data_nef_c15456_2juw save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ALA middle . . 3 A 3 ILE middle . . 4 A 4 GLN middle . . 5 A 5 SER middle . . 6 A 6 LYS middle . . 7 A 7 TYR middle . . 8 A 8 SER middle . . 9 A 9 ASN middle . . 10 A 10 THR middle . . 11 A 11 GLN middle . . 12 A 12 VAL middle . . 13 A 13 GLU middle . . 14 A 14 SER middle . . 15 A 15 LEU middle . . 16 A 16 ILE middle . . 17 A 17 ALA middle . . 18 A 18 GLU middle . . 19 A 19 ILE middle . . 20 A 20 LEU middle . . 21 A 21 VAL middle . . 22 A 22 VAL middle . . 23 A 23 LEU middle . . 24 A 24 GLU middle . . 25 A 25 LYS middle . . 26 A 26 HIS middle . . 27 A 27 LYS middle . . 28 A 28 ALA middle . . 29 A 29 PRO middle . false 30 A 30 THR middle . . 31 A 31 ASP middle . . 32 A 32 LEU middle . . 33 A 33 SER middle . . 34 A 34 LEU middle . . 35 A 35 MET middle . . 36 A 36 ALA middle . . 37 A 37 LEU middle . . 38 A 38 GLY middle . false 39 A 39 ASN middle . . 40 A 40 CYS middle . . 41 A 41 VAL middle . . 42 A 42 THR middle . . 43 A 43 HIS middle . . 44 A 44 LEU middle . . 45 A 45 LEU middle . . 46 A 46 GLU middle . . 47 A 47 ARG middle . . 48 A 48 LYS middle . . 49 A 49 VAL middle . . 50 A 50 PRO middle . false 51 A 51 SER middle . . 52 A 52 GLU middle . . 53 A 53 SER middle . . 54 A 54 ARG middle . . 55 A 55 GLN middle . . 56 A 56 ALA middle . . 57 A 57 VAL middle . . 58 A 58 ALA middle . . 59 A 59 GLU middle . . 60 A 60 GLN middle . . 61 A 61 PHE middle . . 62 A 62 ALA middle . . 63 A 63 LYS middle . . 64 A 64 ALA middle . . 65 A 65 LEU middle . . 66 A 66 ALA middle . . 67 A 67 GLN middle . . 68 A 68 SER middle . . 69 A 69 VAL middle . . 70 A 70 LYS middle . . 71 A 71 SER middle . . 72 A 72 ASN middle . . 73 A 73 LEU middle . . 74 A 74 GLU middle . . 75 A 75 HIS middle . . 76 A 76 HIS middle . . 77 A 77 HIS middle . . 78 A 78 HIS middle . . 79 A 79 HIS middle . . 80 A 80 HIS end . . 81 B 1 MET start . . 82 B 2 ALA middle . . 83 B 3 ILE middle . . 84 B 4 GLN middle . . 85 B 5 SER middle . . 86 B 6 LYS middle . . 87 B 7 TYR middle . . 88 B 8 SER middle . . 89 B 9 ASN middle . . 90 B 10 THR middle . . 91 B 11 GLN middle . . 92 B 12 VAL middle . . 93 B 13 GLU middle . . 94 B 14 SER middle . . 95 B 15 LEU middle . . 96 B 16 ILE middle . . 97 B 17 ALA middle . . 98 B 18 GLU middle . . 99 B 19 ILE middle . . 100 B 20 LEU middle . . 101 B 21 VAL middle . . 102 B 22 VAL middle . . 103 B 23 LEU middle . . 104 B 24 GLU middle . . 105 B 25 LYS middle . . 106 B 26 HIS middle . . 107 B 27 LYS middle . . 108 B 28 ALA middle . . 109 B 29 PRO middle . false 110 B 30 THR middle . . 111 B 31 ASP middle . . 112 B 32 LEU middle . . 113 B 33 SER middle . . 114 B 34 LEU middle . . 115 B 35 MET middle . . 116 B 36 ALA middle . . 117 B 37 LEU middle . . 118 B 38 GLY middle . false 119 B 39 ASN middle . . 120 B 40 CYS middle . . 121 B 41 VAL middle . . 122 B 42 THR middle . . 123 B 43 HIS middle . . 124 B 44 LEU middle . . 125 B 45 LEU middle . . 126 B 46 GLU middle . . 127 B 47 ARG middle . . 128 B 48 LYS middle . . 129 B 49 VAL middle . . 130 B 50 PRO middle . false 131 B 51 SER middle . . 132 B 52 GLU middle . . 133 B 53 SER middle . . 134 B 54 ARG middle . . 135 B 55 GLN middle . . 136 B 56 ALA middle . . 137 B 57 VAL middle . . 138 B 58 ALA middle . . 139 B 59 GLU middle . . 140 B 60 GLN middle . . 141 B 61 PHE middle . . 142 B 62 ALA middle . . 143 B 63 LYS middle . . 144 B 64 ALA middle . . 145 B 65 LEU middle . . 146 B 66 ALA middle . . 147 B 67 GLN middle . . 148 B 68 SER middle . . 149 B 69 VAL middle . . 150 B 70 LYS middle . . 151 B 71 SER middle . . 152 B 72 ASN middle . . 153 B 73 LEU middle . . 154 B 74 GLU middle . . 155 B 75 HIS middle . . 156 B 76 HIS middle . . 157 B 77 HIS middle . . 158 B 78 HIS middle . . 159 B 79 HIS middle . . 160 B 80 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 ALA HA H 1 4.14 0.02 A 2 ALA HB% H 1 1.51 0.02 A 2 ALA C C 13 173.8 0.2 A 2 ALA CA C 13 51.8 0.2 A 2 ALA CB C 13 19.6 0.2 A 3 ILE H H 1 8.54 0.02 A 3 ILE HA H 1 4.19 0.02 A 3 ILE HB H 1 1.85 0.02 A 3 ILE HD1% H 1 0.87 0.02 A 3 ILE HG1x H 1 1.21 0.02 A 3 ILE HG1y H 1 1.49 0.02 A 3 ILE HG2% H 1 0.92 0.02 A 3 ILE C C 13 176.0 0.2 A 3 ILE CA C 13 61.3 0.2 A 3 ILE CB C 13 38.8 0.2 A 3 ILE CD1 C 13 13.0 0.2 A 3 ILE CG1 C 13 27.4 0.2 A 3 ILE CG2 C 13 17.5 0.2 A 3 ILE N N 15 120.5 0.2 A 4 GLN H H 1 8.57 0.02 A 4 GLN HA H 1 4.40 0.02 A 4 GLN HBx H 1 2.01 0.02 A 4 GLN HBy H 1 2.09 0.02 A 4 GLN HE21 H 1 7.53 0.02 A 4 GLN HE22 H 1 6.90 0.02 A 4 GLN HGx H 1 2.39 0.02 A 4 GLN HGy H 1 2.39 0.02 A 4 GLN C C 13 175.7 0.2 A 4 GLN CA C 13 55.8 0.2 A 4 GLN CB C 13 29.6 0.2 A 4 GLN CD C 13 180.5 0.2 A 4 GLN CG C 13 33.7 0.2 A 4 GLN N N 15 125.1 0.2 A 4 GLN NE2 N 15 112.5 0.2 A 5 SER H H 1 8.44 0.02 A 5 SER HA H 1 4.42 0.02 A 5 SER HBx H 1 3.81 0.02 A 5 SER HBy H 1 3.88 0.02 A 5 SER C C 13 174.3 0.2 A 5 SER CA C 13 58.2 0.2 A 5 SER CB C 13 64.0 0.2 A 5 SER N N 15 118.1 0.2 A 6 LYS H H 1 8.32 0.02 A 6 LYS HA H 1 4.11 0.02 A 6 LYS HBx H 1 1.53 0.02 A 6 LYS HBy H 1 1.53 0.02 A 6 LYS HDx H 1 1.58 0.02 A 6 LYS HDy H 1 1.58 0.02 A 6 LYS HEx H 1 2.92 0.02 A 6 LYS HEy H 1 2.92 0.02 A 6 LYS HGx H 1 1.03 0.02 A 6 LYS HGy H 1 1.15 0.02 A 6 LYS C C 13 176.0 0.2 A 6 LYS CA C 13 57.2 0.2 A 6 LYS CB C 13 33.1 0.2 A 6 LYS CD C 13 29.2 0.2 A 6 LYS CE C 13 42.1 0.2 A 6 LYS CG C 13 24.6 0.2 A 6 LYS N N 15 123.6 0.2 A 7 TYR H H 1 8.00 0.02 A 7 TYR HA H 1 4.80 0.02 A 7 TYR HBx H 1 2.64 0.02 A 7 TYR HBy H 1 3.02 0.02 A 7 TYR HDx H 1 7.08 0.02 A 7 TYR HDy H 1 7.08 0.02 A 7 TYR HEx H 1 6.77 0.02 A 7 TYR HEy H 1 6.77 0.02 A 7 TYR C C 13 175.8 0.2 A 7 TYR CA C 13 57.0 0.2 A 7 TYR CB C 13 39.9 0.2 A 7 TYR CDx C 13 133.6 0.02 A 7 TYR CDy C 13 133.6 0.02 A 7 TYR CEx C 13 118.3 0.02 A 7 TYR CEy C 13 118.3 0.02 A 7 TYR N N 15 118.9 0.2 A 8 SER H H 1 8.77 0.02 A 8 SER HA H 1 4.51 0.02 A 8 SER HBx H 1 3.99 0.02 A 8 SER HBy H 1 4.22 0.02 A 8 SER C C 13 175.0 0.2 A 8 SER CA C 13 57.5 0.2 A 8 SER CB C 13 64.7 0.2 A 8 SER N N 15 118.6 0.2 A 9 ASN H H 1 8.91 0.02 A 9 ASN HA H 1 4.54 0.02 A 9 ASN HBx H 1 2.88 0.02 A 9 ASN HBy H 1 2.88 0.02 A 9 ASN HD21 H 1 7.73 0.02 A 9 ASN HD22 H 1 6.96 0.02 A 9 ASN C C 13 177.2 0.2 A 9 ASN CA C 13 55.9 0.2 A 9 ASN CB C 13 38.2 0.2 A 9 ASN CG C 13 176.5 0.2 A 9 ASN N N 15 121.4 0.2 A 9 ASN ND2 N 15 113.3 0.2 A 10 THR H H 1 8.18 0.02 A 10 THR HA H 1 4.07 0.02 A 10 THR HB H 1 4.16 0.02 A 10 THR HG2% H 1 1.27 0.02 A 10 THR C C 13 176.6 0.2 A 10 THR CA C 13 65.3 0.2 A 10 THR CB C 13 68.8 0.2 A 10 THR CG2 C 13 21.8 0.2 A 10 THR N N 15 113.5 0.2 A 11 GLN H H 1 7.95 0.02 A 11 GLN HA H 1 4.16 0.02 A 11 GLN HBx H 1 2.11 0.02 A 11 GLN HBy H 1 2.34 0.02 A 11 GLN HE21 H 1 7.66 0.02 A 11 GLN HE22 H 1 7.07 0.02 A 11 GLN HGx H 1 2.38 0.02 A 11 GLN HGy H 1 2.48 0.02 A 11 GLN C C 13 178.4 0.2 A 11 GLN CA C 13 59.0 0.2 A 11 GLN CB C 13 29.2 0.2 A 11 GLN CD C 13 179.8 0.2 A 11 GLN CG C 13 34.7 0.2 A 11 GLN N N 15 122.5 0.2 A 11 GLN NE2 N 15 111.7 0.2 A 12 VAL H H 1 7.85 0.02 A 12 VAL HA H 1 3.54 0.02 A 12 VAL HB H 1 2.16 0.02 A 12 VAL HG1% H 1 0.90 0.02 A 12 VAL HG2% H 1 1.01 0.02 A 12 VAL C C 13 177.4 0.2 A 12 VAL CA C 13 66.4 0.2 A 12 VAL CB C 13 32.3 0.2 A 12 VAL CG1 C 13 21.2 0.02 A 12 VAL CG2 C 13 22.8 0.02 A 12 VAL N N 15 119.0 0.2 A 13 GLU H H 1 8.55 0.02 A 13 GLU HA H 1 3.91 0.02 A 13 GLU HBx H 1 2.06 0.02 A 13 GLU HBy H 1 2.06 0.02 A 13 GLU HGx H 1 2.34 0.02 A 13 GLU HGy H 1 2.41 0.02 A 13 GLU C C 13 179.5 0.2 A 13 GLU CA C 13 59.7 0.2 A 13 GLU CB C 13 29.1 0.2 A 13 GLU CG C 13 36.2 0.2 A 13 GLU N N 15 118.3 0.2 A 14 SER H H 1 8.08 0.02 A 14 SER HA H 1 4.26 0.02 A 14 SER HBx H 1 3.98 0.02 A 14 SER HBy H 1 3.98 0.02 A 14 SER C C 13 176.2 0.2 A 14 SER CA C 13 61.7 0.2 A 14 SER CB C 13 62.8 0.2 A 14 SER N N 15 114.6 0.2 A 15 LEU H H 1 7.11 0.02 A 15 LEU HA H 1 3.69 0.02 A 15 LEU HBx H 1 1.44 0.02 A 15 LEU HBy H 1 1.55 0.02 A 15 LEU HD1% H 1 0.56 0.02 A 15 LEU HD2% H 1 0.51 0.02 A 15 LEU HG H 1 1.39 0.02 A 15 LEU C C 13 177.8 0.2 A 15 LEU CA C 13 57.7 0.2 A 15 LEU CB C 13 42.3 0.2 A 15 LEU CD1 C 13 24.3 0.02 A 15 LEU CD2 C 13 24.8 0.02 A 15 LEU CG C 13 26.7 0.2 A 15 LEU N N 15 122.2 0.2 A 16 ILE H H 1 8.03 0.02 A 16 ILE HA H 1 3.22 0.02 A 16 ILE HB H 1 1.75 0.02 A 16 ILE HD1% H 1 0.81 0.02 A 16 ILE HG1x H 1 1.10 0.02 A 16 ILE HG1y H 1 1.78 0.02 A 16 ILE HG2% H 1 0.81 0.02 A 16 ILE C C 13 177.2 0.2 A 16 ILE CA C 13 66.0 0.2 A 16 ILE CB C 13 39.1 0.2 A 16 ILE CD1 C 13 16.6 0.2 A 16 ILE CG1 C 13 29.2 0.2 A 16 ILE CG2 C 13 16.6 0.2 A 16 ILE N N 15 117.9 0.2 A 17 ALA H H 1 7.96 0.02 A 17 ALA HA H 1 3.93 0.02 A 17 ALA HB% H 1 1.48 0.02 A 17 ALA C C 13 180.6 0.2 A 17 ALA CA C 13 55.4 0.2 A 17 ALA CB C 13 18.0 0.2 A 17 ALA N N 15 118.3 0.2 A 18 GLU H H 1 7.63 0.02 A 18 GLU HA H 1 4.03 0.02 A 18 GLU HBx H 1 2.09 0.02 A 18 GLU HBy H 1 2.14 0.02 A 18 GLU HGx H 1 2.34 0.02 A 18 GLU HGy H 1 2.60 0.02 A 18 GLU C C 13 179.4 0.2 A 18 GLU CA C 13 59.8 0.2 A 18 GLU CB C 13 30.3 0.2 A 18 GLU CG C 13 37.3 0.2 A 18 GLU N N 15 116.3 0.2 A 19 ILE H H 1 8.11 0.02 A 19 ILE HA H 1 3.59 0.02 A 19 ILE HB H 1 2.03 0.02 A 19 ILE HD1% H 1 0.66 0.02 A 19 ILE HG1x H 1 0.78 0.02 A 19 ILE HG1y H 1 2.03 0.02 A 19 ILE HG2% H 1 0.89 0.02 A 19 ILE C C 13 177.8 0.2 A 19 ILE CA C 13 66.5 0.2 A 19 ILE CB C 13 37.5 0.2 A 19 ILE CD1 C 13 13.6 0.2 A 19 ILE CG1 C 13 29.5 0.2 A 19 ILE CG2 C 13 18.7 0.2 A 19 ILE N N 15 121.1 0.2 A 20 LEU H H 1 8.48 0.02 A 20 LEU HA H 1 4.02 0.02 A 20 LEU HBx H 1 1.44 0.02 A 20 LEU HBy H 1 1.93 0.02 A 20 LEU HD1% H 1 0.51 0.02 A 20 LEU HD2% H 1 0.77 0.02 A 20 LEU HG H 1 2.03 0.02 A 20 LEU C C 13 180.5 0.2 A 20 LEU CA C 13 58.6 0.2 A 20 LEU CB C 13 40.4 0.2 A 20 LEU CD1 C 13 25.8 0.02 A 20 LEU CD2 C 13 22.3 0.02 A 20 LEU CG C 13 26.3 0.2 A 20 LEU N N 15 118.3 0.2 A 21 VAL H H 1 7.81 0.02 A 21 VAL HA H 1 3.77 0.02 A 21 VAL HB H 1 2.27 0.02 A 21 VAL HGx% H 1 1.00 0.02 A 21 VAL HGy% H 1 1.13 0.02 A 21 VAL C C 13 178.2 0.2 A 21 VAL CA C 13 66.8 0.2 A 21 VAL CB C 13 31.6 0.2 A 21 VAL CG1 C 13 21.6 0.02 A 21 VAL CG2 C 13 23.6 0.02 A 21 VAL N N 15 119.7 0.2 A 22 VAL H H 1 7.53 0.02 A 22 VAL HA H 1 3.61 0.02 A 22 VAL HB H 1 2.49 0.02 A 22 VAL HG1% H 1 0.93 0.02 A 22 VAL HG2% H 1 1.15 0.02 A 22 VAL C C 13 178.5 0.2 A 22 VAL CA C 13 67.3 0.2 A 22 VAL CB C 13 31.5 0.2 A 22 VAL CG1 C 13 22.5 0.02 A 22 VAL CG2 C 13 22.9 0.02 A 22 VAL N N 15 121.4 0.2 A 23 LEU H H 1 7.61 0.02 A 23 LEU HA H 1 3.88 0.02 A 23 LEU HBx H 1 1.59 0.02 A 23 LEU HBy H 1 2.09 0.02 A 23 LEU HD1% H 1 0.94 0.02 A 23 LEU HD2% H 1 0.85 0.02 A 23 LEU HG H 1 1.98 0.02 A 23 LEU C C 13 179.7 0.2 A 23 LEU CA C 13 58.4 0.2 A 23 LEU CB C 13 40.9 0.2 A 23 LEU CD1 C 13 26.1 0.02 A 23 LEU CD2 C 13 22.5 0.02 A 23 LEU CG C 13 26.6 0.2 A 23 LEU N N 15 116.8 0.2 A 24 GLU H H 1 8.16 0.02 A 24 GLU HA H 1 4.17 0.02 A 24 GLU HBx H 1 2.13 0.02 A 24 GLU HBy H 1 2.16 0.02 A 24 GLU HGx H 1 2.31 0.02 A 24 GLU HGy H 1 2.39 0.02 A 24 GLU C C 13 180.9 0.2 A 24 GLU CA C 13 59.0 0.2 A 24 GLU CB C 13 29.7 0.2 A 24 GLU CG C 13 36.0 0.2 A 24 GLU N N 15 119.2 0.2 A 25 LYS H H 1 8.98 0.02 A 25 LYS HA H 1 4.05 0.02 A 25 LYS HBx H 1 1.85 0.02 A 25 LYS HBy H 1 2.01 0.02 A 25 LYS HDx H 1 1.63 0.02 A 25 LYS HDy H 1 1.63 0.02 A 25 LYS HEx H 1 2.88 0.02 A 25 LYS HEy H 1 2.88 0.02 A 25 LYS HGx H 1 1.33 0.02 A 25 LYS HGy H 1 1.45 0.02 A 25 LYS C C 13 178.6 0.2 A 25 LYS CA C 13 59.3 0.2 A 25 LYS CB C 13 32.1 0.2 A 25 LYS CD C 13 29.5 0.2 A 25 LYS CE C 13 42.0 0.2 A 25 LYS CG C 13 25.0 0.2 A 25 LYS N N 15 122.9 0.2 A 26 HIS H H 1 7.40 0.02 A 26 HIS HA H 1 4.46 0.02 A 26 HIS HBx H 1 2.92 0.02 A 26 HIS HBy H 1 3.43 0.02 A 26 HIS HD2 H 1 7.62 0.02 A 26 HIS HE1 H 1 8.28 0.02 A 26 HIS C C 13 173.6 0.2 A 26 HIS CA C 13 56.5 0.2 A 26 HIS CB C 13 29.2 0.2 A 26 HIS CD2 C 13 121.3 0.2 A 26 HIS CE1 C 13 137.5 0.2 A 26 HIS N N 15 113.8 0.2 A 27 LYS H H 1 8.20 0.02 A 27 LYS HA H 1 3.95 0.02 A 27 LYS HBx H 1 1.94 0.02 A 27 LYS HBy H 1 1.94 0.02 A 27 LYS HDx H 1 1.67 0.02 A 27 LYS HDy H 1 1.78 0.02 A 27 LYS HEx H 1 3.03 0.02 A 27 LYS HEy H 1 3.03 0.02 A 27 LYS HGx H 1 1.41 0.02 A 27 LYS HGy H 1 1.41 0.02 A 27 LYS C C 13 176.5 0.2 A 27 LYS CA C 13 56.6 0.2 A 27 LYS CB C 13 29.6 0.2 A 27 LYS CD C 13 29.3 0.2 A 27 LYS CE C 13 42.4 0.2 A 27 LYS CG C 13 24.9 0.2 A 27 LYS N N 15 119.5 0.2 A 28 ALA H H 1 7.76 0.02 A 28 ALA HA H 1 4.49 0.02 A 28 ALA HB% H 1 1.20 0.02 A 28 ALA CA C 13 51.0 0.2 A 28 ALA CB C 13 19.2 0.2 A 28 ALA N N 15 121.5 0.2 A 29 PRO HA H 1 4.72 0.02 A 29 PRO HBx H 1 2.20 0.02 A 29 PRO HBy H 1 2.62 0.02 A 29 PRO HDx H 1 3.49 0.02 A 29 PRO HDy H 1 4.31 0.02 A 29 PRO HGx H 1 2.18 0.02 A 29 PRO HGy H 1 2.29 0.02 A 29 PRO C C 13 177.4 0.2 A 29 PRO CA C 13 62.1 0.2 A 29 PRO CB C 13 33.0 0.2 A 29 PRO CD C 13 51.4 0.2 A 29 PRO CG C 13 28.0 0.2 A 30 THR H H 1 8.83 0.02 A 30 THR HA H 1 3.68 0.02 A 30 THR HB H 1 4.11 0.02 A 30 THR HG2% H 1 1.03 0.02 A 30 THR C C 13 175.2 0.2 A 30 THR CA C 13 67.4 0.2 A 30 THR CB C 13 68.5 0.2 A 30 THR CG2 C 13 22.3 0.2 A 30 THR N N 15 120.4 0.2 A 31 ASP H H 1 8.88 0.02 A 31 ASP HA H 1 4.22 0.02 A 31 ASP HBx H 1 2.79 0.02 A 31 ASP HBy H 1 2.88 0.02 A 31 ASP C C 13 179.0 0.2 A 31 ASP CA C 13 57.4 0.2 A 31 ASP CB C 13 38.7 0.2 A 31 ASP N N 15 118.6 0.2 A 32 LEU H H 1 7.54 0.02 A 32 LEU HA H 1 3.97 0.02 A 32 LEU HBy H 1 1.47 0.02 A 32 LEU HBx H 1 0.89 0.02 A 32 LEU HD1% H 1 0.61 0.02 A 32 LEU HD2% H 1 0.67 0.02 A 32 LEU HG H 1 1.31 0.02 A 32 LEU C C 13 178.1 0.2 A 32 LEU CA C 13 57.5 0.2 A 32 LEU CB C 13 40.6 0.2 A 32 LEU CD1 C 13 23.8 0.02 A 32 LEU CD2 C 13 25.2 0.02 A 32 LEU CG C 13 27.0 0.2 A 32 LEU N N 15 124.3 0.2 A 33 SER H H 1 8.42 0.02 A 33 SER HA H 1 3.86 0.02 A 33 SER HBx H 1 3.56 0.02 A 33 SER HBy H 1 4.15 0.02 A 33 SER C C 13 175.9 0.2 A 33 SER CA C 13 63.1 0.2 A 33 SER CB C 13 62.9 0.2 A 33 SER N N 15 116.0 0.2 A 34 LEU H H 1 8.40 0.02 A 34 LEU HA H 1 4.01 0.02 A 34 LEU HBx H 1 1.60 0.02 A 34 LEU HBy H 1 2.00 0.02 A 34 LEU HD1% H 1 0.72 0.02 A 34 LEU HD2% H 1 0.64 0.02 A 34 LEU HG H 1 1.77 0.02 A 34 LEU C C 13 179.5 0.2 A 34 LEU CA C 13 58.7 0.2 A 34 LEU CB C 13 41.5 0.2 A 34 LEU CD1 C 13 25.7 0.02 A 34 LEU CD2 C 13 24.0 0.02 A 34 LEU CG C 13 27.2 0.2 A 34 LEU N N 15 120.4 0.2 A 35 MET H H 1 7.97 0.02 A 35 MET HA H 1 4.21 0.02 A 35 MET HBx H 1 2.16 0.02 A 35 MET HBy H 1 2.31 0.02 A 35 MET HE% H 1 2.14 0.02 A 35 MET HGx H 1 2.49 0.02 A 35 MET HGy H 1 2.70 0.02 A 35 MET C C 13 178.9 0.2 A 35 MET CA C 13 59.1 0.2 A 35 MET CB C 13 33.1 0.2 A 35 MET CE C 13 17.1 0.2 A 35 MET CG C 13 31.6 0.2 A 35 MET N N 15 120.3 0.2 A 36 ALA H H 1 8.71 0.02 A 36 ALA HA H 1 3.90 0.02 A 36 ALA HB% H 1 1.34 0.02 A 36 ALA C C 13 179.7 0.2 A 36 ALA CA C 13 55.4 0.2 A 36 ALA CB C 13 18.6 0.2 A 36 ALA N N 15 121.7 0.2 A 37 LEU H H 1 8.75 0.02 A 37 LEU HA H 1 3.98 0.02 A 37 LEU HBx H 1 1.30 0.02 A 37 LEU HBy H 1 2.08 0.02 A 37 LEU HD1% H 1 0.76 0.02 A 37 LEU HD2% H 1 0.94 0.02 A 37 LEU HG H 1 1.93 0.02 A 37 LEU C C 13 179.6 0.2 A 37 LEU CA C 13 59.0 0.2 A 37 LEU CB C 13 42.0 0.2 A 37 LEU CD1 C 13 26.8 0.02 A 37 LEU CD2 C 13 24.0 0.02 A 37 LEU CG C 13 27.6 0.2 A 37 LEU N N 15 118.1 0.2 A 38 GLY H H 1 8.78 0.02 A 38 GLY HAx H 1 3.65 0.02 A 38 GLY HAy H 1 3.94 0.02 A 38 GLY C C 13 175.6 0.2 A 38 GLY CA C 13 48.3 0.2 A 38 GLY N N 15 105.6 0.2 A 39 ASN H H 1 8.18 0.02 A 39 ASN HA H 1 4.55 0.02 A 39 ASN HBx H 1 2.60 0.02 A 39 ASN HBy H 1 2.85 0.02 A 39 ASN HD21 H 1 7.12 0.02 A 39 ASN HD22 H 1 7.05 0.02 A 39 ASN C C 13 178.4 0.2 A 39 ASN CA C 13 56.0 0.2 A 39 ASN CB C 13 39.2 0.2 A 39 ASN CG C 13 175.9 0.2 A 39 ASN N N 15 120.0 0.2 A 39 ASN ND2 N 15 110.5 0.2 A 40 CYS H H 1 8.42 0.02 A 40 CYS HA H 1 4.01 0.02 A 40 CYS HBx H 1 2.59 0.02 A 40 CYS HBy H 1 3.41 0.02 A 40 CYS C C 13 176.0 0.2 A 40 CYS CA C 13 65.3 0.2 A 40 CYS CB C 13 27.2 0.2 A 40 CYS N N 15 120.2 0.2 A 41 VAL H H 1 7.83 0.02 A 41 VAL HA H 1 3.25 0.02 A 41 VAL HB H 1 2.28 0.02 A 41 VAL HG1% H 1 0.26 0.02 A 41 VAL HG2% H 1 0.92 0.02 A 41 VAL C C 13 177.5 0.2 A 41 VAL CA C 13 67.5 0.2 A 41 VAL CB C 13 30.8 0.2 A 41 VAL CG1 C 13 21.0 0.02 A 41 VAL CG2 C 13 23.7 0.02 A 41 VAL N N 15 119.4 0.2 A 42 THR H H 1 8.27 0.02 A 42 THR HA H 1 3.52 0.02 A 42 THR HB H 1 4.18 0.02 A 42 THR HG2% H 1 1.12 0.02 A 42 THR C C 13 176.2 0.2 A 42 THR CA C 13 67.8 0.2 A 42 THR CB C 13 67.8 0.2 A 42 THR CG2 C 13 22.1 0.2 A 42 THR N N 15 113.6 0.2 A 43 HIS H H 1 8.25 0.02 A 43 HIS HA H 1 4.31 0.02 A 43 HIS HBx H 1 3.29 0.02 A 43 HIS HBy H 1 3.29 0.02 A 43 HIS HD2 H 1 6.88 0.02 A 43 HIS HE1 H 1 8.41 0.02 A 43 HIS C C 13 177.2 0.2 A 43 HIS CA C 13 59.3 0.2 A 43 HIS CB C 13 28.9 0.2 A 43 HIS CD2 C 13 120.1 0.2 A 43 HIS CE1 C 13 136.4 0.2 A 43 HIS N N 15 120.0 0.2 A 43 HIS ND1 N 15 184.3 0.2 A 43 HIS NE2 N 15 195.8 0.2 A 44 LEU H H 1 8.07 0.02 A 44 LEU HA H 1 3.96 0.02 A 44 LEU HBx H 1 1.38 0.02 A 44 LEU HBy H 1 1.86 0.02 A 44 LEU HD1% H 1 0.81 0.02 A 44 LEU HD2% H 1 0.87 0.02 A 44 LEU HG H 1 1.78 0.02 A 44 LEU C C 13 179.3 0.2 A 44 LEU CA C 13 58.4 0.2 A 44 LEU CB C 13 42.2 0.2 A 44 LEU CD1 C 13 26.1 0.02 A 44 LEU CD2 C 13 24.0 0.02 A 44 LEU CG C 13 27.3 0.2 A 44 LEU N N 15 119.4 0.2 A 45 LEU H H 1 8.41 0.02 A 45 LEU HA H 1 3.85 0.02 A 45 LEU HBx H 1 1.10 0.02 A 45 LEU HBy H 1 1.96 0.02 A 45 