 1.0 1.8 3.33 1270 1068 A 73 TYR HE% A 71 LYS H 1.0 1.8 4.82 1271 1069 A 73 TYR HE% A 71 LYS HBx 1.0 1.8 3.85 1272 1070 A 73 TYR HD% A 71 LYS HBy 1.0 1.8 4.95 1273 1071 A 71 LYS HBy A 95 PHE H 1.0 1.8 4.87 1274 1072 A 71 LYS HBx A 95 PHE HD% 1.0 1.8 5.28 1275 1073 A 95 PHE HD% A 71 LYS HDx 1.0 1.8 5.32 1276 1073 A 71 LYS HDy A 95 PHE HD% 1.0 1.8 5.32 1277 1074 A 71 LYS HEy A 95 PHE HD% 1.0 1.8 5.24 1278 1075 A 71 LYS HA A 95 PHE HBx 1.0 1.8 5.07 1279 1076 A 95 PHE HBy A 71 LYS HGx 1.0 1.8 5.50 1280 1076 A 71 LYS HGy A 95 PHE HBy 1.0 1.8 5.50 1281 1077 A 71 LYS HBy A 95 PHE HD% 1.0 1.8 4.19 1282 1078 A 72 PHE HE% A 72 PHE HA 1.0 1.8 4.95 1283 1079 A 72 PHE HD% A 72 PHE HA 1.0 1.8 3.84 1284 1080 A 72 PHE H A 72 PHE HBx 1.0 1.8 3.77 1285 1080 A 72 PHE HBy A 72 PHE H 1.0 1.8 3.77 1286 1081 A 72 PHE HD% A 72 PHE H 1.0 1.8 4.22 1287 1082 A 73 TYR H A 72 PHE HD% 1.0 1.8 4.51 1288 1083 A 73 TYR HD% A 72 PHE HA 1.0 1.8 3.93 1289 1084 A 72 PHE HA A 73 TYR HBx 1.0 1.8 5.50 1290 1085 A 73 TYR HE% A 72 PHE HA 1.0 1.8 4.62 1291 1086 A 73 TYR H A 72 PHE HBx 1.0 1.8 3.57 1292 1086 A 73 TYR H A 72 PHE HBy 1.0 1.8 3.57 1293 1087 A 73 TYR H A 72 PHE HA 1.0 1.8 2.87 1294 1088 A 72 PHE HD% A 94 LEU HBx 1.0 1.8 4.42 1295 1089 A 94 LEU HBx A 72 PHE HBx 1.0 1.8 4.25 1296 1089 A 72 PHE HBy A 94 LEU HBx 1.0 1.8 4.25 1297 1090 A 94 LEU HBy A 72 PHE HBx 1.0 1.8 4.14 1298 1090 A 72 PHE HBy A 94 LEU HBy 1.0 1.8 4.14 1299 1091 A 94 LEU HG A 72 PHE HBx 1.0 1.8 3.98 1300 1091 A 72 PHE HBy A 94 LEU HG 1.0 1.8 3.98 1301 1092 A 72 PHE HD% A 94 LEU HBy 1.0 1.8 5.24 1302 1093 A 72 PHE HD% A 94 LEU HD1% 1.0 1.8 5.50 1303 1094 A 72 PHE H A 95 PHE HBy 1.0 1.8 5.09 1304 1095 A 72 PHE H A 95 PHE H 1.0 1.8 5.31 1305 1096 A 72 PHE H A 95 PHE HD% 1.0 1.8 4.54 1306 1097 A 73 TYR HBy A 73 TYR H 1.0 1.8 3.76 1307 1098 A 73 TYR HE% A 73 TYR H 1.0 1.8 4.92 1308 1099 A 73 TYR HD% A 73 TYR H 1.0 1.8 3.65 1309 1100 A 73 TYR H A 73 TYR HBx 1.0 1.8 4.06 1310 1101 A 73 TYR HD% A 73 TYR HA 1.0 1.8 4.87 1311 1102 A 74 ASN H A 73 TYR HBx 1.0 1.8 3.96 1312 1103 A 73 TYR HA A 74 ASN HBy 1.0 1.8 5.15 1313 1104 A 73 TYR HA A 74 ASN H 1.0 1.8 3.38 1314 1105 A 73 TYR HD% A 74 ASN H 1.0 1.8 4.94 1315 1106 A 73 TYR HBy A 74 ASN HA 1.0 1.8 5.24 1316 1107 A 91 PHE HE% A 73 TYR HD% 1.0 1.8 2.65 1317 1108 A 91 PHE HE% A 73 TYR HBx 1.0 1.8 3.97 1318 1109 A 91 PHE HE% A 73 TYR HA 1.0 1.8 5.12 1319 1110 A 91 PHE HE% A 73 TYR HBy 1.0 1.8 4.24 1320 1111 A 73 TYR HBx A 92 VAL H 1.0 1.8 5.50 1321 1112 A 73 TYR HA A 93 PRO HA 1.0 1.8 3.46 1322 1113 A 73 TYR HD% A 93 PRO HBy 1.0 1.8 4.66 1323 1114 A 73 TYR HD% A 93 PRO HA 1.0 1.8 3.60 1324 1115 A 73 TYR HA A 94 LEU HBy 1.0 1.8 4.34 1325 1116 A 73 TYR HA A 94 LEU H 1.0 1.8 3.55 1326 1117 A 73 TYR HD% A 94 LEU HD2% 1.0 1.8 5.50 1327 1118 A 73 TYR HD% A 94 LEU H 1.0 1.8 5.02 1328 1119 A 73 TYR H A 94 LEU HG 1.0 1.8 4.78 1329 1120 A 73 TYR HA A 94 LEU HA 1.0 1.8 4.11 1330 1121 A 74 ASN H A 74 ASN HBy 1.0 1.8 3.86 1331 1122 A 74 ASN H A 74 ASN HBx 1.0 1.8 3.49 1332 1123 A 74 ASN HA A 75 VAL H 1.0 1.8 3.06 1333 1124 A 75 VAL H A 74 ASN HBx 1.0 1.8 4.78 1334 1125 A 74 ASN HA A 75 VAL HG2% 1.0 1.8 3.84 1335 1126 A 74 ASN H A 92 VAL HB 1.0 1.8 3.59 1336 1127 A 74 ASN H A 92 VAL H 1.0 1.8 4.06 1337 1128 A 74 ASN HBy A 92 VAL HB 1.0 1.8 3.89 1338 1129 A 74 ASN HA A 92 VAL HB 1.0 1.8 5.00 1339 1130 A 74 ASN HBy A 92 VAL HG2% 1.0 1.8 3.80 1340 1130 A 74 ASN HBy A 92 VAL HG1% 1.0 1.8 3.80 1341 1131 A 74 ASN H A 93 PRO HA 1.0 1.8 4.22 1342 1132 A 94 LEU HG A 74 ASN HBy 1.0 1.8 4.79 1343 1133 A 74 ASN HA A 94 LEU HG 1.0 1.8 5.19 1344 1134 A 94 LEU HG A 74 ASN HBx 1.0 1.8 3.76 1345 1135 A 74 ASN H A 94 LEU H 1.0 1.8 4.79 1346 1136 A 74 ASN HBx A 94 LEU HD2% 1.0 1.8 4.03 1347 1137 A 74 ASN HBy A 94 LEU HD2% 1.0 1.8 4.10 1348 1138 A 74 ASN H A 94 LEU HD2% 1.0 1.8 4.64 1349 1139 A 74 ASN H A 94 LEU HG 1.0 1.8 4.67 1350 1140 A 75 VAL HA A 75 VAL HG2% 1.0 1.8 3.55 1351 1140 A 75 VAL HG1% A 75 VAL HA 1.0 1.8 3.55 1352 1141 A 75 VAL HA A 75 VAL HG2% 1.0 1.8 3.30 1353 1142 A 75 VAL H A 75 VAL HG2% 1.0 1.8 3.49 1354 1142 A 75 VAL HG1% A 75 VAL H 1.0 1.8 3.49 1355 1143 A 75 VAL HG1% A 75 VAL H 1.0 1.8 4.97 1356 1144 A 75 VAL