data_nef_c18042_4a54 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 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 18041 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -1 MET start . . 2 A 0 GLY middle . false 3 A 1 MET middle . . 4 A 2 SER middle . . 5 A 3 VAL middle . . 6 A 4 ALA middle . . 7 A 5 ASP middle . . 8 A 6 PHE middle . . 9 A 7 TYR middle . . 10 A 8 GLY middle . false 11 A 9 SER middle . . 12 A 10 ASN middle . . 13 A 11 VAL middle . . 14 A 12 GLU middle . . 15 A 13 VAL middle . . 16 A 14 LEU middle . . 17 A 15 LEU middle . . 18 A 16 ASN middle . . 19 A 17 ASN middle . . 20 A 18 ASP middle . . 21 A 19 SER middle . . 22 A 20 LYS middle . . 23 A 21 ALA middle . . 24 A 22 ARG middle . . 25 A 23 GLY middle . false 26 A 24 VAL middle . . 27 A 25 ILE middle . . 28 A 26 THR middle . . 29 A 27 ASN middle . . 30 A 28 PHE middle . . 31 A 29 ASP middle . . 32 A 30 SER middle . . 33 A 31 SER middle . . 34 A 32 ASN middle . . 35 A 33 SER middle . . 36 A 34 ILE middle . . 37 A 35 LEU middle . . 38 A 36 GLN middle . . 39 A 37 LEU middle . . 40 A 38 ARG middle . . 41 A 39 LEU middle . . 42 A 40 ALA middle . . 43 A 41 ASN middle . . 44 A 42 ASP middle . . 45 A 43 SER middle . . 46 A 44 THR middle . . 47 A 45 LYS middle . . 48 A 46 SER middle . . 49 A 47 ILE middle . . 50 A 48 VAL middle . . 51 A 49 THR middle . . 52 A 50 LYS middle . . 53 A 51 ASP middle . . 54 A 52 ILE middle . . 55 A 53 LYS middle . . 56 A 54 ASP middle . . 57 A 55 LEU middle . . 58 A 56 ARG middle . . 59 A 57 ILE middle . . 60 A 58 LEU middle . . 61 A 59 PRO middle . false 62 A 60 LYS middle . . 63 A 61 ASN middle . . 64 A 62 GLU middle . . 65 A 63 ILE middle . . 66 A 64 MET middle . . 67 A 65 PRO middle . false 68 A 66 LYS middle . . 69 A 67 ASN middle . . 70 A 68 GLY middle . false 71 A 69 THR middle . . 72 A 70 LYS middle . . 73 A 71 SER middle . . 74 A 72 PRO middle . false 75 A 73 SER middle . . 76 A 74 THR middle . . 77 A 75 ASN middle . . 78 A 76 SER middle . . 79 A 77 THR middle . . 80 A 78 LYS middle . . 81 A 79 LEU middle . . 82 A 80 LYS middle . . 83 A 81 SER middle . . 84 A 82 ALA middle . . 85 A 83 GLU middle . . 86 A 84 THR middle . . 87 A 85 TYR middle . . 88 A 86 SER middle . . 89 A 87 SER middle . . 90 A 88 LYS middle . . 91 A 89 ASN middle . . 92 A 90 LYS middle . . 93 A 91 TRP middle . . 94 A 92 SER middle . . 95 A 93 MET middle . . 96 A 94 ASP end . . 97 B 240 GLY start . false 98 B 241 ALA middle . . 99 B 242 THR middle . . 100 B 243 THR middle . . 101 B 244 LYS middle . . 102 B 245 GLU middle . . 103 B 246 LYS middle . . 104 B 247 ASN middle . . 105 B 248 ILE middle . . 106 B 249 SER middle . . 107 B 250 VAL middle . . 108 B 251 ASP middle . . 109 B 252 VAL middle . . 110 B 253 ASP middle . . 111 B 254 ALA middle . . 112 B 255 ASP middle . . 113 B 256 ALA middle . . 114 B 257 SER middle . . 115 B 258 SER middle . . 116 B 259 GLN middle . . 117 B 260 LEU middle . . 118 B 261 LEU middle . . 119 B 262 SER middle . . 120 B 263 LEU middle . . 121 B 264 LEU middle . . 122 B 265 LYS middle . . 123 B 266 SER middle . . 124 B 267 SER middle . . 125 B 268 THR middle . . 126 B 269 ALA middle . . 127 B 270 PRO middle . false 128 B 271 SER middle . . 129 B 272 ASP middle . . 130 B 273 LEU middle . . 131 B 274 ALA middle . . 132 B 275 THR middle . . 133 B 276 PRO middle . false 134 B 277 GLN middle . . 135 B 278 PRO middle . false 136 B 279 SER middle . . 137 B 280 THR middle . . 138 B 281 PHE middle . . 139 B 282 PRO middle . false 140 B 283 GLN middle . . 141 B 284 PRO middle . false 142 B 285 PRO middle . false 143 B 286 VAL middle . . 144 B 287 GLU middle . . 145 B 288 SER middle . . 146 B 289 HIS middle . . 147 B 290 SER middle . . 148 B 291 SER end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.5 0.02 A 1 MET HB2 H 1 2.0 0.02 A 1 MET HB3 H 1 2.0 0.02 A 1 MET HE% H 1 1.91 0.02 A 1 MET HG2 H 1 2.5 0.02 A 1 MET HG3 H 1 2.5 0.02 A 1 MET C C 13 174.89 0.05 A 1 MET CA C 13 55.85 0.05 A 1 MET CB C 13 34.52 0.05 A 1 MET CE C 13 17.09 0.05 A 1 MET CG C 13 32.13 0.05 A 2 SER H H 1 8.81 0.02 A 2 SER HA H 1 4.84 0.02 A 2 SER HB2 H 1 3.81 0.02 A 2 SER HB3 H 1 4.01 0.02 A 2 SER C C 13 175.01 0.05 A 2 SER CA C 13 56.64 0.05 A 2 SER CB C 13 66.19 0.05 A 2 SER N N 15 117.56 0.05 A 3 VAL H H 1 8.83 0.02 A 3 VAL HA H 1 3.46 0.02 A 3 VAL HB H 1 1.85 0.02 A 3 VAL HG1% H 1 0.71 0.02 A 3 VAL HG2% H 1 0.52 0.02 A 3 VAL C C 13 176.86 0.05 A 3 VAL CA C 13 67.09 0.05 A 3 VAL CB C 13 30.84 0.05 A 3 VAL CG1 C 13 21.45 0.05 A 3 VAL CG2 C 13 23.16 0.05 A 3 VAL N N 15 122.80 0.05 A 4 ALA H H 1 7.77 0.02 A 4 ALA HA H 1 2.35 0.02 A 4 ALA HB% H 1 1.00 0.02 A 4 ALA C C 13 179.72 0.05 A 4 ALA CA C 13 53.48 0.05 A 4 ALA CB C 13 17.84 0.05 A 4 ALA N N 15 119.05 0.05 A 5 ASP H H 1 7.47 0.02 A 5 ASP HA H 1 4.20 0.02 A 5 ASP HB2 H 1 2.60 0.02 A 5 ASP HB3 H 1 2.30 0.02 A 5 ASP C C 13 176.51 0.05 A 5 ASP CA C 13 56.78 0.05 A 5 ASP CB C 13 40.53 0.05 A 5 ASP N N 15 117.91 0.05 A 6 PHE H H 1 8.32 0.02 A 6 PHE HA H 1 4.41 0.02 A 6 PHE HB2 H 1 2.97 0.02 A 6 PHE HB3 H 1 3.22 0.02 A 6 PHE HD1 H 1 7.25 0.02 A 6 PHE HD2 H 1 7.25 0.02 A 6 PHE HE1 H 1 7.08 0.02 A 6 PHE HE2 H 1 7.08 0.02 A 6 PHE C C 13 176.82 0.05 A 6 PHE CA C 13 58.00 0.05 A 6 PHE CB C 13 39.52 0.05 A 6 PHE N N 15 115.26 0.05 A 7 TYR H H 1 7.52 0.02 A 7 TYR HA H 1 4.48 0.02 A 7 TYR HB2 H 1 3.20 0.02 A 7 TYR HB3 H 1 3.20 0.02 A 7 TYR HD1 H 1 7.00 0.02 A 7 TYR HD2 H 1 7.00 0.02 A 7 TYR HE1 H 1 6.75 0.02 A 7 TYR HE2 H 1 6.75 0.02 A 7 TYR C C 13 177.50 0.05 A 7 TYR CA C 13 56.73 0.05 A 7 TYR CB C 13 34.91 0.05 A 7 TYR N N 15 122.76 0.05 A 8 GLY H H 1 9.41 0.02 A 8 GLY HA2 H 1 3.50 0.02 A 8 GLY HA3 H 1 4.52 0.02 A 8 GLY C C 13 174.76 0.05 A 8 GLY CA C 13 45.02 0.05 A 8 GLY N N 15 112.02 0.05 A 9 SER H H 1 8.24 0.02 A 9 SER HA H 1 4.48 0.02 A 9 SER HB2 H 1 4.09 0.02 A 9 SER HB3 H 1 3.90 0.02 A 9 SER C C 13 172.28 0.05 A 9 SER CA C 13 60.38 0.05 A 9 SER CB C 13 63.84 0.05 A 9 SER N N 15 116.78 0.05 A 10 ASN H H 1 9.23 0.02 A 10 ASN HA H 1 5.08 0.02 A 10 ASN HB2 H 1 2.68 0.02 A 10 ASN HB3 H 1 2.68 0.02 A 10 ASN HD21 H 1 7.29 0.02 A 10 ASN HD22 H 1 6.59 0.02 A 10 ASN C C 13 174.61 0.05 A 10 ASN CA C 13 52.47 0.05 A 10 ASN CB C 13 39.90 0.05 A 10 ASN N N 15 125.04 0.05 A 10 ASN ND2 N 15 110.59 0.05 A 11 VAL H H 1 9.24 0.02 A 11 VAL HA H 1 5.35 0.02 A 11 VAL HB H 1 1.85 0.02 A 11 VAL HG1% H 1 0.80 0.02 A 11 VAL HG2% H 1 0.74 0.02 A 11 VAL C C 13 173.26 0.05 A 11 VAL CA C 13 58.63 0.05 A 11 VAL CB C 13 36.56 0.05 A 11 VAL CG1 C 13 22.47 0.05 A 11 VAL CG2 C 13 20.26 0.05 A 11 VAL N N 15 118.07 0.05 A 12 GLU H H 1 8.77 0.02 A 12 GLU HA H 1 5.13 0.02 A 12 GLU HB2 H 1 2.03 0.02 A 12 GLU HB3 H 1 1.85 0.02 A 12 GLU HGy H 1 2.00 0.02 A 12 GLU HGx H 1 1.91 0.02 A 12 GLU C C 13 175.23 0.05 A 12 GLU CA C 13 54.92 0.05 A 12 GLU CB C 13 33.73 0.05 A 12 GLU CG C 13 38.12 0.05 A 12 GLU N N 15 120.54 0.05 A 13 VAL H H 1 9.44 0.02 A 13 VAL HA H 1 4.50 0.02 A 13 VAL HB H 1 1.92 0.02 A 13 VAL HG1% H 1 0.86 0.02 A 13 VAL HG2% H 1 0.77 0.02 A 13 VAL C C 13 173.11 0.05 A 13 VAL CA C 13 60.47 0.05 A 13 VAL CB C 13 33.98 0.05 A 13 VAL CG1 C 13 23.12 0.05 A 13 VAL CG2 C 13 21.40 0.05 A 13 VAL N N 15 125.64 0.05 A 14 LEU H H 1 8.58 0.02 A 14 LEU HA H 1 4.89 0.02 A 14 LEU HB2 H 1 1.32 0.02 A 14 LEU HB3 H 1 1.69 0.02 A 14 LEU HD1% H 1 0.87 0.02 A 14 LEU HD2% H 1 0.86 0.02 A 14 LEU HG H 1 1.56 0.02 A 14 LEU C C 13 175.88 0.05 A 14 LEU CA C 13 53.66 0.05 A 14 LEU CB C 13 43.84 0.05 A 14 LEU CD1 C 13 24.06 0.05 A 14 LEU CD2 C 13 26.20 0.05 A 14 LEU CG C 13 27.67 0.05 A 14 LEU N N 15 127.95 0.05 A 15 LEU H H 1 8.99 0.02 A 15 LEU HA H 1 5.14 0.02 A 15 LEU HB2 H 1 1.95 0.02 A 15 LEU HB3 H 1 1.73 0.02 A 15 LEU HD1% H 1 0.81 0.02 A 15 LEU HD2% H 1 0.73 0.02 A 15 LEU HG H 1 1.56 0.02 A 15 LEU C C 13 178.89 0.05 A 15 LEU CA C 13 54.35 0.05 A 15 LEU CB C 13 42.07 0.05 A 15 LEU CD1 C 13 24.88 0.05 A 15 LEU CD2 C 13 24.50 0.05 A 15 LEU CG C 13 28.54 0.05 A 15 LEU N N 15 127.35 0.05 A 16 ASN H H 1 8.60 0.02 A 16 ASN HA H 1 4.35 0.02 A 16 ASN HB2 H 1 2.86 0.02 A 16 ASN HB3 H 1 2.79 0.02 A 16 ASN HD21 H 1 7.71 0.02 A 16 ASN HD22 H 1 6.59 0.02 A 16 ASN C C 13 175.62 0.05 A 16 ASN CA C 13 55.80 0.05 A 16 ASN CB C 13 37.82 0.05 A 16 ASN N N 15 118.72 0.05 A 16 ASN ND2 N 15 111.64 0.05 A 17 ASN H H 1 7.79 0.02 A 17 ASN HA H 1 4.63 0.02 A 17 ASN HB2 H 1 2.78 0.02 A 17 ASN HB3 H 1 3.29 0.02 A 17 ASN HD21 H 1 7.65 0.02 A 17 ASN HD22 H 1 6.80 0.02 A 17 ASN C C 13 175.38 0.05 A 