data_nef_c34234_6fi7 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6FI7 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 13 GLY start . false 2 A 14 PRO middle . false 3 A 15 GLU middle . . 4 A 16 ASP middle . . 5 A 17 THR middle . . 6 A 18 THR middle . . 7 A 19 GLN middle . . 8 A 20 ASP middle . . 9 A 21 ASP middle . . 10 A 22 ASP middle . . 11 A 23 MET middle . . 12 A 24 LYS middle . . 13 A 25 GLN middle . . 14 A 26 SER middle . . 15 A 27 ILE middle . . 16 A 28 VAL middle . . 17 A 29 LYS middle . . 18 A 30 TRP middle . . 19 A 31 LEU middle . . 20 A 32 PHE middle . . 21 A 33 GLU middle . . 22 A 34 LEU middle . . 23 A 35 ASN middle . . 24 A 36 ALA middle . . 25 A 37 LYS middle . . 26 A 38 GLN middle . . 27 A 39 ARG middle . . 28 A 40 GLU middle . . 29 A 41 VAL middle . . 30 A 42 LEU middle . . 31 A 43 ALA middle . . 32 A 44 ARG middle . . 33 A 45 ARG middle . . 34 A 46 PHE middle . . 35 A 47 GLY middle . false 36 A 48 LEU middle . . 37 A 49 LEU middle . . 38 A 50 GLY middle . false 39 A 51 TYR middle . . 40 A 52 GLU middle . . 41 A 53 ALA middle . . 42 A 54 ALA middle . . 43 A 55 THR middle . . 44 A 56 LEU middle . . 45 A 57 GLU middle . . 46 A 58 ASP middle . . 47 A 59 VAL middle . . 48 A 60 GLY middle . false 49 A 61 ARG middle . . 50 A 62 GLU middle . . 51 A 63 ILE middle . . 52 A 64 GLY middle . false 53 A 65 LEU middle . . 54 A 66 THR middle . . 55 A 67 ARG middle . . 56 A 68 GLU middle . . 57 A 69 ARG middle . . 58 A 70 VAL middle . . 59 A 71 ARG middle . . 60 A 72 GLN middle . . 61 A 73 ILE middle . . 62 A 74 GLN middle . . 63 A 75 VAL middle . . 64 A 76 GLU middle . . 65 A 77 GLY middle . false 66 A 78 LEU middle . . 67 A 79 ARG middle . . 68 A 80 ARG middle . . 69 A 81 LEU middle . . 70 A 82 ARG middle . . 71 A 83 GLU middle . . 72 A 84 ILE middle . . 73 A 85 LEU middle . . 74 A 86 GLN middle . . 75 A 87 THR middle . . 76 A 88 GLN middle . . 77 A 89 GLY middle . false 78 A 90 LEU middle . . 79 A 91 ASN middle . . 80 A 92 ILE middle . . 81 A 93 GLU middle . . 82 A 94 ALA middle . . 83 A 95 LEU middle . . 84 A 96 PHE middle . . 85 A 97 ARG middle . . 86 A 98 GLU end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 13 GLY H1 H 1 8.256 . A 13 GLY HAy H 1 4.041 . A 13 GLY HAx H 1 3.698 . A 13 GLY C C 13 172.107 . A 13 GLY CA C 13 44.246 . A 13 GLY N N 15 109.664 . A 14 PRO HA H 1 4.417 . A 14 PRO HBy H 1 2.262 . A 14 PRO HBx H 1 1.943 . A 14 PRO HDx H 1 3.620 . A 14 PRO HDy H 1 3.620 . A 14 PRO HGx H 1 1.990 . A 14 PRO HGy H 1 1.990 . A 14 PRO CA C 13 63.332 . A 14 PRO CB C 13 32.146 . A 14 PRO CD C 13 49.800 . A 14 PRO CG C 13 27.204 . A 15 GLU H H 1 8.600 . A 15 GLU HA H 1 4.270 . A 15 GLU HBy H 1 2.050 . A 15 GLU HBx H 1 1.920 . A 15 GLU HGx H 1 2.269 . A 15 GLU HGy H 1 2.269 . A 15 GLU C C 13 176.332 . A 15 GLU CA C 13 56.604 . A 15 GLU CB C 13 30.100 . A 15 GLU CG C 13 36.210 . A 15 GLU N N 15 120.600 . A 16 ASP H H 1 8.340 . A 16 ASP HA H 1 4.726 . A 16 ASP HBy H 1 2.780 . A 16 ASP HBx H 1 2.647 . A 16 ASP C C 13 176.633 . A 16 ASP CA C 13 54.164 . A 16 ASP CB C 13 41.309 . A 16 ASP N N 15 121.500 . A 17 THR H H 1 8.204 . A 17 THR HA H 1 4.433 . A 17 THR HB H 1 4.341 . A 17 THR HG2% H 1 1.200 . A 17 THR C C 13 175.151 . A 17 THR CA C 13 61.850 . A 17 THR CB C 13 69.746 . A 17 THR CG2 C 13 21.515 . A 17 THR N N 15 114.736 . A 18 THR H H 1 8.328 . A 18 THR HA H 1 4.318 . A 18 THR HB H 1 4.243 . A 18 THR HG2% H 1 1.220 . A 18 THR C C 13 174.870 . A 18 THR CA C 13 62.587 . A 18 THR CB C 13 69.879 . A 18 THR CG2 C 13 21.515 . A 18 THR N N 15 116.454 . A 19 GLN H H 1 8.431 . A 19 GLN HA H 1 4.350 . A 19 GLN HBy H 1 2.139 . A 19 GLN HBx H 1 2.000 . A 19 GLN HGy H 1 2.362 . A 19 GLN HGx H 1 2.357 . A 19 GLN C C 13 176.072 . A 19 GLN CA C 13 56.221 . A 19 GLN CB C 13 29.360 . A 19 GLN CG C 13 33.830 . A 19 GLN N N 15 122.321 . A 19 GLN NE2 N 15 112.000 . A 20 ASP H H 1 8.326 . A 20 ASP HA H 1 4.587 . A 20 ASP HBy H 1 2.730 . A 20 ASP HBx H 1 2.670 . A 20 ASP CA C 13 54.507 . A 20 ASP CB C 13 41.313 . A 20 ASP N N 15 121.800 . A 21 ASP H H 1 8.231 . A 21 ASP HA H 1 4.583 . A 21 ASP HBx H 1 2.685 . A 21 ASP HBy H 1 2.715 . A 21 ASP CA C 13 55.060 . A 21 ASP CB C 13 41.175 . A 21 ASP N N 15 120.500 . A 22 ASP H H 1 8.336 . A 22 ASP HA H 1 4.533 . A 22 ASP HBx H 1 2.745 . A 22 ASP HBy H 1 2.745 . A 22 ASP C C 13 178.035 . A 22 ASP CA C 13 55.459 . A 22 ASP CB C 13 41.075 . A 22 ASP N N 15 120.997 . A 23 MET H H 1 8.386 . A 23 MET HA H 1 4.324 . A 23 MET HBx H 1 2.076 . A 23 MET HBy H 1 2.179 . A 23 MET HE% H 1 2.069 . A 23 MET HGy H 1 2.600 . A 23 MET HGx H 1 2.560 . A 23 MET C C 13 178.035 . A 23 MET CA C 13 57.730 . A 23 MET CB C 13 32.080 . A 23 MET CE C 13 17.079 . A 23 MET CG C 13 32.200 . A 23 MET N N 15 121.416 . A 24 LYS H H 1 8.261 . A 24 LYS HA H 1 3.877 . A 24 LYS HBx H 1 1.880 . A 24 LYS HBy H 1 1.945 . A 24 LYS HDx H 1 1.732 . A 24 LYS HDy H 1 1.736 . A 24 LYS HEx H 1 2.981 . A 24 LYS HEy H 1 2.981 . A 24 LYS HGx H 1 1.300 . A 24 LYS HGy H 1 1.300 . A 24 LYS C C 13 