LEU HD1% H 1 0.67 0.02 A 45 LEU HD2% H 1 0.73 0.02 A 45 LEU HG H 1 1.82 0.02 A 45 LEU C C 13 178.7 0.2 A 45 LEU CA C 13 58.2 0.2 A 45 LEU CB C 13 41.8 0.2 A 45 LEU CD1 C 13 26.2 0.02 A 45 LEU CD2 C 13 24.2 0.02 A 45 LEU CG C 13 27.0 0.2 A 45 LEU N N 15 118.1 0.2 A 46 GLU H H 1 8.12 0.02 A 46 GLU HA H 1 3.74 0.02 A 46 GLU HBx H 1 1.96 0.02 A 46 GLU HBy H 1 2.10 0.02 A 46 GLU HGx H 1 2.19 0.02 A 46 GLU HGy H 1 2.42 0.02 A 46 GLU C C 13 178.0 0.2 A 46 GLU CA C 13 58.9 0.2 A 46 GLU CB C 13 29.7 0.2 A 46 GLU CG C 13 36.5 0.2 A 46 GLU N N 15 115.0 0.2 A 47 ARG H H 1 7.74 0.02 A 47 ARG HA H 1 4.27 0.02 A 47 ARG HBx H 1 1.69 0.02 A 47 ARG HBy H 1 1.84 0.02 A 47 ARG HDx H 1 2.96 0.02 A 47 ARG HDy H 1 3.05 0.02 A 47 ARG HE H 1 7.27 0.02 A 47 ARG HGx H 1 1.53 0.02 A 47 ARG HGy H 1 1.53 0.02 A 47 ARG C C 13 178.5 0.2 A 47 ARG CA C 13 57.0 0.2 A 47 ARG CB C 13 31.6 0.2 A 47 ARG CD C 13 42.8 0.2 A 47 ARG CG C 13 27.1 0.2 A 47 ARG N N 15 114.0 0.2 A 47 ARG NE N 15 84.6 0.2 A 48 LYS H H 1 8.21 0.02 A 48 LYS HA H 1 4.62 0.02 A 48 LYS HBx H 1 1.88 0.02 A 48 LYS HBy H 1 2.05 0.02 A 48 LYS HDx H 1 1.62 0.02 A 48 LYS HDy H 1 1.67 0.02 A 48 LYS HEx H 1 2.91 0.02 A 48 LYS HEy H 1 3.00 0.02 A 48 LYS HGx H 1 1.35 0.02 A 48 LYS HGy H 1 1.53 0.02 A 48 LYS C C 13 176.4 0.2 A 48 LYS CA C 13 55.5 0.2 A 48 LYS CB C 13 34.5 0.2 A 48 LYS CD C 13 28.3 0.2 A 48 LYS CE C 13 42.1 0.2 A 48 LYS CG C 13 24.8 0.2 A 48 LYS N N 15 114.0 0.2 A 49 VAL H H 1 7.63 0.02 A 49 VAL HA H 1 4.71 0.02 A 49 VAL HB H 1 2.48 0.02 A 49 VAL HG1% H 1 1.02 0.02 A 49 VAL HG2% H 1 0.98 0.02 A 49 VAL CA C 13 59.4 0.2 A 49 VAL CB C 13 33.6 0.2 A 49 VAL CG1 C 13 20.7 0.02 A 49 VAL CG2 C 13 21.9 0.02 A 49 VAL N N 15 121.8 0.2 A 50 PRO HA H 1 4.46 0.02 A 50 PRO HBx H 1 2.04 0.02 A 50 PRO HBy H 1 2.48 0.02 A 50 PRO HDx H 1 3.70 0.02 A 50 PRO HDy H 1 3.94 0.02 A 50 PRO HGx H 1 2.04 0.02 A 50 PRO HGy H 1 2.09 0.02 A 50 PRO C C 13 177.9 0.2 A 50 PRO CA C 13 63.2 0.2 A 50 PRO CB C 13 32.9 0.2 A 50 PRO CD C 13 51.8 0.2 A 50 PRO CG C 13 27.8 0.2 A 51 SER H H 1 8.95 0.02 A 51 SER HA H 1 3.91 0.02 A 51 SER HBx H 1 3.72 0.02 A 51 SER HBy H 1 3.72 0.02 A 51 SER C C 13 176.3 0.2 A 51 SER CA C 13 62.8 0.2 A 51 SER CB C 13 62.7 0.2 A 51 SER N N 15 119.0 0.2 A 52 GLU H H 1 9.48 0.02 A 52 GLU HA H 1 4.22 0.02 A 52 GLU HBx H 1 2.11 0.02 A 52 GLU HBy H 1 2.11 0.02 A 52 GLU HGx H 1 2.38 0.02 A 52 GLU HGy H 1 2.38 0.02 A 52 GLU C C 13 177.0 0.2 A 52 GLU CA C 13 59.2 0.2 A 52 GLU CB C 13 28.7 0.2 A 52 GLU CG C 13 36.0 0.2 A 52 GLU N N 15 118.9 0.2 A 53 SER H H 1 7.77 0.02 A 53 SER HA H 1 4.94 0.02 A 53 SER HBx H 1 3.72 0.02 A 53 SER HBy H 1 3.97 0.02 A 53 SER C C 13 174.2 0.2 A 53 SER CA C 13 58.2 0.2 A 53 SER CB C 13 64.8 0.2 A 53 SER N N 15 112.5 0.2 A 54 ARG H H 1 7.38 0.02 A 54 ARG HA H 1 3.63 0.02 A 54 ARG HBx H 1 1.60 0.02 A 54 ARG HBy H 1 1.97 0.02 A 54 ARG HDx H 1 2.95 0.02 A 54 ARG HDy H 1 3.20 0.02 A 54 ARG HE H 1 6.69 0.02 A 54 ARG HGx H 1 1.50 0.02 A 54 ARG HGy H 1 1.59 0.02 A 54 ARG HH1x H 1 7.26 0.02 A 54 ARG HH1y H 1 7.26 0.02 A 54 ARG HH2x H 1 7.26 0.02 A 54 ARG HH2y H 1 7.26 0.02 A 54 ARG C C 13 177.2 0.2 A 54 ARG CA C 13 61.4 0.2 A 54 ARG CB C 13 31.2 0.2 A 54 ARG CD C 13 44.0 0.2 A 54 ARG CG C 13 28.7 0.2 A 54 ARG N N 15 122.1 0.2 A 54 ARG NE N 15 85.6 0.2 A 55 GLN H H 1 9.01 0.02 A 55 GLN HA H 1 3.84 0.02 A 55 GLN HBx H 1 2.03 0.02 A 55 GLN HBy H 1 2.05 0.02 A 55 GLN HE21 H 1 7.73 0.02 A 55 GLN HE22 H 1 6.79 0.02 A 55 GLN HGx H 1 2.32 0.02 A 55 GLN HGy H 1 2.32 0.02 A 55 GLN C C 13 178.0 0.2 A 55 GLN CA C 13 59.7 0.2 A 55 GLN CB C 13 28.1 0.2 A 55 GLN CD C 13 179.5 0.2 A 55 GLN CG C 13 33.9 0.2 A 55 GLN N N 15 118.0 0.2 A 55 GLN NE2 N 15 111.2 0.2 A 56 ALA H H 1 8.28 0.02 A 56 ALA HA H 1 4.19 0.02 A 56 ALA HB% H 1 1.50 0.02 A 56 ALA C C 13 181.2 0.2 A 56 ALA CA C 13 55.2 0.2 A 56 ALA CB C 13 17.9 0.2 A 56 ALA N N 15 122.3 0.2 A 57 VAL H H 1 8.15 0.02 A 57 VAL HA H 1 3.74 0.02 A 57 VAL HB H 1 1.97 0.02 A 57 VAL HG1% H 1 0.92 0.02 A 57 VAL HG2% H 1 1.10 0.02 A 57 VAL C C 13 178.9 0.2 A 57 VAL CA C 13 66.7 0.2 A 57 VAL CB C 13 31.7 0.2 A 57 VAL CG1 C 13 22.3 0.02 A 57 VAL CG2 C 13 23.1 0.02 A 57 VAL N N 15 119.6 0.2 A 58 ALA H H 1 8.37 0.02 A 58 ALA HA H 1 3.91 0.02 A 58 ALA HB% H 1 1.46 0.02 A 58 ALA C C 13 179.5 0.2 A 58 ALA CA C 13 55.8 0.2 A 58 ALA CB C 13 18.5 0.2 A 58 ALA N N 15 123.0 0.2 A 59 GLU H H 1 8.63 0.02 A 59 GLU HA H 1 4.10 0.02 A 59 GLU HBx H 1 2.13 0.02 A 59 GLU HBy H 1 2.23 0.02 A 59 GLU HGx H 1 2.32 0.02 A 59 GLU HGy H 1 2.53 0.02 A 59 GLU C C 13 179.4 0.2 A 59 GLU CA C 13 59.6 0.2 A 59 GLU CB C 13 29.3 0.2 A 59 GLU CG C 13 36.7 0.2 A 59 GLU N N 15 118.4 0.2 A 60 GLN H H 1 8.28 0.02 A 60 GLN HA H 1 4.09 0.02 A 60 GLN HBx H 1 2.29 0.02 A 60 GLN HBy H 1 2.29 0.02 A 60 GLN HE21 H 1 7.48 0.02 A 60 GLN HE22 H 1 6.88 0.02 A 60 GLN HGx H 1 2.51 0.02 A 60 GLN HGy H 1 2.58 0.02 A 60 GLN C C 13 178.7 0.2 A 60 GLN CA C 13 59.1 0.2 A 60 GLN CB C 13 28.1 0.2 A 60 GLN CD C 13 180.1 0.2 A 60 GLN CG C 13 33.8 0.2 A 60 GLN N N 15 120.4 0.2 A 60 GLN NE2 N 15 111.5 0.2 A 61 PHE H H 1 8.40 0.02 A 61 PHE HA H 1 4.16 0.02 A 61 PHE HBx H 1 3.19 0.02 A 61 PHE HBy H 1 3.44 0.02 A 61 PHE HDx H 1 7.18 0.02 A 61 PHE HDy H 1 7.18 0.02 A 61 PHE HEx H 1 7.41 0.02 A 61 PHE HEy H 1 7.41 0.02 A 61 PHE HZ H 1 6.94 0.02 A 61 PHE C C 13 177.6 0.2 A 61 PHE CA C 13 61.4 0.2 A 61 PHE CB C 13 39.1 0.2 A 61 PHE CDx C 13 132.1 0.02 A 61 PHE CDy C 13 132.1 0.02 A 61 PHE CEx C 13 131.0 0.02 A 61 PHE CEy C 13 131.0 0.02 A 61 PHE CZ C 13 129.1 0.2 A 61 PHE N N 15 122.0 0.2 A 62 ALA H H 1 8.62 0.02 A 62 ALA HA H 1 3.98 0.02 A 62 ALA HB% H 1 1.72 0.02 A 62 ALA C C 13 179.7 0.2 A 62 ALA CA C 13 55.5 0.2 A 62 ALA CB C 13 18.9 0.2 A 62 ALA N N 15 122.0 0.2 A 63 LYS H H 1 8.47 0.02 A 63 LYS HA H 1 4.05 0.02 A 63 LYS HBx H 1 1.89 0.02 A 63 LYS HBy H 1 1.95 0.02 A 63 LYS HDx H 1 1.69 0.02 A 63 LYS HDy H 1 1.69 0.02 A 63 LYS HEx H 1 2.96 0.02 A 63 LYS HEy H 1 2.96 0.02 A 63 LYS HGx H 1 1.42 0.02 A 63 LYS HGy H 1 1.63 0.02 A 63 LYS C C 13 179.2 0.2 A 63 LYS CA C 13 59.6 0.2 A 63 LYS CB C 13 32.6 0.2 A 63 LYS CD C 13 29.5 0.2 A 63 LYS CE C 13 42.2 0.2 A 63 LYS CG C 13 25.5 0.2 A 63 LYS N N 15 119.5 0.2 A 64 ALA H H 1 8.00 0.02 A 64 ALA HA H 1 4.10 0.02 A 64 ALA HB% H 1 1.41 0.02 A 64 ALA C C 13 180.7 0.2 A 64 ALA CA C 13 55.0 0.2 A 64 ALA CB C 13 17.7 0.2 A 64 ALA N N 15 122.0 0.2 A 65 LEU H H 1 7.83 0.02 A 65 LEU HA H 1 3.95 0.02 A 65 LEU HBx H 1 1.38 0.02 A 65 LEU HBy H 1 1.68 0.02 A 65 LEU HD1% H 1 0.74 0.02 A 65 LEU HD2% H 1 0.81 0.02 A 65 LEU HG H 1 1.48 0.02 A 65 LEU C C 13 178.9 0.2 A 65 LEU CA C 13 57.8 0.2 A 65 LEU CB C 13 41.7 0.2 A 65 LEU CD1 C 13 25.2 0.02 A 65 LEU CD2 C 13 25.9 0.02 A 65 LEU CG C 13 27.1 0.2 A 65 LEU N N 15 120.6 0.2 A 66 ALA H H 1 7.99 0.02 A 66 ALA HA H 1 3.84 0.02 A 66 ALA HB% H 1 1.49 0.02 A 66 ALA C C 13 180.3 0.2 A 66 ALA CA C 13 55.5 0.2 A 66 ALA CB C 13 17.9 0.2 A 66 ALA N N 15 120.9 0.2 A 67 GLN H H 1 8.14 0.02 A 67 GLN HA H 1 4.07 0.02 A 67 GLN HBx H 1 2.11 0.02 A 67 GLN HBy H 1 2.18 0.02 A 67 GLN HE21 H 1 7.46 0.02 A 67 GLN HE22 H 1 6.91 0.02 A 67 GLN HGx H 1 2.46 0.02 A 67 GLN HGy H 1 2.46 0.02 A 67 GLN C C 13 178.4 0.2 A 67 GLN CA C 13 58.3 0.2 A 67 GLN CB C 13 28.4 0.2 A 67 GLN CD C 13 180.2 0.2 A 67 GLN CG C 13 33.9 0.2 A 67 GLN N N 15 116.6 0.2 A 67 GLN NE2 N 15 112.2 0.2 A 68 SER H H 1 8.12 0.02 A 68 SER HA H 1 4.22 0.02 A 68 SER HBx H 1 3.99 0.02 A 68 SER HBy H 1 3.99 0.02 A 68 SER C C 13 176.5 0.2 A 68 SER CA C 13 61.5 0.2 A 68 SER CB C 13 63.0 0.2 A 68 SER N N 15 116.7 0.2 A 69 VAL H H 1 7.66 0.02 A 69 VAL HA H 1 3.86 0.02 A 69 VAL HB H 1 2.10 0.02 A 69 VAL HG1% H 1 0.82 0.02 A 69 VAL HG2% H 1 0.93 0.02 A 69 VAL C C 13 177.4 0.2 A 69 VAL CA C 13 64.9 0.2 A 69 VAL CB C 13 31.9 0.2 A 69 VAL CG1 C 13 21.2 0.02 A 69 VAL CG2 C 13 22.5 0.02 A 69 VAL N N 15 119.8 0.2 A 70 LYS H H 1 7.86 0.02 A 70 LYS HA H 1 4.04 0.02 A 70 LYS HBx H 1 1.90 0.02 A 70 LYS HBy H 1 1.90 0.02 A 70 LYS HDx H 1 1.66 0.02 A 70 LYS HDy H 1 1.66 0.02 A 70 LYS HEx H 1 2.96 0.02 A 70 LYS HEy H 1 2.96 0.02 A 70 LYS HGx H 1 1.38 0.02 A 70 LYS HGy H 1 1.47 0.02 A 70 LYS C C 13 178.4 0.2 A 70 LYS CA C 13 59.2 0.2 A 70 LYS CB C 13 32.8 0.2 A 70 LYS CD C 13 29.5 0.2 A 70 LYS CE C 13 42.2 0.2 A 70 LYS CG C 13 25.0 0.2 A 70 LYS N N 15 121.3 0.2 A 71 SER H H 1 8.39 0.02 A 71 SER HA H 1 4.28 0.02 A 71 SER HBx H 1 3.94 0.02 A 71 SER HBy H 1 3.94 0.02 A 71 SER C C 13 176.0 0.2 A 71 SER CA C 13 60.7 0.2 A 71 SER CB C 13 63.3 0.2 A 71 SER N N 15 114.4 0.2 A 72 ASN H H 1 7.94 0.02 A 72 ASN HA H 1 4.63 0.02 A 72 ASN HBx H 1 2.87 0.02 A 72 ASN HBy H 1 2.87 0.02 A 72 ASN HD21 H 1 7.76 0.02 A 72 ASN HD22 H 1 6.90 0.02 A 72 ASN C C 13 176.7 0.2 A 72 ASN CA C 13 55.0 0.2 A 72 ASN CB C 13 39.0 0.2 A 72 ASN CG C 13 176.7 0.2 A 72 ASN N N 15 119.7 0.2 A 72 ASN ND2 N 15 112.8 0.2 A 73 LEU H H 1 7.90 0.02 A 73 LEU HA H 1 4.18 0.02 A 73 LEU HBx H 1 1.55 0.02 A 73 LEU HBy H 1 1.86 0.02 A 73 LEU HD1% H 1 0.95 0.02 A 73 LEU HD2% H 1 0.92 0.02 A 73 LEU HG H 1 1.80 0.02 A 73 LEU C C 13 178.4 0.2 A 73 LEU CA C 13 56.7 0.2 A 73 LEU CB C 13 42.3 0.2 A 73 LEU CD1 C 13 26.1 0.02 A 73 LEU CD2 C 13 23.9 0.02 A 73 LEU CG C 13 26.9 0.2 A 73 LEU N N 15 121.0 0.2 A 74 GLU H H 1 8.06 0.02 A 74 GLU HA H 1 4.12 0.02 A 74 GLU HBx H 1 1.96 0.02 A 74 GLU HBy H 1 1.96 0.02 A 74 GLU HGx H 1 2.20 0.02 A 74 GLU HGy H 1 2.32 0.02 A 74 GLU C C 13 177.1 0.2 A 74 GLU CA C 13 57.4 0.2 A 74 GLU CB C 13 29.9 0.2 A 74 GLU CG C 13 36.1 0.2 A 74 GLU N N 15 119.3 0.2 A 75 HIS H H 1 8.14 0.02 A 75 HIS HA H 1 4.59 0.02 A 75 HIS HBx H 1 3.13 0.02 A 75 HIS HBy H 1 3.20 0.02 A 75 HIS HD2 H 1 7.20 0.02 A 75 HIS C C 13 174.9 0.2 A 75 HIS CA C 13 56.1 0.2 A 75 HIS CB C 13 29.0 0.2 A 75 HIS CD2 C 13 120.0 0.2 A 75 HIS N N 15 117.5 0.2 A 76 HIS H H 1 8.24 0.02 A 76 HIS C C 13 174.5 0.2 A 76 HIS CA C 13 55.9 0.2 A 76 HIS CB C 13 29.3 0.2 A 76 HIS N N 15 118.3 0.2 A 77 HIS H H 1 8.40 0.02 A 77 HIS HA H 1 4.64 0.02 A 77 HIS HBx H 1 3.12 0.02 A 77 HIS HBy H 1 3.20 0.02 A 77 HIS C C 13 173.7 0.2 A 77 HIS CA C 13 55.7 0.2 A 77 HIS CB C 13 29.7 0.2 A 77 HIS N N 15 119.3 0.2 A 78 HIS H H 1 8.33 0.02 A 78 HIS CA C 13 57.2 0.2 A 78 HIS CB C 13 29.9 0.2 A 78 HIS N N 15 125.4 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 32 LEU HD11 A 7 TYR HBy 1.0 1.8 5.0 2 2 B 32 LEU HD11 A 7 TYR HBx 1.0 1.8 5.0 3 3 B 32 LEU HD11 A 7 TYR HD% 1.0 1.8 5.0 4 4 A 7 TYR HD% B 32 LEU HD21 1.0 1.8 5.0 5 5 A 7 TYR HD% B 35 MET HE1 1.0 1.8 5.0 6 6 A 7 TYR HE% B 29 PRO HGx 1.0 1.8 5.0 7 6 A 7 TYR HE% B 29 PRO HGy 1.0 1.8 5.0 8 7 A 7 TYR HE% B 31 ASP HBx 1.0 1.8 5.0 9 7 A 7 TYR HE% B 31 ASP HBy 1.0 1.8 5.0 10 8 A 7 TYR HE% B 32 LEU HA 1.0 1.8 5.0 11 9 A 7 TYR HE% B 32 LEU HBx 1.0 1.8 5.0 12 9 A 7 TYR HE% B 32 LEU HBy 1.0 1.8 5.0 13 10 B 32 LEU HD11 A 7 TYR HE% 1.0 1.8 5.0 14 11 B 32 LEU HD21 A 7 TYR HE% 1.0 1.8 5.0 15 12 A 7 TYR HE% B 32 LEU H 1.0 1.8 5.0 16 13 B 35 MET HE1 A 7 TYR HE% 1.0 1.8 5.0 17 14 B 32 LEU HD11 A 11 GLN HBx 1.0 1.8 5.0 18 14 B 32 LEU HD11 A 11 GLN HBy 1.0 1.8 5.0 19 15 B 32 LEU HD21 A 11 GLN HBx 1.0 1.8 5.0 20 15 B 32 LEU HD21 A 11 GLN HBy 1.0 1.8 5.0 21 16 B 32 LEU HD21 A 11 GLN HE22 1.0 1.8 5.0 22 16 B 32 LEU HD21 A 11 GLN HE21 1.0 1.8 5.0 23 17 B 32 LEU HD11 A 11 GLN HGx 1.0 1.8 5.0 24 17 B 32 LEU HD11 A 11 GLN HGy 1.0 1.8 5.0 25 18 B 32 LEU HD21 A 11 GLN HGx 1.0 1.8 5.0 26 18 B 32 LEU HD21 A 11 GLN HGy 1.0 1.8 5.0 27 19 B 32 LEU HG A 11 GLN HGx 1.0 1.8 5.0 28 19 A 11 GLN HGy B 32 LEU HG 1.0 1.8 5.0 29 20 B 32 LEU HD11 A 12 VAL HA 1.0 1.8 5.0 30 21 B 35 MET HE1 A 12 VAL HG1% 1.0 1.8 5.0 31 22 A 12 VAL HG1% B 35 MET HGx 1.0 1.8 5.0 32 22 A 12 VAL HG1% B 35 MET HGy 1.0 1.8 5.0 33 23 A 12 VAL HG1% B 36 ALA HA 1.0 1.8 5.0 34 24 A 12 VAL HG1% B 36 ALA H 1.0 1.8 5.0 35 25 B 35 MET HE1 A 12 VAL HG2% 1.0 1.8 5.0 36 26 B 32 LEU HD11 A 12 VAL H 1.0 1.8 5.0 37 27 A 15 LEU HA B 22 VAL HG11 1.0 1.8 5.0 38 28 A 15 LEU HD1% B 26 HIS HBy 1.0 1.8 5.0 39 28 A 15 LEU HD1% B 26 HIS HBx 1.0 1.8 5.0 40 29 A 15 LEU HD1% B 26 HIS HD2 1.0 1.8 5.0 41 30 A 15 LEU HD1% B 26 HIS HE1 1.0 1.8 5.0 42 31 A 15 LEU HD1% B 28 ALA HB1 1.0 1.8 5.0 43 32 A 15 LEU HD2% B 26 HIS HBy 1.0 1.8 5.0 44 32 B 26 HIS HBx A 15 LEU HD2% 1.0 1.8 5.0 45 33 B 26 HIS HD2 A 15 LEU HD2% 1.0 1.8 5.0 46 34 B 28 ALA HB1 A 15 LEU HD2% 1.0 1.8 5.0 47 35 A 15 LEU HD2% B 33 SER HA 1.0 1.8 5.0 48 36 A 15 LEU HD2% B 36 ALA HB1 1.0 1.8 5.0 49 37 B 36 ALA H A 15 LEU HD2% 1.0 1.8 5.0 50 38 B 28 ALA HB1 A 15 LEU HG 1.0 1.8 5.0 51 39 B 36 ALA HA A 16 ILE HA 1.0 1.8 5.0 52 40 B 36 ALA HB1 A 16 ILE HA 1.0 1.8 5.0 53 41 B 36 ALA HA A 16 ILE HD1% 1.0 1.8 5.0 54 42 B 36 ALA HB1 A 16 ILE HD1% 1.0 1.8 5.0 55 43 A 16 ILE HD1% B 39 ASN HD2y 1.0 1.8 5.0 56 43 A 16 ILE HD1% B 39 ASN HD2x 1.0 1.8 5.0 57 44 A 16 ILE HD1% B 39 ASN H 1.0 1.8 5.0 58 45 B 36 ALA HA A 16 ILE HG1y 1.0 1.8 5.0 59 46 B 36 ALA HA A 16 ILE HG1x 1.0 1.8 5.0 60 47 B 36 ALA HB1 A 16 ILE HG1y 1.0 1.8 5.0 61 47 B 36 ALA HB1 A 16 ILE HG1x 1.0 1.8 5.0 62 48 B 39 ASN H A 16 ILE HG1y 1.0 1.8 5.0 63 48 B 39 ASN H A 16 ILE HG1x 1.0 1.8 5.0 64 49 A 16 ILE HG2% B 39 ASN HBy 1.0 1.8 5.0 65 50 A 16 ILE HG2% B 39 ASN HBx 1.0 1.8 5.0 66 51 A 16 ILE HG2% B 40 CYS HA 1.0 1.8 5.0 67 52 A 16 ILE HG2% B 43 HIS HBx 1.0 1.8 5.0 68 52 A 16 ILE HG2% B 43 HIS HBy 1.0 1.8 5.0 69 53 A 16 ILE HG2% B 43 HIS HD2 1.0 1.8 5.0 70 54 B 22 VAL HG11 A 18 GLU HBx 1.0 1.8 5.0 71 54 B 22 VAL HG11 A 18 GLU HBy 1.0 1.8 5.0 72 55 B 22 VAL HG21 A 18 GLU HBx 1.0 1.8 5.0 73 55 A 18 GLU HBy B 22 VAL HG21 1.0 1.8 5.0 74 56 B 22 VAL HG11 A 18 GLU HGx 1.0 1.8 5.0 75 56 B 22 VAL HG11 A 18 GLU HGy 1.0 1.8 5.0 76 57 B 22 VAL HG21 A 18 GLU HGx 1.0 1.8 5.0 77 57 B 22 VAL HG21 A 18 GLU HGy 1.0 1.8 5.0 78 58 B 22 VAL HG11 A 18 GLU H 1.0 1.8 5.0 79 59 A 19 ILE HB B 40 CYS HBx 1.0 1.8 5.0 80 59 A 19 ILE HB B 40 CYS HBy 1.0 1.8 5.0 81 60 A 19 ILE HD1% B 22 VAL HB 1.0 1.8 5.0 82 61 A 19 ILE HD1% B 23 LEU HD11 1.0 1.8 5.0 83 62 A 19 ILE HD1% B 23 LEU HD21 1.0 1.8 5.0 84 63 B 36 ALA HB1 A 19 ILE HD1% 1.0 1.8 5.0 85 64 A 19 ILE HD1% B 37 LEU HD21 1.0 1.8 5.0 86 65 A 19 ILE HD1% B 37 LEU H 1.0 1.8 5.0 87 66 B 22 VAL HB A 19 ILE HG2% 1.0 1.8 5.0 88 67 B 23 LEU HD11 A 19 ILE HG2% 1.0 1.8 5.0 89 68 B 23 LEU HD21 A 19 ILE HG2% 1.0 1.8 5.0 90 69 A 19 ILE HG2% B 23 LEU HG 1.0 1.8 5.0 91 70 A 19 ILE HG2% B 23 LEU H 1.0 1.8 5.0 92 71 A 20 LEU HD1% B 43 HIS HBx 1.0 1.8 5.0 93 71 B 43 HIS HBy A 20 LEU HD1% 1.0 1.8 5.0 94 72 B 43 HIS HD2 A 20 LEU HD1% 1.0 1.8 5.0 95 73 A 20 LEU HD1% B 43 HIS HE1 1.0 1.8 5.0 96 74 B 40 CYS HA A 20 LEU HD2% 1.0 1.8 5.0 97 75 A 20 LEU HD2% B 40 CYS HBx 1.0 1.8 5.0 98 75 B 40 CYS HBy A 20 LEU HD2% 1.0 1.8 5.0 99 76 A 20 LEU HD2% B 43 HIS HBx 1.0 1.8 5.0 100 76 B 43 HIS HBy A 20 LEU HD2% 1.0 1.8 5.0 101 77 B 43 HIS HD2 A 20 LEU HD2% 1.0 1.8 5.0 102 78 A 20 LEU HD2% B 44 LEU HD11 1.0 1.8 5.0 103 79 A 20 LEU HD2% B 44 LEU HG 1.0 1.8 5.0 104 80 B 44 LEU HD11 A 30 THR HA 1.0 1.8 5.0 105 81 A 30 THR HA B 44 LEU HD21 1.0 1.8 5.0 106 82 B 44 LEU HD21 A 30 THR HG2% 1.0 1.8 5.0 107 83 A 30 THR HG2% B 48 LYS HA 1.0 1.8 5.0 108 84 A 30 THR HG2% B 48 LYS HBx 1.0 1.8 5.0 109 84 A 30 THR HG2% B 48 LYS HBy 1.0 1.8 5.0 110 85 A 30 THR HG2% B 48 LYS HGx 1.0 1.8 5.0 111 85 A 30 THR HG2% B 48 LYS HGy 1.0 1.8 5.0 112 86 B 44 LEU HD11 A 33 SER HA 1.0 1.8 5.0 113 87 B 44 LEU HD11 A 33 SER HBx 1.0 1.8 5.0 114 87 B 44 LEU HD11 A 33 SER HBy 1.0 1.8 5.0 115 88 B 44 LEU HD21 A 33 SER HBx 1.0 1.8 5.0 116 88 B 44 LEU HD21 A 33 SER HBy 1.0 1.8 5.0 117 89 A 34 LEU HA B 41 VAL HA 1.0 1.8 5.0 118 90 A 34 LEU HD1% B 61 PHE HD% 1.0 1.8 5.0 119 91 B 41 VAL HA A 34 LEU HD2% 1.0 1.8 5.0 120 92 A 34 LEU HD2% B 41 VAL HG11 1.0 1.8 5.0 121 93 A 34 LEU HD2% B 41 VAL HG21 1.0 1.8 5.0 122 94 A 34 LEU HD2% B 57 VAL HG11 1.0 1.8 5.0 123 95 A 34 LEU HD2% B 57 VAL HG21 1.0 1.8 5.0 124 96 B 61 PHE HD% A 34 LEU HD2% 1.0 1.8 5.0 125 97 A 34 LEU HD2% B 61 PHE HE% 1.0 1.8 5.0 126 98 A 37 LEU HD1% B 40 CYS HBx 1.0 1.8 5.0 127 98 B 40 CYS HBy A 37 LEU HD1% 1.0 1.8 5.0 128 99 B 41 VAL HA A 37 LEU HD1% 1.0 1.8 5.0 129 100 A 37 LEU HD1% B 41 VAL HB 1.0 1.8 5.0 130 101 B 41 VAL HG21 A 37 LEU HD1% 1.0 1.8 5.0 131 102 A 37 LEU HD2% B 40 CYS HBx 1.0 1.8 5.0 132 102 B 40 CYS HBy A 37 LEU HD2% 1.0 1.8 5.0 133 103 B 61 PHE HZ A 38 GLY HAy 1.0 1.8 5.0 134 104 B 61 PHE HZ A 38 GLY HAx 1.0 1.8 5.0 135 105 B 41 VAL HG21 A 38 GLY HAy 1.0 1.8 5.0 136 105 B 41 VAL HG21 A 38 GLY HAx 1.0 1.8 5.0 137 106 B 61 PHE HE% A 38 GLY HAy 1.0 1.8 5.0 138 106 B 61 PHE HE% A 38 GLY HAx 1.0 1.8 5.0 139 107 A 38 GLY HAy B 65 LEU HBx 1.0 1.8 5.0 140 107 A 38 GLY HAx B 65 LEU HBx 1.0 1.8 5.0 141 107 B 65 LEU HBy A 38 GLY HAy 1.0 1.8 5.0 142 107 A 38 GLY HAx B 65 LEU HBy 1.0 1.8 5.0 143 108 B 65 LEU HD11 A 38 GLY HAy 1.0 1.8 5.0 144 108 A 38 GLY HAx B 65 LEU HD11 1.0 1.8 5.0 145 109 B 65 LEU HD21 A 38 GLY HAy 1.0 1.8 5.0 146 109 A 38 GLY HAx B 65 LEU HD21 1.0 1.8 5.0 147 110 B 61 PHE HE% A 38 GLY H 1.0 1.8 5.0 148 111 B 61 PHE HZ A 38 GLY H 1.0 1.8 5.0 149 112 B 65 LEU HD11 A 41 VAL HB 1.0 1.8 5.0 150 113 B 65 LEU HD21 A 41 VAL HB 1.0 1.8 5.0 151 114 B 61 PHE HE% A 41 VAL HG1% 1.0 1.8 5.0 152 115 B 61 PHE HZ A 41 VAL HG1% 1.0 1.8 5.0 153 