17 ASN CA C 13 52.35 0.05 A 17 ASN CB C 13 36.84 0.05 A 17 ASN N N 15 116.36 0.05 A 17 ASN ND2 N 15 113.00 0.05 A 18 ASP H H 1 8.38 0.02 A 18 ASP HA H 1 4.44 0.02 A 18 ASP HBy H 1 2.96 0.02 A 18 ASP HBx H 1 2.79 0.02 A 18 ASP C C 13 175.05 0.05 A 18 ASP CA C 13 56.95 0.05 A 18 ASP CB C 13 38.84 0.05 A 18 ASP N N 15 113.77 0.05 A 19 SER H H 1 7.67 0.02 A 19 SER HA H 1 4.56 0.02 A 19 SER HB2 H 1 3.86 0.02 A 19 SER HB3 H 1 3.98 0.02 A 19 SER C C 13 172.09 0.05 A 19 SER CA C 13 58.47 0.05 A 19 SER CB C 13 64.91 0.05 A 19 SER N N 15 114.18 0.05 A 20 LYS H H 1 8.31 0.02 A 20 LYS HA H 1 5.58 0.02 A 20 LYS HB2 H 1 1.63 0.02 A 20 LYS HB3 H 1 1.63 0.02 A 20 LYS HD2 H 1 1.55 0.02 A 20 LYS HD3 H 1 1.55 0.02 A 20 LYS HE2 H 1 3.00 0.02 A 20 LYS HE3 H 1 3.00 0.02 A 20 LYS HG2 H 1 1.32 0.02 A 20 LYS HG3 H 1 1.32 0.02 A 20 LYS C C 13 176.25 0.05 A 20 LYS CA C 13 54.70 0.05 A 20 LYS CB C 13 36.86 0.05 A 20 LYS CD C 13 29.92 0.05 A 20 LYS CE C 13 42.24 0.05 A 20 LYS CG C 13 25.60 0.05 A 20 LYS N N 15 118.29 0.05 A 21 ALA H H 1 8.81 0.02 A 21 ALA HA H 1 4.73 0.02 A 21 ALA HB% H 1 1.11 0.02 A 21 ALA C C 13 174.70 0.05 A 21 ALA CA C 13 50.80 0.05 A 21 ALA CB C 13 21.88 0.05 A 21 ALA N N 15 123.50 0.05 A 22 ARG H H 1 8.48 0.02 A 22 ARG HA H 1 5.66 0.02 A 22 ARG HB2 H 1 1.73 0.02 A 22 ARG HB3 H 1 1.82 0.02 A 22 ARG HDy H 1 3.20 0.02 A 22 ARG HDx H 1 3.12 0.02 A 22 ARG HGy H 1 1.61 0.02 A 22 ARG HGx H 1 1.55 0.02 A 22 ARG C C 13 174.92 0.05 A 22 ARG CA C 13 53.94 0.05 A 22 ARG CB C 13 33.75 0.05 A 22 ARG CD C 13 43.82 0.05 A 22 ARG CG C 13 27.44 0.05 A 22 ARG N N 15 121.42 0.05 A 23 GLY H H 1 8.71 0.02 A 23 GLY HA2 H 1 4.02 0.02 A 23 GLY HA3 H 1 4.26 0.02 A 23 GLY C C 13 170.38 0.05 A 23 GLY CA C 13 45.83 0.05 A 23 GLY N N 15 109.30 0.05 A 24 VAL H H 1 8.39 0.02 A 24 VAL HA H 1 4.90 0.02 A 24 VAL HB H 1 1.81 0.02 A 24 VAL HG1% H 1 0.77 0.02 A 24 VAL HG2% H 1 0.95 0.02 A 24 VAL C C 13 177.59 0.05 A 24 VAL CA C 13 60.40 0.05 A 24 VAL CB C 13 34.45 0.05 A 24 VAL CG1 C 13 21.09 0.05 A 24 VAL CG2 C 13 21.88 0.05 A 24 VAL N N 15 119.41 0.05 A 25 ILE H H 1 8.69 0.02 A 25 ILE HA H 1 4.19 0.02 A 25 ILE HB H 1 2.15 0.02 A 25 ILE HD1% H 1 0.87 0.02 A 25 ILE HG12 H 1 1.96 0.02 A 25 ILE HG13 H 1 0.82 0.02 A 25 ILE HG2% H 1 0.95 0.02 A 25 ILE C C 13 176.93 0.05 A 25 ILE CA C 13 63.69 0.05 A 25 ILE CB C 13 38.19 0.05 A 25 ILE CD1 C 13 14.37 0.05 A 25 ILE CG1 C 13 28.13 0.05 A 25 ILE CG2 C 13 17.87 0.05 A 25 ILE N N 15 125.41 0.05 A 26 THR H H 1 8.81 0.02 A 26 THR HA H 1 4.39 0.02 A 26 THR HB H 1 4.01 0.02 A 26 THR HG2% H 1 1.08 0.02 A 26 THR C C 13 174.09 0.05 A 26 THR CA C 13 61.42 0.05 A 26 THR CB C 13 69.62 0.05 A 26 THR CG2 C 13 22.77 0.05 A 26 THR N N 15 120.09 0.05 A 27 ASN H H 1 7.29 0.02 A 27 ASN HA H 1 4.12 0.02 A 27 ASN HB2 H 1 2.36 0.02 A 27 ASN HB3 H 1 2.72 0.02 A 27 ASN HD2y H 1 7.58 0.02 A 27 ASN HD2x H 1 6.8 0.02 A 27 ASN C C 13 172.03 0.05 A 27 ASN CA C 13 54.15 0.05 A 27 ASN CB C 13 42.19 0.05 A 27 ASN N N 15 116.08 0.05 A 28 PHE H H 1 8.21 0.02 A 28 PHE HA H 1 5.38 0.02 A 28 PHE HB2 H 1 2.98 0.02 A 28 PHE HB3 H 1 3.13 0.02 A 28 PHE HD1 H 1 7.13 0.02 A 28 PHE HD2 H 1 7.13 0.02 A 28 PHE HE1 H 1 6.74 0.02 A 28 PHE HE2 H 1 6.74 0.02 A 28 PHE C C 13 172.43 0.05 A 28 PHE CA C 13 56.52 0.05 A 28 PHE CB C 13 42.29 0.05 A 28 PHE N N 15 122.15 0.05 A 29 ASP H H 1 8.34 0.02 A 29 ASP HA H 1 4.67 0.02 A 29 ASP HB2 H 1 2.46 0.02 A 29 ASP HB3 H 1 2.79 0.02 A 29 ASP C C 13 175.94 0.05 A 29 ASP CA C 13 51.47 0.05 A 29 ASP CB C 13 41.58 0.05 A 29 ASP N N 15 127.86 0.05 A 30 SER H H 1 8.42 0.02 A 30 SER HA H 1 3.71 0.02 A 30 SER HBx H 1 4.00 0.02 A 30 SER HBy H 1 4.43 0.02 A 30 SER C C 13 176.24 0.05 A 30 SER CA C 13 60.13 0.05 A 30 SER CB C 13 63.03 0.05 A 30 SER N N 15 119.80 0.05 A 31 SER H H 1 8.31 0.02 A 31 SER HA H 1 4.40 0.02 A 31 SER HBy H 1 3.88 0.02 A 31 SER C C 13 175.20 0.05 A 31 SER CA C 13 61.36 0.05 A 31 SER CB C 13 62.77 0.05 A 31 SER N N 15 118.60 0.05 A 32 ASN H H 1 7.29 0.02 A 32 ASN HA H 1 4.81 0.02 A 32 ASN HB2 H 1 2.31 0.02 A 32 ASN HB3 H 1 2.70 0.02 A 32 ASN HD21 H 1 8.28 0.02 A 32 ASN HD22 H 1 6.81 0.02 A 32 ASN C C 13 173.62 0.05 A 32 ASN CA C 13 52.74 0.05 A 32 ASN CB C 13 40.00 0.05 A 32 ASN N N 15 116.35 0.05 A 32 ASN ND2 N 15 116.26 0.05 A 33 SER H H 1 7.67 0.02 A 33 SER HA H 1 3.79 0.02 A 33 SER HBy H 1 4.51 0.02 A 33 SER HBx H 1 4.03 0.02 A 33 SER C C 13 172.82 0.05 A 33 SER CA C 13 59.34 0.05 A 33 SER CB C 13 61.65 0.05 A 33 SER N N 15 115.41 0.05 A 34 ILE H H 1 7.38 0.02 A 34 ILE HA H 1 4.78 0.02 A 34 ILE HB H 1 1.58 0.02 A 34 ILE HD1% H 1 0.73 0.02 A 34 ILE HG12 H 1 0.86 0.02 A 34 ILE HG13 H 1 1.46 0.02 A 34 ILE HG2% H 1 0.76 0.02 A 34 ILE C C 13 174.69 0.05 A 34 ILE CA C 13 59.53 0.05 A 34 ILE CB C 13 41.13 0.05 A 34 ILE CD1 C 13 12.83 0.05 A 34 ILE CG1 C 13 27.47 0.05 A 34 ILE CG2 C 13 18.00 0.05 A 34 ILE N N 15 117.10 0.05 A 35 LEU H H 1 9.60 0.02 A 35 LEU HA H 1 4.98 0.02 A 35 LEU HB2 H 1 1.28 0.02 A 35 LEU HB3 H 1 2.05 0.02 A 35 LEU HD1% H 1 0.68 0.02 A 35 LEU HD2% H 1 1.03 0.02 A 35 LEU HG H 1 1.50 0.02 A 35 LEU C C 13 173.81 0.05 A 35 LEU CA C 13 53.72 0.05 A 35 LEU CB C 13 45.83 0.05 A 35 LEU CD1 C 13 25.92 0.05 A 35 LEU CD2 C 13 24.13 0.05 A 35 LEU CG C 13 26.96 0.05 A 35 LEU N N 15 131.62 0.05 A 36 GLN H H 1 8.88 0.02 A 36 GLN HA H 1 5.30 0.02 A 36 GLN HB2 H 1 1.90 0.02 A 36 GLN HB3 H 1 1.75 0.02 A 36 GLN HE21 H 1 7.10 0.02 A 36 GLN HE22 H 1 6.77 0.02 A 36 GLN HGy H 1 2.22 0.02 A 36 GLN HGx H 1 2.07 0.02 A 36 GLN C C 13 174.32 0.05 A 36 GLN CA C 13 54.99 0.05 A 36 GLN CB C 13 31.47 0.05 A 36 GLN CG C 13 34.75 0.05 A 36 GLN N N 15 125.91 0.05 A 36 GLN NE2 N 15 111.35 0.05 A 37 LEU H H 1 8.80 0.02 A 37 LEU HA H 1 5.24 0.02 A 37 LEU HB2 H 1 1.45 0.02 A 37 LEU HB3 H 1 1.03 0.02 A 37 LEU HD1% H 1 0.49 0.02 A 37 LEU HD2% H 1 0.52 0.02 A 37 LEU HG H 1 1.37 0.02 A 37 LEU C C 13 175.91 0.05 A 37 LEU CA C 13 52.13 0.05 A 37 LEU CB C 13 46.36 0.05 A 37 LEU CD1 C 13 25.39 0.05 A 37 LEU CD2 C 13 24.22 0.05 A 37 LEU CG C 13 27.13 0.05 A 37 LEU N N 15 122.64 0.05 A 38 ARG H H 1 9.49 0.02 A 38 ARG HA H 1 4.89 0.02 A 38 ARG HBy H 1 1.74 0.02 A 38 ARG HBx H 1 1.71 0.02 A 38 ARG HDy H 1 3.22 0.02 A 38 ARG HDx H 1 3.16 0.02 A 38 ARG HGy H 1 1.72 0.02 A 38 ARG HGx H 1 1.50 0.02 A 38 ARG C C 13 176.66 0.05 A 38 ARG CA C 13 55.17 0.05 A 38 ARG CB C 13 31.29 0.05 A 38 ARG CD C 13 43.25 0.05 A 38 ARG CG C 13 27.34 0.05 A 38 ARG N N 15 123.35 0.05 A 39 LEU H H 1 9.03 0.02 A 39 LEU HA H 1 4.69 0.02 A 39 LEU HB2 H 1 1.83 0.02 A 39 LEU HB3 H 1 1.83 0.02 A 39 LEU HD1% H 1 0.86 0.02 A 39 LEU HD2% H 1 0.86 0.02 A 39 LEU HG H 1 1.63 0.02 A 39 LEU C C 13 178.57 0.05 A 39 LEU CA C 13 54.72 0.05 A 39 LEU CB C 13 42.27 0.05 A 39 LEU CD1 C 13 23.33 0.05 A 39 LEU CD2 C 13 25.67 0.05 A 39 LEU CG C 13 27.44 0.05 A 39 LEU N N 15 128.85 0.05 A 40 ALA H H 1 8.69 0.02 A 40 ALA HA H 1 4.16 0.02 A 40 ALA HB% H 1 1.47 0.02 A 40 ALA C C 13 177.67 0.05 A 40 ALA CA C 13 54.70 0.05 A 40 ALA CB C 13 18.39 0.05 A 40 ALA N N 15 122.70 0.05 A 41 ASN H H 1 7.65 0.02 A 41 ASN HA H 1 4.63 0.02 A 41 ASN HBy H 1 3.3 0.02 A 41 ASN HBx H 1 2.8 0.02 A 41 ASN C C 13 175.56 0.05 A 41 ASN CA C 13 52.31 0.05 A 41 ASN CB C 13 37.02 0.05 A 41 ASN N N 15 113.57 0.05 A 42 ASP H H 1 8.32 0.02 A 42 ASP HA H 1 4.29 0.02 A 42 ASP HBy H 1 3.00 0.02 A 42 ASP HBx H 1 2.92 0.02 A 42 ASP C C 13 175.22 0.05 A 42 ASP CA C 13 56.80 0.05 A 42 ASP CB C 13 39.52 0.05 A 42 ASP N N 15 114.05 0.05 A 43 SER H H 1 7.66 0.02 A 43 SER HA H 1 4.60 0.02 A 43 SER HB2 H 1 3.86 0.02 A 43 SER HB3 H 1 3.99 0.02 A 43 SER C C 13 172.62 0.05 A 43 SER CA C 13 58.40 0.05 A 43 SER CB C 13 64.69 0.05 A 43 SER N N 15 114.70 0.05 A 44 THR H H 1 8.44 0.02 A 44 THR HA H 1 5.28 0.02 A 44 THR HB H 1 3.96 0.02 A 44 THR HG2% H 1 1.02 0.02 A 44 THR C C 13 174.16 0.05 A 44 THR CA C 13 61.16 0.05 A 44 THR CB C 13 70.94 0.05 A 44 THR CG2 C 13 21.51 0.05 A 44 THR N N 15 114.41 0.05 A 45 LYS H H 1 9.19 0.02 A 45 LYS HA H 1 4.67 0.02 A 45 LYS HB2 H 1 1.65 0.02 A 45 LYS HB3 H 1 1.65 0.02 A 45 LYS HD2 H 1 1.54 0.02 A 45 LYS HD3 H 1 1.54 0.02 A 45 LYS HE2 H 1 3.0 0.02 A 45 LYS HE3 H 1 3.0 0.02 A 45 LYS HGy H 1 1.4 0.02 A 45 LYS HGx H 1 1.2 0.02 A 45 LYS C C 13 174.34 0.05 A 45 LYS CA C 13 54.69 0.05 A 45 LYS CB C 13 36.72 0.05 A 45 LYS CD C 13 29.33 0.05 A 45 LYS CE C 13 42.10 0.05 A 45 LYS CG C 13 25.05 0.05 A 45 LYS N N 15 127.21 0.05 A 46 SER H H 1 8.76 0.02 A 46 SER HA H 1 5.05 0.02 A 46 SER HB2 H 1 3.65 0.02 A 46 SER HB3 H 1 3.75 0.02 A 46 SER C C 