178.015 . A 24 LYS CA C 13 59.833 . A 24 LYS CB C 13 32.300 . A 24 LYS CD C 13 29.580 . A 24 LYS CE C 13 42.200 . A 24 LYS CG C 13 26.000 . A 24 LYS N N 15 119.480 . A 25 GLN H H 1 8.064 . A 25 GLN HA H 1 4.180 . A 25 GLN HBx H 1 2.164 . A 25 GLN HBy H 1 2.164 . A 25 GLN HE2x H 1 6.840 . A 25 GLN HE2y H 1 7.576 . A 25 GLN HGx H 1 2.482 . A 25 GLN HGy H 1 2.482 . A 25 GLN C C 13 178.335 . A 25 GLN CA C 13 57.720 . A 25 GLN CB C 13 28.292 . A 25 GLN CG C 13 33.945 . A 25 GLN N N 15 116.436 . A 25 GLN NE2 N 15 112.385 . A 26 SER H H 1 8.064 . A 26 SER HA H 1 4.313 . A 26 SER HBy H 1 4.065 . A 26 SER HBx H 1 3.883 . A 26 SER C C 13 178.335 . A 26 SER CA C 13 61.001 . A 26 SER CB C 13 63.404 . A 26 SER N N 15 115.680 . A 27 ILE H H 1 7.874 . A 27 ILE HA H 1 4.174 . A 27 ILE HB H 1 2.066 . A 27 ILE HD1% H 1 0.793 . A 27 ILE HG1y H 1 1.672 . A 27 ILE HG1x H 1 1.255 . A 27 ILE HG2% H 1 0.948 . A 27 ILE C C 13 176.913 . A 27 ILE CA C 13 63.104 . A 27 ILE CB C 13 38.572 . A 27 ILE CD1 C 13 14.469 . A 27 ILE CG1 C 13 28.800 . A 27 ILE CG2 C 13 18.443 . A 27 ILE N N 15 118.339 . A 28 VAL H H 1 7.567 . A 28 VAL HA H 1 3.500 . A 28 VAL HB H 1 2.179 . A 28 VAL HGx% H 1 1.047 . A 28 VAL HGy% H 1 1.175 . A 28 VAL C C 13 177.093 . A 28 VAL CA C 13 67.209 . A 28 VAL CB C 13 31.729 . A 28 VAL CGx C 13 21.752 . A 28 VAL CGy C 13 23.454 . A 28 VAL N N 15 118.712 . A 29 LYS H H 1 7.728 . A 29 LYS HA H 1 4.030 . A 29 LYS HBy H 1 1.572 . A 29 LYS HBx H 1 1.370 . A 29 LYS HDx H 1 1.250 . A 29 LYS HDy H 1 1.250 . A 29 LYS HEx H 1 2.526 . A 29 LYS HEy H 1 2.526 . A 29 LYS HGy H 1 0.804 . A 29 LYS HGx H 1 0.600 . A 29 LYS C C 13 178.756 . A 29 LYS CA C 13 59.132 . A 29 LYS CB C 13 31.460 . A 29 LYS CD C 13 29.080 . A 29 LYS CE C 13 41.741 . A 29 LYS CG C 13 23.560 . A 29 LYS N N 15 116.692 . A 30 TRP H H 1 7.486 . A 30 TRP HA H 1 4.538 . A 30 TRP HBy H 1 3.330 . A 30 TRP HBx H 1 3.060 . A 30 TRP HD1 H 1 7.310 . A 30 TRP HE1 H 1 10.164 . A 30 TRP HE3 H 1 7.464 . A 30 TRP HH2 H 1 7.115 . A 30 TRP HZ2 H 1 7.387 . A 30 TRP HZ3 H 1 7.056 . A 30 TRP C C 13 178.215 . A 30 TRP CA C 13 58.598 . A 30 TRP CB C 13 29.360 . A 30 TRP CD1 C 13 133.5 . A 30 TRP CE3 C 13 122.47 . A 30 TRP CH2 C 13 126.470 . A 30 TRP CZ2 C 13 116.340 . A 30 TRP CZ3 C 13 123.800 . A 30 TRP N N 15 119.571 . A 30 TRP NE1 N 15 128.500 . A 31 LEU H H 1 8.178 . A 31 LEU HA H 1 3.945 . A 31 LEU HBy H 1 1.884 . A 31 LEU HBx H 1 1.173 . A 31 LEU HDx% H 1 0.799 . A 31 LEU HDy% H 1 0.803 . A 31 LEU HG H 1 0.914 . A 31 LEU C C 13 179.697 . A 31 LEU CA C 13 57.577 . A 31 LEU CB C 13 41.335 . A 31 LEU CDx C 13 24.063 . A 31 LEU CDy C 13 24.075 . A 31 LEU CG C 13 26.084 . A 31 LEU N N 15 118.175 . A 32 PHE H H 1 7.644 . A 32 PHE HA H 1 4.373 . A 32 PHE HBy H 1 3.354 . A 32 PHE HBx H 1 3.000 . A 32 PHE HDy H 1 7.388 . A 32 PHE HDx H 1 7.384 . A 32 PHE HEy H 1 7.302 . A 32 PHE HEx H 1 7.297 . A 32 PHE C C 13 175.471 . A 32 PHE CA C 13 60.868 . A 32 PHE CB C 13 37.683 . A 32 PHE CDx C 13 133.470 . A 32 PHE CDy C 13 133.470 . A 32 PHE CEx C 13 131.800 . A 32 PHE CEy C 13 131.800 . A 32 PHE N N 15 115.377 . A 33 GLU H H 1 7.660 . A 33 GLU HA H 1 4.473 . A 33 GLU HBy H 1 2.460 . A 33 GLU HBx H 1 2.241 . A 33 GLU HGx H 1 2.360 . A 33 GLU HGy H 1 2.638 . A 33 GLU C C 13 177.173 . A 33 GLU CA C 13 56.462 . A 33 GLU CB C 13 29.894 . A 33 GLU CG C 13 36.100 . A 33 GLU N N 15 117.632 . A 34 LEU H H 1 7.065 . A 34 LEU HA H 1 4.533 . A 34 LEU HBy H 1 1.967 . A 34 LEU HBx H 1 1.875 . A 34 LEU HDx% H 1 0.838 . A 34 LEU HDy% H 1 0.838 . A 34 LEU HG H 1 1.851 . A 34 LEU C C 13 175.631 . A 34 LEU CA C 13 53.579 . A 34 LEU CB C 13 42.570 . A 34 LEU CDy C 13 22.582 . A 34 LEU CDx C 13 22.565 . A 34 LEU CG C 13 27.070 . A 34 LEU N N 15 117.880 . A 35 ASN H H 1 7.976 . A 35 ASN HA H 1 4.663 . A 35 ASN HBy H 1 3.274 . A 35 ASN HBx H 1 2.780 . A 35 ASN HD2x H 1 6.810 . A 35 ASN HD2y H 1 7.622 . A 35 ASN C C 13 175.251 . A 35 ASN CA C 13 52.700 . A 35 ASN CB C 13 38.338 . A 35 ASN N N 15 117.000 . A 35 ASN ND2 N 15 112.730 . A 36 ALA H H 1 8.575 . A 36 ALA HA H 1 3.874 . A 36 ALA HB% H 1 1.475 . A 36 ALA C C 13 180.257 . A 36 ALA CA C 13 56.100 . A 36 ALA CB C 13 18.695 . A 36 ALA N N 15 121.299 . A 37 LYS H H 1 8.172 . A 37 LYS HA H 1 4.145 . A 37 LYS HBy H 1 1.945 . A 37 LYS HBx H 1 1.755 . A 37 LYS HDy H 1 1.720 . A 37 LYS HDx H 1 1.629 . A 37 LYS HEy H 1 2.976 . A 37 LYS HEx H 1 2.971 . A 37 LYS HGy H 1 1.555 . A 37 LYS HGx H 1 1.500 . A 37 LYS C C 13 178.455 . A 37 LYS CA C 13 58.932 . A 37 LYS CB C 13 31.836 . A 37 LYS CD C 13 28.457 . A 37 LYS CE C 13 41.724 . A 37 LYS CG C 13 25.000 . A 37 LYS N N 15 118.859 . A 38 GLN H H 1 8.097 . A 38 GLN HA H 1 3.688 . A 38 GLN HBy H 1 2.300 . A 38 GLN HBx H 1 1.684 . A 38 GLN HE2x H 1 6.722 . A 38 GLN HE2y H 1 7.744 . A 38 GLN HGx H 1 2.696 . A 38 GLN HGy H 1 2.696 . A 38 GLN C C 13 178.195 . A 38 GLN CA C 13 58.700 . A 38 GLN CB C 13 29.230 . A 38 GLN CG C 13 33.889 . A 38 GLN N N 15 117.470 . A 38 GLN NE2 N 15 109.460 . A 39 ARG H H 1 8.380 . A 39 