data_nef_c17736_2lf2 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 ARG middle . . 3 A 3 THR middle . . 4 A 4 ASP middle . . 5 A 5 LEU middle . . 6 A 6 ALA middle . . 7 A 7 LEU middle . . 8 A 8 ASP middle . . 9 A 9 PHE middle . . 10 A 10 SER middle . . 11 A 11 VAL middle . . 12 A 12 ASN middle . . 13 A 13 LYS middle . . 14 A 14 GLU middle . . 15 A 15 ASN middle . . 16 A 16 LYS middle . . 17 A 17 THR middle . . 18 A 18 ILE middle . . 19 A 19 THR middle . . 20 A 20 ILE middle . . 21 A 21 LYS middle . . 22 A 22 ARG middle . . 23 A 23 GLU middle . . 24 A 24 PHE middle . . 25 A 25 ALA middle . . 26 A 26 ALA middle . . 27 A 27 VAL middle . . 28 A 28 ARG middle . . 29 A 29 ALA middle . . 30 A 30 ILE middle . . 31 A 31 VAL middle . . 32 A 32 TRP middle . . 33 A 33 GLU middle . . 34 A 34 ALA middle . . 35 A 35 PHE middle . . 36 A 36 THR middle . . 37 A 37 ARG middle . . 38 A 38 ALA middle . . 39 A 39 GLU middle . . 40 A 40 ILE middle . . 41 A 41 LEU middle . . 42 A 42 ASP middle . . 43 A 43 GLN middle . . 44 A 44 TRP middle . . 45 A 45 TRP middle . . 46 A 46 ALA middle . . 47 A 47 PRO middle . false 48 A 48 LYS middle . . 49 A 49 PRO middle . false 50 A 50 TRP middle . . 51 A 51 LYS middle . . 52 A 52 ALA middle . . 53 A 53 LYS middle . . 54 A 54 THR middle . . 55 A 55 LYS middle . . 56 A 56 SER middle . . 57 A 57 MET middle . . 58 A 58 ASP middle . . 59 A 59 PHE middle . . 60 A 60 LYS middle . . 61 A 61 GLU middle . . 62 A 62 GLY middle . false 63 A 63 GLY middle . false 64 A 64 THR middle . . 65 A 65 TRP middle . . 66 A 66 LEU middle . . 67 A 67 TYR middle . . 68 A 68 ALA middle . . 69 A 69 MET middle . . 70 A 70 VAL middle . . 71 A 71 GLY middle . false 72 A 72 PRO middle . false 73 A 73 ASN middle . . 74 A 74 GLY middle . false 75 A 75 GLU middle . . 76 A 76 GLU middle . . 77 A 77 HIS middle . . 78 A 78 TRP middle . . 79 A 79 SER middle . . 80 A 80 ILE middle . . 81 A 81 CYS middle . . 82 A 82 GLU middle . . 83 A 83 TYR middle . . 84 A 84 ALA middle . . 85 A 85 ILE middle . . 86 A 86 ILE middle . . 87 A 87 LYS middle . . 88 A 88 PRO middle . false 89 A 89 ILE middle . . 90 A 90 GLU middle . . 91 A 91 ARG middle . . 92 A 92 PHE middle . . 93 A 93 THR middle . . 94 A 94 GLY middle . false 95 A 95 LYS middle . . 96 A 96 ASP middle . . 97 A 97 GLY middle . false 98 A 98 PHE middle . . 99 A 99 THR middle . . 100 A 100 ASP middle . . 101 A 101 ALA middle . . 102 A 102 SER middle . . 103 A 103 GLY middle . false 104 A 104 LYS middle . . 105 A 105 LEU middle . . 106 A 106 ASN middle . . 107 A 107 THR middle . . 108 A 108 GLU middle . . 109 A 109 MET middle . . 110 A 110 PRO middle . false 111 A 111 ARG middle . . 112 A 112 SER middle . . 113 A 113 ASN middle . . 114 A 114 TRP middle . . 115 A 115 ASP middle . . 116 A 116 MET middle . . 117 A 117 ARG middle . . 118 A 118 PHE middle . . 119 A 119 ILE middle . . 120 A 120 ASP middle . . 121 A 121 LYS middle . . 122 A 122 GLY middle . false 123 A 123 GLU middle . . 124 A 124 ILE middle . . 125 A 125 THR middle . . 126 A 126 GLU middle . . 127 A 127 VAL middle . . 128 A 128 GLN middle . . 129 A 129 TYR middle . . 130 A 130 HIS middle . . 131 A 131 ILE middle . . 132 A 132 SER middle . . 133 A 133 TYR middle . . 134 A 134 ASP middle . . 135 A 135 ASP middle . . 136 A 136 VAL middle . . 137 A 137 ALA middle . . 138 A 138 GLN middle . . 139 A 139 LEU middle . . 140 A 140 GLU middle . . 141 A 141 ALA middle . . 142 A 142 THR middle . . 143 A 143 ILE middle . . 144 A 144 GLN middle . . 145 A 145 MET middle . . 146 A 146 GLY middle . false 147 A 147 PHE middle . . 148 A 148 LYS middle . . 149 A 149 GLU middle . . 150 A 150 GLY middle . false 151 A 151 ILE middle . . 152 A 152 THR middle . . 153 A 153 MET middle . . 154 A 154 ALA middle . . 155 A 155 MET middle . . 156 A 156 GLU middle . . 157 A 157 ASN middle . . 158 A 158 LEU middle . . 159 A 159 ASP middle . . 160 A 160 GLU middle . . 161 A 161 LEU middle . . 162 A 162 LEU middle . . 163 A 163 VAL middle . . 164 A 164 SER middle . . 165 A 165 GLY middle . false 166 A 166 LYS middle . . 167 A 167 LYS middle . . 168 A 168 LEU middle . . 169 A 169 GLU middle . . 170 A 170 HIS middle . . 171 A 171 HIS middle . . 172 A 172 HIS middle . . 173 A 173 HIS middle . . 174 A 174 HIS middle . . 175 A 175 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 ARG H H 1 8.65 0.02 A 2 ARG HA H 1 4.46 0.02 A 2 ARG HBx H 1 1.83 0.02 A 2 ARG HBy H 1 1.99 0.02 A 2 ARG HDx H 1 3.24 0.02 A 2 ARG HDy H 1 3.24 0.02 A 2 ARG HGx H 1 1.70 0.02 A 2 ARG HGy H 1 1.70 0.02 A 2 ARG C C 13 176.5 0.2 A 2 ARG CA C 13 56.4 0.2 A 2 ARG CB C 13 31.2 0.2 A 2 ARG CD C 13 43.5 0.2 A 2 ARG CG C 13 26.9 0.2 A 3 THR H H 1 8.42 0.02 A 3 THR HA H 1 4.34 0.02 A 3 THR HB H 1 4.33 0.02 A 3 THR HG2% H 1 1.22 0.02 A 3 THR C C 13 174.3 0.2 A 3 THR CA C 13 62.2 0.2 A 3 THR CB C 13 69.5 0.2 A 3 THR CG2 C 13 21.7 0.2 A 3 THR N N 15 114.2 0.2 A 4 ASP H H 1 8.63 0.02 A 4 ASP HA H 1 4.57 0.02 A 4 ASP HBx H 1 2.62 0.02 A 4 ASP HBy H 1 2.70 0.02 A 4 ASP C C 13 175.2 0.2 A 4 ASP CA C 13 54.0 0.2 A 4 ASP CB C 13 40.4 0.2 A 4 ASP N N 15 120.9 0.2 A 5 LEU H H 1 7.58 0.02 A 5 LEU HA H 1 4.43 0.02 A 5 LEU HBx H 1 1.47 0.02 A 5 LEU HBy H 1 1.57 0.02 A 5 LEU HD1% H 1 0.92 0.02 A 5 LEU HD2% H 1 0.69 0.02 A 5 LEU HG H 1 1.52 0.02 A 5 LEU C C 13 176.2 0.2 A 5 LEU CA C 13 54.2 0.2 A 5 LEU CB C 13 42.0 0.2 A 5 LEU CD1 C 13 26.2 0.2 A 5 LEU CD2 C 13 22.9 0.2 A 5 LEU CG C 13 26.8 0.2 A 5 LEU N N 15 121.9 0.2 A 6 ALA H H 1 8.75 0.02 A 6 ALA HA H 1 4.15 0.02 A 6 ALA HB% H 1 1.20 0.02 A 6 ALA C C 13 176.1 0.2 A 6 ALA CA C 13 52.7 0.2 A 6 ALA CB C 13 20.0 0.2 A 6 ALA N N 15 126.5 0.2 A 7 LEU H H 1 7.83 0.02 A 7 LEU HA H 1 5.07 0.02 A 7 LEU HBx H 1 1.43 0.02 A 7 LEU HBy H 1 1.73 0.02 A 7 LEU HD1% H 1 0.96 0.02 A 7 LEU HD2% H 1 0.97 0.02 A 7 LEU C C 13 175.1 0.2 A 7 LEU CA C 13 54.5 0.2 A 7 LEU CB C 13 44.6 0.2 A 7 LEU CD1 C 13 24.4 0.2 A 7 LEU CD2 C 13 26.6 0.2 A 7 LEU CG C 13 26.5 0.2 A 7 LEU N N 15 119.8 0.2 A 8 ASP H H 1 9.20 0.02 A 8 ASP HA H 1 4.94 0.02 A 8 ASP HBx H 1 2.52 0.02 A 8 ASP HBy H 1 2.68 0.02 A 8 ASP C C 13 173.3 0.2 A 8 ASP CA C 13 53.8 0.2 A 8 ASP CB C 13 44.6 0.2 A 8 ASP N N 15 127.4 0.2 A 9 PHE H H 1 8.59 0.02 A 9 PHE HA H 1 4.89 0.02 A 9 PHE HBx H 1 2.50 0.02 A 9 PHE HBy H 1 3.25 0.02 A 9 PHE HDx H 1 6.99 0.02 A 9 PHE HDy H 1 6.99 0.02 A 9 PHE HEx H 1 7.07 0.02 A 9 PHE HEy H 1 7.07 0.02 A 9 PHE C C 13 174.1 0.2 A 9 PHE CA C 13 57.3 0.2 A 9 PHE CB C 13 42.5 0.2 A 9 PHE CDx C 13 132.0 0.2 A 9 PHE CDy C 13 132.0 0.2 A 9 PHE CEx C 13 129.0 0.2 A 9 PHE CEy C 13 129.0 0.2 A 9 PHE N N 15 127.5 0.2 A 10 SER H H 1 8.68 0.02 A 10 SER HA H 1 4.89 0.02 A 10 SER HBx H 1 3.72 0.02 A 10 SER HBy H 1 3.76 0.02 A 10 SER C C 13 172.5 0.2 A 10 SER CA C 13 57.3 0.2 A 10 SER CB C 13 65.3 0.2 A 10 SER N N 15 122.3 0.2 A 11 VAL H H 1 8.81 0.02 A 11 VAL HA H 1 4.40 0.02 A 11 VAL HB H 1 2.06 0.02 A 11 VAL HG1% H 1 0.90 0.02 A 11 VAL HG2% H 1 1.05 0.02 A 11 VAL C C 13 174.7 0.2 A 11 VAL CA C 13 61.7 0.2 A 11 VAL CB C 13 34.1 0.2 A 11 VAL CG1 C 13 22.2 0.2 A 11 VAL CG2 C 13 21.8 0.2 A 11 VAL N N 15 126.5 0.2 A 12 ASN H H 1 9.02 0.02 A 12 ASN HA H 1 5.02 0.02 A 12 ASN HBx H 1 2.49 0.02 A 12 ASN HBy H 1 3.35 0.02 A 12 ASN HD21 H 1 7.02 0.02 A 12 ASN HD22 H 1 7.53 0.02 A 12 ASN C C 13 175.3 0.2 A 12 ASN CA C 13 51.8 0.2 A 12 ASN CB C 13 39.4 0.2 A 12 ASN CG C 13 177.3 0.2 A 12 ASN N N 15 127.0 0.2 A 12 ASN ND2 N 15 112.7 0.2 A 13 LYS H H 1 9.14 0.02 A 13 LYS HA H 1 3.84 0.02 A 13 LYS HBx H 1 1.86 0.02 A 13 LYS HBy H 1 1.86 0.02 A 13 LYS HDx H 1 1.67 0.02 A 13 LYS HDy H 1 1.67 0.02 A 13 LYS HGx H 1 1.19 0.02 A 13 LYS HGy H 1 1.59 0.02 A 13 LYS C C 13 177.7 0.2 A 13 LYS CA C 13 60.2 0.2 A 13 LYS CB C 13 32.3 0.2 A 13 LYS CD C 13 29.4 0.2 A 13 LYS CE C 13 42.0 0.2 A 13 LYS CG C 13 27.1 0.2 A 13 LYS N N 15 124.3 0.2 A 14 GLU H H 1 8.37 0.02 A 14 GLU HA H 1 4.10 0.02 A 14 GLU HBx H 1 2.08 0.02 A 14 GLU HBy H 1 2.19 0.02 A 14 GLU HGx H 1 2.32 0.02 A 14 GLU HGy H 1 2.32 0.02 A 14 GLU C C 13 177.8 0.2 A 14 GLU CA C 13 59.7 0.2 A 14 GLU CB C 13 29.0 0.2 A 14 GLU CG C 13 36.9 0.2 A 14 GLU N N 15 119.2 0.2 A 15 ASN H H 1 7.71 0.02 A 15 ASN HA H 1 4.81 0.02 A 15 ASN HBx H 1 2.65 0.02 A 15 ASN HBy H 1 2.86 0.02 A 15 ASN HD21 H 1 6.84 0.02 A 15 ASN HD22 H 1 7.45 0.02 A 15 ASN C C 13 174.8 0.2 A 15 ASN CA C 13 52.0 0.2 A 15 ASN CB C 13 38.3 0.2 A 15 ASN CG C 13 176.1 0.2 A 15 ASN N N 15 114.5 0.2 A 15 ASN ND2 N 15 110.1 0.2 A 16 LYS H H 1 7.85 0.02 A 16 LYS HA H 1 3.67 0.02 A 16 LYS HBx H 1 1.88 0.02 A 16 LYS HBy H 1 2.39 0.02 A 16 LYS HDx H 1 1.70 0.02 A 16 LYS HDy H 1 1.70 0.02 A 16 LYS HEx H 1 2.98 0.02 A 16 LYS HEy H 1 2.98 0.02 A 16 LYS HGx H 1 1.26 0.02 A 16 LYS HGy H 1 1.33 0.02 A 16 LYS C C 13 174.0 0.2 A 16 LYS CA C 13 57.9 0.2 A 16 LYS CB C 13 29.1 0.2 A 16 LYS CD C 13 29.3 0.2 A 16 LYS CE C 13 42.2 0.2 A 16 LYS CG C 13 25.0 0.2 A 16 LYS N N 15 118.0 0.2 A 17 THR H H 1 8.34 0.02 A 17 THR HA H 1 5.72 0.02 A 17 THR HB H 1 3.99 0.02 A 17 THR HG2% H 1 1.09 0.02 A 17 THR C C 13 174.1 0.2 A 17 THR CA C 13 59.9 0.2 A 17 THR CB C 13 73.8 0.2 A 17 THR CG2 C 13 21.1 0.2 A 17 THR N N 15 107.8 0.2 A 18 ILE H H 1 9.22 0.02 A 18 ILE HA H 1 4.52 0.02 A 18 ILE HB H 1 1.59 0.02 A 18 ILE HD1% H 1 0.86 0.02 A 18 ILE HG1x H 1 0.90 0.02 A 18 ILE HG1y H 1 1.73 0.02 A 18 ILE HG2% H 1 0.40 0.02 A 18 ILE C C 13 174.3 0.2 A 18 ILE CA C 13 61.4 0.2 A 18 ILE CB C 13 41.6 0.2 A 18 ILE CD1 C 13 13.7 0.2 A 18 ILE CG1 C 13 28.6 0.2 A 18 ILE CG2 C 13 17.2 0.2 A 18 ILE N N 15 123.3 0.2 A 19 THR H H 1 8.71 0.02 A 19 THR HA H 1 5.22 0.02 A 19 THR HB H 1 3.73 0.02 A 19 THR HG2% H 1 0.89 0.02 A 19 THR C C 13 173.8 0.2 A 19 THR CA C 13 61.3 0.2 A 19 THR CB C 13 70.7 0.2 A 19 THR CG2 C 13 21.1 0.2 A 19 THR N N 15 122.0 0.2 A 20 ILE H H 1 9.26 0.02 A 20 ILE HA H 1 5.03 0.02 A 20 ILE HB H 1 1.61 0.02 A 20 ILE HD1% H 1 0.51 0.02 A 20 ILE HG1x H 1 0.61 0.02 A 20 ILE HG1y H 1 1.29 0.02 A 20 ILE HG2% H 1 0.70 0.02 A 20 ILE C C 13 174.6 0.2 A 20 ILE CA C 13 59.4 0.2 A 20 ILE CB C 13 40.4 0.2 A 20 ILE CD1 C 13 15.1 0.2 A 20 ILE CG1 C 13 27.7 0.2 A 20 ILE CG2 C 13 18.4 0.2 A 20 ILE N N 15 128.9 0.2 A 21 LYS H H 1 8.90 0.02 A 21 LYS HA H 1 5.36 0.02 A 21 LYS HBx H 1 1.71 0.02 A 21 LYS HBy H 1 1.71 0.02 A 21 LYS HDx H 1 0.74 0.02 A 21 LYS HDy H 1 1.42 0.02 A 21 LYS HEx H 1 2.75 0.02 A 21 LYS HEy H 1 2.75 0.02 A 21 LYS HGx H 1 1.05 0.02 A 21 LYS HGy H 1 1.41 0.02 A 21 LYS C C 13 174.7 0.2 A 21 LYS CA C 13 55.0 0.2 A 21 LYS CB C 13 35.3 0.2 A 21 LYS CD C 13 29.4 0.2 A 21 LYS CE C 13 41.9 0.2 A 21 LYS CG C 13 25.3 0.2 A 21 LYS N N 15 126.4 0.2 A 22 ARG H H 1 9.16 0.02 A 22 ARG HA H 1 4.98 0.02 A 22 ARG HBx H 1 1.61 0.02 A 22 ARG HBy H 1 1.69 0.02 A 22 ARG HDx H 1 2.84 0.02 A 22 ARG HDy H 1 3.39 0.02 A 22 ARG HE H 1 6.11 0.02 A 22 ARG HGx H 1 0.75 0.02 A 22 ARG HGy H 1 0.75 0.02 A 22 ARG C C 13 174.4 0.2 A 22 ARG CA C 13 53.5 0.2 A 22 ARG CB C 13 37.4 0.2 A 22 ARG CD C 13 42.8 0.2 A 22 ARG CG C 13 29.3 0.2 A 22 ARG N N 15 125.3 0.2 A 22 ARG NE N 15 82.8 0.2 A 23 GLU H H 1 8.11 0.02 A 23 GLU HA H 1 5.25 0.02 A 23 GLU HBx H 1 1.76 0.02 A 23 GLU HBy H 1 2.03 0.02 A 23 GLU HGx H 1 1.88 0.02 A 23 GLU HGy H 1 2.38 0.02 A 23 GLU C C 13 174.9 0.2 A 23 GLU CA C 13 54.8 0.2 A 23 GLU CB C 13 32.7 0.2 A 23 GLU CG C 13 37.8 0.2 A 23 GLU N N 15 124.3 0.2 A 24 PHE H H 1 9.16 0.02 A 24 PHE HA H 1 4.83 0.02 A 24 PHE HBx H 1 2.49 0.02 A 24 PHE HBy H 1 2.93 0.02 A 24 PHE HDx H 1 7.27 0.02 A 24 PHE HDy H 1 7.27 0.02 A 24 PHE HEx H 1 7.30 0.02 A 24 PHE HEy H 1 7.30 0.02 A 24 PHE C C 13 175.6 0.2 A 24 PHE CA C 13 57.5 0.2 A 24 PHE CB C 13 44.1 0.2 A 24 PHE CDx C 13 132.5 0.2 A 24 PHE CDy C 13 132.5 0.2 A 24 PHE CEx C 13 129.9 0.2 A 24 PHE CEy C 13 129.9 0.2 A 24 PHE N N 15 116.3 0.2 A 25 ALA H H 1 9.73 0.02 A 25 ALA HA H 1 4.70 0.02 A 25 ALA HB% H 1 1.35 0.02 A 25 ALA C C 13 175.6 0.2 A 25 ALA CA C 13 51.0 0.2 A 25 ALA CB C 13 16.6 0.2 A 25 ALA N N 15 128.7 0.2 A 26 ALA H H 1 8.37 0.02 A 26 ALA HA H 1 4.59 0.02 A 26 ALA HB% H 1 1.38 0.02 A 26 ALA C C 13 175.7 0.2 A 26 ALA CA C 13 51.8 0.2 A 26 ALA CB C 13 23.7 0.2 A 26 ALA N N 15 123.3 0.2 A 27 VAL H H 1 8.01 0.02 A 27 VAL HA H 1 4.29 0.02 A 27 VAL HB H 1 2.54 0.02 A 27 VAL HG1% H 1 1.15 0.02 A 27 VAL HG2% H 1 1.03 0.02 A 27 VAL C C 13 178.5 0.2 A 27 VAL CA C 13 61.1 0.2 A 27 VAL CB C 13 32.8 0.2 A 27 VAL CG1 C 13 21.6 0.2 A 27 VAL CG2 C 13 18.6 0.2 A 27 VAL N N 15 111.9 0.2 A 28 ARG H H 1 8.51 0.02 A 28 ARG HA H 1 4.18 0.02 A 28 ARG HBx H 1 1.75 0.02 A 28 ARG HBy H 1 2.20 0.02 A 28 ARG HDx H 1 2.99 0.02 A 28 ARG HDy H 1 2.99 0.02 A 28 ARG HGx H 1 1.74 0.02 A 28 ARG HGy H 1 1.74 0.02 A 28 ARG C C 13 177.1 0.2 A 28 ARG CA C 13 61.6 0.2 A 28 ARG CB C 13 30.2 0.2 A 28 ARG CD C 13 42.2 0.2 A 28 ARG CG C 13 26.3 0.2 A 28 ARG N N 15 125.2 0.2 A 29 ALA H H 1 8.87 0.02 A 29 ALA HA H 1 3.90 0.02 A 29 ALA HB% H 1 1.34 0.02 A 29 ALA C C 13 180.1 0.2 A 29 ALA CA C 13 56.1 0.2 A 29 ALA CB C 13 18.4 0.2 A 29 ALA N N 15 118.8 0.2 A 30 ILE H H 1 7.10 0.02 A 30 ILE HA H 1 3.82 0.02 A 30 ILE HB H 1 1.99 0.02 A 30 ILE HD1% H 1 0.87 0.02 A 30 ILE HG1x H 1 1.13 0.02 A 30 ILE HG1y H 1 1.51 0.02 A 30 ILE HG2% H 1 0.80 0.02 A 30 ILE C C 13 177.7 0.2 A 30 ILE CA C 13 63.4 0.2 A 30 ILE CB C 13 37.9 0.2 A 30 ILE CD1 C 13 12.4 0.2 A 30 ILE CG1 C 13 28.7 0.2 A 30 ILE CG2 C 13 17.4 0.2 A 30 ILE N N 15 116.6 0.2 A 31 VAL H H 1 7.59 0.02 A 31 VAL HA H 1 3.34 0.02 A 31 VAL HB H 1 2.12 0.02 A 31 VAL HG1% H 1 1.03 0.02 A 31 VAL HG2% H 1 0.86 0.02 A 31 VAL C C 13 176.8 0.2 A 31 VAL CA C 13 67.6 0.2 A 31 VAL CB C 13 32.1 0.2 A 31 VAL CG1 C 13 22.9 0.2 A 31 VAL CG2 C 13 24.9 0.2 A 31 VAL N N 15 122.2 0.2 A 32 TRP H H 1 9.22 0.02 A 32 TRP HA H 1 3.53 0.02 A 32 TRP HBx H 1 2.79 0.02 A 32 TRP HBy H 1 2.99 0.02 A 32 TRP HD1 H 1 6.88 0.02 A 32 TRP HE1 H 1 10.13 0.02 A 32 TRP HH2 H 1 7.18 0.02 A 32 TRP HZ2 H 1 7.30 0.02 A 32 TRP C C 13 179.9 0.2 A 32 TRP CA C 13 60.9 0.2 A 32 TRP CB C 13 28.6 0.2 A 32 TRP CD1 C 13 127.2 0.2 A 32 TRP CH2 C 13 123.3 0.2 A 32 TRP CZ2 C 13 112.3 0.2 A 32 TRP N N 15 118.2 0.2 A 32 TRP NE1 N 15 129.5 0.2 A 33 GLU H H 1 7.26 0.02 A 33 GLU HA H 1 3.52 0.02 A 33 GLU HBx H 1 1.99 0.02 A 33 GLU HBy H 1 2.14 0.02 A 33 GLU HGx H 1 2.30 0.02 A 33 GLU HGy H 1 2.47 0.02 A 33 GLU C C 13 177.0 0.2 A 33 GLU CA C 13 59.9 0.2 A 33 GLU CB C 13 29.4 0.2 A 33 GLU CG C 13 36.8 0.2 A 33 GLU N N 15 118.4 0.2 A 34 ALA H H 1 7.68 0.02 A 34 ALA HA H 1 3.99 0.02 A 34 ALA HB% H 1 1.28 0.02 A 34 ALA C C 13 177.2 0.2 A 34 ALA CA C 13 53.9 0.2 A 34 ALA CB C 13 18.1 0.2 A 34 ALA N N 15 118.5 0.2 A 35 PHE H H 1 7.36 0.02 A 35 PHE HA H 1 4.48 0.02 A 35 PHE HBx H 1 2.90 0.02 A 35 PHE HBy H 1 3.23 0.02 A 35 PHE HDx H 1 7.14 0.02 A 35 PHE HDy H 1 7.14 0.02 A 35 PHE HEx H 1 7.38 0.02 A 35 PHE HEy H 1 7.38 0.02 A 35 PHE C C 13 175.4 0.2 A 35 PHE CA C 13 59.4 0.2 A 35 PHE CB C 13 42.4 0.2 A 35 PHE CDx C 13 131.0 0.2 A 35 PHE CDy C 13 131.0 0.2 A 35 PHE CEx C 13 129.5 0.2 A 35 PHE CEy C 13 129.5 0.2 A 35 PHE N N 15 112.3 0.2 A 36 THR H H 1 6.74 0.02 A 36 THR HA H 1 3.13 0.02 A 36 THR HB H 1 1.88 0.02 A 36 THR HG1 H 1 6.18 0.02 A 36 THR HG2% H 1 -0.94 0.02 A 36 THR C C 13 171.9 0.2 A 36 THR CA C 13 61.5 0.2 A 36 THR CB C 13 70.1 0.2 A 36 THR CG2 C 13 21.7 0.2 A 36 THR N N 15 104.6 0.2 A 37 ARG H H 1 6.84 0.02 A 37 ARG HA H 1 4.30 0.02 A 37 ARG HBx H 1 1.62 0.02 A 37 ARG HBy H 1 1.70 0.02 A 37 ARG HDx H 1 3.03 0.02 A 37 ARG HDy H 1 3.11 0.02 A 37 ARG HE H 1 7.58 0.02 A 37 ARG HGx H 1 1.45 0.02 A 37 ARG HGy H 1 1.45 0.02 A 37 ARG C C 13 176.6 0.2 A 37 ARG CA C 13 53.9 0.2 A 37 ARG CB C 13 30.7 0.2 A 37 ARG CD C 13 43.3 0.2 A 37 ARG CG C 13 27.0 0.2 A 37 ARG N N 15 118.3 0.2 A 37 ARG NE N 15 84.9 0.2 A 38 ALA H H 1 8.71 0.02 A 38 ALA HA H 1 3.48 0.02 A 38 ALA HB% H 1 1.36 0.02 A 38 ALA C C 13 176.8 0.2 A 38 ALA CA C 13 55.8 0.2 A 38 ALA CB C 13 19.0 0.2 A 38 ALA N N 15 130.9 0.2 A 39 GLU H H 1 9.33 0.02 A 39 GLU HA H 1 4.07 0.02 A 39 GLU HBx H 1 1.95 0.02 A 39 GLU HBy H 1 1.95 0.02 A 39 GLU HGx H 1 2.23 0.02 A 39 GLU HGy H 1 2.33 0.02 A 39 GLU C C 13 178.1 0.2 A 39 GLU CA C 13 58.8 0.2 A 39 GLU CB C 13 28.6 0.2 A 39 GLU CG C 13 36.3 0.2 A 39 GLU N N 15 112.6 0.2 A 40 ILE H H 1 7.20 0.02 A 40 ILE HA H 1 4.06 0.02 A 40 ILE HB H 1 1.97 0.02 A 40 ILE HD1% H 1 0.72 0.02 A 40 ILE HG1x H 1 0.98 0.02 A 40 ILE HG1y H 1 1.37 0.02 A 40 ILE HG2% H 1 1.04 0.02 A 40 ILE C C 13 177.4 0.2 A 40 ILE CA C 13 63.9 0.2 A 40 ILE CB C 13 37.6 0.2 A 40 ILE CD1 C 13 11.9 0.2 A 40 ILE CG1 C 13 27.8 0.2 A 40 ILE CG2 C 13 19.6 0.2 A 40 ILE N N 15 118.2 0.2 A 41 LEU H H 1 8.38 0.02 A 41 LEU HA H 1 3.52 0.02 A 41 LEU HBx H 1 0.61 0.02 A 41 LEU HBy H 1 1.14 0.02 A 41 LEU HD1% H 1 -1.24 0.02 A 41 LEU HD2% H 1 -0.10 0.02 A 41 LEU HG H 1 0.94 0.02 A 41 LEU C C 13 179.0 0.2 A 41 LEU CA C 13 58.5 0.2 A 41 LEU CB C 13 43.0 0.2 A 41 LEU CD1 C 13 22.2 0.2 A 41 LEU CD2 C 13 24.1 0.2 A 41 LEU CG C 13 26.4 0.2 A 41 LEU N N 15 123.4 0.2 A 42 ASP H H 1 8.30 0.02 A 42 ASP HA H 1 4.32 0.02 A 42 ASP HBx H 1 2.41 0.02 A 42 ASP HBy H 1 2.84 0.02 A 42 ASP C C 13 179.0 0.2 A 42 ASP CA C 13 57.1 0.2 A 42 ASP CB C 13 39.6 0.2 A 42 ASP N N 15 116.4 0.2 A 43 GLN H H 1 8.17 0.02 A 43 GLN HA H 1 4.38 0.02 A 43 GLN HBx H 1 2.42 0.02 A 43 GLN HBy H 1 2.46 0.02 A 43 GLN HE21 H 1 6.99 0.02 A 43 GLN HE22 H 1 7.61 0.02 A 43 GLN HGx H 1 2.37 0.02 A 43 GLN HGy H 1 2.63 0.02 A 43 GLN C C 13 176.9 0.2 A 43 GLN CA C 13 57.4 0.2 A 43 GLN CB C 13 30.6 0.2 A 43 GLN CD C 13 179.9 0.2 A 43 GLN CG C 13 34.7 0.2 A 43 GLN N N 15 115.4 0.2 A 43 GLN NE2 N 15 111.6 0.2 A 44 TRP H H 1 7.80 0.02 A 44 TRP HA H 1 5.10 0.02 A 44 TRP HBx H 1 2.61 0.02 A 44 TRP HBy H 1 3.51 0.02 A 44 TRP HD1 H 1 7.21 0.02 A 44 TRP HE1 H 1 9.91 0.02 A 44 TRP HE3 H 1 6.64 0.02 A 44 TRP HH2 H 1 6.64 0.02 A 44 TRP HZ2 H 1 5.83 0.02 A 44 TRP HZ3 H 1 7.71 0.02 A 44 TRP C C 13 174.4 0.2 A 44 TRP CA C 13 57.1 0.2 A 44 TRP CB C 13 32.4 0.2 A 44 TRP CD1 C 13 127.3 0.2 A 44 TRP CE3 C 13 120.2 0.2 A 44 TRP CH2 C 13 126.3 0.2 A 44 TRP CZ2 C 13 113.3 0.2 A 44 TRP CZ3 C 13 123.5 0.2 A 44 TRP N N 15 115.6 0.2 A 45 TRP H H 1 8.08 0.02 A 45 TRP HA H 1 3.17 0.02 A 45 TRP HBx H 1 2.20 0.02 A 45 TRP HBy H 1 2.40 0.02 A 45 TRP HD1 H 1 6.33 0.02 A 45 TRP HE1 H 1 9.24 0.02 A 45 TRP C C 13 173.9 0.2 A 45 TRP CA C 13 60.1 0.2 A 45 TRP CB C 13 30.9 0.2 A 45 TRP CD1 C 13 126.7 0.2 A 45 TRP N N 15 122.1 0.2 A 46 ALA H H 1 7.43 0.02 A 46 ALA HA H 1 4.51 0.02 A 46 ALA HB% H 1 1.18 0.02 A 46 ALA CA C 13 48.4 0.2 A 46 ALA CB C 13 20.0 0.2 A 46 ALA N N 15 113.0 0.2 A 47 PRO HA H 1 4.29 0.02 A 47 PRO HBy H 1 2.47 0.02 A 47 PRO HBx H 1 2.01 0.02 A 47 PRO HDy H 1 3.55 0.02 A 47 PRO HDx H 1 3.38 0.02 A 47 PRO HGx H 1 1.89 0.02 A 47 PRO HGy H 1 2.05 0.02 A 47 PRO C C 13 176.6 0.2 A 47 PRO CA C 13 61.9 0.2 A 47 PRO CB C 13 31.8 0.2 A 47 PRO CD C 13 50.0 0.2 A 47 PRO CG C 13 27.5 0.2 A 48 LYS H H 1 9.15 0.02 A 48 LYS HA H 1 4.41 0.02 A 48 LYS HBx H 1 1.81 0.02 A 48 LYS HBy H 1 1.81 0.02 A 48 LYS HDx H 1 1.74 0.02 A 48 LYS HDy H 1 1.81 0.02 A 48 LYS HEx H 1 3.10 0.02 A 48 LYS HEy H 1 3.10 0.02 A 48 LYS HGx H 1 1.64 0.02 A 48 LYS HGy H 1 1.79 0.02 A 48 LYS CA C 13 56.9 0.2 A 48 LYS CB C 13 31.5 0.2 A 48 LYS CD C 13 29.9 0.2 A 48 LYS CG C 13 26.0 0.2 A 48 LYS N N 15 124.2 0.2 A 49 PRO HA H 1 4.64 0.02 A 49 PRO HBy H 1 2.35 0.02 A 49 PRO HBx H 1 2.11 0.02 A 49 PRO HDx H 1 3.57 0.02 A 49 PRO HDy H 1 3.57 0.02 A 49 PRO HGx H 1 1.19 0.02 A 49 PRO HGy H 1 2.02 0.02 A 49 PRO C C 13 175.9 0.2 A 49 PRO CA C 13 63.9 0.2 A 49 PRO CB C 13 33.0 0.2 A 49 PRO CD C 13 50.0 0.2 A 49 PRO CG C 13 24.4 0.2 A 50 TRP H H 1 9.43 0.02 A 50 TRP HA H 1 4.51 0.02 A 50 TRP HBx H 1 2.92 0.02 A 50 TRP HBy H 1 3.57 0.02 A 50 TRP HD1 H 1 7.08 0.02 A 50 TRP HE1 H 1 10.37 0.02 A 50 TRP HE3 H 1 7.11 0.02 A 50 TRP HH2 H 1 6.99 0.02 A 50 TRP HZ2 H 1 7.48 0.02 A 50 TRP HZ3 H 1 6.77 0.02 A 50 TRP C C 13 174.1 0.2 A 50 TRP CA C 13 58.9 0.2 A 50 TRP CB C 13 29.7 0.2 A 50 TRP CD1 C 13 126.3 0.2 A 50 TRP CE3 C 13 120.3 0.2 A 50 TRP CH2 C 13 124.7 0.2 A 50 TRP CZ2 C 13 114.6 0.2 A 50 TRP CZ3 C 13 122.0 0.2 A 50 TRP N N 15 128.1 0.2 A 50 TRP NE1 N 15 130.3 0.2 A 51 LYS H H 1 8.60 0.02 A 51 LYS HA H 1 4.57 0.02 A 51 LYS HBx H 1 1.63 0.02 A 51 LYS HBy H 1 1.83 0.02 A 51 LYS HDx H 1 1.76 0.02 A 51 LYS HDy H 1 1.76 0.02 A 51 LYS HEx H 1 3.02 0.02 A 51 LYS HEy H 1 3.02 0.02 A 51 LYS HGx H 1 1.40 0.02 A 51 LYS HGy H 1 1.40 0.02 A 51 LYS C C 13 174.2 0.2 A 51 LYS CA C 13 55.4 0.2 A 51 LYS CB C 13 36.3 0.2 A 51 LYS CD C 13 29.1 0.2 A 51 LYS CE C 13 42.5 0.2 A 51 LYS CG C 13 24.7 0.2 A 51 LYS N N 15 119.2 0.2 A 52 ALA H H 1 8.78 0.02 A 52 ALA HA H 1 5.41 0.02 A 52 ALA HB% H 1 1.39 0.02 A 52 ALA C C 13 176.3 0.2 A 52 ALA CA C 13 51.1 0.2 A 52 ALA CB C 13 19.8 0.2 A 52 ALA N N 15 128.7 0.2 A 53 LYS H H 1 9.08 0.02 A 53 LYS HA H 1 4.61 0.02 A 53 LYS HBx H 1 1.50 0.02 A 53 LYS HBy H 1 1.66 0.02 A 53 LYS HDx H 1 1.76 0.02 A 53 LYS HDy H 1 1.76 0.02 A 53 LYS HEx H 1 2.91 0.02 A 53 LYS HEy H 1 2.91 0.02 A 53 LYS HGx H 1 1.23 0.02 A 53 LYS HGy H 1 1.33 0.02 A 53 LYS C C 13 176.7 0.2 A 53 LYS CA C 13 54.7 0.2 A 53 LYS CB C 13 35.0 0.2 A 53 LYS CD C 13 29.4 0.2 A 53 LYS CE C 13 42.2 0.2 A 53 LYS CG C 13 24.8 0.2 A 53 LYS N N 15 120.8 0.2 A 54 THR H H 1 10.76 0.02 A 54 THR HA H 1 4.18 0.02 A 54 THR HB H 1 4.33 0.02 A 54 THR HG2% H 1 1.33 0.02 A 54 THR C C 13 174.8 0.2 A 54 THR CA C 13 67.4 0.2 A 54 THR CB C 13 68.3 0.2 A 54 THR CG2 C 13 22.6 0.2 A 54 THR N N 15 130.3 0.2 A 55 LYS H H 1 9.61 0.02 A 55 LYS HA H 1 4.64 0.02 A 55 LYS HBx H 1 1.91 0.02 A 55 LYS HBy H 1 2.20 0.02 A 55 LYS HDx H 1 1.69 0.02 A 55 LYS HDy H 1 1.69 0.02 A 55 LYS HEx H 1 2.92 0.02 A 55 LYS HEy H 1 2.92 0.02 A 55 LYS HGx H 1 1.48 0.02 A 55 LYS HGy H 1 1.55 0.02 A 55 LYS C C 13 175.9 0.2 A 55 LYS CA C 13 57.6 0.2 A 55 LYS CB C 13 34.4 0.2 A 55 LYS CD C 13 29.4 0.2 A 55 LYS CE C 13 42.4 0.2 A 55 LYS CG C 13 25.0 0.2 A 55 LYS N N 15 130.3 0.2 A 56 SER H H 1 8.28 0.02 A 56 SER HA H 1 4.68 0.02 A 56 SER HBx H 1 3.82 0.02 A 56 SER HBy H 1 3.89 0.02 A 56 SER C C 13 171.8 0.2 A 56 SER CA C 13 57.8 0.2 A 56 SER CB C 13 65.0 0.2 A 56 SER N N 15 112.3 0.2 A 57 MET H H 1 8.81 0.02 A 57 MET HA H 1 5.43 0.02 A 57 MET HBx H 1 1.99 0.02 A 57 MET HBy H 1 2.03 0.02 A 57 MET HE% H 1 0.80 0.02 A 57 MET HGx H 1 2.24 0.02 A 57 MET HGy H 1 2.44 0.02 A 57 MET C C 13 173.6 0.2 A 57 MET CA C 13 55.7 0.2 A 57 MET CB C 13 36.5 0.2 A 57 MET CE C 13 18.0 0.2 A 57 MET CG C 13 33.3 0.2 A 57 MET N N 15 124.2 0.2 A 58 ASP H H 1 8.39 0.02 A 58 ASP HA H 1 4.86 0.02 A 58 ASP HBx H 1 2.67 0.02 A 58 ASP HBy H 1 2.98 0.02 A 58 ASP C C 13 173.5 0.2 A 58 ASP CA C 13 53.2 0.2 A 58 ASP CB C 13 41.8 0.2 A 58 ASP N N 15 130.7 0.2 A 59 PHE H H 1 8.65 0.02 A 59 PHE HA H 1 4.08 0.02 A 59 PHE HBx H 1 2.84 0.02 A 59 PHE HBy H 1 2.84 0.02 A 59 PHE HDx H 1 6.34 0.02 A 59 PHE HDy H 1 6.34 0.02 A 59 PHE HEx H 1 6.21 0.02 A 59 PHE HEy H 1 6.21 0.02 A 59 PHE C C 13 172.6 0.2 A 59 PHE CA C 13 58.0 0.2 A 59 PHE CB C 13 36.8 0.2 A 59 PHE CDx C 13 131.6 0.2 A 59 PHE CDy C 13 131.6 0.2 A 59 PHE CEx C 13 129.9 0.2 A 59 PHE CEy C 13 129.9 0.2 A 59 PHE N N 15 124.2 0.2 A 60 LYS H H 1 7.55 0.02 A 60 LYS HA H 1 4.07 0.02 A 60 LYS HBx H 1 1.54 0.02 A 60 LYS HBy H 1 1.79 0.02 A 60 LYS HDx H 1 1.58 0.02 A 60 LYS HDy H 1 1.58 0.02 A 60 LYS HEx H 1 2.90 0.02 A 60 LYS HEy H 1 2.90 0.02 A 60 LYS HGx H 1 0.85 0.02 A 60 LYS HGy H 1 1.17 0.02 A 60 LYS C C 13 175.3 0.2 A 60 LYS CA C 13 54.4 0.2 A 60 LYS CB C 13 34.7 0.2 A 60 LYS CD C 13 29.5 0.2 A 60 LYS CE C 13 42.0 0.2 A 60 LYS CG C 13 22.8 0.2 A 60 LYS N N 15 124.0 0.2 A 61 GLU H H 1 8.84 0.02 A 61 GLU HA H 1 3.62 0.02 A 61 GLU HBx H 1 1.99 0.02 A 61 GLU HBy H 1 1.99 0.02 A 61 GLU HGx H 1 2.20 0.02 A 61 GLU HGy H 1 2.44 0.02 A 61 GLU C C 13 178.1 0.2 A 61 GLU CA C 13 59.7 0.2 A 61 GLU CB C 13 28.4 0.2 A 61 GLU CG C 13 37.5 0.2 A 61 GLU N N 15 123.3 0.2 A 62 GLY H H 1 8.53 0.02 A 62 GLY HAx H 1 3.96 0.02 A 62 GLY HAy H 1 4.36 0.02 A 62 GLY C C 13 174.7 0.2 A 62 GLY CA C 13 45.9 0.2 A 62 GLY N N 15 114.5 0.2 A 63 GLY H H 1 8.77 0.02 A 63 GLY HAx H 1 4.49 0.02 A 63 GLY HAy H 1 4.59 0.02 A 63 GLY C C 13 173.1 0.2 A 63 GLY CA C 13 44.1 0.2 A 63 GLY N N 15 110.6 0.2 A 64 THR H H 1 7.78 0.02 A 64 THR HA H 1 5.67 0.02 A 64 THR HB H 1 4.01 0.02 A 64 THR HG2% H 1 1.23 0.02 A 64 THR C C 13 174.0 0.2 A 64 THR CA C 13 60.7 0.2 A 64 THR CB C 13 73.9 0.2 A 64 THR CG2 C 13 22.7 0.2 A 64 THR N N 15 109.5 0.2 A 65 TRP H H 1 9.38 0.02 A 65 TRP HA H 1 5.72 0.02 A 65 TRP HBx H 1 3.32 0.02 A 65 TRP HBy H 1 3.58 0.02 A 65 TRP HD1 H 1 7.34 0.02 A 65 TRP HE1 H 1 10.97 0.02 A 65 TRP HZ2 H 1 5.85 0.02 A 65 TRP C C 13 175.2 0.2 A 65 TRP CA C 13 54.8 0.2 A 65 TRP CB C 13 32.4 0.2 A 65 TRP CD1 C 13 122.2 0.2 A 65 TRP CZ2 C 13 113.0 0.2 A 65 TRP N N 15 128.4 0.2 A 65 TRP NE1 N 15 130.1 0.2 A 66 LEU H H 1 9.22 0.02 A 66 LEU HA H 1 5.24 0.02 A 66 LEU HBx H 1 1.41 0.02 A 66 LEU HBy H 1 2.01 0.02 A 66 LEU HD1% H 1 0.97 0.02 A 66 LEU HD2% H 1 0.78 0.02 A 66 LEU HG H 1 1.59 0.02 A 66 LEU C C 13 175.0 0.2 A 66 LEU CA C 13 54.0 0.2 A 66 LEU CB C 13 44.7 0.2 A 66 LEU CD1 C 13 24.4 0.2 A 66 LEU CD2 C 13 26.2 0.2 A 66 LEU CG C 13 28.4 0.2 A 66 LEU N N 15 128.9 0.2 A 67 TYR H H 1 8.54 0.02 A 67 TYR HA H 1 5.08 0.02 A 67 TYR HBx H 1 2.29 0.02 A 67 TYR HBy H 1 2.51 0.02 A 67 TYR HDx H 1 7.30 0.02 A 67 TYR HDy H 1 7.30 0.02 A 67 TYR C C 13 170.1 0.2 A 67 TYR CA C 13 55.6 0.2 A 67 TYR CB C 13 41.6 0.2 A 67 TYR N N 15 124.2 0.2 A 68 ALA H H 1 8.13 0.02 A 68 ALA HA H 1 4.28 0.02 A 68 ALA HB% H 1 -0.15 0.02 A 68 ALA C C 13 177.0 0.2 A 68 ALA CA C 13 49.0 0.2 A 68 ALA CB C 13 19.6 0.2 A 68 ALA N N 15 120.6 0.2 A 69 MET H H 1 8.38 0.02 A 69 MET HA H 1 4.99 0.02 A 69 MET HBx H 1 1.79 0.02 A 69 MET HBy H 1 1.79 0.02 A 69 MET