data_nef_c16298_2kiw 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 64 THR start . . 2 A 65 PHE middle . . 3 A 66 LYS middle . . 4 A 67 GLN middle . . 5 A 68 VAL middle . . 6 A 69 ALA middle . . 7 A 70 ASP middle . . 8 A 71 ASP middle . . 9 A 72 TRP middle . . 10 A 73 LEU middle . . 11 A 74 LYS middle . . 12 A 75 GLN middle . . 13 A 76 TYR middle . . 14 A 77 ALA middle . . 15 A 78 ASN middle . . 16 A 79 ASP middle . . 17 A 80 VAL middle . . 18 A 81 LYS middle . . 19 A 82 VAL middle . . 20 A 83 SER middle . . 21 A 84 SER middle . . 22 A 85 VAL middle . . 23 A 86 ARG middle . . 24 A 87 ALA middle . . 25 A 88 ARG middle . . 26 A 89 GLU middle . . 27 A 90 LYS middle . . 28 A 91 ALA middle . . 29 A 92 ILE middle . . 30 A 93 GLN middle . . 31 A 94 HIS middle . . 32 A 95 ALA middle . . 33 A 96 ILE middle . . 34 A 97 GLU middle . . 35 A 98 ARG middle . . 36 A 99 PHE middle . . 37 A 100 ASN middle . . 38 A 101 THR middle . . 39 A 102 LYS middle . . 40 A 103 PRO middle . false 41 A 104 ILE middle . . 42 A 105 GLN middle . . 43 A 106 THR middle . . 44 A 107 ILE middle . . 45 A 108 LYS middle . . 46 A 109 LYS middle . . 47 A 110 HIS middle . . 48 A 111 ASP middle . . 49 A 112 TYR middle . . 50 A 113 GLN middle . . 51 A 114 ARG middle . . 52 A 115 PHE middle . . 53 A 116 VAL middle . . 54 A 117 ASP middle . . 55 A 118 ASP middle . . 56 A 119 ILE middle . . 57 A 120 SER middle . . 58 A 121 ALA middle . . 59 A 122 GLN middle . . 60 A 123 TYR middle . . 61 A 124 SER middle . . 62 A 125 LYS middle . . 63 A 126 ASN middle . . 64 A 127 TYR middle . . 65 A 128 VAL middle . . 66 A 129 ASP middle . . 67 A 130 SER middle . . 68 A 131 ILE middle . . 69 A 132 VAL middle . . 70 A 133 ALA middle . . 71 A 134 SER middle . . 72 A 135 THR middle . . 73 A 136 ASN middle . . 74 A 137 MET middle . . 75 A 138 ILE middle . . 76 A 139 PHE middle . . 77 A 140 LYS middle . . 78 A 141 TYR middle . . 79 A 142 ALA middle . . 80 A 143 TYR middle . . 81 A 144 ASP middle . . 82 A 145 THR middle . . 83 A 146 ARG middle . . 84 A 147 LEU middle . . 85 A 148 ILE middle . . 86 A 149 LYS middle . . 87 A 150 ALA middle . . 88 A 151 MET middle . . 89 A 152 PRO middle . false 90 A 153 SER middle . . 91 A 154 GLU middle . . 92 A 155 GLY middle . false 93 A 156 ILE middle . . 94 A 157 LYS middle . . 95 A 158 ARG middle . . 96 A 159 PRO middle . false 97 A 160 LYS middle . . 98 A 161 LYS middle . . 99 A 162 LYS middle . . 100 A 163 VAL middle . . 101 A 164 SER middle . . 102 A 165 VAL middle . . 103 A 166 GLU middle . . 104 A 167 LEU middle . . 105 A 168 GLU middle . . 106 A 169 HIS middle . . 107 A 170 HIS middle . . 108 A 171 HIS middle . . 109 A 172 HIS middle . . 110 A 173 HIS middle . . 111 A 174 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 64 THR H1 H 1 8.96 0.02 A 64 THR HA H 1 3.51 0.02 A 64 THR HB H 1 4.55 0.02 A 64 THR HG2% H 1 1.33 0.02 A 64 THR CA C 13 63.6 0.2 A 64 THR CB C 13 71.2 0.2 A 64 THR CG2 C 13 21.5 0.2 A 64 THR N N 15 122.9 0.2 A 65 PHE HA H 1 3.70 0.02 A 65 PHE HBy H 1 3.16 0.02 A 65 PHE HBx H 1 2.88 0.02 A 65 PHE HDx H 1 6.75 0.02 A 65 PHE HDy H 1 6.75 0.02 A 65 PHE HEx H 1 6.61 0.02 A 65 PHE HEy H 1 6.61 0.02 A 65 PHE HZ H 1 6.33 0.02 A 65 PHE C C 13 175.9 0.2 A 65 PHE CA C 13 63.7 0.2 A 65 PHE CB C 13 39.1 0.2 A 65 PHE CDx C 13 131.4 0.02 A 65 PHE CDy C 13 131.4 0.02 A 65 PHE CEx C 13 131.1 0.02 A 65 PHE CEy C 13 131.1 0.02 A 65 PHE CZ C 13 128.8 0.2 A 66 LYS H H 1 8.44 0.02 A 66 LYS HA H 1 3.73 0.02 A 66 LYS HBy H 1 1.92 0.02 A 66 LYS HBx H 1 1.73 0.02 A 66 LYS HDx H 1 1.66 0.02 A 66 LYS HDy H 1 1.66 0.02 A 66 LYS HEy H 1 3.14 0.02 A 66 LYS HEx H 1 2.91 0.02 A 66 LYS HGy H 1 1.41 0.02 A 66 LYS HGx H 1 1.34 0.02 A 66 LYS C C 13 176.5 0.2 A 66 LYS CA C 13 60.1 0.2 A 66 LYS CB C 13 32.7 0.2 A 66 LYS CD C 13 29.1 0.2 A 66 LYS CE C 13 42.1 0.2 A 66 LYS CG C 13 25.4 0.2 A 66 LYS N N 15 116.2 0.2 A 67 GLN H H 1 7.54 0.02 A 67 GLN HA H 1 4 0.02 A 67 GLN HBx H 1 2.16 0.02 A 67 GLN HBy H 1 2.16 0.02 A 67 GLN HE21 H 1 7.79 0.02 A 67 GLN HE22 H 1 6.94 0.02 A 67 GLN HGy H 1 2.41 0.02 A 67 GLN HGx H 1 2.38 0.02 A 67 GLN C C 13 178 0.2 A 67 GLN CA C 13 58.7 0.2 A 67 GLN CB C 13 28.9 0.2 A 67 GLN CD C 13 180.6 0.2 A 67 GLN CG C 13 34.2 0.2 A 67 GLN N N 15 117.5 0.2 A 67 GLN NE2 N 15 115.1 0.2 A 68 VAL H H 1 7.73 0.02 A 68 VAL HA H 1 3.81 0.02 A 68 VAL HB H 1 1.72 0.02 A 68 VAL HGx% H 1 0.87 0.02 A 68 VAL HGy% H 1 1.04 0.02 A 68 VAL C C 13 177.6 0.2 A 68 VAL CA C 13 65.9 0.2 A 68 VAL CB C 13 31.2 0.2 A 68 VAL CGx C 13 21.9 0.02 A 68 VAL CGy C 13 22.9 0.02 A 68 VAL N N 15 119.9 0.2 A 69 ALA H H 1 8.39 0.02 A 69 ALA HA H 1 3.77 0.02 A 69 ALA HB% H 1 1.14 0.02 A 69 ALA C C 13 179 0.2 A 69 ALA CA C 13 55.5 0.2 A 69 ALA CB C 13 18.4 0.2 A 69 ALA N N 15 121.4 0.2 A 70 ASP H H 1 8.29 0.02 A 70 ASP HA H 1 4.33 0.02 A 70 ASP HBy H 1 2.78 0.02 A 70 ASP HBx H 1 2.58 0.02 A 70 ASP C C 13 176.7 0.2 A 70 ASP CA C 13 57.3 0.2 A 70 ASP CB C 13 40 0.2 A 70 ASP N N 15 118.4 0.2 A 71 ASP H H 1 8.3 0.02 A 71 ASP HA H 1 4.32 0.02 A 71 ASP HBy H 1 3 0.02 A 71 ASP HBx H 1 2.8 0.02 A 71 ASP C C 13 179 0.2 A 71 ASP CA C 13 57.4 0.2 A 71 ASP CB C 13 40 0.2 A 71 ASP N N 15 122.4 0.2 A 72 TRP H H 1 8.9 0.02 A 72 TRP HA H 1 3.05 0.02 A 72 TRP HBy H 1 3.30 0.02 A 72 TRP HBx H 1 2.65 0.02 A 72 TRP HD1 H 1 6.68 0.02 A 72 TRP HE1 H 1 9.96 0.02 A 72 TRP HE3 H 1 7.29 0.02 A 72 TRP HH2 H 1 6.38 0.02 A 72 TRP HZ2 H 1 6.84 0.02 A 72 TRP HZ3 H 1 6.65 0.02 A 72 TRP C C 13 177.5 0.2 A 72 TRP CA C 13 61.9 0.2 A 72 TRP CB C 13 27.5 0.2 A 72 TRP CD1 C 13 126.4 0.2 A 72 TRP CH2 C 13 122.4 0.2 A 72 TRP CZ2 C 13 115 0.2 A 72 TRP CZ3 C 13 120.9 0.2 A 72 TRP N N 15 122.9 0.2 A 72 TRP NE1 N 15 129.0 0.2 A 73 LEU H H 1 8.33 0.02 A 73 LEU HA H 1 3 0.02 A 73 LEU HBx H 1 1.67 0.02 A 73 LEU HBy H 1 1.67 0.02 A 73 LEU HD1% H 1 0.81 0.02 A 73 LEU HD2% H 1 0.81 0.02 A 73 LEU HG H 1 1.58 0.02 A 73 LEU C C 13 179 0.2 A 73 LEU CA C 13 57.4 0.2 A 73 LEU CB C 13 41.8 0.2 A 73 LEU CD1 C 13 24.4 0.02 A 73 LEU CD2 C 13 25.4 0.02 A 73 LEU CG C 13 27.1 0.2 A 73 LEU N N 15 120.2 0.2 A 74 LYS H H 1 7.61 0.02 A 74 LYS HA H 1 3.84 0.02 A 74 LYS HBy H 1 1.98 0.02 A 74 LYS HBx H 1 1.82 0.02 A 74 LYS HDx H 1 1.64 0.02 A 74 LYS HDy H 1 1.64 0.02 A 74 LYS HEx H 1 2.92 0.02 A 74 LYS HEy H 1 2.92 0.02 A 74 LYS HGy H 1 1.52 0.02 A 74 LYS HGx H 1 1.37 0.02 A 74 LYS C C 13 178.5 0.2 A 74 LYS CA C 13 59.1 0.2 A 74 LYS CB C 13 32.7 0.2 A 74 LYS CD C 13 29.3 0.2 A 74 LYS CE C 13 41.9 0.2 A 74 LYS CG C 13 25.1 0.2 A 74 LYS N N 15 117.4 0.2 A 75 GLN H H 1 7.27 0.02 A 75 GLN HA H 1 4.04 0.02 A 75 GLN HBy H 1 1.97 0.02 A 75 GLN HBx H 1 1.89 0.02 A 75 GLN HE21 H 1 7.30 0.02 A 75 GLN HE22 H 1 6.94 0.02 A 75 GLN HGy H 1 2.3 0.02 A 75 GLN HGx H 1 2.18 0.02 A 75 GLN C C 13 177.5 0.2 A 75 GLN CA C 13 57.4 0.2 A 75 GLN CB C 13 28.4 0.2 A 75 GLN CD C 13 180.4 0.2 A 75 GLN CG C 13 33.5 0.2 A 75 GLN N N 15 116.7 0.2 A 75 GLN NE2 N 15 113.5 0.2 A 76 TYR H H 1 8.17 0.02 A 76 TYR HA H 1 4.01 0.02 A 76 TYR HBy H 1 2.28 0.02 A 76 TYR HBx H 1 1.9 0.02 A 76 TYR HDx H 1 6.75 0.02 A 76 TYR HDy H 1 6.75 0.02 A 76 TYR HEx H 1 6.56 0.02 A 76 TYR HEy H 1 6.56 0.02 A 76 TYR C C 13 176.4 0.2 A 76 TYR CA C 13 59.2 0.2 A 76 TYR CB C 13 38.4 0.2 A 76 TYR CDx C 13 132.8 0.02 A 76 TYR CDy C 13 132.8 0.02 A 76 TYR CEx C 13 118.2 0.02 A 76 TYR CEy C 13 118.2 0.02 A 76 TYR N N 15 122.5 0.2 A 77 ALA H H 1 7.58 0.02 A 77 ALA HA H 1 3.82 0.02 A 77 ALA HB% H 1 1.33 0.02 A 77 ALA C C 13 177.8 0.2 A 77 ALA CA C 13 53.3 0.2 A 77 ALA CB C 13 19.0 0.2 A 77 ALA N N 15 118 0.2 A 78 ASN H H 1 7.47 0.02 A 78 ASN HA H 1 4.49 0.02 A 78 ASN HBy H 1 2.76 0.02 A 78 ASN HBx H 1 2.7 0.02 A 78 ASN HD21 H 1 7.57 0.02 A 78 ASN HD22 H 1 6.89 0.02 A 78 ASN C C 13 175.5 0.2 A 78 ASN CA C 13 54.5 0.2 A 78 ASN CB C 13 38.9 0.2 A 78 ASN CG C 13 176.7 0.2 A 78 ASN N N 15 114.3 0.2 A 78 ASN ND2 N 15 113.6 0.2 A 79 ASP H H 1 7.64 0.02 A 79 ASP HA H 1 4.66 0.02 A 79 ASP HBy H 1 2.72 0.02 A 79 ASP HBx H 1 2.57 0.02 A 79 ASP C C 13 175.9 0.2 A 79 ASP CA C 13 54.7 0.2 A 79 ASP CB C 13 42.1 0.2 A 79 ASP N N 15 118.1 0.2 A 80 VAL H H 1 7.38 0.02 A 80 VAL HA H 1 4.31 0.02 A 80 VAL HB H 1 1.99 0.02 A 80 VAL HG1% H 1 0.78 0.02 A 80 VAL HG2% H 1 0.53 0.02 A 80 VAL C C 13 175.7 0.2 A 80 VAL CA C 13 61.0 0.2 A 80 VAL CB C 13 33.8 0.2 A 80 VAL CG1 C 13 21.2 0.02 A 80 VAL CG2 C 13 19.5 0.02 A 80 VAL N N 15 116 0.2 A 81 LYS H H 1 8.2 0.02 A 81 LYS HA H 1 4.33 0.02 A 81 LYS HBy H 1 1.96 0.02 A 81 LYS HBx H 1 1.88 0.02 A 81 LYS HDx H 1 1.69 0.02 A 81 LYS HDy H 1 1.69 0.02 A 81 LYS HEx H 1 2.97 0.02 A 81 LYS HEy H 1 2.97 0.02 A 81 LYS HGy H 1 1.47 0.02 A 81 LYS HGx H 1 1.39 0.02 A 81 LYS C C 13 177.9 0.2 A 81 LYS CA C 13 56.3 0.2 A 81 LYS CB C 13 32.6 0.2 A 81 LYS CD C 13 29.1 0.2 A 81 LYS CE C 13 41.6 0.2 A 81 LYS CG C 13 24.4 0.2 A 81 LYS N N 15 121.4 0.2 A 82 VAL H H 1 8.31 0.02 A 82 VAL HA H 1 3.82 0.02 A 82 VAL HB H 1 2.14 0.02 A 82 VAL HGx% H 1 0.96 0.02 A 82 VAL HGy% H 1 0.96 0.02 A 82 VAL C C 13 177.1 0.2 A 82 VAL CA C 13 65.3 0.2 A 82 VAL CB C 13 31.9 0.2 A 82 VAL CGx C 13 20.9 0.02 A 82 VAL CGy C 13 20.9 0.02 A 82 VAL N N 15 121.8 0.2 A 83 SER H H 1 8.43 0.02 A 83 SER HA H 1 4.2 0.02 A 83 SER HBx H 1 3.93 0.02 A 83 SER HBy H 1 3.93 0.02 A 83 SER HG H 1 5.66 0.02 A 83 SER C C 13 177.2 0.2 A 83 SER CA C 13 60.7 0.2 A 83 SER CB C 13 62.3 0.2 A 83 SER N N 15 115.4 0.2 A 84 SER H H 1 7.73 0.02 A 84 SER HA H 1 4.51 0.02 A 84 SER HBx H 1 4.07 0.02 A 84 SER HBy H 1 4.07 0.02 A 84 SER HG H 1 5.53 0.02 A 84 SER C C 13 176 0.2 A 84 SER CA C 13 60.5 0.2 A 84 SER CB C 13 62.8 0.2 A 84 SER N N 15 118.5 0.2 A 85 VAL H H 1 7.83 0.02 A 85 VAL HA H 1 3.64 0.02 A 85 VAL HB H 1 2.25 0.02 A 85 VAL HG1% H 1 0.93 0.02 A 85 VAL HG2% H 1 0.91 0.02 A 85 VAL C C 13 177.7 0.2 A 85 VAL CA C 13 66.6 0.2 A 85 VAL CB C 13 31.7 0.2 A 85 VAL CG1 C 13 21.5 0.02 A 85 VAL CG2 C 13 23.2 0.02 A 85 VAL N N 15 123.4 0.2 A 86 ARG H H 1 8.37 0.02 A 86 ARG HA H 1 4.18 0.02 A 86 ARG HBx H 1 1.88 0.02 A 86 ARG HBy H 1 1.88 0.02 A 86 ARG HDx H 1 3.22 0.02 A 86 ARG HDy H 1 3.22 0.02 A 86 ARG HGx H 1 1.76 0.02 A 86 ARG HGy H 1 1.76 0.02 A 86 ARG C C 13 179 0.2 A 86 ARG CA C 13 58.6 0.2 A 86 ARG CB C 13 30.2 0.2 A 86 ARG CD C 13 43.2 0.2 A 86 ARG CG C 13 27.2 0.2 A 86 ARG N N 15 118.4 0.2 A 87 ALA H H 1 7.74 0.02 A 87 ALA HA H 1 4.23 0.02 A 87 ALA HB% H 1 1.57 0.02 A 87 ALA C C 13 181.1 0.2 A 87 ALA CA C 13 55.1 0.2 A 87 ALA CB C 13 18.3 0.2 A 87 ALA N N 15 120.7 0.2 A 88 ARG H H 1 7.98 0.02 A 88 ARG HA H 1 4.18 0.02 A 88 ARG HBy H 1 2.09 0.02 A 88 ARG HBx H 1 1.86 0.02 A 88 ARG HDy H 1 3.19 0.02 A 88 ARG HDx H 1 3 0.02 A 88 ARG HGx H 1 1.83 0.02 A 88 ARG HGy H 1 1.83 0.02 A 88 ARG C C 13 177.8 0.2 A 88 ARG CA C 13 58.9 0.2 A 88 ARG CB C 13 29.8 0.2 A 88 ARG CD C 13 43.3 0.2 A 88 ARG CG C 13 27.6 0.2 A 88 ARG N N 15 118.7 0.2 A 89 GLU H H 1 8.73 0.02 A 89 GLU HA H 1 3.83 0.02 A 89 GLU HBx H 1 2.19 0.02 A 89 GLU HBy H 1 2.19 0.02 A 89 GLU HGy H 1 2.27 0.02 A 89 GLU HGx H 1 2.18 0.02 A 89 GLU C C 13 178.8 0.2 A 89 GLU CA C 13 60 0.2 A 89 GLU CB C 13 30.1 0.2 A 89 GLU CG C 13 36.7 0.2 A 89 GLU N N 15 119.3 0.2 A 90 LYS H H 1 7.8 0.02 A 90 LYS HA H 1 4.07 0.02 A 90 LYS HBx H 1 1.97 0.02 A 90 LYS HBy H 1 1.97 0.02 A 90 LYS HDy H 1 1.7 0.02 A 90 LYS HDx H 1 1.66 0.02 A 90 LYS HEx H 1 2.98 0.02 A 90 LYS HEy H 1 2.98 0.02 A 90 LYS HGy H 1 1.61 0.02 A 90 LYS HGx H 1 1.41 0.02 A 90 LYS C C 13 178.9 0.2 A 90 LYS CA C 13 59.2 0.2 A 90 LYS CB C 13 32.6 0.2 A 90 LYS CD C 13 29.4 0.2 A 90 LYS CE C 13 42.2 0.2 A 90 LYS CG C 13 24.5 0.2 A 90 LYS N N 15 117.7 0.2 A 91 ALA H H 1 7.61 0.02 A 91 ALA HA H 1 4.27 0.02 A 91 ALA HB% H 1 1.51 0.02 A 91 ALA C C 13 180.1 0.2 A 91 ALA CA C 13 55.1 0.2 A 91 ALA CB C 13 18.8 0.2 A 91 ALA N N 15 120.5 0.2 A 92 ILE H H 1 8.18 0.02 A 92 ILE HA H 1 4.37 0.02 A 92 ILE HB H 1 2.14 0.02 A 92 ILE HD1% H 1 1.03 0.02 A 92 ILE HG1y H 1 1.81 0.02 A 92 ILE HG1x H 1 1.51 0.02 A 92 ILE HG2% H 1 0.99 0.02 A 92 ILE C C 13 177.5 0.2 A 92 ILE CA C 13 63.6 0.2 A 92 ILE CB C 13 38.8 0.2 A 92 ILE CD1 C 13 15.5 0.2 A 92 ILE CG1 C 13 26.2 0.2 A 92 ILE CG2 C 13 18.8 0.2 A 92 ILE N N 15 108.7 0.2 A 93 GLN H H 1 7.7 0.02 A 93 GLN HA H 1 3.95 0.02 A 93 GLN HBy H 1 2.04 0.02 A 93 GLN HBx H 1 1.97 0.02 A 93 GLN HE21 H 1 7.76 0.02 A 93 GLN HE22 H 1 7.07 0.02 A 93 GLN HGy H 1 2.66 0.02 A 93 GLN HGx H 1 2.32 0.02 A 93 GLN C C 13 177.8 0.2 A 93 GLN CA C 13 58.4 0.2 A 93 GLN CB C 13 27.5 0.2 A 93 GLN CD C 13 179.6 0.2 A 93 GLN CG C 13 32.8 0.2 A 93 GLN N N 15 121.2 0.2 A 93 GLN NE2 N 15 114.1 0.2 A 94 HIS H H 1 7.07 0.02 A 94 HIS HA H 1 4.29 0.02 A 94 HIS HBy H 1 3.35 0.02 A 94 HIS HBx H 1 3.28 0.02 A 94 HIS HE1 H 1 7.82 0.02 A 94 HIS C C 13 177.9 0.2 A 94 HIS CA C 13 58.7 0.2 A 94 HIS CB C 13 29.1 0.2 A 94 HIS CE1 C 13 139.6 0.2 A 94 HIS N N 15 114.8 0.2 A 95 ALA H H 1 8.17 0.02 A 95 ALA HA H 1 3.41 0.02 A 95 ALA HB% H 1 1.41 0.02 A 95 ALA C C 13 178.5 0.2 A 95 ALA CA C 13 54.5 0.2 A 95 ALA CB C 13 18.8 0.2 A 95 ALA N N 15 122.5 0.2 A 96 ILE H H 1 8.34 0.02 A 96 ILE HA H 1 3.61 0.02 A 96 ILE HB H 1 1.95 0.02 A 96 ILE HD1% H 1 0.92 0.02 A 96 ILE HG1y H 1 1.97 0.02 A 96 ILE HG1x H 1 0.85 0.02 A 96 ILE HG2% H 1 0.96 0.02 A 96 ILE C C 13 178.1 0.2 A 96 ILE CA C 13 66.7 0.2 A 96 ILE CB C 13 37.8 0.2 A 96 ILE CD1 C 13 13.8 0.2 A 96 ILE CG1 C 13 30.4 0.2 A 96 ILE CG2 C 13 17.8 0.2 A 96 ILE N N 15 119.7 0.2 A 97 GLU H H 1 8.22 0.02 A 97 GLU HA H 1 4.01 0.02 A 97 GLU HBx H 1 2.07 0.02 A 97 GLU HBy H 1 2.07 0.02 A 97 GLU HGy H 1 2.42 0.02 A 97 GLU HGx H 1 2.26 0.02 A 97 GLU C C 13 178.3 0.2 A 97 GLU CA C 13 59.2 0.2 A 97 GLU CB C 13 29.4 0.2 A 97 GLU CG C 13 36.4 0.2 A 97 GLU N N 15 118.2 0.2 A 98 ARG H H 1 7.17 0.02 A 98 ARG HA H 1 4 0.02 A 98 ARG HBy H 1 1.49 0.02 A 98 ARG HBx H 1 0.74 0.02 A 98 ARG HDx H 1 3.03 0.02 A 98 ARG HDy H 1 3.03 0.02 A 98 ARG HGx H 1 1.68 0.02 A 98 ARG HGy H 1 1.68 0.02 A 98 ARG C C 13 177.3 0.2 A 98 ARG CA C 13 56.9 0.2 A 98 ARG CB C 13 30.3 0.2 A 98 ARG CD C 13 41.6 0.2 A 98 ARG CG C 13 25.9 0.2 A 98 ARG N N 15 117.3 0.2 A 99 PHE H H 1 8.12 0.02 A 99 PHE HA H 1 4.58 0.02 A 99 PHE HBy H 1 2.73 0.02 A 99 PHE HBx H 1 1.87 0.02 A 99 PHE HDx H 1 6.38 0.02 A 99 PHE HDy H 1 6.38 0.02 A 99 PHE HEx H 1 6.71 0.02 A 99 PHE HEy H 1 6.71 0.02 A 99 PHE HZ H 1 6.84 0.02 A 99 PHE C C 13 175 0.2 A 99 PHE CA C 13 57.7 0.2 A 99 PHE CB C 13 39.3 0.2 A 99 PHE CDx C 13 131.3 0.02 A 99 PHE CDy C 13 131.3 0.02 A 99 PHE CEx C 13 130.0 0.02 A 99 PHE CEy C 13 130.0 0.02 A 99 PHE CZ C 13 128.2 0.2 A 99 PHE N N 15 114.9 0.2 A 100 ASN H H 1 8.05 0.02 A 100 ASN HA H 1 4.42 0.02 A 100 ASN HBx H 1 3.09 0.02 A 100 ASN HBy H 1 3.09 0.02 A 100 ASN HD21 H 1 7.40 0.02 A 100 ASN HD22 H 1 6.92 0.02 A 100 ASN C C 13 178.4 0.2 A 100 ASN CA C 13 57.8 0.2 A 100 ASN CB C 13 40 0.2 A 100 ASN CG C 13 176.7 0.2 A 100 ASN N N 15 115.7 0.2 A 100 ASN ND2 N 15 114.3 0.2 A 101 THR H H 1 8.88 0.02 A 101 THR HA H 1 4.28 0.02 A 101 THR HB H 1 4.70 0.02 A 101 THR HG2% H 1 1.29 0.02 A 101 THR C C 13 174.6 0.2 A 101 THR CA C 13 61.9 0.2 A 101 THR CB C 13 68.9 0.2 A 101 THR CG2 C 13 22.0 0.2 A 101 THR N N 15 111.7 0.2 A 102 LYS H H 1 8.82 0.02 A 102 LYS HA H 1 4.5 0.02 A 102 LYS HBy H 1 1.86 0.02 A 102 LYS HBx H 1 1.63 0.02 A 102 LYS HDy H 1 1.65 0.02 A 102 LYS HDx H 1 1.48 0.02 A 102 LYS HEx H 1 3.03 