ARG HA H 1 3.711 . A 39 ARG HBy H 1 1.806 . A 39 ARG HBx H 1 1.805 . A 39 ARG HDx H 1 3.169 . A 39 ARG HDy H 1 3.169 . A 39 ARG HE H 1 7.560 . A 39 ARG HGx H 1 1.654 . A 39 ARG HGy H 1 1.654 . A 39 ARG C C 13 176.252 . A 39 ARG CA C 13 60.000 . A 39 ARG CB C 13 29.900 . A 39 ARG CD C 13 43.580 . A 39 ARG CG C 13 27.074 . A 39 ARG N N 15 117.692 . A 39 ARG NE N 15 128.200 . A 40 GLU H H 1 7.967 . A 40 GLU HA H 1 3.862 . A 40 GLU HBy H 1 2.195 . A 40 GLU HBx H 1 2.194 . A 40 GLU HGx H 1 2.000 . A 40 GLU HGy H 1 2.000 . A 40 GLU C C 13 178.355 . A 40 GLU CA C 13 59.862 . A 40 GLU CB C 13 29.490 . A 40 GLU CG C 13 36.310 . A 40 GLU N N 15 117.843 . A 41 VAL H H 1 8.126 . A 41 VAL HA H 1 3.285 . A 41 VAL HB H 1 2.031 . A 41 VAL HGx% H 1 0.772 . A 41 VAL HGy% H 1 0.916 . A 41 VAL C C 13 177.274 . A 41 VAL CA C 13 67.970 . A 41 VAL CB C 13 31.629 . A 41 VAL CGx C 13 21.070 . A 41 VAL CGy C 13 24.450 . A 41 VAL N N 15 117.374 . A 42 LEU H H 1 8.210 . A 42 LEU HA H 1 3.931 . A 42 LEU HBy H 1 1.888 . A 42 LEU HBx H 1 1.262 . A 42 LEU HDx% H 1 0.729 . A 42 LEU HDy% H 1 0.735 . A 42 LEU HG H 1 1.976 . A 42 LEU C C 13 178.715 . A 42 LEU CA C 13 58.507 . A 42 LEU CB C 13 41.337 . A 42 LEU CDx C 13 25.435 . A 42 LEU CDy C 13 25.450 . A 42 LEU CG C 13 27.829 . A 42 LEU N N 15 116.806 . A 43 ALA H H 1 8.760 . A 43 ALA HA H 1 3.972 . A 43 ALA HB% H 1 1.530 . A 43 ALA C C 13 179.857 . A 43 ALA CA C 13 55.700 . A 43 ALA CB C 13 18.070 . A 43 ALA N N 15 120.161 . A 44 ARG H H 1 8.120 . A 44 ARG HA H 1 3.750 . A 44 ARG HBy H 1 1.565 . A 44 ARG HBx H 1 1.363 . A 44 ARG HDx H 1 2.437 . A 44 ARG HDy H 1 2.935 . A 44 ARG HE H 1 6.311 . A 44 ARG HGx H 1 0.560 . A 44 ARG HGy H 1 1.020 . A 44 ARG HH2x H 1 7.200 . A 44 ARG C C 13 178.155 . A 44 ARG CA C 13 58.598 . A 44 ARG CB C 13 31.496 . A 44 ARG CD C 13 43.600 . A 44 ARG CG C 13 28.450 . A 44 ARG N N 15 116.411 . A 45 ARG H H 1 8.115 . A 45 ARG HA H 1 4.309 . A 45 ARG HBx H 1 1.475 . A 45 ARG HBy H 1 1.482 . A 45 ARG HDx H 1 3.307 . A 45 ARG HDy H 1 3.311 . A 45 ARG HE H 1 6.539 . A 45 ARG HGx H 1 1.478 . A 45 ARG HGy H 1 1.478 . A 45 ARG C C 13 177.594 . A 45 ARG CA C 13 56.229 . A 45 ARG CB C 13 28.059 . A 45 ARG CD C 13 40.700 . A 45 ARG CG C 13 28.081 . A 45 ARG N N 15 116.338 . A 46 PHE H H 1 7.897 . A 46 PHE HA H 1 4.771 . A 46 PHE HBx H 1 2.675 . A 46 PHE HBy H 1 3.337 . A 46 PHE HDx H 1 7.359 . A 46 PHE HDy H 1 7.362 . A 46 PHE HEx H 1 7.077 . A 46 PHE HEy H 1 7.077 . A 46 PHE HZ H 1 7.074 . A 46 PHE C C 13 176.292 . A 46 PHE CA C 13 57.663 . A 46 PHE CB C 13 38.705 . A 46 PHE CDx C 13 133.800 . A 46 PHE CDy C 13 133.800 . A 46 PHE CEx C 13 132.700 . A 46 PHE CEy C 13 132.700 . A 46 PHE CZ C 13 130.860 . A 46 PHE N N 15 111.162 . A 47 GLY H H 1 7.776 . A 47 GLY HAy H 1 3.884 . A 47 GLY HAx H 1 3.694 . A 47 GLY C C 13 174.290 . A 47 GLY CA C 13 48.051 . A 47 GLY N N 15 111.125 . A 48 LEU H H 1 8.974 . A 48 LEU HA H 1 4.923 . A 48 LEU HBy H 1 1.621 . A 48 LEU HBx H 1 1.485 . A 48 LEU HDx% H 1 0.880 . A 48 LEU HDy% H 1 0.880 . A 48 LEU HG H 1 0.830 . A 48 LEU C C 13 176.392 . A 48 LEU CA C 13 52.590 . A 48 LEU CB C 13 44.812 . A 48 LEU CDx C 13 22.900 . A 48 LEU CDy C 13 22.900 . A 48 LEU CG C 13 26.211 . A 48 LEU N N 15 119.531 . A 49 LEU H H 1 8.906 . A 49 LEU HA H 1 3.884 . A 49 LEU HBy H 1 2.000 . A 49 LEU HBx H 1 1.646 . A 49 LEU HDx% H 1 0.972 . A 49 LEU HDy% H 1 0.972 . A 49 LEU HG H 1 0.784 . A 49 LEU C C 13 176.392 . A 49 LEU CA C 13 55.527 . A 49 LEU CB C 13 38.831 . A 49 LEU CDx C 13 23.070 . A 49 LEU CDy C 13 23.070 . A 49 LEU CG C 13 26.000 . A 49 LEU N N 15 112.332 . A 50 GLY H H 1 8.416 . A 50 GLY HAy H 1 4.074 . A 50 GLY HAx H 1 3.454 . A 50 GLY C C 13 175.111 . A 50 GLY CA C 13 44.960 . A 50 GLY N N 15 105.327 . A 51 TYR H H 1 7.387 . A 51 TYR HA H 1 4.473 . A 51 TYR HBy H 1 3.254 . A 51 TYR HBx H 1 2.911 . A 51 TYR HDx H 1 7.269 . A 51 TYR HDy H 1 7.269 . A 51 TYR HEx H 1 6.700 . A 51 TYR HEy H 1 6.700 . A 51 TYR C C 13 176.272 . A 51 TYR CA C 13 58.498 . A 51 TYR CB C 13 38.372 . A 51 TYR CDx C 13 69.500 . A 51 TYR CDy C 13 69.500 . A 51 TYR CEx C 13 53.840 . A 51 TYR CEy C 13 53.840 . A 51 TYR N N 15 120.597 . A 52 GLU H H 1 8.494 . A 52 GLU HA H 1 4.423 . A 52 GLU HBy H 1 2.017 . A 52 GLU HBx H 1 1.905 . A 52 GLU HGx H 1 2.283 . A 52 GLU HGy H 1 2.298 . A 52 GLU C C 13 175.691 . A 52 GLU CA C 13 55.000 . A 52 GLU CB C 13 30.595 . A 52 GLU CG C 13 36.365 . A 52 GLU N N 15 120.841 . A 53 ALA H H 1 8.491 . A 53 ALA HA H 1 3.924 . A 53 ALA HB% H 1 1.194 . A 53 ALA C C 13 177.193 . A 53 ALA CA C 13 53.658 . A 53 ALA CB C 13 18.412 . A 53 ALA N N 15 125.749 . A 54 ALA H H 1 8.074 . A 54 ALA HA H 1 4.927 . A 54 ALA HB% H 1 1.395 . A 54 ALA C C 13 176.993 . A 54 ALA CA C 13 50.521 . A 54 ALA CB C 13 23.452 . A 54 ALA N N 15 126.321 . A 55 THR H H 1 8.408 . A 55 THR HA H 1 4.145 . A 55 THR HB H 1 4.711 . A 55 THR HG2% H 1 1.393 . A 55 THR C C 13 174.951 . A 55 THR CA C 13 61.202 . A 55 THR CB C 13 71.511 . A 55 THR CG2 C 13 21.950 . A 55 THR N N 15 