data_nef_c19906_2mnu 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 PDB 2MNU 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 3 GLY start . false 2 A 4 SER middle . . 3 A 5 GLU middle . . 4 A 6 VAL middle . . 5 A 7 PRO middle . false 6 A 8 GLN middle . . 7 A 9 LEU middle . . 8 A 10 THR middle . . 9 A 11 ASP middle . . 10 A 12 LEU middle . . 11 A 13 SER middle . . 12 A 14 PHE middle . . 13 A 15 VAL middle . . 14 A 16 ASP middle . . 15 A 17 ILE middle . . 16 A 18 THR middle . . 17 A 19 ASP middle . . 18 A 20 SER middle . . 19 A 21 SER middle . . 20 A 22 ILE middle . . 21 A 23 GLY middle . false 22 A 24 LEU middle . . 23 A 25 ARG middle . . 24 A 26 TRP middle . . 25 A 27 THR middle . . 26 A 28 PRO middle . false 27 A 29 LEU middle . . 28 A 30 ASN middle . . 29 A 31 SER middle . . 30 A 32 SER middle . . 31 A 33 THR middle . . 32 A 34 ILE middle . . 33 A 35 ILE middle . . 34 A 36 GLY middle . false 35 A 37 TYR middle . . 36 A 38 ARG middle . . 37 A 39 ILE middle . . 38 A 40 THR middle . . 39 A 41 VAL middle . . 40 A 42 VAL middle . . 41 A 43 ALA middle . . 42 A 44 ALA middle . . 43 A 45 GLY middle . false 44 A 46 GLU middle . . 45 A 47 GLY middle . false 46 A 48 ILE middle . . 47 A 49 PRO middle . false 48 A 50 ILE middle . . 49 A 51 PHE middle . . 50 A 52 GLU middle . . 51 A 53 ASP middle . . 52 A 54 PHE middle . . 53 A 55 VAL middle . . 54 A 56 ASP middle . . 55 A 57 SER middle . . 56 A 58 SER middle . . 57 A 59 VAL middle . . 58 A 60 GLY middle . false 59 A 61 TYR middle . . 60 A 62 TYR middle . . 61 A 63 THR middle . . 62 A 64 VAL middle . . 63 A 65 THR middle . . 64 A 66 GLY middle . false 65 A 67 LEU middle . . 66 A 68 GLU middle . . 67 A 69 PRO middle . false 68 A 70 GLY middle . false 69 A 71 ILE middle . . 70 A 72 ASP middle . . 71 A 73 TYR middle . . 72 A 74 ASP middle . . 73 A 75 ILE middle . . 74 A 76 SER middle . . 75 A 77 VAL middle . . 76 A 78 ILE middle . . 77 A 79 THR middle . . 78 A 80 LEU middle . . 79 A 81 ILE middle . . 80 A 82 ASN middle . . 81 A 83 GLY middle . false 82 A 84 GLY middle . false 83 A 85 GLU middle . . 84 A 86 SER middle . . 85 A 87 ALA middle . . 86 A 88 PRO middle . false 87 A 89 THR middle . . 88 A 90 THR middle . . 89 A 91 LEU middle . . 90 A 92 THR middle . . 91 A 93 GLN middle . . 92 A 94 GLN middle . . 93 A 95 THR end . . 94 B 201 SER start . . 95 B 202 SER middle . . 96 B 203 SER middle . . 97 B 204 PRO middle . false 98 B 205 ILE middle . . 99 B 206 GLN middle . . 100 B 207 GLY middle . false 101 B 208 SER middle . . 102 B 209 TRP middle . . 103 B 210 THR middle . . 104 B 211 TRP middle . . 105 B 212 GLU middle . . 106 B 213 ASN middle . . 107 B 214 GLY middle . false 108 B 215 LYS middle . . 109 B 216 TRP middle . . 110 B 217 THR middle . . 111 B 218 TRP middle . . 112 B 219 LYS middle . . 113 B 220 GLY middle . false 114 B 221 ILE middle . . 115 B 222 ILE middle . . 116 B 223 ARG middle . . 117 B 224 LEU middle . . 118 B 225 GLU middle . . 119 B 226 GLN 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 4 SER HA H 1 4.40 . A 4 SER HB2 H 1 3.78 . A 4 SER HB3 H 1 3.83 . A 4 SER CA C 13 58.29 . A 4 SER CB C 13 63.79 . A 5 GLU H H 1 8.45 . A 5 GLU HA H 1 4.41 . A 5 GLU HB2 H 1 1.92 . A 5 GLU HB3 H 1 2.00 . A 5 GLU HG2 H 1 2.44 . A 5 GLU HG3 H 1 2.49 . A 5 GLU CA C 13 55.61 . A 5 GLU CB C 13 31.95 . A 5 GLU N N 15 121.96 . A 6 VAL H H 1 8.26 . A 6 VAL HA H 1 4.07 . A 6 VAL HB H 1 2.09 . A 6 VAL HG1% H 1 1.86 . A 6 VAL HG2% H 1 1.79 . A 6 VAL CA C 13 56.38 . A 6 VAL CB C 13 29.50 . A 6 VAL N N 15 122.17 . A 9 LEU H H 1 7.77 . A 9 LEU HA H 1 4.49 . A 9 LEU CA C 13 54.82 . A 9 LEU CB C 13 41.93 . A 9 LEU CG C 13 25.70 . A 9 LEU CD1 C 13 23.40 . A 9 LEU N N 15 123.83 . A 11 ASP HA H 1 4.73 . A 11 ASP HB2 H 1 2.61 . A 11 ASP HB3 H 1 2.57 . A 11 ASP CA C 13 53.06 . A 11 ASP CB C 13 38.11 . A 12 LEU H H 1 7.42 . A 12 LEU HA H 1 4.66 . A 12 LEU HB2 H 1 0.97 . A 12 LEU HB3 H 1 1.13 . A 12 LEU HG H 1 0.52 . A 12 LEU HD1% H 1 0.09 . A 12 LEU HD2% H 1 -0.29 . A 12 LEU CA C 13 55.13 . A 12 LEU CB C 13 43.39 . A 12 LEU N N 15 122.73 . A 13 SER H H 1 9.02 . A 13 SER HA H 1 4.27 . A 13 SER HB2 H 1 3.81 . A 13 SER HB3 H 1 3.72 . A 13 SER CA C 13 56.88 . A 13 SER CB C 13 65.89 . A 13 SER N N 15 120.76 . A 14 PHE H H 1 8.37 . A 14 PHE HA H 1 5.51 . A 14 PHE HB3 H 1 2.78 . A 14 PHE HDx H 1 6.98 . A 14 PHE HEx H 1 6.28 . A 14 PHE CA C 13 56.76 . A 14 PHE CB C 13 39.93 . A 14 PHE N N 15 119.92 . A 15 VAL H H 1 9.10 . A 15 VAL HA H 1 4.68 . A 15 VAL HB H 1 2.15 . A 15 VAL HG1% H 1 0.74 . A 15 VAL HG2% H 1 0.68 . A 15 VAL CA C 13 58.88 . A 15 VAL CB C 13 36.90 . A 15 VAL N N 15 117.82 . A 16 ASP H H 1 8.52 . A 16 ASP HA H 1 4.19 . A 16 ASP HB2 H 1 2.60 . A 16 ASP HB3 H 1 2.67 . A 16 ASP CA C 13 54.55 . A 16 ASP CB C 13 38.92 . A 16 ASP N N 15 116.85 . A 17 ILE H H 1 8.15 . A 17 ILE HA H 1 4.15 . A 17 ILE HB H 1 1.85 . A 17 ILE HG13 H 1 1.57 . A 17 ILE HG2% H 1 1.02 . A 17 ILE HD1% H 1 0.86 . A 17 ILE CA C 13 63.19 . A 17 ILE CB C 13 37.77 . A 17 ILE CG1 C 13 28.71 . A 17 ILE CG2 C 13 18.23 . A 17 ILE CD1 C 13 13.15 . A 17 ILE N N 15 118.60 . A 18 THR H H 1 8.74 . A 18 THR HA H 1 4.91 . A 18 THR HB H 1 4.60 . A 18 THR HG2% H 1 1.14 . A 18 THR CA C 13 60.57 . A 18 THR CB C 13 70.60 . A 18 THR N N 15 122.16 . A 19 ASP H H 1 8.45 . A 19 ASP HA H 1 4.48 . A 19 ASP HB3 H 1 2.76 . A 19 ASP CA C 13 54.88 . A 19 ASP CB C 13 40.43 . A 19 ASP N N 15 115.60 . A 20 SER H H 1 8.12 . A 20 SER HA H 1 4.62 . A 20 SER HB2 H 1 3.59 . A 20 SER HB3 H 1 4.10 . A 20 SER CA C 13 57.66 . A 20 SER CB C 13 66.09 . A 20 SER N N 15 108.50 . A 21 SER H H 1 7.53 . A 21 SER HA H 1 5.23 . A 21 SER HB2 H 1 3.72 . A 21 SER HB3 H 1 3.81 . A 21 SER CA C 13 56.73 . A 21 SER CB C 13 66.73 . A 21 SER N N 15 116.59 . A 22 ILE H H 1 8.21 . A 22 ILE HA H 1 4.49 . A 22 ILE HB H 1 1.58 . A 22 ILE HG13 H 1 1.01 . A 22 ILE HG2% H 1 0.81 . A 22 ILE HD1% H 1 0.62 . A 22 ILE CA C 13 60.32 . A 22 ILE CB C 13 42.65 . A 22 ILE CG1 C 13 27.76 . A 22 ILE CG2 C 13 17.68 . A 22 ILE CD1 C 13 15.10 . A 22 ILE N N 15 113.85 . A 23 GLY H H 1 8.30 . A 23 GLY HA3 H 1 3.88 . A 23 GLY CA C 13 44.11 . A 23 GLY N N 15 112.95 . A 24 LEU H H 1 8.82 . A 24 LEU HA H 1 4.82 . A 24 LEU HB3 H 1 1.58 . A 24 LEU CA C 13 53.93 . A 24 LEU CB C 13 42.47 . A 24 LEU N N 15 123.74 . A 25 ARG H H 1 8.57 . A 25 ARG HA H 1 4.89 . A 25 ARG HB3 H 1 1.55 . A 25 ARG HG2 H 1 1.42 . A 25 ARG HG3 H 1 1.70 . A 25 ARG HD2 H 1 3.02 . A 25 ARG HD3 H 1 3.14 . A 25 ARG HH2x H 1 6.60 . A 25 ARG HH2y H 1 6.60 . A 25 ARG CA C 13 54.04 . A 25 ARG CB C 13 33.85 . A 25 ARG CG C 13 26.73 . A 25 ARG CD C 13 43.33 . A 25 ARG N N 15 119.98 . A 26 TRP H H 1 7.96 . A 26 TRP HA H 1 4.84 . A 26 TRP HB2 H 1 2.93 . A 26 TRP HB3 H 1 2.97 . A 26 TRP HD1 H 1 6.93 . A 26 TRP CA C 13 56.79 . A 26 TRP CB C 13 31.46 . A 26 TRP CD1 C 13 118.36 . A 26 TRP N N 15 122.48 . A 27 THR H H 1 9.78 . A 27 THR HA H 1 4.75 . A 27 THR HB H 1 4.30 . A 27 THR HG2% H 1 1.22 . A 27 THR CA C 13 60.69 . A 27 THR CB C 13 68.46 . A 27 THR N N 15 119.82 . A 28 PRO HA H 1 4.47 . A 28 PRO HB2 H 1 1.91 . A 28 PRO HB3 H 1 2.28 . A 28 PRO HG3 H 1 1.99 . A 28 PRO HD2 H 1 3.60 . A 28 PRO HD3 H 1 3.76 . A 28 PRO CA C 13 63.26 . A 28 PRO CB C 13 31.98 . A 28 PRO CG C 13 27.43 . A 28 PRO CD C 13 50.56 . A 29 LEU H H 1 8.57 . A 29 LEU HA H 1 4.49 . A 29 LEU HB2 H 1 1.53 . A 29 LEU HB3 H 1 1.74 . A 29 LEU HD1% H 1 0.92 . A 29 LEU HD2% H 1 0.91 . A 29 LEU CA C 13 54.15 . A 29 LEU CB C 13 43.04 . A 29 LEU CD1 C 13 25.86 . A 29 LEU CD2 C 13 23.21 . A 29 LEU N N 15 124.22 . A 30 ASN H H 1 8.63 . A 30 ASN HA H 1 4.70 . A 30 ASN HB2 H 1 2.77 . A 30 ASN HB3 H 1 2.86 . A 30 ASN CA C 13 53.57 . A 30 ASN CB C 13 38.34 . A 30 ASN N N 15 119.95 . A 31 SER H H 1 8.09 . A 31 SER HA H 1 4.56 . A 31 SER HB2 H 1 3.82 . A 31 SER HB3 H 1 3.95 . A 31 SER CA C 13 57.50 . A 31 SER CB C 13 63.48 . A 31 SER N N 15 114.29 . A 32 SER HA H 1 4.56 . A 32 SER HB2 H 1 3.88 . A 32 SER HB3 H 1 4.01 . A 32 SER CA C 13 58.14 . A 32 SER CB C 13 63.73 . A 33 THR H H 1 8.00 . A 33 THR HA H 1 4.30 . A 33 THR HB H 1 4.21 . A 33 THR HG2% H 1 1.23 . A 33 THR CA C 13 63.62 . A 33 THR CB C 13 69.53 . A 33 THR N N 15 114.16 . A 34 ILE H H 1 7.98 . A 34 ILE HA H 1 4.30 . A 34 ILE HB H 1 1.90 . A 34 ILE HG1x H 1 1.19 . A 34 ILE HG1y H 1 1.19 . A 34 ILE HG2% H 1 1.00 . A 34 ILE HD1% H 1 0.94 . A 34 ILE CA C 13 61.92 . A 34 ILE CB C 13 38.08 . A 34 ILE N N 15 121.09 . A 35 ILE H H 1 8.81 . A 35 ILE HA H 1 4.22 . A 35 ILE HB H 1 1.71 . A 35 ILE HG1x H 1 1.54 . A 35 ILE HG1y H 1 1.54 . A 35 ILE HG2% H 1 0.62 . A 35 ILE HD1% H 1 0.79 . A 35 ILE CA C 13 61.72 . A 35 ILE CB C 13 38.79 . A 35 ILE CG1 C 13 27.71 . A 35 ILE CG2 C 13 17.00 . A 35 ILE CD1 C 13 13.45 . A 35 ILE N N 15 126.23 . A 36 GLY HA2 H 1 3.85 . A 36 GLY HA3 H 1 4.00 . A 36 GLY CA C 13 45.52 . A 37 TYR H H 1 7.34 . A 37 TYR HA H 1 5.07 . A 37 TYR HB2 H 1 2.63 . A 37 TYR HB3 H 1 2.81 . A 37 TYR CA C 13 57.93 . A 37 TYR CB C 13 38.95 . A 37 TYR N N 15 120.40 . A 38 ARG HA H 1 5.15 . A 38 ARG HB2 H 1 1.48 . A 38 ARG HB3 H 1 1.73 . A 38 ARG CA C 13 54.45 . A 38 ARG CB C 13 31.53 . A 39 ILE H H 1 9.04 . A 39 ILE HA H 1 5.06 . A 39 ILE HB H 1 1.45 . A 39 ILE HG13 H 1 1.22 . A 39 ILE HG2% H 1 0.76 . A 39 ILE HD1% H 1 0.27 . A 39 ILE CA C 13 60.03 . A 39 ILE CB C 13 40.78 . A 39 ILE CG1 C 13 27.77 . A 39 ILE CG2 C 13 17.08 . A 39 ILE CD1 C 13 14.20 . A 39 ILE N N 15 129.57 . A 40 THR H H 1 8.88 . A 40 THR HA H 1 5.21 . A 40 THR HB H 1 3.98 . A 40 THR HG2% H 1 1.20 . A 40 THR CA C 13 61.13 . A 40 THR CB C 13 71.09 . A 40 THR CG2 C 13 21.41 . A 40 THR N N 15 120.43 . A 41 VAL H H 1 8.82 . A 41 VAL HA H 1 5.03 . A 41 VAL HB H 1 1.93 . A 41 VAL HG1% H 1 0.84 . A 41 VAL HG2% H 1 0.70 . A 41 VAL CA C 13 61.28 . A 41 VAL CB C 13 33.80 . A 41 VAL CG1 C 13 21.52 . A 42 VAL H H 1 9.10 . A 42 VAL HA H 1 4.65 . A 42 VAL HB H 1 2.01 . A 42 VAL HG1% H 1 0.91 . A 42 VAL CA C 13 60.32 . A 42 VAL CB C 13 35.80 . A 42 VAL CG1 C 13 20.70 . A 42 VAL N N 15 127.67 . A 43 ALA H H 1 9.42 . A 43 ALA HA H 1 4.41 . A 43 ALA HB% H 1 1.31 . A 43 ALA CA C 13 52.42 . A 43 ALA CB C 13 18.75 . A 43 ALA N N 15 131.34 . A 44 ALA H H 1 8.26 . A 44 ALA HA H 1 4.12 . A 44 ALA HB% H 1 1.32 . A 44 ALA CA C 13 53.79 . A 44 ALA CB C 13 18.68 . A 44 ALA N N 15 126.04 . A 45 GLY H H 1 8.70 . A 45 GLY HA2 H 1 3.70 . A 45 GLY HA3 H 1 4.12 . A 45 GLY CA C 13 45.62 . A 46 GLU H H 1 8.11 . A 46 GLU HA H 1 4.47 . A 46 GLU HB3 H 1 2.17 . A 46 GLU HG3 H 1 2.27 . A 46 GLU CA C 13 55.87 . A 46 GLU CB C 13 30.52 . A 46 GLU CG C 13 36.50 . A 46 GLU N N 15 119.65 . A 47 GLY H H 1 8.40 . A 47 GLY HAx H 1 4.12 . A 47 GLY HAy H 1 4.12 . A 47 GLY CA C 13 45.91 . A 47 GLY N N 15 107.16 . A 48 ILE H H 1 7.44 . A 48 ILE HA H 1 4.62 . A 48 ILE HB H 1 1.85 . A 48 ILE HG13 H 1 1.15 . A 48 ILE HG2% H 1 0.99 . A 48 ILE HD1% H 1 0.87 . A 48 ILE CA C 13 58.50 . A 48 ILE CB C 13 39.40 . A 48 ILE CG1 C 13 27.22 . A 48 ILE CG2 C 13 16.89 . A 48 ILE CD1 C 13 12.72 . A 48 ILE N N 15 120.01 . A 49 PRO HA H 1 4.53 . A 49 PRO HB2 H 1 1.85 . A 49 PRO HB3 H 1 2.30 . A 49 PRO HG2 H 1 1.88 . A 49 PRO HG3 H 1 2.12 . A 49 PRO HD2 H 1 3.72 . A 49 PRO HD3 H 1 4.04 . A 49 PRO CA C 13 63.59 . A 49 PRO CB C 13 31.88 . A 49 PRO CG C 13 27.45 . A 49 PRO CD C 13 51.51 . A 50 ILE H H 1 8.72 . A 50 ILE HA H 1 4.15 . A 50 ILE HB H 1 1.84 . A 50 ILE HG12 H 1 1.15 . A 50 ILE HG13 H 1 1.56 . A 50 ILE HG2% H 1 1.08 . A 50 ILE HD1% H 1 1.01 . A 50 ILE CA C 13 63.31 . A 50 ILE CB C 13 38.02 . A 50 ILE CG1 C 13 28.81 . A 50 ILE CG2 C 13 22.23 . A 50 ILE CD1 C 13 18.45 . A 50 ILE N N 15 122.12 . A 51 PHE HA H 1 4.77 . A 51 PHE HBx H 1 3.08 . A 51 PHE HBy H 1 3.08 . A 51 PHE HEx H 1 7.18 . A 51 PHE HEy H 1 7.18 . A 51 PHE CA C 13 57.90 . A 51 PHE CB C 13 41.87 . A 51 PHE CEy C 13 131.65 . A 52 GLU HA H 1 5.35 . A 52 GLU HB2 H 1 2.01 . A 52 GLU HB3 H 1 2.17 . A 52 GLU HG3 H 1 1.90 . A 52 GLU CA C 13 55.14 . A 52 GLU CB C 13 32.03 . A 52 GLU CG C 13 36.44 . A 53 ASP H H 1 8.85 . A 53 ASP HA H 1 5.00 . A 53 ASP HB2 H 1 2.51 . A 53 ASP HB3 H 1 2.57 . A 53 ASP CA C 13 52.95 . A 53 ASP CB C 13 44.77 . A 53 ASP N N 15 122.75 . A 54 PHE H H 1 8.77 . A 54 PHE HA H 1 5.38 . A 54 PHE HB2 H 1 2.85 . A 54 PHE HB3 H 1 2.99 . A 54 PHE HDx H 1 7.04 . A 54 PHE CA C 13 56.18 . A 54 PHE CB C 13 42.11 . A 54 PHE N N 15 121.10 . A 55 VAL H H 1 8.29 . A 55 VAL HA H 1 4.32 . A 55 VAL HB H 1 1.66 . A 55 VAL HG1% H 1 1.08 . A 55 VAL HG2% H 1 0.81 . A 55 VAL CA C 13 59.14 . A 55 VAL CB C 13 34.94 . A 55 VAL CG1 C 13 20.79 . A 55 VAL N N 15 125.76 . A 56 ASP H H 1 8.46 . A 56 ASP HA H 1 4.56 . A 56 ASP HB2 H 1 2.85 . A 56 ASP HB3 H 1 2.93 . A 56 ASP CA C 13 54.98 . A 56 ASP CB C 13 42.73 . A 56 ASP N N 15 127.10 . A 57 SER H H 1 8.26 . A 57 SER HA H 1 4.33 . A 57 SER HB3 H 1 4.10 . A 57 SER CA C 13 60.63 . A 57 SER CB C 13 62.68 . A 57 SER N N 15 119.63 . A 58 SER H H 1 9.08 . A 58 SER HA H 1 4.40 . A 58 SER HB3 H 1 4.05 . A 58 SER CA C 13 60.43 . A 58 SER CB C 13 63.70 . A 58 SER N N 15 117.03 . A 59 VAL H H 1 7.57 . A 59 VAL HA H 1 3.79 . A 59 VAL HB H 1 2.27 . A 59 VAL HG1% H 1 1.31 . A 59 VAL HG2% H 1 1.14 . A 59 VAL CA C 13 65.67 . A 59 VAL CB C 13 32.40 . A 59 VAL CG1 C 13 22.60 . A 59 VAL CG2 C 13 21.98 . A 59 VAL N N 15 119.35 . A 60 GLY H H 1 6.12 . A 60 GLY HA2 H 1 1.46 . A 60 GLY HA3 H 1 3.39 . A 60 GLY CA C 13 44.43 . A 60 GLY N N 15 104.07 . A 61 TYR H H 1 6.08 . A 61 TYR HA H 1 5.03 . A 61 TYR HB2 H 1 2.43 . A 61 TYR HB3 H 1 2.75 . A 61 TYR HDx H 1 6.76 . A 61 TYR HEx H 1 6.37 . A 61 TYR CA C 13 56.32 . A 61 TYR CB C 13 41.70 . A 61 TYR CDx C 13 133.19 . A 61 TYR N N 15 117.69 . A 62 TYR H H 1 8.44 . A 62 TYR HA H 1 4.44 . A 62 TYR HB2 H 1 2.62 . A 62 TYR HB3 H 1 3.23 . A 62 TYR HDx H 1 6.95 . A 62 TYR HEx H 1 6.76 . A 62 TYR CA C 13 58.56 . A 62 TYR CB C 13 43.55 . A 62 TYR CDx C 13 132.75 . A 62 TYR N N 15 126.65 . A 63 THR H H 1 7.38 . A 63 THR HA H 1 4.78 . A 63 THR HB H 1 3.62 . A 63 THR HG2% H 1 0.96 . A 63 THR CA C 13 61.61 . A 63 THR CB C 13 69.81 . A 63 THR CG2 C 13 21.37 . A 63 THR N N 15 122.16 . A 64 VAL H H 1 8.86 . A 64 VAL HA H 1 3.66 . A 64 VAL HB H 1 1.94 . A 64 VAL HG1% H 1 0.78 . A 64 VAL HG2% H 1 0.51 . A 64 VAL CA C 13 61.84 . A 64 VAL CB C 13 31.84 . A 64 VAL CG1 C 13 20.79 . A 64 VAL CG2 C 13 21.31 . A 64 VAL N N 15 127.94 . A 65 THR H H 1 7.29 . A 65 THR HA H 1 4.64 . A 65 THR HB H 1 4.21 . A 65 THR HG2% H 1 1.01 . A 65 THR CA C 13 59.47 . A 65 THR CB C 13 71.16 . A 65 THR CG2 C 13 21.51 . A 65 THR N N 15 116.15 . A 66 GLY H H 1 8.45 . A 66 GLY HA2 H 1 3.75 . A 66 GLY HA3 H 1 4.00 . A 66 GLY CA C 13 45.86 . A 66 GLY N N 15 105.56 . A 67 LEU H H 1 7.85 . A 67 LEU HA H 1 4.18 . A 67 LEU HB3 H 1 1.09 . A 67 LEU HG H 1 0.99 . A 67 LEU HD1% H 1 0.30 . A 67 LEU HD2% H 1 -0.19 . A 67 LEU CA C 13 53.38 . A 67 LEU CB C 13 41.63 . A 67 LEU CG C 13 26.49 . A 67 LEU CD2 C 13 19.98 . A 67 LEU N N 15 119.08 . A 68 GLU H H 1 8.50 . A 68 GLU HA H 1 4.92 . A 68 GLU HB2 H 1 1.97 . A 68 GLU HB3 H 1 2.07 . A 68 GLU HG3 H 1 2.25 . A 68 GLU CA C 13 52.51 . A 68 GLU CB C 13 31.04 . A 68 GLU CG C 13 35.95 . A 68 GLU N N 15 120.03 . A 69 PRO HA H 1 4.47 . A 69 PRO HB2 H 1 1.85 . A 69 PRO HB3 H 1 2.14 . A 69 PRO HG3 H 1 2.05 . A 69 PRO HD2 H 1 3.60 . A 69 PRO HD3 H 1 3.75 . A 69 PRO CA C 13 62.74 . A 69 PRO CB C 13 31.41 . A 69 PRO CG C 13 27.34 . A 69 PRO CD C 13 50.70 . A 70 GLY H H 1 8.50 . A 70 GLY HA2 H 1 3.63 . A 70 GLY HA3 H 1 4.06 . A 70 GLY CA C 13 45.83 . A 70 GLY N N 15 106.94 . A 71 ILE H H 1 7.51 . A 71 ILE HA H 1 4.08 . A 71 ILE HB H 1 1.54 . A 71 ILE HG13 H 1 1.21 . A 71 ILE HG2% H 1 0.22 . A 71 ILE HD1% H 1 0.69 . A 71 ILE CA C 13 58.71 . A 71 ILE CB C 13 40.41 . A 71 ILE CG1 C 13 27.18 . A 71 ILE CG2 C 13 16.11 . A 71 ILE CD1 C 13 11.78 . A 71 ILE N N 15 120.08 . A 72 ASP H H 1 8.19 . A 72 ASP HA H 1 4.93 . A 72 ASP HB2 H 1 2.33 . A 72 ASP HB3 H 1 2.46 . A 72 ASP CA C 13 54.26 . A 72 ASP CB C 13 41.12 . A 72 ASP N N 15 124.92 . A 73 TYR H H 1 9.31 . A 73 TYR HA H 1 5.07 . A 73 TYR HB2 H 1 2.66 . A 73 TYR HB3 H 1 2.81 . A 73 TYR HDx H 1 6.86 . A 73 TYR CA C 13 57.39 . A 73 TYR CB C 13 40.55 . A 73 TYR CDx C 13 133.16 . A 73 TYR N N 15 122.44 . A 74 ASP H H 1 9.29 . A 74 ASP HA H 1 5.22 . A 74 ASP HB2 H 1 2.56 . A 74 ASP HB3 H 1 2.71 . A 74 ASP CA C 13 53.90 . A 74 ASP CB C 13 42.12 . A 74 ASP N N 15 122.98 . A 75 ILE H H 1 8.81 . A 75 ILE HA H 1 5.47 . A 75 ILE HB H 1 1.73 . A 75 ILE HG13 H 1 1.72 . A 75 ILE HG2% H 1 0.94 . A 75 ILE HD1% H 1 0.71 . A 75 ILE CA C 13 58.40 . A 75 ILE CB C 13 40.90 . A 75 ILE CG1 C 13 28.91 . A 75 ILE CG2 C 13 15.72 . A 75 ILE CD1 C 13 13.78 . A 75 ILE N N 15 124.27 . A 76 SER H H 1 8.76 . A 76 SER HA H 1 5.80 . A 76 SER HB2 H 1 3.65 . A 76 SER HB3 H 1 3.77 . A 76 SER CA C 13 56.34 . A 76 SER CB C 13 66.18 . A 76 SER N N 15 121.30 . A 77 VAL H H 1 9.42 . A 77 VAL HA H 1 4.76 . A 77 VAL HB H 1 2.00 . A 77 VAL HG1% H 1 0.48 . A 77 VAL CA C 13 61.19 . A 77 VAL CB C 13 33.27 . A 77 VAL CG1 C 13 20.72 . A 77 VAL N N 15 124.74 . A 78 ILE H H 1 9.37 . A 78 ILE HA H 1 4.71 . A 78 ILE HB H 1 1.89 . A 78 ILE HG12 H 1 1.23 . A 78 ILE HG13 H 1 1.64 . A 78 ILE HG2% H 1 0.95 . A 78 ILE HD1% H 1 0.89 . A 78 ILE CA C 13 61.16 . A 78 ILE CB C 13 41.05 . A 78 ILE CG1 C 13 27.84 . A 78 ILE CG2 C 13 17.82 . A 78 ILE CD1 C 13 14.10 . A 78 ILE N N 15 126.30 . A 79 THR H H 1 8.55 . A 79 THR HA H 1 4.28 . A 79 THR HB H 1 4.20 . A 79 THR HG2% H 1 1.19 . A 79 THR CA C 13 64.26 . A 79 THR CB C 13 69.13 . A 79 THR CG2 C 13 21.77 . A 79 THR N N 15 122.35 . A 80 LEU H H 1 8.66 . A 80 LEU HA H 1 4.73 . A 80 LEU HB2 H 1 1.39 . A 80 LEU HB3 H 1 1.55 . A 80 LEU HG H 1 0.31 . A 80 LEU HD1% H 1 -0.18 . A 80 LEU CA C 13 54.06 . A 80 LEU CB C 13 41.47 . A 80 LEU CG C 13 25.47 . A 80 LEU CD1 C 13 20.11 . A 80 LEU N N 15 128.90 . A 81 ILE H