HGx H 1 2.49 0.02 A 69 MET HGy H 1 2.58 0.02 A 69 MET C C 13 175.1 0.2 A 69 MET CA C 13 54.4 0.2 A 69 MET CB C 13 34.0 0.2 A 69 MET CG C 13 33.2 0.2 A 69 MET N N 15 119.3 0.2 A 70 VAL H H 1 9.34 0.02 A 70 VAL HA H 1 4.92 0.02 A 70 VAL HB H 1 2.02 0.02 A 70 VAL HG1% H 1 0.91 0.02 A 70 VAL HG2% H 1 0.81 0.02 A 70 VAL C C 13 177.3 0.2 A 70 VAL CA C 13 61.2 0.2 A 70 VAL CB C 13 33.3 0.2 A 70 VAL CG1 C 13 21.1 0.2 A 70 VAL CG2 C 13 21.2 0.2 A 70 VAL N N 15 124.4 0.2 A 71 GLY H H 1 8.96 0.02 A 71 GLY HAx H 1 3.07 0.02 A 71 GLY HAy H 1 3.07 0.02 A 71 GLY CA C 13 43.8 0.2 A 71 GLY N N 15 117.8 0.2 A 72 PRO HA H 1 4.21 0.02 A 72 PRO HBy H 1 2.04 0.02 A 72 PRO HBx H 1 1.88 0.02 A 72 PRO HDy H 1 2.83 0.02 A 72 PRO HDx H 1 2.23 0.02 A 72 PRO HGx H 1 1.73 0.02 A 72 PRO HGy H 1 1.83 0.02 A 72 PRO C C 13 176.9 0.2 A 72 PRO CA C 13 64.0 0.2 A 72 PRO CB C 13 31.9 0.2 A 72 PRO CD C 13 48.5 0.2 A 72 PRO CG C 13 27.0 0.2 A 73 ASN H H 1 8.83 0.02 A 73 ASN HA H 1 4.86 0.02 A 73 ASN HBx H 1 2.69 0.02 A 73 ASN HBy H 1 2.86 0.02 A 73 ASN HD21 H 1 6.98 0.02 A 73 ASN HD22 H 1 8.10 0.02 A 73 ASN C C 13 175.7 0.2 A 73 ASN CA C 13 52.3 0.2 A 73 ASN CB C 13 38.7 0.2 A 73 ASN CG C 13 178.2 0.2 A 73 ASN N N 15 117.2 0.2 A 73 ASN ND2 N 15 115.3 0.2 A 74 GLY H H 1 7.81 0.02 A 74 GLY HAx H 1 3.47 0.02 A 74 GLY HAy H 1 4.13 0.02 A 74 GLY C C 13 174.4 0.2 A 74 GLY CA C 13 45.3 0.2 A 74 GLY N N 15 107.6 0.2 A 75 GLU H H 1 9.28 0.02 A 75 GLU HA H 1 4.08 0.02 A 75 GLU HBx H 1 1.81 0.02 A 75 GLU HBy H 1 1.90 0.02 A 75 GLU HGx H 1 2.32 0.02 A 75 GLU HGy H 1 2.49 0.02 A 75 GLU C C 13 175.8 0.2 A 75 GLU CA C 13 57.7 0.2 A 75 GLU CB C 13 30.0 0.2 A 75 GLU CG C 13 36.3 0.2 A 75 GLU N N 15 123.2 0.2 A 76 GLU H H 1 8.41 0.02 A 76 GLU HA H 1 5.03 0.02 A 76 GLU HBx H 1 1.69 0.02 A 76 GLU HBy H 1 1.93 0.02 A 76 GLU HGx H 1 1.83 0.02 A 76 GLU HGy H 1 2.11 0.02 A 76 GLU C C 13 175.0 0.2 A 76 GLU CA C 13 55.7 0.2 A 76 GLU CB C 13 33.1 0.2 A 76 GLU CG C 13 36.9 0.2 A 76 GLU N N 15 121.3 0.2 A 77 HIS H H 1 8.64 0.02 A 77 HIS HA H 1 5.03 0.02 A 77 HIS HBx H 1 3.14 0.02 A 77 HIS HBy H 1 3.21 0.02 A 77 HIS C C 13 174.5 0.2 A 77 HIS CA C 13 54.3 0.2 A 77 HIS CB C 13 31.9 0.2 A 77 HIS N N 15 122.6 0.2 A 78 TRP H H 1 9.00 0.02 A 78 TRP HA H 1 4.77 0.02 A 78 TRP HBx H 1 2.86 0.02 A 78 TRP HBy H 1 2.86 0.02 A 78 TRP HD1 H 1 7.22 0.02 A 78 TRP HE1 H 1 10.27 0.02 A 78 TRP HH2 H 1 7.14 0.02 A 78 TRP HZ2 H 1 7.41 0.02 A 78 TRP HZ3 H 1 6.79 0.02 A 78 TRP C C 13 175.1 0.2 A 78 TRP CA C 13 52.7 0.2 A 78 TRP CB C 13 30.6 0.2 A 78 TRP CD1 C 13 125.7 0.2 A 78 TRP CH2 C 13 123.8 0.2 A 78 TRP CZ2 C 13 114.5 0.2 A 78 TRP N N 15 127.2 0.2 A 78 TRP NE1 N 15 129.8 0.2 A 79 SER H H 1 8.85 0.02 A 79 SER HA H 1 4.91 0.02 A 79 SER HBx H 1 2.24 0.02 A 79 SER HBy H 1 3.17 0.02 A 79 SER C C 13 169.9 0.2 A 79 SER CA C 13 58.0 0.2 A 79 SER CB C 13 67.6 0.2 A 79 SER N N 15 119.9 0.2 A 80 ILE H H 1 8.01 0.02 A 80 ILE HA H 1 5.54 0.02 A 80 ILE HB H 1 1.47 0.02 A 80 ILE HD1% H 1 0.82 0.02 A 80 ILE HG1x H 1 0.79 0.02 A 80 ILE HG1y H 1 1.44 0.02 A 80 ILE HG2% H 1 0.62 0.02 A 80 ILE C C 13 174.3 0.2 A 80 ILE CA C 13 57.8 0.2 A 80 ILE CB C 13 43.6 0.2 A 80 ILE CD1 C 13 14.6 0.2 A 80 ILE CG1 C 13 28.3 0.2 A 80 ILE CG2 C 13 16.4 0.2 A 80 ILE N N 15 116.6 0.2 A 81 CYS H H 1 8.82 0.02 A 81 CYS HA H 1 4.93 0.02 A 81 CYS HBx H 1 2.86 0.02 A 81 CYS HBy H 1 2.91 0.02 A 81 CYS C C 13 173.3 0.2 A 81 CYS CA C 13 57.8 0.2 A 81 CYS CB C 13 29.5 0.2 A 81 CYS N N 15 123.5 0.2 A 82 GLU H H 1 8.88 0.02 A 82 GLU HA H 1 4.98 0.02 A 82 GLU HBx H 1 1.92 0.02 A 82 GLU HBy H 1 2.08 0.02 A 82 GLU HGx H 1 2.08 0.02 A 82 GLU HGy H 1 2.08 0.02 A 82 GLU C C 13 176.5 0.2 A 82 GLU CA C 13 54.3 0.2 A 82 GLU CB C 13 32.1 0.2 A 82 GLU CG C 13 36.9 0.2 A 82 GLU N N 15 127.3 0.2 A 83 TYR H H 1 8.49 0.02 A 83 TYR HA H 1 4.88 0.02 A 83 TYR HBx H 1 2.69 0.02 A 83 TYR HBy H 1 3.11 0.02 A 83 TYR HDx H 1 7.04 0.02 A 83 TYR HDy H 1 7.04 0.02 A 83 TYR HEx H 1 6.69 0.02 A 83 TYR HEy H 1 6.69 0.02 A 83 TYR C C 13 176.5 0.2 A 83 TYR CA C 13 60.3 0.2 A 83 TYR CB C 13 39.7 0.2 A 83 TYR CDx C 13 132.8 0.2 A 83 TYR CDy C 13 132.8 0.2 A 83 TYR CEx C 13 118.6 0.2 A 83 TYR CEy C 13 118.6 0.2 A 83 TYR N N 15 126.3 0.2 A 84 ALA H H 1 9.39 0.02 A 84 ALA HA H 1 4.81 0.02 A 84 ALA HB% H 1 1.46 0.02 A 84 ALA C C 13 175.6 0.2 A 84 ALA CA C 13 53.5 0.2 A 84 ALA CB C 13 20.0 0.2 A 84 ALA N N 15 130.0 0.2 A 85 ILE H H 1 7.66 0.02 A 85 ILE HA H 1 4.52 0.02 A 85 ILE HB H 1 2.08 0.02 A 85 ILE HD1% H 1 0.85 0.02 A 85 ILE HG1x H 1 1.10 0.02 A 85 ILE HG1y H 1 1.48 0.02 A 85 ILE HG2% H 1 0.85 0.02 A 85 ILE C C 13 175.6 0.2 A 85 ILE CA C 13 60.0 0.2 A 85 ILE CB C 13 40.2 0.2 A 85 ILE CD1 C 13 13.1 0.2 A 85 ILE CG1 C 13 27.5 0.2 A 85 ILE CG2 C 13 17.0 0.2 A 85 ILE N N 15 118.7 0.2 A 86 ILE H H 1 9.73 0.02 A 86 ILE HA H 1 4.56 0.02 A 86 ILE HB H 1 1.57 0.02 A 86 ILE HD1% H 1 -0.63 0.02 A 86 ILE HG1x H 1 0.68 0.02 A 86 ILE HG1y H 1 1.26 0.02 A 86 ILE HG2% H 1 0.93 0.02 A 86 ILE C C 13 174.8 0.2 A 86 ILE CA C 13 62.5 0.2 A 86 ILE CB C 13 42.1 0.2 A 86 ILE CD1 C 13 12.2 0.2 A 86 ILE CG1 C 13 27.3 0.2 A 86 ILE CG2 C 13 18.5 0.2 A 86 ILE N N 15 125.6 0.2 A 87 LYS H H 1 9.56 0.02 A 87 LYS HA H 1 5.00 0.02 A 87 LYS HBx H 1 1.74 0.02 A 87 LYS HBy H 1 2.08 0.02 A 87 LYS HDx H 1 1.68 0.02 A 87 LYS HDy H 1 1.68 0.02 A 87 LYS HEx H 1 2.90 0.02 A 87 LYS HEy H 1 2.90 0.02 A 87 LYS HGx H 1 1.31 0.02 A 87 LYS HGy H 1 1.40 0.02 A 87 LYS CA C 13 52.3 0.2 A 87 LYS CB C 13 33.6 0.2 A 87 LYS CD C 13 29.3 0.2 A 87 LYS CE C 13 42.1 0.2 A 87 LYS CG C 13 24.8 0.2 A 87 LYS N N 15 130.4 0.2 A 88 PRO HA H 1 3.69 0.02 A 88 PRO HBy H 1 1.92 0.02 A 88 PRO HBx H 1 1.67 0.02 A 88 PRO HDy H 1 3.84 0.02 A 88 PRO HDx H 1 3.72 0.02 A 88 PRO HGx H 1 2.00 0.02 A 88 PRO HGy H 1 2.22 0.02 A 88 PRO C C 13 172.6 0.2 A 88 PRO CA C 13 57.5 0.2 A 88 PRO CB C 13 31.8 0.2 A 88 PRO CD C 13 51.1 0.2 A 88 PRO CG C 13 28.3 0.2 A 89 ILE H H 1 7.54 0.02 A 89 ILE HA H 1 1.59 0.02 A 89 ILE HB H 1 1.00 0.02 A 89 ILE HD1% H 1 0.62 0.02 A 89 ILE HG1x H 1 1.06 0.02 A 89 ILE HG1y H 1 1.06 0.02 A 89 ILE HG2% H 1 -0.32 0.02 A 89 ILE C C 13 170.8 0.2 A 89 ILE CA C 13 63.7 0.2 A 89 ILE CB C 13 36.7 0.2 A 89 ILE CD1 C 13 14.3 0.2 A 89 ILE CG1 C 13 24.5 0.2 A 89 ILE CG2 C 13 17.1 0.2 A 89 ILE N N 15 124.4 0.2 A 90 GLU H H 1 8.03 0.02 A 90 GLU HA H 1 5.09 0.02 A 90 GLU HBx H 1 2.04 0.02 A 90 GLU HBy H 1 2.23 0.02 A 90 GLU HGx H 1 2.24 0.02 A 90 GLU HGy H 1 2.24 0.02 A 90 GLU C C 13 177.7 0.2 A 90 GLU CA C 13 56.1 0.2 A 90 GLU CB C 13 34.0 0.2 A 90 GLU CG C 13 35.9 0.2 A 90 GLU N N 15 113.7 0.2 A 91 ARG H H 1 8.37 0.02 A 91 ARG HA H 1 6.28 0.02 A 91 ARG HBx H 1 1.67 0.02 A 91 ARG HBy H 1 2.27 0.02 A 91 ARG HDx H 1 2.99 0.02 A 91 ARG HDy H 1 3.14 0.02 A 91 ARG HE H 1 8.01 0.02 A 91 ARG HGx H 1 1.31 0.02 A 91 ARG HGy H 1 1.99 0.02 A 91 ARG C C 13 175.5 0.2 A 91 ARG CA C 13 56.0 0.2 A 91 ARG CB C 13 35.1 0.2 A 91 ARG CD C 13 44.5 0.2 A 91 ARG CG C 13 27.5 0.2 A 91 ARG N N 15 123.7 0.2 A 91 ARG NE N 15 86.1 0.2 A 92 PHE H H 1 9.28 0.02 A 92 PHE HA H 1 5.70 0.02 A 92 PHE HBx H 1 3.59 0.02 A 92 PHE HBy H 1 3.73 0.02 A 92 PHE HDx H 1 7.15 0.02 A 92 PHE HDy H 1 7.15 0.02 A 92 PHE HEx H 1 6.65 0.02 A 92 PHE HEy H 1 6.65 0.02 A 92 PHE C C 13 172.6 0.2 A 92 PHE CA C 13 57.9 0.2 A 92 PHE CB C 13 43.1 0.2 A 92 PHE CDx C 13 132.3 0.2 A 92 PHE CDy C 13 132.3 0.2 A 92 PHE CEx C 13 131.2 0.2 A 92 PHE CEy C 13 131.2 0.2 A 92 PHE N N 15 121.2 0.2 A 93 THR H H 1 9.93 0.02 A 93 THR HA H 1 5.66 0.02 A 93 THR HB H 1 4.64 0.02 A 93 THR HG2% H 1 1.27 0.02 A 93 THR C C 13 174.7 0.2 A 93 THR CA C 13 58.9 0.2 A 93 THR CB C 13 72.2 0.2 A 93 THR N N 15 111.6 0.2 A 94 GLY H H 1 8.55 0.02 A 94 GLY HAx H 1 4.04 0.02 A 94 GLY HAy H 1 4.47 0.02 A 94 GLY C C 13 170.7 0.2 A 94 GLY CA C 13 46.8 0.2 A 94 GLY N N 15 107.0 0.2 A 95 LYS H H 1 8.58 0.02 A 95 LYS HA H 1 5.44 0.02 A 95 LYS HBx H 1 1.79 0.02 A 95 LYS HBy H 1 1.89 0.02 A 95 LYS HDx H 1 1.65 0.02 A 95 LYS HDy H 1 1.65 0.02 A 95 LYS HEx H 1 2.91 0.02 A 95 LYS HEy H 1 2.91 0.02 A 95 LYS HGx H 1 1.48 0.02 A 95 LYS HGy H 1 1.53 0.02 A 95 LYS C C 13 176.1 0.2 A 95 LYS CA C 13 55.1 0.2 A 95 LYS CB C 13 36.2 0.2 A 95 LYS CD C 13 30.0 0.2 A 95 LYS CE C 13 42.9 0.2 A 95 LYS CG C 13 24.8 0.2 A 95 LYS N N 15 121.2 0.2 A 96 ASP H H 1 9.10 0.02 A 96 ASP HA H 1 5.62 0.02 A 96 ASP HBx H 1 2.61 0.02 A 96 ASP HBy H 1 2.92 0.02 A 96 ASP C C 13 176.2 0.2 A 96 ASP CA C 13 52.6 0.2 A 96 ASP CB C 13 43.6 0.2 A 96 ASP N N 15 126.2 0.2 A 97 GLY H H 1 7.91 0.02 A 97 GLY HAx H 1 3.82 0.02 A 97 GLY HAy H 1 4.32 0.02 A 97 GLY C C 13 171.0 0.2 A 97 GLY CA C 13 45.6 0.2 A 97 GLY N N 15 105.8 0.2 A 98 PHE H H 1 9.47 0.02 A 98 PHE HA H 1 5.17 0.02 A 98 PHE HBx H 1 2.93 0.02 A 98 PHE HBy H 1 3.45 0.02 A 98 PHE HDx H 1 7.49 0.02 A 98 PHE HDy H 1 7.49 0.02 A 98 PHE HEx H 1 7.29 0.02 A 98 PHE HEy H 1 7.29 0.02 A 98 PHE C C 13 175.5 0.2 A 98 PHE CA C 13 57.7 0.2 A 98 PHE CB C 13 41.1 0.2 A 98 PHE CDx C 13 132.8 0.2 A 98 PHE CDy C 13 132.8 0.2 A 98 PHE CEx C 13 131.4 0.2 A 98 PHE CEy C 13 131.4 0.2 A 98 PHE N N 15 121.6 0.2 A 99 THR H H 1 8.25 0.02 A 99 THR HA H 1 5.14 0.02 A 99 THR HB H 1 3.83 0.02 A 99 THR HG2% H 1 0.76 0.02 A 99 THR C C 13 174.2 0.2 A 99 THR CA C 13 60.1 0.2 A 99 THR CB C 13 71.7 0.2 A 99 THR CG2 C 13 20.9 0.2 A 99 THR N N 15 112.5 0.2 A 100 ASP H H 1 8.10 0.02 A 100 ASP HA H 1 4.85 0.02 A 100 ASP HBx H 1 2.81 0.02 A 100 ASP HBy H 1 3.23 0.02 A 100 ASP C C 13 178.0 0.2 A 100 ASP CA C 13 52.4 0.2 A 100 ASP CB C 13 41.5 0.2 A 100 ASP N N 15 118.7 0.2 A 101 ALA H H 1 8.02 0.02 A 101 ALA HA H 1 2.11 0.02 A 101 ALA HB% H 1 0.89 0.02 A 101 ALA C C 13 177.3 0.2 A 101 ALA CA C 13 53.7 0.2 A 101 ALA CB C 13 18.0 0.2 A 101 ALA N N 15 120.3 0.2 A 102 SER H H 1 7.90 0.02 A 102 SER HA H 1 4.24 0.02 A 102 SER HBx H 1 3.78 0.02 A 102 SER HBy H 1 3.87 0.02 A 102 SER C C 13 175.3 0.2 A 102 SER CA C 13 58.3 0.2 A 102 SER CB C 13 64.5 0.2 A 102 SER N N 15 111.8 0.2 A 103 GLY H H 1 7.75 0.02 A 103 GLY HAx H 1 3.46 0.02 A 103 GLY HAy H 1 4.02 0.02 A 103 GLY C C 13 172.9 0.2 A 103 GLY CA C 13 45.5 0.2 A 103 GLY N N 15 109.9 0.2 A 104 LYS H H 1 7.77 0.02 A 104 LYS HA H 1 4.18 0.02 A 104 LYS HBx H 1 1.62 0.02 A 104 LYS HBy H 1 1.76 0.02 A 104 LYS HDx H 1 1.67 0.02 A 104 LYS HDy H 1 1.67 0.02 A 104 LYS HEx H 1 2.99 0.02 A 104 LYS HEy H 1 2.99 0.02 A 104 LYS HGx H 1 1.25 0.02 A 104 LYS HGy H 1 1.38 0.02 A 104 LYS C C 13 177.1 0.2 A 104 LYS CA C 13 56.1 0.2 A 104 LYS CB C 13 32.3 0.2 A 104 LYS CD C 13 29.2 0.2 A 104 LYS CE C 13 42.1 0.2 A 104 LYS CG C 13 24.7 0.2 A 104 LYS N N 15 120.9 0.2 A 105 LEU H H 1 8.60 0.02 A 105 LEU HA H 1 3.99 0.02 A 105 LEU HBx H 1 1.51 0.02 A 105 LEU HBy H 1 1.60 0.02 A 105 LEU HD1% H 1 0.89 0.02 A 105 LEU HD2% H 1 0.89 0.02 A 105 LEU HG H 1 1.50 0.02 A 105 LEU C C 13 176.0 0.2 A 105 LEU CA C 13 56.4 0.2 A 105 LEU CB C 13 43.0 0.2 A 105 LEU CD1 C 13 24.3 0.2 A 105 LEU CD2 C 13 24.3 0.2 A 105 LEU CG C 13 27.4 0.2 A 105 LEU N N 15 130.4 0.2 A 106 ASN H H 1 9.09 0.02 A 106 ASN HA H 1 4.88 0.02 A 106 ASN HBx H 1 2.64 0.02 A 106 ASN HBy H 1 2.92 0.02 A 106 ASN HD21 H 1 7.16 0.02 A 106 ASN HD22 H 1 7.59 0.02 A 106 ASN C C 13 177.0 0.2 A 106 ASN CA C 13 52.0 0.2 A 106 ASN CB C 13 37.9 0.2 A 106 ASN CG C 13 176.8 0.2 A 106 ASN N N 15 123.4 0.2 A 106 ASN ND2 N 15 111.5 0.2 A 107 THR H H 1 8.55 0.02 A 107 THR HA H 1 4.19 0.02 A 107 THR HB H 1 4.56 0.02 A 107 THR HG2% H 1 1.26 0.02 A 107 THR C C 13 175.1 0.2 A 107 THR CA C 13 63.6 0.2 A 107 THR CB C 13 68.3 0.2 A 107 THR CG2 C 13 22.1 0.2 A 107 THR N N 15 116.5 0.2 A 108 GLU H H 1 8.36 0.02 A 108 GLU HA H 1 4.38 0.02 A 108 GLU HBx H 1 2.01 0.02 A 108 GLU HBy H 1 2.20 0.02 A 108 GLU HGx H 1 2.22 0.02 A 108 GLU HGy H 1 2.31 0.02 A 108 GLU C C 13 176.4 0.2 A 108 GLU CA C 13 56.7 0.2 A 108 GLU CB C 13 29.9 0.2 A 108 GLU CG C 13 36.9 0.2 A 108 GLU N N 15 119.5 0.2 A 109 MET H H 1 7.21 0.02 A 109 MET HA H 1 4.87 0.02 A 109 MET HBx H 1 1.98 0.02 A 109 MET HBy H 1 1.98 0.02 A 109 MET HGx H 1 2.26 0.02 A 109 MET HGy H 1 2.38 0.02 A 109 MET CA C 13 52.7 0.2 A 109 MET CB C 13 33.6 0.2 A 109 MET CG C 13 32.9 0.2 A 109 MET N N 15 118.7 0.2 A 110 PRO HA H 1 4.53 0.02 A 110 PRO HBy H 1 2.39 0.02 A 110 PRO HBx H 1 2.09 0.02 A 110 PRO HDy H 1 3.87 0.02 A 110 PRO HDx H 1 3.47 0.02 A 110 PRO HGx H 1 2.03 0.02 A 110 PRO HGy H 1 2.14 0.02 A 110 PRO C C 13 176.2 0.2 A 110 PRO CA C 13 64.0 0.2 A 110 PRO CB C 13 33.3 0.2 A 110 PRO CD C 13 50.6 0.2 A 110 PRO CG C 13 28.2 0.2 A 111 ARG H H 1 8.43 0.02 A 111 ARG HA H 1 4.96 0.02 A 111 ARG HBx H 1 1.91 0.02 A 111 ARG HBy H 1 2.09 0.02 A 111 ARG HDx H 1 3.31 0.02 A 111 ARG HDy H 1 3.31 0.02 A 111 ARG HGx H 1 1.92 0.02 A 111 ARG HGy H 1 2.08 0.02 A 111 ARG C C 13 175.3 0.2 A 111 ARG CA C 13 55.8 0.2 A 111 ARG CB C 13 33.2 0.2 A 111 ARG CD C 13 44.1 0.2 A 111 ARG CG C 13 27.4 0.2 A 111 ARG N N 15 120.9 0.2 A 112 SER H H 1 8.57 0.02 A 112 SER HA H 1 4.72 0.02 A 112 SER HBx H 1 3.24 0.02 A 112 SER HBy H 1 3.54 0.02 A 112 SER HG H 1 6.44 0.02 A 112 SER C C 13 172.7 0.2 A 112 SER CA C 13 57.3 0.2 A 112 SER CB C 13 66.4 0.2 A 112 SER N N 15 115.5 0.2 A 113 ASN H H 1 8.52 0.02 A 113 ASN HA H 1 5.41 0.02 A 113 ASN HBx H 1 2.78 0.02 A 113 ASN HBy H 1 2.78 0.02 A 113 ASN HD21 H 1 6.94 0.02 A 113 ASN HD22 H 1 7.29 0.02 A 113 ASN C C 13 173.9 0.2 A 113 ASN CA C 13 53.0 0.2 A 113 ASN CB C 13 41.1 0.2 A 113 ASN CG C 13 177.0 0.2 A 113 ASN N N 15 119.0 0.2 A 113 ASN ND2 N 15 114.1 0.2 A 114 TRP H H 1 9.45 0.02 A 114 TRP HA H 1 5.32 0.02 A 114 TRP HBx H 1 3.18 0.02 A 114 TRP HBy H 1 3.32 0.02 A 114 TRP HD1 H 1 7.11 0.02 A 114 TRP HE1 H 1 9.60 0.02 A 114 TRP HH2 H 1 7.42 0.02 A 114 TRP HZ2 H 1 7.66 0.02 A 114 TRP HZ3 H 1 7.86 0.02 A 114 TRP C C 13 175.2 0.2 A 114 TRP CA C 13 56.7 0.2 A 114 TRP CB C 13 31.7 0.2 A 114 TRP CD1 C 13 126.4 0.2 A 114 TRP CH2 C 13 124.3 0.2 A 114 TRP CZ2 C 13 114.7 0.2 A 114 TRP CZ3 C 13 120.9 0.2 A 114 TRP N N 15 123.9 0.2 A 115 ASP H H 1 8.83 0.02 A 115 ASP HA H 1 5.00 0.02 A 115 ASP HBx H 1 2.66 0.02 A 115 ASP HBy H 1 3.23 0.02 A 115 ASP C C 13 174.5 0.2 A 115 ASP CA C 13 54.0 0.2 A 115 ASP CB C 13 42.9 0.2 A 115 ASP N N 15 124.3 0.2 A 116 MET H H 1 9.25 0.02 A 116 MET HA H 1 5.38 0.02 A 116 MET HBx H 1 1.21 0.02 A 116 MET HBy H 1 1.21 0.02 A 116 MET HE% H 1 0.94 0.02 A 116 MET HGx H 1 2.02 0.02 A 116 MET HGy H 1 2.02 0.02 A 116 MET C C 13 175.1 0.2 A 116 MET CA C 13 52.8 0.2 A 116 MET CB C 13 32.4 0.2 A 116 MET CE C 13 15.8 0.2 A 116 MET CG C 13 30.7 0.2 A 116 MET N N 15 126.2 0.2 A 117 ARG H H 1 8.87 0.02 A 117 ARG HA H 1 5.41 0.02 A 117 ARG HBx H 1 1.64 0.02 A 117 ARG HBy H 1 1.93 0.02 A 117 ARG HDx H 1 3.08 0.02 A 117 ARG HDy H 1 3.21 0.02 A 117 ARG HE H 1 7.53 0.02 A 117 ARG HGx H 1 1.60 0.02 A 117 ARG HGy H 1 1.80 0.02 A 117 ARG C C 13 174.5 0.2 A 117 ARG CA C 13 53.5 0.2 A 117 ARG CB C 13 33.0 0.2 A 117 ARG CD C 13 43.2 0.2 A 117 ARG CG C 13 27.8 0.2 A 117 ARG N N 15 119.9 0.2 A 117 ARG NE N 15 85.2 0.2 A 118 PHE H H 1 8.67 0.02 A 118 PHE HA H 1 4.89 0.02 A 118 PHE HBx H 1 2.43 0.02 A 118 PHE HBy H 1 3.73 0.02 A 118 PHE HDx H 1 6.95 0.02 A 118 PHE HDy H 1 6.95 0.02 A 118 PHE C C 13 175.2 0.2 A 118 PHE CA C 13 56.9 0.2 A 118 PHE CB C 13 41.4 0.2 A 118 PHE CDx C 13 131.1 0.2 A 118 PHE CDy C 13 131.1 0.2 A 118 PHE N N 15 119.7 0.2 A 119 ILE H H 1 9.91 0.02 A 119 ILE HA H 1 4.39 0.02 A 119 ILE HB H 1 2.12 0.02 A 119 ILE HD1% H 1 0.75 0.02 A 119 ILE HG1x H 1 1.30 0.02 A 119 ILE HG1y H 1 1.40 0.02 A 119 ILE HG2% H 1 0.92 0.02 A 119 ILE C C 13 175.5 0.2 A 119 ILE CA C 13 60.7 0.2 A 119 ILE CB C 13 40.0 0.2 A 119 ILE CD1 C 13 13.1 0.2 A 119 ILE CG1 C 13 28.3 0.2 A 119 ILE CG2 C 13 18.0 0.2 A 119 ILE N N 15 128.0 0.2 A 120 ASP H H 1 8.87 0.02 A 120 ASP HA H 1 4.85 0.02 A 120 ASP HBx H 1 2.28 0.02 A 120 ASP HBy H 1 3.08 0.02 A 120 ASP C C 13 175.8 0.2 A 120 ASP CA C 13 54.1 0.2 A 120 ASP CB C 13 41.3 0.2 A 120 ASP N N 15 128.7 0.2 A 121 LYS H H 1 8.03 0.02 A 121 LYS HA H 1 4.80 0.02 A 121 LYS HBx H 1 1.53 0.02 A 121 LYS HBy H 1 1.96 0.02 A 121 LYS HDx H 1 1.66 0.02 A 121 LYS HDy H 1 1.71 0.02 A 121 LYS HEx H 1 2.90 0.02 A 121 LYS HEy H 1 2.90 0.02 A 121 LYS HGx H 1 1.40 0.02 A 121 LYS HGy H 1 1.40 0.02 A 121 LYS C C 13 177.1 0.2 A 121 LYS CA C 13 54.7 0.2 A 121 LYS CB C 13 31.4 0.2 A 121 LYS CD C 13 30.1 0.2 A 121 LYS CE C 13 42.1 0.2 A 121 LYS CG C 13 25.2 0.2 A 121 LYS N N 15 130.0 0.2 A 122 GLY H H 1 9.25 0.02 A 122 GLY HAx H 1 3.60 0.02 A 122 GLY HAy H 1 4.25 0.02 A 122 GLY C C 13 174.6 0.2 A 122 GLY CA C 13 46.9 0.2 A 122 GLY N N 15 111.2 0.2 A 123 GLU H H 1 8.93 0.02 A 123 GLU HA H 1 4.09 0.02 A 123 GLU HBx H 1 1.89 0.02 A 123 GLU HBy H 1 2.18 0.02 A 123 GLU HGx H 1 2.27 0.02 A 123 GLU HGy H 1 2.34 0.02 A 123 GLU C C 13 174.1 0.2 A 123 GLU CA C 13 57.3 0.2 A 123 GLU CB C 13 29.6 0.2 A 123 GLU CG C 13 36.6 0.2 A 123 GLU N N 15 127.6 0.2 A 124 ILE H H 1 6.92 0.02 A 124 ILE HA H 1 4.82 0.02 A 124 ILE HB H 1 1.81 0.02 A 124 ILE HD1% H 1 0.75 0.02 A 124 ILE HG1x H 1 1.13 0.02 A 124 ILE HG1y H 1 1.39 0.02 A 124 ILE HG2% H 1 0.85 0.02 A 124 ILE C C 13 175.8 0.2 A 124 ILE CA C 13 58.3 0.2 A 124 ILE CB C 13 40.9 0.2 A 124 ILE CD1 C 13 13.0 0.2 A 124 ILE CG1 C 13 27.7 0.2 A 124 ILE CG2 C 13 18.0 0.2 A 124 ILE N N 15 114.8 0.2 A 125 THR H H 1 8.87 0.02 A 125 THR HA H 1 5.09 0.02 A 125 THR HB H 1 3.96 0.02 A 125 THR HG1 H 1 6.18 0.02 A 125 THR HG2% H 1 1.29 0.02 A 125 THR C C 13 173.6 0.2 A 125 THR CA C 13 62.0 0.2 A 125 THR CB C 13 72.2 0.2 A 125 THR CG2 C 13 21.0 0.2 A 125 THR N N 15 119.9 0.2 A 126 GLU H H 1 8.95 0.02 A 126 GLU HA H 1 5.04 0.02 A 126 GLU HBx H 1 1.86 0.02 A 126 GLU HBy H 1 2.03 0.02 A 126 GLU HGx H 1 1.84 0.02 A 126 GLU HGy H 1 1.93 0.02 A 126 GLU C C 13 173.4 0.2 A 126 GLU CA C 13 54.9 0.2 A 126 GLU CB C 13 33.6 0.2 A 126 GLU CG C 13 37.4 0.2 A 126 GLU N N 15 126.9 0.2 A 127 VAL H H 1 9.48 0.02 A 127 VAL HA H 1 4.65 0.02 A 127 VAL HB H 1 2.01 0.02 A 127 VAL HG1% H 1 0.03 0.02 A 127 VAL HG2% H 1 0.85 0.02 A 127 VAL C C 13 175.1 0.2 A 127 VAL CA C 13 60.9 0.2 A 127 VAL CB C 13 33.6 0.2 A 127 VAL CG1 C 13 20.9 0.2 A 127 VAL CG2 C 13 23.5 0.2 A 127 VAL N N 15 129.7 0.2 A 128 GLN H H 1 8.98 0.02 A 128 GLN HA H 1 5.44 0.02 A 128 GLN HBx H 1 1.68 0.02 A 128 GLN HBy H 1 1.95 0.02 A 128 GLN HE21 H 1 6.88 0.02 A 128 GLN HE22 H 1 8.24 0.02 A 128 GLN HGx H 1 2.21 0.02 A 128 GLN HGy H 1 2.27 0.02 A 128 GLN C C 13 174.1 0.2 A 128 GLN CA C 13 52.9 0.2 A 128 GLN CB C 13 30.2 0.2 A 128 GLN CD C 13 179.6 0.2 A 128 GLN CG C 13 32.9 0.2 A 128 GLN N N 15 123.2 0.2 A 128 GLN NE2 N 15 112.3 0.2 A 129 TYR H H 1 9.78 0.02 A 129 TYR HA H 1 5.43 0.02 A 129 TYR HBx H 1 2.70 0.02 A 129 TYR HBy H 1 3.03 0.02 A 129 TYR HDx H 1 7.03 0.02 A 129 TYR HDy H 1 7.03 0.02 A 129 TYR HEx H 1 6.80 0.02 A 129 TYR HEy H 1 6.80 0.02 A 129 TYR C C 13 174.7 0.2 A 129 TYR CA C 13 54.8 0.2 A 129 TYR CB C 13 39.3 0.2 A 129 TYR CDx C 13 133.0 0.2 A 129 TYR CDy C 13 133.0 0.2 A 129 TYR CEx C 13 118.5 0.2 A 129 TYR CEy C 13 118.5 0.2 A 129 TYR N N 15 124.9 0.2 A 130 HIS H H 1 9.05 0.02 A 130 HIS HA H 1 5.15 0.02 A 130 HIS HBx H 1 3.07 0.02 A 130 HIS HBy H 1 3.45 0.02 A 130 HIS C C 13 173.4 0.2 A 130 HIS CA C 13 55.7 0.2 A 130 HIS CB C 13 31.4 0.2 A 130 HIS N N 15 124.3 0.2 A 131 ILE H H 1 9.22 0.02 A 131 ILE HA H 1 4.88 0.02 A 131 ILE HB H 1 1.59 0.02 A 131 ILE HD1% H 1 0.24 0.02 A 131 ILE HG1x H 1 0.09 0.02 A 131 ILE HG1y H 1 1.05 0.02 A 131 ILE HG2% H 1 0.43 0.02 A 131 ILE C C 13 175.1 0.2 A 131 ILE CA C 13 60.7 0.2 A 131 ILE CB C 13 40.2 0.2 A 131 ILE CD1 C 13 14.3 0.2 A 131 ILE CG1 C 13 27.4 0.2 A 131 ILE CG2 C 13 17.7 0.2 A 131 ILE N N 15 128.8 0.2 A 132 SER H H 1 9.27 0.02 A 132 SER HA H 1 5.45 0.02 A 132 SER HBx H 1 3.87 0.02 A 132 SER HBy H 1 3.87 0.02 A 132 SER C C 13 173.1 0.2 A 132 SER CA C 13 56.9 0.2 A 132 SER CB C 13 66.3 0.2 A 132 SER N N 15 120.9 0.2 A 133 TYR H H 1 8.44 0.02 A 133 TYR HA H 1 4.79 0.02 A 133 TYR HBx H 1 2.57 0.02 A 133 TYR HBy H 1 3.16 0.02 A 133 TYR HDx H 1 7.02 0.02 A 133 TYR HDy H 1 7.02 0.02 A 133 TYR HEx H 1 6.43 0.02 A 133 TYR HEy H 1 6.43 0.02 A 133 TYR C C 13 176.2 0.2 A 133 TYR CA C 13 57.2 0.2 A 133 TYR CB C 13 42.6 0.2 A 133 TYR CDx C 13 132.9 0.2 A 133 TYR CDy C 13 132.9 0.2 A 133 TYR CEx C 13 118.8 0.2 A 133 TYR CEy C 13 118.8 0.2 A 133 TYR N N 15 120.4 0.2 A 134 ASP H H 1 9.36 0.02 A 134 ASP HA H 1 4.55 0.02 A 134 ASP HBx H 1 2.68 0.02 A 134 ASP HBy H 1 2.79 0.02 A 134 ASP C C 13 176.3 0.2 A 134 ASP CA C 13 56.5 0.2 A 134 ASP CB C 13 41.4 0.2 A 134 ASP N N 15 120.0 0.2 A 135 ASP H H 1 7.63 0.02 A 135 ASP HA H 1 4.79 0.02 A 135 ASP HBx H 1 2.82 0.02 A 135 ASP HBy H 1 2.88 0.02 A 135 ASP C C 13 175.8 0.2 A 135 ASP CA C 13 52.7 0.2 A 135 ASP CB C 13 43.9 0.2 A 135 ASP N N 15 114.2 0.2 A 136 VAL H H 1 9.05 0.02 A 136 VAL HA H 1 3.74 0.02 A 136 VAL HB H 1 2.14 0.02 A 136 VAL HG1% H 1 1.02 0.02 A 136 VAL HG2% H 1 1.18 0.02 A 136 VAL C C 13 176.2 0.2 A 136 VAL CA C 13 65.4 0.2 A 136 VAL CB C 13 32.2 0.2 A 136 VAL CG1 C 13 20.8 0.2 A 136 VAL CG2 C 13 23.6 0.2 A 136 VAL N N 15 123.2 0.2 A 137 ALA H H 1 8.55 0.02 A 137 ALA HA H 1 4.22 0.02 A 137 ALA HB% H 1 1.47 0.02 A 137 ALA C C 13 181.6 0.2 A 137 ALA CA C 13 55.3 0.2 A 137 ALA CB C 13 18.0 0.2 A 137 ALA N N 15 124.6 0.2 A 138 GLN H H 1 8.21 0.02 A 138 GLN HA H 1 4.12 0.02 A 138 GLN HBx H 1 2.31 0.02 A 138 GLN HBy H 1 2.31 0.02 A 138 GLN HE21 H 1 7.01 0.02 A 138 GLN HE22 H 1 7.83 0.02 A 138 GLN HGx H 1 2.43 0.02 A 138 GLN HGy H 1 2.84 0.02 A 138 GLN C C 13 178.0 0.2 A 138 GLN CA C 13 59.1 0.2 A 138 GLN CB C 13 29.7 0.2 A 138 GLN CD C 13 179.2 0.2 A 138 GLN CG C 13 35.2 0.2 A 138 GLN N N 15 118.0 0.2 A 138 GLN NE2 N 15 112.1 0.2 A 139 LEU H H 1 6.74 0.02 A 139 LEU HA H 1 2.72 0.02 A 139 LEU HBx H 1 1.03 0.02 A 139 LEU HBy H 1 1.84 0.02 A 139 LEU HD1% H 1 0.66 0.02 A 139 LEU HD2% H 1 0.68 0.02 A 139 LEU HG H 1 1.22 0.02 A 139 LEU C C 13 178.1 0.2 A 139 LEU CA C 13 58.5 0.2 A 139 LEU CB C 13 42.0 0.2 A 139 LEU CD1 C 13 26.4 0.2 A 139 LEU CD2 C 13 25.5 0.2 A 139 LEU CG C 13 27.5 0.2 A 139 LEU N N 15 123.7 0.2 A 140 GLU H H 1 8.62 0.02 A 140 GLU HA H 1 3.80 0.02 A 140 GLU HBx H 1 1.94 0.02 A 140 GLU HBy H 1 2.06 0.02 A 140 GLU HGx H 1 2.11 0.02 A 140 GLU HGy H 1 2.44 0.02 A 140 GLU C C 13 179.3 0.2 A 140 GLU CA C 13 59.8 0.2 A 140 GLU CB C 13 29.2 0.2 A 140 GLU CG C 13 37.1 0.2 A 140 GLU N N 15 118.5 0.2 A 141 ALA H H 1 8.21 0.02 A 141 ALA HA H 1 4.10 0.02 A 141 ALA HB% H 1 1.47 0.02 A 141 ALA C C 13 179.8 0.2 A 141 ALA CA C 13 55.1 0.2 A 141 ALA CB C 13 18.1 0.2 A 141 ALA N N 15 121.5 0.2 A 142 THR H H 1 7.51 0.02 A 142 THR HA H 1 3.91 0.02 A 142 THR HB H 1 4.20 0.02 A 142 THR HG2% H 1 0.98 0.02 A 142 THR C C 13 176.7 0.2 A 142 THR CA C 13 67.4 0.2 A 142 THR CB C 13 68.9 0.2 A 142 THR CG2 C 13 21.0 0.2 A 142 THR N N 15 116.0 0.2 A 143 ILE H H 1 7.82 0.02 A 143 ILE HA H 1 3.95 0.02 A 143 ILE HB H 1 2.19 0.02 A 143 ILE HD1% H 1 0.95 0.02 A 143 ILE HG1x H 1 1.51 0.02 A 143 ILE HG1y H 1 1.62 0.02 A 143 ILE HG2% H 1 1.03 0.02 A 143 ILE C C 13 180.9 0.2 A 143 ILE CA C 13 63.7 0.2 A 143 ILE CB C 13 36.8 0.2 A 143 ILE CD1 C 13 11.2 0.2 A 143 ILE CG1 C 13 27.8 0.2 A 143 ILE CG2 C 13 17.0 0.2 A 143 ILE N N 15 121.0 0.2 A 144 GLN H H 1 8.52 0.02 A 144 GLN HA H 1 4.13 0.02 A 144 GLN HBx H 1 2.22 0.02 A 144 GLN HBy H 1 2.22 0.02 A 144 GLN HE21 H 1 6.81 0.02 A 144 GLN HE22 H 1 7.49 0.02 A 144 GLN HGx H 1 2.51 0.02 A 144 GLN HGy H 1 2.51 0.02 A 144 GLN C C 13 177.1 0.2 A 144 GLN CA C 13 58.6 0.2 A 144 GLN CB C 13 28.3 0.2 A 144 GLN CD C 13 180.0 0.2 A 144 GLN CG C 13 34.0 0.2 A 144 GLN N N 15 121.6 0.2 A 144 GLN NE2 N 15 111.6 0.2 A 145 MET H H 1 7.71 0.02 A 145 MET HA H 1 4.46 0.02 A 145 MET HBx H 1 2.30 0.02 A 145 MET HBy H 1 2.30 0.02 A 145 MET HGx H 1 2.74 0.02 A 145 MET HGy H 1 2.82 0.02 A 145 MET C C 13 176.4 0.2 A 145 MET CA C 13 56.3 0.2 A 145 MET CB C 13 33.0 0.2 A 145 MET CG C 13 32.2 0.2 A 145 MET N N 15 116.4 0.2 A 146 GLY H H 1 7.86 0.02 A 146 GLY HAx H 1 4.03 0.02 A 146 GLY HAy H 1 4.30 0.02 A 146 GLY C C 13 175.6 0.2 A 146 GLY CA C 13 46.0 0.2 A 146 GLY N N 15 106.1 0.2 A 147 PHE H H 1 7.35 0.02 A 147 PHE HA H 1 4.27 0.02 A 147 PHE HBx H 1 2.40 0.02 A 147 PHE HBy H 1 3.49 0.02 A 147 PHE HDx H 1 7.14 0.02 A 147 PHE HDy H 1 7.14 0.02 A 147 PHE C C 13 175.9 0.2 A 147 PHE CA C 13 61.6 0.2 A 147 PHE CB C 13 42.8 0.2 A 147 PHE CDx C 13 131.4 0.2 A 147 PHE CDy C 13 131.4 0.2 A 147 PHE N N 15 120.1 0.2 A 148 LYS H H 1 8.82 0.02 A 148 LYS HA H 1 3.30 0.02 A 148 LYS HBx H 1 1.10 0.02 A 148 LYS HBy H 1 1.41 0.02 A 148 LYS HDx H 1 0.98 0.02 A 148 LYS HDy H 1 1.17 0.02 A 148 LYS HEx H 1 2.48 0.02 A 148 LYS HEy H 1 2.48 0.02 A 148 LYS HGx H 1 -0.32 0.02 A 148 LYS HGy H 1 0.56 0.02 A 148 LYS C C 13 178.6 0.2 A 148 LYS CA C 13 59.9 0.2 A 148 LYS CB C 13 32.5 0.2 A 148 LYS CD C 13 29.6 0.2 A 148 LYS CE C 13 41.9 0.2 A 148 LYS CG C 13 24.1 0.2 A 148 LYS N N 15 116.7 0.2 A 149 GLU H H 1 8.64 0.02 A 149 GLU HA H 1 3.77 0.02 A 149 GLU HBx H 1 1.89 0.02 A 149 GLU HBy H 1 2.05 0.02 A 149 GLU HGx H 1 2.11 0.02 A 149 GLU HGy H 1 2.43 0.02 A 149 GLU C C 13 178.4 0.2 A 149 GLU CA C 13 60.3 0.2 A 149 GLU CB C 13 28.8 0.2 A 149 GLU CG C 13 37.1 0.2 A 149 GLU N N 15 120.5 0.2 A 150 GLY H H 1 8.18 0.02 A 150 GLY HAx H 1 3.68 0.02 A 150 GLY HAy H 1 3.80 0.02 A 150 GLY C C 13 175.5 0.2 A 150 GLY CA C 13 47.5 0.2 A 150 GLY N N 15 106.3 0.2 A 151 ILE H H 1 8.32 0.02 A 151 ILE HA H 1 3.98 0.02 A 151 ILE HB H 1 1.21 0.02 A 151 ILE HD1% H 1 0.75 0.02 A 151 ILE HG1x H 1 1.01 0.02 A 151 ILE HG1y H 1 1.23 0.02 A 151 ILE HG2% H 1 0.71 0.02 A 151 ILE C C 13 177.6 0.2 A 151 ILE CA C 13 62.2 0.2 A 151 ILE CB C 13 37.7 0.2 A 151 ILE CD1 C 13 13.7 0.2 A 151 ILE CG1 C 13 29.6 0.2 A 151 ILE CG2 C 13 18.6 0.2 A 151 ILE N N 15 122.0 0.2 A 152 THR H H 1 7.51 0.02 A 152 THR HA H 1 4.16 0.02 A 