116 B 65 LEU HD11 A 41 VAL HG1% 1.0 1.8 5.0 154 117 B 65 LEU HD21 A 41 VAL HG1% 1.0 1.8 5.0 155 118 B 61 PHE HE% A 41 VAL HG2% 1.0 1.8 5.0 156 119 B 61 PHE HZ A 41 VAL HG2% 1.0 1.8 5.0 157 120 B 65 LEU HD11 A 42 THR HA 1.0 1.8 5.0 158 121 B 65 LEU HD21 A 42 THR HA 1.0 1.8 5.0 159 122 B 65 LEU HD11 A 42 THR HB 1.0 1.8 5.0 160 123 A 42 THR HG2% B 65 LEU HA 1.0 1.8 5.0 161 124 A 42 THR HG2% B 65 LEU HBx 1.0 1.8 5.0 162 124 B 65 LEU HBy A 42 THR HG2% 1.0 1.8 5.0 163 125 B 65 LEU HD11 A 42 THR HG2% 1.0 1.8 5.0 164 126 A 42 THR HG2% B 65 LEU HG 1.0 1.8 5.0 165 127 A 42 THR HG2% B 68 SER H 1.0 1.8 5.0 166 128 A 42 THR HG2% B 69 VAL HA 1.0 1.8 5.0 167 129 B 65 LEU HD11 A 42 THR H 1.0 1.8 5.0 168 130 B 65 LEU HD21 A 42 THR H 1.0 1.8 5.0 169 131 B 69 VAL HG21 A 45 LEU HBx 1.0 1.8 5.0 170 131 A 45 LEU HBy B 69 VAL HG21 1.0 1.8 5.0 171 132 B 73 LEU HD21 A 51 SER HBx 1.0 1.8 5.0 172 132 A 51 SER HBy B 73 LEU HD21 1.0 1.8 5.0 173 133 A 54 ARG HA B 69 VAL HG11 1.0 1.8 5.0 174 134 B 69 VAL HG11 A 54 ARG HBx 1.0 1.8 5.0 175 134 B 69 VAL HG11 A 54 ARG HBy 1.0 1.8 5.0 176 135 B 69 VAL HG21 A 54 ARG HBx 1.0 1.8 5.0 177 135 B 69 VAL HG21 A 54 ARG HBy 1.0 1.8 5.0 178 136 B 69 VAL HG11 A 54 ARG HDy 1.0 1.8 5.0 179 137 B 69 VAL HG11 A 54 ARG HDx 1.0 1.8 5.0 180 138 B 69 VAL HG21 A 54 ARG HDy 1.0 1.8 5.0 181 138 B 69 VAL HG21 A 54 ARG HDx 1.0 1.8 5.0 182 139 B 69 VAL HG11 A 54 ARG HGx 1.0 1.8 5.0 183 139 B 69 VAL HG11 A 54 ARG HGy 1.0 1.8 5.0 184 140 B 69 VAL HG21 A 54 ARG HGx 1.0 1.8 5.0 185 140 B 69 VAL HG21 A 54 ARG HGy 1.0 1.8 5.0 186 141 B 69 VAL HG11 A 55 GLN HA 1.0 1.8 5.0 187 142 B 69 VAL HG11 A 55 GLN HBx 1.0 1.8 5.0 188 142 B 69 VAL HG11 A 55 GLN HBy 1.0 1.8 5.0 189 143 B 69 VAL HG11 A 55 GLN HGx 1.0 1.8 5.0 190 143 B 69 VAL HG11 A 55 GLN HGy 1.0 1.8 5.0 191 144 B 69 VAL HG21 A 55 GLN HGx 1.0 1.8 5.0 192 144 B 69 VAL HG21 A 55 GLN HGy 1.0 1.8 5.0 193 145 A 55 GLN HGx B 70 LYS HGx 1.0 1.8 5.0 194 145 A 55 GLN HGy B 70 LYS HGx 1.0 1.8 5.0 195 145 B 70 LYS HGy A 55 GLN HGx 1.0 1.8 5.0 196 145 A 55 GLN HGy B 70 LYS HGy 1.0 1.8 5.0 197 146 B 69 VAL HG11 A 55 GLN H 1.0 1.8 5.0 198 147 B 65 LEU HD21 A 58 ALA HB% 1.0 1.8 5.0 199 148 A 58 ALA HB% B 66 ALA HA 1.0 1.8 5.0 200 149 A 58 ALA HB% B 69 VAL HB 1.0 1.8 5.0 201 150 B 69 VAL HG11 A 58 ALA HB% 1.0 1.8 5.0 202 151 B 69 VAL HG21 A 58 ALA HB% 1.0 1.8 5.0 203 152 B 65 LEU HD11 A 61 PHE HE% 1.0 1.8 5.0 204 153 B 65 LEU HD21 A 62 ALA HB% 1.0 1.8 5.0 205 154 A 62 ALA HB% B 66 ALA HB1 1.0 1.8 5.0 206 155 A 32 LEU HD1% B 7 TYR HBy 1.0 1.8 5.0 207 156 A 32 LEU HD1% B 7 TYR HBx 1.0 1.8 5.0 208 157 A 32 LEU HD1% B 7 TYR HD% 1.0 1.8 5.0 209 158 B 7 TYR HD% A 32 LEU HD2% 1.0 1.8 5.0 210 159 B 7 TYR HD% A 35 MET HE% 1.0 1.8 5.0 211 160 B 7 TYR HE% A 29 PRO HGx 1.0 1.8 5.0 212 160 B 7 TYR HE% A 29 PRO HGy 1.0 1.8 5.0 213 161 B 7 TYR HE% A 31 ASP HBx 1.0 1.8 5.0 214 161 B 7 TYR HE% A 31 ASP HBy 1.0 1.8 5.0 215 162 B 7 TYR HE% A 32 LEU HA 1.0 1.8 5.0 216 163 B 7 TYR HE% A 32 LEU HBy 1.0 1.8 5.0 217 163 B 7 TYR HE% A 32 LEU HBx 1.0 1.8 5.0 218 164 A 32 LEU HD1% B 7 TYR HE% 1.0 1.8 5.0 219 165 A 32 LEU HD2% B 7 TYR HE% 1.0 1.8 5.0 220 166 B 7 TYR HE% A 32 LEU H 1.0 1.8 5.0 221 167 A 35 MET HE% B 7 TYR HE% 1.0 1.8 5.0 222 168 A 32 LEU HD1% B 11 GLN HBx 1.0 1.8 5.0 223 168 A 32 LEU HD1% B 11 GLN HBy 1.0 1.8 5.0 224 169 A 32 LEU HD2% B 11 GLN HBx 1.0 1.8 5.0 225 169 A 32 LEU HD2% B 11 GLN HBy 1.0 1.8 5.0 226 170 A 32 LEU HD2% B 11 GLN HE2y 1.0 1.8 5.0 227 170 A 32 LEU HD2% B 11 GLN HE2x 1.0 1.8 5.0 228 171 A 32 LEU HD1% B 11 GLN HGx 1.0 1.8 5.0 229 171 A 32 LEU HD1% B 11 GLN HGy 1.0 1.8 5.0 230 172 A 32 LEU HD2% B 11 GLN HGx 1.0 1.8 5.0 231 172 A 32 LEU HD2% B 11 GLN HGy 1.0 1.8 5.0 232 173 A 32 LEU HG B 11 GLN HGx 1.0 1.8 5.0 233 173 B 11 GLN HGy A 32 LEU HG 1.0 1.8 5.0 234 174 A 32 LEU HD1% B 12 VAL HA 1.0 1.8 5.0 235 175 A 35 MET HE% B 12 VAL HG11 1.0 1.8 5.0 236 176 B 12 VAL HG11 A 35 MET HGx 1.0 1.8 5.0 237 176 B 12 VAL HG11 A 35 MET HGy 1.0 1.8 5.0 238 177 B 12 VAL HG11 A 36 ALA HA 1.0 1.8 5.0 239 178 B 12 VAL HG11 A 36 ALA H 1.0 1.8 5.0 240 179 A 35 MET HE% B 12 VAL HG21 1.0 1.8 5.0 241 180 A 32 LEU HD1% B 12 VAL H 1.0 1.8 5.0 242 181 B 15 LEU HA A 22 VAL HG1% 1.0 1.8 5.0 243 182 B 15 LEU HD11 A 26 HIS HBy 1.0 1.8 5.0 244 182 B 15 LEU HD11 A 26 HIS HBx 1.0 1.8 5.0 245 183 B 15 LEU HD11 A 26 HIS HD2 1.0 1.8 5.0 246 184 B 15 LEU HD11 A 26 HIS HE1 1.0 1.8 5.0 247 185 B 15 LEU HD11 A 28 ALA HB% 1.0 1.8 5.0 248 186 B 15 LEU HD21 A 26 HIS HBy 1.0 1.8 5.0 249 186 A 26 HIS HBx B 15 LEU HD21 1.0 1.8 5.0 250 187 A 26 HIS HD2 B 15 LEU HD21 1.0 1.8 5.0 251 188 A 28 ALA HB% B 15 LEU HD21 1.0 1.8 5.0 252 189 A 33 SER HA B 15 LEU HD21 1.0 1.8 5.0 253 190 B 15 LEU HD21 A 36 ALA HB% 1.0 1.8 5.0 254 191 A 36 ALA H B 15 LEU HD21 1.0 1.8 5.0 255 192 A 28 ALA HB% B 15 LEU HG 1.0 1.8 5.0 256 193 A 36 ALA HA B 16 ILE HA 1.0 1.8 5.0 257 194 A 36 ALA HB% B 16 ILE HA 1.0 1.8 5.0 258 195 A 36 ALA HA B 16 ILE HD11 1.0 1.8 5.0 259 196 A 36 ALA HB% B 16 ILE HD11 1.0 1.8 5.0 260 197 B 16 ILE HD11 A 39 ASN HD22 1.0 1.8 5.0 261 197 B 16 ILE HD11 A 39 ASN HD21 1.0 1.8 5.0 262 198 B 16 ILE HD11 A 39 ASN H 1.0 1.8 5.0 263 199 A 36 ALA HA B 16 ILE HG1y 1.0 1.8 5.0 264 200 A 36 ALA HA B 16 ILE HG1x 1.0 1.8 5.0 265 201 A 36 ALA HB% B 16 ILE HG1y 1.0 1.8 5.0 266 201 A 36 ALA HB% B 16 ILE HG1x 1.0 1.8 5.0 267 202 A 39 ASN H B 16 ILE HG1y 1.0 1.8 5.0 268 202 A 39 ASN H B 16 ILE HG1x 1.0 1.8 5.0 269 203 B 16 ILE HG21 A 39 ASN HBy 1.0 1.8 5.0 270 204 B 16 ILE HG21 A 39 ASN HBx 1.0 1.8 5.0 271 205 B 16 ILE HG21 A 40 CYS HA 1.0 1.8 5.0 272 206 B 16 ILE HG21 A 43 HIS HBx 1.0 1.8 5.0 273 206 B 16 ILE HG21 A 43 HIS HBy 1.0 1.8 5.0 274 207 B 16 ILE HG21 A 43 HIS HD2 1.0 1.8 5.0 275 208 A 22 VAL HG1% B 18 GLU HBx 1.0 1.8 5.0 276 208 A 22 VAL HG1% B 18 GLU HBy 1.0 1.8 5.0 277 209 A 22 VAL HG2% B 18 GLU HBx 1.0 1.8 5.0 278 209 B 18 GLU HBy A 22 VAL HG2% 1.0 1.8 5.0 279 210 A 22 VAL HG1% B 18 GLU HGx 1.0 1.8 5.0 280 210 A 22 VAL HG1% B 18 GLU HGy 1.0 1.8 5.0 281 211 A 22 VAL HG2% B 18 GLU HGx 1.0 1.8 5.0 282 211 A 22 VAL HG2% B 18 GLU HGy 1.0 1.8 5.0 283 212 A 22 VAL HG1% B 18 GLU H 1.0 1.8 5.0 284 213 B 19 ILE HB A 40 CYS HBx 1.0 1.8 5.0 285 213 B 19 ILE HB A 40 CYS HBy 1.0 1.8 5.0 286 214 B 19 ILE HD11 A 22 VAL HB 1.0 1.8 5.0 287 215 B 19 ILE HD11 A 23 LEU HD1% 1.0 1.8 5.0 288 216 B 19 ILE HD11 A 23 LEU HD2% 1.0 1.8 5.0 289 217 A 36 ALA HB% B 19 ILE HD11 1.0 1.8 5.0 290 218 A 37 LEU HD2% B 19 ILE HD11 1.0 1.8 5.0 291 219 B 19 ILE HD11 A 37 LEU H 1.0 1.8 5.0 292 220 A 22 VAL HB B 19 ILE HG21 1.0 1.8 5.0 293 221 A 23 LEU HD1% B 19 ILE HG21 1.0 1.8 5.0 294 222 A 23 LEU HD2% B 19 ILE HG21 1.0 1.8 5.0 295 223 B 19 ILE HG21 A 23 LEU HG 1.0 1.8 5.0 296 224 B 19 ILE HG21 A 23 LEU H 1.0 1.8 5.0 297 225 B 20 LEU HD11 A 43 HIS HBx 1.0 1.8 5.0 298 225 A 43 HIS HBy B 20 LEU HD11 1.0 1.8 5.0 299 226 A 43 HIS HD2 B 20 LEU HD11 1.0 1.8 5.0 300 227 B 20 LEU HD11 A 43 HIS HE1 1.0 1.8 5.0 301 228 A 40 CYS HA B 20 LEU HD21 1.0 1.8 5.0 302 229 B 20 LEU HD21 A 40 CYS HBx 1.0 1.8 5.0 303 229 A 40 CYS HBy B 20 LEU HD21 1.0 1.8 5.0 304 230 B 20 LEU HD21 A 43 HIS HBx 1.0 1.8 5.0 305 230 A 43 HIS HBy B 20 LEU HD21 1.0 1.8 5.0 306 231 A 43 HIS HD2 B 20 LEU HD21 1.0 1.8 5.0 307 232 B 20 LEU HD21 A 44 LEU HD1% 1.0 1.8 5.0 308 233 B 20 LEU HD21 A 44 LEU HG 1.0 1.8 5.0 309 234 A 44 LEU HD1% B 30 THR HA 1.0 1.8 5.0 310 235 B 30 THR HA A 44 LEU HD2% 1.0 1.8 5.0 311 236 A 44 LEU HD2% B 30 THR HG21 1.0 1.8 5.0 312 237 B 30 THR HG21 A 48 LYS HA 1.0 1.8 5.0 313 238 B 30 THR HG21 A 48 LYS HBx 1.0 1.8 5.0 314 238 B 30 THR HG21 A 48 LYS HBy 1.0 1.8 5.0 315 239 B 30 THR HG21 A 48 LYS HGx 1.0 1.8 5.0 316 239 B 30 THR HG21 A 48 LYS HGy 1.0 1.8 5.0 317 240 B 33 SER HA A 44 LEU HD1% 1.0 1.8 5.0 318 241 A 44 LEU HD1% B 33 SER HBx 1.0 1.8 5.0 319 241 A 44 LEU HD1% B 33 SER HBy 1.0 1.8 5.0 320 242 A 44 LEU HD2% B 33 SER HBx 1.0 1.8 5.0 321 242 A 44 LEU HD2% B 33 SER HBy 1.0 1.8 5.0 322 243 B 34 LEU HA A 41 VAL HA 1.0 1.8 5.0 323 244 B 34 LEU HD11 A 61 PHE HD% 1.0 1.8 5.0 324 245 A 41 VAL HA B 34 LEU HD21 1.0 1.8 5.0 325 246 A 41 VAL HG1% B 34 LEU HD21 1.0 1.8 5.0 326 247 A 41 VAL HG2% B 34 LEU HD21 1.0 1.8 5.0 327 248 B 34 LEU HD21 A 57 VAL HG1% 1.0 1.8 5.0 328 249 B 34 LEU HD21 A 57 VAL HG2% 1.0 1.8 5.0 329 250 A 61 PHE HD% B 34 LEU HD21 1.0 1.8 5.0 330 251 A 61 PHE HE% B 34 LEU HD21 1.0 1.8 5.0 331 252 B 37 LEU HD11 A 40 CYS HBx 1.0 1.8 5.0 332 252 A 40 CYS HBy B 37 LEU HD11 1.0 1.8 5.0 333 253 A 41 VAL HA B 37 LEU HD11 1.0 1.8 5.0 334 254 A 41 VAL HB B 37 LEU HD11 1.0 1.8 5.0 335 255 A 41 VAL HG2% B 37 LEU HD11 1.0 1.8 5.0 336 256 B 37 LEU HD21 A 40 CYS HBx 1.0 1.8 5.0 337 256 B 37 LEU HD21 A 40 CYS HBy 1.0 1.8 5.0 338 257 A 61 PHE HZ B 38 GLY HAy 1.0 1.8 5.0 339 258 A 61 PHE HZ B 38 GLY HAx 1.0 1.8 5.0 340 259 A 41 VAL HG2% B 38 GLY HAy 1.0 1.8 5.0 341 259 A 41 VAL HG2% B 38 GLY HAx 1.0 1.8 5.0 342 260 A 61 PHE HE% B 38 GLY HAy 1.0 1.8 5.0 343 260 A 61 PHE HE% B 38 GLY HAx 1.0 1.8 5.0 344 261 A 65 LEU HBx B 38 GLY HAy 1.0 1.8 5.0 345 261 A 65 LEU HBy B 38 GLY HAy 1.0 1.8 5.0 346 261 B 38 GLY HAx A 65 LEU HBx 1.0 1.8 5.0 347 261 B 38 GLY HAx A 65 LEU HBy 1.0 1.8 5.0 348 262 A 65 LEU HD1% B 38 GLY HAy 1.0 1.8 5.0 349 262 B 38 GLY HAx A 65 LEU HD1% 1.0 1.8 5.0 350 263 A 65 LEU HD2% B 38 GLY HAy 1.0 1.8 5.0 351 263 B 38 GLY HAx A 65 LEU HD2% 1.0 1.8 5.0 352 264 A 61 PHE HE% B 38 GLY H 1.0 1.8 5.0 353 265 A 61 PHE HZ B 38 GLY H 1.0 1.8 5.0 354 266 B 41 VAL HB A 65 LEU HD1% 1.0 1.8 5.0 355 267 B 41 VAL HB A 65 LEU HD2% 1.0 1.8 5.0 356 268 B 41 VAL HG11 A 61 PHE HE% 1.0 1.8 5.0 357 269 B 41 VAL HG11 A 61 PHE HZ 1.0 1.8 5.0 358 270 B 41 VAL HG11 A 65 LEU HD1% 1.0 1.8 5.0 359 271 B 41 VAL HG11 A 65 LEU HD2% 1.0 1.8 5.0 360 272 B 41 VAL HG21 A 61 PHE HE% 1.0 1.8 5.0 361 273 B 41 VAL HG21 A 61 PHE HZ 1.0 1.8 5.0 362 274 A 65 LEU HD1% B 42 THR HA 1.0 1.8 5.0 363 275 A 65 LEU HD2% B 42 THR HA 1.0 1.8 5.0 364 276 A 65 LEU HD1% B 42 THR HB 1.0 1.8 5.0 365 277 B 42 THR HG21 A 65 LEU HA 1.0 1.8 5.0 366 278 B 42 THR HG21 A 65 LEU HBx 1.0 1.8 5.0 367 278 A 65 LEU HBy B 42 THR HG21 1.0 1.8 5.0 368 279 A 65 LEU HD1% B 42 THR HG21 1.0 1.8 5.0 369 280 B 42 THR HG21 A 65 LEU HG 1.0 1.8 5.0 370 281 B 42 THR HG21 A 68 SER H 1.0 1.8 5.0 371 282 B 42 THR HG21 A 69 VAL HA 1.0 1.8 5.0 372 283 A 65 LEU HD1% B 42 THR H 1.0 1.8 5.0 373 284 A 65 LEU HD2% B 42 THR H 1.0 1.8 5.0 374 285 A 69 VAL HG2% B 45 LEU HBx 1.0 1.8 5.0 375 285 B 45 LEU HBy A 69 VAL HG2% 1.0 1.8 5.0 376 286 A 73 LEU HD2% B 51 SER HBx 1.0 1.8 5.0 377 286 B 51 SER HBy A 73 LEU HD2% 1.0 1.8 5.0 378 287 B 54 ARG HA A 69 VAL HG1% 1.0 1.8 5.0 379 288 A 69 VAL HG1% B 54 ARG HBx 1.0 1.8 5.0 380 288 A 69 VAL HG1% B 54 ARG HBy 1.0 1.8 5.0 381 289 A 69 VAL HG2% B 54 ARG HBx 1.0 1.8 5.0 382 289 A 69 VAL HG2% B 54 ARG HBy 1.0 1.8 5.0 383 290 A 69 VAL HG1% B 54 ARG HDy 1.0 1.8 5.0 384 291 A 69 VAL HG1% B 54 ARG HDx 1.0 1.8 5.0 385 292 A 69 VAL HG2% B 54 ARG HDy 1.0 1.8 5.0 386 292 A 69 VAL HG2% B 54 ARG HDx 1.0 1.8 5.0 387 293 A 69 VAL HG1% B 54 ARG HGx 1.0 1.8 5.0 388 293 A 69 VAL HG1% B 54 ARG HGy 1.0 1.8 5.0 389 294 A 69 VAL HG2% B 54 ARG HGx 1.0 1.8 5.0 390 294 A 69 VAL HG2% B 54 ARG HGy 1.0 1.8 5.0 391 295 A 69 VAL HG1% B 55 GLN HA 1.0 1.8 5.0 392 296 A 69 VAL HG1% B 55 GLN HBx 1.0 1.8 5.0 393 296 A 69 VAL HG1% B 55 GLN HBy 1.0 1.8 5.0 394 297 A 69 VAL HG1% B 55 GLN HGx 1.0 1.8 5.0 395 297 A 69 VAL HG1% B 55 GLN HGy 1.0 1.8 5.0 396 298 A 69 VAL HG2% B 55 GLN HGx 1.0 1.8 5.0 397 298 A 69 VAL HG2% B 55 GLN HGy 1.0 1.8 5.0 398 299 A 70 LYS HGx B 55 GLN HGx 1.0 1.8 5.0 399 299 A 70 LYS HGy B 55 GLN HGx 1.0 1.8 5.0 400 299 B 55 GLN HGy A 70 LYS HGx 1.0 1.8 5.0 401 299 B 55 GLN HGy A 70 LYS HGy 1.0 1.8 5.0 402 300 A 69 VAL HG1% B 55 GLN H 1.0 1.8 5.0 403 301 A 65 LEU HD2% B 58 ALA HB1 1.0 1.8 5.0 404 302 B 58 ALA HB1 A 66 ALA HA 1.0 1.8 5.0 405 303 B 58 ALA HB1 A 69 VAL HB 1.0 1.8 5.0 406 304 A 69 VAL HG1% B 58 ALA HB1 1.0 1.8 5.0 407 305 A 69 VAL HG2% B 58 ALA HB1 1.0 1.8 5.0 408 306 B 61 PHE HE% A 65 LEU HD1% 1.0 1.8 5.0 409 307 A 65 LEU HD2% B 62 ALA HB1 1.0 1.8 5.0 410 308 B 62 ALA HB1 A 66 ALA HB% 1.0 1.8 5.0 411 309 A 5 SER HA A 7 TYR H 1.0 1.8 5.0 412 310 A 7 TYR H A 5 SER HBx 1.0 1.8 5.0 413 310 A 7 TYR H A 5 SER HBy 1.0 1.8 5.0 414 311 A 7 TYR HD% A 6 LYS HBx 1.0 1.8 5.0 415 311 A 7 TYR HD% A 6 LYS HBy 1.0 1.8 5.0 416 312 A 7 TYR HE% A 6 LYS HBx 1.0 1.8 5.0 417 312 A 7 TYR HE% A 6 LYS HBy 1.0 1.8 5.0 418 313 A 7 TYR HD% A 6 LYS HDx 1.0 1.8 5.0 419 313 A 7 TYR HD% A 6 LYS HDy 1.0 1.8 5.0 420 314 A 7 TYR HD% A 6 LYS HEx 1.0 1.8 5.0 421 314 A 7 TYR HD% A 6 LYS HEy 1.0 1.8 5.0 422 315 A 12 VAL HG2% A 7 TYR HBy 1.0 1.8 5.0 423 316 A 12 VAL HG2% A 7 TYR HBx 1.0 1.8 5.0 424 317 A 7 TYR HBy A 11 GLN HBx 1.0 1.8 5.0 425 317 A 7 TYR HBx A 11 GLN HBx 1.0 1.8 5.0 426 317 A 11 GLN HBy A 7 TYR HBy 1.0 1.8 5.0 427 317 A 11 GLN HBy A 7 TYR HBx 1.0 1.8 5.0 428 318 A 7 TYR HD% A 11 GLN HBx 1.0 1.8 5.0 429 318 A 7 TYR HD% A 11 GLN HBy 1.0 1.8 5.0 430 319 A 7 TYR HD% A 12 VAL HG2% 1.0 1.8 5.0 431 320 A 7 TYR HE% A 12 VAL HG2% 1.0 1.8 5.0 432 321 A 8 SER HA A 11 GLN H 1.0 1.8 5.0 433 322 A 8 SER HA A 9 ASN H 1.0 1.8 3.5 434 323 A 10 THR H A 8 SER HBx 1.0 1.8 5.0 435 323 A 8 SER HBy A 10 THR H 1.0 1.8 5.0 436 324 A 11 GLN H A 8 SER HBx 1.0 1.8 5.0 437 324 A 11 GLN H A 8 SER HBy 1.0 1.8 5.0 438 325 A 8 SER H A 11 GLN HBx 1.0 1.8 5.0 439 325 A 11 GLN HBy A 8 SER H 1.0 1.8 5.0 440 326 A 8 SER H A 11 GLN HGx 1.0 1.8 5.0 441 326 A 11 GLN HGy A 8 SER H 1.0 1.8 5.0 442 327 A 11 GLN H A 8 SER H 1.0 1.8 5.0 443 328 A 12 VAL HG2% A 8 SER H 1.0 1.8 5.0 444 329 A 11 GLN H A 9 ASN HA 1.0 1.8 5.0 445 330 A 9 ASN HA A 12 VAL HB 1.0 1.8 5.0 446 331 A 12 VAL HG1% A 9 ASN HA 1.0 1.8 5.0 447 332 A 12 VAL HG2% A 9 ASN HA 1.0 1.8 5.0 448 333 A 12 VAL H A 9 ASN HA 1.0 1.8 5.0 449 334 A 9 ASN HA A 13 GLU H 1.0 1.8 5.0 450 335 A 9 ASN H A 10 THR H 1.0 1.8 3.5 451 336 A 11 GLN H A 9 ASN H 1.0 1.8 5.0 452 337 A 10 THR HA A 13 GLU HBx 1.0 1.8 5.0 453 337 A 10 THR HA A 13 GLU HBy 1.0 1.8 5.0 454 338 A 10 THR HA A 13 GLU HGx 1.0 1.8 5.0 455 338 A 10 THR HA A 13 GLU HGy 1.0 1.8 5.0 456 339 A 13 GLU H A 10 THR HA 1.0 1.8 5.0 457 340 A 10 THR HG2% A 14 SER H 1.0 1.8 5.0 458 341 A 10 THR H A 11 GLN HBx 1.0 1.8 5.0 459 341 A 11 GLN HBy A 10 THR H 1.0 1.8 5.0 460 342 A 11 GLN H A 10 THR H 1.0 1.8 3.5 461 343 A 10 THR H A 13 GLU H 1.0 1.8 5.0 462 344 A 14 SER H A 11 GLN HA 1.0 1.8 5.0 463 345 A 15 LEU HD1% A 11 GLN HGx 1.0 1.8 5.0 464 345 A 11 GLN HGy A 15 LEU HD1% 1.0 1.8 5.0 465 346 A 12 VAL HG2% A 11 GLN H 1.0 1.8 5.0 466 347 A 11 GLN H A 13 GLU H 1.0 1.8 5.0 467 348 A 12 VAL HA A 14 SER H 1.0 1.8 5.0 468 349 A 12 VAL HA A 15 LEU HBx 1.0 1.8 5.0 469 349 A 12 VAL HA A 15 LEU HBy 1.0 1.8 5.0 470 350 A 12 VAL HA A 15 LEU HD1% 1.0 1.8 5.0 471 351 A 12 VAL HA A 15 LEU HD2% 1.0 1.8 5.0 472 352 A 12 VAL HA A 15 LEU H 1.0 1.8 5.0 473 353 A 12 VAL HA A 16 ILE H 1.0 1.8 5.0 474 354 A 12 VAL HG1% A 15 LEU H 1.0 1.8 5.0 475 355 A 12 VAL HG1% A 16 ILE HD1% 1.0 1.8 5.0 476 356 A 12 VAL HG1% A 16 ILE HG1y 1.0 1.8 5.0 477 356 A 12 VAL HG1% A 16 ILE HG1x 1.0 1.8 5.0 478 357 A 12 VAL HG1% A 16 ILE H 1.0 1.8 5.0 479 358 A 12 VAL HG2% A 16 ILE HD1% 1.0 1.8 5.0 480 359 A 12 VAL H A 13 GLU H 1.0 1.8 3.5 481 360 A 12 VAL H A 14 SER H 1.0 1.8 5.0 482 361 A 12 VAL H A 15 LEU H 1.0 1.8 5.0 483 362 A 13 GLU HA A 16 ILE HB 1.0 1.8 5.0 484 363 A 16 ILE HD1% A 13 GLU HA 1.0 1.8 5.0 485 364 A 16 ILE H A 13 GLU HA 1.0 1.8 5.0 486 365 A 13 GLU HA A 17 ALA H 1.0 1.8 5.0 487 366 A 15 LEU H A 13 GLU HBx 1.0 1.8 5.0 488 366 A 13 GLU HBy A 15 LEU H 1.0 1.8 5.0 489 367 A 16 ILE HG2% A 13 GLU HGx 1.0 1.8 5.0 490 367 A 16 ILE HG2% A 13 GLU HGy 1.0 1.8 5.0 491 368 A 13 GLU H A 14 SER H 1.0 1.8 3.5 492 369 A 13 GLU H A 15 LEU H 1.0 1.8 5.0 493 370 A 14 SER HA A 17 ALA HB% 1.0 1.8 5.0 494 371 A 17 ALA H A 14 SER HA 1.0 1.8 5.0 495 372 A 18 GLU H A 14 SER HA 1.0 1.8 5.0 496 373 A 17 ALA HB% A 14 SER HBx 1.0 1.8 5.0 497 373 A 17 ALA HB% A 14 SER HBy 1.0 1.8 5.0 498 374 A 14 SER H A 15 LEU H 1.0 1.8 3.5 499 375 A 14 SER H A 17 ALA HB% 1.0 1.8 5.0 500 376 A 15 LEU HA A 17 ALA H 1.0 1.8 5.0 501 377 A 15 LEU HA A 18 GLU HBx 1.0 1.8 5.0 502 377 A 15 LEU HA A 18 GLU HBy 1.0 1.8 5.0 503 378 A 15 LEU HA A 18 GLU H 1.0 1.8 5.0 504 379 A 15 LEU HA A 19 ILE H 1.0 1.8 5.0 505 380 A 19 ILE HD1% A 15 LEU HBx 1.0 1.8 5.0 506 380 A 19 ILE HD1% A 15 LEU HBy 1.0 1.8 5.0 507 381 A 15 LEU H A 16 ILE HB 1.0 1.8 5.0 508 382 A 15 LEU H A 16 ILE HG1y 1.0 1.8 5.0 509 382 A 16 ILE HG1x A 15 LEU H 1.0 1.8 5.0 510 383 A 15 LEU H A 16 ILE H 1.0 1.8 3.5 511 384 A 15 LEU H A 17 ALA H 1.0 1.8 5.0 512 385 A 16 ILE HA A 18 GLU H 1.0 1.8 5.0 513 386 A 16 ILE HA A 19 ILE HB 1.0 1.8 5.0 514 387 A 16 ILE HA A 19 ILE HD1% 1.0 1.8 5.0 515 388 A 16 ILE HA A 19 ILE HG2% 1.0 1.8 5.0 516 389 A 16 ILE HA A 19 ILE H 1.0 1.8 5.0 517 390 A 16 ILE HA A 20 LEU H 1.0 1.8 5.0 518 391 A 16 ILE HG2% A 20 LEU HD1% 1.0 1.8 5.0 519 392 A 16 ILE HG2% A 20 LEU HD2% 1.0 1.8 5.0 520 393 A 16 ILE HG2% A 20 LEU HG 1.0 1.8 5.0 521 394 A 18 GLU H A 16 ILE H 1.0 1.8 5.0 522 395 A 17 ALA HA A 20 LEU HBx 1.0 1.8 5.0 523 395 A 17 ALA HA A 