13 173.42 0.05 A 46 SER CA C 13 58.03 0.05 A 46 SER CB C 13 63.98 0.05 A 46 SER N N 15 123.24 0.05 A 47 ILE H H 1 9.39 0.02 A 47 ILE HA H 1 4.35 0.02 A 47 ILE HB H 1 1.72 0.02 A 47 ILE HD1% H 1 0.64 0.02 A 47 ILE HG12 H 1 1.00 0.02 A 47 ILE HG13 H 1 1.35 0.02 A 47 ILE HG2% H 1 0.77 0.02 A 47 ILE C C 13 174.89 0.05 A 47 ILE CA C 13 59.59 0.05 A 47 ILE CB C 13 41.99 0.05 A 47 ILE CD1 C 13 14.00 0.05 A 47 ILE CG1 C 13 27.30 0.05 A 47 ILE CG2 C 13 18.13 0.05 A 47 ILE N N 15 126.61 0.05 A 48 VAL H H 1 9.05 0.02 A 48 VAL HA H 1 4.68 0.02 A 48 VAL HB H 1 2.19 0.02 A 48 VAL HG1% H 1 1.09 0.02 A 48 VAL HG2% H 1 1.10 0.02 A 48 VAL C C 13 179.48 0.05 A 48 VAL CA C 13 61.88 0.05 A 48 VAL CB C 13 31.41 0.05 A 48 VAL CG1 C 13 22.31 0.05 A 48 VAL CG2 C 13 21.76 0.05 A 48 VAL N N 15 128.74 0.05 A 49 THR H H 1 8.81 0.02 A 49 THR HA H 1 3.74 0.02 A 49 THR HB H 1 4.19 0.02 A 49 THR HG2% H 1 1.43 0.02 A 49 THR C C 13 177.41 0.05 A 49 THR CA C 13 66.33 0.05 A 49 THR CB C 13 67.71 0.05 A 49 THR CG2 C 13 24.11 0.05 A 49 THR N N 15 118.68 0.05 A 50 LYS H H 1 7.59 0.02 A 50 LYS HA H 1 4.23 0.02 A 50 LYS HB2 H 1 1.89 0.02 A 50 LYS HB3 H 1 1.89 0.02 A 50 LYS HD2 H 1 1.73 0.02 A 50 LYS HD3 H 1 1.73 0.02 A 50 LYS HE2 H 1 3.04 0.02 A 50 LYS HE3 H 1 3.04 0.02 A 50 LYS HG2 H 1 1.41 0.02 A 50 LYS HG3 H 1 1.41 0.02 A 50 LYS C C 13 176.16 0.05 A 50 LYS CA C 13 58.19 0.05 A 50 LYS CB C 13 31.77 0.05 A 50 LYS CD C 13 29.28 0.05 A 50 LYS CE C 13 42.03 0.05 A 50 LYS CG C 13 24.29 0.05 A 50 LYS N N 15 119.66 0.05 A 51 ASP H H 1 7.91 0.02 A 51 ASP HA H 1 4.76 0.02 A 51 ASP HB2 H 1 3.01 0.02 A 51 ASP HB3 H 1 2.75 0.02 A 51 ASP C C 13 175.26 0.05 A 51 ASP CA C 13 54.72 0.05 A 51 ASP CB C 13 41.24 0.05 A 51 ASP N N 15 118.01 0.05 A 52 ILE H H 1 7.42 0.02 A 52 ILE HA H 1 3.69 0.02 A 52 ILE HB H 1 1.82 0.02 A 52 ILE HD1% H 1 0.66 0.02 A 52 ILE HG12 H 1 0.56 0.02 A 52 ILE HG13 H 1 1.76 0.02 A 52 ILE HG2% H 1 0.65 0.02 A 52 ILE C C 13 174.34 0.05 A 52 ILE CA C 13 63.63 0.05 A 52 ILE CB C 13 38.63 0.05 A 52 ILE CD1 C 13 14.35 0.05 A 52 ILE CG1 C 13 27.89 0.05 A 52 ILE CG2 C 13 17.31 0.05 A 52 ILE N N 15 118.69 0.05 A 53 LYS H H 1 9.38 0.02 A 53 LYS HA H 1 4.39 0.02 A 53 LYS HB2 H 1 1.62 0.02 A 53 LYS HB3 H 1 1.49 0.02 A 53 LYS HDy H 1 1.71 0.02 A 53 LYS HDx H 1 1.64 0.02 A 53 LYS HE2 H 1 2.98 0.02 A 53 LYS HE3 H 1 2.98 0.02 A 53 LYS HG2 H 1 1.4 0.02 A 53 LYS HG3 H 1 1.4 0.02 A 53 LYS C C 13 175.78 0.05 A 53 LYS CA C 13 57.30 0.05 A 53 LYS CB C 13 34.20 0.05 A 53 LYS CD C 13 30.18 0.05 A 53 LYS CE C 13 41.60 0.05 A 53 LYS CG C 13 24.93 0.05 A 53 LYS N N 15 130.06 0.05 A 54 ASP H H 1 8.32 0.02 A 54 ASP HA H 1 4.81 0.02 A 54 ASP HB2 H 1 2.57 0.02 A 54 ASP HB3 H 1 2.52 0.02 A 54 ASP C C 13 173.28 0.05 A 54 ASP CA C 13 52.94 0.05 A 54 ASP CB C 13 44.59 0.05 A 54 ASP N N 15 116.75 0.05 A 55 LEU H H 1 8.70 0.02 A 55 LEU HA H 1 5.08 0.02 A 55 LEU HB2 H 1 1.59 0.02 A 55 LEU HB3 H 1 1.48 0.02 A 55 LEU HD1% H 1 0.63 0.02 A 55 LEU HD2% H 1 0.63 0.02 A 55 LEU HG H 1 1.50 0.02 A 55 LEU C C 13 173.75 0.05 A 55 LEU CA C 13 55.23 0.05 A 55 LEU CB C 13 46.20 0.05 A 55 LEU CD1 C 13 26.74 0.05 A 55 LEU CD2 C 13 26.74 0.05 A 55 LEU CG C 13 26.82 0.05 A 55 LEU N N 15 120.37 0.05 A 56 ARG H H 1 8.79 0.02 A 56 ARG HA H 1 4.68 0.02 A 56 ARG HBy H 1 1.78 0.02 A 56 ARG HBx H 1 1.68 0.02 A 56 ARG HDy H 1 3.18 0.02 A 56 ARG HDx H 1 3.12 0.02 A 56 ARG HE H 1 7.29 0.02 A 56 ARG HGy H 1 1.60 0.02 A 56 ARG HGx H 1 1.55 0.02 A 56 ARG C C 13 174.64 0.05 A 56 ARG CA C 13 54.47 0.05 A 56 ARG CB C 13 33.67 0.05 A 56 ARG CD C 13 43.40 0.05 A 56 ARG CG C 13 26.97 0.05 A 56 ARG N N 15 121.33 0.05 A 57 ILE H H 1 8.54 0.02 A 57 ILE HA H 1 4.33 0.02 A 57 ILE HB H 1 1.69 0.02 A 57 ILE HD1% H 1 0.84 0.02 A 57 ILE HG12 H 1 1.54 0.02 A 57 ILE HG13 H 1 0.85 0.02 A 57 ILE HG2% H 1 1.04 0.02 A 57 ILE C C 13 175.61 0.05 A 57 ILE CA C 13 61.73 0.05 A 57 ILE CB C 13 38.08 0.05 A 57 ILE CD1 C 13 13.42 0.05 A 57 ILE CG1 C 13 28.61 0.05 A 57 ILE CG2 C 13 17.48 0.05 A 57 ILE N N 15 125.49 0.05 A 58 LEU H H 1 8.75 0.02 A 58 LEU HA H 1 4.65 0.02 A 58 LEU HB2 H 1 1.43 0.02 A 58 LEU HB3 H 1 1.43 0.02 A 58 LEU HDx% H 1 0.75 0.02 A 58 LEU HDy% H 1 0.72 0.02 A 58 LEU HG H 1 1.56 0.02 A 58 LEU C C 13 174.25 0.05 A 58 LEU CA C 13 52.40 0.05 A 58 LEU CB C 13 41.58 0.05 A 58 LEU CDx C 13 22.64 0.05 A 58 LEU CDy C 13 25.53 0.05 A 58 LEU CG C 13 27.08 0.05 A 58 LEU N N 15 130.77 0.05 A 59 PRO HA H 1 4.81 0.02 A 59 PRO HBy H 1 2.39 0.02 A 59 PRO HBx H 1 2.15 0.02 A 59 PRO HDy H 1 3.58 0.02 A 59 PRO HDx H 1 3.49 0.02 A 59 PRO HGy H 1 1.94 0.02 A 59 PRO HGx H 1 1.84 0.02 A 59 PRO CA C 13 62.75 0.05 A 59 PRO CB C 13 34.37 0.05 A 59 PRO CD C 13 50.49 0.05 A 59 PRO CG C 13 24.87 0.05 A 60 LYS CA C 13 57.86 0.05 A 61 ASN HA H 1 4.7 0.02 A 61 ASN HBy H 1 2.8 0.02 A 61 ASN C C 13 174.91 0.05 A 61 ASN CA C 13 53.30 0.05 A 61 ASN CB C 13 38.63 0.05 A 62 GLU H H 1 8.14 0.02 A 62 GLU HA H 1 4.28 0.02 A 62 GLU HBy H 1 2.02 0.02 A 62 GLU HBx H 1 1.91 0.02 A 62 GLU HGy H 1 2.00 0.02 A 62 GLU HGx H 1 1.90 0.02 A 62 GLU C C 13 176.03 0.05 A 62 GLU CA C 13 56.61 0.05 A 62 GLU CB C 13 30.47 0.05 A 62 GLU CG C 13 36.33 0.05 A 62 GLU N N 15 121.00 0.05 A 63 ILE H H 1 7.99 0.02 A 63 ILE HA H 1 4.12 0.02 A 63 ILE HB H 1 1.83 0.02 A 63 ILE HD1% H 1 0.84 0.02 A 63 ILE HG1y H 1 1.43 0.02 A 63 ILE HG1x H 1 1.16 0.02 A 63 ILE HG2% H 1 0.89 0.02 A 63 ILE C C 13 175.88 0.05 A 63 ILE CA C 13 61.02 0.05 A 63 ILE CB C 13 38.47 0.05 A 63 ILE CD1 C 13 12.89 0.05 A 63 ILE CG1 C 13 27.32 0.05 A 63 ILE CG2 C 13 17.62 0.05 A 63 ILE N N 15 121.42 0.05 A 64 MET H H 1 8.31 0.02 A 64 MET HA H 1 4.79 0.02 A 64 MET HBy H 1 2.04 0.02 A 64 MET HBx H 1 1.96 0.02 A 64 MET C C 13 173.86 0.05 A 64 MET CA C 13 53.04 0.05 A 64 MET CB C 13 32.49 0.05 A 64 MET N N 15 125.35 0.05 A 73 SER HA H 1 4.1 0.02 A 73 SER HBy H 1 4.0 0.02 A 73 SER C C 13 174.55 0.05 A 73 SER CA C 13 58.70 0.05 A 73 SER CB C 13 63.79 0.05 A 74 THR H H 1 8.03 0.02 A 74 THR CA C 13 61.67 0.05 A 74 THR CB C 13 69.83 0.05 A 74 THR CG2 C 13 21.55 0.05 A 74 THR N N 15 115.94 0.05 A 75 ASN H H 1 8.12 0.02 A 75 ASN HA H 1 4.90 0.02 A 75 ASN HBy H 1 3.19 0.02 A 75 ASN HBx H 1 2.94 0.02 A 75 ASN C C 13 173.65 0.05 A 75 ASN CA C 13 55.50 0.05 A 75 ASN CB C 13 38.99 0.05 A 75 ASN N N 15 123.09 0.05 A 78 LYS HBy H 1 1.6 0.02 A 78 LYS HDy H 1 1.6 0.02 A 78 LYS HEy H 1 3.0 0.02 A 78 LYS HGy H 1 1.4 0.02 A 78 LYS C C 13 176.43 0.05 A 78 LYS CA C 13 56.38 0.05 A 78 LYS CB C 13 32.76 0.05 A 78 LYS CD C 13 29.08 0.05 A 78 LYS CE C 13 42.12 0.05 A 78 LYS CG C 13 24.72 0.05 A 79 LEU H H 1 8.10 0.02 A 79 LEU HA H 1 4.28 0.02 A 79 LEU HB2 H 1 1.57 0.02 A 79 LEU HB3 H 1 1.57 0.02 A 79 LEU HDx% H 1 0.86 0.02 A 79 LEU HDy% H 1 0.91 0.02 A 79 LEU HG H 1 1.62 0.02 A 79 LEU C C 13 177.31 0.05 A 79 LEU CA C 13 55.28 0.05 A 79 LEU CB C 13 42.30 0.05 A 79 LEU CDx C 13 23.56 0.05 A 79 LEU CDy C 13 24.82 0.05 A 79 LEU CG C 13 27.10 0.05 A 79 LEU N N 15 123.10 0.05 A 80 LYS H H 1 8.28 0.02 A 80 LYS C C 13 176.58 0.05 A 80 LYS CA C 13 56.48 0.05 A 80 LYS N N 15 122.23 0.05 A 82 ALA HA H 1 4.26 0.02 A 82 ALA HB% H 1 1.44 0.02 A 82 ALA C C 13 177.77 0.05 A 82 ALA CA C 13 52.90 0.05 A 82 ALA CB C 13 19.20 0.05 A 83 GLU H H 1 8.30 0.02 A 83 GLU HA H 1 4.29 0.02 A 83 GLU HBy H 1 2.22 0.02 A 83 GLU HGy H 1 2.24 0.02 A 83 GLU C C 13 176.74 0.05 A 83 GLU CA C 13 56.77 0.05 A 83 GLU CB C 13 30.15 0.05 A 83 GLU CG C 13 36.27 0.05 A 83 GLU N N 15 119.70 0.05 A 84 THR H H 1 8.03 0.02 A 84 THR CA C 13 62.00 0.05 A 84 THR CB C 13 69.88 0.05 A 84 THR CG2 C 13 21.52 0.05 A 84 THR N N 15 114.49 0.05 A 85 TYR H H 1 8.15 0.02 A 85 TYR HA H 1 4.58 0.02 A 85 TYR HB2 H 1 2.97 0.02 A 85 TYR HB3 H 1 2.97 0.02 A 85 TYR HD1 H 1 7.10 0.02 A 85 TYR HD2 H 1 7.10 0.02 A 85 TYR HE1 H 1 7.00 0.02 A 85 TYR HE2 H 1 7.00 0.02 A 85 TYR C C 13 173.85 0.05 A 85 TYR CA C 13 55.45 0.05 A 85 TYR CB C 13 41.29 0.05 A 85 TYR N N 15 123.27 0.05 A 90 LYS HBy H 1 1.6 0.02 A 90 LYS HDy H 1 1.6 0.02 A 90 LYS HEy H 1 3.0 0.02 A 90 LYS HGy H 1 1.4 0.02 A 90 LYS C C 13 176.03 0.05 A 90 LYS CA C 13 56.74 0.05 A 90 LYS CB C 13 32.86 0.05 A 90 LYS CD C 13 29.09 0.05 A 90 LYS CE C 13 42.00 0.05 A 90 LYS CG C 13 24.32 0.05 A 91 TRP H H 1 8.00 0.02 A 91 TRP HA H 1 4.71 0.02 A 91 TRP HBy H 1 3.34 0.02 A 91 TRP HBx H 1 3.23 0.02 A 91 TRP HD1 H 1 7.25 0.02 A 91 TRP HE1 H 1 10.11 0.02 A 91 TRP HE3 H 1 7.61 0.02 A 91 TRP HZ2 H 1 7.46 0.02 A 91 TRP C C 13 175.94 0.05 A 91 TRP CA C 13 56.96 0.05 A 91 TRP CB C 13 29.44 0.05 A 91 