0.02 A 102 LYS HEy H 1 3.03 0.02 A 102 LYS HGy H 1 1.66 0.02 A 102 LYS HGx H 1 1.47 0.02 A 102 LYS CA C 13 55.3 0.2 A 102 LYS CB C 13 32.6 0.2 A 102 LYS CD C 13 28.9 0.2 A 102 LYS CE C 13 40.6 0.2 A 102 LYS CG C 13 24.8 0.2 A 102 LYS N N 15 125.6 0.2 A 103 PRO HA H 1 4.39 0.02 A 103 PRO HBy H 1 2.26 0.02 A 103 PRO HBx H 1 1.84 0.02 A 103 PRO HDy H 1 3.68 0.02 A 103 PRO HDx H 1 3.61 0.02 A 103 PRO HGx H 1 2 0.02 A 103 PRO HGy H 1 2 0.02 A 103 PRO C C 13 180.6 0.2 A 103 PRO CA C 13 63.0 0.2 A 103 PRO CB C 13 32.4 0.2 A 103 PRO CD C 13 50.6 0.2 A 103 PRO CG C 13 27.2 0.2 A 104 ILE H H 1 9.59 0.02 A 104 ILE HA H 1 3.99 0.02 A 104 ILE HB H 1 1.65 0.02 A 104 ILE HD1% H 1 0.75 0.02 A 104 ILE HG1y H 1 1.73 0.02 A 104 ILE HG1x H 1 1.36 0.02 A 104 ILE HG2% H 1 0.99 0.02 A 104 ILE C C 13 175.8 0.2 A 104 ILE CA C 13 65 0.2 A 104 ILE CB C 13 39.4 0.2 A 104 ILE CD1 C 13 15.3 0.2 A 104 ILE CG1 C 13 30.6 0.2 A 104 ILE CG2 C 13 16.9 0.2 A 104 ILE N N 15 129.6 0.2 A 105 GLN H H 1 9.46 0.02 A 105 GLN HA H 1 4.24 0.02 A 105 GLN HBx H 1 2.23 0.02 A 105 GLN HBy H 1 2.23 0.02 A 105 GLN HE21 H 1 7.70 0.02 A 105 GLN HE22 H 1 7.08 0.02 A 105 GLN HGy H 1 2.7 0.02 A 105 GLN HGx H 1 2.57 0.02 A 105 GLN C C 13 176.1 0.2 A 105 GLN CA C 13 58.4 0.2 A 105 GLN CB C 13 27.3 0.2 A 105 GLN CD C 13 180.6 0.2 A 105 GLN CG C 13 33.8 0.2 A 105 GLN N N 15 121 0.2 A 105 GLN NE2 N 15 111.8 0.2 A 106 THR H H 1 8.02 0.02 A 106 THR HA H 1 4.46 0.02 A 106 THR HB H 1 4.49 0.02 A 106 THR HG1 H 1 5.27 0.02 A 106 THR HG2% H 1 1.28 0.02 A 106 THR C C 13 173.8 0.2 A 106 THR CA C 13 61.9 0.2 A 106 THR CB C 13 70 0.2 A 106 THR CG2 C 13 21.7 0.2 A 106 THR N N 15 108.1 0.2 A 107 ILE H H 1 6.91 0.02 A 107 ILE HA H 1 3.78 0.02 A 107 ILE HB H 1 1.66 0.02 A 107 ILE HD1% H 1 0.43 0.02 A 107 ILE HG1y H 1 1.56 0.02 A 107 ILE HG1x H 1 0.53 0.02 A 107 ILE HG2% H 1 0.28 0.02 A 107 ILE C C 13 174.6 0.2 A 107 ILE CA C 13 62.3 0.2 A 107 ILE CB C 13 37.6 0.2 A 107 ILE CD1 C 13 14.5 0.2 A 107 ILE CG1 C 13 27.7 0.2 A 107 ILE CG2 C 13 17.0 0.2 A 107 ILE N N 15 122.5 0.2 A 108 LYS H H 1 9.11 0.02 A 108 LYS HA H 1 4.58 0.02 A 108 LYS HBy H 1 2.07 0.02 A 108 LYS HBx H 1 1.52 0.02 A 108 LYS HDx H 1 1.7 0.02 A 108 LYS HDy H 1 1.7 0.02 A 108 LYS HEy H 1 3.05 0.02 A 108 LYS HEx H 1 2.81 0.02 A 108 LYS HGy H 1 1.59 0.02 A 108 LYS HGx H 1 1.47 0.02 A 108 LYS C C 13 177.9 0.2 A 108 LYS CA C 13 53.9 0.2 A 108 LYS CB C 13 34.1 0.2 A 108 LYS CD C 13 28.5 0.2 A 108 LYS CE C 13 42.3 0.2 A 108 LYS CG C 13 24.9 0.2 A 108 LYS N N 15 128.5 0.2 A 109 LYS H H 1 8.92 0.02 A 109 LYS HA H 1 4.32 0.02 A 109 LYS HBy H 1 1.93 0.02 A 109 LYS HBx H 1 1.81 0.02 A 109 LYS HDx H 1 1.68 0.02 A 109 LYS HDy H 1 1.68 0.02 A 109 LYS HEy H 1 2.99 0.02 A 109 LYS HEx H 1 2.92 0.02 A 109 LYS HGx H 1 1.6 0.02 A 109 LYS HGy H 1 1.6 0.02 A 109 LYS C C 13 178.9 0.2 A 109 LYS CA C 13 60.4 0.2 A 109 LYS CB C 13 32.1 0.2 A 109 LYS CD C 13 29.7 0.2 A 109 LYS CE C 13 42.3 0.2 A 109 LYS CG C 13 24 0.2 A 109 LYS N N 15 123.6 0.2 A 110 HIS H H 1 8.32 0.02 A 110 HIS HA H 1 4.44 0.02 A 110 HIS HBy H 1 3.2 0.02 A 110 HIS HBx H 1 3.01 0.02 A 110 HIS HD2 H 1 6.60 0.02 A 110 HIS HE1 H 1 7.82 0.02 A 110 HIS C C 13 177.9 0.2 A 110 HIS CA C 13 59.3 0.2 A 110 HIS CB C 13 30.3 0.2 A 110 HIS CD2 C 13 120.2 0.2 A 110 HIS CE1 C 13 138.7 0.2 A 110 HIS N N 15 114 0.2 A 110 HIS ND1 N 15 231 0.2 A 110 HIS NE2 N 15 176.6 0.2 A 111 ASP H H 1 6.92 0.02 A 111 ASP HA H 1 4.5 0.02 A 111 ASP HBy H 1 3.14 0.02 A 111 ASP HBx H 1 3.04 0.02 A 111 ASP C C 13 179.2 0.2 A 111 ASP CA C 13 57.1 0.2 A 111 ASP CB C 13 41.8 0.2 A 111 ASP N N 15 118.5 0.2 A 112 TYR H H 1 8.14 0.02 A 112 TYR HA H 1 4.66 0.02 A 112 TYR HBy H 1 3.1 0.02 A 112 TYR HBx H 1 2.5 0.02 A 112 TYR HDx H 1 6.97 0.02 A 112 TYR HDy H 1 6.97 0.02 A 112 TYR HEx H 1 6.86 0.02 A 112 TYR HEy H 1 6.86 0.02 A 112 TYR C C 13 176.7 0.2 A 112 TYR CA C 13 60.3 0.2 A 112 TYR CB C 13 38.2 0.2 A 112 TYR CDx C 13 131.8 0.2 A 112 TYR CDy C 13 131.8 0.02 A 112 TYR CEx C 13 118.5 0.02 A 112 TYR CEy C 13 118.5 0.02 A 112 TYR N N 15 122.2 0.2 A 113 GLN H H 1 9.3 0.02 A 113 GLN HA H 1 3.71 0.02 A 113 GLN HBx H 1 2.17 0.02 A 113 GLN HBy H 1 2.17 0.02 A 113 GLN HE21 H 1 7.84 0.02 A 113 GLN HE22 H 1 7.62 0.02 A 113 GLN HGx H 1 2.33 0.02 A 113 GLN HGy H 1 2.33 0.02 A 113 GLN C C 13 177.3 0.2 A 113 GLN CA C 13 58.6 0.2 A 113 GLN CB C 13 29.1 0.2 A 113 GLN CD C 13 180.2 0.2 A 113 GLN CG C 13 34.0 0.2 A 113 GLN N N 15 119.8 0.2 A 113 GLN NE2 N 15 118.2 0.2 A 114 ARG H H 1 7.84 0.02 A 114 ARG HA H 1 4.12 0.02 A 114 ARG HBx H 1 1.94 0.02 A 114 ARG HBy H 1 1.94 0.02 A 114 ARG HDy H 1 3.29 0.02 A 114 ARG HDx H 1 3.26 0.02 A 114 ARG HGx H 1 1.68 0.02 A 114 ARG HGy H 1 1.68 0.02 A 114 ARG C C 13 177.9 0.2 A 114 ARG CA C 13 59.3 0.2 A 114 ARG CB C 13 30.0 0.2 A 114 ARG CD C 13 43.3 0.2 A 114 ARG CG C 13 27.6 0.2 A 114 ARG N N 15 117.8 0.2 A 115 PHE H H 1 7.31 0.02 A 115 PHE HA H 1 4.31 0.02 A 115 PHE HBy H 1 3.58 0.02 A 115 PHE HBx H 1 3.17 0.02 A 115 PHE HDx H 1 7.05 0.02 A 115 PHE HDy H 1 7.05 0.02 A 115 PHE HEx H 1 7.10 0.02 A 115 PHE HEy H 1 7.10 0.02 A 115 PHE HZ H 1 7.00 0.02 A 115 PHE C C 13 175.6 0.2 A 115 PHE CA C 13 60.3 0.2 A 115 PHE CB C 13 39 0.2 A 115 PHE CDx C 13 132.1 0.02 A 115 PHE CDy C 13 132.1 0.02 A 115 PHE CEx C 13 130.5 0.02 A 115 PHE CEy C 13 130.5 0.02 A 115 PHE CZ C 13 128.9 0.2 A 115 PHE N N 15 118.7 0.2 A 116 VAL H H 1 8.23 0.02 A 116 VAL HA H 1 2.9 0.02 A 116 VAL HB H 1 1.92 0.02 A 116 VAL HG1% H 1 0.66 0.02 A 116 VAL HG2% H 1 0.53 0.02 A 116 VAL C C 13 179 0.2 A 116 VAL CA C 13 66.8 0.2 A 116 VAL CB C 13 31.1 0.2 A 116 VAL CG1 C 13 21.2 0.02 A 116 VAL CG2 C 13 23.5 0.02 A 116 VAL N N 15 119.8 0.2 A 117 ASP H H 1 9.11 0.02 A 117 ASP HA H 1 4.15 0.02 A 117 ASP HBy H 1 2.83 0.02 A 117 ASP HBx H 1 2.6 0.02 A 117 ASP C C 13 179.2 0.2 A 117 ASP CA C 13 57.9 0.2 A 117 ASP CB C 13 39.8 0.2 A 117 ASP N N 15 124.8 0.2 A 118 ASP H H 1 8.24 0.02 A 118 ASP HA H 1 4.39 0.02 A 118 ASP HBy H 1 2.88 0.02 A 118 ASP HBx H 1 2.65 0.02 A 118 ASP C C 13 180.2 0.2 A 118 ASP CA C 13 57.6 0.2 A 118 ASP CB C 13 40.1 0.2 A 118 ASP N N 15 121.9 0.2 A 119 ILE H H 1 8.35 0.02 A 119 ILE HA H 1 4.04 0.02 A 119 ILE HB H 1 1.74 0.02 A 119 ILE HD1% H 1 0.36 0.02 A 119 ILE HG1y H 1 1.32 0.02 A 119 ILE HG1x H 1 1.06 0.02 A 119 ILE HG2% H 1 0.66 0.02 A 119 ILE C C 13 178.6 0.2 A 119 ILE CA C 13 64.5 0.2 A 119 ILE CB C 13 37.3 0.2 A 119 ILE CD1 C 13 13.9 0.2 A 119 ILE CG1 C 13 25.8 0.2 A 119 ILE CG2 C 13 18.7 0.2 A 119 ILE N N 15 116.1 0.2 A 120 SER H H 1 8.08 0.02 A 120 SER HA H 1 4.38 0.02 A 120 SER HBy H 1 4.05 0.02 A 120 SER HBx H 1 3.84 0.02 A 120 SER C C 13 174.5 0.2 A 120 SER CA C 13 61.7 0.2 A 120 SER CB C 13 63.0 0.2 A 120 SER N N 15 117.5 0.2 A 121 ALA H H 1 7.19 0.02 A 121 ALA HA H 1 4.32 0.02 A 121 ALA HB% H 1 1.47 0.02 A 121 ALA C C 13 177.8 0.2 A 121 ALA CA C 13 52.8 0.2 A 121 ALA CB C 13 19.1 0.2 A 121 ALA N N 15 120.2 0.2 A 122 GLN H H 1 7.14 0.02 A 122 GLN HA H 1 4.12 0.02 A 122 GLN HBy H 1 1.51 0.02 A 122 GLN HBx H 1 1.31 0.02 A 122 GLN HE21 H 1 6.69 0.02 A 122 GLN HE22 H 1 7.01 0.02 A 122 GLN HGy H 1 1.99 0.02 A 122 GLN HGx H 1 1.77 0.02 A 122 GLN C C 13 175.3 0.2 A 122 GLN CA C 13 56.7 0.2 A 122 GLN CB C 13 31.7 0.2 A 122 GLN CD C 13 179.6 0.2 A 122 GLN CG C 13 33.4 0.2 A 122 GLN N N 15 115.3 0.2 A 122 GLN NE2 N 15 110.5 0.2 A 123 TYR H H 1 7.45 0.02 A 123 TYR HA H 1 5.04 0.02 A 123 TYR HBy H 1 3.39 0.02 A 123 TYR HBx H 1 2.62 0.02 A 123 TYR HDx H 1 7.03 0.02 A 123 TYR HDy H 1 7.03 0.02 A 123 TYR HEx H 1 6.60 0.02 A 123 TYR HEy H 1 6.60 0.02 A 123 TYR C C 13 174.6 0.2 A 123 TYR CA C 13 56 0.2 A 123 TYR CB C 13 42.7 0.2 A 123 TYR CDx C 13 133.4 0.02 A 123 TYR CDy C 13 133.4 0.02 A 123 TYR CEx C 13 117.7 0.02 A 123 TYR CEy C 13 117.7 0.02 A 123 TYR N N 15 116.5 0.2 A 124 SER H H 1 8.83 0.02 A 124 SER HA H 1 4.4 0.02 A 124 SER HBy H 1 4.28 0.02 A 124 SER HBx H 1 4.12 0.02 A 124 SER C C 13 174.6 0.2 A 124 SER CA C 13 58 0.2 A 124 SER CB C 13 64.4 0.2 A 124 SER N N 15 116.2 0.2 A 125 LYS H H 1 8.84 0.02 A 125 LYS HA H 1 3.89 0.02 A 125 LYS HBy H 1 1.99 0.02 A 125 LYS HBx H 1 1.82 0.02 A 125 LYS HDx H 1 1.68 0.02 A 125 LYS HDy H 1 1.68 0.02 A 125 LYS HEx H 1 3.09 0.02 A 125 LYS HEy H 1 3.09 0.02 A 125 LYS HGx H 1 1.66 0.02 A 125 LYS HGy H 1 1.66 0.02 A 125 LYS C C 13 177.9 0.2 A 125 LYS CA C 13 60.4 0.2 A 125 LYS CB C 13 32.5 0.2 A 125 LYS CD C 13 29.1 0.2 A 125 LYS CE C 13 42.3 0.2 A 125 LYS CG C 13 24.4 0.2 A 125 LYS N N 15 123.4 0.2 A 126 ASN H H 1 8.67 0.02 A 126 ASN HA H 1 4.44 0.02 A 126 ASN HBx H 1 2.8 0.02 A 126 ASN HBy H 1 2.8 0.02 A 126 ASN HD21 H 1 7.72 0.02 A 126 ASN HD22 H 1 6.99 0.02 A 126 ASN C C 13 177.6 0.2 A 126 ASN CA C 13 56.3 0.2 A 126 ASN CB C 13 37.8 0.2 A 126 ASN CG C 13 176.4 0.2 A 126 ASN N N 15 114.9 0.2 A 126 ASN ND2 N 15 113.0 0.2 A 127 TYR H H 1 7.77 0.02 A 127 TYR HA H 1 4.5 0.02 A 127 TYR HBy H 1 3.12 0.02 A 127 TYR HBx H 1 3.02 0.02 A 127 TYR HDx H 1 6.83 0.02 A 127 TYR HDy H 1 6.83 0.02 A 127 TYR HEx H 1 6.28 0.02 A 127 TYR HEy H 1 6.28 0.02 A 127 TYR C C 13 178.4 0.2 A 127 TYR CA C 13 60.1 0.2 A 127 TYR CB C 13 38.6 0.2 A 127 TYR CDx C 13 132.7 0.02 A 127 TYR CDy C 13 132.7 0.02 A 127 TYR CEx C 13 118.6 0.02 A 127 TYR CEy C 13 118.6 0.02 A 127 TYR N N 15 122.5 0.2 A 128 VAL H H 1 8.59 0.02 A 128 VAL HA H 1 3.19 0.02 A 128 VAL HB H 1 2.14 0.02 A 128 VAL HG1% H 1 0.79 0.02 A 128 VAL HG2% H 1 0.95 0.02 A 128 VAL C C 13 177.6 0.2 A 128 VAL CA C 13 67.4 0.2 A 128 VAL CB C 13 31.4 0.2 A 128 VAL CG1 C 13 21.1 0.02 A 128 VAL CG2 C 13 25.3 0.02 A 128 VAL N N 15 120.9 0.2 A 129 ASP H H 1 8.75 0.02 A 129 ASP HA H 1 4.26 0.02 A 129 ASP HBy H 1 2.93 0.02 A 129 ASP HBx H 1 2.64 0.02 A 129 ASP C C 13 179.3 0.2 A 129 ASP CA C 13 57.7 0.2 A 129 ASP CB C 13 39.7 0.2 A 129 ASP N N 15 118.6 0.2 A 130 SER H H 1 7.33 0.02 A 130 SER HA H 1 4.38 0.02 A 130 SER HBx H 1 4 0.02 A 130 SER HBy H 1 4 0.02 A 130 SER C C 13 177.5 0.2 A 130 SER CA C 13 61.4 0.2 A 130 SER CB C 13 63.0 0.2 A 130 SER N N 15 115.4 0.2 A 131 ILE H H 1 8.28 0.02 A 131 ILE HA H 1 3.6 0.02 A 131 ILE HB H 1 1.76 0.02 A 131 ILE HD1% H 1 -0.08 0.02 A 131 ILE HG1y H 1 1.16 0.02 A 131 ILE HG1x H 1 1.00 0.02 A 131 ILE HG2% H 1 0.94 0.02 A 131 ILE C C 13 179.6 0.2 A 131 ILE CA C 13 66.4 0.2 A 131 ILE CB C 13 38.4 0.2 A 131 ILE CD1 C 13 13.9 0.2 A 131 ILE CG1 C 13 27.5 0.2 A 131 ILE CG2 C 13 17.7 0.2 A 131 ILE N N 15 125.8 0.2 A 132 VAL H H 1 9.13 0.02 A 132 VAL HA H 1 3.67 0.02 A 132 VAL HB H 1 2.05 0.02 A 132 VAL HG1% H 1 0.98 0.02 A 132 VAL HG2% H 1 0.9 0.02 A 132 VAL C C 13 177.5 0.2 A 132 VAL CA C 13 66.8 0.2 A 132 VAL CB C 13 32.1 0.2 A 132 VAL CG1 C 13 20.9 0.02 A 132 VAL CG2 C 13 24 0.02 A 132 VAL N N 15 123.3 0.2 A 133 ALA H H 1 8.33 0.02 A 133 ALA HA H 1 4.09 0.02 A 133 ALA HB% H 1 1.55 0.02 A 133 ALA C C 13 181.7 0.2 A 133 ALA CA C 13 55.7 0.2 A 133 ALA CB C 13 18.5 0.2 A 133 ALA N N 15 120.3 0.2 A 134 SER H H 1 7.96 0.02 A 134 SER HA H 1 4.19 0.02 A 134 SER HBy H 1 3.87 0.02 A 134 SER HBx H 1 3.72 0.02 A 134 SER HG H 1 5.17 0.02 A 134 SER C C 13 174.6 0.2 A 134 SER CA C 13 62.3 0.2 A 134 SER CB C 13 63.6 0.2 A 134 SER N N 15 112 0.2 A 135 THR H H 1 8.41 0.02 A 135 THR HA H 1 4.67 0.02 A 135 THR HB H 1 3.54 0.02 A 135 THR HG2% H 1 1.21 0.02 A 135 THR C C 13 176.9 0.2 A 135 THR CA C 13 67.5 0.2 A 135 THR CB C 13 68.3 0.2 A 135 THR CG2 C 13 23.0 0.2 A 135 THR N N 15 119.2 0.2 A 136 ASN H H 1 8.95 0.02 A 136 ASN HA H 1 4.47 0.02 A 136 ASN HBy H 1 3.08 0.02 A 136 ASN HBx H 1 2.84 0.02 A 136 ASN HD21 H 1 7.63 0.02 A 136 ASN HD22 H 1 6.58 0.02 A 136 ASN C C 13 178.4 0.2 A 136 ASN CA C 13 56.0 0.2 A 136 ASN CB C 13 37.0 0.2 A 136 ASN CG C 13 175.5 0.2 A 136 ASN N N 15 121 0.2 A 136 ASN ND2 N 15 109.0 0.2 A 137 MET H H 1 7.3 0.02 A 137 MET HA H 1 3.94 0.02 A 137 MET HBy H 1 1.92 0.02 A 137 MET HBx H 1 1.77 0.02 A 137 MET HE% H 1 2.18 0.02 A 137 MET HGy H 1 3.02 0.02 A 137 MET HGx H 1 2.6 0.02 A 137 MET C C 13 178.4 0.2 A 137 MET CA C 13 59.6 0.2 A 137 MET CB C 13 31.7 0.2 A 137 MET CE C 13 18.1 0.2 A 137 MET CG C 13 33.5 0.2 A 137 MET N N 15 118.9 0.2 A 138 ILE H H 1 6.89 0.02 A 138 ILE HA H 1 2.89 0.02 A 138 ILE HB H 1 1.54 0.02 A 138 ILE HD1% H 1 0.59 0.02 A 138 ILE HG1y H 1 0.79 0.02 A 138 ILE HG1x H 1 0.27 0.02 A 138 ILE HG2% H 1 0.09 0.02 A 138 ILE C C 13 178 0.2 A 138 ILE CA C 13 65.1 0.2 A 138 ILE CB C 13 36.7 0.2 A 138 ILE CD1 C 13 14.4 0.2 A 138 ILE CG1 C 13 28.8 0.2 A 138 ILE CG2 C 13 17.1 0.2 A 138 ILE N N 15 120.9 0.2 A 139 PHE H H 1 7.27 0.02 A 139 PHE HA H 1 4.17 0.02 A 139 PHE HB2 H 1 3.12 0.02 A 139 PHE HB3 H 1 2.92 0.02 A 139 PHE HDx H 1 6.74 0.02 A 139 PHE HDy H 1 6.74 0.02 A 139 PHE HEx H 1 6.54 0.02 A 139 PHE HEy H 1 6.54 0.02 A 139 PHE HZ H 1 6.73 0.02 A 139 PHE C C 13 177.3 0.2 A 139 PHE CA C 13 62.3 0.2 A 139 PHE CB C 13 38.3 0.2 A 139 PHE CDx C 13 131.8 0.02 A 139 PHE CDy C 13 131.8 0.02 A 139 PHE CEx C 13 130.6 0.02 A 139 PHE CEy C 13 130.6 0.02 A 139 PHE CZ C 13 128.7 0.2 A 139 PHE N N 15 116.5 0.2 A 140 LYS H H 1 8.5 0.02 A 140 LYS HA H 1 4.33 0.02 A 140 LYS HBy H 1 2 0.02 A 140 LYS HBx H 1 1.85 0.02 A 140 LYS HDx H 1 1.61 0.02 A 140 LYS HDy H 1 1.61 0.02 A 140 LYS HEy H 1 3.05 0.02 A 140 LYS HEx H 1 2.82 0.02 A 140 LYS HGx H 1 1.57 0.02 A 140 LYS HGy H 1 1.57 0.02 A 140 LYS C C 13 177.3 0.2 A 140 LYS CA C 13 59.1 0.2 A 140 LYS CB C 13 32.3 0.2 A 140 LYS CD C 13 28.4 0.2 A 140 LYS CE C 13 41.9 0.2 A 140 LYS CG C 13 24.9 0.2 A 140 LYS N N 15 121.2 0.2 A 141 TYR H H 1 7.94 0.02 A 141 TYR HA H 1 4.57 0.02 A 141 TYR HBy H 1 3.41 0.02 A 141 TYR HBx H 1 3.23 0.02 A 141 TYR HDx H 1 7.15 0.02 A 141 TYR HDy H 1 7.15 0.02 A 141 TYR HEx H 1 6.86 0.02 A 141 TYR HEy H 1 6.86 0.02 A 141 TYR C C 13 178.7 0.2 A 141 TYR CA C 13 61.2 0.2 A 141 TYR CB C 13 39 0.2 A 141 TYR CDx C 13 133.3 0.02 A 141 TYR CDy C 13 133.3 0.02 A 141 TYR CEx C 13 118.3 0.02 A 141 TYR CEy C 13 118.3 0.02 A 141 TYR N N 15 121.7 0.2 A 142 ALA H H 1 8.51 0.02 A 142 ALA HA H 1 3.74 0.02 A 142 ALA HB% H 1 1.56 0.02 A 142 ALA C C 13 177.8 0.2 A 142 ALA CA C 13 54.6 0.2 A 142 ALA CB C 13 18.7 0.2 A 142 ALA N N 15 123 0.2 A 143 TYR H H 1 8.58 0.02 A 143 TYR HA H 1 4.31 0.02 A 143 TYR HBy H 1 3.35 0.02 A 143 TYR HBx H 1 2.8 0.02 A 143 TYR HDx H 1 6.93 0.02 A 143 TYR HDy H 1 6.93 0.02 A 143 TYR HEx H 1 6.79 0.02 A 143 TYR HEy H 1 6.79 0.02 A 143 TYR C C 13 179.7 0.2 A 143 TYR CA C 13 60.9 0.2 A 143 TYR CB C 13 39.4 0.2 A 143 TYR CDx C 13 133.2 0.02 A 143 TYR CDy C 13 133.2 0.02 A 143 TYR CEx C 13 118.5 0.02 A 143 TYR CEy C 13 118.5 0.02 A 143 TYR N N 15 122 0.2 A 144 ASP H H 1 9.58 0.02 A 144 ASP HA H 1 4.3 0.02 A 144 ASP HBy H 1 2.85 0.02 A 144 ASP HBx H 1 2.69 0.02 A 144 ASP C C 13 174.7 0.2 A 144 ASP CA C 13 57.4 0.2 A 144 ASP CB C 13 40.0 0.2 A 144 ASP N N 15 124.3 0.2 A 145 THR H H 1 7.62 0.02 A 145 THR HA H 1 4.22 0.02 A 145 THR HB H 1 4.16 0.02 A 145 THR HG2% H 1 0.87 0.02 A 145 THR C C 13 173.2 0.2 A 145 THR CA C 13 61.5 0.2 A 145 THR CB C 13 68.9 0.2 A 145 THR CG2 C 13 21.4 0.2 A 145 THR N N 15 108.1 0.2 A 146 ARG H H 1 7.66 0.02 A 146 ARG HA H 1 3.88 0.02 A 146 ARG HBy H 1 2.09 0.02 A 146 ARG HBx H 1 1.91 0.02 A 146 ARG HDy H 1 3.13 0.02 A 146 ARG HDx H 1 3.06 0.02 A 146 ARG HGx H 1 1.41 0.02 A 146 ARG HGy H 1 1.41 0.02 A 146 ARG C C 13 176 0.2 A 146 ARG CA C 13 57.2 0.2 A 