H 1 8.35 . A 81 ILE HA H 1 4.87 . A 81 ILE HB H 1 1.93 . A 81 ILE HG12 H 1 1.25 . A 81 ILE HG13 H 1 1.48 . A 81 ILE HG2% H 1 0.97 . A 81 ILE HD1% H 1 0.95 . A 81 ILE CA C 13 59.30 . A 81 ILE CB C 13 40.51 . A 81 ILE CG1 C 13 27.07 . A 81 ILE CG2 C 13 17.47 . A 81 ILE CD1 C 13 13.31 . A 81 ILE N N 15 121.64 . A 82 ASN H H 1 8.82 . A 82 ASN HA H 1 4.64 . A 82 ASN HB2 H 1 2.73 . A 82 ASN HB3 H 1 2.91 . A 82 ASN CA C 13 53.45 . A 82 ASN CB C 13 38.94 . A 82 ASN N N 15 123.24 . A 83 GLY H H 1 8.63 . A 83 GLY HA3 H 1 4.00 . A 83 GLY CA C 13 45.42 . A 83 GLY N N 15 112.68 . A 84 GLY H H 1 8.28 . A 84 GLY HA3 H 1 3.98 . A 84 GLY CA C 13 45.19 . A 84 GLY N N 15 108.56 . A 85 GLU H H 1 8.46 . A 85 GLU HA H 1 4.32 . A 85 GLU HB2 H 1 1.97 . A 85 GLU HB3 H 1 2.07 . A 85 GLU CA C 13 56.48 . A 85 GLU CB C 13 30.48 . A 85 GLU N N 15 120.69 . A 86 SER H H 1 8.35 . A 86 SER HA H 1 4.43 . A 86 SER HB3 H 1 3.83 . A 86 SER CA C 13 57.92 . A 86 SER CB C 13 63.72 . A 86 SER N N 15 116.86 . A 87 ALA H H 1 8.24 . A 87 ALA HA H 1 4.58 . A 87 ALA HB% H 1 1.34 . A 87 ALA CA C 13 50.45 . A 87 ALA CB C 13 18.11 . A 87 ALA N N 15 126.89 . A 88 PRO HA H 1 4.47 . A 88 PRO HB2 H 1 1.90 . A 88 PRO HB3 H 1 2.27 . A 88 PRO CA C 13 62.96 . A 88 PRO CB C 13 31.46 . A 89 THR H H 1 8.27 . A 89 THR HA H 1 4.34 . A 89 THR HB H 1 4.21 . A 89 THR HG2% H 1 1.20 . A 89 THR CA C 13 62.32 . A 89 THR CB C 13 69.53 . A 89 THR CG2 C 13 21.77 . A 89 THR N N 15 114.28 . A 90 THR H H 1 8.09 . A 90 THR HA H 1 4.33 . A 90 THR HB H 1 4.20 . A 90 THR CA C 13 61.89 . A 90 THR CB C 13 69.50 . A 90 THR CG2 C 13 21.77 . A 90 THR N N 15 116.29 . A 91 LEU H H 1 8.29 . A 91 LEU HA H 1 4.41 . A 91 LEU HBx H 1 1.62 . A 91 LEU HBy H 1 1.62 . A 91 LEU HG H 1 1.62 . A 91 LEU HD1% H 1 0.91 . A 91 LEU HD2% H 1 0.86 . A 91 LEU CA C 13 55.59 . A 91 LEU CB C 13 41.60 . A 91 LEU CG C 13 27.57 . A 91 LEU CD1 C 13 24.92 . A 91 LEU CD2 C 13 23.48 . A 91 LEU N N 15 124.66 . A 92 THR H H 1 8.10 . A 92 THR HA H 1 4.30 . A 92 THR HB H 1 4.18 . A 92 THR HG2% H 1 1.20 . A 92 THR CA C 13 61.89 . A 92 THR CB C 13 69.50 . A 92 THR CG2 C 13 21.77 . A 92 THR N N 15 115.03 . A 93 GLN H H 1 8.38 . A 93 GLN HA H 1 4.35 . A 93 GLN HB2 H 1 1.98 . A 93 GLN HB3 H 1 2.10 . A 93 GLN HG3 H 1 2.36 . A 93 GLN CA C 13 55.72 . A 93 GLN CB C 13 29.05 . A 93 GLN CG C 13 33.86 . A 93 GLN N N 15 123.20 . A 94 GLN H H 1 8.48 . A 94 GLN HA H 1 4.40 . A 94 GLN HB2 H 1 1.99 . A 94 GLN HB3 H 1 2.14 . A 94 GLN CA C 13 55.78 . A 94 GLN CB C 13 29.10 . A 94 GLN N N 15 122.72 . A 95 THR H H 1 7.88 . A 95 THR HA H 1 4.41 . A 95 THR CA C 13 63.17 . A 95 THR CB C 13 70.40 . A 95 THR N N 15 121.21 . B 201 SER HA H 1 4.58 . B 201 SER HB3 H 1 3.91 . B 201 SER CA C 13 58.43 . B 201 SER CB C 13 64.12 . B 202 SER H H 1 8.52 . B 202 SER HA H 1 4.56 . B 202 SER HB2 H 1 3.89 . B 202 SER HB3 H 1 3.93 . B 202 SER CA C 13 58.30 . B 202 SER CB C 13 63.89 . B 202 SER N N 15 118.00 . B 203 SER H H 1 8.35 . B 203 SER HA H 1 4.86 . B 203 SER HB3 H 1 3.90 . B 203 SER CA C 13 56.09 . B 203 SER CB C 13 63.92 . B 203 SER N N 15 118.16 . B 204 PRO HA H 1 4.63 . B 204 PRO HB2 H 1 1.92 . B 204 PRO HB3 H 1 2.41 . B 204 PRO HG2 H 1 1.96 . B 204 PRO HG3 H 1 2.11 . B 204 PRO HD3 H 1 3.86 . B 204 PRO CA C 13 63.95 . B 204 PRO CB C 13 32.66 . B 204 PRO CG C 13 27.29 . B 204 PRO CD C 13 51.01 . B 205 ILE H H 1 7.64 . B 205 ILE HA H 1 4.71 . B 205 ILE HB H 1 1.50 . B 205 ILE HG12 H 1 0.80 . B 205 ILE HG13 H 1 1.27 . B 205 ILE HG2% H 1 0.46 . B 205 ILE HD1% H 1 0.47 . B 205 ILE CA C 13 59.75 . B 205 ILE CB C 13 39.74 . B 205 ILE CG1 C 13 27.91 . B 205 ILE CG2 C 13 16.88 . B 205 ILE CD1 C 13 13.92 . B 205 ILE N N 15 117.53 . B 206 GLN H H 1 8.27 . B 206 GLN HA H 1 4.79 . B 206 GLN HB2 H 1 1.95 . B 206 GLN HB3 H 1 2.15 . B 206 GLN HG3 H 1 2.37 . B 206 GLN HE21 H 1 6.94 . B 206 GLN HE22 H 1 7.58 . B 206 GLN CA C 13 54.63 . B 206 GLN CB C 13 31.75 . B 206 GLN CG C 13 33.66 . B 206 GLN N N 15 125.25 . B 207 GLY H H 1 8.13 . B 207 GLY HA2 H 1 3.13 . B 207 GLY HA3 H 1 3.79 . B 207 GLY CA C 13 46.28 . B 207 GLY N N 15 111.33 . B 208 SER H H 1 6.99 . B 208 SER HA H 1 4.55 . B 208 SER HB2 H 1 3.76 . B 208 SER HB3 H 1 3.82 . B 208 SER CA C 13 57.29 . B 208 SER CB C 13 65.83 . B 208 SER N N 15 109.86 . B 209 TRP H H 1 8.65 . B 209 TRP HA H 1 5.08 . B 209 TRP HB2 H 1 3.17 . B 209 TRP HB3 H 1 3.21 . B 209 TRP HD1 H 1 7.53 . B 209 TRP HE1 H 1 10.48 . B 209 TRP HE3 H 1 7.12 . B 209 TRP HZ2 H 1 7.09 . B 209 TRP HH2 H 1 6.80 . B 209 TRP CA C 13 58.02 . B 209 TRP CB C 13 31.00 . B 209 TRP CD1 C 13 127.47 . B 209 TRP CZ2 C 13 115.20 . B 209 TRP CH2 C 13 122.87 . B 209 TRP N N 15 122.32 . B 209 TRP NE1 N 15 130.01 . B 210 THR H H 1 9.84 . B 210 THR HA H 1 4.91 . B 210 THR HB H 1 4.15 . B 210 THR HG2% H 1 1.17 . B 210 THR CA C 13 61.13 . B 210 THR CB C 13 71.67 . B 210 THR CG2 C 13 19.90 . B 210 THR N N 15 118.41 . B 211 TRP H H 1 8.62 . B 211 TRP HA H 1 4.71 . B 211 TRP HB2 H 1 1.79 . B 211 TRP HB3 H 1 2.86 . B 211 TRP HE1 H 1 9.84 . B 211 TRP HE3 H 1 6.67 . B 211 TRP HZ2 H 1 7.21 . B 211 TRP HZ3 H 1 6.50 . B 211 TRP HH2 H 1 6.96 . B 211 TRP CA C 13 55.85 . B 211 TRP CB C 13 28.72 . B 211 TRP CD1 C 13 127.81 . B 211 TRP CE3 C 13 119.61 . B 211 TRP CZ2 C 13 113.24 . B 211 TRP CZ3 C 13 121.09 . B 211 TRP CH2 C 13 122.81 . B 211 TRP N N 15 128.47 . B 211 TRP NE1 N 15 127.55 . B 212 GLU H H 1 8.22 . B 212 GLU HA H 1 4.37 . B 212 GLU HB2 H 1 1.78 . B 212 GLU HB3 H 1 1.89 . B 212 GLU HG2 H 1 2.03 . B 212 GLU HG3 H 1 2.09 . B 212 GLU CA C 13 55.45 . B 212 GLU CB C 13 32.59 . B 212 GLU CG C 13 36.24 . B 212 GLU N N 15 126.98 . B 213 ASN H H 1 9.22 . B 213 ASN HA H 1 4.18 . B 213 ASN HB2 H 1 2.60 . B 213 ASN HB3 H 1 2.91 . B 213 ASN HD21 H 1 6.88 . B 213 ASN HD22 H 1 7.59 . B 213 ASN CA C 13 53.90 . B 213 ASN CB C 13 37.48 . B 213 ASN N N 15 124.48 . B 213 ASN ND2 N 15 113.41 . B 214 GLY H H 1 7.67 . B 214 GLY HA2 H 1 3.07 . B 214 GLY HA3 H 1 3.75 . B 214 GLY CA C 13 45.96 . B 214 GLY N N 15 101.87 . B 215 LYS H H 1 6.82 . B 215 LYS HA H 1 4.47 . B 215 LYS HB2 H 1 1.66 . B 215 LYS HB3 H 1 1.86 . B 215 LYS HG2 H 1 1.30 . B 215 LYS HG3 H 1 1.36 . B 215 LYS HD2 H 1 1.59 . B 215 LYS HD3 H 1 1.71 . B 215 LYS HE2 H 1 2.97 . B 215 LYS HE3 H 1 3.01 . B 215 LYS CA C 13 54.81 . B 215 LYS CB C 13 35.92 . B 215 LYS CG C 13 24.01 . B 215 LYS CD C 13 29.15 . B 215 LYS CE C 13 42.49 . B 215 LYS N N 15 117.09 . B 216 TRP H H 1 9.27 . B 216 TRP HA H 1 5.35 . B 216 TRP HB2 H 1 3.12 . B 216 TRP HB3 H 1 3.48 . B 216 TRP HD1 H 1 7.53 . B 216 TRP HE1 H 1 10.48 . B 216 TRP HE3 H 1 7.30 . B 216 TRP HZ2 H 1 7.08 . B 216 TRP HZ3 H 1 6.80 . B 216 TRP HH2 H 1 7.00 . B 216 TRP CA C 13 58.37 . B 216 TRP CB C 13 30.31 . B 216 TRP N N 15 125.33 . B 217 THR H H 1 10.01 . B 217 THR HA H 1 5.60 . B 217 THR HB H 1 4.02 . B 217 THR HG2% H 1 1.11 . B 217 THR CA C 13 61.70 . B 217 THR CB C 13 72.51 . B 217 THR CG2 C 13 20.98 . B 217 THR N N 15 125.74 . B 218 TRP H H 1 9.67 . B 218 TRP HA H 1 4.30 . B 218 TRP HB3 H 1 2.34 . B 218 TRP HD1 H 1 7.56 . B 218 TRP HE1 H 1 9.44 . B 218 TRP HZ2 H 1 6.91 . B 218 TRP CA C 13 57.92 . B 218 TRP CB C 13 28.17 . B 218 TRP CD1 C 13 127.47 . B 218 TRP CZ2 C 13 113.24 . B 218 TRP N N 15 135.30 . B 219 LYS H H 1 7.55 . B 219 LYS HA H 1 5.24 . B 219 LYS HB2 H 1 1.42 . B 219 LYS HB3 H 1 1.63 . B 219 LYS HG2 H 1 1.24 . B 219 LYS HG3 H 1 1.32 . B 219 LYS HD2 H 1 1.53 . B 219 LYS HD3 H 1 1.62 . B 219 LYS HE3 H 1 2.86 . B 219 LYS CA C 13 54.36 . B 219 LYS CB C 13 35.32 . B 219 LYS CG C 13 24.72 . B 219 LYS CD C 13 29.04 . B 219 LYS CE C 13 41.59 . B 219 LYS N N 15 126.23 . B 220 GLY H H 1 8.50 . B 220 GLY HA2 H 1 3.74 . B 220 GLY HA3 H 1 4.29 . B 220 GLY CA C 13 45.92 . B 220 GLY N N 15 111.11 . B 221 ILE H H 1 8.49 . B 221 ILE HA H 1 5.46 . B 221 ILE HB H 1 1.66 . B 221 ILE HG12 H 1 1.13 . B 221 ILE HG13 H 1 1.45 . B 221 ILE HG2% H 1 0.76 . B 221 ILE HD1% H 1 0.78 . B 221 ILE CA C 13 59.07 . B 221 ILE CB C 13 41.43 . B 221 ILE CG1 C 13 27.44 . B 221 ILE CG2 C 13 17.35 . B 221 ILE CD1 C 13 13.07 . B 221 ILE N N 15 120.66 . B 222 ILE H H 1 9.21 . B 222 ILE HA H 1 5.51 . B 222 ILE HB H 1 1.66 . B 222 ILE HG12 H 1 1.13 . B 222 ILE HG13 H 1 1.45 . B 222 ILE HG2% H 1 0.80 . B 222 ILE HD1% H 1 0.56 . B 222 ILE CA C 13 59.25 . B 222 ILE CB C 13 41.72 . B 222 ILE CG1 C 13 27.22 . B 222 ILE CG2 C 13 17.25 . B 222 ILE CD1 C 13 14.50 . B 222 ILE N N 15 125.74 . B 223 ARG H H 1 8.30 . B 223 ARG HA H 1 4.74 . B 223 ARG HB2 H 1 1.64 . B 223 ARG HB3 H 1 1.96 . B 223 ARG HG3 H 1 1.31 . B 223 ARG HD2 H 1 3.09 . B 223 ARG HD3 H 1 3.11 . B 223 ARG CA C 13 55.72 . B 223 ARG CB C 13 32.36 . B 223 ARG CG C 13 27.43 . B 223 ARG CD C 13 43.47 . B 223 ARG N N 15 126.29 . B 224 LEU H H 1 9.98 . B 224 LEU HA H 1 4.51 . B 224 LEU HB3 H 1 1.58 . B 224 LEU HG H 1 0.57 . B 224 LEU HD1% H 1 0.72 . B 224 LEU CA C 13 54.49 . B 224 LEU CB C 13 41.31 . B 224 LEU CG C 13 25.95 . B 224 LEU CD1 C 13 22.23 . B 224 LEU N N 15 127.92 . B 225 GLU H H 1 8.62 . B 225 GLU HA H 1 4.52 . B 225 GLU HB2 H 1 1.83 . B 225 GLU HB3 H 1 2.08 . B 225 GLU HG2 H 1 2.23 . B 225 GLU HG3 H 1 2.28 . B 225 GLU CA C 13 55.54 . B 225 GLU CB C 13 32.20 . B 225 GLU CG C 13 36.09 . B 225 GLU N N 15 121.37 . B 226 GLN H H 1 8.22 . B 226 GLN HA H 1 4.12 . B 226 GLN HB2 H 1 1.93 . B 226 GLN HB3 H 1 2.03 . B 226 GLN HG3 H 1 2.32 . B 226 GLN HE21 H 1 6.84 . B 226 GLN HE22 H 1 7.66 . B 226 GLN CA C 13 57.79 . B 226 GLN CB C 13 30.60 . B 226 GLN CG C 13 34.73 . B 226 GLN N N 15 125.88 . B 226 GLN NE2 N 15 112.23 . 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 4 SER HA A 4 SER HB2 1.0 1.8 3.11 2 1 A 4 SER HA A 4 SER HB3 1.0 1.8 3.11 3 2 A 4 SER HA A 5 GLU HB2 1.0 1.8 5.12 4 2 A 4 SER HA A 5 GLU HB3 1.0 1.8 5.12 5 3 A 4 SER HA A 5 GLU HG2 1.0 1.8 5.84 6 3 A 4 SER HA A 5 GLU HG3 1.0 1.8 5.84 7 4 A 4 SER HB2 A 5 GLU HB2 1.0 1.8 5.68 8 4 A 4 SER HB3 A 5 GLU HB2 1.0 1.8 5.68 9 4 A 5 GLU HB3 A 4 SER HB2 1.0 1.8 5.68 10 4 A 4 SER HB3 A 5 GLU HB3 1.0 1.8 5.68 11 5 A 5 GLU HA A 6 VAL HA 1.0 1.8 4.93 12 6 A 5 GLU HA A 6 VAL H 1.0 1.8 3.25 13 7 A 6 VAL H A 5 GLU HB2 1.0 1.8 4.90 14 7 A 5 GLU HB3 A 6 VAL H 1.0 1.8 4.90 15 8 A 6 VAL HA A 6 VAL HG1% 1.0 1.8 3.29 16 8 A 6 VAL HA A 6 VAL HG2% 1.0 1.8 3.29 17 9 A 6 VAL H A 6 VAL HB 1.0 1.8 4.36 18 10 A 6 VAL H A 6 VAL HG1% 1.0 1.8 3.20 19 10 A 6 VAL H A 6 VAL HG2% 1.0 1.8 3.20 20 11 A 9 LEU HA A 29 LEU HB3 1.0 1.8 5.31 21 12 A 11 ASP HA A 12 LEU H 1.0 1.8 3.96 22 13 A 12 LEU H A 11 ASP HB3 1.0 1.8 4.38 23 13 A 12 LEU H A 11 ASP HB2 1.0 1.8 4.38 24 14 A 12 LEU H A 11 ASP HB3 1.0 1.8 4.97 25 15 A 12 LEU H A 11 ASP HB2 1.0 1.8 4.97 26 16 A 12 LEU HA A 12 LEU HD2% 1.0 1.8 3.94 27 16 A 12 LEU HA A 12 LEU HD1% 1.0 1.8 3.94 28 17 A 12 LEU HA A 12 LEU HD1% 1.0 1.8 4.65 29 18 A 12 LEU HA A 12 LEU HD2% 1.0 1.8 4.65 30 19 A 12 LEU HA A 12 LEU HG 1.0 1.8 4.46 31 20 A 12 LEU HA A 13 SER HB3 1.0 1.8 5.84 32 20 A 12 LEU HA A 13 SER HB2 1.0 1.8 5.84 33 21 A 12 LEU HA A 13 SER H 1.0 1.8 3.52 34 22 A 12 LEU HA A 26 TRP HB2 1.0 1.8 3.69 35 23 A 13 SER H A 12 LEU HD2% 1.0 1.8 4.39 36 23 A 12 LEU HD1% A 13 SER H 1.0 1.8 4.39 37 24 A 25 ARG H A 12 LEU HD2% 1.0 1.8 5.05 38 24 A 12 LEU HD1% A 25 ARG H 1.0 1.8 5.05 39 25 A 77 VAL HB A 12 LEU HD2% 1.0 1.8 5.94 40 25 A 12 LEU HD1% A 77 VAL HB 1.0 1.8 5.94 41 26 A 12 LEU HD1% A 77 VAL HG21 1.0 1.8 3.85 42 26 A 12 LEU HD2% A 77 VAL HG21 1.0 1.8 3.85 43 26 A 77 VAL HG1% A 12 LEU HD2% 1.0 1.8 3.85 44 26 A 12 LEU HD1% A 77 VAL HG1% 1.0 1.8 3.85 45 27 A 12 LEU HD1% A 26 TRP HB3 1.0 1.8 3.74 46 28 A 12 LEU HD1% A 26 TRP HB2 1.0 1.8 3.62 47 29 A 12 LEU H A 12 LEU HB3 1.0 1.8 3.05 48 29 A 12 LEU H A 12 LEU HB2 1.0 1.8 3.05 49 30 A 12 LEU H A 12 LEU HB3 1.0 1.8 3.47 50 31 A 12 LEU H A 12 LEU HB2 1.0 1.8 3.47 51 32 A 12 LEU H A 12 LEU HD2% 1.0 1.8 4.55 52 32 A 12 LEU H A 12 LEU HD1% 1.0 1.8 4.55 53 33 A 12 LEU H A 12 LEU HD1% 1.0 1.8 5.32 54 34 A 12 LEU H A 12 LEU HD2% 1.0 1.8 5.32 55 35 A 12 LEU H A 12 LEU HG 1.0 1.8 5.28 56 36 A 12 LEU H A 13 SER H 1.0 1.8 5.40 57 37 A 13 SER HA A 25 ARG HB3 1.0 1.8 6.00 58 37 A 13 SER HA A 25 ARG HBx 1.0 1.8 6.00 59 38 A 14 PHE HA A 13 SER HB3 1.0 1.8 5.84 60 38 A 13 SER HB2 A 14 PHE HA 1.0 1.8 5.84 61 39 A 13 SER HB3 A 14 PHE HB3 1.0 1.8 5.61 62 39 A 13 SER HB2 A 14 PHE HB3 1.0 1.8 5.61 63 39 A 14 PHE HBx A 13 SER HB3 1.0 1.8 5.61 64 39 A 13 SER HB2 A 14 PHE HBx 1.0 1.8 5.61 65 40 A 14 PHE H A 13 SER HB3 1.0 1.8 3.73 66 40 A 13 SER HB2 A 14 PHE H 1.0 1.8 3.73 67 41 A 13 SER HB3 A 25 ARG HB3 1.0 1.8 5.38 68 41 A 13 SER HB2 A 25 ARG HB3 1.0 1.8 5.38 69 41 A 25 ARG HBx A 13 SER HB3 1.0 1.8 5.38 70 41 A 13 SER HB2 A 25 ARG HBx 1.0 1.8 5.38 71 42 A 13 SER HB2 A 14 PHE HD% 1.0 1.8 4.00 72 43 A 13 SER H A 13 SER HB3 1.0 1.8 4.11 73 43 A 13 SER HB2 A 13 SER H 1.0 1.8 4.11 74 44 A 13 SER H A 25 ARG H 1.0 1.8 4.42 75 45 A 14 PHE HA A 14 PHE HD% 1.0 1.8 4.29 76 46 A 14 PHE HA A 15 VAL HA 1.0 1.8 6.00 77 47 A 14 PHE HA A 15 VAL HG2% 1.0 1.8 4.20 78 47 A 14 PHE HA A 15 VAL HG1% 1.0 1.8 4.20 79 48 A 14 PHE HA A 15 VAL H 1.0 1.8 3.05 80 49 A 14 PHE HA A 22 ILE HD1% 1.0 1.8 5.88 81 50 A 14 PHE HA A 25 ARG HB3 1.0 1.8 4.75 82 50 A 25 ARG HBx A 14 PHE HA 1.0 1.8 4.75 83 51 A 25 ARG H A 14 PHE HA 1.0 1.8 4.45 84 52 A 15 VAL H A 14 PHE HB3 1.0 1.8 3.79 85 52 A 14 PHE HBx A 15 VAL H 1.0 1.8 3.79 86 53 A 22 ILE HG2% A 14 PHE HB3 1.0 1.8 5.38 87 53 A 14 PHE HBx A 22 ILE HG2% 1.0 1.8 5.38 88 54 A 14 PHE HD% A 15 VAL H 1.0 1.8 4.41 89 55 A 14 PHE HD% A 22 ILE HD1% 1.0 1.8 4.02 90 56 A 14 PHE HD% A 22 ILE HG13 1.0 1.8 5.43 91 56 A 14 PHE HD% A 22 ILE HG1x 1.0 1.8 5.43 92 57 A 14 PHE HD% A 22 ILE HG2% 1.0 1.8 4.86 93 58 A 14 PHE H A 14 PHE HB3 1.0 1.8 3.69 94 58 A 14 PHE HBx A 14 PHE H 1.0 1.8 3.69 95 59 A 14 PHE H A 14 PHE HD% 1.0 1.8 3.95 96 60 A 14 PHE H A 15 VAL HG2% 1.0 1.8 5.94 97 60 A 14 PHE H A 15 VAL HG1% 1.0 1.8 5.94 98 61 A 15 VAL HA A 15 VAL HG2% 1.0 1.8 3.08 99 61 A 15 VAL HA A 15 VAL HG1% 1.0 1.8 3.08 100 62 A 15 VAL HA A 16 ASP HA 1.0 1.8 4.39 101 63 A 15 VAL HA A 16 ASP HA 1.0 1.8 5.27 102 64 A 15 VAL HA A 16 ASP HB3 1.0 1.8 5.47 103 64 A 15 VAL HA A 16 ASP HB2 1.0 1.8 5.47 104 65 A 15 VAL HA A 16 ASP H 1.0 1.8 3.18 105 66 A 15 VAL HA A 17 ILE H 1.0 1.8 4.28 106 67 A 16 ASP HA A 15 VAL HB 1.0 1.8 4.63 107 68 A 15 VAL HB A 16 ASP HB3 1.0 1.8 5.29 108 68 A 16 ASP HB2 A 15 VAL HB 1.0 1.8 5.29 109 69 A 16 ASP HB2 A 15 VAL HB 1.0 1.8 4.09 110 70 A 16 ASP H A 15 VAL HB 1.0 1.8 3.09 111 71 A 17 ILE H A 15 VAL HB 1.0 1.8 5.53 112 72 A 15 VAL HG1% A 16 ASP HB3 1.0 1.8 3.87 113 72 A 15 VAL HG2% A 16 ASP HB3 1.0 1.8 3.87 114 72 A 16 ASP HB2 A 15 VAL HG2% 1.0 1.8 3.87 115 72 A 15 VAL HG1% A 16 ASP HB2 1.0 1.8 3.87 116 73 A 24 LEU HA A 15 VAL HG2% 1.0 1.8 5.44 117 73 A 15 VAL HG1% A 24 LEU HA 1.0 1.8 5.44 118 74 A 16 ASP HB2 A 15 VAL HG2% 1.0 1.8 4.83 119 75 A 15 VAL H A 15 VAL HG2% 1.0 1.8 3.10 120 75 A 15 VAL HG1% A 15 VAL H 1.0 1.8 3.10 121 76 A 15 VAL H A 16 ASP H 1.0 1.8 5.19 122 77 A 15 VAL H A 22 ILE HA 1.0 1.8 6.00 123 78 A 15 VAL H A 22 ILE HB 1.0 1.8 5.63 124 79 A 15 VAL H A 22 ILE HD1% 1.0 1.8 6.00 125 80 A 15 VAL H A 23 GLY H 1.0 1.8 4.28 126 81 A 15 VAL H A 24 LEU H 1.0 1.8 5.56 127 82 A 15 VAL H A 25 ARG HB3 1.0 1.8 5.91 128 82 A 25 ARG HBx A 15 VAL H 1.0 1.8 5.91 129 83 A 16 ASP HA A 17 ILE H 1.0 1.8 3.65 130 84 A 17 ILE H A 16 ASP HB3 1.0 1.8 4.71 131 84 A 16 ASP HB2 A 17 ILE H 1.0 1.8 4.71 132 85 A 22 ILE HA A 16 ASP HB3 1.0 1.8 4.97 133 85 A 16 ASP HB2 A 22 ILE HA 1.0 1.8 4.97 134 86 A 22 ILE HB A 16 ASP HB3 1.0 1.8 5.84 135 86 A 16 ASP HB2 A 22 ILE HB 1.0 1.8 5.84 136 87 A 23 GLY H A 16 ASP HB3 1.0 1.8 4.37 137 87 A 16 ASP HB2 A 23 GLY H 1.0 1.8 4.37 138 88 A 16 ASP HA A 16 ASP H 1.0 1.8 3.09 139 89 A 16 ASP H A 16 ASP HB3 1.0 1.8 4.04 140 89 A 16 ASP HB2 A 16 ASP H 1.0 1.8 4.04 141 90 A 16 ASP H A 17 ILE HB 1.0 1.8 5.68 142 91 A 16 ASP H A 17 ILE H 1.0 1.8 3.56 143 92 A 17 ILE HA A 17 ILE HD1% 1.0 1.8 3.77 144 93 A 17 ILE HA A 17 ILE HG13 1.0 1.8 3.51 145 93 A 17 ILE HA A 17 ILE HG1x 1.0 1.8 3.51 146 94 A 17 ILE HA A 18 THR H 1.0 1.8 3.02 147 95 A 17 ILE HA A 21 SER H 1.0 1.8 6.00 148 96 A 22 ILE HA A 17 ILE HA 1.0 1.8 3.15 149 97 A 22 ILE HB A 17 ILE HA 1.0 1.8 3.91 150 98 A 22 ILE HD1% A 17 ILE HA 1.0 1.8 5.50 151 99 A 22 ILE HG2% A 17 ILE HA 1.0 1.8 3.22 152 100 A 23 GLY H A 17 ILE HA 1.0 1.8 4.37 153 101 A 17 ILE HB A 17 ILE HD1% 1.0 1.8 2.90 154 102 A 22 ILE HA A 17 ILE HB 1.0 1.8 5.13 155 103 A 22 ILE HD1% A 17 ILE HD1% 1.0 1.8 5.54 156 104 A 18 THR H A 17 ILE HG13 1.0 1.8 3.81 157 104 A 17 ILE HG1x A 18 THR H 1.0 1.8 3.81 158 105 A 22 ILE HA A 17 ILE HG13 1.0 1.8 4.82 159 105 A 22 ILE HA A 17 ILE HG1x 1.0 1.8 4.82 160 106 A 22 ILE HG2% A 17 ILE HG13 1.0 1.8 4.14 161 106 A 22 ILE HG2% A 17 ILE HG1x 1.0 1.8 4.14 162 107 A 17 ILE HG2% A 17 ILE HG13 1.0 1.8 3.12 163 107 A 17 ILE HG1x A 17 ILE HG2% 1.0 1.8 3.12 164 108 A 17 ILE HG2% A 18 THR HA 1.0 1.8 4.93 165 109 A 17 ILE H A 17 ILE HB 1.0 1.8 3.23 166 110 A 17 ILE H A 17 ILE HG2% 1.0 1.8 3.83 167 111 A 17 ILE H A 18 THR H 1.0 1.8 5.51 168 112 A 17 ILE H A 22 ILE HA 1.0 1.8 5.07 169 113 A 18 THR HA A 18 THR HG2% 1.0 1.8 3.24 170 114 A 18 THR HA A 19 ASP HB3 1.0 1.8 5.84 171 114 A 18 THR HA A 19 ASP HBx 1.0 1.8 5.84 172 115 A 18 THR HA A 19 ASP H 1.0 1.8 3.34 173 116 A 18 THR HA A 20 SER H 1.0 1.8 4.93 174 117 A 21 SER H A 18 THR HA 1.0 1.8 6.00 175 118 A 19 ASP H A 18 THR HB 1.0 1.8 3.89 176 119 A 20 SER H A 18 THR HB 1.0 1.8 3.41 177 120 A 21 SER H A 18 THR HB 1.0 1.8 5.56 178 121 A 18 THR HG2% A 19 ASP HA 1.0 1.8 5.08 179 122 A 18 THR HG2% A 19 ASP H 1.0 1.8 3.47 180 123 A 18 THR HG2% A 20 SER H 1.0 1.8 4.08 181 124 A 21 SER H A 18 THR HG2% 1.0 1.8 5.16 182 125 A 18 THR H A 19 ASP H 1.0 1.8 5.31 183 126 A 18 THR H A 20 SER H 1.0 1.8 5.45 184 127 A 18 THR H A 21 SER H 1.0 1.8 4.09 185 128 A 22 ILE HA A 18 THR H 1.0 1.8 3.94 186 129 A 19 