TRP N N 15 120.88 0.05 A 92 SER H H 1 7.90 0.02 A 92 SER C C 13 173.94 0.05 A 92 SER CA C 13 58.11 0.05 A 92 SER CB C 13 64.01 0.05 A 92 SER N N 15 116.58 0.05 A 93 MET H H 1 8.23 0.02 A 93 MET HA H 1 4.4 0.02 A 93 MET HBy H 1 2.1 0.02 A 93 MET C C 13 174.94 0.05 A 93 MET CA C 13 55.39 0.05 A 93 MET CB C 13 32.94 0.05 A 93 MET CG C 13 33.55 0.05 A 93 MET N N 15 122.27 0.05 A 94 ASP H H 1 7.89 0.02 A 94 ASP HA H 1 4.36 0.02 A 94 ASP HBy H 1 2.66 0.02 A 94 ASP HBx H 1 2.53 0.02 A 94 ASP C C 13 180.75 0.05 A 94 ASP CA C 13 55.86 0.05 A 94 ASP CB C 13 42.26 0.05 A 94 ASP N N 15 126.46 0.05 B 247 ASN HA H 1 4.66 0.02 B 247 ASN HBy H 1 2.8 0.02 B 247 ASN C C 13 174.90 0.05 B 247 ASN CA C 13 53.24 0.05 B 247 ASN CB C 13 38.86 0.05 B 248 ILE H H 1 8.05 0.02 B 248 ILE HA H 1 4.22 0.02 B 248 ILE HB H 1 1.88 0.02 B 248 ILE HD1% H 1 0.83 0.02 B 248 ILE HG1y H 1 1.4 0.02 B 248 ILE HG1x H 1 1.1 0.02 B 248 ILE HG2% H 1 0.89 0.02 B 248 ILE C C 13 175.97 0.05 B 248 ILE CA C 13 61.12 0.05 B 248 ILE CB C 13 38.91 0.05 B 248 ILE CD1 C 13 13.14 0.05 B 248 ILE CG1 C 13 27.14 0.05 B 248 ILE CG2 C 13 17.68 0.05 B 248 ILE N N 15 120.71 0.05 B 249 SER H H 1 8.33 0.02 B 249 SER HA H 1 4.51 0.02 B 249 SER HBy H 1 3.84 0.02 B 249 SER C C 13 174.27 0.05 B 249 SER CA C 13 58.16 0.05 B 249 SER CB C 13 63.89 0.05 B 249 SER N N 15 119.71 0.05 B 250 VAL H H 1 8.07 0.02 B 250 VAL HA H 1 4.16 0.02 B 250 VAL HB H 1 2.08 0.02 B 250 VAL HGx% H 1 0.90 0.02 B 250 VAL HGy% H 1 0.92 0.02 B 250 VAL C C 13 175.46 0.05 B 250 VAL CA C 13 62.07 0.05 B 250 VAL CB C 13 32.84 0.05 B 250 VAL CGx C 13 20.33 0.05 B 250 VAL CGy C 13 21.05 0.05 B 250 VAL N N 15 121.09 0.05 B 251 ASP H H 1 8.33 0.02 B 251 ASP HA H 1 4.66 0.02 B 251 ASP HBy H 1 2.73 0.02 B 251 ASP HBx H 1 2.56 0.02 B 251 ASP C C 13 176.24 0.05 B 251 ASP CA C 13 54.17 0.05 B 251 ASP CB C 13 41.25 0.05 B 251 ASP N N 15 123.79 0.05 B 252 VAL H H 1 8.06 0.02 B 252 VAL HA H 1 4.08 0.02 B 252 VAL HB H 1 2.11 0.02 B 252 VAL HGx% H 1 0.93 0.02 B 252 VAL HGy% H 1 0.94 0.02 B 252 VAL C C 13 176.01 0.05 B 252 VAL CA C 13 62.71 0.05 B 252 VAL CB C 13 32.61 0.05 B 252 VAL CGx C 13 20.41 0.05 B 252 VAL CGy C 13 21.21 0.05 B 252 VAL N N 15 119.89 0.05 B 253 ASP H H 1 8.29 0.02 B 253 ASP HA H 1 4.64 0.02 B 253 ASP HBy H 1 2.77 0.02 B 253 ASP HBx H 1 2.59 0.02 B 253 ASP C C 13 176.45 0.05 B 253 ASP CA C 13 54.52 0.05 B 253 ASP CB C 13 41.12 0.05 B 253 ASP N N 15 122.96 0.05 B 254 ALA H H 1 8.16 0.02 B 254 ALA HA H 1 4.29 0.02 B 254 ALA HB% H 1 1.44 0.02 B 254 ALA C C 13 178.23 0.05 B 254 ALA CA C 13 53.40 0.05 B 254 ALA CB C 13 19.20 0.05 B 254 ALA N N 15 125.09 0.05 B 255 ASP H H 1 8.30 0.02 B 255 ASP HA H 1 4.62 0.02 B 255 ASP HB2 H 1 2.78 0.02 B 255 ASP HB3 H 1 2.78 0.02 B 255 ASP C C 13 176.94 0.05 B 255 ASP CA C 13 54.85 0.05 B 255 ASP CB C 13 41.25 0.05 B 255 ASP N N 15 119.50 0.05 B 256 ALA H H 1 8.43 0.02 B 256 ALA HA H 1 4.33 0.02 B 256 ALA HB% H 1 1.59 0.02 B 256 ALA C C 13 178.78 0.05 B 256 ALA CA C 13 54.78 0.05 B 256 ALA CB C 13 18.93 0.05 B 256 ALA N N 15 125.27 0.05 B 257 SER H H 1 8.30 0.02 B 257 SER HA H 1 3.84 0.02 B 257 SER HBy H 1 4.17 0.02 B 257 SER HBx H 1 3.92 0.02 B 257 SER C C 13 175.28 0.05 B 257 SER CA C 13 63.12 0.05 B 257 SER CB C 13 62.95 0.05 B 257 SER N N 15 114.18 0.05 B 258 SER H H 1 8.10 0.02 B 258 SER HA H 1 4.19 0.02 B 258 SER HBy H 1 4.07 0.02 B 258 SER HBx H 1 3.99 0.02 B 258 SER C C 13 182.87 0.05 B 258 SER CA C 13 61.31 0.05 B 258 SER CB C 13 62.47 0.05 B 258 SER N N 15 116.73 0.05 B 259 GLN H H 1 8.1 0.02 B 259 GLN HGy H 1 2.3 0.02 B 260 LEU H H 1 8.02 0.02 B 260 LEU HA H 1 3.52 0.02 B 260 LEU HB2 H 1 0.19 0.02 B 260 LEU HB3 H 1 1.42 0.02 B 260 LEU HD1% H 1 0.37 0.02 B 260 LEU HD2% H 1 0.42 0.02 B 260 LEU HG H 1 1.04 0.02 B 260 LEU C C 13 177.68 0.05 B 260 LEU CA C 13 57.84 0.05 B 260 LEU CB C 13 39.27 0.05 B 260 LEU CD1 C 13 21.64 0.05 B 260 LEU CD2 C 13 26.03 0.05 B 260 LEU CG C 13 26.61 0.05 B 261 LEU H H 1 8.16 0.02 B 261 LEU HA H 1 3.78 0.02 B 261 LEU HB2 H 1 1.47 0.02 B 261 LEU HB3 H 1 1.91 0.02 B 261 LEU HD1% H 1 0.79 0.02 B 261 LEU HD2% H 1 0.98 0.02 B 261 LEU HG H 1 1.58 0.02 B 261 LEU C C 13 178.05 0.05 B 261 LEU CA C 13 58.56 0.05 B 261 LEU CB C 13 41.48 0.05 B 261 LEU CD1 C 13 23.83 0.05 B 261 LEU CD2 C 13 26.03 0.05 B 261 LEU CG C 13 26.64 0.05 B 261 LEU N N 15 118.68 0.05 B 262 SER H H 1 7.86 0.02 B 262 SER HA H 1 4.12 0.02 B 262 SER HB2 H 1 3.94 0.02 B 262 SER HB3 H 1 3.94 0.02 B 262 SER CA C 13 61.73 0.05 B 262 SER CB C 13 62.84 0.05 B 262 SER N N 15 112.26 0.05 B 263 LEU H H 1 7.79 0.02 B 263 LEU HA H 1 4.03 0.02 B 263 LEU HB2 H 1 1.83 0.02 B 263 LEU HB3 H 1 1.24 0.02 B 263 LEU HD1% H 1 0.67 0.02 B 263 LEU HD2% H 1 0.82 0.02 B 263 LEU HG H 1 1.74 0.02 B 263 LEU C C 13 179.70 0.05 B 263 LEU CA C 13 57.49 0.05 B 263 LEU CB C 13 42.62 0.05 B 263 LEU CD1 C 13 25.62 0.05 B 263 LEU CD2 C 13 23.08 0.05 B 263 LEU CG C 13 26.67 0.05 B 263 LEU N N 15 122.06 0.05 B 264 LEU H H 1 7.95 0.02 B 264 LEU HA H 1 3.71 0.02 B 264 LEU HB2 H 1 1.88 0.02 B 264 LEU HB3 H 1 1.09 0.02 B 264 LEU HD1% H 1 0.51 0.02 B 264 LEU HD2% H 1 0.18 0.02 B 264 LEU HG H 1 1.63 0.02 B 264 LEU C C 13 178.50 0.05 B 264 LEU CA C 13 57.02 0.05 B 264 LEU CB C 13 42.00 0.05 B 264 LEU CD1 C 13 26.84 0.05 B 264 LEU CD2 C 13 23.83 0.05 B 264 LEU CG C 13 25.91 0.05 B 264 LEU N N 15 118.17 0.05 B 265 LYS H H 1 7.94 0.02 B 265 LYS HA H 1 4.22 0.02 B 265 LYS HB2 H 1 1.76 0.02 B 265 LYS HB3 H 1 1.76 0.02 B 265 LYS HGy H 1 1.4 0.02 B 265 LYS C C 13 177.44 0.05 B 265 LYS CA C 13 56.88 0.05 B 265 LYS CB C 13 31.86 0.05 B 265 LYS CG C 13 24.88 0.05 B 265 LYS N N 15 116.39 0.05 B 266 SER H H 1 7.77 0.02 B 266 SER HA H 1 4.46 0.02 B 266 SER HB2 H 1 3.97 0.02 B 266 SER HB3 H 1 3.97 0.02 B 266 SER CA C 13 59.29 0.05 B 266 SER CB C 13 63.71 0.05 B 266 SER N N 15 114.64 0.05 B 268 THR HB H 1 4.2 0.02 B 268 THR HG2% H 1 1.2 0.02 B 268 THR C C 13 173.75 0.05 B 268 THR CA C 13 61.62 0.05 B 268 THR CB C 13 70.11 0.05 B 268 THR CG2 C 13 21.62 0.05 B 269 ALA H H 1 8.31 0.02 B 269 ALA HA H 1 4.61 0.02 B 269 ALA HB% H 1 1.39 0.02 B 269 ALA C C 13 175.58 0.05 B 269 ALA CA C 13 50.59 0.05 B 269 ALA CB C 13 18.20 0.05 B 269 ALA N N 15 128.14 0.05 B 270 PRO HA H 1 4.41 0.02 B 270 PRO HBy H 1 2.3 0.02 B 270 PRO HBx H 1 1.9 0.02 B 270 PRO HD2 H 1 3.82 0.02 B 270 PRO HD3 H 1 3.82 0.02 B 270 PRO HG2 H 1 2.03 0.02 B 270 PRO HG3 H 1 2.03 0.02 B 270 PRO CA C 13 63.36 0.05 B 270 PRO CB C 13 32.06 0.05 B 270 PRO CD C 13 50.46 0.05 B 270 PRO CG C 13 27.45 0.05 B 271 SER H H 1 8.32 0.02 B 271 SER C C 13 174.45 0.05 B 271 SER CA C 13 58.56 0.05 B 271 SER CB C 13 63.92 0.05 B 271 SER N N 15 115.28 0.05 B 272 ASP H H 1 8.31 0.02 B 272 ASP HA H 1 4.61 0.02 B 272 ASP HB2 H 1 2.67 0.02 B 272 ASP HB3 H 1 2.67 0.02 B 272 ASP C C 13 176.09 0.05 B 272 ASP CA C 13 54.45 0.05 B 272 ASP CB C 13 41.05 0.05 B 272 ASP N N 15 122.11 0.05 B 273 LEU H H 1 7.98 0.02 B 273 LEU HA H 1 4.72 0.02 B 273 LEU HB2 H 1 1.60 0.02 B 273 LEU HB3 H 1 1.60 0.02 B 273 LEU HDx% H 1 0.92 0.02 B 273 LEU HDy% H 1 0.86 0.02 B 273 LEU HG H 1 1.57 0.02 B 273 LEU C C 13 176.97 0.05 B 273 LEU CA C 13 55.13 0.05 B 273 LEU CB C 13 42.36 0.05 B 273 LEU CDy C 13 24.98 0.05 B 273 LEU CDx C 13 23.41 0.05 B 273 LEU CG C 13 26.95 0.05 B 273 LEU N N 15 121.74 0.05 B 274 ALA H H 1 8.15 0.02 B 274 ALA HA H 1 4.35 0.02 B 274 ALA HB% H 1 1.40 0.02 B 274 ALA C C 13 177.47 0.05 B 274 ALA CA C 13 52.36 0.05 B 274 ALA CB C 13 19.20 0.05 B 274 ALA N N 15 124.42 0.05 B 275 THR H H 1 8.01 0.02 B 275 THR HB H 1 4.2 0.02 B 275 THR C C 13 172.74 0.05 B 275 THR CA C 13 59.78 0.05 B 275 THR CB C 13 69.78 0.05 B 275 THR CG2 C 13 21.6 0.05 B 275 THR N N 15 116.02 0.05 B 285 PRO CA C 13 62.97 0.05 B 285 PRO CB C 13 31.94 0.05 B 285 PRO CD C 13 50.32 0.05 B 285 PRO CG C 13 27.28 0.05 B 286 VAL H H 1 8.16 0.02 B 286 VAL HA H 1 4.05 0.02 B 286 VAL HB H 1 2.01 0.02 B 286 VAL HGx% H 1 0.93 0.02 B 286 VAL HGy% H 1 0.94 0.02 B 286 VAL C C 13 176.24 0.05 B 286 VAL CA C 13 62.40 0.05 B 286 VAL CB C 13 32.72 0.05 B 286 VAL CGx C 13 20.27 0.05 B 286 VAL CGy C 13 21.34 0.05 B 286 VAL N N 15 120.30 0.05 B 287 GLU H H 1 8.48 0.02 B 287 GLU C C 13 176.21 0.05 B 287 GLU CA C 13 56.43 0.05 B 287 GLU CB C 13 30.35 0.05 B 287 GLU N N 15 124.60 0.05 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 noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 261 LEU HA B 261 LEU H 1.0 0.0 3.2 2 2 B 258 SER H B 258 SER HA 1.0 0.0 3.2 3 3 B 265 LYS HA B 265 LYS