146 ARG CB C 13 25.7 0.2 A 146 ARG CD C 13 43.1 0.2 A 146 ARG CG C 13 27.3 0.2 A 146 ARG N N 15 113.6 0.2 A 147 LEU H H 1 8.75 0.02 A 147 LEU HA H 1 4.19 0.02 A 147 LEU HBy H 1 1.68 0.02 A 147 LEU HBx H 1 1.38 0.02 A 147 LEU HD1% H 1 0.88 0.02 A 147 LEU HD2% H 1 0.81 0.02 A 147 LEU HG H 1 1.72 0.02 A 147 LEU C C 13 178.1 0.2 A 147 LEU CA C 13 56.6 0.2 A 147 LEU CB C 13 43.2 0.2 A 147 LEU CD1 C 13 26.0 0.02 A 147 LEU CD2 C 13 22.2 0.02 A 147 LEU CG C 13 26.5 0.2 A 147 LEU N N 15 118.4 0.2 A 148 ILE H H 1 6.93 0.02 A 148 ILE HA H 1 4.78 0.02 A 148 ILE HB H 1 2.21 0.02 A 148 ILE HD1% H 1 1.14 0.02 A 148 ILE HG1y H 1 1.25 0.02 A 148 ILE HG1x H 1 1.13 0.02 A 148 ILE HG2% H 1 0.85 0.02 A 148 ILE C C 13 174.6 0.2 A 148 ILE CA C 13 58.6 0.2 A 148 ILE CB C 13 41.3 0.2 A 148 ILE CD1 C 13 14.0 0.2 A 148 ILE CG1 C 13 24.3 0.2 A 148 ILE CG2 C 13 19.8 0.2 A 148 ILE N N 15 105.9 0.2 A 149 LYS H H 1 8.98 0.02 A 149 LYS HA H 1 4.31 0.02 A 149 LYS HBy H 1 1.95 0.02 A 149 LYS HBx H 1 1.73 0.02 A 149 LYS HDx H 1 1.62 0.02 A 149 LYS HDy H 1 1.62 0.02 A 149 LYS HEx H 1 2.95 0.02 A 149 LYS HEy H 1 2.95 0.02 A 149 LYS HGy H 1 1.42 0.02 A 149 LYS HGx H 1 1.39 0.02 A 149 LYS C C 13 175.6 0.2 A 149 LYS CA C 13 56.4 0.2 A 149 LYS CB C 13 33.5 0.2 A 149 LYS CD C 13 29 0.2 A 149 LYS CE C 13 42 0.2 A 149 LYS CG C 13 25.0 0.2 A 149 LYS N N 15 119.4 0.2 A 150 ALA H H 1 7.48 0.02 A 150 ALA HA H 1 4.53 0.02 A 150 ALA HB% H 1 1.29 0.02 A 150 ALA C C 13 176.2 0.2 A 150 ALA CA C 13 50.9 0.2 A 150 ALA CB C 13 21.5 0.2 A 150 ALA N N 15 119.6 0.2 A 151 MET H H 1 9.04 0.02 A 151 MET HA H 1 4.52 0.02 A 151 MET HBy H 1 1.84 0.02 A 151 MET HBx H 1 1.73 0.02 A 151 MET HE% H 1 1.70 0.02 A 151 MET HGx H 1 2.03 0.02 A 151 MET HGy H 1 2.03 0.02 A 151 MET CA C 13 52.7 0.2 A 151 MET CB C 13 33.3 0.2 A 151 MET CE C 13 16.5 0.2 A 151 MET CG C 13 32.1 0.2 A 151 MET N N 15 120.8 0.2 A 152 PRO HA H 1 4.2 0.02 A 152 PRO HBy H 1 1.69 0.02 A 152 PRO HBx H 1 1.09 0.02 A 152 PRO HDy H 1 3.68 0.02 A 152 PRO HDx H 1 2.75 0.02 A 152 PRO HGy H 1 1.12 0.02 A 152 PRO HGx H 1 0.16 0.02 A 152 PRO C C 13 172.6 0.2 A 152 PRO CA C 13 63.9 0.2 A 152 PRO CB C 13 31 0.2 A 152 PRO CD C 13 50.5 0.2 A 152 PRO CG C 13 25.9 0.2 A 153 SER H H 1 6.33 0.02 A 153 SER HA H 1 3.92 0.02 A 153 SER HBy H 1 3.93 0.02 A 153 SER HBx H 1 3.12 0.02 A 153 SER C C 13 175.1 0.2 A 153 SER CA C 13 57.1 0.2 A 153 SER CB C 13 63.6 0.2 A 153 SER N N 15 104.5 0.2 A 154 GLU H H 1 7.08 0.02 A 154 GLU HA H 1 4.11 0.02 A 154 GLU HB2 H 1 1.94 0.02 A 154 GLU HB3 H 1 1.86 0.02 A 154 GLU HGy H 1 2.18 0.02 A 154 GLU HGx H 1 2.1 0.02 A 154 GLU C C 13 176.7 0.2 A 154 GLU CA C 13 56.8 0.2 A 154 GLU CB C 13 30 0.2 A 154 GLU CG C 13 36.2 0.2 A 154 GLU N N 15 123.6 0.2 A 155 GLY H H 1 8.76 0.02 A 155 GLY HAy H 1 3.96 0.02 A 155 GLY HAx H 1 3.77 0.02 A 155 GLY C C 13 174.7 0.2 A 155 GLY CA C 13 45.7 0.2 A 155 GLY N N 15 112.6 0.2 A 156 ILE H H 1 7.24 0.02 A 156 ILE HA H 1 4.07 0.02 A 156 ILE HB H 1 1.89 0.02 A 156 ILE HD1% H 1 0.73 0.02 A 156 ILE HG1y H 1 1.67 0.02 A 156 ILE HG1x H 1 1.32 0.02 A 156 ILE HG2% H 1 0.78 0.02 A 156 ILE C C 13 175.8 0.2 A 156 ILE CA C 13 59.8 0.2 A 156 ILE CB C 13 37.9 0.2 A 156 ILE CD1 C 13 11.9 0.2 A 156 ILE CG1 C 13 27.2 0.2 A 156 ILE CG2 C 13 17.8 0.2 A 156 ILE N N 15 119.6 0.2 A 157 LYS H H 1 9.12 0.02 A 157 LYS HA H 1 4.46 0.02 A 157 LYS HBy H 1 1.72 0.02 A 157 LYS HBx H 1 1.67 0.02 A 157 LYS HDx H 1 1.68 0.02 A 157 LYS HDy H 1 1.68 0.02 A 157 LYS HEx H 1 2.94 0.02 A 157 LYS HEy H 1 2.94 0.02 A 157 LYS HGy H 1 1.42 0.02 A 157 LYS HGx H 1 1.35 0.02 A 157 LYS C C 13 176.1 0.2 A 157 LYS CA C 13 55.2 0.2 A 157 LYS CB C 13 33.9 0.2 A 157 LYS CD C 13 29 0.2 A 157 LYS CE C 13 42.2 0.2 A 157 LYS CG C 13 24.3 0.2 A 157 LYS N N 15 127.4 0.2 A 158 ARG H H 1 8.52 0.02 A 158 ARG HA H 1 4.58 0.02 A 158 ARG HBy H 1 1.8 0.02 A 158 ARG HBx H 1 1.67 0.02 A 158 ARG HDx H 1 3.06 0.02 A 158 ARG HDy H 1 3.06 0.02 A 158 ARG HGy H 1 1.66 0.02 A 158 ARG HGx H 1 1.46 0.02 A 158 ARG CA C 13 52.5 0.2 A 158 ARG CB C 13 29.7 0.2 A 158 ARG CD C 13 42.1 0.2 A 158 ARG CG C 13 26.5 0.2 A 158 ARG N N 15 123.3 0.2 A 159 PRO HA H 1 4.38 0.02 A 159 PRO HBy H 1 2.26 0.02 A 159 PRO HBx H 1 1.82 0.02 A 159 PRO HDy H 1 3.79 0.02 A 159 PRO HDx H 1 3.63 0.02 A 159 PRO HGx H 1 2 0.02 A 159 PRO HGy H 1 2 0.02 A 159 PRO C C 13 176.7 0.2 A 159 PRO CA C 13 62.9 0.2 A 159 PRO CB C 13 32.4 0.2 A 159 PRO CD C 13 50.7 0.2 A 159 PRO CG C 13 27.6 0.2 A 160 LYS H H 1 8.46 0.02 A 160 LYS HA H 1 4.28 0.02 A 160 LYS HBx H 1 1.73 0.02 A 160 LYS HBy H 1 1.73 0.02 A 160 LYS HDx H 1 1.68 0.02 A 160 LYS HDy H 1 1.68 0.02 A 160 LYS HEx H 1 2.99 0.02 A 160 LYS HEy H 1 2.99 0.02 A 160 LYS HGy H 1 1.57 0.02 A 160 LYS HGx H 1 1.42 0.02 A 160 LYS C C 13 176.5 0.2 A 160 LYS CA C 13 56.1 0.2 A 160 LYS CB C 13 33.5 0.2 A 160 LYS CD C 13 29.2 0.2 A 160 LYS CE C 13 42.2 0.2 A 160 LYS CG C 13 24.8 0.2 A 160 LYS N N 15 122.3 0.2 A 161 LYS H H 1 8.31 0.02 A 161 LYS HA H 1 4.28 0.02 A 161 LYS HBx H 1 1.74 0.02 A 161 LYS HBy H 1 1.74 0.02 A 161 LYS HDx H 1 1.66 0.02 A 161 LYS HDy H 1 1.66 0.02 A 161 LYS HEx H 1 2.94 0.02 A 161 LYS HEy H 1 2.94 0.02 A 161 LYS HGx H 1 1.41 0.02 A 161 LYS HGy H 1 1.41 0.02 A 161 LYS C C 13 176.3 0.2 A 161 LYS CA C 13 56.1 0.2 A 161 LYS CB C 13 33.4 0.2 A 161 LYS CD C 13 29.1 0.2 A 161 LYS CE C 13 42.1 0.2 A 161 LYS CG C 13 24.4 0.2 A 161 LYS N N 15 123.6 0.2 A 162 LYS H H 1 8.47 0.02 A 162 LYS HA H 1 4.3 0.02 A 162 LYS HBy H 1 1.78 0.02 A 162 LYS HBx H 1 1.73 0.02 A 162 LYS HDx H 1 1.68 0.02 A 162 LYS HDy H 1 1.68 0.02 A 162 LYS HEx H 1 2.99 0.02 A 162 LYS HEy H 1 2.99 0.02 A 162 LYS HGx H 1 1.42 0.02 A 162 LYS HGy H 1 1.42 0.02 A 162 LYS C C 13 176.4 0.2 A 162 LYS CA C 13 56.3 0.2 A 162 LYS CB C 13 33.4 0.2 A 162 LYS CD C 13 29.2 0.2 A 162 LYS CE C 13 42.1 0.2 A 162 LYS CG C 13 24.5 0.2 A 162 LYS N N 15 124.7 0.2 A 163 VAL H H 1 8.27 0.02 A 163 VAL HA H 1 4.12 0.02 A 163 VAL HB H 1 2.05 0.02 A 163 VAL HGx% H 1 0.91 0.02 A 163 VAL HGy% H 1 0.91 0.02 A 163 VAL C C 13 176 0.2 A 163 VAL CA C 13 62.3 0.2 A 163 VAL CB C 13 33 0.2 A 163 VAL CGx C 13 20.5 0.02 A 163 VAL CGy C 13 20.5 0.02 A 163 VAL N N 15 122.5 0.2 A 164 SER H H 1 8.41 0.02 A 164 SER HA H 1 4.49 0.02 A 164 SER HBx H 1 3.83 0.02 A 164 SER HBy H 1 3.83 0.02 A 164 SER C C 13 174.5 0.2 A 164 SER CA C 13 58.1 0.2 A 164 SER CB C 13 63.7 0.2 A 164 SER N N 15 120.1 0.2 A 165 VAL H H 1 8.21 0.02 A 165 VAL HA H 1 4.11 0.02 A 165 VAL HB H 1 2.07 0.02 A 165 VAL HGx% H 1 0.91 0.02 A 165 VAL HGy% H 1 0.91 0.02 A 165 VAL C C 13 176.1 0.2 A 165 VAL CA C 13 62.3 0.2 A 165 VAL CB C 13 32.8 0.2 A 165 VAL CGy C 13 20.8 0.02 A 165 VAL CGx C 13 20.2 0.02 A 165 VAL N N 15 122.1 0.2 A 166 GLU H H 1 8.47 0.02 A 166 GLU HA H 1 4.25 0.02 A 166 GLU HBy H 1 2 0.02 A 166 GLU HBx H 1 1.89 0.02 A 166 GLU HGx H 1 2.24 0.02 A 166 GLU HGy H 1 2.24 0.02 A 166 GLU C C 13 176.4 0.2 A 166 GLU CA C 13 56.4 0.2 A 166 GLU CB C 13 30.0 0.2 A 166 GLU CG C 13 36 0.2 A 166 GLU N N 15 124.1 0.2 A 167 LEU H H 1 8.23 0.02 A 167 LEU HA H 1 4.25 0.02 A 167 LEU HBy H 1 1.57 0.02 A 167 LEU HBx H 1 1.48 0.02 A 167 LEU HD1% H 1 0.87 0.02 A 167 LEU HD2% H 1 0.81 0.02 A 167 LEU HG H 1 1.58 0.02 A 167 LEU C C 13 177.4 0.2 A 167 LEU CA C 13 55.2 0.2 A 167 LEU CB C 13 42.3 0.2 A 167 LEU CD1 C 13 24.9 0.02 A 167 LEU CD2 C 13 23.3 0.02 A 167 LEU CG C 13 27.0 0.2 A 167 LEU N N 15 123.1 0.2 A 168 GLU H H 1 8.27 0.02 A 168 GLU HA H 1 4.14 0.02 A 168 GLU HBx H 1 1.86 0.02 A 168 GLU HBy H 1 1.86 0.02 A 168 GLU HGx H 1 2.14 0.02 A 168 GLU HGy H 1 2.14 0.02 A 168 GLU C C 13 176.2 0.2 A 168 GLU CA C 13 56.8 0.2 A 168 GLU CB C 13 30.3 0.2 A 168 GLU CG C 13 36 0.2 A 168 GLU N N 15 121.1 0.2 A 169 HIS H H 1 8.27 0.02 A 169 HIS HA H 1 4.76 0.02 A 169 HIS HBy H 1 2.99 0.02 A 169 HIS HBx H 1 2.82 0.02 A 169 HIS CA C 13 56.3 0.2 A 169 HIS CB C 13 30.4 0.2 A 169 HIS N N 15 119.7 0.2 A 173 HIS HA H 1 4.57 0.02 A 173 HIS HBy H 1 3.08 0.02 A 173 HIS HBx H 1 2.97 0.02 A 173 HIS CA C 13 55.9 0.2 A 173 HIS CB C 13 30.2 0.2 A 174 HIS H H 1 8.09 0.02 A 174 HIS HA H 1 4.39 0.02 A 174 HIS HBy H 1 3.16 0.02 A 174 HIS HBx H 1 3.04 0.02 A 174 HIS CA C 13 57.3 0.2 A 174 HIS CB C 13 30.2 0.2 A 174 HIS N N 15 125.4 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 65 PHE HA A 68 VAL HB 1.0 1.8 4.32 2 2 A 65 PHE HA A 68 VAL HGy% 1.0 1.8 4.48 3 3 A 65 PHE HA A 68 VAL H 1.0 1.8 4.60 4 4 A 65 PHE HA A 104 ILE HD1% 1.0 1.8 5.02 5 5 A 66 LYS H A 65 PHE HBy 1.0 1.8 4.33 6 5 A 65 PHE HBx A 66 LYS H 1.0 1.8 4.33 7 6 A 65 PHE HD% A 66 LYS HA 1.0 1.8 5.28 8 7 A 65 PHE HD% A 96 ILE HA 1.0 1.8 4.72 9 8 A 66 LYS HA A 66 LYS HGy 1.0 1.8 3.92 10 8 A 66 LYS HA A 66 LYS HGx 1.0 1.8 3.92 11 9 A 66 LYS HA A 69 ALA HB% 1.0 1.8 3.90 12 10 A 66 LYS HA A 69 ALA H 1.0 1.8 3.90 13 11 A 66 LYS HA A 96 ILE HD1% 1.0 1.8 4.50 14 12 A 66 LYS HA A 96 ILE HG2% 1.0 1.8 3.94 15 13 A 66 LYS HBx A 66 LYS HDx 1.0 1.8 3.65 16 13 A 66 LYS HBy A 66 LYS HDx 1.0 1.8 3.65 17 13 A 66 LYS HDy A 66 LYS HBy 1.0 1.8 3.65 18 13 A 66 LYS HBx A 66 LYS HDy 1.0 1.8 3.65 19 14 A 67 GLN H A 66 LYS HBy 1.0 1.8 4.29 20 14 A 66 LYS HBx A 67 GLN H 1.0 1.8 4.29 21 15 A 96 ILE HG2% A 66 LYS HBy 1.0 1.8 4.46 22 15 A 96 ILE HG2% A 66 LYS HBx 1.0 1.8 4.46 23 16 A 67 GLN HA A 66 LYS HGy 1.0 1.8 4.87 24 16 A 66 LYS HGx A 67 GLN HA 1.0 1.8 4.87 25 17 A 67 GLN H A 66 LYS HGy 1.0 1.8 4.57 26 17 A 66 LYS HGx A 67 GLN H 1.0 1.8 4.57 27 18 A 66 LYS H A 66 LYS HBy 1.0 1.8 3.67 28 18 A 66 LYS H A 66 LYS HBx 1.0 1.8 3.67 29 19 A 66 LYS H A 66 LYS HGy 1.0 1.8 4.36 30 19 A 66 LYS H A 66 LYS HGx 1.0 1.8 4.36 31 20 A 66 LYS H A 67 GLN H 1.0 1.8 4.33 32 21 A 67 GLN HA A 67 GLN HGy 1.0 1.8 3.80 33 21 A 67 GLN HA A 67 GLN HGx 1.0 1.8 3.80 34 22 A 67 GLN HA A 70 ASP HBx 1.0 1.8 3.92 35 22 A 67 GLN HA A 70 ASP HBy 1.0 1.8 3.92 36 23 A 67 GLN HA A 70 ASP H 1.0 1.8 4.53 37 24 A 68 VAL HGy% A 67 GLN HBx 1.0 1.8 4.28 38 24 A 68 VAL HGy% A 67 GLN HBy 1.0 1.8 4.28 39 25 A 68 VAL H A 67 GLN HBx 1.0 1.8 3.99 40 25 A 68 VAL H A 67 GLN HBy 1.0 1.8 3.99 41 26 A 67 GLN HE21 A 67 GLN HGy 1.0 1.8 3.47 42 26 A 67 GLN HGx A 67 GLN HE22 1.0 1.8 3.47 43 26 A 67 GLN HGx A 67 GLN HE21 1.0 1.8 3.47 44 26 A 67 GLN HE22 A 67 GLN HGy 1.0 1.8 3.47 45 27 A 67 GLN H A 67 GLN HBx 1.0 1.8 3.53 46 27 A 67 GLN H A 67 GLN HBy 1.0 1.8 3.53 47 28 A 67 GLN H A 67 GLN HGy 1.0 1.8 4.13 48 28 A 67 GLN H A 67 GLN HGx 1.0 1.8 4.13 49 29 A 68 VAL H A 67 GLN H 1.0 1.8 4.11 50 30 A 68 VAL HA A 68 VAL HGx% 1.0 1.8 3.67 51 31 A 68 VAL HGy% A 68 VAL HA 1.0 1.8 3.63 52 32 A 68 VAL HA A 71 ASP HBx 1.0 1.8 4.16 53 32 A 68 VAL HA A 71 ASP HBy 1.0 1.8 4.16 54 33 A 68 VAL HA A 71 ASP H 1.0 1.8 4.57 55 34 A 68 VAL HB A 69 ALA HA 1.0 1.8 5.39 56 35 A 68 VAL HB A 69 ALA H 1.0 1.8 4.36 57 36 A 68 VAL HB A 138 ILE HG2% 1.0 1.8 4.74 58 37 A 69 ALA H A 68 VAL HGx% 1.0 1.8 4.63 59 38 A 68 VAL HGx% A 71 ASP HBx 1.0 1.8 5.37 60 38 A 68 VAL HGx% A 71 ASP HBy 1.0 1.8 5.37 61 39 A 68 VAL HGx% A 72 TRP H 1.0 1.8 5.41 62 40 A 68 VAL HGx% A 138 ILE HG2% 1.0 1.8 3.66 63 41 A 68 VAL HGx% A 141 TYR HD% 1.0 1.8 3.88 64 42 A 68 VAL HGx% A 141 TYR HE% 1.0 1.8 3.79 65 43 A 68 VAL HGx% A 142 ALA HB% 1.0 1.8 3.62 66 44 A 68 VAL HGx% A 142 ALA H 1.0 1.8 4.44 67 45 A 68 VAL HGy% A 69 ALA H 1.0 1.8 4.62 68 46 A 68 VAL HB A 68 VAL H 1.0 1.8 3.97 69 47 A 68 VAL H A 68 VAL HGx% 1.0 1.8 4.38 70 48 A 68 VAL HGy% A 68 VAL H 1.0 1.8 3.52 71 49 A 68 VAL H A 69 ALA H 1.0 1.8 3.88 72 50 A 69 ALA HA A 72 TRP HBx 1.0 1.8 4.40 73 50 A 69 ALA HA A 72 TRP HBy 1.0 1.8 4.40 74 51 A 69 ALA HA A 72 TRP H 1.0 1.8 4.60 75 52 A 96 ILE HD1% A 69 ALA HA 1.0 1.8 5.29 76 53 A 69 ALA HA A 138 ILE HD1% 1.0 1.8 4.53 77 54 A 69 ALA HA A 138 ILE HG1y 1.0 1.8 4.69 78 54 A 69 ALA HA A 138 ILE HG1x 1.0 1.8 4.69 79 55 A 69 ALA HA A 138 ILE HG2% 1.0 1.8 4.13 80 56 A 69 ALA HB% A 70 ASP HA 1.0 1.8 5.29 81 57 A 69 ALA HB% A 70 ASP H 1.0 1.8 3.88 82 58 A 69 ALA HB% A 72 TRP HBx 1.0 1.8 5.30 83 58 A 69 ALA HB% A 72 TRP HBy 1.0 1.8 5.30 84 59 A 69 ALA HB% A 96 ILE HD1% 1.0 1.8 3.78 85 60 A 69 ALA HB% A 96 ILE HG1y 1.0 1.8 4.27 86 60 A 69 ALA HB% A 96 ILE HG1x 1.0 1.8 4.27 87 61 A 69 ALA HB% A 138 ILE HD1% 1.0 1.8 3.82 88 62 A 69 ALA HB% A 138 ILE HG2% 1.0 1.8 4.17 89 63 A 69 ALA HB% A 69 ALA H 1.0 1.8 3.56 90 64 A 69 ALA H A 138 ILE HG2% 1.0 1.8 4.98 91 65 A 70 ASP HA A 73 LEU HBy 1.0 1.8 4.48 92 65 A 70 ASP HA A 73 LEU HBx 1.0 1.8 4.48 93 66 A 70 ASP HA A 73 LEU HD1% 1.0 1.8 4.80 94 66 A 70 ASP HA A 73 LEU HD2% 1.0 1.8 4.80 95 67 A 70 ASP HA A 73 LEU H 1.0 1.8 4.60 96 68 A 71 ASP H A 70 ASP HBx 1.0 1.8 4.35 97 69 A 70 ASP HBy A 71 ASP H 1.0 1.8 4.35 98 70 A 70 ASP H A 70 ASP HBx 1.0 1.8 3.41 99 70 A 70 ASP HBy A 70 ASP H 1.0 1.8 3.41 100 71 A 70 ASP H A 71 ASP H 1.0 1.8 3.41 101 72 A 71 ASP HA A 74 LYS HBx 1.0 1.8 4.13 102 72 A 71 ASP HA A 74 LYS HBy 1.0 1.8 4.13 103 73 A 71 ASP HA A 74 LYS H 1.0 1.8 4.39 104 74 A 71 ASP HA A 75 GLN H 1.0 1.8 5.00 105 75 A 141 TYR HE% A 71 ASP HBx 1.0 1.8 5.00 106 75 A 71 ASP HBy A 141 TYR HE% 1.0 1.8 5.00 107 76 A 72 TRP H A 71 ASP HBx 1.0 1.8 4.60 108 77 A 71 ASP HBy A 72 TRP H 1.0 1.8 4.60 109 78 A 71 ASP H A 72 TRP H 1.0 1.8 4.25 110 79 A 72 TRP HA A 72 TRP HD1 1.0 1.8 4.64 111 80 A 72 TRP HA A 75 GLN HBx 1.0 1.8 4.30 112 80 A 72 TRP HA A 75 GLN HBy 1.0 1.8 4.30 113 81 A 72 TRP HA A 75 GLN HGy 1.0 1.8 4.73 114 81 A 72 TRP HA A 75 GLN HGx 1.0 1.8 4.73 115 82 A 75 GLN H A 72 TRP HA 1.0 1.8 4.23 116 83 A 73 LEU H A 72 TRP HBx 1.0 1.8 4.26 117 83 A 72 TRP HBy A 73 LEU H 1.0 1.8 4.26 118 84 A 72 TRP HD1 A 141 TYR HBx 1.0 1.8 4.80 119 85 A 72 TRP HD1 A 141 TYR HBy 1.0 1.8 4.80 120 86 A 72 TRP HE1 A 137 MET HBx 1.0 1.8 5.00 121 86 A 72 TRP HE1 A 137 MET HBy 1.0 1.8 5.00 122 87 A 72 TRP HE1 A 137 MET HGx 1.0 1.8 6.00 123 87 A 72 TRP HE1 A 137 MET HGy 1.0 1.8 6.00 124 88 A 72 TRP HE1 A 141 TYR HBx 1.0 1.8 6.05 125 89 A 72 TRP HE1 A 141 TYR HBy 1.0 1.8 6.05 126 90 A 72 TRP HE3 A 73 LEU HBy 1.0 1.8 6.05 127 91 A 73 LEU HBx A 72 TRP HE3 1.0 1.8 6.05 128 92 A 72 TRP HE3 A 137 MET HE% 1.0 1.8 6.15 129 93 A 72 TRP H A 72 TRP HBx 1.0 1.8 4.10 130 94 A 72 TRP H A 72 TRP HBy 1.0 1.8 4.10 131 95 A 72 TRP H A 73 LEU H 1.0 1.8 4.57 132 96 A 137 MET HE% A 72 TRP HZ2 1.0 1.8 6.00 133 97 A 72 TRP HZ3 A 73 LEU HD1% 1.0 1.8 4.58 134 97 A 73 LEU HD2% A 72 TRP HZ3 1.0 1.8 4.58 135 98 A 73 LEU HA A 73 LEU HD1% 1.0 1.8 3.66 136 98 A 73 LEU HD2% A 73 LEU HA 1.0 1.8 3.66 137 99 A 73 LEU HA A 76 TYR HBy 1.0 1.8 4.10 138 99 A 73 LEU HA A 76 TYR HBx 1.0 1.8 4.10 139 100 A 73 LEU HA A 76 TYR HD% 1.0 1.8 5.12 140 101 A 73 LEU HA A 76 TYR H 1.0 1.8 4.60 141 102 A 73 LEU HA A 77 ALA H 1.0 1.8 5.19 142 103 A 74 LYS H A 73 LEU HBy 1.0 1.8 4.37 143 103 A 73 LEU HBx A 74 LYS H 1.0 1.8 4.37 144 104 A 92 ILE HD1% A 73 LEU HBy 1.0 1.8 5.19 145 104 A 73 LEU HBx A 92 ILE HD1% 1.0 1.8 5.19 146 105 A 89 GLU HBx A 73 LEU HBy 1.0 1.8 6.05 147 105 A 73 LEU HBy A 89 GLU HBy 1.0 1.8 6.05 148 106 A 73 LEU HBx A 89 GLU HBx 1.0 1.8 6.05 149 106 A 73 LEU HBx A 89 GLU HBy 1.0 1.8 6.05 150 107 A 74 LYS H A 73 LEU HD1% 1.0 1.8 4.76 151 107 A 73 LEU HD2% A 74 LYS H 1.0 1.8 4.76 152 108 A 76 TYR HD% A 73 LEU HD1% 1.0 1.8 4.55 153 108 A 73 LEU HD2% A 76 TYR HD% 1.0 1.8 4.55 154 109 A 77 ALA H A 73 LEU HD1% 1.0 1.8 6.05 155 109 A 73 LEU HD2% A 77 ALA H 1.0 1.8 6.05 156 110 A 85 VAL HA A 73 LEU HD1% 