152 THR HB H 1 4.22 0.02 A 152 THR HG2% H 1 1.19 0.02 A 152 THR C C 13 178.0 0.2 A 152 THR CA C 13 66.5 0.2 A 152 THR CB C 13 68.8 0.2 A 152 THR CG2 C 13 21.3 0.2 A 152 THR N N 15 116.3 0.2 A 153 MET H H 1 7.91 0.02 A 153 MET HA H 1 4.21 0.02 A 153 MET HBx H 1 2.28 0.02 A 153 MET HBy H 1 2.42 0.02 A 153 MET HGx H 1 2.66 0.02 A 153 MET HGy H 1 2.88 0.02 A 153 MET C C 13 178.7 0.2 A 153 MET CA C 13 59.3 0.2 A 153 MET CB C 13 32.9 0.2 A 153 MET CG C 13 33.0 0.2 A 153 MET N N 15 122.0 0.2 A 154 ALA H H 1 8.28 0.02 A 154 ALA HA H 1 4.36 0.02 A 154 ALA HB% H 1 1.43 0.02 A 154 ALA C C 13 180.2 0.2 A 154 ALA CA C 13 55.7 0.2 A 154 ALA CB C 13 18.3 0.2 A 154 ALA N N 15 123.2 0.2 A 155 MET H H 1 8.04 0.02 A 155 MET HA H 1 4.18 0.02 A 155 MET HBx H 1 2.17 0.02 A 155 MET HBy H 1 2.17 0.02 A 155 MET HGx H 1 2.75 0.02 A 155 MET HGy H 1 3.46 0.02 A 155 MET C C 13 178.2 0.2 A 155 MET CA C 13 60.8 0.2 A 155 MET CB C 13 32.3 0.2 A 155 MET CG C 13 34.0 0.2 A 155 MET N N 15 114.6 0.2 A 156 GLU H H 1 7.44 0.02 A 156 GLU HA H 1 4.32 0.02 A 156 GLU HBx H 1 2.19 0.02 A 156 GLU HBy H 1 2.45 0.02 A 156 GLU HGx H 1 2.19 0.02 A 156 GLU HGy H 1 2.72 0.02 A 156 GLU C C 13 179.9 0.2 A 156 GLU CA C 13 59.7 0.2 A 156 GLU CB C 13 28.9 0.2 A 156 GLU CG C 13 37.3 0.2 A 156 GLU N N 15 117.7 0.2 A 157 ASN H H 1 8.18 0.02 A 157 ASN HA H 1 4.57 0.02 A 157 ASN HBx H 1 3.15 0.02 A 157 ASN HBy H 1 4.42 0.02 A 157 ASN HD21 H 1 6.11 0.02 A 157 ASN HD22 H 1 8.35 0.02 A 157 ASN C C 13 179.3 0.2 A 157 ASN CA C 13 55.5 0.2 A 157 ASN CB C 13 38.4 0.2 A 157 ASN CG C 13 176.1 0.2 A 157 ASN N N 15 118.9 0.2 A 157 ASN ND2 N 15 112.5 0.2 A 158 LEU H H 1 7.86 0.02 A 158 LEU HA H 1 3.71 0.02 A 158 LEU HBx H 1 1.51 0.02 A 158 LEU HBy H 1 1.51 0.02 A 158 LEU HD1% H 1 -0.31 0.02 A 158 LEU HD2% H 1 -0.96 0.02 A 158 LEU HG H 1 0.69 0.02 A 158 LEU C C 13 177.9 0.2 A 158 LEU CA C 13 57.8 0.2 A 158 LEU CB C 13 38.0 0.2 A 158 LEU CD1 C 13 22.3 0.2 A 158 LEU CD2 C 13 23.8 0.2 A 158 LEU N N 15 123.8 0.2 A 159 ASP H H 1 8.19 0.02 A 159 ASP HA H 1 4.38 0.02 A 159 ASP HBx H 1 2.72 0.02 A 159 ASP HBy H 1 3.21 0.02 A 159 ASP C C 13 179.7 0.2 A 159 ASP CA C 13 58.0 0.2 A 159 ASP CB C 13 40.8 0.2 A 159 ASP N N 15 119.0 0.2 A 160 GLU H H 1 7.41 0.02 A 160 GLU HA H 1 4.12 0.02 A 160 GLU HBx H 1 2.21 0.02 A 160 GLU HBy H 1 2.21 0.02 A 160 GLU HGx H 1 2.33 0.02 A 160 GLU HGy H 1 2.49 0.02 A 160 GLU C C 13 178.8 0.2 A 160 GLU CA C 13 58.9 0.2 A 160 GLU CB C 13 29.8 0.2 A 160 GLU CG C 13 36.3 0.2 A 160 GLU N N 15 116.8 0.2 A 161 LEU H H 1 7.94 0.02 A 161 LEU HA H 1 4.16 0.02 A 161 LEU HBx H 1 1.74 0.02 A 161 LEU HBy H 1 1.74 0.02 A 161 LEU HD1% H 1 0.95 0.02 A 161 LEU HD2% H 1 0.82 0.02 A 161 LEU HG H 1 1.70 0.02 A 161 LEU C C 13 180.2 0.2 A 161 LEU CA C 13 57.9 0.2 A 161 LEU CB C 13 42.6 0.2 A 161 LEU CD1 C 13 25.7 0.2 A 161 LEU CD2 C 13 25.4 0.2 A 161 LEU CG C 13 27.1 0.2 A 161 LEU N N 15 122.5 0.2 A 162 LEU H H 1 8.46 0.02 A 162 LEU HA H 1 4.05 0.02 A 162 LEU HBx H 1 1.38 0.02 A 162 LEU HBy H 1 1.97 0.02 A 162 LEU HD1% H 1 0.68 0.02 A 162 LEU HD2% H 1 0.53 0.02 A 162 LEU HG H 1 1.75 0.02 A 162 LEU C C 13 179.2 0.2 A 162 LEU CA C 13 57.1 0.2 A 162 LEU CB C 13 41.4 0.2 A 162 LEU CD1 C 13 26.4 0.2 A 162 LEU CD2 C 13 21.9 0.2 A 162 LEU CG C 13 26.1 0.2 A 162 LEU N N 15 117.8 0.2 A 163 VAL H H 1 7.49 0.02 A 163 VAL HA H 1 4.16 0.02 A 163 VAL HB H 1 2.30 0.02 A 163 VAL HG1% H 1 1.05 0.02 A 163 VAL HG2% H 1 1.14 0.02 A 163 VAL C C 13 177.4 0.2 A 163 VAL CA C 13 64.1 0.2 A 163 VAL CB C 13 32.3 0.2 A 163 VAL CG1 C 13 21.2 0.2 A 163 VAL CG2 C 13 21.9 0.2 A 163 VAL N N 15 116.8 0.2 A 164 SER H H 1 7.95 0.02 A 164 SER HA H 1 4.39 0.02 A 164 SER HBx H 1 4.05 0.02 A 164 SER HBy H 1 4.05 0.02 A 164 SER C C 13 175.9 0.2 A 164 SER CA C 13 60.2 0.2 A 164 SER CB C 13 63.8 0.2 A 164 SER N N 15 116.6 0.2 A 165 GLY H H 1 8.25 0.02 A 165 GLY HAx H 1 3.99 0.02 A 165 GLY HAy H 1 3.99 0.02 A 165 GLY C C 13 174.5 0.2 A 165 GLY CA C 13 46.0 0.2 A 165 GLY N N 15 109.9 0.2 A 166 LYS H H 1 7.90 0.02 A 166 LYS HA H 1 4.28 0.02 A 166 LYS HBx H 1 1.81 0.02 A 166 LYS HBy H 1 1.85 0.02 A 166 LYS HDx H 1 1.70 0.02 A 166 LYS HDy H 1 1.70 0.02 A 166 LYS HEx H 1 3.01 0.02 A 166 LYS HEy H 1 3.01 0.02 A 166 LYS HGx H 1 1.50 0.02 A 166 LYS HGy H 1 1.50 0.02 A 166 LYS C C 13 176.7 0.2 A 166 LYS CA C 13 56.8 0.2 A 166 LYS CB C 13 33.0 0.2 A 166 LYS CD C 13 29.2 0.2 A 166 LYS CE C 13 42.3 0.2 A 166 LYS CG C 13 25.0 0.2 A 166 LYS N N 15 120.8 0.2 A 167 LYS H H 1 8.27 0.02 A 167 LYS HA H 1 4.28 0.02 A 167 LYS HBx H 1 1.81 0.02 A 167 LYS HBy H 1 1.85 0.02 A 167 LYS HDx H 1 1.70 0.02 A 167 LYS HDy H 1 1.70 0.02 A 167 LYS HEx H 1 3.01 0.02 A 167 LYS HEy H 1 3.01 0.02 A 167 LYS HGx H 1 1.50 0.02 A 167 LYS HGy H 1 1.50 0.02 A 167 LYS C C 13 176.6 0.2 A 167 LYS CA C 13 56.6 0.2 A 167 LYS CB C 13 32.7 0.2 A 167 LYS CD C 13 29.2 0.2 A 167 LYS CE C 13 42.3 0.2 A 167 LYS CG C 13 25.0 0.2 A 167 LYS N N 15 121.6 0.2 A 168 LEU H H 1 8.24 0.02 A 168 LEU HA H 1 4.31 0.02 A 168 LEU HBx H 1 1.50 0.02 A 168 LEU HBy H 1 1.62 0.02 A 168 LEU HD1% H 1 0.87 0.02 A 168 LEU HD2% H 1 0.82 0.02 A 168 LEU HG H 1 1.61 0.02 A 168 LEU C C 13 177.1 0.2 A 168 LEU CA C 13 55.2 0.2 A 168 LEU CB C 13 42.2 0.2 A 168 LEU CD1 C 13 25.2 0.2 A 168 LEU CD2 C 13 23.6 0.2 A 168 LEU CG C 13 27.1 0.2 A 168 LEU N N 15 123.0 0.2 A 169 GLU H H 1 8.33 0.02 A 169 GLU HA H 1 4.20 0.02 A 169 GLU HBx H 1 1.86 0.02 A 169 GLU HBy H 1 1.92 0.02 A 169 GLU HGx H 1 2.13 0.02 A 169 GLU HGy H 1 2.20 0.02 A 169 GLU C C 13 176.1 0.2 A 169 GLU CA C 13 56.7 0.2 A 169 GLU CB C 13 30.3 0.2 A 169 GLU CG C 13 36.2 0.2 A 169 GLU N N 15 120.9 0.2 A 170 HIS H H 1 8.26 0.02 A 170 HIS C C 13 174.1 0.2 A 170 HIS CA C 13 56.1 0.2 A 170 HIS CB C 13 30.6 0.2 A 170 HIS N N 15 119.8 0.2 A 171 HIS H H 1 7.95 0.02 A 171 HIS CA C 13 57.5 0.2 A 171 HIS CB C 13 30.8 0.2 A 171 HIS N N 15 125.6 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 ARG HA A 2 ARG HDx 1.0 1.8 4.42 2 1 A 2 ARG HA A 2 ARG HDy 1.0 1.8 4.42 3 2 A 2 ARG HA A 2 ARG HGx 1.0 1.8 3.71 4 2 A 2 ARG HA A 2 ARG HGy 1.0 1.8 3.71 5 3 A 2 ARG H A 2 ARG HGx 1.0 1.8 5.13 6 3 A 2 ARG HGy A 2 ARG H 1.0 1.8 5.13 7 4 A 3 THR HA A 3 THR HG2% 1.0 1.8 3.56 8 5 A 3 THR HA A 4 ASP H 1.0 1.8 3.82 9 6 A 4 ASP H A 3 THR HB 1.0 1.8 5.27 10 7 A 3 THR HG2% A 4 ASP H 1.0 1.8 4.60 11 8 A 3 THR HG2% A 3 THR H 1.0 1.8 4.92 12 9 A 4 ASP HA A 5 LEU H 1.0 1.8 3.92 13 10 A 5 LEU H A 4 ASP HBy 1.0 1.8 4.62 14 11 A 5 LEU H A 4 ASP HBx 1.0 1.8 4.62 15 12 A 4 ASP H A 4 ASP HBy 1.0 1.8 3.62 16 12 A 4 ASP H A 4 ASP HBx 1.0 1.8 3.62 17 13 A 4 ASP H A 5 LEU H 1.0 1.8 4.60 18 14 A 5 LEU HA A 5 LEU HD1% 1.0 1.8 4.55 19 15 A 5 LEU HA A 5 LEU HD2% 1.0 1.8 3.60 20 16 A 5 LEU HA A 5 LEU HG 1.0 1.8 3.74 21 17 A 5 LEU HA A 6 ALA H 1.0 1.8 3.43 22 18 A 5 LEU HA A 23 GLU HBx 1.0 1.8 5.00 23 18 A 5 LEU HA A 23 GLU HBy 1.0 1.8 5.00 24 19 A 5 LEU HA A 23 GLU HGx 1.0 1.8 6.00 25 19 A 5 LEU HA A 23 GLU HGy 1.0 1.8 6.00 26 20 A 5 LEU HD1% A 5 LEU HBy 1.0 1.8 3.37 27 21 A 5 LEU HD2% A 5 LEU HBy 1.0 1.8 3.51 28 22 A 6 ALA H A 5 LEU HBy 1.0 1.8 5.33 29 23 A 5 LEU HD1% A 5 LEU HBx 1.0 1.8 3.37 30 24 A 5 LEU HD2% A 5 LEU HBx 1.0 1.8 3.51 31 25 A 6 ALA H A 5 LEU HBx 1.0 1.8 5.33 32 26 A 5 LEU HD1% A 24 PHE HA 1.0 1.8 5.50 33 27 A 5 LEU HD1% A 24 PHE HD% 1.0 1.8 6.00 34 28 A 5 LEU HD1% A 25 ALA HB% 1.0 1.8 5.20 35 29 A 5 LEU HD1% A 25 ALA H 1.0 1.8 5.40 36 30 A 5 LEU HD2% A 6 ALA H 1.0 1.8 4.23 37 31 A 5 LEU HD2% A 24 PHE HA 1.0 1.8 4.27 38 32 A 5 LEU HD2% A 24 PHE HD% 1.0 1.8 4.35 39 33 A 5 LEU HD2% A 24 PHE H 1.0 1.8 6.00 40 34 A 5 LEU HD2% A 25 ALA HB% 1.0 1.8 3.63 41 35 A 5 LEU HD2% A 25 ALA H 1.0 1.8 4.49 42 36 A 5 LEU HG A 6 ALA H 1.0 1.8 5.92 43 37 A 5 LEU H A 5 LEU HBy 1.0 1.8 4.11 44 38 A 5 LEU H A 5 LEU HBx 1.0 1.8 4.11 45 39 A 5 LEU H A 5 LEU HD1% 1.0 1.8 4.60 46 40 A 5 LEU H A 5 LEU HD2% 1.0 1.8 4.54 47 41 A 5 LEU H A 5 LEU HG 1.0 1.8 4.00 48 42 A 6 ALA HA A 7 LEU H 1.0 1.8 2.89 49 43 A 6 ALA HA A 23 GLU HBx 1.0 1.8 5.86 50 43 A 23 GLU HBy A 6 ALA HA 1.0 1.8 5.86 51 44 A 7 LEU H A 6 ALA HB% 1.0 1.8 3.44 52 45 A 6 ALA HB% A 22 ARG HA 1.0 1.8 5.97 53 46 A 6 ALA HB% A 23 GLU HBx 1.0 1.8 3.96 54 46 A 23 GLU HBy A 6 ALA HB% 1.0 1.8 3.96 55 47 A 23 GLU HGy A 6 ALA HB% 1.0 1.8 4.84 56 48 A 6 ALA HB% A 23 GLU HGx 1.0 1.8 4.84 57 49 A 6 ALA HB% A 23 GLU H 1.0 1.8 4.64 58 50 A 6 ALA H A 6 ALA HB% 1.0 1.8 3.30 59 51 A 6 ALA H A 7 LEU H 1.0 1.8 4.96 60 52 A 6 ALA H A 23 GLU HBy 1.0 1.8 4.70 61 53 A 6 ALA H A 23 GLU HBx 1.0 1.8 4.70 62 54 A 6 ALA H A 23 GLU HGy 1.0 1.8 5.30 63 55 A 6 ALA H A 23 GLU HGx 1.0 1.8 5.30 64 56 A 6 ALA H A 23 GLU H 1.0 1.8 5.15 65 57 A 7 LEU HA A 7 LEU HD1% 1.0 1.8 3.40 66 58 A 7 LEU HA A 7 LEU HD2% 1.0 1.8 4.82 67 59 A 7 LEU HA A 8 ASP H 1.0 1.8 3.41 68 60 A 22 ARG HA A 7 LEU HA 1.0 1.8 3.50 69 61 A 7 LEU HA A 22 ARG HDx 1.0 1.8 5.25 70 61 A 7 LEU HA A 22 ARG HDy 1.0 1.8 5.25 71 62 A 23 GLU H A 7 LEU HA 1.0 1.8 4.58 72 63 A 7 LEU HD1% A 7 LEU HBy 1.0 1.8 3.28 73 63 A 7 LEU HD1% A 7 LEU HBx 1.0 1.8 3.28 74 64 A 8 ASP H A 7 LEU HBy 1.0 1.8 4.39 75 64 A 8 ASP H A 7 LEU HBx 1.0 1.8 4.39 76 65 A 22 ARG HA A 7 LEU HBy 1.0 1.8 5.28 77 65 A 22 ARG HA A 7 LEU HBx 1.0 1.8 5.28 78 66 A 7 LEU HBx A 22 ARG HBx 1.0 1.8 5.57 79 66 A 7 LEU HBy A 22 ARG HBx 1.0 1.8 5.57 80 66 A 22 ARG HBy A 7 LEU HBy 1.0 1.8 5.57 81 66 A 7 LEU HBx A 22 ARG HBy 1.0 1.8 5.57 82 67 A 7 LEU HBy A 22 ARG HDx 1.0 1.8 5.24 83 67 A 7 LEU HBx A 22 ARG HDx 1.0 1.8 5.24 84 67 A 22 ARG HDy A 7 LEU HBy 1.0 1.8 5.24 85 67 A 22 ARG HDy A 7 LEU HBx 1.0 1.8 5.24 86 68 A 7 LEU HD2% A 7 LEU HBy 1.0 1.8 3.49 87 69 A 7 LEU HD2% A 7 LEU HBx 1.0 1.8 3.49 88 70 A 7 LEU HD1% A 8 ASP HA 1.0 1.8 5.07 89 71 A 7 LEU HD1% A 8 ASP H 1.0 1.8 3.74 90 72 A 7 LEU HD1% A 20 ILE HD1% 1.0 1.8 5.60 91 73 A 7 LEU HD1% A 20 ILE HG2% 1.0 1.8 4.20 92 74 A 7 LEU HD1% A 21 LYS H 1.0 1.8 5.40 93 75 A 22 ARG HA A 7 LEU HD1% 1.0 1.8 4.30 94 76 A 7 LEU HD1% A 22 ARG HBx 1.0 1.8 4.83 95 76 A 7 LEU HD1% A 22 ARG HBy 1.0 1.8 4.83 96 77 A 7 LEU HD1% A 22 ARG HDx 1.0 1.8 3.74 97 77 A 7 LEU HD1% A 22 ARG HDy 1.0 1.8 3.74 98 78 A 7 LEU HD1% A 22 ARG HE 1.0 1.8 4.75 99 79 A 7 LEU HD1% A 22 ARG HGx 1.0 1.8 5.16 100 79 A 7 LEU HD1% A 22 ARG HGy 1.0 1.8 5.16 101 80 A 23 GLU H A 7 LEU HD1% 1.0 1.8 6.00 102 81 A 7 LEU HD2% A 22 ARG HDx 1.0 1.8 5.00 103 81 A 7 LEU HD2% A 22 ARG HDy 1.0 1.8 5.00 104 82 A 7 LEU H A 7 LEU HBy 1.0 1.8 4.06 105 83 A 7 LEU H A 7 LEU HBx 1.0 1.8 4.06 106 84 A 7 LEU H A 7 LEU HD1% 1.0 1.8 5.19 107 85 A 7 LEU H A 7 LEU HD2% 1.0 1.8 5.42 108 86 A 8 ASP HA A 9 PHE H 1.0 1.8 3.60 109 87 A 9 PHE H A 8 ASP HBy 1.0 1.8 4.60 110 87 A 9 PHE H A 8 ASP HBx 1.0 1.8 4.60 111 88 A 20 ILE HG2% A 8 ASP HBy 1.0 1.8 5.87 112 88 A 20 ILE HG2% A 8 ASP HBx 1.0 1.8 5.87 113 89 A 8 ASP HBx A 21 LYS HBx 1.0 1.8 4.00 114 89 A 8 ASP HBy A 21 LYS HBx 1.0 1.8 4.00 115 89 A 21 LYS HBy A 8 ASP HBy 1.0 1.8 4.00 116 89 A 8 ASP HBx A 21 LYS HBy 1.0 1.8 4.00 117 90 A 8 ASP HBx A 21 LYS HDx 1.0 1.8 5.20 118 90 A 8 ASP HBy A 21 LYS HDx 1.0 1.8 5.20 119 90 A 21 LYS HDy A 8 ASP HBy 1.0 1.8 5.20 120 90 A 8 ASP HBx A 21 LYS HDy 1.0 1.8 5.20 121 91 A 8 ASP HBx A 21 LYS HGx 1.0 1.8 5.57 122 91 A 8 ASP HBy A 21 LYS HGx 1.0 1.8 5.57 123 91 A 21 LYS HGy A 8 ASP HBy 1.0 1.8 5.57 124 91 A 8 ASP HBx A 21 LYS HGy 1.0 1.8 5.57 125 92 A 21 LYS H A 8 ASP HBy 1.0 1.8 4.11 126 92 A 21 LYS H A 8 ASP HBx 1.0 1.8 4.11 127 93 A 8 ASP H A 8 ASP HBy 1.0 1.8 4.14 128 94 A 8 ASP H A 8 ASP HBx 1.0 1.8 4.14 129 95 A 8 ASP H A 9 PHE H 1.0 1.8 5.01 130 96 A 8 ASP H A 21 LYS HBx 1.0 1.8 4.52 131 96 A 8 ASP H A 21 LYS HBy 1.0 1.8 4.52 132 97 A 8 ASP H A 21 LYS H 1.0 1.8 4.39 133 98 A 22 ARG HA A 8 ASP H 1.0 1.8 4.20 134 99 A 9 PHE HA A 9 PHE HD% 1.0 1.8 5.01 135 100 A 9 PHE HA A 10 SER H 1.0 1.8 3.60 136 101 A 9 PHE HA A 20 ILE HA 1.0 1.8 4.22 137 102 A 9 PHE HA A 20 ILE HG1x 1.0 1.8 5.04 138 102 A 9 PHE HA A 20 ILE HG1y 1.0 1.8 5.04 139 103 A 20 ILE HG2% A 9 PHE HA 1.0 1.8 4.76 140 104 A 21 LYS H A 9 PHE HA 1.0 1.8 4.54 141 105 A 20 ILE HG2% A 9 PHE HBy 1.0 1.8 5.04 142 105 A 20 ILE HG2% A 9 PHE HBx 1.0 1.8 5.04 143 106 A 10 SER H A 9 PHE HBy 1.0 1.8 5.32 144 107 A 10 SER H A 9 PHE HBx 1.0 1.8 5.32 145 108 A 9 PHE HD% A 10 SER H 1.0 1.8 4.96 146 109 A 9 PHE HD% A 20 ILE HG1x 1.0 1.8 6.00 147 109 A 9 PHE HD% A 20 ILE HG1y 1.0 1.8 6.00 148 110 A 20 ILE HG2% A 9 PHE HD% 1.0 1.8 4.80 149 111 A 9 PHE HD% A 143 ILE HD1% 1.0 1.8 6.00 150 112 A 9 PHE HE% A 11 VAL HG2% 1.0 1.8 4.73 151 113 A 9 PHE HE% A 143 ILE HG2% 1.0 1.8 5.60 152 114 A 9 PHE H A 9 PHE HBy 1.0 1.8 3.95 153 115 A 9 PHE H A 9 PHE HBx 1.0 1.8 3.95 154 116 A 9 PHE H A 9 PHE HD% 1.0 1.8 5.22 155 117 A 9 PHE H A 10 SER H 1.0 1.8 4.99 156 118 A 10 SER HA A 11 VAL H 1.0 1.8 3.88 157 119 A 11 VAL H A 10 SER HBy 1.0 1.8 5.90 158 120 A 11 VAL H A 10 SER HBx 1.0 1.8 5.90 159 121 A 10 SER H A 10 SER HBy 1.0 1.8 3.88 160 122 A 10 SER H A 10 SER HBx 1.0 1.8 3.88 161 123 A 10 SER H A 20 ILE HA 1.0 1.8 4.07 162 124 A 20 ILE HG2% A 10 SER H 1.0 1.8 5.17 163 125 A 21 LYS H A 10 SER H 1.0 1.8 5.19 164 126 A 11 VAL HA A 11 VAL HG1% 1.0 1.8 3.70 165 127 A 11 VAL HG2% A 11 VAL HA 1.0 1.8 4.05 166 128 A 11 VAL HA A 12 ASN H 1.0 1.8 3.60 167 129 A 11 VAL HA A 18 ILE HA 1.0 1.8 4.18 168 130 A 11 VAL HA A 18 ILE HG2% 1.0 1.8 5.14 169 131 A 11 VAL HA A 19 THR H 1.0 1.8 4.73 170 132 A 12 ASN H A 11 VAL HB 1.0 1.8 4.83 171 133 A 11 VAL HG1% A 12 ASN H 1.0 1.8 3.58 172 134 A 11 VAL HG1% A 13 LYS HA 1.0 1.8 4.80 173 135 A 11 VAL HG1% A 13 LYS HGx 1.0 1.8 3.71 174 135 A 11 VAL HG1% A 13 LYS HGy 1.0 1.8 3.71 175 136 A 11 VAL HG1% A 18 ILE HA 1.0 1.8 4.44 176 137 A 11 VAL HG1% A 18 ILE HG1y 1.0 1.8 4.17 177 137 A 11 VAL HG1% A 18 ILE HG1x 1.0 1.8 4.17 178 138 A 11 VAL HG1% A 19 THR H 1.0 1.8 5.14 179 139 A 11 VAL HG1% A 139 LEU HD2% 1.0 1.8 3.60 180 140 A 11 VAL HG1% A 140 GLU HA 1.0 1.8 5.49 181 141 A 11 VAL HG2% A 12 ASN H 1.0 1.8 4.49 182 142 A 11 VAL HG2% A 18 ILE HA 1.0 1.8 4.82 183 143 A 11 VAL HG2% A 18 ILE HG1y 1.0 1.8 5.17 184 143 A 11 VAL HG2% A 18 ILE HG1x 1.0 1.8 5.17 185 144 A 11 VAL HG2% A 18 ILE HG2% 1.0 1.8 4.50 186 145 A 11 VAL HG2% A 19 THR H 1.0 1.8 5.85 187 146 A 11 VAL HG2% A 139 LEU HD2% 1.0 1.8 4.35 188 147 A 11 VAL H A 11 VAL HG1% 1.0 1.8 4.95 189 148 A 11 VAL HG2% A 11 VAL H 1.0 1.8 4.38 190 149 A 12 ASN HBy A 15 ASN HBx 1.0 1.8 5.03 191 149 A 12 ASN HBx A 15 ASN HBx 1.0 1.8 5.03 192 149 A 15 ASN HBy A 12 ASN HBx 1.0 1.8 5.03 193 149 A 12 ASN HBy A 15 ASN HBy 1.0 1.8 5.03 194 150 A 17 THR H A 12 ASN HBx 1.0 1.8 4.68 195 150 A 12 ASN HBy A 17 THR H 1.0 1.8 4.68 196 151 A 12 ASN HBy A 15 ASN H 1.0 1.8 5.03 197 152 A 15 ASN H A 12 ASN HBx 1.0 1.8 5.03 198 153 A 12 ASN H A 12 ASN HBy 1.0 1.8 4.26 199 154 A 12 ASN H A 12 ASN HBx 1.0 1.8 4.26 200 155 A 12 ASN H A 17 THR H 1.0 1.8 4.48 201 156 A 12 ASN H A 18 ILE HA 1.0 1.8 4.39 202 157 A 12 ASN H A 18 ILE HG1y 1.0 1.8 5.27 203 157 A 12 ASN H A 18 ILE HG1x 1.0 1.8 5.27 204 158 A 12 ASN H A 139 LEU HD1% 1.0 1.8 5.74 205 159 A 12 ASN H A 139 LEU HD2% 1.0 1.8 6.05 206 160 A 13 LYS HA A 13 LYS HGx 1.0 1.8 3.66 207 160 A 13 LYS HA A 13 LYS HGy 1.0 1.8 3.66 208 161 A 13 LYS HA A 15 ASN H 1.0 1.8 5.07 209 162 A 13 LYS HA A 16 LYS HA 1.0 1.8 4.42 210 163 A 13 LYS HA A 16 LYS H 1.0 1.8 4.26 211 164 A 13 LYS HA A 17 THR H 1.0 1.8 5.02 212 165 A 13 LYS HA A 136 VAL HG1% 1.0 1.8 6.00 213 166 A 13 LYS HA A 136 VAL HG2% 1.0 1.8 6.00 214 167 A 13 LYS HA A 139 LEU HD2% 1.0 1.8 4.55 215 168 A 13 LYS HBx A 13 LYS HDx 1.0 1.8 2.83 216 168 A 13 LYS HDy A 13 LYS HBx 1.0 1.8 2.83 217 168 A 13 LYS HBy A 13 LYS HDy 1.0 1.8 2.83 218 168 A 13 LYS HBy A 13 LYS HDx 1.0 1.8 2.83 219 169 A 14 GLU H A 13 LYS HBx 1.0 1.8 3.75 220 169 A 13 LYS HBy A 14 GLU H 1.0 1.8 3.75 221 170 A 136 VAL HG2% A 13 LYS HBx 1.0 1.8 4.70 222 170 A 136 VAL HG2% A 13 LYS HBy 1.0 1.8 4.70 223 171 A 136 VAL HG1% A 13 LYS HDx 1.0 1.8 4.30 224 171 A 136 VAL HG1% A 13 LYS HDy 1.0 1.8 4.30 225 172 A 139 LEU HD2% A 13 LYS HDx 1.0 1.8 5.40 226 172 A 139 LEU HD2% A 13 LYS HDy 1.0 1.8 5.40 227 173 A 13 LYS HDy A 140 GLU HGx 1.0 1.8 5.60 228 173 A 13 LYS HDx A 140 GLU HGx 1.0 1.8 5.60 229 173 A 140 GLU HGy A 13 LYS HDx 1.0 1.8 5.60 230 173 A 13 LYS HDy A 140 GLU HGy 1.0 1.8 5.60 231 174 A 139 LEU HD2% A 13 LYS HGx 1.0 1.8 4.07 232 174 A 13 LYS HGy A 139 LEU HD2% 1.0 1.8 4.07 233 175 A 13 LYS H A 13 LYS HBx 1.0 1.8 3.83 234 175 A 13 LYS HBy A 13 LYS H 1.0 1.8 3.83 235 176 A 14 GLU H A 13 LYS H 1.0 1.8 4.80 236 177 A 14 GLU HA A 14 GLU HGx 1.0 1.8 3.76 237 177 A 14 GLU HA A 14 GLU HGy 1.0 1.8 3.76 238 178 A 15 ASN H A 14 GLU HBx 1.0 1.8 3.54 239 178 A 15 ASN H A 14 GLU HBy 1.0 1.8 3.54 240 179 A 14 GLU HGy A 14 GLU HBy 1.0 1.8 2.90 241 179 A 14 GLU HBy A 14 GLU HGx 1.0 1.8 2.90 242 180 A 14 GLU HGy A 14 GLU HBx 1.0 1.8 2.90 243 180 A 14 GLU HBx A 14 GLU HGx 1.0 1.8 2.90 244 181 A 15 ASN H A 14 GLU HGx 1.0 1.8 4.75 245 181 A 15 ASN H A 14 GLU HGy 1.0 1.8 4.75 246 182 A 14 GLU H A 14 GLU HBx 1.0 1.8 3.21 247 182 A 14 GLU H A 14 GLU HBy 1.0 1.8 3.21 248 183 A 14 GLU H A 14 GLU HGx 1.0 1.8 4.15 249 183 A 14 GLU H A 14 GLU HGy 1.0 1.8 4.15 250 184 A 15 ASN H A 14 GLU H 1.0 1.8 3.80 251 185 A 16 LYS H A 14 GLU H 1.0 1.8 4.54 252 186 A 16 LYS H A 15 ASN HBx 1.0 1.8 4.30 253 186 A 15 ASN HBy A 16 LYS H 1.0 1.8 4.30 254 187 A 17 THR HG2% A 15 ASN HBx 1.0 1.8 3.93 255 187 A 15 ASN HBy A 17 THR HG2% 1.0 1.8 3.93 256 188 A 15 ASN H A 15 ASN HBx 1.0 1.8 3.38 257 188 A 15 ASN HBy A 15 ASN H 1.0 1.8 3.38 258 189 A 15 ASN H A 16 LYS HA 1.0 1.8 5.07 259 190 A 15 ASN H A 16 LYS H 1.0 1.8 3.60 260 191 A 17 THR H A 15 ASN H 1.0 1.8 4.86 261 192 A 16 LYS HA A 16 LYS HDx 1.0 1.8 5.09 262 192 A 16 LYS HA A 16 LYS HDy 1.0 1.8 5.09 263 193 A 16 LYS HA A 16 LYS HGy 1.0 1.8 4.33 264 194 A 16 LYS HA A 16 LYS HGx 1.0 1.8 4.33 265 195 A 17 THR H A 16 LYS HA 1.0 1.8 3.81 266 196 A 139 LEU HD1% A 16 LYS HA 1.0 1.8 4.37 267 197 A 16 LYS HBy A 16 LYS HDx 1.0 1.8 2.93 268 197 A 16 LYS HDy A 16 LYS HBx 1.0 1.8 2.93 269 197 A 16 LYS HDy A 16 LYS HBy 1.0 1.8 2.93 270 197 A 16 LYS HBx A 16 LYS HDx 1.0 1.8 2.93 271 198 A 16 LYS HBx A 16 LYS HEx 1.0 1.8 4.93 272 198 A 16 LYS HBy A 16 LYS HEx 1.0 1.8 4.93 273 198 A 16 LYS HEy A 16 LYS HBx 1.0 1.8 4.93 274 198 A 16 LYS HBy A 16 LYS HEy 1.0 1.8 4.93 275 199 A 136 VAL HG2% A 16 LYS HDx 1.0 1.8 4.64 276 199 A 136 VAL HG2% A 16 LYS HDy 1.0 1.8 4.64 277 200 A 136 VAL HG2% A 16 LYS HEx 1.0 1.8 4.98 278 200 A 136 VAL HG2% A 16 LYS HEy 1.0 1.8 4.98 279 201 A 16 LYS HGy A 16 LYS HEx 1.0 1.8 3.86 280 201 A 16 LYS HGy A 16 LYS HEy 1.0 1.8 3.86 281 202 A 16 LYS HGx A 16 LYS HEx 1.0 1.8 3.86 282 202 A 16 LYS HGx A 16 LYS HEy 1.0 1.8 3.86 283 203 A 17 THR H A 16 LYS H 1.0 1.8 3.77 284 204 A 139 LEU HD1% A 16 LYS H 1.0 1.8 6.00 285 205 A 17 THR HG2% A 17 THR HA 1.0 1.8 3.56 286 206 A 17 THR HA A 18 ILE H 1.0 1.8 3.70 287 207 A 17 THR HA A 132 SER HA 1.0 1.8 4.08 288 208 A 17 THR HA A 132 SER HBx 1.0 1.8 4.76 289 208 A 17 THR HA A 132 SER HBy 1.0 1.8 4.76 290 209 A 17 THR HA A 133 TYR HD% 1.0 1.8 6.00 291 210 A 17 THR HA A 133 TYR H 1.0 1.8 4.85 292 211 A 18 ILE H A 17 THR HB 1.0 1.8 4.26 293 212 A 132 SER HA A 17 THR HB 1.0 1.8 5.08 294 213 A 17 THR HG2% A 18 ILE H 1.0 1.8 4.21 295 214 A 17 THR HG2% A 132 SER HA 1.0 1.8 3.92 296 215 A 17 THR HG2% A 132 SER HBx 1.0 1.8 3.80 297 215 A 17 THR HG2% A 132 SER HBy 1.0 1.8 3.80 298 216 A 17 THR HG2% A 132 SER H 1.0 1.8 5.85 299 217 A 17 THR HG2% A 133 TYR H 1.0 1.8 5.42 300 218 A 17 THR H A 17 THR HG2% 1.0 1.8 4.26 301 219 A 17 THR H A 139 LEU HD1% 1.0 1.8 4.80 302 220 A 139 LEU HD2% A 17 THR H 1.0 1.8 6.00 303 221 A 18 ILE HA A 19 THR H 1.0 1.8 3.61 304 222 A 18 ILE HB A 131 ILE H 1.0 1.8 4.42 305 223 A 18 ILE HB A 133 TYR HE% 1.0 1.8 5.19 306 224 A 18 ILE HD1% A 131 ILE HB 1.0 1.8 4.65 307 225 A 18 ILE HD1% A 131 ILE HG2% 1.0 1.8 4.80 308 226 A 133 TYR HD% A 18 ILE HD1% 1.0 1.8 4.21 309 227 A 133 TYR HE% A 18 ILE HD1% 1.0 1.8 4.16 310 228 A 18 ILE HD1% A 139 LEU HG 1.0 1.8 3.99 311 229 A 18 ILE HD1% A 143 ILE HG1y 1.0 1.8 4.23 312 229 A 18 ILE HD1% A 143 ILE HG1x 1.0 1.8 4.23 313 230 A 19 THR H A 18 ILE HG1y 1.0 1.8 5.48 314 230 A 19 THR H A 18 ILE HG1x 1.0 1.8 5.48 315 231 A 133 TYR HE% A 18 ILE HG1y 1.0 1.8 5.58 316 231 A 18 ILE HG1x A 133 TYR HE% 1.0 1.8 5.58 317 232 A 139 LEU HD2% A 18 ILE HG1y 1.0 1.8 5.43 318 232 A 18 ILE HG1x A 139 LEU HD2% 1.0 1.8 5.43 319 233 A 18 ILE HG1x A 143 ILE HG1y 1.0 1.8 5.00 320 233 A 18 ILE HG1y A 143 ILE HG1y 1.0 1.8 5.00 321 233 A 143 ILE HG1x A 18 ILE HG1y 1.0 1.8 5.00 322 233 A 18 ILE HG1x A 143 ILE HG1x 1.0 1.8 5.00 323 234 A 139 LEU HD1% A 18 ILE HG1y 1.0 1.8 5.07 324 235 A 18 ILE HG1x A 139 LEU HD1% 1.0 1.8 5.07 325 236 A 18 ILE HG2% A 18 ILE HD1% 1.0 1.8 3.58 326 237 A 18 ILE HG2% A 18 ILE HG1y 1.0 1.8 4.09 327 238 A 18 ILE HG2% A 18 ILE HG1x 1.0 1.8 4.09 328 239 A 18 ILE HG2% A 19 THR H 1.0 1.8 3.96 329 240 A 18 ILE HG2% A 20 ILE HG1x 1.0 1.8 3.86 330 240 A 20 ILE HG1y A 18 ILE HG2% 1.0 1.8 3.86 331 241 A 18 ILE HG2% A 131 ILE HD1% 1.0 1.8 4.80 332 242 A 18 ILE HG2% A 131 ILE H 1.0 1.8 5.14 333 243 A 143 ILE HD1% A 18 ILE HG2% 1.0 1.8 3.69 334 244 A 18 ILE H A 18 ILE HD1% 1.0 1.8 5.01 335 245 A 18 ILE H A 18 ILE HG1y 1.0 1.8 5.01 336 245 A 18 ILE HG1x A 18 ILE H 1.0 1.8 5.01 337 246 A 18 ILE H A 131 ILE HG2% 1.0 1.8 5.78 338 247 A 18 ILE H A 132 SER HA 1.0 1.8 4.69 339 248 A 19 THR HA A 19 THR HG2% 1.0 1.8 3.60 340 249 A 19 THR HA A 20 ILE H 1.0 1.8 3.50 341 250 A 19 THR HA A 130 HIS HA 1.0 1.8 3.60 342 251 A 131 ILE H A 19 THR HA 1.0 1.8 4.52 343 252 A 20 ILE H A 19 THR HB 1.0 1.8 5.27 344 253 A 19 THR HG2% A 20 ILE H 1.0 1.8 4.60 345 254 A 19 THR HG2% A 21 LYS HEx 1.0 1.8 4.80 346 254 A 19 THR HG2% A 21 LYS HEy 1.0 1.8 4.80 347 255 A 19 THR HG2% A 21 LYS HGx 1.0 1.8 5.07 348 255 A 21 LYS HGy A 19 THR HG2% 1.0 1.8 5.07 349 256 A 19 THR HG2% A 130 HIS HA 1.0 1.8 4.81 350 257 A 19 THR H A 19 THR HB 1.0 1.8 3.97 351 258 A 19 THR H A 19 THR HG2% 1.0 1.8 4.48 352 259 A 21 LYS H A 20 ILE HA 1.0 1.8 3.60 353 260 A 21 LYS H A 20 ILE HB 1.0 1.8 5.03 354 261 A 20 ILE HB A 129 TYR HBy 1.0 1.8 4.29 355 261 A 20 ILE HB A 129 TYR HBx 1.0 1.8 4.29 356 262 A 20 ILE HB A 129 TYR HD% 1.0 1.8 4.81 357 263 A 20 ILE HD1% A 129 TYR HBy 1.0 1.8 4.69 358 263 A 20 ILE HD1% A 129 TYR HBx 1.0 1.8 4.69 359 264 A 20 ILE HD1% A 129 TYR HD% 1.0 1.8 5.40 360 265 A 20 ILE HD1% A 131 ILE HD1% 1.0 1.8 4.65 361 266 A 20 ILE HD1% A 147 PHE HD% 1.0 1.8 4.59 362 267 A 20 ILE HD1% A 20 ILE HG2% 1.0 1.8 3.26 363 268 A 20 ILE HG2% A 20 ILE HG1x 1.0 1.8 3.23 364 268 A 20 ILE HG2% A 20 ILE HG1y 1.0 1.8 3.23 365 269 A 20 ILE HG2% A 21 LYS H 1.0 1.8 3.75 366 270 A 20 ILE HG2% A 129 TYR HBy 1.0 1.8 5.87 367 270 A 20 ILE HG2% A 129 TYR HBx 1.0 1.8 5.87 368 271 A 20 ILE HG2% A 129 TYR HD% 1.0 1.8 3.79 369 272 A 20 ILE HG2% A 129 TYR HE% 1.0 1.8 4.40 370 273 A 20 ILE HG2% A 147 PHE HD% 1.0 1.8 5.40 371 274 A 20 ILE HD1% A 20 ILE H 1.0 1.8 4.85 372 275 A 20 ILE H A 20 ILE HG1x 1.0 1.8 4.42 373 275 A 20 ILE HG1y A 20 ILE H 1.0 1.8 4.42 374 276 A 20 ILE HG2% A 20 ILE H 1.0 1.8 4.86 375 277 A 20 ILE H A 129 TYR HBy 1.0 1.8 4.61 376 277 A 20 ILE H A 129 TYR HBx 1.0 1.8 4.61 377 278 A 20 ILE H A 129 TYR H 1.0 1.8 4.69 378 279 A 20 ILE H A 130 HIS HA 1.0 1.8 4.29 379 280 A 21 LYS HA A 22 ARG H 1.0 1.8 3.41 380 281 A 21 LYS HA A 128 GLN HA 1.0 1.8 3.60 381 282 A 21 LYS HA A 128 GLN HGx 1.0 1.8 5.32 382 282 A 21 LYS HA A 128 GLN HGy 1.0 1.8 5.32 383 283 A 21 LYS HA A 128 GLN H 1.0 1.8 5.97 384 284 A 129 TYR H A 21 LYS HA 1.0 1.8 4.38 385 285 A 21 LYS HBy A 21 LYS HEx 1.0 1.8 3.95 386 285 A 21 LYS HBx A 21 LYS HEx 1.0 1.8 3.95 387 285 A 21 LYS HEy A 21 LYS HBx 1.0 1.8 3.95 388 285 A 21 LYS HBy A 21 LYS HEy 1.0 1.8 3.95 389 286 A 22 ARG H A 21 LYS HBx 1.0 1.8 4.30 390 286 A 21 LYS HBy A 22 ARG H 1.0 1.8 4.30 391 287 A 21 LYS HDx A 128 GLN HBx 1.0 1.8 5.70 392 287 A 21 LYS HDy A 128 GLN HBx 1.0 1.8 5.70 393 287 A 128 GLN HBy A 21 LYS HDx 1.0 1.8 5.70 394 287 A 21 LYS HDy A 128 GLN HBy 1.0 1.8 5.70 395 288 A 21 LYS HDy A 128 GLN HE22 1.0 1.8 4.44 396 288 A 128 GLN HE22 A 21 LYS HDx 1.0 1.8 4.44 397 288 A 21 LYS HDy A 128 GLN HE21 1.0 1.8 4.44 398 288 A 128 GLN HE21 A 21 LYS HDx 1.0 1.8 4.44 399 289 A 128 GLN HE21 A 21 LYS HEx 1.0 1.8 5.31 400 289 A 21 LYS HEy A 128 GLN HE21 1.0 1.8 5.31 401 290 A 128 GLN HE22 A 21 LYS HEx 1.0 1.8 5.31 402 290 A 21 LYS HEy A 128 GLN HE22 1.0 1.8 5.31 403 291 A 21 LYS HEx A 21 LYS HGx 1.0 1.8 3.64 404 291 A 21 LYS HEy A 21 LYS HGx 1.0 1.8 3.64 405 291 A 21 LYS HGy A 21 LYS HEx 1.0 1.8 3.64 406 291 A 21 LYS HGy A 21 LYS HEy 1.0 1.8 3.64 407 292 A 22 ARG H A 21 LYS HGx 1.0 1.8 4.97 408 292 A 21 LYS HGy A 22 ARG H 1.0 1.8 4.97 409 293 A 128 GLN HA A 21 LYS HGx 1.0 1.8 5.33 410 293 A 21 LYS HGy A 128 GLN HA 1.0 1.8 5.33 411 294 A 21 LYS HGy A 128 GLN HBx 1.0 1.8 3.55 412 294 A 128 GLN HBy A 21 LYS HGx 1.0 1.8 3.55 413 294 A 21 LYS HGy A 128 GLN HBy 1.0 1.8 3.55 414 294 A 21 LYS HGx A 128 GLN HBx 1.0 1.8 3.55 415 295 A 21 LYS HGy A 128 GLN HE22 1.0 1.8 4.65 416 295 A 128 GLN HE21 A 21 LYS HGx 1.0 1.8 4.65 417 295 A 21 LYS HGy A 128 GLN HE21 1.0 1.8 4.65 418 295 A 128 GLN HE22 A 21 LYS HGx 1.0 1.8 4.65 419 296 A 21 LYS HGy A 128 GLN HGx 1.0 1.8 5.00 420 296 A 128 GLN HGy A 21 LYS HGx 1.0 1.8 5.00 421 296 A 21 LYS HGy A 128 GLN HGy 1.0 1.8 5.00 422 296 A 21 LYS HGx A 128 GLN HGx 1.0 1.8 5.00 423 297 A 21 LYS H A 21 LYS HBx 1.0 1.8 3.85 424 297 A 21 LYS H A 21 LYS HBy 1.0 1.8 3.85 425 298 A 21 LYS H A 21 LYS HGx 1.0 1.8 4.55 426 298 A 21 LYS H A 21 LYS HGy 1.0 1.8 4.55 427 299 A 22 ARG HA A 22 ARG HDx 1.0 1.8 4.22 428 299 A 22 ARG HA A 22 ARG HDy 1.0 1.8 4.22 429 300 A 22 ARG HA A 23 GLU H 1.0 1.8 3.52 430 301 A 127 VAL HB A 22 ARG HBx 1.0 1.8 5.52 431 301 A 