109.838 . A 56 LEU H H 1 8.824 . A 56 LEU HA H 1 3.698 . A 56 LEU HBy H 1 1.743 . A 56 LEU HBx H 1 1.377 . A 56 LEU HDx% H 1 0.876 . A 56 LEU HDy% H 1 0.776 . A 56 LEU HG H 1 1.625 . A 56 LEU C C 13 178.695 . A 56 LEU CA C 13 59.332 . A 56 LEU CB C 13 43.200 . A 56 LEU CDy C 13 25.593 . A 56 LEU CDx C 13 23.827 . A 56 LEU CG C 13 27.227 . A 56 LEU N N 15 120.279 . A 57 GLU H H 1 8.888 . A 57 GLU HA H 1 3.855 . A 57 GLU HBy H 1 2.059 . A 57 GLU HBx H 1 1.881 . A 57 GLU HGx H 1 2.203 . A 57 GLU HGy H 1 2.464 . A 57 GLU C C 13 178.976 . A 57 GLU CA C 13 59.860 . A 57 GLU CB C 13 29.083 . A 57 GLU CG C 13 36.700 . A 57 GLU N N 15 116.073 . A 58 ASP H H 1 7.778 . A 58 ASP HA H 1 4.433 . A 58 ASP HBy H 1 2.840 . A 58 ASP HBx H 1 2.680 . A 58 ASP C C 13 178.896 . A 58 ASP CA C 13 57.593 . A 58 ASP CB C 13 40.241 . A 58 ASP N N 15 122.356 . A 59 VAL H H 1 8.665 . A 59 VAL HA H 1 3.481 . A 59 VAL HB H 1 2.058 . A 59 VAL HGx% H 1 0.858 . A 59 VAL HGy% H 1 0.857 . A 59 VAL C C 13 178.195 . A 59 VAL CA C 13 67.243 . A 59 VAL CB C 13 31.456 . A 59 VAL CGy C 13 24.277 . A 59 VAL CGx C 13 24.265 . A 59 VAL N N 15 121.087 . A 60 GLY H H 1 8.350 . A 60 GLY HAy H 1 3.694 . A 60 GLY HAx H 1 3.404 . A 60 GLY C C 13 176.052 . A 60 GLY CA C 13 48.850 . A 60 GLY N N 15 105.280 . A 61 ARG H H 1 7.842 . A 61 ARG HA H 1 4.040 . A 61 ARG HBy H 1 1.988 . A 61 ARG HBx H 1 1.987 . A 61 ARG HDx H 1 3.248 . A 61 ARG HDy H 1 3.251 . A 61 ARG HE H 1 7.300 . A 61 ARG HGy H 1 1.791 . A 61 ARG HGx H 1 1.606 . A 61 ARG C C 13 179.036 . A 61 ARG CA C 13 59.399 . A 61 ARG CB C 13 30.086 . A 61 ARG CD C 13 43.394 . A 61 ARG CG C 13 27.739 . A 61 ARG N N 15 120.757 . A 62 GLU H H 1 7.833 . A 62 GLU HA H 1 4.138 . A 62 GLU HBx H 1 1.986 . A 62 GLU HBy H 1 1.986 . A 62 GLU HGx H 1 2.372 . A 62 GLU HGy H 1 2.372 . A 62 GLU C C 13 178.615 . A 62 GLU CA C 13 59.265 . A 62 GLU CB C 13 30.080 . A 62 GLU CG C 13 35.700 . A 62 GLU N N 15 117.890 . A 63 ILE H H 1 8.009 . A 63 ILE HA H 1 4.544 . A 63 ILE HB H 1 2.010 . A 63 ILE HD1% H 1 0.584 . A 63 ILE HG1y H 1 1.400 . A 63 ILE HG1x H 1 1.172 . A 63 ILE HG2% H 1 0.748 . A 63 ILE C C 13 175.952 . A 63 ILE CA C 13 61.097 . A 63 ILE CB C 13 38.505 . A 63 ILE CD1 C 13 14.850 . A 63 ILE CG1 C 13 25.456 . A 63 ILE CG2 C 13 16.695 . A 63 ILE N N 15 110.326 . A 64 GLY H H 1 7.854 . A 64 GLY HAy H 1 4.000 . A 64 GLY HAx H 1 3.864 . A 64 GLY C C 13 174.330 . A 64 GLY CA C 13 46.849 . A 64 GLY N N 15 112.061 . A 65 LEU H H 1 8.259 . A 65 LEU HA H 1 4.935 . A 65 LEU HBy H 1 1.468 . A 65 LEU HBx H 1 1.290 . A 65 LEU HDx% H 1 0.912 . A 65 LEU HDy% H 1 0.912 . A 65 LEU HG H 1 0.677 . A 65 LEU C C 13 176.593 . A 65 LEU CA C 13 52.590 . A 65 LEU CB C 13 47.842 . A 65 LEU CDx C 13 23.273 . A 65 LEU CDy C 13 23.273 . A 65 LEU CG C 13 26.248 . A 65 LEU N N 15 119.944 . A 66 THR H H 1 7.910 . A 66 THR HA H 1 4.250 . A 66 THR HB H 1 4.726 . A 66 THR HG2% H 1 1.374 . A 66 THR C C 13 175.451 . A 66 THR CA C 13 61.000 . A 66 THR CB C 13 70.680 . A 66 THR CG2 C 13 22.320 . A 66 THR N N 15 110.262 . A 67 ARG H H 1 8.909 . A 67 ARG HA H 1 3.720 . A 67 ARG HBx H 1 1.791 . A 67 ARG HBy H 1 1.897 . A 67 ARG HDx H 1 3.236 . A 67 ARG HDy H 1 3.236 . A 67 ARG HGy H 1 1.583 . A 67 ARG HGx H 1 1.532 . A 67 ARG C C 13 177.814 . A 67 ARG CA C 13 60.000 . A 67 ARG CB C 13 29.827 . A 67 ARG CD C 13 43.580 . A 67 ARG CG C 13 27.320 . A 67 ARG N N 15 121.520 . A 68 GLU H H 1 7.906 . A 68 GLU HA H 1 4.144 . A 68 GLU HBy H 1 2.070 . A 68 GLU HBx H 1 1.880 . A 68 GLU HGx H 1 2.370 . A 68 GLU HGy H 1 2.372 . A 68 GLU C C 13 179.036 . A 68 GLU CA C 13 59.399 . A 68 GLU CB C 13 28.839 . A 68 GLU CG C 13 35.737 . A 68 GLU N N 15 117.720 . A 69 ARG H H 1 7.728 . A 69 ARG HA H 1 4.153 . A 69 ARG HBx H 1 1.956 . A 69 ARG HBy H 1 1.956 . A 69 ARG HDx H 1 3.210 . A 69 ARG HDy H 1 3.415 . A 69 ARG HGy H 1 1.837 . A 69 ARG HGx H 1 1.687 . A 69 ARG C C 13 178.876 . A 69 ARG CA C 13 58.064 . A 69 ARG CB C 13 29.360 . A 69 ARG CD C 13 42.500 . A 69 ARG CG C 13 27.320 . A 69 ARG N N 15 121.025 . A 70 VAL H H 1 8.353 . A 70 VAL HA H 1 3.400 . A 70 VAL HB H 1 2.105 . A 70 VAL HGx% H 1 0.903 . A 70 VAL HGy% H 1 0.903 . A 70 VAL C C 13 177.414 . A 70 VAL CA C 13 67.243 . A 70 VAL CB C 13 31.095 . A 70 VAL CGy C 13 23.878 . A 70 VAL CGx C 13 23.836 . A 70 VAL N N 15 118.604 . A 71 ARG H H 1 8.206 . A 71 ARG HA H 1 3.713 . A 71 ARG HBy H 1 2.089 . A 71 ARG HBx H 1 1.807 . A 71 ARG HDx H 1 3.200 . A 71 ARG HDy H 1 3.200 . A 71 ARG HGx H 1 1.630 . A 71 ARG HGy H 1 1.630 . A 71 ARG C C 13 177.634 . A 71 ARG CA C 13 59.970 . A 71 ARG CB C 13 29.800 . A 71 ARG CD C 13 43.460 . A 71 ARG CG C 13 27.320 . A 71 ARG N N 15 120.120 . A 72 GLN H H 1 7.900 . A 72 GLN HA H 1 3.966 . A 72 GLN HBy H 1 2.283 . A 72 GLN HBx H 1 2.157 . A 72 GLN HE2x H 1 6.783 . A 72 GLN HE2y H 1 7.775 . A 72 GLN HGy H 1 2.626 . A 72 GLN HGx H 1 2.400 . A 72 GLN C C 13 174.991 . A 72 GLN CA C 13 59.219 . A 72 GLN CB C 13 28.323 . A 72 GLN CG C 13 33.465 . A 72 GLN N N 15 117.700 . A 72 GLN NE2 