1.0 1.8 5.03 157 110 A 73 LEU HD2% A 85 VAL HA 1.0 1.8 5.03 158 111 A 89 GLU HA A 73 LEU HD1% 1.0 1.8 3.92 159 111 A 73 LEU HD2% A 89 GLU HA 1.0 1.8 3.92 160 112 A 73 LEU HD2% A 89 GLU HBy 1.0 1.8 3.94 161 112 A 73 LEU HD1% A 89 GLU HBy 1.0 1.8 3.94 162 112 A 89 GLU HBx A 73 LEU HD1% 1.0 1.8 3.94 163 112 A 73 LEU HD2% A 89 GLU HBx 1.0 1.8 3.94 164 113 A 73 LEU HD1% A 89 GLU HGy 1.0 1.8 3.51 165 113 A 73 LEU HD2% A 89 GLU HGy 1.0 1.8 3.51 166 113 A 89 GLU HGx A 73 LEU HD1% 1.0 1.8 3.51 167 113 A 73 LEU HD2% A 89 GLU HGx 1.0 1.8 3.51 168 114 A 89 GLU H A 73 LEU HD1% 1.0 1.8 5.14 169 114 A 73 LEU HD2% A 89 GLU H 1.0 1.8 5.14 170 115 A 92 ILE HD1% A 73 LEU HD1% 1.0 1.8 3.60 171 115 A 73 LEU HD2% A 92 ILE HD1% 1.0 1.8 3.60 172 116 A 89 GLU HA A 73 LEU HG 1.0 1.8 6.05 173 117 A 73 LEU H A 73 LEU HBy 1.0 1.8 3.61 174 117 A 73 LEU HBx A 73 LEU H 1.0 1.8 3.61 175 118 A 73 LEU H A 73 LEU HD1% 1.0 1.8 4.54 176 118 A 73 LEU HD2% A 73 LEU H 1.0 1.8 4.54 177 119 A 73 LEU H A 74 LYS H 1.0 1.8 3.88 178 120 A 74 LYS HA A 74 LYS HDy 1.0 1.8 5.38 179 120 A 74 LYS HA A 74 LYS HDx 1.0 1.8 5.38 180 121 A 74 LYS HA A 74 LYS HGy 1.0 1.8 3.53 181 121 A 74 LYS HA A 74 LYS HGx 1.0 1.8 3.53 182 122 A 75 GLN HA A 74 LYS HBx 1.0 1.8 4.77 183 122 A 74 LYS HBy A 75 GLN HA 1.0 1.8 4.77 184 123 A 75 GLN H A 74 LYS HBx 1.0 1.8 3.54 185 123 A 74 LYS HBy A 75 GLN H 1.0 1.8 3.54 186 124 A 75 GLN H A 74 LYS HGy 1.0 1.8 4.60 187 124 A 75 GLN H A 74 LYS HGx 1.0 1.8 4.60 188 125 A 74 LYS H A 74 LYS HBx 1.0 1.8 4.23 189 126 A 74 LYS HBy A 74 LYS H 1.0 1.8 4.23 190 127 A 74 LYS H A 74 LYS HDy 1.0 1.8 6.05 191 128 A 74 LYS H A 75 GLN H 1.0 1.8 3.83 192 129 A 75 GLN HA A 77 ALA HB% 1.0 1.8 5.30 193 130 A 77 ALA H A 75 GLN HA 1.0 1.8 5.09 194 131 A 75 GLN HA A 78 ASN HD21 1.0 1.8 5.24 195 132 A 75 GLN HA A 78 ASN HD22 1.0 1.8 5.24 196 133 A 75 GLN HA A 78 ASN H 1.0 1.8 5.65 197 134 A 75 GLN HBy A 75 GLN HE22 1.0 1.8 4.59 198 134 A 75 GLN HBx A 75 GLN HE22 1.0 1.8 4.59 199 134 A 75 GLN HE21 A 75 GLN HBx 1.0 1.8 4.59 200 134 A 75 GLN HBy A 75 GLN HE21 1.0 1.8 4.59 201 135 A 76 TYR H A 75 GLN HBx 1.0 1.8 5.19 202 136 A 75 GLN HBy A 76 TYR H 1.0 1.8 5.19 203 137 A 75 GLN HE21 A 75 GLN HGy 1.0 1.8 3.50 204 137 A 75 GLN HE22 A 75 GLN HGy 1.0 1.8 3.50 205 137 A 75 GLN HGx A 75 GLN HE22 1.0 1.8 3.50 206 137 A 75 GLN HGx A 75 GLN HE21 1.0 1.8 3.50 207 138 A 75 GLN H A 75 GLN HGy 1.0 1.8 4.35 208 138 A 75 GLN H A 75 GLN HGx 1.0 1.8 4.35 209 139 A 75 GLN H A 76 TYR H 1.0 1.8 3.78 210 140 A 76 TYR HD% A 76 TYR HA 1.0 1.8 3.96 211 141 A 76 TYR HA A 76 TYR HE% 1.0 1.8 4.93 212 142 A 77 ALA H A 76 TYR HBy 1.0 1.8 4.02 213 142 A 76 TYR HBx A 77 ALA H 1.0 1.8 4.02 214 143 A 76 TYR HD% A 77 ALA HA 1.0 1.8 5.30 215 144 A 76 TYR HD% A 77 ALA H 1.0 1.8 5.09 216 145 A 76 TYR HD% A 85 VAL HA 1.0 1.8 4.75 217 146 A 76 TYR HD% A 85 VAL HG1% 1.0 1.8 4.80 218 147 A 76 TYR HD% A 85 VAL HG2% 1.0 1.8 4.65 219 148 A 76 TYR HE% A 80 VAL HG1% 1.0 1.8 4.64 220 149 A 76 TYR HE% A 80 VAL HG2% 1.0 1.8 4.54 221 150 A 85 VAL HA A 76 TYR HE% 1.0 1.8 4.53 222 151 A 76 TYR HE% A 85 VAL HG2% 1.0 1.8 5.19 223 152 A 76 TYR H A 76 TYR HBy 1.0 1.8 3.67 224 152 A 76 TYR HBx A 76 TYR H 1.0 1.8 3.67 225 153 A 76 TYR HD% A 76 TYR H 1.0 1.8 4.93 226 154 A 76 TYR H A 77 ALA H 1.0 1.8 4.15 227 155 A 77 ALA HA A 78 ASN HA 1.0 1.8 5.28 228 156 A 77 ALA HA A 80 VAL HG2% 1.0 1.8 4.44 229 157 A 77 ALA HB% A 78 ASN HA 1.0 1.8 4.69 230 158 A 77 ALA HB% A 78 ASN H 1.0 1.8 4.50 231 159 A 77 ALA HB% A 85 VAL HB 1.0 1.8 5.17 232 160 A 77 ALA HB% A 85 VAL HG1% 1.0 1.8 4.37 233 161 A 77 ALA HB% A 85 VAL HG2% 1.0 1.8 4.00 234 162 A 77 ALA H A 77 ALA HB% 1.0 1.8 3.60 235 163 A 77 ALA H A 78 ASN H 1.0 1.8 4.11 236 164 A 77 ALA H A 85 VAL HG1% 1.0 1.8 5.13 237 165 A 77 ALA H A 85 VAL HG2% 1.0 1.8 5.20 238 166 A 78 ASN HD22 A 78 ASN HBx 1.0 1.8 3.60 239 166 A 78 ASN HD21 A 78 ASN HBy 1.0 1.8 3.60 240 166 A 78 ASN HD22 A 78 ASN HBy 1.0 1.8 3.60 241 166 A 78 ASN HD21 A 78 ASN HBx 1.0 1.8 3.60 242 167 A 79 ASP H A 78 ASN HBy 1.0 1.8 4.44 243 167 A 78 ASN HBx A 79 ASP H 1.0 1.8 4.44 244 168 A 78 ASN H A 78 ASN HBy 1.0 1.8 3.64 245 168 A 78 ASN H A 78 ASN HBx 1.0 1.8 3.64 246 169 A 78 ASN H A 79 ASP H 1.0 1.8 4.50 247 170 A 80 VAL HG1% A 79 ASP HBy 1.0 1.8 4.80 248 170 A 80 VAL HG1% A 79 ASP HBx 1.0 1.8 4.80 249 171 A 79 ASP H A 80 VAL H 1.0 1.8 4.70 250 172 A 80 VAL HG1% A 80 VAL HA 1.0 1.8 3.52 251 173 A 80 VAL HG2% A 80 VAL HA 1.0 1.8 4.28 252 174 A 80 VAL HA A 81 LYS H 1.0 1.8 3.60 253 175 A 81 LYS H A 80 VAL HB 1.0 1.8 4.00 254 176 A 80 VAL HG1% A 81 LYS H 1.0 1.8 4.15 255 177 A 80 VAL HG2% A 81 LYS H 1.0 1.8 4.47 256 178 A 80 VAL HG2% A 84 SER HBx 1.0 1.8 4.60 257 178 A 80 VAL HG2% A 84 SER HBy 1.0 1.8 4.60 258 179 A 80 VAL HG1% A 80 VAL H 1.0 1.8 4.48 259 180 A 80 VAL HG2% A 80 VAL H 1.0 1.8 4.20 260 181 A 80 VAL H A 81 LYS H 1.0 1.8 5.00 261 182 A 81 LYS HA A 82 VAL HA 1.0 1.8 4.84 262 183 A 81 LYS HA A 82 VAL H 1.0 1.8 3.60 263 184 A 81 LYS HBy A 81 LYS HEx 1.0 1.8 5.48 264 184 A 81 LYS HBx A 81 LYS HEx 1.0 1.8 5.48 265 184 A 81 LYS HEy A 81 LYS HBy 1.0 1.8 5.48 266 184 A 81 LYS HBx A 81 LYS HEy 1.0 1.8 5.48 267 185 A 81 LYS H A 81 LYS HDx 1.0 1.8 5.30 268 185 A 81 LYS H A 81 LYS HDy 1.0 1.8 5.30 269 186 A 81 LYS H A 81 LYS HGy 1.0 1.8 4.15 270 186 A 81 LYS H A 81 LYS HGx 1.0 1.8 4.15 271 187 A 82 VAL HA A 82 VAL HGx% 1.0 1.8 3.60 272 187 A 82 VAL HA A 82 VAL HGy% 1.0 1.8 3.60 273 188 A 82 VAL HA A 83 SER HA 1.0 1.8 5.56 274 189 A 85 VAL HB A 82 VAL HA 1.0 1.8 4.80 275 190 A 85 VAL HG2% A 82 VAL HA 1.0 1.8 4.70 276 191 A 82 VAL HA A 85 VAL H 1.0 1.8 4.60 277 192 A 82 VAL HB A 83 SER H 1.0 1.8 4.94 278 193 A 83 SER HA A 82 VAL HGx% 1.0 1.8 4.44 279 193 A 82 VAL HGy% A 83 SER HA 1.0 1.8 4.44 280 194 A 82 VAL HGx% A 83 SER HBx 1.0 1.8 4.73 281 194 A 82 VAL HGy% A 83 SER HBx 1.0 1.8 4.73 282 194 A 83 SER HBy A 82 VAL HGx% 1.0 1.8 4.73 283 194 A 82 VAL HGy% A 83 SER HBy 1.0 1.8 4.73 284 195 A 83 SER H A 82 VAL HGx% 1.0 1.8 4.69 285 195 A 82 VAL HGy% A 83 SER H 1.0 1.8 4.69 286 196 A 82 VAL HGy% A 86 ARG HDx 1.0 1.8 4.30 287 196 A 82 VAL HGx% A 86 ARG HDx 1.0 1.8 4.30 288 196 A 86 ARG HDy A 82 VAL HGx% 1.0 1.8 4.30 289 196 A 82 VAL HGy% A 86 ARG HDy 1.0 1.8 4.30 290 197 A 82 VAL HGy% A 86 ARG HGx 1.0 1.8 4.80 291 197 A 82 VAL HGx% A 86 ARG HGx 1.0 1.8 4.80 292 197 A 86 ARG HGy A 82 VAL HGx% 1.0 1.8 4.80 293 197 A 82 VAL HGy% A 86 ARG HGy 1.0 1.8 4.80 294 198 A 86 ARG H A 82 VAL HGx% 1.0 1.8 4.68 295 198 A 82 VAL HGy% A 86 ARG H 1.0 1.8 4.68 296 199 A 82 VAL H A 82 VAL HB 1.0 1.8 3.81 297 200 A 82 VAL H A 82 VAL HGx% 1.0 1.8 4.10 298 200 A 82 VAL H A 82 VAL HGy% 1.0 1.8 4.10 299 201 A 83 SER HA A 86 ARG HBx 1.0 1.8 4.15 300 201 A 83 SER HA A 86 ARG HBy 1.0 1.8 4.15 301 202 A 83 SER HA A 86 ARG H 1.0 1.8 3.97 302 203 A 84 SER HA A 87 ALA HB% 1.0 1.8 3.86 303 204 A 84 SER HA A 87 ALA H 1.0 1.8 4.60 304 205 A 85 VAL H A 84 SER HBx 1.0 1.8 4.44 305 205 A 84 SER HBy A 85 VAL H 1.0 1.8 4.44 306 206 A 85 VAL HA A 85 VAL HG1% 1.0 1.8 3.60 307 207 A 85 VAL HA A 85 VAL HG2% 1.0 1.8 3.64 308 208 A 85 VAL HA A 88 ARG HBy 1.0 1.8 4.30 309 208 A 85 VAL HA A 88 ARG HBx 1.0 1.8 4.30 310 209 A 85 VAL HA A 88 ARG H 1.0 1.8 4.07 311 210 A 85 VAL HB A 86 ARG H 1.0 1.8 4.07 312 211 A 85 VAL HG1% A 86 ARG H 1.0 1.8 5.25 313 212 A 85 VAL HG1% A 88 ARG H 1.0 1.8 5.41 314 213 A 85 VAL HG2% A 86 ARG H 1.0 1.8 4.72 315 214 A 85 VAL HB A 85 VAL H 1.0 1.8 4.13 316 215 A 85 VAL HG1% A 85 VAL H 1.0 1.8 4.77 317 216 A 85 VAL HG2% A 85 VAL H 1.0 1.8 4.10 318 217 A 85 VAL H A 86 ARG H 1.0 1.8 4.40 319 218 A 86 ARG HA A 86 ARG HGx 1.0 1.8 3.82 320 218 A 86 ARG HGy A 86 ARG HA 1.0 1.8 3.82 321 219 A 86 ARG HA A 89 GLU HBy 1.0 1.8 4.40 322 220 A 89 GLU HBx A 86 ARG HA 1.0 1.8 4.40 323 221 A 89 GLU H A 86 ARG HA 1.0 1.8 4.60 324 222 A 87 ALA H A 86 ARG HBx 1.0 1.8 4.20 325 222 A 86 ARG HBy A 87 ALA H 1.0 1.8 4.20 326 223 A 86 ARG H A 86 ARG HBx 1.0 1.8 3.77 327 223 A 86 ARG H A 86 ARG HBy 1.0 1.8 3.77 328 224 A 86 ARG H A 86 ARG HDx 1.0 1.8 5.30 329 224 A 86 ARG HDy A 86 ARG H 1.0 1.8 5.30 330 225 A 86 ARG H A 86 ARG HGx 1.0 1.8 4.99 331 225 A 86 ARG HGy A 86 ARG H 1.0 1.8 4.99 332 226 A 86 ARG H A 87 ALA H 1.0 1.8 4.18 333 227 A 87 ALA HA A 90 LYS HBx 1.0 1.8 4.50 334 227 A 87 ALA HA A 90 LYS HBy 1.0 1.8 4.50 335 228 A 87 ALA HA A 90 LYS H 1.0 1.8 4.46 336 229 A 87 ALA HB% A 88 ARG H 1.0 1.8 3.63 337 230 A 87 ALA HB% A 87 ALA H 1.0 1.8 3.60 338 231 A 87 ALA H A 88 ARG H 1.0 1.8 4.04 339 232 A 88 ARG HA A 88 ARG HDy 1.0 1.8 4.45 340 232 A 88 ARG HA A 88 ARG HDx 1.0 1.8 4.45 341 233 A 88 ARG HA A 88 ARG HGx 1.0 1.8 3.90 342 233 A 88 ARG HA A 88 ARG HGy 1.0 1.8 3.90 343 234 A 88 ARG HA A 91 ALA HB% 1.0 1.8 4.02 344 235 A 88 ARG HA A 91 ALA H 1.0 1.8 4.76 345 236 A 88 ARG HA A 92 ILE H 1.0 1.8 5.00 346 237 A 89 GLU H A 88 ARG HBy 1.0 1.8 4.36 347 237 A 89 GLU H A 88 ARG HBx 1.0 1.8 4.36 348 238 A 88 ARG H A 88 ARG HDy 1.0 1.8 4.65 349 238 A 88 ARG H A 88 ARG HDx 1.0 1.8 4.65 350 239 A 88 ARG H A 88 ARG HGx 1.0 1.8 4.37 351 239 A 88 ARG H A 88 ARG HGy 1.0 1.8 4.37 352 240 A 89 GLU H A 88 ARG H 1.0 1.8 4.06 353 241 A 89 GLU HA A 92 ILE HB 1.0 1.8 5.40 354 242 A 89 GLU HA A 92 ILE H 1.0 1.8 4.80 355 243 A 90 LYS H A 89 GLU HBy 1.0 1.8 3.81 356 243 A 89 GLU HBx A 90 LYS H 1.0 1.8 3.81 357 244 A 90 LYS H A 89 GLU HGy 1.0 1.8 4.25 358 244 A 89 GLU HGx A 90 LYS H 1.0 1.8 4.25 359 245 A 89 GLU H A 89 GLU HGy 1.0 1.8 4.64 360 245 A 89 GLU HGx A 89 GLU H 1.0 1.8 4.64 361 246 A 89 GLU H A 90 LYS H 1.0 1.8 4.16 362 247 A 90 LYS HA A 90 LYS HGy 1.0 1.8 3.88 363 247 A 90 LYS HA A 90 LYS HGx 1.0 1.8 3.88 364 248 A 90 LYS HA A 93 GLN HBy 1.0 1.8 3.53 365 248 A 90 LYS HA A 93 GLN HBx 1.0 1.8 3.53 366 249 A 90 LYS HA A 93 GLN HGy 1.0 1.8 4.68 367 249 A 90 LYS HA A 93 GLN HGx 1.0 1.8 4.68 368 250 A 90 LYS HA A 93 GLN H 1.0 1.8 4.69 369 251 A 90 LYS H A 90 LYS HGy 1.0 1.8 4.05 370 251 A 90 LYS H A 90 LYS HGx 1.0 1.8 4.05 371 252 A 90 LYS H A 91 ALA H 1.0 1.8 3.74 372 253 A 91 ALA HA A 94 HIS HBy 1.0 1.8 4.90 373 253 A 91 ALA HA A 94 HIS HBx 1.0 1.8 4.90 374 254 A 91 ALA HA A 94 HIS HD2 1.0 1.8 4.57 375 255 A 91 ALA HA A 94 HIS H 1.0 1.8 4.60 376 256 A 91 ALA HA A 131 ILE HD1% 1.0 1.8 5.00 377 257 A 91 ALA HA A 131 ILE HG2% 1.0 1.8 5.30 378 258 A 91 ALA HB% A 92 ILE H 1.0 1.8 3.85 379 259 A 91 ALA HB% A 131 ILE H 1.0 1.8 5.50 380 260 A 91 ALA HB% A 91 ALA H 1.0 1.8 3.60 381 261 A 91 ALA H A 92 ILE H 1.0 1.8 3.99 382 262 A 92 ILE HD1% A 92 ILE HA 1.0 1.8 4.87 383 263 A 92 ILE HA A 95 ALA HB% 1.0 1.8 4.30 384 264 A 92 ILE HA A 95 ALA H 1.0 1.8 4.60 385 265 A 92 ILE HB A 93 GLN H 1.0 1.8 4.92 386 266 A 138 ILE HD1% A 92 ILE HB 1.0 1.8 4.66 387 267 A 138 ILE HD1% A 92 ILE HD1% 1.0 1.8 4.09 388 268 A 93 GLN H A 92 ILE HG1y 1.0 1.8 4.17 389 268 A 93 GLN H A 92 ILE HG1x 1.0 1.8 4.17 390 269 A 92 ILE HD1% A 92 ILE HG2% 1.0 1.8 3.64 391 270 A 93 GLN H A 92 ILE HG2% 1.0 1.8 4.74 392 271 A 92 ILE HG2% A 134 SER HA 1.0 1.8 6.00 393 272 A 92 ILE HG2% A 134 SER HBx 1.0 1.8 4.30 394 272 A 92 ILE HG2% A 134 SER HBy 1.0 1.8 4.30 395 273 A 92 ILE HG2% A 135 THR H 1.0 1.8 5.00 396 274 A 138 ILE HD1% A 92 ILE HG2% 1.0 1.8 3.81 397 275 A 92 ILE HD1% A 92 ILE H 1.0 1.8 4.65 398 276 A 92 ILE H A 92 ILE HG1y 1.0 1.8 4.40 399 276 A 92 ILE H A 92 ILE HG1x 1.0 1.8 4.40 400 277 A 92 ILE H A 92 ILE HG2% 1.0 1.8 3.86 401 278 A 92 ILE H A 93 GLN H 1.0 1.8 3.88 402 279 A 93 GLN HA A 96 ILE HB 1.0 1.8 4.06 403 280 A 96 ILE HD1% A 93 GLN HA 1.0 1.8 4.10 404 281 A 96 ILE HG2% A 93 GLN HA 1.0 1.8 4.64 405 282 A 93 GLN HA A 96 ILE H 1.0 1.8 4.51 406 283 A 93 GLN HBy A 93 GLN HE22 1.0 1.8 4.73 407 283 A 93 GLN HBx A 93 GLN HE22 1.0 1.8 4.73 408 283 A 93 GLN HE21 A 93 GLN HBy 1.0 1.8 4.73 409 283 A 93 GLN HBx A 93 GLN HE21 1.0 1.8 4.73 410 284 A 94 HIS H A 93 GLN HBy 1.0 1.8 4.47 411 284 A 93 GLN HBx A 94 HIS H 1.0 1.8 4.47 412 285 A 93 GLN HE21 A 93 GLN HGy 1.0 1.8 3.49 413 285 A 93 GLN HE22 A 93 GLN HGy 1.0 1.8 3.49 414 285 A 93 GLN HGx A 93 GLN HE22 1.0 1.8 3.49 415 285 A 93 GLN HGx A 93 GLN HE21 1.0 1.8 3.49 416 286 A 96 ILE HD1% A 93 GLN HGy 1.0 1.8 5.86 417 286 A 96 ILE HD1% A 93 GLN HGx 1.0 1.8 5.86 418 287 A 93 GLN HGx A 94 HIS H 1.0 1.8 5.54 419 288 A 94 HIS H A 93 GLN HGy 1.0 1.8 5.54 420 289 A 93 GLN H A 93 GLN HBy 1.0 1.8 3.60 421 289 A 93 GLN HBx A 93 GLN H 1.0 1.8 3.60 422 290 A 93 GLN H A 94 HIS H 1.0 1.8 4.25 423 291 A 94 HIS HA A 97 GLU HBx 1.0 1.8 4.86 424 291 A 94 HIS HA A 97 GLU HBy 1.0 1.8 4.86 425 292 A 94 HIS HA A 97 GLU H 1.0 1.8 4.60 426 293 A 95 ALA H A 94 HIS HBy 1.0 1.8 4.18 427 293 A 94 HIS HBx A 95 ALA H 1.0 1.8 4.18 428 294 A 94 HIS HD2 A 94 HIS H 1.0 1.8 5.05 429 295 A 94 HIS H A 95 ALA H 1.0 1.8 4.30 430 296 A 95 ALA HA A 98 ARG HBx 1.0 1.8 4.51 431 296 A 95 ALA HA A 98 ARG HBy 1.0 1.8 4.51 432 297 A 95 ALA HA A 98 ARG H 1.0 1.8 4.50 433 298 A 95 ALA HA A 99 PHE H 1.0 1.8 5.05 434 299 A 95 ALA HA A 115 PHE HE% 1.0 1.8 4.65 435 300 A 96 ILE HD1% A 95 ALA HB% 1.0 1.8 5.64 436 301 A 95 ALA HB% A 96 ILE H 1.0 1.8 4.11 437 302 A 95 ALA HB% A 99 PHE HD% 1.0 1.8 4.31 438 303 A 95 ALA HB% A 99 PHE HE% 1.0 1.8 4.75 439 304 A 95 ALA HB% A 115 PHE HE% 1.0 1.8 4.83 440 305 A 95 ALA HB% A 115 PHE HZ 1.0 1.8 4.72 441 306 A 95 ALA HB% A 139 PHE HZ 1.0 1.8 5.30 442 307 A 95 ALA HB% A 95 ALA H 1.0 1.8 3.62 443 308 A 95 ALA H A 96 ILE H 1.0 1.8 3.98 444 309 A 96 ILE HA A 96 ILE HD1% 1.0 1.8 4.51 445 310 A 96 ILE HA A 96 ILE HG2% 1.0 1.8 3.75 446 311 A 96 ILE HA A 99 PHE HBy 1.0 1.8 4.70 447 311 A 96 ILE HA A 99 PHE HBx 1.0 1.8 4.70 448 312 A 96 ILE HA A 99 PHE H 1.0 1.8 5.00 449 313 A 96 ILE HA A 100 ASN H 1.0 1.8 5.29 450 314 A 96 ILE HD1% A 96 ILE HB 1.0 1.8 3.59 451 315 A 96 ILE HB A 97 GLU H 1.0 1.8 3.79 452 316 A 96 ILE HD1% A 97 GLU H 1.0 1.8 5.36 453 317 A 96 ILE HD1% A 96 ILE HG2% 1.0 1.8 3.60 454 318 A 96 ILE HG2% A 96 ILE HG1y 1.0 1.8 3.59 455 318 A 96 ILE HG2% A 96 ILE HG1x 1.0 1.8 3.59 456 319 A 96 ILE HG2% A 97 GLU HA 1.0 1.8 4.35 457 320 A 96 ILE HG2% A 97 GLU H 1.0 1.8 4.22 458 321 A 96 ILE HG2% A 100 ASN HA 1.0 1.8 4.22 459 322 A 96 ILE HG2% A 100 ASN H 1.0 1.8 5.07 460 323 A 96 ILE HB A 96 ILE H 1.0 1.8 3.77 461 324 A 96 ILE HD1% A 96 ILE H 1.0 1.8 4.15 462 325 A 96 ILE H A 96 ILE HG1y 1.0 1.8 4.93 463 325 A 96 ILE HG1x A 96 ILE H 1.0 1.8 4.93 464 326 A 96 ILE HG2% A 96 ILE H 1.0 1.8 4.15 465 327 A 96 ILE H A 97 GLU H 1.0 1.8 4.15 466 328 A 97 GLU HA A 97 GLU HGx 1.0 1.8 4.14 467 329 A 97 GLU HA A 97 GLU HGy 1.0 1.8 4.14 468 330 A 97 GLU HA A 100 ASN HBx 1.0 1.8 4.82 469 330 A 97 GLU HA A 100 ASN HBy 1.0 1.8 4.82 470 331 A 100 ASN H A 97 GLU HA 1.0 1.8 4.60 471 332 A 98 ARG H A 97 GLU HBx 1.0 1.8 3.89 472 332 A 97 GLU HBy A 98 ARG H 1.0 1.8 3.89 473 333 A 98 ARG H A 97 GLU HGx 1.0 1.8 4.82 474 333 A 98 ARG H A 97 GLU HGy 1.0 1.8 4.82 475 334 A 97 GLU H A 97 GLU HBx 1.0 1.8 3.60 476 334 A 97 GLU HBy A 97 GLU H 1.0 1.8 3.60 477 335 A 97 GLU H A 97 GLU HGx 1.0 1.8 4.34 478 335 A 97 GLU H A 97 GLU HGy 1.0 1.8 4.34 479 336 A 97 GLU H A 98 ARG H 1.0 1.8 3.92 480 337 A 98 ARG HA A 98 ARG HDx 1.0 1.8 4.58 481 337 A 98 ARG HA A 98 ARG HDy 1.0 1.8 4.58 482 338 A 99 PHE H A 98 ARG HBx 1.0 1.8 4.08 483 338 A 98 ARG HBy A 99 PHE H 1.0 1.8 4.08 484 339 A 98 ARG H A 98 ARG HBx 1.0 1.8 3.95 485 340 A 98 ARG HBy A 98 