20 LEU HBy 1.0 1.8 5.0 524 396 A 20 LEU HD1% A 17 ALA HA 1.0 1.8 5.0 525 397 A 20 LEU H A 17 ALA HA 1.0 1.8 5.0 526 398 A 17 ALA H A 18 GLU HBx 1.0 1.8 5.0 527 398 A 18 GLU HBy A 17 ALA H 1.0 1.8 5.0 528 399 A 18 GLU H A 17 ALA H 1.0 1.8 3.5 529 400 A 18 GLU HA A 21 VAL HB 1.0 1.8 5.0 530 401 A 18 GLU HA A 21 VAL HGx% 1.0 1.8 5.0 531 402 A 18 GLU HA A 21 VAL H 1.0 1.8 5.0 532 403 A 18 GLU HA A 22 VAL H 1.0 1.8 5.0 533 404 A 18 GLU H A 19 ILE HD1% 1.0 1.8 5.0 534 405 A 18 GLU H A 19 ILE H 1.0 1.8 3.5 535 406 A 18 GLU H A 20 LEU H 1.0 1.8 5.0 536 407 A 21 VAL H A 19 ILE HA 1.0 1.8 5.0 537 408 A 22 VAL HB A 19 ILE HA 1.0 1.8 5.0 538 409 A 22 VAL HG2% A 19 ILE HA 1.0 1.8 5.0 539 410 A 22 VAL H A 19 ILE HA 1.0 1.8 5.0 540 411 A 19 ILE H A 20 LEU H 1.0 1.8 3.5 541 412 A 19 ILE H A 21 VAL H 1.0 1.8 5.0 542 413 A 22 VAL HG2% A 19 ILE H 1.0 1.8 5.0 543 414 A 20 LEU HA A 23 LEU HBy 1.0 1.8 5.0 544 414 A 20 LEU HA A 23 LEU HBx 1.0 1.8 5.0 545 415 A 23 LEU H A 20 LEU HA 1.0 1.8 5.0 546 416 A 20 LEU H A 21 VAL HGy% 1.0 1.8 5.0 547 416 A 20 LEU H A 21 VAL HGx% 1.0 1.8 5.0 548 417 A 20 LEU H A 21 VAL H 1.0 1.8 3.5 549 418 A 20 LEU H A 22 VAL H 1.0 1.8 5.0 550 419 A 21 VAL HA A 24 GLU HBx 1.0 1.8 5.0 551 419 A 21 VAL HA A 24 GLU HBy 1.0 1.8 5.0 552 420 A 21 VAL HA A 24 GLU HGx 1.0 1.8 5.0 553 420 A 21 VAL HA A 24 GLU HGy 1.0 1.8 5.0 554 421 A 21 VAL HA A 24 GLU H 1.0 1.8 5.0 555 422 A 21 VAL HA A 25 LYS H 1.0 1.8 5.0 556 423 A 21 VAL HGx% A 24 GLU HBy 1.0 1.8 5.0 557 423 A 21 VAL HGx% A 24 GLU HBx 1.0 1.8 5.0 558 424 A 21 VAL HGx% A 25 LYS HBy 1.0 1.8 5.0 559 424 A 21 VAL HGx% A 25 LYS HBx 1.0 1.8 5.0 560 425 A 21 VAL HGx% A 25 LYS HDy 1.0 1.8 5.0 561 425 A 21 VAL HGx% A 25 LYS HDx 1.0 1.8 5.0 562 426 A 21 VAL HGx% A 25 LYS HEy 1.0 1.8 5.0 563 426 A 21 VAL HGx% A 25 LYS HEx 1.0 1.8 5.0 564 427 A 21 VAL HGx% A 25 LYS HGy 1.0 1.8 5.0 565 427 A 21 VAL HGx% A 25 LYS HGx 1.0 1.8 5.0 566 428 A 24 GLU HBy A 21 VAL HGy% 1.0 1.8 5.0 567 428 A 21 VAL HGy% A 24 GLU HBx 1.0 1.8 5.0 568 429 A 25 LYS H A 21 VAL HGy% 1.0 1.8 5.0 569 429 A 21 VAL HGx% A 25 LYS H 1.0 1.8 5.0 570 430 A 22 VAL HG2% A 21 VAL H 1.0 1.8 5.0 571 431 A 21 VAL H A 22 VAL H 1.0 1.8 3.5 572 432 A 22 VAL HA A 25 LYS HBx 1.0 1.8 5.0 573 432 A 25 LYS HBy A 22 VAL HA 1.0 1.8 5.0 574 433 A 22 VAL HA A 25 LYS HDx 1.0 1.8 5.0 575 433 A 25 LYS HDy A 22 VAL HA 1.0 1.8 5.0 576 434 A 25 LYS H A 22 VAL HA 1.0 1.8 5.0 577 435 A 22 VAL HA A 26 HIS H 1.0 1.8 5.0 578 436 A 22 VAL HG1% A 25 LYS HBx 1.0 1.8 5.0 579 436 A 22 VAL HG1% A 25 LYS HBy 1.0 1.8 5.0 580 437 A 22 VAL HG1% A 26 HIS HD2 1.0 1.8 5.0 581 438 A 22 VAL HG2% A 25 LYS HDx 1.0 1.8 5.0 582 438 A 22 VAL HG2% A 25 LYS HDy 1.0 1.8 5.0 583 439 A 22 VAL HG2% A 25 LYS HEx 1.0 1.8 5.0 584 439 A 22 VAL HG2% A 25 LYS HEy 1.0 1.8 5.0 585 440 A 22 VAL H A 23 LEU HBy 1.0 1.8 5.0 586 440 A 22 VAL H A 23 LEU HBx 1.0 1.8 5.0 587 441 A 23 LEU HG A 22 VAL H 1.0 1.8 5.0 588 442 A 22 VAL H A 24 GLU H 1.0 1.8 5.0 589 443 A 25 LYS H A 23 LEU HA 1.0 1.8 5.0 590 444 A 26 HIS HD2 A 23 LEU HA 1.0 1.8 5.0 591 445 A 26 HIS H A 23 LEU HA 1.0 1.8 5.0 592 446 A 23 LEU HA A 27 LYS H 1.0 1.8 5.0 593 447 A 28 ALA HB% A 23 LEU HA 1.0 1.8 5.0 594 448 A 28 ALA HB% A 23 LEU HBy 1.0 1.8 5.0 595 449 A 28 ALA HB% A 23 LEU HBx 1.0 1.8 5.0 596 450 A 28 ALA HB% A 23 LEU HBy 1.0 1.8 5.0 597 450 A 28 ALA HB% A 23 LEU HBx 1.0 1.8 5.0 598 451 A 28 ALA H A 23 LEU HBy 1.0 1.8 5.0 599 451 A 23 LEU HBx A 28 ALA H 1.0 1.8 5.0 600 452 A 28 ALA HB% A 23 LEU HD1% 1.0 1.8 5.0 601 453 A 33 SER HA A 23 LEU HD1% 1.0 1.8 5.0 602 454 A 33 SER HBy A 23 LEU HD1% 1.0 1.8 5.0 603 455 A 23 LEU HD1% A 33 SER HBx 1.0 1.8 5.0 604 456 A 36 ALA HB% A 23 LEU HD1% 1.0 1.8 5.0 605 457 A 37 LEU HD1% A 23 LEU HD1% 1.0 1.8 5.0 606 458 A 23 LEU HD1% A 37 LEU HG 1.0 1.8 5.0 607 459 A 28 ALA HB% A 23 LEU HD2% 1.0 1.8 5.0 608 460 A 23 LEU HD2% A 28 ALA H 1.0 1.8 5.0 609 461 A 33 SER HA A 23 LEU HD2% 1.0 1.8 5.0 610 462 A 23 LEU HD2% A 33 SER HBx 1.0 1.8 5.0 611 462 A 33 SER HBy A 23 LEU HD2% 1.0 1.8 5.0 612 463 A 36 ALA HB% A 23 LEU HD2% 1.0 1.8 5.0 613 464 A 23 LEU H A 24 GLU H 1.0 1.8 3.5 614 465 A 23 LEU H A 25 LYS H 1.0 1.8 5.0 615 466 A 26 HIS H A 24 GLU HA 1.0 1.8 5.0 616 467 A 28 ALA H A 24 GLU HA 1.0 1.8 5.0 617 468 A 26 HIS H A 24 GLU HBx 1.0 1.8 5.0 618 468 A 24 GLU HBy A 26 HIS H 1.0 1.8 5.0 619 469 A 24 GLU H A 25 LYS H 1.0 1.8 3.5 620 470 A 24 GLU H A 26 HIS H 1.0 1.8 5.0 621 471 A 27 LYS H A 25 LYS HA 1.0 1.8 5.0 622 472 A 26 HIS HD2 A 25 LYS HBx 1.0 1.8 5.0 623 472 A 26 HIS HD2 A 25 LYS HBy 1.0 1.8 5.0 624 473 A 27 LYS H A 25 LYS HBx 1.0 1.8 5.0 625 473 A 25 LYS HBy A 27 LYS H 1.0 1.8 5.0 626 474 A 25 LYS H A 26 HIS H 1.0 1.8 3.5 627 475 A 25 LYS H A 27 LYS H 1.0 1.8 5.0 628 476 A 28 ALA H A 26 HIS HBy 1.0 1.8 5.0 629 477 A 26 HIS HBx A 28 ALA H 1.0 1.8 5.0 630 478 A 28 ALA HB% A 26 HIS HBy 1.0 1.8 5.0 631 478 A 26 HIS HBx A 28 ALA HB% 1.0 1.8 5.0 632 479 A 26 HIS H A 27 LYS H 1.0 1.8 2.9 633 480 A 28 ALA HB% A 26 HIS H 1.0 1.8 5.0 634 481 A 26 HIS H A 28 ALA H 1.0 1.8 5.0 635 482 A 28 ALA H A 27 LYS HA 1.0 1.8 3.5 636 483 A 27 LYS H A 28 ALA H 1.0 1.8 3.5 637 484 A 28 ALA HA A 29 PRO HDy 1.0 1.8 5.0 638 485 A 28 ALA HA A 29 PRO HDx 1.0 1.8 5.0 639 486 A 28 ALA HA A 29 PRO HGx 1.0 1.8 5.0 640 486 A 29 PRO HGy A 28 ALA HA 1.0 1.8 5.0 641 487 A 32 LEU HD2% A 28 ALA HA 1.0 1.8 5.0 642 488 A 28 ALA HB% A 29 PRO HDy 1.0 1.8 5.0 643 488 A 28 ALA HB% A 29 PRO HDx 1.0 1.8 5.0 644 489 A 28 ALA HB% A 32 LEU HBy 1.0 1.8 5.0 645 489 A 32 LEU HBx A 28 ALA HB% 1.0 1.8 5.0 646 490 A 32 LEU HD2% A 28 ALA HB% 1.0 1.8 5.0 647 491 A 32 LEU HG A 28 ALA HB% 1.0 1.8 5.0 648 492 A 33 SER HA A 28 ALA HB% 1.0 1.8 5.0 649 493 A 28 ALA HB% A 33 SER H 1.0 1.8 5.0 650 494 A 28 ALA H A 29 PRO HDy 1.0 1.8 5.0 651 494 A 28 ALA H A 29 PRO HDx 1.0 1.8 5.0 652 495 A 30 THR H A 29 PRO HBy 1.0 1.8 4.0 653 496 A 31 ASP H A 29 PRO HBy 1.0 1.8 5.0 654 497 A 30 THR H A 29 PRO HBx 1.0 1.8 4.0 655 498 A 31 ASP H A 29 PRO HBx 1.0 1.8 5.0 656 499 A 32 LEU H A 29 PRO HBx 1.0 1.8 5.0 657 499 A 32 LEU H A 29 PRO HBy 1.0 1.8 5.0 658 500 A 32 LEU HD2% A 29 PRO HDy 1.0 1.8 5.0 659 501 A 32 LEU HD2% A 29 PRO HDx 1.0 1.8 5.0 660 502 A 29 PRO HDx A 32 LEU HBy 1.0 1.8 5.0 661 502 A 29 PRO HDy A 32 LEU HBy 1.0 1.8 5.0 662 502 A 32 LEU HBx A 29 PRO HDy 1.0 1.8 5.0 663 502 A 32 LEU HBx A 29 PRO HDx 1.0 1.8 5.0 664 503 A 32 LEU H A 29 PRO HDy 1.0 1.8 5.0 665 503 A 32 LEU H A 29 PRO HDx 1.0 1.8 5.0 666 504 A 29 PRO HGx A 32 LEU HBy 1.0 1.8 5.0 667 504 A 29 PRO HGy A 32 LEU HBy 1.0 1.8 5.0 668 504 A 32 LEU HBx A 29 PRO HGx 1.0 1.8 5.0 669 504 A 29 PRO HGy A 32 LEU HBx 1.0 1.8 5.0 670 505 A 32 LEU HD2% A 29 PRO HGx 1.0 1.8 5.0 671 505 A 32 LEU HD2% A 29 PRO HGy 1.0 1.8 5.0 672 506 A 30 THR HA A 33 SER H 1.0 1.8 5.0 673 507 A 30 THR HA A 34 LEU H 1.0 1.8 5.0 674 508 A 30 THR HG2% A 34 LEU HBx 1.0 1.8 5.0 675 508 A 30 THR HG2% A 34 LEU HBy 1.0 1.8 5.0 676 509 A 30 THR HG2% A 34 LEU HD1% 1.0 1.8 5.0 677 510 A 30 THR HG2% A 34 LEU HG 1.0 1.8 5.0 678 511 A 30 THR HG2% A 34 LEU H 1.0 1.8 5.0 679 512 A 33 SER H A 30 THR H 1.0 1.8 5.0 680 513 A 31 ASP HA A 34 LEU HBx 1.0 1.8 5.0 681 513 A 34 LEU HBy A 31 ASP HA 1.0 1.8 5.0 682 514 A 34 LEU HD1% A 31 ASP HA 1.0 1.8 5.0 683 515 A 34 LEU H A 31 ASP HA 1.0 1.8 5.0 684 516 A 31 ASP HA A 35 MET H 1.0 1.8 5.0 685 517 A 35 MET HE% A 31 ASP HBx 1.0 1.8 5.0 686 517 A 35 MET HE% A 31 ASP HBy 1.0 1.8 5.0 687 518 A 32 LEU H A 31 ASP H 1.0 1.8 3.5 688 519 A 33 SER H A 31 ASP H 1.0 1.8 5.0 689 520 A 32 LEU HA A 35 MET HBx 1.0 1.8 5.0 690 520 A 32 LEU HA A 35 MET HBy 1.0 1.8 5.0 691 521 A 35 MET HE% A 32 LEU HA 1.0 1.8 5.0 692 522 A 32 LEU HA A 35 MET H 1.0 1.8 5.0 693 523 A 32 LEU HA A 36 ALA H 1.0 1.8 5.0 694 524 A 32 LEU HD1% A 35 MET HBx 1.0 1.8 5.0 695 524 A 32 LEU HD1% A 35 MET HBy 1.0 1.8 5.0 696 525 A 32 LEU HD1% A 35 MET HE% 1.0 1.8 5.0 697 526 A 32 LEU HD1% A 35 MET H 1.0 1.8 5.0 698 527 A 32 LEU HD1% A 36 ALA HB% 1.0 1.8 5.0 699 528 A 32 LEU HD1% A 36 ALA H 1.0 1.8 5.0 700 529 A 32 LEU H A 33 SER H 1.0 1.8 3.5 701 530 A 32 LEU H A 34 LEU H 1.0 1.8 5.0 702 531 A 32 LEU H A 35 MET H 1.0 1.8 5.0 703 532 A 33 SER HA A 36 ALA HB% 1.0 1.8 5.0 704 533 A 33 SER HA A 36 ALA H 1.0 1.8 5.0 705 534 A 37 LEU HD2% A 33 SER HBx 1.0 1.8 5.0 706 534 A 33 SER HBy A 37 LEU HD2% 1.0 1.8 5.0 707 535 A 33 SER H A 34 LEU HBx 1.0 1.8 5.0 708 535 A 33 SER H A 34 LEU HBy 1.0 1.8 5.0 709 536 A 33 SER H A 34 LEU HG 1.0 1.8 5.0 710 537 A 33 SER H A 35 MET H 1.0 1.8 5.0 711 538 A 36 ALA H A 33 SER H 1.0 1.8 5.0 712 539 A 34 LEU HA A 37 LEU HBx 1.0 1.8 5.0 713 539 A 34 LEU HA A 37 LEU HBy 1.0 1.8 5.0 714 540 A 34 LEU HA A 37 LEU H 1.0 1.8 5.0 715 541 A 34 LEU HA A 38 GLY H 1.0 1.8 5.0 716 542 A 34 LEU HD2% A 37 LEU HBx 1.0 1.8 5.0 717 542 A 34 LEU HD2% A 37 LEU HBy 1.0 1.8 5.0 718 543 A 34 LEU HD2% A 37 LEU HD2% 1.0 1.8 5.0 719 544 A 34 LEU H A 35 MET H 1.0 1.8 3.5 720 545 A 36 ALA H A 34 LEU H 1.0 1.8 5.0 721 546 A 34 LEU H A 37 LEU HBx 1.0 1.8 5.0 722 546 A 34 LEU H A 37 LEU HBy 1.0 1.8 5.0 723 547 A 37 LEU H A 34 LEU H 1.0 1.8 5.0 724 548 A 38 GLY H A 35 MET HA 1.0 1.8 5.0 725 549 A 39 ASN H A 35 MET HA 1.0 1.8 5.0 726 550 A 35 MET HBx A 39 ASN HD22 1.0 1.8 5.0 727 550 A 35 MET HBy A 39 ASN HD22 1.0 1.8 5.0 728 550 A 39 ASN HD21 A 35 MET HBx 1.0 1.8 5.0 729 550 A 39 ASN HD21 A 35 MET HBy 1.0 1.8 5.0 730 551 A 35 MET HGx A 39 ASN HD22 1.0 1.8 5.0 731 551 A 35 MET HGy A 39 ASN HD22 1.0 1.8 5.0 732 551 A 39 ASN HD21 A 35 MET HGx 1.0 1.8 5.0 733 551 A 35 MET HGy A 39 ASN HD21 1.0 1.8 5.0 734 552 A 36 ALA H A 35 MET H 1.0 1.8 3.5 735 553 A 37 LEU H A 35 MET H 1.0 1.8 5.0 736 554 A 36 ALA HA A 39 ASN HBy 1.0 1.8 5.0 737 554 A 36 ALA HA A 39 ASN HBx 1.0 1.8 5.0 738 555 A 36 ALA HA A 39 ASN H 1.0 1.8 5.0 739 556 A 36 ALA HB% A 39 ASN HBy 1.0 1.8 5.0 740 556 A 36 ALA HB% A 39 ASN HBx 1.0 1.8 5.0 741 557 A 36 ALA HB% A 39 ASN H 1.0 1.8 5.0 742 558 A 37 LEU HA A 40 CYS HBx 1.0 1.8 5.0 743 558 A 40 CYS HBy A 37 LEU HA 1.0 1.8 5.0 744 559 A 37 LEU HA A 40 CYS H 1.0 1.8 5.0 745 560 A 37 LEU HA A 41 VAL H 1.0 1.8 5.0 746 561 A 41 VAL H A 37 LEU HBx 1.0 1.8 5.0 747 561 A 37 LEU HBy A 41 VAL H 1.0 1.8 5.0 748 562 A 37 LEU HD1% A 40 CYS HBx 1.0 1.8 5.0 749 562 A 37 LEU HD1% A 40 CYS HBy 1.0 1.8 5.0 750 563 A 38 GLY H A 37 LEU H 1.0 1.8 3.5 751 564 A 39 ASN H A 37 LEU H 1.0 1.8 5.0 752 565 A 37 LEU H A 40 CYS H 1.0 1.8 5.0 753 566 A 41 VAL HG2% A 38 GLY HAy 1.0 1.8 5.0 754 567 A 38 GLY HAx A 41 VAL HG2% 1.0 1.8 5.0 755 568 A 40 CYS H A 38 GLY HAy 1.0 1.8 5.0 756 568 A 38 GLY HAx A 40 CYS H 1.0 1.8 5.0 757 569 A 41 VAL HB A 38 GLY HAy 1.0 1.8 5.0 758 569 A 38 GLY HAx A 41 VAL HB 1.0 1.8 5.0 759 570 A 41 VAL HG2% A 38 GLY HAy 1.0 1.8 5.0 760 570 A 38 GLY HAx A 41 VAL HG2% 1.0 1.8 5.0 761 571 A 41 VAL H A 38 GLY HAy 1.0 1.8 5.0 762 571 A 38 GLY HAx A 41 VAL H 1.0 1.8 5.0 763 572 A 38 GLY H A 39 ASN HBy 1.0 1.8 5.0 764 572 A 38 GLY H A 39 ASN HBx 1.0 1.8 5.0 765 573 A 38 GLY H A 39 ASN H 1.0 1.8 3.5 766 574 A 38 GLY H A 40 CYS H 1.0 1.8 5.0 767 575 A 38 GLY H A 41 VAL H 1.0 1.8 5.0 768 576 A 42 THR HB A 39 ASN HA 1.0 1.8 5.0 769 577 A 42 THR HG2% A 39 ASN HA 1.0 1.8 5.0 770 578 A 42 THR H A 39 ASN HA 1.0 1.8 5.0 771 579 A 39 ASN HA A 43 HIS H 1.0 1.8 5.0 772 580 A 42 THR H A 39 ASN HBy 1.0 1.8 5.0 773 580 A 42 THR H A 39 ASN HBx 1.0 1.8 5.0 774 581 A 39 ASN HBy A 43 HIS HBx 1.0 1.8 5.0 775 581 A 39 ASN HBx A 43 HIS HBx 1.0 1.8 5.0 776 581 A 43 HIS HBy A 39 ASN HBy 1.0 1.8 5.0 777 581 A 43 HIS HBy A 39 ASN HBx 1.0 1.8 5.0 778 582 A 39 ASN H A 40 CYS HBx 1.0 1.8 5.0 779 582 A 39 ASN H A 40 CYS HBy 1.0 1.8 5.0 780 583 A 39 ASN H A 40 CYS H 1.0 1.8 3.5 781 584 A 39 ASN H A 41 VAL H 1.0 1.8 5.0 782 585 A 42 THR H A 40 CYS HA 1.0 1.8 5.0 783 586 A 40 CYS HA A 43 HIS HBx 1.0 1.8 5.0 784 586 A 40 CYS HA A 43 HIS HBy 1.0 1.8 5.0 785 587 A 40 CYS HA A 43 HIS HD2 1.0 1.8 5.0 786 588 A 40 CYS HA A 43 HIS H 1.0 1.8 5.0 787 589 A 40 CYS HBx A 43 HIS HBx 1.0 1.8 5.0 788 589 A 40 CYS HBy A 43 HIS HBx 1.0 1.8 5.0 789 589 A 43 HIS HBy A 40 CYS HBx 1.0 1.8 5.0 790 589 A 43 HIS HBy A 40 CYS HBy 1.0 1.8 5.0 791 590 A 41 VAL HB A 40 CYS H 1.0 1.8 5.0 792 591 A 41 VAL HG2% A 40 CYS H 1.0 1.8 5.0 793 592 A 40 CYS H A 41 VAL H 1.0 1.8 3.5 794 593 A 42 THR H A 40 CYS H 1.0 1.8 5.0 795 594 A 41 VAL HA A 44 LEU HBy 1.0 1.8 5.0 796 595 A 41 VAL HA A 44 LEU HBx 1.0 1.8 5.0 797 596 A 44 LEU HD1% A 41 VAL HA 1.0 1.8 5.0 798 597 A 44 LEU HG A 41 VAL HA 1.0 1.8 5.0 799 598 A 41 VAL HA A 44 LEU H 1.0 1.8 5.0 800 599 A 41 VAL HA A 45 LEU H 1.0 1.8 5.0 801 600 A 41 VAL HG1% A 42 THR HA 1.0 1.8 5.0 802 601 A 41 VAL HG1% A 42 THR HG2% 1.0 1.8 5.0 803 602 A 41 VAL HG1% A 45 LEU HBx 1.0 1.8 5.0 804 602 A 41 VAL HG1% A 45 LEU HBy 1.0 1.8 5.0 805 603 A 41 VAL HG1% A 45 LEU HD1% 1.0 1.8 5.0 806 604 A 41 VAL HG1% A 45 LEU HD2% 1.0 1.8 5.0 807 605 A 41 VAL HG1% A 45 LEU HG 1.0 1.8 5.0 808 606 A 41 VAL HG1% A 45 LEU H 1.0 1.8 5.0 809 607 A 41 VAL HG1% A 61 PHE HD% 1.0 1.8 5.0 810 608 A 41 VAL HG1% A 61 PHE HE% 1.0 1.8 5.0 811 609 A 41 VAL HG1% A 61 PHE HZ 1.0 1.8 5.0 812 610 A 41 VAL HG1% A 65 LEU HD1% 1.0 1.8 5.0 813 611 A 41 VAL HG1% A 65 LEU HD2% 1.0 1.8 5.0 814 612 A 41 VAL HG2% A 61 PHE HE% 1.0 1.8 5.0 815 613 A 41 VAL HG2% A 61 PHE HZ 1.0 1.8 5.0 816 614 A 42 THR H A 41 VAL H 1.0 1.8 3.5 817 615 A 41 VAL H A 43 HIS H 1.0 1.8 5.0 818 616 A 42 THR HA A 45 LEU HBx 1.0 1.8 5.0 819 616 A 42 THR HA A 45 LEU HBy 1.0 1.8 5.0 820 617 A 42 THR HA A 45 LEU HD1% 1.0 1.8 5.0 821 618 A 42 THR HA A 45 LEU H 1.0 1.8 5.0 822 619 A 42 THR HA A 46 GLU H 1.0 1.8 5.0 823 620 A 42 THR HG2% A 46 GLU HGx 1.0 1.8 5.0 824 620 A 42 THR HG2% A 46 GLU HGy 1.0 1.8 5.0 825 621 A 42 THR HG2% A 46 GLU H 1.0 1.8 5.0 826 622 A 46 GLU H A 43 HIS HA 1.0 1.8 5.0 827 623 A 43 HIS HA A 47 ARG H 1.0 1.8 5.0 828 624 A 44 LEU HG A 43 HIS HBx 1.0 1.8 5.0 829 624 A 43 HIS HBy A 44 LEU HG 1.0 1.8 5.0 830 625 A 43 HIS HD2 A 44 LEU HA 1.0 1.8 5.0 831 626 A 43 HIS HD2 A 44 LEU HG 1.0 1.8 5.0 832 627 A 43 HIS H A 44 LEU H 1.0 1.8 3.5 833 628 A 44 LEU HA A 47 ARG HBx 1.0 1.8 5.0 834 628 A 44 LEU HA A 47 ARG HBy 1.0 1.8 5.0 835 629 A 47 ARG H A 44 LEU HA 1.0 1.8 5.0 836 630 A 44 LEU HA A 48 LYS H 1.0 1.8 5.0 837 631 A 44 LEU H A 45 LEU H 1.0 1.8 3.5 838 632 A 48 LYS H A 45 LEU HA 1.0 1.8 5.0 839 633 A 45 LEU HA A 49 VAL HG2% 1.0 1.8 5.0 840 634 A 45 LEU HA A 49 VAL H 1.0 1.8 5.0 841 635 A 45 LEU HA A 54 ARG HGx 1.0 1.8 5.0 842 635 A 54 ARG HGy A 45 LEU HA 1.0 1.8 5.0 843 636 A 45 LEU HD1% A 57 VAL HB 1.0 1.8 5.0 844 637 A 57 VAL HG1% A 45 LEU HD1% 1.0 1.8 5.0 845 638 A 58 ALA HB% A 45 LEU HD1% 1.0 1.8 5.0 846 639 A 45 LEU HD2% A 49 VAL HB 1.0 1.8 5.0 847 640 A 45 LEU HD2% A 49 VAL HG1% 1.0 1.8 5.0 848 641 A 45 LEU HD2% A 49 VAL HG2% 1.0 1.8 5.0 849 642 A 45 LEU HD2% A 49 VAL H 1.0 1.8 5.0 850 643 A 54 ARG HA A 45 LEU HD2% 1.0 1.8 5.0 851 644 A 45 LEU HD2% A 54 ARG HBx 1.0 1.8 5.0 852 644 A 54 ARG HBy A 45 LEU HD2% 1.0 1.8 5.0 853 645 A 45 LEU HD2% A 54 ARG HDy 1.0 1.8 5.0 854 645 A 54 ARG HDx A 45 LEU HD2% 1.0 1.8 5.0 855 646 A 45 LEU HD2% A 54 ARG HGx 1.0 1.8 5.0 856 646 A 54 ARG HGy A 45 LEU HD2% 1.0 1.8 5.0 857 647 A 45 LEU HD2% A 54 ARG H 1.0 1.8 5.0 858 648 A 45 LEU HD2% A 57 VAL HB 1.0 1.8 5.0 859 649 A 57 VAL HG1% A 45 LEU HD2% 1.0 1.8 5.0 860 650 A 58 ALA HB% A 45 LEU HD2% 1.0 1.8 5.0 861 651 A 45 LEU HD2% A 58 ALA H 1.0 1.8 5.0 862 652 A 45 LEU H A 46 GLU H 1.0 1.8 3.5 863 653 A 49 VAL H A 46 GLU HA 1.0 1.8 5.0 864 654 A 46 GLU HA A 54 ARG HDy 1.0 1.8 5.0 865 655 A 54 ARG HDx A 46 GLU HA 1.0 1.8 5.0 866 656 A 46 GLU HA A 54 ARG HE 1.0 1.8 5.0 867 657 A 46 GLU HGy A 54 ARG HDy 1.0 1.8 5.0 868 657 A 46 GLU HGx A 54 ARG HDy 1.0 1.8 5.0 869 657 A 54 ARG HDx A 46 GLU HGx 1.0 1.8 5.0 870 657 A 54 ARG HDx A 46 GLU HGy 1.0 1.8 5.0 871 658 A 54 ARG HE A 46 GLU HGx 1.0 1.8 5.0 872 658 A 46 GLU HGy A 54 ARG HE 1.0 1.8 5.0 873 659 A 46 GLU HGx A 54 ARG HGx 1.0 1.8 5.0 874 659 A 46 GLU HGy A 54 ARG HGx 1.0 1.8 5.0 875 659 A 54 ARG HGy A 46 GLU HGx 1.0 1.8 5.0 876 659 A 54 ARG HGy A 46 GLU HGy 1.0 1.8 5.0 877 660 A 46 GLU H A 47 ARG H 1.0 1.8 3.5 878 661 A 49 VAL H A 47 ARG HA 1.0 1.8 5.0 879 662 A 48 LYS HA A 47 ARG H 1.0 1.8 5.0 880 663 A 47 ARG H A 48 LYS H 1.0 1.8 3.5 881 664 A 48 LYS H A 49 VAL HB 1.0 1.8 5.0 882 665 A 48 LYS H A 49 VAL HG2% 1.0 1.8 5.0 883 666 A 48 LYS H A 49 VAL H 1.0 1.8 3.5 884 667 A 54 ARG HA A 49 VAL HB 1.0 1.8 5.0 885 668 A 49 VAL HB A 54 ARG HGx 1.0 1.8 5.0 886 668 A 54 ARG HGy A 49 VAL HB 1.0 1.8 5.0 887 669 A 49 VAL HG1% A 50 PRO HDy 1.0 1.8 5.0 888 670 A 49 VAL HG1% A 50 PRO HDx 1.0 1.8 5.0 889 671 A 49 VAL HG1% A 53 SER HBx 1.0 1.8 5.0 890 671 A 49 VAL HG1% A 53 SER HBy 1.0 1.8 5.0 891 672 A 49 VAL HG1% A 53 SER H 1.0 1.8 5.0 892 673 A 54 ARG HA A 49 VAL HG1% 1.0 1.8 5.0 893 674 A 49 VAL HG1% A 54 ARG HBx 1.0 1.8 5.0 894 674 A 54 ARG HBy A 49 VAL HG1% 1.0 1.8 5.0 895 675 A 49 VAL HG1% A 54 ARG HGx 1.0 1.8 5.0 896 675 A 54 ARG HGy A 49 VAL HG1% 1.0 1.8 5.0 897 676 A 49 VAL HG1% A 54 ARG H 1.0 1.8 5.0 898 677 A 57 VAL HB A 49 VAL HG1% 1.0 1.8 5.0 899 678 A 49 VAL HG2% A 50 PRO HDy 1.0 1.8 5.0 900 678 A 49 VAL HG2% A 50 PRO HDx 1.0 1.8 5.0 