data_nef_c15203_2jov save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 HIS middle . . 3 A 3 LYS middle . . 4 A 4 ASP middle . . 5 A 5 ILE middle . . 6 A 6 PHE middle . . 7 A 7 THR middle . . 8 A 8 SER middle . . 9 A 9 VAL middle . . 10 A 10 VAL middle . . 11 A 11 ARG middle . . 12 A 12 VAL middle . . 13 A 13 ARG middle . . 14 A 14 GLY middle . false 15 A 15 SER middle . . 16 A 16 LYS middle . . 17 A 17 LYS middle . . 18 A 18 TYR middle . . 19 A 19 ASN middle . . 20 A 20 VAL middle . . 21 A 21 VAL middle . . 22 A 22 PRO middle . false 23 A 23 VAL middle . . 24 A 24 LYS middle . . 25 A 25 SER middle . . 26 A 26 ASN middle . . 27 A 27 LYS middle . . 28 A 28 PRO middle . false 29 A 29 VAL middle . . 30 A 30 GLU middle . . 31 A 31 ILE middle . . 32 A 32 SER middle . . 33 A 33 LYS middle . . 34 A 34 TRP middle . . 35 A 35 ILE middle . . 36 A 36 ASP middle . . 37 A 37 PHE middle . . 38 A 38 SER middle . . 39 A 39 ASN middle . . 40 A 40 VAL middle . . 41 A 41 LEU middle . . 42 A 42 SER middle . . 43 A 43 ARG middle . . 44 A 44 LEU middle . . 45 A 45 TYR middle . . 46 A 46 VAL middle . . 47 A 47 GLY middle . false 48 A 48 VAL middle . . 49 A 49 PRO middle . false 50 A 50 THR middle . . 51 A 51 LYS middle . . 52 A 52 SER middle . . 53 A 53 GLY middle . false 54 A 54 ASN middle . . 55 A 55 VAL middle . . 56 A 56 VAL middle . . 57 A 57 CYS middle . . 58 A 58 LYS middle . . 59 A 59 ASN middle . . 60 A 60 ILE middle . . 61 A 61 MET middle . . 62 A 62 ASN middle . . 63 A 63 THR middle . . 64 A 64 GLY middle . false 65 A 65 VAL middle . . 66 A 66 ASP middle . . 67 A 67 ILE middle . . 68 A 68 ILE middle . . 69 A 69 CYS middle . . 70 A 70 THR middle . . 71 A 71 LYS middle . . 72 A 72 ASN middle . . 73 A 73 LEU middle . . 74 A 74 PRO middle . false 75 A 75 LYS middle . . 76 A 76 ASP middle . . 77 A 77 SER middle . . 78 A 78 LEU middle . . 79 A 79 GLU middle . . 80 A 80 HIS middle . . 81 A 81 HIS middle . . 82 A 82 HIS middle . . 83 A 83 HIS middle . . 84 A 84 HIS middle . . 85 A 85 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 HIS HA H 1 4.64 0.02 A 2 HIS HBx H 1 3.02 0.02 A 2 HIS HBy H 1 3.05 0.02 A 2 HIS C C 13 173.6 0.2 A 2 HIS CA C 13 56.5 0.2 A 2 HIS CB C 13 31.0 0.2 A 3 LYS H H 1 8.16 0.02 A 3 LYS HA H 1 4.66 0.02 A 3 LYS HBx H 1 1.28 0.02 A 3 LYS HBy H 1 1.52 0.02 A 3 LYS HD2 H 1 1.34 0.02 A 3 LYS HD3 H 1 1.34 0.02 A 3 LYS HE2 H 1 2.88 0.02 A 3 LYS HE3 H 1 2.88 0.02 A 3 LYS HG2 H 1 0.98 0.02 A 3 LYS HG3 H 1 0.98 0.02 A 3 LYS C C 13 174.4 0.2 A 3 LYS CA C 13 54.8 0.2 A 3 LYS CB C 13 35.8 0.2 A 3 LYS CD C 13 29.0 0.2 A 3 LYS CE C 13 42.0 0.2 A 3 LYS CG C 13 24.9 0.2 A 3 LYS N N 15 121.9 0.2 A 4 ASP H H 1 8.47 0.02 A 4 ASP HA H 1 4.90 0.02 A 4 ASP HBx H 1 2.70 0.02 A 4 ASP HBy H 1 2.86 0.02 A 4 ASP C C 13 176.9 0.2 A 4 ASP CA C 13 52.7 0.2 A 4 ASP CB C 13 44.1 0.2 A 4 ASP N N 15 117.9 0.2 A 5 ILE H H 1 9.57 0.02 A 5 ILE HA H 1 3.64 0.02 A 5 ILE HB H 1 1.92 0.02 A 5 ILE HD1% H 1 0.54 0.02 A 5 ILE HG1x H 1 1.36 0.02 A 5 ILE HG1y H 1 1.46 0.02 A 5 ILE HG2% H 1 0.88 0.02 A 5 ILE C C 13 174.8 0.2 A 5 ILE CA C 13 60.9 0.2 A 5 ILE CB C 13 37.0 0.2 A 5 ILE CD1 C 13 9.6 0.2 A 5 ILE CG1 C 13 26.9 0.2 A 5 ILE CG2 C 13 17.2 0.2 A 5 ILE N N 15 124.4 0.2 A 6 PHE H H 1 7.79 0.02 A 6 PHE HA H 1 3.16 0.02 A 6 PHE HBx H 1 2.20 0.02 A 6 PHE HBy H 1 2.30 0.02 A 6 PHE HD1 H 1 6.20 0.02 A 6 PHE HD2 H 1 6.20 0.02 A 6 PHE HE1 H 1 6.99 0.02 A 6 PHE HE2 H 1 6.99 0.02 A 6 PHE C C 13 173.5 0.2 A 6 PHE CA C 13 56.9 0.2 A 6 PHE CB C 13 40.1 0.2 A 6 PHE CD1 C 13 131.0 0.02 A 6 PHE CD2 C 13 131.0 0.02 A 6 PHE CE1 C 13 131.0 0.02 A 6 PHE CE2 C 13 131.0 0.02 A 6 PHE N N 15 130.2 0.2 A 7 THR H H 1 6.79 0.02 A 7 THR HA H 1 4.53 0.02 A 7 THR HB H 1 3.92 0.02 A 7 THR HG2% H 1 1.00 0.02 A 7 THR C C 13 172.3 0.2 A 7 THR CA C 13 59.2 0.2 A 7 THR CB C 13 71.0 0.2 A 7 THR CG2 C 13 21.7 0.2 A 7 THR N N 15 117.9 0.2 A 8 SER H H 1 7.60 0.02 A 8 SER HA H 1 4.18 0.02 A 8 SER HBx H 1 2.81 0.02 A 8 SER HBy H 1 3.44 0.02 A 8 SER C C 13 175.3 0.2 A 8 SER CA C 13 55.8 0.2 A 8 SER CB C 13 64.0 0.2 A 8 SER N N 15 113.4 0.2 A 9 VAL H H 1 8.88 0.02 A 9 VAL HA H 1 5.22 0.02 A 9 VAL HB H 1 1.79 0.02 A 9 VAL HGx% H 1 0.71 0.02 A 9 VAL HGy% H 1 0.71 0.02 A 9 VAL C C 13 174.0 0.2 A 9 VAL CA C 13 59.1 0.2 A 9 VAL CB C 13 36.5 0.2 A 9 VAL CGy C 13 21.5 0.02 A 9 VAL CGx C 13 17.7 0.02 A 9 VAL N N 15 114.7 0.2 A 10 VAL H H 1 8.51 0.02 A 10 VAL HA H 1 4.47 0.02 A 10 VAL HB H 1 1.72 0.02 A 10 VAL HGx% H 1 0.85 0.02 A 10 VAL HGy% H 1 0.84 0.02 A 10 VAL C C 13 173.7 0.2 A 10 VAL CA C 13 59.4 0.2 A 10 VAL CB C 13 36.0 0.2 A 10 VAL CGx C 13 22.0 0.02 A 10 VAL CGy C 13 22.8 0.02 A 10 VAL N N 15 117.1 0.2 A 11 ARG H H 1 8.50 0.02 A 11 ARG HA H 1 4.46 0.02 A 11 ARG HBx H 1 1.78 0.02 A 11 ARG HBy H 1 1.84 0.02 A 11 ARG HDx H 1 3.18 0.02 A 11 ARG HDy H 1 3.25 0.02 A 11 ARG HG2 H 1 1.63 0.02 A 11 ARG HG3 H 1 1.63 0.02 A 11 ARG C C 13 174.5 0.2 A 11 ARG CA C 13 57.4 0.2 A 11 ARG CB C 13 31.0 0.2 A 11 ARG CD C 13 43.4 0.2 A 11 ARG CG C 13 27.7 0.2 A 11 ARG N N 15 124.8 0.2 A 12 VAL H H 1 7.65 0.02 A 12 VAL HA H 1 4.97 0.02 A 12 VAL HB H 1 1.38 0.02 A 12 VAL HGx% H 1 0.69 0.02 A 12 VAL HGy% H 1 0.54 0.02 A 12 VAL C C 13 176.7 0.2 A 12 VAL CA C 13 59.4 0.2 A 12 VAL CB C 13 34.4 0.2 A 12 VAL CGy C 13 22.4 0.02 A 12 VAL CGx C 13 21.8 0.02 A 12 VAL N N 15 120.9 0.2 A 13 ARG H H 1 9.02 0.02 A 13 ARG HA H 1 4.70 0.02 A 13 ARG HBx H 1 1.44 0.02 A 13 ARG HBy H 1 1.61 0.02 A 13 ARG HDx H 1 2.46 0.02 A 13 ARG HDy H 1 2.62 0.02 A 13 ARG HG2 H 1 1.31 0.02 A 13 ARG HG3 H 1 1.31 0.02 A 13 ARG C C 13 176.0 0.2 A 13 ARG CA C 13 54.6 0.2 A 13 ARG CB C 13 32.9 0.2 A 13 ARG CD C 13 43.1 0.2 A 13 ARG CG C 13 27.1 0.2 A 13 ARG N N 15 127.5 0.2 A 14 GLY H H 1 8.64 0.02 A 14 GLY HAx H 1 3.68 0.02 A 14 GLY HAy H 1 4.19 0.02 A 14 GLY C C 13 173.7 0.2 A 14 GLY CA C 13 45.6 0.2 A 14 GLY N N 15 108.8 0.2 A 15 SER H H 1 8.22 0.02 A 15 SER HA H 1 5.02 0.02 A 15 SER HBx H 1 3.71 0.02 A 15 SER HBy H 1 4.10 0.02 A 15 SER C C 13 175.4 0.2 A 15 SER CA C 13 55.3 0.2 A 15 SER CB C 13 64.9 0.2 A 15 SER N N 15 113.2 0.2 A 16 LYS H H 1 9.93 0.02 A 16 LYS HA H 1 4.19 0.02 A 16 LYS HBx H 1 1.66 0.02 A 16 LYS HBy H 1 1.78 0.02 A 16 LYS HD2 H 1 1.60 0.02 A 16 LYS HD3 H 1 1.60 0.02 A 16 LYS HE2 H 1 2.92 0.02 A 16 LYS HE3 H 1 2.92 0.02 A 16 LYS HG2 H 1 1.40 0.02 A 16 LYS HG3 H 1 1.40 0.02 A 16 LYS C C 13 176.5 0.2 A 16 LYS CA C 13 57.3 0.2 A 16 LYS CB C 13 32.3 0.2 A 16 LYS CD C 13 28.9 0.2 A 16 LYS CE C 13 42.0 0.2 A 16 LYS CG C 13 25.1 0.2 A 16 LYS N N 15 129.2 0.2 A 17 LYS H H 1 7.96 0.02 A 17 LYS HA H 1 4.03 0.02 A 17 LYS HBx H 1 1.03 0.02 A 17 LYS HBy H 1 1.20 0.02 A 17 LYS HD2 H 1 1.42 0.02 A 17 LYS HD3 H 1 1.42 0.02 A 17 LYS HE2 H 1 2.81 0.02 A 17 LYS HE3 H 1 2.81 0.02 A 17 LYS HGx H 1 0.70 0.02 A 17 LYS HGy H 1 0.95 0.02 A 17 LYS C C 13 175.6 0.2 A 17 LYS CA C 13 56.9 0.2 A 17 LYS CB C 13 34.7 0.2 A 17 LYS CD C 13 28.9 0.2 A 17 LYS CE C 13 42.0 0.2 A 17 LYS CG C 13 24.8 0.2 A 17 LYS N N 15 118.5 0.2 A 18 TYR H H 1 7.78 0.02 A 18 TYR HA H 1 4.76 0.02 A 18 TYR HBx H 1 2.48 0.02 A 18 TYR HBy H 1 3.00 0.02 A 18 TYR HD1 H 1 7.15 0.02 A 18 TYR HD2 H 1 7.15 0.02 A 18 TYR HE1 H 1 6.79 0.02 A 18 TYR HE2 H 1 6.79 0.02 A 18 TYR C C 13 174.0 0.2 A 18 TYR CA C 13 56.8 0.2 A 18 TYR CB C 13 41.1 0.2 A 18 TYR CD1 C 13 134.3 0.02 A 18 TYR CD2 C 13 134.3 0.02 A 18 TYR CE1 C 13 118.4 0.02 A 18 TYR CE2 C 13 118.4 0.02 A 18 TYR N N 15 117.1 0.2 A 19 ASN H H 1 8.89 0.02 A 19 ASN HA H 1 4.96 0.02 A 19 ASN HB2 H 1 2.85 0.02 A 19 ASN HB3 H 1 2.85 0.02 A 19 ASN HD2x H 1 6.85 0.02 A 19 ASN HD2y H 1 7.53 0.02 A 19 ASN C C 13 176.1 0.2 A 19 ASN CA C 13 53.6 0.2 A 19 ASN CB C 13 40.3 0.2 A 19 ASN N N 15 116.6 0.2 A 19 ASN ND2 N 15 112.8 0.2 A 20 VAL H H 1 7.73 0.02 A 20 VAL HA H 1 5.25 0.02 A 20 VAL HB H 1 1.84 0.02 A 20 VAL HGx% H 1 0.82 0.02 A 20 VAL HGy% H 1 0.69 0.02 A 20 VAL C C 13 173.8 0.2 A 20 VAL CA C 13 59.4 0.2 A 20 VAL CB C 13 37.6 0.2 A 20 VAL CGy C 13 22.2 0.02 A 20 VAL CGx C 13 17.8 0.02 A 20 VAL N N 15 113.9 0.2 A 21 VAL H H 1 8.89 0.02 A 21 VAL HA H 1 4.84 0.02 A 21 VAL HB H 1 1.75 0.02 A 21 VAL HGx% H 1 0.69 0.02 A 21 VAL HGy% H 1 0.97 0.02 A 21 VAL CA C 13 56.8 0.2 A 21 VAL CB C 13 36.0 0.2 A 21 VAL CGx C 13 20.0 0.02 A 21 VAL CGy C 13 23.2 0.02 A 21 VAL N N 15 118.5 0.2 A 22 PRO HA H 1 4.94 0.02 A 22 PRO HBx H 1 1.97 0.02 A 22 PRO HBy H 1 2.12 0.02 A 22 PRO HDx H 1 3.40 0.02 A 22 PRO HDy H 1 3.65 0.02 A 22 PRO HGx H 1 1.72 0.02 A 22 PRO HGy H 1 1.90 0.02 A 22 PRO C C 13 175.6 0.2 A 22 PRO CA C 13 62.7 0.2 A 22 PRO CB C 13 31.8 0.2 A 22 PRO CD C 13 51.9 0.2 A 22 PRO CG C 13 27.8 0.2 A 23 VAL H H 1 8.06 0.02 A 23 VAL HA H 1 5.39 0.02 A 23 VAL HB H 1 1.85 0.02 A 23 VAL HGx% H 1 0.71 0.02 A 23 VAL HGy% H 1 0.24 0.02 A 23 VAL C C 13 175.4 0.2 A 23 VAL CA C 13 57.8 0.2 A 23 VAL CB C 13 36.3 0.2 A 23 VAL CGy C 13 22.4 0.02 A 23 VAL CGx C 13 18.5 0.02 A 23 VAL N N 15 110.9 0.2 A 24 LYS H H 1 8.96 0.02 A 24 LYS HA H 1 5.60 0.02 A 24 LYS HBx H 1 1.64 0.02 A 24 LYS HBy H 1 1.74 0.02 A 24 LYS HD2 H 1 1.47 0.02 A 24 LYS HD3 H 1 1.47 0.02 A 24 LYS HEx H 1 2.74 0.02 A 24 LYS HEy H 1 2.82 0.02 A 24 LYS HGx H 1 0.97 0.02 A 24 LYS HGy H 1 1.05 0.02 A 24 LYS C C 13 175.6 0.2 A 24 LYS CA C 13 54.2 0.2 A 24 LYS CB C 13 37.0 0.2 A 24 LYS CD C 13 29.8 0.2 A 24 LYS CE C 13 42.2 0.2 A 24 LYS CG C 13 23.4 0.2 A 24 LYS N N 15 117.9 0.2 A 25 SER H H 1 8.95 0.02 A 25 SER HA H 1 5.19 0.02 A 25 SER HBx H 1 3.85 0.02 A 25 SER HBy H 1 4.46 0.02 A 25 SER C C 13 173.8 0.2 A 25 SER CA C 13 57.7 0.2 A 25 SER CB C 13 65.1 0.2 A 25 SER N N 15 114.6 0.2 A 26 ASN H H 1 9.02 0.02 A 26 ASN HA H 1 4.37 0.02 A 26 ASN HBx H 1 2.49 0.02 A 26 ASN HBy H 1 3.26 0.02 A 26 ASN HD2x H 1 7.47 0.02 A 26 ASN HD2y H 1 7.58 0.02 A 26 ASN C C 13 173.5 0.2 A 26 ASN CA C 13 53.7 0.2 A 26 ASN CB C 13 37.1 0.2 A 26 ASN N N 15 118.3 0.2 A 26 ASN ND2 N 15 112.9 0.2 A 27 LYS H H 1 7.40 0.02 A 27 LYS HA H 1 4.78 0.02 A 27 LYS HBx H 1 1.59 0.02 A 27 LYS HBy H 1 1.95 0.02 A 27 LYS HD2 H 1 1.66 0.02 A 27 LYS HD3 H 1 1.66 0.02 A 27 LYS HE2 H 1 2.95 0.02 A 27 LYS HE3 H 1 2.95 0.02 A 27 LYS HGx H 1 1.36 0.02 A 27 LYS HGy H 1 1.44 0.02 A 27 LYS CA C 13 53.5 0.2 A 27 LYS CB C 13 34.1 0.2 A 