HG1% A 76 VAL HA 1.0 1.8 5.50 1357 1145 A 75 VAL HA A 76 VAL H 1.0 1.8 2.99 1358 1146 A 75 VAL HG1% A 76 VAL H 1.0 1.8 4.46 1359 1147 A 76 VAL H A 75 VAL HB 1.0 1.8 3.75 1360 1148 A 77 VAL HG1% A 75 VAL HB 1.0 1.8 4.84 1361 1149 A 88 LEU HD2% A 75 VAL HA 1.0 1.8 5.39 1362 1150 A 88 LEU HD2% A 75 VAL HB 1.0 1.8 4.45 1363 1151 A 88 LEU HD2% A 75 VAL HG2% 1.0 1.8 4.34 1364 1152 A 75 VAL HA A 90 ALA HB% 1.0 1.8 4.83 1365 1153 A 75 VAL HB A 91 PHE HA 1.0 1.8 4.70 1366 1154 A 91 PHE HA A 75 VAL HG2% 1.0 1.8 4.00 1367 1154 A 75 VAL HG1% A 91 PHE HA 1.0 1.8 4.00 1368 1155 A 75 VAL HG1% A 91 PHE HE% 1.0 1.8 4.79 1369 1156 A 75 VAL HA A 91 PHE H 1.0 1.8 4.98 1370 1157 A 75 VAL HG1% A 91 PHE HA 1.0 1.8 3.83 1371 1158 A 91 PHE HE% A 75 VAL HG2% 1.0 1.8 4.21 1372 1158 A 75 VAL HG1% A 91 PHE HE% 1.0 1.8 4.21 1373 1159 A 91 PHE HD% A 75 VAL HB 1.0 1.8 5.42 1374 1160 A 91 PHE HA A 75 VAL HG2% 1.0 1.8 4.44 1375 1161 A 91 PHE HD% A 75 VAL HG2% 1.0 1.8 4.00 1376 1161 A 75 VAL HG1% A 91 PHE HD% 1.0 1.8 4.00 1377 1162 A 75 VAL HG1% A 91 PHE HD% 1.0 1.8 4.16 1378 1163 A 92 VAL H A 75 VAL HA 1.0 1.8 3.75 1379 1164 A 76 VAL H A 76 VAL HB 1.0 1.8 3.97 1380 1165 A 76 VAL HG1% A 76 VAL HA 1.0 1.8 3.51 1381 1166 A 76 VAL HA A 76 VAL HG2% 1.0 1.8 3.44 1382 1167 A 76 VAL HA A 76 VAL HG2% 1.0 1.8 3.82 1383 1167 A 76 VAL HG1% A 76 VAL HA 1.0 1.8 3.82 1384 1168 A 76 VAL H A 76 VAL HG2% 1.0 1.8 3.96 1385 1168 A 76 VAL HG1% A 76 VAL H 1.0 1.8 3.96 1386 1169 A 76 VAL HA A 77 VAL H 1.0 1.8 3.11 1387 1170 A 77 VAL H A 76 VAL H 1.0 1.8 5.14 1388 1171 A 76 VAL HG1% A 77 VAL H 1.0 1.8 3.29 1389 1172 A 77 VAL H A 76 VAL HG2% 1.0 1.8 3.56 1390 1172 A 76 VAL HG1% A 77 VAL H 1.0 1.8 3.56 1391 1173 A 89 VAL HG2% A 76 VAL HB 1.0 1.8 3.02 1392 1174 A 90 ALA HB% A 76 VAL HB 1.0 1.8 3.35 1393 1175 A 90 ALA H A 76 VAL HG2% 1.0 1.8 4.73 1394 1175 A 76 VAL HG1% A 90 ALA H 1.0 1.8 4.73 1395 1176 A 90 ALA HB% A 76 VAL HG2% 1.0 1.8 3.69 1396 1177 A 76 VAL HB A 90 ALA H 1.0 1.8 3.47 1397 1178 A 76 VAL H A 91 PHE HA 1.0 1.8 4.19 1398 1179 A 77 VAL HG1% A 77 VAL H 1.0 1.8 3.83 1399 1180 A 77 VAL HG1% A 77 VAL HA 1.0 1.8 3.82 1400 1181 A 77 VAL HB A 77 VAL H 1.0 1.8 3.60 1401 1182 A 77 VAL HG1% A 78 LEU H 1.0 1.8 3.56 1402 1183 A 78 LEU HBx A 77 VAL HA 1.0 1.8 4.70 1403 1184 A 78 LEU H A 77 VAL HA 1.0 1.8 3.17 1404 1185 A 78 LEU HBy A 77 VAL HA 1.0 1.8 4.82 1405 1186 A 77 VAL HG1% A 86 LEU HBx 1.0 1.8 4.60 1406 1187 A 77 VAL HG1% A 87 LYS H 1.0 1.8 3.94 1407 1188 A 87 LYS H A 77 VAL HG2% 1.0 1.8 5.27 1408 1189 A 88 LEU HD2% A 77 VAL HA 1.0 1.8 5.32 1409 1190 A 77 VAL HG1% A 88 LEU HD2% 1.0 1.8 4.52 1410 1191 A 77 VAL HG1% A 88 LEU HA 1.0 1.8 4.25 1411 1192 A 88 LEU HD2% A 77 VAL H 1.0 1.8 4.88 1412 1193 A 77 VAL HA A 89 VAL H 1.0 1.8 4.21 1413 1194 A 77 VAL HG1% A 89 VAL H 1.0 1.8 4.11 1414 1195 A 78 LEU H A 78 LEU HG 1.0 1.8 4.38 1415 1196 A 78 LEU HD1% A 78 LEU HA 1.0 1.8 3.84 1416 1197 A 78 LEU H A 78 LEU HBx 1.0 1.8 3.19 1417 1198 A 78 LEU HBy A 78 LEU H 1.0 1.8 3.44 1418 1199 A 78 LEU HD1% A 78 LEU HBx 1.0 1.8 4.07 1419 1200 A 78 LEU HBy A 78 LEU HG 1.0 1.8 2.82 1420 1201 A 79 GLU H A 78 LEU HG 1.0 1.8 4.10 1421 1202 A 78 LEU HD1% A 79 GLU H 1.0 1.8 3.59 1422 1203 A 79 GLU H A 78 LEU HA 1.0 1.8 3.40 1423 1204 A 78 LEU HG A 79 GLU HA 1.0 1.8 5.50 1424 1205 A 78 LEU HD1% A 80 LYS H 1.0 1.8 5.43 1425 1206 A 78 LEU HG A 80 LYS HEx 1.0 1.8 4.03 1426 1206 A 78 LEU HG A 80 LYS HEy 1.0 1.8 4.03 1427 1207 A 78 LEU HD1% A 80 LYS HEx 1.0 1.8 5.23 1428 1207 A 78 LEU HD1% A 80 LYS HEy 1.0 1.8 5.23 1429 1208 A 78 LEU HD1% A 80 LYS HBx 1.0 1.8 5.46 1430 1209 A 78 LEU HD1% A 80 LYS HA 1.0 1.8 5.00 1431 1210 A 78 LEU HG A 80 LYS H 1.0 1.8 4.53 1432 1211 A 80 LYS HA A 78 LEU HG 1.0 1.8 5.14 1433 1212 A 78 LEU HD1% A 81 ALA H 1.0 1.8 5.50 1434 1213 A 87 LYS H A 78 LEU H 1.0 1.8 3.99 1435 1214 A 87 LYS H A 78 LEU HD1% 1.0 1.8 5.48 1436 1215 A 78 LEU HBx A 87 LYS HEx 1.0 1.8 4.68 1437 1215 A 78 LEU HBx A 87 LYS HEy 1.0 1.8 4.68 1438 1216 A 87 LYS H A 78 LEU HBy 1.0 1.8 4.47 1439 1217 A 87 LYS H A 78 LEU HG 1.0 1.8 4.79 1440 1218 A 78 LEU HG A 87 LYS HBx 1.0 1.8 3.07 1441 1218 A 87 LYS HBy A 78 LEU HG 1.0 1.8 3.07 1442 1219 A 78 LEU HG A 87 LYS HDx 