H 1.0 0.0 3.2 4 4 B 257 SER H B 257 SER HA 1.0 0.0 3.2 5 5 B 254 ALA H B 254 ALA HA 1.0 0.0 3.2 6 6 B 255 ASP H B 255 ASP HA 1.0 0.0 3.2 7 7 B 256 ALA H B 256 ALA HA 1.0 0.0 3.2 8 8 B 263 LEU HA B 263 LEU H 1.0 0.0 3.2 9 9 B 264 LEU HA B 264 LEU H 1.0 0.0 3.2 10 10 B 262 SER HA B 262 SER H 1.0 0.0 3.2 11 11 A 51 ASP H A 51 ASP HA 1.0 0.0 3.2 12 12 A 28 PHE H A 28 PHE HA 1.0 2.7 7.7 13 13 A 19 SER H A 19 SER HA 1.0 2.7 7.7 14 14 A 25 ILE HA A 25 ILE H 1.0 2.7 7.7 15 15 A 21 ALA HA A 21 ALA H 1.0 2.7 7.7 16 16 A 50 LYS HA A 50 LYS HG2 1.0 2.7 8.2 17 17 A 10 ASN H A 10 ASN HA 1.0 2.7 7.7 18 18 A 17 ASN H A 17 ASN HA 1.0 0.0 3.2 19 19 A 33 SER HA A 33 SER H 1.0 0.0 3.2 20 20 A 57 ILE H A 57 ILE HA 1.0 2.7 7.7 21 21 A 22 ARG H A 22 ARG HA 1.0 2.7 7.7 22 22 A 2 SER H A 2 SER HA 1.0 2.7 7.7 23 23 A 43 SER HA A 43 SER H 1.0 2.7 7.7 24 24 A 23 GLY HA3 A 23 GLY H 1.0 0.0 3.2 25 25 A 50 LYS HA A 50 LYS H 1.0 0.0 3.2 26 26 A 29 ASP HA A 29 ASP H 1.0 2.7 7.7 27 27 A 13 VAL HA A 13 VAL H 1.0 2.7 7.7 28 28 A 24 VAL HA A 24 VAL H 1.0 2.7 7.7 29 29 A 44 THR H A 44 THR HA 1.0 2.7 7.7 30 30 A 55 LEU H A 55 LEU HA 1.0 2.7 7.7 31 31 A 50 LYS H A 50 LYS HD2 1.0 4.0 9.5 32 31 A 50 LYS H A 50 LYS HD3 1.0 4.0 9.5 33 32 A 12 GLU HA A 12 GLU H 1.0 2.7 7.7 34 33 A 32 ASN H A 32 ASN HA 1.0 0.0 3.2 35 34 A 11 VAL HA A 11 VAL H 1.0 2.7 7.7 36 35 A 56 ARG HA A 56 ARG H 1.0 2.7 7.7 37 36 A 14 LEU HA A 14 LEU H 1.0 2.7 7.7 38 37 A 5 ASP H A 5 ASP HA 1.0 0.0 3.2 39 38 A 52 ILE H A 52 ILE HA 1.0 2.7 7.7 40 39 A 39 LEU HA A 39 LEU H 1.0 2.7 7.7 41 40 A 45 LYS HA A 45 LYS H 1.0 2.7 7.7 42 41 A 3 VAL H A 3 VAL HA 1.0 0.0 3.2 43 42 A 37 LEU HA A 37 LEU H 1.0 2.7 7.7 44 43 A 27 ASN HA A 27 ASN H 1.0 2.7 7.7 45 44 A 58 LEU HA A 58 LEU H 1.0 2.7 7.7 46 45 A 35 LEU HA A 35 LEU H 1.0 2.7 7.7 47 46 A 42 ASP HA A 42 ASP H 1.0 0.0 3.2 48 47 A 47 ILE HA A 47 ILE H 1.0 2.7 7.7 49 48 A 15 LEU HA A 15 LEU H 1.0 2.7 7.7 50 49 A 50 LYS HA A 50 LYS HG3 1.0 2.7 8.2 51 50 A 49 THR H A 49 THR HA 1.0 0.0 3.2 52 51 A 20 LYS H A 20 LYS HA 1.0 2.7 7.7 53 52 A 48 VAL H A 48 VAL HA 1.0 2.7 7.7 54 53 A 18 ASP HA A 18 ASP H 1.0 0.0 3.2 55 54 A 9 SER HA A 9 SER H 1.0 2.7 7.7 56 55 A 7 TYR H A 7 TYR HA 1.0 2.7 7.7 57 56 A 34 ILE HA A 34 ILE H 1.0 2.7 7.7 58 57 A 16 ASN HA A 16 ASN H 1.0 0.0 3.2 59 58 A 26 THR HA A 26 THR H 1.0 2.7 7.7 60 59 A 54 ASP HA A 54 ASP H 1.0 2.7 7.7 61 60 A 4 ALA H A 4 ALA HA 1.0 0.0 3.2 62 61 A 38 ARG HA A 38 ARG H 1.0 2.7 7.7 63 62 A 46 SER H A 46 SER HA 1.0 2.7 7.7 64 63 A 36 GLN HA A 36 GLN H 1.0 2.7 7.7 65 64 A 53 LYS HA A 53 LYS H 1.0 0.0 3.2 66 65 A 6 PHE H A 6 PHE HA 1.0 0.0 3.2 67 66 A 23 GLY HA2 A 23 GLY H 1.0 0.0 3.2 stop_ save_ save_CNS/XPLOR_distance_constraints_6 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_6 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 258 SER H B 255 ASP HA 1.0 0.0 3.5 2 2 B 260 LEU HA B 264 LEU H 1.0 0.0 4.5 3 3 B 258 SER HA B 261 LEU H 1.0 0.0 3.5 4 4 B 262 SER HA B 265 LYS H 1.0 0.0 3.5 5 5 B 260 LEU HA B 263 LEU H 1.0 0.0 3.5 6 6 B 254 ALA HA B 256 ALA H 1.0 3.2 8.2 7 7 B 261 LEU HA B 265 LYS H 1.0 0.0 4.5 8 8 B 260 LEU HA B 264 LEU HD1% 1.0 3.2 8.2 9 9 A 3 VAL HA A 6 PHE HD1 1.0 0.0 2.7 10 10 A 7 TYR H A 3 VAL HG1% 1.0 0.0 4.8 11 11 A 3 VAL HA A 6 PHE H 1.0 0.0 3.5 12 12 A 15 LEU HB2 A 19 SER HB2 1.0 0.0 3.2 13 13 A 43 SER HB3 A 39 LEU H 1.0 4.0 9.5 14 14 A 29 ASP HA A 32 ASN H 1.0 0.0 5.0 15 15 A 52 ILE HG2% A 54 ASP H 1.0 0.0 4.0 16 16 A 4 ALA HB% A 7 TYR HE2 1.0 0.0 4.8 17 17 A 52 ILE H A 49 THR HA 1.0 0.0 3.5 18 18 A 3 VAL HG1% A 7 TYR HD2 1.0 0.0 4.8 19 19 A 39 LEU HG A 43 SER H 1.0 0.0 5.0 20 20 A 43 SER HB2 A 39 LEU H 1.0 4.0 9.5 21 21 A 7 TYR HE2 A 3 VAL HB 1.0 3.2 8.7 22 22 A 4 ALA HB% A 7 TYR HD2 1.0 0.0 4.8 23 23 A 4 ALA H A 2 SER HB2 1.0 0.0 4.0 24 24 A 5 ASP HA A 7 TYR H 1.0 0.0 4.0 25 25 A 7 TYR H A 4 ALA HA 1.0 0.0 3.5 26 26 A 19 SER H A 17 ASN HD22 1.0 4.0 9.0 27 27 A 29 ASP HB3 A 33 SER H 1.0 0.0 4.0 28 28 A 52 ILE HA A 54 ASP H 1.0 0.0 3.5 29 29 A 50 LYS H A 48 VAL HB 1.0 4.0 9.5 30 30 A 19 SER H A 15 LEU H 1.0 0.0 3.5 31 31 A 43 SER H A 39 LEU H 1.0 0.0 4.0 32 32 A 33 SER HA A 29 ASP H 1.0 0.0 3.5 33 33 A 49 THR HA A 52 ILE HD1% 1.0 0.0 4.0 34 34 A 51 ASP H A 48 VAL HB 1.0 0.0 5.0 35 35 A 25 ILE HG2% A 27 ASN H 1.0 0.0 4.8 36 36 A 50 LYS HA A 52 ILE H 1.0 0.0 3.5 37 37 A 4 ALA HA A 7 TYR HE2 1.0 3.2 8.7 38 38 A 3 VAL HB A 7 TYR HE1 1.0 3.2 8.7 39 39 A 4 ALA HA A 7 TYR HD2 1.0 4.0 9.5 40 40 A 39 LEU HB3 A 43 SER H 1.0 0.0 4.8 41 40 A 43 SER H A 39 LEU HB2 1.0 0.0 4.8 42 41 A 50 LYS H A 48 VAL HG1% 1.0 0.0 4.0 43 42 A 30 SER HA A 33 SER H 1.0 0.0 3.5 44 43 A 2 SER H A 5 ASP H 1.0 0.0 4.0 45 44 A 3 VAL HG1% A 7 TYR HE2 1.0 0.0 4.0 46 45 A 41 ASN HBx A 43 SER H 1.0 4.0 9.5 47 45 A 43 SER H A 41 ASN HBy 1.0 4.0 9.5 48 46 A 19 SER H A 15 LEU HB2 1.0 0.0 3.2 49 47 A 14 LEU HD1% A 18 ASP H 1.0 0.0 5.8 stop_ save_ save_CNS/XPLOR_distance_constraints_8 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_8 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 254 ALA HA B 255 ASP H 1.0 3.2 8.2 2 2 B 254 ALA H B 255 ASP H 1.0 0.0 2.7 3 3 B 254 ALA H B 253 ASP HA 1.0 0.0 2.7 4 4 B 263 LEU HA B 264 LEU H 1.0 3.2 8.2 5 5 B 262 SER HA B 263 LEU H 1.0 3.2 8.2 6 6 B 264 LEU HA B 265 LYS H 1.0 3.2 8.2 7 7 B 264 LEU H B 265 LYS H 1.0 0.0 2.7 8 8 B 255 ASP HA B 256 ALA H 1.0 3.2 8.2 9 9 B 262 SER H B 263 LEU H 1.0 0.0 2.7 10 10 B 258 SER H B 257 SER HA 1.0 3.2 8.2 11 11 B 257 SER H B 256 ALA HA 1.0 3.2 8.2 12 12 B 258 SER H B 257 SER H 1.0 0.0 2.7 13 13 B 261 LEU HA B 262 SER H 1.0 3.2 8.2 14 14 B 265 LYS H B 266 SER H 1.0 0.0 2.7 15 15 B 263 LEU H B 264 LEU H 1.0 0.0 2.7 16 16 B 260 LEU HA B 261 LEU H 1.0 3.2 8.2 17 17 B 261 LEU H B 262 SER H 1.0 0.0 2.7 18 18 A 25 ILE H A 24 VAL H 1.0 3.2 8.2 19 19 A 57 ILE HA A 58 LEU H 1.0 0.0 2.7 20 20 A 36 GLN H A 35 LEU H 1.0 3.2 8.2 21 21 A 15 LEU HA A 16 ASN HB3 1.0 0.0 5.0 22 22 A 51 ASP H A 52 ILE H 1.0 0.0 2.7 23 23 A 44 THR H A 45 LYS H 1.0 3.2 8.2 24 24 A 7 TYR H A 6 PHE HA 1.0 3.2 8.2 25 25 A 11 VAL HA A 12 GLU H 1.0 0.0 2.7 26 26 A 5 ASP HA A 6 PHE H 1.0 3.2 8.2 27 27 A 38 ARG H A 37 LEU H 1.0 3.2 8.2 28 28 A 37 LEU HA A 38 ARG H 1.0 0.0 2.7 29 29 A 10 ASN HA A 11 VAL H 1.0 0.0 2.7 30 30 A 55 LEU HA A 56 ARG H 1.0 0.0 2.7 31 31 A 35 LEU H A 34 ILE H 1.0 3.2 8.2 32 32 A 52 ILE H A 53 LYS H 1.0 3.2 8.2 33 33 A 44 THR H A 43 SER H 1.0 3.2 8.2 34 34 A 12 GLU H A 13 VAL H 1.0 3.2 8.2 35 35 A 5 ASP H A 6 PHE H 1.0 0.0 2.7 36 36 A 15 LEU HA A 16 ASN H 1.0 0.0 2.7 37 37 A 8 GLY H A 9 SER H 1.0 0.0 2.7 38 38 A 10 ASN H A 9 SER H 1.0 3.2 8.2 39 39 A 17 ASN H A 18 ASP H 1.0 0.0 2.7 40 40 A 20 LYS HA A 21 ALA H 1.0 0.0 2.7 41 41 A 32 ASN H A 31 SER H 1.0 0.0 3.5 42 42 A 49 THR H A 48 VAL H 1.0 3.2 8.2 43 43 A 33 SER HA A 34 ILE H 1.0 0.0 2.7 44 44 A 32 ASN H A 31 SER HBx 1.0 0.0 3.5 45 44 A 32 ASN H A 31 SER HBy 1.0 0.0 3.5 46 45 A 51 ASP HA A 52 ILE H 1.0 3.2 8.2 47 46 A 46 SER H A 47 ILE H 1.0 3.2 8.2 48 47 A 47 ILE HA A 48 VAL H 1.0 0.0 2.7 49 48 A 10 ASN H A 9 SER HA 1.0 0.0 2.7 50 49 A 14 LEU HA A 15 LEU H 1.0 0.0 2.7 51 50 A 51 ASP H A 50 LYS H 1.0 0.0 2.7 52 51 A 10 ASN H A 11 VAL H 1.0 3.2 8.2 53 52 A 22 ARG H A 23 GLY H 1.0 3.2 8.2 54 53 A 38 ARG HA A 39 LEU H 1.0 0.0 2.7 55 54 A 14 LEU H A 15 LEU H 1.0 3.2 8.2 56 55 A 13 VAL HA A 14 LEU H 1.0 0.0 2.7 57 56 A 19 SER H A 18 ASP H 1.0 0.0 2.7 58 57 A 26 THR H A 27 ASN H 1.0 0.0 2.7 59 58 A 48 VAL H A 47 ILE H 1.0 3.2 8.2 60 59 A 23 GLY H A 24 VAL H 1.0 3.2 8.2 61 60 A 55 LEU H A 54 ASP H 1.0 3.2 8.2 62 61 A 43 SER H A 42 ASP H 1.0 0.0 2.7 63 62 A 53 LYS HA A 54 ASP H 1.0 3.2 8.2 64 63 A 2 SER H A 1 MET HA 1.0 0.0 2.7 65 64 A 38 ARG H A 39 LEU H 1.0 3.2 8.2 66 65 A 20 LYS H A 21 ALA H 1.0 3.2 8.2 67 66 A 3 VAL H A 4 ALA H 1.0 0.0 2.7 68 67 A 19 SER H A 18 ASP HA 1.0 3.2 8.2 69 68 A 19 SER HA A 20 LYS H 1.0 0.0 2.7 70 69 A 28 PHE H A 27 ASN H 1.0 3.2 8.2 71 70 A 22 ARG HA A 23 GLY H 1.0 0.0 2.7 72 71 A 17 ASN HA A 18 ASP H 1.0 3.2 8.2 73 72 A 52 ILE HA A 53 LYS H 1.0 0.0 2.7 74 73 A 26 THR HA A 27 ASN H 1.0 3.2 8.2 75 74 A 46 SER H A 45 LYS HGy 1.0 0.0 4.0 76 75 A 12 GLU HA A 13 VAL H 1.0 0.0 2.7 77 76 A 35 LEU HA A 36 GLN H 1.0 0.0 2.7 78 77 A 22 ARG H A 21 ALA H 1.0 3.2 8.2 79 78 A 54 ASP H A 53 LYS H 1.0 0.0 2.7 80 79 A 43 SER HA A 44 THR H 1.0 0.0 2.7 81 80 A 15 LEU HA A 16 ASN HD21 1.0 0.0 5.0 82 81 A 7 TYR H A 6 PHE H 1.0 0.0 2.7 83 82 A 46 SER HA A 47 ILE H 1.0 0.0 2.7 84 83 A 46 SER H A 45 LYS HGx 1.0 0.0 5.0 85 84 A 