901 679 A 54 ARG HA A 49 VAL HG2% 1.0 1.8 5.0 902 680 A 49 VAL H A 50 PRO HDy 1.0 1.8 5.0 903 680 A 49 VAL H A 50 PRO HDx 1.0 1.8 5.0 904 681 A 49 VAL H A 54 ARG HE 1.0 1.8 5.0 905 682 A 50 PRO HA A 51 SER H 1.0 1.8 3.5 906 683 A 50 PRO HA A 52 GLU H 1.0 1.8 5.0 907 684 A 52 GLU H A 50 PRO HBy 1.0 1.8 5.0 908 685 A 50 PRO HBy A 53 SER HBx 1.0 1.8 5.0 909 685 A 53 SER HBy A 50 PRO HBx 1.0 1.8 5.0 910 685 A 53 SER HBy A 50 PRO HBy 1.0 1.8 5.0 911 685 A 50 PRO HBx A 53 SER HBx 1.0 1.8 5.0 912 686 A 52 GLU H A 50 PRO HBx 1.0 1.8 5.0 913 687 A 53 SER H A 50 PRO HBx 1.0 1.8 5.0 914 687 A 53 SER H A 50 PRO HBy 1.0 1.8 5.0 915 688 A 53 SER HBy A 50 PRO HDy 1.0 1.8 5.0 916 688 A 50 PRO HDy A 53 SER HBx 1.0 1.8 5.0 917 689 A 53 SER HBy A 50 PRO HDx 1.0 1.8 5.0 918 689 A 50 PRO HDx A 53 SER HBx 1.0 1.8 5.0 919 690 A 50 PRO HGy A 53 SER HBx 1.0 1.8 5.0 920 690 A 50 PRO HGx A 53 SER HBx 1.0 1.8 5.0 921 690 A 53 SER HBy A 50 PRO HGx 1.0 1.8 5.0 922 690 A 53 SER HBy A 50 PRO HGy 1.0 1.8 5.0 923 691 A 53 SER H A 51 SER HA 1.0 1.8 5.0 924 692 A 51 SER HA A 54 ARG HDy 1.0 1.8 5.0 925 692 A 54 ARG HDx A 51 SER HA 1.0 1.8 5.0 926 693 A 54 ARG HE A 51 SER HA 1.0 1.8 5.0 927 694 A 51 SER HA A 54 ARG HH1% 1.0 1.8 5.0 928 694 A 51 SER HA A 54 ARG HH2% 1.0 1.8 5.0 929 695 A 54 ARG H A 51 SER HA 1.0 1.8 5.0 930 696 A 53 SER H A 51 SER HBx 1.0 1.8 5.0 931 696 A 51 SER HBy A 53 SER H 1.0 1.8 5.0 932 697 A 51 SER HBx A 54 ARG HBx 1.0 1.8 5.0 933 697 A 51 SER HBy A 54 ARG HBx 1.0 1.8 5.0 934 697 A 54 ARG HBy A 51 SER HBx 1.0 1.8 5.0 935 697 A 51 SER HBy A 54 ARG HBy 1.0 1.8 5.0 936 698 A 54 ARG HE A 51 SER HBx 1.0 1.8 5.0 937 698 A 51 SER HBy A 54 ARG HE 1.0 1.8 5.0 938 699 A 54 ARG H A 51 SER HBx 1.0 1.8 5.0 939 699 A 51 SER HBy A 54 ARG H 1.0 1.8 5.0 940 700 A 51 SER H A 52 GLU H 1.0 1.8 3.5 941 701 A 53 SER H A 51 SER H 1.0 1.8 5.0 942 702 A 51 SER H A 54 ARG HDy 1.0 1.8 5.0 943 702 A 54 ARG HDx A 51 SER H 1.0 1.8 5.0 944 703 A 54 ARG HE A 51 SER H 1.0 1.8 5.0 945 704 A 51 SER H A 54 ARG HH1% 1.0 1.8 5.0 946 704 A 51 SER H A 54 ARG HH2% 1.0 1.8 5.0 947 705 A 54 ARG H A 52 GLU HA 1.0 1.8 5.0 948 706 A 55 GLN H A 52 GLU HA 1.0 1.8 5.0 949 707 A 53 SER H A 52 GLU H 1.0 1.8 3.5 950 708 A 54 ARG H A 52 GLU H 1.0 1.8 5.0 951 709 A 53 SER HA A 56 ALA HB% 1.0 1.8 5.0 952 710 A 53 SER HA A 56 ALA H 1.0 1.8 5.0 953 711 A 57 VAL HG2% A 53 SER HA 1.0 1.8 5.0 954 712 A 53 SER HA A 57 VAL H 1.0 1.8 5.0 955 713 A 56 ALA HB% A 53 SER HBx 1.0 1.8 5.0 956 713 A 53 SER HBy A 56 ALA HB% 1.0 1.8 5.0 957 714 A 57 VAL HG2% A 53 SER HBx 1.0 1.8 5.0 958 714 A 57 VAL HG2% A 53 SER HBy 1.0 1.8 5.0 959 715 A 57 VAL H A 53 SER HBx 1.0 1.8 5.0 960 715 A 53 SER HBy A 57 VAL H 1.0 1.8 5.0 961 716 A 53 SER H A 54 ARG HBx 1.0 1.8 5.0 962 716 A 54 ARG HBy A 53 SER H 1.0 1.8 5.0 963 717 A 54 ARG H A 53 SER H 1.0 1.8 2.9 964 718 A 55 GLN H A 53 SER H 1.0 1.8 5.0 965 719 A 54 ARG HA A 56 ALA H 1.0 1.8 5.0 966 720 A 54 ARG HA A 57 VAL HG1% 1.0 1.8 5.0 967 721 A 54 ARG HA A 57 VAL HG2% 1.0 1.8 5.0 968 722 A 54 ARG HA A 57 VAL H 1.0 1.8 5.0 969 723 A 54 ARG HA A 58 ALA H 1.0 1.8 5.0 970 724 A 55 GLN H A 54 ARG H 1.0 1.8 3.5 971 725 A 54 ARG H A 56 ALA H 1.0 1.8 5.0 972 726 A 55 GLN HA A 58 ALA HB% 1.0 1.8 5.0 973 727 A 55 GLN HA A 58 ALA H 1.0 1.8 5.0 974 728 A 58 ALA HB% A 55 GLN HGx 1.0 1.8 5.0 975 728 A 55 GLN HGy A 58 ALA HB% 1.0 1.8 5.0 976 729 A 55 GLN H A 56 ALA HB% 1.0 1.8 5.0 977 730 A 55 GLN H A 56 ALA H 1.0 1.8 3.5 978 731 A 55 GLN H A 57 VAL H 1.0 1.8 5.0 979 732 A 58 ALA H A 56 ALA HA 1.0 1.8 5.0 980 733 A 56 ALA HA A 59 GLU HBx 1.0 1.8 5.0 981 733 A 56 ALA HA A 59 GLU HBy 1.0 1.8 5.0 982 734 A 56 ALA HA A 59 GLU H 1.0 1.8 5.0 983 735 A 56 ALA HA A 60 GLN H 1.0 1.8 5.0 984 736 A 57 VAL HG2% A 56 ALA HB% 1.0 1.8 5.0 985 737 A 56 ALA HB% A 59 GLU HBx 1.0 1.8 5.0 986 737 A 56 ALA HB% A 59 GLU HBy 1.0 1.8 5.0 987 738 A 56 ALA HB% A 59 GLU HGx 1.0 1.8 5.0 988 738 A 56 ALA HB% A 59 GLU HGy 1.0 1.8 5.0 989 739 A 56 ALA HB% A 60 GLN HBx 1.0 1.8 5.0 990 739 A 56 ALA HB% A 60 GLN HBy 1.0 1.8 5.0 991 740 A 56 ALA HB% A 60 GLN HE22 1.0 1.8 5.0 992 740 A 56 ALA HB% A 60 GLN HE21 1.0 1.8 5.0 993 741 A 56 ALA H A 57 VAL H 1.0 1.8 3.5 994 742 A 59 GLU H A 57 VAL HA 1.0 1.8 5.0 995 743 A 57 VAL HA A 60 GLN HBx 1.0 1.8 5.0 996 743 A 60 GLN HBy A 57 VAL HA 1.0 1.8 5.0 997 744 A 57 VAL HA A 60 GLN HGx 1.0 1.8 5.0 998 744 A 57 VAL HA A 60 GLN HGy 1.0 1.8 5.0 999 745 A 60 GLN H A 57 VAL HA 1.0 1.8 5.0 1000 746 A 57 VAL HA A 61 PHE H 1.0 1.8 5.0 1001 747 A 58 ALA HB% A 57 VAL HG1% 1.0 1.8 5.0 1002 748 A 57 VAL HG1% A 60 GLN HBx 1.0 1.8 5.0 1003 748 A 57 VAL HG1% A 60 GLN HBy 1.0 1.8 5.0 1004 749 A 57 VAL HG1% A 61 PHE H 1.0 1.8 5.0 1005 750 A 58 ALA H A 57 VAL H 1.0 1.8 3.5 1006 751 A 57 VAL H A 59 GLU H 1.0 1.8 5.0 1007 752 A 58 ALA HA A 61 PHE HBx 1.0 1.8 5.0 1008 752 A 58 ALA HA A 61 PHE HBy 1.0 1.8 5.0 1009 753 A 61 PHE H A 58 ALA HA 1.0 1.8 5.0 1010 754 A 58 ALA HA A 62 ALA H 1.0 1.8 5.0 1011 755 A 58 ALA HB% A 60 GLN H 1.0 1.8 5.0 1012 756 A 58 ALA HB% A 61 PHE HBx 1.0 1.8 5.0 1013 756 A 58 ALA HB% A 61 PHE HBy 1.0 1.8 5.0 1014 757 A 58 ALA HB% A 62 ALA HB% 1.0 1.8 5.0 1015 758 A 58 ALA HB% A 62 ALA H 1.0 1.8 5.0 1016 759 A 58 ALA H A 59 GLU HBx 1.0 1.8 5.0 1017 759 A 58 ALA H A 59 GLU HBy 1.0 1.8 5.0 1018 760 A 58 ALA H A 59 GLU H 1.0 1.8 3.5 1019 761 A 62 ALA HB% A 59 GLU HA 1.0 1.8 5.0 1020 762 A 62 ALA H A 59 GLU HA 1.0 1.8 5.0 1021 763 A 59 GLU HA A 63 LYS H 1.0 1.8 5.0 1022 764 A 62 ALA HB% A 59 GLU HBx 1.0 1.8 5.0 1023 764 A 62 ALA HB% A 59 GLU HBy 1.0 1.8 5.0 1024 765 A 59 GLU HBy A 63 LYS HEx 1.0 1.8 5.0 1025 765 A 59 GLU HBx A 63 LYS HEx 1.0 1.8 5.0 1026 765 A 63 LYS HEy A 59 GLU HBx 1.0 1.8 5.0 1027 765 A 59 GLU HBy A 63 LYS HEy 1.0 1.8 5.0 1028 766 A 62 ALA HB% A 59 GLU HGx 1.0 1.8 5.0 1029 766 A 62 ALA HB% A 59 GLU HGy 1.0 1.8 5.0 1030 767 A 59 GLU H A 60 GLN H 1.0 1.8 3.5 1031 768 A 59 GLU H A 61 PHE H 1.0 1.8 5.0 1032 769 A 62 ALA H A 60 GLN HA 1.0 1.8 5.0 1033 770 A 60 GLN HA A 63 LYS HDx 1.0 1.8 5.0 1034 770 A 60 GLN HA A 63 LYS HDy 1.0 1.8 5.0 1035 771 A 63 LYS H A 60 GLN HA 1.0 1.8 5.0 1036 772 A 60 GLN HA A 64 ALA H 1.0 1.8 5.0 1037 773 A 62 ALA H A 60 GLN HBx 1.0 1.8 5.0 1038 773 A 60 GLN HBy A 62 ALA H 1.0 1.8 5.0 1039 774 A 63 LYS H A 60 GLN HBx 1.0 1.8 5.0 1040 774 A 60 GLN HBy A 63 LYS H 1.0 1.8 5.0 1041 775 A 60 GLN H A 61 PHE HBx 1.0 1.8 5.0 1042 775 A 60 GLN H A 61 PHE HBy 1.0 1.8 5.0 1043 776 A 60 GLN H A 62 ALA H 1.0 1.8 5.0 1044 777 A 61 PHE HA A 64 ALA HB% 1.0 1.8 5.0 1045 778 A 64 ALA H A 61 PHE HA 1.0 1.8 5.0 1046 779 A 61 PHE HA A 65 LEU H 1.0 1.8 5.0 1047 780 A 61 PHE HD% A 65 LEU HBx 1.0 1.8 5.0 1048 780 A 61 PHE HD% A 65 LEU HBy 1.0 1.8 5.0 1049 781 A 61 PHE HD% A 65 LEU HD1% 1.0 1.8 5.0 1050 782 A 61 PHE HE% A 64 ALA HB% 1.0 1.8 5.0 1051 783 A 61 PHE HE% A 65 LEU HD1% 1.0 1.8 5.0 1052 784 A 62 ALA HB% A 61 PHE H 1.0 1.8 5.0 1053 785 A 61 PHE H A 62 ALA H 1.0 1.8 3.5 1054 786 A 61 PHE H A 64 ALA H 1.0 1.8 5.0 1055 787 A 61 PHE HZ A 65 LEU HD1% 1.0 1.8 5.0 1056 788 A 62 ALA HA A 65 LEU HBx 1.0 1.8 5.0 1057 788 A 65 LEU HBy A 62 ALA HA 1.0 1.8 5.0 1058 789 A 65 LEU HD1% A 62 ALA HA 1.0 1.8 5.0 1059 790 A 65 LEU HD2% A 62 ALA HA 1.0 1.8 5.0 1060 791 A 65 LEU H A 62 ALA HA 1.0 1.8 5.0 1061 792 A 62 ALA HA A 66 ALA H 1.0 1.8 5.0 1062 793 A 62 ALA HB% A 65 LEU HBx 1.0 1.8 5.0 1063 793 A 62 ALA HB% A 65 LEU HBy 1.0 1.8 5.0 1064 794 A 62 ALA HB% A 65 LEU HD2% 1.0 1.8 5.0 1065 795 A 62 ALA H A 63 LYS H 1.0 1.8 3.5 1066 796 A 62 ALA H A 64 ALA H 1.0 1.8 5.0 1067 797 A 66 ALA HB% A 63 LYS HA 1.0 1.8 5.0 1068 798 A 66 ALA H A 63 LYS HA 1.0 1.8 5.0 1069 799 A 63 LYS HA A 67 GLN H 1.0 1.8 5.0 1070 800 A 63 LYS H A 64 ALA HB% 1.0 1.8 5.0 1071 801 A 63 LYS H A 64 ALA H 1.0 1.8 3.5 1072 802 A 63 LYS H A 65 LEU H 1.0 1.8 5.0 1073 803 A 64 ALA HA A 67 GLN HBx 1.0 1.8 5.0 1074 803 A 64 ALA HA A 67 GLN HBy 1.0 1.8 5.0 1075 804 A 67 GLN H A 64 ALA HA 1.0 1.8 5.0 1076 805 A 68 SER H A 64 ALA HA 1.0 1.8 5.0 1077 806 A 64 ALA H A 65 LEU H 1.0 1.8 3.5 1078 807 A 65 LEU HA A 68 SER H 1.0 1.8 5.0 1079 808 A 68 SER H A 65 LEU HBx 1.0 1.8 5.0 1080 808 A 65 LEU HBy A 68 SER H 1.0 1.8 5.0 1081 809 A 65 LEU HD1% A 69 VAL HG2% 1.0 1.8 5.0 1082 810 A 65 LEU H A 66 ALA H 1.0 1.8 3.5 1083 811 A 65 LEU H A 67 GLN H 1.0 1.8 5.0 1084 812 A 66 ALA HA A 69 VAL HB 1.0 1.8 5.0 1085 813 A 69 VAL HG2% A 66 ALA HA 1.0 1.8 5.0 1086 814 A 66 ALA HA A 69 VAL H 1.0 1.8 5.0 1087 815 A 66 ALA HA A 70 LYS H 1.0 1.8 5.0 1088 816 A 69 VAL HB A 66 ALA HB% 1.0 1.8 5.0 1089 817 A 66 ALA HB% A 70 LYS HBx 1.0 1.8 5.0 1090 817 A 66 ALA HB% A 70 LYS HBy 1.0 1.8 5.0 1091 818 A 68 SER H A 66 ALA H 1.0 1.8 5.0 1092 819 A 67 GLN HA A 70 LYS HDx 1.0 1.8 5.0 1093 819 A 67 GLN HA A 70 LYS HDy 1.0 1.8 5.0 1094 820 A 70 LYS H A 67 GLN HA 1.0 1.8 5.0 1095 821 A 67 GLN H A 69 VAL H 1.0 1.8 5.0 1096 822 A 70 LYS H A 68 SER HA 1.0 1.8 5.0 1097 823 A 68 SER H A 69 VAL HB 1.0 1.8 5.0 1098 824 A 68 SER H A 69 VAL HG2% 1.0 1.8 5.0 1099 825 A 68 SER H A 69 VAL H 1.0 1.8 3.5 1100 826 A 68 SER H A 70 LYS H 1.0 1.8 5.0 1101 827 A 69 VAL HA A 72 ASN HBx 1.0 1.8 5.0 1102 827 A 69 VAL HA A 72 ASN HBy 1.0 1.8 5.0 1103 828 A 69 VAL HA A 72 ASN HD22 1.0 1.8 5.0 1104 828 A 69 VAL HA A 72 ASN HD21 1.0 1.8 5.0 1105 829 A 69 VAL H A 70 LYS HBx 1.0 1.8 5.0 1106 829 A 69 VAL H A 70 LYS HBy 1.0 1.8 5.0 1107 830 A 69 VAL H A 71 SER H 1.0 1.8 5.0 1108 831 A 70 LYS HA A 73 LEU HBx 1.0 1.8 5.0 1109 831 A 70 LYS HA A 73 LEU HBy 1.0 1.8 5.0 1110 832 A 70 LYS HA A 73 LEU HD1% 1.0 1.8 5.0 1111 833 A 71 SER HA A 74 GLU HBx 1.0 1.8 5.0 1112 833 A 71 SER HA A 74 GLU HBy 1.0 1.8 5.0 1113 834 A 71 SER H A 72 ASN HBx 1.0 1.8 5.0 1114 834 A 72 ASN HBy A 71 SER H 1.0 1.8 5.0 1115 835 A 72 ASN H A 73 LEU HBx 1.0 1.8 5.0 1116 835 A 73 LEU HBy A 72 ASN H 1.0 1.8 5.0 1117 836 B 5 SER HA B 7 TYR H 1.0 1.8 5.0 1118 837 B 7 TYR H B 5 SER HBx 1.0 1.8 5.0 1119 837 B 7 TYR H B 5 SER HBy 1.0 1.8 5.0 1120 838 B 7 TYR HD% B 6 LYS HBx 1.0 1.8 5.0 1121 838 B 7 TYR HD% B 6 LYS HBy 1.0 1.8 5.0 1122 839 B 7 TYR HE% B 6 LYS HBx 1.0 1.8 5.0 1123 839 B 7 TYR HE% B 6 LYS HBy 1.0 1.8 5.0 1124 840 B 7 TYR HD% B 6 LYS HDx 1.0 1.8 5.0 1125 840 B 7 TYR HD% B 6 LYS HDy 1.0 1.8 5.0 1126 841 B 7 TYR HD% B 6 LYS HEx 1.0 1.8 5.0 1127 841 B 7 TYR HD% B 6 LYS HEy 1.0 1.8 5.0 1128 842 B 12 VAL HG21 B 7 TYR HBy 1.0 1.8 5.0 1129 843 B 12 VAL HG21 B 7 TYR HBx 1.0 1.8 5.0 1130 844 B 7 TYR HBx B 11 GLN HBx 1.0 1.8 5.0 1131 844 B 7 TYR HBy B 11 GLN HBx 1.0 1.8 5.0 1132 844 B 11 GLN HBy B 7 TYR HBy 1.0 1.8 5.0 1133 844 B 11 GLN HBy B 7 TYR HBx 1.0 1.8 5.0 1134 845 B 7 TYR HD% B 11 GLN HBx 1.0 1.8 5.0 1135 845 B 7 TYR HD% B 11 GLN HBy 1.0 1.8 5.0 1136 846 B 7 TYR HD% B 12 VAL HG21 1.0 1.8 5.0 1137 847 B 7 TYR HE% B 12 VAL HG21 1.0 1.8 5.0 1138 848 B 8 SER HA B 11 GLN H 1.0 1.8 5.0 1139 849 B 8 SER HA B 9 ASN H 1.0 1.8 3.5 1140 850 B 10 THR H B 8 SER HBx 1.0 1.8 5.0 1141 850 B 8 SER HBy B 10 THR H 1.0 1.8 5.0 1142 851 B 11 GLN H B 8 SER HBx 1.0 1.8 5.0 1143 851 B 11 GLN H B 8 SER HBy 1.0 1.8 5.0 1144 852 B 8 SER H B 11 GLN HBx 1.0 1.8 5.0 1145 852 B 11 GLN HBy B 8 SER H 1.0 1.8 5.0 1146 853 B 8 SER H B 11 GLN HGx 1.0 1.8 5.0 1147 853 B 11 GLN HGy B 8 SER H 1.0 1.8 5.0 1148 854 B 11 GLN H B 8 SER H 1.0 1.8 5.0 1149 855 B 12 VAL HG21 B 8 SER H 1.0 1.8 5.0 1150 856 B 11 GLN H B 9 ASN HA 1.0 1.8 5.0 1151 857 B 9 ASN HA B 12 VAL HB 1.0 1.8 5.0 1152 858 B 12 VAL HG11 B 9 ASN HA 1.0 1.8 5.0 1153 859 B 12 VAL HG21 B 9 ASN HA 1.0 1.8 5.0 1154 860 B 12 VAL H B 9 ASN HA 1.0 1.8 5.0 1155 861 B 9 ASN HA B 13 GLU H 1.0 1.8 5.0 1156 862 B 9 ASN H B 10 THR H 1.0 1.8 3.5 1157 863 B 11 GLN H B 9 ASN H 1.0 1.8 5.0 1158 864 B 10 THR HA B 13 GLU HBx 1.0 1.8 5.0 1159 864 B 10 THR HA B 13 GLU HBy 1.0 1.8 5.0 1160 865 B 10 THR HA B 13 GLU HGx 1.0 1.8 5.0 1161 865 B 10 THR HA B 13 GLU HGy 1.0 1.8 5.0 1162 866 B 13 GLU H B 10 THR HA 1.0 1.8 5.0 1163 867 B 10 THR HG21 B 14 SER H 1.0 1.8 5.0 1164 868 B 10 THR H B 11 GLN HBx 1.0 1.8 5.0 1165 868 B 11 GLN HBy B 10 THR H 1.0 1.8 5.0 1166 869 B 11 GLN H B 10 THR H 1.0 1.8 3.5 1167 870 B 10 THR H B 13 GLU H 1.0 1.8 5.0 1168 871 B 14 SER H B 11 GLN HA 1.0 1.8 5.0 1169 872 B 15 LEU HD11 B 11 GLN HGx 1.0 1.8 5.0 1170 872 B 11 GLN HGy B 15 LEU HD11 1.0 1.8 5.0 1171 873 B 12 VAL HG21 B 11 GLN H 1.0 1.8 5.0 1172 874 B 11 GLN H B 13 GLU H 1.0 1.8 5.0 1173 875 B 12 VAL HA B 14 SER H 1.0 1.8 5.0 1174 876 B 12 VAL HA B 15 LEU HBx 1.0 1.8 5.0 1175 876 B 12 VAL HA B 15 LEU HBy 1.0 1.8 5.0 1176 877 B 12 VAL HA B 15 LEU HD11 1.0 1.8 5.0 1177 878 B 12 VAL HA B 15 LEU HD21 1.0 1.8 5.0 1178 879 B 12 VAL HA B 15 LEU H 1.0 1.8 5.0 1179 880 B 12 VAL HA B 16 ILE H 1.0 1.8 5.0 1180 881 B 12 VAL HG11 B 15 LEU H 1.0 1.8 5.0 1181 882 B 12 VAL HG11 B 16 ILE HD11 1.0 1.8 5.0 1182 883 B 12 VAL HG11 B 16 ILE HG1y 1.0 1.8 5.0 1183 883 B 12 VAL HG11 B 16 ILE HG1x 1.0 1.8 5.0 1184 884 B 12 VAL HG11 B 16 ILE H 1.0 1.8 5.0 1185 885 B 12 VAL HG21 B 16 ILE HD11 1.0 1.8 5.0 1186 886 B 12 VAL H B 13 GLU H 1.0 1.8 3.5 1187 887 B 12 VAL H B 14 SER H 1.0 1.8 5.0 1188 888 B 12 VAL H B 15 LEU H 1.0 1.8 5.0 1189 889 B 13 GLU HA B 16 ILE HB 1.0 1.8 5.0 1190 890 B 16 ILE HD11 B 13 GLU HA 1.0 1.8 5.0 1191 891 B 16 ILE H B 13 GLU HA 1.0 1.8 5.0 1192 892 B 13 GLU HA B 17 ALA H 1.0 1.8 5.0 1193 893 B 15 LEU H B 13 GLU HBx 1.0 1.8 5.0 1194 893 B 13 GLU HBy B 15 LEU H 1.0 1.8 5.0 1195 894 B 16 ILE HG21 B 13 GLU HGx 1.0 1.8 5.0 1196 894 B 16 ILE HG21 B 13 GLU HGy 1.0 1.8 5.0 1197 895 B 13 GLU H B 14 SER H 1.0 1.8 3.5 1198 896 B 13 GLU H B 15 LEU H 1.0 1.8 5.0 1199 897 B 14 SER HA B 17 ALA HB1 1.0 1.8 5.0 1200 898 B 17 ALA H B 14 SER HA 1.0 1.8 5.0 1201 899 B 18 GLU H B 14 SER HA 1.0 1.8 5.0 1202 900 B 17 ALA HB1 B 14 SER HBx 1.0 1.8 5.0 1203 900 B 17 ALA HB1 B 14 SER HBy 1.0 1.8 5.0 1204 901 B 14 SER H B 15 LEU H 1.0 1.8 3.5 1205 902 B 14 SER H B 17 ALA HB1 1.0 1.8 5.0 1206 903 B 15 LEU HA B 17 ALA H 1.0 1.8 5.0 1207 904 B 15 LEU HA B 18 GLU HBx 1.0 1.8 5.0 1208 904 B 15 LEU HA B 18 GLU HBy 1.0 1.8 5.0 1209 905 B 15 LEU HA B 18 GLU H 1.0 1.8 5.0 1210 906 B 15 LEU HA B 19 ILE H 1.0 1.8 5.0 1211 907 B 19 ILE HD11 B 15 LEU HBx 1.0 1.8 5.0 1212 907 B 19 ILE HD11 B 15 LEU HBy 1.0 1.8 5.0 1213 908 B 15 LEU H B 16 ILE HB 1.0 1.8 5.0 1214 909 B 15 LEU H B 16 ILE HG1y 1.0 1.8 5.0 1215 909 B 16 ILE HG1x B 15 LEU H 1.0 1.8 5.0 1216 910 B 15 LEU H B 16 ILE H 1.0 1.8 3.5 1217 911 B 15 LEU H B 17 ALA H 1.0 1.8 5.0 1218 912 B 16 ILE HA B 18 GLU H 1.0 1.8 5.0 1219 913 B 16 ILE HA B 19 ILE HB 1.0 1.8 5.0 1220 914 B 16 ILE HA B 19 ILE HD11 1.0 1.8 5.0 1221 915 B 16 ILE HA B 19 ILE HG21 1.0 1.8 5.0 1222 916 B 16 ILE HA B 19 ILE H 1.0 1.8 5.0 1223 917 B 16 ILE HA B 20 LEU H 1.0 1.8 5.0 1224 918 B 16 ILE HG21 B 20 LEU HD11 1.0 1.8 5.0 1225 919 B 16 ILE HG21 B 20 LEU HD21 1.0 1.8 5.0 1226 920 B 16 ILE HG21 B 20 LEU HG 1.0 1.8 5.0 1227 921 B 18 GLU H B 16 ILE H 1.0 1.8 5.0 1228 922 B 17 ALA HA B 20 LEU HBx 1.0 1.8 5.0 1229 922 B 17 ALA HA B 20 LEU HBy 1.0 1.8 5.0 1230 923 B 20 LEU HD11 B 17 ALA HA 1.0 1.8 5.0 1231 924 B 20 LEU H B 17 ALA HA 1.0 1.8 5.0 1232 925 B 17 ALA H B 18 GLU HBx 1.0 1.8 5.0 1233 925 B 18 GLU HBy B 17 ALA H 1.0 1.8 5.0 1234 926 B 18 GLU H B 17 ALA H 1.0 1.8 3.5 1235 927 B 18 GLU HA B 21 VAL HB 1.0 1.8 5.0 1236 928 B 18 GLU HA B 21 VAL HG11 1.0 1.8 5.0 1237 929 B 18 GLU HA B 21 VAL H 1.0 1.8 5.0 1238 930 B 18 GLU HA B 22 VAL H 1.0 1.8 5.0 1239 931 B 18 GLU H B 19 ILE HD11 1.0 1.8 5.0 1240 932 B 18 GLU H B 19 ILE H 1.0 1.8 3.5 1241 933 B 18 GLU H B 20 LEU H 1.0 1.8 5.0 1242 934 B 21 VAL H B 19 ILE HA 1.0 1.8 5.0 1243 935 B 22 VAL HB B 19 ILE HA 1.0 1.8 5.0 1244 936 B 22 VAL HG21 B 19 ILE HA 1.0 1.8 5.0 1245 937 B 22 VAL H B 19 ILE HA 1.0 1.8 5.0 1246 938 B 19 ILE H B 20 LEU H 1.0 1.8 3.5 1247 939 B 19 ILE H B 21 VAL H 1.0 1.8 5.0 1248 940 B 22 VAL HG21 B 19 ILE H 1.0 1.8 5.0 1249 941 B 20 LEU HA B 23 LEU HBy 1.0 1.8 5.0 1250 941 B 20 LEU HA B 23 LEU HBx 1.0 1.8 5.0 1251 942 B 23 LEU H B 20 LEU HA 1.0 1.8 5.0 1252 943 B 20 LEU H B 21 VAL HG21 1.0 1.8 5.0 1253 943 B 20 LEU H B 21 VAL HG11 1.0 1.8 5.0 1254 944 B 20 LEU H B 21 VAL H 1.0 1.8 3.5 1255 945 B 20 LEU H B 22 VAL H 1.0 1.8 5.0 1256 946 B 21 VAL HA B 24 GLU HBx 1.0 1.8 5.0 1257 946 B 21 VAL HA B 24 GLU HBy 1.0 1.8 5.0 1258 947 B 21 VAL HA B 24 GLU HGx 1.0 1.8 5.0 1259 947 B 21 VAL HA B 24 GLU HGy 1.0 1.8 5.0 1260 948 B 21 VAL HA B 24 GLU H 1.0 1.8 5.0 1261 949 B 21 VAL HA B 25 LYS H 1.0 1.8 5.0 1262 950 B 21 VAL HG11 B 24 GLU HBy 1.0 1.8 5.0 1263 950 B 21 VAL HG11 B 24 GLU HBx 1.0 1.8 5.0 1264 951 B 21 VAL HG11 B 25 LYS HBy 1.0 1.8 5.0 1265 951 B 21 VAL HG11 B 25 LYS HBx 1.0 1.8 5.0 1266 952 B 21 VAL HG11 B 25 LYS HDy 1.0 1.8 5.0 1267 952 B 21 VAL HG11 B 25 LYS HDx 1.0 1.8 5.0 1268 953 B 21 VAL HG11 B 25 LYS HEy 1.0 1.8 5.0 1269 953 B 21 VAL HG11 B 25 LYS HEx 1.0 1.8 5.0 1270 954 B 21 VAL HG11 B 25 LYS HGy 1.0 1.8 5.0 1271 954 B 21 VAL HG11 B 25 LYS HGx 1.0 1.8 5.0 1272 955 B 24 GLU HBy B 21 VAL HG21 1.0 1.8 5.0 1273 955 B 21 VAL HG21 B 24 GLU HBx 1.0 1.8 5.0 1274 956 B 25 LYS H B 21 VAL HG21 1.0 1.8 5.0 1275 956 B 21 VAL HG11 B 25 LYS H 1.0 1.8 5.0 1276 957 B 22 VAL HG21 B 21 VAL H 1.0 1.8 