ASP HA A 19 ASP HB3 1.0 1.8 2.99 187 129 A 19 ASP HBx A 19 ASP HA 1.0 1.8 2.99 188 130 A 21 SER H A 19 ASP HA 1.0 1.8 5.51 189 131 A 20 SER HA A 19 ASP HB3 1.0 1.8 5.80 190 131 A 19 ASP HBx A 20 SER HA 1.0 1.8 5.80 191 132 A 20 SER H A 19 ASP HB3 1.0 1.8 4.30 192 132 A 19 ASP HBx A 20 SER H 1.0 1.8 4.30 193 133 A 69 PRO HA A 19 ASP HB3 1.0 1.8 5.40 194 133 A 19 ASP HBx A 69 PRO HA 1.0 1.8 5.40 195 134 A 69 PRO HB2 A 19 ASP HB3 1.0 1.8 4.48 196 134 A 19 ASP HBx A 69 PRO HB2 1.0 1.8 4.48 197 135 A 19 ASP HBx A 69 PRO HD3 1.0 1.8 5.81 198 135 A 19 ASP HB3 A 69 PRO HD3 1.0 1.8 5.81 199 135 A 69 PRO HD2 A 19 ASP HB3 1.0 1.8 5.81 200 135 A 19 ASP HBx A 69 PRO HD2 1.0 1.8 5.81 201 136 A 19 ASP HBx A 69 PRO HG3 1.0 1.8 4.17 202 136 A 69 PRO HGx A 19 ASP HB3 1.0 1.8 4.17 203 136 A 19 ASP HBx A 69 PRO HGx 1.0 1.8 4.17 204 136 A 19 ASP HB3 A 69 PRO HG3 1.0 1.8 4.17 205 137 A 19 ASP HBx A 20 SER HB2 1.0 1.8 4.74 206 138 A 19 ASP HBx A 69 PRO HA 1.0 1.8 3.86 207 139 A 19 ASP H A 19 ASP HB3 1.0 1.8 3.39 208 139 A 19 ASP HBx A 19 ASP H 1.0 1.8 3.39 209 140 A 19 ASP H A 20 SER HB3 1.0 1.8 5.84 210 140 A 19 ASP H A 20 SER HB2 1.0 1.8 5.84 211 141 A 19 ASP H A 20 SER H 1.0 1.8 3.56 212 142 A 21 SER H A 19 ASP H 1.0 1.8 4.84 213 143 A 20 SER HA A 20 SER HB3 1.0 1.8 3.01 214 143 A 20 SER HA A 20 SER HB2 1.0 1.8 3.01 215 144 A 20 SER HA A 20 SER HB3 1.0 1.8 3.38 216 145 A 20 SER HA A 20 SER HB2 1.0 1.8 3.38 217 146 A 20 SER HA A 66 GLY H 1.0 1.8 5.17 218 147 A 20 SER HA A 67 LEU HBx 1.0 1.8 4.74 219 147 A 20 SER HA A 67 LEU HB3 1.0 1.8 4.74 220 148 A 20 SER HA A 67 LEU HD1% 1.0 1.8 5.07 221 149 A 20 SER HA A 67 LEU HD2% 1.0 1.8 5.59 222 150 A 20 SER HA A 67 LEU H 1.0 1.8 3.74 223 151 A 20 SER HA A 68 GLU H 1.0 1.8 5.67 224 152 A 20 SER HB2 A 21 SER HB3 1.0 1.8 5.68 225 152 A 20 SER HB3 A 21 SER HB3 1.0 1.8 5.68 226 152 A 21 SER HB2 A 20 SER HB3 1.0 1.8 5.68 227 152 A 20 SER HB2 A 21 SER HB2 1.0 1.8 5.68 228 153 A 21 SER H A 20 SER HB3 1.0 1.8 4.74 229 153 A 21 SER H A 20 SER HB2 1.0 1.8 4.74 230 154 A 66 GLY HA2 A 20 SER HB3 1.0 1.8 5.40 231 154 A 20 SER HB2 A 66 GLY HA2 1.0 1.8 5.40 232 155 A 66 GLY H A 20 SER HB3 1.0 1.8 4.66 233 155 A 20 SER HB2 A 66 GLY H 1.0 1.8 4.66 234 156 A 20 SER HB2 A 67 LEU HBx 1.0 1.8 5.12 235 156 A 67 LEU HB3 A 20 SER HB3 1.0 1.8 5.12 236 156 A 20 SER HB2 A 67 LEU HB3 1.0 1.8 5.12 237 156 A 20 SER HB3 A 67 LEU HBx 1.0 1.8 5.12 238 157 A 67 LEU H A 20 SER HB3 1.0 1.8 4.49 239 157 A 20 SER HB2 A 67 LEU H 1.0 1.8 4.49 240 158 A 20 SER H A 20 SER HB3 1.0 1.8 3.93 241 158 A 20 SER H A 20 SER HB2 1.0 1.8 3.93 242 159 A 20 SER H A 20 SER HB3 1.0 1.8 4.47 243 160 A 20 SER H A 20 SER HB2 1.0 1.8 4.47 244 161 A 20 SER H A 21 SER HA 1.0 1.8 5.79 245 162 A 21 SER H A 20 SER H 1.0 1.8 3.11 246 163 A 20 SER H A 67 LEU H 1.0 1.8 6.00 247 164 A 22 ILE HA A 21 SER HA 1.0 1.8 6.00 248 165 A 22 ILE HB A 21 SER HA 1.0 1.8 6.00 249 166 A 22 ILE HG2% A 21 SER HA 1.0 1.8 4.12 250 167 A 21 SER HA A 22 ILE H 1.0 1.8 3.14 251 168 A 21 SER HA A 63 THR HG2% 1.0 1.8 4.35 252 169 A 21 SER HA A 63 THR HG2% 1.0 1.8 5.33 253 170 A 21 SER HA A 64 VAL HB 1.0 1.8 5.96 254 171 A 21 SER HA A 64 VAL HG2% 1.0 1.8 4.43 255 171 A 21 SER HA A 64 VAL HG1% 1.0 1.8 4.43 256 172 A 21 SER HA A 64 VAL H 1.0 1.8 5.57 257 173 A 21 SER HA A 65 THR HA 1.0 1.8 3.57 258 174 A 21 SER HA A 65 THR HA 1.0 1.8 4.41 259 175 A 21 SER HA A 65 THR HB 1.0 1.8 3.78 260 176 A 21 SER HA A 65 THR HB 1.0 1.8 4.55 261 177 A 66 GLY H A 21 SER HA 1.0 1.8 4.96 262 178 A 67 LEU HD1% A 21 SER HA 1.0 1.8 4.24 263 179 A 21 SER HA A 67 LEU HG 1.0 1.8 3.75 264 180 A 67 LEU H A 21 SER HA 1.0 1.8 6.00 265 181 A 22 ILE HA A 21 SER HB3 1.0 1.8 4.83 266 181 A 22 ILE HA A 21 SER HB2 1.0 1.8 4.83 267 182 A 22 ILE HG2% A 21 SER HB3 1.0 1.8 5.68 268 182 A 22 ILE HG2% A 21 SER HB2 1.0 1.8 5.68 269 183 A 22 ILE H A 21 SER HB3 1.0 1.8 3.25 270 183 A 21 SER HB2 A 22 ILE H 1.0 1.8 3.25 271 184 A 21 SER HB3 A 64 VAL HG2% 1.0 1.8 5.78 272 184 A 64 VAL HG1% A 21 SER HB3 1.0 1.8 5.78 273 184 A 21 SER HB2 A 64 VAL HG1% 1.0 1.8 5.78 274 184 A 21 SER HB2 A 64 VAL HG2% 1.0 1.8 5.78 275 185 A 65 THR HA A 21 SER HB3 1.0 1.8 3.47 276 185 A 21 SER HB2 A 65 THR HA 1.0 1.8 3.47 277 186 A 65 THR HB A 21 SER HB3 1.0 1.8 3.84 278 186 A 21 SER HB2 A 65 THR HB 1.0 1.8 3.84 279 187 A 66 GLY H A 21 SER HB3 1.0 1.8 5.84 280 187 A 66 GLY H A 21 SER HB2 1.0 1.8 5.84 281 188 A 67 LEU HG A 21 SER HB3 1.0 1.8 5.84 282 188 A 21 SER HB2 A 67 LEU HG 1.0 1.8 5.84 283 189 A 65 THR HA A 21 SER HB3 1.0 1.8 4.89 284 190 A 65 THR HB A 21 SER HB3 1.0 1.8 4.57 285 191 A 21 SER H A 21 SER HB3 1.0 1.8 4.10 286 191 A 21 SER H A 21 SER HB2 1.0 1.8 4.10 287 192 A 21 SER H A 22 ILE H 1.0 1.8 5.03 288 193 A 21 SER H A 67 LEU HBx 1.0 1.8 5.34 289 193 A 21 SER H A 67 LEU HB3 1.0 1.8 5.34 290 194 A 21 SER H A 67 LEU H 1.0 1.8 6.00 291 195 A 22 ILE HA A 22 ILE HB 1.0 1.8 3.35 292 196 A 22 ILE HD1% A 22 ILE HA 1.0 1.8 4.76 293 197 A 22 ILE HA A 22 ILE HG13 1.0 1.8 3.86 294 197 A 22 ILE HG1x A 22 ILE HA 1.0 1.8 3.86 295 198 A 22 ILE HG2% A 22 ILE HA 1.0 1.8 3.37 296 199 A 22 ILE HA A 23 GLY H 1.0 1.8 3.19 297 200 A 22 ILE HB A 23 GLY H 1.0 1.8 3.66 298 201 A 22 ILE HB A 64 VAL HG2% 1.0 1.8 5.94 299 201 A 22 ILE HB A 64 VAL HG1% 1.0 1.8 5.94 300 202 A 22 ILE HD1% A 23 GLY H 1.0 1.8 4.82 301 203 A 22 ILE HD1% A 24 LEU H 1.0 1.8 5.35 302 204 A 22 ILE HD1% A 67 LEU HD1% 1.0 1.8 4.02 303 205 A 22 ILE HD1% A 67 LEU HD2% 1.0 1.8 5.75 304 206 A 23 GLY H A 22 ILE HG13 1.0 1.8 4.05 305 206 A 22 ILE HG1x A 23 GLY H 1.0 1.8 4.05 306 207 A 24 LEU HA A 22 ILE HG13 1.0 1.8 4.84 307 207 A 22 ILE HG1x A 24 LEU HA 1.0 1.8 4.84 308 208 A 24 LEU H A 22 ILE HG13 1.0 1.8 3.84 309 208 A 22 ILE HG1x A 24 LEU H 1.0 1.8 3.84 310 209 A 22 ILE HG1x A 64 VAL HG2% 1.0 1.8 3.52 311 209 A 22 ILE HG13 A 64 VAL HG2% 1.0 1.8 3.52 312 209 A 64 VAL HG1% A 22 ILE HG13 1.0 1.8 3.52 313 209 A 22 ILE HG1x A 64 VAL HG1% 1.0 1.8 3.52 314 210 A 64 VAL H A 22 ILE HG13 1.0 1.8 4.11 315 210 A 22 ILE HG1x A 64 VAL H 1.0 1.8 4.11 316 211 A 22 ILE HG1x A 64 VAL HG2% 1.0 1.8 5.05 317 212 A 22 ILE HD1% A 22 ILE HG2% 1.0 1.8 2.90 318 213 A 22 ILE HG2% A 22 ILE HG13 1.0 1.8 2.90 319 213 A 22 ILE HG2% A 22 ILE HG1x 1.0 1.8 2.90 320 214 A 22 ILE HG2% A 67 LEU HD1% 1.0 1.8 3.40 321 215 A 22 ILE HG2% A 67 LEU HD2% 1.0 1.8 5.27 322 216 A 22 ILE HB A 22 ILE H 1.0 1.8 4.59 323 217 A 22 ILE H A 22 ILE HG13 1.0 1.8 3.40 324 217 A 22 ILE HG1x A 22 ILE H 1.0 1.8 3.40 325 218 A 22 ILE HG2% A 22 ILE H 1.0 1.8 3.45 326 219 A 22 ILE H A 63 THR HG2% 1.0 1.8 4.57 327 220 A 22 ILE H A 63 THR HG2% 1.0 1.8 4.65 328 221 A 22 ILE H A 64 VAL HG2% 1.0 1.8 5.79 329 221 A 22 ILE H A 64 VAL HG1% 1.0 1.8 5.79 330 222 A 22 ILE H A 64 VAL H 1.0 1.8 4.15 331 223 A 22 ILE H A 65 THR HA 1.0 1.8 4.06 332 224 A 22 ILE H A 65 THR HA 1.0 1.8 4.89 333 225 A 22 ILE H A 65 THR HG2% 1.0 1.8 4.16 334 226 A 67 LEU HD1% A 22 ILE H 1.0 1.8 4.69 335 227 A 63 THR HB A 23 GLY HAx 1.0 1.8 5.91 336 227 A 23 GLY HA3 A 63 THR HB 1.0 1.8 5.91 337 228 A 23 GLY H A 24 LEU H 1.0 1.8 4.72 338 229 A 25 ARG H A 24 LEU HA 1.0 1.8 2.96 339 230 A 62 TYR HB3 A 24 LEU HB3 1.0 1.8 4.32 340 230 A 24 LEU HBx A 62 TYR HB3 1.0 1.8 4.32 341 231 A 62 TYR H A 24 LEU HB3 1.0 1.8 3.83 342 231 A 24 LEU HBx A 62 TYR H 1.0 1.8 3.83 343 232 A 24 LEU HBx A 62 TYR HB3 1.0 1.8 4.05 344 233 A 24 LEU HBx A 62 TYR HB2 1.0 1.8 4.92 345 234 A 24 LEU HBx A 64 VAL HG2% 1.0 1.8 3.75 346 235 A 24 LEU H A 24 LEU HB3 1.0 1.8 3.23 347 235 A 24 LEU H A 24 LEU HBx 1.0 1.8 3.23 348 236 A 25 ARG H A 24 LEU H 1.0 1.8 5.14 349 237 A 24 LEU H A 61 TYR HA 1.0 1.8 6.00 350 238 A 24 LEU H A 62 TYR H 1.0 1.8 4.09 351 239 A 25 ARG HA A 25 ARG HB3 1.0 1.8 3.37 352 239 A 25 ARG HBx A 25 ARG HA 1.0 1.8 3.37 353 240 A 25 ARG HA A 25 ARG HD3 1.0 1.8 4.01 354 240 A 25 ARG HA A 25 ARG HD2 1.0 1.8 4.01 355 241 A 25 ARG HA A 25 ARG HG3 1.0 1.8 3.75 356 241 A 25 ARG HA A 25 ARG HG2 1.0 1.8 3.75 357 242 A 25 ARG HA A 25 ARG HG3 1.0 1.8 4.37 358 243 A 25 ARG HA A 25 ARG HG2 1.0 1.8 4.37 359 244 A 25 ARG HA A 26 TRP H 1.0 1.8 3.01 360 245 A 25 ARG HA A 61 TYR HB3 1.0 1.8 3.59 361 245 A 25 ARG HA A 61 TYR HB2 1.0 1.8 3.59 362 246 A 25 ARG HA A 61 TYR HB2 1.0 1.8 4.34 363 247 A 25 ARG HA A 61 TYR HD% 1.0 1.8 4.89 364 248 A 25 ARG HBx A 25 ARG HD3 1.0 1.8 3.08 365 248 A 25 ARG HB3 A 25 ARG HD3 1.0 1.8 3.08 366 248 A 25 ARG HD2 A 25 ARG HB3 1.0 1.8 3.08 367 248 A 25 ARG HBx A 25 ARG HD2 1.0 1.8 3.08 368 249 A 26 TRP H A 25 ARG HB3 1.0 1.8 4.33 369 249 A 25 ARG HBx A 26 TRP H 1.0 1.8 4.33 370 250 A 25 ARG HBx A 61 TYR HB3 1.0 1.8 4.64 371 250 A 25 ARG HB3 A 61 TYR HB3 1.0 1.8 4.64 372 250 A 61 TYR HB2 A 25 ARG HB3 1.0 1.8 4.64 373 250 A 25 ARG HBx A 61 TYR HB2 1.0 1.8 4.64 374 251 A 25 ARG HBx A 61 TYR HA 1.0 1.8 4.36 375 252 A 25 ARG HBx A 61 TYR HB2 1.0 1.8 4.02 376 253 A 26 TRP H A 25 ARG HD3 1.0 1.8 4.63 377 253 A 25 ARG HD2 A 26 TRP H 1.0 1.8 4.63 378 254 A 25 ARG HD3 A 59 VAL HG2% 1.0 1.8 5.78 379 254 A 25 ARG HD2 A 59 VAL HG2% 1.0 1.8 5.78 380 254 A 59 VAL HG1% A 25 ARG HD3 1.0 1.8 5.78 381 254 A 25 ARG HD2 A 59 VAL HG1% 1.0 1.8 5.78 382 255 A 25 ARG HD3 A 60 GLY HA3 1.0 1.8 5.68 383 255 A 25 ARG HD2 A 60 GLY HA3 1.0 1.8 5.68 384 255 A 60 GLY HA2 A 25 ARG HD3 1.0 1.8 5.68 385 255 A 25 ARG HD2 A 60 GLY HA2 1.0 1.8 5.68 386 256 A 25 ARG HD2 A 61 TYR HB3 1.0 1.8 4.99 387 256 A 25 ARG HD3 A 61 TYR HB3 1.0 1.8 4.99 388 256 A 61 TYR HB2 A 25 ARG HD3 1.0 1.8 4.99 389 256 A 25 ARG HD2 A 61 TYR HB2 1.0 1.8 4.99 390 257 A 61 TYR HD% A 25 ARG HD3 1.0 1.8 4.19 391 257 A 25 ARG HD2 A 61 TYR HD% 1.0 1.8 4.19 392 258 A 61 TYR HD% A 25 ARG HD3 1.0 1.8 4.96 393 259 A 25 ARG HD2 A 61 TYR HD% 1.0 1.8 4.96 394 260 A 25 ARG HD2 A 25 ARG HG3 1.0 1.8 2.83 395 260 A 25 ARG HG2 A 25 ARG HD3 1.0 1.8 2.83 396 260 A 25 ARG HD2 A 25 ARG HG2 1.0 1.8 2.83 397 260 A 25 ARG HD3 A 25 ARG HG3 1.0 1.8 2.83 398 261 A 26 TRP H A 25 ARG HG3 1.0 1.8 4.59 399 261 A 25 ARG HG2 A 26 TRP H 1.0 1.8 4.59 400 262 A 61 TYR HD% A 25 ARG HG3 1.0 1.8 4.59 401 262 A 25 ARG HG2 A 61 TYR HD% 1.0 1.8 4.59 402 263 A 25 ARG H A 25 ARG HB3 1.0 1.8 3.17 403 263 A 25 ARG H A 25 ARG HBx 1.0 1.8 3.17 404 264 A 25 ARG H A 25 ARG HD3 1.0 1.8 5.84 405 264 A 25 ARG H A 25 ARG HD2 1.0 1.8 5.84 406 265 A 25 ARG H A 25 ARG HG3 1.0 1.8 4.80 407 265 A 25 ARG H A 25 ARG HG2 1.0 1.8 4.80 408 266 A 25 ARG H A 25 ARG HG3 1.0 1.8 5.58 409 267 A 25 ARG H A 25 ARG HG2 1.0 1.8 5.58 410 268 A 25 ARG H A 26 TRP H 1.0 1.8 5.09 411 269 A 26 TRP HA A 27 THR H 1.0 1.8 3.99 412 270 A 27 THR H A 26 TRP HB3 1.0 1.8 4.56 413 270 A 27 THR H A 26 TRP HB2 1.0 1.8 4.56 414 271 A 27 THR H A 26 TRP HB3 1.0 1.8 5.22 415 272 A 27 THR H A 26 TRP HB2 1.0 1.8 5.22 416 273 A 26 TRP HD1 A 28 PRO HA 1.0 1.8 5.13 417 274 A 26 TRP H A 60 GLY HA3 1.0 1.8 5.84 418 274 A 26 TRP H A 60 GLY HA2 1.0 1.8 5.84 419 275 A 61 TYR HA A 26 TRP H 1.0 1.8 3.90 420 276 A 61 TYR HA A 26 TRP H 1.0 1.8 5.35 421 277 A 62 TYR H A 26 TRP H 1.0 1.8 6.00 422 278 A 28 PRO HA A 27 THR HB 1.0 1.8 4.73 423 279 A 27 THR HB A 28 PRO HD3 1.0 1.8 4.74 424 279 A 27 THR HB A 28 PRO HD2 1.0 1.8 4.74 425 280 A 28 PRO HA A 27 THR HG2% 1.0 1.8 4.61 426 281 A 27 THR H A 27 THR HB 1.0 1.8 4.49 427 282 A 28 PRO HA A 29 LEU HD2% 1.0 1.8 5.01 428 282 A 28 PRO HA A 29 LEU HD1% 1.0 1.8 5.01 429 283 A 28 PRO HA A 29 LEU H 1.0 1.8 3.65 430 284 A 28 PRO HB3 A 29 LEU HD2% 1.0 1.8 5.69 431 285 A 28 PRO HB2 A 32 SER HB2 1.0 1.8 4.41 432 286 A 60 GLY HA2 A 28 PRO HD3 1.0 1.8 3.68 433 287 A 28 PRO HG3 A 29 LEU HD2% 1.0 1.8 5.94 434 287 A 29 LEU HD1% A 28 PRO HG3 1.0 1.8 5.94 435 287 A 29 LEU HD1% A 28 PRO HGx 1.0 1.8 5.94 436 287 A 28 PRO HGx A 29 LEU HD2% 1.0 1.8 5.94 437 288 A 60 GLY HA2 A 28 PRO HGx 1.0 1.8 3.86 438 289 A 60 GLY HA2 A 28 PRO HGx 1.0 1.8 4.24 439 290 A 29 LEU HA A 29 LEU HB3 1.0 1.8 3.06 440 290 A 29 LEU HA A 29 LEU HB2 1.0 1.8 3.06 441 291 A 29 LEU HA A 29 LEU HD2% 1.0 1.8 3.17 442 291 A 29 LEU HD1% A 29 LEU HA 1.0 1.8 3.17 443 292 A 29 LEU HA A 30 ASN HA 1.0 1.8 4.37 444 293 A 29 LEU HA A 30 ASN HA 1.0 1.8 5.16 445 294 A 29 LEU HA A 30 ASN HB3 1.0 1.8 4.76 446 294 A 29 LEU HA A 30 ASN HB2 1.0 1.8 4.76 447 295 A 29 LEU HA A 30 ASN HB3 1.0 1.8 4.46 448 296 A 29 LEU HA A 30 ASN HB3 1.0 1.8 5.57 449 297 A 29 LEU HA A 30 ASN HB2 1.0 1.8 4.07 450 298 A 29 LEU HA A 30 ASN HB2 1.0 1.8 5.57 451 299 A 29 LEU HB3 A 29 LEU HD2% 1.0 1.8 2.67 452 299 A 29 LEU HB2 A 29 LEU HD2% 1.0 1.8 2.67 453 299 A 29 LEU HD1% A 29 LEU HB3 1.0 1.8 2.67 454 299 A 29 LEU HD1% A 29 LEU HB2 1.0 1.8 2.67 455 300 A 29 LEU HB3 A 30 ASN HB3 1.0 1.8 5.52 456 300 A 29 LEU HB2 A 30 ASN HB3 1.0 1.8 5.52 457 300 A 30 ASN HB2 A 29 LEU HB3 1.0 1.8 5.52 458 300 A 29 LEU HB2 A 30 ASN HB2 1.0 1.8 5.52 459 301 A 29 LEU HB3 A 32 SER HB3 1.0 1.8 3.84 460 301 A 29 LEU HB2 A 32 SER HB3 1.0 1.8 3.84 461 301 A 32 SER HB2 A 29 LEU HB3 1.0 1.8 3.84 462 301 A 29 LEU HB2 A 32 SER HB2 1.0 1.8 3.84 463 302 A 33 THR H A 29 LEU HB3 1.0 1.8 5.84 464 302 A 29 LEU HB2 A 33 THR H 1.0 1.8 5.84 465 303 A 29 LEU HB3 A 30 ASN HB3 1.0 1.8 4.51 466 304 A 31 SER HB2 A 29 LEU HB3 1.0 1.8 3.98 467 305 A 29 LEU HB3 A 32 SER HB3 1.0 1.8 6.08 468 306 A 32 SER HB2 A 29 LEU HB3 1.0 1.8 5.08 469 307 A 29 LEU HB2 A 31 SER HB2 1.0 1.8 4.09 470 308 A 29 LEU HB2 A 32 SER HA 1.0 1.8 3.95 471 309 A 29 LEU HB2 A 32 SER HB3 1.0 1.8 5.08 472 310 A 29 LEU HB2 A 32 SER HB2 1.0 1.8 5.38 473 311 A 32 SER HA A 29 LEU HD2% 1.0 1.8 5.28 474 311 A 29 LEU HD1% A 32 SER HA 1.0 1.8 5.28 475 312 A 29 LEU HD1% A 32 SER HB3 1.0 1.8 3.92 476 312 A 29 LEU HD2% A 32 SER HB3 1.0 1.8 3.92 477 312 A 32 SER HB2 A 29 LEU HD2% 1.0 1.8 3.92 478 312 A 29 LEU HD1% A 32 SER HB2 1.0 1.8 3.92 479 313 A 29 LEU HD1% A 32 SER HA 1.0 1.8 4.35 480 314 A 29 LEU HD1% A 32 SER HB3 1.0 1.8 5.29 481 315 A 29 LEU HD2% A 30 ASN HB3 1.0 1.8 4.99 482 316 A 32 SER HB2 A 29 LEU HD2% 1.0 1.8 4.33 483 317 A 29 LEU H A 29 LEU HB3 1.0 1.8 3.85 484 317 A 29 LEU H A 29 LEU HB2 1.0 1.8 3.85 485 318 A 29 LEU H A 29 LEU HB3 1.0 1.8 4.37 486 319 A 29 LEU H A 29 LEU HB2 1.0 1.8 4.37 487 320 A 29 LEU H A 29 LEU HD2% 1.0 1.8 3.91 488 320 A 29 LEU HD1% A 29 LEU H 1.0 1.8 3.91 489 321 A 29 LEU HD1% A 29 LEU H 1.0 1.8 4.38 490 322 A 29 LEU H A 29 LEU HD2% 1.0 1.8 4.38 491 323 A 29 LEU H A 29 LEU HG 1.0 1.8 4.40 492 324 A 29 LEU H A 32 SER HB2 1.0 1.8 3.69 493 325 A 30 ASN HA A 31 SER H 1.0 1.8 4.53 494 326 A 31 SER H A 30 ASN HB3 1.0 1.8 4.65 495 326 A 30 ASN HB2 A 31 SER H 1.0 1.8 4.65 496 327 A 31 SER H A 30 ASN HB3 1.0 1.8 5.34 497 328 A 30 ASN HB2 A 31 SER H 1.0 1.8 5.34 498 329 A 30 ASN H A 30 ASN HB3 1.0 1.8 4.28 499 330 A 30 ASN HB2 A 30 ASN H 1.0 1.8 4.28 500 331 A 31 SER HA A 31 SER HB3 1.0 1.8 3.13 501 331 A 31 SER HA A 31 SER HB2 1.0 1.8 3.13 502 332 A 31 SER H A 31 SER HB3 1.0 1.8 4.57 503 333 A 31 SER H A 31 SER HB2 1.0 1.8 4.57 504 334 A 32 SER HA A 32 SER HB3 1.0 1.8 3.09 505 334 A 32 SER HB2 A 32 SER HA 1.0 1.8 3.09 506 335 A 32 SER HA A 33 THR HA 1.0 1.8 5.05 507 336 A 33 THR H A 32 SER HA 1.0 1.8 3.61 508 337 A 32 SER HA A 81 ILE HG13 1.0 1.8 4.58 509 338 A 33 THR H A 32 SER HB3 1.0 1.8 3.95 510 338 A 32 SER HB2 A 33 THR H 1.0 1.8 3.95 511 339 A 81 ILE HB A 32 SER HB3 1.0 1.8 5.84 512 339 A 32 SER HB2 A 81 ILE HB 1.0 1.8 5.84 513 340 A 81 ILE HG12 A 32 SER HB3 1.0 1.8 4.98 514 340 A 32 SER HB2 A 81 ILE HG12 1.0 1.8 4.98 515 341 A 33 THR H A 32 SER HB3 1.0 1.8 4.61 516 342 A 81 ILE HG12 A 32 SER HB3 1.0 1.8 5.68 517 343 A 32 SER HB2 A 33 THR H 1.0 1.8 4.61 518 344 A 32 SER HB2 A 81 ILE HG12 1.0 1.8 5.68 519 345 A 33 THR HA A 33 THR HG2% 1.0 1.8 2.96 520 346 A 33 THR HA A 34 ILE H 1.0 1.8 3.67 521 347 A 81 ILE HB A 33 THR HB 1.0 1.8 5.09 522 348 A 81 ILE HG12 A 33 THR HB 1.0 1.8 4.93 523 349 A 81 ILE HB A 33 THR HB 1.0 1.8 5.15 524 350 A 33 THR HB A 82 ASN HB3 1.0 1.8 5.23 525 351 A 33 THR HB A 82 ASN H 1.0 1.8 3.96 526 352 A 33 THR HG2% A 34 ILE H 1.0 1.8 5.03 527 353 A 33 THR H A 33 THR HB 1.0 1.8 3.64 528 354 A 33 THR H A 33 THR HG2% 1.0 1.8 4.47 529 355 A 33 THR H A 81 ILE HD1% 1.0 1.8 6.00 530 356 A 33 THR H A 81 ILE HG2% 1.0 1.8 6.00 531 357 A 34 ILE HA A 34 ILE HB 1.0 1.8 3.17 532 358 A 34 ILE HA A 34 ILE HG2% 1.0 1.8 3.16 533 359 A 34 ILE HA A 35 ILE HG2% 1.0 1.8 6.06 534 360 A 34 ILE HD1% A 57 SER HBx 1.0 1.8 4.30 535 361 A 34 ILE H A 35 ILE HG2% 1.0 1.8 4.94 536 362 A 34 ILE H A 35 ILE H 1.0 1.8 5.62 537 363 A 34 ILE H A 81 ILE HG2% 1.0 1.8 6.00 538 364 A 34 ILE H A 82 ASN H 1.0 1.8 6.00 539 365 A 35 ILE HA A 35 ILE HG1x 1.0 1.8 3.88 540 365 A 35 ILE HA A 35 ILE HG1y 1.0 1.8 3.88 541 366 A 35 ILE HG2% A 35 ILE HA 1.0 1.8 3.45 542 367 A 35 ILE HA A 36 GLY HA3 1.0 1.8 5.84 543 367 A 35 ILE HA A 36 GLY HA2 1.0 1.8 5.84 544 368 A 35 ILE HB A 35 ILE HD1% 1.0 1.8 3.13 545 369 A 35 ILE HD1% A 81 ILE HA 1.0 1.8 3.99 546 370 A 35 ILE HD1% A 81 ILE HA 1.0 1.8 4.53 547 371 A 35 ILE HD1% A 81 ILE H 1.0 1.8 5.57 548 372 A 35 ILE HD1% A 82 ASN HA 1.0 1.8 4.88 549 373 A 82 ASN HB3 A 35 ILE HD1% 1.0 1.8 4.24 550 374 A 82 ASN HB3 A 35 ILE HD1% 1.0 1.8 4.24 551 375 A 35 ILE HD1% A 82 ASN HB2 1.0 1.8 3.79 552 376 A 35 ILE HD1% A 82 ASN HB2 1.0 1.8 4.53 553 377 A 82 ASN H A 35 ILE HD1% 1.0 1.8 3.49 554 378 A 80 LEU HB3 A 35 ILE HG1x 1.0 1.8 5.11 555 378 A 35 ILE HG1y A 80 LEU HB3 1.0 1.8 5.11 556 379 A 81 ILE HA A 35 ILE HG1x 1.0 1.8 4.40 557 379 A 35 ILE HG1y A 81 ILE HA 1.0 1.8 4.40 558 380 A 35 ILE HG2% A 35 ILE HD1% 1.0 1.8 3.05 559 381 A 35 ILE HG2% A 35 ILE HG1x 1.0 1.8 3.31 560 381 A 35 ILE HG2% A 35 ILE HG1y 1.0 1.8 3.31 561 382 A 35 ILE HG2% A 57 SER HBx 1.0 1.8 4.68 562 383 A 35 ILE HG2% A 81 ILE HA 1.0 1.8 5.25 563 384 A 81 ILE HB A 35 ILE HG2% 1.0 1.8 6.00 564 385 A 35 ILE H A 35 ILE HA 1.0 1.8 3.42 565 386 A 35 ILE H A 35 ILE HG1x 1.0 1.8 5.33 566 386 A 35 ILE H A 35 ILE HG1y 1.0 1.8 5.33 567 387 A 35 ILE HG2% A 35 ILE H 1.0 1.8 4.11 568 388 A 35 ILE H A 81 ILE HA 1.0 1.8 4.97 