22 ARG HBy A 127 VAL HB 1.0 1.8 5.52 432 302 A 127 VAL H A 22 ARG HBx 1.0 1.8 4.86 433 302 A 22 ARG HBy A 127 VAL H 1.0 1.8 4.86 434 303 A 23 GLU H A 22 ARG HGx 1.0 1.8 4.69 435 303 A 23 GLU H A 22 ARG HGy 1.0 1.8 4.69 436 304 A 22 ARG H A 22 ARG HBx 1.0 1.8 3.72 437 304 A 22 ARG HBy A 22 ARG H 1.0 1.8 3.72 438 305 A 22 ARG H A 127 VAL HB 1.0 1.8 4.84 439 306 A 22 ARG H A 127 VAL HG2% 1.0 1.8 5.64 440 307 A 22 ARG H A 127 VAL H 1.0 1.8 4.36 441 308 A 22 ARG H A 128 GLN HA 1.0 1.8 4.35 442 309 A 23 GLU HGy A 23 GLU HA 1.0 1.8 4.58 443 310 A 23 GLU HA A 23 GLU HGx 1.0 1.8 4.58 444 311 A 24 PHE H A 23 GLU HA 1.0 1.8 3.41 445 312 A 23 GLU HA A 124 ILE HG2% 1.0 1.8 4.76 446 313 A 23 GLU HA A 126 GLU HA 1.0 1.8 4.18 447 314 A 23 GLU HA A 126 GLU HGy 1.0 1.8 5.00 448 315 A 23 GLU HA A 126 GLU HGx 1.0 1.8 5.00 449 316 A 127 VAL H A 23 GLU HA 1.0 1.8 4.44 450 317 A 124 ILE HG2% A 23 GLU HBx 1.0 1.8 4.69 451 317 A 23 GLU HBy A 124 ILE HG2% 1.0 1.8 4.69 452 318 A 23 GLU HBy A 24 PHE H 1.0 1.8 5.06 453 319 A 24 PHE H A 23 GLU HBx 1.0 1.8 5.06 454 320 A 23 GLU HGy A 124 ILE HG2% 1.0 1.8 5.05 455 321 A 23 GLU HGy A 126 GLU HA 1.0 1.8 5.78 456 322 A 24 PHE H A 23 GLU HGx 1.0 1.8 5.59 457 323 A 124 ILE HG2% A 23 GLU HGx 1.0 1.8 5.05 458 324 A 126 GLU HA A 23 GLU HGx 1.0 1.8 5.78 459 325 A 23 GLU HBy A 23 GLU H 1.0 1.8 4.29 460 326 A 23 GLU H A 23 GLU HBx 1.0 1.8 4.29 461 327 A 24 PHE HA A 24 PHE HD% 1.0 1.8 4.37 462 328 A 24 PHE HA A 25 ALA H 1.0 1.8 3.52 463 329 A 125 THR HG2% A 24 PHE HBy 1.0 1.8 6.05 464 329 A 24 PHE HBx A 125 THR HG2% 1.0 1.8 6.05 465 330 A 125 THR H A 24 PHE HBy 1.0 1.8 5.33 466 330 A 24 PHE HBx A 125 THR H 1.0 1.8 5.33 467 331 A 127 VAL HG2% A 24 PHE HBy 1.0 1.8 5.29 468 331 A 127 VAL HG2% A 24 PHE HBx 1.0 1.8 5.29 469 332 A 25 ALA H A 24 PHE HBy 1.0 1.8 4.97 470 333 A 31 VAL HG2% A 24 PHE HBy 1.0 1.8 4.75 471 334 A 162 LEU HD1% A 24 PHE HBy 1.0 1.8 4.59 472 335 A 25 ALA H A 24 PHE HBx 1.0 1.8 4.97 473 336 A 24 PHE HBx A 31 VAL HG1% 1.0 1.8 5.87 474 337 A 24 PHE HBx A 31 VAL HG2% 1.0 1.8 4.75 475 338 A 24 PHE HBx A 162 LEU HD1% 1.0 1.8 6.00 476 339 A 24 PHE HD% A 25 ALA H 1.0 1.8 4.89 477 340 A 24 PHE HD% A 31 VAL HG1% 1.0 1.8 5.40 478 341 A 24 PHE HD% A 31 VAL HG2% 1.0 1.8 5.40 479 342 A 24 PHE HD% A 127 VAL HB 1.0 1.8 5.04 480 343 A 24 PHE HD% A 127 VAL HG2% 1.0 1.8 3.83 481 344 A 24 PHE HD% A 162 LEU HD1% 1.0 1.8 5.00 482 345 A 24 PHE HE% A 155 MET HA 1.0 1.8 4.95 483 346 A 24 PHE HE% A 158 LEU HD2% 1.0 1.8 4.17 484 347 A 24 PHE HD% A 24 PHE H 1.0 1.8 4.54 485 348 A 24 PHE H A 124 ILE HG2% 1.0 1.8 4.00 486 349 A 24 PHE H A 125 THR HB 1.0 1.8 5.19 487 350 A 24 PHE H A 125 THR H 1.0 1.8 4.27 488 351 A 24 PHE H A 126 GLU HA 1.0 1.8 4.33 489 352 A 24 PHE H A 127 VAL H 1.0 1.8 4.94 490 353 A 25 ALA HA A 26 ALA H 1.0 1.8 3.60 491 354 A 25 ALA HA A 124 ILE HD1% 1.0 1.8 4.83 492 355 A 25 ALA HA A 124 ILE HG1y 1.0 1.8 4.63 493 355 A 25 ALA HA A 124 ILE HG1x 1.0 1.8 4.63 494 356 A 124 ILE HG2% A 25 ALA HA 1.0 1.8 4.63 495 357 A 125 THR H A 25 ALA HA 1.0 1.8 3.95 496 358 A 25 ALA HB% A 26 ALA H 1.0 1.8 4.36 497 359 A 25 ALA HB% A 25 ALA H 1.0 1.8 3.53 498 360 A 25 ALA H A 26 ALA H 1.0 1.8 4.79 499 361 A 26 ALA HA A 27 VAL HG1% 1.0 1.8 4.47 500 362 A 26 ALA HA A 27 VAL HG2% 1.0 1.8 4.40 501 363 A 26 ALA HA A 27 VAL H 1.0 1.8 3.60 502 364 A 26 ALA HA A 30 ILE HD1% 1.0 1.8 4.77 503 365 A 31 VAL HG2% A 26 ALA HA 1.0 1.8 4.98 504 366 A 27 VAL H A 26 ALA HB% 1.0 1.8 3.40 505 367 A 26 ALA HB% A 30 ILE HB 1.0 1.8 3.56 506 368 A 30 ILE HD1% A 26 ALA HB% 1.0 1.8 3.71 507 369 A 26 ALA HB% A 30 ILE HG2% 1.0 1.8 3.48 508 370 A 26 ALA HB% A 30 ILE H 1.0 1.8 5.24 509 371 A 26 ALA HB% A 31 VAL HA 1.0 1.8 5.22 510 372 A 31 VAL HG2% A 26 ALA HB% 1.0 1.8 3.60 511 373 A 26 ALA HB% A 31 VAL H 1.0 1.8 4.18 512 374 A 125 THR HG2% A 26 ALA HB% 1.0 1.8 5.29 513 374 A 26 ALA HB% A 125 THR HG1 1.0 1.8 5.29 514 375 A 125 THR H A 26 ALA HB% 1.0 1.8 4.92 515 376 A 162 LEU HD1% A 26 ALA HB% 1.0 1.8 4.50 516 377 A 26 ALA HB% A 162 LEU HD2% 1.0 1.8 4.10 517 378 A 26 ALA H A 26 ALA HB% 1.0 1.8 3.40 518 379 A 26 ALA H A 27 VAL H 1.0 1.8 5.09 519 380 A 31 VAL HG2% A 26 ALA H 1.0 1.8 4.85 520 381 A 26 ALA H A 124 ILE HA 1.0 1.8 3.41 521 382 A 26 ALA H A 124 ILE HG1y 1.0 1.8 6.00 522 382 A 26 ALA H A 124 ILE HG1x 1.0 1.8 6.00 523 383 A 124 ILE HG2% A 26 ALA H 1.0 1.8 4.13 524 384 A 125 THR HB A 26 ALA H 1.0 1.8 4.91 525 385 A 125 THR HG2% A 26 ALA H 1.0 1.8 4.83 526 385 A 26 ALA H A 125 THR HG1 1.0 1.8 4.83 527 386 A 125 THR H A 26 ALA H 1.0 1.8 3.89 528 387 A 27 VAL HG1% A 27 VAL HA 1.0 1.8 3.40 529 388 A 27 VAL HG2% A 27 VAL HA 1.0 1.8 4.03 530 389 A 27 VAL HA A 28 ARG H 1.0 1.8 3.61 531 390 A 125 THR HG2% A 27 VAL HA 1.0 1.8 4.62 532 390 A 125 THR HG1 A 27 VAL HA 1.0 1.8 4.62 533 391 A 28 ARG H A 27 VAL HB 1.0 1.8 3.83 534 392 A 27 VAL HB A 29 ALA H 1.0 1.8 4.43 535 393 A 27 VAL HG1% A 28 ARG H 1.0 1.8 4.14 536 394 A 27 VAL HG1% A 29 ALA H 1.0 1.8 4.68 537 395 A 27 VAL HG1% A 123 GLU HA 1.0 1.8 3.67 538 396 A 27 VAL HG1% A 123 GLU HBx 1.0 1.8 5.69 539 396 A 27 VAL HG1% A 123 GLU HBy 1.0 1.8 5.69 540 397 A 27 VAL HG2% A 28 ARG H 1.0 1.8 4.40 541 398 A 27 VAL HG2% A 29 ALA HB% 1.0 1.8 3.60 542 399 A 27 VAL HG2% A 30 ILE HA 1.0 1.8 4.68 543 400 A 27 VAL HG2% A 30 ILE HB 1.0 1.8 3.70 544 401 A 27 VAL HG2% A 30 ILE HG1y 1.0 1.8 3.71 545 401 A 27 VAL HG2% A 30 ILE HG1x 1.0 1.8 3.71 546 402 A 27 VAL HG2% A 30 ILE H 1.0 1.8 4.44 547 403 A 27 VAL HG2% A 31 VAL H 1.0 1.8 3.88 548 404 A 125 THR HG2% A 27 VAL HG2% 1.0 1.8 5.26 549 404 A 27 VAL HG2% A 125 THR HG1 1.0 1.8 5.26 550 405 A 27 VAL HG1% A 27 VAL H 1.0 1.8 3.26 551 406 A 27 VAL HG2% A 27 VAL H 1.0 1.8 3.35 552 407 A 27 VAL H A 28 ARG H 1.0 1.8 5.04 553 408 A 27 VAL H A 30 ILE HB 1.0 1.8 4.81 554 409 A 27 VAL H A 30 ILE HD1% 1.0 1.8 4.20 555 410 A 28 ARG HA A 31 VAL HB 1.0 1.8 4.40 556 411 A 31 VAL HG2% A 28 ARG HA 1.0 1.8 4.72 557 412 A 31 VAL H A 28 ARG HA 1.0 1.8 4.57 558 413 A 125 THR HG2% A 28 ARG HA 1.0 1.8 5.06 559 413 A 125 THR HG1 A 28 ARG HA 1.0 1.8 5.06 560 414 A 125 THR HG2% A 28 ARG HA 1.0 1.8 3.85 561 415 A 28 ARG HBx A 28 ARG HDx 1.0 1.8 3.72 562 415 A 28 ARG HBy A 28 ARG HDx 1.0 1.8 3.72 563 415 A 28 ARG HDy A 28 ARG HBx 1.0 1.8 3.72 564 415 A 28 ARG HBy A 28 ARG HDy 1.0 1.8 3.72 565 416 A 29 ALA H A 28 ARG HBx 1.0 1.8 4.28 566 416 A 29 ALA H A 28 ARG HBy 1.0 1.8 4.28 567 417 A 89 ILE HB A 28 ARG HBx 1.0 1.8 5.35 568 417 A 28 ARG HBy A 89 ILE HB 1.0 1.8 5.35 569 418 A 89 ILE HD1% A 28 ARG HBx 1.0 1.8 4.58 570 418 A 28 ARG HBy A 89 ILE HD1% 1.0 1.8 4.58 571 419 A 89 ILE HG2% A 28 ARG HBx 1.0 1.8 5.41 572 419 A 28 ARG HBy A 89 ILE HG2% 1.0 1.8 5.41 573 420 A 125 THR HG2% A 28 ARG HBx 1.0 1.8 4.80 574 420 A 125 THR HG2% A 28 ARG HBy 1.0 1.8 4.80 575 421 A 29 ALA H A 28 ARG HDx 1.0 1.8 5.06 576 421 A 29 ALA H A 28 ARG HDy 1.0 1.8 5.06 577 422 A 89 ILE HB A 28 ARG HDx 1.0 1.8 6.05 578 422 A 28 ARG HDy A 89 ILE HB 1.0 1.8 6.05 579 423 A 89 ILE HD1% A 28 ARG HDx 1.0 1.8 5.24 580 423 A 28 ARG HDy A 89 ILE HD1% 1.0 1.8 5.24 581 424 A 125 THR HG2% A 28 ARG HDx 1.0 1.8 6.05 582 424 A 125 THR HG2% A 28 ARG HDy 1.0 1.8 6.05 583 425 A 29 ALA H A 28 ARG HGx 1.0 1.8 4.48 584 425 A 29 ALA H A 28 ARG HGy 1.0 1.8 4.48 585 426 A 89 ILE HD1% A 28 ARG HGx 1.0 1.8 4.60 586 426 A 89 ILE HD1% A 28 ARG HGy 1.0 1.8 4.60 587 427 A 28 ARG H A 28 ARG HGx 1.0 1.8 4.74 588 427 A 28 ARG H A 28 ARG HGy 1.0 1.8 4.74 589 428 A 28 ARG H A 29 ALA H 1.0 1.8 4.55 590 429 A 125 THR HG1 A 28 ARG H 1.0 1.8 4.73 591 429 A 125 THR HG2% A 28 ARG H 1.0 1.8 4.73 592 430 A 125 THR HG2% A 28 ARG H 1.0 1.8 5.57 593 431 A 29 ALA HA A 32 TRP HBy 1.0 1.8 5.14 594 432 A 29 ALA HA A 32 TRP HBx 1.0 1.8 5.14 595 433 A 29 ALA HA A 32 TRP H 1.0 1.8 4.64 596 434 A 29 ALA HA A 33 GLU H 1.0 1.8 5.47 597 435 A 89 ILE HD1% A 29 ALA HA 1.0 1.8 5.60 598 436 A 89 ILE HG2% A 29 ALA HA 1.0 1.8 5.05 599 437 A 29 ALA HB% A 30 ILE HA 1.0 1.8 4.79 600 438 A 30 ILE H A 29 ALA HB% 1.0 1.8 3.73 601 439 A 29 ALA HB% A 89 ILE HD1% 1.0 1.8 6.00 602 440 A 29 ALA HB% A 89 ILE HG2% 1.0 1.8 6.00 603 441 A 29 ALA H A 29 ALA HB% 1.0 1.8 3.07 604 442 A 30 ILE H A 29 ALA H 1.0 1.8 3.98 605 443 A 30 ILE HD1% A 30 ILE HA 1.0 1.8 4.33 606 444 A 30 ILE HA A 30 ILE HG1y 1.0 1.8 4.09 607 445 A 30 ILE HA A 30 ILE HG1x 1.0 1.8 4.09 608 446 A 30 ILE HG2% A 30 ILE HA 1.0 1.8 3.51 609 447 A 30 ILE HA A 33 GLU HBy 1.0 1.8 5.29 610 448 A 30 ILE HA A 33 GLU HBx 1.0 1.8 5.29 611 449 A 30 ILE HA A 33 GLU HGy 1.0 1.8 5.72 612 450 A 30 ILE HA A 33 GLU HGx 1.0 1.8 5.72 613 451 A 30 ILE HA A 33 GLU H 1.0 1.8 4.18 614 452 A 30 ILE HA A 34 ALA H 1.0 1.8 5.26 615 453 A 30 ILE HB A 31 VAL H 1.0 1.8 3.69 616 454 A 30 ILE HD1% A 31 VAL H 1.0 1.8 5.31 617 455 A 30 ILE HG2% A 30 ILE HG1y 1.0 1.8 4.55 618 456 A 30 ILE HG2% A 30 ILE HG1x 1.0 1.8 4.55 619 457 A 30 ILE HG2% A 31 VAL H 1.0 1.8 3.77 620 458 A 30 ILE HG2% A 33 GLU HBx 1.0 1.8 4.96 621 458 A 30 ILE HG2% A 33 GLU HBy 1.0 1.8 4.96 622 459 A 30 ILE HG2% A 33 GLU HGx 1.0 1.8 5.13 623 459 A 30 ILE HG2% A 33 GLU HGy 1.0 1.8 5.13 624 460 A 30 ILE HG2% A 33 GLU H 1.0 1.8 5.24 625 461 A 30 ILE HG2% A 34 ALA HB% 1.0 1.8 3.74 626 462 A 30 ILE HG2% A 34 ALA H 1.0 1.8 4.97 627 463 A 30 ILE HG2% A 162 LEU HA 1.0 1.8 6.00 628 464 A 30 ILE HG2% A 162 LEU HD2% 1.0 1.8 3.60 629 465 A 30 ILE HG2% A 162 LEU HG 1.0 1.8 6.00 630 466 A 30 ILE HB A 30 ILE H 1.0 1.8 3.44 631 467 A 30 ILE HD1% A 30 ILE H 1.0 1.8 3.96 632 468 A 30 ILE H A 30 ILE HG1y 1.0 1.8 4.10 633 469 A 30 ILE H A 30 ILE HG1x 1.0 1.8 4.10 634 470 A 30 ILE HG2% A 30 ILE H 1.0 1.8 4.20 635 471 A 30 ILE H A 31 VAL H 1.0 1.8 3.43 636 472 A 30 ILE H A 32 TRP H 1.0 1.8 4.82 637 473 A 31 VAL HG1% A 31 VAL HA 1.0 1.8 3.63 638 474 A 31 VAL HG2% A 31 VAL HA 1.0 1.8 3.45 639 475 A 31 VAL HA A 34 ALA HB% 1.0 1.8 3.86 640 476 A 31 VAL HA A 34 ALA H 1.0 1.8 4.21 641 477 A 31 VAL HA A 162 LEU HD2% 1.0 1.8 6.00 642 478 A 31 VAL HB A 32 TRP H 1.0 1.8 4.06 643 479 A 125 THR HG2% A 31 VAL HB 1.0 1.8 3.81 644 480 A 31 VAL HG1% A 32 TRP H 1.0 1.8 4.37 645 481 A 31 VAL HG1% A 118 PHE HD% 1.0 1.8 4.36 646 482 A 31 VAL HG1% A 125 THR HB 1.0 1.8 4.67 647 483 A 125 THR HG2% A 31 VAL HG1% 1.0 1.8 3.45 648 484 A 31 VAL HG1% A 127 VAL HG1% 1.0 1.8 4.96 649 485 A 127 VAL HG2% A 31 VAL HG1% 1.0 1.8 3.60 650 486 A 31 VAL HG1% A 158 LEU HD2% 1.0 1.8 6.00 651 487 A 31 VAL HG2% A 32 TRP H 1.0 1.8 4.59 652 488 A 31 VAL HG2% A 34 ALA HB% 1.0 1.8 4.95 653 489 A 31 VAL HG2% A 125 THR HB 1.0 1.8 3.60 654 490 A 125 THR HG2% A 31 VAL HG2% 1.0 1.8 3.95 655 490 A 31 VAL HG2% A 125 THR HG1 1.0 1.8 3.95 656 491 A 125 THR HG2% A 31 VAL HG2% 1.0 1.8 3.60 657 492 A 125 THR H A 31 VAL HG2% 1.0 1.8 5.74 658 493 A 31 VAL HG2% A 158 LEU HD2% 1.0 1.8 5.62 659 494 A 31 VAL HG2% A 162 LEU HD2% 1.0 1.8 5.60 660 495 A 31 VAL H A 31 VAL HB 1.0 1.8 3.56 661 496 A 31 VAL HG2% A 31 VAL H 1.0 1.8 3.31 662 497 A 31 VAL H A 32 TRP H 1.0 1.8 3.83 663 498 A 125 THR HG2% A 31 VAL H 1.0 1.8 5.25 664 499 A 32 TRP HA A 35 PHE HBx 1.0 1.8 4.07 665 499 A 32 TRP HA A 35 PHE HBy 1.0 1.8 4.07 666 500 A 32 TRP HA A 35 PHE H 1.0 1.8 4.75 667 501 A 32 TRP HBy A 33 GLU H 1.0 1.8 4.49 668 502 A 89 ILE HG2% A 32 TRP HBy 1.0 1.8 5.52 669 503 A 32 TRP HBx A 33 GLU H 1.0 1.8 4.49 670 504 A 89 ILE HB A 32 TRP HBx 1.0 1.8 6.00 671 505 A 89 ILE HG2% A 32 TRP HBx 1.0 1.8 5.52 672 506 A 89 ILE HG2% A 32 TRP HD1 1.0 1.8 5.00 673 507 A 32 TRP HE1 A 36 THR HG2% 1.0 1.8 4.49 674 508 A 89 ILE HG2% A 32 TRP HE1 1.0 1.8 5.60 675 509 A 32 TRP HBy A 32 TRP H 1.0 1.8 3.87 676 510 A 32 TRP HBx A 32 TRP H 1.0 1.8 3.87 677 511 A 32 TRP H A 33 GLU H 1.0 1.8 3.90 678 512 A 32 TRP HZ2 A 86 ILE HG2% 1.0 1.8 6.00 679 513 A 33 GLU HGy A 33 GLU HA 1.0 1.8 4.36 680 514 A 33 GLU HA A 33 GLU HGx 1.0 1.8 4.36 681 515 A 35 PHE H A 33 GLU HA 1.0 1.8 5.17 682 516 A 33 GLU HA A 36 THR HB 1.0 1.8 5.69 683 517 A 36 THR HG2% A 33 GLU HA 1.0 1.8 4.53 684 518 A 33 GLU HA A 36 THR H 1.0 1.8 4.31 685 519 A 34 ALA H A 33 GLU HBy 1.0 1.8 4.81 686 520 A 33 GLU HBy A 40 ILE HD1% 1.0 1.8 5.82 687 521 A 34 ALA H A 33 GLU HBx 1.0 1.8 4.81 688 522 A 40 ILE HD1% A 33 GLU HBx 1.0 1.8 5.82 689 523 A 33 GLU HGy A 37 ARG HDx 1.0 1.8 5.00 690 523 A 33 GLU HGx A 37 ARG HDx 1.0 1.8 5.00 691 524 A 40 ILE HD1% A 33 GLU HGx 1.0 1.8 4.43 692 524 A 33 GLU HGy A 40 ILE HD1% 1.0 1.8 4.43 693 525 A 40 ILE HG2% A 33 GLU HGx 1.0 1.8 5.20 694 525 A 33 GLU HGy A 40 ILE HG2% 1.0 1.8 5.20 695 526 A 34 ALA H A 33 GLU HGy 1.0 1.8 5.06 696 527 A 33 GLU HGy A 37 ARG HDy 1.0 1.8 4.92 697 527 A 33 GLU HGy A 37 ARG HDx 1.0 1.8 4.92 698 528 A 34 ALA H A 33 GLU HGx 1.0 1.8 5.06 699 529 A 33 GLU H A 33 GLU HBy 1.0 1.8 3.83 700 530 A 33 GLU H A 33 GLU HBx 1.0 1.8 3.83 701 531 A 33 GLU H A 33 GLU HGy 1.0 1.8 5.02 702 532 A 33 GLU H A 33 GLU HGx 1.0 1.8 5.02 703 533 A 33 GLU H A 34 ALA H 1.0 1.8 3.52 704 534 A 34 ALA HA A 40 ILE HB 1.0 1.8 4.15 705 535 A 40 ILE HD1% A 34 ALA HA 1.0 1.8 4.35 706 536 A 40 ILE HG2% A 34 ALA HA 1.0 1.8 3.60 707 537 A 34 ALA HA A 44 TRP HE1 1.0 1.8 5.67 708 538 A 34 ALA HB% A 35 PHE H 1.0 1.8 4.03 709 539 A 34 ALA HB% A 40 ILE HB 1.0 1.8 4.44 710 540 A 34 ALA HB% A 40 ILE HG2% 1.0 1.8 3.60 711 541 A 34 ALA HB% A 41 LEU HD2% 1.0 1.8 5.40 712 542 A 34 ALA HB% A 44 TRP HE1 1.0 1.8 3.99 713 543 A 34 ALA HB% A 44 TRP HZ2 1.0 1.8 5.43 714 544 A 34 ALA HB% A 158 LEU HD1% 1.0 1.8 4.45 715 545 A 158 LEU HD2% A 34 ALA HB% 1.0 1.8 6.00 716 546 A 34 ALA HB% A 161 LEU HD2% 1.0 1.8 4.80 717 547 A 162 LEU HD2% A 34 ALA HB% 1.0 1.8 4.60 718 548 A 34 ALA H A 34 ALA HB% 1.0 1.8 3.09 719 549 A 34 ALA H A 35 PHE H 1.0 1.8 3.49 720 550 A 34 ALA H A 40 ILE HD1% 1.0 1.8 4.65 721 551 A 34 ALA H A 40 ILE HG2% 1.0 1.8 4.65 722 552 A 35 PHE HA A 41 LEU HD1% 1.0 1.8 5.36 723 553 A 41 LEU HD2% A 35 PHE HA 1.0 1.8 4.64 724 554 A 35 PHE HA A 41 LEU HG 1.0 1.8 4.96 725 555 A 44 TRP HZ2 A 35 PHE HA 1.0 1.8 5.00 726 556 A 36 THR H A 35 PHE HBx 1.0 1.8 4.43 727 556 A 35 PHE HBy A 36 THR H 1.0 1.8 4.43 728 557 A 116 MET HE% A 35 PHE HBx 1.0 1.8 5.87 729 557 A 35 PHE HBy A 116 MET HE% 1.0 1.8 5.87 730 558 A 116 MET HE% A 35 PHE HE% 1.0 1.8 4.13 731 559 A 35 PHE H A 35 PHE HBx 1.0 1.8 3.52 732 559 A 35 PHE HBy A 35 PHE H 1.0 1.8 3.52 733 560 A 35 PHE H A 36 THR H 1.0 1.8 3.67 734 561 A 35 PHE H A 40 ILE HG2% 1.0 1.8 5.06 735 562 A 36 THR HG2% A 36 THR HA 1.0 1.8 3.83 736 563 A 41 LEU HD1% A 36 THR HA 1.0 1.8 5.00 737 564 A 36 THR HA A 57 MET HE% 1.0 1.8 5.69 738 565 A 36 THR HB A 37 ARG H 1.0 1.8 4.99 739 566 A 36 THR HG2% A 37 ARG H 1.0 1.8 4.80 740 567 A 36 THR HG2% A 36 THR H 1.0 1.8 3.88 741 568 A 36 THR H A 37 ARG H 1.0 1.8 3.60 742 569 A 37 ARG HA A 37 ARG HDx 1.0 1.8 4.22 743 569 A 37 ARG HDy A 37 ARG HA 1.0 1.8 4.22 744 570 A 37 ARG HA A 38 ALA HB% 1.0 1.8 4.35 745 571 A 37 ARG HA A 38 ALA H 1.0 1.8 3.60 746 572 A 37 ARG HA A 39 GLU H 1.0 1.8 4.64 747 573 A 57 MET HE% A 37 ARG HA 1.0 1.8 5.13 748 574 A 37 ARG HDy A 37 ARG HBx 1.0 1.8 4.38 749 574 A 37 ARG HDy A 37 ARG HBy 1.0 1.8 4.38 750 575 A 37 ARG HBx A 37 ARG HDx 1.0 1.8 4.38 751 575 A 37 ARG HBy A 37 ARG HDx 1.0 1.8 4.38 752 576 A 39 GLU HGy A 37 ARG HBy 1.0 1.8 5.40 753 576 A 37 ARG HBx A 39 GLU HGy 1.0 1.8 5.40 754 577 A 37 ARG HBy A 39 GLU HGx 1.0 1.8 5.40 755 577 A 37 ARG HBx A 39 GLU HGx 1.0 1.8 5.40 756 578 A 39 GLU H A 37 ARG HBy 1.0 1.8 4.30 757 578 A 39 GLU H A 37 ARG HBx 1.0 1.8 4.30 758 579 A 37 ARG HDy A 37 ARG HBy 1.0 1.8 3.73 759 579 A 37 ARG HBy A 37 ARG HDx 1.0 1.8 3.73 760 580 A 38 ALA H A 37 ARG HBy 1.0 1.8 5.33 761 581 A 39 GLU HGy A 37 ARG HBy 1.0 1.8 4.89 762 581 A 37 ARG HBy A 39 GLU HGx 1.0 1.8 4.89 763 582 A 40 ILE HD1% A 37 ARG HBy 1.0 1.8 4.82 764 583 A 40 ILE H A 37 ARG HBy 1.0 1.8 4.46 765 584 A 37 ARG HDy A 37 ARG HBx 1.0 1.8 3.73 766 584 A 37 ARG HBx A 37 ARG HDx 1.0 1.8 3.73 767 585 A 38 ALA H A 37 ARG HBx 1.0 1.8 5.33 768 586 A 40 ILE HD1% A 37 ARG HBx 1.0 1.8 4.82 769 587 A 37 ARG HBx A 40 ILE H 1.0 1.8 4.46 770 588 A 38 ALA H A 37 ARG HGx 1.0 1.8 5.37 771 588 A 38 ALA H A 37 ARG HGy 1.0 1.8 5.37 772 589 A 37 ARG H A 37 ARG HBy 1.0 1.8 3.84 773 590 A 37 ARG H A 37 ARG HBx 1.0 1.8 3.84 774 591 A 37 ARG H A 37 ARG HDx 1.0 1.8 4.75 775 591 A 37 ARG HDy A 37 ARG H 1.0 1.8 4.75 776 592 A 37 ARG H A 37 ARG HGx 1.0 1.8 4.64 777 592 A 37 ARG H A 37 ARG HGy 1.0 1.8 4.64 778 593 A 40 ILE HB A 37 ARG H 1.0 1.8 4.65 779 594 A 40 ILE HD1% A 37 ARG H 1.0 1.8 4.96 780 595 A 41 LEU HD1% A 37 ARG H 1.0 1.8 4.53 781 596 A 41 LEU HG A 37 ARG H 1.0 1.8 5.00 782 597 A 37 ARG H A 41 LEU H 1.0 1.8 5.27 783 598 A 38 ALA HA A 41 LEU HBy 1.0 1.8 4.49 784 599 A 38 ALA HA A 41 LEU HBx 1.0 1.8 4.49 785 600 A 41 LEU HD1% A 38 ALA HA 1.0 1.8 3.65 786 601 A 41 LEU HD2% A 38 ALA HA 1.0 1.8 5.28 787 602 A 41 LEU HG A 38 ALA HA 1.0 1.8 5.40 788 603 A 41 LEU H A 38 ALA HA 1.0 1.8 4.54 789 604 A 57 MET HE% A 38 ALA HA 1.0 1.8 4.92 790 605 A 38 ALA HB% A 39 GLU H 1.0 1.8 3.40 791 606 A 41 LEU HD1% A 38 ALA HB% 1.0 1.8 4.46 792 607 A 38 ALA HB% A 42 ASP H 1.0 1.8 5.09 793 608 A 38 ALA HB% A 54 THR HG2% 1.0 1.8 4.68 794 609 A 38 ALA HB% A 57 MET HA 1.0 1.8 5.79 795 610 A 38 ALA HB% A 57 MET HBy 1.0 1.8 4.43 796 610 A 38 ALA HB% A 57 MET HBx 1.0 1.8 4.43 797 611 A 57 MET HE% A 38 ALA HB% 1.0 1.8 4.07 798 612 A 38 ALA HB% A 57 MET HGx 1.0 1.8 4.30 799 612 A 38 ALA HB% A 57 MET HGy 1.0 1.8 4.30 800 613 A 38 ALA HB% A 65 TRP HD1 1.0 1.8 4.80 801 614 A 38 ALA HB% A 65 TRP HE1 1.0 1.8 4.64 802 615 A 38 ALA HB% A 38 ALA H 1.0 1.8 3.40 803 616 A 38 ALA H A 39 GLU HGx 1.0 1.8 4.63 804 616 A 38 ALA H A 39 GLU HGy 1.0 1.8 4.63 805 617 A 38 ALA H A 39 GLU H 1.0 1.8 3.84 806 618 A 41 LEU HD1% A 38 ALA H 1.0 1.8 5.01 807 619 A 57 MET HE% A 38 ALA H 1.0 1.8 4.16 808 620 A 39 GLU HA A 39 GLU HGx 1.0 1.8 3.97 809 620 A 39 GLU HGy A 39 GLU HA 1.0 1.8 3.97 810 621 A 39 GLU HA A 42 ASP HBy 1.0 1.8 5.44 811 622 A 39 GLU HA A 42 ASP HBx 1.0 1.8 5.44 812 623 A 42 ASP H A 39 GLU HA 1.0 1.8 4.68 813 624 A 40 ILE H A 39 GLU HBx 1.0 1.8 4.30 814 624 A 40 ILE H A 39 GLU HBy 1.0 1.8 4.30 815 625 A 39 GLU HGy A 40 ILE H 1.0 1.8 4.90 816 626 A 40 ILE H A 39 GLU HGx 1.0 1.8 4.95 817 627 A 39 GLU H A 39 GLU HBx 1.0 1.8 3.27 818 627 A 39 GLU H A 39 GLU HBy 1.0 1.8 3.27 819 628 A 39 GLU H A 40 ILE H 1.0 1.8 3.75 820 629 A 40 ILE HD1% A 40 ILE HA 1.0 1.8 4.33 821 630 A 40 ILE HA A 40 ILE HG1y 1.0 1.8 4.44 822 631 A 40 ILE HA A 40 ILE HG1x 1.0 1.8 4.44 823 632 A 40 ILE HG2% A 40 ILE HA 1.0 1.8 3.13 824 633 A 40 ILE HA A 43 GLN HBy 1.0 1.8 4.74 825 633 A 40 ILE HA A 43 GLN HBx 1.0 1.8 4.74 826 634 A 40 ILE HA A 43 GLN HGx 1.0 1.8 4.80 827 634 A 40 ILE HA A 43 GLN HGy 1.0 1.8 4.80 828 635 A 40 ILE HA A 43 GLN H 1.0 1.8 4.53 829 636 A 40 ILE HA A 161 LEU HD1% 1.0 1.8 5.40 830 637 A 40 ILE HB A 41 LEU H 1.0 1.8 3.94 831 638 A 40 ILE HG1y A 43 GLN HE21 1.0 1.8 5.40 832 638 A 40 ILE HG1x A 43 GLN HE22 1.0 1.8 5.40 833 638 A 40 ILE HG1x A 43 GLN HE21 1.0 1.8 5.40 834 638 A 43 GLN HE22 A 40 ILE HG1y 1.0 1.8 5.40 835 639 A 40 ILE HD1% A 40 ILE HG2% 1.0 1.8 3.20 836 640 A 40 ILE HG2% A 40 ILE HG1y 1.0 1.8 3.63 837 641 A 40 ILE HG2% A 40 ILE HG1x 1.0 1.8 3.63 838 642 A 40 ILE HG2% A 41 LEU HA 1.0 1.8 4.55 839 643 A 40 ILE HG2% A 41 LEU H 1.0 1.8 4.57 840 644 A 40 ILE HG2% A 43 GLN HBy 1.0 1.8 5.28 841 645 A 40 ILE HG2% A 43 GLN HBx 1.0 1.8 5.28 842 646 A 40 ILE HG2% A 44 TRP HD1 1.0 1.8 4.80 843 647 A 40 ILE HG2% A 44 TRP HE1 1.0 1.8 3.89 844 648 A 40 ILE HG2% A 158 LEU HD1% 1.0 1.8 4.80 845 649 A 40 ILE HG2% A 161 LEU HD2% 1.0 1.8 3.86 846 650 A 40 ILE HB A 40 ILE H 1.0 1.8 3.64 847 651 A 40 ILE HD1% A 40 ILE H 1.0 1.8 4.32 848 652 A 40 ILE H A 40 ILE HG1y 1.0 1.8 3.86 849 653 A 40 ILE H A 40 ILE HG1x 1.0 1.8 3.86 850 654 A 40 ILE HG2% A 40 ILE H 1.0 1.8 4.35 851 655 A 40 ILE H A 41 LEU H 1.0 1.8 3.60 852 656 A 41 LEU HD1% A 41 LEU HA 1.0 1.8 4.82 853 657 A 41 LEU HD2% A 41 LEU HA 1.0 1.8 3.63 854 658 A 43 GLN H A 41 LEU HA 1.0 1.8 4.97 855 659 A 41 LEU HA A 44 TRP HD1 1.0 1.8 4.76 856 660 A 44 TRP HE1 A 41 LEU HA 1.0 1.8 4.10 857 661 A 41 LEU HA A 44 TRP H 1.0 1.8 5.06 858 662 A 41 LEU HD1% A 41 LEU HBy 1.0 1.8 4.05 859 663 A 41 LEU HD2% A 41 LEU HBy 1.0 1.8 4.46 860 664 A 41 LEU HBy A 42 ASP H 1.0 1.8 4.31 861 665 A 41 LEU HD1% A 41 LEU HBx 1.0 1.8 4.05 862 666 A 41 LEU HD2% A 41 LEU HBx 1.0 1.8 4.46 863 667 A 41 LEU HBx A 42 ASP H 1.0 1.8 4.31 864 668 A 41 LEU HD1% A 42 ASP H 1.0 1.8 4.82 865 669 A 41 LEU HD1% A 57 MET HE% 1.0 1.8 3.85 866 670 A 44 TRP HE1 A 41 LEU HD2% 1.0 1.8 4.73 867 671 A 41 LEU HG A 42 ASP H 1.0 1.8 4.94 868 672 A 41 LEU HD1% A 41 LEU H 1.0 1.8 4.49 869 673 A 41 LEU HD2% A 41 LEU H 1.0 1.8 4.54 870 674 A 43 GLN H A 42 ASP HBy 1.0 1.8 4.30 871 674 A 43 GLN H A 42 ASP HBx 1.0 1.8 4.30 872 675 A 42 ASP H A 42 ASP HBy 1.0 1.8 3.34 873 675 A 42 ASP H A 42 ASP HBx 1.0 1.8 3.34 874 676 A 42 ASP H A 43 GLN H 1.0 1.8 3.67 875 677 A 43 GLN HA A 43 GLN HGx 1.0 1.8 3.50 876 677 A 43 GLN HGy A 43 GLN HA 1.0 1.8 3.50 877 678 A 43 GLN HBy A 43 GLN HE21 1.0 1.8 4.86 878 678 A 43 GLN HBx A 43 GLN HE21 1.0 1.8 4.86 879 678 A 43 GLN HE22 A 43 GLN HBy 1.0 1.8 4.86 880 678 A 43 GLN HBx A 43 GLN HE22 1.0 1.8 4.86 881 679 A 43 GLN HE22 A 43 GLN HBy 1.0 1.8 5.00 882 679 A 43 GLN HBx A 43 GLN HE22 1.0 1.8 5.00 883 680 A 161 LEU HD1% A 43 GLN HBy 1.0 1.8 4.41 884 680 A 43 GLN HBx A 161 LEU HD1% 1.0 1.8 4.41 885 681 A 44 TRP H A 43 GLN HBy 1.0 1.8 4.29 886 682 A 161 LEU HD2% A 43 GLN HBy 1.0 1.8 4.40 887 683 A 43 GLN HBx A 44 TRP H 1.0 1.8 4.29 888 684 A 161 LEU HD2% A 43 GLN HBx 1.0 1.8 4.40 889 685 A 161 LEU HD1% A 43 GLN HE22 1.0 1.8 4.75 890 685 A 161 LEU HD1% A 43 GLN HE21 1.0 1.8 4.75 891 686 A 43 GLN HE22 A 43 GLN HGx 1.0 1.8 3.47 892 686 A 43 GLN HGy A 43 GLN HE21 1.0 1.8 3.47 893 686 A 43 GLN HGy A 43 GLN HE22 1.0 1.8 3.47 894 686 A 43 GLN HE21 A 43 GLN HGx 1.0 1.8 3.47 895 687 A 161 LEU HD2% A 43 GLN HGx 1.0 1.8 4.69 896 687 A 161 LEU HD2% A 43 GLN HGy 1.0 1.8 4.69 897 688 A 43 GLN HGy A 161 LEU HD1% 1.0 1.8 4.99 898 689 A 161 LEU HD1% A 43 GLN HGx 1.0 1.8 4.99 899 690 A 43 GLN H A 43 GLN HGx 1.0 1.8 4.10 900 690 A 43 GLN HGy A 43 GLN H 1.0 1.8 4.10 901 691 A 43 GLN H A 44 TRP H 1.0 1.8 3.60 902 692 A 161 LEU HD2% A 43 GLN H 1.0 1.8 6.05 903 693 A 44 TRP HA A 157 ASN HBy 1.0 1.8 5.14 904 694 A 44 TRP HA A 157 ASN HBx 1.0 1.8 5.14 905 695 A 44 TRP HA A 157 ASN HD22 1.0 1.8 4.80 906 695 A 44 TRP HA A 157 ASN HD21 1.0 1.8 4.80 907 696 A 44 TRP HBy A 157 ASN HBy 1.0 1.8 5.25 908 697 A 44 TRP HBy A 157 ASN HBx 1.0 1.8 5.25 909 698 A 44 TRP HBy A 158 LEU H 1.0 1.8 5.47 910 699 A 161 LEU HD1% A 44 TRP HBy 1.0 1.8 5.48 911 700 A 44 TRP HBx A 157 ASN HBy 1.0 1.8 5.25 912 701 A 44 TRP HBx A 157 ASN HBx 1.0 1.8 5.25 913 702 A 158 LEU HD1% A 44 TRP HD1 1.0 1.8 4.68 914 703 A 161 LEU HD1% A 44 TRP HD1 1.0 1.8 5.00 915 704 A 161 LEU HD2% A 44 TRP HD1 1.0 1.8 4.18 916 705 A 44 TRP HE1 A 158 LEU HD1% 1.0 1.8 4.70 917 706 A 44 TRP HE3 A 154 ALA HB% 1.0 1.8 4.30 918 707 A 158 LEU HD2% A 44 TRP HE3 1.0 1.8 5.40 919 708 A 44 TRP H A 45 TRP H 1.0 1.8 4.80 920 709 A 44 TRP H A 157 ASN HBx 1.0 1.8 5.97 921 709 A 44 TRP H A 157 ASN HBy 1.0 1.8 5.97 922 710 A 158 LEU HD2% A 44 TRP HZ2 1.0 1.8 5.40 923 711 A 154 ALA HB% A 44 TRP HZ3 1.0 1.8 4.61 924 712 A 158 LEU HD2% A 44 TRP HZ3 1.0 1.8 5.60 925 713 A 45 TRP HA A 154 ALA HA 1.0 1.8 5.57 926 714 A 154 ALA HB% A 45 TRP HA 1.0 1.8 5.60 927 715 A 46 ALA H A 45 TRP HBx 1.0 1.8 4.23 928 715 A 45 TRP HBy A 46 ALA H 1.0 1.8 4.23 929 716 A 45 TRP H A 45 TRP HBy 1.0 1.8 4.20 930 717 A 45 TRP H A 45 TRP HBx 1.0 1.8 3.90 931 718 A 45 TRP H A 46 ALA H 1.0 1.8 4.70 932 719 A 154 ALA HB% A 45 TRP H 1.0 1.8 6.00 933 720 A 46 ALA HB% A 47 PRO HDx 1.0 1.8 4.40 934 721 A 46 ALA HB% A 47 PRO HDy 1.0 1.8 4.40 935 722 A 46 ALA H A 46 ALA HB% 1.0 1.8 3.47 936 723 A 47 PRO HA A 48 LYS H 1.0 1.8 3.65 937 724 A 47 PRO HA A 157 ASN HD22 1.0 1.8 6.00 938 725 A 48 LYS H A 47 PRO HBx 1.0 1.8 4.62 939 726 A 48 LYS H A 47 PRO HBy 1.0 1.8 4.62 940 727 A 154 ALA HB% A 47 PRO HDx 1.0 1.8 6.05 941 727 A 154 ALA HB% A 47 PRO HDy 1.0 1.8 6.05 942 728 A 48 LYS HA A 48 LYS HDx 1.0 1.8 4.93 943 728 A 48 LYS HA A 48 LYS HDy 1.0 1.8 4.93 944 729 A 48 LYS HA A 48 LYS HGy 1.0 1.8 3.92 945 729 A 48 LYS HA A 48 LYS HGx 1.0 1.8 3.92 946 730 A 48 LYS HBy A 48 LYS HEx 1.0 1.8 4.88 947 730 A 48 LYS HBx A 48 LYS HEx 1.0 1.8 4.88 948 730 A 48 LYS HEy A 48 LYS HBx 1.0 1.8 4.88 949 730 A 48 LYS HBy A 48 LYS HEy 1.0 1.8 4.88 950 731 A 48 LYS HEx A 48 LYS HGy 1.0 1.8 4.43 951 731 A 48 LYS HEy A 48 LYS HGy 1.0 1.8 4.43 952 732 A 48 LYS HGx A 48 LYS HEy 1.0 1.8 4.43 953 732 A 48 LYS HGx A 48 LYS HEx 1.0 1.8 4.43 954 733 A 48 LYS H A 48 LYS HBx 1.0 1.8 3.48 955 733 A 48 LYS H A 48 LYS HBy 1.0 1.8 3.48 956 734 A 48 LYS H A 48 LYS HGy 1.0 1.8 4.20 957 734 A 48 LYS H A 48 LYS HGx 1.0 1.8 4.20 958 735 A 50 TRP HA A 71 GLY HAx 1.0 1.8 5.17 959 735 A 50 TRP HA A 71 GLY HAy 1.0 1.8 5.17 960 736 A 70 VAL HB A 50 TRP HBx 1.0 1.8 5.49 961 736 A 50 TRP HBy A 70 VAL HB 1.0 1.8 5.49 962 737 A 70 VAL HG1% A 50 TRP HBx 1.0 1.8 5.89 963 737 A 50 TRP HBy A 70 VAL HG1% 1.0 1.8 5.89 964 738 A 50 TRP HBy A 50 TRP HE3 1.0 1.8 4.60 965 739 A 50 TRP HBy A 51 LYS H 1.0 1.8 4.23 966 740 A 50 TRP HE3 A 50 TRP HBx 1.0 1.8 4.60 967 741 A 51 LYS H A 50 TRP HBx 1.0 1.8 4.23 968 742 A 50 TRP HE1 A 72 PRO HGx 1.0 1.8 5.16 969 742 A 50 TRP HE1 A 72 PRO HGy 1.0 1.8 5.16 970 743 A 50 TRP HBy A 50 TRP H 1.0 1.8 4.22 971 744 A 50 TRP H A 50 TRP HBx 1.0 1.8 4.22 972 745 A 51 LYS HA A 51 LYS HGx 1.0 1.8 3.94 973 745 A 51 LYS HA A 51 LYS HGy 1.0 1.8 3.94 974 746 A 51 LYS HA A 52 ALA H 1.0 1.8 3.60 975 747 A 51 LYS HA A 70 VAL HG2% 1.0 1.8 6.05 976 748 A 51 LYS HA A 70 VAL H 1.0 1.8 5.40 977 749 A 70 VAL HB A 51 LYS HBy 1.0 1.8 6.00 978 