1.0 1.8 4.92 1443 1219 A 78 LEU HG A 87 LYS HDy 1.0 1.8 4.92 1444 1220 A 78 LEU H A 87 LYS HBx 1.0 1.8 4.65 1445 1220 A 87 LYS HBy A 78 LEU H 1.0 1.8 4.65 1446 1221 A 78 LEU H A 89 VAL HG2% 1.0 1.8 3.39 1447 1222 A 78 LEU HBx A 89 VAL HG2% 1.0 1.8 2.40 1448 1223 A 78 LEU H A 89 VAL H 1.0 1.8 5.15 1449 1224 A 79 GLU H A 79 GLU HGx 1.0 1.8 4.43 1450 1224 A 79 GLU HGy A 79 GLU H 1.0 1.8 4.43 1451 1225 A 79 GLU HA A 79 GLU HGx 1.0 1.8 3.71 1452 1225 A 79 GLU HGy A 79 GLU HA 1.0 1.8 3.71 1453 1226 A 79 GLU HA A 80 LYS H 1.0 1.8 2.87 1454 1227 A 79 GLU H A 80 LYS H 1.0 1.8 5.07 1455 1228 A 80 LYS H A 79 GLU HGx 1.0 1.8 3.94 1456 1228 A 79 GLU HGy A 80 LYS H 1.0 1.8 3.94 1457 1229 A 86 LEU HD1% A 79 GLU HGx 1.0 1.8 3.47 1458 1229 A 79 GLU HGy A 86 LEU HD1% 1.0 1.8 3.47 1459 1230 A 79 GLU HBy A 86 LEU HD1% 1.0 1.8 4.53 1460 1231 A 79 GLU HBx A 86 LEU HD1% 1.0 1.8 5.50 1461 1232 A 86 LEU HBy A 79 GLU HA 1.0 1.8 3.82 1462 1233 A 86 LEU HD1% A 79 GLU HA 1.0 1.8 3.64 1463 1234 A 87 LYS H A 79 GLU HA 1.0 1.8 4.98 1464 1235 A 80 LYS HEy A 80 LYS HGy 1.0 1.8 4.07 1465 1235 A 80 LYS HEx A 80 LYS HGy 1.0 1.8 4.07 1466 1235 A 80 LYS HGx A 80 LYS HEx 1.0 1.8 4.07 1467 1235 A 80 LYS HEy A 80 LYS HGx 1.0 1.8 4.07 1468 1236 A 80 LYS H A 80 LYS HDx 1.0 1.8 5.36 1469 1236 A 80 LYS H A 80 LYS HDy 1.0 1.8 5.36 1470 1237 A 80 LYS H A 80 LYS HEx 1.0 1.8 5.46 1471 1237 A 80 LYS H A 80 LYS HEy 1.0 1.8 5.46 1472 1238 A 80 LYS H A 80 LYS HBx 1.0 1.8 3.45 1473 1239 A 80 LYS HA A 81 ALA HB% 1.0 1.8 4.39 1474 1240 A 80 LYS HA A 81 ALA H 1.0 1.8 3.18 1475 1241 A 81 ALA H A 80 LYS HGy 1.0 1.8 5.50 1476 1241 A 81 ALA H A 80 LYS HGx 1.0 1.8 5.50 1477 1242 A 82 SER H A 80 LYS HGy 1.0 1.8 4.52 1478 1242 A 80 LYS HGx A 82 SER H 1.0 1.8 4.52 1479 1243 A 80 LYS HGx A 82 SER HBx 1.0 1.8 4.10 1480 1244 A 82 SER HBx A 80 LYS HEx 1.0 1.8 5.41 1481 1244 A 80 LYS HEy A 82 SER HBx 1.0 1.8 5.41 1482 1245 A 80 LYS HA A 82 SER H 1.0 1.8 4.66 1483 1246 A 82 SER H A 80 LYS HBy 1.0 1.8 4.12 1484 1247 A 80 LYS HBx A 82 SER H 1.0 1.8 5.15 1485 1248 A 82 SER HBx A 80 LYS HGy 1.0 1.8 2.94 1486 1248 A 80 LYS HGx A 82 SER HBx 1.0 1.8 2.94 1487 1249 A 80 LYS HBx A 83 ASP H 1.0 1.8 4.18 1488 1250 A 80 LYS HBy A 83 ASP H 1.0 1.8 4.21 1489 1251 A 80 LYS HBy A 85 SER H 1.0 1.8 4.21 1490 1252 A 80 LYS H A 85 SER H 1.0 1.8 4.26 1491 1253 A 86 LEU HD1% A 80 LYS H 1.0 1.8 4.21 1492 1254 A 80 LYS H A 86 LEU HA 1.0 1.8 2.98 1493 1255 A 81 ALA H A 81 ALA HB% 1.0 1.8 3.38 1494 1256 A 81 ALA H A 82 SER H 1.0 1.8 3.64 1495 1257 A 81 ALA HB% A 82 SER H 1.0 1.8 4.07 1496 1258 A 82 SER H A 82 SER HBx 1.0 1.8 3.34 1497 1259 A 82 SER HA A 82 SER HBy 1.0 1.8 2.97 1498 1260 A 82 SER H A 83 ASP H 1.0 1.8 3.71 1499 1261 A 82 SER HBx A 83 ASP H 1.0 1.8 4.43 1500 1262 A 83 ASP H A 83 ASP HBx 1.0 1.8 3.97 1501 1263 A 83 ASP H A 84 ASN H 1.0 1.8 2.81 1502 1264 A 83 ASP HA A 84 ASN HBx 1.0 1.8 5.02 1503 1265 A 83 ASP H A 85 SER H 1.0 1.8 3.99 1504 1266 A 84 ASN H A 84 ASN HA 1.0 1.8 2.89 1505 1267 A 84 ASN H A 84 ASN HBy 1.0 1.8 4.13 1506 1268 A 85 SER H A 84 ASN H 1.0 1.8 3.42 1507 1269 A 85 SER H A 84 ASN HBy 1.0 1.8 4.91 1508 1270 A 85 SER H A 84 ASN HBx 1.0 1.8 5.00 1509 1271 A 85 SER H A 85 SER HBx 1.0 1.8 3.19 1510 1271 A 85 SER H A 85 SER HBy 1.0 1.8 3.19 1511 1272 A 86 LEU H A 85 SER HBx 1.0 1.8 3.26 1512 1272 A 85 SER HBy A 86 LEU H 1.0 1.8 3.26 1513 1273 A 85 SER H A 86 LEU H 1.0 1.8 4.20 1514 1274 A 86 LEU HD2% A 85 SER HBx 1.0 1.8 4.56 1515 1274 A 86 LEU HD2% A 85 SER HBy 1.0 1.8 4.56 1516 1275 A 86 LEU HD2% A 86 LEU H 1.0 1.8 3.86 1517 1276 A 86 LEU HD1% A 86 LEU HA 1.0 1.8 3.26 1518 1277 A 86 LEU HD1% A 86 LEU HBy 1.0 1.8 2.40 1519 1278 A 86 LEU HBy A 86 LEU H 1.0 1.8 3.91 1520 1279 A 86 LEU HG A 86 LEU H 1.0 1.8 4.37 1521 1280 A 86 LEU HD1% A 86 LEU H 1.0 1.8 4.04 1522 1281 A 86 LEU HBy A 87 LYS H 1.0 1.8 3.78 1523 1282 A 87 LYS H A 86 LEU HA 1.0 1.8 3.10 1524 1283 A 86 LEU HA A 87 LYS HBx 1.0 1.8 5.17 1525 1283 A 87 LYS HBy A 86 LEU HA 1.0 1.8 5.17 1526 1284 A 86 LEU HG A 87 LYS H 1.0 1.8 4.96 1527 1285 A 86 LEU HBx A 87 LYS H 1.0 1.8 4.18 1528 1286 A 87 LYS H A 86 LEU H 1.0 1.8 4.77 1529 1287 A 87 LYS H A 87 LYS HGx 1.0 1.8 4.72 1530 1287 A 87 