569 389 A 37 TYR H A 36 GLY HA3 1.0 1.8 3.54 570 389 A 36 GLY HA2 A 37 TYR H 1.0 1.8 3.54 571 390 A 56 ASP H A 36 GLY HA3 1.0 1.8 4.95 572 391 A 38 ARG HA A 38 ARG HDx 1.0 1.8 4.37 573 391 A 38 ARG HA A 38 ARG HDy 1.0 1.8 4.37 574 392 A 38 ARG HA A 38 ARG HGy 1.0 1.8 4.20 575 393 A 38 ARG HA A 38 ARG HGx 1.0 1.8 4.16 576 394 A 38 ARG HA A 39 ILE HD1% 1.0 1.8 6.00 577 395 A 38 ARG HA A 39 ILE H 1.0 1.8 3.24 578 396 A 38 ARG HA A 54 PHE HA 1.0 1.8 3.64 579 397 A 38 ARG HA A 54 PHE HA 1.0 1.8 4.63 580 398 A 38 ARG HA A 54 PHE HB2 1.0 1.8 5.32 581 398 A 38 ARG HA A 54 PHE HB3 1.0 1.8 5.32 582 399 A 38 ARG HA A 55 VAL H 1.0 1.8 4.04 583 400 A 38 ARG HB3 A 38 ARG HDx 1.0 1.8 3.11 584 400 A 38 ARG HDy A 38 ARG HB3 1.0 1.8 3.11 585 401 A 39 ILE H A 38 ARG HB2 1.0 1.8 4.73 586 402 A 39 ILE H A 38 ARG HDx 1.0 1.8 4.44 587 402 A 38 ARG HDy A 39 ILE H 1.0 1.8 4.44 588 403 A 40 THR HG2% A 38 ARG HDx 1.0 1.8 4.83 589 403 A 38 ARG HDy A 40 THR HG2% 1.0 1.8 4.83 590 404 A 40 THR H A 38 ARG HDx 1.0 1.8 4.65 591 404 A 38 ARG HDy A 40 THR H 1.0 1.8 4.65 592 405 A 52 GLU HA A 38 ARG HDx 1.0 1.8 5.18 593 405 A 38 ARG HDy A 52 GLU HA 1.0 1.8 5.18 594 406 A 52 GLU HB2 A 38 ARG HDx 1.0 1.8 5.10 595 406 A 38 ARG HDy A 52 GLU HB2 1.0 1.8 5.10 596 407 A 38 ARG HDx A 52 GLU HG3 1.0 1.8 3.90 597 407 A 38 ARG HDy A 52 GLU HG3 1.0 1.8 3.90 598 407 A 52 GLU HGx A 38 ARG HDx 1.0 1.8 3.90 599 407 A 38 ARG HDy A 52 GLU HGx 1.0 1.8 3.90 600 408 A 78 ILE HB A 38 ARG HDx 1.0 1.8 3.98 601 408 A 38 ARG HDy A 78 ILE HB 1.0 1.8 3.98 602 409 A 38 ARG HDy A 78 ILE HD1% 1.0 1.8 3.82 603 409 A 78 ILE HD1% A 38 ARG HDx 1.0 1.8 3.82 604 410 A 38 ARG HGx A 38 ARG HDx 1.0 1.8 3.25 605 410 A 38 ARG HDy A 38 ARG HGx 1.0 1.8 3.25 606 411 A 38 ARG HGx A 39 ILE HD1% 1.0 1.8 5.12 607 412 A 38 ARG HGx A 39 ILE H 1.0 1.8 3.56 608 413 A 38 ARG HGx A 52 GLU HG3 1.0 1.8 3.92 609 413 A 38 ARG HGx A 52 GLU HGx 1.0 1.8 3.92 610 414 A 38 ARG HGx A 53 ASP HA 1.0 1.8 6.00 611 415 A 38 ARG HGx A 53 ASP HB3 1.0 1.8 6.00 612 416 A 38 ARG HGx A 53 ASP HB2 1.0 1.8 6.00 613 417 A 38 ARG HGx A 53 ASP H 1.0 1.8 4.02 614 418 A 38 ARG HGx A 54 PHE HA 1.0 1.8 4.12 615 419 A 39 ILE HD1% A 39 ILE HA 1.0 1.8 4.23 616 420 A 39 ILE HA A 39 ILE HG1x 1.0 1.8 4.01 617 420 A 39 ILE HA A 39 ILE HG13 1.0 1.8 4.01 618 421 A 39 ILE HA A 39 ILE HG2% 1.0 1.8 3.27 619 422 A 39 ILE HA A 40 THR HB 1.0 1.8 5.32 620 423 A 40 THR H A 39 ILE HA 1.0 1.8 2.95 621 424 A 39 ILE HA A 76 SER HB3 1.0 1.8 5.84 622 424 A 39 ILE HA A 76 SER HB2 1.0 1.8 5.84 623 425 A 39 ILE HA A 77 VAL HA 1.0 1.8 3.88 624 426 A 39 ILE HA A 77 VAL HG21 1.0 1.8 4.45 625 426 A 77 VAL HG1% A 39 ILE HA 1.0 1.8 4.45 626 427 A 39 ILE HA A 78 ILE H 1.0 1.8 4.32 627 428 A 39 ILE HD1% A 39 ILE HB 1.0 1.8 3.72 628 429 A 40 THR H A 39 ILE HB 1.0 1.8 4.14 629 430 A 39 ILE HB A 64 VAL HG2% 1.0 1.8 5.94 630 430 A 64 VAL HG1% A 39 ILE HB 1.0 1.8 5.94 631 431 A 39 ILE HB A 64 VAL HG2% 1.0 1.8 4.82 632 432 A 39 ILE HB A 77 VAL HG21 1.0 1.8 5.49 633 432 A 77 VAL HG1% A 39 ILE HB 1.0 1.8 5.49 634 433 A 39 ILE HD1% A 52 GLU HA 1.0 1.8 5.00 635 434 A 39 ILE HD1% A 52 GLU HG3 1.0 1.8 5.38 636 434 A 39 ILE HD1% A 52 GLU HGx 1.0 1.8 5.38 637 435 A 39 ILE HD1% A 53 ASP HB2 1.0 1.8 3.59 638 436 A 39 ILE HD1% A 53 ASP HB2 1.0 1.8 4.67 639 437 A 39 ILE HD1% A 53 ASP H 1.0 1.8 4.26 640 438 A 39 ILE HD1% A 55 VAL HB 1.0 1.8 5.03 641 439 A 39 ILE HD1% A 55 VAL HG2% 1.0 1.8 5.56 642 440 A 39 ILE HD1% A 55 VAL H 1.0 1.8 5.68 643 441 A 62 TYR HB3 A 39 ILE HD1% 1.0 1.8 3.71 644 442 A 62 TYR HB3 A 39 ILE HD1% 1.0 1.8 5.25 645 443 A 62 TYR HB2 A 39 ILE HD1% 1.0 1.8 3.67 646 444 A 62 TYR HB2 A 39 ILE HD1% 1.0 1.8 6.00 647 445 A 39 ILE HD1% A 62 TYR HD% 1.0 1.8 3.87 648 446 A 39 ILE HD1% A 62 TYR HEx 1.0 1.8 4.04 649 446 A 39 ILE HD1% A 62 TYR HEy 1.0 1.8 4.04 650 447 A 39 ILE HD1% A 63 THR H 1.0 1.8 5.83 651 448 A 64 VAL HB A 39 ILE HD1% 1.0 1.8 5.65 652 449 A 39 ILE HD1% A 64 VAL HG2% 1.0 1.8 3.27 653 449 A 64 VAL HG1% A 39 ILE HD1% 1.0 1.8 3.27 654 450 A 64 VAL HG1% A 39 ILE HD1% 1.0 1.8 5.21 655 451 A 39 ILE HD1% A 77 VAL HA 1.0 1.8 6.00 656 452 A 40 THR H A 39 ILE HG1x 1.0 1.8 3.83 657 452 A 40 THR H A 39 ILE HG13 1.0 1.8 3.83 658 453 A 52 GLU HA A 39 ILE HG1x 1.0 1.8 3.99 659 453 A 52 GLU HA A 39 ILE HG13 1.0 1.8 3.99 660 454 A 53 ASP H A 39 ILE HG1x 1.0 1.8 4.86 661 454 A 53 ASP H A 39 ILE HG13 1.0 1.8 4.86 662 455 A 64 VAL HA A 39 ILE HG1x 1.0 1.8 6.00 663 455 A 39 ILE HG13 A 64 VAL HA 1.0 1.8 6.00 664 456 A 39 ILE HG13 A 64 VAL HG2% 1.0 1.8 4.29 665 456 A 39 ILE HG1x A 64 VAL HG2% 1.0 1.8 4.29 666 456 A 64 VAL HG1% A 39 ILE HG1x 1.0 1.8 4.29 667 456 A 64 VAL HG1% A 39 ILE HG13 1.0 1.8 4.29 668 457 A 39 ILE HD1% A 39 ILE HG2% 1.0 1.8 3.02 669 458 A 39 ILE HG2% A 39 ILE HG1x 1.0 1.8 2.90 670 458 A 39 ILE HG13 A 39 ILE HG2% 1.0 1.8 2.90 671 459 A 53 ASP HB3 A 39 ILE HG2% 1.0 1.8 4.02 672 460 A 53 ASP HB2 A 39 ILE HG2% 1.0 1.8 5.28 673 461 A 53 ASP H A 39 ILE HG2% 1.0 1.8 4.87 674 462 A 54 PHE HA A 39 ILE HG2% 1.0 1.8 4.84 675 463 A 62 TYR HB3 A 39 ILE HG2% 1.0 1.8 3.61 676 464 A 62 TYR HB2 A 39 ILE HG2% 1.0 1.8 3.48 677 465 A 39 ILE HG2% A 62 TYR HD% 1.0 1.8 4.42 678 466 A 39 ILE HG2% A 62 TYR HEx 1.0 1.8 4.59 679 466 A 39 ILE HG2% A 62 TYR HEy 1.0 1.8 4.59 680 467 A 39 ILE HG2% A 77 VAL HA 1.0 1.8 4.65 681 468 A 39 ILE HG2% A 77 VAL HG21 1.0 1.8 3.47 682 468 A 77 VAL HG1% A 39 ILE HG2% 1.0 1.8 3.47 683 469 A 39 ILE HG2% A 78 ILE H 1.0 1.8 4.93 684 470 A 39 ILE H A 39 ILE HB 1.0 1.8 4.29 685 471 A 39 ILE HD1% A 39 ILE H 1.0 1.8 4.52 686 472 A 39 ILE H A 39 ILE HG1x 1.0 1.8 4.52 687 472 A 39 ILE H A 39 ILE HG13 1.0 1.8 4.52 688 473 A 39 ILE H A 39 ILE HG2% 1.0 1.8 3.92 689 474 A 39 ILE H A 53 ASP H 1.0 1.8 3.87 690 475 A 39 ILE H A 54 PHE HA 1.0 1.8 4.31 691 476 A 39 ILE H A 54 PHE HA 1.0 1.8 4.45 692 477 A 39 ILE H A 54 PHE H 1.0 1.8 5.86 693 478 A 40 THR HG2% A 40 THR HA 1.0 1.8 3.63 694 479 A 40 THR HA A 41 VAL HA 1.0 1.8 5.20 695 480 A 40 THR HA A 41 VAL HG2% 1.0 1.8 4.28 696 480 A 40 THR HA A 41 VAL HG1% 1.0 1.8 4.28 697 481 A 40 THR HA A 41 VAL H 1.0 1.8 3.66 698 482 A 52 GLU HA A 40 THR HA 1.0 1.8 4.40 699 483 A 40 THR HA A 52 GLU HG3 1.0 1.8 4.61 700 483 A 52 GLU HGx A 40 THR HA 1.0 1.8 4.61 701 484 A 40 THR HB A 41 VAL HA 1.0 1.8 6.00 702 485 A 40 THR HB A 76 SER HB3 1.0 1.8 4.35 703 485 A 40 THR HB A 76 SER HB2 1.0 1.8 4.35 704 486 A 40 THR HB A 77 VAL HA 1.0 1.8 6.00 705 487 A 40 THR HG2% A 41 VAL HA 1.0 1.8 4.60 706 488 A 40 THR HG2% A 41 VAL HG2% 1.0 1.8 5.94 707 488 A 40 THR HG2% A 41 VAL HG1% 1.0 1.8 5.94 708 489 A 40 THR HG2% A 41 VAL H 1.0 1.8 3.40 709 490 A 40 THR HG2% A 42 VAL H 1.0 1.8 6.00 710 491 A 40 THR HG2% A 52 GLU HA 1.0 1.8 4.33 711 492 A 40 THR HG2% A 52 GLU HB3 1.0 1.8 3.16 712 493 A 40 THR HG2% A 52 GLU HB2 1.0 1.8 3.81 713 494 A 40 THR H A 40 THR HB 1.0 1.8 3.62 714 495 A 40 THR H A 75 ILE HA 1.0 1.8 6.00 715 496 A 40 THR H A 75 ILE HB 1.0 1.8 6.00 716 497 A 40 THR H A 76 SER HB3 1.0 1.8 4.98 717 497 A 40 THR H A 76 SER HB2 1.0 1.8 4.98 718 498 A 40 THR H A 77 VAL HA 1.0 1.8 3.86 719 499 A 40 THR H A 77 VAL HG21 1.0 1.8 5.24 720 499 A 77 VAL HG1% A 40 THR H 1.0 1.8 5.24 721 500 A 40 THR H A 78 ILE HB 1.0 1.8 6.00 722 501 A 40 THR H A 78 ILE HD1% 1.0 1.8 5.03 723 502 A 40 THR H A 78 ILE H 1.0 1.8 5.65 724 503 A 41 VAL HA A 41 VAL HG2% 1.0 1.8 2.94 725 503 A 41 VAL HA A 41 VAL HG1% 1.0 1.8 2.94 726 504 A 41 VAL HA A 41 VAL HG1% 1.0 1.8 3.83 727 505 A 41 VAL HA A 41 VAL HG2% 1.0 1.8 3.83 728 506 A 41 VAL HA A 42 VAL HB 1.0 1.8 4.72 729 507 A 41 VAL HA A 42 VAL H 1.0 1.8 3.11 730 508 A 41 VAL HA A 64 VAL HG2% 1.0 1.8 5.82 731 508 A 64 VAL HG1% A 41 VAL HA 1.0 1.8 5.82 732 509 A 41 VAL HA A 75 ILE HA 1.0 1.8 4.21 733 510 A 41 VAL HA A 75 ILE HA 1.0 1.8 4.27 734 511 A 41 VAL HA A 75 ILE HB 1.0 1.8 4.86 735 512 A 41 VAL HA A 75 ILE HD1% 1.0 1.8 4.25 736 513 A 41 VAL HA A 75 ILE HG13 1.0 1.8 5.97 737 513 A 41 VAL HA A 75 ILE HG1x 1.0 1.8 5.97 738 514 A 41 VAL HA A 75 ILE HG2% 1.0 1.8 3.92 739 515 A 41 VAL HA A 75 ILE HG2% 1.0 1.8 5.31 740 516 A 41 VAL HA A 76 SER HB3 1.0 1.8 5.84 741 516 A 76 SER HB2 A 41 VAL HA 1.0 1.8 5.84 742 517 A 67 LEU HD2% A 41 VAL HB 1.0 1.8 4.44 743 518 A 42 VAL H A 41 VAL HG2% 1.0 1.8 3.92 744 518 A 41 VAL HG1% A 42 VAL H 1.0 1.8 3.92 745 519 A 51 PHE HA A 41 VAL HG2% 1.0 1.8 4.53 746 519 A 41 VAL HG1% A 51 PHE HA 1.0 1.8 4.53 747 520 A 41 VAL HG1% A 51 PHE HBx 1.0 1.8 5.05 748 520 A 41 VAL HG2% A 51 PHE HBx 1.0 1.8 5.05 749 520 A 51 PHE HBy A 41 VAL HG2% 1.0 1.8 5.05 750 520 A 41 VAL HG1% A 51 PHE HBy 1.0 1.8 5.05 751 521 A 41 VAL HG1% A 64 VAL HG2% 1.0 1.8 3.20 752 521 A 41 VAL HG2% A 64 VAL HG2% 1.0 1.8 3.20 753 521 A 64 VAL HG1% A 41 VAL HG2% 1.0 1.8 3.20 754 521 A 64 VAL HG1% A 41 VAL HG1% 1.0 1.8 3.20 755 522 A 67 LEU HD2% A 41 VAL HG2% 1.0 1.8 3.19 756 522 A 67 LEU HD2% A 41 VAL HG1% 1.0 1.8 3.19 757 523 A 41 VAL HG1% A 42 VAL H 1.0 1.8 4.72 758 524 A 41 VAL HG1% A 50 ILE HA 1.0 1.8 4.93 759 525 A 41 VAL HG1% A 50 ILE HB 1.0 1.8 5.15 760 526 A 41 VAL HG1% A 50 ILE HD1% 1.0 1.8 6.36 761 527 A 52 GLU HA A 41 VAL HG1% 1.0 1.8 4.12 762 528 A 67 LEU HD2% A 41 VAL HG1% 1.0 1.8 4.65 763 529 A 42 VAL H A 41 VAL HG2% 1.0 1.8 4.72 764 530 A 43 ALA HA A 41 VAL HG2% 1.0 1.8 4.14 765 531 A 50 ILE HB A 41 VAL HG2% 1.0 1.8 4.13 766 532 A 67 LEU HD2% A 41 VAL HG2% 1.0 1.8 4.65 767 533 A 41 VAL H A 41 VAL HG2% 1.0 1.8 3.52 768 533 A 41 VAL HG1% A 41 VAL H 1.0 1.8 3.52 769 534 A 41 VAL H A 42 VAL H 1.0 1.8 5.39 770 535 A 42 VAL HA A 42 VAL HG21 1.0 1.8 3.43 771 535 A 42 VAL HA A 42 VAL HG1% 1.0 1.8 3.43 772 536 A 42 VAL HA A 43 ALA HB% 1.0 1.8 4.41 773 537 A 42 VAL HA A 43 ALA HB% 1.0 1.8 4.53 774 538 A 42 VAL HA A 43 ALA H 1.0 1.8 3.64 775 539 A 42 VAL HA A 49 PRO HB2 1.0 1.8 4.93 776 539 A 42 VAL HA A 49 PRO HB3 1.0 1.8 4.93 777 540 A 50 ILE HA A 42 VAL HA 1.0 1.8 5.50 778 541 A 42 VAL HA A 50 ILE H 1.0 1.8 4.03 779 542 A 42 VAL HB A 74 ASP HB3 1.0 1.8 4.46 780 543 A 42 VAL HB A 74 ASP HB3 1.0 1.8 4.49 781 544 A 42 VAL HB A 74 ASP HB2 1.0 1.8 3.84 782 545 A 42 VAL HB A 74 ASP HB2 1.0 1.8 4.47 783 546 A 42 VAL HB A 74 ASP H 1.0 1.8 5.25 784 547 A 43 ALA HA A 42 VAL HG21 1.0 1.8 4.08 785 547 A 43 ALA HA A 42 VAL HG1% 1.0 1.8 4.08 786 548 A 43 ALA H A 42 VAL HG21 1.0 1.8 3.59 787 548 A 42 VAL HG1% A 43 ALA H 1.0 1.8 3.59 788 549 A 44 ALA HA A 42 VAL HG21 1.0 1.8 3.90 789 549 A 42 VAL HG1% A 44 ALA HA 1.0 1.8 3.90 790 550 A 73 TYR HA A 42 VAL HG21 1.0 1.8 4.43 791 550 A 42 VAL HG1% A 73 TYR HA 1.0 1.8 4.43 792 551 A 74 ASP HA A 42 VAL HG21 1.0 1.8 4.88 793 551 A 42 VAL HG1% A 74 ASP HA 1.0 1.8 4.88 794 552 A 74 ASP HB3 A 42 VAL HG21 1.0 1.8 3.99 795 552 A 42 VAL HG1% A 74 ASP HB3 1.0 1.8 3.99 796 553 A 74 ASP HB2 A 42 VAL HG21 1.0 1.8 3.33 797 553 A 42 VAL HG1% A 74 ASP HB2 1.0 1.8 3.33 798 554 A 43 ALA HA A 42 VAL HG1% 1.0 1.8 4.45 799 555 A 42 VAL HG1% A 49 PRO HA 1.0 1.8 5.67 800 556 A 42 VAL HG1% A 49 PRO HG2 1.0 1.8 4.87 801 557 A 42 VAL HG1% A 73 TYR HA 1.0 1.8 4.29 802 558 A 42 VAL HG1% A 74 ASP HB3 1.0 1.8 5.02 803 559 A 42 VAL HG1% A 74 ASP HB2 1.0 1.8 5.04 804 560 A 42 VAL H A 42 VAL HB 1.0 1.8 3.62 805 561 A 42 VAL H A 42 VAL HG21 1.0 1.8 3.92 806 561 A 42 VAL H A 42 VAL HG1% 1.0 1.8 3.92 807 562 A 42 VAL H A 43 ALA H 1.0 1.8 5.03 808 563 A 42 VAL H A 49 PRO HA 1.0 1.8 6.00 809 564 A 42 VAL H A 73 TYR HA 1.0 1.8 4.75 810 565 A 42 VAL H A 73 TYR HA 1.0 1.8 6.24 811 566 A 42 VAL H A 74 ASP HB3 1.0 1.8 3.97 812 567 A 42 VAL H A 74 ASP HB3 1.0 1.8 5.46 813 568 A 42 VAL H A 74 ASP HB2 1.0 1.8 3.89 814 569 A 42 VAL H A 74 ASP HB2 1.0 1.8 5.01 815 570 A 42 VAL H A 75 ILE HA 1.0 1.8 3.87 816 571 A 42 VAL H A 75 ILE HA 1.0 1.8 4.62 817 572 A 42 VAL H A 75 ILE HD1% 1.0 1.8 3.62 818 573 A 42 VAL H A 75 ILE HD1% 1.0 1.8 6.00 819 574 A 42 VAL H A 75 ILE H 1.0 1.8 5.77 820 575 A 43 ALA HA A 44 ALA HA 1.0 1.8 5.17 821 576 A 43 ALA HA A 44 ALA H 1.0 1.8 3.58 822 577 A 43 ALA HA A 71 ILE HG2% 1.0 1.8 4.67 823 578 A 43 ALA HA A 73 TYR HA 1.0 1.8 3.62 824 579 A 43 ALA HA A 73 TYR HA 1.0 1.8 4.92 825 580 A 43 ALA HA A 73 TYR HB3 1.0 1.8 3.86 826 581 A 43 ALA HA A 73 TYR HB2 1.0 1.8 6.02 827 582 A 43 ALA HA A 73 TYR HDx 1.0 1.8 4.72 828 583 A 43 ALA HA A 73 TYR HDx 1.0 1.8 4.55 829 584 A 43 ALA HA A 74 ASP H 1.0 1.8 4.66 830 585 A 43 ALA HB% A 44 ALA HA 1.0 1.8 6.22 831 586 A 43 ALA HB% A 44 ALA H 1.0 1.8 5.97 832 587 A 43 ALA HB% A 46 GLU HGx 1.0 1.8 3.85 833 587 A 43 ALA HB% A 46 GLU HG3 1.0 1.8 3.85 834 588 A 43 ALA HB% A 46 GLU H 1.0 1.8 4.13 835 589 A 43 ALA HB% A 49 PRO HA 1.0 1.8 4.22 836 590 A 43 ALA HB% A 49 PRO HD3 1.0 1.8 5.31 837 591 A 50 ILE HB A 43 ALA HB% 1.0 1.8 4.93 838 592 A 43 ALA HB% A 50 ILE H 1.0 1.8 4.60 839 593 A 43 ALA HB% A 71 ILE HG2% 1.0 1.8 5.26 840 594 A 43 ALA HB% A 73 TYR HA 1.0 1.8 4.71 841 595 A 43 ALA HB% A 73 TYR HA 1.0 1.8 4.81 842 596 A 43 ALA HB% A 73 TYR HB3 1.0 1.8 6.00 843 597 A 43 ALA HB% A 73 TYR HDx 1.0 1.8 4.95 844 598 A 43 ALA HB% A 73 TYR HDx 1.0 1.8 4.60 845 599 A 43 ALA HB% A 43 ALA H 1.0 1.8 3.85 846 600 A 43 ALA H A 49 PRO HA 1.0 1.8 4.03 847 601 A 43 ALA H A 49 PRO HA 1.0 1.8 4.71 848 602 A 44 ALA HA A 45 GLY HA3 1.0 1.8 5.20 849 602 A 44 ALA HA A 45 GLY HA2 1.0 1.8 5.20 850 603 A 44 ALA HA A 46 GLU HGx 1.0 1.8 6.00 851 603 A 44 ALA HA A 46 GLU HG3 1.0 1.8 6.00 852 604 A 44 ALA HA A 46 GLU H 1.0 1.8 4.49 853 605 A 44 ALA HA A 73 TYR HA 1.0 1.8 4.93 854 606 A 44 ALA HB% A 45 GLY HA3 1.0 1.8 4.22 855 606 A 45 GLY HA2 A 44 ALA HB% 1.0 1.8 4.22 856 607 A 44 ALA HB% A 45 GLY HA3 1.0 1.8 4.27 857 608 A 44 ALA HB% A 45 GLY HA3 1.0 1.8 4.91 858 609 A 45 GLY HA2 A 44 ALA HB% 1.0 1.8 4.22 859 610 A 45 GLY HA2 A 44 ALA HB% 1.0 1.8 4.91 860 611 A 44 ALA HB% A 72 ASP HA 1.0 1.8 4.43 861 612 A 44 ALA HB% A 72 ASP HA 1.0 1.8 4.81 862 613 A 44 ALA HB% A 72 ASP HB3 1.0 1.8 3.93 863 613 A 44 ALA HB% A 72 ASP HB2 1.0 1.8 3.93 864 614 A 44 ALA HB% A 72 ASP HB3 1.0 1.8 4.84 865 615 A 44 ALA HB% A 72 ASP HB2 1.0 1.8 5.00 866 616 A 73 TYR HA A 44 ALA HB% 1.0 1.8 3.70 867 617 A 73 TYR HB3 A 44 ALA HB% 1.0 1.8 6.00 868 618 A 74 ASP HB3 A 44 ALA HB% 1.0 1.8 5.19 869 619 A 74 ASP HB2 A 44 ALA HB% 1.0 1.8 4.22 870 620 A 74 ASP HB2 A 44 ALA HB% 1.0 1.8 4.24 871 621 A 74 ASP H A 44 ALA HB% 1.0 1.8 4.32 872 622 A 44 ALA HA A 44 ALA H 1.0 1.8 3.38 873 623 A 44 ALA H A 44 ALA HB% 1.0 1.8 2.90 874 624 A 44 ALA H A 45 GLY H 1.0 1.8 5.16 875 625 A 44 ALA H A 71 ILE HG2% 1.0 1.8 4.75 876 626 A 73 TYR HA A 44 ALA H 1.0 1.8 3.44 877 627 A 73 TYR HA A 44 ALA H 1.0 1.8 4.58 878 628 A 44 ALA H A 73 TYR HB3 1.0 1.8 5.59 879 629 A 74 ASP HB2 A 44 ALA H 1.0 1.8 5.14 880 630 A 74 ASP H A 44 ALA H 1.0 1.8 3.92 881 631 A 46 GLU HA A 45 GLY HA3 1.0 1.8 5.07 882 631 A 45 GLY HA2 A 46 GLU HA 1.0 1.8 5.07 883 632 A 46 GLU H A 45 GLY HA3 1.0 1.8 3.60 884 632 A 46 GLU H A 45 GLY HA2 1.0 1.8 3.60 885 633 A 45 GLY HA2 A 45 GLY HA3 1.0 1.8 5.94 886 634 A 46 GLU HA A 46 GLU HB3 1.0 1.8 2.90 887 634 A 46 GLU HA A 46 GLU HBx 1.0 1.8 2.90 888 635 A 46 GLU HA A 46 GLU HGx 1.0 1.8 3.67 889 635 A 46 GLU HG3 A 46 GLU HA 1.0 1.8 3.67 890 636 A 46 GLU HA A 47 GLY HAx 1.0 1.8 4.19 891 636 A 46 GLU HA A 47 GLY HAy 1.0 1.8 4.19 892 637 A 46 GLU HA A 47 GLY H 1.0 1.8 5.29 893 638 A 46 GLU HBx A 47 GLY HAx 1.0 1.8 4.94 894 638 A 47 GLY HAy A 46 GLU HB3 1.0 1.8 4.94 895 638 A 46 GLU HBx A 47 GLY HAy 1.0 1.8 4.94 896 638 A 46 GLU HB3 A 47 GLY HAx 1.0 1.8 4.94 897 639 A 46 GLU HBx A 47 GLY H 1.0 1.8 4.09 898 640 A 71 ILE HB A 46 GLU HGx 1.0 1.8 6.00 899 640 A 46 GLU HG3 A 71 ILE HB 1.0 1.8 6.00 900 641 A 71 ILE HG13 A 46 GLU HGx 1.0 1.8 5.36 901 641 A 46 GLU HG3 A 71 ILE HG13 1.0 1.8 5.36 902 642 A 71 ILE HG1x A 46 GLU HGx 1.0 1.8 4.65 903 642 A 46 GLU HG3 A 71 ILE HG1x 1.0 1.8 4.65 904 643 A 71 ILE HG2% A 46 GLU HGx 1.0 1.8 4.02 905 643 A 71 ILE HG2% A 46 GLU HG3 1.0 1.8 4.02 906 644 A 46 GLU H A 46 GLU HB3 1.0 1.8 3.60 907 644 A 46 GLU H A 46 GLU HBx 1.0 1.8 3.60 908 645 A 46 GLU H A 46 GLU HGx 1.0 1.8 4.01 909 645 A 46 GLU HG3 A 46 GLU H 1.0 1.8 4.01 910 646 A 46 GLU H A 47 GLY H 1.0 1.8 4.30 911 647 A 48 ILE HD1% A 47 GLY HAx 1.0 1.8 4.96 912 647 A 47 GLY HAy A 48 ILE HD1% 1.0 1.8 4.96 913 648 A 48 ILE HD1% A 48 ILE HA 1.0 1.8 4.18 914 649 A 48 ILE HA A 48 ILE HG13 1.0 1.8 3.89 915 650 A 48 ILE HA A 48 ILE HG1x 1.0 1.8 3.70 916 651 A 48 ILE HA A 48 ILE HG2% 1.0 1.8 3.46 917 652 A 48 ILE HA A 49 PRO HD2 1.0 1.8 3.35 918 653 A 48 ILE HG13 A 48 ILE HB 1.0 1.8 3.28 919 654 A 48 ILE HG1x A 48 ILE HB 1.0 1.8 3.50 920 655 A 49 PRO HD2 A 48 ILE HB 1.0 1.8 4.54 921 656 A 49 PRO HD3 A 48 ILE HG13 1.0 1.8 4.07 922 657 A 48 ILE HG13 A 49 PRO HD2 1.0 1.8 3.85 923 658 A 49 PRO HD3 A 48 ILE HG1x 1.0 1.8 4.57 924 659 A 48 ILE HG1x A 49 PRO HD2 1.0 1.8 4.08 925 660 A 48 ILE HG1x A 49 PRO HD2 1.0 1.8 4.14 926 661 A 49 PRO HG2 A 48 ILE HG1x 1.0 1.8 4.42 927 662 A 48 ILE HG1x A 48 ILE HG2% 1.0 1.8 2.90 928 663 A 49 PRO HD3 A 48 ILE HG2% 1.0 1.8 4.11 929 664 A 49 PRO HD3 A 48 ILE HG2% 1.0 1.8 5.33 930 665 A 48 ILE HG2% A 49 PRO HD2 1.0 1.8 3.40 931 666 A 48 ILE HG2% A 49 PRO HD2 1.0 1.8 5.11 932 667 A 49 PRO HG2 A 48 ILE HG2% 1.0 1.8 3.65 933 668 A 50 ILE HD1% A 49 PRO HA 1.0 1.8 5.06 934 669 A 49 PRO HA A 50 ILE HG13 1.0 1.8 4.14 935 670 A 49 PRO HA A 50 ILE HG13 1.0 1.8 4.21 936 671 A 50 ILE H A 49 PRO HA 1.0 1.8 2.96 937 672 A 50 ILE H A 49 PRO HB2 1.0 1.8 4.54 938 672 A 49 PRO HB3 A 50 ILE H 1.0 1.8 4.54 939 673 A 50 ILE H A 49 PRO HG2 1.0 1.8 5.40 940 674 A 68 GLU H A 50 ILE HD1% 1.0 1.8 5.64 941 675 A 50 ILE HD1% A 73 TYR HB2 1.0 1.8 6.00 942 676 A 50 ILE HG12 A 67 LEU HBx 1.0 1.8 5.83 943 676 A 50 ILE HG13 A 67 LEU HBx 1.0 1.8 5.83 944 676 A 67 LEU HB3 A 50 ILE HG13 1.0 1.8 5.83 945 676 A 67 LEU HB3 A 50 ILE HG12 1.0 1.8 5.83 946 677 A 67 LEU HD2% A 50 ILE HG13 1.0 1.8 4.40 947 677 A 67 LEU HD2% A 50 ILE HG12 1.0 1.8 4.40 948 678 A 68 GLU H A 50 ILE HG13 1.0 1.8 5.84 949 678 