5.0 1277 958 B 21 VAL H B 22 VAL H 1.0 1.8 3.5 1278 959 B 22 VAL HA B 25 LYS HBx 1.0 1.8 5.0 1279 959 B 25 LYS HBy B 22 VAL HA 1.0 1.8 5.0 1280 960 B 22 VAL HA B 25 LYS HDx 1.0 1.8 5.0 1281 960 B 25 LYS HDy B 22 VAL HA 1.0 1.8 5.0 1282 961 B 25 LYS H B 22 VAL HA 1.0 1.8 5.0 1283 962 B 22 VAL HA B 26 HIS H 1.0 1.8 5.0 1284 963 B 22 VAL HG11 B 25 LYS HBx 1.0 1.8 5.0 1285 963 B 22 VAL HG11 B 25 LYS HBy 1.0 1.8 5.0 1286 964 B 22 VAL HG11 B 26 HIS HD2 1.0 1.8 5.0 1287 965 B 22 VAL HG21 B 25 LYS HDx 1.0 1.8 5.0 1288 965 B 22 VAL HG21 B 25 LYS HDy 1.0 1.8 5.0 1289 966 B 22 VAL HG21 B 25 LYS HEx 1.0 1.8 5.0 1290 966 B 22 VAL HG21 B 25 LYS HEy 1.0 1.8 5.0 1291 967 B 22 VAL H B 23 LEU HBy 1.0 1.8 5.0 1292 967 B 22 VAL H B 23 LEU HBx 1.0 1.8 5.0 1293 968 B 23 LEU HG B 22 VAL H 1.0 1.8 5.0 1294 969 B 22 VAL H B 24 GLU H 1.0 1.8 5.0 1295 970 B 25 LYS H B 23 LEU HA 1.0 1.8 5.0 1296 971 B 26 HIS HD2 B 23 LEU HA 1.0 1.8 5.0 1297 972 B 26 HIS H B 23 LEU HA 1.0 1.8 5.0 1298 973 B 23 LEU HA B 27 LYS H 1.0 1.8 5.0 1299 974 B 28 ALA HB1 B 23 LEU HA 1.0 1.8 5.0 1300 975 B 28 ALA HB1 B 23 LEU HBy 1.0 1.8 5.0 1301 976 B 28 ALA HB1 B 23 LEU HBx 1.0 1.8 5.0 1302 977 B 28 ALA HB1 B 23 LEU HBy 1.0 1.8 5.0 1303 977 B 28 ALA HB1 B 23 LEU HBx 1.0 1.8 5.0 1304 978 B 28 ALA H B 23 LEU HBy 1.0 1.8 5.0 1305 978 B 23 LEU HBx B 28 ALA H 1.0 1.8 5.0 1306 979 B 28 ALA HB1 B 23 LEU HD11 1.0 1.8 5.0 1307 980 B 33 SER HA B 23 LEU HD11 1.0 1.8 5.0 1308 981 B 23 LEU HD11 B 33 SER HBy 1.0 1.8 5.0 1309 982 B 23 LEU HD11 B 33 SER HBx 1.0 1.8 5.0 1310 983 B 36 ALA HB1 B 23 LEU HD11 1.0 1.8 5.0 1311 984 B 23 LEU HD11 B 37 LEU HD11 1.0 1.8 5.0 1312 985 B 23 LEU HD11 B 37 LEU HG 1.0 1.8 5.0 1313 986 B 28 ALA HB1 B 23 LEU HD21 1.0 1.8 5.0 1314 987 B 23 LEU HD21 B 28 ALA H 1.0 1.8 5.0 1315 988 B 33 SER HA B 23 LEU HD21 1.0 1.8 5.0 1316 989 B 23 LEU HD21 B 33 SER HBx 1.0 1.8 5.0 1317 989 B 23 LEU HD21 B 33 SER HBy 1.0 1.8 5.0 1318 990 B 36 ALA HB1 B 23 LEU HD21 1.0 1.8 5.0 1319 991 B 23 LEU H B 24 GLU H 1.0 1.8 3.5 1320 992 B 23 LEU H B 25 LYS H 1.0 1.8 5.0 1321 993 B 26 HIS H B 24 GLU HA 1.0 1.8 5.0 1322 994 B 28 ALA H B 24 GLU HA 1.0 1.8 5.0 1323 995 B 26 HIS H B 24 GLU HBx 1.0 1.8 5.0 1324 995 B 24 GLU HBy B 26 HIS H 1.0 1.8 5.0 1325 996 B 24 GLU H B 25 LYS H 1.0 1.8 3.5 1326 997 B 24 GLU H B 26 HIS H 1.0 1.8 5.0 1327 998 B 27 LYS H B 25 LYS HA 1.0 1.8 5.0 1328 999 B 26 HIS HD2 B 25 LYS HBx 1.0 1.8 5.0 1329 999 B 26 HIS HD2 B 25 LYS HBy 1.0 1.8 5.0 1330 1000 B 27 LYS H B 25 LYS HBx 1.0 1.8 5.0 1331 1000 B 25 LYS HBy B 27 LYS H 1.0 1.8 5.0 1332 1001 B 25 LYS H B 26 HIS H 1.0 1.8 3.5 1333 1002 B 25 LYS H B 27 LYS H 1.0 1.8 5.0 1334 1003 B 28 ALA H B 26 HIS HBy 1.0 1.8 5.0 1335 1004 B 26 HIS HBx B 28 ALA H 1.0 1.8 5.0 1336 1005 B 28 ALA HB1 B 26 HIS HBy 1.0 1.8 5.0 1337 1005 B 26 HIS HBx B 28 ALA HB1 1.0 1.8 5.0 1338 1006 B 26 HIS H B 27 LYS H 1.0 1.8 2.9 1339 1007 B 28 ALA HB1 B 26 HIS H 1.0 1.8 5.0 1340 1008 B 26 HIS H B 28 ALA H 1.0 1.8 5.0 1341 1009 B 28 ALA H B 27 LYS HA 1.0 1.8 3.5 1342 1010 B 27 LYS H B 28 ALA H 1.0 1.8 3.5 1343 1011 B 28 ALA HA B 29 PRO HDy 1.0 1.8 5.0 1344 1012 B 28 ALA HA B 29 PRO HDx 1.0 1.8 5.0 1345 1013 B 28 ALA HA B 29 PRO HGx 1.0 1.8 5.0 1346 1013 B 29 PRO HGy B 28 ALA HA 1.0 1.8 5.0 1347 1014 B 32 LEU HD21 B 28 ALA HA 1.0 1.8 5.0 1348 1015 B 28 ALA HB1 B 29 PRO HDy 1.0 1.8 5.0 1349 1015 B 28 ALA HB1 B 29 PRO HDx 1.0 1.8 5.0 1350 1016 B 28 ALA HB1 B 32 LEU HBx 1.0 1.8 5.0 1351 1016 B 32 LEU HBy B 28 ALA HB1 1.0 1.8 5.0 1352 1017 B 32 LEU HD21 B 28 ALA HB1 1.0 1.8 5.0 1353 1018 B 32 LEU HG B 28 ALA HB1 1.0 1.8 5.0 1354 1019 B 28 ALA HB1 B 33 SER HA 1.0 1.8 5.0 1355 1020 B 28 ALA HB1 B 33 SER H 1.0 1.8 5.0 1356 1021 B 28 ALA H B 29 PRO HDy 1.0 1.8 5.0 1357 1021 B 28 ALA H B 29 PRO HDx 1.0 1.8 5.0 1358 1022 B 30 THR H B 29 PRO HBy 1.0 1.8 4.0 1359 1023 B 31 ASP H B 29 PRO HBy 1.0 1.8 5.0 1360 1024 B 30 THR H B 29 PRO HBx 1.0 1.8 4.0 1361 1025 B 31 ASP H B 29 PRO HBx 1.0 1.8 5.0 1362 1026 B 32 LEU H B 29 PRO HBx 1.0 1.8 5.0 1363 1026 B 32 LEU H B 29 PRO HBy 1.0 1.8 5.0 1364 1027 B 32 LEU HD21 B 29 PRO HDy 1.0 1.8 5.0 1365 1028 B 32 LEU HD21 B 29 PRO HDx 1.0 1.8 5.0 1366 1029 B 29 PRO HDx B 32 LEU HBx 1.0 1.8 5.0 1367 1029 B 29 PRO HDy B 32 LEU HBx 1.0 1.8 5.0 1368 1029 B 32 LEU HBy B 29 PRO HDy 1.0 1.8 5.0 1369 1029 B 32 LEU HBy B 29 PRO HDx 1.0 1.8 5.0 1370 1030 B 32 LEU H B 29 PRO HDy 1.0 1.8 5.0 1371 1030 B 32 LEU H B 29 PRO HDx 1.0 1.8 5.0 1372 1031 B 29 PRO HGy B 32 LEU HBx 1.0 1.8 5.0 1373 1031 B 29 PRO HGx B 32 LEU HBx 1.0 1.8 5.0 1374 1031 B 32 LEU HBy B 29 PRO HGx 1.0 1.8 5.0 1375 1031 B 29 PRO HGy B 32 LEU HBy 1.0 1.8 5.0 1376 1032 B 32 LEU HD21 B 29 PRO HGx 1.0 1.8 5.0 1377 1032 B 32 LEU HD21 B 29 PRO HGy 1.0 1.8 5.0 1378 1033 B 30 THR HA B 33 SER H 1.0 1.8 5.0 1379 1034 B 30 THR HA B 34 LEU H 1.0 1.8 5.0 1380 1035 B 30 THR HG21 B 34 LEU HBx 1.0 1.8 5.0 1381 1035 B 30 THR HG21 B 34 LEU HBy 1.0 1.8 5.0 1382 1036 B 30 THR HG21 B 34 LEU HD11 1.0 1.8 5.0 1383 1037 B 30 THR HG21 B 34 LEU HG 1.0 1.8 5.0 1384 1038 B 30 THR HG21 B 34 LEU H 1.0 1.8 5.0 1385 1039 B 33 SER H B 30 THR H 1.0 1.8 5.0 1386 1040 B 31 ASP HA B 34 LEU HBx 1.0 1.8 5.0 1387 1040 B 34 LEU HBy B 31 ASP HA 1.0 1.8 5.0 1388 1041 B 34 LEU HD11 B 31 ASP HA 1.0 1.8 5.0 1389 1042 B 34 LEU H B 31 ASP HA 1.0 1.8 5.0 1390 1043 B 31 ASP HA B 35 MET H 1.0 1.8 5.0 1391 1044 B 35 MET HE1 B 31 ASP HBx 1.0 1.8 5.0 1392 1044 B 35 MET HE1 B 31 ASP HBy 1.0 1.8 5.0 1393 1045 B 32 LEU H B 31 ASP H 1.0 1.8 3.5 1394 1046 B 33 SER H B 31 ASP H 1.0 1.8 5.0 1395 1047 B 32 LEU HA B 35 MET HBx 1.0 1.8 5.0 1396 1047 B 32 LEU HA B 35 MET HBy 1.0 1.8 5.0 1397 1048 B 35 MET HE1 B 32 LEU HA 1.0 1.8 5.0 1398 1049 B 32 LEU HA B 35 MET H 1.0 1.8 5.0 1399 1050 B 32 LEU HA B 36 ALA H 1.0 1.8 5.0 1400 1051 B 32 LEU HD11 B 35 MET HBx 1.0 1.8 5.0 1401 1051 B 32 LEU HD11 B 35 MET HBy 1.0 1.8 5.0 1402 1052 B 32 LEU HD11 B 35 MET HE1 1.0 1.8 5.0 1403 1053 B 32 LEU HD11 B 35 MET H 1.0 1.8 5.0 1404 1054 B 32 LEU HD11 B 36 ALA HB1 1.0 1.8 5.0 1405 1055 B 32 LEU HD11 B 36 ALA H 1.0 1.8 5.0 1406 1056 B 32 LEU H B 33 SER H 1.0 1.8 3.5 1407 1057 B 32 LEU H B 34 LEU H 1.0 1.8 5.0 1408 1058 B 32 LEU H B 35 MET H 1.0 1.8 5.0 1409 1059 B 33 SER HA B 36 ALA HB1 1.0 1.8 5.0 1410 1060 B 36 ALA H B 33 SER HA 1.0 1.8 5.0 1411 1061 B 37 LEU HD21 B 33 SER HBx 1.0 1.8 5.0 1412 1061 B 37 LEU HD21 B 33 SER HBy 1.0 1.8 5.0 1413 1062 B 33 SER H B 34 LEU HBx 1.0 1.8 5.0 1414 1062 B 33 SER H B 34 LEU HBy 1.0 1.8 5.0 1415 1063 B 33 SER H B 34 LEU HG 1.0 1.8 5.0 1416 1064 B 33 SER H B 35 MET H 1.0 1.8 5.0 1417 1065 B 36 ALA H B 33 SER H 1.0 1.8 5.0 1418 1066 B 34 LEU HA B 37 LEU HBx 1.0 1.8 5.0 1419 1066 B 34 LEU HA B 37 LEU HBy 1.0 1.8 5.0 1420 1067 B 37 LEU H B 34 LEU HA 1.0 1.8 5.0 1421 1068 B 34 LEU HA B 38 GLY H 1.0 1.8 5.0 1422 1069 B 34 LEU HD21 B 37 LEU HBx 1.0 1.8 5.0 1423 1069 B 34 LEU HD21 B 37 LEU HBy 1.0 1.8 5.0 1424 1070 B 37 LEU HD21 B 34 LEU HD21 1.0 1.8 5.0 1425 1071 B 34 LEU H B 35 MET H 1.0 1.8 3.5 1426 1072 B 36 ALA H B 34 LEU H 1.0 1.8 5.0 1427 1073 B 34 LEU H B 37 LEU HBx 1.0 1.8 5.0 1428 1073 B 34 LEU H B 37 LEU HBy 1.0 1.8 5.0 1429 1074 B 37 LEU H B 34 LEU H 1.0 1.8 5.0 1430 1075 B 38 GLY H B 35 MET HA 1.0 1.8 5.0 1431 1076 B 39 ASN H B 35 MET HA 1.0 1.8 5.0 1432 1077 B 35 MET HBy B 39 ASN HD2y 1.0 1.8 5.0 1433 1077 B 35 MET HBx B 39 ASN HD2y 1.0 1.8 5.0 1434 1077 B 39 ASN HD2x B 35 MET HBx 1.0 1.8 5.0 1435 1077 B 39 ASN HD2x B 35 MET HBy 1.0 1.8 5.0 1436 1078 B 35 MET HGx B 39 ASN HD2y 1.0 1.8 5.0 1437 1078 B 35 MET HGy B 39 ASN HD2y 1.0 1.8 5.0 1438 1078 B 39 ASN HD2x B 35 MET HGx 1.0 1.8 5.0 1439 1078 B 35 MET HGy B 39 ASN HD2x 1.0 1.8 5.0 1440 1079 B 36 ALA H B 35 MET H 1.0 1.8 3.5 1441 1080 B 37 LEU H B 35 MET H 1.0 1.8 5.0 1442 1081 B 36 ALA HA B 39 ASN HBy 1.0 1.8 5.0 1443 1081 B 36 ALA HA B 39 ASN HBx 1.0 1.8 5.0 1444 1082 B 36 ALA HA B 39 ASN H 1.0 1.8 5.0 1445 1083 B 36 ALA HB1 B 39 ASN HBy 1.0 1.8 5.0 1446 1083 B 36 ALA HB1 B 39 ASN HBx 1.0 1.8 5.0 1447 1084 B 36 ALA HB1 B 39 ASN H 1.0 1.8 5.0 1448 1085 B 37 LEU HA B 40 CYS HBx 1.0 1.8 5.0 1449 1085 B 40 CYS HBy B 37 LEU HA 1.0 1.8 5.0 1450 1086 B 37 LEU HA B 40 CYS H 1.0 1.8 5.0 1451 1087 B 37 LEU HA B 41 VAL H 1.0 1.8 5.0 1452 1088 B 41 VAL H B 37 LEU HBx 1.0 1.8 5.0 1453 1088 B 37 LEU HBy B 41 VAL H 1.0 1.8 5.0 1454 1089 B 37 LEU HD11 B 40 CYS HBx 1.0 1.8 5.0 1455 1089 B 40 CYS HBy B 37 LEU HD11 1.0 1.8 5.0 1456 1090 B 37 LEU H B 38 GLY H 1.0 1.8 3.5 1457 1091 B 39 ASN H B 37 LEU H 1.0 1.8 5.0 1458 1092 B 37 LEU H B 40 CYS H 1.0 1.8 5.0 1459 1093 B 41 VAL HG21 B 38 GLY HAy 1.0 1.8 5.0 1460 1094 B 41 VAL HG21 B 38 GLY HAx 1.0 1.8 5.0 1461 1095 B 40 CYS H B 38 GLY HAy 1.0 1.8 5.0 1462 1095 B 38 GLY HAx B 40 CYS H 1.0 1.8 5.0 1463 1096 B 41 VAL HB B 38 GLY HAy 1.0 1.8 5.0 1464 1096 B 41 VAL HB B 38 GLY HAx 1.0 1.8 5.0 1465 1097 B 41 VAL HG21 B 38 GLY HAy 1.0 1.8 5.0 1466 1097 B 41 VAL HG21 B 38 GLY HAx 1.0 1.8 5.0 1467 1098 B 41 VAL H B 38 GLY HAy 1.0 1.8 5.0 1468 1098 B 38 GLY HAx B 41 VAL H 1.0 1.8 5.0 1469 1099 B 38 GLY H B 39 ASN HBy 1.0 1.8 5.0 1470 1099 B 38 GLY H B 39 ASN HBx 1.0 1.8 5.0 1471 1100 B 39 ASN H B 38 GLY H 1.0 1.8 3.5 1472 1101 B 38 GLY H B 40 CYS H 1.0 1.8 5.0 1473 1102 B 38 GLY H B 41 VAL H 1.0 1.8 5.0 1474 1103 B 42 THR HB B 39 ASN HA 1.0 1.8 5.0 1475 1104 B 42 THR HG21 B 39 ASN HA 1.0 1.8 5.0 1476 1105 B 42 THR H B 39 ASN HA 1.0 1.8 5.0 1477 1106 B 39 ASN HA B 43 HIS H 1.0 1.8 5.0 1478 1107 B 42 THR H B 39 ASN HBy 1.0 1.8 5.0 1479 1107 B 42 THR H B 39 ASN HBx 1.0 1.8 5.0 1480 1108 B 39 ASN HBx B 43 HIS HBx 1.0 1.8 5.0 1481 1108 B 43 HIS HBy B 39 ASN HBy 1.0 1.8 5.0 1482 1108 B 43 HIS HBy B 39 ASN HBx 1.0 1.8 5.0 1483 1108 B 39 ASN HBy B 43 HIS HBx 1.0 1.8 5.0 1484 1109 B 39 ASN H B 40 CYS HBx 1.0 1.8 5.0 1485 1109 B 39 ASN H B 40 CYS HBy 1.0 1.8 5.0 1486 1110 B 39 ASN H B 40 CYS H 1.0 1.8 3.5 1487 1111 B 39 ASN H B 41 VAL H 1.0 1.8 5.0 1488 1112 B 40 CYS HA B 42 THR H 1.0 1.8 5.0 1489 1113 B 40 CYS HA B 43 HIS HBx 1.0 1.8 5.0 1490 1113 B 40 CYS HA B 43 HIS HBy 1.0 1.8 5.0 1491 1114 B 40 CYS HA B 43 HIS HD2 1.0 1.8 5.0 1492 1115 B 40 CYS HA B 43 HIS H 1.0 1.8 5.0 1493 1116 B 40 CYS HBx B 43 HIS HBx 1.0 1.8 5.0 1494 1116 B 40 CYS HBy B 43 HIS HBx 1.0 1.8 5.0 1495 1116 B 43 HIS HBy B 40 CYS HBx 1.0 1.8 5.0 1496 1116 B 43 HIS HBy B 40 CYS HBy 1.0 1.8 5.0 1497 1117 B 41 VAL HB B 40 CYS H 1.0 1.8 5.0 1498 1118 B 41 VAL HG21 B 40 CYS H 1.0 1.8 5.0 1499 1119 B 40 CYS H B 41 VAL H 1.0 1.8 3.5 1500 1120 B 42 THR H B 40 CYS H 1.0 1.8 5.0 1501 1121 B 41 VAL HA B 44 LEU HBy 1.0 1.8 5.0 1502 1122 B 41 VAL HA B 44 LEU HBx 1.0 1.8 5.0 1503 1123 B 44 LEU HD11 B 41 VAL HA 1.0 1.8 5.0 1504 1124 B 44 LEU HG B 41 VAL HA 1.0 1.8 5.0 1505 1125 B 41 VAL HA B 44 LEU H 1.0 1.8 5.0 1506 1126 B 41 VAL HA B 45 LEU H 1.0 1.8 5.0 1507 1127 B 41 VAL HG11 B 42 THR HA 1.0 1.8 5.0 1508 1128 B 41 VAL HG11 B 42 THR HG21 1.0 1.8 5.0 1509 1129 B 41 VAL HG11 B 45 LEU HBx 1.0 1.8 5.0 1510 1129 B 41 VAL HG11 B 45 LEU HBy 1.0 1.8 5.0 1511 1130 B 41 VAL HG11 B 45 LEU HD11 1.0 1.8 5.0 1512 1131 B 41 VAL HG11 B 45 LEU HD21 1.0 1.8 5.0 1513 1132 B 41 VAL HG11 B 45 LEU HG 1.0 1.8 5.0 1514 1133 B 41 VAL HG11 B 45 LEU H 1.0 1.8 5.0 1515 1134 B 61 PHE HD% B 41 VAL HG11 1.0 1.8 5.0 1516 1135 B 41 VAL HG11 B 61 PHE HE% 1.0 1.8 5.0 1517 1136 B 41 VAL HG11 B 61 PHE HZ 1.0 1.8 5.0 1518 1137 B 41 VAL HG11 B 65 LEU HD11 1.0 1.8 5.0 1519 1138 B 41 VAL HG11 B 65 LEU HD21 1.0 1.8 5.0 1520 1139 B 41 VAL HG21 B 61 PHE HE% 1.0 1.8 5.0 1521 1140 B 41 VAL HG21 B 61 PHE HZ 1.0 1.8 5.0 1522 1141 B 42 THR H B 41 VAL H 1.0 1.8 3.5 1523 1142 B 41 VAL H B 43 HIS H 1.0 1.8 5.0 1524 1143 B 42 THR HA B 45 LEU HBx 1.0 1.8 5.0 1525 1143 B 42 THR HA B 45 LEU HBy 1.0 1.8 5.0 1526 1144 B 42 THR HA B 45 LEU HD11 1.0 1.8 5.0 1527 1145 B 42 THR HA B 45 LEU H 1.0 1.8 5.0 1528 1146 B 42 THR HA B 46 GLU H 1.0 1.8 5.0 1529 1147 B 42 THR HG21 B 46 GLU HGx 1.0 1.8 5.0 1530 1147 B 42 THR HG21 B 46 GLU HGy 1.0 1.8 5.0 1531 1148 B 42 THR HG21 B 46 GLU H 1.0 1.8 5.0 1532 1149 B 46 GLU H B 43 HIS HA 1.0 1.8 5.0 1533 1150 B 43 HIS HA B 47 ARG H 1.0 1.8 5.0 1534 1151 B 44 LEU HG B 43 HIS HBx 1.0 1.8 5.0 1535 1151 B 43 HIS HBy B 44 LEU HG 1.0 1.8 5.0 1536 1152 B 43 HIS HD2 B 44 LEU HA 1.0 1.8 5.0 1537 1153 B 43 HIS HD2 B 44 LEU HG 1.0 1.8 5.0 1538 1154 B 43 HIS H B 44 LEU H 1.0 1.8 3.5 1539 1155 B 44 LEU HA B 47 ARG HBx 1.0 1.8 5.0 1540 1155 B 44 LEU HA B 47 ARG HBy 1.0 1.8 5.0 1541 1156 B 47 ARG H B 44 LEU HA 1.0 1.8 5.0 1542 1157 B 44 LEU HA B 48 LYS H 1.0 1.8 5.0 1543 1158 B 44 LEU H B 45 LEU H 1.0 1.8 3.5 1544 1159 B 48 LYS H B 45 LEU HA 1.0 1.8 5.0 1545 1160 B 45 LEU HA B 49 VAL HG21 1.0 1.8 5.0 1546 1161 B 45 LEU HA B 49 VAL H 1.0 1.8 5.0 1547 1162 B 45 LEU HA B 54 ARG HGx 1.0 1.8 5.0 1548 1162 B 54 ARG HGy B 45 LEU HA 1.0 1.8 5.0 1549 1163 B 45 LEU HD11 B 57 VAL HB 1.0 1.8 5.0 1550 1164 B 57 VAL HG11 B 45 LEU HD11 1.0 1.8 5.0 1551 1165 B 58 ALA HB1 B 45 LEU HD11 1.0 1.8 5.0 1552 1166 B 45 LEU HD21 B 49 VAL HB 1.0 1.8 5.0 1553 1167 B 45 LEU HD21 B 49 VAL HG11 1.0 1.8 5.0 1554 1168 B 45 LEU HD21 B 49 VAL HG21 1.0 1.8 5.0 1555 1169 B 45 LEU HD21 B 49 VAL H 1.0 1.8 5.0 1556 1170 B 54 ARG HA B 45 LEU HD21 1.0 1.8 5.0 1557 1171 B 45 LEU HD21 B 54 ARG HBx 1.0 1.8 5.0 1558 1171 B 54 ARG HBy B 45 LEU HD21 1.0 1.8 5.0 1559 1172 B 45 LEU HD21 B 54 ARG HDy 1.0 1.8 5.0 1560 1172 B 54 ARG HDx B 45 LEU HD21 1.0 1.8 5.0 1561 1173 B 45 LEU HD21 B 54 ARG HGx 1.0 1.8 5.0 1562 1173 B 54 ARG HGy B 45 LEU HD21 1.0 1.8 5.0 1563 1174 B 45 LEU HD21 B 54 ARG H 1.0 1.8 5.0 1564 1175 B 45 LEU HD21 B 57 VAL HB 1.0 1.8 5.0 1565 1176 B 57 VAL HG11 B 45 LEU HD21 1.0 1.8 5.0 1566 1177 B 58 ALA HB1 B 45 LEU HD21 1.0 1.8 5.0 1567 1178 B 45 LEU HD21 B 58 ALA H 1.0 1.8 5.0 1568 1179 B 45 LEU H B 46 GLU H 1.0 1.8 3.5 1569 1180 B 49 VAL H B 46 GLU HA 1.0 1.8 5.0 1570 1181 B 46 GLU HA B 54 ARG HDy 1.0 1.8 5.0 1571 1182 B 54 ARG HDx B 46 GLU HA 1.0 1.8 5.0 1572 1183 B 46 GLU HA B 54 ARG HE 1.0 1.8 5.0 1573 1184 B 46 GLU HGx B 54 ARG HDy 1.0 1.8 5.0 1574 1184 B 46 GLU HGy B 54 ARG HDy 1.0 1.8 5.0 1575 1184 B 54 ARG HDx B 46 GLU HGx 1.0 1.8 5.0 1576 1184 B 54 ARG HDx B 46 GLU HGy 1.0 1.8 5.0 1577 1185 B 54 ARG HE B 46 GLU HGx 1.0 1.8 5.0 1578 1185 B 46 GLU HGy B 54 ARG HE 1.0 1.8 5.0 1579 1186 B 46 GLU HGx B 54 ARG HGx 1.0 1.8 5.0 1580 1186 B 46 GLU HGy B 54 ARG HGx 1.0 1.8 5.0 1581 1186 B 54 ARG HGy B 46 GLU HGx 1.0 1.8 5.0 1582 1186 B 54 ARG HGy B 46 GLU HGy 1.0 1.8 5.0 1583 1187 B 46 GLU H B 47 ARG H 1.0 1.8 3.5 1584 1188 B 49 VAL H B 47 ARG HA 1.0 1.8 5.0 1585 1189 B 48 LYS HA B 47 ARG H 1.0 1.8 5.0 1586 1190 B 47 ARG H B 48 LYS H 1.0 1.8 3.5 1587 1191 B 48 LYS H B 49 VAL HB 1.0 1.8 5.0 1588 1192 B 48 LYS H B 49 VAL HG21 1.0 1.8 5.0 1589 1193 B 48 LYS H B 49 VAL H 1.0 1.8 3.5 1590 1194 B 54 ARG HA B 49 VAL HB 1.0 1.8 5.0 1591 1195 B 49 VAL HB B 54 ARG HGx 1.0 1.8 5.0 1592 1195 B 54 ARG HGy B 49 VAL HB 1.0 1.8 5.0 1593 1196 B 49 VAL HG11 B 50 PRO HDy 1.0 1.8 5.0 1594 1197 B 49 VAL HG11 B 50 PRO HDx 1.0 1.8 5.0 1595 1198 B 49 VAL HG11 B 53 SER HBx 1.0 1.8 5.0 1596 1198 B 49 VAL HG11 B 53 SER HBy 1.0 1.8 5.0 1597 1199 B 49 VAL HG11 B 53 SER H 1.0 1.8 5.0 1598 1200 B 54 ARG HA B 49 VAL HG11 1.0 1.8 5.0 1599 1201 B 49 VAL HG11 B 54 ARG HBx 1.0 1.8 5.0 1600 1201 B 54 ARG HBy B 49 VAL HG11 1.0 1.8 5.0 1601 1202 B 49 VAL HG11 B 54 ARG HGx 1.0 1.8 5.0 1602 1202 B 54 ARG HGy B 49 VAL HG11 1.0 1.8 5.0 1603 1203 B 49 VAL HG11 B 54 ARG H 1.0 1.8 5.0 1604 1204 B 57 VAL HB B 49 VAL HG11 1.0 1.8 5.0 1605 1205 B 49 VAL HG21 B 50 PRO HDy 1.0 1.8 5.0 1606 1205 B 49 VAL HG21 B 50 PRO HDx 1.0 1.8 5.0 1607 1206 B 54 ARG HA B 49 VAL HG21 1.0 1.8 5.0 1608 1207 B 49 VAL H B 50 PRO HDy 1.0 1.8 5.0 1609 1207 B 49 VAL H B 50 PRO HDx 1.0 1.8 5.0 1610 1208 B 49 VAL H B 54 ARG HE 1.0 1.8 5.0 1611 1209 B 50 PRO HA B 51 SER H 1.0 1.8 3.5 1612 1210 B 50 PRO HA B 52 GLU H 1.0 1.8 5.0 1613 1211 B 52 GLU H B 50 PRO HBy 1.0 1.8 5.0 1614 1212 B 50 PRO HBx B 53 SER HBx 1.0 1.8 5.0 1615 1212 B 50 PRO HBy B 53 SER HBx 1.0 1.8 5.0 1616 1212 B 53 SER HBy B 50 PRO HBx 1.0 1.8 5.0 1617 1212 B 53 SER HBy B 50 PRO HBy 1.0 1.8 5.0 1618 1213 B 52 GLU H B 50 PRO HBx 1.0 1.8 5.0 1619 1214 B 53 SER H B 50 PRO HBx 1.0 1.8 5.0 1620 1214 B 53 SER H B 50 PRO HBy 1.0 1.8 5.0 1621 1215 B 53 SER HBy B 50 PRO HDy 1.0 1.8 5.0 1622 1215 B 50 PRO HDy B 53 SER HBx 1.0 1.8 5.0 1623 1216 B 53 SER HBy B 50 PRO HDx 1.0 1.8 5.0 1624 1216 B 50 PRO HDx B 53 SER HBx 1.0 1.8 5.0 1625 1217 B 50 PRO HGy B 53 SER HBx 1.0 1.8 5.0 1626 1217 B 50 PRO HGx B 53 SER HBx 1.0 1.8 5.0 1627 1217 B 53 SER HBy B 50 PRO HGx 1.0 1.8 5.0 1628 1217 B 53 SER HBy B 50 PRO HGy 1.0 1.8 5.0 1629 1218 B 53 SER H B 51 SER HA 1.0 1.8 5.0 1630 1219 B 51 SER HA B 54 ARG HDy 1.0 1.8 5.0 1631 1219 B 54 ARG HDx B 51 SER HA 1.0 1.8 5.0 1632 1220 B 54 ARG HE B 51 SER HA 1.0 1.8 5.0 1633 1221 B 51 SER HA B 54 ARG HH1% 1.0 1.8 5.0 1634 1221 B 51 SER HA B 54 ARG HH2% 1.0 1.8 5.0 1635 1222 B 54 ARG H B 51 SER HA 1.0 1.8 5.0 1636 1223 B 53 SER H B 51 SER HBx 1.0 1.8 5.0 1637 1223 B 51 SER HBy B 53 SER H 1.0 1.8 5.0 1638 1224 B 51 SER HBx B 54 ARG HBx 1.0 1.8 5.0 1639 1224 