N 15 112.040 . A 73 ILE H H 1 8.120 . A 73 ILE HA H 1 3.827 . A 73 ILE HB H 1 1.808 . A 73 ILE HD1% H 1 0.730 . A 73 ILE HG1y H 1 1.043 . A 73 ILE HG1x H 1 1.037 . A 73 ILE HG2% H 1 0.828 . A 73 ILE C C 13 178.075 . A 73 ILE CA C 13 65.309 . A 73 ILE CB C 13 38.337 . A 73 ILE CD1 C 13 14.700 . A 73 ILE CG1 C 13 28.830 . A 73 ILE CG2 C 13 18.452 . A 73 ILE N N 15 120.665 . A 74 GLN H H 1 8.736 . A 74 GLN HA H 1 3.786 . A 74 GLN HBy H 1 2.402 . A 74 GLN HBx H 1 2.035 . A 74 GLN HE2y H 1 7.088 . A 74 GLN HE2x H 1 6.905 . A 74 GLN HGx H 1 1.955 . A 74 GLN HGy H 1 2.183 . A 74 GLN C C 13 177.554 . A 74 GLN CA C 13 59.840 . A 74 GLN CB C 13 29.336 . A 74 GLN CG C 13 34.795 . A 74 GLN N N 15 121.429 . A 74 GLN NE2 N 15 109.296 . A 75 VAL H H 1 8.594 . A 75 VAL HA H 1 3.650 . A 75 VAL HB H 1 2.230 . A 75 VAL HGx% H 1 0.993 . A 75 VAL HGy% H 1 1.151 . A 75 VAL C C 13 179.316 . A 75 VAL CA C 13 67.000 . A 75 VAL CB C 13 31.930 . A 75 VAL CGx C 13 20.950 . A 75 VAL CGy C 13 23.000 . A 75 VAL N N 15 118.497 . A 76 GLU H H 1 8.165 . A 76 GLU HA H 1 4.145 . A 76 GLU HBy H 1 2.200 . A 76 GLU HBx H 1 2.000 . A 76 GLU HGx H 1 2.370 . A 76 GLU HGy H 1 2.443 . A 76 GLU C C 13 179.537 . A 76 GLU CA C 13 59.065 . A 76 GLU CB C 13 29.426 . A 76 GLU CG C 13 36.101 . A 76 GLU N N 15 120.789 . A 77 GLY H H 1 9.305 . A 77 GLY HAy H 1 3.824 . A 77 GLY HAx H 1 3.475 . A 77 GLY C C 13 175.011 . A 77 GLY CA C 13 47.215 . A 77 GLY N N 15 108.577 . A 78 LEU H H 1 8.738 . A 78 LEU HA H 1 3.993 . A 78 LEU HBy H 1 1.965 . A 78 LEU HBx H 1 1.400 . A 78 LEU HDx% H 1 0.683 . A 78 LEU HDy% H 1 0.687 . A 78 LEU HG H 1 0.897 . A 78 LEU C C 13 178.976 . A 78 LEU CA C 13 57.850 . A 78 LEU CB C 13 41.709 . A 78 LEU CDx C 13 23.276 . A 78 LEU CDy C 13 23.320 . A 78 LEU CG C 13 26.064 . A 78 LEU N N 15 121.556 . A 79 ARG H H 1 8.079 . A 79 ARG HA H 1 3.970 . A 79 ARG HBx H 1 1.982 . A 79 ARG HBy H 1 1.982 . A 79 ARG HDy H 1 3.167 . A 79 ARG HDx H 1 3.165 . A 79 ARG HGy H 1 1.766 . A 79 ARG HGx H 1 1.586 . A 79 ARG C C 13 179.356 . A 79 ARG CA C 13 60.000 . A 79 ARG CB C 13 30.080 . A 79 ARG CD C 13 43.512 . A 79 ARG CG C 13 27.204 . A 79 ARG N N 15 120.562 . A 80 ARG H H 1 8.050 . A 80 ARG HA H 1 4.147 . A 80 ARG HBx H 1 2.007 . A 80 ARG HBy H 1 2.007 . A 80 ARG HDx H 1 3.220 . A 80 ARG HDy H 1 3.450 . A 80 ARG HGx H 1 1.840 . A 80 ARG HGy H 1 1.842 . A 80 ARG C C 13 178.635 . A 80 ARG CA C 13 58.106 . A 80 ARG CB C 13 29.450 . A 80 ARG CD C 13 42.835 . A 80 ARG CG C 13 27.201 . A 80 ARG N N 15 119.081 . A 81 LEU H H 1 8.700 . A 81 LEU HA H 1 4.000 . A 81 LEU HBy H 1 1.733 . A 81 LEU HBx H 1 1.585 . A 81 LEU HDx% H 1 0.810 . A 81 LEU HDy% H 1 0.811 . A 81 LEU HG H 1 1.584 . A 81 LEU C C 13 178.115 . A 81 LEU CA C 13 57.720 . A 81 LEU CB C 13 42.000 . A 81 LEU CDx C 13 23.700 . A 81 LEU CDy C 13 23.700 . A 81 LEU CG C 13 26.450 . A 81 LEU N N 15 119.611 . A 82 ARG H H 1 8.546 . A 82 ARG HA H 1 3.743 . A 82 ARG HBx H 1 1.922 . A 82 ARG HBy H 1 1.927 . A 82 ARG HDx H 1 3.192 . A 82 ARG HDy H 1 3.192 . A 82 ARG HGx H 1 1.525 . A 82 ARG HGy H 1 1.762 . A 82 ARG C C 13 178.555 . A 82 ARG CA C 13 60.534 . A 82 ARG CB C 13 29.960 . A 82 ARG CD C 13 43.570 . A 82 ARG CG C 13 28.450 . A 82 ARG N N 15 118.230 . A 83 GLU H H 1 7.530 . A 83 GLU HA H 1 4.030 . A 83 GLU HBy H 1 2.285 . A 83 GLU HBx H 1 2.160 . A 83 GLU HGx H 1 2.476 . A 83 GLU HGy H 1 2.477 . A 83 GLU C C 13 179.416 . A 83 GLU CA C 13 59.330 . A 83 GLU CB C 13 29.694 . A 83 GLU CG C 13 36.215 . A 83 GLU N N 15 118.585 . A 84 ILE H H 1 8.061 . A 84 ILE HA H 1 3.684 . A 84 ILE HB H 1 1.815 . A 84 ILE HD1% H 1 0.885 . A 84 ILE HG1x H 1 1.135 . A 84 ILE HG1y H 1 1.136 . A 84 ILE HG2% H 1 0.677 . A 84 ILE C C 13 178.916 . A 84 ILE CA C 13 64.980 . A 84 ILE CB C 13 38.872 . A 84 ILE CD1 C 13 14.574 . A 84 ILE CG1 C 13 28.590 . A 84 ILE CG2 C 13 17.186 . A 84 ILE N N 15 120.722 . A 85 LEU H H 1 8.551 . A 85 LEU HA H 1 3.480 . A 85 LEU HBy H 1 1.655 . A 85 LEU HBx H 1 1.206 . A 85 LEU HDx% H 1 0.552 . A 85 LEU HDy% H 1 0.316 . A 85 LEU HG H 1 1.612 . A 85 LEU C C 13 179.557 . A 85 LEU CA C 13 57.596 . A 85 LEU CB C 13 40.207 . A 85 LEU CDy C 13 26.075 . A 85 LEU CDx C 13 22.479 . A 85 LEU CG C 13 26.829 . A 85 LEU N N 15 119.134 . A 86 GLN H H 1 8.214 . A 86 GLN HA H 1 4.144 . A 86 GLN HBy H 1 2.280 . A 86 GLN HBx H 1 2.149 . A 86 GLN HE2x H 1 6.833 . A 86 GLN HE2y H 1 7.470 . A 86 GLN HGy H 1 2.510 . A 86 GLN HGx H 1 2.448 . A 86 GLN C C 13 179.797 . A 86 GLN CA C 13 59.199 . A 86 GLN CB C 13 28.225 . A 86 GLN CG C 13 33.952 . A 86 GLN N N 15 119.526 . A 86 GLN NE2 N 15 111.000 . A 87 THR H H 1 7.737 . A 87 THR HA H 1 4.130 . A 87 THR HB H 1 4.339 . A 87 THR HG2% H 1 1.304 . A 87 THR C C 13 175.331 . A 87 THR CA C 13 65.007 . A 87 THR CB C 13 69.245 . A 87 THR CG2 C 13 21.855 . A 87 THR N N 15 113.563 . A 88 GLN H H 1 7.391 . A 88 GLN HA H 1 4.300 . A 88 GLN HBy H 1 2.285 . A 88 GLN HBx H 1 1.550 . A 88 GLN HE2y H 1 7.200 . A 88 GLN HE2x H 1 6.780 . A 88 GLN HGx H 1 2.102 . A 88 GLN HGy H 1 