27 LYS CD C 13 29.3 0.2 A 27 LYS CE C 13 42.3 0.2 A 27 LYS CG C 13 23.7 0.2 A 27 LYS N N 15 116.6 0.2 A 28 PRO HA H 1 4.04 0.02 A 28 PRO HBx H 1 1.60 0.02 A 28 PRO HBy H 1 1.92 0.02 A 28 PRO HDx H 1 3.59 0.02 A 28 PRO HDy H 1 3.81 0.02 A 28 PRO HGx H 1 1.87 0.02 A 28 PRO HGy H 1 2.06 0.02 A 28 PRO C C 13 174.5 0.2 A 28 PRO CA C 13 63.2 0.2 A 28 PRO CB C 13 32.5 0.2 A 28 PRO CD C 13 50.8 0.2 A 28 PRO CG C 13 27.9 0.2 A 29 VAL H H 1 8.86 0.02 A 29 VAL HA H 1 4.42 0.02 A 29 VAL HB H 1 2.08 0.02 A 29 VAL HGx% H 1 1.03 0.02 A 29 VAL HGy% H 1 1.18 0.02 A 29 VAL C C 13 174.8 0.2 A 29 VAL CA C 13 60.3 0.2 A 29 VAL CB C 13 36.4 0.2 A 29 VAL CGx C 13 21.4 0.02 A 29 VAL CGy C 13 21.7 0.02 A 29 VAL N N 15 119.8 0.2 A 30 GLU H H 1 9.55 0.02 A 30 GLU HA H 1 4.26 0.02 A 30 GLU HBx H 1 1.85 0.02 A 30 GLU HBy H 1 1.99 0.02 A 30 GLU HGx H 1 2.25 0.02 A 30 GLU HGy H 1 2.35 0.02 A 30 GLU C C 13 177.8 0.2 A 30 GLU CA C 13 58.0 0.2 A 30 GLU CB C 13 29.7 0.2 A 30 GLU CG C 13 37.2 0.2 A 30 GLU N N 15 128.9 0.2 A 31 ILE H H 1 7.91 0.02 A 31 ILE HA H 1 2.12 0.02 A 31 ILE HB H 1 1.09 0.02 A 31 ILE HD1% H 1 0.35 0.02 A 31 ILE HG1x H 1 0.57 0.02 A 31 ILE HG1y H 1 0.74 0.02 A 31 ILE HG2% H 1 0.22 0.02 A 31 ILE C C 13 178.0 0.2 A 31 ILE CA C 13 63.5 0.2 A 31 ILE CB C 13 37.2 0.2 A 31 ILE CD1 C 13 13.4 0.2 A 31 ILE CG1 C 13 27.7 0.2 A 31 ILE CG2 C 13 17.4 0.2 A 31 ILE N N 15 122.5 0.2 A 32 SER H H 1 7.94 0.02 A 32 SER HA H 1 4.07 0.02 A 32 SER HBx H 1 3.82 0.02 A 32 SER HBy H 1 3.93 0.02 A 32 SER C C 13 175.8 0.2 A 32 SER CA C 13 60.2 0.2 A 32 SER CB C 13 62.1 0.2 A 32 SER N N 15 115.3 0.2 A 33 LYS H H 1 7.64 0.02 A 33 LYS HA H 1 4.40 0.02 A 33 LYS HBx H 1 1.35 0.02 A 33 LYS HBy H 1 1.42 0.02 A 33 LYS HD2 H 1 1.63 0.02 A 33 LYS HD3 H 1 1.63 0.02 A 33 LYS HE2 H 1 2.93 0.02 A 33 LYS HE3 H 1 2.93 0.02 A 33 LYS HG2 H 1 1.33 0.02 A 33 LYS HG3 H 1 1.33 0.02 A 33 LYS C C 13 176.6 0.2 A 33 LYS CA C 13 56.2 0.2 A 33 LYS CB C 13 32.7 0.2 A 33 LYS CD C 13 28.9 0.2 A 33 LYS CE C 13 42.4 0.2 A 33 LYS CG C 13 25.7 0.2 A 33 LYS N N 15 119.8 0.2 A 34 TRP H H 1 7.86 0.02 A 34 TRP HA H 1 3.87 0.02 A 34 TRP HBx H 1 3.43 0.02 A 34 TRP HBy H 1 3.52 0.02 A 34 TRP C C 13 178.6 0.2 A 34 TRP CA C 13 60.2 0.2 A 34 TRP CB C 13 28.5 0.2 A 34 TRP N N 15 120.0 0.2 A 35 ILE H H 1 8.20 0.02 A 35 ILE HA H 1 3.99 0.02 A 35 ILE HB H 1 1.93 0.02 A 35 ILE HD1% H 1 0.90 0.02 A 35 ILE HG1x H 1 1.28 0.02 A 35 ILE HG1y H 1 1.60 0.02 A 35 ILE HG2% H 1 0.92 0.02 A 35 ILE C C 13 177.9 0.2 A 35 ILE CA C 13 64.3 0.2 A 35 ILE CB C 13 37.2 0.2 A 35 ILE CD1 C 13 13.0 0.2 A 35 ILE CG1 C 13 29.0 0.2 A 35 ILE CG2 C 13 17.2 0.2 A 35 ILE N N 15 119.5 0.2 A 36 ASP H H 1 7.68 0.02 A 36 ASP HA H 1 4.49 0.02 A 36 ASP HB2 H 1 2.73 0.02 A 36 ASP HB3 H 1 2.73 0.02 A 36 ASP C C 13 179.2 0.2 A 36 ASP CA C 13 57.5 0.2 A 36 ASP CB C 13 40.4 0.2 A 36 ASP N N 15 122.0 0.2 A 37 PHE H H 1 8.45 0.02 A 37 PHE HA H 1 4.08 0.02 A 37 PHE HBx H 1 2.02 0.02 A 37 PHE HBy H 1 2.82 0.02 A 37 PHE HD1 H 1 6.33 0.02 A 37 PHE HD2 H 1 6.33 0.02 A 37 PHE HE1 H 1 6.96 0.02 A 37 PHE HE2 H 1 6.96 0.02 A 37 PHE HZ H 1 7.07 0.02 A 37 PHE C C 13 178.3 0.2 A 37 PHE CA C 13 58.6 0.2 A 37 PHE CB C 13 37.0 0.2 A 37 PHE CD1 C 13 129.2 0.02 A 37 PHE CD2 C 13 129.2 0.02 A 37 PHE CE1 C 13 130.9 0.02 A 37 PHE CE2 C 13 130.9 0.02 A 37 PHE CZ C 13 129.2 0.2 A 37 PHE N N 15 119.8 0.2 A 38 SER H H 1 8.58 0.02 A 38 SER HA H 1 4.25 0.02 A 38 SER HBx H 1 4.13 0.02 A 38 SER HBy H 1 4.25 0.02 A 38 SER C C 13 176.8 0.2 A 38 SER CA C 13 62.7 0.2 A 38 SER CB C 13 62.7 0.2 A 38 SER N N 15 115.8 0.2 A 39 ASN H H 1 8.19 0.02 A 39 ASN HA H 1 4.54 0.02 A 39 ASN HBx H 1 2.93 0.02 A 39 ASN HBy H 1 3.09 0.02 A 39 ASN HD2x H 1 6.93 0.02 A 39 ASN HD2y H 1 7.86 0.02 A 39 ASN C C 13 178.5 0.2 A 39 ASN CA C 13 56.2 0.2 A 39 ASN CB C 13 37.9 0.2 A 39 ASN N N 15 121.3 0.2 A 39 ASN ND2 N 15 113.0 0.2 A 40 VAL H H 1 7.84 0.02 A 40 VAL HA H 1 3.65 0.02 A 40 VAL HB H 1 2.18 0.02 A 40 VAL HGx% H 1 0.85 0.02 A 40 VAL HGy% H 1 1.07 0.02 A 40 VAL C C 13 179.0 0.2 A 40 VAL CA C 13 66.6 0.2 A 40 VAL CB C 13 32.1 0.2 A 40 VAL CGx C 13 21.1 0.02 A 40 VAL CGy C 13 22.7 0.02 A 40 VAL N N 15 121.8 0.2 A 41 LEU H H 1 8.21 0.02 A 41 LEU HA H 1 3.84 0.02 A 41 LEU HBx H 1 1.60 0.02 A 41 LEU HBy H 1 1.95 0.02 A 41 LEU HDx% H 1 0.83 0.02 A 41 LEU HDy% H 1 0.68 0.02 A 41 LEU HG H 1 1.79 0.02 A 41 LEU C C 13 178.8 0.2 A 41 LEU CA C 13 57.4 0.2 A 41 LEU CB C 13 41.2 0.2 A 41 LEU CDy C 13 26.7 0.02 A 41 LEU CDx C 13 23.4 0.02 A 41 LEU CG C 13 27.0 0.2 A 41 LEU N N 15 117.7 0.2 A 42 SER H H 1 7.98 0.02 A 42 SER HA H 1 4.26 0.02 A 42 SER HBx H 1 4.05 0.02 A 42 SER HBy H 1 4.15 0.02 A 42 SER C C 13 174.9 0.2 A 42 SER CA C 13 61.2 0.2 A 42 SER CB C 13 63.1 0.2 A 42 SER N N 15 113.2 0.2 A 43 ARG H H 1 7.10 0.02 A 43 ARG HA H 1 4.50 0.02 A 43 ARG HBx H 1 1.76 0.02 A 43 ARG HBy H 1 2.13 0.02 A 43 ARG HD2 H 1 3.22 0.02 A 43 ARG HD3 H 1 3.22 0.02 A 43 ARG HG2 H 1 1.66 0.02 A 43 ARG HG3 H 1 1.66 0.02 A 43 ARG C C 13 175.8 0.2 A 43 ARG CA C 13 55.6 0.2 A 43 ARG CB C 13 30.8 0.2 A 43 ARG CD C 13 43.4 0.2 A 43 ARG CG C 13 27.6 0.2 A 43 ARG N N 15 118.4 0.2 A 44 LEU H H 1 7.61 0.02 A 44 LEU HA H 1 4.59 0.02 A 44 LEU HBx H 1 1.42 0.02 A 44 LEU HBy H 1 1.71 0.02 A 44 LEU HDx% H 1 0.77 0.02 A 44 LEU HDy% H 1 0.77 0.02 A 44 LEU HG H 1 1.80 0.02 A 44 LEU C C 13 175.3 0.2 A 44 LEU CA C 13 53.9 0.2 A 44 LEU CB C 13 44.1 0.2 A 44 LEU CDy C 13 25.5 0.02 A 44 LEU CDx C 13 22.9 0.02 A 44 LEU CG C 13 26.5 0.2 A 44 LEU N N 15 120.4 0.2 A 45 TYR H H 1 7.63 0.02 A 45 TYR HA H 1 5.18 0.02 A 45 TYR HBx H 1 2.61 0.02 A 45 TYR HBy H 1 2.76 0.02 A 45 TYR HD1 H 1 6.74 0.02 A 45 TYR HD2 H 1 6.74 0.02 A 45 TYR HE1 H 1 6.69 0.02 A 45 TYR HE2 H 1 6.69 0.02 A 45 TYR C C 13 174.6 0.2 A 45 TYR CA C 13 56.3 0.2 A 45 TYR CB C 13 41.4 0.2 A 45 TYR CD1 C 13 133.3 0.02 A 45 TYR CD2 C 13 133.3 0.02 A 45 TYR CE1 C 13 117.9 0.02 A 45 TYR CE2 C 13 117.9 0.02 A 45 TYR N N 15 115.3 0.2 A 46 VAL H H 1 8.77 0.02 A 46 VAL HA H 1 4.54 0.02 A 46 VAL HB H 1 2.16 0.02 A 46 VAL HGx% H 1 0.84 0.02 A 46 VAL HGy% H 1 0.72 0.02 A 46 VAL C C 13 174.6 0.2 A 46 VAL CA C 13 59.6 0.2 A 46 VAL CB C 13 34.7 0.2 A 46 VAL CGy C 13 22.1 0.02 A 46 VAL CGx C 13 20.4 0.02 A 46 VAL N N 15 115.4 0.2 A 47 GLY H H 1 8.28 0.02 A 47 GLY HAx H 1 3.61 0.02 A 47 GLY HAy H 1 4.97 0.02 A 47 GLY C C 13 173.1 0.2 A 47 GLY CA C 13 43.6 0.2 A 47 GLY N N 15 109.9 0.2 A 48 VAL H H 1 7.63 0.02 A 48 VAL HA H 1 4.32 0.02 A 48 VAL HB H 1 1.79 0.02 A 48 VAL HGx% H 1 0.84 0.02 A 48 VAL HGy% H 1 0.98 0.02 A 48 VAL CA C 13 58.7 0.2 A 48 VAL CB C 13 32.1 0.2 A 48 VAL CGy C 13 23.4 0.02 A 48 VAL CGx C 13 21.6 0.02 A 48 VAL N N 15 109.9 0.2 A 49 PRO HA H 1 4.80 0.02 A 49 PRO HBx H 1 2.09 0.02 A 49 PRO HBy H 1 2.42 0.02 A 49 PRO HDx H 1 3.34 0.02 A 49 PRO HDy H 1 3.70 0.02 A 49 PRO HGy H 1 1.95 0.02 A 49 PRO HGx H 1 1.90 0.02 A 49 PRO C C 13 176.7 0.2 A 49 PRO CA C 13 62.3 0.2 A 49 PRO CB C 13 35.4 0.2 A 49 PRO CD C 13 50.6 0.2 A 49 PRO CG C 13 24.4 0.2 A 50 THR H H 1 8.79 0.02 A 50 THR HA H 1 4.69 0.02 A 50 THR HB H 1 4.41 0.02 A 50 THR HG2% H 1 1.06 0.02 A 50 THR C C 13 173.5 0.2 A 50 THR CA C 13 60.8 0.2 A 50 THR CB C 13 70.8 0.2 A 50 THR CG2 C 13 21.7 0.2 A 50 THR N N 15 113.5 0.2 A 51 LYS H H 1 7.81 0.02 A 51 LYS HA H 1 4.89 0.02 A 51 LYS HBx H 1 1.46 0.02 A 51 LYS HBy H 1 1.62 0.02 A 51 LYS HD2 H 1 1.62 0.02 A 51 LYS HD3 H 1 1.62 0.02 A 51 LYS HE2 H 1 2.92 0.02 A 51 LYS HE3 H 1 2.92 0.02 A 51 LYS HG2 H 1 1.28 0.02 A 51 LYS HG3 H 1 1.28 0.02 A 51 LYS C C 13 175.9 0.2 A 51 LYS CA C 13 54.1 0.2 A 51 LYS CB C 13 35.3 0.2 A 51 LYS CD C 13 29.1 0.2 A 51 LYS CE C 13 42.1 0.2 A 51 LYS CG C 13 24.6 0.2 A 51 LYS N N 15 122.2 0.2 A 52 SER H H 1 8.41 0.02 A 52 SER HA H 1 3.63 0.02 A 52 SER HBx H 1 3.34 0.02 A 52 SER HBy H 1 3.57 0.02 A 52 SER C C 13 175.8 0.2 A 52 SER CA C 13 58.8 0.2 A 52 SER CB C 13 62.6 0.2 A 52 SER N N 15 118.9 0.2 A 53 GLY H H 1 9.07 0.02 A 53 GLY HAx H 1 3.39 0.02 A 53 GLY HAy H 1 4.46 0.02 A 53 GLY C C 13 174.1 0.2 A 53 GLY CA C 13 44.8 0.2 A 53 GLY N N 15 115.6 0.2 A 54 ASN H H 1 7.87 0.02 A 54 ASN HA H 1 4.57 0.02 A 54 ASN HBx H 1 2.71 0.02 A 54 ASN HBy H 1 2.97 0.02 A 54 ASN HD2x H 1 6.97 0.02 A 54 ASN HD2y H 1 7.69 0.02 A 54 ASN C C 13 175.5 0.2 A 54 ASN CA C 13 53.0 0.2 A 54 ASN CB C 13 38.6 0.2 A 54 ASN N N 15 119.6 0.2 A 54 ASN ND2 N 15 110.5 0.2 A 55 VAL H H 1 8.77 0.02 A 55 VAL HA H 1 3.88 0.02 A 55 VAL HB H 1 1.97 0.02 A 55 VAL HGx% H 1 0.67 0.02 A 55 VAL HGy% H 1 0.93 0.02 A 55 VAL C C 13 176.2 0.2 A 55 VAL CA C 13 63.7 0.2 A 55 VAL CB C 13 31.6 0.2 A 55 VAL CGx C 13 21.6 0.02 A 55 VAL CGy C 13 21.9 0.02 A 55 VAL N N 15 123.9 0.2 A 56 VAL H H 1 9.05 0.02 A 56 VAL HA H 1 3.99 0.02 A 56 VAL HB H 1 1.58 0.02 A 56 VAL HGx% H 1 0.74 0.02 A 56 VAL HGy% H 1 0.74 0.02 A 56 VAL C C 13 175.2 0.2 A 56 VAL CA C 13 62.7 0.2 A 56 VAL CB C 13 32.9 0.2 A 56 VAL CG1 C 13 21.4 0.02 A 56 VAL CG2 C 13 21.4 0.02 A 56 VAL N N 15 127.5 0.2 A 57 CYS H H 1 7.25 0.02 A 57 CYS HA H 1 4.37 0.02 A 57 CYS HB2 H 1 2.28 0.02 A 57 CYS HB3 H 1 2.28 0.02 A 57 CYS C C 13 171.9 0.2 A 57 CYS CA C 13 58.6 0.2 A 57 CYS CB C 13 28.6 0.2 A 57 CYS N N 15 117.6 0.2 A 58 LYS H H 1 8.88 0.02 A 58 LYS HA H 1 4.22 0.02 A 58 LYS HBx H 1 1.48 0.02 A 58 LYS HBy H 1 1.71 0.02 A 58 LYS HDx H 1 1.59 0.02 A 58 LYS HDy H 1 1.64 0.02 A 58 LYS HE2 H 1 2.93 0.02 A 58 LYS HE3 H 1 2.93 0.02 A 58 LYS HG2 H 1 1.26 0.02 A 58 LYS HG3 H 1 1.26 0.02 A 58 LYS C C 13 176.0 0.2 A 58 LYS CA C 13 54.4 0.2 A 58 LYS CB C 13 33.6 0.2 A 58 LYS CD C 13 29.0 0.2 A 58 LYS CE C 13 42.0 0.2 A 58 LYS CG C 13 24.6 0.2 A 58 LYS N N 15 132.0 0.2 A 59 ASN H H 1 9.50 0.02 A 59 ASN HA H 1 4.04 0.02 A 59 ASN HBx H 1 2.35 0.02 A 59 ASN HBy H 1 3.08 0.02 A 59 ASN HD2x H 1 6.88 0.02 A 59 ASN HD2y H 1 7.37 0.02 A 59 ASN C C 13 176.4 0.2 A 59 ASN CA C 13 53.2 0.2 A 59 ASN CB C 13 35.9 0.2 A 59 ASN N N 15 127.5 0.2 A 59 ASN ND2 N 15 109.9 0.2 A 60 ILE H H 1 8.05 0.02 A 60 ILE HA H 1 3.68 0.02 A 60 ILE HB H 1 1.14 0.02 A 60 ILE HD1% H 1 0.22 0.02 A 60 ILE HG12 H 1 1.37 0.02 A 60 ILE HG13 H 1 1.37 0.02 A 60 ILE HG2% H 1 -0.01 0.02 A 60 ILE C C 13 175.7 0.2 A 60 ILE CA C 13 61.9 0.2 A 60 ILE CB C 13 38.3 0.2 A 60 ILE CD1 C 13 13.7 0.2 A 60 ILE