749 A 70 VAL HB A 51 LYS HBx 1.0 1.8 6.00 979 750 A 51 LYS HGy A 51 LYS HBy 1.0 1.8 3.17 980 750 A 51 LYS HBy A 51 LYS HGx 1.0 1.8 3.17 981 751 A 52 ALA H A 51 LYS HBy 1.0 1.8 5.15 982 752 A 70 VAL HG1% A 51 LYS HBy 1.0 1.8 5.03 983 753 A 70 VAL HG2% A 51 LYS HBy 1.0 1.8 4.88 984 754 A 70 VAL H A 51 LYS HBy 1.0 1.8 5.12 985 755 A 51 LYS HGy A 51 LYS HBx 1.0 1.8 3.17 986 755 A 51 LYS HBx A 51 LYS HGx 1.0 1.8 3.17 987 756 A 52 ALA H A 51 LYS HBx 1.0 1.8 5.15 988 757 A 70 VAL HG1% A 51 LYS HBx 1.0 1.8 5.13 989 758 A 70 VAL HG2% A 51 LYS HBx 1.0 1.8 5.48 990 759 A 51 LYS HEy A 51 LYS HGx 1.0 1.8 3.56 991 759 A 51 LYS HGy A 51 LYS HEx 1.0 1.8 3.56 992 759 A 51 LYS HGy A 51 LYS HEy 1.0 1.8 3.56 993 759 A 51 LYS HEx A 51 LYS HGx 1.0 1.8 3.56 994 760 A 70 VAL H A 51 LYS HGx 1.0 1.8 6.05 995 760 A 51 LYS HGy A 70 VAL H 1.0 1.8 6.05 996 761 A 51 LYS H A 51 LYS HBy 1.0 1.8 3.90 997 762 A 51 LYS H A 51 LYS HBx 1.0 1.8 3.90 998 763 A 51 LYS H A 51 LYS HGx 1.0 1.8 4.76 999 763 A 51 LYS H A 51 LYS HGy 1.0 1.8 4.76 1000 764 A 70 VAL HB A 51 LYS H 1.0 1.8 4.55 1001 765 A 70 VAL HG1% A 51 LYS H 1.0 1.8 5.64 1002 766 A 51 LYS H A 70 VAL HG2% 1.0 1.8 5.31 1003 767 A 51 LYS H A 70 VAL H 1.0 1.8 4.06 1004 768 A 51 LYS H A 71 GLY HAx 1.0 1.8 5.07 1005 768 A 71 GLY HAy A 51 LYS H 1.0 1.8 5.07 1006 769 A 52 ALA HA A 53 LYS H 1.0 1.8 3.60 1007 770 A 52 ALA HA A 68 ALA H 1.0 1.8 5.73 1008 771 A 52 ALA HA A 69 MET HA 1.0 1.8 4.11 1009 772 A 52 ALA HA A 69 MET HGy 1.0 1.8 5.57 1010 773 A 52 ALA HA A 69 MET HGx 1.0 1.8 5.57 1011 774 A 70 VAL H A 52 ALA HA 1.0 1.8 4.63 1012 775 A 53 LYS H A 52 ALA HB% 1.0 1.8 3.76 1013 776 A 68 ALA H A 52 ALA HB% 1.0 1.8 5.72 1014 777 A 69 MET HA A 52 ALA HB% 1.0 1.8 4.54 1015 778 A 70 VAL H A 52 ALA HB% 1.0 1.8 6.05 1016 779 A 52 ALA H A 52 ALA HB% 1.0 1.8 3.49 1017 780 A 53 LYS HA A 53 LYS HGx 1.0 1.8 3.89 1018 780 A 53 LYS HA A 53 LYS HGy 1.0 1.8 3.89 1019 781 A 53 LYS HA A 54 THR H 1.0 1.8 3.42 1020 782 A 53 LYS HBx A 53 LYS HEx 1.0 1.8 3.86 1021 782 A 53 LYS HBy A 53 LYS HEx 1.0 1.8 3.86 1022 782 A 53 LYS HEy A 53 LYS HBx 1.0 1.8 3.86 1023 782 A 53 LYS HBy A 53 LYS HEy 1.0 1.8 3.86 1024 783 A 54 THR H A 53 LYS HBx 1.0 1.8 4.20 1025 783 A 54 THR H A 53 LYS HBy 1.0 1.8 4.20 1026 784 A 68 ALA HB% A 53 LYS HBx 1.0 1.8 4.22 1027 784 A 53 LYS HBy A 68 ALA HB% 1.0 1.8 4.22 1028 785 A 68 ALA H A 53 LYS HBx 1.0 1.8 4.57 1029 785 A 68 ALA H A 53 LYS HBy 1.0 1.8 4.57 1030 786 A 70 VAL HG2% A 53 LYS HBx 1.0 1.8 4.33 1031 786 A 70 VAL HG2% A 53 LYS HBy 1.0 1.8 4.33 1032 787 A 68 ALA HB% A 53 LYS HEx 1.0 1.8 5.00 1033 787 A 53 LYS HEy A 68 ALA HB% 1.0 1.8 5.00 1034 788 A 70 VAL HG1% A 53 LYS HEx 1.0 1.8 6.05 1035 788 A 70 VAL HG1% A 53 LYS HEy 1.0 1.8 6.05 1036 789 A 70 VAL HG2% A 53 LYS HEx 1.0 1.8 4.35 1037 789 A 70 VAL HG2% A 53 LYS HEy 1.0 1.8 4.35 1038 790 A 53 LYS HEy A 53 LYS HGx 1.0 1.8 3.60 1039 790 A 53 LYS HEx A 53 LYS HGx 1.0 1.8 3.60 1040 790 A 53 LYS HGy A 53 LYS HEx 1.0 1.8 3.60 1041 790 A 53 LYS HGy A 53 LYS HEy 1.0 1.8 3.60 1042 791 A 54 THR H A 53 LYS HGx 1.0 1.8 4.65 1043 791 A 53 LYS HGy A 54 THR H 1.0 1.8 4.65 1044 792 A 53 LYS H A 53 LYS HBx 1.0 1.8 3.54 1045 792 A 53 LYS H A 53 LYS HBy 1.0 1.8 3.54 1046 793 A 53 LYS H A 53 LYS HGx 1.0 1.8 4.72 1047 793 A 53 LYS H A 53 LYS HGy 1.0 1.8 4.72 1048 794 A 53 LYS H A 67 TYR HBx 1.0 1.8 5.84 1049 794 A 53 LYS H A 67 TYR HBy 1.0 1.8 5.84 1050 795 A 53 LYS H A 68 ALA HA 1.0 1.8 5.61 1051 796 A 53 LYS H A 68 ALA HB% 1.0 1.8 4.45 1052 797 A 53 LYS H A 68 ALA H 1.0 1.8 3.99 1053 798 A 53 LYS H A 69 MET HA 1.0 1.8 4.48 1054 799 A 70 VAL HG2% A 53 LYS H 1.0 1.8 5.29 1055 800 A 54 THR HG2% A 54 THR HA 1.0 1.8 3.98 1056 801 A 65 TRP HE1 A 54 THR HA 1.0 1.8 5.26 1057 802 A 54 THR HA A 67 TYR HA 1.0 1.8 4.35 1058 803 A 54 THR HA A 67 TYR HBx 1.0 1.8 4.41 1059 803 A 67 TYR HBy A 54 THR HA 1.0 1.8 4.41 1060 804 A 68 ALA H A 54 THR HA 1.0 1.8 4.43 1061 805 A 54 THR HG2% A 55 LYS HA 1.0 1.8 4.69 1062 806 A 54 THR HG2% A 55 LYS H 1.0 1.8 4.03 1063 807 A 54 THR HG2% A 56 SER HA 1.0 1.8 4.64 1064 808 A 54 THR HG2% A 56 SER H 1.0 1.8 3.53 1065 809 A 54 THR HG2% A 57 MET HBy 1.0 1.8 3.64 1066 809 A 54 THR HG2% A 57 MET HBx 1.0 1.8 3.64 1067 810 A 54 THR HG2% A 57 MET HGx 1.0 1.8 4.65 1068 810 A 54 THR HG2% A 57 MET HGy 1.0 1.8 4.65 1069 811 A 54 THR HG2% A 57 MET H 1.0 1.8 4.39 1070 812 A 54 THR HG2% A 65 TRP HA 1.0 1.8 5.50 1071 813 A 54 THR HG2% A 65 TRP HD1 1.0 1.8 3.78 1072 814 A 54 THR HG2% A 65 TRP HE1 1.0 1.8 5.20 1073 815 A 54 THR HG2% A 66 LEU H 1.0 1.8 4.88 1074 816 A 54 THR HG2% A 67 TYR HA 1.0 1.8 4.85 1075 817 A 54 THR HG2% A 67 TYR HBx 1.0 1.8 4.50 1076 817 A 54 THR HG2% A 67 TYR HBy 1.0 1.8 4.50 1077 818 A 54 THR HG2% A 68 ALA H 1.0 1.8 6.00 1078 819 A 54 THR H A 54 THR HB 1.0 1.8 3.70 1079 820 A 54 THR HG2% A 54 THR H 1.0 1.8 4.85 1080 821 A 55 LYS HA A 55 LYS HDx 1.0 1.8 5.03 1081 821 A 55 LYS HA A 55 LYS HDy 1.0 1.8 5.03 1082 822 A 55 LYS HA A 55 LYS HEx 1.0 1.8 5.04 1083 822 A 55 LYS HA A 55 LYS HEy 1.0 1.8 5.04 1084 823 A 55 LYS HA A 55 LYS HGy 1.0 1.8 3.65 1085 823 A 55 LYS HA A 55 LYS HGx 1.0 1.8 3.65 1086 824 A 55 LYS HA A 66 LEU HD2% 1.0 1.8 5.57 1087 825 A 55 LYS HA A 66 LEU HG 1.0 1.8 5.38 1088 826 A 55 LYS HBx A 55 LYS HDx 1.0 1.8 3.29 1089 826 A 55 LYS HBy A 55 LYS HDx 1.0 1.8 3.29 1090 826 A 55 LYS HDy A 55 LYS HBy 1.0 1.8 3.29 1091 826 A 55 LYS HDy A 55 LYS HBx 1.0 1.8 3.29 1092 827 A 55 LYS HBx A 55 LYS HEx 1.0 1.8 4.65 1093 827 A 55 LYS HBy A 55 LYS HEx 1.0 1.8 4.65 1094 827 A 55 LYS HEy A 55 LYS HBy 1.0 1.8 4.65 1095 827 A 55 LYS HEy A 55 LYS HBx 1.0 1.8 4.65 1096 828 A 56 SER H A 55 LYS HBy 1.0 1.8 3.66 1097 828 A 56 SER H A 55 LYS HBx 1.0 1.8 3.66 1098 829 A 55 LYS HBy A 66 LEU HBx 1.0 1.8 4.04 1099 829 A 55 LYS HBx A 66 LEU HBx 1.0 1.8 4.04 1100 829 A 66 LEU HBy A 55 LYS HBy 1.0 1.8 4.04 1101 829 A 55 LYS HBx A 66 LEU HBy 1.0 1.8 4.04 1102 830 A 66 LEU HD2% A 55 LYS HBy 1.0 1.8 4.04 1103 830 A 66 LEU HD2% A 55 LYS HBx 1.0 1.8 4.04 1104 831 A 78 TRP HH2 A 55 LYS HBy 1.0 1.8 5.20 1105 831 A 55 LYS HBx A 78 TRP HH2 1.0 1.8 5.20 1106 832 A 78 TRP HZ3 A 55 LYS HBy 1.0 1.8 4.25 1107 832 A 55 LYS HBx A 78 TRP HZ3 1.0 1.8 4.25 1108 833 A 66 LEU HG A 55 LYS HBy 1.0 1.8 4.26 1109 834 A 66 LEU HG A 55 LYS HBx 1.0 1.8 4.26 1110 835 A 66 LEU HD2% A 55 LYS HEx 1.0 1.8 4.25 1111 835 A 55 LYS HEy A 66 LEU HD2% 1.0 1.8 4.25 1112 836 A 78 TRP HH2 A 55 LYS HEx 1.0 1.8 5.61 1113 836 A 55 LYS HEy A 78 TRP HH2 1.0 1.8 5.61 1114 837 A 55 LYS HEy A 55 LYS HGy 1.0 1.8 3.66 1115 837 A 55 LYS HEx A 55 LYS HGy 1.0 1.8 3.66 1116 837 A 55 LYS HGx A 55 LYS HEx 1.0 1.8 3.66 1117 837 A 55 LYS HEy A 55 LYS HGx 1.0 1.8 3.66 1118 838 A 56 SER H A 55 LYS HGy 1.0 1.8 5.47 1119 838 A 56 SER H A 55 LYS HGx 1.0 1.8 5.47 1120 839 A 66 LEU HD2% A 55 LYS HGy 1.0 1.8 4.75 1121 839 A 55 LYS HGx A 66 LEU HD2% 1.0 1.8 4.75 1122 840 A 78 TRP HZ3 A 55 LYS HGy 1.0 1.8 5.35 1123 841 A 55 LYS HGx A 78 TRP HZ3 1.0 1.8 5.35 1124 842 A 55 LYS H A 56 SER H 1.0 1.8 3.53 1125 843 A 55 LYS H A 66 LEU H 1.0 1.8 5.63 1126 844 A 67 TYR HA A 55 LYS H 1.0 1.8 4.17 1127 845 A 68 ALA H A 55 LYS H 1.0 1.8 5.01 1128 846 A 56 SER HA A 57 MET H 1.0 1.8 3.42 1129 847 A 56 SER HA A 66 LEU H 1.0 1.8 5.91 1130 848 A 57 MET H A 56 SER HBx 1.0 1.8 4.26 1131 848 A 57 MET H A 56 SER HBy 1.0 1.8 4.26 1132 849 A 56 SER HBy A 66 LEU HBx 1.0 1.8 4.05 1133 849 A 56 SER HBx A 66 LEU HBx 1.0 1.8 4.05 1134 849 A 66 LEU HBy A 56 SER HBx 1.0 1.8 4.05 1135 849 A 66 LEU HBy A 56 SER HBy 1.0 1.8 4.05 1136 850 A 66 LEU HD2% A 56 SER HBx 1.0 1.8 4.60 1137 850 A 66 LEU HD2% A 56 SER HBy 1.0 1.8 4.60 1138 851 A 66 LEU HG A 56 SER HBx 1.0 1.8 5.87 1139 851 A 66 LEU HG A 56 SER HBy 1.0 1.8 5.87 1140 852 A 66 LEU H A 56 SER HBx 1.0 1.8 5.50 1141 852 A 66 LEU H A 56 SER HBy 1.0 1.8 5.50 1142 853 A 56 SER H A 57 MET HBy 1.0 1.8 5.09 1143 853 A 57 MET HBx A 56 SER H 1.0 1.8 5.09 1144 854 A 65 TRP HD1 A 56 SER H 1.0 1.8 4.82 1145 855 A 56 SER H A 66 LEU HBx 1.0 1.8 4.06 1146 855 A 56 SER H A 66 LEU HBy 1.0 1.8 4.06 1147 856 A 56 SER H A 66 LEU HG 1.0 1.8 5.83 1148 857 A 56 SER H A 66 LEU H 1.0 1.8 4.31 1149 858 A 57 MET HE% A 57 MET HA 1.0 1.8 4.74 1150 859 A 57 MET HA A 58 ASP H 1.0 1.8 3.45 1151 860 A 57 MET HA A 65 TRP HA 1.0 1.8 4.03 1152 861 A 57 MET HA A 65 TRP HD1 1.0 1.8 4.89 1153 862 A 57 MET HA A 66 LEU H 1.0 1.8 4.54 1154 863 A 58 ASP H A 57 MET HBy 1.0 1.8 4.54 1155 863 A 57 MET HBx A 58 ASP H 1.0 1.8 4.54 1156 864 A 65 TRP HA A 57 MET HBy 1.0 1.8 5.82 1157 864 A 57 MET HBx A 65 TRP HA 1.0 1.8 5.82 1158 865 A 65 TRP HD1 A 57 MET HBy 1.0 1.8 4.16 1159 865 A 57 MET HBx A 65 TRP HD1 1.0 1.8 4.16 1160 866 A 57 MET HE% A 58 ASP H 1.0 1.8 5.04 1161 867 A 57 MET HE% A 59 PHE HBx 1.0 1.8 5.10 1162 867 A 57 MET HE% A 59 PHE HBy 1.0 1.8 5.10 1163 868 A 57 MET HE% A 59 PHE HD% 1.0 1.8 4.49 1164 869 A 57 MET HE% A 65 TRP HA 1.0 1.8 5.60 1165 870 A 57 MET HE% A 65 TRP HBx 1.0 1.8 4.73 1166 870 A 57 MET HE% A 65 TRP HBy 1.0 1.8 4.73 1167 871 A 57 MET HE% A 65 TRP HD1 1.0 1.8 4.65 1168 872 A 57 MET HE% A 83 TYR HE% 1.0 1.8 4.35 1169 873 A 57 MET HE% A 57 MET HGx 1.0 1.8 3.08 1170 873 A 57 MET HE% A 57 MET HGy 1.0 1.8 3.08 1171 874 A 58 ASP H A 57 MET HGx 1.0 1.8 4.82 1172 874 A 57 MET HGy A 58 ASP H 1.0 1.8 4.82 1173 875 A 57 MET H A 57 MET HBy 1.0 1.8 4.26 1174 876 A 57 MET HBx A 57 MET H 1.0 1.8 4.26 1175 877 A 57 MET H A 65 TRP HA 1.0 1.8 5.59 1176 878 A 58 ASP HA A 59 PHE H 1.0 1.8 3.60 1177 879 A 60 LYS H A 58 ASP HBy 1.0 1.8 5.09 1178 879 A 58 ASP HBx A 60 LYS H 1.0 1.8 5.09 1179 880 A 59 PHE H A 58 ASP HBy 1.0 1.8 4.86 1180 881 A 64 THR H A 58 ASP HBy 1.0 1.8 5.00 1181 882 A 59 PHE H A 58 ASP HBx 1.0 1.8 4.86 1182 883 A 58 ASP HBx A 64 THR H 1.0 1.8 5.00 1183 884 A 58 ASP H A 58 ASP HBy 1.0 1.8 4.21 1184 885 A 58 ASP H A 58 ASP HBx 1.0 1.8 4.21 1185 886 A 58 ASP H A 59 PHE H 1.0 1.8 4.80 1186 887 A 58 ASP H A 64 THR H 1.0 1.8 4.48 1187 888 A 65 TRP HA A 58 ASP H 1.0 1.8 4.42 1188 889 A 59 PHE HD% A 59 PHE HA 1.0 1.8 4.36 1189 890 A 60 LYS H A 59 PHE HA 1.0 1.8 3.60 1190 891 A 59 PHE HA A 83 TYR HD% 1.0 1.8 6.00 1191 892 A 83 TYR HE% A 59 PHE HA 1.0 1.8 5.24 1192 893 A 59 PHE HA A 86 ILE HD1% 1.0 1.8 6.00 1193 894 A 60 LYS H A 59 PHE HBx 1.0 1.8 4.55 1194 894 A 59 PHE HBy A 60 LYS H 1.0 1.8 4.55 1195 895 A 59 PHE HD% A 60 LYS H 1.0 1.8 5.41 1196 896 A 59 PHE H A 59 PHE HBx 1.0 1.8 3.54 1197 896 A 59 PHE HBy A 59 PHE H 1.0 1.8 3.54 1198 897 A 59 PHE HD% A 59 PHE H 1.0 1.8 4.79 1199 898 A 59 PHE H A 60 LYS H 1.0 1.8 5.06 1200 899 A 60 LYS HA A 61 GLU H 1.0 1.8 3.58 1201 900 A 86 ILE HD1% A 60 LYS HA 1.0 1.8 4.38 1202 901 A 86 ILE HG2% A 60 LYS HA 1.0 1.8 5.60 1203 902 A 60 LYS HBx A 60 LYS HDx 1.0 1.8 2.95 1204 902 A 60 LYS HBy A 60 LYS HDx 1.0 1.8 2.95 1205 902 A 60 LYS HDy A 60 LYS HBy 1.0 1.8 2.95 1206 902 A 60 LYS HBx A 60 LYS HDy 1.0 1.8 2.95 1207 903 A 60 LYS HBx A 60 LYS HEx 1.0 1.8 4.81 1208 903 A 60 LYS HBy A 60 LYS HEx 1.0 1.8 4.81 1209 903 A 60 LYS HEy A 60 LYS HBy 1.0 1.8 4.81 1210 903 A 60 LYS HBx A 60 LYS HEy 1.0 1.8 4.81 1211 904 A 61 GLU H A 60 LYS HBy 1.0 1.8 4.60 1212 905 A 61 GLU H A 60 LYS HBx 1.0 1.8 4.60 1213 906 A 60 LYS HEx A 60 LYS HGy 1.0 1.8 3.30 1214 906 A 60 LYS HEy A 60 LYS HGy 1.0 1.8 3.30 1215 906 A 60 LYS HGx A 60 LYS HEx 1.0 1.8 3.30 1216 906 A 60 LYS HEy A 60 LYS HGx 1.0 1.8 3.30 1217 907 A 61 GLU H A 60 LYS HGy 1.0 1.8 4.54 1218 907 A 61 GLU H A 60 LYS HGx 1.0 1.8 4.54 1219 908 A 60 LYS HGy A 63 GLY HAy 1.0 1.8 4.17 1220 908 A 60 LYS HGx A 63 GLY HAy 1.0 1.8 4.17 1221 908 A 63 GLY HAx A 60 LYS HGy 1.0 1.8 4.17 1222 908 A 60 LYS HGx A 63 GLY HAx 1.0 1.8 4.17 1223 909 A 60 LYS HGy A 63 GLY HAy 1.0 1.8 6.00 1224 910 A 60 LYS HGx A 63 GLY HAy 1.0 1.8 6.00 1225 911 A 60 LYS HGx A 63 GLY HAx 1.0 1.8 6.00 1226 912 A 60 LYS HGx A 63 GLY H 1.0 1.8 5.00 1227 913 A 60 LYS H A 60 LYS HGy 1.0 1.8 4.30 1228 913 A 60 LYS H A 60 LYS HGx 1.0 1.8 4.30 1229 914 A 60 LYS H A 63 GLY HAy 1.0 1.8 5.00 1230 914 A 60 LYS H A 63 GLY HAx 1.0 1.8 5.00 1231 915 A 60 LYS H A 63 GLY H 1.0 1.8 4.66 1232 916 A 60 LYS H A 83 TYR HD% 1.0 1.8 5.00 1233 917 A 60 LYS H A 86 ILE HD1% 1.0 1.8 4.28 1234 918 A 61 GLU HA A 61 GLU HGx 1.0 1.8 3.86 1235 918 A 61 GLU HA A 61 GLU HGy 1.0 1.8 3.86 1236 919 A 61 GLU HA A 62 GLY HAx 1.0 1.8 4.53 1237 919 A 61 GLU HA A 62 GLY HAy 1.0 1.8 4.53 1238 920 A 61 GLU HA A 62 GLY H 1.0 1.8 3.70 1239 921 A 63 GLY H A 61 GLU HA 1.0 1.8 4.54 1240 922 A 61 GLU HA A 86 ILE HB 1.0 1.8 6.00 1241 923 A 86 ILE HD1% A 61 GLU HA 1.0 1.8 5.04 1242 924 A 62 GLY H A 61 GLU HBx 1.0 1.8 4.48 1243 924 A 62 GLY H A 61 GLU HBy 1.0 1.8 4.48 1244 925 A 86 ILE HB A 61 GLU HBx 1.0 1.8 6.00 1245 925 A 86 ILE HB A 61 GLU HBy 1.0 1.8 6.00 1246 926 A 86 ILE HD1% A 61 GLU HBx 1.0 1.8 5.47 1247 926 A 86 ILE HD1% A 61 GLU HBy 1.0 1.8 5.47 1248 927 A 86 ILE H A 61 GLU HBx 1.0 1.8 5.56 1249 927 A 61 GLU HBy A 86 ILE H 1.0 1.8 5.56 1250 928 A 62 GLY H A 61 GLU HGx 1.0 1.8 5.14 1251 928 A 61 GLU HGy A 62 GLY H 1.0 1.8 5.14 1252 929 A 85 ILE HA A 61 GLU HGx 1.0 1.8 4.66 1253 929 A 61 GLU HGy A 85 ILE HA 1.0 1.8 4.66 1254 930 A 86 ILE HB A 61 GLU HGx 1.0 1.8 5.60 1255 930 A 61 GLU HGy A 86 ILE HB 1.0 1.8 5.60 1256 931 A 86 ILE H A 61 GLU HGx 1.0 1.8 4.80 1257 931 A 61 GLU HGy A 86 ILE H 1.0 1.8 4.80 1258 932 A 86 ILE HD1% A 61 GLU HGy 1.0 1.8 5.80 1259 933 A 86 ILE HD1% A 61 GLU HGx 1.0 1.8 5.80 1260 934 A 61 GLU H A 61 GLU HBx 1.0 1.8 3.65 1261 934 A 61 GLU H A 61 GLU HBy 1.0 1.8 3.65 1262 935 A 61 GLU H A 61 GLU HGx 1.0 1.8 4.35 1263 935 A 61 GLU H A 61 GLU HGy 1.0 1.8 4.35 1264 936 A 61 GLU H A 62 GLY H 1.0 1.8 5.01 1265 937 A 86 ILE HD1% A 61 GLU H 1.0 1.8 4.89 1266 938 A 61 GLU H A 86 ILE HG1x 1.0 1.8 5.59 1267 938 A 61 GLU H A 86 ILE HG1y 1.0 1.8 5.59 1268 939 A 63 GLY H A 62 GLY H 1.0 1.8 3.82 1269 940 A 64 THR H A 63 GLY HAy 1.0 1.8 3.40 1270 940 A 64 THR H A 63 GLY HAx 1.0 1.8 3.40 1271 941 A 64 THR H A 63 GLY H 1.0 1.8 5.03 1272 942 A 63 GLY H A 83 TYR HBy 1.0 1.8 5.11 1273 943 A 63 GLY H A 83 TYR HBx 1.0 1.8 5.11 1274 944 A 63 GLY H A 83 TYR H 1.0 1.8 4.91 1275 945 A 64 THR HA A 64 THR HG2% 1.0 1.8 3.64 1276 946 A 64 THR HA A 65 TRP H 1.0 1.8 3.59 1277 947 A 64 THR HA A 82 GLU HA 1.0 1.8 4.06 1278 948 A 64 THR HA A 82 GLU HGx 1.0 1.8 5.28 1279 948 A 64 THR HA A 82 GLU HGy 1.0 1.8 5.28 1280 949 A 83 TYR H A 64 THR HA 1.0 1.8 4.28 1281 950 A 65 TRP H A 64 THR HB 1.0 1.8 4.25 1282 951 A 64 THR HB A 80 ILE HD1% 1.0 1.8 4.08 1283 952 A 64 THR HB A 80 ILE HG1y 1.0 1.8 4.55 1284 952 A 64 THR HB A 80 ILE HG1x 1.0 1.8 4.55 1285 953 A 64 THR HB A 80 ILE HG2% 1.0 1.8 6.05 1286 954 A 64 THR HG2% A 65 TRP H 1.0 1.8 4.16 1287 955 A 64 THR HG2% A 80 ILE HD1% 1.0 1.8 4.64 1288 956 A 64 THR HG2% A 80 ILE HG1y 1.0 1.8 4.30 1289 956 A 64 THR HG2% A 80 ILE HG1x 1.0 1.8 4.30 1290 957 A 64 THR HG2% A 80 ILE HG2% 1.0 1.8 5.60 1291 958 A 64 THR HG2% A 81 CYS H 1.0 1.8 6.00 1292 959 A 64 THR HG2% A 82 GLU HA 1.0 1.8 3.85 1293 960 A 64 THR HG2% A 82 GLU HGx 1.0 1.8 3.51 1294 960 A 64 THR HG2% A 82 GLU HGy 1.0 1.8 3.51 1295 961 A 83 TYR H A 64 THR HG2% 1.0 1.8 4.54 1296 962 A 64 THR H A 64 THR HB 1.0 1.8 4.21 1297 963 A 64 THR H A 64 THR HG2% 1.0 1.8 4.31 1298 964 A 65 TRP HA A 66 LEU H 1.0 1.8 3.56 1299 965 A 66 LEU H A 65 TRP HBx 1.0 1.8 4.30 1300 965 A 66 LEU H A 65 TRP HBy 1.0 1.8 4.30 1301 966 A 65 TRP HBy A 81 CYS HBy 1.0 1.8 4.16 1302 966 A 65 TRP HBx A 81 CYS HBy 1.0 1.8 4.16 1303 966 A 81 CYS HBx A 65 TRP HBx 1.0 1.8 4.16 1304 966 A 65 TRP HBy A 81 CYS HBx 1.0 1.8 4.16 1305 967 A 81 CYS H A 65 TRP HBx 1.0 1.8 5.28 1306 967 A 65 TRP HBy A 81 CYS H 1.0 1.8 5.28 1307 968 A 65 TRP HBy A 81 CYS HBy 1.0 1.8 6.05 1308 969 A 65 TRP HBy A 81 CYS HBx 1.0 1.8 6.05 1309 970 A 65 TRP HBy A 83 TYR HE% 1.0 1.8 5.79 1310 971 A 65 TRP HBx A 81 CYS HBy 1.0 1.8 6.05 1311 972 A 81 CYS HBx A 65 TRP HBx 1.0 1.8 6.05 1312 973 A 83 TYR HE% A 65 TRP HBx 1.0 1.8 5.79 1313 974 A 65 TRP HD1 A 66 LEU H 1.0 1.8 3.60 1314 975 A 65 TRP HE1 A 67 TYR HBx 1.0 1.8 4.75 1315 975 A 65 TRP HE1 A 67 TYR HBy 1.0 1.8 4.75 1316 976 A 65 TRP HE1 A 67 TYR HD% 1.0 1.8 4.83 1317 977 A 66 LEU H A 65 TRP H 1.0 1.8 4.80 1318 978 A 65 TRP H A 80 ILE HD1% 1.0 1.8 5.63 1319 979 A 65 TRP H A 80 ILE HG1y 1.0 1.8 5.05 1320 979 A 65 TRP H A 80 ILE HG1x 1.0 1.8 5.05 1321 980 A 65 TRP H A 81 CYS HA 1.0 1.8 5.54 1322 981 A 65 TRP H A 81 CYS HBy 1.0 1.8 4.99 1323 981 A 65 TRP H A 81 CYS HBx 1.0 1.8 4.99 1324 982 A 65 TRP H A 81 CYS H 1.0 1.8 4.46 1325 983 A 65 TRP H A 82 GLU HA 1.0 1.8 5.74 1326 984 A 66 LEU HA A 66 LEU HD1% 1.0 1.8 3.52 1327 985 A 66 LEU HD2% A 66 LEU HA 1.0 1.8 4.48 1328 986 A 66 LEU HA A 67 TYR H 1.0 1.8 3.60 1329 987 A 66 LEU HA A 80 ILE HA 1.0 1.8 4.38 1330 988 A 80 ILE HD1% A 66 LEU HA 1.0 1.8 5.08 1331 989 A 66 LEU HA A 80 ILE HG1y 1.0 1.8 4.81 1332 989 A 80 ILE HG1x A 66 LEU HA 1.0 1.8 4.81 1333 990 A 80 ILE HG2% A 66 LEU HA 1.0 1.8 5.13 1334 991 A 81 CYS H A 66 LEU HA 1.0 1.8 5.01 1335 992 A 66 LEU HD1% A 66 LEU HBx 1.0 1.8 3.64 1336 992 A 66 LEU HBy A 66 LEU HD1% 1.0 1.8 3.64 1337 993 A 66 LEU HD2% A 66 LEU HBx 1.0 1.8 3.06 1338 993 A 66 LEU HD2% A 66 LEU HBy 1.0 1.8 3.06 1339 994 A 67 TYR H A 66 LEU HBx 1.0 1.8 4.30 1340 994 A 66 LEU HBy A 67 TYR H 1.0 1.8 4.30 1341 995 A 80 ILE HD1% A 66 LEU HBx 1.0 1.8 4.68 1342 995 A 66 LEU HBy A 80 ILE HD1% 1.0 1.8 4.68 1343 996 A 66 LEU HD1% A 67 TYR H 1.0 1.8 3.69 1344 997 A 66 LEU HD1% A 78 TRP HBx 1.0 1.8 5.00 1345 997 A 66 LEU HD1% A 78 TRP HBy 1.0 1.8 5.00 1346 998 A 78 TRP HZ3 A 66 LEU HD1% 1.0 1.8 5.40 1347 999 A 66 LEU HD1% A 79 SER H 1.0 1.8 4.60 1348 1000 A 66 LEU HD1% A 80 ILE HA 1.0 1.8 4.60 1349 1001 A 66 LEU HD1% A 80 ILE HB 1.0 1.8 3.43 1350 1002 A 66 LEU HD1% A 80 ILE HG1y 1.0 1.8 3.97 1351 1002 A 80 ILE HG1x A 66 LEU HD1% 1.0 1.8 3.97 1352 1003 A 80 ILE HG2% A 66 LEU HD1% 1.0 1.8 4.27 1353 1004 A 66 LEU HD1% A 99 THR HG2% 1.0 1.8 5.00 1354 1005 A 66 LEU HD1% A 103 GLY HAx 1.0 1.8 6.00 1355 1005 A 66 LEU HD1% A 103 GLY HAy 1.0 1.8 6.00 1356 1006 A 66 LEU HD1% A 103 GLY H 1.0 1.8 6.00 1357 1007 A 66 LEU HD2% A 67 TYR H 1.0 1.8 5.13 1358 1008 A 66 LEU HD2% A 78 TRP HBx 1.0 1.8 5.54 1359 1008 A 66 LEU HD2% A 78 TRP HBy 1.0 1.8 5.54 1360 1009 A 66 LEU HD2% A 78 TRP HZ3 1.0 1.8 4.76 1361 1010 A 66 LEU HD2% A 99 THR HB 1.0 1.8 5.59 1362 1011 A 66 LEU HD2% A 103 GLY HAx 1.0 1.8 6.00 1363 1011 A 66 LEU HD2% A 103 GLY HAy 1.0 1.8 6.00 1364 1012 A 66 LEU HD2% A 103 GLY H 1.0 1.8 6.00 1365 1013 A 66 LEU HG A 67 TYR H 1.0 1.8 4.84 1366 1014 A 66 LEU HG A 78 TRP HZ3 1.0 1.8 4.71 1367 1015 A 66 LEU HG A 79 SER H 1.0 1.8 6.05 1368 1016 A 66 LEU H A 66 LEU HBx 1.0 1.8 3.60 1369 1016 A 66 LEU H A 66 LEU HBy 1.0 1.8 3.60 1370 1017 A 66 LEU H A 66 LEU HD2% 1.0 1.8 5.21 1371 1018 A 66 LEU H A 67 TYR H 1.0 1.8 4.97 1372 1019 A 66 LEU H A 80 ILE HD1% 1.0 1.8 5.73 1373 1020 A 68 ALA H A 67 TYR HA 1.0 1.8 3.52 1374 1021 A 68 ALA H A 67 TYR HBx 1.0 1.8 3.83 1375 1021 A 68 ALA H A 67 TYR HBy 1.0 1.8 3.83 1376 1022 A 67 TYR HD% A 79 SER H 1.0 1.8 5.49 1377 1023 A 67 TYR HD% A 67 TYR H 1.0 1.8 4.99 1378 1024 A 68 ALA H A 67 TYR H 1.0 1.8 5.06 1379 1025 A 67 TYR H A 79 SER H 1.0 1.8 4.06 1380 1026 A 67 TYR H A 80 ILE HA 1.0 1.8 4.55 1381 1027 A 68 ALA HA A 69 MET H 1.0 1.8 3.65 1382 1028 A 68 ALA HA A 77 HIS H 1.0 1.8 5.70 1383 1029 A 68 ALA HA A 78 TRP HA 1.0 1.8 3.93 1384 1030 A 68 ALA HA A 78 TRP HBx 1.0 1.8 5.63 1385 1030 A 68 ALA HA A 78 TRP HBy 1.0 1.8 5.63 1386 1031 A 68 ALA HA A 78 TRP HD1 1.0 1.8 5.64 1387 1032 A 68 ALA HA A 79 SER H 1.0 1.8 4.41 1388 1033 A 68 ALA HB% A 69 MET H 1.0 1.8 3.93 1389 1034 A 70 VAL HG2% A 68 ALA HB% 1.0 1.8 3.80 1390 1035 A 68 ALA HB% A 76 GLU HBx 1.0 1.8 4.93 1391 1035 A 68 ALA HB% A 76 GLU HBy 1.0 1.8 4.93 1392 1036 A 68 ALA HB% A 76 GLU HGx 1.0 1.8 6.00 1393 1036 A 68 ALA HB% A 76 GLU HGy 1.0 1.8 6.00 1394 1037 A 68 ALA HB% A 77 HIS H 1.0 1.8 6.05 1395 1038 A 68 ALA HB% A 78 TRP HA 1.0 1.8 4.66 1396 1039 A 68 ALA HB% A 78 TRP HD1 1.0 1.8 4.94 1397 1040 A 68 ALA HB% A 78 TRP HE1 1.0 1.8 4.44 1398 1041 A 68 ALA HB% A 78 TRP HH2 1.0 1.8 5.09 1399 1042 A 68 ALA HB% A 78 TRP HZ2 1.0 1.8 4.98 1400 1043 A 68 ALA HB% A 78 TRP HZ3 1.0 1.8 5.35 1401 1044 A 68 ALA HB% A 79 SER H 1.0 1.8 5.36 1402 1045 A 68 ALA H A 68 ALA HB% 1.0 1.8 3.54 1403 1046 A 70 VAL H A 69 MET HA 1.0 1.8 3.60 1404 1047 A 70 VAL H A 69 MET HBx 1.0 1.8 4.60 1405 1047 A 70 VAL H A 69 MET HBy 1.0 1.8 4.60 1406 1048 A 69 MET HBy A 77 HIS HBx 1.0 1.8 4.95 1407 1048 A 69 MET HBx A 77 HIS HBx 1.0 1.8 4.95 1408 1048 A 77 HIS HBy A 69 MET HBx 1.0 1.8 4.95 1409 1048 A 69 MET HBy A 77 HIS HBy 1.0 1.8 4.95 1410 1049 A 77 HIS H A 69 MET HBx 1.0 1.8 5.18 1411 1049 A 77 HIS H A 69 MET HBy 1.0 1.8 5.18 1412 1050 A 69 MET H A 69 MET HGy 1.0 1.8 4.25 1413 1050 A 69 MET H A 69 MET HGx 1.0 1.8 4.25 1414 1051 A 69 MET H A 77 HIS HBx 1.0 1.8 4.95 1415 1051 A 69 MET H A 77 HIS HBy 1.0 1.8 4.95 1416 1052 A 69 MET H A 77 HIS H 1.0 1.8 4.22 1417 1053 A 70 VAL HG1% A 70 VAL HA 1.0 1.8 3.34 1418 1054 A 70 VAL HG2% A 70 VAL HA 1.0 1.8 3.39 1419 1055 A 70 VAL HA A 71 GLY H 1.0 1.8 3.41 1420 1056 A 70 VAL HA A 76 GLU HA 1.0 1.8 3.79 1421 1057 A 70 VAL HA A 76 GLU HBx 1.0 1.8 4.80 1422 1057 A 76 GLU HBy A 70 VAL HA 1.0 1.8 4.80 1423 1058 A 70 VAL HA A 76 GLU HGx 1.0 1.8 5.61 1424 1058 A 76 GLU HGy A 70 VAL HA 1.0 1.8 5.61 1425 1059 A 77 HIS H A 70 VAL HA 1.0 1.8 4.43 1426 1060 A 70 VAL HB A 71 GLY H 1.0 1.8 5.04 1427 1061 A 70 VAL HG1% A 71 GLY HAx 1.0 1.8 4.70 1428 1061 A 71 GLY HAy A 70 VAL HG1% 1.0 1.8 4.70 1429 1062 A 70 VAL HG1% A 71 GLY H 1.0 1.8 3.79 1430 1063 A 70 VAL HG1% A 76 GLU HBx 1.0 1.8 4.91 1431 1063 A 70 VAL HG1% A 76 GLU HBy 1.0 1.8 4.91 1432 1064 A 70 VAL HG1% A 76 GLU HGx 1.0 1.8 5.58 1433 1065 A 70 VAL HG1% A 76 GLU H 1.0 1.8 5.80 1434 1066 A 70 VAL HG2% A 71 GLY H 1.0 1.8 4.68 1435 1067 A 70 VAL HG2% A 76 GLU HA 1.0 1.8 4.58 1436 1068 A 70 VAL HG2% A 76 GLU HBx 1.0 1.8 3.70 1437 1068 A 70 VAL HG2% A 76 GLU HBy 1.0 1.8 3.70 1438 1069 A 70 VAL HG2% A 76 GLU HGx 1.0 1.8 4.30 1439 1069 A 70 VAL HG2% A 76 GLU HGy 1.0 1.8 4.30 1440 1070 A 70 VAL HG2% A 77 HIS H 1.0 1.8 5.96 1441 1071 A 70 VAL HB A 70 VAL H 1.0 1.8 3.72 1442 1072 A 70 VAL HG1% A 70 VAL H 1.0 1.8 4.36 1443 1073 A 70 VAL HG2% A 70 VAL H 1.0 1.8 3.66 1444 1074 A 70 VAL H A 71 GLY H 1.0 1.8 5.05 1445 1075 A 71 GLY HAx A 72 PRO HDy 1.0 1.8 4.18 1446 1075 A 71 GLY HAy A 72 PRO HDy 1.0 1.8 4.18 1447 1075 A 72 PRO HDx A 71 GLY HAx 1.0 1.8 4.18 1448 1075 A 71 GLY HAy A 72 PRO HDx 1.0 1.8 4.18 1449 1076 A 71 GLY H A 75 GLU H 1.0 1.8 5.29 1450 1077 A 71 GLY H A 76 GLU HA 1.0 1.8 4.65 1451 1078 A 73 ASN H A 72 PRO HBy 1.0 1.8 4.38 1452 1078 A 72 PRO HBx A 73 ASN H 1.0 1.8 4.38 1453 1079 A 73 ASN H A 72 PRO HDy 1.0 1.8 5.10 1454 1079 A 72 PRO HDx A 73 ASN H 1.0 1.8 5.10 1455 1080 A 73 ASN H A 72 PRO HGx 1.0 1.8 5.00 1456 1080 A 72 PRO HGy A 73 ASN H 1.0 1.8 5.00 1457 1081 A 73 ASN HBy A 73 ASN HD22 1.0 1.8 3.49 1458 1081 A 73 ASN HBx A 73 ASN HD22 1.0 1.8 3.49 1459 1081 A 73 ASN HD21 A 73 ASN HBx 1.0 1.8 3.49 1460 1081 A 73 ASN HBy A 73 ASN HD21 1.0 1.8 3.49 1461 1082 A 73 ASN HBy A 74 GLY H 1.0 1.8 5.01 1462 1083 A 74 GLY H A 73 ASN HBx 1.0 1.8 5.01 1463 1084 A 73 ASN H A 74 GLY H 1.0 1.8 4.80 1464 1085 A 75 GLU H A 74 GLY H 1.0 1.8 4.80 1465 1086 A 75 GLU HA A 75 GLU HGx 1.0 1.8 3.45 1466 1086 A 75 GLU HA A 75 GLU HGy 1.0 1.8 3.45 1467 1087 A 76 GLU H A 75 GLU HA 1.0 1.8 3.60 1468 1088 A 76 GLU H A 75 GLU HBx 1.0 1.8 4.35 1469 1088 A 76 GLU H A 75 GLU HBy 1.0 1.8 4.35 1470 1089 A 75 GLU H A 75 GLU HGx 1.0 1.8 4.61 1471 1089 A 75 GLU H A 75 GLU HGy 1.0 1.8 4.61 1472 1090 A 77 HIS H A 76 GLU HA 1.0 1.8 3.64 1473 1091 A 77 HIS H A 76 GLU HBy 1.0 1.8 5.18 1474 1092 A 76 GLU HBy A 78 TRP HE1 1.0 1.8 5.44 1475 1093 A 78 TRP HE1 A 76 GLU HBx 1.0 1.8 5.44 1476 1094 A 78 TRP HE1 A 76 GLU HGx 1.0 1.8 4.30 1477 1094 A 76 GLU HGy A 78 TRP HE1 1.0 1.8 4.30 1478 1095 A 76 GLU H A 76 GLU HGx 1.0 1.8 4.14 1479 1095 A 76 GLU HGy A 76 GLU H 1.0 1.8 4.14 1480 1096 A 77 HIS H A 76 GLU H 1.0 1.8 4.84 1481 1097 A 77 HIS HA A 78 TRP H 1.0 1.8 3.64 1482 1098 A 78 TRP H A 77 HIS HBx 1.0 1.8 4.55 1483 1098 A 77 HIS HBy A 78 TRP H 1.0 1.8 4.55 1484 1099 A 79 SER H A 78 TRP HA 1.0 1.8 3.60 1485 1100 A 78 TRP HE1 A 78 TRP HBx 1.0 1.8 5.29 1486 1100 A 78 TRP HBy A 78 TRP HE1 1.0 1.8 5.29 1487 1101 A 79 SER H A 78 TRP HBx 1.0 1.8 4.36 1488 1101 A 78 TRP HBy A 79 SER H 1.0 1.8 4.36 1489 1102 A 99 THR HG2% A 78 TRP HBx 1.0 1.8 6.01 1490 1102 A 78 TRP HBy A 99 THR HG2% 1.0 1.8 6.01 1491 1103 A 78 TRP HD1 A 101 ALA HA 1.0 1.8 5.40 1492 1104 A 78 TRP HD1 A 101 ALA HB% 1.0 1.8 5.32 1493 1105 A 78 TRP HE1 A 101 ALA HA 1.0 1.8 4.96 1494 1106 A 78 TRP HE1 A 101 ALA HB% 1.0 1.8 5.00 1495 1107 A 78 TRP HZ2 A 101 ALA HB% 1.0 1.8 4.73 1496 1108 A 79 SER HA A 80 ILE H 1.0 1.8 3.79 1497 1109 A 79 SER HA A 98 PHE HA 1.0 1.8 4.30 1498 1110 A 79 SER HA A 99 THR H 1.0 1.8 4.36 1499 1111 A 80 ILE H A 79 SER HBx 1.0 1.8 4.02 1500 1111 A 80 ILE H A 79 SER HBy 1.0 1.8 4.02 1501 1112 A 80 ILE HD1% A 80 ILE HA 1.0 1.8 4.47 1502 1113 A 80 ILE HA A 80 ILE HG1y 1.0 1.8 4.58 1503 1114 A 80 ILE HG1x A 80 ILE HA 1.0 1.8 4.58 1504 1115 A 81 CYS H A 80 ILE HA 1.0 1.8 3.74 1505 1116 A 80 ILE HD1% A 80 ILE HB 1.0 1.8 3.48 1506 1117 A 81 CYS H A 80 ILE HB 1.0 1.8 4.71 1507 1118 A 80 ILE HB A 99 THR HG2% 1.0 1.8 4.03 1508 1119 A 80 ILE HD1% A 81 CYS H 1.0 1.8 4.86 1509 1120 A 80 ILE HD1% A 82 GLU HGx 1.0 1.8 4.15 1510 1120 A 82 GLU HGy A 80 ILE HD1% 1.0 1.8 4.15 1511 1121 A 80 ILE HG1y A 82 GLU HGx 1.0 1.8 4.20 1512 1121 A 80 ILE HG1x A 82 GLU HGx 1.0 1.8 4.20 1513 1121 A 82 GLU HGy A 80 ILE HG1y 1.0 1.8 4.20 1514 1121 A 82 GLU HGy A 80 ILE HG1x 1.0 1.8 4.20 1515 1122 A 81 CYS H A 80 ILE HG1y 1.0 