ARG H 1.0 1.8 3.95 486 341 A 98 ARG H A 99 PHE H 1.0 1.8 3.89 487 342 A 99 PHE HD% A 99 PHE HA 1.0 1.8 3.87 488 343 A 99 PHE HA A 102 LYS HBx 1.0 1.8 4.64 489 343 A 99 PHE HA A 102 LYS HBy 1.0 1.8 4.64 490 344 A 99 PHE HA A 107 ILE HD1% 1.0 1.8 5.87 491 345 A 100 ASN H A 99 PHE HBy 1.0 1.8 4.44 492 345 A 99 PHE HBx A 100 ASN H 1.0 1.8 4.44 493 346 A 107 ILE HD1% A 99 PHE HBy 1.0 1.8 4.36 494 346 A 99 PHE HBx A 107 ILE HD1% 1.0 1.8 4.36 495 347 A 99 PHE HD% A 107 ILE HD1% 1.0 1.8 4.69 496 348 A 99 PHE HE% A 107 ILE HG2% 1.0 1.8 5.00 497 349 A 99 PHE H A 99 PHE HD% 1.0 1.8 4.71 498 350 A 99 PHE H A 99 PHE HE% 1.0 1.8 5.73 499 351 A 99 PHE H A 100 ASN HA 1.0 1.8 5.53 500 352 A 99 PHE H A 100 ASN HBx 1.0 1.8 5.30 501 352 A 99 PHE H A 100 ASN HBy 1.0 1.8 5.30 502 353 A 101 THR HG2% A 100 ASN HBx 1.0 1.8 4.85 503 353 A 100 ASN HBy A 101 THR HG2% 1.0 1.8 4.85 504 354 A 101 THR H A 100 ASN HBx 1.0 1.8 4.29 505 354 A 100 ASN HBy A 101 THR H 1.0 1.8 4.29 506 355 A 101 THR HG2% A 100 ASN HD22 1.0 1.8 4.85 507 355 A 101 THR HG2% A 100 ASN HD21 1.0 1.8 4.85 508 356 A 100 ASN H A 101 THR HG2% 1.0 1.8 4.25 509 357 A 101 THR HG2% A 101 THR HA 1.0 1.8 3.51 510 358 A 101 THR HG2% A 102 LYS H 1.0 1.8 5.28 511 359 A 101 THR HG2% A 101 THR H 1.0 1.8 4.30 512 360 A 102 LYS HA A 103 PRO HBy 1.0 1.8 5.41 513 360 A 102 LYS HA A 103 PRO HBx 1.0 1.8 5.41 514 361 A 102 LYS HA A 103 PRO HDy 1.0 1.8 3.70 515 361 A 102 LYS HA A 103 PRO HDx 1.0 1.8 3.70 516 362 A 102 LYS HBx A 102 LYS HEx 1.0 1.8 4.94 517 362 A 102 LYS HBy A 102 LYS HEx 1.0 1.8 4.94 518 362 A 102 LYS HEy A 102 LYS HBx 1.0 1.8 4.94 519 362 A 102 LYS HBy A 102 LYS HEy 1.0 1.8 4.94 520 363 A 102 LYS HBy A 103 PRO HDy 1.0 1.8 3.86 521 363 A 102 LYS HBx A 103 PRO HDy 1.0 1.8 3.86 522 363 A 103 PRO HDx A 102 LYS HBx 1.0 1.8 3.86 523 363 A 102 LYS HBy A 103 PRO HDx 1.0 1.8 3.86 524 364 A 102 LYS HDy A 103 PRO HDy 1.0 1.8 5.56 525 364 A 102 LYS HDx A 103 PRO HDy 1.0 1.8 5.56 526 364 A 103 PRO HDx A 102 LYS HDy 1.0 1.8 5.56 527 364 A 103 PRO HDx A 102 LYS HDx 1.0 1.8 5.56 528 365 A 102 LYS HGx A 103 PRO HDy 1.0 1.8 4.46 529 365 A 102 LYS HGy A 103 PRO HDy 1.0 1.8 4.46 530 365 A 103 PRO HDx A 102 LYS HGy 1.0 1.8 4.46 531 365 A 103 PRO HDx A 102 LYS HGx 1.0 1.8 4.46 532 366 A 102 LYS H A 102 LYS HBx 1.0 1.8 4.25 533 367 A 102 LYS HBy A 102 LYS H 1.0 1.8 4.25 534 368 A 102 LYS H A 102 LYS HGy 1.0 1.8 4.23 535 368 A 102 LYS H A 102 LYS HGx 1.0 1.8 4.23 536 369 A 104 ILE HD1% A 104 ILE HA 1.0 1.8 4.52 537 370 A 107 ILE HD1% A 104 ILE HA 1.0 1.8 4.05 538 371 A 104 ILE HA A 107 ILE HG1y 1.0 1.8 5.32 539 371 A 104 ILE HA A 107 ILE HG1x 1.0 1.8 5.32 540 372 A 104 ILE HA A 107 ILE H 1.0 1.8 5.21 541 373 A 104 ILE HB A 105 GLN H 1.0 1.8 5.15 542 374 A 107 ILE HD1% A 104 ILE HB 1.0 1.8 5.42 543 375 A 104 ILE HD1% A 107 ILE HD1% 1.0 1.8 4.64 544 376 A 104 ILE HD1% A 138 ILE HG2% 1.0 1.8 3.82 545 377 A 104 ILE HD1% A 139 PHE HA 1.0 1.8 4.70 546 378 A 104 ILE HD1% A 139 PHE HD% 1.0 1.8 4.08 547 379 A 104 ILE HD1% A 142 ALA HB% 1.0 1.8 3.48 548 380 A 104 ILE HD1% A 143 TYR H 1.0 1.8 5.86 549 381 A 104 ILE HG1y A 105 GLN HBx 1.0 1.8 5.87 550 381 A 104 ILE HG1x A 105 GLN HBx 1.0 1.8 5.87 551 381 A 105 GLN HBy A 104 ILE HG1x 1.0 1.8 5.87 552 381 A 104 ILE HG1y A 105 GLN HBy 1.0 1.8 5.87 553 382 A 107 ILE HD1% A 104 ILE HG1x 1.0 1.8 5.20 554 383 A 107 ILE HD1% A 104 ILE HG1y 1.0 1.8 5.20 555 384 A 104 ILE HD1% A 104 ILE HG2% 1.0 1.8 3.60 556 385 A 104 ILE HG2% A 104 ILE HG1x 1.0 1.8 3.64 557 385 A 104 ILE HG1y A 104 ILE HG2% 1.0 1.8 3.64 558 386 A 104 ILE HG2% A 105 GLN HA 1.0 1.8 4.63 559 387 A 104 ILE HG2% A 105 GLN HBx 1.0 1.8 4.53 560 387 A 105 GLN HBy A 104 ILE HG2% 1.0 1.8 4.53 561 388 A 104 ILE HG2% A 105 GLN HGy 1.0 1.8 4.72 562 388 A 104 ILE HG2% A 105 GLN HGx 1.0 1.8 4.72 563 389 A 105 GLN H A 104 ILE HG2% 1.0 1.8 3.79 564 390 A 104 ILE HG2% A 148 ILE HG2% 1.0 1.8 3.63 565 391 A 104 ILE HG2% A 104 ILE H 1.0 1.8 4.58 566 392 A 107 ILE H A 105 GLN HA 1.0 1.8 5.21 567 393 A 105 GLN HA A 148 ILE HG2% 1.0 1.8 3.90 568 394 A 106 THR HA A 105 GLN HBx 1.0 1.8 5.32 569 394 A 105 GLN HBy A 106 THR HA 1.0 1.8 5.32 570 395 A 148 ILE HG2% A 105 GLN HBx 1.0 1.8 3.80 571 395 A 105 GLN HBy A 148 ILE HG2% 1.0 1.8 3.80 572 396 A 106 THR HG2% A 105 GLN HGy 1.0 1.8 5.20 573 396 A 105 GLN HGx A 106 THR HG2% 1.0 1.8 5.20 574 397 A 106 THR H A 105 GLN HGy 1.0 1.8 5.23 575 397 A 105 GLN HGx A 106 THR H 1.0 1.8 5.23 576 398 A 148 ILE HG2% A 105 GLN HGy 1.0 1.8 4.13 577 398 A 105 GLN HGx A 148 ILE HG2% 1.0 1.8 4.13 578 399 A 105 GLN H A 105 GLN HBx 1.0 1.8 3.76 579 399 A 105 GLN H A 105 GLN HBy 1.0 1.8 3.76 580 400 A 105 GLN H A 105 GLN HGx 1.0 1.8 4.68 581 401 A 105 GLN H A 105 GLN HGy 1.0 1.8 4.68 582 402 A 105 GLN H A 106 THR HG2% 1.0 1.8 5.04 583 403 A 105 GLN H A 106 THR H 1.0 1.8 4.20 584 404 A 105 GLN H A 148 ILE HG2% 1.0 1.8 4.73 585 405 A 106 THR HA A 106 THR HG2% 1.0 1.8 3.53 586 406 A 106 THR HA A 107 ILE HA 1.0 1.8 5.67 587 407 A 107 ILE H A 106 THR HG2% 1.0 1.8 5.01 588 408 A 106 THR HG2% A 106 THR H 1.0 1.8 4.92 589 408 A 106 THR H A 106 THR HG1 1.0 1.8 4.92 590 409 A 106 THR HG2% A 106 THR H 1.0 1.8 4.11 591 410 A 107 ILE H A 106 THR H 1.0 1.8 3.86 592 411 A 107 ILE HD1% A 107 ILE HA 1.0 1.8 5.20 593 412 A 107 ILE HA A 108 LYS HA 1.0 1.8 5.09 594 413 A 107 ILE HA A 108 LYS HGy 1.0 1.8 4.86 595 413 A 107 ILE HA A 108 LYS HGx 1.0 1.8 4.86 596 414 A 107 ILE HA A 108 LYS H 1.0 1.8 3.50 597 415 A 107 ILE HA A 111 ASP HBy 1.0 1.8 5.63 598 415 A 107 ILE HA A 111 ASP HBx 1.0 1.8 5.63 599 416 A 108 LYS H A 107 ILE HB 1.0 1.8 4.84 600 417 A 107 ILE HD1% A 111 ASP HBy 1.0 1.8 5.26 601 417 A 107 ILE HD1% A 111 ASP HBx 1.0 1.8 5.26 602 418 A 107 ILE HD1% A 139 PHE HB2 1.0 1.8 5.97 603 418 A 107 ILE HD1% A 139 PHE HB3 1.0 1.8 5.97 604 419 A 107 ILE HD1% A 139 PHE HD% 1.0 1.8 4.49 605 420 A 107 ILE HD1% A 107 ILE HG2% 1.0 1.8 3.76 606 421 A 107 ILE HG2% A 108 LYS HA 1.0 1.8 5.09 607 422 A 107 ILE HG2% A 108 LYS H 1.0 1.8 4.39 608 423 A 107 ILE HG2% A 111 ASP HBy 1.0 1.8 3.88 609 423 A 107 ILE HG2% A 111 ASP HBx 1.0 1.8 3.88 610 424 A 107 ILE HG2% A 111 ASP H 1.0 1.8 4.88 611 425 A 107 ILE HG2% A 112 TYR HBx 1.0 1.8 4.72 612 425 A 107 ILE HG2% A 112 TYR HBy 1.0 1.8 4.72 613 426 A 107 ILE HG2% A 112 TYR H 1.0 1.8 4.77 614 427 A 107 ILE H A 107 ILE HB 1.0 1.8 3.61 615 428 A 107 ILE HD1% A 107 ILE H 1.0 1.8 4.43 616 429 A 107 ILE H A 107 ILE HG1y 1.0 1.8 4.51 617 429 A 107 ILE HG1x A 107 ILE H 1.0 1.8 4.51 618 430 A 107 ILE HG2% A 107 ILE H 1.0 1.8 4.27 619 431 A 108 LYS HA A 108 LYS HDx 1.0 1.8 4.60 620 431 A 108 LYS HA A 108 LYS HDy 1.0 1.8 4.60 621 432 A 108 LYS HA A 111 ASP HBy 1.0 1.8 5.67 622 432 A 108 LYS HA A 111 ASP HBx 1.0 1.8 5.67 623 433 A 109 LYS H A 108 LYS HBy 1.0 1.8 4.47 624 433 A 108 LYS HBx A 109 LYS H 1.0 1.8 4.47 625 434 A 110 HIS H A 108 LYS HBy 1.0 1.8 4.59 626 434 A 108 LYS HBx A 110 HIS H 1.0 1.8 4.59 627 435 A 111 ASP H A 108 LYS HBy 1.0 1.8 4.17 628 435 A 111 ASP H A 108 LYS HBx 1.0 1.8 4.17 629 436 A 111 ASP H A 108 LYS HDx 1.0 1.8 5.56 630 436 A 111 ASP H A 108 LYS HDy 1.0 1.8 5.56 631 437 A 111 ASP H A 108 LYS HEy 1.0 1.8 4.40 632 437 A 111 ASP H A 108 LYS HEx 1.0 1.8 4.40 633 438 A 108 LYS H A 108 LYS HDx 1.0 1.8 4.94 634 438 A 108 LYS H A 108 LYS HDy 1.0 1.8 4.94 635 439 A 108 LYS H A 108 LYS HEy 1.0 1.8 4.71 636 439 A 108 LYS H A 108 LYS HEx 1.0 1.8 4.71 637 440 A 108 LYS H A 108 LYS HGy 1.0 1.8 4.27 638 440 A 108 LYS HGx A 108 LYS H 1.0 1.8 4.27 639 441 A 109 LYS HA A 112 TYR HBx 1.0 1.8 4.30 640 442 A 112 TYR HBy A 109 LYS HA 1.0 1.8 4.30 641 443 A 109 LYS HA A 112 TYR HD% 1.0 1.8 5.90 642 444 A 112 TYR H A 109 LYS HA 1.0 1.8 4.60 643 445 A 109 LYS HA A 156 ILE HD1% 1.0 1.8 4.89 644 446 A 109 LYS HBx A 109 LYS HEy 1.0 1.8 4.17 645 446 A 109 LYS HBy A 109 LYS HEy 1.0 1.8 4.17 646 446 A 109 LYS HEx A 109 LYS HBy 1.0 1.8 4.17 647 446 A 109 LYS HBx A 109 LYS HEx 1.0 1.8 4.17 648 447 A 109 LYS H A 109 LYS HDx 1.0 1.8 5.22 649 447 A 109 LYS H A 109 LYS HDy 1.0 1.8 5.22 650 448 A 109 LYS H A 110 HIS H 1.0 1.8 5.38 651 449 A 110 HIS HA A 113 GLN HBx 1.0 1.8 4.07 652 449 A 110 HIS HA A 113 GLN HBy 1.0 1.8 4.07 653 450 A 110 HIS HA A 113 GLN H 1.0 1.8 4.79 654 451 A 110 HIS HA A 114 ARG H 1.0 1.8 5.00 655 452 A 110 HIS HE1 A 110 HIS HBy 1.0 1.8 5.01 656 452 A 110 HIS HBx A 110 HIS HE1 1.0 1.8 5.01 657 453 A 111 ASP H A 110 HIS HBy 1.0 1.8 3.86 658 453 A 111 ASP H A 110 HIS HBx 1.0 1.8 3.86 659 454 A 111 ASP H A 110 HIS H 1.0 1.8 4.60 660 455 A 111 ASP HA A 114 ARG HBx 1.0 1.8 4.30 661 455 A 111 ASP HA A 114 ARG HBy 1.0 1.8 4.30 662 456 A 111 ASP HA A 114 ARG HDy 1.0 1.8 4.82 663 456 A 111 ASP HA A 114 ARG HDx 1.0 1.8 4.82 664 457 A 111 ASP HA A 114 ARG HGx 1.0 1.8 4.72 665 457 A 111 ASP HA A 114 ARG HGy 1.0 1.8 4.72 666 458 A 114 ARG H A 111 ASP HA 1.0 1.8 4.60 667 459 A 112 TYR H A 111 ASP HBy 1.0 1.8 4.57 668 459 A 111 ASP HBx A 112 TYR H 1.0 1.8 4.57 669 460 A 111 ASP H A 111 ASP HBy 1.0 1.8 3.55 670 460 A 111 ASP HBx A 111 ASP H 1.0 1.8 3.55 671 461 A 111 ASP H A 112 TYR H 1.0 1.8 3.69 672 462 A 112 TYR HD% A 112 TYR HA 1.0 1.8 4.35 673 463 A 112 TYR HA A 115 PHE HBx 1.0 1.8 4.72 674 463 A 112 TYR HA A 115 PHE HBy 1.0 1.8 4.72 675 464 A 112 TYR HA A 115 PHE H 1.0 1.8 4.60 676 465 A 156 ILE HG2% A 112 TYR HBx 1.0 1.8 6.00 677 465 A 112 TYR HBy A 156 ILE HG2% 1.0 1.8 6.00 678 466 A 113 GLN H A 112 TYR HBx 1.0 1.8 5.17 679 467 A 156 ILE HD1% A 112 TYR HBx 1.0 1.8 5.20 680 468 A 112 TYR HBy A 113 GLN H 1.0 1.8 5.17 681 469 A 112 TYR HBy A 156 ILE HD1% 1.0 1.8 5.20 682 470 A 112 TYR HD% A 153 SER HA 1.0 1.8 4.07 683 471 A 112 TYR HD% A 153 SER HBy 1.0 1.8 4.83 684 471 A 112 TYR HD% A 153 SER HBx 1.0 1.8 4.83 685 472 A 112 TYR HD% A 156 ILE HD1% 1.0 1.8 4.18 686 473 A 112 TYR HD% A 156 ILE HG1y 1.0 1.8 4.30 687 473 A 112 TYR HD% A 156 ILE HG1x 1.0 1.8 4.30 688 474 A 112 TYR HD% A 156 ILE HG2% 1.0 1.8 4.72 689 475 A 112 TYR HE% A 115 PHE HD% 1.0 1.8 4.79 690 476 A 112 TYR HE% A 116 VAL HG2% 1.0 1.8 4.70 691 477 A 112 TYR HE% A 132 VAL HG1% 1.0 1.8 4.72 692 478 A 112 TYR HE% A 135 THR HG2% 1.0 1.8 3.97 693 479 A 153 SER HA A 112 TYR HE% 1.0 1.8 4.80 694 480 A 112 TYR HE% A 153 SER HBy 1.0 1.8 4.30 695 480 A 153 SER HBx A 112 TYR HE% 1.0 1.8 4.30 696 481 A 112 TYR H A 112 TYR HBx 1.0 1.8 4.02 697 482 A 112 TYR HBy A 112 TYR H 1.0 1.8 4.02 698 483 A 112 TYR H A 113 GLN H 1.0 1.8 4.23 699 484 A 113 GLN HA A 113 GLN HE21 1.0 1.8 4.11 700 484 A 113 GLN HA A 113 GLN HE22 1.0 1.8 4.11 701 485 A 113 GLN HA A 113 GLN HE21 1.0 1.8 4.92 702 486 A 113 GLN HA A 113 GLN HE22 1.0 1.8 4.92 703 487 A 113 GLN HA A 113 GLN HGx 1.0 1.8 3.95 704 487 A 113 GLN HA A 113 GLN HGy 1.0 1.8 3.95 705 488 A 113 GLN HA A 116 VAL HB 1.0 1.8 4.06 706 489 A 116 VAL HG2% A 113 GLN HA 1.0 1.8 4.32 707 490 A 113 GLN HA A 116 VAL H 1.0 1.8 4.68 708 491 A 113 GLN HA A 117 ASP H 1.0 1.8 5.00 709 492 A 156 ILE HD1% A 113 GLN HA 1.0 1.8 4.05 710 493 A 156 ILE HG2% A 113 GLN HA 1.0 1.8 4.70 711 494 A 114 ARG H A 113 GLN HBx 1.0 1.8 3.74 712 494 A 113 GLN HBy A 114 ARG H 1.0 1.8 3.74 713 495 A 156 ILE HD1% A 113 GLN HBx 1.0 1.8 4.30 714 495 A 156 ILE HD1% A 113 GLN HBy 1.0 1.8 4.30 715 496 A 113 GLN HE21 A 116 VAL HG1% 1.0 1.8 4.46 716 496 A 113 GLN HE22 A 116 VAL HG1% 1.0 1.8 4.46 717 497 A 113 GLN HE21 A 117 ASP H 1.0 1.8 5.63 718 497 A 113 GLN HE22 A 117 ASP H 1.0 1.8 5.63 719 498 A 156 ILE HD1% A 113 GLN HE21 1.0 1.8 4.85 720 498 A 156 ILE HD1% A 113 GLN HE22 1.0 1.8 4.85 721 499 A 156 ILE HG2% A 113 GLN HE21 1.0 1.8 4.38 722 499 A 156 ILE HG2% A 113 GLN HE22 1.0 1.8 4.38 723 500 A 113 GLN HE21 A 116 VAL HG1% 1.0 1.8 5.12 724 501 A 156 ILE HD1% A 113 GLN HE21 1.0 1.8 5.60 725 502 A 113 GLN HE22 A 116 VAL HG1% 1.0 1.8 5.12 726 503 A 156 ILE HD1% A 113 GLN HE22 1.0 1.8 5.60 727 504 A 113 GLN HE21 A 113 GLN HGy 1.0 1.8 3.52 728 504 A 113 GLN HE21 A 113 GLN HGx 1.0 1.8 3.52 729 504 A 113 GLN HE22 A 113 GLN HGy 1.0 1.8 3.52 730 504 A 113 GLN HE22 A 113 GLN HGx 1.0 1.8 3.52 731 505 A 113 GLN H A 113 GLN HGx 1.0 1.8 4.62 732 505 A 113 GLN H A 113 GLN HGy 1.0 1.8 4.62 733 506 A 113 GLN H A 114 ARG H 1.0 1.8 4.40 734 507 A 156 ILE HD1% A 113 GLN H 1.0 1.8 4.69 735 508 A 114 ARG HA A 114 ARG HDy 1.0 1.8 4.59 736 508 A 114 ARG HDx A 114 ARG HA 1.0 1.8 4.59 737 509 A 114 ARG HA A 117 ASP HBy 1.0 1.8 4.20 738 509 A 114 ARG HA A 117 ASP HBx 1.0 1.8 4.20 739 510 A 117 ASP H A 114 ARG HA 1.0 1.8 4.00 740 511 A 114 ARG HBx A 114 ARG HDy 1.0 1.8 3.52 741 511 A 114 ARG HBy A 114 ARG HDy 1.0 1.8 3.52 742 511 A 114 ARG HDx A 114 ARG HBx 1.0 1.8 3.52 743 511 A 114 ARG HBy A 114 ARG HDx 1.0 1.8 3.52 744 512 A 115 PHE H A 114 ARG HBx 1.0 1.8 4.26 745 512 A 114 ARG HBy A 115 PHE H 1.0 1.8 4.26 746 513 A 115 PHE H A 114 ARG HGx 1.0 1.8 5.09 747 513 A 114 ARG HGy A 115 PHE H 1.0 1.8 5.09 748 514 A 114 ARG H A 114 ARG HBx 1.0 1.8 3.60 749 514 A 114 ARG H A 114 ARG HBy 1.0 1.8 3.60 750 515 A 114 ARG H A 114 ARG HDy 1.0 1.8 4.70 751 515 A 114 ARG H A 114 ARG HDx 1.0 1.8 4.70 752 516 A 114 ARG H A 114 ARG HGx 1.0 1.8 4.18 753 516 A 114 ARG H A 114 ARG HGy 1.0 1.8 4.18 754 517 A 114 ARG H A 115 PHE H 1.0 1.8 4.08 755 518 A 115 PHE HD% A 115 PHE HA 1.0 1.8 3.93 756 519 A 115 PHE HA A 118 ASP HBx 1.0 1.8 4.23 757 520 A 115 PHE HA A 118 ASP HBy 1.0 1.8 4.73 758 521 A 115 PHE HA A 118 ASP H 1.0 1.8 3.93 759 522 A 115 PHE HA A 119 ILE HG2% 1.0 1.8 5.18 760 523 A 116 VAL H A 115 PHE HBx 1.0 1.8 4.11 761 523 A 115 PHE HBy A 116 VAL H 1.0 1.8 4.11 762 524 A 119 ILE HG2% A 115 PHE HBx 1.0 1.8 5.25 763 524 A 115 PHE HBy A 119 ILE HG2% 1.0 1.8 5.25 764 525 A 115 PHE HD% A 116 VAL HG2% 1.0 1.8 4.42 765 526 A 115 PHE HD% A 116 VAL H 1.0 1.8 4.65 766 527 A 115 PHE HD% A 119 ILE HD1% 1.0 1.8 4.36 767 528 A 115 PHE HD% A 119 ILE HG2% 1.0 1.8 4.30 768 529 A 115 PHE HE% A 119 ILE HG2% 1.0 1.8 4.29 769 530 A 131 ILE HG2% A 115 PHE HE% 1.0 1.8 4.43 770 531 A 115 PHE HE% A 135 THR HG2% 1.0 1.8 4.55 771 532 A 115 PHE H A 115 PHE HBx 1.0 1.8 3.87 772 533 A 115 PHE HBy A 115 PHE H 1.0 1.8 3.87 773 534 A 115 PHE H A 115 PHE HD% 1.0 1.8 4.85 774 535 A 115 PHE H A 116 VAL H 1.0 1.8 3.94 775 536 A 115 PHE HZ A 119 ILE HG2% 1.0 1.8 4.69 776 537 A 131 ILE HG2% A 115 PHE HZ 1.0 1.8 4.58 777 538 A 115 PHE HZ A 135 THR HG2% 1.0 1.8 6.02 778 539 A 116 VAL HG1% A 116 VAL HA 1.0 1.8 4.18 779 540 A 116 VAL HG2% A 116 VAL HA 1.0 1.8 4.02 780 541 A 116 VAL HA A 119 ILE HB 1.0 1.8 5.15 781 542 A 119 ILE HD1% A 116 VAL HA 1.0 1.8 4.27 782 543 A 116 VAL HA A 119 ILE HG1y 1.0 1.8 4.10 783 543 A 116 VAL HA A 119 ILE HG1x 1.0 1.8 4.10 784 544 A 119 ILE HG2% A 116 VAL HA 1.0 1.8 4.62 785 545 A 116 VAL HA A 119 ILE H 1.0 1.8 4.75 786 546 A 116 VAL HA A 120 SER H 1.0 1.8 5.00 787 547 A 116 VAL HB A 117 ASP H 1.0 1.8 3.97 788 548 A 116 VAL HG1% A 117 ASP HA 1.0 1.8 4.72 789 549 A 117 ASP H A 116 VAL HG1% 1.0 1.8 4.33 790 550 A 116 VAL HG1% A 118 ASP H 1.0 1.8 5.74 791 551 A 116 VAL HG1% A 119 ILE HD1% 1.0 1.8 4.59 792 552 A 116 VAL HG1% A 119 ILE HG1y 1.0 1.8 5.18 793 552 A 116 VAL HG1% A 119 ILE HG1x 1.0 1.8 5.18 794 553 A 116 VAL HG1% A 120 SER H 1.0 1.8 5.02 795 554 A 116 VAL HG2% A 117 ASP H 1.0 1.8 4.55 796 555 A 116 VAL HG2% A 119 ILE HG1y 1.0 1.8 5.35 797 555 A 116 VAL HG2% A 119 ILE HG1x 1.0 1.8 5.35 798 556 A 116 