CG1 C 13 29.3 0.2 A 60 ILE CG2 C 13 13.9 0.2 A 60 ILE N N 15 120.2 0.2 A 61 MET H H 1 9.59 0.02 A 61 MET HA H 1 3.92 0.02 A 61 MET HBx H 1 1.96 0.02 A 61 MET HBy H 1 2.57 0.02 A 61 MET HE% H 1 2.08 0.02 A 61 MET HGx H 1 2.41 0.02 A 61 MET HGy H 1 2.45 0.02 A 61 MET C C 13 174.3 0.2 A 61 MET CA C 13 57.0 0.2 A 61 MET CB C 13 31.3 0.2 A 61 MET CE C 13 16.3 0.2 A 61 MET CG C 13 32.8 0.2 A 61 MET N N 15 124.4 0.2 A 62 ASN H H 1 8.25 0.02 A 62 ASN HA H 1 4.40 0.02 A 62 ASN HBx H 1 2.63 0.02 A 62 ASN HBy H 1 3.18 0.02 A 62 ASN HD2x H 1 6.78 0.02 A 62 ASN HD2y H 1 7.48 0.02 A 62 ASN C C 13 176.8 0.2 A 62 ASN CA C 13 54.4 0.2 A 62 ASN CB C 13 37.6 0.2 A 62 ASN N N 15 111.9 0.2 A 62 ASN ND2 N 15 111.9 0.2 A 63 THR H H 1 7.48 0.02 A 63 THR HA H 1 4.21 0.02 A 63 THR HB H 1 4.51 0.02 A 63 THR HG2% H 1 1.45 0.02 A 63 THR C C 13 177.1 0.2 A 63 THR CA C 13 62.9 0.2 A 63 THR CB C 13 72.5 0.2 A 63 THR CG2 C 13 21.9 0.2 A 63 THR N N 15 105.9 0.2 A 64 GLY H H 1 9.11 0.02 A 64 GLY HAx H 1 3.58 0.02 A 64 GLY HAy H 1 4.09 0.02 A 64 GLY C C 13 173.2 0.2 A 64 GLY CA C 13 45.3 0.2 A 64 GLY N N 15 111.5 0.2 A 65 VAL H H 1 7.58 0.02 A 65 VAL HA H 1 4.06 0.02 A 65 VAL HB H 1 2.14 0.02 A 65 VAL HGx% H 1 1.03 0.02 A 65 VAL HGy% H 1 0.88 0.02 A 65 VAL C C 13 172.9 0.2 A 65 VAL CA C 13 61.4 0.2 A 65 VAL CB C 13 32.9 0.2 A 65 VAL CGy C 13 22.7 0.02 A 65 VAL CGx C 13 22.0 0.02 A 65 VAL N N 15 121.6 0.2 A 66 ASP H H 1 8.21 0.02 A 66 ASP HA H 1 5.32 0.02 A 66 ASP HBx H 1 2.28 0.02 A 66 ASP HBy H 1 2.41 0.02 A 66 ASP C C 13 174.8 0.2 A 66 ASP CA C 13 51.7 0.2 A 66 ASP CB C 13 43.2 0.2 A 66 ASP N N 15 123.1 0.2 A 67 ILE H H 1 8.54 0.02 A 67 ILE HA H 1 4.63 0.02 A 67 ILE HB H 1 1.82 0.02 A 67 ILE HD1% H 1 0.41 0.02 A 67 ILE HG1x H 1 0.98 0.02 A 67 ILE HG1y H 1 1.31 0.02 A 67 ILE HG2% H 1 0.62 0.02 A 67 ILE C C 13 175.6 0.2 A 67 ILE CA C 13 56.9 0.2 A 67 ILE CB C 13 35.3 0.2 A 67 ILE CD1 C 13 8.1 0.2 A 67 ILE CG1 C 13 26.3 0.2 A 67 ILE CG2 C 13 17.2 0.2 A 67 ILE N N 15 119.2 0.2 A 68 ILE H H 1 9.42 0.02 A 68 ILE HA H 1 4.98 0.02 A 68 ILE HB H 1 1.60 0.02 A 68 ILE HD1% H 1 0.70 0.02 A 68 ILE HG1x H 1 1.01 0.02 A 68 ILE HG1y H 1 1.28 0.02 A 68 ILE HG2% H 1 0.75 0.02 A 68 ILE C C 13 175.0 0.2 A 68 ILE CA C 13 58.6 0.2 A 68 ILE CB C 13 40.9 0.2 A 68 ILE CD1 C 13 13.0 0.2 A 68 ILE CG1 C 13 26.0 0.2 A 68 ILE CG2 C 13 17.7 0.2 A 68 ILE N N 15 125.0 0.2 A 69 CYS H H 1 8.87 0.02 A 69 CYS HA H 1 4.61 0.02 A 69 CYS HBx H 1 2.79 0.02 A 69 CYS HBy H 1 2.89 0.02 A 69 CYS C C 13 176.2 0.2 A 69 CYS CA C 13 58.9 0.2 A 69 CYS CB C 13 27.1 0.2 A 69 CYS N N 15 122.3 0.2 A 70 THR H H 1 8.27 0.02 A 70 THR HA H 1 4.71 0.02 A 70 THR HB H 1 4.45 0.02 A 70 THR HG2% H 1 0.94 0.02 A 70 THR C C 13 173.6 0.2 A 70 THR CA C 13 61.5 0.2 A 70 THR CB C 13 68.1 0.2 A 70 THR CG2 C 13 21.7 0.2 A 70 THR N N 15 116.7 0.2 A 71 LYS H H 1 7.37 0.02 A 71 LYS HA H 1 4.52 0.02 A 71 LYS HBx H 1 1.39 0.02 A 71 LYS HBy H 1 1.41 0.02 A 71 LYS HD2 H 1 1.50 0.02 A 71 LYS HD3 H 1 1.50 0.02 A 71 LYS HE2 H 1 2.83 0.02 A 71 LYS HE3 H 1 2.83 0.02 A 71 LYS HGx H 1 1.14 0.02 A 71 LYS HGy H 1 1.28 0.02 A 71 LYS CA C 13 55.1 0.2 A 71 LYS CB C 13 37.8 0.2 A 71 LYS CD C 13 29.3 0.2 A 71 LYS CE C 13 42.0 0.2 A 71 LYS CG C 13 24.8 0.2 A 71 LYS N N 15 120.9 0.2 A 72 ASN H H 1 8.58 0.02 A 72 ASN HA H 1 4.62 0.02 A 72 ASN HBx H 1 2.58 0.02 A 72 ASN HBy H 1 2.73 0.02 A 72 ASN HD2x H 1 7.05 0.02 A 72 ASN HD2y H 1 7.62 0.02 A 72 ASN C C 13 173.5 0.2 A 72 ASN CA C 13 52.2 0.2 A 72 ASN CB C 13 38.5 0.2 A 72 ASN N N 15 122.7 0.2 A 72 ASN ND2 N 15 115.9 0.2 A 73 LEU H H 1 8.10 0.02 A 73 LEU HA H 1 4.68 0.02 A 73 LEU HBx H 1 0.84 0.02 A 73 LEU HBy H 1 1.65 0.02 A 73 LEU HDx% H 1 0.43 0.02 A 73 LEU HDy% H 1 0.07 0.02 A 73 LEU HG H 1 1.09 0.02 A 73 LEU CA C 13 51.0 0.2 A 73 LEU CB C 13 42.5 0.2 A 73 LEU CDy C 13 26.0 0.02 A 73 LEU CDx C 13 21.9 0.02 A 73 LEU CG C 13 25.9 0.2 A 73 LEU N N 15 125.1 0.2 A 74 PRO HA H 1 4.67 0.02 A 74 PRO HBx H 1 2.14 0.02 A 74 PRO HBy H 1 2.18 0.02 A 74 PRO HD2 H 1 3.63 0.02 A 74 PRO HD3 H 1 3.63 0.02 A 74 PRO HGx H 1 1.99 0.02 A 74 PRO HGy H 1 2.07 0.02 A 74 PRO C C 13 176.5 0.2 A 74 PRO CA C 13 61.8 0.2 A 74 PRO CB C 13 32.8 0.2 A 74 PRO CD C 13 50.4 0.2 A 74 PRO CG C 13 26.4 0.2 A 75 LYS H H 1 8.28 0.02 A 75 LYS HA H 1 4.11 0.02 A 75 LYS HBx H 1 1.63 0.02 A 75 LYS HBy H 1 1.71 0.02 A 75 LYS HD2 H 1 1.67 0.02 A 75 LYS HD3 H 1 1.67 0.02 A 75 LYS HE2 H 1 3.00 0.02 A 75 LYS HE3 H 1 3.00 0.02 A 75 LYS HG2 H 1 1.38 0.02 A 75 LYS HG3 H 1 1.38 0.02 A 75 LYS CA C 13 56.5 0.2 A 75 LYS CB C 13 33.3 0.2 A 75 LYS CD C 13 29.7 0.2 A 75 LYS CE C 13 42.0 0.2 A 75 LYS CG C 13 25.0 0.2 A 75 LYS N N 15 117.0 0.2 A 76 ASP H H 1 8.57 0.02 A 76 ASP HA H 1 4.53 0.02 A 76 ASP HB2 H 1 2.65 0.02 A 76 ASP HB3 H 1 2.65 0.02 A 76 ASP C C 13 176.3 0.2 A 76 ASP CA C 13 55.0 0.2 A 76 ASP CB C 13 41.1 0.2 A 76 ASP N N 15 122.7 0.2 A 77 SER H H 1 8.33 0.02 A 77 SER HA H 1 4.41 0.02 A 77 SER HB2 H 1 3.82 0.02 A 77 SER HB3 H 1 3.82 0.02 A 77 SER C C 13 174.3 0.2 A 77 SER CA C 13 58.0 0.2 A 77 SER CB C 13 63.9 0.2 A 77 SER N N 15 116.1 0.2 A 78 LEU H H 1 8.35 0.02 A 78 LEU HA H 1 4.28 0.02 A 78 LEU HBy H 1 1.54 0.02 A 78 LEU HBx H 1 1.49 0.02 A 78 LEU HDx% H 1 0.85 0.02 A 78 LEU HDy% H 1 0.80 0.02 A 78 LEU HG H 1 1.53 0.02 A 78 LEU C C 13 177.2 0.2 A 78 LEU CA C 13 55.2 0.2 A 78 LEU CB C 13 42.1 0.2 A 78 LEU CDy C 13 24.9 0.02 A 78 LEU CDx C 13 23.5 0.02 A 78 LEU CG C 13 27.0 0.2 A 78 LEU N N 15 124.3 0.2 A 79 GLU H H 1 8.30 0.02 A 79 GLU CA C 13 56.4 0.2 A 79 GLU CB C 13 30.2 0.2 A 79 GLU N N 15 121.7 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 3 LYS HA A 31 ILE HG2% 1.0 1.8 5.0 2 2 A 3 LYS HA A 4 ASP H 1.0 1.8 2.9 3 3 A 3 LYS HBy A 28 PRO HBx 1.0 1.8 5.0 4 3 A 3 LYS HBx A 28 PRO HBx 1.0 1.8 5.0 5 3 A 28 PRO HBy A 3 LYS HBx 1.0 1.8 5.0 6 3 A 3 LYS HBy A 28 PRO HBy 1.0 1.8 5.0 7 4 A 29 VAL H A 3 LYS HBx 1.0 1.8 5.0 8 4 A 3 LYS HBy A 29 VAL H 1.0 1.8 5.0 9 5 A 30 GLU HA A 3 LYS HBx 1.0 1.8 5.0 10 5 A 3 LYS HBy A 30 GLU HA 1.0 1.8 5.0 11 6 A 30 GLU HA A 3 LYS HD2 1.0 1.8 5.0 12 6 A 30 GLU HA A 3 LYS HD3 1.0 1.8 5.0 13 7 A 30 GLU HGy A 3 LYS HD2 1.0 1.8 5.0 14 7 A 3 LYS HD3 A 30 GLU HGy 1.0 1.8 5.0 15 8 A 3 LYS HD2 A 30 GLU HGx 1.0 1.8 5.0 16 8 A 3 LYS HD3 A 30 GLU HGx 1.0 1.8 5.0 17 9 A 30 GLU H A 3 LYS HD2 1.0 1.8 5.0 18 9 A 3 LYS HD3 A 30 GLU H 1.0 1.8 5.0 19 10 A 30 GLU HGy A 3 LYS HE2 1.0 1.8 5.0 20 10 A 3 LYS HE3 A 30 GLU HGy 1.0 1.8 5.0 21 11 A 3 LYS HE2 A 30 GLU HGx 1.0 1.8 5.0 22 11 A 3 LYS HE3 A 30 GLU HGx 1.0 1.8 5.0 23 12 A 30 GLU H A 3 LYS HE2 1.0 1.8 5.0 24 12 A 30 GLU H A 3 LYS HE3 1.0 1.8 5.0 25 13 A 30 GLU HA A 3 LYS HG2 1.0 1.8 5.0 26 13 A 30 GLU HA A 3 LYS HG3 1.0 1.8 5.0 27 14 A 30 GLU HGy A 3 LYS HG2 1.0 1.8 5.0 28 14 A 3 LYS HG3 A 30 GLU HGy 1.0 1.8 5.0 29 15 A 3 LYS HG2 A 30 GLU HGx 1.0 1.8 5.0 30 15 A 3 LYS HG3 A 30 GLU HGx 1.0 1.8 5.0 31 16 A 4 ASP HA A 28 PRO HBx 1.0 1.8 5.0 32 16 A 28 PRO HBy A 4 ASP HA 1.0 1.8 5.0 33 17 A 4 ASP HA A 5 ILE H 1.0 1.8 2.9 34 18 A 31 ILE HD1% A 4 ASP HBx 1.0 1.8 5.0 35 18 A 4 ASP HBy A 31 ILE HD1% 1.0 1.8 5.0 36 19 A 31 ILE HG2% A 4 ASP HBx 1.0 1.8 5.0 37 19 A 31 ILE HG2% A 4 ASP HBy 1.0 1.8 5.0 38 20 A 4 ASP H A 29 VAL HGy% 1.0 1.8 5.0 39 20 A 4 ASP H A 29 VAL HGx% 1.0 1.8 5.0 40 21 A 4 ASP H A 29 VAL H 1.0 1.8 4.0 41 22 A 4 ASP H A 30 GLU HA 1.0 1.8 4.0 42 23 A 31 ILE HG2% A 4 ASP H 1.0 1.8 5.0 43 24 A 4 ASP H A 5 ILE H 1.0 1.8 5.0 44 25 A 5 ILE HA A 28 PRO HA 1.0 1.8 3.0 45 26 A 29 VAL H A 5 ILE HA 1.0 1.8 4.0 46 27 A 5 ILE HA A 6 PHE H 1.0 1.8 2.9 47 28 A 6 PHE H A 5 ILE HB 1.0 1.8 5.0 48 29 A 5 ILE HD1% A 25 SER HA 1.0 1.8 5.0 49 30 A 5 ILE HD1% A 27 LYS HA 1.0 1.8 5.0 50 31 A 5 ILE HD1% A 27 LYS H 1.0 1.8 5.0 51 32 A 28 PRO HA A 5 ILE HD1% 1.0 1.8 5.0 52 33 A 5 ILE HD1% A 28 PRO HDy 1.0 1.8 5.0 53 34 A 5 ILE HD1% A 28 PRO HDx 1.0 1.8 5.0 54 35 A 5 ILE HD1% A 28 PRO HGy 1.0 1.8 5.0 55 36 A 5 ILE HD1% A 28 PRO HGx 1.0 1.8 5.0 56 37 A 29 VAL H A 5 ILE HD1% 1.0 1.8 5.0 57 38 A 6 PHE H A 5 ILE HD1% 1.0 1.8 5.0 58 39 A 5 ILE HG1x A 28 PRO HBx 1.0 1.8 5.0 59 39 A 5 ILE HG1y A 28 PRO HBx 1.0 1.8 5.0 60 39 A 28 PRO HBy A 5 ILE HG1x 1.0 1.8 5.0 61 39 A 28 PRO HBy A 5 ILE HG1y 1.0 1.8 5.0 62 40 A 5 ILE HG2% A 24 LYS HA 1.0 1.8 5.0 63 41 A 5 ILE HG2% A 24 LYS HBx 1.0 1.8 5.0 64 41 A 5 ILE HG2% A 24 LYS HBy 1.0 1.8 5.0 65 42 A 25 SER HA A 5 ILE HG2% 1.0 1.8 5.0 66 43 A 5 ILE HG2% A 25 SER H 1.0 1.8 5.0 67 44 A 29 VAL H A 5 ILE HG2% 1.0 1.8 5.0 68 45 A 6 PHE H A 5 ILE HG2% 1.0 1.8 5.0 69 46 A 5 ILE H A 29 VAL HGy% 1.0 1.8 5.0 70 46 A 5 ILE H A 29 VAL HGx% 1.0 1.8 5.0 71 47 A 6 PHE HA A 7 THR H 1.0 1.8 2.9 72 48 A 6 PHE HBx A 25 SER HBx 1.0 1.8 5.0 73 48 A 6 PHE HBy A 25 SER HBx 1.0 1.8 5.0 74 48 A 25 SER HBy A 6 PHE HBx 1.0 1.8 5.0 75 48 A 6 PHE HBy A 25 SER HBy 1.0 1.8 5.0 76 49 A 25 SER H A 6 PHE HBx 1.0 1.8 5.0 77 49 A 25 SER H A 6 PHE HBy 1.0 1.8 5.0 78 50 A 29 VAL HGx% A 6 PHE HBy 1.0 1.8 5.0 79 50 A 29 VAL HGx% A 6 PHE HBx 1.0 1.8 5.0 80 51 A 6 PHE HBy A 29 VAL HGy% 1.0 1.8 5.0 81 51 A 6 PHE HBx A 29 VAL HGy% 1.0 1.8 5.0 82 52 A 67 ILE HD1% A 6 PHE HBx 1.0 1.8 5.0 83 52 A 6 PHE HBy A 67 ILE HD1% 1.0 1.8 5.0 84 53 A 25 SER H A 6 PHE HD% 1.0 1.8 5.0 85 54 A 6 PHE HD% A 34 TRP HA 1.0 1.8 5.0 86 55 A 67 ILE HD1% A 6 PHE HD% 1.0 1.8 5.0 87 56 A 6 PHE HE% A 23 VAL HGy% 1.0 1.8 5.0 88 56 A 6 PHE HE% A 23 VAL HGx% 1.0 1.8 5.0 89 57 A 34 TRP HA A 6 PHE HE% 1.0 1.8 5.0 90 58 A 6 PHE HE% A 37 PHE HBx 1.0 1.8 5.0 91 58 A 6 PHE HE% A 37 PHE HBy 1.0 1.8 5.0 92 59 A 6 PHE HE% A 38 SER H 1.0 1.8 5.0 93 60 A 6 PHE HE% A 41 LEU HDx% 1.0 1.8 5.0 94 61 A 6 PHE HE% A 41 LEU HDx% 1.0 1.8 5.0 95 61 A 6 PHE HE% A 41 LEU HDy% 1.0 1.8 5.0 96 62 A 6 PHE HE% A 67 ILE HG2% 1.0 1.8 5.0 97 63 A 6 PHE HE% A 8 SER HBx 1.0 1.8 5.0 98 63 A 6 PHE HE% A 8 SER HBy 1.0 1.8 5.0 99 64 A 6 PHE H A 25 SER HBx 1.0 1.8 5.0 100 64 A 6 PHE H A 25 SER HBy 1.0 1.8 5.0 101 65 A 6 PHE H A 25 SER H 1.0 1.8 4.0 102 66 A 28 PRO HA A 6 PHE H 1.0 1.8 4.0 103 67 A 6 PHE H A 29 VAL HB 1.0 1.8 5.0 104 68 A 6 PHE H A 29 VAL HGy% 1.0 1.8 5.0 105 68 A 29 VAL HGx% A 6 PHE H 1.0 1.8 5.0 106 69 A 6 PHE H A 29 VAL HGy% 1.0 1.8 5.0 107 70 A 24 LYS HA A 7 THR HA 1.0 1.8 3.0 108 71 A 25 SER H A 7 THR HA 1.0 1.8 4.0 109 