51 ASP H A 50 LYS HA 1.0 3.2 8.2 86 85 A 11 VAL H A 12 GLU H 1.0 3.2 8.2 87 86 A 21 ALA HA A 22 ARG H 1.0 0.0 2.7 88 87 A 57 ILE H A 58 LEU H 1.0 3.2 8.2 89 88 A 55 LEU H A 54 ASP HA 1.0 0.0 2.7 90 89 A 57 ILE HD1% A 58 LEU H 1.0 5.0 10.5 91 90 A 46 SER H A 45 LYS H 1.0 3.2 8.2 92 91 A 45 LYS HA A 46 SER H 1.0 0.0 2.7 93 92 A 50 LYS H A 49 THR H 1.0 0.0 2.7 94 93 A 29 ASP HA A 30 SER H 1.0 0.0 2.7 95 94 A 55 LEU H A 56 ARG H 1.0 3.2 8.2 96 95 A 16 ASN HD21 A 15 LEU HD2% 1.0 0.0 5.8 97 96 A 28 PHE H A 29 ASP H 1.0 3.2 8.2 98 97 A 17 ASN H A 16 ASN H 1.0 0.0 2.7 99 98 A 32 ASN H A 33 SER H 1.0 0.0 2.7 100 99 A 13 VAL H A 14 LEU H 1.0 3.2 8.2 101 100 A 19 SER H A 20 LYS H 1.0 3.2 8.2 102 101 A 15 LEU H A 16 ASN H 1.0 3.2 8.2 103 102 A 49 THR H A 48 VAL HA 1.0 0.0 2.7 104 103 A 36 GLN HA A 37 LEU H 1.0 0.0 2.7 105 104 A 24 VAL HA A 25 ILE H 1.0 0.0 2.7 106 105 A 37 LEU H A 36 GLN H 1.0 3.2 8.2 107 106 A 3 VAL HA A 4 ALA H 1.0 3.2 8.2 108 107 A 42 ASP HA A 43 SER H 1.0 3.2 8.2 109 108 A 17 ASN H A 16 ASN HA 1.0 3.2 8.2 110 109 A 5 ASP H A 4 ALA H 1.0 0.0 2.7 111 110 A 57 ILE H A 56 ARG H 1.0 3.2 8.2 112 111 A 7 TYR HA A 8 GLY H 1.0 0.0 2.7 113 112 A 5 ASP H A 4 ALA HA 1.0 3.2 8.2 114 113 A 32 ASN HD21 A 31 SER HBx 1.0 0.0 4.7 115 113 A 31 SER HBy A 32 ASN HD21 1.0 0.0 4.7 116 114 A 32 ASN HD22 A 31 SER HBx 1.0 0.0 4.7 117 114 A 31 SER HBy A 32 ASN HD22 1.0 0.0 4.7 118 115 A 32 ASN HA A 33 SER H 1.0 3.2 8.2 119 116 A 40 ALA H A 39 LEU H 1.0 3.2 8.2 120 117 A 41 ASN HA A 42 ASP H 1.0 3.2 8.2 121 118 A 50 LYS H A 49 THR HA 1.0 3.2 8.2 122 119 A 34 ILE H A 33 SER H 1.0 0.0 3.2 123 120 A 25 ILE HA A 26 THR H 1.0 0.0 2.7 124 121 A 28 PHE H A 27 ASN HA 1.0 0.0 2.7 125 122 A 34 ILE HA A 35 LEU H 1.0 0.0 2.7 126 123 A 7 TYR H A 8 GLY H 1.0 3.2 8.2 127 124 A 2 SER HA A 3 VAL H 1.0 0.0 2.7 128 125 A 8 GLY H A 7 TYR HB2 1.0 3.2 8.2 129 125 A 8 GLY H A 7 TYR HB3 1.0 3.2 8.2 130 126 A 57 ILE H A 56 ARG HA 1.0 0.0 2.7 131 127 A 44 THR HA A 45 LYS H 1.0 0.0 2.7 132 128 A 28 PHE HA A 29 ASP H 1.0 0.0 2.7 stop_ save_ save_CNS/XPLOR_distance_constraints_10 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_10 _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 15 LEU HA A 53 LYS HB3 1.0 3.2 8.7 2 1 A 15 LEU HA A 53 LYS HB2 1.0 3.2 8.7 3 2 A 11 VAL HA A 58 LEU H 1.0 0.0 3.5 4 3 A 10 ASN H A 24 VAL HG1% 1.0 0.0 5.8 5 4 A 10 ASN HB3 A 58 LEU H 1.0 0.0 4.8 6 4 A 58 LEU H A 10 ASN HB2 1.0 0.0 4.8 7 5 A 44 THR HA A 39 LEU H 1.0 0.0 3.5 8 6 A 29 ASP HB2 A 34 ILE H 1.0 0.0 4.0 9 7 A 27 ASN HA A 7 TYR HE2 1.0 2.7 3.2 10 8 A 56 ARG HGx A 12 GLU H 1.0 0.0 3.2 11 9 A 24 VAL HA A 11 VAL H 1.0 0.0 3.5 12 10 A 26 THR HG2% A 38 ARG H 1.0 0.0 4.8 13 11 A 48 VAL HA A 35 LEU H 1.0 0.0 3.5 14 12 A 25 ILE HA A 37 LEU HD2% 1.0 0.0 4.8 15 13 A 45 LYS H A 37 LEU H 1.0 0.0 3.5 16 14 A 25 ILE HG2% A 9 SER H 1.0 0.0 4.8 17 15 A 49 THR H A 34 ILE HD1% 1.0 4.0 5.0 18 16 A 15 LEU HD2% A 53 LYS H 1.0 0.0 4.8 19 17 A 10 ASN H A 58 LEU HB2 1.0 5.0 10.5 20 18 A 36 GLN HA A 47 ILE H 1.0 0.0 3.5 21 19 A 48 VAL HB A 34 ILE HD1% 1.0 0.0 4.0 22 20 A 8 GLY H A 25 ILE HB 1.0 0.0 4.0 23 21 A 57 ILE HA A 12 GLU H 1.0 0.0 3.5 24 22 A 44 THR HA A 38 ARG HA 1.0 0.0 2.7 25 23 A 49 THR H A 35 LEU H 1.0 0.0 3.5 26 24 A 27 ASN HB2 A 36 GLN H 1.0 0.0 4.0 27 25 A 37 LEU HD2% A 23 GLY H 1.0 0.0 5.8 28 26 A 3 VAL H A 28 PHE HD2 1.0 0.0 5.0 29 27 A 15 LEU HD2% A 51 ASP HB2 1.0 0.0 4.8 30 28 A 38 ARG HA A 45 LYS H 1.0 0.0 3.5 31 29 A 11 VAL HG2% A 23 GLY H 1.0 0.0 5.8 32 30 A 36 GLN H A 27 ASN H 1.0 0.0 3.5 33 31 A 46 SER HA A 34 ILE HG2% 1.0 0.0 5.8 34 32 A 24 VAL HG2% A 10 ASN HB2 1.0 0.0 5.5 35 32 A 10 ASN HB3 A 24 VAL HG2% 1.0 0.0 5.5 36 33 A 3 VAL HG1% A 28 PHE HB3 1.0 0.0 5.8 37 34 A 28 PHE H A 7 TYR HE2 1.0 0.0 4.0 38 35 A 58 LEU HB3 A 11 VAL H 1.0 5.0 10.5 39 36 A 37 LEU HB3 A 45 LYS H 1.0 0.0 5.8 40 36 A 45 LYS H A 37 LEU HB2 1.0 0.0 5.8 41 37 A 58 LEU HB2 A 11 VAL H 1.0 5.0 10.5 42 38 A 22 ARG HA A 37 LEU HD1% 1.0 0.0 4.8 43 39 A 36 GLN HGy A 45 LYS H 1.0 0.0 5.8 44 39 A 45 LYS H A 36 GLN HGx 1.0 0.0 5.8 45 40 A 25 ILE HA A 38 ARG H 1.0 0.0 3.5 46 41 A 36 GLN HB2 A 27 ASN H 1.0 0.0 2.7 47 42 A 26 THR HB A 38 ARG H 1.0 0.0 5.0 48 43 A 38 ARG H A 26 THR H 1.0 0.0 5.0 49 44 A 15 LEU HA A 54 ASP H 1.0 0.0 4.0 50 45 A 25 ILE HA A 37 LEU HA 1.0 0.0 2.7 51 46 A 8 GLY H A 24 VAL HG1% 1.0 0.0 4.8 52 47 A 13 VAL HA A 55 LEU HA 1.0 0.0 2.7 53 48 A 10 ASN HA A 24 VAL HA 1.0 0.0 2.7 54 49 A 22 ARG HA A 13 VAL H 1.0 0.0 3.5 55 50 A 28 PHE HA A 35 LEU HA 1.0 0.0 2.7 56 51 A 10 ASN HA A 24 VAL HG1% 1.0 0.0 4.8 57 52 A 33 SER HA A 49 THR HG2% 1.0 0.0 5.8 58 53 A 55 LEU HA A 14 LEU H 1.0 0.0 3.5 59 54 A 25 ILE H A 11 VAL H 1.0 0.0 5.0 60 55 A 10 ASN H A 57 ILE HG2% 1.0 0.0 5.8 61 56 A 25 ILE H A 9 SER H 1.0 0.0 3.5 62 57 A 49 THR H A 34 ILE HA 1.0 0.0 3.2 63 58 A 24 VAL HB A 38 ARG H 1.0 0.0 4.0 64 59 A 56 ARG HDx A 12 GLU H 1.0 0.0 5.0 65 60 A 52 ILE HG2% A 14 LEU H 1.0 0.0 5.8 66 61 A 25 ILE HG2% A 8 GLY H 1.0 0.0 5.8 67 62 A 11 VAL HA A 58 LEU HDy% 1.0 0.0 5.8 68 63 A 14 LEU HA A 20 LYS HA 1.0 0.0 2.7 69 64 A 36 GLN HB2 A 26 THR HB 1.0 0.0 5.0 70 65 A 13 VAL HA A 56 ARG H 1.0 0.0 3.5 71 66 A 12 GLU HGy A 21 ALA H 1.0 0.0 4.0 72 67 A 20 LYS H A 14 LEU HD1% 1.0 0.0 5.8 73 68 A 37 LEU HA A 24 VAL H 1.0 0.0 5.0 74 69 A 35 LEU HA A 28 PHE HD1 1.0 0.0 4.0 75 70 A 46 SER HA A 37 LEU H 1.0 0.0 3.5 76 71 A 52 ILE HA A 15 LEU HA 1.0 0.0 3.5 77 72 A 46 SER HA A 36 GLN HA 1.0 0.0 2.7 78 73 A 16 ASN H A 53 LYS HB3 1.0 3.2 8.7 79 74 A 46 SER HA A 36 GLN HGx 1.0 2.7 8.2 80 75 A 13 VAL HG1% A 53 LYS H 1.0 0.0 5.8 81 76 A 24 VAL HG2% A 10 ASN HD22 1.0 0.0 4.0 82 77 A 22 ARG HA A 12 GLU HA 1.0 0.0 2.7 83 78 A 35 LEU HA A 27 ASN H 1.0 0.0 4.0 84 79 A 14 LEU HA A 21 ALA H 1.0 0.0 3.5 85 80 A 39 LEU HA A 23 GLY HA2 1.0 0.0 3.2 86 81 A 14 LEU HD2% A 54 ASP HB3 1.0 0.0 5.8 87 82 A 37 LEU HA A 26 THR H 1.0 0.0 3.5 88 83 A 26 THR HA A 8 GLY H 1.0 3.2 8.2 89 84 A 28 PHE HD2 A 3 VAL HG2% 1.0 4.0 5.8 90 85 A 13 VAL H A 21 ALA H 1.0 0.0 3.5 91 86 A 24 VAL H A 38 ARG H 1.0 0.0 3.5 92 87 A 10 ASN HA A 25 ILE H 1.0 0.0 3.5 93 88 A 14 LEU HB3 A 54 ASP HB2 1.0 0.0 2.7 94 89 A 58 LEU HDy% A 12 GLU H 1.0 0.0 4.8 95 90 A 29 ASP H A 34 ILE H 1.0 0.0 3.5 96 91 A 57 ILE HA A 11 VAL HA 1.0 0.0 2.7 97 92 A 14 LEU H A 54 ASP H 1.0 0.0 3.5 98 93 A 37 LEU HD2% A 24 VAL H 1.0 0.0 5.8 99 94 A 28 PHE HD1 A 35 LEU HD2% 1.0 0.0 5.8 100 95 A 24 VAL HG2% A 10 ASN HD21 1.0 0.0 4.0 101 96 A 47 ILE H A 35 LEU H 1.0 0.0 3.5 102 97 A 10 ASN HA A 23 GLY H 1.0 0.0 4.0 103 98 A 56 ARG HDy A 12 GLU H 1.0 0.0 5.0 104 99 A 23 GLY HA2 A 39 LEU HD1% 1.0 0.0 4.8 105 100 A 28 PHE H A 7 TYR HD2 1.0 0.0 5.0 106 101 A 37 LEU HD2% A 26 THR H 1.0 0.0 5.8 107 102 A 23 GLY HA3 A 39 LEU HA 1.0 0.0 4.0 108 103 A 20 LYS HA A 14 LEU HD1% 1.0 0.0 4.8 109 104 A 44 THR HA A 38 ARG HGy 1.0 0.0 4.0 110 104 A 44 THR HA A 38 ARG HGx 1.0 0.0 4.0 111 105 A 3 VAL HB A 28 PHE HD2 1.0 3.2 5.0 112 106 A 25 ILE HD1% A 9 SER H 1.0 0.0 5.8 113 107 A 12 GLU HA A 23 GLY H 1.0 0.0 3.5 114 108 A 57 ILE HG2% A 12 GLU H 1.0 0.0 5.8 115 109 A 14 LEU HD2% A 20 LYS HE2 1.0 0.0 6.5 116 109 A 14 LEU HD2% A 20 LYS HE3 1.0 0.0 6.5 117 110 A 20 LYS HA A 15 LEU H 1.0 0.0 3.5 118 111 A 53 LYS HB2 A 16 ASN H 1.0 3.2 8.7 119 112 A 56 ARG HGy A 12 GLU H 1.0 0.0 3.2 120 113 A 10 ASN HA A 24 VAL HG2% 1.0 0.0 4.0 121 114 A 36 GLN HB2 A 26 THR H 1.0 0.0 4.0 122 115 A 8 GLY H A 25 ILE H 1.0 0.0 5.0 123 116 A 28 PHE HA A 34 ILE H 1.0 0.0 3.5 124 117 A 24 VAL HG1% A 8 GLY HA3 1.0 0.0 4.0 125 118 A 39 LEU HA A 24 VAL H 1.0 0.0 3.5 126 119 A 11 VAL HA A 23 GLY H 1.0 0.0 5.0 127 120 A 25 ILE HB A 9 SER H 1.0 0.0 3.2 128 121 A 53 LYS H A 16 ASN H 1.0 0.0 3.5 129 122 A 23 GLY HA3 A 39 LEU HD2% 1.0 0.0 4.8 130 123 A 10 ASN H A 58 LEU HB3 1.0 5.0 10.5 131 124 A 37 LEU HA A 26 THR HG2% 1.0 0.0 4.0 132 125 A 14 LEU HD2% A 54 ASP HB2 1.0 0.0 4.8 133 126 A 25 ILE HG2% A 7 TYR HE1 1.0 0.0 4.8 134 127 A 38 ARG HBx A 24 VAL H 1.0 0.0 4.8 135 127 A 24 VAL H A 38 ARG HBy 1.0 0.0 4.8 136 128 A 49 THR HG2% A 28 PHE HD1 1.0 0.0 4.8 137 129 A 24 VAL HG1% A 8 GLY HA2 1.0 0.0 3.5 138 130 A 34 ILE HB A 29 ASP H 1.0 0.0 4.0 139 131 A 35 LEU HD2% A 49 THR HB 1.0 0.0 5.8 140 132 A 15 LEU HA A 53 LYS H 1.0 0.0 2.7 141 133 A 25 ILE HG2% A 7 TYR HD1 1.0 0.0 3.5 142 134 A 22 ARG H A 39 LEU HD1% 1.0 0.0 4.8 143 135 A 37 LEU HD1% A 23 GLY H 1.0 0.0 5.8 144 136 A 35 LEU HD2% A 47 ILE H 1.0 0.0 5.8 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 260 LEU H