VAL HG2% A 132 VAL HG1% 1.0 1.8 4.80 799 557 A 116 VAL HG2% A 132 VAL HG2% 1.0 1.8 3.64 800 558 A 156 ILE HG2% A 116 VAL HG2% 1.0 1.8 4.60 801 559 A 116 VAL HB A 116 VAL H 1.0 1.8 3.79 802 560 A 116 VAL H A 116 VAL HG1% 1.0 1.8 4.35 803 561 A 116 VAL HG2% A 116 VAL H 1.0 1.8 3.67 804 562 A 116 VAL H A 117 ASP H 1.0 1.8 3.82 805 563 A 117 ASP HA A 120 SER HBy 1.0 1.8 4.30 806 564 A 120 SER H A 117 ASP HA 1.0 1.8 4.60 807 565 A 118 ASP H A 117 ASP HBy 1.0 1.8 4.35 808 565 A 117 ASP HBx A 118 ASP H 1.0 1.8 4.35 809 566 A 117 ASP H A 117 ASP HBy 1.0 1.8 3.60 810 566 A 117 ASP H A 117 ASP HBx 1.0 1.8 3.60 811 567 A 117 ASP H A 118 ASP H 1.0 1.8 4.05 812 568 A 118 ASP HA A 121 ALA HB% 1.0 1.8 3.98 813 569 A 118 ASP HA A 121 ALA H 1.0 1.8 5.08 814 570 A 119 ILE HA A 118 ASP HBx 1.0 1.8 5.27 815 570 A 118 ASP HBy A 119 ILE HA 1.0 1.8 5.27 816 571 A 119 ILE HG2% A 118 ASP HBx 1.0 1.8 4.70 817 571 A 119 ILE HG2% A 118 ASP HBy 1.0 1.8 4.70 818 572 A 119 ILE H A 118 ASP HBx 1.0 1.8 4.95 819 573 A 119 ILE H A 118 ASP HBy 1.0 1.8 4.95 820 574 A 118 ASP H A 118 ASP HBx 1.0 1.8 3.60 821 574 A 118 ASP H A 118 ASP HBy 1.0 1.8 3.60 822 575 A 118 ASP H A 119 ILE H 1.0 1.8 5.00 823 576 A 119 ILE HD1% A 119 ILE HA 1.0 1.8 4.61 824 577 A 119 ILE HG2% A 119 ILE HA 1.0 1.8 3.61 825 578 A 121 ALA H A 119 ILE HA 1.0 1.8 4.29 826 579 A 119 ILE HA A 122 GLN HBy 1.0 1.8 4.95 827 579 A 119 ILE HA A 122 GLN HBx 1.0 1.8 4.95 828 580 A 119 ILE HA A 122 GLN H 1.0 1.8 4.48 829 581 A 119 ILE HA A 123 TYR HD% 1.0 1.8 4.38 830 582 A 119 ILE HA A 123 TYR HE% 1.0 1.8 4.86 831 583 A 119 ILE HA A 128 VAL HG2% 1.0 1.8 5.25 832 584 A 119 ILE HB A 120 SER HA 1.0 1.8 5.08 833 585 A 119 ILE HB A 120 SER H 1.0 1.8 5.02 834 586 A 119 ILE HB A 123 TYR HD% 1.0 1.8 4.31 835 587 A 119 ILE HB A 123 TYR HE% 1.0 1.8 4.62 836 588 A 119 ILE HB A 123 TYR H 1.0 1.8 5.65 837 589 A 119 ILE HB A 128 VAL HG2% 1.0 1.8 4.15 838 590 A 131 ILE HD1% A 119 ILE HB 1.0 1.8 5.07 839 591 A 119 ILE HD1% A 120 SER HA 1.0 1.8 5.21 840 592 A 119 ILE HD1% A 120 SER H 1.0 1.8 5.18 841 593 A 119 ILE HD1% A 123 TYR HD% 1.0 1.8 5.04 842 594 A 119 ILE HD1% A 128 VAL HA 1.0 1.8 4.59 843 595 A 119 ILE HD1% A 128 VAL HG1% 1.0 1.8 3.63 844 596 A 119 ILE HD1% A 128 VAL HG2% 1.0 1.8 4.22 845 597 A 119 ILE HD1% A 131 ILE HB 1.0 1.8 4.52 846 598 A 131 ILE HD1% A 119 ILE HD1% 1.0 1.8 3.81 847 599 A 131 ILE HG2% A 119 ILE HD1% 1.0 1.8 3.60 848 600 A 119 ILE HD1% A 132 VAL HG2% 1.0 1.8 3.86 849 601 A 119 ILE HD1% A 132 VAL H 1.0 1.8 5.30 850 602 A 120 SER H A 119 ILE HG1y 1.0 1.8 3.88 851 602 A 119 ILE HG1x A 120 SER H 1.0 1.8 3.88 852 603 A 119 ILE HG2% A 119 ILE HD1% 1.0 1.8 3.40 853 604 A 119 ILE HG2% A 120 SER H 1.0 1.8 4.89 854 605 A 119 ILE HG2% A 123 TYR HD% 1.0 1.8 4.40 855 606 A 119 ILE HG2% A 123 TYR HE% 1.0 1.8 4.13 856 607 A 119 ILE HG2% A 128 VAL HG2% 1.0 1.8 5.00 857 608 A 131 ILE HD1% A 119 ILE HG2% 1.0 1.8 4.04 858 609 A 131 ILE HG2% A 119 ILE HG2% 1.0 1.8 4.00 859 610 A 119 ILE HD1% A 119 ILE H 1.0 1.8 4.62 860 611 A 119 ILE H A 119 ILE HG1y 1.0 1.8 3.87 861 611 A 119 ILE HG1x A 119 ILE H 1.0 1.8 3.87 862 612 A 119 ILE HG2% A 119 ILE H 1.0 1.8 3.89 863 613 A 119 ILE H A 120 SER H 1.0 1.8 4.05 864 614 A 121 ALA H A 120 SER HA 1.0 1.8 3.86 865 615 A 120 SER HA A 123 TYR HBy 1.0 1.8 5.87 866 615 A 120 SER HA A 123 TYR HBx 1.0 1.8 5.87 867 616 A 120 SER HA A 123 TYR H 1.0 1.8 4.85 868 617 A 128 VAL HG2% A 120 SER HA 1.0 1.8 3.41 869 618 A 128 VAL HG1% A 120 SER HBx 1.0 1.8 4.06 870 618 A 128 VAL HG1% A 120 SER HBy 1.0 1.8 4.06 871 619 A 128 VAL HG2% A 120 SER HBx 1.0 1.8 5.32 872 619 A 128 VAL HG2% A 120 SER HBy 1.0 1.8 5.32 873 620 A 120 SER H A 121 ALA HB% 1.0 1.8 5.08 874 621 A 120 SER H A 121 ALA H 1.0 1.8 3.99 875 622 A 121 ALA HB% A 122 GLN H 1.0 1.8 3.85 876 623 A 121 ALA HB% A 121 ALA H 1.0 1.8 3.60 877 624 A 121 ALA H A 122 GLN HGy 1.0 1.8 4.51 878 624 A 121 ALA H A 122 GLN HGx 1.0 1.8 4.51 879 625 A 121 ALA H A 128 VAL HG2% 1.0 1.8 5.46 880 626 A 122 GLN HA A 122 GLN HGy 1.0 1.8 3.72 881 626 A 122 GLN HGx A 122 GLN HA 1.0 1.8 3.72 882 627 A 122 GLN HBy A 122 GLN HE22 1.0 1.8 5.10 883 627 A 122 GLN HBx A 122 GLN HE22 1.0 1.8 5.10 884 627 A 122 GLN HE21 A 122 GLN HBy 1.0 1.8 5.10 885 627 A 122 GLN HBx A 122 GLN HE21 1.0 1.8 5.10 886 628 A 123 TYR HD% A 122 GLN HBy 1.0 1.8 4.22 887 628 A 122 GLN HBx A 123 TYR HD% 1.0 1.8 4.22 888 629 A 123 TYR HE% A 122 GLN HBy 1.0 1.8 4.19 889 629 A 122 GLN HBx A 123 TYR HE% 1.0 1.8 4.19 890 630 A 123 TYR H A 122 GLN HBy 1.0 1.8 3.95 891 630 A 122 GLN HBx A 123 TYR H 1.0 1.8 3.95 892 631 A 123 TYR H A 122 GLN HGy 1.0 1.8 4.61 893 631 A 123 TYR H A 122 GLN HGx 1.0 1.8 4.61 894 632 A 122 GLN H A 122 GLN HBy 1.0 1.8 3.60 895 632 A 122 GLN HBx A 122 GLN H 1.0 1.8 3.60 896 633 A 122 GLN H A 122 GLN HGy 1.0 1.8 3.82 897 633 A 122 GLN H A 122 GLN HGx 1.0 1.8 3.82 898 634 A 122 GLN H A 123 TYR H 1.0 1.8 3.43 899 635 A 122 GLN H A 128 VAL HG2% 1.0 1.8 5.24 900 636 A 123 TYR HD% A 123 TYR HA 1.0 1.8 3.97 901 637 A 123 TYR HA A 124 SER H 1.0 1.8 3.86 902 638 A 128 VAL HG2% A 123 TYR HA 1.0 1.8 5.18 903 639 A 124 SER H A 123 TYR HBy 1.0 1.8 3.94 904 639 A 123 TYR HBx A 124 SER H 1.0 1.8 3.94 905 640 A 127 TYR HD% A 123 TYR HBy 1.0 1.8 3.98 906 640 A 123 TYR HBx A 127 TYR HD% 1.0 1.8 3.98 907 641 A 128 VAL HG2% A 123 TYR HBy 1.0 1.8 3.59 908 641 A 128 VAL HG2% A 123 TYR HBx 1.0 1.8 3.59 909 642 A 123 TYR HD% A 124 SER H 1.0 1.8 5.18 910 643 A 123 TYR HD% A 128 VAL HG2% 1.0 1.8 4.60 911 644 A 131 ILE HD1% A 123 TYR HD% 1.0 1.8 4.71 912 645 A 123 TYR HE% A 127 TYR HD% 1.0 1.8 5.00 913 646 A 123 TYR H A 123 TYR HBy 1.0 1.8 3.87 914 646 A 123 TYR H A 123 TYR HBx 1.0 1.8 3.87 915 647 A 123 TYR HD% A 123 TYR H 1.0 1.8 4.18 916 648 A 128 VAL HG2% A 123 TYR H 1.0 1.8 4.53 917 649 A 126 ASN H A 124 SER HBx 1.0 1.8 4.89 918 649 A 124 SER HBy A 126 ASN H 1.0 1.8 4.89 919 650 A 127 TYR H A 124 SER HBx 1.0 1.8 5.26 920 650 A 124 SER HBy A 127 TYR H 1.0 1.8 5.26 921 651 A 125 LYS H A 124 SER HBx 1.0 1.8 4.70 922 652 A 124 SER HBy A 125 LYS H 1.0 1.8 4.70 923 653 A 124 SER H A 124 SER HBx 1.0 1.8 4.20 924 654 A 124 SER H A 124 SER HBy 1.0 1.8 4.20 925 655 A 125 LYS HA A 128 VAL HB 1.0 1.8 4.22 926 656 A 128 VAL HG2% A 125 LYS HA 1.0 1.8 4.22 927 657 A 125 LYS HA A 128 VAL H 1.0 1.8 4.63 928 658 A 125 LYS HBy A 126 ASN HBx 1.0 1.8 5.15 929 658 A 125 LYS HBx A 126 ASN HBx 1.0 1.8 5.15 930 658 A 126 ASN HBy A 125 LYS HBy 1.0 1.8 5.15 931 658 A 125 LYS HBx A 126 ASN HBy 1.0 1.8 5.15 932 659 A 126 ASN H A 125 LYS HBy 1.0 1.8 3.99 933 659 A 126 ASN H A 125 LYS HBx 1.0 1.8 3.99 934 660 A 126 ASN H A 125 LYS H 1.0 1.8 4.37 935 661 A 126 ASN HA A 126 ASN HD22 1.0 1.8 4.20 936 661 A 126 ASN HA A 126 ASN HD21 1.0 1.8 4.20 937 662 A 126 ASN HA A 129 ASP HBy 1.0 1.8 4.30 938 662 A 126 ASN HA A 129 ASP HBx 1.0 1.8 4.30 939 663 A 126 ASN HA A 129 ASP H 1.0 1.8 4.60 940 664 A 127 TYR HA A 126 ASN HBx 1.0 1.8 5.35 941 664 A 126 ASN HBy A 127 TYR HA 1.0 1.8 5.35 942 665 A 127 TYR HD% A 126 ASN HBx 1.0 1.8 5.29 943 665 A 127 TYR HD% A 126 ASN HBy 1.0 1.8 5.29 944 666 A 127 TYR H A 126 ASN HBx 1.0 1.8 3.93 945 666 A 127 TYR H A 126 ASN HBy 1.0 1.8 3.93 946 667 A 126 ASN H A 126 ASN HBx 1.0 1.8 3.58 947 667 A 126 ASN H A 126 ASN HBy 1.0 1.8 3.58 948 668 A 126 ASN H A 127 TYR H 1.0 1.8 4.20 949 669 A 127 TYR HD% A 127 TYR HA 1.0 1.8 3.88 950 670 A 127 TYR HA A 127 TYR HE% 1.0 1.8 4.92 951 671 A 127 TYR HA A 130 SER HBx 1.0 1.8 4.44 952 671 A 127 TYR HA A 130 SER HBy 1.0 1.8 4.44 953 672 A 127 TYR HA A 130 SER H 1.0 1.8 4.44 954 673 A 128 VAL HG2% A 127 TYR HBx 1.0 1.8 4.49 955 673 A 128 VAL HG2% A 127 TYR HBy 1.0 1.8 4.49 956 674 A 128 VAL H A 127 TYR HBx 1.0 1.8 3.79 957 674 A 128 VAL H A 127 TYR HBy 1.0 1.8 3.79 958 675 A 131 ILE HD1% A 127 TYR HD% 1.0 1.8 4.29 959 676 A 127 TYR H A 127 TYR HBx 1.0 1.8 3.79 960 677 A 127 TYR H A 127 TYR HBy 1.0 1.8 3.79 961 678 A 127 TYR HD% A 127 TYR H 1.0 1.8 5.17 962 679 A 127 TYR H A 128 VAL HB 1.0 1.8 5.73 963 680 A 127 TYR H A 128 VAL H 1.0 1.8 3.76 964 681 A 128 VAL HA A 128 VAL HG1% 1.0 1.8 3.81 965 682 A 128 VAL HG2% A 128 VAL HA 1.0 1.8 3.55 966 683 A 128 VAL HA A 131 ILE HB 1.0 1.8 4.17 967 684 A 131 ILE HD1% A 128 VAL HA 1.0 1.8 4.02 968 685 A 128 VAL HA A 131 ILE HG1x 1.0 1.8 4.83 969 685 A 128 VAL HA A 131 ILE HG1y 1.0 1.8 4.83 970 686 A 131 ILE HG2% A 128 VAL HA 1.0 1.8 5.69 971 687 A 131 ILE H A 128 VAL HA 1.0 1.8 4.73 972 688 A 128 VAL HA A 132 VAL H 1.0 1.8 5.00 973 689 A 128 VAL HB A 129 ASP H 1.0 1.8 4.37 974 690 A 128 VAL HG1% A 129 ASP H 1.0 1.8 4.48 975 691 A 131 ILE HD1% A 128 VAL HG1% 1.0 1.8 4.54 976 692 A 128 VAL HG2% A 129 ASP H 1.0 1.8 4.48 977 693 A 131 ILE HD1% A 128 VAL HG2% 1.0 1.8 4.30 978 694 A 128 VAL HB A 128 VAL H 1.0 1.8 3.73 979 695 A 128 VAL HG1% A 128 VAL H 1.0 1.8 4.38 980 696 A 128 VAL HG2% A 128 VAL H 1.0 1.8 3.56 981 697 A 128 VAL H A 129 ASP H 1.0 1.8 3.94 982 698 A 129 ASP HA A 132 VAL HB 1.0 1.8 4.20 983 699 A 132 VAL HG2% A 129 ASP HA 1.0 1.8 4.59 984 700 A 132 VAL H A 129 ASP HA 1.0 1.8 4.60 985 701 A 130 SER H A 129 ASP HBy 1.0 1.8 3.62 986 701 A 129 ASP HBx A 130 SER H 1.0 1.8 3.62 987 702 A 129 ASP H A 130 SER H 1.0 1.8 4.06 988 703 A 130 SER HA A 131 ILE HA 1.0 1.8 5.35 989 704 A 130 SER HA A 133 ALA HB% 1.0 1.8 3.72 990 705 A 130 SER HA A 133 ALA H 1.0 1.8 4.60 991 706 A 131 ILE H A 130 SER HBx 1.0 1.8 4.05 992 706 A 131 ILE H A 130 SER HBy 1.0 1.8 4.05 993 707 A 130 SER H A 130 SER HBx 1.0 1.8 3.45 994 707 A 130 SER HBy A 130 SER H 1.0 1.8 3.45 995 708 A 131 ILE H A 130 SER H 1.0 1.8 3.83 996 709 A 131 ILE HD1% A 131 ILE HA 1.0 1.8 5.12 997 710 A 131 ILE HA A 134 SER HBx 1.0 1.8 4.30 998 711 A 131 ILE HA A 134 SER H 1.0 1.8 4.60 999 712 A 131 ILE HB A 132 VAL H 1.0 1.8 4.21 1000 713 A 131 ILE HD1% A 132 VAL H 1.0 1.8 5.28 1001 714 A 132 VAL H A 131 ILE HG1x 1.0 1.8 5.33 1002 714 A 132 VAL H A 131 ILE HG1y 1.0 1.8 5.33 1003 715 A 131 ILE HD1% A 131 ILE HG2% 1.0 1.8 3.42 1004 716 A 131 ILE HG2% A 132 VAL H 1.0 1.8 5.03 1005 717 A 131 ILE H A 131 ILE HB 1.0 1.8 4.21 1006 718 A 131 ILE HD1% A 131 ILE H 1.0 1.8 4.63 1007 719 A 131 ILE H A 131 ILE HG1x 1.0 1.8 4.96 1008 720 A 131 ILE H A 131 ILE HG1y 1.0 1.8 4.96 1009 721 A 131 ILE HG2% A 131 ILE H 1.0 1.8 4.38 1010 722 A 131 ILE H A 132 VAL H 1.0 1.8 3.96 1011 723 A 132 VAL HG1% A 132 VAL HA 1.0 1.8 3.70 1012 724 A 132 VAL HG2% A 132 VAL HA 1.0 1.8 3.53 1013 725 A 132 VAL HA A 135 THR HB 1.0 1.8 4.30 1014 726 A 135 THR H A 132 VAL HA 1.0 1.8 4.60 1015 727 A 132 VAL HA A 136 ASN H 1.0 1.8 5.00 1016 728 A 132 VAL HB A 133 ALA H 1.0 1.8 3.99 1017 729 A 132 VAL HG1% A 133 ALA HA 1.0 1.8 4.42 1018 730 A 132 VAL HG1% A 133 ALA H 1.0 1.8 4.18 1019 731 A 132 VAL HG1% A 136 ASN HBy 1.0 1.8 4.46 1020 731 A 132 VAL HG1% A 136 ASN HBx 1.0 1.8 4.46 1021 732 A 132 VAL HG1% A 136 ASN HD21 1.0 1.8 4.03 1022 732 A 132 VAL HG1% A 136 ASN HD22 1.0 1.8 4.03 1023 733 A 132 VAL HG1% A 136 ASN HD21 1.0 1.8 4.76 1024 734 A 132 VAL HG1% A 136 ASN H 1.0 1.8 4.91 1025 735 A 132 VAL HG2% A 133 ALA H 1.0 1.8 4.38 1026 736 A 132 VAL H A 132 VAL HB 1.0 1.8 3.69 1027 737 A 132 VAL HG1% A 132 VAL H 1.0 1.8 4.59 1028 738 A 132 VAL HG2% A 132 VAL H 1.0 1.8 3.43 1029 739 A 132 VAL H A 133 ALA H 1.0 1.8 4.19 1030 740 A 133 ALA HA A 136 ASN HBy 1.0 1.8 4.20 1031 740 A 133 ALA HA A 136 ASN HBx 1.0 1.8 4.20 1032 741 A 133 ALA HA A 136 ASN HD21 1.0 1.8 4.98 1033 741 A 133 ALA HA A 136 ASN HD22 1.0 1.8 4.98 1034 742 A 136 ASN H A 133 ALA HA 1.0 1.8 4.60 1035 743 A 133 ALA HB% A 134 SER H 1.0 1.8 3.93 1036 744 A 135 THR H A 133 ALA HB% 1.0 1.8 5.61 1037 745 A 133 ALA HB% A 133 ALA H 1.0 1.8 3.60 1038 746 A 133 ALA H A 134 SER H 1.0 1.8 4.07 1039 747 A 134 SER HA A 137 MET HBx 1.0 1.8 4.50 1040 748 A 134 SER HA A 137 MET H 1.0 1.8 4.60 1041 749 A 136 ASN H A 134 SER HBx 1.0 1.8 5.69 1042 749 A 134 SER HBy A 136 ASN H 1.0 1.8 5.69 1043 750 A 135 THR H A 134 SER HBx 1.0 1.8 5.01 1044 751 A 134 SER HBy A 135 THR H 1.0 1.8 5.01 1045 752 A 134 SER H A 134 SER HG 1.0 1.8 5.03 1046 753 A 135 THR H A 134 SER H 1.0 1.8 4.50 1047 754 A 135 THR HG2% A 135 THR HA 1.0 1.8 3.77 1048 755 A 135 THR HB A 136 ASN H 1.0 1.8 5.24 1049 756 A 135 THR HG2% A 136 ASN H 1.0 1.8 4.76 1050 757 A 138 ILE HD1% A 135 THR HG2% 1.0 1.8 4.87 1051 758 A 135 THR HG2% A 139 PHE HB2 1.0 1.8 6.05 1052 758 A 139 PHE HB3 A 135 THR HG2% 1.0 1.8 6.05 1053 759 A 139 PHE HD% A 135 THR HG2% 1.0 1.8 4.60 1054 760 A 139 PHE HZ A 135 THR HG2% 1.0 1.8 4.69 1055 761 A 135 THR H A 135 THR HG2% 1.0 1.8 4.64 1056 762 A 135 THR H A 136 ASN H 1.0 1.8 4.15 1057 763 A 136 ASN HD21 A 136 ASN HA 1.0 1.8 4.96 1058 763 A 136 ASN HA A 136 ASN HD22 1.0 1.8 4.96 1059 764 A 136 ASN HA A 139 PHE HB2 1.0 1.8 4.64 1060 764 A 139 PHE HB3 A 136 ASN HA 1.0 1.8 4.64 1061 765 A 136 ASN HA A 139 PHE H 1.0 1.8 4.60 1062 766 A 136 ASN HD21 A 136 ASN HBy 1.0 1.8 3.52 1063 766 A 136 ASN HBy A 136 ASN HD22 1.0 1.8 3.52 1064 766 A 136 ASN HBx A 136 ASN HD22 1.0 1.8 3.52 1065 766 A 136 ASN HBx A 136 ASN HD21 1.0 1.8 3.52 1066 767 A 137 MET H A 136 ASN HBy 1.0 1.8 4.38 1067 767 A 136 ASN HBx A 137 MET H 1.0 1.8 4.38 1068 768 A 136 ASN H A 136 ASN HBy 1.0 1.8 3.60 1069 768 A 136 ASN H A 136 ASN HBx 1.0 1.8 3.60 1070 769 A 136 ASN H A 137 MET H 1.0 1.8 4.31 1071 770 A 137 MET HA A 137 MET HGx 1.0 1.8 4.41 1072 771 A 137 MET HGy A 137 MET HA 1.0 1.8 4.41 1073 772 A 137 MET HA A 140 LYS HBx 1.0 1.8 3.85 1074 772 A 137 MET HA A 140 LYS HBy 1.0 1.8 3.85 1075 773 A 137 MET HA A 140 LYS HDy 1.0 1.8 6.03 1076 774 A 137 MET HA A 140 LYS HDx 1.0 1.8 6.03 1077 775 A 137 MET HA A 140 LYS H 1.0 1.8 4.60 1078 776 A 137 MET HA A 141 TYR H 1.0 1.8 5.00 1079 777 A 138 ILE H A 137 MET HBx 1.0 1.8 4.53 1080 777 A 137 MET HBy A 138 ILE H 1.0 1.8 4.53 1081 778 A 137 MET H A 137 MET HGx 1.0 1.8 4.20 1082 778 A 137 MET HGy A 137 MET H 1.0 1.8 4.20 1083 779 A 137 MET H A 138 ILE H 1.0 1.8 3.84 1084 780 A 138 ILE HD1% A 138 ILE HA 1.0 1.8 4.65 1085 781 A 138 ILE HA A 141 TYR HBx 1.0 1.8 4.77 1086 782 A 138 ILE HA A 141 TYR HBy 1.0 1.8 4.77 1087 783 A 141 TYR HD% A 138 ILE HA 1.0 1.8 5.00 1088 784 A 141 TYR H A 138 ILE HA 1.0 1.8 4.60 1089 785 A 142 ALA H A 138 ILE HA 1.0 1.8 5.06 1090 786 A 139 PHE H A 138 ILE HB 1.0 1.8 4.05 1091 787 A 138 ILE HG2% A 138 ILE HD1% 1.0 1.8 3.69 1092 788 A 138 ILE HG2% A 139 PHE HE% 1.0 1.8 4.76 1093 789 A 138 ILE HG2% A 139 PHE H 1.0 1.8 4.77 1094 790 A 138 ILE HG2% A 142 ALA HB% 1.0 1.8 4.58 1095 791 A 138 ILE H A 138 ILE HB 1.0 1.8 3.93 1096 792 A 138 ILE HD1% A 138 ILE H 1.0 1.8 4.54 1097 793 A 138 ILE H A 138 ILE HG1y 1.0 1.8 3.79 1098 793 A 138 ILE HG1x A 138 ILE H 1.0 1.8 3.79 1099 794 A 138 ILE HG2% A 138 ILE H 1.0 1.8 4.66 1100 795 A 139 PHE H A 138 ILE H 1.0 1.8 4.07 1101 796 A 142 ALA HB% A 139 PHE HA 1.0 1.8 4.13 1102 797 A 142 ALA H A 139 PHE HA 1.0 1.8 4.60 1103 798 A 139 PHE HA A 148 ILE HD1% 1.0 1.8 4.51 1104 799 A 140 LYS H A 139 PHE HB2 1.0 1.8 4.37 1105 799 A 139 PHE HB3 A 140 LYS H 1.0 1.8 4.37 1106 800 A 139 PHE H A 139 PHE HB2 1.0 1.8 3.92 1107 800 A 139 PHE HB3 A 139 PHE H 1.0 1.8 3.92 1108 801 A 139 PHE H A 140 LYS H 1.0 1.8 4.17 1109 802 A 140 LYS HA A 140 LYS HGx 1.0 1.8 3.90 1110 802 A 140 LYS HA A 140 LYS HGy 1.0 1.8 3.90 1111 803 A 140 LYS HA A 143 TYR