72 A 7 THR HA A 8 SER H 1.0 1.8 2.9 110 73 A 8 SER H A 7 THR HB 1.0 1.8 5.0 111 74 A 24 LYS HA A 7 THR HG2% 1.0 1.8 5.0 112 75 A 7 THR HG2% A 24 LYS HBx 1.0 1.8 5.0 113 75 A 24 LYS HBy A 7 THR HG2% 1.0 1.8 5.0 114 76 A 25 SER H A 7 THR HG2% 1.0 1.8 5.0 115 77 A 8 SER H A 7 THR HG2% 1.0 1.8 5.0 116 78 A 8 SER HA A 9 VAL H 1.0 1.8 3.5 117 79 A 23 VAL HGx% A 8 SER HBx 1.0 1.8 5.0 118 79 A 23 VAL HGx% A 8 SER HBy 1.0 1.8 5.0 119 80 A 8 SER HBx A 23 VAL HGy% 1.0 1.8 5.0 120 80 A 8 SER HBy A 23 VAL HGy% 1.0 1.8 5.0 121 81 A 8 SER HBx A 41 LEU HDx% 1.0 1.8 5.0 122 81 A 8 SER HBy A 41 LEU HDx% 1.0 1.8 5.0 123 82 A 41 LEU HDy% A 8 SER HBx 1.0 1.8 5.0 124 82 A 41 LEU HDy% A 8 SER HBy 1.0 1.8 5.0 125 83 A 23 VAL HGx% A 8 SER H 1.0 1.8 5.0 126 84 A 8 SER H A 23 VAL HGy% 1.0 1.8 5.0 127 84 A 23 VAL HGx% A 8 SER H 1.0 1.8 5.0 128 85 A 8 SER H A 23 VAL H 1.0 1.8 4.0 129 86 A 24 LYS HA A 8 SER H 1.0 1.8 4.0 130 87 A 8 SER H A 41 LEU HDx% 1.0 1.8 5.0 131 87 A 41 LEU HDy% A 8 SER H 1.0 1.8 5.0 132 88 A 9 VAL HA A 10 VAL H 1.0 1.8 2.9 133 89 A 9 VAL HA A 22 PRO HA 1.0 1.8 3.0 134 90 A 23 VAL HGx% A 9 VAL HA 1.0 1.8 5.0 135 91 A 9 VAL HA A 23 VAL HGy% 1.0 1.8 5.0 136 92 A 23 VAL H A 9 VAL HA 1.0 1.8 4.0 137 93 A 10 VAL H A 9 VAL HB 1.0 1.8 5.0 138 94 A 10 VAL H A 9 VAL HGx% 1.0 1.8 5.0 139 94 A 10 VAL H A 9 VAL HGy% 1.0 1.8 5.0 140 95 A 22 PRO HA A 9 VAL HGx% 1.0 1.8 5.0 141 95 A 22 PRO HA A 9 VAL HGy% 1.0 1.8 5.0 142 96 A 9 VAL HGx% A 22 PRO HBx 1.0 1.8 5.0 143 96 A 9 VAL HGy% A 22 PRO HBx 1.0 1.8 5.0 144 96 A 22 PRO HBy A 9 VAL HGx% 1.0 1.8 5.0 145 96 A 9 VAL HGy% A 22 PRO HBy 1.0 1.8 5.0 146 97 A 9 VAL HGy% A 22 PRO HGy 1.0 1.8 5.0 147 97 A 9 VAL HGx% A 22 PRO HGy 1.0 1.8 5.0 148 97 A 22 PRO HGx A 9 VAL HGx% 1.0 1.8 5.0 149 97 A 9 VAL HGy% A 22 PRO HGx 1.0 1.8 5.0 150 98 A 9 VAL H A 10 VAL H 1.0 1.8 5.0 151 99 A 9 VAL H A 23 VAL HGy% 1.0 1.8 5.0 152 99 A 23 VAL HGx% A 9 VAL H 1.0 1.8 5.0 153 100 A 9 VAL H A 41 LEU HDx% 1.0 1.8 5.0 154 100 A 41 LEU HDy% A 9 VAL H 1.0 1.8 5.0 155 101 A 10 VAL HA A 11 ARG H 1.0 1.8 2.9 156 102 A 10 VAL HA A 23 VAL HGy% 1.0 1.8 5.0 157 102 A 23 VAL HGx% A 10 VAL HA 1.0 1.8 5.0 158 103 A 11 ARG H A 10 VAL HB 1.0 1.8 5.0 159 104 A 10 VAL HB A 23 VAL HGy% 1.0 1.8 5.0 160 104 A 23 VAL HGx% A 10 VAL HB 1.0 1.8 5.0 161 105 A 10 VAL HB A 41 LEU HBx 1.0 1.8 5.0 162 105 A 10 VAL HB A 41 LEU HBy 1.0 1.8 5.0 163 106 A 10 VAL HB A 41 LEU HDx% 1.0 1.8 5.0 164 107 A 41 LEU HDy% A 10 VAL HB 1.0 1.8 5.0 165 108 A 23 VAL HGx% A 10 VAL HGx% 1.0 1.8 5.0 166 108 A 10 VAL HGx% A 23 VAL HGy% 1.0 1.8 5.0 167 109 A 41 LEU HBy A 10 VAL HGx% 1.0 1.8 5.0 168 109 A 10 VAL HGx% A 41 LEU HBx 1.0 1.8 5.0 169 110 A 23 VAL HGx% A 10 VAL HGy% 1.0 1.8 5.0 170 110 A 10 VAL HGy% A 23 VAL HGy% 1.0 1.8 5.0 171 111 A 41 LEU HBy A 10 VAL HGy% 1.0 1.8 5.0 172 111 A 10 VAL HGy% A 41 LEU HBx 1.0 1.8 5.0 173 112 A 11 ARG H A 10 VAL HGy% 1.0 1.8 5.0 174 112 A 11 ARG H A 10 VAL HGx% 1.0 1.8 5.0 175 113 A 21 VAL HA A 10 VAL HGy% 1.0 1.8 5.0 176 113 A 10 VAL HGx% A 21 VAL HA 1.0 1.8 5.0 177 114 A 10 VAL HGx% A 21 VAL HGy% 1.0 1.8 5.0 178 114 A 10 VAL HGy% A 21 VAL HGy% 1.0 1.8 5.0 179 114 A 21 VAL HGx% A 10 VAL HGy% 1.0 1.8 5.0 180 114 A 10 VAL HGx% A 21 VAL HGx% 1.0 1.8 5.0 181 115 A 21 VAL H A 10 VAL HGy% 1.0 1.8 5.0 182 115 A 10 VAL HGx% A 21 VAL H 1.0 1.8 5.0 183 116 A 23 VAL HB A 10 VAL HGy% 1.0 1.8 5.0 184 116 A 10 VAL HGx% A 23 VAL HB 1.0 1.8 5.0 185 117 A 23 VAL H A 10 VAL HGy% 1.0 1.8 5.0 186 117 A 23 VAL H A 10 VAL HGx% 1.0 1.8 5.0 187 118 A 41 LEU HA A 10 VAL HGy% 1.0 1.8 5.0 188 118 A 10 VAL HGx% A 41 LEU HA 1.0 1.8 5.0 189 119 A 10 VAL HGx% A 41 LEU HBx 1.0 1.8 5.0 190 119 A 10 VAL HGy% A 41 LEU HBx 1.0 1.8 5.0 191 119 A 41 LEU HBy A 10 VAL HGy% 1.0 1.8 5.0 192 119 A 41 LEU HBy A 10 VAL HGx% 1.0 1.8 5.0 193 120 A 42 SER HA A 10 VAL HGy% 1.0 1.8 5.0 194 120 A 10 VAL HGx% A 42 SER HA 1.0 1.8 5.0 195 121 A 10 VAL HGx% A 44 LEU HBx 1.0 1.8 5.0 196 121 A 10 VAL HGy% A 44 LEU HBx 1.0 1.8 5.0 197 121 A 44 LEU HBy A 10 VAL HGy% 1.0 1.8 5.0 198 121 A 10 VAL HGx% A 44 LEU HBy 1.0 1.8 5.0 199 122 A 45 TYR HA A 10 VAL HGy% 1.0 1.8 5.0 200 122 A 10 VAL HGx% A 45 TYR HA 1.0 1.8 5.0 201 123 A 10 VAL H A 20 VAL HB 1.0 1.8 5.0 202 124 A 10 VAL H A 21 VAL HGy% 1.0 1.8 5.0 203 124 A 10 VAL H A 21 VAL HGx% 1.0 1.8 5.0 204 125 A 10 VAL H A 21 VAL H 1.0 1.8 4.0 205 126 A 10 VAL H A 22 PRO HA 1.0 1.8 4.0 206 127 A 23 VAL HGx% A 10 VAL H 1.0 1.8 5.0 207 128 A 10 VAL H A 23 VAL HGy% 1.0 1.8 5.0 208 129 A 11 ARG HA A 12 VAL H 1.0 1.8 2.9 209 130 A 11 ARG HA A 20 VAL HA 1.0 1.8 3.0 210 131 A 11 ARG HA A 20 VAL HGx% 1.0 1.8 5.0 211 131 A 11 ARG HA A 20 VAL HGy% 1.0 1.8 5.0 212 132 A 21 VAL H A 11 ARG HA 1.0 1.8 4.0 213 133 A 45 TYR HA A 11 ARG HBx 1.0 1.8 5.0 214 133 A 45 TYR HA A 11 ARG HBy 1.0 1.8 5.0 215 134 A 11 ARG HBy A 45 TYR HBx 1.0 1.8 5.0 216 134 A 11 ARG HBx A 45 TYR HBx 1.0 1.8 5.0 217 134 A 45 TYR HBy A 11 ARG HBx 1.0 1.8 5.0 218 134 A 11 ARG HBy A 45 TYR HBy 1.0 1.8 5.0 219 135 A 45 TYR HD% A 11 ARG HBx 1.0 1.8 5.0 220 135 A 11 ARG HBy A 45 TYR HD% 1.0 1.8 5.0 221 136 A 11 ARG HDy A 20 VAL HGx% 1.0 1.8 5.0 222 136 A 20 VAL HGy% A 11 ARG HDy 1.0 1.8 5.0 223 137 A 11 ARG HDy A 45 TYR HE% 1.0 1.8 5.0 224 138 A 11 ARG HDx A 20 VAL HGx% 1.0 1.8 5.0 225 138 A 20 VAL HGy% A 11 ARG HDx 1.0 1.8 5.0 226 139 A 45 TYR HE% A 11 ARG HDx 1.0 1.8 5.0 227 140 A 12 VAL H A 11 ARG HG2 1.0 1.8 5.0 228 140 A 12 VAL H A 11 ARG HG3 1.0 1.8 5.0 229 141 A 11 ARG HG3 A 20 VAL HGx% 1.0 1.8 5.0 230 141 A 11 ARG HG2 A 20 VAL HGx% 1.0 1.8 5.0 231 141 A 20 VAL HGy% A 11 ARG HG2 1.0 1.8 5.0 232 141 A 20 VAL HGy% A 11 ARG HG3 1.0 1.8 5.0 233 142 A 11 ARG H A 12 VAL H 1.0 1.8 5.0 234 143 A 11 ARG H A 20 VAL HGx% 1.0 1.8 5.0 235 143 A 11 ARG H A 20 VAL HGy% 1.0 1.8 5.0 236 144 A 12 VAL HA A 13 ARG H 1.0 1.8 2.9 237 145 A 12 VAL HA A 46 VAL HGx% 1.0 1.8 5.0 238 145 A 12 VAL HA A 46 VAL HGy% 1.0 1.8 5.0 239 146 A 12 VAL HA A 46 VAL H 1.0 1.8 4.0 240 147 A 20 VAL HA A 12 VAL HB 1.0 1.8 5.0 241 148 A 12 VAL HB A 20 VAL H 1.0 1.8 5.0 242 149 A 12 VAL HB A 21 VAL HGy% 1.0 1.8 5.0 243 149 A 21 VAL HGx% A 12 VAL HB 1.0 1.8 5.0 244 150 A 13 ARG H A 12 VAL HGx% 1.0 1.8 5.0 245 151 A 19 ASN HA A 12 VAL HGx% 1.0 1.8 5.0 246 152 A 20 VAL HA A 12 VAL HGx% 1.0 1.8 5.0 247 153 A 21 VAL HB A 12 VAL HGx% 1.0 1.8 5.0 248 154 A 21 VAL H A 12 VAL HGx% 1.0 1.8 5.0 249 155 A 47 GLY HAx A 12 VAL HGx% 1.0 1.8 5.0 250 155 A 12 VAL HGx% A 47 GLY HAy 1.0 1.8 5.0 251 156 A 73 LEU HG A 12 VAL HGx% 1.0 1.8 5.0 252 157 A 13 ARG H A 12 VAL HGy% 1.0 1.8 5.0 253 158 A 19 ASN HA A 12 VAL HGy% 1.0 1.8 5.0 254 159 A 20 VAL HA A 12 VAL HGy% 1.0 1.8 5.0 255 160 A 20 VAL H A 12 VAL HGy% 1.0 1.8 5.0 256 161 A 21 VAL H A 12 VAL HGy% 1.0 1.8 5.0 257 162 A 47 GLY HAx A 12 VAL HGy% 1.0 1.8 5.0 258 162 A 12 VAL HGy% A 47 GLY HAy 1.0 1.8 5.0 259 163 A 73 LEU HG A 12 VAL HGy% 1.0 1.8 5.0 260 164 A 12 VAL HGx% A 19 ASN HB2 1.0 1.8 5.0 261 164 A 12 VAL HGy% A 19 ASN HB2 1.0 1.8 5.0 262 164 A 19 ASN HB3 A 12 VAL HGy% 1.0 1.8 5.0 263 164 A 12 VAL HGx% A 19 ASN HB3 1.0 1.8 5.0 264 165 A 19 ASN H A 12 VAL HGy% 1.0 1.8 5.0 265 165 A 12 VAL HGx% A 19 ASN H 1.0 1.8 5.0 266 166 A 20 VAL H A 12 VAL HGy% 1.0 1.8 5.0 267 166 A 20 VAL H A 12 VAL HGx% 1.0 1.8 5.0 268 167 A 21 VAL HA A 12 VAL HGy% 1.0 1.8 5.0 269 167 A 21 VAL HA A 12 VAL HGx% 1.0 1.8 5.0 270 168 A 21 VAL HB A 12 VAL HGy% 1.0 1.8 5.0 271 168 A 21 VAL HB A 12 VAL HGx% 1.0 1.8 5.0 272 169 A 46 VAL H A 12 VAL HGy% 1.0 1.8 5.0 273 169 A 46 VAL H A 12 VAL HGx% 1.0 1.8 5.0 274 170 A 47 GLY H A 12 VAL HGy% 1.0 1.8 5.0 275 170 A 12 VAL HGx% A 47 GLY H 1.0 1.8 5.0 276 171 A 48 VAL H A 12 VAL HGy% 1.0 1.8 5.0 277 171 A 12 VAL HGx% A 48 VAL H 1.0 1.8 5.0 278 172 A 12 VAL HGx% A 73 LEU HBx 1.0 1.8 5.0 279 172 A 73 LEU HBy A 12 VAL HGy% 1.0 1.8 5.0 280 172 A 12 VAL HGx% A 73 LEU HBy 1.0 1.8 5.0 281 172 A 12 VAL HGy% A 73 LEU HBx 1.0 1.8 5.0 282 173 A 12 VAL HGy% A 73 LEU HDx% 1.0 1.8 5.0 283 173 A 12 VAL HGx% A 73 LEU HDx% 1.0 1.8 5.0 284 174 A 12 VAL HGx% A 73 LEU HDy% 1.0 1.8 5.0 285 174 A 73 LEU HDy% A 12 VAL HGy% 1.0 1.8 5.0 286 175 A 12 VAL H A 13 ARG H 1.0 1.8 5.0 287 176 A 12 VAL H A 20 VAL HA 1.0 1.8 4.0 288 177 A 12 VAL H A 20 VAL HGx% 1.0 1.8 5.0 289 177 A 12 VAL H A 20 VAL HGy% 1.0 1.8 5.0 290 178 A 13 ARG HBy A 45 TYR HBx 1.0 1.8 5.0 291 178 A 13 ARG HBx A 45 TYR HBx 1.0 1.8 5.0 292 178 A 45 TYR HBy A 13 ARG HBx 1.0 1.8 5.0 293 178 A 45 TYR HBy A 13 ARG HBy 1.0 1.8 5.0 294 179 A 45 TYR HD% A 13 ARG HBx 1.0 1.8 5.0 295 179 A 45 TYR HD% A 13 ARG HBy 1.0 1.8 5.0 296 180 A 46 VAL H A 13 ARG HBx 1.0 1.8 5.0 297 180 A 46 VAL H A 13 ARG HBy 1.0 1.8 5.0 298 181 A 45 TYR HD% A 13 ARG HDy 1.0 1.8 5.0 299 182 A 45 TYR HD% A 13 ARG HDx 1.0 1.8 5.0 300 183 A 14 GLY H A 13 ARG HG2 1.0 1.8 5.0 301 183 A 13 ARG HG3 A 14 GLY H 1.0 1.8 5.0 302 184 A 13 ARG HG2 A 45 TYR HBx 1.0 1.8 5.0 303 184 A 13 ARG HG3 A 45 TYR HBx 1.0 1.8 5.0 304 184 A 45 TYR HBy A 13 ARG HG2 1.0 1.8 5.0 305 184 A 45 TYR HBy A 13 ARG HG3 1.0 1.8 5.0 306 185 A 13 ARG H A 45 TYR HBx 1.0 1.8 5.0 307 185 A 45 TYR HBy A 13 ARG H 1.0 1.8 5.0 308 186 A 13 ARG H A 46 VAL H 1.0 1.8 4.0 309 187 A 13 ARG H A 47 GLY HAy 1.0 1.8 5.0 310 188 A 13 ARG H A 47 GLY HAx 1.0 1.8 5.0 311 189 A 13 ARG H A 48 VAL H 1.0 1.8 5.0 312 190 A 14 GLY H A 15 SER H 1.0 1.8 5.0 313 191 A 14 GLY H A 16 LYS HD2 1.0 1.8 5.0 314 191 A 14 GLY H A 16 LYS HD3 1.0 1.8 5.0 315 192 A 49 PRO HA A 16 LYS HBx 1.0 1.8 5.0 316 192 A 16 LYS HBy A 49 PRO HA 1.0 1.8 5.0 317 193 A 49 PRO HDy A 16 LYS HBx 1.0 1.8 5.0 318 193 A 16 LYS HBy A 49 PRO HDy 1.0 1.8 5.0 319 194 A 16 LYS HBy A 49 PRO HDx 1.0 1.8 5.0 320 194 A 16 LYS HBx A 49 PRO HDx 1.0 1.8 5.0 321 195 A 75 LYS HA A 16 LYS HBx 1.0 1.8 5.0 322 195 A 16 LYS HBy A 75 LYS HA 1.0 1.8 5.0 323 196 A 18 TYR HA A 16 LYS HD2 1.0 1.8 5.0 324 196 A 16 LYS HD3 A 18 TYR HA 1.0 1.8 5.0 325 197 A 18 TYR HA A 16 LYS HE2 1.0 1.8 5.0 326 197 A 18 TYR HA A 16 LYS HE3 1.0 1.8 5.0 327 198 A 17 LYS H A 16 LYS HG2 1.0 1.8 5.0 328 198 A 16 LYS HG3 A 17 LYS H 1.0 1.8 5.0 329 199 A 49 PRO HDy A 16 LYS HG2 1.0 1.8 5.0 330 199 A 16 LYS HG3 A 49 PRO HDy 1.0 1.8 5.0 331 200 A 16 LYS HG2 A 49 PRO HDx 1.0 1.8 5.0 332 200 A 16 LYS HG3 