LYS H A 87 LYS HGy 1.0 1.8 4.72 1531 1288 A 87 LYS HA A 87 LYS HDx 1.0 1.8 3.91 1532 1288 A 87 LYS HA A 87 LYS HDy 1.0 1.8 3.91 1533 1289 A 87 LYS HEx A 87 LYS HGx 1.0 1.8 4.05 1534 1289 A 87 LYS HEy A 87 LYS HGx 1.0 1.8 4.05 1535 1289 A 87 LYS HGy A 87 LYS HEx 1.0 1.8 4.05 1536 1289 A 87 LYS HEy A 87 LYS HGy 1.0 1.8 4.05 1537 1290 A 87 LYS HBx A 87 LYS HDx 1.0 1.8 2.60 1538 1290 A 87 LYS HBy A 87 LYS HDx 1.0 1.8 2.60 1539 1290 A 87 LYS HDy A 87 LYS HBx 1.0 1.8 2.60 1540 1290 A 87 LYS HBy A 87 LYS HDy 1.0 1.8 2.60 1541 1291 A 87 LYS HBy A 87 LYS HEx 1.0 1.8 3.19 1542 1291 A 87 LYS HBx A 87 LYS HEx 1.0 1.8 3.19 1543 1291 A 87 LYS HEy A 87 LYS HBx 1.0 1.8 3.19 1544 1291 A 87 LYS HBy A 87 LYS HEy 1.0 1.8 3.19 1545 1292 A 87 LYS H A 87 LYS HBx 1.0 1.8 3.76 1546 1292 A 87 LYS HBy A 87 LYS H 1.0 1.8 3.76 1547 1293 A 87 LYS H A 88 LEU H 1.0 1.8 4.89 1548 1294 A 87 LYS HA A 88 LEU H 1.0 1.8 2.91 1549 1295 A 88 LEU H A 87 LYS HDx 1.0 1.8 4.12 1550 1295 A 88 LEU H A 87 LYS HDy 1.0 1.8 4.12 1551 1296 A 88 LEU H A 87 LYS HGx 1.0 1.8 3.46 1552 1296 A 88 LEU H A 87 LYS HGy 1.0 1.8 3.46 1553 1297 A 88 LEU HA A 87 LYS HBx 1.0 1.8 5.19 1554 1297 A 87 LYS HBy A 88 LEU HA 1.0 1.8 5.19 1555 1298 A 88 LEU H A 87 LYS HBx 1.0 1.8 3.97 1556 1298 A 87 LYS HBy A 88 LEU H 1.0 1.8 3.97 1557 1299 A 89 VAL HG1% A 87 LYS HEx 1.0 1.8 5.50 1558 1299 A 89 VAL HG1% A 87 LYS HEy 1.0 1.8 5.50 1559 1300 A 89 VAL HG2% A 87 LYS HEx 1.0 1.8 4.36 1560 1300 A 89 VAL HG2% A 87 LYS HEy 1.0 1.8 4.36 1561 1301 A 89 VAL HA A 87 LYS HEx 1.0 1.8 4.62 1562 1301 A 87 LYS HEy A 89 VAL HA 1.0 1.8 4.62 1563 1302 A 88 LEU H A 88 LEU HBx 1.0 1.8 3.30 1564 1303 A 88 LEU HD2% A 88 LEU HA 1.0 1.8 3.32 1565 1304 A 88 LEU HD1% A 88 LEU HBy 1.0 1.8 3.53 1566 1305 A 88 LEU H A 88 LEU HD1% 1.0 1.8 4.49 1567 1306 A 88 LEU H A 88 LEU HBy 1.0 1.8 3.30 1568 1307 A 88 LEU H A 88 LEU HG 1.0 1.8 4.92 1569 1308 A 88 LEU HA A 89 VAL HG2% 1.0 1.8 4.11 1570 1309 A 88 LEU H A 89 VAL H 1.0 1.8 4.78 1571 1310 A 88 LEU HD1% A 89 VAL H 1.0 1.8 4.86 1572 1311 A 88 LEU HA A 89 VAL H 1.0 1.8 3.33 1573 1312 A 88 LEU HBy A 89 VAL H 1.0 1.8 4.48 1574 1313 A 88 LEU HD2% A 89 VAL H 1.0 1.8 3.57 1575 1314 A 88 LEU HD1% A 90 ALA H 1.0 1.8 4.47 1576 1315 A 88 LEU HD1% A 90 ALA HA 1.0 1.8 4.06 1577 1316 A 88 LEU HD2% A 90 ALA H 1.0 1.8 3.57 1578 1317 A 88 LEU HD2% A 90 ALA HA 1.0 1.8 4.98 1579 1318 A 88 LEU HD1% A 91 PHE HD% 1.0 1.8 4.26 1580 1319 A 88 LEU HD1% A 91 PHE H 1.0 1.8 5.50 1581 1320 A 88 LEU HD1% A 91 PHE HBy 1.0 1.8 4.37 1582 1321 A 88 LEU HD2% A 91 PHE HBx 1.0 1.8 4.39 1583 1322 A 88 LEU HD2% A 91 PHE HD% 1.0 1.8 3.98 1584 1323 A 88 LEU HD1% A 91 PHE HBx 1.0 1.8 4.04 1585 1324 A 88 LEU HD2% A 91 PHE H 1.0 1.8 5.50 1586 1325 A 89 VAL H A 89 VAL HB 1.0 1.8 3.55 1587 1326 A 89 VAL HG2% A 89 VAL H 1.0 1.8 4.08 1588 1327 A 89 VAL HG1% A 89 VAL H 1.0 1.8 4.01 1589 1328 A 89 VAL HG2% A 89 VAL HA 1.0 1.8 3.31 1590 1329 A 89 VAL HG1% A 89 VAL HA 1.0 1.8 3.52 1591 1330 A 89 VAL H A 90 ALA HA 1.0 1.8 5.22 1592 1331 A 89 VAL HG1% A 90 ALA H 1.0 1.8 4.45 1593 1332 A 90 ALA H A 89 VAL HB 1.0 1.8 3.13 1594 1333 A 90 ALA H A 89 VAL H 1.0 1.8 3.19 1595 1334 A 90 ALA HB% A 90 ALA H 1.0 1.8 3.68 1596 1335 A 91 PHE H A 90 ALA HA 1.0 1.8 2.63 1597 1336 A 90 ALA HB% A 91 PHE H 1.0 1.8 3.41 1598 1337 A 91 PHE H A 90 ALA H 1.0 1.8 4.51 1599 1338 A 90 ALA HB% A 92 VAL HG2% 1.0 1.8 3.13 1600 1338 A 92 VAL HG1% A 90 ALA HB% 1.0 1.8 3.13 1601 1339 A 92 VAL H A 90 ALA HB% 1.0 1.8 5.00 1602 1340 A 91 PHE HBy A 91 PHE H 1.0 1.8 3.39 1603 1341 A 91 PHE H A 91 PHE HBx 1.0 1.8 3.64 1604 1342 A 91 PHE HD% A 91 PHE H 1.0 1.8 4.92 1605 1343 A 91 PHE HD% A 91 PHE HA 1.0 1.8 4.68 1606 1344 A 91 PHE HD% A 92 VAL HA 1.0 1.8 4.93 1607 1345 A 91 PHE HA A 92 VAL HG2% 1.0 1.8 3.15 1608 1345 A 92 VAL HG1% A 91 PHE HA 1.0 1.8 3.15 1609 1346 A 92 VAL H A 91 PHE H 1.0 1.8 4.79 1610 1347 A 91 PHE HD% A 92 VAL H 1.0 1.8 4.70 1611 1348 A 91 PHE HBy A 92 VAL H 1.0 1.8 5.06 1612 1349 A 91 PHE HD% A 92 VAL HB 1.0 1.8 5.12 1613 1350 A 91 PHE H A 92 VAL HG2% 1.0 1.8 4.03 1614 1350 A 92 VAL HG1% A 91 PHE H 1.0 1.8 4.03 1615 1351 A 92 VAL H A 91 PHE HA 1.0 1.8 2.93 1616 1352 A 91 PHE H A 92 VAL HG2% 1.0 