A 68 GLU H A 50 ILE HG12 1.0 1.8 5.84 950 679 A 52 GLU HA A 51 PHE HA 1.0 1.8 5.44 951 680 A 51 PHE HA A 52 GLU H 1.0 1.8 3.36 952 681 A 52 GLU H A 51 PHE HBx 1.0 1.8 4.54 953 681 A 51 PHE HBy A 52 GLU H 1.0 1.8 4.54 954 682 A 64 VAL HG1% A 51 PHE HBx 1.0 1.8 6.34 955 682 A 64 VAL HG1% A 51 PHE HBy 1.0 1.8 6.34 956 683 A 52 GLU HA A 53 ASP HA 1.0 1.8 4.22 957 684 A 52 GLU HA A 53 ASP HA 1.0 1.8 5.11 958 685 A 52 GLU HA A 53 ASP HB2 1.0 1.8 3.79 959 686 A 52 GLU HA A 53 ASP HB2 1.0 1.8 5.19 960 687 A 52 GLU HA A 53 ASP H 1.0 1.8 2.91 961 688 A 52 GLU HB2 A 53 ASP H 1.0 1.8 4.18 962 689 A 53 ASP HA A 52 GLU HG3 1.0 1.8 5.08 963 689 A 52 GLU HGx A 53 ASP HA 1.0 1.8 5.08 964 690 A 52 GLU HGx A 53 ASP HA 1.0 1.8 3.83 965 691 A 52 GLU H A 52 GLU HG3 1.0 1.8 4.40 966 691 A 52 GLU HGx A 52 GLU H 1.0 1.8 4.40 967 692 A 53 ASP H A 52 GLU H 1.0 1.8 5.39 968 693 A 53 ASP HA A 53 ASP HB3 1.0 1.8 3.31 969 694 A 54 PHE HA A 53 ASP HA 1.0 1.8 5.69 970 695 A 53 ASP HA A 54 PHE HB2 1.0 1.8 5.21 971 695 A 54 PHE HB3 A 53 ASP HA 1.0 1.8 5.21 972 696 A 53 ASP HA A 54 PHE HDy 1.0 1.8 6.34 973 697 A 53 ASP HA A 54 PHE H 1.0 1.8 3.07 974 698 A 54 PHE HA A 53 ASP HB3 1.0 1.8 5.20 975 699 A 53 ASP HB3 A 54 PHE HB2 1.0 1.8 5.83 976 699 A 54 PHE HB3 A 53 ASP HB3 1.0 1.8 5.83 977 700 A 53 ASP HB3 A 54 PHE H 1.0 1.8 3.60 978 701 A 53 ASP HB3 A 62 TYR HEx 1.0 1.8 5.06 979 702 A 53 ASP HB2 A 54 PHE H 1.0 1.8 4.44 980 703 A 64 VAL HG1% A 53 ASP HB2 1.0 1.8 4.00 981 704 A 53 ASP HB2 A 53 ASP H 1.0 1.8 3.60 982 705 A 53 ASP H A 64 VAL HG2% 1.0 1.8 5.12 983 705 A 64 VAL HG1% A 53 ASP H 1.0 1.8 5.12 984 706 A 54 PHE HA A 55 VAL HA 1.0 1.8 5.57 985 707 A 54 PHE HA A 55 VAL H 1.0 1.8 3.27 986 708 A 54 PHE HDy A 54 PHE HB2 1.0 1.8 3.21 987 708 A 54 PHE HB3 A 54 PHE HDy 1.0 1.8 3.21 988 709 A 55 VAL H A 54 PHE HB2 1.0 1.8 4.44 989 709 A 54 PHE HB3 A 55 VAL H 1.0 1.8 4.44 990 710 A 54 PHE H A 54 PHE HB2 1.0 1.8 3.32 991 710 A 54 PHE HB3 A 54 PHE H 1.0 1.8 3.32 992 711 A 54 PHE H A 54 PHE HDy 1.0 1.8 5.33 993 712 A 55 VAL H A 54 PHE H 1.0 1.8 5.29 994 713 A 55 VAL HB A 55 VAL HA 1.0 1.8 3.48 995 714 A 55 VAL HG2% A 55 VAL HA 1.0 1.8 3.20 996 715 A 55 VAL HA A 56 ASP HA 1.0 1.8 5.03 997 716 A 56 ASP H A 55 VAL HA 1.0 1.8 3.06 998 717 A 55 VAL HA A 59 VAL HG2% 1.0 1.8 4.11 999 717 A 59 VAL HG1% A 55 VAL HA 1.0 1.8 4.11 1000 718 A 62 TYR HD% A 55 VAL HA 1.0 1.8 5.10 1001 719 A 62 TYR HEx A 55 VAL HA 1.0 1.8 5.15 1002 719 A 55 VAL HA A 62 TYR HEy 1.0 1.8 5.15 1003 720 A 56 ASP H A 55 VAL HB 1.0 1.8 4.87 1004 721 A 55 VAL HB A 59 VAL HB 1.0 1.8 6.00 1005 722 A 59 VAL HG1% A 55 VAL HB 1.0 1.8 5.07 1006 723 A 55 VAL HB A 59 VAL HG2% 1.0 1.8 5.07 1007 724 A 55 VAL HB A 62 TYR HA 1.0 1.8 5.28 1008 725 A 55 VAL HB A 62 TYR HD% 1.0 1.8 4.25 1009 726 A 55 VAL HB A 62 TYR HEx 1.0 1.8 4.59 1010 726 A 55 VAL HB A 62 TYR HEy 1.0 1.8 4.59 1011 727 A 56 ASP HA A 55 VAL HG1% 1.0 1.8 4.52 1012 728 A 56 ASP H A 55 VAL HG1% 1.0 1.8 3.92 1013 729 A 55 VAL HG1% A 59 VAL HG2% 1.0 1.8 3.66 1014 729 A 59 VAL HG1% A 55 VAL HG1% 1.0 1.8 3.66 1015 730 A 59 VAL HG1% A 55 VAL HG1% 1.0 1.8 4.23 1016 731 A 55 VAL HG1% A 59 VAL HG2% 1.0 1.8 4.23 1017 732 A 61 TYR HA A 55 VAL HG1% 1.0 1.8 4.92 1018 733 A 62 TYR HA A 55 VAL HG1% 1.0 1.8 4.20 1019 734 A 62 TYR HB3 A 55 VAL HG1% 1.0 1.8 4.11 1020 735 A 62 TYR HB2 A 55 VAL HG1% 1.0 1.8 4.15 1021 736 A 55 VAL HG2% A 56 ASP HA 1.0 1.8 5.29 1022 737 A 55 VAL HG2% A 56 ASP HB2 1.0 1.8 4.48 1023 738 A 56 ASP H A 55 VAL HG2% 1.0 1.8 3.53 1024 739 A 55 VAL HG2% A 59 VAL HG2% 1.0 1.8 3.01 1025 739 A 59 VAL HG1% A 55 VAL HG2% 1.0 1.8 3.01 1026 740 A 55 VAL HG2% A 62 TYR HA 1.0 1.8 4.25 1027 741 A 62 TYR HB3 A 55 VAL HG2% 1.0 1.8 4.42 1028 742 A 62 TYR HB3 A 55 VAL HG2% 1.0 1.8 4.58 1029 743 A 62 TYR HB2 A 55 VAL HG2% 1.0 1.8 4.32 1030 744 A 55 VAL HG2% A 62 TYR HD% 1.0 1.8 3.66 1031 745 A 55 VAL HG2% A 62 TYR HEx 1.0 1.8 3.67 1032 745 A 55 VAL HG2% A 62 TYR HEy 1.0 1.8 3.67 1033 746 A 55 VAL H A 55 VAL HB 1.0 1.8 4.64 1034 747 A 55 VAL H A 55 VAL HG1% 1.0 1.8 3.41 1035 748 A 55 VAL H A 55 VAL HG2% 1.0 1.8 4.54 1036 749 A 56 ASP HA A 56 ASP HB2 1.0 1.8 3.42 1037 750 A 56 ASP HA A 57 SER HB3 1.0 1.8 4.92 1038 750 A 56 ASP HA A 57 SER HBx 1.0 1.8 4.92 1039 751 A 56 ASP HA A 57 SER H 1.0 1.8 3.40 1040 752 A 56 ASP HA A 58 SER H 1.0 1.8 5.24 1041 753 A 56 ASP HA A 59 VAL HG2% 1.0 1.8 4.39 1042 753 A 59 VAL HG1% A 56 ASP HA 1.0 1.8 4.39 1043 754 A 57 SER H A 56 ASP HB3 1.0 1.8 4.34 1044 755 A 56 ASP HB3 A 58 SER HB3 1.0 1.8 5.66 1045 755 A 56 ASP HB3 A 58 SER HBx 1.0 1.8 5.66 1046 756 A 58 SER H A 56 ASP HB3 1.0 1.8 4.05 1047 757 A 59 VAL HB A 56 ASP HB3 1.0 1.8 5.28 1048 758 A 56 ASP HB3 A 59 VAL HG2% 1.0 1.8 3.50 1049 758 A 59 VAL HG1% A 56 ASP HB3 1.0 1.8 3.50 1050 759 A 56 ASP HB3 A 59 VAL H 1.0 1.8 4.36 1051 760 A 56 ASP HB2 A 57 SER H 1.0 1.8 4.63 1052 761 A 56 ASP HB2 A 58 SER HBx 1.0 1.8 3.69 1053 762 A 56 ASP HB2 A 58 SER H 1.0 1.8 5.23 1054 763 A 56 ASP HB2 A 59 VAL HA 1.0 1.8 6.00 1055 764 A 59 VAL HB A 56 ASP HB2 1.0 1.8 6.00 1056 765 A 56 ASP HB2 A 59 VAL HG2% 1.0 1.8 3.24 1057 765 A 59 VAL HG1% A 56 ASP HB2 1.0 1.8 3.24 1058 766 A 56 ASP HB2 A 59 VAL H 1.0 1.8 5.64 1059 767 A 56 ASP H A 56 ASP HB3 1.0 1.8 4.00 1060 768 A 56 ASP H A 56 ASP HB2 1.0 1.8 3.13 1061 769 A 56 ASP H A 59 VAL HG2% 1.0 1.8 3.92 1062 769 A 59 VAL HG1% A 56 ASP H 1.0 1.8 3.92 1063 770 A 57 SER H A 57 SER HB3 1.0 1.8 4.02 1064 770 A 57 SER HBx A 57 SER H 1.0 1.8 4.02 1065 771 A 57 SER H A 58 SER H 1.0 1.8 4.24 1066 772 A 59 VAL HB A 57 SER H 1.0 1.8 6.00 1067 773 A 57 SER H A 59 VAL HG2% 1.0 1.8 5.07 1068 773 A 59 VAL HG1% A 57 SER H 1.0 1.8 5.07 1069 774 A 57 SER H A 59 VAL H 1.0 1.8 6.00 1070 775 A 58 SER HA A 58 SER HB3 1.0 1.8 3.02 1071 775 A 58 SER HBx A 58 SER HA 1.0 1.8 3.02 1072 776 A 59 VAL H A 58 SER HA 1.0 1.8 4.24 1073 777 A 59 VAL HA A 58 SER HB3 1.0 1.8 4.29 1074 777 A 58 SER HBx A 59 VAL HA 1.0 1.8 4.29 1075 778 A 58 SER HBx A 59 VAL HG2% 1.0 1.8 4.26 1076 778 A 58 SER HB3 A 59 VAL HG2% 1.0 1.8 4.26 1077 778 A 59 VAL HG1% A 58 SER HB3 1.0 1.8 4.26 1078 778 A 59 VAL HG1% A 58 SER HBx 1.0 1.8 4.26 1079 779 A 59 VAL H A 58 SER HB3 1.0 1.8 4.13 1080 779 A 58 SER HBx A 59 VAL H 1.0 1.8 4.13 1081 780 A 58 SER H A 58 SER HB3 1.0 1.8 3.44 1082 780 A 58 SER H A 58 SER HBx 1.0 1.8 3.44 1083 781 A 58 SER H A 59 VAL HA 1.0 1.8 6.00 1084 782 A 59 VAL HB A 58 SER H 1.0 1.8 5.94 1085 783 A 58 SER H A 59 VAL HG2% 1.0 1.8 4.56 1086 783 A 59 VAL HG1% A 58 SER H 1.0 1.8 4.56 1087 784 A 58 SER H A 59 VAL H 1.0 1.8 3.60 1088 785 A 59 VAL HA A 59 VAL HG2% 1.0 1.8 2.71 1089 785 A 59 VAL HG1% A 59 VAL HA 1.0 1.8 2.71 1090 786 A 59 VAL HG1% A 59 VAL HA 1.0 1.8 3.09 1091 787 A 59 VAL HA A 59 VAL HG2% 1.0 1.8 3.09 1092 788 A 61 TYR HD% A 59 VAL HA 1.0 1.8 6.00 1093 789 A 59 VAL HB A 60 GLY HA3 1.0 1.8 5.69 1094 789 A 60 GLY HA2 A 59 VAL HB 1.0 1.8 5.69 1095 790 A 59 VAL HB A 60 GLY H 1.0 1.8 4.51 1096 791 A 61 TYR HD% A 59 VAL HB 1.0 1.8 6.00 1097 792 A 59 VAL HB A 61 TYR H 1.0 1.8 3.89 1098 793 A 59 VAL HB A 62 TYR HA 1.0 1.8 6.00 1099 794 A 62 TYR HB2 A 59 VAL HB 1.0 1.8 5.97 1100 795 A 59 VAL HG1% A 60 GLY HA3 1.0 1.8 5.21 1101 795 A 59 VAL HG2% A 60 GLY HA3 1.0 1.8 5.21 1102 795 A 60 GLY HA2 A 59 VAL HG2% 1.0 1.8 5.21 1103 795 A 59 VAL HG1% A 60 GLY HA2 1.0 1.8 5.21 1104 796 A 60 GLY H A 59 VAL HG2% 1.0 1.8 4.01 1105 796 A 59 VAL HG1% A 60 GLY H 1.0 1.8 4.01 1106 797 A 61 TYR HA A 59 VAL HG2% 1.0 1.8 4.85 1107 797 A 61 TYR HA A 59 VAL HG1% 1.0 1.8 4.85 1108 798 A 61 TYR HD% A 59 VAL HG2% 1.0 1.8 3.87 1109 798 A 61 TYR HD% A 59 VAL HG1% 1.0 1.8 3.87 1110 799 A 61 TYR H A 59 VAL HG2% 1.0 1.8 3.19 1111 799 A 59 VAL HG1% A 61 TYR H 1.0 1.8 3.19 1112 800 A 62 TYR HD% A 59 VAL HG2% 1.0 1.8 4.08 1113 800 A 59 VAL HG1% A 62 TYR HD% 1.0 1.8 4.08 1114 801 A 59 VAL HG1% A 62 TYR HA 1.0 1.8 4.31 1115 802 A 59 VAL HG1% A 62 TYR HD% 1.0 1.8 5.52 1116 803 A 62 TYR HD% A 59 VAL HG2% 1.0 1.8 5.52 1117 804 A 59 VAL HB A 59 VAL H 1.0 1.8 3.34 1118 805 A 59 VAL H A 59 VAL HG2% 1.0 1.8 3.07 1119 805 A 59 VAL HG1% A 59 VAL H 1.0 1.8 3.07 1120 806 A 59 VAL HG1% A 59 VAL H 1.0 1.8 4.35 1121 807 A 59 VAL H A 59 VAL HG2% 1.0 1.8 4.35 1122 808 A 59 VAL H A 60 GLY H 1.0 1.8 4.71 1123 809 A 60 GLY HA3 A 61 TYR HB3 1.0 1.8 5.68 1124 809 A 60 GLY HA2 A 61 TYR HB3 1.0 1.8 5.68 1125 809 A 61 TYR HB2 A 60 GLY HA3 1.0 1.8 5.68 1126 809 A 61 TYR HB2 A 60 GLY HA2 1.0 1.8 5.68 1127 810 A 61 TYR HA A 61 TYR HD% 1.0 1.8 4.30 1128 811 A 62 TYR H A 61 TYR HA 1.0 1.8 3.16 1129 812 A 62 TYR H A 61 TYR HB3 1.0 1.8 4.64 1130 812 A 62 TYR H A 61 TYR HB2 1.0 1.8 4.64 1131 813 A 61 TYR HD% A 62 TYR HA 1.0 1.8 3.96 1132 814 A 62 TYR H A 61 TYR HD% 1.0 1.8 4.28 1133 815 A 61 TYR HD% A 63 THR H 1.0 1.8 5.02 1134 816 A 61 TYR H A 61 TYR HB3 1.0 1.8 3.95 1135 816 A 61 TYR HB2 A 61 TYR H 1.0 1.8 3.95 1136 817 A 61 TYR H A 61 TYR HB3 1.0 1.8 4.57 1137 818 A 61 TYR HB2 A 61 TYR H 1.0 1.8 4.57 1138 819 A 61 TYR HD% A 61 TYR H 1.0 1.8 4.28 1139 820 A 62 TYR H A 61 TYR H 1.0 1.8 5.43 1140 821 A 62 TYR HD% A 62 TYR HA 1.0 1.8 3.41 1141 822 A 63 THR HB A 62 TYR HA 1.0 1.8 4.47 1142 823 A 63 THR HB A 62 TYR HA 1.0 1.8 4.56 1143 824 A 63 THR H A 62 TYR HA 1.0 1.8 2.92 1144 825 A 62 TYR HB3 A 62 TYR HB2 1.0 1.8 4.73 1145 826 A 62 TYR HB3 A 63 THR H 1.0 1.8 4.32 1146 827 A 62 TYR HB3 A 62 TYR HB2 1.0 1.8 4.65 1147 828 A 62 TYR HB2 A 63 THR H 1.0 1.8 5.08 1148 829 A 63 THR HB A 62 TYR HD% 1.0 1.8 5.80 1149 830 A 62 TYR HD% A 63 THR H 1.0 1.8 3.74 1150 831 A 64 VAL H A 62 TYR HD% 1.0 1.8 6.00 1151 832 A 63 THR HB A 62 TYR HEx 1.0 1.8 6.00 1152 832 A 63 THR HB A 62 TYR HEy 1.0 1.8 6.00 1153 833 A 63 THR H A 62 TYR HEx 1.0 1.8 5.32 1154 833 A 63 THR H A 62 TYR HEy 1.0 1.8 5.32 1155 834 A 62 TYR HB3 A 62 TYR H 1.0 1.8 4.04 1156 835 A 62 TYR H A 62 TYR HB2 1.0 1.8 4.68 1157 836 A 62 TYR H A 63 THR H 1.0 1.8 4.91 1158 837 A 63 THR HG2% A 63 THR HA 1.0 1.8 3.18 1159 838 A 64 VAL HG1% A 63 THR HA 1.0 1.8 4.28 1160 839 A 63 THR HA A 64 VAL HG2% 1.0 1.8 4.04 1161 840 A 64 VAL H A 63 THR HA 1.0 1.8 2.99 1162 841 A 64 VAL H A 63 THR HB 1.0 1.8 5.04 1163 842 A 63 THR HG2% A 64 VAL HA 1.0 1.8 4.55 1164 843 A 63 THR HG2% A 64 VAL H 1.0 1.8 3.79 1165 844 A 63 THR HG2% A 65 THR HG2% 1.0 1.8 3.35 1166 845 A 63 THR HB A 63 THR H 1.0 1.8 3.27 1167 846 A 63 THR HG2% A 63 THR H 1.0 1.8 4.33 1168 847 A 63 THR H A 64 VAL HA 1.0 1.8 4.91 1169 848 A 64 VAL HG1% A 63 THR H 1.0 1.8 4.46 1170 849 A 63 THR H A 64 VAL HG2% 1.0 1.8 4.59 1171 850 A 64 VAL H A 63 THR H 1.0 1.8 4.83 1172 851 A 64 VAL HA A 64 VAL HG2% 1.0 1.8 3.36 1173 851 A 64 VAL HG1% A 64 VAL HA 1.0 1.8 3.36 1174 852 A 64 VAL HG1% A 64 VAL HA 1.0 1.8 3.81 1175 853 A 64 VAL HA A 64 VAL HG2% 1.0 1.8 3.81 1176 854 A 65 THR HG2% A 64 VAL HA 1.0 1.8 4.17 1177 855 A 65 THR HG2% A 64 VAL HA 1.0 1.8 5.37 1178 856 A 64 VAL HA A 65 THR H 1.0 1.8 3.86 1179 857 A 67 LEU HD1% A 64 VAL HB 1.0 1.8 4.16 1180 858 A 65 THR HA A 64 VAL HG2% 1.0 1.8 4.87 1181 858 A 64 VAL HG1% A 65 THR HA 1.0 1.8 4.87 1182 859 A 65 THR HB A 64 VAL HG2% 1.0 1.8 5.94 1183 859 A 64 VAL HG1% A 65 THR HB 1.0 1.8 5.94 1184 860 A 65 THR HG2% A 64 VAL HG2% 1.0 1.8 4.87 1185 860 A 64 VAL HG1% A 65 THR HG2% 1.0 1.8 4.87 1186 861 A 64 VAL HB A 64 VAL H 1.0 1.8 4.35 1187 862 A 64 VAL H A 64 VAL HG2% 1.0 1.8 3.37 1188 862 A 64 VAL HG1% A 64 VAL H 1.0 1.8 3.37 1189 863 A 64 VAL HG1% A 64 VAL H 1.0 1.8 4.18 1190 864 A 64 VAL H A 64 VAL HG2% 1.0 1.8 4.18 1191 865 A 64 VAL H A 65 THR HG2% 1.0 1.8 4.17 1192 866 A 65 THR HA A 66 GLY HA3 1.0 1.8 4.26 1193 867 A 66 GLY H A 65 THR HA 1.0 1.8 3.38 1194 868 A 67 LEU HD1% A 65 THR HA 1.0 1.8 5.59 1195 869 A 67 LEU HD2% A 65 THR HA 1.0 1.8 5.78 1196 870 A 67 LEU H A 65 THR HA 1.0 1.8 5.32 1197 871 A 65 THR HB A 66 GLY HA3 1.0 1.8 4.72 1198 872 A 65 THR HB A 66 GLY HA3 1.0 1.8 5.60 1199 873 A 66 GLY H A 65 THR HB 1.0 1.8 3.18 1200 874 A 67 LEU H A 65 THR HB 1.0 1.8 5.18 1201 875 A 66 GLY H A 65 THR HG2% 1.0 1.8 4.91 1202 876 A 67 LEU HG A 65 THR H 1.0 1.8 6.00 1203 877 A 66 GLY HA2 A 67 LEU HA 1.0 1.8 5.08 1204 878 A 67 LEU HD2% A 66 GLY HA2 1.0 1.8 5.48 1205 879 A 66 GLY HA2 A 67 LEU HG 1.0 1.8 6.00 1206 880 A 67 LEU H A 66 GLY HA2 1.0 1.8 3.81 1207 881 A 66 GLY HA2 A 68 GLU HGx 1.0 1.8 5.85 1208 882 A 66 GLY H A 66 GLY HA2 1.0 1.8 3.27 1209 883 A 66 GLY H A 67 LEU HD2% 1.0 1.8 4.91 1210 884 A 66 GLY H A 67 LEU HG 1.0 1.8 4.37 1211 885 A 66 GLY H A 67 LEU H 1.0 1.8 3.46 1212 886 A 67 LEU HA A 67 LEU HBx 1.0 1.8 3.31 1213 886 A 67 LEU HB3 A 67 LEU HA 1.0 1.8 3.31 1214 887 A 67 LEU HD1% A 67 LEU HA 1.0 1.8 4.50 1215 888 A 67 LEU HD2% A 67 LEU HA 1.0 1.8 3.39 1216 889 A 68 GLU H A 67 LEU HA 1.0 1.8 3.30 1217 890 A 67 LEU HD1% A 67 LEU HBx 1.0 1.8 3.55 1218 890 A 67 LEU HB3 A 67 LEU HD1% 1.0 1.8 3.55 1219 891 A 67 LEU HD2% A 67 LEU HBx 1.0 1.8 3.68 1220 891 A 67 LEU HB3 A 67 LEU HD2% 1.0 1.8 3.68 1221 892 A 68 GLU H A 67 LEU HBx 1.0 1.8 3.32 1222 892 A 67 LEU HB3 A 68 GLU H 1.0 1.8 3.32 1223 893 A 67 LEU HD1% A 68 GLU H 1.0 1.8 5.24 1224 894 A 67 LEU HD1% A 75 ILE HG2% 1.0 1.8 4.02 1225 895 A 67 LEU HD1% A 75 ILE HG2% 1.0 1.8 5.15 1226 896 A 67 LEU HD2% A 68 GLU H 1.0 1.8 4.42 1227 897 A 67 LEU HD2% A 71 ILE HG2% 1.0 1.8 6.00 1228 898 A 67 LEU HD2% A 75 ILE HD1% 1.0 1.8 5.97 1229 899 A 67 LEU H A 67 LEU HBx 1.0 1.8 4.11 1230 899 A 67 LEU HB3 A 67 LEU H 1.0 1.8 4.11 1231 900 A 67 LEU HD1% A 67 LEU H 1.0 1.8 4.65 1232 901 A 67 LEU HD2% A 67 LEU H 1.0 1.8 3.98 1233 902 A 67 LEU H A 67 LEU HG 1.0 1.8 4.15 1234 903 A 67 LEU H A 68 GLU H 1.0 1.8 5.16 1235 904 A 69 PRO HD2 A 68 GLU HA 1.0 1.8 5.39 1236 905 A 69 PRO HGx A 68 GLU HA 1.0 1.8 5.11 1237 906 A 68 GLU HB2 A 71 ILE HD1% 1.0 1.8 4.52 1238 907 A 71 ILE HG2% A 68 GLU HB2 1.0 1.8 3.74 1239 908 A 69 PRO HD2 A 68 GLU HGx 1.0 1.8 4.80 1240 909 A 68 GLU HGx A 71 ILE HD1% 1.0 1.8 4.86 1241 910 A 71 ILE HG2% A 68 GLU HGx 1.0 1.8 4.24 1242 911 A 68 GLU H A 69 PRO HD3 1.0 1.8 5.41 1243 911 A 69 PRO HD2 A 68 GLU H 1.0 1.8 5.41 1244 912 A 68 GLU H A 71 ILE HB 1.0 1.8 6.00 1245 913 A 68 GLU H A 71 ILE HG2% 1.0 1.8 5.93 1246 914 A 69 PRO HA A 70 GLY HA3 1.0 1.8 4.22 1247 915 A 69 PRO HA A 70 GLY HA2 1.0 1.8 4.22 1248 916 A 69 PRO HA A 70 GLY H 1.0 1.8 3.29 1249 917 A 69 PRO HA A 71 ILE HD1% 1.0 1.8 5.96 1250 918 A 69 PRO HA A 71 ILE H 1.0 1.8 5.14 1251 919 A 70 GLY H A 69 PRO HB3 1.0 1.8 4.55 1252 920 A 69 PRO HB2 A 70 GLY HA3 1.0 1.8 4.77 1253 920 A 69 PRO HB2 A 70 GLY HA2 1.0 1.8 4.77 1254 921 A 69 PRO HB2 A 70 GLY HA3 1.0 1.8 5.63 1255 922 A 69 PRO HB2 A 70 GLY HA2 1.0 1.8 5.63 1256 923 A 69 PRO HB2 A 70 GLY H 1.0 1.8 4.13 1257 924 A 71 ILE HD1% A 69 PRO HD3 1.0 1.8 5.83 1258 924 A 69 PRO HD2 A 71 ILE HD1% 1.0 1.8 5.83 1259 925 A 71 ILE HB A 69 PRO HG3 1.0 1.8 6.00 1260 925 A 69 PRO HGx A 71 ILE HB 1.0 1.8 6.00 1261 926 A 69 PRO HGx A 70 GLY H 1.0 1.8 4.43 1262 927 A 70 GLY HA2 A 70 GLY HA3 1.0 1.8 5.67 1263 928 A 71 ILE HD1% A 70 GLY HA3 1.0 1.8 6.00 1264 929 A 71 ILE H A 70 GLY HA3 1.0 1.8 4.15 1265 930 A 70 GLY HA2 A 70 GLY HA3 1.0 1.8 5.58 1266 931 A 71 ILE HD1% A 70 GLY HA2 1.0 1.8 6.00 1267 932 A 71 ILE H A 70 GLY HA2 1.0 1.8 4.15 1268 933 A 71 ILE HB A 70 GLY H 1.0 1.8 6.00 1269 934 A 71 ILE HD1% A 70 GLY H 1.0 1.8 5.18 1270 935 A 70 GLY H A 71 ILE H 1.0 1.8 3.85 1271 936 A 71 ILE HD1% A 71 ILE HA 1.0 1.8 3.55 1272 937 A 71 ILE HG13 A 71 ILE HA 1.0 1.8 3.57 1273 938 A 71 ILE HG1x A 71 ILE HA 1.0 1.8 4.14 1274 939 A 71 ILE HG2% A 71 ILE HA 1.0 1.8 3.45 1275 940 A 72 ASP HA A 71 ILE HA 1.0 1.8 4.80 1276 941 A 72 ASP HA A 71 ILE HA 1.0 1.8 4.99 1277 942 A 71 ILE HA A 72 ASP HB3 1.0 1.8 4.34 1278 943 A 72 ASP HB2 A 71 ILE HA 1.0 1.8 4.23 1279 944 A 71 ILE HA A 72 ASP H 1.0 1.8 2.91 1280 945 A 71 ILE HB A 71 ILE HD1% 1.0 1.8 3.45 1281 946 A 71 ILE HB A 72 ASP H 1.0 1.8 4.89 1282 947 A 71 ILE HD1% A 72 ASP H 1.0 1.8 4.58 1283 948 A 71 ILE HG13 A 72 ASP H 1.0 1.8 5.40 1284 949 A 71 ILE HG1x A 72 ASP H 1.0 1.8 5.52 1285 950 A 71 ILE HG2% A 71 ILE HG13 1.0 1.8 3.35 1286 951 A 71 ILE HG2% A 71 ILE HG1x 1.0 1.8 3.38 1287 952 A 71 ILE HG2% A 72 ASP HA 1.0 1.8 5.40 1288 953 A 71 ILE HG2% A 72 ASP HB3 1.0 1.8 3.66 1289 954 A 71 ILE HG2% A 72 ASP HB2 1.0 1.8 4.79 1290 955 A 71 ILE HG2% A 72 ASP H 1.0 1.8 3.41 1291 956 A 71 ILE HG2% A 73 TYR H 1.0 1.8 5.02 1292 957 A 71 ILE HB A 71 ILE H 1.0 1.8 3.59 1293 958 A 71 ILE HD1% A 71 ILE H 1.0 1.8 4.72 1294 959 A 71 ILE HG13 A 71 ILE H 1.0 1.8 5.23 1295 960 A 71 ILE HG1x A 71 ILE H 1.0 1.8 5.43 1296 961 A 71 ILE HG2% A 71 ILE H 1.0 1.8 4.56 1297 962 A 71 ILE H A 72 ASP H 1.0 1.8 4.94 1298 963 A 72 ASP HA A 73 TYR H 1.0 1.8 3.01 1299 964 A 73 TYR H A 72 ASP HB3 1.0 1.8 4.11 1300 964 A 72 ASP HB2 A 73 TYR H 1.0 1.8 4.11 1301 965 A 73 TYR H A 72 ASP HB3 1.0 1.8 4.84 1302 966 A 72 ASP HB2 A 73 TYR H 1.0 1.8 4.84 1303 967 A 72 ASP H A 72 ASP HB3 1.0 1.8 3.26 1304 967 A 72 ASP HB2 A 72 ASP H 1.0 1.8 3.26 1305 968 A 72 ASP H A 73 TYR H 1.0 1.8 5.20 1306 969 A 74 ASP H A 73 TYR HA 1.0 1.8 2.92 1307 970 A 73 TYR HA A 75 ILE HD1% 1.0 1.8 4.63 1308 971 A 73 TYR HB3 A 75 ILE HD1% 1.0 1.8 4.74 1309 972 A 74 ASP H A 73 TYR HB2 1.0 1.8 4.94 1310 973 A 73 TYR HB2 A 75 ILE HD1% 1.0 1.8 5.20 1311 974 A 73 TYR HDx A 75 ILE HD1% 1.0 1.8 4.23 1312 974 A 75 ILE HD1% A 73 TYR HDy 1.0 1.8 4.23 1313 975 A 75 ILE HG2% A 73 TYR HDx 1.0 1.8 4.38 1314 975 A 75 ILE HG2% A 73 TYR HDy 1.0 1.8 4.38 1315 976 A 73 TYR HB3 A 73 TYR H 1.0 1.8 4.37 1316 977 A 73 TYR HB2 A 73 TYR H 1.0 1.8 4.51 1317 978 A 73 TYR HDx A 73 TYR H 1.0 1.8 3.81 1318 978 A 73 TYR H A 73 TYR HDy 1.0 1.8 3.81 1319 979 A 73 TYR H A 75 ILE HD1% 1.0 1.8 6.00 1320 980 A 74 ASP HB3 A 74 ASP HA 1.0 1.8 3.40 1321 981 A 75 ILE HA A 74 ASP HA 1.0 1.8 5.46 1322 982 A 74 ASP HA A 75 ILE HD1% 1.0 1.8 3.74 1323 983 A 74 ASP HA A 75 ILE HD1% 1.0 1.8 5.85 1324 984 A 74 ASP HA A 75 ILE HG13 1.0 1.8 4.78 1325 984 A 75 ILE HG1x A 74 ASP