A 49 PRO HDx 1.0 1.8 5.0 333 201 A 16 LYS HG3 A 73 LEU HDx% 1.0 1.8 5.0 334 201 A 16 LYS HG2 A 73 LEU HDx% 1.0 1.8 5.0 335 202 A 16 LYS HG3 A 73 LEU HDy% 1.0 1.8 5.0 336 202 A 73 LEU HDy% A 16 LYS HG2 1.0 1.8 5.0 337 203 A 17 LYS H A 16 LYS H 1.0 1.8 5.0 338 204 A 18 TYR H A 17 LYS HGx 1.0 1.8 5.0 339 204 A 17 LYS HGy A 18 TYR H 1.0 1.8 5.0 340 205 A 17 LYS H A 18 TYR H 1.0 1.8 5.0 341 206 A 18 TYR HE% A 71 LYS HE2 1.0 1.8 5.0 342 206 A 18 TYR HE% A 71 LYS HE3 1.0 1.8 5.0 343 207 A 18 TYR HE% A 74 PRO HD2 1.0 1.8 5.0 344 207 A 18 TYR HE% A 74 PRO HD3 1.0 1.8 5.0 345 208 A 20 VAL H A 19 ASN HA 1.0 1.8 3.5 346 209 A 20 VAL H A 19 ASN H 1.0 1.8 5.0 347 210 A 21 VAL H A 20 VAL HA 1.0 1.8 2.9 348 211 A 21 VAL H A 20 VAL HB 1.0 1.8 5.0 349 212 A 21 VAL H A 20 VAL HGx% 1.0 1.8 5.0 350 212 A 21 VAL H A 20 VAL HGy% 1.0 1.8 5.0 351 213 A 21 VAL H A 20 VAL H 1.0 1.8 5.0 352 214 A 21 VAL HA A 22 PRO HDy 1.0 1.8 4.0 353 215 A 21 VAL HA A 22 PRO HDx 1.0 1.8 4.0 354 216 A 21 VAL HA A 73 LEU HDx% 1.0 1.8 5.0 355 216 A 21 VAL HA A 73 LEU HDy% 1.0 1.8 5.0 356 217 A 21 VAL HB A 73 LEU HDx% 1.0 1.8 5.0 357 218 A 21 VAL HB A 73 LEU HDy% 1.0 1.8 5.0 358 219 A 21 VAL HB A 73 LEU HG 1.0 1.8 5.0 359 220 A 23 VAL HGx% A 21 VAL HGx% 1.0 1.8 5.0 360 220 A 21 VAL HGx% A 23 VAL HGy% 1.0 1.8 5.0 361 221 A 21 VAL HGx% A 73 LEU HDx% 1.0 1.8 5.0 362 222 A 21 VAL HGx% A 73 LEU HDy% 1.0 1.8 5.0 363 223 A 23 VAL HGx% A 21 VAL HGy% 1.0 1.8 5.0 364 223 A 21 VAL HGy% A 23 VAL HGy% 1.0 1.8 5.0 365 224 A 21 VAL HGy% A 69 CYS HBx 1.0 1.8 5.0 366 224 A 21 VAL HGx% A 69 CYS HBx 1.0 1.8 5.0 367 224 A 69 CYS HBy A 21 VAL HGy% 1.0 1.8 5.0 368 224 A 21 VAL HGx% A 69 CYS HBy 1.0 1.8 5.0 369 225 A 70 THR H A 21 VAL HGy% 1.0 1.8 5.0 370 225 A 21 VAL HGx% A 70 THR H 1.0 1.8 5.0 371 226 A 21 VAL HGy% A 71 LYS HBx 1.0 1.8 5.0 372 226 A 21 VAL HGx% A 71 LYS HBx 1.0 1.8 5.0 373 226 A 71 LYS HBy A 21 VAL HGy% 1.0 1.8 5.0 374 226 A 21 VAL HGx% A 71 LYS HBy 1.0 1.8 5.0 375 227 A 21 VAL HGy% A 71 LYS HGx 1.0 1.8 5.0 376 227 A 21 VAL HGx% A 71 LYS HGx 1.0 1.8 5.0 377 227 A 71 LYS HGy A 21 VAL HGy% 1.0 1.8 5.0 378 227 A 21 VAL HGx% A 71 LYS HGy 1.0 1.8 5.0 379 228 A 71 LYS H A 21 VAL HGy% 1.0 1.8 5.0 380 228 A 21 VAL HGx% A 71 LYS H 1.0 1.8 5.0 381 229 A 21 VAL HGy% A 73 LEU HDx% 1.0 1.8 5.0 382 229 A 21 VAL HGx% A 73 LEU HDx% 1.0 1.8 5.0 383 230 A 21 VAL HGx% A 73 LEU HDy% 1.0 1.8 5.0 384 230 A 73 LEU HDy% A 21 VAL HGy% 1.0 1.8 5.0 385 231 A 73 LEU HG A 21 VAL HGy% 1.0 1.8 5.0 386 231 A 21 VAL HGx% A 73 LEU HG 1.0 1.8 5.0 387 232 A 23 VAL H A 22 PRO HA 1.0 1.8 2.9 388 233 A 70 THR HG2% A 22 PRO HBx 1.0 1.8 5.0 389 233 A 22 PRO HBy A 70 THR HG2% 1.0 1.8 5.0 390 234 A 71 LYS HBy A 22 PRO HDy 1.0 1.8 5.0 391 234 A 22 PRO HDy A 71 LYS HBx 1.0 1.8 5.0 392 235 A 71 LYS HD3 A 22 PRO HDy 1.0 1.8 5.0 393 235 A 22 PRO HDy A 71 LYS HD2 1.0 1.8 5.0 394 236 A 71 LYS HBy A 22 PRO HDx 1.0 1.8 5.0 395 236 A 22 PRO HDx A 71 LYS HBx 1.0 1.8 5.0 396 237 A 71 LYS HD3 A 22 PRO HDx 1.0 1.8 5.0 397 237 A 22 PRO HDx A 71 LYS HD2 1.0 1.8 5.0 398 238 A 70 THR H A 22 PRO HDx 1.0 1.8 5.0 399 238 A 70 THR H A 22 PRO HDy 1.0 1.8 5.0 400 239 A 71 LYS HGy A 22 PRO HDx 1.0 1.8 5.0 401 239 A 71 LYS HGy A 22 PRO HDy 1.0 1.8 5.0 402 240 A 22 PRO HDx A 71 LYS HGx 1.0 1.8 5.0 403 240 A 22 PRO HDy A 71 LYS HGx 1.0 1.8 5.0 404 241 A 70 THR HG2% A 22 PRO HGy 1.0 1.8 5.0 405 242 A 71 LYS HBy A 22 PRO HGy 1.0 1.8 5.0 406 242 A 22 PRO HGy A 71 LYS HBx 1.0 1.8 5.0 407 243 A 22 PRO HGx A 70 THR HG2% 1.0 1.8 5.0 408 244 A 22 PRO HGx A 71 LYS HBy 1.0 1.8 5.0 409 244 A 22 PRO HGx A 71 LYS HBx 1.0 1.8 5.0 410 245 A 23 VAL H A 22 PRO HGy 1.0 1.8 5.0 411 245 A 23 VAL H A 22 PRO HGx 1.0 1.8 5.0 412 246 A 71 LYS H A 22 PRO HGy 1.0 1.8 5.0 413 246 A 22 PRO HGx A 71 LYS H 1.0 1.8 5.0 414 247 A 23 VAL HA A 24 LYS H 1.0 1.8 2.9 415 248 A 23 VAL HA A 56 VAL HGx% 1.0 1.8 5.0 416 248 A 23 VAL HA A 56 VAL HGy% 1.0 1.8 5.0 417 249 A 67 ILE HG2% A 23 VAL HA 1.0 1.8 5.0 418 250 A 23 VAL HA A 69 CYS HA 1.0 1.8 3.0 419 251 A 70 THR HG2% A 23 VAL HA 1.0 1.8 5.0 420 252 A 70 THR H A 23 VAL HA 1.0 1.8 4.0 421 253 A 23 VAL HB A 24 LYS H 1.0 1.8 5.0 422 254 A 23 VAL HB A 41 LEU HDx% 1.0 1.8 5.0 423 254 A 41 LEU HDy% A 23 VAL HB 1.0 1.8 5.0 424 255 A 67 ILE HG2% A 23 VAL HB 1.0 1.8 5.0 425 256 A 23 VAL HB A 69 CYS HA 1.0 1.8 5.0 426 257 A 23 VAL HGx% A 24 LYS H 1.0 1.8 5.0 427 258 A 23 VAL HGx% A 69 CYS HA 1.0 1.8 5.0 428 259 A 69 CYS HA A 23 VAL HGy% 1.0 1.8 5.0 429 260 A 69 CYS HBy A 23 VAL HGy% 1.0 1.8 5.0 430 260 A 23 VAL HGy% A 69 CYS HBx 1.0 1.8 5.0 431 261 A 24 LYS H A 23 VAL HGy% 1.0 1.8 5.0 432 261 A 23 VAL HGx% A 24 LYS H 1.0 1.8 5.0 433 262 A 23 VAL HGx% A 41 LEU HBx 1.0 1.8 5.0 434 262 A 23 VAL HGy% A 41 LEU HBx 1.0 1.8 5.0 435 262 A 41 LEU HBy A 23 VAL HGy% 1.0 1.8 5.0 436 262 A 23 VAL HGx% A 41 LEU HBy 1.0 1.8 5.0 437 263 A 23 VAL HGx% A 41 LEU HDx% 1.0 1.8 5.0 438 263 A 23 VAL HGy% A 41 LEU HDx% 1.0 1.8 5.0 439 264 A 23 VAL HGx% A 41 LEU HDy% 1.0 1.8 5.0 440 264 A 41 LEU HDy% A 23 VAL HGy% 1.0 1.8 5.0 441 265 A 23 VAL HGy% A 56 VAL HGx% 1.0 1.8 5.0 442 265 A 23 VAL HGx% A 56 VAL HGx% 1.0 1.8 5.0 443 265 A 56 VAL HGy% A 23 VAL HGy% 1.0 1.8 5.0 444 265 A 23 VAL HGx% A 56 VAL HGy% 1.0 1.8 5.0 445 266 A 67 ILE HD1% A 23 VAL HGy% 1.0 1.8 5.0 446 266 A 67 ILE HD1% A 23 VAL HGx% 1.0 1.8 5.0 447 267 A 67 ILE HG2% A 23 VAL HGy% 1.0 1.8 5.0 448 267 A 23 VAL HGx% A 67 ILE HG2% 1.0 1.8 5.0 449 268 A 23 VAL HGx% A 69 CYS HBx 1.0 1.8 5.0 450 268 A 23 VAL HGy% A 69 CYS HBx 1.0 1.8 5.0 451 268 A 69 CYS HBy A 23 VAL HGy% 1.0 1.8 5.0 452 268 A 23 VAL HGx% A 69 CYS HBy 1.0 1.8 5.0 453 269 A 23 VAL H A 70 THR HG2% 1.0 1.8 5.0 454 270 A 24 LYS HA A 25 SER H 1.0 1.8 2.9 455 271 A 70 THR HA A 24 LYS HD2 1.0 1.8 5.0 456 271 A 24 LYS HD3 A 70 THR HA 1.0 1.8 5.0 457 272 A 70 THR HB A 24 LYS HD2 1.0 1.8 5.0 458 272 A 24 LYS HD3 A 70 THR HB 1.0 1.8 5.0 459 273 A 68 ILE HD1% A 24 LYS HEx 1.0 1.8 5.0 460 273 A 24 LYS HEy A 68 ILE HD1% 1.0 1.8 5.0 461 274 A 70 THR HG2% A 24 LYS HEx 1.0 1.8 5.0 462 274 A 70 THR HG2% A 24 LYS HEy 1.0 1.8 5.0 463 275 A 25 SER H A 24 LYS HGx 1.0 1.8 5.0 464 275 A 25 SER H A 24 LYS HGy 1.0 1.8 5.0 465 276 A 69 CYS HA A 24 LYS HGx 1.0 1.8 5.0 466 276 A 69 CYS HA A 24 LYS HGy 1.0 1.8 5.0 467 277 A 67 ILE HD1% A 24 LYS H 1.0 1.8 5.0 468 278 A 67 ILE HG2% A 24 LYS H 1.0 1.8 5.0 469 279 A 24 LYS H A 68 ILE HG1x 1.0 1.8 5.0 470 279 A 24 LYS H A 68 ILE HG1y 1.0 1.8 5.0 471 280 A 24 LYS H A 68 ILE H 1.0 1.8 4.0 472 281 A 24 LYS H A 69 CYS HA 1.0 1.8 4.0 473 282 A 70 THR HG2% A 24 LYS H 1.0 1.8 5.0 474 283 A 25 SER HA A 29 VAL HGy% 1.0 1.8 5.0 475 283 A 29 VAL HGx% A 25 SER HA 1.0 1.8 5.0 476 284 A 25 SER HA A 65 VAL HGx% 1.0 1.8 5.0 477 285 A 25 SER HA A 65 VAL HGy% 1.0 1.8 5.0 478 286 A 25 SER HA A 67 ILE HA 1.0 1.8 3.0 479 287 A 25 SER HA A 67 ILE HD1% 1.0 1.8 5.0 480 288 A 25 SER HA A 67 ILE HG2% 1.0 1.8 5.0 481 289 A 25 SER HA A 68 ILE H 1.0 1.8 4.0 482 290 A 29 VAL HGx% A 25 SER HBx 1.0 1.8 5.0 483 290 A 29 VAL HGx% A 25 SER HBy 1.0 1.8 5.0 484 291 A 25 SER HBy A 29 VAL HGy% 1.0 1.8 5.0 485 291 A 25 SER HBx A 29 VAL HGy% 1.0 1.8 5.0 486 292 A 25 SER HBy A 65 VAL HGx% 1.0 1.8 5.0 487 292 A 65 VAL HGx% A 25 SER HBx 1.0 1.8 5.0 488 293 A 25 SER HBx A 65 VAL HGy% 1.0 1.8 5.0 489 293 A 25 SER HBy A 65 VAL HGy% 1.0 1.8 5.0 490 294 A 67 ILE HD1% A 25 SER HBx 1.0 1.8 5.0 491 294 A 25 SER HBy A 67 ILE HD1% 1.0 1.8 5.0 492 295 A 25 SER H A 67 ILE HD1% 1.0 1.8 5.0 493 296 A 68 ILE HD1% A 26 ASN HA 1.0 1.8 5.0 494 297 A 68 ILE HD1% A 26 ASN HBx 1.0 1.8 5.0 495 297 A 68 ILE HD1% A 26 ASN HBy 1.0 1.8 5.0 496 298 A 68 ILE HG2% A 26 ASN HBx 1.0 1.8 5.0 497 298 A 26 ASN HBy A 68 ILE HG2% 1.0 1.8 5.0 498 299 A 26 ASN HD2x A 65 VAL HA 1.0 1.8 5.0 499 300 A 26 ASN HD2x A 66 ASP H 1.0 1.8 5.0 500 301 A 65 VAL HA A 26 ASN HD2y 1.0 1.8 5.0 501 302 A 66 ASP H A 26 ASN HD2y 1.0 1.8 5.0 502 303 A 26 ASN HD2y A 66 ASP HBx 1.0 1.8 5.0 503 303 A 26 ASN HD2x A 66 ASP HBy 1.0 1.8 5.0 504 303 A 26 ASN HD2y A 66 ASP HBy 1.0 1.8 5.0 505 303 A 26 ASN HD2x A 66 ASP HBx 1.0 1.8 5.0 506 304 A 27 LYS H A 26 ASN H 1.0 1.8 3.5 507 305 A 26 ASN H A 65 VAL HGx% 1.0 1.8 5.0 508 306 A 26 ASN H A 65 VAL HGy% 1.0 1.8 5.0 509 307 A 67 ILE HA A 26 ASN H 1.0 1.8 4.0 510 308 A 67 ILE HD1% A 26 ASN H 1.0 1.8 5.0 511 309 A 68 ILE HD1% A 26 ASN H 1.0 1.8 5.0 512 310 A 27 LYS HA A 28 PRO HDy 1.0 1.8 4.0 513 311 A 27 LYS HA A 28 PRO HDx 1.0 1.8 4.0 514 312 A 27 LYS HBy A 29 VAL HGy% 1.0 1.8 5.0 515 312 A 27 LYS HBx A 29 VAL HGy% 1.0 1.8 5.0 516 312 A 29 VAL HGx% A 27 LYS HBx 1.0 1.8 5.0 517 312 A 29 VAL HGx% A 27 LYS HBy 1.0 1.8 5.0 518 313 A 65 VAL HGx% A 27 LYS HBx 1.0 1.8 5.0 519 313 A 27 LYS HBy A 65 VAL HGx% 1.0 1.8 5.0 520 314 A 27 LYS HBx A 65 VAL HGy% 1.0 1.8 5.0 521 314 A 27 LYS HBy A 65 VAL HGy% 1.0 1.8 5.0 522 315 A 65 VAL HA A 27 LYS HE2 1.0 1.8 5.0 523 315 A 65 VAL HA A 27 LYS HE3 1.0 1.8 5.0 524 316 A 65 VAL HGx% A 27 LYS HE2 1.0 1.8 5.0 525 316 A 27 LYS HE3 A 65 VAL HGx% 1.0 1.8 5.0 526 317 A 27 LYS HE3 A 65 VAL HGy% 1.0 1.8 5.0 527 317 A 27 LYS HE2 A 65 VAL HGy% 1.0 1.8 5.0 528 317 A 65 VAL HGx% A 27 LYS HE2 1.0 1.8 5.0 529 317 A 27 LYS HE3 A 65 VAL HGx% 1.0 1.8 5.0 530 318 A 66 ASP H A 27 LYS HE2 1.0 1.8 5.0 531 318 A 66 ASP H A 27 LYS HE3 1.0 1.8 5.0 532 319 A 27 LYS H A 29 VAL HGy% 1.0 1.8 5.0 533 319 A 29 VAL HGx% A 27 LYS H 1.0 1.8 5.0 534 320 A 27 LYS H A 65 VAL HGy% 1.0 1.8 5.0 535 320 A 27 LYS H A 65 VAL HGx% 1.0 1.8 5.0 536 321 A 27 LYS H A 65 VAL HGy% 1.0 1.8 5.0 537 322 A 27 LYS H A 67 ILE HD1% 1.0 1.8 5.0 538 323 A 29 VAL HB A 65 VAL HGy% 1.0 1.8 5.0 539 323 A 29 VAL HB A 65 VAL HGx% 1.0 1.8 5.0 540 324 A 30 GLU H A 29 VAL HGx% 1.0 1.8 5.0 541 325 A 29 VAL HGx% A 33 LYS HBy 1.0 1.8 5.0 542 325 A 29 VAL HGx% A 33 LYS HBx 1.0 1.8 5.0 543 326 A 29 VAL HGx% A 37 PHE HD% 1.0 1.8 5.0 544 327 A 29 VAL HGx% A 37 PHE HE% 1.0 1.8 5.0 545 328 A 29 VAL HGx% A 37 PHE HZ 1.0 1.8 5.0 546 329 A 30 GLU H A 29 VAL HGy% 1.0 1.8 5.0 547 330 A 33 LYS HBy A 29 VAL HGy% 1.0 1.8 5.0 548 330 A 29 VAL HGy% A 33 LYS HBx 1.0 1.8 5.0 549 331 A 37 PHE HD% A 29 VAL HGy% 1.0 1.8 5.0 550 332 A 37 PHE HE% A 29 VAL HGy% 1.0 1.8 5.0 551 333 A 37 PHE HZ A 29 VAL HGy% 1.0 1.8 5.0 