2.104 . A 88 GLN C C 13 175.992 . A 88 GLN CA C 13 54.597 . A 88 GLN CB C 13 28.900 . A 88 GLN CG C 13 32.457 . A 88 GLN N N 15 117.660 . A 88 GLN NE2 N 15 113.400 . A 89 GLY H H 1 7.814 . A 89 GLY HAy H 1 4.034 . A 89 GLY HAx H 1 3.824 . A 89 GLY C C 13 174.250 . A 89 GLY CA C 13 46.115 . A 89 GLY N N 15 107.846 . A 90 LEU H H 1 7.621 . A 90 LEU HA H 1 4.533 . A 90 LEU HBy H 1 1.436 . A 90 LEU HBx H 1 1.277 . A 90 LEU HDx% H 1 0.825 . A 90 LEU HDy% H 1 0.878 . A 90 LEU HG H 1 1.450 . A 90 LEU C C 13 175.331 . A 90 LEU CA C 13 53.591 . A 90 LEU CB C 13 44.513 . A 90 LEU CDy C 13 25.830 . A 90 LEU CDx C 13 23.200 . A 90 LEU CG C 13 27.070 . A 90 LEU N N 15 120.103 . A 91 ASN H H 1 8.364 . A 91 ASN HA H 1 4.816 . A 91 ASN HBy H 1 2.930 . A 91 ASN HBx H 1 2.725 . A 91 ASN HD2x H 1 6.951 . A 91 ASN HD2y H 1 7.630 . A 91 ASN C C 13 175.511 . A 91 ASN CA C 13 52.090 . A 91 ASN CB C 13 39.707 . A 91 ASN N N 15 119.750 . A 91 ASN ND2 N 15 112.900 . A 92 ILE H H 1 8.557 . A 92 ILE HA H 1 3.913 . A 92 ILE HB H 1 1.821 . A 92 ILE HD1% H 1 0.785 . A 92 ILE HG1y H 1 1.285 . A 92 ILE HG1x H 1 1.230 . A 92 ILE HG2% H 1 0.872 . A 92 ILE C C 13 175.531 . A 92 ILE CA C 13 62.470 . A 92 ILE CB C 13 38.841 . A 92 ILE CD1 C 13 14.643 . A 92 ILE CG1 C 13 28.329 . A 92 ILE CG2 C 13 17.586 . A 92 ILE N N 15 122.359 . A 93 GLU H H 1 8.370 . A 93 GLU HA H 1 3.970 . A 93 GLU HBy H 1 2.015 . A 93 GLU HBx H 1 1.961 . A 93 GLU HGy H 1 2.320 . A 93 GLU HGx H 1 2.313 . A 93 GLU C C 13 177.814 . A 93 GLU CA C 13 59.265 . A 93 GLU CB C 13 28.800 . A 93 GLU CG C 13 36.580 . A 93 GLU N N 15 120.955 . A 94 ALA H H 1 7.876 . A 94 ALA HA H 1 4.089 . A 94 ALA HB% H 1 1.371 . A 94 ALA C C 13 178.495 . A 94 ALA CA C 13 53.758 . A 94 ALA CB C 13 18.679 . A 94 ALA N N 15 119.874 . A 95 LEU H H 1 7.582 . A 95 LEU HA H 1 3.966 . A 95 LEU HBy H 1 1.160 . A 95 LEU HBx H 1 0.984 . A 95 LEU HDx% H 1 0.638 . A 95 LEU HDy% H 1 0.525 . A 95 LEU HG H 1 1.227 . A 95 LEU C C 13 176.493 . A 95 LEU CA C 13 56.100 . A 95 LEU CB C 13 42.711 . A 95 LEU CDy C 13 24.800 . A 95 LEU CDx C 13 24.227 . A 95 LEU CG C 13 26.700 . A 95 LEU N N 15 116.492 . A 96 PHE H H 1 7.338 . A 96 PHE HA H 1 4.472 . A 96 PHE HBx H 1 2.710 . A 96 PHE HBy H 1 3.015 . A 96 PHE HDx H 1 6.857 . A 96 PHE HDy H 1 6.860 . A 96 PHE HEx H 1 6.850 . A 96 PHE HEy H 1 6.850 . A 96 PHE HZ H 1 6.814 . A 96 PHE C C 13 174.992 . A 96 PHE CA C 13 56.470 . A 96 PHE CB C 13 39.000 . A 96 PHE CDx C 13 133.700 . A 96 PHE CDy C 13 133.700 . A 96 PHE CEx C 13 132.600 . A 96 PHE CEy C 13 132.600 . A 96 PHE CZ C 13 130.200 . A 96 PHE N N 15 115.503 . A 97 ARG H H 1 7.638 . A 97 ARG HA H 1 4.361 . A 97 ARG HBx H 1 1.789 . A 97 ARG HBy H 1 1.885 . A 97 ARG HDx H 1 3.183 . A 97 ARG HDy H 1 3.183 . A 97 ARG HGx H 1 1.645 . A 97 ARG HGy H 1 1.645 . A 97 ARG C C 13 175.271 . A 97 ARG CA C 13 56.262 . A 97 ARG CB C 13 31.200 . A 97 ARG CD C 13 43.461 . A 97 ARG CG C 13 27.073 . A 97 ARG N N 15 120.698 . A 98 GLU H H 1 8.129 . A 98 GLU HA H 1 4.145 . A 98 GLU HBx H 1 2.080 . A 98 GLU HBy H 1 2.080 . A 98 GLU HGx H 1 2.253 . A 98 GLU HGy H 1 2.254 . A 98 GLU C C 13 181.199 . A 98 GLU CA C 13 58.266 . A 98 GLU CB C 13 31.195 . A 98 GLU CG C 13 36.707 . A 98 GLU N N 15 127.728 . stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 20 ASP C A 21 ASP N A 21 ASP CA A 21 ASP C 1.0 -87.0 -45.0 PHI 2 2 A 21 ASP C A 22 ASP N A 22 ASP CA A 22 ASP C 1.0 -86.0 -42.0 PHI 3 3 A 22 ASP C A 23 MET N A 23 MET CA A 23 MET C 1.0 -103.0 -31.0 PHI 4 4 A 23 MET C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -78.0 -54.0 PHI 5 5 A 24 LYS C A 25 GLN N A 25 GLN CA A 25 GLN C 1.0 -68.0 -54.0 PHI 6 6 A 25 GLN C A 26 SER N A 26 SER CA A 26 SER C 1.0 -77.0 -51.0 PHI 7 7 A 26 SER C A 27 ILE N A 27 ILE CA A 27 ILE C 1.0 -82.0 -52.0 PHI 8 8 A 27 ILE C A 28 VAL N A 28 VAL CA A 28 VAL C 1.0 -76.0 -50.0 PHI 9 9 A 28 VAL C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -68.0 -50.0 PHI 10 10 A 29 LYS C A 30 TRP N A 30 TRP CA A 30 TRP C 1.0 -101.0 -45.0 PHI 11 11 A 30 TRP C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -79.0 -47.0 PHI 12 12 A 31 LEU C A 32 PHE N A 32 PHE CA A 32 PHE C 1.0 -80.0 -52.0 PHI 13 13 A 32 PHE C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -106.0 -50.0 PHI 14 14 A 33 GLU C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -130.0 -82.0 PHI 15 15 A 34 LEU C A 35 ASN N A 35 ASN CA A 35 ASN C 1.0 -246.0 -14.0 PHI 16 16 A 35 ASN C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -68.0 -46.0 PHI 17 17 A 36 ALA C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -81.0 -47.0 PHI 18 18 A 37 LYS C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -72.0 -52.0 PHI 19 19 A 38 GLN C A 39 ARG N A 39 ARG CA A 39 ARG C 1.0 -73.0 -53.0 PHI 20 20 A 39 ARG C A 40 GLU N A 40 GLU CA A 40 GLU C 1.0 -76.0 -50.0 PHI 21 21 A 40 GLU C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -72.0 -54.0 PHI 22 22 A 41 VAL C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -68.0 -52.0 PHI 23 23 A 42 LEU C A 43 ALA N