1.8 4.25 1516 1123 A 80 ILE HG1x A 81 CYS H 1.0 1.8 4.25 1517 1124 A 80 ILE HD1% A 80 ILE HG2% 1.0 1.8 3.13 1518 1125 A 80 ILE HG2% A 80 ILE HG1y 1.0 1.8 4.57 1519 1126 A 80 ILE HG1x A 80 ILE HG2% 1.0 1.8 4.57 1520 1127 A 80 ILE HG2% A 81 CYS H 1.0 1.8 4.86 1521 1128 A 80 ILE HG2% A 82 GLU HGx 1.0 1.8 5.13 1522 1128 A 82 GLU HGy A 80 ILE HG2% 1.0 1.8 5.13 1523 1129 A 80 ILE HG2% A 97 GLY HAy 1.0 1.8 4.80 1524 1129 A 80 ILE HG2% A 97 GLY HAx 1.0 1.8 4.80 1525 1130 A 80 ILE HG2% A 97 GLY H 1.0 1.8 4.92 1526 1131 A 80 ILE HG2% A 99 THR HG2% 1.0 1.8 3.60 1527 1132 A 80 ILE HG2% A 105 LEU HA 1.0 1.8 6.05 1528 1133 A 80 ILE HG2% A 105 LEU HD1% 1.0 1.8 4.33 1529 1134 A 80 ILE HG2% A 80 ILE H 1.0 1.8 3.88 1530 1135 A 80 ILE H A 97 GLY H 1.0 1.8 4.65 1531 1136 A 80 ILE H A 98 PHE HA 1.0 1.8 5.02 1532 1137 A 99 THR HG2% A 80 ILE H 1.0 1.8 5.86 1533 1138 A 81 CYS HA A 82 GLU H 1.0 1.8 3.71 1534 1139 A 81 CYS HA A 96 ASP HA 1.0 1.8 4.66 1535 1140 A 81 CYS HA A 97 GLY H 1.0 1.8 5.28 1536 1141 A 82 GLU H A 81 CYS HBy 1.0 1.8 5.04 1537 1142 A 81 CYS HBx A 82 GLU H 1.0 1.8 5.04 1538 1143 A 83 TYR H A 82 GLU HA 1.0 1.8 3.60 1539 1144 A 83 TYR H A 82 GLU HBx 1.0 1.8 4.59 1540 1144 A 83 TYR H A 82 GLU HBy 1.0 1.8 4.59 1541 1145 A 95 LYS H A 82 GLU HBx 1.0 1.8 4.79 1542 1145 A 82 GLU HBy A 95 LYS H 1.0 1.8 4.79 1543 1146 A 82 GLU HGy A 82 GLU HBy 1.0 1.8 3.19 1544 1146 A 82 GLU HBy A 82 GLU HGx 1.0 1.8 3.19 1545 1147 A 82 GLU HGy A 82 GLU HBx 1.0 1.8 3.19 1546 1147 A 82 GLU HBx A 82 GLU HGx 1.0 1.8 3.19 1547 1148 A 83 TYR H A 82 GLU HGx 1.0 1.8 4.65 1548 1148 A 83 TYR H A 82 GLU HGy 1.0 1.8 4.65 1549 1149 A 82 GLU H A 82 GLU HBy 1.0 1.8 4.16 1550 1150 A 82 GLU H A 82 GLU HBx 1.0 1.8 4.16 1551 1151 A 82 GLU H A 82 GLU HGx 1.0 1.8 4.77 1552 1151 A 82 GLU HGy A 82 GLU H 1.0 1.8 4.77 1553 1152 A 83 TYR H A 82 GLU H 1.0 1.8 4.96 1554 1153 A 82 GLU H A 95 LYS H 1.0 1.8 4.61 1555 1154 A 82 GLU H A 96 ASP HA 1.0 1.8 4.80 1556 1155 A 82 GLU H A 96 ASP HBx 1.0 1.8 5.86 1557 1155 A 82 GLU H A 96 ASP HBy 1.0 1.8 5.86 1558 1156 A 83 TYR HD% A 83 TYR HA 1.0 1.8 4.86 1559 1157 A 83 TYR HA A 84 ALA H 1.0 1.8 3.86 1560 1158 A 83 TYR HA A 94 GLY HAx 1.0 1.8 3.85 1561 1158 A 83 TYR HA A 94 GLY HAy 1.0 1.8 3.85 1562 1159 A 95 LYS H A 83 TYR HA 1.0 1.8 4.82 1563 1160 A 84 ALA H A 83 TYR HBy 1.0 1.8 4.30 1564 1160 A 84 ALA H A 83 TYR HBx 1.0 1.8 4.30 1565 1161 A 86 ILE HD1% A 83 TYR HBy 1.0 1.8 5.00 1566 1161 A 86 ILE HD1% A 83 TYR HBx 1.0 1.8 5.00 1567 1162 A 83 TYR H A 83 TYR HBy 1.0 1.8 3.77 1568 1162 A 83 TYR H A 83 TYR HBx 1.0 1.8 3.77 1569 1163 A 83 TYR HD% A 83 TYR H 1.0 1.8 3.97 1570 1164 A 84 ALA HB% A 85 ILE H 1.0 1.8 3.60 1571 1165 A 84 ALA HB% A 95 LYS HEx 1.0 1.8 4.87 1572 1165 A 84 ALA HB% A 95 LYS HEy 1.0 1.8 4.87 1573 1166 A 95 LYS H A 84 ALA HB% 1.0 1.8 5.01 1574 1167 A 84 ALA H A 85 ILE H 1.0 1.8 4.20 1575 1168 A 95 LYS H A 84 ALA H 1.0 1.8 5.10 1576 1169 A 85 ILE HA A 85 ILE HD1% 1.0 1.8 4.39 1577 1170 A 85 ILE HA A 85 ILE HG1y 1.0 1.8 4.23 1578 1171 A 85 ILE HA A 85 ILE HG1x 1.0 1.8 4.23 1579 1172 A 85 ILE HA A 85 ILE HG2% 1.0 1.8 3.55 1580 1173 A 86 ILE H A 85 ILE HA 1.0 1.8 3.60 1581 1174 A 85 ILE HD1% A 85 ILE HB 1.0 1.8 3.65 1582 1175 A 86 ILE H A 85 ILE HB 1.0 1.8 4.85 1583 1176 A 85 ILE HB A 93 THR HG2% 1.0 1.8 6.00 1584 1177 A 85 ILE HB A 93 THR H 1.0 1.8 4.70 1585 1178 A 86 ILE H A 85 ILE HD1% 1.0 1.8 5.37 1586 1179 A 85 ILE HD1% A 93 THR H 1.0 1.8 6.00 1587 1180 A 86 ILE H A 85 ILE HG1y 1.0 1.8 5.35 1588 1180 A 86 ILE H A 85 ILE HG1x 1.0 1.8 5.35 1589 1181 A 85 ILE HG2% A 85 ILE HG1y 1.0 1.8 3.63 1590 1182 A 85 ILE HG2% A 85 ILE HG1x 1.0 1.8 3.63 1591 1183 A 86 ILE H A 85 ILE HG2% 1.0 1.8 3.79 1592 1184 A 85 ILE HG2% A 87 LYS HDx 1.0 1.8 3.82 1593 1184 A 85 ILE HG2% A 87 LYS HDy 1.0 1.8 3.82 1594 1185 A 85 ILE HG2% A 87 LYS HGx 1.0 1.8 4.00 1595 1185 A 85 ILE HG2% A 87 LYS HGy 1.0 1.8 4.00 1596 1186 A 85 ILE HG2% A 87 LYS H 1.0 1.8 4.94 1597 1187 A 85 ILE HG2% A 92 PHE HA 1.0 1.8 5.70 1598 1188 A 85 ILE HG2% A 93 THR H 1.0 1.8 5.60 1599 1189 A 85 ILE H A 85 ILE HB 1.0 1.8 3.80 1600 1190 A 85 ILE H A 85 ILE HD1% 1.0 1.8 4.87 1601 1191 A 85 ILE H A 85 ILE HG1y 1.0 1.8 4.02 1602 1191 A 85 ILE H A 85 ILE HG1x 1.0 1.8 4.02 1603 1192 A 85 ILE H A 85 ILE HG2% 1.0 1.8 4.59 1604 1193 A 86 ILE H A 85 ILE H 1.0 1.8 5.05 1605 1194 A 85 ILE H A 93 THR H 1.0 1.8 5.60 1606 1195 A 87 LYS H A 86 ILE HA 1.0 1.8 3.58 1607 1196 A 86 ILE HA A 92 PHE HBy 1.0 1.8 5.30 1608 1196 A 86 ILE HA A 92 PHE HBx 1.0 1.8 5.30 1609 1197 A 86 ILE HG2% A 86 ILE HD1% 1.0 1.8 3.44 1610 1198 A 86 ILE HG2% A 86 ILE HG1x 1.0 1.8 3.51 1611 1198 A 86 ILE HG2% A 86 ILE HG1y 1.0 1.8 3.51 1612 1199 A 86 ILE HG2% A 87 LYS HA 1.0 1.8 4.63 1613 1200 A 86 ILE HG2% A 87 LYS H 1.0 1.8 4.16 1614 1201 A 86 ILE HB A 86 ILE H 1.0 1.8 4.22 1615 1202 A 86 ILE H A 86 ILE HG1x 1.0 1.8 4.52 1616 1202 A 86 ILE H A 86 ILE HG1y 1.0 1.8 4.52 1617 1203 A 86 ILE HG2% A 86 ILE H 1.0 1.8 4.62 1618 1204 A 87 LYS HA A 87 LYS HDx 1.0 1.8 4.45 1619 1204 A 87 LYS HDy A 87 LYS HA 1.0 1.8 4.45 1620 1205 A 87 LYS HA A 87 LYS HGx 1.0 1.8 3.92 1621 1205 A 87 LYS HGy A 87 LYS HA 1.0 1.8 3.92 1622 1206 A 87 LYS HA A 88 PRO HDx 1.0 1.8 3.80 1623 1207 A 87 LYS HA A 88 PRO HDy 1.0 1.8 3.80 1624 1208 A 87 LYS HBy A 87 LYS HDx 1.0 1.8 3.73 1625 1208 A 87 LYS HDy A 87 LYS HBy 1.0 1.8 3.73 1626 1209 A 87 LYS HBx A 87 LYS HDx 1.0 1.8 3.73 1627 1209 A 87 LYS HDy A 87 LYS HBx 1.0 1.8 3.73 1628 1210 A 87 LYS HEy A 87 LYS HGx 1.0 1.8 3.50 1629 1210 A 87 LYS HEx A 87 LYS HGx 1.0 1.8 3.50 1630 1210 A 87 LYS HGy A 87 LYS HEx 1.0 1.8 3.50 1631 1210 A 87 LYS HGy A 87 LYS HEy 1.0 1.8 3.50 1632 1211 A 87 LYS H A 87 LYS HBy 1.0 1.8 4.26 1633 1212 A 87 LYS H A 87 LYS HBx 1.0 1.8 4.26 1634 1213 A 87 LYS H A 87 LYS HGx 1.0 1.8 4.97 1635 1213 A 87 LYS HGy A 87 LYS H 1.0 1.8 4.97 1636 1214 A 87 LYS H A 92 PHE HBy 1.0 1.8 6.00 1637 1215 A 87 LYS H A 92 PHE HBx 1.0 1.8 6.00 1638 1216 A 87 LYS H A 92 PHE HD% 1.0 1.8 5.60 1639 1217 A 88 PRO HA A 89 ILE H 1.0 1.8 3.80 1640 1218 A 89 ILE HG2% A 89 ILE HA 1.0 1.8 3.62 1641 1219 A 89 ILE HB A 89 ILE HD1% 1.0 1.8 3.69 1642 1220 A 89 ILE HB A 90 GLU H 1.0 1.8 4.93 1643 1221 A 89 ILE HD1% A 89 ILE HG2% 1.0 1.8 3.21 1644 1222 A 89 ILE HG2% A 89 ILE HG1x 1.0 1.8 3.61 1645 1222 A 89 ILE HG2% A 89 ILE HG1y 1.0 1.8 3.61 1646 1223 A 89 ILE HG2% A 90 GLU H 1.0 1.8 4.75 1647 1224 A 89 ILE HB A 89 ILE H 1.0 1.8 4.11 1648 1225 A 89 ILE H A 89 ILE HG1x 1.0 1.8 4.10 1649 1225 A 89 ILE H A 89 ILE HG1y 1.0 1.8 4.10 1650 1226 A 89 ILE H A 90 GLU H 1.0 1.8 4.50 1651 1227 A 90 GLU HA A 118 PHE HBy 1.0 1.8 6.00 1652 1228 A 90 GLU HA A 118 PHE HBx 1.0 1.8 6.00 1653 1229 A 90 GLU HA A 118 PHE H 1.0 1.8 6.00 1654 1230 A 90 GLU HBy A 91 ARG H 1.0 1.8 4.41 1655 1231 A 91 ARG H A 90 GLU HBx 1.0 1.8 4.41 1656 1232 A 91 ARG HA A 92 PHE H 1.0 1.8 3.67 1657 1233 A 91 ARG HA A 117 ARG HA 1.0 1.8 4.52 1658 1234 A 118 PHE HD% A 91 ARG HA 1.0 1.8 5.10 1659 1235 A 118 PHE H A 91 ARG HA 1.0 1.8 5.07 1660 1236 A 91 ARG HDy A 91 ARG HBy 1.0 1.8 4.53 1661 1236 A 91 ARG HBx A 91 ARG HDy 1.0 1.8 4.53 1662 1237 A 91 ARG HBy A 91 ARG HDx 1.0 1.8 4.53 1663 1237 A 91 ARG HBx A 91 ARG HDx 1.0 1.8 4.53 1664 1238 A 117 ARG HA A 91 ARG HBy 1.0 1.8 4.74 1665 1238 A 117 ARG HA A 91 ARG HBx 1.0 1.8 4.74 1666 1239 A 91 ARG HDy A 91 ARG HBy 1.0 1.8 3.97 1667 1239 A 91 ARG HBy A 91 ARG HDx 1.0 1.8 3.97 1668 1240 A 92 PHE H A 91 ARG HBy 1.0 1.8 5.48 1669 1241 A 91 ARG HBx A 91 ARG HDy 1.0 1.8 3.97 1670 1241 A 91 ARG HBx A 91 ARG HDx 1.0 1.8 3.97 1671 1242 A 92 PHE H A 91 ARG HBx 1.0 1.8 5.48 1672 1243 A 118 PHE H A 91 ARG HBx 1.0 1.8 5.04 1673 1244 A 92 PHE H A 91 ARG HGx 1.0 1.8 4.71 1674 1244 A 92 PHE H A 91 ARG HGy 1.0 1.8 4.71 1675 1245 A 118 PHE H A 91 ARG HGx 1.0 1.8 5.49 1676 1245 A 118 PHE H A 91 ARG HGy 1.0 1.8 5.49 1677 1246 A 91 ARG H A 91 ARG HGx 1.0 1.8 4.34 1678 1246 A 91 ARG H A 91 ARG HGy 1.0 1.8 4.34 1679 1247 A 92 PHE HA A 92 PHE HD% 1.0 1.8 4.84 1680 1248 A 93 THR H A 92 PHE HA 1.0 1.8 3.75 1681 1249 A 93 THR H A 92 PHE HBy 1.0 1.8 4.02 1682 1249 A 93 THR H A 92 PHE HBx 1.0 1.8 4.02 1683 1250 A 93 THR H A 92 PHE HD% 1.0 1.8 4.73 1684 1251 A 118 PHE HD% A 92 PHE HE% 1.0 1.8 4.86 1685 1252 A 92 PHE HD% A 92 PHE H 1.0 1.8 4.95 1686 1253 A 92 PHE H A 117 ARG HA 1.0 1.8 4.89 1687 1254 A 93 THR HG2% A 93 THR HA 1.0 1.8 4.46 1688 1255 A 93 THR HA A 115 ASP HA 1.0 1.8 4.21 1689 1256 A 93 THR HA A 116 MET H 1.0 1.8 5.31 1690 1257 A 93 THR HB A 94 GLY H 1.0 1.8 5.37 1691 1258 A 93 THR HG2% A 115 ASP HBx 1.0 1.8 5.06 1692 1258 A 93 THR HG2% A 115 ASP HBy 1.0 1.8 5.06 1693 1259 A 93 THR HG2% A 116 MET H 1.0 1.8 5.40 1694 1260 A 93 THR HG2% A 93 THR H 1.0 1.8 4.15 1695 1261 A 115 ASP HA A 94 GLY H 1.0 1.8 4.38 1696 1262 A 95 LYS HA A 95 LYS HDx 1.0 1.8 4.86 1697 1262 A 95 LYS HA A 95 LYS HDy 1.0 1.8 4.86 1698 1263 A 95 LYS HA A 96 ASP H 1.0 1.8 3.77 1699 1264 A 95 LYS HA A 114 TRP H 1.0 1.8 5.30 1700 1265 A 95 LYS HBy A 95 LYS HDx 1.0 1.8 2.93 1701 1265 A 95 LYS HBx A 95 LYS HDx 1.0 1.8 2.93 1702 1265 A 95 LYS HDy A 95 LYS HBy 1.0 1.8 2.93 1703 1265 A 95 LYS HDy A 95 LYS HBx 1.0 1.8 2.93 1704 1266 A 95 LYS HBx A 95 LYS HEx 1.0 1.8 4.26 1705 1266 A 95 LYS HBy A 95 LYS HEx 1.0 1.8 4.26 1706 1266 A 95 LYS HEy A 95 LYS HBy 1.0 1.8 4.26 1707 1266 A 95 LYS HEy A 95 LYS HBx 1.0 1.8 4.26 1708 1267 A 96 ASP H A 95 LYS HBy 1.0 1.8 5.18 1709 1268 A 96 ASP H A 95 LYS HBx 1.0 1.8 5.18 1710 1269 A 95 LYS HDy A 95 LYS HGy 1.0 1.8 3.31 1711 1269 A 95 LYS HDx A 95 LYS HGy 1.0 1.8 3.31 1712 1270 A 95 LYS HEy A 95 LYS HGy 1.0 1.8 4.46 1713 1270 A 95 LYS HEx A 95 LYS HGy 1.0 1.8 4.46 1714 1271 A 95 LYS HDy A 95 LYS HGx 1.0 1.8 3.31 1715 1271 A 95 LYS HGx A 95 LYS HDx 1.0 1.8 3.31 1716 1272 A 95 LYS HEy A 95 LYS HGx 1.0 1.8 4.46 1717 1272 A 95 LYS HGx A 95 LYS HEx 1.0 1.8 4.46 1718 1273 A 95 LYS H A 95 LYS HBy 1.0 1.8 3.73 1719 1273 A 95 LYS H A 95 LYS HBx 1.0 1.8 3.73 1720 1274 A 95 LYS H A 95 LYS HGy 1.0 1.8 4.61 1721 1274 A 95 LYS H A 95 LYS HGx 1.0 1.8 4.61 1722 1275 A 97 GLY H A 96 ASP HBx 1.0 1.8 4.35 1723 1275 A 97 GLY H A 96 ASP HBy 1.0 1.8 4.35 1724 1276 A 96 ASP H A 112 SER H 1.0 1.8 4.94 1725 1277 A 112 SER H A 97 GLY HAy 1.0 1.8 5.42 1726 1277 A 97 GLY HAx A 112 SER H 1.0 1.8 5.42 1727 1278 A 105 LEU HD1% A 97 GLY HAy 1.0 1.8 4.83 1728 1279 A 111 ARG HBx A 97 GLY HAy 1.0 1.8 5.87 1729 1279 A 97 GLY HAy A 111 ARG HBy 1.0 1.8 5.87 1730 1280 A 111 ARG HGx A 97 GLY HAy 1.0 1.8 5.87 1731 1280 A 97 GLY HAy A 111 ARG HGy 1.0 1.8 5.87 1732 1281 A 97 GLY HAx A 105 LEU HD1% 1.0 1.8 4.83 1733 1282 A 97 GLY HAx A 111 ARG HBx 1.0 1.8 5.87 1734 1282 A 97 GLY HAx A 111 ARG HBy 1.0 1.8 5.87 1735 1283 A 97 GLY HAx A 111 ARG HGx 1.0 1.8 5.87 1736 1283 A 97 GLY HAx A 111 ARG HGy 1.0 1.8 5.87 1737 1284 A 97 GLY H A 105 LEU HD1% 1.0 1.8 6.05 1738 1285 A 98 PHE HA A 98 PHE HD% 1.0 1.8 4.66 1739 1286 A 98 PHE HA A 99 THR H 1.0 1.8 3.72 1740 1287 A 105 LEU HD1% A 98 PHE HBy 1.0 1.8 5.81 1741 1287 A 105 LEU HD1% A 98 PHE HBx 1.0 1.8 5.81 1742 1288 A 98 PHE HBx A 109 MET HBx 1.0 1.8 6.00 1743 1288 A 109 MET HBy A 98 PHE HBy 1.0 1.8 6.00 1744 1288 A 98 PHE HBx A 109 MET HBy 1.0 1.8 6.00 1745 1288 A 98 PHE HBy A 109 MET HBx 1.0 1.8 6.00 1746 1289 A 98 PHE HBy A 109 MET HGx 1.0 1.8 6.00 1747 1289 A 98 PHE HBx A 109 MET HGx 1.0 1.8 6.00 1748 1289 A 109 MET HGy A 98 PHE HBy 1.0 1.8 6.00 1749 1289 A 98 PHE HBx A 109 MET HGy 1.0 1.8 6.00 1750 1290 A 99 THR H A 98 PHE HBy 1.0 1.8 4.68 1751 1291 A 99 THR H A 98 PHE HBx 1.0 1.8 4.68 1752 1292 A 98 PHE HD% A 109 MET HBx 1.0 1.8 4.18 1753 1292 A 98 PHE HD% A 109 MET HBy 1.0 1.8 4.18 1754 1293 A 98 PHE HD% A 110 PRO HDy 1.0 1.8 6.00 1755 1294 A 98 PHE HE% A 110 PRO HDx 1.0 1.8 6.00 1756 1294 A 98 PHE HE% A 110 PRO HDy 1.0 1.8 6.00 1757 1295 A 98 PHE HE% A 110 PRO HGx 1.0 1.8 6.00 1758 1295 A 98 PHE HE% A 110 PRO HGy 1.0 1.8 6.00 1759 1296 A 98 PHE HD% A 98 PHE H 1.0 1.8 4.32 1760 1297 A 105 LEU HD1% A 98 PHE H 1.0 1.8 4.52 1761 1298 A 99 THR HG2% A 99 THR HA 1.0 1.8 3.77 1762 1299 A 105 LEU HA A 99 THR HA 1.0 1.8 4.20 1763 1300 A 105 LEU HD1% A 99 THR HA 1.0 1.8 5.00 1764 1301 A 99 THR HB A 100 ASP H 1.0 1.8 3.76 1765 1302 A 99 THR HB A 103 GLY HAx 1.0 1.8 4.87 1766 1302 A 103 GLY HAy A 99 THR HB 1.0 1.8 4.87 1767 1303 A 99 THR HG2% A 100 ASP H 1.0 1.8 4.26 1768 1304 A 99 THR HG2% A 103 GLY HAx 1.0 1.8 4.21 1769 1304 A 99 THR HG2% A 103 GLY HAy 1.0 1.8 4.21 1770 1305 A 99 THR HG2% A 104 LYS HA 1.0 1.8 5.18 1771 1306 A 99 THR HG2% A 104 LYS H 1.0 1.8 5.00 1772 1307 A 99 THR HG2% A 105 LEU HA 1.0 1.8 4.80 1773 1308 A 99 THR HG2% A 105 LEU HBy 1.0 1.8 4.35 1774 1308 A 99 THR HG2% A 105 LEU HBx 1.0 1.8 4.35 1775 1309 A 99 THR HG2% A 105 LEU H 1.0 1.8 5.03 1776 1310 A 99 THR HG2% A 99 THR H 1.0 1.8 4.23 1777 1311 A 101 ALA HB% A 100 ASP HBx 1.0 1.8 4.97 1778 1311 A 101 ALA HB% A 100 ASP HBy 1.0 1.8 4.97 1779 1312 A 101 ALA H A 100 ASP HBx 1.0 1.8 4.17 1780 1312 A 100 ASP HBy A 101 ALA H 1.0 1.8 4.17 1781 1313 A 103 GLY H A 101 ALA HA 1.0 1.8 4.93 1782 1314 A 101 ALA HB% A 102 SER HA 1.0 1.8 5.08 1783 1315 A 101 ALA HB% A 102 SER H 1.0 1.8 4.00 1784 1316 A 101 ALA H A 102 SER H 1.0 1.8 4.15 1785 1317 A 103 GLY H A 102 SER HBy 1.0 1.8 5.51 1786 1318 A 103 GLY H A 102 SER HBx 1.0 1.8 5.51 1787 1319 A 102 SER H A 102 SER HBy 1.0 1.8 4.16 1788 1320 A 102 SER H A 102 SER HBx 1.0 1.8 4.16 1789 1321 A 102 SER H A 103 GLY HAx 1.0 1.8 4.91 1790 1321 A 103 GLY HAy A 102 SER H 1.0 1.8 4.91 1791 1322 A 103 GLY H A 102 SER H 1.0 1.8 4.40 1792 1323 A 104 LYS HA A 104 LYS HGy 1.0 1.8 3.71 1793 1323 A 104 LYS HA A 104 LYS HGx 1.0 1.8 3.71 1794 1324 A 104 LYS HA A 105 LEU HBy 1.0 1.8 4.68 1795 1324 A 104 LYS HA A 105 LEU HBx 1.0 1.8 4.68 1796 1325 A 104 LYS HA A 105 LEU H 1.0 1.8 3.60 1797 1326 A 105 LEU H A 104 LYS HBy 1.0 1.8 4.46 1798 1326 A 105 LEU H A 104 LYS HBx 1.0 1.8 4.46 1799 1327 A 104 LYS HEy A 104 LYS HBy 1.0 1.8 5.14 1800 1327 A 104 LYS HBy A 104 LYS HEx 1.0 1.8 5.14 1801 1328 A 104 LYS HBx A 104 LYS HDy 1.0 1.8 3.40 1802 1328 A 104 LYS HBx A 104 LYS HDx 1.0 1.8 3.40 1803 1329 A 104 LYS HBx A 104 LYS HEy 1.0 1.8 5.14 1804 1329 A 104 LYS HBx A 104 LYS HEx 1.0 1.8 5.14 1805 1330 A 104 LYS HEy A 104 LYS HGy 1.0 1.8 4.16 1806 1330 A 104 LYS HEx A 104 LYS HGy 1.0 1.8 4.16 1807 1331 A 105 LEU H A 104 LYS HGy 1.0 1.8 5.20 1808 1332 A 104 LYS HGx A 104 LYS HEx 1.0 1.8 4.16 1809 1332 A 104 LYS HGx A 104 LYS HEy 1.0 1.8 4.16 1810 1333 A 104 LYS H A 104 LYS HBx 1.0 1.8 3.84 1811 1334 A 104 LYS H A 104 LYS HGy 1.0 1.8 5.19 1812 1335 A 104 LYS H A 104 LYS HGx 1.0 1.8 5.19 1813 1336 A 104 LYS H A 105 LEU H 1.0 1.8 5.17 1814 1337 A 105 LEU HA A 106 ASN H 1.0 1.8 3.62 1815 1338 A 105 LEU HD2% A 105 LEU HBy 1.0 1.8 3.71 1816 1338 A 105 LEU HBx A 105 LEU HD2% 1.0 1.8 3.71 1817 1339 A 106 ASN H A 105 LEU HBy 1.0 1.8 4.50 1818 1339 A 105 LEU HBx A 106 ASN H 1.0 1.8 4.50 1819 1340 A 105 LEU HD1% A 105 LEU HBy 1.0 1.8 3.92 1820 1341 A 105 LEU HD1% A 105 LEU HBx 1.0 1.8 3.92 1821 1342 A 105 LEU HD1% A 111 ARG HGy 1.0 1.8 5.00 1822 1342 A 105 LEU HD1% A 111 ARG HGx 1.0 1.8 5.00 1823 1343 A 105 LEU HD2% A 111 ARG HGy 1.0 1.8 5.00 1824 1343 A 111 ARG HGx A 105 LEU HD2% 1.0 1.8 5.00 1825 1344 A 105 LEU H A 105 LEU HBy 1.0 1.8 3.25 1826 1344 A 105 LEU HBx A 105 LEU H 1.0 1.8 3.25 1827 1345 A 105 LEU HD1% A 105 LEU H 1.0 1.8 5.18 1828 1346 A 105 LEU H A 105 LEU HG 1.0 1.8 5.10 1829 1347 A 106 ASN HA A 107 THR H 1.0 1.8 3.50 1830 1348 A 108 GLU H A 106 ASN HBx 1.0 1.8 5.31 1831 1348 A 106 ASN HBy A 108 GLU H 1.0 1.8 5.31 1832 1349 A 106 ASN H A 106 ASN HBx 1.0 1.8 3.77 1833 1349 A 106 ASN H A 106 ASN HBy 1.0 1.8 3.77 1834 1350 A 107 THR HA A 107 THR HG2% 1.0 1.8 3.65 1835 1351 A 108 GLU H A 107 THR HB 1.0 1.8 5.07 1836 1352 A 108 GLU H A 107 THR HG2% 1.0 1.8 4.68 1837 1353 A 107 THR H A 108 GLU H 1.0 1.8 4.45 1838 1354 A 108 GLU HA A 108 GLU HGx 1.0 1.8 3.50 1839 1354 A 108 GLU HA A 108 GLU HGy 1.0 1.8 3.50 1840 1355 A 109 MET H A 108 GLU HBx 1.0 1.8 4.44 1841 1355 A 108 GLU HBy A 109 MET H 1.0 1.8 4.44 1842 1356 A 108 GLU H A 108 GLU HBx 1.0 1.8 3.38 1843 1356 A 108 GLU H A 108 GLU HBy 1.0 1.8 3.38 1844 1357 A 108 GLU H A 109 MET H 1.0 1.8 4.50 1845 1358 A 109 MET HA A 109 MET HGx 1.0 1.8 3.98 1846 1358 A 109 MET HGy A 109 MET HA 1.0 1.8 3.98 1847 1359 A 109 MET HA A 110 PRO HDx 1.0 1.8 3.60 1848 1359 A 110 PRO HDy A 109 MET HA 1.0 1.8 3.60 1849 1360 A 109 MET H A 109 MET HBx 1.0 1.8 3.55 1850 1360 A 109 MET HBy A 109 MET H 1.0 1.8 3.55 1851 1361 A 110 PRO HA A 111 ARG H 1.0 1.8 3.45 1852 1362 A 111 ARG H A 110 PRO HBy 1.0 1.8 4.27 1853 1362 A 111 ARG H A 110 PRO HBx 1.0 1.8 4.27 1854 1363 A 111 ARG HDy A 111 ARG HBy 1.0 1.8 4.41 1855 1363 A 111 ARG HBy A 111 ARG HDx 1.0 1.8 4.41 1856 1364 A 112 SER H A 111 ARG HBy 1.0 1.8 5.27 1857 1365 A 111 ARG HBx A 111 ARG HDy 1.0 1.8 4.41 1858 1365 A 111 ARG HBx A 111 ARG HDx 1.0 1.8 4.41 1859 1366 A 112 SER H A 111 ARG HBx 1.0 1.8 5.27 1860 1367 A 111 ARG H A 111 ARG HGy 1.0 1.8 5.00 1861 1368 A 111 ARG HGx A 111 ARG H 1.0 1.8 5.00 1862 1369 A 112 SER H A 111 ARG H 1.0 1.8 5.07 1863 1370 A 113 ASN H A 112 SER HBx 1.0 1.8 4.19 1864 1370 A 112 SER HBy A 113 ASN H 1.0 1.8 4.19 1865 1371 A 131 ILE HG2% A 112 SER HBx 1.0 1.8 4.47 1866 1371 A 131 ILE HG2% A 112 SER HBy 1.0 1.8 4.47 1867 1372 A 132 SER H A 113 ASN HA 1.0 1.8 5.87 1868 1373 A 114 TRP H A 113 ASN HBx 1.0 1.8 4.60 1869 1373 A 114 TRP H A 113 ASN HBy 1.0 1.8 4.60 1870 1374 A 113 ASN HBx A 132 SER HBx 1.0 1.8 4.21 1871 1374 A 113 ASN HBy A 132 SER HBx 1.0 1.8 4.21 1872 1374 A 132 SER HBy A 113 ASN HBx 1.0 1.8 4.21 1873 1374 A 132 SER HBy A 113 ASN HBy 1.0 1.8 4.21 1874 1375 A 132 SER H A 113 ASN HBx 1.0 1.8 4.51 1875 1375 A 132 SER H A 113 ASN HBy 1.0 1.8 4.51 1876 1376 A 131 ILE HG2% A 113 ASN H 1.0 1.8 5.19 1877 1377 A 132 SER H A 113 ASN H 1.0 1.8 4.61 1878 1378 A 114 TRP HA A 131 ILE HA 1.0 1.8 5.63 1879 1379 A 132 SER H A 114 TRP HA 1.0 1.8 5.39 1880 1380 A 115 ASP H A 114 TRP HBx 1.0 1.8 4.53 1881 1380 A 114 TRP HBy A 115 ASP H 1.0 1.8 4.53 1882 1381 A 115 ASP HA A 116 MET H 1.0 1.8 3.89 1883 1382 A 130 HIS H A 115 ASP HBx 1.0 1.8 5.87 1884 1382 A 115 ASP HBy A 130 HIS H 1.0 1.8 5.87 1885 1383 A 115 ASP H A 130 HIS HBx 1.0 1.8 4.93 1886 1383 A 115 ASP H A 130 HIS HBy 1.0 1.8 4.93 1887 1384 A 115 ASP H A 130 HIS H 1.0 1.8 4.77 1888 1385 A 131 ILE HA A 115 ASP H 1.0 1.8 4.75 1889 1386 A 116 MET HE% A 116 MET HA 1.0 1.8 4.75 1890 1387 A 116 MET HA A 117 ARG H 1.0 1.8 3.45 1891 1388 A 127 VAL HG1% A 116 MET HA 1.0 1.8 5.61 1892 1389 A 116 MET HA A 129 TYR HA 1.0 1.8 3.60 1893 1390 A 130 HIS H A 116 MET HA 1.0 1.8 4.38 1894 1391 A 117 ARG H A 116 MET HBx 1.0 1.8 4.60 1895 1391 A 117 ARG H A 116 MET HBy 1.0 1.8 4.60 1896 1392 A 127 VAL HG1% A 116 MET HE% 1.0 1.8 4.80 1897 1393 A 116 MET HE% A 129 TYR HA 1.0 1.8 5.46 1898 1394 A 129 TYR HE% A 116 MET HE% 1.0 1.8 4.39 1899 1395 A 116 MET HE% A 116 MET HGx 1.0 1.8 3.63 1900 1395 A 116 MET HE% A 116 MET HGy 1.0 1.8 3.63 1901 1396 A 117 ARG H A 116 MET HGx 1.0 1.8 4.75 1902 1396 A 117 ARG H A 116 MET HGy 1.0 1.8 4.75 1903 1397 A 129 TYR HE% A 116 MET HGx 1.0 1.8 4.96 1904 1397 A 129 TYR HE% A 116 MET HGy 1.0 1.8 4.96 1905 1398 A 116 MET H A 117 ARG H 1.0 1.8 4.93 1906 1399 A 117 ARG HA A 117 ARG HDx 1.0 1.8 4.29 1907 1399 A 117 ARG HA A 117 ARG HDy 1.0 1.8 4.29 1908 1400 A 118 PHE H A 117 ARG HA 1.0 1.8 3.56 1909 1401 A 128 GLN H A 117 ARG HA 1.0 1.8 6.05 1910 1402 A 117 ARG HBx A 117 ARG HDx 1.0 1.8 3.39 1911 1402 A 117 ARG HBy A 117 ARG HDx 1.0 1.8 3.39 1912 1402 A 117 ARG HDy A 117 ARG HBy 1.0 1.8 3.39 1913 1402 A 117 ARG HDy A 117 ARG HBx 1.0 1.8 3.39 1914 1403 A 118 PHE H A 117 ARG HBy 1.0 1.8 4.30 1915 1403 A 118 PHE H A 117 ARG HBx 1.0 1.8 4.30 1916 1404 A 128 GLN H A 117 ARG HBy 1.0 1.8 4.29 1917 1404 A 128 GLN H A 117 ARG HBx 1.0 1.8 4.29 1918 1405 A 117 ARG HDy A 117 ARG HBy 1.0 1.8 4.41 1919 1406 A 117 ARG HBy A 117 ARG HDx 1.0 1.8 4.41 1920 1407 A 117 ARG HDy A 117 ARG HBx 1.0 1.8 4.41 1921 1408 A 117 ARG HBx A 117 ARG HDx 1.0 1.8 4.41 1922 1409 A 117 ARG HDx A 128 GLN HBx 1.0 1.8 5.40 1923 1409 A 117 ARG HDy A 128 GLN HBx 1.0 1.8 5.40 1924 1409 A 128 GLN HBy A 117 ARG HDx 1.0 1.8 5.40 1925 1409 A 128 GLN HBy A 117 ARG HDy 1.0 1.8 5.40 1926 1410 A 118 PHE H A 117 ARG HGx 1.0 1.8 5.12 1927 1410 A 118 PHE H A 117 ARG HGy 1.0 1.8 5.12 1928 1411 A 117 ARG H A 117 ARG HBy 1.0 1.8 3.85 1929 1411 A 117 ARG H A 117 ARG HBx 1.0 1.8 3.85 1930 1412 A 117 ARG H A 117 ARG HGx 1.0 1.8 4.86 1931 1412 A 117 ARG H A 117 ARG HGy 1.0 1.8 4.86 1932 1413 A 118 PHE H A 117 ARG H 1.0 1.8 4.97 1933 1414 A 117 ARG H A 128 GLN HBx 1.0 1.8 5.01 1934 1414 A 128 GLN HBy A 117 ARG H 1.0 1.8 5.01 1935 1415 A 128 GLN H A 117 ARG H 1.0 1.8 3.78 1936 1416 A 117 ARG H A 129 TYR HA 1.0 1.8 5.46 1937 1417 A 118 PHE HA A 119 ILE H 1.0 1.8 3.41 1938 1418 A 125 THR HG2% A 118 PHE HA 1.0 1.8 5.49 1939 1419 A 118 PHE HA A 127 VAL HA 1.0 1.8 4.20 1940 1420 A 127 VAL HG2% A 118 PHE HA 1.0 1.8 4.89 1941 1421 A 128 GLN H A 118 PHE HA 1.0 1.8 5.04 1942 1422 A 119 ILE H A 118 PHE HBy 1.0 1.8 4.30 1943 1422 A 119 ILE H A 118 PHE HBx 1.0 1.8 4.30 1944 1423 A 125 THR HG2% A 118 PHE HBy 1.0 1.8 5.74 1945 1424 A 125 THR HG2% A 118 PHE HBx 1.0 1.8 5.74 1946 1425 A 125 THR HG2% A 118 PHE HD% 1.0 1.8 4.35 1947 1426 A 127 VAL HG2% A 118 PHE HD% 1.0 1.8 4.09 1948 1427 A 118 PHE HD% A 118 PHE H 1.0 1.8 4.10 1949 1428 A 119 ILE HA A 119 ILE HD1% 1.0 1.8 4.37 1950 1429 A 119 ILE HA A 119 ILE HG1y 1.0 1.8 4.31 1951 1430 A 119 ILE HA A 119 ILE HG1x 1.0 1.8 4.31 1952 1431 A 119 ILE HA A 119 ILE HG2% 1.0 1.8 3.61 1953 1432 A 119 ILE HA A 120 ASP H 1.0 1.8 3.60 1954 1433 A 119 ILE HD1% A 119 ILE HB 1.0 1.8 3.61 1955 1434 A 120 ASP H A 119 ILE HB 1.0 1.8 5.16 1956 1435 A 119 ILE HB A 126 GLU HBx 1.0 1.8 5.00 1957 1435 A 119 ILE HB A 126 GLU HBy 1.0 1.8 5.00 1958 1436 A 119 ILE HB A 126 GLU HGx 1.0 1.8 4.65 1959 1436 A 119 ILE HB A 126 GLU HGy 1.0 1.8 4.65 1960 1437 A 119 ILE HB A 126 GLU H 1.0 1.8 3.90 1961 1438 A 119 ILE HD1% A 121 LYS HEx 1.0 1.8 5.03 1962 1438 A 119 ILE HD1% A 121 LYS HEy 1.0 1.8 5.03 1963 1439 A 119 ILE HD1% A 128 GLN HBx 1.0 1.8 5.87 1964 1439 A 128 GLN HBy A 119 ILE HD1% 1.0 1.8 5.87 1965 1440 A 128 GLN HE21 A 119 ILE HD1% 1.0 1.8 4.14 1966 1440 A 128 GLN HE22 A 119 ILE HD1% 1.0 1.8 4.14 1967 1441 A 128 GLN HE21 A 119 ILE HD1% 1.0 1.8 5.00 1968 1442 A 128 GLN HE22 A 119 ILE HD1% 1.0 1.8 4.92 1969 1443 A 119 ILE HD1% A 128 GLN HGx 1.0 1.8 4.87 1970 1443 A 128 GLN HGy A 119 ILE HD1% 1.0 1.8 4.87 1971 1444 A 119 ILE HG2% A 119 ILE HG1y 1.0 1.8 2.99 1972 1444 A 119 ILE HG2% A 119 ILE HG1x 1.0 1.8 2.99 1973 1445 A 119 ILE HG2% A 120 ASP H 1.0 1.8 3.76 1974 1446 A 119 ILE HG2% A 121 LYS HDy 1.0 1.8 4.49 1975 1447 A 119 ILE HG2% A 121 LYS HDx 1.0 1.8 4.59 1976 1448 A 119 ILE HG2% A 121 LYS HEx 1.0 1.8 4.18 1977 1448 A 119 ILE HG2% A 121 LYS HEy 1.0 1.8 4.18 1978 1449 A 119 ILE HG2% A 121 LYS HGx 1.0 1.8 4.80 1979 1449 A 119 ILE HG2% A 121 LYS HGy 1.0 1.8 4.80 1980 1450 A 119 ILE HG2% A 126 GLU H 1.0 1.8 4.41 1981 1451 A 119 ILE H A 119 ILE HB 1.0 1.8 3.79 1982 1452 A 119 ILE H A 119 ILE HD1% 1.0 1.8 4.33 1983 1453 A 119 ILE H A 119 ILE HG1y 1.0 1.8 3.88 1984 1453 A 119 ILE H A 119 ILE HG1x 1.0 1.8 3.88 1985 1454 A 119 ILE H A 119 ILE HG2% 1.0 1.8 4.27 1986 1455 A 125 THR HG2% A 119 ILE H 1.0 1.8 3.90 1987 1456 A 119 ILE H A 126 GLU H 1.0 1.8 4.22 1988 1457 A 119 ILE H A 127 VAL HA 1.0 1.8 4.76 1989 1458 A 120 ASP HA A 121 LYS H 1.0 1.8 3.60 1990 1459 A 120 ASP HA A 125 THR HA 1.0 1.8 4.33 1991 1460 A 125 THR HB A 120 ASP HA 1.0 1.8 5.97 1992 1461 A 125 THR HG2% A 120 ASP HA 1.0 1.8 4.19 1993 1462 A 126 GLU H A 120 ASP HA 1.0 1.8 4.57 1994 1463 A 120 ASP H A 120 ASP HBx 1.0 1.8 3.51 1995 1463 A 120 ASP H A 120 ASP HBy 1.0 1.8 3.51 1996 1464 A 125 THR HG2% A 120 ASP H 1.0 1.8 5.79 1997 1465 A 121 LYS HA A 121 LYS HGx 1.0 1.8 3.96 1998 1465 A 121 LYS HGy A 121 LYS HA 1.0 1.8 3.96 1999 1466 A 121 LYS HA A 122 GLY H 1.0 1.8 3.47 2000 1467 A 121 LYS HDy A 121 LYS HBx 1.0 1.8 3.98 2001 1467 A 121 LYS HDy A 121 LYS HBy 1.0 1.8 3.98 2002 1468 A 121 LYS HDx A 121 LYS HBx 1.0 1.8 3.98 2003 1468 A 121 LYS HDx A 121 LYS HBy 1.0 1.8 3.98 2004 1469 A 122 GLY H A 121 LYS HBx 1.0 1.8 4.60 2005 1469 A 122 GLY H A 121 LYS HBy 1.0 1.8 4.60 2006 1470 A 124 ILE H A 121 LYS HBx 1.0 1.8 5.08 2007 1470 A 121 LYS HBy A 124 ILE H 1.0 1.8 5.08 2008 1471 A 121 LYS H A 121 LYS HGx 1.0 1.8 4.24 2009 1471 A 121 LYS HGy A 121 LYS H 1.0 1.8 4.24 2010 1472 A 121 LYS H A 122 GLY H 1.0 1.8 4.40 2011 1473 A 121 LYS H A 125 THR HA 1.0 1.8 4.02 2012 1474 A 123 GLU H A 122 GLY HAx 1.0 1.8 3.40 2013 1474 A 122 GLY HAy A 123 GLU H 1.0 1.8 3.40 2014 1475 A 122 GLY H A 123 GLU H 1.0 1.8 4.87 2015 1476 A 123 GLU HA A 123 GLU HGx 1.0 1.8 3.90 2016 1476 A 123 GLU HA A 123 GLU HGy 1.0 1.8 3.90 2017 1477 A 124 ILE H A 123 GLU HBx 1.0 1.8 4.16 2018 1477 A 123 GLU HBy A 124 ILE H 1.0 1.8 4.16 2019 1478 A 124 ILE H A 123 GLU HGx 1.0 1.8 5.00 2020 1478 A 124 ILE H A 123 GLU HGy 1.0 1.8 5.00 2021 1479 A 123 GLU HBy A 123 GLU H 1.0 1.8 4.16 2022 1480 A 123 GLU H A 123 GLU HBx 1.0 1.8 4.16 2023 1481 A 124 ILE H A 123 GLU H 1.0 1.8 3.64 2024 1482 A 124 ILE HD1% A 124 ILE HA 1.0 1.8 4.44 2025 1483 A 124 ILE HA A 124 ILE HG1y 1.0 1.8 4.48 2026 1484 A 124 ILE HG1x A 124 ILE HA 1.0 1.8 4.48 2027 1485 A 124 ILE HG2% A 124 ILE HA 1.0 1.8 3.56 2028 1486 A 125 THR H A 124 ILE HA 1.0 1.8 3.60 2029 1487 A 124 ILE HD1% A 124 ILE HB 1.0 1.8 3.59 2030 1488 A 125 THR H A 124 ILE HB 1.0 1.8 4.42 2031 1489 A 124 ILE HG2% A 124 ILE HG1y 1.0 1.8 3.63 2032 1490 A 124 ILE HG2% A 124 ILE HG1x 1.0 1.8 3.63 2033 1491 A 124 ILE HG2% A 125 THR H 1.0 1.8 3.49 2034 