HA 1.0 1.8 4.78 1326 985 A 75 ILE HG2% A 74 ASP HA 1.0 1.8 4.74 1327 986 A 74 ASP HA A 75 ILE H 1.0 1.8 3.05 1328 987 A 75 ILE HA A 74 ASP HB3 1.0 1.8 5.58 1329 988 A 74 ASP HB3 A 75 ILE H 1.0 1.8 4.43 1330 989 A 75 ILE HA A 74 ASP HB2 1.0 1.8 5.70 1331 990 A 74 ASP HB2 A 75 ILE H 1.0 1.8 5.03 1332 991 A 74 ASP HB3 A 74 ASP H 1.0 1.8 4.26 1333 992 A 74 ASP HB2 A 74 ASP H 1.0 1.8 3.74 1334 993 A 74 ASP H A 75 ILE HD1% 1.0 1.8 3.68 1335 994 A 74 ASP H A 75 ILE HD1% 1.0 1.8 6.00 1336 995 A 75 ILE HG2% A 74 ASP H 1.0 1.8 4.58 1337 996 A 74 ASP H A 75 ILE H 1.0 1.8 5.33 1338 997 A 75 ILE HA A 75 ILE HD1% 1.0 1.8 4.78 1339 998 A 75 ILE HA A 75 ILE HG13 1.0 1.8 4.38 1340 998 A 75 ILE HA A 75 ILE HG1x 1.0 1.8 4.38 1341 999 A 75 ILE HA A 75 ILE HG2% 1.0 1.8 3.48 1342 1000 A 75 ILE HA A 76 SER HA 1.0 1.8 6.00 1343 1001 A 75 ILE HA A 76 SER HB3 1.0 1.8 5.24 1344 1001 A 76 SER HB2 A 75 ILE HA 1.0 1.8 5.24 1345 1002 A 75 ILE HA A 76 SER HB3 1.0 1.8 6.00 1346 1003 A 76 SER HB2 A 75 ILE HA 1.0 1.8 6.00 1347 1004 A 75 ILE HA A 76 SER H 1.0 1.8 2.99 1348 1005 A 75 ILE HB A 75 ILE HD1% 1.0 1.8 3.72 1349 1006 A 75 ILE HB A 76 SER H 1.0 1.8 4.86 1350 1007 A 75 ILE HG2% A 75 ILE HD1% 1.0 1.8 2.90 1351 1008 A 75 ILE HG2% A 75 ILE HG13 1.0 1.8 3.65 1352 1008 A 75 ILE HG1x A 75 ILE HG2% 1.0 1.8 3.65 1353 1009 A 75 ILE HG2% A 76 SER HA 1.0 1.8 6.00 1354 1010 A 75 ILE HB A 75 ILE H 1.0 1.8 4.68 1355 1011 A 75 ILE H A 75 ILE HD1% 1.0 1.8 4.19 1356 1012 A 75 ILE H A 75 ILE HG13 1.0 1.8 3.56 1357 1012 A 75 ILE HG1x A 75 ILE H 1.0 1.8 3.56 1358 1013 A 75 ILE HG2% A 75 ILE H 1.0 1.8 3.80 1359 1014 A 77 VAL HA A 76 SER HA 1.0 1.8 5.73 1360 1015 A 77 VAL HB A 76 SER HA 1.0 1.8 5.96 1361 1016 A 76 SER HA A 77 VAL HG21 1.0 1.8 4.29 1362 1016 A 77 VAL HG1% A 76 SER HA 1.0 1.8 4.29 1363 1017 A 76 SER HA A 77 VAL H 1.0 1.8 3.24 1364 1018 A 77 VAL H A 76 SER HB3 1.0 1.8 4.11 1365 1018 A 76 SER HB2 A 77 VAL H 1.0 1.8 4.11 1366 1019 A 77 VAL H A 76 SER HB3 1.0 1.8 4.93 1367 1020 A 76 SER HB2 A 77 VAL H 1.0 1.8 4.93 1368 1021 A 76 SER H A 76 SER HB3 1.0 1.8 3.72 1369 1021 A 76 SER HB2 A 76 SER H 1.0 1.8 3.72 1370 1022 A 76 SER H A 76 SER HB3 1.0 1.8 4.53 1371 1023 A 76 SER HB2 A 76 SER H 1.0 1.8 4.53 1372 1024 A 77 VAL HA A 76 SER H 1.0 1.8 5.61 1373 1025 A 76 SER H A 77 VAL H 1.0 1.8 5.50 1374 1026 A 78 ILE HB A 77 VAL HA 1.0 1.8 4.85 1375 1027 A 77 VAL HA A 78 ILE H 1.0 1.8 3.38 1376 1028 A 78 ILE H A 77 VAL HG21 1.0 1.8 4.28 1377 1028 A 77 VAL HG1% A 78 ILE H 1.0 1.8 4.28 1378 1029 A 79 THR HA A 77 VAL HG21 1.0 1.8 5.57 1379 1029 A 77 VAL HG1% A 79 THR HA 1.0 1.8 5.57 1380 1030 A 77 VAL HB A 77 VAL H 1.0 1.8 4.01 1381 1031 A 77 VAL H A 77 VAL HG21 1.0 1.8 3.70 1382 1031 A 77 VAL HG1% A 77 VAL H 1.0 1.8 3.70 1383 1032 A 77 VAL HG1% A 77 VAL H 1.0 1.8 4.99 1384 1033 A 77 VAL H A 77 VAL HG21 1.0 1.8 4.99 1385 1034 A 78 ILE HA A 78 ILE HG13 1.0 1.8 3.69 1386 1035 A 78 ILE HA A 78 ILE HG12 1.0 1.8 3.76 1387 1036 A 78 ILE HA A 79 THR H 1.0 1.8 3.17 1388 1037 A 78 ILE HB A 78 ILE HG13 1.0 1.8 3.34 1389 1038 A 78 ILE HB A 79 THR H 1.0 1.8 5.96 1390 1039 A 79 THR H A 78 ILE HD1% 1.0 1.8 5.68 1391 1040 A 78 ILE HG13 A 79 THR H 1.0 1.8 4.88 1392 1041 A 78 ILE HG12 A 79 THR H 1.0 1.8 4.60 1393 1042 A 78 ILE HG12 A 78 ILE HG2% 1.0 1.8 3.13 1394 1043 A 79 THR HA A 78 ILE HG2% 1.0 1.8 3.80 1395 1044 A 79 THR H A 78 ILE HG2% 1.0 1.8 3.61 1396 1045 A 78 ILE HB A 78 ILE H 1.0 1.8 3.78 1397 1046 A 78 ILE H A 78 ILE HD1% 1.0 1.8 4.43 1398 1047 A 78 ILE H A 78 ILE HG13 1.0 1.8 4.30 1399 1048 A 78 ILE H A 78 ILE HG12 1.0 1.8 5.37 1400 1049 A 78 ILE H A 78 ILE HG2% 1.0 1.8 4.60 1401 1050 A 78 ILE H A 79 THR H 1.0 1.8 6.00 1402 1051 A 79 THR HA A 79 THR HG2% 1.0 1.8 3.55 1403 1052 A 79 THR HA A 80 LEU H 1.0 1.8 3.30 1404 1053 A 79 THR HG2% A 80 LEU H 1.0 1.8 3.92 1405 1054 A 80 LEU HA A 80 LEU HD1% 1.0 1.8 3.91 1406 1054 A 80 LEU HA A 80 LEU HD21 1.0 1.8 3.91 1407 1055 A 81 ILE H A 80 LEU HA 1.0 1.8 2.90 1408 1056 A 80 LEU HB3 A 80 LEU HD1% 1.0 1.8 2.93 1409 1056 A 80 LEU HB3 A 80 LEU HD21 1.0 1.8 2.93 1410 1057 A 81 ILE H A 80 LEU HB3 1.0 1.8 4.48 1411 1058 A 80 LEU HB3 A 80 LEU H 1.0 1.8 4.28 1412 1059 A 80 LEU H A 80 LEU HD1% 1.0 1.8 4.43 1413 1059 A 80 LEU H A 80 LEU HD21 1.0 1.8 4.43 1414 1060 A 81 ILE HD1% A 81 ILE HA 1.0 1.8 4.32 1415 1061 A 81 ILE HG2% A 81 ILE HA 1.0 1.8 3.13 1416 1062 A 82 ASN HB3 A 81 ILE HA 1.0 1.8 5.63 1417 1063 A 81 ILE HA A 82 ASN HB2 1.0 1.8 5.41 1418 1064 A 82 ASN H A 81 ILE HA 1.0 1.8 3.05 1419 1065 A 81 ILE HB A 81 ILE HD1% 1.0 1.8 3.00 1420 1066 A 81 ILE HG13 A 81 ILE HB 1.0 1.8 3.52 1421 1067 A 81 ILE HB A 81 ILE HG12 1.0 1.8 3.27 1422 1068 A 81 ILE HB A 82 ASN HB3 1.0 1.8 4.96 1423 1069 A 81 ILE HB A 82 ASN HB2 1.0 1.8 5.31 1424 1070 A 81 ILE HB A 82 ASN H 1.0 1.8 3.31 1425 1071 A 81 ILE HD1% A 82 ASN HA 1.0 1.8 4.53 1426 1072 A 81 ILE HD1% A 82 ASN HA 1.0 1.8 4.88 1427 1073 A 82 ASN HB3 A 81 ILE HD1% 1.0 1.8 4.08 1428 1074 A 82 ASN H A 81 ILE HD1% 1.0 1.8 3.24 1429 1075 A 81 ILE HD1% A 83 GLY HA3 1.0 1.8 4.02 1430 1075 A 81 ILE HD1% A 83 GLY HAx 1.0 1.8 4.02 1431 1076 A 81 ILE HD1% A 83 GLY H 1.0 1.8 5.36 1432 1077 A 81 ILE HG12 A 82 ASN H 1.0 1.8 5.32 1433 1078 A 81 ILE HG12 A 81 ILE HG2% 1.0 1.8 3.28 1434 1079 A 81 ILE HB A 81 ILE H 1.0 1.8 4.44 1435 1080 A 81 ILE HD1% A 81 ILE H 1.0 1.8 4.10 1436 1081 A 81 ILE HG13 A 81 ILE H 1.0 1.8 4.54 1437 1082 A 81 ILE HG12 A 81 ILE H 1.0 1.8 4.15 1438 1083 A 81 ILE HG2% A 81 ILE H 1.0 1.8 3.81 1439 1084 A 82 ASN H A 81 ILE H 1.0 1.8 4.95 1440 1085 A 81 ILE H A 83 GLY H 1.0 1.8 6.00 1441 1086 A 82 ASN HA A 82 ASN HB2 1.0 1.8 3.16 1442 1087 A 82 ASN HA A 83 GLY HA3 1.0 1.8 4.83 1443 1088 A 82 ASN HA A 83 GLY H 1.0 1.8 3.64 1444 1089 A 82 ASN HB3 A 83 GLY HA3 1.0 1.8 5.63 1445 1089 A 82 ASN HB3 A 83 GLY HAx 1.0 1.8 5.63 1446 1090 A 82 ASN HB3 A 83 GLY H 1.0 1.8 4.99 1447 1091 A 82 ASN HB2 A 83 GLY HA3 1.0 1.8 5.97 1448 1091 A 82 ASN HB2 A 83 GLY HAx 1.0 1.8 5.97 1449 1092 A 82 ASN HB2 A 83 GLY H 1.0 1.8 5.00 1450 1093 A 82 ASN HB3 A 82 ASN H 1.0 1.8 3.52 1451 1094 A 82 ASN H A 82 ASN HB2 1.0 1.8 3.37 1452 1095 A 84 GLY H A 83 GLY HA3 1.0 1.8 3.51 1453 1095 A 83 GLY HAx A 84 GLY H 1.0 1.8 3.51 1454 1096 A 83 GLY H A 83 GLY HA3 1.0 1.8 3.18 1455 1096 A 83 GLY HAx A 83 GLY H 1.0 1.8 3.18 1456 1097 A 85 GLU HA A 84 GLY HAx 1.0 1.8 4.57 1457 1097 A 84 GLY HA3 A 85 GLU HA 1.0 1.8 4.57 1458 1098 A 84 GLY HA3 A 85 GLU HB2 1.0 1.8 4.81 1459 1098 A 84 GLY HAx A 85 GLU HB2 1.0 1.8 4.81 1460 1098 A 85 GLU HB3 A 84 GLY HAx 1.0 1.8 4.81 1461 1098 A 84 GLY HA3 A 85 GLU HB3 1.0 1.8 4.81 1462 1099 A 84 GLY HA3 A 85 GLU HGx 1.0 1.8 4.48 1463 1099 A 85 GLU HGy A 84 GLY HAx 1.0 1.8 4.48 1464 1099 A 84 GLY HA3 A 85 GLU HGy 1.0 1.8 4.48 1465 1099 A 84 GLY HAx A 85 GLU HGx 1.0 1.8 4.48 1466 1100 A 85 GLU H A 84 GLY HAx 1.0 1.8 2.90 1467 1100 A 84 GLY HA3 A 85 GLU H 1.0 1.8 2.90 1468 1101 A 84 GLY H A 84 GLY HAx 1.0 1.8 3.02 1469 1101 A 84 GLY H A 84 GLY HA3 1.0 1.8 3.02 1470 1102 A 85 GLU HA A 85 GLU HB2 1.0 1.8 3.02 1471 1102 A 85 GLU HA A 85 GLU HB3 1.0 1.8 3.02 1472 1103 A 85 GLU HA A 85 GLU HGx 1.0 1.8 3.88 1473 1103 A 85 GLU HA A 85 GLU HGy 1.0 1.8 3.88 1474 1104 A 85 GLU HA A 86 SER HB3 1.0 1.8 6.00 1475 1105 A 85 GLU HA A 86 SER HBx 1.0 1.8 6.00 1476 1106 A 85 GLU HA A 86 SER H 1.0 1.8 3.45 1477 1107 A 85 GLU HB2 A 85 GLU HGx 1.0 1.8 2.91 1478 1107 A 85 GLU HB3 A 85 GLU HGx 1.0 1.8 2.91 1479 1107 A 85 GLU HGy A 85 GLU HB2 1.0 1.8 2.91 1480 1107 A 85 GLU HB3 A 85 GLU HGy 1.0 1.8 2.91 1481 1108 A 86 SER H A 85 GLU HB2 1.0 1.8 4.77 1482 1108 A 85 GLU HB3 A 86 SER H 1.0 1.8 4.77 1483 1109 A 85 GLU H A 85 GLU HB2 1.0 1.8 3.82 1484 1109 A 85 GLU HB3 A 85 GLU H 1.0 1.8 3.82 1485 1110 A 85 GLU H A 85 GLU HGx 1.0 1.8 4.49 1486 1110 A 85 GLU HGy A 85 GLU H 1.0 1.8 4.49 1487 1111 A 85 GLU H A 86 SER HA 1.0 1.8 5.72 1488 1112 A 86 SER HA A 87 ALA H 1.0 1.8 3.21 1489 1113 A 86 SER H A 86 SER HB3 1.0 1.8 4.07 1490 1113 A 86 SER H A 86 SER HBx 1.0 1.8 4.07 1491 1114 A 87 ALA H A 87 ALA HB% 1.0 1.8 3.40 1492 1115 A 88 PRO HA A 89 THR HB 1.0 1.8 5.32 1493 1116 A 88 PRO HA A 89 THR H 1.0 1.8 3.28 1494 1117 A 89 THR HA A 89 THR HG2% 1.0 1.8 3.36 1495 1118 A 89 THR HA A 90 THR H 1.0 1.8 3.68 1496 1119 A 89 THR HB A 90 THR H 1.0 1.8 4.48 1497 1120 A 89 THR HG2% A 90 THR HA 1.0 1.8 5.49 1498 1121 A 89 THR HG2% A 90 THR H 1.0 1.8 6.00 1499 1122 A 89 THR HB A 89 THR H 1.0 1.8 4.08 1500 1123 A 89 THR H A 89 THR HG2% 1.0 1.8 4.64 1501 1124 A 90 THR HA A 90 THR HG21 1.0 1.8 3.51 1502 1125 A 90 THR HA A 91 LEU HBx 1.0 1.8 4.68 1503 1125 A 90 THR HA A 91 LEU HBy 1.0 1.8 4.68 1504 1126 A 90 THR HA A 91 LEU H 1.0 1.8 3.38 1505 1127 A 90 THR HB A 91 LEU HA 1.0 1.8 5.16 1506 1128 A 90 THR HB A 91 LEU HD1% 1.0 1.8 5.35 1507 1129 A 91 LEU H A 90 THR HB 1.0 1.8 4.13 1508 1130 A 90 THR HB A 92 THR HG2% 1.0 1.8 6.25 1509 1131 A 90 THR HG21 A 91 LEU HA 1.0 1.8 6.00 1510 1132 A 91 LEU HA A 91 LEU HBx 1.0 1.8 3.44 1511 1132 A 91 LEU HBy A 91 LEU HA 1.0 1.8 3.44 1512 1133 A 91 LEU HA A 91 LEU HD2% 1.0 1.8 3.58 1513 1133 A 91 LEU HA A 91 LEU HD1% 1.0 1.8 3.58 1514 1134 A 91 LEU HA A 92 THR HG2% 1.0 1.8 3.79 1515 1135 A 91 LEU HA A 92 THR HG2% 1.0 1.8 6.00 1516 1136 A 91 LEU HA A 92 THR H 1.0 1.8 3.55 1517 1137 A 92 THR H A 91 LEU HBx 1.0 1.8 4.71 1518 1137 A 91 LEU HBy A 92 THR H 1.0 1.8 4.71 1519 1138 A 91 LEU H A 91 LEU HBx 1.0 1.8 3.87 1520 1138 A 91 LEU HBy A 91 LEU H 1.0 1.8 3.87 1521 1139 A 92 THR HA A 93 GLN H 1.0 1.8 4.83 1522 1140 A 92 THR HG2% A 93 GLN H 1.0 1.8 5.54 1523 1141 A 92 THR HG2% A 92 THR H 1.0 1.8 5.08 1524 1142 A 92 THR H A 93 GLN H 1.0 1.8 4.63 1525 1143 A 93 GLN HA A 93 GLN HGx 1.0 1.8 4.62 1526 1143 A 93 GLN HA A 93 GLN HG3 1.0 1.8 4.62 1527 1144 A 93 GLN HA A 94 GLN H 1.0 1.8 3.76 1528 1145 A 94 GLN HA A 95 THR H 1.0 1.8 4.74 1529 1146 B 202 SER HA B 203 SER H 1.0 1.8 4.18 1530 1147 B 203 SER H B 203 SER HB3 1.0 1.8 4.31 1531 1148 B 204 PRO HA B 204 PRO HB3 1.0 1.8 5.29 1532 1149 B 204 PRO HA B 204 PRO HB2 1.0 1.8 5.07 1533 1150 B 204 PRO HA B 204 PRO HG3 1.0 1.8 4.15 1534 1151 B 204 PRO HA B 205 ILE H 1.0 1.8 4.84 1535 1152 B 204 PRO HA B 204 PRO HB3 1.0 1.8 5.21 1536 1153 B 204 PRO HB3 B 204 PRO HB2 1.0 1.8 6.20 1537 1154 B 204 PRO HB3 B 204 PRO HD3 1.0 1.8 4.53 1538 1155 B 204 PRO HB3 B 204 PRO HG3 1.0 1.8 4.87 1539 1156 B 204 PRO HB3 B 205 ILE H 1.0 1.8 4.83 1540 1157 B 204 PRO HA B 204 PRO HB2 1.0 1.8 5.03 1541 1158 B 204 PRO HB3 B 204 PRO HB2 1.0 1.8 6.25 1542 1159 B 204 PRO HB2 B 204 PRO HD3 1.0 1.8 4.69 1543 1160 B 204 PRO HB2 B 205 ILE H 1.0 1.8 4.04 1544 1161 B 204 PRO HA B 204 PRO HD3 1.0 1.8 4.39 1545 1162 B 204 PRO HB3 B 204 PRO HD3 1.0 1.8 4.38 1546 1163 B 204 PRO HG3 B 204 PRO HD3 1.0 1.8 5.16 1547 1164 B 204 PRO HD3 B 204 PRO HG2 1.0 1.8 5.25 1548 1165 B 205 ILE H B 204 PRO HD3 1.0 1.8 4.21 1549 1166 B 204 PRO HA B 204 PRO HG3 1.0 1.8 4.00 1550 1167 B 204 PRO HB3 B 204 PRO HG3 1.0 1.8 4.89 1551 1168 B 204 PRO HG3 B 204 PRO HD3 1.0 1.8 5.26 1552 1169 B 204 PRO HG3 B 205 ILE H 1.0 1.8 5.62 1553 1170 B 204 PRO HA B 204 PRO HG2 1.0 1.8 3.95 1554 1171 B 204 PRO HB3 B 204 PRO HG2 1.0 1.8 4.76 1555 1172 B 204 PRO HD3 B 204 PRO HG2 1.0 1.8 5.14 1556 1173 B 205 ILE H B 204 PRO HG2 1.0 1.8 3.85 1557 1174 B 205 ILE HA B 205 ILE HB 1.0 1.8 3.94 1558 1175 B 205 ILE HA B 205 ILE HB 1.0 1.8 4.47 1559 1176 B 205 ILE HA B 205 ILE HD1% 1.0 1.8 3.83 1560 1177 B 205 ILE HA B 205 ILE HD1% 1.0 1.8 4.16 1561 1178 B 205 ILE HA B 205 ILE HG13 1.0 1.8 4.63 1562 1179 B 205 ILE HA B 205 ILE HG12 1.0 1.8 4.39 1563 1180 B 205 ILE HA B 205 ILE HG12 1.0 1.8 4.49 1564 1181 B 205 ILE HA B 205 ILE HG2% 1.0 1.8 4.60 1565 1182 B 205 ILE HA B 206 GLN H 1.0 1.8 4.56 1566 1183 B 205 ILE HB B 205 ILE HD1% 1.0 1.8 4.66 1567 1184 B 205 ILE HB B 205 ILE HG13 1.0 1.8 4.52 1568 1185 B 205 ILE HB B 205 ILE HG12 1.0 1.8 4.51 1569 1186 B 205 ILE HB B 205 ILE HG2% 1.0 1.8 5.06 1570 1187 B 205 ILE HB B 206 GLN H 1.0 1.8 3.72 1571 1188 B 205 ILE HG13 B 205 ILE HD1% 1.0 1.8 4.73 1572 1189 B 205 ILE HG12 B 205 ILE HD1% 1.0 1.8 5.69 1573 1190 B 206 GLN H B 205 ILE HD1% 1.0 1.8 3.70 1574 1191 B 205 ILE HG13 B 205 ILE HD1% 1.0 1.8 4.97 1575 1192 B 205 ILE HG13 B 205 ILE HG12 1.0 1.8 5.70 1576 1193 B 205 ILE HG13 B 206 GLN H 1.0 1.8 4.80 1577 1194 B 205 ILE HG12 B 205 ILE HD1% 1.0 1.8 5.31 1578 1195 B 205 ILE HG13 B 205 ILE HG12 1.0 1.8 5.48 1579 1196 B 205 ILE HG12 B 206 GLN H 1.0 1.8 3.85 1580 1197 B 205 ILE HB B 205 ILE HG2% 1.0 1.8 5.01 1581 1198 B 205 ILE HG13 B 205 ILE HG2% 1.0 1.8 4.36 1582 1199 B 206 GLN H B 205 ILE HG2% 1.0 1.8 4.03 1583 1200 B 205 ILE H B 205 ILE HB 1.0 1.8 4.35 1584 1201 B 205 ILE H B 205 ILE HD1% 1.0 1.8 4.57 1585 1202 B 205 ILE H B 205 ILE HG13 1.0 1.8 4.92 1586 1203 B 205 ILE H B 205 ILE HG12 1.0 1.8 4.75 1587 1204 B 205 ILE H B 205 ILE HG2% 1.0 1.8 4.30 1588 1205 B 206 GLN HA B 206 GLN HB3 1.0 1.8 4.59 1589 1206 B 206 GLN HA B 206 GLN HB2 1.0 1.8 5.14 1590 1207 B 206 GLN HA B 206 GLN HG3 1.0 1.8 4.76 1591 1208 B 206 GLN HA B 207 GLY HA3 1.0 1.8 4.86 1592 1209 B 206 GLN HB3 B 206 GLN HB2 1.0 1.8 5.81 1593 1210 B 206 GLN HG3 B 206 GLN HE21 1.0 1.8 4.68 1594 1211 B 206 GLN HG3 B 206 GLN HE22 1.0 1.8 4.24 1595 1212 B 206 GLN H B 206 GLN HB3 1.0 1.8 4.12 1596 1213 B 206 GLN H B 206 GLN HG3 1.0 1.8 4.32 1597 1214 B 207 GLY HA3 B 208 SER H 1.0 1.8 5.00 1598 1215 B 208 SER H B 207 GLY HA2 1.0 1.8 4.15 1599 1216 B 207 GLY HA3 B 207 GLY H 1.0 1.8 4.11 1600 1217 B 208 SER HA B 208 SER HB3 1.0 1.8 5.08 1601 1218 B 208 SER HA B 208 SER HB3 1.0 1.8 5.82 1602 1219 B 208 SER HA B 208 SER HB2 1.0 1.8 5.16 1603 1220 B 208 SER HA B 209 TRP HD1 1.0 1.8 3.99 1604 1221 B 208 SER HA B 209 TRP H 1.0 1.8 5.47 1605 1222 B 208 SER HB3 B 209 TRP H 1.0 1.8 4.50 1606 1223 B 208 SER HB2 B 209 TRP HD1 1.0 1.8 4.61 1607 1224 B 208 SER HB2 B 209 TRP H 1.0 1.8 4.74 1608 1225 B 208 SER H B 208 SER HA 1.0 1.8 4.57 1609 1226 B 208 SER H B 208 SER HB3 1.0 1.8 3.99 1610 1227 B 208 SER H B 208 SER HB2 1.0 1.8 4.18 1611 1228 B 209 TRP HA B 209 TRP HB2 1.0 1.8 3.84 1612 1229 B 209 TRP HA B 209 TRP HB2 1.0 1.8 4.46 1613 1230 B 209 TRP HD1 B 209 TRP HA 1.0 1.8 4.57 1614 1231 B 209 TRP HA B 210 THR H 1.0 1.8 4.74 1615 1232 B 209 TRP HD1 B 209 TRP HB3 1.0 1.8 4.03 1616 1233 B 209 TRP H B 209 TRP HA 1.0 1.8 4.09 1617 1234 B 209 TRP H B 209 TRP HB3 1.0 1.8 4.02 1618 1235 B 210 THR HA B 210 THR HB 1.0 1.8 4.60 1619 1236 B 210 THR HA B 210 THR HB 1.0 1.8 5.02 1620 1237 B 210 THR HA B 210 THR HG2% 1.0 1.8 4.56 1621 1238 B 210 THR HA B 211 TRP H 1.0 1.8 4.95 1622 1239 B 210 THR HB B 210 THR HG2% 1.0 1.8 5.50 1623 1240 B 210 THR HB B 211 TRP H 1.0 1.8 4.47 1624 1241 B 210 THR H B 210 THR HA 1.0 1.8 3.57 1625 1242 B 210 THR H B 210 THR HB 1.0 1.8 4.02 1626 1243 B 211 TRP HA B 211 TRP HB3 1.0 1.8 4.05 1627 1244 B 211 TRP HB3 B 211 TRP HB2 1.0 1.8 4.76 1628 1245 B 211 TRP HB3 B 211 TRP HD1 1.0 1.8 3.87 1629 1246 B 211 TRP H B 211 TRP HB3 1.0 1.8 4.42 1630 1247 B 212 GLU HA B 212 GLU HB3 1.0 1.8 4.71 1631 1248 B 212 GLU HA B 212 GLU HB3 1.0 1.8 5.21 1632 1249 B 212 GLU HA B 212 GLU HB2 1.0 1.8 4.52 1633 1250 B 212 GLU HA B 212 GLU HG3 1.0 1.8 4.52 1634 1251 B 212 GLU HA B 212 GLU HG2 1.0 1.8 4.34 1635 1252 B 212 GLU HA B 212 GLU HG2 1.0 1.8 4.94 1636 1253 B 212 GLU HB3 B 212 GLU HG3 1.0 1.8 5.32 1637 1254 B 212 GLU HB3 B 212 GLU HG2 1.0 1.8 5.17 1638 1255 B 212 GLU HG3 B 213 ASN HB3 1.0 1.8 3.82 1639 1256 B 212 GLU HG3 B 213 ASN HB3 1.0 1.8 4.19 1640 1257 B 212 GLU HG2 B 213 ASN HA 1.0 1.8 4.62 1641 1258 B 212 GLU HG2 B 213 ASN HB3 1.0 1.8 4.13 1642 1259 B 212 GLU HG2 B 213 ASN HB2 1.0 1.8 4.27 1643 1260 B 212 GLU HG2 B 213 ASN HB2 1.0 1.8 4.28 1644 1261 B 212 GLU HA B 212 GLU H 1.0 1.8 4.00 1645 1262 B 212 GLU HB3 B 212 GLU H 1.0 1.8 3.87 1646 1263 B 212 GLU HB2 B 212 GLU H 1.0 1.8 4.09 1647 1264 B 213 ASN HB3 B 213 ASN HA 1.0 1.8 4.83 1648 1265 B 213 ASN HB3 B 213 ASN HA 1.0 1.8 5.26 1649 1266 B 213 ASN HA B 213 ASN HB2 1.0 1.8 4.66 1650 1267 B 213 ASN HA B 213 ASN HB2 1.0 1.8 4.84 1651 1268 B 213 ASN HA B 214 GLY H 1.0 1.8 4.20 1652 1269 B 213 ASN HB3 B 213 ASN HD21 1.0 1.8 3.93 1653 1270 B 213 ASN HB3 B 213 ASN HD22 1.0 1.8 3.65 1654 1271 B 213 ASN HB3 B 213 ASN HB2 1.0 1.8 6.58 1655 1272 B 213 ASN HB2 B 213 ASN HD21 1.0 1.8 4.62 1656 1273 B 213 ASN HB2 B 213 ASN HD22 1.0 1.8 4.07 1657 1274 B 213 ASN HA B 213 ASN H 1.0 1.8 3.69 1658 1275 B 214 GLY HA3 B 214 GLY HA2 1.0 1.8 5.79 1659 1276 B 214 GLY HA3 B 214 GLY HA2 1.0 1.8 5.50 1660 1277 B 214 GLY HA2 B 215 LYS H 1.0 1.8 3.67 1661 1278 B 214 GLY H B 214 GLY HA3 1.0 1.8 4.28 1662 1279 B 214 GLY H B 214 GLY HA2 1.0 1.8 4.20 1663 1280 B 215 LYS HA B 215 LYS HB3 1.0 1.8 4.16 1664 1281 B 215 LYS HA B 215 LYS HB2 1.0 1.8 4.54 1665 1282 B 215 LYS HA B 215 LYS HG3 1.0 1.8 4.15 1666 1283 B 215 LYS HA B 215 LYS HG3 1.0 1.8 4.36 1667 1284 B 215 LYS HA B 215 LYS HG2 1.0 1.8 4.09 1668 1285 B 215 LYS HA B 216 TRP H 1.0 1.8 4.61 1669 1286 B 215 LYS HB3 B 215 LYS HE3 1.0 1.8 5.09 1670 1287 B 215 LYS HB3 B 215 LYS HE2 1.0 1.8 5.02 1671 1288 B 215 LYS HB3 B 215 LYS HB2 1.0 1.8 5.91 1672 1289 B 215 LYS HB2 B 215 LYS HE2 1.0 1.8 4.49 1673 1290 B 215 LYS HB2 B 215 LYS HG3 1.0 1.8 4.59 1674 1291 B 215 LYS HB2 B 215 LYS HG2 1.0 1.8 4.50 1675 1292 B 215 LYS HB2 B 215 LYS HG2 1.0 1.8 4.92 1676 1293 B 215 LYS HB2 B 216 TRP H 1.0 1.8 3.97 1677 1294 B 215 LYS HE2 B 215 LYS HD3 1.0 1.8 4.88 1678 1295 B 215 LYS HE2 B 215 LYS HD2 1.0 1.8 4.77 1679 1296 B 215 LYS HG3 B 215 LYS HD3 1.0 1.8 4.66 1680 1297 B 215 LYS HG3 B 215 LYS HE3 1.0 1.8 4.44 1681 1298 B 215 LYS HG2 B 215 LYS HE3 1.0 1.8 4.36 1682 1299 B 215 LYS HG2 B 215 LYS HE3 1.0 1.8 4.72 1683 1300 B 215 LYS H B 215 LYS HA 1.0 1.8 3.71 1684 1301 B 215 LYS H B 215 LYS HB3 1.0 1.8 3.89 1685 1302 B 215 LYS H B 215 LYS HB2 1.0 1.8 3.62 1686 1303 B 215 LYS H B 215 LYS HG3 1.0 1.8 3.75 1687 1304 B 215 LYS H B 215 LYS HG2 