B 51 SER HBy B 54 ARG HBx 1.0 1.8 5.0 1640 1224 B 54 ARG HBy B 51 SER HBx 1.0 1.8 5.0 1641 1224 B 51 SER HBy B 54 ARG HBy 1.0 1.8 5.0 1642 1225 B 54 ARG HE B 51 SER HBx 1.0 1.8 5.0 1643 1225 B 51 SER HBy B 54 ARG HE 1.0 1.8 5.0 1644 1226 B 54 ARG H B 51 SER HBx 1.0 1.8 5.0 1645 1226 B 51 SER HBy B 54 ARG H 1.0 1.8 5.0 1646 1227 B 51 SER H B 52 GLU H 1.0 1.8 3.5 1647 1228 B 53 SER H B 51 SER H 1.0 1.8 5.0 1648 1229 B 51 SER H B 54 ARG HDy 1.0 1.8 5.0 1649 1229 B 54 ARG HDx B 51 SER H 1.0 1.8 5.0 1650 1230 B 54 ARG HE B 51 SER H 1.0 1.8 5.0 1651 1231 B 51 SER H B 54 ARG HH1% 1.0 1.8 5.0 1652 1231 B 51 SER H B 54 ARG HH2% 1.0 1.8 5.0 1653 1232 B 54 ARG H B 52 GLU HA 1.0 1.8 5.0 1654 1233 B 55 GLN H B 52 GLU HA 1.0 1.8 5.0 1655 1234 B 53 SER H B 52 GLU H 1.0 1.8 3.5 1656 1235 B 54 ARG H B 52 GLU H 1.0 1.8 5.0 1657 1236 B 53 SER HA B 56 ALA HB1 1.0 1.8 5.0 1658 1237 B 53 SER HA B 56 ALA H 1.0 1.8 5.0 1659 1238 B 57 VAL HG21 B 53 SER HA 1.0 1.8 5.0 1660 1239 B 53 SER HA B 57 VAL H 1.0 1.8 5.0 1661 1240 B 56 ALA HB1 B 53 SER HBx 1.0 1.8 5.0 1662 1240 B 53 SER HBy B 56 ALA HB1 1.0 1.8 5.0 1663 1241 B 57 VAL HG21 B 53 SER HBx 1.0 1.8 5.0 1664 1241 B 57 VAL HG21 B 53 SER HBy 1.0 1.8 5.0 1665 1242 B 57 VAL H B 53 SER HBx 1.0 1.8 5.0 1666 1242 B 53 SER HBy B 57 VAL H 1.0 1.8 5.0 1667 1243 B 53 SER H B 54 ARG HBx 1.0 1.8 5.0 1668 1243 B 54 ARG HBy B 53 SER H 1.0 1.8 5.0 1669 1244 B 54 ARG H B 53 SER H 1.0 1.8 2.9 1670 1245 B 55 GLN H B 53 SER H 1.0 1.8 5.0 1671 1246 B 54 ARG HA B 56 ALA H 1.0 1.8 5.0 1672 1247 B 57 VAL HG11 B 54 ARG HA 1.0 1.8 5.0 1673 1248 B 57 VAL HG21 B 54 ARG HA 1.0 1.8 5.0 1674 1249 B 54 ARG HA B 57 VAL H 1.0 1.8 5.0 1675 1250 B 54 ARG HA B 58 ALA H 1.0 1.8 5.0 1676 1251 B 55 GLN H B 54 ARG H 1.0 1.8 3.5 1677 1252 B 54 ARG H B 56 ALA H 1.0 1.8 5.0 1678 1253 B 55 GLN HA B 58 ALA HB1 1.0 1.8 5.0 1679 1254 B 55 GLN HA B 58 ALA H 1.0 1.8 5.0 1680 1255 B 58 ALA HB1 B 55 GLN HGx 1.0 1.8 5.0 1681 1255 B 55 GLN HGy B 58 ALA HB1 1.0 1.8 5.0 1682 1256 B 55 GLN H B 56 ALA HB1 1.0 1.8 5.0 1683 1257 B 55 GLN H B 56 ALA H 1.0 1.8 3.5 1684 1258 B 55 GLN H B 57 VAL H 1.0 1.8 5.0 1685 1259 B 58 ALA H B 56 ALA HA 1.0 1.8 5.0 1686 1260 B 56 ALA HA B 59 GLU HBx 1.0 1.8 5.0 1687 1260 B 56 ALA HA B 59 GLU HBy 1.0 1.8 5.0 1688 1261 B 56 ALA HA B 59 GLU H 1.0 1.8 5.0 1689 1262 B 56 ALA HA B 60 GLN H 1.0 1.8 5.0 1690 1263 B 57 VAL HG21 B 56 ALA HB1 1.0 1.8 5.0 1691 1264 B 56 ALA HB1 B 59 GLU HBx 1.0 1.8 5.0 1692 1264 B 56 ALA HB1 B 59 GLU HBy 1.0 1.8 5.0 1693 1265 B 56 ALA HB1 B 59 GLU HGx 1.0 1.8 5.0 1694 1265 B 56 ALA HB1 B 59 GLU HGy 1.0 1.8 5.0 1695 1266 B 56 ALA HB1 B 60 GLN HBx 1.0 1.8 5.0 1696 1266 B 56 ALA HB1 B 60 GLN HBy 1.0 1.8 5.0 1697 1267 B 56 ALA HB1 B 60 GLN HE2y 1.0 1.8 5.0 1698 1267 B 56 ALA HB1 B 60 GLN HE2x 1.0 1.8 5.0 1699 1268 B 56 ALA H B 57 VAL H 1.0 1.8 3.5 1700 1269 B 59 GLU H B 57 VAL HA 1.0 1.8 5.0 1701 1270 B 57 VAL HA B 60 GLN HBx 1.0 1.8 5.0 1702 1270 B 60 GLN HBy B 57 VAL HA 1.0 1.8 5.0 1703 1271 B 57 VAL HA B 60 GLN HGx 1.0 1.8 5.0 1704 1271 B 57 VAL HA B 60 GLN HGy 1.0 1.8 5.0 1705 1272 B 60 GLN H B 57 VAL HA 1.0 1.8 5.0 1706 1273 B 57 VAL HA B 61 PHE H 1.0 1.8 5.0 1707 1274 B 57 VAL HG11 B 58 ALA HB1 1.0 1.8 5.0 1708 1275 B 57 VAL HG11 B 60 GLN HBx 1.0 1.8 5.0 1709 1275 B 57 VAL HG11 B 60 GLN HBy 1.0 1.8 5.0 1710 1276 B 57 VAL HG11 B 61 PHE H 1.0 1.8 5.0 1711 1277 B 58 ALA H B 57 VAL H 1.0 1.8 3.5 1712 1278 B 57 VAL H B 59 GLU H 1.0 1.8 5.0 1713 1279 B 58 ALA HA B 61 PHE HBx 1.0 1.8 5.0 1714 1279 B 58 ALA HA B 61 PHE HBy 1.0 1.8 5.0 1715 1280 B 61 PHE H B 58 ALA HA 1.0 1.8 5.0 1716 1281 B 58 ALA HA B 62 ALA H 1.0 1.8 5.0 1717 1282 B 58 ALA HB1 B 60 GLN H 1.0 1.8 5.0 1718 1283 B 58 ALA HB1 B 61 PHE HBx 1.0 1.8 5.0 1719 1283 B 58 ALA HB1 B 61 PHE HBy 1.0 1.8 5.0 1720 1284 B 58 ALA HB1 B 62 ALA HB1 1.0 1.8 5.0 1721 1285 B 58 ALA HB1 B 62 ALA H 1.0 1.8 5.0 1722 1286 B 58 ALA H B 59 GLU HBx 1.0 1.8 5.0 1723 1286 B 58 ALA H B 59 GLU HBy 1.0 1.8 5.0 1724 1287 B 58 ALA H B 59 GLU H 1.0 1.8 3.5 1725 1288 B 62 ALA HB1 B 59 GLU HA 1.0 1.8 5.0 1726 1289 B 62 ALA H B 59 GLU HA 1.0 1.8 5.0 1727 1290 B 59 GLU HA B 63 LYS H 1.0 1.8 5.0 1728 1291 B 62 ALA HB1 B 59 GLU HBx 1.0 1.8 5.0 1729 1291 B 62 ALA HB1 B 59 GLU HBy 1.0 1.8 5.0 1730 1292 B 59 GLU HBx B 63 LYS HEx 1.0 1.8 5.0 1731 1292 B 59 GLU HBy B 63 LYS HEx 1.0 1.8 5.0 1732 1292 B 63 LYS HEy B 59 GLU HBx 1.0 1.8 5.0 1733 1292 B 59 GLU HBy B 63 LYS HEy 1.0 1.8 5.0 1734 1293 B 62 ALA HB1 B 59 GLU HGx 1.0 1.8 5.0 1735 1293 B 62 ALA HB1 B 59 GLU HGy 1.0 1.8 5.0 1736 1294 B 59 GLU H B 60 GLN H 1.0 1.8 3.5 1737 1295 B 59 GLU H B 61 PHE H 1.0 1.8 5.0 1738 1296 B 62 ALA H B 60 GLN HA 1.0 1.8 5.0 1739 1297 B 60 GLN HA B 63 LYS HDx 1.0 1.8 5.0 1740 1297 B 60 GLN HA B 63 LYS HDy 1.0 1.8 5.0 1741 1298 B 63 LYS H B 60 GLN HA 1.0 1.8 5.0 1742 1299 B 60 GLN HA B 64 ALA H 1.0 1.8 5.0 1743 1300 B 62 ALA H B 60 GLN HBx 1.0 1.8 5.0 1744 1300 B 60 GLN HBy B 62 ALA H 1.0 1.8 5.0 1745 1301 B 63 LYS H B 60 GLN HBx 1.0 1.8 5.0 1746 1301 B 60 GLN HBy B 63 LYS H 1.0 1.8 5.0 1747 1302 B 60 GLN H B 61 PHE HBx 1.0 1.8 5.0 1748 1302 B 60 GLN H B 61 PHE HBy 1.0 1.8 5.0 1749 1303 B 60 GLN H B 62 ALA H 1.0 1.8 5.0 1750 1304 B 61 PHE HA B 64 ALA HB1 1.0 1.8 5.0 1751 1305 B 64 ALA H B 61 PHE HA 1.0 1.8 5.0 1752 1306 B 61 PHE HA B 65 LEU H 1.0 1.8 5.0 1753 1307 B 61 PHE HD% B 65 LEU HBx 1.0 1.8 5.0 1754 1307 B 61 PHE HD% B 65 LEU HBy 1.0 1.8 5.0 1755 1308 B 61 PHE HD% B 65 LEU HD11 1.0 1.8 5.0 1756 1309 B 61 PHE HE% B 64 ALA HB1 1.0 1.8 5.0 1757 1310 B 61 PHE HE% B 65 LEU HD11 1.0 1.8 5.0 1758 1311 B 62 ALA HB1 B 61 PHE H 1.0 1.8 5.0 1759 1312 B 61 PHE H B 62 ALA H 1.0 1.8 3.5 1760 1313 B 61 PHE H B 64 ALA H 1.0 1.8 5.0 1761 1314 B 61 PHE HZ B 65 LEU HD11 1.0 1.8 5.0 1762 1315 B 62 ALA HA B 65 LEU HBx 1.0 1.8 5.0 1763 1315 B 65 LEU HBy B 62 ALA HA 1.0 1.8 5.0 1764 1316 B 65 LEU HD11 B 62 ALA HA 1.0 1.8 5.0 1765 1317 B 65 LEU HD21 B 62 ALA HA 1.0 1.8 5.0 1766 1318 B 65 LEU H B 62 ALA HA 1.0 1.8 5.0 1767 1319 B 62 ALA HA B 66 ALA H 1.0 1.8 5.0 1768 1320 B 62 ALA HB1 B 65 LEU HBx 1.0 1.8 5.0 1769 1320 B 65 LEU HBy B 62 ALA HB1 1.0 1.8 5.0 1770 1321 B 65 LEU HD21 B 62 ALA HB1 1.0 1.8 5.0 1771 1322 B 62 ALA H B 63 LYS H 1.0 1.8 3.5 1772 1323 B 62 ALA H B 64 ALA H 1.0 1.8 5.0 1773 1324 B 66 ALA HB1 B 63 LYS HA 1.0 1.8 5.0 1774 1325 B 66 ALA H B 63 LYS HA 1.0 1.8 5.0 1775 1326 B 63 LYS HA B 67 GLN H 1.0 1.8 5.0 1776 1327 B 63 LYS H B 64 ALA HB1 1.0 1.8 5.0 1777 1328 B 63 LYS H B 64 ALA H 1.0 1.8 3.5 1778 1329 B 63 LYS H B 65 LEU H 1.0 1.8 5.0 1779 1330 B 64 ALA HA B 67 GLN HBx 1.0 1.8 5.0 1780 1330 B 64 ALA HA B 67 GLN HBy 1.0 1.8 5.0 1781 1331 B 67 GLN H B 64 ALA HA 1.0 1.8 5.0 1782 1332 B 68 SER H B 64 ALA HA 1.0 1.8 5.0 1783 1333 B 64 ALA H B 65 LEU H 1.0 1.8 3.5 1784 1334 B 65 LEU HA B 68 SER H 1.0 1.8 5.0 1785 1335 B 68 SER H B 65 LEU HBx 1.0 1.8 5.0 1786 1335 B 65 LEU HBy B 68 SER H 1.0 1.8 5.0 1787 1336 B 65 LEU HD11 B 69 VAL HG21 1.0 1.8 5.0 1788 1337 B 65 LEU H B 66 ALA H 1.0 1.8 3.5 1789 1338 B 65 LEU H B 67 GLN H 1.0 1.8 5.0 1790 1339 B 66 ALA HA B 69 VAL HB 1.0 1.8 5.0 1791 1340 B 69 VAL HG21 B 66 ALA HA 1.0 1.8 5.0 1792 1341 B 66 ALA HA B 69 VAL H 1.0 1.8 5.0 1793 1342 B 66 ALA HA B 70 LYS H 1.0 1.8 5.0 1794 1343 B 69 VAL HB B 66 ALA HB1 1.0 1.8 5.0 1795 1344 B 66 ALA HB1 B 70 LYS HBx 1.0 1.8 5.0 1796 1344 B 66 ALA HB1 B 70 LYS HBy 1.0 1.8 5.0 1797 1345 B 68 SER H B 66 ALA H 1.0 1.8 5.0 1798 1346 B 67 GLN HA B 70 LYS HDx 1.0 1.8 5.0 1799 1346 B 67 GLN HA B 70 LYS HDy 1.0 1.8 5.0 1800 1347 B 70 LYS H B 67 GLN HA 1.0 1.8 5.0 1801 1348 B 67 GLN H B 69 VAL H 1.0 1.8 5.0 1802 1349 B 70 LYS H B 68 SER HA 1.0 1.8 5.0 1803 1350 B 68 SER H B 69 VAL HB 1.0 1.8 5.0 1804 1351 B 68 SER H B 69 VAL HG21 1.0 1.8 5.0 1805 1352 B 68 SER H B 69 VAL H 1.0 1.8 3.5 1806 1353 B 68 SER H B 70 LYS H 1.0 1.8 5.0 1807 1354 B 69 VAL HA B 72 ASN HBx 1.0 1.8 5.0 1808 1354 B 69 VAL HA B 72 ASN HBy 1.0 1.8 5.0 1809 1355 B 69 VAL HA B 72 ASN HD2y 1.0 1.8 5.0 1810 1355 B 69 VAL HA B 72 ASN HD2x 1.0 1.8 5.0 1811 1356 B 69 VAL H B 70 LYS HBx 1.0 1.8 5.0 1812 1356 B 69 VAL H B 70 LYS HBy 1.0 1.8 5.0 1813 1357 B 69 VAL H B 71 SER H 1.0 1.8 5.0 1814 1358 B 70 LYS HA B 73 LEU HBx 1.0 1.8 5.0 1815 1358 B 70 LYS HA B 73 LEU HBy 1.0 1.8 5.0 1816 1359 B 70 LYS HA B 73 LEU HD11 1.0 1.8 5.0 1817 1360 B 71 SER HA B 74 GLU HBx 1.0 1.8 5.0 1818 1360 B 71 SER HA B 74 GLU HBy 1.0 1.8 5.0 1819 1361 B 71 SER H B 72 ASN HBx 1.0 1.8 5.0 1820 1361 B 72 ASN HBy B 71 SER H 1.0 1.8 5.0 1821 1362 B 72 ASN H B 73 LEU HBx 1.0 1.8 5.0 1822 1362 B 73 LEU HBy B 72 ASN H 1.0 1.8 5.0 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _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 13 GLU H A 9 ASN O 1.0 1.7 2.3 2 2 A 9 ASN O A 13 GLU N 1.0 2.7 3.3 3 3 A 14 SER H A 10 THR O 1.0 1.7 2.3 4 4 A 10 THR O A 14 SER N 1.0 2.7 3.3 5 5 A 15 LEU H A 11 GLN O 1.0 1.7 2.3 6 6 A 11 GLN O A 15 LEU N 1.0 2.7 3.3 7 7 A 16 ILE H A 12 VAL O 1.0 1.7 2.3 8 8 A 12 VAL O A 16 ILE N 1.0 2.7 3.3 9 9 A 17 ALA H A 13 GLU O 1.0 1.7 2.3 10 10 A 13 GLU O A 17 ALA N 1.0 2.7 3.3 11 11 A 18 GLU H A 14 SER O 1.0 1.7 2.3 12 12 A 14 SER O A 18 GLU N 1.0 2.7 3.3 13 13 A 19 ILE H A 15 LEU O 1.0 1.7 2.3 14 14 A 15 LEU O A 19 ILE N 1.0 2.7 3.3 15 15 A 20 LEU H A 16 ILE O 1.0 1.7 2.3 16 16 A 16 ILE O A 20 LEU N 1.0 2.7 3.3 17 17 A 21 VAL H A 17 ALA O 1.0 1.7 2.3 18 18 A 17 ALA O A 21 VAL N 1.0 2.7 3.3 19 19 A 22 VAL H A 18 GLU O 1.0 1.7 2.3 20 20 A 18 GLU O A 22 VAL N 1.0 2.7 3.3 21 21 A 23 LEU H A 19 ILE O 1.0 1.7 2.3 22 22 A 19 ILE O A 23 LEU N 1.0 2.7 3.3 23 23 A 24 GLU H A 20 LEU O 1.0 1.7 2.3 24 24 A 20 LEU O A 24 GLU N 1.0 2.7 3.3 25 25 A 25 LYS H A 21 VAL O 1.0 1.7 2.3 26 26 A 21 VAL O A 25 LYS N 1.0 2.7 3.3 27 27 A 35 MET H A 31 ASP O 1.0 1.7 2.3 28 28 A 31 ASP O A 35 MET N 1.0 2.7 3.3 29 29 A 36 ALA H A 32 LEU O 1.0 1.7 2.3 30 30 A 32 LEU O A 36 ALA N 1.0 2.7 3.3 31 31 A 37 LEU H A 33 SER O 1.0 1.7 2.3 32 32 A 33 SER O A 37 LEU N 1.0 2.7 3.3 33 33 A 38 GLY H A 34 LEU O 1.0 1.7 2.3 34 34 A 34 LEU O A 38 GLY N 1.0 2.7 3.3 35 35 A 40 CYS H A 36 ALA O 1.0 1.7 2.3 36 36 A 36 ALA O A 40 CYS N 1.0 2.7 3.3 37 37 A 41 VAL H A 37 LEU O 1.0 1.7 2.3 38 38 A 37 LEU O A 41 VAL N 1.0 2.7 3.3 39 39 A 59 GLU H A 55 GLN O 1.0 1.7 2.3 40 40 A 55 GLN O A 59 GLU N 1.0 2.7 3.3 41 41 A 60 GLN H A 56 ALA O 1.0 1.7 2.3 42 42 A 56 ALA O A 60 GLN N 1.0 2.7 3.3 43 43 A 61 PHE H A 57 VAL O 1.0 1.7 2.3 44 44 A 57 VAL O A 61 PHE N 1.0 2.7 3.3 45 45 A 62 ALA H A 58 ALA O 1.0 1.7 2.3 46 46 A 58 ALA O A 62 ALA N 1.0 2.7 3.3 47 47 A 63 LYS H A 59 GLU O 1.0 1.7 2.3 48 48 A 59 GLU O A 63 LYS N 1.0 2.7 3.3 49 49 A 64 ALA H A 60 GLN O 1.0 1.7 2.3 50 50 A 60 GLN O A 64 ALA N 1.0 2.7 3.3 51 51 A 65 LEU H A 61 PHE O 1.0 1.7 2.3 52 52 A 61 PHE O A 65 LEU N 1.0 2.7 3.3 53 53 A 66 ALA H A 62 ALA O 1.0 1.7 2.3 54 54 A 62 ALA O A 66 ALA N 1.0 2.7 3.3 55 55 A 67 GLN H A 63 LYS O 1.0 1.7 2.3 56 56 A 63 LYS O A 67 GLN N 1.0 2.7 3.3 57 57 A 68 SER H A 64 ALA O 1.0 1.7 2.3 58 58 A 64 ALA O A 68 SER N 1.0 2.7 3.3 59 59 A 69 VAL H A 65 LEU O 1.0 1.7 2.3 60 60 A 65 LEU O A 69 VAL N 1.0 2.7 3.3 stop_ save_ save_CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_7 _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 B 13 GLU H B 9 ASN O 1.0 1.7 2.3 2 2 B 9 ASN O B 13 GLU N 1.0 2.7 3.3 3 3 B 14 SER H B 10 THR O 1.0 1.7 2.3 4 4 B 10 THR O B 14 SER N 1.0 2.7 3.3 5 5 B 15 LEU H B 11 GLN O 1.0 1.7 2.3 6 6 B 11 GLN O B 15 LEU N 1.0 2.7 3.3 7 7 B 16 ILE H B 12 VAL O 1.0 1.7 2.3 8 8 B 12 VAL O B 16 ILE N 1.0 2.7 3.3 9 9 B 17 ALA H B 13 GLU O 1.0 1.7 2.3 10 10 B 13 GLU O B 17 ALA N 1.0 2.7 3.3 11 11 B 18 GLU H B 14 SER O 1.0 1.7 2.3 12 12 B 14 SER O B 18 GLU N 1.0 2.7 3.3 13 13 B 19 ILE H B 15 LEU O 1.0 1.7 2.3 14 14 B 15 LEU O B 19 ILE N 1.0 2.7 3.3 15 15 B 20 LEU H B 16 ILE O 1.0 1.7 2.3 16 16 B 16 ILE O B 20 LEU N 1.0 2.7 3.3 17 17 B 21 VAL H B 17 ALA O 1.0 1.7 2.3 18 18 B 17 ALA O B 21 VAL N 1.0 2.7 3.3 19 19 B 22 VAL H B 18 GLU O 1.0 1.7 2.3 20 20 B 18 GLU O B 22 VAL N 1.0 2.7 3.3 21 21 B 23 LEU H B 19 ILE O 1.0 1.7 2.3 22 22 B 19 ILE O B 23 LEU N 1.0 2.7 3.3 23 23 B 24 GLU H B 20 LEU O 1.0 1.7 2.3 24 24 B 20 LEU O B 24 GLU N 1.0 2.7 3.3 25 25 B 25 LYS H B 21 VAL O 1.0 1.7 2.3 26 26 B 21 VAL O B 25 LYS N 1.0 2.7 3.3 27 27 B 35 MET H B 31 ASP O 1.0 1.7 2.3 28 28 B 31 ASP O B 35 MET N 1.0 2.7 3.3 29 29 B 36 ALA H B 32 LEU O 1.0 1.7 2.3 30 30 B 32 LEU O B 36 ALA N 1.0 2.7 3.3 31 31 B 37 LEU H B 33 SER O 1.0 1.7 2.3 32 32 B 33 SER O B 37 LEU N 1.0 2.7 3.3 33 33 B 38 GLY H B 34 LEU O 1.0 1.7 2.3 34 34 B 34 LEU O B 38 GLY N 1.0 2.7 3.3 35 35 B 40 CYS H B 36 ALA O 1.0 1.7 2.3 36 36 B 36 ALA O B 40 CYS N 1.0 2.7 3.3 37 37 B 41 VAL H B 37 LEU O 1.0 1.7 2.3 38 38 B 37 LEU O B 41 VAL N 1.0 2.7 3.3 39 39 B 58 ALA H B 54 ARG O 1.0 1.7 2.3 40 40 B 54 ARG O B 58 ALA N 1.0 2.7 3.3 41 41 B 59 GLU H B 55 GLN O 1.0 1.7 2.3 42 42 B 55 GLN O B 59 GLU N 1.0 2.7 3.3 43 43 B 60 GLN H B 56 ALA O 1.0 1.7 2.3 44 44 B 56 ALA O B 60 GLN N 1.0 2.7 3.3 45 45 B 61 PHE H B 57 VAL O 1.0 1.7 2.3 46 46 B 57 VAL O B 61 PHE N 1.0 2.7 3.3 47 47 B 62 ALA H B 58 ALA O 1.0 1.7 2.3 48 48 B 58 ALA O B 62 ALA N 1.0 2.7 3.3 49 49 B 63 LYS H B 59 GLU O 1.0 1.7 2.3 50 50 B 59 GLU O B 63 LYS N 1.0 2.7 3.3 51 51 B 64 ALA H B 60 GLN O 1.0 1.7 2.3 52 52 B 60 GLN O B 64 ALA N 1.0 2.7 3.3 53 53 B 65 LEU H B 61 PHE O 1.0 1.7 2.3 54 54 B 61 PHE O B 65 LEU N 1.0 2.7 3.3 55 55 B 66 ALA H B 62 ALA O 1.0 1.7 2.3 56 56 B 62 ALA O B 66 ALA N 1.0 2.7 3.3 57 57 B 67 GLN H B 63 LYS O 1.0 1.7 2.3 58 58 B 63 LYS O B 67 GLN N 1.0 2.7 3.3 59 59 B 68 SER H B 64 ALA O 1.0 1.7 2.3 60 60 B 64 ALA O B 68 SER N 1.0 2.7 3.3 61 61 B 69 VAL H B 65 LEU O 1.0 1.7 2.3 62 62 B 65 LEU O B 69 VAL N 1.0 2.7 3.3 stop_ save_ save_CNS/XPLOR_dihedral_9 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_9 _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 8 SER C A 9 ASN N A 9 ASN CA A 9 ASN C 1.0 -89.20 -29.20 PHI 2 2 A 9 ASN N A 9 ASN CA A 9 ASN C A 10 THR N 1.0 -78.37 1.63 PSI 3 3 A 9 ASN C A 10 THR N A 10 THR CA A 10 THR C 1.0 -94.42 -34.42 PHI 4 4 A 10 THR N A 10 THR CA A 10 THR C A 11 GLN N 1.0 -80.42 -0.42 PSI 5 5 A 10 THR C A 11 GLN N A 11 GLN CA A 11 GLN C 1.0 -95.45 -35.45 PHI 6 6 A 11 GLN N A 11 GLN CA A 11 GLN C A 12 VAL N 1.0 -81.34 -1.34 PSI 7 7 A 11 GLN C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -93.92 -33.92 PHI 8 8 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 GLU N 1.0 -84.54 -4.54 PSI 9 9 A 12 VAL C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -90.23 -30.23 PHI 10 10 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 SER N 1.0 -81.50 -1.50 PSI 11 11 A 13 GLU C A 14 SER N A 14 SER CA A 14 SER C 1.0 -93.16 -33.16 PHI 12 12 A 14 SER N A 14 SER CA A 14 SER C A 15 LEU N 1.0 -81.71 -1.71 PSI 13 13 A 14 SER C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -96.24 -36.24 PHI 14 14 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 ILE N 1.0 -80.63 -0.63 PSI 15 15 A 15 LEU C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -93.31 -33.31 PHI 16 16 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 ALA N 1.0 -83.45 -3.45 PSI 17 17 A 16 ILE C A 17 ALA N A 17 ALA CA A 17 ALA C 1.0 -88.59 -28.59 PHI 18 18 A 17 ALA N A 17 ALA CA A 17 ALA C A 18 GLU N 1.0 -81.36 -1.36 PSI 19 19 A 17 ALA C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -98.37 -38.37 PHI 20 20 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 ILE N 1.0 -79.56 0.44 PSI 21 21 A 18 GLU C A 19 ILE N A 19 ILE CA A 19 ILE C 1.0 -94.16 -34.16 PHI 22 22 A 19 ILE N A 19 ILE CA A 19 ILE C A 20 LEU N 1.0 -83.07 -3.07 PSI 23 23 A 19 ILE C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -90.23 -30.23 PHI 24 24 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 VAL N 1.0 -79.43 0.57 PSI 25 25 A 20 LEU C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -96.04 -36.04 PHI 26 26 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 VAL N 1.0 -84.98 -4.98 PSI 27 27 A 21 VAL C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -93.50 -33.50 PHI 28 28 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 LEU N 1.0 -83.10 -3.10 PSI 29 29 A 22 VAL C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -89.85 -29.85 PHI 30 30 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 GLU N 1.0 -79.69 0.31 PSI 31 31 A 23 LEU C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -93.11 -33.11 PHI 32 32 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 LYS N 1.0 -80.47 -0.47 PSI 33 33 A 24 GLU C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -96.48 -36.48 PHI 34 34 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 HIS N 1.0 -66.97 13.03 PSI 35 35 A 25 LYS C A 26 HIS N A 26 HIS CA A 26 HIS C 1.0 -120.13 -60.13 PHI 36 36 A 26 HIS N A 26 HIS CA A 26 HIS C A 27 LYS N 1.0 -38.14 41.86 PSI 37 37 A 28 ALA C A 29 PRO N A 29 PRO CA A 29 PRO C 1.0 -106.86 -46.86 PHI 38 38 A 29 PRO N A 29 PRO CA A 29 PRO C A 30 THR N 1.0 98.88 178.88 PSI 39 39 A 29 PRO C A 30 THR N A 30 THR CA A 30 THR C 1.0 -86.56 -26.56 PHI 40 40 A 30 THR N A 30 THR CA A 30 THR C A 31 ASP N 1.0 -85.56 -5.56 PSI 41 41 A 30 THR C A 31 ASP N A 31 ASP CA