1492 A 124 ILE H A 124 ILE HB 1.0 1.8 3.43 2035 1493 A 124 ILE HD1% A 124 ILE H 1.0 1.8 4.73 2036 1494 A 124 ILE H A 124 ILE HG1y 1.0 1.8 4.25 2037 1495 A 124 ILE HG1x A 124 ILE H 1.0 1.8 4.25 2038 1496 A 124 ILE HG2% A 124 ILE H 1.0 1.8 4.39 2039 1497 A 125 THR HG2% A 125 THR HA 1.0 1.8 3.71 2040 1498 A 126 GLU H A 125 THR HA 1.0 1.8 3.60 2041 1499 A 125 THR HB A 126 GLU H 1.0 1.8 4.72 2042 1500 A 125 THR HG2% A 126 GLU H 1.0 1.8 3.56 2043 1501 A 125 THR HG2% A 127 VAL HG1% 1.0 1.8 4.95 2044 1502 A 127 VAL HG2% A 125 THR HG2% 1.0 1.8 3.73 2045 1503 A 125 THR H A 125 THR HB 1.0 1.8 3.83 2046 1504 A 125 THR HG2% A 125 THR H 1.0 1.8 4.11 2047 1504 A 125 THR H A 125 THR HG1 1.0 1.8 4.11 2048 1505 A 125 THR HG2% A 125 THR H 1.0 1.8 4.31 2049 1506 A 126 GLU HA A 126 GLU HGx 1.0 1.8 3.82 2050 1506 A 126 GLU HA A 126 GLU HGy 1.0 1.8 3.82 2051 1507 A 127 VAL H A 126 GLU HA 1.0 1.8 3.51 2052 1508 A 127 VAL H A 126 GLU HGy 1.0 1.8 5.60 2053 1509 A 127 VAL H A 126 GLU HGx 1.0 1.8 5.60 2054 1510 A 126 GLU HBy A 126 GLU H 1.0 1.8 4.05 2055 1511 A 126 GLU H A 126 GLU HBx 1.0 1.8 4.05 2056 1512 A 126 GLU H A 126 GLU HGx 1.0 1.8 5.13 2057 1512 A 126 GLU HGy A 126 GLU H 1.0 1.8 5.13 2058 1513 A 127 VAL H A 126 GLU H 1.0 1.8 5.19 2059 1514 A 127 VAL HG1% A 127 VAL HA 1.0 1.8 4.30 2060 1515 A 127 VAL HG2% A 127 VAL HA 1.0 1.8 3.95 2061 1516 A 128 GLN H A 127 VAL HA 1.0 1.8 3.60 2062 1517 A 128 GLN H A 127 VAL HB 1.0 1.8 4.80 2063 1518 A 128 GLN H A 127 VAL HG1% 1.0 1.8 3.85 2064 1519 A 129 TYR HD% A 127 VAL HG1% 1.0 1.8 4.30 2065 1520 A 129 TYR HE% A 127 VAL HG1% 1.0 1.8 4.51 2066 1521 A 128 GLN H A 127 VAL HG2% 1.0 1.8 4.88 2067 1522 A 127 VAL HB A 127 VAL H 1.0 1.8 3.85 2068 1523 A 127 VAL H A 127 VAL HG1% 1.0 1.8 4.80 2069 1524 A 127 VAL H A 127 VAL HG2% 1.0 1.8 3.99 2070 1525 A 129 TYR H A 128 GLN HA 1.0 1.8 3.78 2071 1526 A 129 TYR H A 128 GLN HBx 1.0 1.8 4.50 2072 1526 A 129 TYR H A 128 GLN HBy 1.0 1.8 4.50 2073 1527 A 128 GLN H A 128 GLN HGx 1.0 1.8 4.13 2074 1527 A 128 GLN HGy A 128 GLN H 1.0 1.8 4.13 2075 1528 A 129 TYR HD% A 129 TYR HA 1.0 1.8 4.50 2076 1529 A 130 HIS H A 129 TYR HA 1.0 1.8 3.69 2077 1530 A 130 HIS H A 129 TYR HBy 1.0 1.8 4.30 2078 1530 A 129 TYR HBx A 130 HIS H 1.0 1.8 4.30 2079 1531 A 131 ILE HD1% A 129 TYR HBy 1.0 1.8 5.14 2080 1532 A 131 ILE HD1% A 129 TYR HBx 1.0 1.8 5.14 2081 1533 A 129 TYR HD% A 130 HIS H 1.0 1.8 5.09 2082 1534 A 129 TYR HD% A 129 TYR H 1.0 1.8 4.39 2083 1535 A 130 HIS HA A 131 ILE HG1y 1.0 1.8 4.98 2084 1535 A 130 HIS HA A 131 ILE HG1x 1.0 1.8 4.98 2085 1536 A 131 ILE H A 130 HIS HA 1.0 1.8 3.66 2086 1537 A 131 ILE H A 130 HIS H 1.0 1.8 5.02 2087 1538 A 132 SER H A 131 ILE HA 1.0 1.8 3.61 2088 1539 A 131 ILE HG2% A 131 ILE HD1% 1.0 1.8 3.67 2089 1540 A 131 ILE HG2% A 131 ILE HG1y 1.0 1.8 4.60 2090 1541 A 131 ILE HG2% A 131 ILE HG1x 1.0 1.8 4.60 2091 1542 A 132 SER H A 131 ILE HG2% 1.0 1.8 4.18 2092 1543 A 131 ILE H A 131 ILE HD1% 1.0 1.8 4.66 2093 1544 A 131 ILE H A 131 ILE HG1y 1.0 1.8 4.21 2094 1544 A 131 ILE H A 131 ILE HG1x 1.0 1.8 4.21 2095 1545 A 132 SER HA A 133 TYR H 1.0 1.8 3.58 2096 1546 A 133 TYR H A 132 SER HBx 1.0 1.8 4.06 2097 1546 A 132 SER HBy A 133 TYR H 1.0 1.8 4.06 2098 1547 A 133 TYR HD% A 133 TYR HA 1.0 1.8 4.41 2099 1548 A 133 TYR HA A 134 ASP H 1.0 1.8 3.54 2100 1549 A 134 ASP H A 133 TYR HBx 1.0 1.8 4.50 2101 1549 A 134 ASP H A 133 TYR HBy 1.0 1.8 4.50 2102 1550 A 133 TYR HD% A 134 ASP H 1.0 1.8 5.05 2103 1551 A 133 TYR HD% A 138 GLN HBx 1.0 1.8 6.00 2104 1551 A 133 TYR HD% A 138 GLN HBy 1.0 1.8 6.00 2105 1552 A 139 LEU HD1% A 133 TYR HD% 1.0 1.8 5.00 2106 1553 A 133 TYR HD% A 133 TYR H 1.0 1.8 4.10 2107 1554 A 139 LEU HD1% A 133 TYR H 1.0 1.8 4.96 2108 1555 A 135 ASP H A 134 ASP HBy 1.0 1.8 5.10 2109 1556 A 135 ASP H A 134 ASP HBx 1.0 1.8 5.10 2110 1557 A 134 ASP H A 134 ASP HBy 1.0 1.8 3.66 2111 1557 A 134 ASP H A 134 ASP HBx 1.0 1.8 3.66 2112 1558 A 134 ASP H A 135 ASP H 1.0 1.8 4.80 2113 1559 A 136 VAL HG2% A 135 ASP HA 1.0 1.8 4.29 2114 1560 A 135 ASP HA A 136 VAL H 1.0 1.8 3.50 2115 1561 A 135 ASP HA A 137 ALA H 1.0 1.8 4.89 2116 1562 A 137 ALA HB% A 135 ASP HBx 1.0 1.8 4.80 2117 1562 A 135 ASP HBy A 137 ALA HB% 1.0 1.8 4.80 2118 1563 A 138 GLN H A 135 ASP HBx 1.0 1.8 3.90 2119 1563 A 135 ASP HBy A 138 GLN H 1.0 1.8 3.90 2120 1564 A 136 VAL HG1% A 136 VAL HA 1.0 1.8 3.82 2121 1565 A 136 VAL HG2% A 136 VAL HA 1.0 1.8 3.59 2122 1566 A 136 VAL HA A 139 LEU HBy 1.0 1.8 5.15 2123 1567 A 136 VAL HA A 139 LEU HBx 1.0 1.8 5.15 2124 1568 A 139 LEU HD1% A 136 VAL HA 1.0 1.8 5.13 2125 1569 A 139 LEU HD2% A 136 VAL HA 1.0 1.8 5.32 2126 1570 A 136 VAL HA A 139 LEU H 1.0 1.8 4.54 2127 1571 A 136 VAL HA A 140 GLU H 1.0 1.8 4.85 2128 1572 A 137 ALA H A 136 VAL HB 1.0 1.8 4.09 2129 1573 A 136 VAL HG1% A 137 ALA HB% 1.0 1.8 4.74 2130 1574 A 136 VAL HG1% A 137 ALA H 1.0 1.8 4.10 2131 1575 A 139 LEU HD2% A 136 VAL HG1% 1.0 1.8 3.78 2132 1576 A 136 VAL HG1% A 140 GLU HGy 1.0 1.8 4.62 2133 1577 A 136 VAL HG1% A 140 GLU HGx 1.0 1.8 4.62 2134 1578 A 136 VAL HG1% A 140 GLU H 1.0 1.8 4.70 2135 1579 A 136 VAL HG2% A 137 ALA H 1.0 1.8 4.51 2136 1580 A 139 LEU HD1% A 136 VAL HG2% 1.0 1.8 5.07 2137 1581 A 139 LEU HD2% A 136 VAL HG2% 1.0 1.8 4.68 2138 1582 A 136 VAL HG1% A 136 VAL H 1.0 1.8 5.05 2139 1583 A 136 VAL HG2% A 136 VAL H 1.0 1.8 5.08 2140 1584 A 136 VAL H A 137 ALA H 1.0 1.8 4.41 2141 1585 A 137 ALA HA A 140 GLU HBy 1.0 1.8 5.40 2142 1586 A 137 ALA HA A 140 GLU HBx 1.0 1.8 4.60 2143 1587 A 140 GLU HGy A 137 ALA HA 1.0 1.8 5.40 2144 1588 A 137 ALA HA A 140 GLU HGx 1.0 1.8 5.40 2145 1589 A 140 GLU H A 137 ALA HA 1.0 1.8 4.62 2146 1590 A 137 ALA HB% A 138 GLN H 1.0 1.8 3.60 2147 1591 A 137 ALA HB% A 139 LEU H 1.0 1.8 4.76 2148 1592 A 137 ALA HB% A 140 GLU H 1.0 1.8 5.50 2149 1593 A 137 ALA H A 137 ALA HB% 1.0 1.8 2.96 2150 1594 A 137 ALA H A 138 GLN H 1.0 1.8 3.66 2151 1595 A 138 GLN HA A 138 GLN HGx 1.0 1.8 3.63 2152 1595 A 138 GLN HA A 138 GLN HGy 1.0 1.8 3.63 2153 1596 A 138 GLN HA A 141 ALA HB% 1.0 1.8 3.70 2154 1597 A 138 GLN HA A 142 THR H 1.0 1.8 4.55 2155 1598 A 139 LEU H A 138 GLN HBx 1.0 1.8 4.29 2156 1598 A 138 GLN HBy A 139 LEU H 1.0 1.8 4.29 2157 1599 A 138 GLN H A 138 GLN HBx 1.0 1.8 3.69 2158 1599 A 138 GLN HBy A 138 GLN H 1.0 1.8 3.69 2159 1600 A 138 GLN H A 138 GLN HGx 1.0 1.8 4.30 2160 1600 A 138 GLN H A 138 GLN HGy 1.0 1.8 4.30 2161 1601 A 138 GLN H A 139 LEU H 1.0 1.8 3.88 2162 1602 A 139 LEU HD1% A 139 LEU HA 1.0 1.8 4.53 2163 1603 A 139 LEU HD2% A 139 LEU HA 1.0 1.8 4.25 2164 1604 A 139 LEU HA A 142 THR HB 1.0 1.8 4.59 2165 1605 A 142 THR H A 139 LEU HA 1.0 1.8 4.77 2166 1606 A 139 LEU HD2% A 139 LEU HBy 1.0 1.8 3.64 2167 1606 A 139 LEU HD2% A 139 LEU HBx 1.0 1.8 3.64 2168 1607 A 139 LEU HD1% A 139 LEU HBy 1.0 1.8 3.88 2169 1608 A 140 GLU H A 139 LEU HBy 1.0 1.8 5.08 2170 1609 A 139 LEU HD1% A 139 LEU HBx 1.0 1.8 3.88 2171 1610 A 140 GLU H A 139 LEU HBx 1.0 1.8 5.08 2172 1611 A 139 LEU HD2% A 140 GLU HA 1.0 1.8 3.54 2173 1612 A 139 LEU HD2% A 140 GLU HGy 1.0 1.8 4.10 2174 1613 A 139 LEU HD2% A 140 GLU HGx 1.0 1.8 4.10 2175 1614 A 139 LEU HD2% A 140 GLU H 1.0 1.8 4.44 2176 1615 A 139 LEU HD2% A 143 ILE HG1y 1.0 1.8 5.28 2177 1615 A 139 LEU HD2% A 143 ILE HG1x 1.0 1.8 5.28 2178 1616 A 143 ILE HG2% A 139 LEU HD2% 1.0 1.8 5.28 2179 1617 A 139 LEU HG A 140 GLU H 1.0 1.8 4.75 2180 1618 A 139 LEU H A 139 LEU HBy 1.0 1.8 3.94 2181 1619 A 139 LEU H A 139 LEU HBx 1.0 1.8 3.94 2182 1620 A 139 LEU HD2% A 139 LEU H 1.0 1.8 4.51 2183 1621 A 139 LEU HG A 139 LEU H 1.0 1.8 5.21 2184 1622 A 139 LEU H A 140 GLU H 1.0 1.8 4.11 2185 1623 A 140 GLU HA A 140 GLU HGy 1.0 1.8 4.35 2186 1624 A 140 GLU HA A 140 GLU HGx 1.0 1.8 4.35 2187 1625 A 140 GLU HA A 143 ILE HB 1.0 1.8 4.90 2188 1626 A 143 ILE HG2% A 140 GLU HA 1.0 1.8 4.41 2189 1627 A 140 GLU HA A 143 ILE H 1.0 1.8 4.86 2190 1628 A 141 ALA HA A 140 GLU HBx 1.0 1.8 4.79 2191 1628 A 140 GLU HBy A 141 ALA HA 1.0 1.8 4.79 2192 1629 A 140 GLU HBy A 141 ALA H 1.0 1.8 4.08 2193 1630 A 141 ALA H A 140 GLU HBx 1.0 1.8 4.08 2194 1631 A 140 GLU H A 140 GLU HBy 1.0 1.8 4.10 2195 1632 A 140 GLU H A 140 GLU HBx 1.0 1.8 4.10 2196 1633 A 140 GLU HGy A 140 GLU H 1.0 1.8 4.41 2197 1634 A 140 GLU H A 140 GLU HGx 1.0 1.8 4.41 2198 1635 A 140 GLU H A 141 ALA H 1.0 1.8 3.79 2199 1636 A 141 ALA HA A 144 GLN HBx 1.0 1.8 3.69 2200 1636 A 141 ALA HA A 144 GLN HBy 1.0 1.8 3.69 2201 1637 A 141 ALA HA A 144 GLN HGx 1.0 1.8 4.93 2202 1637 A 141 ALA HA A 144 GLN HGy 1.0 1.8 4.93 2203 1638 A 141 ALA HA A 144 GLN H 1.0 1.8 4.02 2204 1639 A 141 ALA HB% A 142 THR HA 1.0 1.8 4.92 2205 1640 A 141 ALA HB% A 142 THR H 1.0 1.8 3.65 2206 1641 A 141 ALA HB% A 143 ILE H 1.0 1.8 5.67 2207 1642 A 141 ALA HB% A 144 GLN HBx 1.0 1.8 4.51 2208 1642 A 141 ALA HB% A 144 GLN HBy 1.0 1.8 4.51 2209 1643 A 141 ALA HB% A 144 GLN H 1.0 1.8 5.27 2210 1644 A 141 ALA HB% A 145 MET H 1.0 1.8 5.17 2211 1645 A 141 ALA HB% A 141 ALA H 1.0 1.8 3.06 2212 1646 A 142 THR H A 141 ALA H 1.0 1.8 3.71 2213 1647 A 142 THR HA A 142 THR HG2% 1.0 1.8 3.71 2214 1648 A 142 THR HA A 145 MET HBx 1.0 1.8 4.00 2215 1648 A 142 THR HA A 145 MET HBy 1.0 1.8 4.00 2216 1649 A 142 THR HA A 145 MET H 1.0 1.8 4.32 2217 1650 A 142 THR HB A 143 ILE H 1.0 1.8 4.25 2218 1651 A 143 ILE H A 142 THR HG2% 1.0 1.8 4.47 2219 1652 A 142 THR H A 142 THR HB 1.0 1.8 3.78 2220 1653 A 142 THR H A 142 THR HG2% 1.0 1.8 4.21 2221 1654 A 142 THR H A 143 ILE H 1.0 1.8 3.95 2222 1655 A 143 ILE HA A 143 ILE HG1y 1.0 1.8 3.99 2223 1655 A 143 ILE HG1x A 143 ILE HA 1.0 1.8 3.99 2224 1656 A 143 ILE HG2% A 143 ILE HA 1.0 1.8 3.59 2225 1657 A 143 ILE HA A 147 PHE HBx 1.0 1.8 5.25 2226 1658 A 143 ILE HA A 147 PHE H 1.0 1.8 4.69 2227 1659 A 143 ILE HB A 144 GLN H 1.0 1.8 4.68 2228 1660 A 143 ILE HG2% A 143 ILE HG1y 1.0 1.8 3.62 2229 1661 A 143 ILE HG2% A 143 ILE HG1x 1.0 1.8 3.62 2230 1662 A 143 ILE HG2% A 144 GLN H 1.0 1.8 4.75 2231 1663 A 143 ILE HG2% A 147 PHE H 1.0 1.8 5.02 2232 1664 A 143 ILE HB A 143 ILE H 1.0 1.8 3.84 2233 1665 A 143 ILE H A 143 ILE HG1y 1.0 1.8 4.46 2234 1665 A 143 ILE HG1x A 143 ILE H 1.0 1.8 4.46 2235 1666 A 143 ILE HG2% A 143 ILE H 1.0 1.8 4.31 2236 1667 A 143 ILE H A 144 GLN H 1.0 1.8 4.08 2237 1668 A 144 GLN HA A 144 GLN HGx 1.0 1.8 3.77 2238 1668 A 144 GLN HGy A 144 GLN HA 1.0 1.8 3.77 2239 1669 A 145 MET H A 144 GLN HBx 1.0 1.8 3.52 2240 1669 A 144 GLN HBy A 145 MET H 1.0 1.8 3.52 2241 1670 A 145 MET H A 144 GLN HGx 1.0 1.8 4.87 2242 1670 A 144 GLN HGy A 145 MET H 1.0 1.8 4.87 2243 1671 A 144 GLN H A 144 GLN HBx 1.0 1.8 3.30 2244 1671 A 144 GLN HBy A 144 GLN H 1.0 1.8 3.30 2245 1672 A 144 GLN H A 144 GLN HGx 1.0 1.8 4.50 2246 1672 A 144 GLN HGy A 144 GLN H 1.0 1.8 4.50 2247 1673 A 144 GLN H A 145 MET H 1.0 1.8 3.71 2248 1674 A 145 MET HA A 145 MET HGy 1.0 1.8 4.18 2249 1675 A 145 MET HA A 145 MET HGx 1.0 1.8 4.18 2250 1676 A 145 MET HA A 148 LYS HBy 1.0 1.8 5.54 2251 1676 A 145 MET HA A 148 LYS HBx 1.0 1.8 5.54 2252 1677 A 146 GLY H A 145 MET HBx 1.0 1.8 4.30 2253 1677 A 145 MET HBy A 146 GLY H 1.0 1.8 4.30 2254 1678 A 145 MET H A 145 MET HBx 1.0 1.8 3.38 2255 1678 A 145 MET H A 145 MET HBy 1.0 1.8 3.38 2256 1679 A 145 MET H A 145 MET HGy 1.0 1.8 4.10 2257 1679 A 145 MET H A 145 MET HGx 1.0 1.8 4.10 2258 1680 A 145 MET H A 146 GLY H 1.0 1.8 3.52 2259 1681 A 146 GLY HAx A 149 GLU HBx 1.0 1.8 5.19 2260 1681 A 149 GLU HBy A 146 GLY HAx 1.0 1.8 5.19 2261 1681 A 146 GLY HAy A 149 GLU HBy 1.0 1.8 5.19 2262 1681 A 146 GLY HAy A 149 GLU HBx 1.0 1.8 5.19 2263 1682 A 149 GLU H A 146 GLY HAx 1.0 1.8 4.75 2264 1682 A 146 GLY HAy A 149 GLU H 1.0 1.8 4.75 2265 1683 A 147 PHE H A 146 GLY H 1.0 1.8 4.16 2266 1684 A 147 PHE HD% A 147 PHE HA 1.0 1.8 4.27 2267 1685 A 147 PHE HBy A 148 LYS H 1.0 1.8 5.04 2268 1686 A 147 PHE HBx A 148 LYS H 1.0 1.8 5.04 2269 1687 A 147 PHE H A 147 PHE HBy 1.0 1.8 4.27 2270 1688 A 147 PHE HBx A 147 PHE H 1.0 1.8 4.27 2271 1689 A 147 PHE H A 148 LYS H 1.0 1.8 4.66 2272 1690 A 148 LYS HA A 148 LYS HDx 1.0 1.8 4.49 2273 1690 A 148 LYS HA A 148 LYS HDy 1.0 1.8 4.49 2274 1691 A 148 LYS HBy A 148 LYS HDx 1.0 1.8 2.83 2275 1691 A 148 LYS HDy A 148 LYS HBy 1.0 1.8 2.83 2276 1691 A 148 LYS HBx A 148 LYS HDy 1.0 1.8 2.83 2277 1691 A 148 LYS HBx A 148 LYS HDx 1.0 1.8 2.83 2278 1692 A 148 LYS HBy A 148 LYS HEx 1.0 1.8 4.00 2279 1692 A 148 LYS HBx A 148 LYS HEx 1.0 1.8 4.00 2280 1692 A 148 LYS HEy A 148 LYS HBy 1.0 1.8 4.00 2281 1692 A 148 LYS HBx A 148 LYS HEy 1.0 1.8 4.00 2282 1693 A 149 GLU H A 148 LYS HBy 1.0 1.8 4.08 2283 1693 A 148 LYS HBx A 149 GLU H 1.0 1.8 4.08 2284 1694 A 148 LYS HDy A 148 LYS HBy 1.0 1.8 4.35 2285 1695 A 148 LYS HBy A 148 LYS HDx 1.0 1.8 4.35 2286 1696 A 148 LYS HBx A 148 LYS HDy 1.0 1.8 4.35 2287 1697 A 148 LYS HBx A 148 LYS HDx 1.0 1.8 4.35 2288 1698 A 148 LYS HEx A 148 LYS HGx 1.0 1.8 3.37 2289 1698 A 148 LYS HEy A 148 LYS HGx 1.0 1.8 3.37 2290 1698 A 148 LYS HGy A 148 LYS HEx 1.0 1.8 3.37 2291 1698 A 148 LYS HEy A 148 LYS HGy 1.0 1.8 3.37 2292 1699 A 149 GLU H A 148 LYS HGx 1.0 1.8 5.30 2293 1699 A 149 GLU H A 148 LYS HGy 1.0 1.8 5.30 2294 1700 A 148 LYS H A 148 LYS HBy 1.0 1.8 4.17 2295 1701 A 148 LYS HBx A 148 LYS H 1.0 1.8 4.17 2296 1702 A 148 LYS H A 148 LYS HDx 1.0 1.8 5.18 2297 1702 A 148 LYS H A 148 LYS HDy 1.0 1.8 5.18 2298 1703 A 149 GLU H A 148 LYS H 1.0 1.8 4.09 2299 1704 A 149 GLU HA A 149 GLU HGx 1.0 1.8 3.71 2300 1704 A 149 GLU HA A 149 GLU HGy 1.0 1.8 3.71 2301 1705 A 149 GLU HA A 152 THR HB 1.0 1.8 4.31 2302 1706 A 149 GLU HA A 152 THR HG2% 1.0 1.8 4.63 2303 1707 A 149 GLU HA A 152 THR H 1.0 1.8 4.88 2304 1708 A 149 GLU HA A 153 MET H 1.0 1.8 5.25 2305 1709 A 149 GLU HBx A 150 GLY HAx 1.0 1.8 4.92 2306 1709 A 149 GLU HBy A 150 GLY HAx 1.0 1.8 4.92 2307 1709 A 150 GLY HAy A 149 GLU HBx 1.0 1.8 4.92 2308 1709 A 149 GLU HBy A 150 GLY HAy 1.0 1.8 4.92 2309 1710 A 150 GLY H A 149 GLU HBx 1.0 1.8 4.00 2310 1710 A 149 GLU HBy A 150 GLY H 1.0 1.8 4.00 2311 1711 A 150 GLY H A 149 GLU HGx 1.0 1.8 4.96 2312 1711 A 149 GLU HGy A 150 GLY H 1.0 1.8 4.96 2313 1712 A 149 GLU H A 149 GLU HBx 1.0 1.8 3.75 2314 1712 A 149 GLU HBy A 149 GLU H 1.0 1.8 3.75 2315 1713 A 149 GLU H A 149 GLU HGx 1.0 1.8 4.51 2316 1713 A 149 GLU H A 149 GLU HGy 1.0 1.8 4.51 2317 1714 A 149 GLU H A 150 GLY H 1.0 1.8 4.25 2318 1715 A 150 GLY H A 151 ILE H 1.0 1.8 4.14 2319 1716 A 151 ILE HA A 151 ILE HD1% 1.0 1.8 4.27 2320 1717 A 154 ALA HB% A 151 ILE HA 1.0 1.8 3.84 2321 1718 A 151 ILE HA A 154 ALA H 1.0 1.8 4.99 2322 1719 A 152 THR H A 151 ILE HB 1.0 1.8 4.44 2323 1720 A 151 ILE HG2% A 151 ILE HG1x 1.0 1.8 3.55 2324 1720 A 151 ILE HG2% A 151 ILE HG1y 1.0 1.8 3.55 2325 1721 A 152 THR H A 151 ILE HG2% 1.0 1.8 4.05 2326 1722 A 151 ILE H A 151 ILE HD1% 1.0 1.8 5.04 2327 1723 A 151 ILE H A 151 ILE HG1x 1.0 1.8 4.48 2328 1723 A 151 ILE H A 151 ILE HG1y 1.0 1.8 4.48 2329 1724 A 151 ILE H A 151 ILE HG2% 1.0 1.8 4.18 2330 1725 A 152 THR H A 151 ILE H 1.0 1.8 4.42 2331 1726 A 152 THR HG2% A 152 THR HA 1.0 1.8 3.38 2332 1727 A 152 THR HB A 153 MET H 1.0 1.8 4.13 2333 1728 A 152 THR HG2% A 153 MET H 1.0 1.8 4.83 2334 1729 A 152 THR HB A 152 THR H 1.0 1.8 4.06 2335 1730 A 152 THR HG2% A 152 THR H 1.0 1.8 4.17 2336 1731 A 152 THR H A 153 MET H 1.0 1.8 4.42 2337 1732 A 153 MET HA A 153 MET HGx 1.0 1.8 3.66 2338 1732 A 153 MET HA A 153 MET HGy 1.0 1.8 3.66 2339 1733 A 153 MET HA A 156 GLU HBy 1.0 1.8 4.75 2340 1734 A 153 MET HA A 156 GLU HBx 1.0 1.8 4.11 2341 1735 A 153 MET HA A 156 GLU H 1.0 1.8 4.72 2342 1736 A 153 MET HA A 157 ASN H 1.0 1.8 4.98 2343 1737 A 154 ALA H A 153 MET HBy 1.0 1.8 4.79 2344 1738 A 154 ALA H A 153 MET HBx 1.0 1.8 4.79 2345 1739 A 153 MET H A 153 MET HBy 1.0 1.8 3.86 2346 1739 A 153 MET H A 153 MET HBx 1.0 1.8 3.86 2347 1740 A 153 MET H A 153 MET HGx 1.0 1.8 4.02 2348 1740 A 153 MET H A 153 MET HGy 1.0 1.8 4.02 2349 1741 A 153 MET H A 154 ALA H 1.0 1.8 4.41 2350 1742 A 157 ASN HBy A 154 ALA HA 1.0 1.8 5.40 2351 1743 A 154 ALA HA A 157 ASN HBx 1.0 1.8 5.40 2352 1744 A 154 ALA HA A 157 ASN HD21 1.0 1.8 4.45 2353 1744 A 154 ALA HA A 157 ASN HD22 1.0 1.8 4.45 2354 1745 A 154 ALA HB% A 155 MET H 1.0 1.8 4.08 2355 1746 A 154 ALA HB% A 154 ALA H 1.0 1.8 3.51 2356 1747 A 154 ALA H A 155 MET H 1.0 1.8 4.44 2357 1748 A 155 MET HA A 158 LEU HBx 1.0 1.8 4.75 2358 1748 A 155 MET HA A 158 LEU HBy 1.0 1.8 4.75 2359 1749 A 155 MET HA A 158 LEU HD2% 1.0 1.8 5.25 2360 1750 A 155 MET HA A 158 LEU H 1.0 1.8 4.59 2361 1751 A 155 MET HA A 159 ASP H 1.0 1.8 5.26 2362 1752 A 156 GLU H A 155 MET HBx 1.0 1.8 4.30 2363 1752 A 156 GLU H A 155 MET HBy 1.0 1.8 4.30 2364 1753 A 156 GLU HA A 155 MET HGx 1.0 1.8 4.41 2365 1753 A 155 MET HGy A 156 GLU HA 1.0 1.8 4.41 2366 1754 A 156 GLU H A 155 MET HGx 1.0 1.8 3.92 2367 1754 A 156 GLU H A 155 MET HGy 1.0 1.8 3.92 2368 1755 A 155 MET H A 155 MET HGx 1.0 1.8 4.30 2369 1755 A 155 MET H A 155 MET HGy 1.0 1.8 4.30 2370 1756 A 156 GLU H A 155 MET H 1.0 1.8 4.35 2371 1757 A 156 GLU HA A 156 GLU HGx 1.0 1.8 3.85 2372 1757 A 156 GLU HA A 156 GLU HGy 1.0 1.8 3.85 2373 1758 A 156 GLU HA A 159 ASP HBy 1.0 1.8 4.76 2374 1759 A 156 GLU HA A 159 ASP HBx 1.0 1.8 4.76 2375 1760 A 159 ASP H A 156 GLU HA 1.0 1.8 4.81 2376 1761 A 157 ASN H A 156 GLU HBx 1.0 1.8 3.69 2377 1761 A 157 ASN H A 156 GLU HBy 1.0 1.8 3.69 2378 1762 A 156 GLU H A 156 GLU HBx 1.0 1.8 3.47 2379 1762 A 156 GLU H A 156 GLU HBy 1.0 1.8 3.47 2380 1763 A 156 GLU H A 156 GLU HGx 1.0 1.8 4.59 2381 1763 A 156 GLU H A 156 GLU HGy 1.0 1.8 4.59 2382 1764 A 156 GLU H A 157 ASN H 1.0 1.8 3.75 2383 1765 A 157 ASN HA A 157 ASN HD21 1.0 1.8 5.30 2384 1765 A 157 ASN HD22 A 157 ASN HA 1.0 1.8 5.30 2385 1766 A 157 ASN HA A 160 GLU HBx 1.0 1.8 4.07 2386 1766 A 157 ASN HA A 160 GLU HBy 1.0 1.8 4.07 2387 1767 A 157 ASN HA A 160 GLU HGx 1.0 1.8 5.10 2388 1767 A 157 ASN HA A 160 GLU HGy 1.0 1.8 5.10 2389 1768 A 157 ASN HA A 160 GLU H 1.0 1.8 4.68 2390 1769 A 158 LEU H A 157 ASN HBy 1.0 1.8 4.59 2391 1770 A 158 LEU H A 157 ASN HBx 1.0 1.8 4.59 2392 1771 A 158 LEU H A 157 ASN H 1.0 1.8 3.71 2393 1772 A 158 LEU HD1% A 158 LEU HA 1.0 1.8 3.50 2394 1773 A 158 LEU HD2% A 158 LEU HA 1.0 1.8 4.74 2395 1774 A 158 LEU HA A 158 LEU HG 1.0 1.8 4.25 2396 1775 A 158 LEU HA A 161 LEU HBx 1.0 1.8 3.92 2397 1775 A 158 LEU HA A 161 LEU HBy 1.0 1.8 3.92 2398 1776 A 161 LEU HD2% A 158 LEU HA 1.0 1.8 5.25 2399 1777 A 158 LEU HA A 161 LEU H 1.0 1.8 4.31 2400 1778 A 158 LEU HA A 162 LEU H 1.0 1.8 5.05 2401 1779 A 158 LEU HD1% A 158 LEU HBx 1.0 1.8 4.35 2402 1779 A 158 LEU HD1% A 158 LEU HBy 1.0 1.8 4.35 2403 1780 A 158 LEU HD2% A 158 LEU HBx 1.0 1.8 3.89 2404 1780 A 158 LEU HD2% A 158 LEU HBy 1.0 1.8 3.89 2405 1781 A 159 ASP H A 158 LEU HBx 1.0 1.8 4.17 2406 1781 A 158 LEU HBy A 159 ASP H 1.0 1.8 4.17 2407 1782 A 158 LEU HD1% A 159 ASP H 1.0 1.8 4.96 2408 1783 A 158 LEU HD1% A 161 LEU HBx 1.0 1.8 3.64 2409 1783 A 158 LEU HD1% A 161 LEU HBy 1.0 1.8 3.64 2410 1784 A 158 LEU HD1% A 161 LEU H 1.0 1.8 4.77 2411 1785 A 162 LEU HD1% A 158 LEU HD1% 1.0 1.8 4.20 2412 1786 A 162 LEU HD2% A 158 LEU HD1% 1.0 1.8 3.69 2413 1787 A 162 LEU HG A 158 LEU HD1% 1.0 1.8 3.87 2414 1788 A 158 LEU HD1% A 162 LEU H 1.0 1.8 4.40 2415 1789 A 158 LEU HD2% A 159 ASP H 1.0 1.8 5.15 2416 1790 A 162 LEU HD1% A 158 LEU HD2% 1.0 1.8 4.47 2417 1791 A 158 LEU HD2% A 162 LEU HD2% 1.0 1.8 4.80 2418 1792 A 158 LEU HD2% A 162 LEU HG 1.0 1.8 5.06 2419 1793 A 159 ASP H A 158 LEU HG 1.0 1.8 4.53 2420 1794 A 158 LEU HD1% A 158 LEU H 1.0 1.8 4.73 2421 1795 A 158 LEU HD2% A 158 LEU H 1.0 1.8 4.92 2422 1796 A 158 LEU H A 158 LEU HG 1.0 1.8 5.20 2423 1797 A 158 LEU H A 159 ASP H 1.0 1.8 3.96 2424 1798 A 159 ASP HA A 162 LEU HBy 1.0 1.8 4.64 2425 1798 A 159 ASP HA A 162 LEU HBx 1.0 1.8 4.64 2426 1799 A 162 LEU HD1% A 159 ASP HA 1.0 1.8 4.15 2427 1800 A 162 LEU HG A 159 ASP HA 1.0 1.8 5.16 2428 1801 A 162 LEU H A 159 ASP HA 1.0 1.8 5.17 2429 1802 A 159 ASP HA A 163 VAL H 1.0 1.8 4.93 2430 1803 A 159 ASP HBy A 160 GLU H 1.0 1.8 4.39 2431 1804 A 159 ASP HBx A 160 GLU H 1.0 1.8 4.39 2432 1805 A 159 ASP H A 159 ASP HBy 1.0 1.8 4.02 2433 1806 A 159 ASP H A 159 ASP HBx 1.0 1.8 4.02 2434 1807 A 159 ASP H A 160 GLU H 1.0 1.8 3.94 2435 1808 A 160 GLU HA A 160 GLU HGx 1.0 1.8 3.41 2436 1808 A 160 GLU HGy A 160 GLU HA 1.0 1.8 3.41 2437 1809 A 160 GLU HA A 163 VAL HB 1.0 1.8 3.94 2438 1810 A 160 GLU HA A 163 VAL HG1% 1.0 1.8 4.62 2439 1811 A 160 GLU HA A 163 VAL HG2% 1.0 1.8 3.89 2440 1812 A 163 VAL H A 160 GLU HA 1.0 1.8 4.28 2441 1813 A 160 GLU HA A 164 SER H 1.0 1.8 5.46 2442 1814 A 160 GLU HBx A 161 LEU HBx 1.0 1.8 5.10 2443 1814 A 160 GLU HBy A 161 LEU HBx 1.0 1.8 5.10 2444 1814 A 161 LEU HBy A 160 GLU HBx 1.0 1.8 5.10 2445 1814 A 160 GLU HBy A 161 LEU HBy 1.0 1.8 5.10 2446 1815 A 161 LEU H A 160 GLU HBx 1.0 1.8 3.67 2447 1815 A 160 GLU HBy A 161 LEU H 1.0 1.8 3.67 2448 1816 A 161 LEU H A 160 GLU HGx 1.0 1.8 4.63 2449 1816 A 160 GLU HGy A 161 LEU H 1.0 1.8 4.63 2450 1817 A 163 VAL HG2% A 160 GLU HGx 1.0 1.8 5.19 2451 1817 A 160 GLU HGy A 163 VAL HG2% 1.0 1.8 5.19 2452 1818 A 160 GLU H A 160 GLU HBx 1.0 1.8 3.19 2453 1818 A 160 GLU HBy A 160 GLU H 1.0 1.8 3.19 2454 1819 A 160 GLU H A 161 LEU H 1.0 1.8 3.71 2455 1820 A 161 LEU HD1% A 161 LEU HA 1.0 1.8 3.75 2456 1821 A 161 LEU HD2% A 161 LEU HA 1.0 1.8 4.25 2457 1822 A 161 LEU HA A 161 LEU HG 1.0 1.8 3.47 2458 1823 A 161 LEU HA A 164 SER HBx 1.0 1.8 4.10 2459 1823 A 161 LEU HA A 164 SER HBy 1.0 1.8 4.10 2460 1824 A 164 SER H A 161 LEU HA 1.0 1.8 4.49 2461 1825 A 161 LEU HA A 165 GLY H 1.0 1.8 5.32 2462 1826 A 161 LEU HD1% A 161 LEU HBx 1.0 1.8 3.42 2463 1826 A 161 LEU HD1% A 161 LEU HBy 1.0 1.8 3.42 2464 1827 A 161 LEU HD2% A 161 LEU HBx 1.0 1.8 3.09 2465 1827 A 161 LEU HD2% A 161 LEU HBy 1.0 1.8 3.09 2466 1828 A 162 LEU H A 161 LEU HBx 1.0 1.8 3.56 2467 1828 A 161 LEU HBy A 162 LEU H 1.0 1.8 3.56 2468 1829 A 161 LEU HD1% A 162 LEU H 1.0 1.8 5.26 2469 1830 A 161 LEU HD2% A 162 LEU H 1.0 1.8 4.95 2470 1831 A 162 LEU H A 161 LEU HG 1.0 1.8 5.37 2471 1832 A 161 LEU H A 161 LEU HBx 1.0 1.8 3.22 2472 1832 A 161 LEU HBy A 161 LEU H 1.0 1.8 3.22 2473 1833 A 161 LEU HD1% A 161 LEU H 1.0 1.8 4.22 2474 1834 A 161 LEU HD2% A 161 LEU H 1.0 1.8 4.98 2475 1835 A 161 LEU H A 161 LEU HG 1.0 1.8 4.60 2476 1836 A 161 LEU H A 162 LEU H 1.0 1.8 3.71 2477 1837 A 162 LEU HD1% A 162 LEU HA 1.0 1.8 4.30 2478 1838 A 162 LEU HD2% A 162 LEU HA 1.0 1.8 3.19 2479 1839 A 162 LEU HA A 162 LEU HG 1.0 1.8 4.19 2480 1840 A 162 LEU HD2% A 162 LEU HBy 1.0 1.8 3.34 2481 1840 A 162 LEU HD2% A 162 LEU HBx 1.0 1.8 3.34 2482 1841 A 163 VAL H A 162 LEU HBy 1.0 1.8 3.78 2483 1841 A 162 LEU HBx A 163 VAL H 1.0 1.8 3.78 2484 1842 A 162 LEU HD1% A 162 LEU HBy 1.0 1.8 3.94 2485 1843 A 162 LEU HD1% A 162 LEU HBx 1.0 1.8 3.94 2486 1844 A 162 LEU HD1% A 163 VAL H 1.0 1.8 5.03 2487 1845 A 162 LEU HD2% A 163 VAL H 1.0 1.8 5.27 2488 1846 A 162 LEU HG A 163 VAL H 1.0 1.8 5.78 2489 1847 A 162 LEU H A 162 LEU HBy 1.0 1.8 3.44 2490 1847 A 162 LEU H A 162 LEU HBx 1.0 1.8 3.44 2491 1848 A 162 LEU HD1% A 162 LEU H 1.0 1.8 3.94 2492 1849 A 162 LEU HD2% A 162 LEU H 1.0 1.8 4.23 2493 1850 A 162 LEU HG A 162 LEU H 1.0 1.8 3.78 2494 1851 A 162 LEU H A 163 VAL H 1.0 1.8 3.66 2495 1852 A 163 VAL HG1% A 163 VAL HA 1.0 1.8 3.27 2496 1853 A 163 VAL HG2% A 163 VAL HA 1.0 1.8 3.07 2497 1854 A 163 VAL HA A 166 LYS HBx 1.0 1.8 4.66 2498 1854 A 163 VAL HA A 166 LYS HBy 1.0 1.8 4.66 2499 1855 A 163 VAL HA A 166 LYS H 1.0 1.8 4.95 2500 1856 A 163 VAL HB A 164 SER H 1.0 1.8 3.81 2501 1857 A 163 VAL HG1% A 164 SER HA 1.0 1.8 4.49 2502 1858 A 163 VAL HG1% A 164 SER H 1.0 1.8 3.97 2503 1859 A 163 VAL HG2% A 164 SER H 1.0 1.8 4.28 2504 1860 A 163 VAL H A 163 VAL HB 1.0 1.8 3.34 2505 1861 A 163 VAL H A 163 VAL HG1% 1.0 1.8 4.15 2506 1862 A 163 VAL H A 163 VAL HG2% 1.0 1.8 3.28 2507 1863 A 163 VAL H A 164 SER H 1.0 1.8 3.40 2508 1864 A 165 GLY H A 164 SER HBx 1.0 1.8 4.05 2509 1864 A 164 SER HBy A 165 GLY H 1.0 1.8 4.05 2510 1865 A 164 SER H A 164 SER HBx 1.0 1.8 3.36 2511 1865 A 164 SER H A 164 SER HBy 1.0 1.8 3.36 2512 1866 A 164 SER H A 165 GLY H 1.0 1.8 4.48 2513 1867 A 165 GLY H A 166 LYS H 1.0 1.8 4.62 2514 1868 A 166 LYS HA A 166 LYS HGx 1.0 1.8 3.76 2515 1868 A 166 LYS HA A 166 LYS HGy 1.0 1.8 3.76 2516 1869 A 166 LYS HA A 167 LYS H 1.0 1.8 3.58 2517 1870 A 166 LYS HBy A 166 LYS HDx 1.0 1.8 3.00 2518 1870 A 166 LYS HBx A 166 LYS HDx 1.0 1.8 3.00 2519 1870 A 166 LYS HDy A 166 LYS HBx 1.0 1.8 3.00 2520 1870 A 166 LYS HBy A 166 LYS HDy 1.0 1.8 3.00 2521 1871 A 167 LYS H A 166 LYS HBx 1.0 1.8 4.52 2522 1871 A 166 LYS HBy A 167 LYS H 1.0 1.8 4.52 2523 1872 A 167 LYS H A 166 LYS HGx 1.0 1.8 5.18 2524 1872 A 166 LYS HGy A 167 LYS H 1.0 1.8 5.18 2525 1873 A 166 LYS H A 166 LYS HBx 1.0 1.8 3.64 2526 1873 A 166 LYS HBy A 166 LYS H 1.0 1.8 3.64 2527 1874 A 166 LYS H A 166 LYS HGx 1.0 1.8 4.47 2528 1874 A 166 LYS H A 166 LYS HGy 1.0 1.8 4.47 2529 1875 A 167 LYS HA A 167 LYS HDx 1.0 1.8 4.56 2530 1875 A 167 LYS HA A 167 LYS HDy 1.0 1.8 4.56 2531 1876 A 167 LYS HA A 168 LEU H 1.0 1.8 3.48 2532 1877 A 167 LYS HBx A 167 LYS HDx 1.0 1.8 2.86 2533 1877 A 167 LYS HBy A 167 LYS HDx 1.0 1.8 2.86 2534 1877 A 167 LYS HDy A 167 LYS HBx 1.0 1.8 2.86 2535 1877 A 167 LYS HDy A 167 LYS HBy 1.0 1.8 2.86 2536 1878 A 168 LEU H A 167 LYS HBx 1.0 1.8 4.08 2537 1878 A 168 LEU H A 167 LYS HBy 1.0 1.8 4.08 2538 1879 A 168 LEU H A 167 LYS HGx 1.0 1.8 5.00 2539 1879 A 168 LEU H A 167 LYS HGy 1.0 1.8 5.00 2540 1880 A 167 LYS H A 167 LYS HDx 1.0 1.8 5.49 2541 1880 A 167 LYS H A 167 LYS HDy 1.0 1.8 5.49 2542 1881 A 167 LYS H A 167 LYS HGx 1.0 1.8 5.46 2543 1881 A 167 LYS H A 167 LYS HGy 1.0 1.8 5.46 2544 1882 A 168 LEU HA A 168 LEU HD2% 1.0 1.8 3.73 2545 1882 A 168 LEU HA A 168 LEU HD1% 1.0 1.8 3.73 2546 