1.0 1.8 3.67 1688 1305 B 216 TRP HA B 216 TRP HB3 1.0 1.8 3.57 1689 1306 B 216 TRP HA B 216 TRP HB3 1.0 1.8 3.83 1690 1307 B 216 TRP HA B 216 TRP HB2 1.0 1.8 3.63 1691 1308 B 216 TRP HA B 216 TRP HB2 1.0 1.8 3.66 1692 1309 B 216 TRP HA B 216 TRP HD1 1.0 1.8 3.63 1693 1310 B 216 TRP HA B 217 THR H 1.0 1.8 4.39 1694 1311 B 216 TRP HB3 B 216 TRP HB2 1.0 1.8 4.52 1695 1312 B 216 TRP HB3 B 216 TRP HB2 1.0 1.8 4.40 1696 1313 B 216 TRP H B 216 TRP HA 1.0 1.8 3.70 1697 1314 B 216 TRP H B 216 TRP HB3 1.0 1.8 3.84 1698 1315 B 216 TRP H B 216 TRP HB2 1.0 1.8 3.64 1699 1316 B 217 THR HA B 217 THR HB 1.0 1.8 3.99 1700 1317 B 217 THR HA B 217 THR HB 1.0 1.8 4.05 1701 1318 B 217 THR HA B 217 THR HG2% 1.0 1.8 4.75 1702 1319 B 217 THR HA B 217 THR HG2% 1.0 1.8 4.83 1703 1320 B 217 THR HA B 217 THR HG2% 1.0 1.8 4.84 1704 1321 B 217 THR HA B 218 TRP H 1.0 1.8 4.97 1705 1322 B 217 THR HB B 217 THR HG2% 1.0 1.8 5.39 1706 1323 B 217 THR HB B 217 THR HG2% 1.0 1.8 5.29 1707 1324 B 217 THR HB B 217 THR HG2% 1.0 1.8 5.35 1708 1325 B 218 TRP H B 217 THR HG2% 1.0 1.8 4.46 1709 1326 B 217 THR H B 217 THR HB 1.0 1.8 4.17 1710 1327 B 218 TRP HA B 218 TRP HB3 1.0 1.8 3.61 1711 1328 B 218 TRP HA B 218 TRP HB3 1.0 1.8 4.02 1712 1329 B 218 TRP HA B 219 LYS H 1.0 1.8 5.18 1713 1330 B 218 TRP H B 218 TRP HB3 1.0 1.8 3.91 1714 1331 B 219 LYS HA B 219 LYS HB3 1.0 1.8 4.45 1715 1332 B 219 LYS HA B 219 LYS HB3 1.0 1.8 4.88 1716 1333 B 219 LYS HA B 219 LYS HB2 1.0 1.8 4.41 1717 1334 B 219 LYS HA B 219 LYS HG3 1.0 1.8 4.11 1718 1335 B 219 LYS HA B 219 LYS HG3 1.0 1.8 4.67 1719 1336 B 219 LYS HA B 219 LYS HG2 1.0 1.8 4.43 1720 1337 B 219 LYS HA B 220 GLY HA2 1.0 1.8 4.95 1721 1338 B 219 LYS HA B 220 GLY H 1.0 1.8 5.25 1722 1339 B 219 LYS HB3 B 219 LYS HB2 1.0 1.8 6.02 1723 1340 B 219 LYS HB3 B 219 LYS HE3 1.0 1.8 4.40 1724 1341 B 219 LYS HB3 B 220 GLY H 1.0 1.8 3.93 1725 1342 B 219 LYS HB2 B 219 LYS HE3 1.0 1.8 5.18 1726 1343 B 219 LYS HB2 B 220 GLY H 1.0 1.8 3.71 1727 1344 B 219 LYS HE3 B 219 LYS HD3 1.0 1.8 4.81 1728 1345 B 219 LYS HE3 B 219 LYS HD3 1.0 1.8 5.53 1729 1346 B 219 LYS HE3 B 219 LYS HD2 1.0 1.8 4.86 1730 1347 B 219 LYS HG3 B 219 LYS HE3 1.0 1.8 4.39 1731 1348 B 219 LYS HG3 B 219 LYS HE3 1.0 1.8 4.91 1732 1349 B 219 LYS HG2 B 219 LYS HE3 1.0 1.8 4.42 1733 1350 B 219 LYS H B 219 LYS HA 1.0 1.8 4.05 1734 1351 B 219 LYS H B 219 LYS HB3 1.0 1.8 3.88 1735 1352 B 219 LYS H B 219 LYS HB2 1.0 1.8 4.27 1736 1353 B 220 GLY HA2 B 220 GLY HA3 1.0 1.8 5.55 1737 1354 B 220 GLY HA3 B 221 ILE H 1.0 1.8 5.02 1738 1355 B 220 GLY HA2 B 220 GLY HA3 1.0 1.8 5.23 1739 1356 B 220 GLY HA2 B 221 ILE H 1.0 1.8 4.86 1740 1357 B 221 ILE HA B 221 ILE HB 1.0 1.8 4.52 1741 1358 B 221 ILE HA B 221 ILE HB 1.0 1.8 4.81 1742 1359 B 221 ILE HA B 221 ILE HD1% 1.0 1.8 4.21 1743 1360 B 221 ILE HA B 221 ILE HD1% 1.0 1.8 5.31 1744 1361 B 221 ILE HA B 221 ILE HG13 1.0 1.8 4.17 1745 1362 B 221 ILE HA B 221 ILE HG13 1.0 1.8 4.33 1746 1363 B 221 ILE HA B 221 ILE HG12 1.0 1.8 4.32 1747 1364 B 221 ILE HA B 222 ILE HG12 1.0 1.8 4.27 1748 1365 B 221 ILE HA B 222 ILE H 1.0 1.8 5.47 1749 1366 B 221 ILE HD1% B 222 ILE H 1.0 1.8 3.78 1750 1367 B 221 ILE HD1% B 221 ILE HG13 1.0 1.8 6.16 1751 1368 B 221 ILE HG13 B 222 ILE H 1.0 1.8 4.10 1752 1369 B 221 ILE HB B 221 ILE HG2% 1.0 1.8 5.50 1753 1370 B 222 ILE H B 221 ILE HG2% 1.0 1.8 5.54 1754 1371 B 221 ILE H B 221 ILE HA 1.0 1.8 4.27 1755 1372 B 221 ILE H B 221 ILE HB 1.0 1.8 4.61 1756 1373 B 221 ILE H B 221 ILE HG13 1.0 1.8 4.05 1757 1374 B 221 ILE H B 221 ILE HG12 1.0 1.8 4.84 1758 1375 B 222 ILE HA B 222 ILE HD1% 1.0 1.8 3.75 1759 1376 B 222 ILE HB B 222 ILE HD1% 1.0 1.8 4.56 1760 1377 B 222 ILE HB B 222 ILE HD1% 1.0 1.8 5.21 1761 1378 B 222 ILE HB B 222 ILE HG2% 1.0 1.8 5.94 1762 1379 B 222 ILE HG13 B 222 ILE HD1% 1.0 1.8 5.11 1763 1380 B 222 ILE HG13 B 222 ILE HD1% 1.0 1.8 5.55 1764 1381 B 222 ILE HG12 B 222 ILE HG13 1.0 1.8 6.05 1765 1382 B 222 ILE H B 222 ILE HB 1.0 1.8 4.47 1766 1383 B 222 ILE H B 222 ILE HD1% 1.0 1.8 3.95 1767 1384 B 222 ILE H B 222 ILE HG2% 1.0 1.8 4.79 1768 1385 B 223 ARG HA B 223 ARG HB2 1.0 1.8 4.33 1769 1386 B 223 ARG HA B 223 ARG HD3 1.0 1.8 4.50 1770 1387 B 223 ARG HA B 223 ARG HD2 1.0 1.8 4.52 1771 1388 B 223 ARG HA B 223 ARG HG3 1.0 1.8 4.71 1772 1389 B 223 ARG HA B 224 LEU HD1% 1.0 1.8 5.15 1773 1390 B 223 ARG HD3 B 223 ARG HB3 1.0 1.8 4.62 1774 1391 B 223 ARG HD3 B 223 ARG HB3 1.0 1.8 4.74 1775 1392 B 223 ARG HD2 B 223 ARG HB3 1.0 1.8 4.64 1776 1393 B 223 ARG HG3 B 223 ARG HB3 1.0 1.8 4.92 1777 1394 B 223 ARG HG3 B 223 ARG HB3 1.0 1.8 4.97 1778 1395 B 224 LEU HD1% B 223 ARG HB3 1.0 1.8 6.20 1779 1396 B 223 ARG HB2 B 223 ARG HD3 1.0 1.8 4.67 1780 1397 B 223 ARG HB2 B 223 ARG HD2 1.0 1.8 4.52 1781 1398 B 223 ARG HB2 B 223 ARG HD2 1.0 1.8 4.73 1782 1399 B 223 ARG HB2 B 223 ARG HG3 1.0 1.8 4.88 1783 1400 B 223 ARG HB2 B 223 ARG HG3 1.0 1.8 5.07 1784 1401 B 223 ARG HD3 B 223 ARG HG3 1.0 1.8 5.35 1785 1402 B 223 ARG HD2 B 223 ARG HG3 1.0 1.8 5.25 1786 1403 B 223 ARG HD2 B 223 ARG HG3 1.0 1.8 5.39 1787 1404 B 223 ARG HB3 B 223 ARG H 1.0 1.8 4.31 1788 1405 B 223 ARG HB2 B 223 ARG H 1.0 1.8 3.89 1789 1406 B 224 LEU HA B 224 LEU HB3 1.0 1.8 5.25 1790 1407 B 224 LEU HA B 224 LEU HB3 1.0 1.8 5.48 1791 1408 B 224 LEU HD1% B 224 LEU HA 1.0 1.8 5.55 1792 1409 B 224 LEU HD1% B 224 LEU HA 1.0 1.8 5.63 1793 1410 B 224 LEU HA B 224 LEU HG 1.0 1.8 5.02 1794 1411 B 224 LEU HA B 225 GLU H 1.0 1.8 5.74 1795 1412 B 224 LEU HD1% B 224 LEU HB3 1.0 1.8 5.80 1796 1413 B 224 LEU HB3 B 224 LEU HG 1.0 1.8 4.94 1797 1414 B 224 LEU HB3 B 224 LEU HG 1.0 1.8 5.94 1798 1415 B 224 LEU HB3 B 225 GLU H 1.0 1.8 4.36 1799 1416 B 224 LEU HD1% B 225 GLU H 1.0 1.8 4.49 1800 1417 B 224 LEU HA B 224 LEU H 1.0 1.8 4.10 1801 1418 B 224 LEU HB3 B 224 LEU H 1.0 1.8 4.11 1802 1419 B 224 LEU HD1% B 224 LEU H 1.0 1.8 4.09 1803 1420 B 224 LEU HG B 224 LEU H 1.0 1.8 3.86 1804 1421 B 225 GLU HA B 225 GLU HB3 1.0 1.8 5.01 1805 1422 B 225 GLU HA B 225 GLU HB3 1.0 1.8 5.40 1806 1423 B 225 GLU HA B 225 GLU HB2 1.0 1.8 4.89 1807 1424 B 225 GLU HA B 225 GLU HB2 1.0 1.8 5.37 1808 1425 B 225 GLU HA B 225 GLU HG3 1.0 1.8 4.48 1809 1426 B 225 GLU HA B 225 GLU HG2 1.0 1.8 4.57 1810 1427 B 225 GLU HA B 226 GLN HB3 1.0 1.8 5.48 1811 1428 B 225 GLU HA B 226 GLN HB2 1.0 1.8 4.83 1812 1429 B 225 GLU HA B 226 GLN H 1.0 1.8 6.02 1813 1430 B 225 GLU HG3 B 226 GLN H 1.0 1.8 3.68 1814 1431 B 225 GLU HG2 B 226 GLN H 1.0 1.8 3.67 1815 1432 B 225 GLU H B 225 GLU HB3 1.0 1.8 4.34 1816 1433 B 225 GLU H B 225 GLU HB2 1.0 1.8 4.86 1817 1434 B 225 GLU H B 225 GLU HG3 1.0 1.8 5.00 1818 1435 B 225 GLU H B 225 GLU HG2 1.0 1.8 5.11 1819 1436 B 226 GLN HB3 B 226 GLN HA 1.0 1.8 4.69 1820 1437 B 226 GLN HB2 B 226 GLN HA 1.0 1.8 4.81 1821 1438 B 226 GLN HB2 B 226 GLN HA 1.0 1.8 5.32 1822 1439 B 226 GLN HA B 226 GLN HG3 1.0 1.8 4.35 1823 1440 B 226 GLN HA B 226 GLN HG3 1.0 1.8 4.69 1824 1441 B 226 GLN H B 226 GLN HA 1.0 1.8 4.80 1825 1442 B 226 GLN H B 226 GLN HG3 1.0 1.8 4.15 1826 1443 B 205 ILE HG2% A 14 PHE HB3 1.0 1.8 5.50 1827 1444 A 14 PHE HD% B 205 ILE HG2% 1.0 1.8 5.50 1828 1445 A 14 PHE HD% B 205 ILE HD1% 1.0 1.8 5.50 1829 1446 B 224 LEU HG A 17 ILE HG13 1.0 1.8 4.50 1830 1447 A 17 ILE HG2% B 204 PRO HB3 1.0 1.8 4.50 1831 1448 A 17 ILE HG2% B 204 PRO HB2 1.0 1.8 4.50 1832 1449 A 17 ILE HG2% B 204 PRO HG3 1.0 1.8 4.50 1833 1450 A 17 ILE HG2% B 204 PRO HG2 1.0 1.8 4.50 1834 1451 A 17 ILE HG2% B 204 PRO HD3 1.0 1.8 5.50 1835 1452 A 17 ILE HG2% B 223 ARG HB2 1.0 1.8 5.50 1836 1453 A 17 ILE HG2% B 224 LEU HA 1.0 1.8 5.50 1837 1454 A 17 ILE HG2% B 224 LEU HD1% 1.0 1.8 5.50 1838 1455 A 17 ILE HG2% B 224 LEU HG 1.0 1.8 4.50 1839 1456 B 204 PRO HB2 A 17 ILE HD1% 1.0 1.8 4.50 1840 1457 B 204 PRO HG3 A 17 ILE HD1% 1.0 1.8 4.50 1841 1458 B 204 PRO HD3 A 17 ILE HD1% 1.0 1.8 6.50 1842 1459 B 204 PRO HG2 A 17 ILE HD1% 1.0 1.8 6.50 1843 1460 B 205 ILE HG2% A 17 ILE HD1% 1.0 1.8 4.50 1844 1461 B 205 ILE HD1% A 17 ILE HD1% 1.0 1.8 4.50 1845 1462 B 205 ILE HD1% A 17 ILE HD1% 1.0 1.8 4.50 1846 1463 A 22 ILE HA B 224 LEU HD1% 1.0 1.8 6.50 1847 1464 A 22 ILE HA B 224 LEU HG 1.0 1.8 6.50 1848 1465 A 22 ILE HB B 224 LEU HD1% 1.0 1.8 6.50 1849 1466 A 22 ILE HD1% B 205 ILE HD1% 1.0 1.8 6.50 1850 1467 A 22 ILE HD1% B 224 LEU HD1% 1.0 1.8 5.50 1851 1468 A 22 ILE HD1% B 224 LEU HG 1.0 1.8 5.50 1852 1469 A 22 ILE HG2% B 223 ARG HB2 1.0 1.8 4.50 1853 1470 A 22 ILE HG2% B 224 LEU HA 1.0 1.8 5.50 1854 1471 A 22 ILE HG2% B 224 LEU HD1% 1.0 1.8 6.50 1855 1472 A 22 ILE HG2% B 224 LEU HG 1.0 1.8 4.50 1856 1473 A 72 ASP HA B 222 ILE HD1% 1.0 1.8 4.50 1857 1474 B 222 ILE HG2% A 72 ASP HB3 1.0 1.8 4.50 1858 1475 A 72 ASP HB2 B 222 ILE HG2% 1.0 1.8 4.50 1859 1476 B 222 ILE HD1% A 72 ASP HB3 1.0 1.8 4.50 1860 1477 A 72 ASP HB2 B 222 ILE HD1% 1.0 1.8 4.50 1861 1478 A 73 TYR HB3 B 222 ILE HB 1.0 1.8 4.50 1862 1479 A 73 TYR HB2 B 222 ILE HB 1.0 1.8 5.50 1863 1480 A 73 TYR HB2 B 222 ILE HD1% 1.0 1.8 4.50 1864 1481 A 73 TYR HDx B 222 ILE HB 1.0 1.8 5.50 1865 1481 B 222 ILE HB A 73 TYR HDy 1.0 1.8 5.50 1866 1482 A 74 ASP HA B 222 ILE HG2% 1.0 1.8 5.50 1867 1483 B 222 ILE HD1% A 75 ILE HG13 1.0 1.8 6.50 1868 1484 B 222 ILE HB A 75 ILE HD1% 1.0 1.8 5.50 1869 1485 B 222 ILE HG2% A 75 ILE HD1% 1.0 1.8 5.50 1870 1486 A 77 VAL HB B 218 TRP HB3 1.0 1.8 4.50 1871 1487 A 76 SER HA B 217 THR HG2% 1.0 1.8 5.50 1872 1488 B 217 THR HG2% A 76 SER HB3 1.0 1.8 4.50 1873 1489 A 76 SER HB2 B 217 THR HG2% 1.0 1.8 4.50 1874 1490 A 76 SER HA B 219 LYS HA 1.0 1.8 5.50 1875 1491 A 76 SER HA B 219 LYS HB3 1.0 1.8 5.50 1876 1492 A 76 SER HA B 219 LYS HG2 1.0 1.8 5.50 1877 1493 B 215 LYS HB3 A 78 ILE HG2% 1.0 1.8 6.50 1878 1494 B 215 LYS HB2 A 78 ILE HG2% 1.0 1.8 6.50 1879 1495 B 215 LYS HD2 A 78 ILE HG2% 1.0 1.8 6.50 1880 1496 B 215 LYS HE2 A 78 ILE HG2% 1.0 1.8 6.50 1881 1497 B 215 LYS HG3 A 78 ILE HG2% 1.0 1.8 6.50 1882 1498 B 215 LYS HG2 A 78 ILE HG2% 1.0 1.8 6.50 1883 1499 B 215 LYS HD3 A 78 ILE HG2% 1.0 1.8 6.50 1884 1500 B 215 LYS HD2 A 78 ILE HD1% 1.0 1.8 6.50 1885 1501 A 78 ILE HA B 217 THR HG2% 1.0 1.8 6.50 1886 1502 A 78 ILE HG13 B 217 THR HG2% 1.0 1.8 6.50 1887 1503 A 78 ILE HG12 B 217 THR HG2% 1.0 1.8 6.50 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 A 17 ILE HA B 224 LEU HG 1.0 1.8 4.3 2 2 A 17 ILE H B 224 LEU HG 1.0 1.8 5.6 3 3 A 72 ASP HB2 B 222 ILE HG2% 1.0 1.8 3.7 4 4 A 73 TYR HB3 B 222 ILE HB 1.0 1.8 5.9 5 5 A 74 ASP HA B 222 ILE HA 1.0 1.8 5.5 6 6 A 76 SER HA B 217 THR HG2% 1.0 1.8 5.0 7 7 A 76 SER HA B 219 LYS HA 1.0 1.8 4.7 8 8 A 77 VAL H B 217 THR HG2% 1.0 1.8 4.9 9 9 A 77 VAL HA B 218 TRP HB3 1.0 1.8 5.7 10 10 A 77 VAL HB B 218 TRP HB3 1.0 1.8 5.9 11 11 A 77 VAL H B 218 TRP HB3 1.0 1.8 5.6 12 12 A 77 VAL H B 219 LYS HA 1.0 1.8 5.5 13 13 A 78 ILE HA B 217 THR HA 1.0 1.8 5.7 14 14 A 79 THR H B 217 THR HA 1.0 1.8 6.4 15 15 A 80 LEU HA B 215 LYS HB3 1.0 1.8 6.5 16 16 A 80 LEU HA B 215 LYS HD3 1.0 1.8 5.4 17 17 A 80 LEU HA B 215 LYS HD2 1.0 1.8 5.4 18 18 B 207 GLY HA3 B 207 GLY H 1.0 1.8 4.1 19 19 B 207 GLY HA3 B 218 TRP HH2 1.0 1.8 3.4 20 20 B 207 GLY HA2 B 218 TRP HH2 1.0 1.8 4.1 21 21 B 208 SER HA B 208 SER HB3 1.0 1.8 3.4 22 22 B 208 SER HA B 208 SER HB2 1.0 1.8 3.3 23 23 B 208 SER H B 208 SER HB2 1.0 1.8 4.0 24 24 B 208 SER HB3 B 209 TRP H 1.0 1.8 3.8 25 25 B 208 SER HB2 B 209 TRP H 1.0 1.8 3.6 26 26 B 208 SER HB2 B 209 TRP HD1 1.0 1.8 4.7 27 27 B 208 SER HA B 209 TRP HB2 1.0 1.8 5.0 28 28 B 208 SER HA B 209 TRP HD1 1.0 1.8 4.2 29 29 B 208 SER HA B 209 TRP H 1.0 1.8 3.1 30 30 B 208 SER HB3 B 218 TRP HH2 1.0 1.8 4.2 31 31 B 209 TRP HD1 B 209 TRP HA 1.0 1.8 3.7 32 32 B 209 TRP HA B 209 TRP HB2 1.0 1.8 3.8 33 33 B 209 TRP H B 209 TRP HA 1.0 1.8 4.1 34 34 B 209 TRP H B 209 TRP HB3 1.0 1.8 4.2 35 35 B 209 TRP HD1 B 209 TRP HB2 1.0 1.8 4.2 36 36 B 209 TRP HA B 210 THR H 1.0 1.8 3.6 37 37 B 216 TRP HB2 B 209 TRP HE3 1.0 1.8 4.6 38 38 B 217 THR HA B 209 TRP HE3 1.0 1.8 4.4 39 39 B 209 TRP HA B 218 TRP HA 1.0 1.8 3.5 40 40 B 209 TRP HA B 218 TRP HB3 1.0 1.8 5.8 41 41 B 210 THR HA B 210 THR HB 1.0 1.8 3.4 42 42 B 210 THR HB B 210 THR HG2% 1.0 1.8 3.1 43 43 B 210 THR HA B 210 THR HG2% 1.0 1.8 3.7 44 44 B 210 THR HB B 211 TRP H 1.0 1.8 3.8 45 45 B 210 THR HA B 211 TRP HB3 1.0 1.8 4.7 46 46 B 210 THR HA B 211 TRP H 1.0 1.8 3.4 47 47 B 211 TRP H B 211 TRP HB3 1.0 1.8 3.8 48 48 B 211 TRP HA B 211 TRP HB3 1.0 1.8 4.2 49 49 B 211 TRP HB3 B 211 TRP HE3 1.0 1.8 4.4 50 50 B 214 GLY HA2 B 211 TRP HZ3 1.0 1.8 4.4 51 51 B 215 LYS HA B 211 TRP HE3 1.0 1.8 4.6 52 52 B 215 LYS HA B 216 TRP H 1.0 1.8 3.7 53 53 B 215 LYS HB3 B 216 TRP H 1.0 1.8 4.3 54 54 B 216 TRP HA B 216 TRP HB2 1.0 1.8 4.4 55 55 B 216 TRP HB3 B 216 TRP HB2 1.0 1.8 3.8 56 56 B 216 TRP H B 216 TRP HB3 1.0 1.8 4.7 57 57 B 216 TRP H B 216 TRP HB2 1.0 1.8 4.4 58 58 B 216 TRP HA B 217 THR H 1.0 1.8 3.9 59 59 B 217 THR HA B 218 TRP H 1.0 1.8 3.4 60 60 B 218 TRP H B 217 THR HG2% 1.0 1.8 3.8 61 61 B 219 LYS HE3 B 217 THR HG2% 1.0 1.8 3.8 62 62 B 218 TRP H B 218 TRP HB3 1.0 1.8 4.3 63 63 B 218 TRP HB3 B 218 TRP HD1 1.0 1.8 4.4 64 64 B 218 TRP HA B 219 LYS H 1.0 1.8 3.3 65 65 B 219 LYS HA B 220 GLY HA2 1.0 1.8 4.3 66 66 B 219 LYS HA B 220 GLY H 1.0 1.8 3.2 67 67 B 219 LYS HB2 B 220 GLY H 1.0 1.8 4.6 68 68 B 219 LYS HB3 B 220 GLY H 1.0 1.8 4.3 69 69 B 219 LYS HG3 B 220 GLY H 1.0 1.8 4.7 70 70 B 219 LYS HG2 B 220 GLY H 1.0 1.8 4.6 71 71 A 12 LEU HB2 B 209 TRP HZ2 1.0 1.8 4.8 72 72 B 209 TRP HZ2 A 12 LEU HD2% 1.0 1.8 5.6 73 73 A 12 LEU HB2 B 218 TRP HZ3 1.0 1.8 5.6 74 74 B 207 GLY HA3 B 218 TRP HZ2 1.0 1.8 5.2 75 75 B 208 SER HA B 209 TRP HD1 1.0 1.8 5.6 76 76 B 209 TRP HD1 B 209 TRP HB3 1.0 1.8 4.9 77 77 B 209 TRP HD1 B 209 TRP HE1 1.0 1.8 4.5 78 78 B 209 TRP HD1 B 209 TRP H 1.0 1.8 5.2 79 79 B 209 TRP HZ2 B 209 TRP HH2 1.0 1.8 5.1 80 80 B 209 TRP HD1 B 218 TRP HZ3 1.0 1.8 5.6 81 81 B 211 TRP HZ3 B 211 TRP HH2 1.0 1.8 5.5 82 82 B 211 TRP HH2 B 211 TRP HZ2 1.0 1.8 5.2 83 83 B 211 TRP HE3 B 211 TRP HZ3 1.0 1.8 4.7 84 84 B 211 TRP HZ2 B 211 TRP HE1 1.0 1.8 4.8 85 85 B 214 GLY HA3 B 211 TRP HZ2 1.0 1.8 5.5 86 86 B 214 GLY HA2 B 211 TRP HZ2 1.0 1.8 5.1 87 87 B 216 TRP HD1 B 216 TRP HE1 1.0 1.8 5.2 88 88 B 218 TRP HD1 B 218 TRP HE1 1.0 1.8 5.0 89 89 B 218 TRP HH2 B 218 TRP HZ3 1.0 1.8 4.5 90 90 B 218 TRP HH2 B 218 TRP HZ2 1.0 1.8 4.3 91 91 B 218 TRP HZ3 B 218 TRP HZ2 1.0 1.8 5.5 92 92 B 218 TRP HZ2 B 218 TRP HE1 1.0 1.8 5.0 93 93 A 11 ASP HA B 209 TRP HE1 1.0 1.8 4.1 94 94 B 209 TRP HE1 A 12 LEU HB3 1.0 1.8 4.5 95 95 A 12 LEU HB2 B 209 TRP HE1 1.0 1.8 4.5 96 96 B 207 GLY HA3 B 218 TRP HE1 1.0 1.8 4.6 97 97 B 208 SER H B 209 TRP H 1.0 1.8 4.9 98 98 B 208 SER HA B 209 TRP H 1.0 1.8 3.3 99 99 B 208 SER HB2 B 209 TRP H 1.0 1.8 3.5 100 100 B 209 TRP HZ2 B 209 TRP HE1 1.0 1.8 4.0 101 101 B 209 TRP H B 209 TRP HA 1.0 1.8 4.3 102 102 B 209 TRP H B 209 TRP HB2 1.0 1.8 3.6 103 103 B 209 TRP HD1 B 209 TRP H 1.0 1.8 4.0 104 104 B 211 TRP HB3 B 212 GLU H 1.0 1.8 4.8 105 105 B 215 LYS HA B 216 TRP H 1.0 1.8 4.3 106 106 B 218 TRP HZ2 B 218 TRP HE1 1.0 1.8 3.4 107 107 B 218 TRP HD1 B 218 TRP HE1 1.0 1.8 3.2 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 210 THR H B 217 THR O 1.0 1.8 2.5 2 2 B 217 THR H B 210 THR O 1.0 1.8 2.5 3 3 B 212 GLU H B 215 LYS O 1.0 1.8 2.5 4 4 B 215 LYS H B 212 GLU O 1.0 1.8 2.5 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _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 4 SER C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 -130.0 -50.0 PHI 2 2 A 5 GLU N A 5 GLU CA A 5 GLU C A 6 VAL N 1.0 60.0 180.0 PSI 3 3 A 5 GLU C A 6 VAL N A 6 VAL CA A 6 VAL C 1.0 -145.2 -54.6 PHI 4 4 A 6 VAL N A 6 VAL CA A 6 VAL C A 7 PRO N 1.0 75.7 206.7 PSI 5 5 A 6 VAL C A 7 PRO N A 7 PRO CA A 7 PRO C 1.0 -130.0 -50.0 PHI 6 6 A 7 PRO N A 7 PRO CA A 7 PRO C A 8 GLN N 1.0 60.0 180.0 PSI 7 7 A 8 GLN C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -130.0 -50.0 PHI 8 8 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 THR N 1.0 50.0 130.0 PSI 9 9 A 9 LEU C A 10 THR N A 10 THR CA A 10 THR C 1.0 -130.0 -50.0 PHI 10 10 A 10 THR N A 10 THR CA A 10 THR C A 11 ASP N 1.0 60.0 180.0 PSI 11 11 A 10 THR C A 11 ASP N A 11 ASP CA A 11 ASP C 1.0 -140.0 -80.0 PHI 12 12 A 11 ASP N A 11 ASP CA A 11 ASP C A 12 LEU N 1.0 90.0 170.0 PSI 13 13 A 11 ASP C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -105.5 -65.5 PHI 14 14 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 SER N 1.0 111.7 151.7 PSI 15 15 A 12 LEU C A 13 SER N A 13 SER CA A 13 SER C 1.0 -152.5 -53.7 PHI 16 16 A 13 SER N A 13 SER CA A 13 SER C A 14 PHE N 1.0 138.3 190.3 PSI 17 17 A 13 SER C A 14 PHE N A 14 PHE CA A 14 PHE C 1.0 -110.0 -55.2 PHI 18 18 A 14 PHE N A 14 PHE CA A 14 PHE C A 15 VAL N 1.0 100.4 180.6 PSI 19 19 A 14 PHE C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -177.5 -65.7 PHI 20 20 A 15 VAL N A 15 VAL CA A 15 VAL C A 16 ASP N 1.0 142.4 188.2 PSI 21 21 A 15 VAL C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 33.2 73.2 PHI 22 22 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 ILE N 1.0 24.5 64.5 PSI 23 23 A 16 ASP C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -97.0 -57.0 PHI 24 24 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 THR N 1.0 116.2 156.2 PSI 25 25 A 17 ILE C A 18 THR N A 18 THR CA A 18 THR C 1.0 -160.0 -80.0 PHI 26 26 A 18 THR N A 18 THR CA A 18 THR C A 19 ASP N 1.0 110.0 190.0 PSI 27 27 A 18 THR C A 19 ASP N A 19 ASP CA A 19 ASP C 1.0 -90.0 -50.0 PHI 28 28 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 SER N 1.0 -60.0 0.0 PSI 29 29 A 19 ASP C A 20 SER N A 20 SER CA A 20 SER C 1.0 -120.0 -80.0 PHI 30 30 A 20 SER N A 20 SER CA A 20 SER C A 21 SER N 1.0 -40.0 40.0 PSI 31 31 A 21 SER C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -151.8 -111.8 PHI 32 32 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 GLY N 1.0 132.5 172.5 PSI 33 33 A 23 GLY