A 43 ALA CA A 43 ALA C 1.0 -72.0 -50.0 PHI 24 24 A 43 ALA C A 44 ARG N A 44 ARG CA A 44 ARG C 1.0 -84.0 -46.0 PHI 25 25 A 44 ARG C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -96.0 -44.0 PHI 26 26 A 45 ARG C A 46 PHE N A 46 PHE CA A 46 PHE C 1.0 -141.0 -57.0 PHI 27 27 A 46 PHE C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 53.0 95.0 PHI 28 28 A 47 GLY C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -177.0 -37.0 PHI 29 29 A 48 LEU C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 47.0 67.0 PHI 30 30 A 49 LEU C A 50 GLY N A 50 GLY CA A 50 GLY C 1.0 71.0 125.0 PHI 31 31 A 51 TYR C A 52 GLU N A 52 GLU CA A 52 GLU C 1.0 -171.0 -41.0 PHI 32 32 A 52 GLU C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -109.0 -57.0 PHI 33 33 A 53 ALA C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -160.0 -78.0 PHI 34 34 A 54 ALA C A 55 THR N A 55 THR CA A 55 THR C 1.0 -105.0 -57.0 PHI 35 35 A 55 THR C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -65.0 -53.0 PHI 36 36 A 56 LEU C A 57 GLU N A 57 GLU CA A 57 GLU C 1.0 -68.0 -54.0 PHI 37 37 A 57 GLU C A 58 ASP N A 58 ASP CA A 58 ASP C 1.0 -78.0 -56.0 PHI 38 38 A 58 ASP C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -73.0 -53.0 PHI 39 39 A 59 VAL C A 60 GLY N A 60 GLY CA A 60 GLY C 1.0 -71.0 -51.0 PHI 40 40 A 60 GLY C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -70.0 -54.0 PHI 41 41 A 61 ARG C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -80.0 -50.0 PHI 42 42 A 62 GLU C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -137.0 -65.0 PHI 43 43 A 63 ILE C A 64 GLY N A 64 GLY CA A 64 GLY C 1.0 43.0 107.0 PHI 44 44 A 64 GLY C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -146.0 -82.0 PHI 45 45 A 65 LEU C A 66 THR N A 66 THR CA A 66 THR C 1.0 -92.0 -62.0 PHI 46 46 A 66 THR C A 67 ARG N A 67 ARG CA A 67 ARG C 1.0 -67.0 -49.0 PHI 47 47 A 67 ARG C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -73.0 -49.0 PHI 48 48 A 68 GLU C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -75.0 -53.0 PHI 49 49 A 69 ARG C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -70.0 -58.0 PHI 50 50 A 70 VAL C A 71 ARG N A 71 ARG CA A 71 ARG C 1.0 -65.0 -53.0 PHI 51 51 A 71 ARG C A 72 GLN N A 72 GLN CA A 72 GLN C 1.0 -76.0 -54.0 PHI 52 52 A 72 GLN C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -70.0 -58.0 PHI 53 53 A 73 ILE C A 74 GLN N A 74 GLN CA A 74 GLN C 1.0 -71.0 -51.0 PHI 54 54 A 74 GLN C A 75 VAL N A 75 VAL CA A 75 VAL C 1.0 -74.0 -52.0 PHI 55 55 A 75 VAL C A 76 GLU N A 76 GLU CA A 76 GLU C 1.0 -73.0 -57.0 PHI 56 56 A 76 GLU C A 77 GLY N A 77 GLY CA A 77 GLY C 1.0 -78.0 -54.0 PHI 57 57 A 77 GLY C A 78 LEU N A 78 LEU CA A 78 LEU C 1.0 -71.0 -55.0 PHI 58 58 A 78 LEU C A 79 ARG N A 79 ARG CA A 79 ARG C 1.0 -77.0 -51.0 PHI 59 59 A 79 ARG C A 80 ARG N A 80 ARG CA A 80 ARG C 1.0 -71.0 -55.0 PHI 60 60 A 80 ARG C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -76.0 -50.0 PHI 61 61 A 81 LEU C A 82 ARG N A 82 ARG CA A 82 ARG C 1.0 -68.0 -52.0 PHI 62 62 A 82 ARG C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -72.0 -58.0 PHI 63 63 A 83 GLU C A 84 ILE N A 84 ILE CA A 84 ILE C 1.0 -87.0 -47.0 PHI 64 64 A 84 ILE C A 85 LEU N A 85 LEU CA A 85 LEU C 1.0 -78.0 -52.0 PHI 65 65 A 85 LEU C A 86 GLN N A 86 GLN CA A 86 GLN C 1.0 -71.0 -51.0 PHI 66 66 A 86 GLN C A 87 THR N A 87 THR CA A 87 THR C 1.0 -82.0 -52.0 PHI 67 67 A 87 THR C A 88 GLN N A 88 GLN CA A 88 GLN C 1.0 -117.0 -65.0 PHI 68 68 A 88 GLN C A 89 GLY N A 89 GLY CA A 89 GLY C 1.0 58.0 106.0 PHI 69 69 A 89 GLY C A 90 LEU N A 90 LEU CA A 90 LEU C 1.0 -126.0 -76.0 PHI 70 70 A 90 LEU C A 91 ASN N A 91 ASN CA A 91 ASN C 1.0 -125.0 -35.0 PHI 71 71 A 91 ASN C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 -74.0 -44.0 PHI 72 72 A 92 ILE C A 93 GLU N A 93 GLU CA A 93 GLU C 1.0 -76.0 -50.0 PHI 73 73 A 93 GLU C A 94 ALA N A 94 ALA CA A 94 ALA C 1.0 -89.0 -49.0 PHI 74 74 A 94 ALA C A 95 LEU N A 95 LEU CA A 95 LEU C 1.0 -115.0 -53.0 PHI 75 75 A 95 LEU C A 96 PHE N A 96 PHE CA A 96 PHE C 1.0 -127.0 -83.0 PHI 76 76 A 96 PHE C A 97 ARG N A 97 ARG CA A 97 ARG C 1.0 -143.0 -19.0 PHI 77 77 A 21 ASP N A 21 ASP CA A 21 ASP C A 22 ASP N 1.0 -56.0 -24.0 PSI 78 78 A 22 ASP N A 22 ASP CA A 22 ASP C A 23 MET N 1.0 -50.0 -24.0 PSI 79 79 A 23 MET N A 23 MET CA A 23 MET C A 24 LYS N 1.0 -55.0 -17.0 PSI 80 80 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 GLN N 1.0 -58.0 -24.0 PSI 81 81 A 25 GLN N A 25 GLN CA A 25 GLN C A 26 SER N 1.0 -53.0 -29.0 PSI 82 82 A 26 SER N A 26 SER CA A 26 SER C A 27 ILE N 1.0 -52.0 -30.0 PSI 83 83 A 27 ILE N A 27 ILE CA A 27 ILE C A 28 VAL N 1.0 -57.0 -15.0 PSI 84 84 A 28 VAL N A 28 VAL CA A 28 VAL C A 29 LYS N 1.0 -60.0 -32.0 PSI 85 85 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 TRP N 1.0 -59.0 -23.0 PSI 86 86 A 30 TRP N A 30 TRP CA A 30 TRP C A 31 LEU N 1.0 -58.0 -18.0 PSI 87 87 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 PHE N 1.0 -54.0 -6.0 PSI 88 88 A 32 PHE N A 32 PHE CA A 32 PHE C A 33 GLU N 1.0 -54.0 14.0 PSI 89 89 