1883 A 168 LEU HA A 168 LEU HD1% 1.0 1.8 4.51 2547 1884 A 168 LEU HA A 168 LEU HD2% 1.0 1.8 4.51 2548 1885 A 168 LEU HA A 169 GLU H 1.0 1.8 3.55 2549 1886 A 168 LEU HBy A 168 LEU HD2% 1.0 1.8 2.80 2550 1886 A 168 LEU HBx A 168 LEU HD2% 1.0 1.8 2.80 2551 1886 A 168 LEU HD1% A 168 LEU HBy 1.0 1.8 2.80 2552 1886 A 168 LEU HD1% A 168 LEU HBx 1.0 1.8 2.80 2553 1887 A 169 GLU H A 168 LEU HBy 1.0 1.8 4.46 2554 1887 A 169 GLU H A 168 LEU HBx 1.0 1.8 4.46 2555 1888 A 168 LEU HD1% A 168 LEU HBy 1.0 1.8 3.60 2556 1889 A 168 LEU HBy A 168 LEU HD2% 1.0 1.8 3.60 2557 1890 A 168 LEU HD1% A 168 LEU HBx 1.0 1.8 3.60 2558 1891 A 168 LEU HBx A 168 LEU HD2% 1.0 1.8 3.60 2559 1892 A 169 GLU H A 168 LEU HD2% 1.0 1.8 4.98 2560 1892 A 168 LEU HD1% A 169 GLU H 1.0 1.8 4.98 2561 1893 A 169 GLU H A 168 LEU HG 1.0 1.8 5.72 2562 1894 A 168 LEU H A 168 LEU HBy 1.0 1.8 3.38 2563 1894 A 168 LEU H A 168 LEU HBx 1.0 1.8 3.38 2564 1895 A 168 LEU H A 168 LEU HD2% 1.0 1.8 4.05 2565 1895 A 168 LEU H A 168 LEU HD1% 1.0 1.8 4.05 2566 1896 A 168 LEU H A 168 LEU HD1% 1.0 1.8 4.85 2567 1897 A 168 LEU H A 168 LEU HD2% 1.0 1.8 4.80 2568 1898 A 169 GLU HA A 169 GLU HGx 1.0 1.8 3.81 2569 1898 A 169 GLU HA A 169 GLU HGy 1.0 1.8 3.81 2570 1899 A 169 GLU H A 169 GLU HBx 1.0 1.8 3.51 2571 1899 A 169 GLU H A 169 GLU HBy 1.0 1.8 3.51 2572 1900 A 169 GLU H A 169 GLU HGy 1.0 1.8 4.85 2573 1901 A 169 GLU H A 169 GLU HGx 1.0 1.8 4.85 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 23 GLU H A 6 ALA O 1.0 1.7 2.3 2 2 A 6 ALA O A 23 GLU N 1.0 2.7 3.3 3 3 A 21 LYS H A 8 ASP O 1.0 1.7 2.3 4 4 A 8 ASP O A 21 LYS N 1.0 2.7 3.3 5 5 A 19 THR H A 10 SER O 1.0 1.7 2.3 6 6 A 10 SER O A 19 THR N 1.0 2.7 3.3 7 7 A 17 THR H A 12 ASN O 1.0 1.7 2.3 8 8 A 12 ASN O A 17 THR N 1.0 2.7 3.3 9 9 A 16 LYS H A 13 LYS O 1.0 1.7 2.3 10 10 A 13 LYS O A 16 LYS N 1.0 2.7 3.3 11 11 A 12 ASN H A 17 THR O 1.0 1.7 2.3 12 12 A 17 THR O A 12 ASN N 1.0 2.7 3.3 13 13 A 131 ILE H A 18 ILE O 1.0 1.7 2.3 14 14 A 18 ILE O A 131 ILE N 1.0 2.7 3.3 15 15 A 10 SER H A 19 THR O 1.0 1.7 2.3 16 16 A 19 THR O A 10 SER N 1.0 2.7 3.3 17 17 A 129 TYR H A 20 ILE O 1.0 1.7 2.3 18 18 A 20 ILE O A 129 TYR N 1.0 2.7 3.3 19 19 A 8 ASP H A 21 LYS O 1.0 1.7 2.3 20 20 A 21 LYS O A 8 ASP N 1.0 2.7 3.3 21 21 A 127 VAL H A 22 ARG O 1.0 1.7 2.3 22 22 A 22 ARG O A 127 VAL N 1.0 2.7 3.3 23 23 A 6 ALA H A 23 GLU O 1.0 1.7 2.3 24 24 A 23 GLU O A 6 ALA N 1.0 2.7 3.3 25 25 A 125 THR H A 24 PHE O 1.0 1.7 2.3 26 26 A 24 PHE O A 125 THR N 1.0 2.7 3.3 27 27 A 31 VAL H A 27 VAL O 1.0 1.7 2.3 28 28 A 27 VAL O A 31 VAL N 1.0 2.7 3.3 29 29 A 32 TRP H A 28 ARG O 1.0 1.7 2.3 30 30 A 28 ARG O A 32 TRP N 1.0 2.7 3.3 31 31 A 33 GLU H A 29 ALA O 1.0 1.7 2.3 32 32 A 29 ALA O A 33 GLU N 1.0 2.7 3.3 33 33 A 34 ALA H A 30 ILE O 1.0 1.7 2.3 34 34 A 30 ILE O A 34 ALA N 1.0 2.7 3.3 35 35 A 36 THR H A 32 TRP O 1.0 1.7 2.3 36 36 A 32 TRP O A 36 THR N 1.0 2.7 3.3 37 37 A 41 LEU H A 37 ARG O 1.0 1.7 2.3 38 38 A 37 ARG O A 41 LEU N 1.0 2.7 3.3 39 39 A 42 ASP H A 38 ALA O 1.0 1.7 2.3 40 40 A 38 ALA O A 42 ASP N 1.0 2.7 3.3 41 41 A 43 GLN H A 39 GLU O 1.0 1.7 2.3 42 42 A 39 GLU O A 43 GLN N 1.0 2.7 3.3 43 43 A 70 VAL H A 51 LYS O 1.0 1.7 2.3 44 44 A 51 LYS O A 70 VAL N 1.0 2.7 3.3 45 45 A 68 ALA H A 53 LYS O 1.0 1.7 2.3 46 46 A 53 LYS O A 68 ALA N 1.0 2.7 3.3 47 47 A 83 TYR H A 63 GLY O 1.0 1.7 2.3 48 48 A 63 GLY O A 83 TYR N 1.0 2.7 3.3 49 49 A 81 CYS H A 65 TRP O 1.0 1.7 2.3 50 50 A 65 TRP O A 81 CYS N 1.0 2.7 3.3 51 51 A 55 LYS H A 66 LEU O 1.0 1.7 2.3 52 52 A 66 LEU O A 55 LYS N 1.0 2.7 3.3 53 53 A 79 SER H A 67 TYR O 1.0 1.7 2.3 54 54 A 67 TYR O A 79 SER N 1.0 2.7 3.3 55 55 A 53 LYS H A 68 ALA O 1.0 1.7 2.3 56 56 A 68 ALA O A 53 LYS N 1.0 2.7 3.3 57 57 A 77 HIS H A 69 MET O 1.0 1.7 2.3 58 58 A 69 MET O A 77 HIS N 1.0 2.7 3.3 59 59 A 51 LYS H A 70 VAL O 1.0 1.7 2.3 60 60 A 70 VAL O A 51 LYS N 1.0 2.7 3.3 61 61 A 71 GLY H A 75 GLU O 1.0 1.7 2.3 62 62 A 75 GLU O A 71 GLY N 1.0 2.7 3.3 63 63 A 69 MET H A 77 HIS O 1.0 1.7 2.3 64 64 A 77 HIS O A 69 MET N 1.0 2.7 3.3 65 65 A 67 TYR H A 79 SER O 1.0 1.7 2.3 66 66 A 79 SER O A 67 TYR N 1.0 2.7 3.3 67 67 A 97 GLY H A 80 ILE O 1.0 1.7 2.3 68 68 A 80 ILE O A 97 GLY N 1.0 2.7 3.3 69 69 A 65 TRP H A 81 CYS O 1.0 1.7 2.3 70 70 A 81 CYS O A 65 TRP N 1.0 2.7 3.3 71 71 A 95 LYS H A 82 GLU O 1.0 1.7 2.3 72 72 A 82 GLU O A 95 LYS N 1.0 2.7 3.3 73 73 A 116 MET H A 92 PHE O 1.0 1.7 2.3 74 74 A 92 PHE O A 116 MET N 1.0 2.7 3.3 75 75 A 82 GLU H A 95 LYS O 1.0 1.7 2.3 76 76 A 95 LYS O A 82 GLU N 1.0 2.7 3.3 77 77 A 112 SER H A 96 ASP O 1.0 1.7 2.3 78 78 A 96 ASP O A 112 SER N 1.0 2.7 3.3 79 79 A 80 ILE H A 97 GLY O 1.0 1.7 2.3 80 80 A 97 GLY O A 80 ILE N 1.0 2.7 3.3 81 81 A 96 ASP H A 112 SER O 1.0 1.7 2.3 82 82 A 112 SER O A 96 ASP N 1.0 2.7 3.3 83 83 A 132 SER H A 113 ASN O 1.0 1.7 2.3 84 84 A 113 ASN O A 132 SER N 1.0 2.7 3.3 85 85 A 130 HIS H A 115 ASP O 1.0 1.7 2.3 86 86 A 115 ASP O A 130 HIS N 1.0 2.7 3.3 87 87 A 92 PHE H A 116 MET O 1.0 1.7 2.3 88 88 A 116 MET O A 92 PHE N 1.0 2.7 3.3 89 89 A 128 GLN H A 117 ARG O 1.0 1.7 2.3 90 90 A 117 ARG O A 128 GLN N 1.0 2.7 3.3 91 91 A 126 GLU H A 119 ILE O 1.0 1.7 2.3 92 92 A 119 ILE O A 126 GLU N 1.0 2.7 3.3 93 93 A 124 ILE H A 121 LYS O 1.0 1.7 2.3 94 94 A 121 LYS O A 124 ILE N 1.0 2.7 3.3 95 95 A 121 LYS H A 124 ILE O 1.0 1.7 2.3 96 96 A 124 ILE O A 121 LYS N 1.0 2.7 3.3 97 97 A 24 PHE H A 125 THR O 1.0 1.7 2.3 98 98 A 125 THR O A 24 PHE N 1.0 2.7 3.3 99 99 A 119 ILE H A 126 GLU O 1.0 1.7 2.3 100 100 A 126 GLU O A 119 ILE N 1.0 2.7 3.3 101 101 A 22 ARG H A 127 VAL O 1.0 1.7 2.3 102 102 A 127 VAL O A 22 ARG N 1.0 2.7 3.3 103 103 A 117 ARG H A 128 GLN O 1.0 1.7 2.3 104 104 A 128 GLN O A 117 ARG N 1.0 2.7 3.3 105 105 A 20 ILE H A 129 TYR O 1.0 1.7 2.3 106 106 A 129 TYR O A 20 ILE N 1.0 2.7 3.3 107 107 A 115 ASP H A 130 HIS O 1.0 1.7 2.3 108 108 A 130 HIS O A 115 ASP N 1.0 2.7 3.3 109 109 A 18 ILE H A 131 ILE O 1.0 1.7 2.3 110 110 A 131 ILE O A 18 ILE N 1.0 2.7 3.3 111 111 A 139 LEU H A 135 ASP O 1.0 1.7 2.3 112 112 A 135 ASP O A 139 LEU N 1.0 2.7 3.3 113 113 A 140 GLU H A 136 VAL O 1.0 1.7 2.3 114 114 A 136 VAL O A 140 GLU N 1.0 2.7 3.3 115 115 A 141 ALA H A 137 ALA O 1.0 1.7 2.3 116 116 A 137 ALA O A 141 ALA N 1.0 2.7 3.3 117 117 A 142 THR H A 138 GLN O 1.0 1.7 2.3 118 118 A 138 GLN O A 142 THR N 1.0 2.7 3.3 119 119 A 143 ILE H A 139 LEU O 1.0 1.7 2.3 120 120 A 139 LEU O A 143 ILE N 1.0 2.7 3.3 121 121 A 144 GLN H A 140 GLU O 1.0 1.7 2.3 122 122 A 140 GLU O A 144 GLN N 1.0 2.7 3.3 123 123 A 145 MET H A 141 ALA O 1.0 1.7 2.3 124 124 A 141 ALA O A 145 MET N 1.0 2.7 3.3 125 125 A 146 GLY H A 142 THR O 1.0 1.7 2.3 126 126 A 142 THR O A 146 GLY N 1.0 2.7 3.3 127 127 A 147 PHE H A 143 ILE O 1.0 1.7 2.3 128 128 A 143 ILE O A 147 PHE N 1.0 2.7 3.3 129 129 A 148 LYS H A 144 GLN O 1.0 1.7 2.3 130 130 A 144 GLN O A 148 LYS N 1.0 2.7 3.3 131 131 A 149 GLU H A 145 MET O 1.0 1.7 2.3 132 132 A 145 MET O A 149 GLU N 1.0 2.7 3.3 133 133 A 150 GLY H A 146 GLY O 1.0 1.7 2.3 134 134 A 146 GLY O A 150 GLY N 1.0 2.7 3.3 135 135 A 151 ILE H A 147 PHE O 1.0 1.7 2.3 136 136 A 147 PHE O A 151 ILE N 1.0 2.7 3.3 137 137 A 152 THR H A 148 LYS O 1.0 1.7 2.3 138 138 A 148 LYS O A 152 THR N 1.0 2.7 3.3 139 139 A 153 MET H A 149 GLU O 1.0 1.7 2.3 140 140 A 149 GLU O A 153 MET N 1.0 2.7 3.3 141 141 A 154 ALA H A 150 GLY O 1.0 1.7 2.3 142 142 A 150 GLY O A 154 ALA N 1.0 2.7 3.3 143 143 A 155 MET H A 151 ILE O 1.0 1.7 2.3 144 144 A 151 ILE O A 155 MET N 1.0 2.7 3.3 145 145 A 156 GLU H A 152 THR O 1.0 1.7 2.3 146 146 A 152 THR O A 156 GLU N 1.0 2.7 3.3 147 147 A 157 ASN H A 153 MET O 1.0 1.7 2.3 148 148 A 153 MET O A 157 ASN N 1.0 2.7 3.3 149 149 A 158 LEU H A 154 ALA O 1.0 1.7 2.3 150 150 A 154 ALA O A 158 LEU N 1.0 2.7 3.3 151 151 A 159 ASP H A 155 MET O 1.0 1.7 2.3 152 152 A 155 MET O A 159 ASP N 1.0 2.7 3.3 153 153 A 160 GLU H A 156 GLU O 1.0 1.7 2.3 154 154 A 156 GLU O A 160 GLU N 1.0 2.7 3.3 155 155 A 161 LEU H A 157 ASN O 1.0 1.7 2.3 156 156 A 157 ASN O A 161 LEU N 1.0 2.7 3.3 157 157 A 162 LEU H A 158 LEU O 1.0 1.7 2.3 158 158 A 158 LEU O A 162 LEU N 1.0 2.7 3.3 159 159 A 163 VAL H A 159 ASP O 1.0 1.7 2.3 160 160 A 159 ASP O A 163 VAL N 1.0 2.7 3.3 161 161 A 164 SER H A 160 GLU O 1.0 1.7 2.3 162 162 A 160 GLU O A 164 SER N 1.0 2.7 3.3 163 163 A 165 GLY H A 161 LEU O 1.0 1.7 2.3 164 164 A 161 LEU O A 165 GLY N 1.0 2.7 3.3 165 165 A 166 LYS H A 162 LEU O 1.0 1.7 2.3 166 166 A 162 LEU O A 166 LYS N 1.0 2.7 3.3 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 5 LEU C A 6 ALA N A 6 ALA CA A 6 ALA C 1.0 -158.5 -18.5 PHI 2 2 A 6 ALA N A 6 ALA CA A 6 ALA C A 7 LEU N 1.0 69.9 189.9 PSI 3 3 A 6 ALA C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -154.9 -80.5 PHI 4 4 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 ASP N 1.0 112.6 152.6 PSI 5 5 A 7 LEU C A 8 ASP N A 8 ASP CA A 8 ASP C 1.0 -162.3 -73.9 PHI 6 6 A 8 ASP N A 8 ASP CA A 8 ASP C A 9 PHE N 1.0 104.4 146.4 PSI 7 7 A 8 ASP C A 9 PHE N A 9 PHE CA A 9 PHE C 1.0 -144.6 -74.6 PHI 8 8 A 9 PHE N A 9 PHE CA A 9 PHE C A 10 SER N 1.0 107.6 147.6 PSI 9 9 A 9 PHE C A 10 SER N A 10 SER CA A 10 SER C 1.0 -146.9 -72.9 PHI 10 10 A 10 SER N A 10 SER CA A 10 SER C A 11 VAL N 1.0 103.9 143.9 PSI 11 11 A 10 SER C A 11 VAL N A 11 VAL CA A 11 VAL C 1.0 -135.0 -88.2 PHI 12 12 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 ASN N 1.0 108.5 148.5 PSI 13 13 A 11 VAL C A 12 ASN N A 12 ASN CA A 12 ASN C 1.0 -132.8 -68.4 PHI 14 14 A 12 ASN N A 12 ASN CA A 12 ASN C A 13 LYS N 1.0 48.3 170.3 PSI 15 15 A 16 LYS C A 17 THR N A 17 THR CA A 17 THR C 1.0 -156.2 -83.4 PHI 16 16 A 17 THR N A 17 THR CA A 17 THR C A 18 ILE N 1.0 127.4 180.2 PSI 17 17 A 17 THR C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -168.7 -96.5 PHI 18 18 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 THR N 1.0 103.5 147.7 PSI 19 19 A 18 ILE C A 19 THR N A 19 THR CA A 19 THR C 1.0 -140.5 -74.3 PHI 20 20 A 19 THR N A 19 THR CA A 19 THR C A 20 ILE N 1.0 105.4 145.4 PSI 21 21 A 19 THR C A 20 ILE N A 20 ILE CA A 20 ILE C 1.0 -139.6 -99.6 PHI 22 22 A 20 ILE N A 20 ILE CA A 20 ILE C A 21 LYS N 1.0 105.0 155.8 PSI 23 23 A 20 ILE C A 21 LYS N A 21 LYS CA A 21 LYS C 1.0 -142.4 -94.0 PHI 24 24 A 21 LYS N A 21 LYS CA A 21 LYS C A 22 ARG N 1.0 107.1 156.1 PSI 25 25 A 21 LYS C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -145.5 -101.1 PHI 26 26 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 GLU N 1.0 112.7 169.7 PSI 27 27 A 22 ARG C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -164.4 -97.6 PHI 28 28 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 PHE N 1.0 104.9 181.1 PSI 29 29 A 23 GLU C A 24 PHE N A 24 PHE CA A 24 PHE C 1.0 -202.8 -62.8 PHI 30 30 A 24 PHE N A 24 PHE CA A 24 PHE C A 25 ALA N 1.0 93.9 179.7 PSI 31 31 A 27 VAL C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -78.0 -38.0 PHI 32 32 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 ALA N 1.0 -63.4 -23.4 PSI 33 33 A 28 ARG C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -76.8 -36.8 PHI 34 34 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 ILE N 1.0 -63.1 -23.1 PSI 35 35 A 29 ALA C A 30 ILE N A 30 ILE CA A 30 ILE C 1.0 -87.4 -47.4 PHI 36 36 A 30 ILE N A 30 ILE CA A 30 ILE C A 31 VAL N 1.0 -60.7 -20.7 PSI 37 37 A 30 ILE C A 31 VAL N A 31 VAL CA A 31 VAL C 1.0 -83.3 -43.3 PHI 38 38 A 31 VAL N A 31 VAL CA A 31 VAL C A 32 TRP N 1.0 -65.2 -25.2 PSI 39 39 A 31 VAL C A 32 TRP N A 32 TRP CA A 32 TRP C 1.0 -79.2 -39.2 PHI 40 40 A 32 TRP N A 32 TRP CA A 32 TRP C A 33 GLU N 1.0 -60.5 -20.5 PSI 41 41 A 32 TRP C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -85.7 -45.7 PHI 42 42 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 ALA N 1.0 -58.1 -18.1 PSI 43 43 A 33 GLU C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 -92.7 -51.7 PHI 44 44 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 PHE N 1.0 -54.9 -9.3 PSI 45 45 A 34 ALA C A 35 PHE N A 35 PHE CA A 35 PHE C 1.0 -103.8 -50.4 PHI 46 46 A 35 PHE N A 35 PHE CA A 35 PHE C A 36 THR N 1.0 -58.1 -1.3 PSI 47 47 A 37 ARG C A 38 ALA N A 38 ALA CA A 38 ALA C 1.0 -78.1 -38.1 PHI 48 48 A 38 ALA N A 38 ALA CA A 38 ALA C A 39 GLU N 1.0 -58.5 -13.7 PSI 49 49 A 38 ALA C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -77.5 -37.5 PHI 50 50 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 ILE N 1.0 -65.7 -6.5 PSI 51 51 A 39 GLU C A 40 ILE N A 40 ILE CA A 40 ILE C 1.0 -89.2 -49.2 PHI 52 52 A 40 ILE N A 40 ILE CA A 40 ILE C A 41 LEU N 1.0 -57.5 -17.5 PSI 53 53 A 40 ILE C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -81.2 -41.2 PHI 54 54 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 ASP N 1.0 -67.7 -27.7 PSI 55 55 A 41 LEU C A 42 ASP N A 42 ASP CA A 42 ASP C 1.0 -84.0 -44.0 PHI 56 56 A 42 ASP N A 42 ASP CA A 42 ASP C A 43 GLN N 1.0 -69.1 -1.5 PSI 57 57 A 42 ASP C A 43 GLN N A 43 GLN CA A 43 GLN C 1.0 -94.0 -49.0 PHI 58 58 A 43 GLN N A 43 GLN CA A 43 GLN C A 44 TRP N 1.0 -49.0 -9.0 PSI 59 59 A 50 TRP C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -176.1 -85.5 PHI 60 60 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 ALA N 1.0 113.9 153.9 PSI 61 61 A 51 LYS C A 52 ALA N A 52 ALA CA A 52 ALA C 1.0 -129.8 -78.0 PHI 62 62 A 52 ALA N A 52 ALA CA A 52 ALA C A 53 LYS N 1.0 102.5 150.1 PSI 63 63 A 52 ALA C A 53 LYS N A 53 LYS CA A 53 LYS C 1.0 -152.8 -98.6 PHI 64 64 A 53 LYS N A 53 LYS CA A 53 LYS C A 54 THR N 1.0 107.5 147.5 PSI 65 65 A 53 LYS C A 54 THR N A 54 THR CA A 54 THR C 1.0 -138.5 1.5 PHI 66 66 A 54 THR N A 54 THR CA A 54 THR C A 55 LYS N 1.0 63.8 202.8 PSI 67 67 A 55 LYS C A 56 SER N A 56 SER CA A 56 SER C 1.0 -172.9 -131.1 PHI 68 68 A 56 SER N A 56 SER CA A 56 SER C A 57 MET N 1.0 122.0 162.0 PSI 69 69 A 56 SER C A 57 MET N A 57 MET CA A 57 MET C 1.0 -179.6 -79.4 PHI 70 70 A 57 MET N A 57 MET CA A 57 MET C A 58 ASP N 1.0 106.9 146.9 PSI 71 71 A 62 GLY C A 63 GLY N A 63 GLY CA A 63 GLY C 1.0 -158.8 -41.2 PHI 72 72 A 63 GLY N A 63 GLY CA A 63 GLY C A 64 THR N 1.0 94.9 207.3 PSI 73 73 A 63 GLY C A 64 THR N A 64 THR CA A 64 THR C 1.0 -151.0 -105.4 PHI 74 74 A 64 THR N A 64 THR CA A 64 THR C A 65 TRP N 1.0 126.7 166.7 PSI 75 75 A 64 THR C A 65 TRP N A 65 TRP CA A 65 TRP C 1.0 -162.3 -85.9 PHI 76 76 A 65 TRP N A 65 TRP CA A 65 TRP C A 66 LEU N 1.0 96.8 147.0 PSI 77 77 A 65 TRP C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -140.2 -83.0 PHI 78 78 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 TYR N 1.0 111.0 151.0 PSI 79 79 A 66 LEU C A 67 TYR N A 67 TYR CA A 67 TYR C 1.0 -185.4 -103.2 PHI 80 80 A 67 TYR N A 67 TYR CA A 67 TYR C A 68 ALA N 1.0 143.0 183.0 PSI 81 81 A 67 TYR C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -156.3 -74.3 PHI 82 82 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 MET N 1.0 121.1 168.1 PSI 83 83 A 68 ALA C A 69 MET N A 69 MET CA A 69 MET C 1.0 -151.3 -73.5 PHI 84 84 A 69 MET N A 69 MET CA A 69 MET C A 70 VAL N 1.0 93.3 160.3 PSI 85 85 A 69 MET C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -142.0 -77.6 PHI 86 86 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 GLY N 1.0 89.4 156.2 PSI 87 87 A 75 GLU C A 76 GLU N A 76 GLU CA A 76 GLU C 1.0 -142.2 -100.4 PHI 88 88 A 76 GLU N A 76 GLU CA A 76 GLU C A 77 HIS N 1.0 111.0 172.2 PSI 89 89 A 76 GLU C A 77 HIS N A 77 HIS CA A 77 HIS C 1.0 -141.3 -78.1 PHI 90 90 A 77 HIS N A 77 HIS CA A 77 HIS C A 78 TRP N 1.0 103.6 151.4 PSI 91 91 A 77 HIS C A 78 TRP N A 78 TRP CA A 78 TRP C 1.0 -153.2 -81.2 PHI 92 92 A 78 TRP N A 78 TRP CA A 78 TRP C A 79 SER N 1.0 112.8 152.8 PSI 93 93 A 78 TRP C A 79 SER N A 79 SER CA A 79 SER C 1.0 -164.8 -83.2 PHI 94 94 A 79 SER N A 79 SER CA A 79 SER C A 80 ILE N 1.0 136.1 176.1 PSI 95 95 A 79 SER C A 80 ILE N A 80 ILE CA A 80 ILE C 1.0 -156.6 -114.0 PHI 96 96 A 80 ILE N A 80 ILE CA A 80 ILE C A 81 CYS N 1.0 122.4 162.4 PSI 97 97 A 80 ILE C A 81 CYS N A 81 CYS CA A 81 CYS C 1.0 -148.3 -90.9 PHI 98 98 A 81 CYS N A 81 CYS CA A 81 CYS C A 82 GLU N 1.0 104.3 144.3 PSI 99 99 A 81 CYS C A 82 GLU N A 82 GLU CA A 82 GLU C 1.0 -141.7 -85.7 PHI 100 100 A 82 GLU N A 82 GLU CA A 82 GLU C A 83 TYR N 1.0 108.8 153.4 PSI 101 101 A 82 GLU C A 83 TYR N A 83 TYR CA A 83 TYR C 1.0 -112.9 -61.1 PHI 102 102 A 83 TYR N A 83 TYR CA A 83 TYR C A 84 ALA N 1.0 106.7 146.7 PSI 103 103 A 90 GLU C A 91 ARG N A 91 ARG CA A 91 ARG C 1.0 -161.2 -103.0 PHI 104 104 A 91 ARG N A 91 ARG CA A 91 ARG C A 92 PHE N 1.0 102.1 162.9 PSI 105 105 A 91 ARG C A 92 PHE N A 92 PHE CA A 92 PHE C 1.0 -170.3 -102.3 PHI 106 106 A 92 PHE N A 92 PHE CA A 92 PHE C A 93 THR N 1.0 108.8 182.0 PSI 107 107 A 92 PHE C A 93 THR N A 93 THR CA A 93 THR C 1.0 -166.0 -103.6 PHI 108 108 A 93 THR N A 93 THR CA A 93 THR C A 94 GLY N 1.0 120.7 182.1 PSI 109 109 A 93 THR C A 94 GLY N A 94 GLY CA A 94 GLY C 1.0 -195.3 -145.1 PHI 110 110 A 94 GLY N A 94 GLY CA A 94 GLY C A 95 LYS N 1.0 144.0 204.6 PSI 111 111 A 94 GLY C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -159.4 -99.0 PHI 112 112 A 95 LYS N A 95 LYS CA A 95 LYS C A 96 ASP N 1.0 117.8 157.8 PSI 113 113 A 95 LYS C A 96 ASP N A 96 ASP CA A 96 ASP C 1.0 -164.4 -84.0 PHI 114 114 A 96 ASP N A 96 ASP CA A 96 ASP C A 97 GLY N 1.0 111.4 167.8 PSI 115 115 A 96 ASP C A 97 GLY N A 97 GLY CA A 97 GLY C 1.0 -201.4 -118.0 PHI 116 116 A 97 GLY N A 97 GLY CA A 97 GLY C A 98 PHE N 1.0 140.4 185.0 PSI 117 117 A 97 GLY C A 98 PHE N A 98 PHE CA A 98 PHE C 1.0 -145.0 -67.8 PHI 118 118 A 98 PHE N A 98 PHE CA A 98 PHE C A 99 THR N 1.0 114.7 174.1 PSI 119 119 A 98 PHE C A 99 THR N A 99 THR CA A 99 THR C 1.0 -169.7 -96.1 PHI 120 120 A 99 THR N A 99 THR CA A 99 THR C A 100 ASP N 1.0 135.2 181.2 PSI 121 121 A 111 ARG C A 112 SER N A 112 SER CA A 112 SER C 1.0 -178.2 -106.0 PHI 122 122 A 112 SER N A 112 SER CA A 112 SER C A 113 ASN N 1.0 130.7 175.1 PSI 123 123 A 112 SER C A 113 ASN N A 113 ASN CA A 113 ASN C 1.0 -169.0 -71.8 PHI 124 124 A 113 ASN N A 113 ASN CA A 113 ASN C A 114 TRP N 1.0 96.8 175.6 PSI 125 125 A 113 ASN C A 114 TRP N A 114 TRP CA A 114 TRP C 1.0 -146.1 -68.9 PHI 126 126 A 114 TRP N A 114 TRP CA A 114 TRP C A 115 ASP N 1.0 101.1 163.7 PSI 127 127 A 114 TRP C A 115 ASP N A 115 ASP CA A 115 ASP C 1.0 -141.9 -72.7 PHI 128 128 A 115 ASP N A 115 ASP CA A 115 ASP C A 116 MET N 1.0 99.5 139.5 PSI 129 129 A 115 ASP C A 116 MET N A 116 MET CA A 116 MET C 1.0 -154.8 -78.0 PHI 130 130 A 116 MET N A 116 MET CA A 116 MET C A 117 ARG N 1.0 96.7 180.9 PSI 131 131 A 116 MET C A 117 ARG N A 117 ARG CA A 117 ARG C 1.0 -163.9 -97.1 PHI 132 132 A 117 ARG N A 117 ARG CA A 117 ARG C A 118 PHE N 1.0 117.6 178.8 PSI 133 133 A 117 ARG C A 118 PHE N A 118 PHE CA A 118 PHE C 1.0 -164.8 -82.2 PHI 134 134 A 118 PHE N A 118 PHE CA A 118 PHE C A 119 ILE N 1.0 99.4 140.0 PSI 135 135 A 118 PHE C A 119 ILE N A 119 ILE CA A 119 ILE C 1.0 -131.0 -91.0 PHI 136 136 A 119 ILE N A 119 ILE CA A 119 ILE C A 120 ASP N 1.0 101.2 145.8 PSI 137 137 A 119 ILE C A 120 ASP N A 120 ASP CA A 120 ASP C 1.0 -131.6 -54.2 PHI 138 138 A 120 ASP N A 120 ASP CA A 120 ASP C A 121 LYS N 1.0 91.3 149.9 PSI 139 139 A 120 ASP C A 121 LYS N A 121 LYS CA A 121 LYS C 1.0 -156.7 -59.7 PHI 140 140 A 121 LYS N A 121 LYS CA A 121 LYS C A 122 GLY N 1.0 59.8 162.0 PSI 141 141 A 123 GLU C A 124 ILE N A 124 ILE CA A 124 ILE C 1.0 -184.2 -88.0 PHI 142 142 A 124 ILE N A 124 ILE CA A 124 ILE C A 125 THR N 1.0 125.7 166.7 PSI 143 143 A 124 ILE C A 125 THR N A 125 THR CA A 125 THR C 1.0 -165.9 -75.7 PHI 144 144 A 125 THR N A 125 THR CA A 125 THR C A 126 GLU N 1.0 93.8 170.2 PSI 145 145 A 125 THR C A 126 GLU N A 126 GLU CA A 126 GLU C 1.0 -162.9 -82.1 PHI 146 146 A 126 GLU N A 126 GLU CA A 126 GLU C A 127 VAL N 1.0 106.9 148.1 PSI 147 147 A 126 GLU C A 127 VAL N A 127 VAL CA A 127 VAL C 1.0 -143.2 -91.6 PHI 148 148 A 127 VAL N A 127 VAL CA A 127 VAL C A 128 GLN N 1.0 109.5 152.1 PSI 149 149 A 127 VAL C A 128 GLN N A 128 GLN CA A 128 GLN C 1.0 -136.6 -88.8 PHI 150 150 A 128 GLN N A 128 GLN CA A 128 GLN C A 129 TYR N 1.0 101.0 156.2 PSI 151 151 A 128 GLN C A 129 TYR N A 129 TYR CA A 129 TYR C 1.0 -132.9 -92.9 PHI 152 152 A 129 TYR N A 129 TYR CA A 129 TYR C A 130 HIS N 1.0 103.5 148.5 PSI 153 153 A 129 TYR C A 130 HIS N A 130 HIS CA A 130 HIS C 1.0 -139.7 -94.9 PHI 154 154 A 130 HIS N A 130 HIS CA A 130 HIS C A 131 ILE N 1.0 102.2 142.2 PSI 155 155 A 130 HIS C A 131 ILE N A 131 ILE CA A 131 ILE C 1.0 -136.7 -96.7 PHI 156 156 A 131 ILE N A 131 ILE CA A 131 ILE C A 132 SER N 1.0 107.1 147.1 PSI 157 157 A 131 ILE C A 132 SER N A 132 SER CA A 132 SER C 1.0 -171.7 -84.1 PHI 158 158 A 132 SER N A 132 SER CA A 132 SER C A 133 TYR N 1.0 109.6 183.0 PSI 159 159 A 135 ASP C A 136 VAL N A 136 VAL CA A 136 VAL C 1.0 -85.2 -45.2 PHI 160 160 A 136 VAL N A 136 VAL CA A 136 VAL C A 137 ALA N 1.0 -55.8 -15.8 PSI 161 161 A 136 VAL C A 137 ALA N A 137 ALA CA A 137 ALA C 1.0 -79.9 -39.9 PHI 162 162 A 137 ALA N A 137 ALA CA A 137 ALA C A 138 GLN N 1.0 -62.4 -22.4 PSI 163 163 A 137 ALA C A 138 GLN N A 138 GLN CA A 138 GLN C 1.0 -86.1 -46.1 PHI 164 164 A 138 GLN N A 138 GLN CA A 138 GLN C A 139 LEU N 1.0 -59.6 -19.6 PSI 165 165 A 138 GLN C A 139 LEU N A 139 LEU CA A 139 LEU C 1.0 -85.7 -45.7 PHI 166 166 A 139 LEU N A 139 LEU CA A 139 LEU C A 140 GLU N 1.0 -64.1 -24.1 PSI 167 167 A 139 LEU C A 140 GLU N A 140 GLU CA A 140 GLU C 1.0 -80.9 -40.9 PHI 168 168 A 140 GLU N A 140 GLU CA A 140 GLU C A 141 ALA N 1.0 -62.1 -22.1 PSI 169 169 A 140 GLU C A 141 ALA N A 141 ALA CA A 141 ALA C 1.0 -86.0 -46.0 PHI 170 170 A 141 ALA N A 141 ALA CA A 141 ALA C A 142 THR N 1.0 -59.5 -10.1 PSI 171 171 A 141 ALA C A 142 THR N A 142 THR CA A 142 THR C 1.0 -85.5 -45.5 PHI 172 172 A 142 THR N A 142 THR CA A 142 THR C A 143 ILE N 1.0 -61.7 -21.7 PSI 173 173 A 142 THR C A 143 ILE N A 143 ILE CA A 143 ILE C 1.0 -84.6 -44.6 PHI 174 174 A 143 ILE N A 143 ILE CA A 143 ILE C A 144 GLN N 1.0 -62.6 -22.6 PSI 175 175 A 143 ILE C A 144 GLN N A 144 GLN CA A 144 GLN C 1.0 -86.7 -46.7 PHI 176 176 A 144 GLN N A 144 GLN CA A 144 GLN C A 145 MET N 1.0 -50.9 -10.9 PSI 177 177 A 144 GLN C A 145 MET N A 145 MET CA A 145 MET C 1.0 -100.8 -54.8 PHI 178 178 A 145 MET N A 145 MET CA A 145 MET C A 146 GLY N 1.0 -44.7 15.1 PSI 179 179 A 146 GLY C A 147 PHE N A 147 PHE CA A 147 PHE C 1.0 -81.6 -41.6 PHI 180 180 A 147 PHE N A 147 PHE CA A 147 PHE C A 148 LYS N 1.0 -65.2 -25.2 PSI 181 181 A 147 PHE C A 148 LYS N A 148 LYS CA A 148 LYS C 1.0 -79.3 -39.3 PHI 182 182 A 148 LYS N A 148 LYS CA A 148 LYS C A 149 GLU N 1.0 -62.6 -22.6 PSI 183 183 A 148 LYS C A 149 GLU N A 149 GLU CA A 149 GLU C 1.0 -84.7 -44.7 PHI 184 184 A 149 GLU N A 149 GLU CA A 149 GLU C A 150 GLY N 1.0 -63.3 -23.3 PSI 185 185 A 149 GLU C A 150 GLY N A 150 GLY CA A 150 GLY C 1.0 -85.0 -45.0 PHI 186 186 A 150 GLY N A 150 GLY CA A 150 GLY C A 151 ILE N 1.0 -62.1 -22.1 PSI 187 187 A 150 GLY C A 151 ILE N A 151 ILE CA A 151 ILE C 1.0 -103.4 -36.2 PHI 188 188 A 151 ILE N A 151 ILE CA A 151 ILE C A 152 THR N 1.0 -57.6 -16.8 PSI 189 189 A 151 ILE C A 152 THR N A 152 THR CA A 152 THR C 1.0 -81.2 -41.2 PHI 190 190 A 152 THR N A 152 THR CA A 152 THR C A 153 MET N 1.0 -59.8 -19.8 PSI 191 191 A 152 THR C A 153 MET N A 153 MET CA A 153 MET C 1.0 -83.8 -43.8 PHI 192 192 A 153 MET N A 153 MET CA A 153 MET C A 154 ALA N 1.0 -64.1 -24.1 PSI 193 193 A 153 MET C A 154 ALA N A 154 ALA CA A 154 ALA C 1.0 -83.4 -43.4 PHI 194 194 A 154 ALA N A 154 ALA CA A 154 ALA C A 155 MET N 1.0 -64.0 -24.0 PSI 195 195 A 154 ALA C A 155 MET N A 155 MET CA A 155 MET C 1.0 -82.8 -42.8 PHI 196 196 A 155 MET N A 155 MET CA A 155 MET C A 156 GLU N 1.0 -61.1 -21.1 PSI 197 197 A 155 MET C A 156 GLU N A 156 GLU CA A 156 GLU C 1.0 -82.3 -42.3 PHI 198 198 A 156 GLU N A 156 GLU CA A 156 GLU C A 157 ASN N 1.0 -61.6 -21.6 PSI 199 199 A 156 GLU C A 157 ASN N A 157 ASN CA A 157 ASN C 1.0 -84.4 -44.4 PHI 200 200 A 157 ASN N A 157 ASN CA A 157 ASN C A 158 LEU N 1.0 -58.8 -18.8 PSI 201 201 A 157 ASN C A 158 LEU N A 158 LEU CA A 158 LEU C 1.0 -84.1 -44.1 PHI 202 202 A 158 LEU N A 158 LEU CA A 158 LEU C A 159 ASP N 1.0 -62.0 -22.0 PSI 203 203 A 158 LEU C A 159 ASP N A 159 ASP CA A 159 ASP C 1.0 -82.7 -42.7 PHI 204 204 A 159 ASP N A 159 ASP CA A 159 ASP C A 160 GLU N 1.0 -57.5 -17.5 PSI 205 205 A 159 ASP C A 160 GLU N A 160 GLU CA A 160 GLU C 1.0 -83.1 -43.1 PHI 206 206 A 160 GLU N A 160 GLU CA A 160 GLU C A 161 LEU N 1.0 -62.2 -22.2 PSI 207 207 A 160 GLU C A 161 LEU N A 161 LEU CA A 161 LEU C 1.0 -85.8 -45.8 PHI 208 208 A 161 LEU N A 161 LEU CA A 161 LEU C A 162 LEU N 1.0 -63.4 -23.4 PSI 209 209 A 161 LEU C A 162 LEU N A 162 LEU CA A 162 LEU C 1.0 -82.9 -42.9 PHI 210 210 A 162 LEU N A 162 LEU CA A 162 LEU C A 163 VAL N 1.0 -53.7 -10.1 PSI 211 211 A 162 LEU C A 163 VAL N A 163 VAL CA A 163 VAL C 1.0 -88.1 -45.7 PHI 212 212 A 163 VAL N A 163 VAL CA A 163 VAL C A 164 SER N 1.0 -63.5 -7.7 PSI 213 213 A 163 VAL C A 164 SER N A 164 SER CA A 164 SER C 1.0 -105.9 -37.3 PHI 214 214 A 164 SER N A 164 SER CA A 164 SER C A 165 GLY N 1.0 -60.3 -1.7 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 2412.201 2 1H 10626.300 3 1H 15243.902 stop_ save_ save_Cnoesy_aliph.list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode Cnoesy_aliph.list _nef_nmr_spectrum.num_dimensions 2 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 13681.062 2 1H 10626.300 3 1H 12755.102 stop_ save_ save_Cnoesy_arom.list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode Cnoesy_arom.list _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 6413.526 2 1H 10626.300 3 1H 12755.102 stop_ save_ save_4D_ccnoesy.list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode 4D_ccnoesy.list _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3124.146 2 13C 3124.146 3 1H 4197.272 4 1H 8000.000 stop_ save_