C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -110.0 -50.0 PHI 34 34 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 ARG N 1.0 105.2 156.6 PSI 35 35 A 24 LEU C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -156.9 -102.7 PHI 36 36 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 TRP N 1.0 134.9 174.9 PSI 37 37 A 25 ARG C A 26 TRP N A 26 TRP CA A 26 TRP C 1.0 -146.1 -62.3 PHI 38 38 A 26 TRP N A 26 TRP CA A 26 TRP C A 27 THR N 1.0 102.7 162.7 PSI 39 39 A 26 TRP C A 27 THR N A 27 THR CA A 27 THR C 1.0 -110.0 -70.0 PHI 40 40 A 27 THR N A 27 THR CA A 27 THR C A 28 PRO N 1.0 90.2 130.2 PSI 41 41 A 28 PRO N A 28 PRO CA A 28 PRO C A 29 LEU N 1.0 110.0 150.0 PSI 42 42 A 28 PRO C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -120.0 -80.0 PHI 43 43 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 ASN N 1.0 105.0 145.0 PSI 44 44 A 30 ASN C A 31 SER N A 31 SER CA A 31 SER C 1.0 -90.0 -30.0 PHI 45 45 A 31 SER N A 31 SER CA A 31 SER C A 32 SER N 1.0 -60.0 -20.0 PSI 46 46 A 32 SER N A 32 SER CA A 32 SER C A 33 THR N 1.0 110.0 150.0 PSI 47 47 A 32 SER C A 33 THR N A 33 THR CA A 33 THR C 1.0 -105.0 -55.0 PHI 48 48 A 33 THR N A 33 THR CA A 33 THR C A 34 ILE N 1.0 135.0 185.0 PSI 49 49 A 33 THR C A 34 ILE N A 34 ILE CA A 34 ILE C 1.0 -145.0 -95.0 PHI 50 50 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 ILE N 1.0 75.0 125.0 PSI 51 51 A 34 ILE C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -175.0 -125.0 PHI 52 52 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 GLY N 1.0 105.0 155.0 PSI 53 53 A 36 GLY C A 37 TYR N A 37 TYR CA A 37 TYR C 1.0 -140.0 -80.0 PHI 54 54 A 37 TYR N A 37 TYR CA A 37 TYR C A 38 ARG N 1.0 120.0 180.0 PSI 55 55 A 37 TYR C A 38 ARG N A 38 ARG CA A 38 ARG C 1.0 -143.2 -77.8 PHI 56 56 A 38 ARG N A 38 ARG CA A 38 ARG C A 39 ILE N 1.0 95.8 152.8 PSI 57 57 A 38 ARG C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 -136.3 -96.3 PHI 58 58 A 39 ILE N A 39 ILE CA A 39 ILE C A 40 THR N 1.0 105.6 155.6 PSI 59 59 A 39 ILE C A 40 THR N A 40 THR CA A 40 THR C 1.0 -164.5 -95.9 PHI 60 60 A 40 THR N A 40 THR CA A 40 THR C A 41 VAL N 1.0 100.3 178.1 PSI 61 61 A 40 THR C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -134.4 -94.4 PHI 62 62 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 VAL N 1.0 109.2 149.2 PSI 63 63 A 41 VAL C A 42 VAL N A 42 VAL CA A 42 VAL C 1.0 -148.5 -98.1 PHI 64 64 A 42 VAL N A 42 VAL CA A 42 VAL C A 43 ALA N 1.0 103.8 163.2 PSI 65 65 A 42 VAL C A 43 ALA N A 43 ALA CA A 43 ALA C 1.0 -131.4 -42.8 PHI 66 66 A 43 ALA N A 43 ALA CA A 43 ALA C A 44 ALA N 1.0 110.0 170.0 PSI 67 67 A 43 ALA C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -100.0 -40.0 PHI 68 68 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 GLY N 1.0 -70.0 -10.0 PSI 69 69 A 44 ALA C A 45 GLY N A 45 GLY CA A 45 GLY C 1.0 -100.0 -40.0 PHI 70 70 A 45 GLY N A 45 GLY CA A 45 GLY C A 46 GLU N 1.0 -30.0 30.0 PSI 71 71 A 45 GLY C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -160.0 -100.0 PHI 72 72 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 GLY N 1.0 90.0 150.0 PSI 73 73 A 46 GLU C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 -120.0 -60.0 PHI 74 74 A 47 GLY N A 47 GLY CA A 47 GLY C A 48 ILE N 1.0 -20.0 40.0 PSI 75 75 A 47 GLY C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -140.0 -80.0 PHI 76 76 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 PRO N 1.0 100.0 160.0 PSI 77 77 A 49 PRO N A 49 PRO CA A 49 PRO C A 50 ILE N 1.0 127.5 168.5 PSI 78 78 A 49 PRO C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -110.0 -50.0 PHI 79 79 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 PHE N 1.0 100.0 160.0 PSI 80 80 A 51 PHE C A 52 GLU N A 52 GLU CA A 52 GLU C 1.0 -110.0 -50.0 PHI 81 81 A 52 GLU N A 52 GLU CA A 52 GLU C A 53 ASP N 1.0 115.0 185.0 PSI 82 82 A 52 GLU C A 53 ASP N A 53 ASP CA A 53 ASP C 1.0 -171.3 -92.3 PHI 83 83 A 53 ASP N A 53 ASP CA A 53 ASP C A 54 PHE N 1.0 129.4 169.8 PSI 84 84 A 53 ASP C A 54 PHE N A 54 PHE CA A 54 PHE C 1.0 -143.1 -97.9 PHI 85 85 A 54 PHE N A 54 PHE CA A 54 PHE C A 55 VAL N 1.0 108.9 148.9 PSI 86 86 A 54 PHE C A 55 VAL N A 55 VAL CA A 55 VAL C 1.0 -145.5 -95.9 PHI 87 87 A 55 VAL N A 55 VAL CA A 55 VAL C A 56 ASP N 1.0 102.3 180.5 PSI 88 88 A 55 VAL C A 56 ASP N A 56 ASP CA A 56 ASP C 1.0 -137.0 -31.0 PHI 89 89 A 56 ASP N A 56 ASP CA A 56 ASP C A 57 SER N 1.0 100.3 180.1 PSI 90 90 A 56 ASP C A 57 SER N A 57 SER CA A 57 SER C 1.0 -107.7 -25.9 PHI 91 91 A 57 SER N A 57 SER CA A 57 SER C A 58 SER N 1.0 -63.6 11.2 PSI 92 92 A 57 SER C A 58 SER N A 58 SER CA A 58 SER C 1.0 -82.5 -42.5 PHI 93 93 A 58 SER N A 58 SER CA A 58 SER C A 59 VAL N 1.0 -62.1 -22.1 PSI 94 94 A 58 SER C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -90.2 -45.0 PHI 95 95 A 60 GLY N A 60 GLY CA A 60 GLY C A 61 TYR N 1.0 -44.4 25.4 PSI 96 96 A 60 GLY C A 61 TYR N A 61 TYR CA A 61 TYR C 1.0 -169.1 -103.3 PHI 97 97 A 61 TYR N A 61 TYR CA A 61 TYR C A 62 TYR N 1.0 96.7 156.7 PSI 98 98 A 61 TYR C A 62 TYR N A 62 TYR CA A 62 TYR C 1.0 -170.0 -110.0 PHI 99 99 A 62 TYR N A 62 TYR CA A 62 TYR C A 63 THR N 1.0 110.0 170.0 PSI 100 100 A 62 TYR C A 63 THR N A 63 THR CA A 63 THR C 1.0 -130.0 -90.0 PHI 101 101 A 63 THR N A 63 THR CA A 63 THR C A 64 VAL N 1.0 100.0 140.0 PSI 102 102 A 63 THR C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -130.0 -50.0 PHI 103 103 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 THR N 1.0 100.0 160.0 PSI 104 104 A 64 VAL C A 65 THR N A 65 THR CA A 65 THR C 1.0 -156.3 -74.3 PHI 105 105 A 65 THR N A 65 THR CA A 65 THR C A 66 GLY N 1.0 144.4 185.0 PSI 106 106 A 65 THR C A 66 GLY N A 66 GLY CA A 66 GLY C 1.0 2.3 112.3 PHI 107 107 A 66 GLY N A 66 GLY CA A 66 GLY C A 67 LEU N 1.0 -2.5 71.1 PSI 108 108 A 66 GLY C A 67 LEU N A 67 LEU CA A 67 LEU C 1.0 -127.4 -59.4 PHI 109 109 A 67 LEU N A 67 LEU CA A 67 LEU C A 68 GLU N 1.0 97.5 177.5 PSI 110 110 A 67 LEU C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -155.6 -46.2 PHI 111 111 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 PRO N 1.0 43.1 176.3 PSI 112 112 A 69 PRO C A 70 GLY N A 70 GLY CA A 70 GLY C 1.0 40.8 104.8 PHI 113 113 A 70 GLY N A 70 GLY CA A 70 GLY C A 71 ILE N 1.0 -33.2 73.2 PSI 114 114 A 70 GLY C A 71 ILE N A 71 ILE CA A 71 ILE C 1.0 -125.6 -65.2 PHI 115 115 A 71 ILE N A 71 ILE CA A 71 ILE C A 72 ASP N 1.0 92.9 180.3 PSI 116 116 A 72 ASP N A 72 ASP CA A 72 ASP C A 73 TYR N 1.0 100.0 140.0 PSI 117 117 A 72 ASP C A 73 TYR N A 73 TYR CA A 73 TYR C 1.0 -147.6 -54.6 PHI 118 118 A 73 TYR N A 73 TYR CA A 73 TYR C A 74 ASP N 1.0 109.0 169.4 PSI 119 119 A 73 TYR C A 74 ASP N A 74 ASP CA A 74 ASP C 1.0 -158.0 -56.4 PHI 120 120 A 74 ASP N A 74 ASP CA A 74 ASP C A 75 ILE N 1.0 100.5 149.9 PSI 121 121 A 74 ASP C A 75 ILE N A 75 ILE CA A 75 ILE C 1.0 -125.0 -55.0 PHI 122 122 A 75 ILE N A 75 ILE CA A 75 ILE C A 76 SER N 1.0 120.0 180.0 PSI 123 123 A 75 ILE C A 76 SER N A 76 SER CA A 76 SER C 1.0 -155.0 -85.0 PHI 124 124 A 76 SER N A 76 SER CA A 76 SER C A 77 VAL N 1.0 105.3 151.1 PSI 125 125 A 76 SER C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -132.2 -82.8 PHI 126 126 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 ILE N 1.0 101.7 153.7 PSI 127 127 A 77 VAL C A 78 ILE N A 78 ILE CA A 78 ILE C 1.0 -153.0 -75.8 PHI 128 128 A 78 ILE N A 78 ILE CA A 78 ILE C A 79 THR N 1.0 95.9 166.5 PSI 129 129 A 78 ILE C A 79 THR N A 79 THR CA A 79 THR C 1.0 -129.2 -52.4 PHI 130 130 A 79 THR N A 79 THR CA A 79 THR C A 80 LEU N 1.0 106.8 146.8 PSI 131 131 A 79 THR C A 80 LEU N A 80 LEU CA A 80 LEU C 1.0 -120.2 -76.6 PHI 132 132 A 80 LEU N A 80 LEU CA A 80 LEU C A 81 ILE N 1.0 90.1 139.9 PSI 133 133 A 80 LEU C A 81 ILE N A 81 ILE CA A 81 ILE C 1.0 -145.7 -98.1 PHI 134 134 A 81 ILE C A 82 ASN N A 82 ASN CA A 82 ASN C 1.0 -88.8 -28.8 PHI 135 135 A 82 ASN N A 82 ASN CA A 82 ASN C A 83 GLY N 1.0 -90.0 -30.0 PSI 136 136 A 83 GLY C A 84 GLY N A 84 GLY CA A 84 GLY C 1.0 -117.0 -37.0 PHI 137 137 A 84 GLY N A 84 GLY CA A 84 GLY C A 85 GLU N 1.0 106.1 187.9 PSI 138 138 A 84 GLY C A 85 GLU N A 85 GLU CA A 85 GLU C 1.0 -100.0 -20.0 PHI 139 139 A 85 GLU N A 85 GLU CA A 85 GLU C A 86 SER N 1.0 84.1 165.9 PSI 140 140 A 85 GLU C A 86 SER N A 86 SER CA A 86 SER C 1.0 -97.0 -17.0 PHI 141 141 A 86 SER N A 86 SER CA A 86 SER C A 87 ALA N 1.0 107.1 188.9 PSI 142 142 A 88 PRO C A 89 THR N A 89 THR CA A 89 THR C 1.0 -142.0 -62.0 PHI 143 143 A 89 THR N A 89 THR CA A 89 THR C A 90 THR N 1.0 86.1 167.9 PSI 144 144 A 89 THR C A 90 THR N A 90 THR CA A 90 THR C 1.0 -167.0 -87.0 PHI 145 145 A 90 THR N A 90 THR CA A 90 THR C A 91 LEU N 1.0 102.1 183.9 PSI 146 146 A 90 THR C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -102.0 -22.0 PHI 147 147 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 THR N 1.0 97.1 178.9 PSI 148 148 A 91 LEU C A 92 THR N A 92 THR CA A 92 THR C 1.0 -95.0 -15.0 PHI 149 149 A 92 THR N A 92 THR CA A 92 THR C A 93 GLN N 1.0 96.1 177.9 PSI 150 150 A 92 THR C A 93 GLN N A 93 GLN CA A 93 GLN C 1.0 -103.0 -23.0 PHI 151 151 A 93 GLN N A 93 GLN CA A 93 GLN C A 94 GLN N 1.0 90.1 171.9 PSI 152 152 A 94 GLN C A 95 THR N A 95 THR CA A 95 THR C 1.0 -150.1 -66.1 PHI 153 153 B 201 SER N B 201 SER CA B 201 SER C B 202 SER N 1.0 120.0 160.0 PSI 154 154 B 201 SER C B 202 SER N B 202 SER CA B 202 SER C 1.0 -80.0 -40.0 PHI 155 155 B 202 SER N B 202 SER CA B 202 SER C B 203 SER N 1.0 120.0 160.0 PSI 156 156 B 202 SER C B 203 SER N B 203 SER CA B 203 SER C 1.0 -135.0 -85.0 PHI 157 157 B 203 SER N B 203 SER CA B 203 SER C B 204 PRO N 1.0 105.0 155.0 PSI 158 158 B 204 PRO C B 205 ILE N B 205 ILE CA B 205 ILE C 1.0 -155.0 -105.0 PHI 159 159 B 205 ILE N B 205 ILE CA B 205 ILE C B 206 GLN N 1.0 140.0 180.0 PSI 160 160 B 205 ILE C B 206 GLN N B 206 GLN CA B 206 GLN C 1.0 -190.0 -110.0 PHI 161 161 B 206 GLN N B 206 GLN CA B 206 GLN C B 207 GLY N 1.0 80.0 160.0 PSI 162 162 B 206 GLN C B 207 GLY N B 207 GLY CA B 207 GLY C 1.0 -110.0 -70.0 PHI 163 163 B 207 GLY N B 207 GLY CA B 207 GLY C B 208 SER N 1.0 -160.0 -120.0 PSI 164 164 B 207 GLY C B 208 SER N B 208 SER CA B 208 SER C 1.0 -180.0 -120.0 PHI 165 165 B 208 SER N B 208 SER CA B 208 SER C B 209 TRP N 1.0 110.0 170.0 PSI 166 166 B 208 SER C B 209 TRP N B 209 TRP CA B 209 TRP C 1.0 -110.0 -70.0 PHI 167 167 B 209 TRP N B 209 TRP CA B 209 TRP C B 210 THR N 1.0 101.5 158.3 PSI 168 168 B 209 TRP C B 210 THR N B 210 THR CA B 210 THR C 1.0 -144.1 -82.3 PHI 169 169 B 210 THR N B 210 THR CA B 210 THR C B 211 TRP N 1.0 130.0 170.0 PSI 170 170 B 210 THR C B 211 TRP N B 211 TRP CA B 211 TRP C 1.0 -121.1 -75.7 PHI 171 171 B 211 TRP N B 211 TRP CA B 211 TRP C B 212 GLU N 1.0 105.0 152.8 PSI 172 172 B 211 TRP C B 212 GLU N B 212 GLU CA B 212 GLU C 1.0 -165.0 -115.0 PHI 173 173 B 212 GLU N B 212 GLU CA B 212 GLU C B 213 ASN N 1.0 93.8 173.8 PSI 174 174 B 212 GLU C B 213 ASN N B 213 ASN CA B 213 ASN C 1.0 20.0 60.0 PHI 175 175 B 213 ASN N B 213 ASN CA B 213 ASN C B 214 GLY N 1.0 30.0 70.0 PSI 176 176 B 213 ASN C B 214 GLY N B 214 GLY CA B 214 GLY C 1.0 50.1 101.3 PHI 177 177 B 214 GLY N B 214 GLY CA B 214 GLY C B 215 LYS N 1.0 -24.6 36.8 PSI 178 178 B 214 GLY C B 215 LYS N B 215 LYS CA B 215 LYS C 1.0 -160.0 -120.0 PHI 179 179 B 215 LYS N B 215 LYS CA B 215 LYS C B 216 TRP N 1.0 150.0 190.0 PSI 180 180 B 215 LYS C B 216 TRP N B 216 TRP CA B 216 TRP C 1.0 -126.0 -86.0 PHI 181 181 B 216 TRP N B 216 TRP CA B 216 TRP C B 217 THR N 1.0 115.0 155.0 PSI 182 182 B 216 TRP C B 217 THR N B 217 THR CA B 217 THR C 1.0 -140.0 -100.0 PHI 183 183 B 217 THR N B 217 THR CA B 217 THR C B 218 TRP N 1.0 130.0 170.0 PSI 184 184 B 217 THR C B 218 TRP N B 218 TRP CA B 218 TRP C 1.0 -105.0 -65.0 PHI 185 185 B 218 TRP N B 218 TRP CA B 218 TRP C B 219 LYS N 1.0 80.0 120.0 PSI 186 186 B 218 TRP C B 219 LYS N B 219 LYS CA B 219 LYS C 1.0 -170.0 -130.0 PHI 187 187 B 219 LYS N B 219 LYS CA B 219 LYS C B 220 GLY N 1.0 140.0 180.0 PSI 188 188 B 219 LYS C B 220 GLY N B 220 GLY CA B 220 GLY C 1.0 140.0 180.0 PHI 189 189 B 220 GLY N B 220 GLY CA B 220 GLY C B 221 ILE N 1.0 -160.0 -120.0 PSI 190 190 B 220 GLY C B 221 ILE N B 221 ILE CA B 221 ILE C 1.0 -110.0 -50.0 PHI 191 191 B 221 ILE N B 221 ILE CA B 221 ILE C B 222 ILE N 1.0 -75.0 15.0 PSI 192 192 B 221 ILE C B 222 ILE N B 222 ILE CA B 222 ILE C 1.0 -160.0 -80.0 PHI 193 193 B 222 ILE N B 222 ILE CA B 222 ILE C B 223 ARG N 1.0 85.0 195.0 PSI 194 194 B 222 ILE C B 223 ARG N B 223 ARG CA B 223 ARG C 1.0 -90.0 -30.0 PHI 195 195 B 223 ARG N B 223 ARG CA B 223 ARG C B 224 LEU N 1.0 85.0 175.0 PSI 196 196 B 223 ARG C B 224 LEU N B 224 LEU CA B 224 LEU C 1.0 -120.0 -60.0 PHI 197 197 B 224 LEU N B 224 LEU CA B 224 LEU C B 225 GLU N 1.0 110.0 150.0 PSI 198 198 B 224 LEU C B 225 GLU N B 225 GLU CA B 225 GLU C 1.0 -120.0 -80.0 PHI 199 199 B 225 GLU N B 225 GLU CA B 225 GLU C B 226 GLN N 1.0 120.0 160.0 PSI 200 200 A 14 PHE N A 14 PHE CA A 14 PHE CB A 14 PHE CG 1.0 -80.0 -40.0 CHI1 201 201 A 17 ILE N A 17 ILE CA A 17 ILE CB A 17 ILE CG1 1.0 -80.0 -40.0 CHI1 202 202 A 22 ILE N A 22 ILE CA A 22 ILE CB A 22 ILE CG1 1.0 40.0 80.0 CHI1 203 203 A 26 TRP N A 26 TRP CA A 26 TRP CB A 26 TRP CG 1.0 40.0 80.0 CHI1 204 204 A 34 ILE N A 34 ILE CA A 34 ILE CB A 34 ILE CG1 1.0 -80.0 -40.0 CHI1 205 205 A 35 ILE N A 35 ILE CA A 35 ILE CB A 35 ILE CG1 1.0 40.0 80.0 CHI1 206 206 A 38 ARG N A 38 ARG CA A 38 ARG CB A 38 ARG CG 1.0 160.0 200.0 CHI1 207 207 A 54 PHE N A 54 PHE CA A 54 PHE CB A 54 PHE CG 1.0 -80.0 -40.0 CHI1 208 208 A 72 ASP N A 72 ASP CA A 72 ASP CB A 72 ASP CG 1.0 150.0 210.0 CHI1 209 209 A 73 TYR N A 73 TYR CA A 73 TYR CB A 73 TYR CG 1.0 -90.0 -30.0 CHI1 210 210 A 78 ILE N A 78 ILE CA A 78 ILE CB A 78 ILE CG1 1.0 -80.0 -40.0 CHI1 211 211 B 205 ILE N B 205 ILE CA B 205 ILE CB B 205 ILE CG1 1.0 160.0 200.0 CHI1 212 212 B 209 TRP N B 209 TRP CA B 209 TRP CB B 209 TRP CG 1.0 -80.0 -40.0 CHI1 213 213 B 210 THR N B 210 THR CA B 210 THR CB B 210 THR OG1 1.0 40.0 80.0 CHI1 214 214 B 211 TRP N B 211 TRP CA B 211 TRP CB B 211 TRP CG 1.0 160.0 200.0 CHI1 215 215 B 213 ASN N B 213 ASN CA B 213 ASN CB B 213 ASN CG 1.0 -80.0 -40.0 CHI1 216 216 B 215 LYS N B 215 LYS CA B 215 LYS CB B 215 LYS CG 1.0 -80.0 -40.0 CHI1 217 217 B 216 TRP N B 216 TRP CA B 216 TRP CB B 216 TRP CG 1.0 -80.0 -40.0 CHI1 218 218 B 216 TRP CA B 216 TRP CB B 216 TRP CG B 216 TRP CD1 1.0 70.0 110.0 CHI2 219 219 B 217 THR N B 217 THR CA B 217 THR CB B 217 THR OG1 1.0 -80.0 -40.0 CHI1 220 220 B 218 TRP N B 218 TRP CA B 218 TRP CB B 218 TRP CG 1.0 160.0 200.0 CHI1 221 221 B 219 LYS N B 219 LYS CA B 219 LYS CB B 219 LYS CG 1.0 -80.0 -40.0 CHI1 222 222 B 222 ILE N B 222 ILE CA B 222 ILE CB B 222 ILE CG1 1.0 40.0 80.0 CHI1 223 223 B 223 ARG N B 223 ARG CA B 223 ARG CB B 223 ARG CG 1.0 40.0 80.0 CHI1 224 224 B 224 LEU N B 224 LEU CA B 224 LEU CB B 224 LEU CG 1.0 -80.0 -40.0 CHI1 225 225 B 225 GLU N B 225 GLU CA B 225 GLU CB B 225 GLU CG 1.0 150.0 210.0 CHI1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_6 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_6 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 12 LEU N A 12 LEU H 1.0 . . . 2 2 A 13 SER N A 13 SER H 1.0 . . . 3 3 A 14 PHE N A 14 PHE H 1.0 . . . 4 4 A 15 VAL N A 15 VAL H 1.0 . . . 5 5 A 16 ASP N A 16 ASP H 1.0 . . . 6 6 A 17 ILE N A 17 ILE H 1.0 . . . 7 7 A 19 ASP N A 19 ASP H 1.0 . . . 8 8 A 20 SER N A 20 SER H 1.0 . . . 9 9 A 21 SER N A 21 SER H 1.0 . . . 10 10 A 22 ILE N A 22 ILE H 1.0 . . . 11 11 A 23 GLY N A 23 GLY H 1.0 . . . 12 12 A 24 LEU N A 24 LEU H 1.0 . . . 13 13 A 25 ARG N A 25 ARG H 1.0 . . . 14 14 A 26 TRP N A 26 TRP H 1.0 . . . 15 15 A 29 LEU N A 29 LEU H 1.0 . . . 16 16 A 30 ASN N A 30 ASN H 1.0 . . . 17 17 A 31 SER N A 31 SER H 1.0 . . . 18 18 A 33 THR N A 33 THR H 1.0 . . . 19 19 A 35 ILE N A 35 ILE H 1.0 . . . 20 20 A 39 ILE N A 39 ILE H 1.0 . . . 21 21 A 40 THR N A 40 THR H 1.0 . . . 22 22 A 42 VAL N A 42 VAL H 1.0 . . . 23 23 A 43 ALA N A 43 ALA H 1.0 . . . 24 24 A 44 ALA N A 44 ALA H 1.0 . . . 25 25 A 46 GLU N A 46 GLU H 1.0 . . . 26 26 A 53 ASP N A 53 ASP H 1.0 . . . 27 27 A 54 PHE N A 54 PHE H 1.0 . . . 28 28 A 55 VAL N A 55 VAL H 1.0 . . . 29 29 A 56 ASP N A 56 ASP H 1.0 . . . 30 30 A 57 SER N A 57 SER H 1.0 . . . 31 31 A 58 SER N A 58 SER H 1.0 . . . 32 32 A 59 VAL N A 59 VAL H 1.0 . . . 33 33 A 60 GLY N A 60 GLY H 1.0 . . . 34 34 A 61 TYR N A 61 TYR H 1.0 . . . 35 35 A 62 TYR N A 62 TYR H 1.0 . . . 36 36 A 63 THR N A 63 THR H 1.0 . . . 37 37 A 64 VAL N A 64 VAL H 1.0 . . . 38 38 A 66 GLY N A 66 GLY H 1.0 . . . 39 39 A 67 LEU N A 67 LEU H 1.0 . . . 40 40 A 68 GLU N A 68 GLU H 1.0 . . . 41 41 A 70 GLY N A 70 GLY H 1.0 . . . 42 42 A 71 ILE N A 71 ILE H 1.0 . . . 43 43 A 73 TYR N A 73 TYR H 1.0 . . . 44 44 A 74 ASP N A 74 ASP H 1.0 . . . 45 45 A 75 ILE N A 75 ILE H 1.0 . . . 46 46 A 76 SER N A 76 SER H 1.0 . . . 47 47 A 77 VAL N A 77 VAL H 1.0 . . . 48 48 A 78 ILE N A 78 ILE H 1.0 . . . 49 49 A 79 THR N A 79 THR H 1.0 . . . 50 50 A 80 LEU N A 80 LEU H 1.0 . . . 51 51 B 203 SER N B 203 SER H 1.0 . . . 52 52 B 205 ILE N B 205 ILE H 1.0 . . . 53 53 B 206 GLN N B 206 GLN H 1.0 . . . 54 54 B 207 GLY N B 207 GLY H 1.0 . . . 55 55 B 208 SER N B 208 SER H 1.0 . . . 56 56 B 209 TRP N B 209 TRP H 1.0 . . . 57 57 B 210 THR N B 210 THR H 1.0 . . . 58 58 B 211 TRP N B 211 TRP H 1.0 . . . 59 59 B 212 GLU N B 212 GLU H 1.0 . . . 60 60 B 214 GLY N B 214 GLY H 1.0 . . . 61 61 B 215 LYS N B 215 LYS H 1.0 . . . 62 62 B 216 TRP N B 216 TRP H 1.0 . . . 63 63 B 217 THR N B 217 THR H 1.0 . . . 64 64 B 218 TRP N B 218 TRP H 1.0 . . . 65 65 B 219 LYS N B 219 LYS H 1.0 . . . 66 66 B 220 GLY N B 220 GLY H 1.0 . . . 67 67 B 221 ILE N B 221 ILE H 1.0 . . . 68 68 B 222 ILE N B 222 ILE H 1.0 . . . 69 69 B 223 ARG N B 223 ARG H 1.0 . . . 70 70 B 224 LEU N B 224 LEU H 1.0 . . . 71 71 B 225 GLU N B 225 GLU H 1.0 . . . 72 72 B 226 GLN N B 226 GLN H 1.0 . . . stop_ save_