552 334 A 29 VAL HGx% A 33 LYS HE2 1.0 1.8 5.0 553 334 A 29 VAL HGy% A 33 LYS HE2 1.0 1.8 5.0 554 334 A 33 LYS HE3 A 29 VAL HGy% 1.0 1.8 5.0 555 334 A 29 VAL HGx% A 33 LYS HE3 1.0 1.8 5.0 556 335 A 60 ILE HG2% A 29 VAL HGy% 1.0 1.8 5.0 557 335 A 29 VAL HGx% A 60 ILE HG2% 1.0 1.8 5.0 558 336 A 67 ILE HD1% A 29 VAL HGy% 1.0 1.8 5.0 559 336 A 29 VAL HGx% A 67 ILE HD1% 1.0 1.8 5.0 560 337 A 29 VAL H A 30 GLU H 1.0 1.8 5.0 561 338 A 30 GLU HBy A 33 LYS HG2 1.0 1.8 5.0 562 338 A 30 GLU HBx A 33 LYS HG2 1.0 1.8 5.0 563 338 A 33 LYS HG3 A 30 GLU HBx 1.0 1.8 5.0 564 338 A 30 GLU HBy A 33 LYS HG3 1.0 1.8 5.0 565 339 A 31 ILE H A 30 GLU HGx 1.0 1.8 5.0 566 339 A 30 GLU HGy A 31 ILE H 1.0 1.8 5.0 567 340 A 31 ILE HA A 33 LYS H 1.0 1.8 5.0 568 341 A 31 ILE HD1% A 32 SER H 1.0 1.8 5.0 569 342 A 32 SER H A 31 ILE HG1x 1.0 1.8 5.0 570 342 A 32 SER H A 31 ILE HG1y 1.0 1.8 5.0 571 343 A 31 ILE HG2% A 32 SER H 1.0 1.8 5.0 572 344 A 33 LYS H A 32 SER H 1.0 1.8 3.5 573 345 A 33 LYS HA A 36 ASP HB2 1.0 1.8 5.0 574 345 A 33 LYS HA A 36 ASP HB3 1.0 1.8 5.0 575 346 A 33 LYS HA A 36 ASP H 1.0 1.8 4.0 576 347 A 33 LYS HA A 37 PHE H 1.0 1.8 5.0 577 348 A 34 TRP H A 33 LYS HBx 1.0 1.8 4.0 578 348 A 33 LYS HBy A 34 TRP H 1.0 1.8 4.0 579 349 A 33 LYS HBx A 36 ASP HB2 1.0 1.8 5.0 580 349 A 33 LYS HBy A 36 ASP HB2 1.0 1.8 5.0 581 349 A 36 ASP HB3 A 33 LYS HBx 1.0 1.8 5.0 582 349 A 33 LYS HBy A 36 ASP HB3 1.0 1.8 5.0 583 350 A 37 PHE HE% A 33 LYS HD2 1.0 1.8 5.0 584 350 A 37 PHE HE% A 33 LYS HD3 1.0 1.8 5.0 585 351 A 63 THR HG2% A 33 LYS HE2 1.0 1.8 5.0 586 351 A 33 LYS HE3 A 63 THR HG2% 1.0 1.8 5.0 587 352 A 34 TRP H A 33 LYS HG2 1.0 1.8 5.0 588 352 A 33 LYS HG3 A 34 TRP H 1.0 1.8 5.0 589 353 A 33 LYS H A 34 TRP H 1.0 1.8 3.5 590 354 A 33 LYS H A 35 ILE H 1.0 1.8 5.0 591 355 A 34 TRP HA A 36 ASP H 1.0 1.8 5.0 592 356 A 34 TRP HA A 37 PHE HBx 1.0 1.8 5.0 593 356 A 34 TRP HA A 37 PHE HBy 1.0 1.8 5.0 594 357 A 34 TRP HA A 37 PHE HD% 1.0 1.8 5.0 595 358 A 34 TRP HA A 37 PHE H 1.0 1.8 4.0 596 359 A 34 TRP HA A 38 SER H 1.0 1.8 5.0 597 360 A 35 ILE H A 34 TRP HBx 1.0 1.8 4.0 598 360 A 35 ILE H A 34 TRP HBy 1.0 1.8 4.0 599 361 A 34 TRP H A 35 ILE H 1.0 1.8 5.0 600 362 A 35 ILE HA A 38 SER HBx 1.0 1.8 5.0 601 362 A 35 ILE HA A 38 SER HBy 1.0 1.8 5.0 602 363 A 38 SER H A 35 ILE HA 1.0 1.8 4.0 603 364 A 35 ILE HA A 39 ASN H 1.0 1.8 5.0 604 365 A 36 ASP H A 35 ILE HB 1.0 1.8 4.0 605 366 A 36 ASP H A 35 ILE HD1% 1.0 1.8 5.0 606 367 A 36 ASP H A 35 ILE HG1x 1.0 1.8 5.0 607 367 A 36 ASP H A 35 ILE HG1y 1.0 1.8 5.0 608 368 A 36 ASP H A 35 ILE HG2% 1.0 1.8 5.0 609 369 A 35 ILE HG2% A 39 ASN HD2x 1.0 1.8 5.0 610 369 A 35 ILE HG2% A 39 ASN HD2y 1.0 1.8 5.0 611 370 A 36 ASP H A 35 ILE H 1.0 1.8 5.0 612 371 A 37 PHE H A 35 ILE H 1.0 1.8 5.0 613 372 A 38 SER H A 36 ASP HA 1.0 1.8 5.0 614 373 A 36 ASP HA A 39 ASN HBx 1.0 1.8 5.0 615 373 A 36 ASP HA A 39 ASN HBy 1.0 1.8 5.0 616 374 A 36 ASP HA A 39 ASN HD2x 1.0 1.8 5.0 617 375 A 36 ASP HA A 39 ASN HD2y 1.0 1.8 5.0 618 376 A 39 ASN H A 36 ASP HA 1.0 1.8 4.0 619 377 A 36 ASP HA A 40 VAL H 1.0 1.8 5.0 620 378 A 37 PHE H A 36 ASP HB2 1.0 1.8 4.0 621 378 A 36 ASP HB3 A 37 PHE H 1.0 1.8 4.0 622 379 A 36 ASP H A 37 PHE H 1.0 1.8 5.0 623 380 A 38 SER H A 36 ASP H 1.0 1.8 5.0 624 381 A 37 PHE HA A 40 VAL HB 1.0 1.8 5.0 625 382 A 37 PHE HA A 40 VAL HGx% 1.0 1.8 5.0 626 383 A 37 PHE HA A 40 VAL HGy% 1.0 1.8 5.0 627 384 A 40 VAL H A 37 PHE HA 1.0 1.8 4.0 628 385 A 37 PHE HA A 41 LEU H 1.0 1.8 5.0 629 386 A 37 PHE HA A 60 ILE HD1% 1.0 1.8 5.0 630 387 A 38 SER H A 37 PHE HBx 1.0 1.8 4.0 631 387 A 37 PHE HBy A 38 SER H 1.0 1.8 4.0 632 388 A 37 PHE HBx A 41 LEU HDx% 1.0 1.8 5.0 633 388 A 37 PHE HBy A 41 LEU HDx% 1.0 1.8 5.0 634 388 A 41 LEU HDy% A 37 PHE HBx 1.0 1.8 5.0 635 388 A 37 PHE HBy A 41 LEU HDy% 1.0 1.8 5.0 636 389 A 60 ILE HD1% A 37 PHE HBx 1.0 1.8 5.0 637 389 A 37 PHE HBy A 60 ILE HD1% 1.0 1.8 5.0 638 390 A 37 PHE HD% A 40 VAL HGy% 1.0 1.8 5.0 639 390 A 37 PHE HD% A 40 VAL HGx% 1.0 1.8 5.0 640 391 A 37 PHE HD% A 60 ILE HD1% 1.0 1.8 5.0 641 392 A 37 PHE HD% A 60 ILE HG2% 1.0 1.8 5.0 642 393 A 37 PHE HD% A 61 MET HE% 1.0 1.8 5.0 643 394 A 67 ILE HD1% A 37 PHE HD% 1.0 1.8 5.0 644 395 A 37 PHE HE% A 60 ILE HD1% 1.0 1.8 5.0 645 396 A 37 PHE HE% A 60 ILE HG2% 1.0 1.8 5.0 646 397 A 37 PHE HE% A 61 MET HBx 1.0 1.8 5.0 647 397 A 37 PHE HE% A 61 MET HBy 1.0 1.8 5.0 648 398 A 37 PHE HE% A 61 MET HE% 1.0 1.8 5.0 649 399 A 37 PHE HE% A 63 THR HG2% 1.0 1.8 5.0 650 400 A 65 VAL HGx% A 37 PHE HE% 1.0 1.8 5.0 651 401 A 37 PHE HE% A 65 VAL HGy% 1.0 1.8 5.0 652 402 A 67 ILE HD1% A 37 PHE HE% 1.0 1.8 5.0 653 403 A 38 SER H A 37 PHE H 1.0 1.8 3.5 654 404 A 37 PHE H A 39 ASN H 1.0 1.8 5.0 655 405 A 37 PHE HZ A 60 ILE HG2% 1.0 1.8 5.0 656 406 A 37 PHE HZ A 63 THR HG2% 1.0 1.8 5.0 657 407 A 65 VAL HGx% A 37 PHE HZ 1.0 1.8 5.0 658 408 A 37 PHE HZ A 65 VAL HGy% 1.0 1.8 5.0 659 409 A 38 SER HA A 41 LEU HBx 1.0 1.8 5.0 660 409 A 41 LEU HBy A 38 SER HA 1.0 1.8 5.0 661 410 A 38 SER HA A 41 LEU HDx% 1.0 1.8 5.0 662 410 A 41 LEU HDy% A 38 SER HA 1.0 1.8 5.0 663 411 A 41 LEU H A 38 SER HA 1.0 1.8 4.0 664 412 A 39 ASN H A 38 SER HBx 1.0 1.8 4.0 665 412 A 38 SER HBy A 39 ASN H 1.0 1.8 4.0 666 413 A 38 SER HBx A 41 LEU HDx% 1.0 1.8 5.0 667 413 A 38 SER HBy A 41 LEU HDx% 1.0 1.8 5.0 668 413 A 41 LEU HDy% A 38 SER HBx 1.0 1.8 5.0 669 413 A 41 LEU HDy% A 38 SER HBy 1.0 1.8 5.0 670 414 A 38 SER H A 39 ASN H 1.0 1.8 3.5 671 415 A 39 ASN HA A 42 SER HBx 1.0 1.8 5.0 672 415 A 39 ASN HA A 42 SER HBy 1.0 1.8 5.0 673 416 A 39 ASN HA A 42 SER H 1.0 1.8 4.0 674 417 A 40 VAL H A 39 ASN HBx 1.0 1.8 4.0 675 417 A 39 ASN HBy A 40 VAL H 1.0 1.8 4.0 676 418 A 39 ASN H A 40 VAL H 1.0 1.8 5.0 677 419 A 40 VAL HA A 43 ARG HBx 1.0 1.8 5.0 678 419 A 40 VAL HA A 43 ARG HBy 1.0 1.8 5.0 679 420 A 40 VAL HA A 43 ARG H 1.0 1.8 4.0 680 421 A 40 VAL HB A 41 LEU H 1.0 1.8 4.0 681 422 A 40 VAL HB A 60 ILE HD1% 1.0 1.8 5.0 682 423 A 41 LEU H A 40 VAL HGx% 1.0 1.8 5.0 683 424 A 60 ILE HD1% A 40 VAL HGx% 1.0 1.8 5.0 684 425 A 40 VAL HGx% A 61 MET HGy 1.0 1.8 5.0 685 426 A 40 VAL HGx% A 61 MET HGx 1.0 1.8 5.0 686 427 A 41 LEU H A 40 VAL HGy% 1.0 1.8 5.0 687 428 A 60 ILE HD1% A 40 VAL HGy% 1.0 1.8 5.0 688 429 A 40 VAL HGy% A 61 MET HGy 1.0 1.8 5.0 689 430 A 61 MET HGx A 40 VAL HGy% 1.0 1.8 5.0 690 431 A 40 VAL HGx% A 43 ARG HG2 1.0 1.8 5.0 691 431 A 40 VAL HGy% A 43 ARG HG2 1.0 1.8 5.0 692 431 A 43 ARG HG3 A 40 VAL HGy% 1.0 1.8 5.0 693 431 A 40 VAL HGx% A 43 ARG HG3 1.0 1.8 5.0 694 432 A 40 VAL HGx% A 44 LEU HBx 1.0 1.8 5.0 695 432 A 40 VAL HGy% A 44 LEU HBx 1.0 1.8 5.0 696 432 A 44 LEU HBy A 40 VAL HGy% 1.0 1.8 5.0 697 432 A 44 LEU HBy A 40 VAL HGx% 1.0 1.8 5.0 698 433 A 60 ILE HA A 40 VAL HGy% 1.0 1.8 5.0 699 433 A 40 VAL HGx% A 60 ILE HA 1.0 1.8 5.0 700 434 A 40 VAL HGy% A 60 ILE HG12 1.0 1.8 5.0 701 434 A 40 VAL HGx% A 60 ILE HG12 1.0 1.8 5.0 702 434 A 60 ILE HG13 A 40 VAL HGy% 1.0 1.8 5.0 703 434 A 40 VAL HGx% A 60 ILE HG13 1.0 1.8 5.0 704 435 A 61 MET HE% A 40 VAL HGy% 1.0 1.8 5.0 705 435 A 40 VAL HGx% A 61 MET HE% 1.0 1.8 5.0 706 436 A 40 VAL H A 41 LEU H 1.0 1.8 3.5 707 437 A 40 VAL H A 60 ILE HD1% 1.0 1.8 5.0 708 438 A 41 LEU HA A 43 ARG H 1.0 1.8 5.0 709 439 A 41 LEU HA A 44 LEU HBx 1.0 1.8 5.0 710 439 A 41 LEU HA A 44 LEU HBy 1.0 1.8 5.0 711 440 A 41 LEU HA A 44 LEU HDx% 1.0 1.8 5.0 712 441 A 41 LEU HA A 44 LEU HDy% 1.0 1.8 5.0 713 442 A 41 LEU HA A 44 LEU HG 1.0 1.8 5.0 714 443 A 41 LEU HA A 44 LEU H 1.0 1.8 4.0 715 444 A 41 LEU HA A 60 ILE HD1% 1.0 1.8 5.0 716 445 A 42 SER H A 41 LEU HBx 1.0 1.8 4.0 717 445 A 41 LEU HBy A 42 SER H 1.0 1.8 4.0 718 446 A 42 SER H A 41 LEU HDx% 1.0 1.8 5.0 719 447 A 60 ILE HD1% A 41 LEU HDx% 1.0 1.8 5.0 720 448 A 41 LEU HDy% A 42 SER H 1.0 1.8 5.0 721 449 A 41 LEU HDy% A 60 ILE HD1% 1.0 1.8 5.0 722 450 A 41 LEU HDx% A 57 CYS HB2 1.0 1.8 5.0 723 450 A 41 LEU HDy% A 57 CYS HB2 1.0 1.8 5.0 724 450 A 57 CYS HB3 A 41 LEU HDx% 1.0 1.8 5.0 725 450 A 41 LEU HDy% A 57 CYS HB3 1.0 1.8 5.0 726 451 A 60 ILE HG2% A 41 LEU HDx% 1.0 1.8 5.0 727 451 A 41 LEU HDy% A 60 ILE HG2% 1.0 1.8 5.0 728 452 A 67 ILE HD1% A 41 LEU HDx% 1.0 1.8 5.0 729 452 A 67 ILE HD1% A 41 LEU HDy% 1.0 1.8 5.0 730 453 A 42 SER H A 41 LEU HG 1.0 1.8 5.0 731 454 A 60 ILE HD1% A 41 LEU HG 1.0 1.8 5.0 732 455 A 41 LEU H A 42 SER H 1.0 1.8 3.5 733 456 A 41 LEU H A 60 ILE HD1% 1.0 1.8 5.0 734 457 A 42 SER HA A 44 LEU H 1.0 1.8 5.0 735 458 A 43 ARG H A 42 SER HBx 1.0 1.8 4.0 736 458 A 42 SER HBy A 43 ARG H 1.0 1.8 4.0 737 459 A 42 SER H A 43 ARG H 1.0 1.8 3.5 738 460 A 42 SER H A 44 LEU H 1.0 1.8 5.0 739 461 A 44 LEU H A 43 ARG HBx 1.0 1.8 4.0 740 461 A 43 ARG HBy A 44 LEU H 1.0 1.8 4.0 741 462 A 44 LEU H A 43 ARG HG2 1.0 1.8 5.0 742 462 A 43 ARG HG3 A 44 LEU H 1.0 1.8 5.0 743 463 A 43 ARG H A 44 LEU H 1.0 1.8 3.5 744 464 A 44 LEU HA A 45 TYR H 1.0 1.8 3.5 745 465 A 45 TYR H A 44 LEU HDx% 1.0 1.8 5.0 746 466 A 57 CYS HB3 A 44 LEU HDx% 1.0 1.8 5.0 747 466 A 44 LEU HDx% A 57 CYS HB2 1.0 1.8 5.0 748 467 A 57 CYS HB3 A 44 LEU HDy% 1.0 1.8 5.0 749 467 A 44 LEU HDy% A 57 CYS HB2 1.0 1.8 5.0 750 468 A 45 TYR H A 44 LEU HDx% 1.0 1.8 5.0 751 468 A 45 TYR H A 44 LEU HDy% 1.0 1.8 5.0 752 469 A 56 VAL HB A 44 LEU HDx% 1.0 1.8 5.0 753 469 A 44 LEU HDy% A 56 VAL HB 1.0 1.8 5.0 754 470 A 57 CYS HA A 44 LEU HDx% 1.0 1.8 5.0 755 470 A 44 LEU HDy% A 57 CYS HA 1.0 1.8 5.0 756 471 A 44 LEU HG A 45 TYR H 1.0 1.8 5.0 757 472 A 44 LEU HG A 46 VAL HGx% 1.0 1.8 5.0 758 472 A 46 VAL HGy% A 44 LEU HG 1.0 1.8 5.0 759 473 A 45 TYR HA A 46 VAL H 1.0 1.8 3.5 760 474 A 45 TYR HD% A 46 VAL H 1.0 1.8 5.0 761 475 A 46 VAL H A 45 TYR H 1.0 1.8 5.0 762 476 A 47 GLY H A 46 VAL HA 1.0 1.8 3.5 763 477 A 46 VAL HB A 56 VAL HGx% 1.0 1.8 5.0 764 477 A 56 VAL HGy% A 46 VAL HB 1.0 1.8 5.0 765 478 A 47 GLY H A 46 VAL HGx% 1.0 1.8 5.0 766 478 A 46 VAL HGy% A 47 GLY H 1.0 1.8 5.0 767 479 A 56 VAL HA A 46 VAL HGx% 1.0 1.8 5.0 768 479 A 46 VAL HGy% A 56 VAL HA 1.0 1.8 5.0 769 480 A 46 VAL H A 47 GLY H 1.0 1.8 5.0 770 481 A 48 VAL H A 47 GLY HAy 1.0 1.8 3.5 771 482 A 47 GLY HAx A 48 VAL H 1.0 1.8 3.5 772 483 A 47 GLY H A 48 VAL H 1.0 1.8 5.0 773 484 A 49 PRO HA A 48 VAL HA 1.0 1.8 5.0 774 485 A 48 VAL HA A 50 THR HG2% 1.0 1.8 5.0 