1.8 3.94 1617 1353 A 91 PHE HD% A 93 PRO HA 1.0 1.8 4.67 1618 1354 A 91 PHE HE% A 93 PRO HBy 1.0 1.8 4.82 1619 1355 A 92 VAL H A 92 VAL HG2% 1.0 1.8 3.40 1620 1356 A 92 VAL H A 92 VAL HG2% 1.0 1.8 3.40 1621 1356 A 92 VAL H A 92 VAL HG1% 1.0 1.8 3.40 1622 1357 A 92 VAL HA A 92 VAL HG2% 1.0 1.8 3.17 1623 1357 A 92 VAL HG1% A 92 VAL HA 1.0 1.8 3.17 1624 1358 A 92 VAL H A 92 VAL HB 1.0 1.8 3.38 1625 1359 A 93 PRO HDx A 92 VAL HG2% 1.0 1.8 3.08 1626 1359 A 92 VAL HG1% A 93 PRO HDx 1.0 1.8 3.08 1627 1360 A 92 VAL H A 93 PRO HA 1.0 1.8 5.12 1628 1361 A 93 PRO HBy A 92 VAL HA 1.0 1.8 4.76 1629 1362 A 92 VAL HB A 94 LEU HD2% 1.0 1.8 4.48 1630 1363 A 92 VAL HA A 94 LEU HD2% 1.0 1.8 5.50 1631 1364 A 92 VAL HG1% A 94 LEU HD2% 1.0 1.8 4.40 1632 1364 A 92 VAL HG2% A 94 LEU HD2% 1.0 1.8 4.40 1633 1365 A 93 PRO HA A 94 LEU H 1.0 1.8 3.14 1634 1366 A 94 LEU H A 93 PRO HBx 1.0 1.8 4.56 1635 1367 A 95 PHE H A 93 PRO HBx 1.0 1.8 3.99 1636 1368 A 95 PHE H A 93 PRO HGy 1.0 1.8 5.20 1637 1369 A 93 PRO HA A 95 PHE HE% 1.0 1.8 4.71 1638 1370 A 93 PRO HBx A 95 PHE HE% 1.0 1.8 3.35 1639 1371 A 94 LEU H A 94 LEU HD2% 1.0 1.8 5.10 1640 1372 A 94 LEU HBy A 94 LEU H 1.0 1.8 3.60 1641 1373 A 94 LEU HBy A 94 LEU HD2% 1.0 1.8 3.53 1642 1374 A 94 LEU HA A 94 LEU HD2% 1.0 1.8 3.42 1643 1375 A 94 LEU HA A 94 LEU HD1% 1.0 1.8 3.91 1644 1376 A 94 LEU HBx A 95 PHE HD% 1.0 1.8 4.64 1645 1377 A 95 PHE H A 94 LEU H 1.0 1.8 4.10 1646 1378 A 95 PHE H A 94 LEU HA 1.0 1.8 3.48 1647 1379 A 95 PHE H A 94 LEU HD2% 1.0 1.8 4.81 1648 1379 A 95 PHE H A 94 LEU HD1% 1.0 1.8 4.81 1649 1380 A 95 PHE H A 94 LEU HD2% 1.0 1.8 4.60 1650 1381 A 95 PHE HD% A 94 LEU H 1.0 1.8 4.04 1651 1382 A 94 LEU HBx A 95 PHE H 1.0 1.8 4.61 1652 1383 A 94 LEU H A 95 PHE HE% 1.0 1.8 4.60 1653 1384 A 95 PHE H A 94 LEU HBy 1.0 1.8 4.53 1654 1385 A 95 PHE H A 95 PHE HD% 1.0 1.8 4.40 1655 1386 A 95 PHE HD% A 95 PHE HA 1.0 1.8 4.92 1656 1387 A 55 TYR HE% A 78 LEU HA 1.0 1.8 5.08 1657 1388 A 55 TYR HD% A 78 LEU HA 1.0 1.8 5.08 1658 1389 A 55 TYR HE% A 78 LEU HBy 1.0 1.8 5.25 1659 1390 A 55 TYR HE% A 78 LEU HBx 1.0 1.8 3.61 1660 1391 A 55 TYR HD% A 79 GLU H 1.0 1.8 4.70 1661 1392 A 55 TYR HE% A 78 LEU HG 1.0 1.8 5.10 1662 1393 A 91 PHE HD% A 93 PRO HA 1.0 1.8 5.50 1663 1394 A 73 TYR HD% A 93 PRO HA 1.0 1.8 4.20 1664 1395 A 73 TYR HE% A 93 PRO HA 1.0 1.8 4.70 1665 1396 A 91 PHE HE% A 27 LEU HA 1.0 1.8 3.95 1666 1397 A 73 TYR HD% A 62 ALA H 1.0 1.8 5.19 1667 1398 A 36 ILE HD1% A 66 PRO HDx 1.0 1.8 4.50 1668 1398 A 36 ILE HD1% A 66 PRO HDy 1.0 1.8 4.50 1669 1399 A 36 ILE HD1% A 65 SER HA 1.0 1.8 4.00 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 12 ILE H A 43 GLY O 1.0 1.5 2.2 2 2 A 43 GLY O A 12 ILE N 1.0 2.3 3.2 3 3 A 16 ASP H A 13 SER O 1.0 1.5 2.2 4 4 A 13 SER O A 16 ASP N 1.0 2.3 3.2 5 5 A 20 LYS H A 16 ASP O 1.0 1.5 2.2 6 6 A 16 ASP O A 20 LYS N 1.0 2.3 3.2 7 7 A 22 ILE H A 18 ARG O 1.0 1.5 2.2 8 8 A 18 ARG O A 22 ILE N 1.0 2.3 3.2 9 9 A 23 ALA H A 19 VAL O 1.0 1.5 2.2 10 10 A 19 VAL O A 23 ALA N 1.0 2.3 3.2 11 11 A 24 GLU H A 20 LYS O 1.0 1.5 2.2 12 12 A 20 LYS O A 24 GLU N 1.0 2.3 3.2 13 13 A 25 PHE H A 21 GLU O 1.0 1.5 2.2 14 14 A 21 GLU O A 25 PHE N 1.0 2.3 3.2 15 15 A 26 ALA H A 22 ILE O 1.0 1.5 2.2 16 16 A 22 ILE O A 26 ALA N 1.0 2.3 3.2 17 17 A 27 LEU H A 23 ALA O 1.0 1.5 2.2 18 18 A 23 ALA O A 27 LEU N 1.0 2.3 3.2 19 19 A 28 LYS H A 24 GLU O 1.0 1.5 2.2 20 20 A 24 GLU O A 28 LYS N 1.0 2.3 3.2 21 21 A 29 GLN H A 25 PHE O 1.0 1.5 2.2 22 22 A 25 PHE O A 29 GLN N 1.0 2.3 3.2 23 23 A 36 ILE H A 63 LYS O 1.0 1.5 2.2 24 24 A 63 LYS O A 36 ILE N 1.0 2.3 3.2 25 25 A 38 ALA H A 61 SER O 1.0 1.5 2.2 26 26 A 61 SER O A 38 ALA N 1.0 2.3 3.2 27 27 A 39 GLY H A 61 SER O 1.0 1.5 2.2 28 28 A 61 SER O A 39 GLY N 1.0 2.3 3.2 29 29 A 42 ALA H A 59 ILE O 1.0 1.5 2.2 30 30 A 59 ILE O A 42 ALA N 1.0 2.3 3.2 31 31 A 44 GLN H A 57 ASN O 1.0 1.5 2.2 32 32 A 57 ASN O A 44 GLN N 1.0 2.3 3.2 33 33 A 46 ILE H A 55 TYR O 1.0 1.5 2.2 34 34 A 55 TYR O A 46 ILE N 1.0 2.3 3.2 35 35 A 55 TYR H A 46 ILE O 1.0 1.5 2.2 36 36 A 46 ILE O A 55 TYR N 1.0 2.3 3.2 37 37 A 56 TYR H A 77 VAL O 1.0 1.5 2.2 38 38 A 77 VAL O A 56 TYR N 1.0 2.3 3.2 39 39 A 57 ASN H A 44 GLN O 1.0 1.5 2.2 