B 256 ALA O 1.0 1.8 2.6 2 2 B 256 ALA O B 260 LEU N 1.0 2.6 3.5 3 3 B 261 LEU H B 257 SER O 1.0 1.8 2.6 4 4 B 257 SER O B 261 LEU N 1.0 2.6 3.5 5 5 B 262 SER H B 258 SER O 1.0 1.8 2.6 6 6 B 258 SER O B 262 SER N 1.0 2.6 3.5 7 7 B 263 LEU H B 259 GLN O 1.0 1.8 2.6 8 8 B 259 GLN O B 263 LEU N 1.0 2.6 3.5 9 9 B 264 LEU H B 260 LEU O 1.0 1.8 2.6 10 10 B 260 LEU O B 264 LEU N 1.0 2.6 3.5 11 11 B 265 LYS H B 261 LEU O 1.0 1.8 2.6 12 12 B 261 LEU O B 265 LYS N 1.0 2.6 3.5 13 13 B 266 SER H B 262 SER O 1.0 1.8 2.6 14 14 B 262 SER O B 266 SER N 1.0 2.6 3.5 15 15 A 25 ILE H A 9 SER O 1.0 1.9 2.6 16 16 A 58 LEU H A 10 ASN O 1.0 1.9 2.6 17 17 A 11 VAL H A 23 GLY O 1.0 1.9 2.6 18 18 A 23 GLY H A 11 VAL O 1.0 1.9 2.6 19 19 A 12 GLU H A 56 ARG O 1.0 1.9 2.6 20 20 A 56 ARG H A 12 GLU O 1.0 1.9 2.6 21 21 A 13 VAL H A 21 ALA O 1.0 1.9 2.6 22 22 A 21 ALA H A 13 VAL O 1.0 1.9 2.6 23 23 A 14 LEU H A 54 ASP O 1.0 1.9 2.6 24 24 A 54 ASP H A 14 LEU O 1.0 1.9 2.6 25 25 A 14 LEU O A 53 LYS H 1.0 1.9 2.6 26 26 A 15 LEU H A 19 SER O 1.0 1.9 2.6 27 27 A 18 ASP H A 15 LEU O 1.0 1.9 2.6 28 28 A 24 VAL H A 38 ARG O 1.0 1.9 2.6 29 29 A 38 ARG H A 24 VAL O 1.0 1.9 2.6 30 30 A 43 SER H A 39 LEU O 1.0 1.9 2.6 31 31 A 39 LEU H A 43 SER O 1.0 1.9 2.6 32 32 A 45 LYS H A 37 LEU O 1.0 1.9 2.6 33 33 A 37 LEU H A 45 LYS O 1.0 1.9 2.6 34 34 A 26 THR H A 36 GLN O 1.0 1.9 2.6 35 35 A 36 GLN H A 27 ASN O 1.0 1.9 2.6 36 36 A 47 ILE H A 35 LEU O 1.0 1.9 2.6 37 37 A 35 LEU H A 47 ILE O 1.0 1.9 2.6 38 38 A 29 ASP H A 34 ILE O 1.0 1.9 2.6 39 39 A 36 GLN O A 27 ASN H 1.0 1.9 2.6 40 40 A 34 ILE H A 29 ASP O 1.0 1.9 2.6 41 41 A 33 SER H A 30 SER O 1.0 1.9 2.6 42 42 A 39 LEU O A 42 ASP H 1.0 1.9 2.6 43 43 A 16 ASN H A 51 ASP O 1.0 1.9 2.6 44 44 A 9 SER H A 6 PHE O 1.0 1.9 2.6 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _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 B 253 ASP C B 254 ALA N B 254 ALA CA B 254 ALA C 1.0 -96.0 -56.0 PHI 2 2 B 254 ALA N B 254 ALA CA B 254 ALA C B 255 ASP N 1.0 -60.0 10.0 PSI 3 3 B 254 ALA C B 255 ASP N B 255 ASP CA B 255 ASP C 1.0 -82.0 -46.0 PHI 4 4 B 255 ASP N B 255 ASP CA B 255 ASP C B 256 ALA N 1.0 -46.0 -26.0 PSI 5 5 B 255 ASP C B 256 ALA N B 256 ALA CA B 256 ALA C 1.0 -76.0 -52.0 PHI 6 6 B 256 ALA N B 256 ALA CA B 256 ALA C B 257 SER N 1.0 -50.0 -18.0 PSI 7 7 B 256 ALA C B 257 SER N B 257 SER CA B 257 SER C 1.0 -72.0 -50.0 PHI 8 8 B 257 SER N B 257 SER CA B 257 SER C B 258 SER N 1.0 -55.0 -35.0 PSI 9 9 B 257 SER C B 258 SER N B 258 SER CA B 258 SER C 1.0 -75.0 -53.0 PHI 10 10 B 258 SER N B 258 SER CA B 258 SER C B 259 GLN N 1.0 -55.0 -29.0 PSI 11 11 B 259 GLN C B 260 LEU N B 260 LEU CA B 260 LEU C 1.0 -73.0 -53.0 PHI 12 12 B 260 LEU N B 260 LEU CA B 260 LEU C B 261 LEU N 1.0 -45.0 -31.0 PSI 13 13 B 260 LEU C B 261 LEU N B 261 LEU CA B 261 LEU C 1.0 -75.0 -53.0 PHI 14 14 B 261 LEU N B 261 LEU CA B 261 LEU C B 262 SER N 1.0 -56.0 -26.0 PSI 15 15 B 261 LEU C B 262 SER N B 262 SER CA B 262 SER C 1.0 -80.0 -54.0 PHI 16 16 B 262 SER N B 262 SER CA B 262 SER C B 263 LEU N 1.0 -57.0 -17.0 PSI 17 17 B 262 SER C B 263 LEU N B 263 LEU CA B 263 LEU C 1.0 -74.0 -52.0 PHI 18 18 B 263 LEU N B 263 LEU CA B 263 LEU C B 264 LEU N 1.0 -57.0 -27.0 PSI 19 19 B 263 LEU C B 264 LEU N B 264 LEU CA B 264 LEU C 1.0 -75.0 -51.0 PHI 20 20 B 264 LEU N B 264 LEU CA B 264 LEU C B 265 LYS N 1.0 -42.0 -24.0 PSI 21 21 B 264 LEU C B 265 LYS N B 265 LYS CA B 265 LYS C 1.0 -99.0 -57.0 PHI 22 22 B 265 LYS N B 265 LYS CA B 265 LYS C B 266 SER N 1.0 -45.0 5.0 PSI 23 23 A 1 MET C A 2 SER N A 2 SER CA A 2 SER C 1.0 -101.0 -71.0 PHI 24 24 A 2 SER N A 2 SER CA A 2 SER C A 3 VAL N 1.0 137.0 181.0 PSI 25 25 A 2 SER C A 3 VAL N A 3 VAL CA A 3 VAL C 1.0 -71.0 -47.0 PHI 26 26 A 3 VAL N A 3 VAL CA A 3 VAL C A 4 ALA N 1.0 -54.0 -28.0 PSI 27 27 A 3 VAL C A 4 ALA N A 4 ALA CA A 4 ALA C 1.0 -71.0 -51.0 PHI 28 28 A 4 ALA N A 4 ALA CA A 4 ALA C A 5 ASP N 1.0 -54.0 -26.0 PSI 29 29 A 4 ALA C A 5 ASP N A 5 ASP CA A 5 ASP C 1.0 -78.0 -44.0 PHI 30 30 A 5 ASP N A 5 ASP CA A 5 ASP C A 6 PHE N 1.0 -50.0 -24.0 PSI 31 31 A 5 ASP C A 6 PHE N A 6 PHE CA A 6 PHE C 1.0 -100.0 -66.0 PHI 32 32 A 6 PHE N A 6 PHE CA A 6 PHE C A 7 TYR N 1.0 -36.0 10.0 PSI 33 33 A 6 PHE C A 7 TYR N A 7 TYR CA A 7 TYR C 1.0 -98.0 -68.0 PHI 34 34 A 7 TYR N A 7 TYR CA A 7 TYR C A 8 GLY N 1.0 82.0 172.0 PSI 35 35 A 7 TYR C A 8 GLY N A 8 GLY CA A 8 GLY C 1.0 77.0 105.0 PHI 36 36 A 8 GLY N A 8 GLY CA A 8 GLY C A 9 SER N 1.0 -23.0 5.0 PSI 37 37 A 8 GLY C A 9 SER N A 9 SER CA A 9 SER C 1.0 -95.0 -65.0 PHI 38 38 A 9 SER N A 9 SER CA A 9 SER C A 10 ASN N 1.0 107.0 151.0 PSI 39 39 A 9 SER C A 10 ASN N A 10 ASN CA A 10 ASN C 1.0 -127.0 -81.0 PHI 40 40 A 10 ASN N A 10 ASN CA A 10 ASN C A 11 VAL N 1.0 113.0 147.0 PSI 41 41 A 10 ASN C A 11 VAL N A 11 VAL CA A 11 VAL C 1.0 -153.0 -117.0 PHI 42 42 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 GLU N 1.0 147.0 177.0 PSI 43 43 A 11 VAL C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -156.0 -110.0 PHI 44 44 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 VAL N 1.0 113.0 147.0 PSI 45 45 A 12 GLU C A 13 VAL N A 13 VAL CA A 13 VAL C 1.0 -145.0 -107.0 PHI 46 46 A 13 VAL N A 13 VAL CA A 13 VAL C A 14 LEU N 1.0 118.0 150.0 PSI 47 47 A 13 VAL C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -120.0 -96.0 PHI 48 48 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 LEU N 1.0 112.0 142.0 PSI 49 49 A 14 LEU C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -117.0 -67.0 PHI 50 50 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 ASN N 1.0 124.0 176.0 PSI 51 51 A 15 LEU C A 16 ASN N A 16 ASN CA A 16 ASN C 1.0 -69.0 -49.0 PHI 52 52 A 16 ASN N A 16 ASN CA A 16 ASN C A 17 ASN N 1.0 -41.0 -9.0 PSI 53 53 A 16 ASN C A 17 ASN N A 17 ASN CA A 17 ASN C 1.0 -113.0 -71.0 PHI 54 54 A 17 ASN N A 17 ASN CA A 17 ASN C A 18 ASP N 1.0 -13.0 27.0 PSI 55 55 A 17 ASN C A 18 ASP N A 18 ASP CA A 18 ASP C 1.0 49.0 73.0 PHI 56 56 A 18 ASP N A 18 ASP CA A 18 ASP C A 19 SER N 1.0 6.0 54.0 PSI 57 57 A 18 ASP C A 19 SER N A 19 SER CA A 19 SER C 1.0 -121.0 -63.0 PHI 58 58 A 19 SER N A 19 SER CA A 19 SER C A 20 LYS N 1.0 134.0 168.0 PSI 59 59 A 19 SER C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -150.0 -110.0 PHI 60 60 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 ALA N 1.0 135.2 166.0 PSI 61 61 A 20 LYS C A 21 ALA N A 21 ALA CA A 21 ALA C 1.0 -153.0 -121.0 PHI 62 62 A 21 ALA N A 21 ALA CA A 21 ALA C A 22 ARG N 1.0 116.0 162.0 PSI 63 63 A 21 ALA C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -144.0 -116.0 PHI 64 64 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 GLY N 1.0 130.0 168.0 PSI 65 65 A 22 ARG C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 -171.0 -109.0 PHI 66 66 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 VAL N 1.0 125.0 171.0 PSI 67 67 A 23 GLY C A 24 VAL N A 24 VAL CA A 24 VAL C 1.0 -137.0 -95.0 PHI 68 68 A 24 VAL N A 24 VAL CA A 24 VAL C A 25 ILE N 1.0 114.0 162.0 PSI 69 69 A 24 VAL C A 25 ILE N A 25 ILE CA A 25 ILE C 1.0 -88.0 -54.0 PHI 70 70 A 25 ILE N A 25 ILE CA A 25 ILE C A 26 THR N 1.0 115.0 147.0 PSI 71 71 A 25 ILE C A 26 THR N A 26 THR CA A 26 THR C 1.0 -121.0 -83.0 PHI 72 72 A 26 THR N A 26 THR CA A 26 THR C A 27 ASN N 1.0 -43.0 9.0 PSI 73 73 A 26 THR C A 27 ASN N A 27 ASN CA A 27 ASN C 1.0 -167.0 -135.0 PHI 74 74 A 27 ASN N A 27 ASN CA A 27 ASN C A 28 PHE N 1.0 128.0 174.0 PSI 75 75 A 27 ASN C A 28 PHE N A 28 PHE CA A 28 PHE C 1.0 -150.0 -104.0 PHI 76 76 A 28 PHE N A 28 PHE CA A 28 PHE C A 29 ASP N 1.0 120.0 146.0 PSI 77 77 A 28 PHE C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -136.0 -66.0 PHI 78 78 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 SER N 1.0 115.0 151.0 PSI 79 79 A 30 SER C A 31 SER N A 31 SER CA A 31 SER C 1.0 -86.0 -58.0 PHI 80 80 A 31 SER N A 31 SER CA A 31 SER C A 32 ASN N 1.0 -48.0 -10.0 PSI 81 81 A 31 SER C A 32 ASN N A 32 ASN CA A 32 ASN C 1.0 -107.0 -71.0 PHI 82 82 A 32 ASN N A 32 ASN CA A 32 ASN C A 33 SER N 1.0 -10.0 26.0 PSI 83 83 A 32 ASN C A 33 SER N A 33 SER CA A 33 SER C 1.0 43.0 65.0 PHI 84 84 A 33 SER N A 33 SER CA A 33 SER C A 34 ILE N 1.0 37.0 67.0 PSI 85 85 A 33 SER C A 34 ILE N A 34 ILE CA A 34 ILE C 1.0 -151.0 -111.0 PHI 86 86 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 LEU N 1.0 126.0 170.0 PSI 87 87 A 34 ILE C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -150.0 -116.0 PHI 88 88 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 GLN N 1.0 119.0 145.0 PSI 89 89 A 