775 486 A 50 THR HG2% A 48 VAL HB 1.0 1.8 5.0 776 487 A 50 THR HA A 48 VAL HGx% 1.0 1.8 5.0 777 487 A 48 VAL HGy% A 50 THR HA 1.0 1.8 5.0 778 488 A 49 PRO HA A 50 THR H 1.0 1.8 3.5 779 489 A 49 PRO HA A 73 LEU HDx% 1.0 1.8 5.0 780 490 A 49 PRO HA A 73 LEU HDy% 1.0 1.8 5.0 781 491 A 74 PRO HA A 49 PRO HBx 1.0 1.8 5.0 782 491 A 49 PRO HBy A 74 PRO HA 1.0 1.8 5.0 783 492 A 75 LYS H A 49 PRO HBx 1.0 1.8 5.0 784 492 A 49 PRO HBy A 75 LYS H 1.0 1.8 5.0 785 493 A 75 LYS HE3 A 49 PRO HDy 1.0 1.8 5.0 786 493 A 49 PRO HDy A 75 LYS HE2 1.0 1.8 5.0 787 494 A 75 LYS HE3 A 49 PRO HDx 1.0 1.8 5.0 788 494 A 49 PRO HDx A 75 LYS HE2 1.0 1.8 5.0 789 495 A 49 PRO HDx A 75 LYS HD2 1.0 1.8 5.0 790 495 A 49 PRO HDy A 75 LYS HD2 1.0 1.8 5.0 791 495 A 75 LYS HD3 A 49 PRO HDx 1.0 1.8 5.0 792 495 A 49 PRO HDy A 75 LYS HD3 1.0 1.8 5.0 793 496 A 75 LYS H A 49 PRO HGy 1.0 1.8 5.0 794 496 A 75 LYS H A 49 PRO HGx 1.0 1.8 5.0 795 497 A 50 THR HA A 51 LYS H 1.0 1.8 2.9 796 498 A 50 THR HB A 54 ASN HA 1.0 1.8 5.0 797 499 A 50 THR HB A 73 LEU H 1.0 1.8 5.0 798 500 A 50 THR HG2% A 51 LYS H 1.0 1.8 5.0 799 501 A 50 THR HG2% A 54 ASN HA 1.0 1.8 5.0 800 502 A 50 THR HG2% A 54 ASN HBx 1.0 1.8 5.0 801 502 A 50 THR HG2% A 54 ASN HBy 1.0 1.8 5.0 802 503 A 50 THR H A 51 LYS H 1.0 1.8 5.0 803 504 A 50 THR H A 73 LEU HBx 1.0 1.8 5.0 804 504 A 73 LEU HBy A 50 THR H 1.0 1.8 5.0 805 505 A 50 THR H A 73 LEU H 1.0 1.8 5.0 806 506 A 51 LYS HA A 52 SER H 1.0 1.8 2.9 807 507 A 51 LYS HA A 72 ASN HA 1.0 1.8 3.5 808 508 A 73 LEU H A 51 LYS HA 1.0 1.8 4.0 809 509 A 72 ASN HA A 51 LYS HBx 1.0 1.8 5.0 810 509 A 72 ASN HA A 51 LYS HBy 1.0 1.8 5.0 811 510 A 51 LYS HBy A 72 ASN HBx 1.0 1.8 5.0 812 510 A 72 ASN HBy A 51 LYS HBx 1.0 1.8 5.0 813 510 A 51 LYS HBy A 72 ASN HBy 1.0 1.8 5.0 814 510 A 51 LYS HBx A 72 ASN HBx 1.0 1.8 5.0 815 511 A 52 SER H A 51 LYS HG2 1.0 1.8 5.0 816 511 A 52 SER H A 51 LYS HG3 1.0 1.8 5.0 817 512 A 51 LYS H A 52 SER H 1.0 1.8 5.0 818 513 A 51 LYS H A 54 ASN HBx 1.0 1.8 5.0 819 513 A 51 LYS H A 54 ASN HBy 1.0 1.8 5.0 820 514 A 51 LYS H A 54 ASN HD2x 1.0 1.8 5.0 821 514 A 51 LYS H A 54 ASN HD2y 1.0 1.8 5.0 822 515 A 52 SER HA A 53 GLY H 1.0 1.8 2.9 823 516 A 52 SER HA A 69 CYS HBx 1.0 1.8 5.0 824 516 A 69 CYS HBy A 52 SER HA 1.0 1.8 5.0 825 517 A 70 THR HA A 52 SER HBx 1.0 1.8 5.0 826 517 A 70 THR HA A 52 SER HBy 1.0 1.8 5.0 827 518 A 71 LYS HA A 52 SER HBx 1.0 1.8 5.0 828 518 A 52 SER HBy A 71 LYS HA 1.0 1.8 5.0 829 519 A 71 LYS H A 52 SER HBx 1.0 1.8 5.0 830 519 A 71 LYS H A 52 SER HBy 1.0 1.8 5.0 831 520 A 72 ASN H A 52 SER HBx 1.0 1.8 5.0 832 520 A 52 SER HBy A 72 ASN H 1.0 1.8 5.0 833 521 A 52 SER H A 53 GLY H 1.0 1.8 5.0 834 522 A 52 SER H A 72 ASN HA 1.0 1.8 4.0 835 523 A 68 ILE HD1% A 53 GLY HAy 1.0 1.8 5.0 836 524 A 68 ILE HG2% A 53 GLY HAy 1.0 1.8 5.0 837 525 A 68 ILE HD1% A 53 GLY HAx 1.0 1.8 5.0 838 526 A 68 ILE HG2% A 53 GLY HAx 1.0 1.8 5.0 839 527 A 54 ASN H A 53 GLY HAy 1.0 1.8 3.5 840 527 A 53 GLY HAx A 54 ASN H 1.0 1.8 3.5 841 528 A 68 ILE HB A 53 GLY HAy 1.0 1.8 5.0 842 528 A 53 GLY HAx A 68 ILE HB 1.0 1.8 5.0 843 529 A 53 GLY H A 54 ASN H 1.0 1.8 3.5 844 530 A 53 GLY H A 68 ILE HB 1.0 1.8 5.0 845 531 A 68 ILE HD1% A 53 GLY H 1.0 1.8 5.0 846 532 A 68 ILE HG2% A 53 GLY H 1.0 1.8 5.0 847 533 A 53 GLY H A 69 CYS HBx 1.0 1.8 5.0 848 533 A 69 CYS HBy A 53 GLY H 1.0 1.8 5.0 849 534 A 54 ASN HA A 55 VAL H 1.0 1.8 2.9 850 535 A 54 ASN HBy A 56 VAL HGx% 1.0 1.8 5.0 851 535 A 56 VAL HGy% A 54 ASN HBx 1.0 1.8 5.0 852 535 A 56 VAL HGy% A 54 ASN HBy 1.0 1.8 5.0 853 535 A 54 ASN HBx A 56 VAL HGx% 1.0 1.8 5.0 854 536 A 70 THR HA A 54 ASN HD2x 1.0 1.8 5.0 855 537 A 70 THR HA A 54 ASN HD2y 1.0 1.8 5.0 856 538 A 54 ASN H A 55 VAL H 1.0 1.8 5.0 857 539 A 54 ASN H A 68 ILE HB 1.0 1.8 5.0 858 540 A 68 ILE HG2% A 54 ASN H 1.0 1.8 5.0 859 541 A 54 ASN H A 69 CYS HBx 1.0 1.8 5.0 860 541 A 69 CYS HBy A 54 ASN H 1.0 1.8 5.0 861 542 A 54 ASN H A 69 CYS H 1.0 1.8 4.0 862 543 A 70 THR HA A 54 ASN H 1.0 1.8 4.0 863 544 A 55 VAL HA A 68 ILE HA 1.0 1.8 3.5 864 545 A 68 ILE HB A 55 VAL HA 1.0 1.8 5.0 865 546 A 68 ILE HD1% A 55 VAL HA 1.0 1.8 5.0 866 547 A 68 ILE HG2% A 55 VAL HA 1.0 1.8 5.0 867 548 A 69 CYS H A 55 VAL HA 1.0 1.8 4.0 868 549 A 55 VAL HB A 66 ASP HBx 1.0 1.8 5.0 869 549 A 66 ASP HBy A 55 VAL HB 1.0 1.8 5.0 870 550 A 56 VAL H A 55 VAL HGx% 1.0 1.8 5.0 871 551 A 58 LYS HBy A 55 VAL HGx% 1.0 1.8 5.0 872 551 A 55 VAL HGx% A 58 LYS HBx 1.0 1.8 5.0 873 552 A 58 LYS HDy A 55 VAL HGx% 1.0 1.8 5.0 874 552 A 55 VAL HGx% A 58 LYS HDx 1.0 1.8 5.0 875 553 A 66 ASP HA A 55 VAL HGx% 1.0 1.8 5.0 876 554 A 66 ASP HBy A 55 VAL HGx% 1.0 1.8 5.0 877 554 A 55 VAL HGx% A 66 ASP HBx 1.0 1.8 5.0 878 555 A 58 LYS HA A 55 VAL HGy% 1.0 1.8 5.0 879 556 A 58 LYS HBy A 55 VAL HGy% 1.0 1.8 5.0 880 556 A 55 VAL HGy% A 58 LYS HBx 1.0 1.8 5.0 881 557 A 58 LYS HDy A 55 VAL HGy% 1.0 1.8 5.0 882 557 A 55 VAL HGy% A 58 LYS HDx 1.0 1.8 5.0 883 558 A 58 LYS HE3 A 55 VAL HGy% 1.0 1.8 5.0 884 558 A 55 VAL HGy% A 58 LYS HE2 1.0 1.8 5.0 885 559 A 66 ASP HA A 55 VAL HGy% 1.0 1.8 5.0 886 560 A 66 ASP HBy A 55 VAL HGy% 1.0 1.8 5.0 887 560 A 55 VAL HGy% A 66 ASP HBx 1.0 1.8 5.0 888 561 A 67 ILE H A 55 VAL HGy% 1.0 1.8 5.0 889 562 A 56 VAL H A 55 VAL HGy% 1.0 1.8 5.0 890 562 A 56 VAL H A 55 VAL HGx% 1.0 1.8 5.0 891 563 A 57 CYS HA A 55 VAL HGy% 1.0 1.8 5.0 892 563 A 57 CYS HA A 55 VAL HGx% 1.0 1.8 5.0 893 564 A 55 VAL HGy% A 57 CYS HB2 1.0 1.8 5.0 894 564 A 57 CYS HB3 A 55 VAL HGy% 1.0 1.8 5.0 895 564 A 57 CYS HB3 A 55 VAL HGx% 1.0 1.8 5.0 896 564 A 55 VAL HGx% A 57 CYS HB2 1.0 1.8 5.0 897 565 A 58 LYS HA A 55 VAL HGy% 1.0 1.8 5.0 898 565 A 58 LYS HA A 55 VAL HGx% 1.0 1.8 5.0 899 566 A 55 VAL HGy% A 58 LYS HBx 1.0 1.8 5.0 900 566 A 55 VAL HGx% A 58 LYS HBx 1.0 1.8 5.0 901 566 A 58 LYS HBy A 55 VAL HGy% 1.0 1.8 5.0 902 566 A 58 LYS HBy A 55 VAL HGx% 1.0 1.8 5.0 903 567 A 55 VAL HGx% A 58 LYS HE2 1.0 1.8 5.0 904 567 A 55 VAL HGy% A 58 LYS HE2 1.0 1.8 5.0 905 567 A 58 LYS HE3 A 55 VAL HGy% 1.0 1.8 5.0 906 567 A 58 LYS HE3 A 55 VAL HGx% 1.0 1.8 5.0 907 568 A 55 VAL HGy% A 58 LYS HG2 1.0 1.8 5.0 908 568 A 55 VAL HGx% A 58 LYS HG2 1.0 1.8 5.0 909 568 A 58 LYS HG3 A 55 VAL HGy% 1.0 1.8 5.0 910 568 A 55 VAL HGx% A 58 LYS HG3 1.0 1.8 5.0 911 569 A 67 ILE HB A 55 VAL HGy% 1.0 1.8 5.0 912 569 A 55 VAL HGx% A 67 ILE HB 1.0 1.8 5.0 913 570 A 67 ILE H A 55 VAL HGy% 1.0 1.8 5.0 914 570 A 67 ILE H A 55 VAL HGx% 1.0 1.8 5.0 915 571 A 68 ILE HA A 55 VAL HGy% 1.0 1.8 5.0 916 571 A 68 ILE HA A 55 VAL HGx% 1.0 1.8 5.0 917 572 A 55 VAL H A 56 VAL H 1.0 1.8 5.0 918 573 A 68 ILE HG2% A 55 VAL H 1.0 1.8 5.0 919 574 A 56 VAL HB A 67 ILE HB 1.0 1.8 5.0 920 575 A 67 ILE HG2% A 56 VAL HB 1.0 1.8 5.0 921 576 A 57 CYS H A 56 VAL HGx% 1.0 1.8 5.0 922 576 A 56 VAL HGy% A 57 CYS H 1.0 1.8 5.0 923 577 A 68 ILE HA A 56 VAL HGx% 1.0 1.8 5.0 924 577 A 56 VAL HGy% A 68 ILE HA 1.0 1.8 5.0 925 578 A 69 CYS HA A 56 VAL HGx% 1.0 1.8 5.0 926 578 A 56 VAL HGy% A 69 CYS HA 1.0 1.8 5.0 927 579 A 56 VAL HGx% A 69 CYS HBx 1.0 1.8 5.0 928 579 A 56 VAL HGy% A 69 CYS HBx 1.0 1.8 5.0 929 579 A 69 CYS HBy A 56 VAL HGx% 1.0 1.8 5.0 930 579 A 69 CYS HBy A 56 VAL HGy% 1.0 1.8 5.0 931 580 A 69 CYS H A 56 VAL HGx% 1.0 1.8 5.0 932 580 A 56 VAL HGy% A 69 CYS H 1.0 1.8 5.0 933 581 A 56 VAL H A 57 CYS H 1.0 1.8 3.5 934 582 A 56 VAL H A 67 ILE HB 1.0 1.8 5.0 935 583 A 67 ILE HG2% A 56 VAL H 1.0 1.8 5.0 936 584 A 56 VAL H A 67 ILE H 1.0 1.8 5.0 937 585 A 68 ILE HA A 56 VAL H 1.0 1.8 4.0 938 586 A 68 ILE HG2% A 56 VAL H 1.0 1.8 5.0 939 587 A 60 ILE HA A 57 CYS HB2 1.0 1.8 5.0 940 587 A 60 ILE HA A 57 CYS HB3 1.0 1.8 5.0 941 588 A 60 ILE HB A 57 CYS HB2 1.0 1.8 5.0 942 588 A 57 CYS HB3 A 60 ILE HB 1.0 1.8 5.0 943 589 A 60 ILE HD1% A 57 CYS HB2 1.0 1.8 5.0 944 589 A 60 ILE HD1% A 57 CYS HB3 1.0 1.8 5.0 945 590 A 60 ILE HG2% A 57 CYS HB2 1.0 1.8 5.0 946 590 A 60 ILE HG2% A 57 CYS HB3 1.0 1.8 5.0 947 591 A 67 ILE HB A 57 CYS HB2 1.0 1.8 5.0 948 591 A 57 CYS HB3 A 67 ILE HB 1.0 1.8 5.0 949 592 A 67 ILE HD1% A 57 CYS HB2 1.0 1.8 5.0 950 592 A 67 ILE HD1% A 57 CYS HB3 1.0 1.8 5.0 951 593 A 57 CYS HB3 A 67 ILE HG1y 1.0 1.8 5.0 952 593 A 57 CYS HB2 A 67 ILE HG1y 1.0 1.8 5.0 953 594 A 67 ILE HG1x A 57 CYS HB2 1.0 1.8 5.0 954 594 A 57 CYS HB3 A 67 ILE HG1x 1.0 1.8 5.0 955 595 A 67 ILE HG2% A 57 CYS HB2 1.0 1.8 5.0 956 595 A 67 ILE HG2% A 57 CYS HB3 1.0 1.8 5.0 957 596 A 67 ILE H A 57 CYS HB2 1.0 1.8 5.0 958 596 A 57 CYS HB3 A 67 ILE H 1.0 1.8 5.0 959 597 A 57 CYS H A 58 LYS H 1.0 1.8 5.0 960 598 A 67 ILE HB A 57 CYS H 1.0 1.8 5.0 961 599 A 57 CYS H A 67 ILE HG1y 1.0 1.8 5.0 962 599 A 57 CYS H A 67 ILE HG1x 1.0 1.8 5.0 963 600 A 67 ILE HG2% A 57 CYS H 1.0 1.8 5.0 964 601 A 67 ILE H A 57 CYS H 1.0 1.8 4.0 965 602 A 58 LYS HA A 59 ASN H 1.0 1.8 2.9 966 603 A 66 ASP HA A 58 LYS HA 1.0 1.8 3.5 967 604 A 58 LYS HA A 67 ILE H 1.0 1.8 4.0 968 605 A 59 ASN H A 58 LYS HG2 1.0 1.8 5.0 969 605 A 58 LYS HG3 A 59 ASN H 1.0 1.8 5.0 970 606 A 58 LYS H A 59 ASN H 1.0 1.8 5.0 971 607 A 63 THR HG2% A 59 ASN HA 1.0 1.8 5.0 972 608 A 59 ASN HA A 64 GLY H 1.0 1.8 5.0 973 609 A 59 ASN HA A 65 VAL H 1.0 1.8 5.0 974 610 A 59 ASN HD2x A 62 ASN HA 1.0 1.8 5.0 975 611 A 62 ASN HA A 59 ASN HD2y 1.0 1.8 5.0 976 612 A 59 ASN H A 60 ILE H 1.0 1.8 5.0 977 613 A 66 ASP HA A 59 ASN H 1.0 1.8 5.0 978 614 A 60 ILE HA A 62 ASN H 1.0 1.8 5.0 979 615 A 67 ILE HD1% A 60 ILE HB 1.0 1.8 5.0 980 616 A 60 ILE HD1% A 61 MET H 1.0 1.8 5.0 981 617 A 67 ILE HD1% A 60 ILE HD1% 1.0 1.8 5.0 982 618 A 60 ILE HD1% A 67 ILE HG1y 1.0 1.8 5.0 983 619 A 60 ILE HD1% A 67 ILE HG1x 1.0 1.8 5.0 984 620 A 60 ILE HG2% A 61 MET H 1.0 1.8 5.0 985 621 A 60 ILE HG2% A 63 THR HG2% 1.0 1.8 5.0 986 622 A 60 ILE HG2% A 65 VAL HB 1.0 1.8 5.0 987 623 A 65 VAL HGx% A 60 ILE HG2% 1.0 1.8 5.0 988 624 A 60 ILE HG2% A 65 VAL HGy% 1.0 1.8 5.0 989 625 A 60 ILE HG2% A 65 VAL H 1.0 1.8 5.0 990 626 A 60 ILE HG2% A 66 ASP HA 1.0 1.8 5.0 991 627 A 60 ILE HG2% A 67 ILE HB 1.0 1.8 5.0 992 628 A 67 ILE HD1% A 60 ILE HG2% 1.0 1.8 5.0 993 629 A 60 ILE HG2% A 67 ILE HG1y 1.0 1.8 5.0 994 630 A 60 ILE HG2% A 67 ILE HG1x 1.0 1.8 5.0 995 631 A 67 ILE HG2% A 60 ILE HG2% 1.0 1.8 5.0 996 632 A 60 ILE HG2% A 67 ILE H 1.0 1.8 5.0 997 633 A 60 ILE H A 