40 40 A 44 GLN O A 57 ASN N 1.0 2.3 3.2 41 41 A 58 LEU H A 75 VAL O 1.0 1.5 2.2 42 42 A 75 VAL O A 58 LEU N 1.0 2.3 3.2 43 43 A 59 ILE H A 42 ALA O 1.0 1.5 2.2 44 44 A 42 ALA O A 59 ILE N 1.0 2.3 3.2 45 45 A 60 LEU H A 73 TYR O 1.0 1.5 2.2 46 46 A 73 TYR O A 60 LEU N 1.0 2.3 3.2 47 47 A 62 ALA H A 71 LYS O 1.0 1.5 2.2 48 48 A 71 LYS O A 62 ALA N 1.0 2.3 3.2 49 49 A 63 LYS H A 36 ILE O 1.0 1.5 2.2 50 50 A 36 ILE O A 63 LYS N 1.0 2.3 3.2 51 51 A 68 GLU H A 65 SER O 1.0 1.5 2.2 52 52 A 65 SER O A 68 GLU N 1.0 2.3 3.2 53 53 A 71 LYS H A 62 ALA O 1.0 1.5 2.2 54 54 A 62 ALA O A 71 LYS N 1.0 2.3 3.2 55 55 A 73 TYR H A 60 LEU O 1.0 1.5 2.2 56 56 A 60 LEU O A 73 TYR N 1.0 2.3 3.2 57 57 A 74 ASN H A 92 VAL O 1.0 1.5 2.2 58 58 A 92 VAL O A 74 ASN N 1.0 2.3 3.2 59 59 A 75 VAL H A 58 LEU O 1.0 1.5 2.2 60 60 A 58 LEU O A 75 VAL N 1.0 2.3 3.2 61 61 A 77 VAL H A 56 TYR O 1.0 1.5 2.2 62 62 A 56 TYR O A 77 VAL N 1.0 2.3 3.2 63 63 A 78 LEU H A 87 LYS O 1.0 1.5 2.2 64 64 A 87 LYS O A 78 LEU N 1.0 2.3 3.2 65 65 A 80 LYS H A 85 SER O 1.0 1.5 2.2 66 66 A 85 SER O A 80 LYS N 1.0 2.3 3.2 67 67 A 84 ASN H A 81 ALA O 1.0 1.5 2.2 68 68 A 81 ALA O A 84 ASN N 1.0 2.3 3.2 69 69 A 85 SER H A 80 LYS O 1.0 1.5 2.2 70 70 A 80 LYS O A 85 SER N 1.0 2.3 3.2 71 71 A 87 LYS H A 78 LEU O 1.0 1.5 2.2 72 72 A 78 LEU O A 87 LYS N 1.0 2.3 3.2 73 73 A 90 ALA H A 76 VAL O 1.0 1.5 2.2 74 74 A 76 VAL O A 90 ALA N 1.0 2.3 3.2 75 75 A 92 VAL H A 74 ASN O 1.0 1.5 2.2 76 76 A 74 ASN O A 92 VAL N 1.0 2.3 3.2 77 77 A 94 LEU H A 72 PHE O 1.0 1.5 2.2 78 78 A 72 PHE O A 94 LEU N 1.0 2.3 3.2 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 GLY C A 2 PRO N A 2 PRO CA A 2 PRO C 1.0 -111.18 -58.68 PHI 2 2 A 7 GLY C A 8 GLU N A 8 GLU CA A 8 GLU C 1.0 -146.61 -90.47 PHI 3 3 A 8 GLU C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -123.98 -93.98 PHI 4 4 A 9 VAL C A 10 ILE N A 10 ILE CA A 10 ILE C 1.0 -142.74 -102.64 PHI 5 5 A 11 GLY C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -127.34 -97.34 PHI 6 6 A 12 ILE C A 13 SER N A 13 SER CA A 13 SER C 1.0 -116.23 -76.11 PHI 7 7 A 13 SER C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -74.38 -44.38 PHI 8 8 A 15 ASN C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 -106.68 -58.16 PHI 9 9 A 16 ASP C A 17 PRO N A 17 PRO CA A 17 PRO C 1.0 -75.64 -45.64 PHI 10 10 A 17 PRO C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 -80.57 -50.57 PHI 11 11 A 18 ARG C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -80.59 -50.59 PHI 12 12 A 19 VAL C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -77.45 -45.41 PHI 13 13 A 20 LYS C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -80.44 -50.44 PHI 14 14 A 21 GLU C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -81.65 -51.65 PHI 15 15 A 22 ILE C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -78.02 -48.02 PHI 16 16 A 23 ALA C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -79.28 -49.28 PHI 17 17 A 24 GLU C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -79.11 -49.11 PHI 18 18 A 25 PHE C A 26 ALA N A 26 ALA CA A 26 ALA C 1.0 -78.60 -48.60 PHI 19 19 A 26 ALA C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -80.58 -48.92 PHI 20 20 A 27 LEU C A 28 LYS N A 28 LYS CA A 28 LYS C 1.0 -80.42 -50.42 PHI 21 21 A 28 LYS C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -90.32 -60.14 PHI 22 22 A 31 ALA C A 32 GLU N A 32 GLU CA A 32 GLU C 1.0 -95.16 -64.70 PHI 23 23 A 34 ASN C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -140.78 -85.24 PHI 24 24 A 35 LEU C A 36 ILE N A 36 ILE CA A 36 ILE C 1.0 -147.02 -101.20 PHI 25 25 A 36 ILE C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -135.19 -48.93 PHI 26 26 A 37 LEU C A 38 ALA N A 38 ALA CA A 38 ALA C 1.0 -127.50 -66.34 PHI 27 27 A 41 ASP C A 42 ALA N A 42 ALA CA A 42 ALA C 1.0 -162.64 -132.58 PHI 28 28 A 43 GLY C A 44 GLN N A 44 GLN CA A 44 GLN C 1.0 -156.56 -127.02 PHI 29 29 A 44 GLN C A 45 ILE N A 45 ILE CA A 45 ILE C 1.0 -144.56 -114.48 PHI 30 30 A 45 ILE C A 46 ILE N A 46 ILE CA A 46 ILE C 1.0 -138.15 -108.11 PHI 31 31 A 46 ILE C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -133.99 -96.25 PHI 32 32 A 48 GLY C A 49 ILE N A 49 ILE CA A 49 