HBx 1.0 1.8 4.65 1112 803 A 140 LYS HA A 143 TYR HBy 1.0 1.8 4.65 1113 804 A 143 TYR H A 140 LYS HA 1.0 1.8 4.65 1114 805 A 140 LYS HA A 144 ASP H 1.0 1.8 5.00 1115 806 A 148 ILE HD1% A 140 LYS HA 1.0 1.8 5.37 1116 807 A 140 LYS HA A 151 MET HE% 1.0 1.8 6.00 1117 808 A 141 TYR H A 140 LYS HBx 1.0 1.8 4.30 1118 808 A 140 LYS HBy A 141 TYR H 1.0 1.8 4.30 1119 809 A 141 TYR H A 140 LYS HGx 1.0 1.8 4.99 1120 809 A 141 TYR H A 140 LYS HGy 1.0 1.8 4.99 1121 810 A 140 LYS H A 140 LYS HBx 1.0 1.8 3.97 1122 811 A 140 LYS HBy A 140 LYS H 1.0 1.8 3.97 1123 812 A 140 LYS H A 140 LYS HGx 1.0 1.8 5.01 1124 812 A 140 LYS H A 140 LYS HGy 1.0 1.8 5.01 1125 813 A 140 LYS H A 141 TYR H 1.0 1.8 4.18 1126 814 A 141 TYR HD% A 141 TYR HA 1.0 1.8 4.06 1127 815 A 141 TYR HE% A 141 TYR HA 1.0 1.8 5.28 1128 816 A 141 TYR HA A 144 ASP HBy 1.0 1.8 3.89 1129 816 A 141 TYR HA A 144 ASP HBx 1.0 1.8 3.89 1130 817 A 144 ASP H A 141 TYR HA 1.0 1.8 4.60 1131 818 A 142 ALA HB% A 141 TYR HBx 1.0 1.8 5.43 1132 818 A 142 ALA HB% A 141 TYR HBy 1.0 1.8 5.43 1133 819 A 142 ALA H A 141 TYR HBx 1.0 1.8 4.68 1134 820 A 142 ALA H A 141 TYR HBy 1.0 1.8 4.68 1135 821 A 141 TYR HD% A 142 ALA H 1.0 1.8 4.95 1136 822 A 141 TYR H A 141 TYR HBx 1.0 1.8 4.15 1137 823 A 141 TYR H A 141 TYR HBy 1.0 1.8 4.15 1138 824 A 141 TYR HD% A 141 TYR H 1.0 1.8 4.92 1139 825 A 142 ALA H A 141 TYR H 1.0 1.8 4.33 1140 826 A 142 ALA HA A 145 THR HB 1.0 1.8 4.30 1141 827 A 142 ALA HA A 145 THR H 1.0 1.8 4.60 1142 828 A 142 ALA HA A 147 LEU HBx 1.0 1.8 5.17 1143 829 A 142 ALA HA A 147 LEU HBy 1.0 1.8 5.07 1144 830 A 142 ALA HA A 147 LEU HD1% 1.0 1.8 4.16 1145 831 A 142 ALA HA A 147 LEU H 1.0 1.8 5.19 1146 832 A 142 ALA HB% A 143 TYR H 1.0 1.8 4.14 1147 833 A 142 ALA HB% A 144 ASP H 1.0 1.8 5.41 1148 834 A 142 ALA HB% A 147 LEU HD1% 1.0 1.8 3.69 1149 835 A 142 ALA HB% A 147 LEU H 1.0 1.8 5.71 1150 836 A 142 ALA HB% A 148 ILE HD1% 1.0 1.8 3.71 1151 837 A 142 ALA HB% A 148 ILE HG2% 1.0 1.8 3.85 1152 838 A 142 ALA HB% A 148 ILE H 1.0 1.8 4.44 1153 839 A 142 ALA HB% A 142 ALA H 1.0 1.8 3.53 1154 840 A 143 TYR HA A 143 TYR HD% 1.0 1.8 4.32 1155 841 A 145 THR H A 143 TYR HA 1.0 1.8 4.93 1156 842 A 143 TYR HA A 146 ARG H 1.0 1.8 4.60 1157 843 A 148 ILE HD1% A 143 TYR HA 1.0 1.8 4.59 1158 844 A 143 TYR HA A 148 ILE HG1x 1.0 1.8 4.27 1159 844 A 143 TYR HA A 148 ILE HG1y 1.0 1.8 4.27 1160 845 A 148 ILE H A 143 TYR HA 1.0 1.8 4.58 1161 846 A 144 ASP H A 143 TYR HBx 1.0 1.8 4.33 1162 846 A 143 TYR HBy A 144 ASP H 1.0 1.8 4.33 1163 847 A 148 ILE HD1% A 143 TYR HBx 1.0 1.8 4.07 1164 847 A 148 ILE HD1% A 143 TYR HBy 1.0 1.8 4.07 1165 848 A 143 TYR HBy A 148 ILE HG1x 1.0 1.8 5.33 1166 848 A 143 TYR HBx A 148 ILE HG1x 1.0 1.8 5.33 1167 849 A 143 TYR HBy A 148 ILE HG1y 1.0 1.8 5.33 1168 849 A 148 ILE HG1y A 143 TYR HBx 1.0 1.8 5.33 1169 850 A 143 TYR HD% A 144 ASP HA 1.0 1.8 4.79 1170 851 A 144 ASP H A 143 TYR HD% 1.0 1.8 5.10 1171 852 A 143 TYR HD% A 148 ILE HB 1.0 1.8 5.98 1172 853 A 148 ILE HD1% A 143 TYR HD% 1.0 1.8 4.42 1173 854 A 143 TYR HD% A 148 ILE HG1x 1.0 1.8 5.01 1174 855 A 143 TYR HD% A 148 ILE HG1y 1.0 1.8 5.01 1175 856 A 143 TYR HD% A 149 LYS HA 1.0 1.8 4.96 1176 857 A 143 TYR HD% A 150 ALA HB% 1.0 1.8 5.46 1177 858 A 143 TYR HD% A 150 ALA H 1.0 1.8 5.14 1178 859 A 151 MET HE% A 143 TYR HD% 1.0 1.8 6.00 1179 860 A 149 LYS HA A 143 TYR HE% 1.0 1.8 4.21 1180 861 A 150 ALA HB% A 143 TYR HE% 1.0 1.8 5.60 1181 862 A 151 MET HE% A 143 TYR HE% 1.0 1.8 6.00 1182 863 A 143 TYR H A 143 TYR HBx 1.0 1.8 3.90 1183 864 A 143 TYR H A 143 TYR HBy 1.0 1.8 3.90 1184 865 A 143 TYR H A 143 TYR HD% 1.0 1.8 5.13 1185 866 A 143 TYR H A 144 ASP H 1.0 1.8 4.10 1186 867 A 143 TYR H A 148 ILE HD1% 1.0 1.8 4.61 1187 868 A 143 TYR H A 148 ILE HG2% 1.0 1.8 5.42 1188 869 A 143 TYR H A 148 ILE H 1.0 1.8 5.64 1189 870 A 145 THR H A 144 ASP HBy 1.0 1.8 4.22 1190 870 A 144 ASP HBx A 145 THR H 1.0 1.8 4.22 1191 871 A 144 ASP H A 145 THR H 1.0 1.8 4.17 1192 872 A 145 THR HA A 145 THR HG2% 1.0 1.8 3.72 1193 873 A 145 THR HA A 146 ARG HGx 1.0 1.8 4.74 1194 873 A 145 THR HA A 146 ARG HGy 1.0 1.8 4.74 1195 874 A 145 THR HB A 147 LEU HBx 1.0 1.8 5.16 1196 874 A 145 THR HB A 147 LEU HBy 1.0 1.8 5.16 1197 875 A 145 THR HB A 147 LEU HD1% 1.0 1.8 4.10 1198 876 A 145 THR HB A 147 LEU HG 1.0 1.8 5.43 1199 877 A 146 ARG H A 145 THR HG2% 1.0 1.8 4.94 1200 878 A 145 THR HG2% A 147 LEU HG 1.0 1.8 3.87 1201 879 A 147 LEU H A 145 THR HG2% 1.0 1.8 4.84 1202 880 A 145 THR H A 145 THR HG2% 1.0 1.8 4.26 1203 881 A 145 THR H A 146 ARG H 1.0 1.8 4.48 1204 882 A 146 ARG HA A 146 ARG HGx 1.0 1.8 3.61 1205 882 A 146 ARG HGy A 146 ARG HA 1.0 1.8 3.61 1206 883 A 146 ARG HBy A 146 ARG HDx 1.0 1.8 3.60 1207 883 A 146 ARG HBx A 146 ARG HDx 1.0 1.8 3.60 1208 883 A 146 ARG HDy A 146 ARG HBx 1.0 1.8 3.60 1209 883 A 146 ARG HBy A 146 ARG HDy 1.0 1.8 3.60 1210 884 A 146 ARG HBx A 146 ARG HDx 1.0 1.8 4.28 1211 885 A 146 ARG HDy A 146 ARG HBx 1.0 1.8 4.28 1212 886 A 146 ARG HBy A 146 ARG HDx 1.0 1.8 4.28 1213 887 A 146 ARG HBy A 146 ARG HDy 1.0 1.8 4.28 1214 888 A 146 ARG H A 146 ARG HGx 1.0 1.8 3.93 1215 888 A 146 ARG H A 146 ARG HGy 1.0 1.8 3.93 1216 889 A 146 ARG H A 147 LEU HBx 1.0 1.8 5.78 1217 889 A 146 ARG H A 147 LEU HBy 1.0 1.8 5.78 1218 890 A 147 LEU H A 146 ARG H 1.0 1.8 4.20 1219 891 A 148 ILE H A 146 ARG H 1.0 1.8 4.98 1220 892 A 147 LEU HA A 147 LEU HD2% 1.0 1.8 3.60 1221 893 A 147 LEU HD2% A 147 LEU HBx 1.0 1.8 3.72 1222 893 A 147 LEU HBy A 147 LEU HD2% 1.0 1.8 3.72 1223 894 A 147 LEU HD1% A 147 LEU HBx 1.0 1.8 3.90 1224 895 A 148 ILE H A 147 LEU HBx 1.0 1.8 5.36 1225 896 A 147 LEU HD1% A 147 LEU HBy 1.0 1.8 3.90 1226 897 A 148 ILE H A 147 LEU HBy 1.0 1.8 5.36 1227 898 A 147 LEU HD1% A 147 LEU H 1.0 1.8 4.71 1228 899 A 147 LEU H A 147 LEU HD2% 1.0 1.8 4.86 1229 900 A 147 LEU H A 147 LEU HG 1.0 1.8 4.46 1230 901 A 148 ILE HG2% A 147 LEU H 1.0 1.8 4.94 1231 902 A 147 LEU H A 148 ILE H 1.0 1.8 4.21 1232 903 A 148 ILE HG2% A 148 ILE HA 1.0 1.8 3.51 1233 904 A 148 ILE HB A 149 LYS H 1.0 1.8 4.86 1234 905 A 148 ILE HB A 150 ALA HB% 1.0 1.8 4.37 1235 906 A 148 ILE HB A 150 ALA H 1.0 1.8 4.08 1236 907 A 148 ILE HD1% A 150 ALA H 1.0 1.8 5.30 1237 908 A 148 ILE HD1% A 151 MET HA 1.0 1.8 4.60 1238 909 A 148 ILE HD1% A 152 PRO HDy 1.0 1.8 5.00 1239 909 A 148 ILE HD1% A 152 PRO HDx 1.0 1.8 5.00 1240 910 A 148 ILE HG2% A 148 ILE HD1% 1.0 1.8 3.60 1241 911 A 148 ILE HG2% A 149 LYS H 1.0 1.8 5.53 1242 912 A 148 ILE HG2% A 150 ALA H 1.0 1.8 5.00 1243 913 A 148 ILE H A 148 ILE HG1x 1.0 1.8 4.77 1244 913 A 148 ILE H A 148 ILE HG1y 1.0 1.8 4.77 1245 914 A 148 ILE HG2% A 148 ILE H 1.0 1.8 4.30 1246 915 A 149 LYS HA A 149 LYS HGy 1.0 1.8 3.69 1247 915 A 149 LYS HA A 149 LYS HGx 1.0 1.8 3.69 1248 916 A 150 ALA H A 149 LYS HBy 1.0 1.8 4.47 1249 916 A 150 ALA H A 149 LYS HBx 1.0 1.8 4.47 1250 917 A 149 LYS H A 149 LYS HGy 1.0 1.8 4.79 1251 917 A 149 LYS H A 149 LYS HGx 1.0 1.8 4.79 1252 918 A 150 ALA H A 149 LYS H 1.0 1.8 4.27 1253 919 A 150 ALA HA A 151 MET H 1.0 1.8 3.72 1254 920 A 150 ALA HB% A 151 MET H 1.0 1.8 3.95 1255 921 A 150 ALA HB% A 150 ALA H 1.0 1.8 3.56 1256 922 A 151 MET HA A 151 MET HGx 1.0 1.8 3.96 1257 922 A 151 MET HA A 151 MET HGy 1.0 1.8 3.96 1258 923 A 151 MET HA A 152 PRO HGy 1.0 1.8 5.05 1259 923 A 151 MET HA A 152 PRO HGx 1.0 1.8 5.05 1260 924 A 154 GLU H A 152 PRO HBy 1.0 1.8 5.95 1261 924 A 152 PRO HBx A 154 GLU H 1.0 1.8 5.95 1262 925 A 156 ILE HD1% A 153 SER HA 1.0 1.8 6.05 1263 926 A 153 SER HA A 156 ILE HG1y 1.0 1.8 4.80 1264 926 A 153 SER HA A 156 ILE HG1x 1.0 1.8 4.80 1265 927 A 154 GLU H A 153 SER H 1.0 1.8 4.70 1266 928 A 154 GLU HA A 154 GLU HGx 1.0 1.8 4.22 1267 929 A 154 GLU HA A 154 GLU HGy 1.0 1.8 4.22 1268 930 A 154 GLU H A 154 GLU HB2 1.0 1.8 3.42 1269 930 A 154 GLU H A 154 GLU HB3 1.0 1.8 3.42 1270 931 A 154 GLU H A 154 GLU HGx 1.0 1.8 4.50 1271 931 A 154 GLU H A 154 GLU HGy 1.0 1.8 4.50 1272 932 A 156 ILE HD1% A 156 ILE HA 1.0 1.8 4.10 1273 933 A 156 ILE HA A 156 ILE HG1y 1.0 1.8 3.89 1274 933 A 156 ILE HG1x A 156 ILE HA 1.0 1.8 3.89 1275 934 A 156 ILE HG2% A 156 ILE HG1y 1.0 1.8 3.47 1276 934 A 156 ILE HG2% A 156 ILE HG1x 1.0 1.8 3.47 1277 935 A 156 ILE HG2% A 157 LYS HA 1.0 1.8 5.00 1278 936 A 156 ILE HG2% A 157 LYS H 1.0 1.8 4.11 1279 937 A 156 ILE H A 156 ILE HB 1.0 1.8 3.76 1280 938 A 156 ILE HD1% A 156 ILE H 1.0 1.8 4.77 1281 939 A 156 ILE H A 156 ILE HG1y 1.0 1.8 4.20 1282 939 A 156 ILE HG1x A 156 ILE H 1.0 1.8 4.20 1283 940 A 156 ILE HG2% A 156 ILE H 1.0 1.8 4.41 1284 941 A 157 LYS H A 156 ILE H 1.0 1.8 5.09 1285 942 A 157 LYS HA A 157 LYS HGx 1.0 1.8 3.86 1286 942 A 157 LYS HA A 157 LYS HGy 1.0 1.8 3.86 1287 943 A 157 LYS HA A 158 ARG H 1.0 1.8 3.70 1288 944 A 158 ARG H A 157 LYS HBy 1.0 1.8 4.28 1289 944 A 158 ARG H A 157 LYS HBx 1.0 1.8 4.28 1290 945 A 157 LYS H A 157 LYS HGx 1.0 1.8 4.80 1291 946 A 157 LYS H A 157 LYS HGy 1.0 1.8 4.80 1292 947 A 157 LYS H A 158 ARG H 1.0 1.8 5.37 1293 948 A 158 ARG HA A 158 ARG HGx 1.0 1.8 4.42 1294 949 A 158 ARG HA A 158 ARG HGy 1.0 1.8 4.42 1295 950 A 158 ARG HA A 159 PRO HDy 1.0 1.8 3.60 1296 950 A 158 ARG HA A 159 PRO HDx 1.0 1.8 3.60 1297 951 A 158 ARG HBx A 158 ARG HDx 1.0 1.8 3.60 1298 951 A 158 ARG HDy A 158 ARG HBy 1.0 1.8 3.60 1299 951 A 158 ARG HBx A 158 ARG HDy 1.0 1.8 3.60 1300 951 A 158 ARG HBy A 158 ARG HDx 1.0 1.8 3.60 1301 952 A 158 ARG HBx A 159 PRO HDy 1.0 1.8 4.76 1302 952 A 158 ARG HBy A 159 PRO HDy 1.0 1.8 4.76 1303 952 A 159 PRO HDx A 158 ARG HBy 1.0 1.8 4.76 1304 952 A 159 PRO HDx A 158 ARG HBx 1.0 1.8 4.76 1305 953 A 158 ARG HGy A 159 PRO HDy 1.0 1.8 4.52 1306 953 A 158 ARG HGx A 159 PRO HDy 1.0 1.8 4.52 1307 953 A 159 PRO HDx A 158 ARG HGx 1.0 1.8 4.52 1308 953 A 159 PRO HDx A 158 ARG HGy 1.0 1.8 4.52 1309 954 A 158 ARG H A 158 ARG HGx 1.0 1.8 5.24 1310 955 A 158 ARG H A 158 ARG HGy 1.0 1.8 5.24 1311 956 A 159 PRO HA A 160 LYS H 1.0 1.8 3.60 1312 957 A 160 LYS H A 159 PRO HBy 1.0 1.8 3.55 1313 957 A 160 LYS H A 159 PRO HBx 1.0 1.8 3.55 1314 958 A 160 LYS H A 159 PRO HGx 1.0 1.8 5.15 1315 958 A 160 LYS H A 159 PRO HGy 1.0 1.8 5.15 1316 959 A 160 LYS HA A 161 LYS H 1.0 1.8 3.60 1317 960 A 161 LYS H A 160 LYS HGy 1.0 1.8 5.80 1318 960 A 161 LYS H A 160 LYS HGx 1.0 1.8 5.80 1319 961 A 160 LYS H A 160 LYS HGy 1.0 1.8 4.35 1320 961 A 160 LYS H A 160 LYS HGx 1.0 1.8 4.35 1321 962 A 161 LYS HA A 162 LYS H 1.0 1.8 3.50 1322 963 A 162 LYS H A 161 LYS HGx 1.0 1.8 5.32 1323 963 A 162 LYS H A 161 LYS HGy 1.0 1.8 5.32 1324 964 A 161 LYS H A 161 LYS HBy 1.0 1.8 4.28 1325 965 A 161 LYS H A 161 LYS HBx 1.0 1.8 4.28 1326 966 A 162 LYS HA A 162 LYS HGx 1.0 1.8 3.85 1327 966 A 162 LYS HA A 162 LYS HGy 1.0 1.8 3.85 1328 967 A 162 LYS HA A 163 VAL HGx% 1.0 1.8 4.45 1329 967 A 162 LYS HA A 163 VAL HGy% 1.0 1.8 4.45 1330 968 A 162 LYS HA A 163 VAL H 1.0 1.8 3.60 1331 969 A 163 VAL H A 162 LYS HBy 1.0 1.8 4.12 1332 969 A 163 VAL H A 162 LYS HBx 1.0 1.8 4.12 1333 970 A 163 VAL H A 162 LYS HGx 1.0 1.8 4.87 1334 970 A 162 LYS HGy A 163 VAL H 1.0 1.8 4.87 1335 971 A 162 LYS H A 162 LYS HBy 1.0 1.8 3.60 1336 971 A 162 LYS H A 162 LYS HBx 1.0 1.8 3.60 1337 972 A 162 LYS H A 162 LYS HGx 1.0 1.8 5.87 1338 972 A 162 LYS H A 162 LYS HGy 1.0 1.8 5.87 1339 973 A 163 VAL HA A 163 VAL HGx% 1.0 1.8 3.60 1340 973 A 163 VAL HGy% A 163 VAL HA 1.0 1.8 3.60 1341 974 A 163 VAL HB A 164 SER H 1.0 1.8 4.61 1342 975 A 164 SER HA A 163 VAL HGx% 1.0 1.8 4.63 1343 975 A 163 VAL HGy% A 164 SER HA 1.0 1.8 4.63 1344 976 A 163 VAL HGx% A 164 SER HBx 1.0 1.8 5.37 1345 976 A 163 VAL HGy% A 164 SER HBx 1.0 1.8 5.37 1346 976 A 164 SER HBy A 163 VAL HGx% 1.0 1.8 5.37 1347 976 A 163 VAL HGy% A 164 SER HBy 1.0 1.8 5.37 1348 977 A 164 SER H A 163 VAL HGx% 1.0 1.8 4.37 1349 977 A 163 VAL HGy% A 164 SER H 1.0 1.8 4.37 1350 978 A 163 VAL H A 163 VAL HB 1.0 1.8 3.70 1351 979 A 163 VAL H A 163 VAL HGx% 1.0 1.8 4.20 1352 979 A 163 VAL HGy% A 163 VAL H 1.0 1.8 4.20 1353 980 A 164 SER HA A 165 VAL HGx% 1.0 1.8 4.92 1354 980 A 164 SER HA A 165 VAL HGy% 1.0 1.8 4.92 1355 981 A 164 SER HA A 165 VAL H 1.0 1.8 3.68 1356 982 A 164 SER HBx A 165 VAL HGx% 1.0 1.8 5.86 1357 982 A 164 SER HBy A 165 VAL HGx% 1.0 1.8 5.86 1358 982 A 165 VAL HGy% A 164 SER HBx 1.0 1.8 5.86 1359 982 A 164 SER HBy A 165 VAL HGy% 1.0 1.8 5.86 1360 983 A 165 VAL H A 164 SER HBx 1.0 1.8 4.00 1361 983 A 164 SER HBy A 165 VAL H 1.0 1.8 4.00 1362 984 A 165 VAL HA A 165 VAL HGx% 1.0 1.8 3.58 1363 984 A 165 VAL HGy% A 165 VAL HA 1.0 1.8 3.58 1364 985 A 165 VAL HB A 166 GLU H 1.0 1.8 4.89 1365 986 A 166 GLU H A 165 VAL HGx% 1.0 1.8 3.77 1366 986 A 165 VAL HGy% A 166 GLU H 1.0 1.8 3.77 1367 987 A 165 VAL H A 165 VAL HB 1.0 1.8 4.06 1368 988 A 165 VAL H A 165 VAL HGx% 1.0 1.8 3.90 1369 988 A 165 VAL HGy% A 165 VAL H 1.0 1.8 3.90 1370 989 A 165 VAL H A 166 GLU H 1.0 1.8 4.64 1371 990 A 166 GLU HA A 166 GLU HGx 1.0 1.8 4.00 1372 990 A 166 GLU HA A 166 GLU HGy 1.0 1.8 4.00 1373 991 A 167 LEU H A 166 GLU HBy 1.0 1.8 4.05 1374 991 A 166 GLU HBx A 167 LEU H 1.0 1.8 4.05 1375 992 A 167 LEU H A 166 GLU HGx 1.0 1.8 4.30 1376 992 A 166 GLU HGy A 167 LEU H 1.0 1.8 4.30 1377 993 A 166 GLU H A 166 GLU HBy 1.0 1.8 3.60 1378 993 A 166 GLU H A 166 GLU HBx 1.0 1.8 3.60 1379 994 A 167 LEU HA A 167 LEU HD2% 1.0 1.8 4.03 1380 994 A 167 LEU HA A 167 LEU HD1% 1.0 1.8 4.03 1381 995 A 167 LEU HA A 168 GLU H 1.0 1.8 3.60 1382 996 A 168 GLU H A 167 LEU HBx 1.0 1.8 4.07 1383 996 A 168 GLU H A 167 LEU HBy 1.0 1.8 4.07 1384 997 A 167 LEU HD1% A 167 LEU HBx 1.0 1.8 4.25 1385 998 A 167 LEU HBx A 167 LEU HD2% 1.0 1.8 4.25 1386 999 A 167 LEU HD1% A 167 LEU HBy 1.0 1.8 4.25 1387 1000 A 167 LEU HBy A 167 LEU HD2% 1.0 1.8 4.25 1388 1001 A 168 GLU H A 167 LEU HD2% 1.0 1.8 4.68 1389 1001 A 167 LEU HD1% A 168 GLU H 1.0 1.8 4.68 1390 1002 A 168 GLU H A 167 LEU HG 1.0 1.8 6.05 1391 1003 A 167 LEU H A 167 LEU HBx 1.0 1.8 3.60 1392 1003 A 167 LEU H A 167 LEU HBy 1.0 1.8 3.60 1393 1004 A 167 LEU H A 167 LEU HD2% 1.0 1.8 4.90 1394 1004 A 167 LEU H A 167 LEU HD1% 1.0 1.8 4.90 1395 1005 A 167 LEU H A 167 LEU HG 1.0 1.8 6.00 1396 1006 A 168 GLU H A 168 GLU HBx 1.0 1.8 3.60 1397 1006 A 168 GLU H A 168 GLU HBy 1.0 1.8 3.60 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 69 ALA H A 65 PHE O 1.0 1.7 2.3 2 2 A 65 PHE O A 69 ALA N 1.0 2.7 3.3 3 3 A 70 ASP H A 66 LYS O 1.0 1.7 2.3 4 4 A 66 LYS O A 70 ASP N 1.0 2.7 3.3 5 5 A 71 ASP H A 67 GLN O 1.0 1.7 2.3 6 6 A 67 GLN O A 71 ASP N 1.0 2.7 3.3 7 7 A 72 TRP H A 68 VAL O 1.0 1.7 2.3 8 8 A 68 VAL O A 72 TRP N 1.0 2.7 3.3 9 9 A 73 LEU H A 69 ALA O 1.0 1.7 2.3 10 10 A 69 ALA O A 73 LEU N 1.0 2.7 3.3 11 11 A 74 LYS H A 70 ASP O 1.0 1.7 2.3 12 12 A 70 ASP O A 74 LYS N 1.0 2.7 3.3 13 13 A 76 TYR H A 72 TRP O 1.0 1.7 2.3 14 14 A 72 TRP O A 76 TYR N 1.0 2.7 3.3 15 15 A 77 ALA H A 73 LEU O 1.0 1.7 2.3 16 16 A 73 LEU O A 77 ALA N 1.0 2.7 3.3 17 17 A 78 ASN H A 75 GLN O 1.0 1.7 2.3 18 18 A 75 GLN O A 78 ASN N 1.0 2.7 3.3 19 19 A 86 ARG H A 82 VAL O 1.0 1.7 2.3 20 20 A 82 VAL O A 86 ARG N 1.0 2.7 3.3 21 21 A 87 ALA H A 83 SER O 1.0 1.7 2.3 22 22 A 83 SER O A 87 ALA N 1.0 2.7 3.3 23 23 A 88 ARG H A 84 SER O 1.0 1.7 2.3 24 24 A 84 SER O A 88 ARG N 1.0 2.7 3.3 25 25 A 89 GLU H A 85 VAL O 1.0 1.7 2.3 26 26 A 85 VAL O A 89 GLU N 1.0 2.7 3.3 27 27 A 90 LYS H A 86 ARG O 1.0 1.7 2.3 28 28 A 