A 31 ASP C 1.0 -94.05 -34.05 PHI 42 42 A 31 ASP N A 31 ASP CA A 31 ASP C A 32 LEU N 1.0 -79.21 0.79 PSI 43 43 A 31 ASP C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -96.20 -36.20 PHI 44 44 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 SER N 1.0 -77.93 2.07 PSI 45 45 A 32 LEU C A 33 SER N A 33 SER CA A 33 SER C 1.0 -91.55 -31.55 PHI 46 46 A 33 SER N A 33 SER CA A 33 SER C A 34 LEU N 1.0 -83.25 -3.25 PSI 47 47 A 33 SER C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -92.67 -32.67 PHI 48 48 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 MET N 1.0 -77.88 2.12 PSI 49 49 A 34 LEU C A 35 MET N A 35 MET CA A 35 MET C 1.0 -95.30 -35.30 PHI 50 50 A 35 MET N A 35 MET CA A 35 MET C A 36 ALA N 1.0 -78.67 1.33 PSI 51 51 A 35 MET C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -96.02 -36.02 PHI 52 52 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 LEU N 1.0 -80.40 -0.40 PSI 53 53 A 36 ALA C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -97.76 -37.76 PHI 54 54 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 GLY N 1.0 -76.32 3.68 PSI 55 55 A 37 LEU C A 38 GLY N A 38 GLY CA A 38 GLY C 1.0 -100.23 -40.23 PHI 56 56 A 38 GLY N A 38 GLY CA A 38 GLY C A 39 ASN N 1.0 -80.56 -0.56 PSI 57 57 A 38 GLY C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -95.22 -35.22 PHI 58 58 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 CYS N 1.0 -75.12 4.88 PSI 59 59 A 39 ASN C A 40 CYS N A 40 CYS CA A 40 CYS C 1.0 -95.83 -35.83 PHI 60 60 A 40 CYS N A 40 CYS CA A 40 CYS C A 41 VAL N 1.0 -82.16 -2.16 PSI 61 61 A 40 CYS C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -93.33 -33.33 PHI 62 62 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 THR N 1.0 -83.74 -3.74 PSI 63 63 A 41 VAL C A 42 THR N A 42 THR CA A 42 THR C 1.0 -90.00 -30.00 PHI 64 64 A 42 THR N A 42 THR CA A 42 THR C A 43 HIS N 1.0 -81.43 -1.43 PSI 65 65 A 42 THR C A 43 HIS N A 43 HIS CA A 43 HIS C 1.0 -92.08 -32.08 PHI 66 66 A 43 HIS N A 43 HIS CA A 43 HIS C A 44 LEU N 1.0 -83.26 -3.26 PSI 67 67 A 43 HIS C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -93.28 -33.28 PHI 68 68 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 LEU N 1.0 -82.58 -2.58 PSI 69 69 A 44 LEU C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -95.53 -35.53 PHI 70 70 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLU N 1.0 -80.12 -0.12 PSI 71 71 A 45 LEU C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -96.56 -36.56 PHI 72 72 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 ARG N 1.0 -78.76 1.24 PSI 73 73 A 46 GLU C A 47 ARG N A 47 ARG CA A 47 ARG C 1.0 -107.70 -47.70 PHI 74 74 A 47 ARG N A 47 ARG CA A 47 ARG C A 48 LYS N 1.0 -67.13 12.87 PSI 75 75 A 47 ARG C A 48 LYS N A 48 LYS CA A 48 LYS C 1.0 -130.63 -70.63 PHI 76 76 A 48 LYS N A 48 LYS CA A 48 LYS C A 49 VAL N 1.0 -51.00 29.00 PSI 77 77 A 48 LYS C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -123.70 -63.70 PHI 78 78 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 PRO N 1.0 88.91 168.91 PSI 79 79 A 49 VAL C A 50 PRO N A 50 PRO CA A 50 PRO C 1.0 -92.07 -32.07 PHI 80 80 A 50 PRO N A 50 PRO CA A 50 PRO C A 51 SER N 1.0 101.96 181.96 PSI 81 81 A 50 PRO C A 51 SER N A 51 SER CA A 51 SER C 1.0 -86.64 -26.64 PHI 82 82 A 51 SER N A 51 SER CA A 51 SER C A 52 GLU N 1.0 -76.92 3.08 PSI 83 83 A 51 SER C A 52 GLU N A 52 GLU CA A 52 GLU C 1.0 -99.37 -39.37 PHI 84 84 A 52 GLU N A 52 GLU CA A 52 GLU C A 53 SER N 1.0 -70.89 9.11 PSI 85 85 A 52 GLU C A 53 SER N A 53 SER CA A 53 SER C 1.0 -130.76 -70.76 PHI 86 86 A 53 SER N A 53 SER CA A 53 SER C A 54 ARG N 1.0 -33.76 46.24 PSI 87 87 A 53 SER C A 54 ARG N A 54 ARG CA A 54 ARG C 1.0 -90.15 -30.15 PHI 88 88 A 54 ARG N A 54 ARG CA A 54 ARG C A 55 GLN N 1.0 -78.51 1.49 PSI 89 89 A 54 ARG C A 55 GLN N A 55 GLN CA A 55 GLN C 1.0 -91.69 -31.69 PHI 90 90 A 55 GLN N A 55 GLN CA A 55 GLN C A 56 ALA N 1.0 -80.85 -0.85 PSI 91 91 A 55 GLN C A 56 ALA N A 56 ALA CA A 56 ALA C 1.0 -92.34 -32.34 PHI 92 92 A 56 ALA N A 56 ALA CA A 56 ALA C A 57 VAL N 1.0 -79.42 0.58 PSI 93 93 A 56 ALA C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -98.27 -38.27 PHI 94 94 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 ALA N 1.0 -84.59 -4.59 PSI 95 95 A 57 VAL C A 58 ALA N A 58 ALA CA A 58 ALA C 1.0 -90.35 -30.35 PHI 96 96 A 58 ALA N A 58 ALA CA A 58 ALA C A 59 GLU N 1.0 -81.00 -1.00 PSI 97 97 A 58 ALA C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -94.20 -34.20 PHI 98 98 A 59 GLU N A 59 GLU CA A 59 GLU C A 60 GLN N 1.0 -81.31 -1.31 PSI 99 99 A 59 GLU C A 60 GLN N A 60 GLN CA A 60 GLN C 1.0 -98.33 -38.33 PHI 100 100 A 60 GLN N A 60 GLN CA A 60 GLN C A 61 PHE N 1.0 -77.61 2.39 PSI 101 101 A 60 GLN C A 61 PHE N A 61 PHE CA A 61 PHE C 1.0 -95.96 -35.96 PHI 102 102 A 61 PHE N A 61 PHE CA A 61 PHE C A 62 ALA N 1.0 -81.80 -1.80 PSI 103 103 A 61 PHE C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -96.52 -36.52 PHI 104 104 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 LYS N 1.0 -80.59 -0.59 PSI 105 105 A 62 ALA C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -95.86 -35.86 PHI 106 106 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 ALA N 1.0 -82.72 -2.72 PSI 107 107 A 63 LYS C A 64 ALA N A 64 ALA CA A 64 ALA C 1.0 -94.50 -34.50 PHI 108 108 A 64 ALA N A 64 ALA CA A 64 ALA C A 65 LEU N 1.0 -78.05 1.95 PSI 109 109 A 64 ALA C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -91.80 -31.80 PHI 110 110 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 ALA N 1.0 -80.50 -0.50 PSI 111 111 A 65 LEU C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -95.22 -35.22 PHI 112 112 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 GLN N 1.0 -77.69 2.31 PSI 113 113 A 66 ALA C A 67 GLN N A 67 GLN CA A 67 GLN C 1.0 -92.76 -32.76 PHI 114 114 A 67 GLN N A 67 GLN CA A 67 GLN C A 68 SER N 1.0 -79.78 0.22 PSI 115 115 A 67 GLN C A 68 SER N A 68 SER CA A 68 SER C 1.0 -96.63 -36.63 PHI 116 116 A 68 SER N A 68 SER CA A 68 SER C A 69 VAL N 1.0 -75.93 4.07 PSI 117 117 A 68 SER C A 69 VAL N A 69 VAL CA A 69 VAL C 1.0 -95.85 -35.85 PHI 118 118 A 69 VAL N A 69 VAL CA A 69 VAL C A 70 LYS N 1.0 -83.55 -3.55 PSI 119 119 A 69 VAL C A 70 LYS N A 70 LYS CA A 70 LYS C 1.0 -90.10 -30.10 PHI 120 120 A 70 LYS N A 70 LYS CA A 70 LYS C A 71 SER N 1.0 -81.33 -1.33 PSI 121 121 A 70 LYS C A 71 SER N A 71 SER CA A 71 SER C 1.0 -93.32 -33.32 PHI 122 122 A 71 SER N A 71 SER CA A 71 SER C A 72 ASN N 1.0 -79.46 0.54 PSI 123 123 A 71 SER C A 72 ASN N A 72 ASN CA A 72 ASN C 1.0 -94.21 -34.21 PHI 124 124 A 72 ASN N A 72 ASN CA A 72 ASN C A 73 LEU N 1.0 -84.20 -4.20 PSI 125 125 A 72 ASN C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -100.87 -40.87 PHI 126 126 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 GLU N 1.0 -72.20 7.80 PSI 127 127 B 8 SER C B 9 ASN N B 9 ASN CA B 9 ASN C 1.0 -89.20 -29.20 PHI 128 128 B 9 ASN N B 9 ASN CA B 9 ASN C B 10 THR N 1.0 -78.37 1.63 PSI 129 129 B 9 ASN C B 10 THR N B 10 THR CA B 10 THR C 1.0 -94.42 -34.42 PHI 130 130 B 10 THR N B 10 THR CA B 10 THR C B 11 GLN N 1.0 -80.42 -0.42 PSI 131 131 B 10 THR C B 11 GLN N B 11 GLN CA B 11 GLN C 1.0 -95.45 -35.45 PHI 132 132 B 11 GLN N B 11 GLN CA B 11 GLN C B 12 VAL N 1.0 -81.34 -1.34 PSI 133 133 B 11 GLN C B 12 VAL N B 12 VAL CA B 12 VAL C 1.0 -93.92 -33.92 PHI 134 134 B 12 VAL N B 12 VAL CA B 12 VAL C B 13 GLU N 1.0 -84.54 -4.54 PSI 135 135 B 12 VAL C B 13 GLU N B 13 GLU CA B 13 GLU C 1.0 -90.23 -30.23 PHI 136 136 B 13 GLU N B 13 GLU CA B 13 GLU C B 14 SER N 1.0 -81.50 -1.50 PSI 137 137 B 13 GLU C B 14 SER N B 14 SER CA B 14 SER C 1.0 -93.16 -33.16 PHI 138 138 B 14 SER N B 14 SER CA B 14 SER C B 15 LEU N 1.0 -81.71 -1.71 PSI 139 139 B 14 SER C B 15 LEU N B 15 LEU CA B 15 LEU C 1.0 -96.24 -36.24 PHI 140 140 B 15 LEU N B 15 LEU CA B 15 LEU C B 16 ILE N 1.0 -80.63 -0.63 PSI 141 141 B 15 LEU C B 16 ILE N B 16 ILE CA B 16 ILE C 1.0 -93.31 -33.31 PHI 142 142 B 16 ILE N B 16 ILE CA B 16 ILE C B 17 ALA N 1.0 -83.45 -3.45 PSI 143 143 B 16 ILE C B 17 ALA N B 17 ALA CA B 17 ALA C 1.0 -88.59 -28.59 PHI 144 144 B 17 ALA N B 17 ALA CA B 17 ALA C B 18 GLU N 1.0 -81.36 -1.36 PSI 145 145 B 17 ALA C B 18 GLU N B 18 GLU CA B 18 GLU C 1.0 -98.37 -38.37 PHI 146 146 B 18 GLU N B 18 GLU CA B 18 GLU C B 19 ILE N 1.0 -79.56 0.44 PSI 147 147 B 18 GLU C B 19 ILE N B 19 ILE CA B 19 ILE C 1.0 -94.16 -34.16 PHI 148 148 B 19 ILE N B 19 ILE CA B 19 ILE C B 20 LEU N 1.0 -83.07 -3.07 PSI 149 149 B 19 ILE C B 20 LEU N B 20 LEU CA B 20 LEU C 1.0 -90.23 -30.23 PHI 150 150 B 20 LEU N B 20 LEU CA B 20 LEU C B 21 VAL N 1.0 -79.43 0.57 PSI 151 151 B 20 LEU C B 21 VAL N B 21 VAL CA B 21 VAL C 1.0 -96.04 -36.04 PHI 152 152 B 21 VAL N B 21 VAL CA B 21 VAL C B 22 VAL N 1.0 -84.98 -4.98 PSI 153 153 B 21 VAL C B 22 VAL N B 22 VAL CA B 22 VAL C 1.0 -93.50 -33.50 PHI 154 154 B 22 VAL N B 22 VAL CA B 22 VAL C B 23 LEU N 1.0 -83.10 -3.10 PSI 155 155 B 22 VAL C B 23 LEU N B 23 LEU CA B 23 LEU C 1.0 -89.85 -29.85 PHI 156 156 B 23 LEU N B 23 LEU CA B 23 LEU C B 24 GLU N 1.0 -79.69 0.31 PSI 157 157 B 23 LEU C B 24 GLU N B 24 GLU CA B 24 GLU C 1.0 -93.11 -33.11 PHI 158 158 B 24 GLU N B 24 GLU CA B 24 GLU C B 25 LYS N 1.0 -80.47 -0.47 PSI 159 159 B 24 GLU C B 25 LYS N B 25 LYS CA B 25 LYS C 1.0 -96.48 -36.48 PHI 160 160 B 25 LYS N B 25 LYS CA B 25 LYS C B 26 HIS N 1.0 -66.97 13.03 PSI 161 161 B 25 LYS C B 26 HIS N B 26 HIS CA B 26 HIS C 1.0 -120.13 -60.13 PHI 162 162 B 26 HIS N B 26 HIS CA B 26 HIS C B 27 LYS N 1.0 -38.14 41.86 PSI 163 163 B 28 ALA C B 29 PRO N B 29 PRO CA B 29 PRO C 1.0 -106.86 -46.86 PHI 164 164 B 29 PRO N B 29 PRO CA B 29 PRO C B 30 THR N 1.0 98.88 178.88 PSI 165 165 B 29 PRO C B 30 THR N B 30 THR CA B 30 THR C 1.0 -86.56 -26.56 PHI 166 166 B 30 THR N B 30 THR CA B 30 THR C B 31 ASP N 1.0 -85.56 -5.56 PSI 167 167 B 30 THR C B 31 ASP N B 31 ASP CA B 31 ASP C 1.0 -94.05 -34.05 PHI 168 168 B 31 ASP N B 31 ASP CA B 31 ASP C B 32 LEU N 1.0 -79.21 0.79 PSI 169 169 B 31 ASP C B 32 LEU N B 32 LEU CA B 32 LEU C 1.0 -96.20 -36.20 PHI 170 170 B 32 LEU N B 32 LEU CA B 32 LEU C B 33 SER N 1.0 -77.93 2.07 PSI 171 171 B 32 LEU C B 33 SER N B 33 SER CA B 33 SER C 1.0 -91.55 -31.55 PHI 172 172 B 33 SER N B 33 SER CA B 33 SER C B 34 LEU N 1.0 -83.25 -3.25 PSI 173 173 B 33 SER C B 34 LEU N B 34 LEU CA B 34 LEU C 1.0 -92.67 -32.67 PHI 174 174 B 34 LEU N B 34 LEU CA B 34 LEU C B 35 MET N 1.0 -77.88 2.12 PSI 175 175 B 34 LEU C B 35 MET N B 35 MET CA B 35 MET C 1.0 -95.30 -35.30 PHI 176 176 B 35 MET N B 35 MET CA B 35 MET C B 36 ALA N 1.0 -78.67 1.33 PSI 177 177 B 35 MET C B 36 ALA N B 36 ALA CA B 36 ALA C 1.0 -96.02 -36.02 PHI 178 178 B 36 ALA N B 36 ALA CA B 36 ALA C B 37 LEU N 1.0 -80.40 -0.40 PSI 179 179 B 36 ALA C B 37 LEU N B 37 LEU CA B 37 LEU C 1.0 -97.76 -37.76 PHI 180 180 B 37 LEU N B 37 LEU CA B 37 LEU C B 38 GLY N 1.0 -76.32 3.68 PSI 181 181 B 37 LEU C B 38 GLY N B 38 GLY CA B 38 GLY C 1.0 -100.23 -40.23 PHI 182 182 B 38 GLY N B 38 GLY CA B 38 GLY C B 39 ASN N 1.0 -80.56 -0.56 PSI 183 183 B 38 GLY C B 39 ASN N B 39 ASN CA B 39 ASN C 1.0 -95.22 -35.22 PHI 184 184 B 39 ASN N B 39 ASN CA B 39 ASN C B 40 CYS N 1.0 -75.12 4.88 PSI 185 185 B 39 ASN C B 40 CYS N B 40 CYS CA B 40 CYS C 1.0 -95.83 -35.83 PHI 186 186 B 40 CYS N B 40 CYS CA B 40 CYS C B 41 VAL N 1.0 -82.16 -2.16 PSI 187 187 B 40 CYS C B 41 VAL N B 41 VAL CA B 41 VAL C 1.0 -93.33 -33.33 PHI 188 188 B 41 VAL N B 41 VAL CA B 41 VAL C B 42 THR N 1.0 -83.74 -3.74 PSI 189 189 B 41 VAL C B 42 THR N B 42 THR CA B 42 THR C 1.0 -90.00 -30.00 PHI 190 190 B 42 THR N B 42 THR CA B 42 THR C B 43 HIS N 1.0 -81.43 -1.43 PSI 191 191 B 42 THR C B 43 HIS N B 43 HIS CA B 43 HIS C 1.0 -92.08 -32.08 PHI 192 192 B 43 HIS N B 43 HIS CA B 43 HIS C B 44 LEU N 1.0 -83.26 -3.26 PSI 193 193 B 43 HIS C B 44 LEU N B 44 LEU CA B 44 LEU C 1.0 -93.28 -33.28 PHI 194 194 B 44 LEU N B 44 LEU CA B 44 LEU C B 45 LEU N 1.0 -82.58 -2.58 PSI 195 195 B 44 LEU C B 45 LEU N B 45 LEU CA B 45 LEU C 1.0 -95.53 -35.53 PHI 196 196 B 45 LEU N B 45 LEU CA B 45 LEU C B 46 GLU N 1.0 -80.12 -0.12 PSI 197 197 B 45 LEU C B 46 GLU N B 46 GLU CA B 46 GLU C 1.0 -96.56 -36.56 PHI 198 198 B 46 GLU N B 46 GLU CA B 46 GLU C B 47 ARG N 1.0 -78.76 1.24 PSI 199 199 B 46 GLU C B 47 ARG N B 47 ARG CA B 47 ARG C 1.0 -107.70 -47.70 PHI 200 200 B 47 ARG N B 47 ARG CA B 47 ARG C B 48 LYS N 1.0 -67.13 12.87 PSI 201 201 B 47 ARG C B 48 LYS N B 48 LYS CA B 48 LYS C 1.0 -130.63 -70.63 PHI 202 202 B 48 LYS N B 48 LYS CA B 48 LYS C B 49 VAL N 1.0 -51.00 29.00 PSI 203 203 B 48 LYS C B 49 VAL N B 49 VAL CA B 49 VAL C 1.0 -123.70 -63.70 PHI 204 204 B 49 VAL N B 49 VAL CA B 49 VAL C B 50 PRO N 1.0 88.91 168.91 PSI 205 205 B 49 VAL C B 50 PRO N B 50 PRO CA B 50 PRO C 1.0 -92.07 -32.07 PHI 206 206 B 50 PRO N B 50 PRO CA B 50 PRO C B 51 SER N 1.0 101.96 181.96 PSI 207 207 B 50 PRO C B 51 SER N B 51 SER CA B 51 SER C 1.0 -86.64 -26.64 PHI 208 208 B 51 SER N B 51 SER CA B 51 SER C B 52 GLU N 1.0 -76.92 3.08 PSI 209 209 B 51 SER C B 52 GLU N B 52 GLU CA B 52 GLU C 1.0 -99.37 -39.37 PHI 210 210 B 52 GLU N B 52 GLU CA B 52 GLU C B 53 SER N 1.0 -70.89 9.11 PSI 211 211 B 52 GLU C B 53 SER N B 53 SER CA B 53 SER C 1.0 -130.76 -70.76 PHI 212 212 B 53 SER N B 53 SER CA B 53 SER C B 54 ARG N 1.0 -33.76 46.24 PSI 213 213 B 53 SER C B 54 ARG N B 54 ARG CA B 54 ARG C 1.0 -90.15 -30.15 PHI 214 214 B 54 ARG N B 54 ARG CA B 54 ARG C B 55 GLN N 1.0 -78.51 1.49 PSI 215 215 B 54 ARG C B 55 GLN N B 55 GLN CA B 55 GLN C 1.0 -91.69 -31.69 PHI 216 216 B 55 GLN N B 55 GLN CA B 55 GLN C B 56 ALA N 1.0 -80.85 -0.85 PSI 217 217 B 55 GLN C B 56 ALA N B 56 ALA CA B 56 ALA C 1.0 -92.34 -32.34 PHI 218 218 B 56 ALA N B 56 ALA CA B 56 ALA C B 57 VAL N 1.0 -79.42 0.58 PSI 219 219 B 56 ALA C B 57 VAL N B 57 VAL CA B 57 VAL C 1.0 -98.27 -38.27 PHI 220 220 B 57 VAL N B 57 VAL CA B 57 VAL C B 58 ALA N 1.0 -84.59 -4.59 PSI 221 221 B 57 VAL C B 58 ALA N B 58 ALA CA B 58 ALA C 1.0 -90.35 -30.35 PHI 222 222 B 58 ALA N B 58 ALA CA B 58 ALA C B 59 GLU N 1.0 -81.00 -1.00 PSI 223 223 B 58 ALA C B 59 GLU N B 59 GLU CA B 59 GLU C 1.0 -94.20 -34.20 PHI 224 224 B 59 GLU N B 59 GLU CA B 59 GLU C B 60 GLN N 1.0 -81.31 -1.31 PSI 225 225 B 59 GLU C B 60 GLN N B 60 GLN CA B 60 GLN C 1.0 -98.33 -38.33 PHI 226 226 B 60 GLN N B 60 GLN CA B 60 GLN C B 61 PHE N 1.0 -77.61 2.39 PSI 227 227 B 60 GLN C B 61 PHE N B 61 PHE CA B 61 PHE C 1.0 -95.96 -35.96 PHI 228 228 B 61 PHE N B 61 PHE CA B 61 PHE C B 62 ALA N 1.0 -81.80 -1.80 PSI 229 229 B 61 PHE C B 62 ALA N B 62 ALA CA B 62 ALA C 1.0 -96.52 -36.52 PHI 230 230 B 62 ALA N B 62 ALA CA B 62 ALA C B 63 LYS N 1.0 -80.59 -0.59 PSI 231 231 B 62 ALA C B 63 LYS N B 63 LYS CA B 63 LYS C 1.0 -95.86 -35.86 PHI 232 232 B 63 LYS N B 63 LYS CA B 63 LYS C B 64 ALA N 1.0 -82.72 -2.72 PSI 233 233 B 63 LYS C B 64 ALA N B 64 ALA CA B 64 ALA C 1.0 -94.50 -34.50 PHI 234 234 B 64 ALA N B 64 ALA CA B 64 ALA C B 65 LEU N 1.0 -78.05 1.95 PSI 235 235 B 64 ALA C B 65 LEU N B 65 LEU CA B 65 LEU C 1.0 -91.80 -31.80 PHI 236 236 B 65 LEU N B 65 LEU CA B 65 LEU C B 66 ALA N 1.0 -80.50 -0.50 PSI 237 237 B 65 LEU C B 66 ALA N B 66 ALA CA B 66 ALA C 1.0 -95.22 -35.22 PHI 238 238 B 66 ALA N B 66 ALA CA B 66 ALA C B 67 GLN N 1.0 -77.69 2.31 PSI 239 239 B 66 ALA C B 67 GLN N B 67 GLN CA B 67 GLN C 1.0 -92.76 -32.76 PHI 240 240 B 67 GLN N B 67 GLN CA B 67 GLN C B 68 SER N 1.0 -79.78 0.22 PSI 241 241 B 67 GLN C B 68 SER N B 68 SER CA B 68 SER C 1.0 -96.63 -36.63 PHI 242 242 B 68 SER N B 68 SER CA B 68 SER C B 69 VAL N 1.0 -75.93 4.07 PSI 243 243 B 68 SER C B 69 VAL N B 69 VAL CA B 69 VAL C 1.0 -95.85 -35.85 PHI 244 244 B 69 VAL N B 69 VAL CA B 69 VAL C B 70 LYS N 1.0 -83.55 -3.55 PSI 245 245 B 69 VAL C B 70 LYS N B 70 LYS CA B 70 LYS C 1.0 -90.10 -30.10 PHI 246 246 B 70 LYS N B 70 LYS CA B 70 LYS C B 71 SER N 1.0 -81.33 -1.33 PSI 247 247 B 70 LYS C B 71 SER N B 71 SER CA B 71 SER C 1.0 -93.32 -33.32 PHI 248 248 B 71 SER N B 71 SER CA B 71 SER C B 72 ASN N 1.0 -79.46 0.54 PSI 249 249 B 71 SER C B 72 ASN N B 72 ASN CA B 72 ASN C 1.0 -94.21 -34.21 PHI 250 250 B 72 ASN N B 72 ASN CA B 72 ASN C B 73 LEU N 1.0 -84.20 -4.20 PSI 251 251 B 72 ASN C B 73 LEU N B 73 LEU CA B 73 LEU C 1.0 -100.87 -40.87 PHI 252 252 B 73 LEU N B 73 LEU CA B 73 LEU C B 74 GLU N 1.0 -72.20 7.80 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 15N 1519.0 2 1H 7500 3 1H 12001.2 stop_ save_ save_c13_noesy_aliph _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode c13_noesy_aliph _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 4522.3 2 1H 7500.5 3 1H 12001.2 stop_ save_ save_c13_noesy_arom _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode c13_noesy_arom _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3768.6 2 1H 7500.5 3 1H 12001.2 stop_ save_ save_d2o_c13_noesy_aliph _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode d2o_c13_noesy_aliph _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3620.07 2 1H 5998.8 3 1H 11001.1 stop_ save_ save_4d_noesy _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode 4d_noesy _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3121.3 2 13C 3121.3 3 1H 4197.3 4 1H 8000 stop_ save_