ILE C 1.0 -120.00 0.00 PHI 33 33 A 49 ILE C A 50 PRO N A 50 PRO CA A 50 PRO C 1.0 -125.85 -65.81 PHI 34 34 A 50 PRO C A 51 HIS N A 51 HIS CA A 51 HIS C 1.0 -120.00 0.00 PHI 35 35 A 51 HIS C A 52 TRP N A 52 TRP CA A 52 TRP C 1.0 27.10 99.72 PHI 36 36 A 52 TRP C A 53 ASP N A 53 ASP CA A 53 ASP C 1.0 -120.00 0.00 PHI 37 37 A 54 ASN C A 55 TYR N A 55 TYR CA A 55 TYR C 1.0 -127.64 -79.86 PHI 38 38 A 55 TYR C A 56 TYR N A 56 TYR CA A 56 TYR C 1.0 -123.20 -82.26 PHI 39 39 A 56 TYR C A 57 ASN N A 57 ASN CA A 57 ASN C 1.0 -143.90 -109.14 PHI 40 40 A 57 ASN C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -149.67 -83.87 PHI 41 41 A 58 LEU C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -141.54 -81.54 PHI 42 42 A 59 ILE C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -145.21 -105.67 PHI 43 43 A 60 LEU C A 61 SER N A 61 SER CA A 61 SER C 1.0 -141.22 -89.92 PHI 44 44 A 61 SER C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -154.88 -117.28 PHI 45 45 A 62 ALA C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -155.41 -117.55 PHI 46 46 A 63 LYS C A 64 HIS N A 64 HIS CA A 64 HIS C 1.0 -110.40 -74.40 PHI 47 47 A 65 SER C A 66 PRO N A 66 PRO CA A 66 PRO C 1.0 -74.71 -43.65 PHI 48 48 A 66 PRO C A 67 HIS N A 67 HIS CA A 67 HIS C 1.0 -111.26 -81.10 PHI 49 49 A 67 HIS C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -140.38 -82.28 PHI 50 50 A 70 SER C A 71 LYS N A 71 LYS CA A 71 LYS C 1.0 -155.77 -108.21 PHI 51 51 A 71 LYS C A 72 PHE N A 72 PHE CA A 72 PHE C 1.0 -157.05 -86.89 PHI 52 52 A 72 PHE C A 73 TYR N A 73 TYR CA A 73 TYR C 1.0 -155.23 -117.19 PHI 53 53 A 73 TYR C A 74 ASN N A 74 ASN CA A 74 ASN C 1.0 -142.22 -112.02 PHI 54 54 A 74 ASN C A 75 VAL N A 75 VAL CA A 75 VAL C 1.0 -141.85 -111.85 PHI 55 55 A 75 VAL C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -133.68 -103.60 PHI 56 56 A 76 VAL C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -137.00 -106.92 PHI 57 57 A 77 VAL C A 78 LEU N A 78 LEU CA A 78 LEU C 1.0 -132.72 -102.54 PHI 58 58 A 78 LEU C A 79 GLU N A 79 GLU CA A 79 GLU C 1.0 -147.62 -88.04 PHI 59 59 A 79 GLU C A 80 LYS N A 80 LYS CA A 80 LYS C 1.0 -125.17 -59.69 PHI 60 60 A 81 ALA C A 82 SER N A 82 SER CA A 82 SER C 1.0 -79.31 -49.19 PHI 61 61 A 82 SER C A 83 ASP N A 83 ASP CA A 83 ASP C 1.0 -105.69 -75.63 PHI 62 62 A 86 LEU C A 87 LYS N A 87 LYS CA A 87 LYS C 1.0 -146.84 -110.52 PHI 63 63 A 87 LYS C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -113.20 -75.70 PHI 64 64 A 88 LEU C A 89 VAL N A 89 VAL CA A 89 VAL C 1.0 -104.85 -74.67 PHI 65 65 A 89 VAL C A 90 ALA N A 90 ALA CA A 90 ALA C 1.0 -171.15 -141.03 PHI 66 66 A 90 ALA C A 91 PHE N A 91 PHE CA A 91 PHE C 1.0 -149.43 -107.21 PHI 67 67 A 91 PHE C A 92 VAL N A 92 VAL CA A 92 VAL C 1.0 -131.29 -101.17 PHI 68 68 A 92 VAL C A 93 PRO N A 93 PRO CA A 93 PRO C 1.0 -109.62 -78.46 PHI 69 69 A 2 PRO N A 2 PRO CA A 2 PRO C A 3 GLY N 1.0 133.06 164.84 PSI 70 70 A 8 GLU N A 8 GLU CA A 8 GLU C A 9 VAL N 1.0 124.87 166.79 PSI 71 71 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 ILE N 1.0 112.73 142.85 PSI 72 72 A 10 ILE N A 10 ILE CA A 10 ILE C A 11 GLY N 1.0 130.20 165.76 PSI 73 73 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 SER N 1.0 136.92 167.10 PSI 74 74 A 13 SER N A 13 SER CA A 13 SER C A 14 VAL N 1.0 150.45 180.57 PSI 75 75 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 ASN N 1.0 -39.34 -9.34 PSI 76 76 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 PRO N 1.0 104.76 155.44 PSI 77 77 A 17 PRO N A 17 PRO CA A 17 PRO C A 18 ARG N 1.0 -39.02 -8.90 PSI 78 78 A 18 ARG N A 18 ARG CA A 18 ARG C A 19 VAL N 1.0 -49.19 -19.19 PSI 79 79 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 LYS N 1.0 -60.38 -30.38 PSI 80 80 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 GLU N 1.0 -54.91 -24.91 PSI 81 81 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 ILE N 1.0 -54.88 -24.88 PSI 82 82 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 ALA N 1.0 -54.92 -24.92 PSI 83 83 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 GLU N 1.0 -59.58 -29.58 PSI 84 84 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 PHE N 1.0 -53.64 -23.64 PSI 85 85 