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 LEU N 1.0 -54.0 2.0 PSI 90 90 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 ASN N 1.0 -29.0 29.0 PSI 91 91 A 35 ASN N A 35 ASN CA A 35 ASN C A 36 ALA N 1.0 117.0 229.0 PSI 92 92 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 LYS N 1.0 -54.0 -20.0 PSI 93 93 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 GLN N 1.0 -54.0 -32.0 PSI 94 94 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ARG N 1.0 -59.0 -17.0 PSI 95 95 A 39 ARG N A 39 ARG CA A 39 ARG C A 40 GLU N 1.0 -58.0 -26.0 PSI 96 96 A 40 GLU N A 40 GLU CA A 40 GLU C A 41 VAL N 1.0 -51.0 -35.0 PSI 97 97 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 LEU N 1.0 -63.0 -29.0 PSI 98 98 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 ALA N 1.0 -56.0 -26.0 PSI 99 99 A 43 ALA N A 43 ALA CA A 43 ALA C A 44 ARG N 1.0 -50.0 -30.0 PSI 100 100 A 44 ARG N A 44 ARG CA A 44 ARG C A 45 ARG N 1.0 -57.0 -21.0 PSI 101 101 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 PHE N 1.0 -53.0 -1.0 PSI 102 102 A 46 PHE N A 46 PHE CA A 46 PHE C A 47 GLY N 1.0 -26.0 30.0 PSI 103 103 A 47 GLY N A 47 GLY CA A 47 GLY C A 48 LEU N 1.0 4.0 52.0 PSI 104 104 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 LEU N 1.0 141.0 189.0 PSI 105 105 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 GLY N 1.0 24.0 44.0 PSI 106 106 A 50 GLY N A 50 GLY CA A 50 GLY C A 51 TYR N 1.0 -32.0 32.0 PSI 107 107 A 52 GLU N A 52 GLU CA A 52 GLU C A 53 ALA N 1.0 106.0 170.0 PSI 108 108 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 ALA N 1.0 91.0 167.0 PSI 109 109 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 THR N 1.0 128.0 188.0 PSI 110 110 A 55 THR N A 55 THR CA A 55 THR C A 56 LEU N 1.0 156.0 178.0 PSI 111 111 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 GLU N 1.0 -55.0 -25.0 PSI 112 112 A 57 GLU N A 57 GLU CA A 57 GLU C A 58 ASP N 1.0 -51.0 -37.0 PSI 113 113 A 58 ASP N A 58 ASP CA A 58 ASP C A 59 VAL N 1.0 -51.0 -23.0 PSI 114 114 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 GLY N 1.0 -54.0 -34.0 PSI 115 115 A 60 GLY N A 60 GLY CA A 60 GLY C A 61 ARG N 1.0 -51.0 -31.0 PSI 116 116 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 GLU N 1.0 -55.0 -33.0 PSI 117 117 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 ILE N 1.0 -53.0 -13.0 PSI 118 118 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 GLY N 1.0 -17.0 25.0 PSI 119 119 A 64 GLY N A 64 GLY CA A 64 GLY C A 65 LEU N 1.0 -8.0 60.0 PSI 120 120 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 THR N 1.0 137.0 181.0 PSI 121 121 A 66 THR N A 66 THR CA A 66 THR C A 67 ARG N 1.0 150.0 186.0 PSI 122 122 A 67 ARG N A 67 ARG CA A 67 ARG C A 68 GLU N 1.0 -52.0 -22.0 PSI 123 123 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 ARG N 1.0 -59.0 -29.0 PSI 124 124 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 VAL N 1.0 -56.0 -32.0 PSI 125 125 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 ARG N 1.0 -48.0 -34.0 PSI 126 126 A 71 ARG N A 71 ARG CA A 71 ARG C A 72 GLN N 1.0 -56.0 -26.0 PSI 127 127 A 72 GLN N A 72 GLN CA A 72 GLN C A 73 ILE N 1.0 -49.0 -31.0 PSI 128 128 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 GLN N 1.0 -51.0 -33.0 PSI 129 129 A 74 GLN N A 74 GLN CA A 74 GLN C A 75 VAL N 1.0 -51.0 -35.0 PSI 130 130 A 75 VAL N A 75 VAL CA A 75 VAL C A 76 GLU N 1.0 -54.0 -30.0 PSI 131 131 A 76 GLU N A 76 GLU CA A 76 GLU C A 77 GLY N 1.0 -52.0 -32.0 PSI 132 132 A 77 GLY N A 77 GLY CA A 77 GLY C A 78 LEU N 1.0 -51.0 -29.0 PSI 133 133 A 78 LEU N A 78 LEU CA A 78 LEU C A 79 ARG N 1.0 -53.0 -21.0 PSI 134 134 A 79 ARG N A 79 ARG CA A 79 ARG C A 80 ARG N 1.0 -63.0 -25.0 PSI 135 135 A 80 ARG N A 80 ARG CA A 80 ARG C A 81 LEU N 1.0 -54.0 -30.0 PSI 136 136 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 ARG N 1.0 -54.0 -30.0 PSI 137 137 A 82 ARG N A 82 ARG CA A 82 ARG C A 83 GLU N 1.0 -49.0 -31.0 PSI 138 138 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 ILE N 1.0 -51.0 -33.0 PSI 139 139 A 84 ILE N A 84 ILE CA A 84 ILE C A 85 LEU N 1.0 -57.0 -19.0 PSI 140 140 A 85 LEU N A 85 LEU CA A 85 LEU C A 86 GLN N 1.0 -52.0 -26.0 PSI 141 141 A 86 GLN N A 86 GLN CA A 86 GLN C A 87 THR N 1.0 -50.0 -30.0 PSI 142 142 A 87 THR N A 87 THR CA A 87 THR C A 88 GLN N 1.0 -51.0 -5.0 PSI 143 143 A 88 GLN N A 88 GLN CA A 88 GLN C A 89 GLY N 1.0 -32.0 26.0 PSI 144 144 A 89 GLY N A 89 GLY CA A 89 GLY C A 90 LEU N 1.0 -9.0 43.0 PSI 145 145 A 90 LEU N A 90 LEU CA A 90 LEU C A 91 ASN N 1.0 115.0 189.0 PSI 146 146 A 91 ASN N A 91 ASN CA A 91 ASN C A 92 ILE N 1.0 74.0 172.0 PSI 147 147 A 92 ILE N A 92 ILE CA A 92 ILE C A 93 GLU N 1.0 -55.0 -9.0 PSI 148 148 A 93 GLU N A 93 GLU CA A 93 GLU C A 94 ALA N 1.0 -57.0 -9.0 PSI 149 149 A 94 ALA N A 94 ALA CA A 94 ALA C A 95 LEU N 1.0 -77.0 31.0 PSI 150 150 A 95 LEU N A 95 LEU CA A 95 LEU C A 96 PHE N 1.0 -61.0 11.0 PSI 151 151 A 96 PHE N A 96 PHE CA A 96 PHE C A 97 ARG N 1.0 -30.0 42.0 PSI 152 152 A 97 ARG N A 97 ARG CA A 97 ARG C A 98 GLU N 1.0 45.0 171.0 PSI stop_ save_