86 ARG O A 90 LYS N 1.0 2.7 3.3 29 29 A 91 ALA H A 87 ALA O 1.0 1.7 2.3 30 30 A 87 ALA O A 91 ALA N 1.0 2.7 3.3 31 31 A 92 ILE H A 88 ARG O 1.0 1.7 2.3 32 32 A 88 ARG O A 92 ILE N 1.0 2.7 3.3 33 33 A 96 ILE H A 92 ILE O 1.0 1.7 2.3 34 34 A 92 ILE O A 96 ILE N 1.0 2.7 3.3 35 35 A 97 GLU H A 93 GLN O 1.0 1.7 2.3 36 36 A 93 GLN O A 97 GLU N 1.0 2.7 3.3 37 37 A 98 ARG H A 94 HIS O 1.0 1.7 2.3 38 38 A 94 HIS O A 98 ARG N 1.0 2.7 3.3 39 39 A 99 PHE H A 95 ALA O 1.0 1.7 2.3 40 40 A 95 ALA O A 99 PHE N 1.0 2.7 3.3 41 41 A 100 ASN H A 97 GLU O 1.0 1.7 2.3 42 42 A 97 GLU O A 100 ASN N 1.0 2.7 3.3 43 43 A 112 TYR H A 108 LYS O 1.0 1.7 2.3 44 44 A 108 LYS O A 112 TYR N 1.0 2.7 3.3 45 45 A 113 GLN H A 109 LYS O 1.0 1.7 2.3 46 46 A 109 LYS O A 113 GLN N 1.0 2.7 3.3 47 47 A 114 ARG H A 110 HIS O 1.0 1.7 2.3 48 48 A 110 HIS O A 114 ARG N 1.0 2.7 3.3 49 49 A 115 PHE H A 111 ASP O 1.0 1.7 2.3 50 50 A 111 ASP O A 115 PHE N 1.0 2.7 3.3 51 51 A 116 VAL H A 112 TYR O 1.0 1.7 2.3 52 52 A 112 TYR O A 116 VAL N 1.0 2.7 3.3 53 53 A 117 ASP H A 113 GLN O 1.0 1.7 2.3 54 54 A 113 GLN O A 117 ASP N 1.0 2.7 3.3 55 55 A 118 ASP H A 114 ARG O 1.0 1.7 2.3 56 56 A 114 ARG O A 118 ASP N 1.0 2.7 3.3 57 57 A 119 ILE H A 115 PHE O 1.0 1.7 2.3 58 58 A 115 PHE O A 119 ILE N 1.0 2.7 3.3 59 59 A 120 SER H A 116 VAL O 1.0 1.7 2.3 60 60 A 116 VAL O A 120 SER N 1.0 2.7 3.3 61 61 A 129 ASP H A 125 LYS O 1.0 1.7 2.3 62 62 A 125 LYS O A 129 ASP N 1.0 2.7 3.3 63 63 A 131 ILE H A 127 TYR O 1.0 1.7 2.3 64 64 A 127 TYR O A 131 ILE N 1.0 2.7 3.3 65 65 A 132 VAL H A 128 VAL O 1.0 1.7 2.3 66 66 A 128 VAL O A 132 VAL N 1.0 2.7 3.3 67 67 A 133 ALA H A 129 ASP O 1.0 1.7 2.3 68 68 A 129 ASP O A 133 ALA N 1.0 2.7 3.3 69 69 A 134 SER H A 130 SER O 1.0 1.7 2.3 70 70 A 130 SER O A 134 SER N 1.0 2.7 3.3 71 71 A 135 THR H A 131 ILE O 1.0 1.7 2.3 72 72 A 131 ILE O A 135 THR N 1.0 2.7 3.3 73 73 A 136 ASN H A 132 VAL O 1.0 1.7 2.3 74 74 A 132 VAL O A 136 ASN N 1.0 2.7 3.3 75 75 A 137 MET H A 133 ALA O 1.0 1.7 2.3 76 76 A 133 ALA O A 137 MET N 1.0 2.7 3.3 77 77 A 138 ILE H A 134 SER O 1.0 1.7 2.3 78 78 A 134 SER O A 138 ILE N 1.0 2.7 3.3 79 79 A 139 PHE H A 135 THR O 1.0 1.7 2.3 80 80 A 135 THR O A 139 PHE N 1.0 2.7 3.3 81 81 A 140 LYS H A 136 ASN O 1.0 1.7 2.3 82 82 A 136 ASN O A 140 LYS N 1.0 2.7 3.3 83 83 A 141 TYR H A 137 MET O 1.0 1.7 2.3 84 84 A 137 MET O A 141 TYR N 1.0 2.7 3.3 85 85 A 142 ALA H A 138 ILE O 1.0 1.7 2.3 86 86 A 138 ILE O A 142 ALA N 1.0 2.7 3.3 87 87 A 143 TYR H A 139 PHE O 1.0 1.7 2.3 88 88 A 139 PHE O A 143 TYR N 1.0 2.7 3.3 89 89 A 144 ASP H A 140 LYS O 1.0 1.7 2.3 90 90 A 140 LYS O A 144 ASP N 1.0 2.7 3.3 91 91 A 145 THR H A 141 TYR O 1.0 1.7 2.3 92 92 A 141 TYR O A 145 THR N 1.0 2.7 3.3 93 93 A 146 ARG H A 143 TYR O 1.0 1.7 2.3 94 94 A 143 TYR O A 146 ARG N 1.0 2.7 3.3 95 95 A 147 LEU H A 142 ALA O 1.0 1.7 2.3 96 96 A 142 ALA O A 147 LEU 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 64 THR C A 65 PHE N A 65 PHE CA A 65 PHE C 1.0 -92.25 -32.25 PHI 2 2 A 65 PHE N A 65 PHE CA A 65 PHE C A 66 LYS N 1.0 -73.10 -13.10 PSI 3 3 A 65 PHE C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -91.24 -31.24 PHI 4 4 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 GLN N 1.0 -68.60 -8.60 PSI 5 5 A 66 LYS C A 67 GLN N A 67 GLN CA A 67 GLN C 1.0 -93.04 -33.04 PHI 6 6 A 67 GLN N A 67 GLN CA A 67 GLN C A 68 VAL N 1.0 -75.07 -15.07 PSI 7 7 A 67 GLN C A 68 VAL N A 68 VAL CA A 68 VAL C 1.0 -95.90 -35.90 PHI 8 8 A 68 VAL N A 68 VAL CA A 68 VAL C A 69 ALA N 1.0 -73.72 -13.72 PSI 9 9 A 68 VAL C A 69 ALA N A 69 ALA CA A 69 ALA C 1.0 -90.43 -30.43 PHI 10 10 A 69 ALA N A 69 ALA CA A 69 ALA C A 70 ASP N 1.0 -71.58 -11.58 PSI 11 11 A 69 ALA C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -95.81 -35.81 PHI 12 12 A 70 ASP N A 70 ASP CA A 70 ASP C A 71 ASP N 1.0 -70.99 -10.99 PSI 13 13 A 70 ASP C A 71 ASP N A 71 ASP CA A 71 ASP C 1.0 -98.30 -38.30 PHI 14 14 A 71 ASP N A 71 ASP CA A 71 ASP C A 72 TRP N 1.0 -68.51 -8.51 PSI 15 15 A 71 ASP C A 72 TRP N A 72 TRP CA A 72 TRP C 1.0 -94.39 -34.39 PHI 16 16 A 72 TRP N A 72 TRP CA A 72 TRP C A 73 LEU N 1.0 -72.62 -12.62 PSI 17 17 A 72 TRP C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -92.31 -32.31 PHI 18 18 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 LYS N 1.0 -72.06 -12.06 PSI 19 19 A 73 LEU C A 74 LYS N A 74 LYS CA A 74 LYS C 1.0 -92.32 -32.32 PHI 20 20 A 74 LYS N A 74 LYS CA A 74 LYS C A 75 GLN N 1.0 -72.99 -12.99 PSI 21 21 A 74 LYS C A 75 GLN N A 75 GLN CA A 75 GLN C 1.0 -99.32 -39.32 PHI 22 22 A 75 GLN N A 75 GLN CA A 75 GLN C A 76 TYR N 1.0 -65.21 -5.21 PSI 23 23 A 75 GLN C A 76 TYR N A 76 TYR CA A 76 TYR C 1.0 -91.68 -31.68 PHI 24 24 A 76 TYR N A 76 TYR CA A 76 TYR C A 77 ALA N 1.0 -66.90 -6.90 PSI 25 25 A 80 VAL C A 81 LYS N A 81 LYS CA A 81 LYS C 1.0 -111.72 -51.72 PHI 26 26 A 81 LYS N A 81 LYS CA A 81 LYS C A 82 VAL N 1.0 122.70 182.70 PSI 27 27 A 81 LYS C A 82 VAL N A 82 VAL CA A 82 VAL C 1.0 -92.06 -32.06 PHI 28 28 A 82 VAL N A 82 VAL CA A 82 VAL C A 83 SER N 1.0 -68.19 -8.19 PSI 29 29 A 82 VAL C A 83 SER N A 83 SER CA A 83 SER C 1.0 -94.32 -34.32 PHI 30 30 A 83 SER N A 83 SER CA A 83 SER C A 84 SER N 1.0 -65.96 -5.96 PSI 31 31 A 83 SER C A 84 SER N A 84 SER CA A 84 SER C 1.0 -97.57 -37.57 PHI 32 32 A 84 SER N A 84 SER CA A 84 SER C A 85 VAL N 1.0 -66.87 -6.87 PSI 33 33 A 84 SER C A 85 VAL N A 85 VAL CA A 85 VAL C 1.0 -93.97 -33.97 PHI 34 34 A 85 VAL N A 85 VAL CA A 85 VAL C A 86 ARG N 1.0 -72.68 -12.68 PSI 35 35 A 85 VAL C A 86 ARG N A 86 ARG CA A 86 ARG C 1.0 -89.77 -29.77 PHI 36 36 A 86 ARG N A 86 ARG CA A 86 ARG C A 87 ALA N 1.0 -71.45 -11.45 PSI 37 37 A 86 ARG C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -91.42 -31.42 PHI 38 38 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 ARG N 1.0 -74.67 -14.67 PSI 39 39 A 87 ALA C A 88 ARG N A 88 ARG CA A 88 ARG C 1.0 -94.43 -34.43 PHI 40 40 A 88 ARG N A 88 ARG CA A 88 ARG C A 89 GLU N 1.0 -69.82 -9.82 PSI 41 41 A 88 ARG C A 89 GLU N A 89 GLU CA A 89 GLU C 1.0 -90.73 -30.73 PHI 42 42 A 89 GLU N A 89 GLU CA A 89 GLU C A 90 LYS N 1.0 -73.24 -13.24 PSI 43 43 A 89 GLU C A 90 LYS N A 90 LYS CA A 90 LYS C 1.0 -93.39 -33.39 PHI 44 44 A 90 LYS N A 90 LYS CA A 90 LYS C A 91 ALA N 1.0 -69.38 -9.38 PSI 45 45 A 90 LYS C A 91 ALA N A 91 ALA CA A 91 ALA C 1.0 -91.32 -31.32 PHI 46 46 A 91 ALA N A 91 ALA CA A 91 ALA C A 92 ILE N 1.0 -75.80 -15.80 PSI 47 47 A 91 ALA C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 -99.24 -39.24 PHI 48 48 A 92 ILE N A 92 ILE CA A 92 ILE C A 93 GLN N 1.0 -63.39 -3.39 PSI 49 49 A 92 ILE C A 93 GLN N A 93 GLN CA A 93 GLN C 1.0 -93.82 -33.82 PHI 50 50 A 93 GLN N A 93 GLN CA A 93 GLN C A 94 HIS N 1.0 -70.83 -10.83 PSI 51 51 A 93 GLN C A 94 HIS N A 94 HIS CA A 94 HIS C 1.0 -99.15 -39.15 PHI 52 52 A 94 HIS N A 94 HIS CA A 94 HIS C A 95 ALA N 1.0 -70.98 -10.98 PSI 53 53 A 94 HIS C A 95 ALA N A 95 ALA CA A 95 ALA C 1.0 -97.58 -37.58 PHI 54 54 A 95 ALA N A 95 ALA CA A 95 ALA C A 96 ILE N 1.0 -68.31 -8.31 PSI 55 55 A 95 ALA C A 96 ILE N A 96 ILE CA A 96 ILE C 1.0 -91.13 -31.13 PHI 56 56 A 96 ILE N A 96 ILE CA A 96 ILE C A 97 GLU N 1.0 -74.00 -14.00 PSI 57 57 A 96 ILE C A 97 GLU N A 97 GLU CA A 97 GLU C 1.0 -93.38 -33.38 PHI 58 58 A 97 GLU N A 97 GLU CA A 97 GLU C A 98 ARG N 1.0 -65.15 -5.15 PSI 59 59 A 97 GLU C A 98 ARG N A 98 ARG CA A 98 ARG C 1.0 -99.37 -39.37 PHI 60 60 A 98 ARG N A 98 ARG CA A 98 ARG C A 99 PHE N 1.0 -57.64 2.36 PSI 61 61 A 98 ARG C A 99 PHE N A 99 PHE CA A 99 PHE C 1.0 -127.11 -67.11 PHI 62 62 A 99 PHE N A 99 PHE CA A 99 PHE C A 100 ASN N 1.0 -40.81 19.19 PSI 63 63 A 99 PHE C A 100 ASN N A 100 ASN CA A 100 ASN C 1.0 -90.97 -30.97 PHI 64 64 A 100 ASN N A 100 ASN CA A 100 ASN C A 101 THR N 1.0 -62.26 -2.26 PSI 65 65 A 100 ASN C A 101 THR N A 101 THR CA A 101 THR C 1.0 -116.35 -56.35 PHI 66 66 A 101 THR N A 101 THR CA A 101 THR C A 102 LYS N 1.0 -35.58 24.42 PSI 67 67 A 101 THR C A 102 LYS N A 102 LYS CA A 102 LYS C 1.0 -111.74 -51.74 PHI 68 68 A 102 LYS N A 102 LYS CA A 102 LYS C A 103 PRO N 1.0 104.39 164.39 PSI 69 69 A 102 LYS C A 103 PRO N A 103 PRO CA A 103 PRO C 1.0 -98.26 -38.26 PHI 70 70 A 103 PRO N A 103 PRO CA A 103 PRO C A 104 ILE N 1.0 100.19 160.19 PSI 71 71 A 103 PRO C A 104 ILE N A 104 ILE CA A 104 ILE C 1.0 -86.74 -26.74 PHI 72 72 A 104 ILE N A 104 ILE CA A 104 ILE C A 105 GLN N 1.0 -66.43 -6.43 PSI 73 73 A 104 ILE C A 105 GLN N A 105 GLN CA A 105 GLN C 1.0 -99.84 -39.84 PHI 74 74 A 105 GLN N A 105 GLN CA A 105 GLN C A 106 THR N 1.0 -56.01 3.99 PSI 75 75 A 105 GLN C A 106 THR N A 106 THR CA A 106 THR C 1.0 -128.97 -68.97 PHI 76 76 A 106 THR N A 106 THR CA A 106 THR C A 107 ILE N 1.0 -36.42 23.58 PSI 77 77 A 106 THR C A 107 ILE N A 107 ILE CA A 107 ILE C 1.0 -109.65 -49.65 PHI 78 78 A 107 ILE N A 107 ILE CA A 107 ILE C A 108 LYS N 1.0 102.71 162.71 PSI 79 79 A 108 LYS C A 109 LYS N A 109 LYS CA A 109 LYS C 1.0 -90.68 -30.68 PHI 80 80 A 109 LYS N A 109 LYS CA A 109 LYS C A 110 HIS N 1.0 -68.25 -8.25 PSI 81 81 A 109 LYS C A 110 HIS N A 110 HIS CA A 110 HIS C 1.0 -92.37 -32.37 PHI 82 82 A 110 HIS N A 110 HIS CA A 110 HIS C A 111 ASP N 1.0 -70.65 -10.65 PSI 83 83 A 110 HIS C A 111 ASP N A 111 ASP CA A 111 ASP C 1.0 -95.20 -35.20 PHI 84 84 A 111 ASP N A 111 ASP CA A 111 ASP C A 112 TYR N 1.0 -69.79 -9.79 PSI 85 85 A 111 ASP C A 112 TYR N A 112 TYR CA A 112 TYR C 1.0 -93.37 -33.37 PHI 86 86 A 112 TYR N A 112 TYR CA A 112 TYR C A 113 GLN N 1.0 -73.25 -13.25 PSI 87 87 A 112 TYR C A 113 GLN N A 113 GLN CA A 113 GLN C 1.0 -90.79 -30.79 PHI 88 88 A 113 GLN N A 113 GLN CA A 113 GLN C A 114 ARG N 1.0 -74.93 -14.93 PSI 89 89 A 113 GLN C A 114 ARG N A 114 ARG CA A 114 ARG C 1.0 -93.62 -33.62 PHI 90 90 A 114 ARG N A 114 ARG CA A 114 ARG C A 115 PHE N 1.0 -65.42 -5.42 PSI 91 91 A 114 ARG C A 115 PHE N A 115 PHE CA A 115 PHE C 1.0 -96.80 -36.80 PHI 92 92 A 115 PHE N A 115 PHE CA A 115 PHE C A 116 VAL N 1.0 -74.86 -14.86 PSI 93 93 A 115 PHE C A 116 VAL N A 116 VAL CA A 116 VAL C 1.0 -94.25 -34.25 PHI 94 94 A 116 VAL N A 116 VAL CA A 116 VAL C A 117 ASP N 1.0 -69.73 -9.73 PSI 95 95 A 116 VAL C A 117 ASP N A 117 ASP CA A 117 ASP C 1.0 -95.11 -35.11 PHI 96 96 A 117 ASP N A 117 ASP CA A 117 ASP C A 118 ASP N 1.0 -69.62 -9.62 PSI 97 97 A 117 ASP C A 118 ASP N A 118 ASP CA A 118 ASP C 1.0 -98.67 -38.67 PHI 98 98 A 118 ASP N A 118 ASP CA A 118 ASP C A 119 ILE N 1.0 -72.37 -12.37 PSI 99 99 A 118 ASP C A 119 ILE N A 119 ILE CA A 119 ILE C 1.0 -95.69 -35.69 PHI 100 100 A 119 ILE N A 119 ILE CA A 119 ILE C A 120 SER N 1.0 -68.76 -8.76 PSI 101 101 A 119 ILE C A 120 SER N A 120 SER CA A 120 SER C 1.0 -98.87 -38.87 PHI 102 102 A 120 SER N A 120 SER CA A 120 SER C A 121 ALA N 1.0 -65.51 -5.51 PSI 103 103 A 120 SER C A 121 ALA N A 121 ALA CA A 121 ALA C 1.0 -106.33 -46.33 PHI 104 104 A 121 ALA N A 121 ALA CA A 121 ALA C A 122 GLN N 1.0 -58.74 1.26 PSI 105 105 A 122 GLN C A 123 TYR N A 123 TYR CA A 123 TYR C 1.0 -148.10 -88.10 PHI 106 106 A 123 TYR N A 123 TYR CA A 123 TYR C A 124 SER N 1.0 116.56 176.56 PSI 107 107 A 123 TYR C A 124 SER N A 124 SER CA A 124 SER C 1.0 -117.87 -57.87 PHI 108 108 A 124 SER N A 124 SER CA A 124 SER C A 125 LYS N 1.0 118.06 178.06 PSI 109 109 A 124 SER C A 125 LYS N A 125 LYS CA A 125 LYS C 1.0 -88.50 -28.50 PHI 110 110 A 125 LYS N A 125 LYS CA A 125 LYS C A 126 ASN N 1.0 -69.95 -9.95 PSI 111 111 A 125 LYS C A 126 ASN N A 126 ASN CA A 126 ASN C 1.0 -93.14 -33.14 PHI 112 112 A 126 ASN N A 126 ASN CA A 126 ASN C A 127 TYR N 1.0 -67.38 -7.38 PSI 113 113 A 126 ASN C A 127 TYR N A 127 TYR CA A 127 TYR C 1.0 -102.12 -42.12 PHI 114 114 A 127 TYR N A 127 TYR CA A 127 TYR C A 128 VAL N 1.0 -68.98 -8.98 PSI 115 115 A 127 TYR C A 128 VAL N A 128 VAL CA A 128 VAL C 1.0 -95.08 -35.08 PHI 116 116 A 128 VAL N A 128 VAL CA A 128 VAL C A 129 ASP N 1.0 -70.83 -10.83 PSI 117 117 A 128 VAL C A 129 ASP N A 129 ASP CA A 129 ASP C 1.0 -92.32 -32.32 PHI 118 118 A 129 ASP N A 129 ASP CA A 129 ASP C A 130 SER N 1.0 -69.04 -9.04 PSI 119 119 A 129 ASP C A 130 SER N A 130 SER CA A 130 SER C 1.0 -93.37 -33.37 PHI 120 120 A 130 SER N A 130 SER CA A 130 SER C A 131 ILE N 1.0 -69.81 -9.81 PSI 121 121 A 130 SER C A 131 ILE N A 131 ILE CA A 131 ILE C 1.0 -97.37 -37.37 PHI 122 122 A 131 ILE N A 131 ILE CA A 131 ILE C A 132 VAL N 1.0 -71.54 -11.54 PSI 123 123 A 131 ILE C A 132 VAL N A 132 VAL CA A 132 VAL C 1.0 -94.25 -34.25 PHI 124 124 A 132 VAL N A 132 VAL CA A 132 VAL C A 133 ALA N 1.0 -75.77 -15.77 PSI 125 125 A 132 VAL C A 133 ALA N A 133 ALA CA A 133 ALA C 1.0 -93.99 -33.99 PHI 126 126 A 133 ALA N A 133 ALA CA A 133 ALA C A 134 SER N 1.0 -71.35 -11.35 PSI 127 127 A 133 ALA C A 134 SER N A 134 SER CA A 134 SER C 1.0 -96.59 -36.59 PHI 128 128 A 134 SER N A 134 SER CA A 134 SER C A 135 THR N 1.0 -70.94 -10.94 PSI 129 129 A 134 SER C A 135 THR N A 135 THR CA A 135 THR C 1.0 -98.54 -38.54 PHI 130 130 A 135 THR N A 135 THR CA A 135 THR C A 136 ASN N 1.0 -74.28 -14.28 PSI 131 131 A 135 THR C A 136 ASN N A 136 ASN CA A 136 ASN C 1.0 -96.28 -36.28 PHI 132 132 A 136 ASN N A 136 ASN CA A 136 ASN C A 137 MET N 1.0 -70.94 -10.94 PSI 133 133 A 136 ASN C A 137 MET N A 137 MET CA A 137 MET C 1.0 -94.27 -34.27 PHI 134 134 A 137 MET N A 137 MET CA A 137 MET C A 138 ILE N 1.0 -69.78 -9.78 PSI 135 135 A 137 MET C A 138 ILE N A 138 ILE CA A 138 ILE C 1.0 -97.47 -37.47 PHI 136 136 A 138 ILE N A 138 ILE CA A 138 ILE C A 139 PHE N 1.0 -73.46 -13.46 PSI 137 137 A 138 ILE C A 139 PHE N A 139 PHE CA A 139 PHE C 1.0 -95.47 -35.47 PHI 138 138 A 139 PHE N A 139 PHE CA A 139 PHE C A 140 LYS N 1.0 -72.17 -12.17 PSI 139 139 A 139 PHE C A 140 LYS N A 140 LYS CA A 140 LYS C 1.0 -94.59 -34.59 PHI 140 140 A 140 LYS N A 140 LYS CA A 140 LYS C A 141 TYR N 1.0 -72.54 -12.54 PSI 141 141 A 140 LYS C A 141 TYR N A 141 TYR CA A 141 TYR C 1.0 -93.90 -33.90 PHI 142 142 A 141 TYR N A 141 TYR CA A 141 TYR C A 142 ALA N 1.0 -71.18 -11.18 PSI 143 143 A 141 TYR C A 142 ALA N A 142 ALA CA A 142 ALA C 1.0 -94.71 -34.71 PHI 144 144 A 142 ALA N A 142 ALA CA A 142 ALA C A 143 TYR N 1.0 -67.83 -7.83 PSI 145 145 A 142 ALA C A 143 TYR N A 143 TYR CA A 143 TYR C 1.0 -93.26 -33.26 PHI 146 146 A 143 TYR N A 143 TYR CA A 143 TYR C A 144 ASP N 1.0 -71.57 -11.57 PSI 147 147 A 143 TYR C A 144 ASP N A 144 ASP CA A 144 ASP C 1.0 -96.04 -36.04 PHI 148 148 A 144 ASP N A 144 ASP CA A 144 ASP C A 145 THR N 1.0 -64.00 -4.00 PSI 149 149 A 144 ASP C A 145 THR N A 145 THR CA A 145 THR C 1.0 -124.47 -64.47 PHI 150 150 A 145 THR N A 145 THR CA A 145 THR C A 146 ARG N 1.0 -14.28 45.72 PSI 151 151 A 145 THR C A 146 ARG N A 146 ARG CA A 146 ARG C 1.0 26.68 86.68 PHI 152 152 A 146 ARG N A 146 ARG CA A 146 ARG C A 147 LEU N 1.0 3.54 63.54 PSI stop_ save_ save_Nnoesy.list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode Nnoesy.list _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 2110.678 2 1H 10416.667 3 1H 12755.102 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 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 14963.631 2 1H 10000 3 1H 15243.902 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 10000 3 1H 15243.902 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 4 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 3121.342 2 13C 3121.342 3 1H 4197.272 4 1H 8000 stop_ save_