35 LEU C A 36 GLN N A 36 GLN CA A 36 GLN C 1.0 -141.0 -91.0 PHI 90 90 A 36 GLN N A 36 GLN CA A 36 GLN C A 37 LEU N 1.0 110.0 142.0 PSI 91 91 A 36 GLN C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -144.0 -118.0 PHI 92 92 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 ARG N 1.0 124.0 160.0 PSI 93 93 A 37 LEU C A 38 ARG N A 38 ARG CA A 38 ARG C 1.0 -121.0 -81.0 PHI 94 94 A 38 ARG N A 38 ARG CA A 38 ARG C A 39 LEU N 1.0 105.0 137.0 PSI 95 95 A 38 ARG C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -92.0 -54.0 PHI 96 96 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 ALA N 1.0 100.0 168.0 PSI 97 97 A 39 LEU C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -81.0 -53.0 PHI 98 98 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 ASN N 1.0 -45.0 -3.0 PSI 99 99 A 40 ALA C A 41 ASN N A 41 ASN CA A 41 ASN C 1.0 -110.0 -76.0 PHI 100 100 A 41 ASN N A 41 ASN CA A 41 ASN C A 42 ASP N 1.0 -5.0 29.0 PSI 101 101 A 41 ASN C A 42 ASP N A 42 ASP CA A 42 ASP C 1.0 49.0 73.0 PHI 102 102 A 42 ASP N A 42 ASP CA A 42 ASP C A 43 SER N 1.0 6.0 56.0 PSI 103 103 A 42 ASP C A 43 SER N A 43 SER CA A 43 SER C 1.0 -129.0 -51.0 PHI 104 104 A 43 SER N A 43 SER CA A 43 SER C A 44 THR N 1.0 138.0 168.0 PSI 105 105 A 43 SER C A 44 THR N A 44 THR CA A 44 THR C 1.0 -128.0 -96.0 PHI 106 106 A 44 THR N A 44 THR CA A 44 THR C A 45 LYS N 1.0 113.0 151.0 PSI 107 107 A 44 THR C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -153.7 -87.3 PHI 108 108 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 SER N 1.0 119.2 150.0 PSI 109 109 A 45 LYS C A 46 SER N A 46 SER CA A 46 SER C 1.0 -113.1 -77.9 PHI 110 110 A 46 SER N A 46 SER CA A 46 SER C A 47 ILE N 1.0 118.6 141.2 PSI 111 111 A 46 SER C A 47 ILE N A 47 ILE CA A 47 ILE C 1.0 -129.1 -98.5 PHI 112 112 A 47 ILE N A 47 ILE CA A 47 ILE C A 48 VAL N 1.0 111.5 148.1 PSI 113 113 A 47 ILE C A 48 VAL N A 48 VAL CA A 48 VAL C 1.0 -113.0 -55.0 PHI 114 114 A 48 VAL N A 48 VAL CA A 48 VAL C A 49 THR N 1.0 128.0 174.0 PSI 115 115 A 48 VAL C A 49 THR N A 49 THR CA A 49 THR C 1.0 -74.0 -50.0 PHI 116 116 A 49 THR N A 49 THR CA A 49 THR C A 50 LYS N 1.0 -49.0 -25.0 PSI 117 117 A 49 THR C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -79.0 -55.0 PHI 118 118 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 ASP N 1.0 -39.0 -9.0 PSI 119 119 A 50 LYS C A 51 ASP N A 51 ASP CA A 51 ASP C 1.0 -109.0 -67.0 PHI 120 120 A 51 ASP N A 51 ASP CA A 51 ASP C A 52 ILE N 1.0 -43.0 15.0 PSI 121 121 A 51 ASP C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -123.0 -59.0 PHI 122 122 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 LYS N 1.0 114.0 144.0 PSI 123 123 A 52 ILE C A 53 LYS N A 53 LYS CA A 53 LYS C 1.0 -110.0 -74.0 PHI 124 124 A 53 LYS N A 53 LYS CA A 53 LYS C A 54 ASP N 1.0 -53.0 -21.0 PSI 125 125 A 53 LYS C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -173.0 -135.0 PHI 126 126 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 LEU N 1.0 126.0 166.0 PSI 127 127 A 54 ASP C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -165.0 -133.0 PHI 128 128 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 ARG N 1.0 125.0 163.0 PSI 129 129 A 55 LEU C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -157.0 -113.0 PHI 130 130 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 ILE N 1.0 115.0 157.0 PSI 131 131 A 56 ARG C A 57 ILE N A 57 ILE CA A 57 ILE C 1.0 -119.0 -83.0 PHI 132 132 A 57 ILE N A 57 ILE CA A 57 ILE C A 58 LEU N 1.0 107.0 133.0 PSI 133 133 A 57 ILE C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -111.0 -69.0 PHI 134 134 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 PRO N 1.0 117.0 163.0 PSI stop_ save_ save_CNS/XPLOR_dihedral_9 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_9 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 B 253 ASP N B 253 ASP CA B 253 ASP CB B 253 ASP CG 1.0 -90.0 90.0 CHI1 2 2 B 260 LEU N B 260 LEU CA B 260 LEU CB B 260 LEU CG 1.0 -90.0 -30.0 CHI1 3 3 B 260 LEU CA B 260 LEU CB B 260 LEU CG B 260 LEU CD1 1.0 150.0 210.0 CHI2 4 4 B 261 LEU N B 261 LEU CA B 261 LEU CB B 261 LEU CG 1.0 150.0 210.0 CHI1 5 5 B 261 LEU CA B 261 LEU CB B 261 LEU CG B 261 LEU CD1 1.0 30.0 90.0 CHI2 6 6 B 263 LEU N B 263 LEU CA B 263 LEU CB B 263 LEU CG 1.0 -90.0 -30.0 CHI1 7 7 B 263 LEU CA B 263 LEU CB B 263 LEU CG B 263 LEU CD1 1.0 150.0 210.0 CHI2 8 8 B 264 LEU N B 264 LEU CA B 264 LEU CB B 264 LEU CG 1.0 -90.0 -30.0 CHI1 9 9 B 264 LEU CA B 264 LEU CB B 264 LEU CG B 264 LEU CD1 1.0 150.0 210.0 CHI2 10 10 A 2 SER N A 2 SER CA A 2 SER CB A 2 SER OG 1.0 -90.0 -30.0 CHI1 11 11 A 2 SER N A 2 SER CA A 2 SER CB A 2 SER OG 1.0 -90.0 -30.0 CHI1 12 12 A 3 VAL N A 3 VAL CA A 3 VAL CB A 3 VAL CG1 1.0 150.0 210.0 CHI1 13 13 A 5 ASP N A 5 ASP CA A 5 ASP CB A 5 ASP CG 1.0 -90.0 -30.0 CHI1 14 14 A 6 PHE N A 6 PHE CA A 6 PHE CB A 6 PHE CG 1.0 -90.0 -30.0 CHI1 15 15 A 11 VAL N A 11 VAL CA A 11 VAL CB A 11 VAL CG1 1.0 -90.0 -30.0 CHI1 16 16 A 12 GLU N A 12 GLU CA A 12 GLU CB A 12 GLU CG 1.0 150.0 210.0 CHI1 17 17 A 13 VAL N A 13 VAL CA A 13 VAL CB A 13 VAL CG1 1.0 150.0 210.0 CHI1 18 18 A 14 LEU N A 14 LEU CA A 14 LEU CB A 14 LEU CG 1.0 150.0 210.0 CHI1 19 19 A 14 LEU CA A 14 LEU CB A 14 LEU CG A 14 LEU CD1 1.0 30.0 90.0 CHI2 20 20 A 15 LEU N A 15 LEU CA A 15 LEU CB A 15 LEU CG 1.0 -90.0 -30.0 CHI1 21 21 A 15 LEU CA A 15 LEU CB A 15 LEU CG A 15 LEU CD1 1.0 150.0 210.0 CHI2 22 22 A 16 ASN N A 16 ASN CA A 16 ASN CB A 16 ASN CG 1.0 30.0 90.0 CHI1 23 23 A 17 ASN N A 17 ASN CA A 17 ASN CB A 17 ASN CG 1.0 30.0 90.0 CHI1 24 24 A 18 ASP N A 18 ASP CA A 18 ASP CB A 18 ASP CG 1.0 -90.0 90.0 CHI1 25 25 A 19 SER N A 19 SER CA A 19 SER CB A 19 SER OG 1.0 -90.0 -30.0 CHI1 26 26 A 22 ARG N A 22 ARG CA A 22 ARG CB A 22 ARG CG 1.0 60.0 60.0 CHI1 27 27 A 24 VAL N A 24 VAL CA A 24 VAL CB A 24 VAL CG1 1.0 150.0 210.0 CHI1 28 28 A 25 ILE N A 25 ILE CA A 25 ILE CB A 25 ILE CG1 1.0 -90.0 -30.0 CHI1 29 29 A 25 ILE CA A 25 ILE CB A 25 ILE CG1 A 25 ILE CD1 1.0 150.0 210.0 CHI2 30 30 A 26 THR N A 26 THR CA A 26 THR CB A 26 THR OG1 1.0 30.0 90.0 CHI1 31 31 A 27 ASN N A 27 ASN CA A 27 ASN CB A 27 ASN CG 1.0 150.0 210.0 CHI1 32 32 A 28 PHE N A 28 PHE CA A 28 PHE CB A 28 PHE CG 1.0 150.0 210.0 CHI1 33 33 A 29 ASP N A 29 ASP CA A 29 ASP CB A 29 ASP CG 1.0 150.0 210.0 CHI1 34 34 A 32 ASN N A 32 ASN CA A 32 ASN CB A 32 ASN CG 1.0 -90.0 -30.0 CHI1 35 35 A 33 SER N A 33 SER CA A 33 SER CB A 33 SER OG 1.0 -90.0 90.0 CHI1 36 36 A 34 ILE N A 34 ILE CA A 34 ILE CB A 34 ILE CG1 1.0 -90.0 -30.0 CHI1 37 37 A 34 ILE CA A 34 ILE CB A 34 ILE CG1 A 34 ILE CD1 1.0 -90.0 -30.0 CHI2 38 38 A 35 LEU N A 35 LEU CA A 35 LEU CB A 35 LEU CG 1.0 150.0 210.0 CHI1 39 39 A 35 LEU CA A 35 LEU CB A 35 LEU CG A 35 LEU CD1 1.0 30.0 90.0 CHI2 40 40 A 36 GLN N A 36 GLN CA A 36 GLN CB A 36 GLN CG 1.0 -90.0 -30.0 CHI1 41 41 A 37 LEU N A 37 LEU CA A 37 LEU CB A 37 LEU CG 1.0 -90.0 -30.0 CHI1 42 42 A 37 LEU CA A 37 LEU CB A 37 LEU CG A 37 LEU CD1 1.0 150.0 210.0 CHI2 43 43 A 39 LEU N A 39 LEU CA A 39 LEU CB A 39 LEU CG 1.0 150.0 210.0 CHI1 44 44 A 39 LEU CA A 39 LEU CB A 39 LEU CG A 39 LEU CD1 1.0 30.0 90.0 CHI2 45 45 A 43 SER N A 43 SER CA A 43 SER CB A 43 SER OG 1.0 -90.0 -30.0 CHI1 46 46 A 44 THR N A 44 THR CA A 44 THR CB A 44 THR OG1 1.0 150.0 210.0 CHI1 47 47 A 46 SER N A 46 SER CA A 46 SER CB A 46 SER OG 1.0 30.0 90.0 CHI1 48 48 A 47 ILE N A 47 ILE CA A 47 ILE CB A 47 ILE CG1 1.0 -90.0 -30.0 CHI1 49 49 A 47 ILE CA A 47 ILE CB A 47 ILE CG1 A 47 ILE CD1 1.0 150.0 210.0 CHI2 50 50 A 48 VAL N A 48 VAL CA A 48 VAL CB A 48 VAL CG1 1.0 150.0 210.0 CHI1 51 51 A 49 THR N A 49 THR CA A 49 THR CB A 49 THR OG1 1.0 30.0 90.0 CHI1 52 52 A 51 ASP N A 51 ASP CA A 51 ASP CB A 51 ASP CG 1.0 30.0 90.0 CHI1 53 53 A 52 ILE N A 52 ILE CA A 52 ILE CB A 52 ILE CG1 1.0 -90.0 -30.0 CHI1 54 54 A 52 ILE CA A 52 ILE CB A 52 ILE CG1 A 52 ILE CD1 1.0 150.0 210.0 CHI2 55 55 A 53 LYS N A 53 LYS CA A 53 LYS CB A 53 LYS CG 1.0 150.0 210.0 CHI1 56 56 A 54 ASP N A 54 ASP CA A 54 ASP CB A 54 ASP CG 1.0 -90.0 -30.0 CHI1 57 57 A 55 LEU N A 55 LEU CA A 55 LEU CB A 55 LEU CG 1.0 -90.0 -30.0 CHI1 58 58 A 56 ARG N A 56 ARG CA A 56 ARG CB A 56 ARG CG 1.0 30.0 90.0 CHI1 59 59 A 57 ILE N A 57 ILE CA A 57 ILE CB A 57 ILE CG1 1.0 -90.0 -30.0 CHI1 60 60 A 57 ILE CA A 57 ILE CB A 57 ILE CG1 A 57 ILE CD1 1.0 150.0 210.0 CHI2 61 61 A 58 LEU N A 58 LEU CA A 58 LEU CB A 58 LEU CG 1.0 -90.0 -30.0 CHI1 62 62 A 58 LEU CA A 58 LEU CB A 58 LEU CG A 58 LEU CD1 1.0 150.0 210.0 CHI2 stop_ save_