62 ASN H 1.0 1.8 5.0 998 634 A 63 THR HG2% A 60 ILE H 1.0 1.8 5.0 999 635 A 60 ILE H A 65 VAL HB 1.0 1.8 5.0 1000 636 A 60 ILE H A 65 VAL HGy% 1.0 1.8 5.0 1001 636 A 65 VAL HGx% A 60 ILE H 1.0 1.8 5.0 1002 637 A 63 THR HG2% A 61 MET HBx 1.0 1.8 5.0 1003 637 A 63 THR HG2% A 61 MET HBy 1.0 1.8 5.0 1004 638 A 63 THR HG2% A 61 MET HGy 1.0 1.8 5.0 1005 638 A 63 THR HG2% A 61 MET HGx 1.0 1.8 5.0 1006 639 A 62 ASN H A 61 MET H 1.0 1.8 5.0 1007 640 A 64 GLY H A 62 ASN HA 1.0 1.8 5.0 1008 641 A 62 ASN H A 63 THR H 1.0 1.8 3.5 1009 642 A 64 GLY H A 62 ASN H 1.0 1.8 5.0 1010 643 A 63 THR HA A 65 VAL HGy% 1.0 1.8 5.0 1011 643 A 65 VAL HGx% A 63 THR HA 1.0 1.8 5.0 1012 644 A 63 THR HG2% A 64 GLY H 1.0 1.8 5.0 1013 645 A 64 GLY H A 63 THR H 1.0 1.8 3.5 1014 646 A 64 GLY H A 65 VAL H 1.0 1.8 3.5 1015 647 A 65 VAL HA A 66 ASP H 1.0 1.8 3.5 1016 648 A 66 ASP H A 65 VAL HGx% 1.0 1.8 5.0 1017 649 A 66 ASP H A 65 VAL HGy% 1.0 1.8 5.0 1018 650 A 67 ILE HA A 65 VAL HGy% 1.0 1.8 5.0 1019 650 A 67 ILE HA A 65 VAL HGx% 1.0 1.8 5.0 1020 651 A 67 ILE HD1% A 65 VAL HGy% 1.0 1.8 5.0 1021 651 A 67 ILE HD1% A 65 VAL HGx% 1.0 1.8 5.0 1022 652 A 66 ASP H A 65 VAL H 1.0 1.8 5.0 1023 653 A 66 ASP HA A 67 ILE H 1.0 1.8 2.9 1024 654 A 68 ILE HD1% A 66 ASP HBx 1.0 1.8 5.0 1025 654 A 68 ILE HD1% A 66 ASP HBy 1.0 1.8 5.0 1026 655 A 66 ASP H A 67 ILE H 1.0 1.8 5.0 1027 656 A 68 ILE H A 67 ILE HA 1.0 1.8 2.9 1028 657 A 68 ILE H A 67 ILE HB 1.0 1.8 5.0 1029 658 A 67 ILE HD1% A 68 ILE H 1.0 1.8 5.0 1030 659 A 67 ILE HG2% A 68 ILE H 1.0 1.8 5.0 1031 660 A 69 CYS H A 68 ILE HA 1.0 1.8 2.9 1032 661 A 68 ILE HB A 69 CYS H 1.0 1.8 5.0 1033 662 A 68 ILE HD1% A 69 CYS H 1.0 1.8 5.0 1034 663 A 68 ILE HG2% A 69 CYS H 1.0 1.8 5.0 1035 664 A 70 THR H A 69 CYS HA 1.0 1.8 2.9 1036 665 A 70 THR H A 69 CYS H 1.0 1.8 5.0 1037 666 A 71 LYS H A 70 THR HA 1.0 1.8 3.5 1038 667 A 70 THR HA A 72 ASN HD2x 1.0 1.8 5.0 1039 668 A 70 THR HA A 72 ASN HD2y 1.0 1.8 5.0 1040 669 A 71 LYS H A 70 THR HG2% 1.0 1.8 5.0 1041 670 A 70 THR H A 71 LYS H 1.0 1.8 3.5 1042 671 A 71 LYS HA A 72 ASN H 1.0 1.8 3.5 1043 672 A 71 LYS HBx A 73 LEU HDx% 1.0 1.8 5.0 1044 672 A 71 LYS HBy A 73 LEU HDx% 1.0 1.8 5.0 1045 673 A 73 LEU HDy% A 71 LYS HBy 1.0 1.8 5.0 1046 673 A 73 LEU HDy% A 71 LYS HBx 1.0 1.8 5.0 1047 674 A 72 ASN H A 71 LYS HD2 1.0 1.8 5.0 1048 674 A 71 LYS HD3 A 72 ASN H 1.0 1.8 5.0 1049 675 A 71 LYS HD3 A 73 LEU HDx% 1.0 1.8 5.0 1050 675 A 71 LYS HD2 A 73 LEU HDx% 1.0 1.8 5.0 1051 676 A 71 LYS HD3 A 73 LEU HDx% 1.0 1.8 5.0 1052 676 A 71 LYS HD2 A 73 LEU HDx% 1.0 1.8 5.0 1053 676 A 73 LEU HDy% A 71 LYS HD2 1.0 1.8 5.0 1054 676 A 73 LEU HDy% A 71 LYS HD3 1.0 1.8 5.0 1055 677 A 71 LYS HE3 A 73 LEU HDx% 1.0 1.8 5.0 1056 677 A 71 LYS HE2 A 73 LEU HDx% 1.0 1.8 5.0 1057 677 A 73 LEU HDy% A 71 LYS HE2 1.0 1.8 5.0 1058 677 A 71 LYS HE3 A 73 LEU HDy% 1.0 1.8 5.0 1059 678 A 72 ASN H A 71 LYS HGx 1.0 1.8 5.0 1060 678 A 71 LYS HGy A 72 ASN H 1.0 1.8 5.0 1061 679 A 71 LYS HGx A 73 LEU HDx% 1.0 1.8 5.0 1062 679 A 71 LYS HGy A 73 LEU HDx% 1.0 1.8 5.0 1063 679 A 73 LEU HDy% A 71 LYS HGx 1.0 1.8 5.0 1064 679 A 73 LEU HDy% A 71 LYS HGy 1.0 1.8 5.0 1065 680 A 71 LYS H A 72 ASN H 1.0 1.8 5.0 1066 681 A 73 LEU H A 72 ASN HA 1.0 1.8 3.5 1067 682 A 73 LEU HA A 74 PRO HD2 1.0 1.8 3.5 1068 682 A 74 PRO HD3 A 73 LEU HA 1.0 1.8 3.5 1069 683 A 74 PRO HA A 75 LYS H 1.0 1.8 3.5 1070 684 A 75 LYS H A 74 PRO HD2 1.0 1.8 5.0 1071 684 A 74 PRO HD3 A 75 LYS H 1.0 1.8 5.0 1072 685 A 75 LYS HA A 76 ASP H 1.0 1.8 3.5 1073 686 A 76 ASP H A 75 LYS HG2 1.0 1.8 5.0 1074 686 A 76 ASP H A 75 LYS HG3 1.0 1.8 5.0 1075 687 A 75 LYS H A 76 ASP H 1.0 1.8 5.0 1076 688 A 76 ASP HA A 77 SER H 1.0 1.8 3.5 1077 689 A 77 SER HA A 78 LEU H 1.0 1.8 3.5 1078 690 A 78 LEU HA A 79 GLU H 1.0 1.8 3.5 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 8 SER H A 23 VAL O 1.0 1.8 2.3 2 2 A 23 VAL O A 8 SER N 1.0 2.7 3.3 3 3 A 23 VAL H A 8 SER O 1.0 1.8 2.3 4 4 A 8 SER O A 23 VAL N 1.0 2.7 3.3 5 5 A 10 VAL H A 21 VAL O 1.0 1.8 2.3 6 6 A 21 VAL O A 10 VAL N 1.0 2.7 3.3 7 7 A 21 VAL H A 10 VAL O 1.0 1.8 2.3 8 8 A 10 VAL O A 21 VAL N 1.0 2.7 3.3 9 9 A 24 LYS H A 68 ILE O 1.0 1.8 2.3 10 10 A 68 ILE O A 24 LYS N 1.0 2.7 3.3 11 11 A 68 ILE H A 24 LYS O 1.0 1.8 2.3 12 12 A 24 LYS O A 68 ILE N 1.0 2.7 3.3 13 13 A 13 ARG H A 46 VAL O 1.0 1.8 2.3 14 14 A 46 VAL O A 13 ARG N 1.0 2.7 3.3 15 15 A 29 VAL H A 4 ASP O 1.0 1.8 2.3 16 16 A 4 ASP O A 29 VAL N 1.0 2.7 3.3 17 17 A 69 CYS H A 54 ASN O 1.0 1.8 2.3 18 18 A 54 ASN O A 69 CYS N 1.0 2.7 3.3 19 19 A 38 SER H A 34 TRP O 1.0 1.8 2.3 20 20 A 34 TRP O A 38 SER N 1.0 2.7 3.3 21 21 A 39 ASN H A 35 ILE O 1.0 1.8 2.3 22 22 A 35 ILE O A 39 ASN N 1.0 2.7 3.3 23 23 A 40 VAL H A 36 ASP O 1.0 1.8 2.3 24 24 A 36 ASP O A 40 VAL N 1.0 2.7 3.3 25 25 A 41 LEU H A 37 PHE O 1.0 1.8 2.3 26 26 A 37 PHE O A 41 LEU N 1.0 2.7 3.3 27 27 A 42 SER H A 38 SER O 1.0 1.8 2.3 28 28 A 38 SER O A 42 SER N 1.0 2.7 3.3 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 2 HIS C A 3 LYS N A 3 LYS CA A 3 LYS C 1.0 -134.77 -74.77 PHI 2 2 A 3 LYS N A 3 LYS CA A 3 LYS C A 4 ASP N 1.0 110.06 190.06 PSI 3 3 A 3 LYS C A 4 ASP N A 4 ASP CA A 4 ASP C 1.0 -140.57 -80.57 PHI 4 4 A 4 ASP N A 4 ASP CA A 4 ASP C A 5 ILE N 1.0 99.77 179.77 PSI 5 5 A 5 ILE C A 6 PHE N A 6 PHE CA A 6 PHE C 1.0 -119.25 -59.25 PHI 6 6 A 6 PHE N A 6 PHE CA A 6 PHE C A 7 THR N 1.0 89.56 169.56 PSI 7 7 A 6 PHE C A 7 THR N A 7 THR CA A 7 THR C 1.0 -158.48 -98.48 PHI 8 8 A 7 THR N A 7 THR CA A 7 THR C A 8 SER N 1.0 120.48 200.48 PSI 9 9 A 8 SER C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -170.11 -110.11 PHI 10 10 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 VAL N 1.0 116.42 196.42 PSI 11 11 A 9 VAL C A 10 VAL N A 10 VAL CA A 10 VAL C 1.0 -165.67 -105.67 PHI 12 12 A 10 VAL N A 10 VAL CA A 10 VAL C A 11 ARG N 1.0 104.29 184.29 PSI 13 13 A 11 ARG C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -144.23 -84.23 PHI 14 14 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 ARG N 1.0 93.31 173.31 PSI 15 15 A 12 VAL C A 13 ARG N A 13 ARG CA A 13 ARG C 1.0 -140.17 -80.17 PHI 16 16 A 13 ARG N A 13 ARG CA A 13 ARG C A 14 GLY N 1.0 100.92 180.92 PSI 17 17 A 19 ASN C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -163.79 -103.79 PHI 18 18 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 VAL N 1.0 114.04 194.04 PSI 19 19 A 20 VAL C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -166.79 -106.79 PHI 20 20 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 PRO N 1.0 109.47 189.47 PSI 21 21 A 23 VAL C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -160.19 -100.19 PHI 22 22 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 SER N 1.0 98.77 178.77 PSI 23 23 A 24 LYS C A 25 SER N A 25 SER CA A 25 SER C 1.0 -169.42 -109.42 PHI 24 24 A 25 SER N A 25 SER CA A 25 SER C A 26 ASN N 1.0 102.79 182.79 PSI 25 25 A 28 PRO C A 29 VAL N A 29 VAL CA A 29 VAL C 1.0 -153.45 -93.45 PHI 26 26 A 29 VAL N A 29 VAL CA A 29 VAL C A 30 GLU N 1.0 101.96 181.96 PSI 27 27 A 29 VAL C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -98.42 -38.42 PHI 28 28 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 ILE N 1.0 102.20 182.20 PSI 29 29 A 32 SER C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -116.14 -56.14 PHI 30 30 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 TRP N 1.0 -54.82 25.18 PSI 31 31 A 33 LYS C A 34 TRP N A 34 TRP CA A 34 TRP C 1.0 -87.51 -27.51 PHI 32 32 A 34 TRP N A 34 TRP CA A 34 TRP C A 35 ILE N 1.0 -81.36 -1.36 PSI 33 33 A 34 TRP C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -94.08 -34.08 PHI 34 34 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 ASP N 1.0 -83.23 -3.23 PSI 35 35 A 35 ILE C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -92.59 -32.59 PHI 36 36 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 PHE N 1.0 -80.26 -0.26 PSI 37 37 A 36 ASP C A 37 PHE N A 37 PHE CA A 37 PHE C 1.0 -96.89 -36.89 PHI 38 38 A 37 PHE N A 37 PHE CA A 37 PHE C A 38 SER N 1.0 -82.26 -2.26 PSI 39 39 A 37 PHE C A 38 SER N A 38 SER CA A 38 SER C 1.0 -93.32 -33.32 PHI 40 40 A 38 SER N A 38 SER CA A 38 SER C A 39 ASN N 1.0 -78.53 1.47 PSI 41 41 A 38 SER C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -95.07 -35.07 PHI 42 42 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 VAL N 1.0 -80.67 -0.67 PSI 43 43 A 39 ASN C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -93.85 -33.85 PHI 44 44 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 LEU N 1.0 -85.01 -5.01 PSI 45 45 A 40 VAL C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -90.88 -30.88 PHI 46 46 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 SER N 1.0 -81.02 -1.02 PSI 47 47 A 41 LEU C A 42 SER N A 42 SER CA A 42 SER C 1.0 -98.04 -38.04 PHI 48 48 A 42 SER N A 42 SER CA A 42 SER C A 43 ARG N 1.0 -73.44 6.56 PSI 49 49 A 56 VAL C A 57 CYS N A 57 CYS CA A 57 CYS C 1.0 -130.67 -70.67 PHI 50 50 A 57 CYS N A 57 CYS CA A 57 CYS C A 58 LYS N 1.0 85.58 165.58 PSI 51 51 A 57 CYS C A 58 LYS N A 58 LYS CA A 58 LYS C 1.0 -135.89 -75.89 PHI 52 52 A 58 LYS N A 58 LYS CA A 58 LYS C A 59 ASN N 1.0 81.78 161.78 PSI 53 53 A 64 GLY C A 65 VAL N A 65 VAL CA A 65 VAL C 1.0 -126.80 -66.80 PHI 54 54 A 65 VAL N A 65 VAL CA A 65 VAL C A 66 ASP N 1.0 99.11 179.11 PSI 55 55 A 65 VAL C A 66 ASP N A 66 ASP CA A 66 ASP C 1.0 -155.65 -95.65 PHI 56 56 A 66 ASP N A 66 ASP CA A 66 ASP C A 67 ILE N 1.0 98.86 178.86 PSI 57 57 A 70 THR C A 71 LYS N A 71 LYS CA A 71 LYS C 1.0 -156.63 -96.63 PHI 58 58 A 71 LYS N A 71 LYS CA A 71 LYS C A 72 ASN N 1.0 113.16 193.16 PSI 59 59 A 71 LYS C A 72 ASN N A 72 ASN CA A 72 ASN C 1.0 -126.71 -66.71 PHI 60 60 A 72 ASN N A 72 ASN CA A 72 ASN C A 73 LEU N 1.0 85.25 165.25 PSI 61 61 A 72 ASN C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -119.82 -59.82 PHI 62 62 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 PRO N 1.0 87.77 167.77 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 11H 9803.922 2 1515N 2099.958 3 11H 9803.922 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 11H 9803.922 2 1313C 4224.757 3 11H 9803.922 stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 11H 9803.922 2 1313C 4224.757 3 11H 9803.922 stop_ save_