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 ALA N 1.0 -62.62 -32.62 PSI 86 86 A 26 ALA N A 26 ALA CA A 26 ALA C A 27 LEU N 1.0 -57.21 -27.21 PSI 87 87 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 LYS N 1.0 -55.98 -24.42 PSI 88 88 A 28 LYS N A 28 LYS CA A 28 LYS C A 29 GLN N 1.0 -48.63 -18.63 PSI 89 89 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 HIS N 1.0 -37.35 -7.35 PSI 90 90 A 32 GLU N A 32 GLU CA A 32 GLU C A 33 GLN N 1.0 -36.96 6.06 PSI 91 91 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 ILE N 1.0 133.45 167.87 PSI 92 92 A 36 ILE N A 36 ILE CA A 36 ILE C A 37 LEU N 1.0 125.78 160.04 PSI 93 93 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 ALA N 1.0 106.12 136.12 PSI 94 94 A 38 ALA N A 38 ALA CA A 38 ALA C A 39 GLY N 1.0 -52.66 -22.66 PSI 95 95 A 42 ALA N A 42 ALA CA A 42 ALA C A 43 GLY N 1.0 105.93 175.91 PSI 96 96 A 44 GLN N A 44 GLN CA A 44 GLN C A 45 ILE N 1.0 138.07 168.07 PSI 97 97 A 45 ILE N A 45 ILE CA A 45 ILE C A 46 ILE N 1.0 112.34 142.40 PSI 98 98 A 46 ILE N A 46 ILE CA A 46 ILE C A 47 LYS N 1.0 115.97 145.97 PSI 99 99 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 GLY N 1.0 129.56 162.60 PSI 100 100 A 49 ILE N A 49 ILE CA A 49 ILE C A 50 PRO N 1.0 110.03 192.15 PSI 101 101 A 50 PRO N A 50 PRO CA A 50 PRO C A 51 HIS N 1.0 115.79 175.79 PSI 102 102 A 51 HIS N A 51 HIS CA A 51 HIS C A 52 TRP N 1.0 -37.00 23.00 PSI 103 103 A 52 TRP N A 52 TRP CA A 52 TRP C A 53 ASP N 1.0 6.31 66.31 PSI 104 104 A 53 ASP N A 53 ASP CA A 53 ASP C A 54 ASN N 1.0 -35.19 24.81 PSI 105 105 A 54 ASN N A 54 ASN CA A 54 ASN C A 55 TYR N 1.0 132.18 162.36 PSI 106 106 A 55 TYR N A 55 TYR CA A 55 TYR C A 56 TYR N 1.0 118.29 148.29 PSI 107 107 A 56 TYR N A 56 TYR CA A 56 TYR C A 57 ASN N 1.0 115.30 145.42 PSI 108 108 A 57 ASN N A 57 ASN CA A 57 ASN C A 58 LEU N 1.0 111.82 171.82 PSI 109 109 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 ILE N 1.0 108.21 168.21 PSI 110 110 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 LEU N 1.0 98.10 158.10 PSI 111 111 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 SER N 1.0 138.35 168.45 PSI 112 112 A 61 SER N A 61 SER CA A 61 SER C A 62 ALA N 1.0 116.68 146.80 PSI 113 113 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 LYS N 1.0 131.64 163.24 PSI 114 114 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 HIS N 1.0 131.79 162.69 PSI 115 115 A 64 HIS N A 64 HIS CA A 64 HIS C A 65 SER N 1.0 -25.00 9.00 PSI 116 116 A 66 PRO N A 66 PRO CA A 66 PRO C A 67 HIS N 1.0 -39.87 -8.01 PSI 117 117 A 67 HIS N A 67 HIS CA A 67 HIS C A 68 GLU N 1.0 -16.14 13.90 PSI 118 118 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 PHE N 1.0 134.58 166.42 PSI 119 119 A 71 LYS N A 71 LYS CA A 71 LYS C A 72 PHE N 1.0 139.42 169.52 PSI 120 120 A 72 PHE N A 72 PHE CA A 72 PHE C A 73 TYR N 1.0 139.01 169.13 PSI 121 121 A 73 TYR N A 73 TYR CA A 73 TYR C A 74 ASN N 1.0 117.00 177.00 PSI 122 122 A 74 ASN N A 74 ASN CA A 74 ASN C A 75 VAL N 1.0 103.79 163.79 PSI 123 123 A 75 VAL N A 75 VAL CA A 75 VAL C A 76 VAL N 1.0 119.70 179.70 PSI 124 124 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 VAL N 1.0 110.92 140.92 PSI 125 125 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 LEU N 1.0 116.27 146.27 PSI 126 126 A 78 LEU N A 78 LEU CA A 78 LEU C A 79 GLU N 1.0 103.44 133.44 PSI 127 127 A 79 GLU N A 79 GLU CA A 79 GLU C A 80 LYS N 1.0 102.72 152.80 PSI 128 128 A 80 LYS N A 80 LYS CA A 80 LYS C A 81 ALA N 1.0 93.89 152.27 PSI 129 129 A 82 SER N A 82 SER CA A 82 SER C A 83 ASP N 1.0 -43.29 -13.29 PSI 130 130 A 83 ASP N A 83 ASP CA A 83 ASP C A 84 ASN N 1.0 -21.22 9.02 PSI 131 131 A 87 LYS N A 87 LYS CA A 87 LYS C A 88 LEU N 1.0 113.83 143.87 PSI 132 132 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 VAL N 1.0 95.79 125.93 PSI 133 133 A 89 VAL N A 89 VAL CA A 89 VAL C A 90 ALA N 1.0 -54.90 -24.90 PSI 134 134 A 90 ALA N A 90 ALA CA A 90 ALA C A 91 PHE N 1.0 125.33 155.51 PSI 135 135 A 91 PHE N A 91 PHE CA A 91 PHE C A 92 VAL N 1.0 110.23 140.31 PSI 136 136 A 92 VAL N A 92 VAL CA A 92 VAL C A 93 PRO N 1.0 107.32 146.94 PSI 137 137 A 93 PRO N A 93 PRO CA A 93 PRO C A 94 LEU N 1.0 107.75 138.07 PSI stop_ save_