data_nef_c27167_6hka 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 BMRB 27168 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLN middle . . 3 A 3 TYR middle . . 4 A 4 LYS middle . . 5 A 5 LEU middle . . 6 A 6 ALA middle . . 7 A 7 LEU middle . . 8 A 8 ASN middle . . 9 A 9 GLY middle . false 10 A 10 LYS middle . . 11 A 11 THR middle . . 12 A 12 LEU middle . . 13 A 13 LYS middle . . 14 A 14 GLY middle . false 15 A 15 GLU middle . . 16 A 16 THR middle . . 17 A 17 THR middle . . 18 A 18 THR middle . . 19 A 19 GLU middle . . 20 A 20 ALA middle . . 21 A 21 VAL middle . . 22 A 22 ASP middle . . 23 A 23 ALA middle . . 24 A 24 ALA middle . . 25 A 25 THR middle . . 26 A 26 ALA middle . . 27 A 27 GLU middle . . 28 A 28 LYS middle . . 29 A 29 VAL middle . . 30 A 30 PHE middle . . 31 A 31 LYS middle . . 32 A 32 GLN middle . . 33 A 33 TYR middle . . 34 A 34 ALA middle . . 35 A 35 ASN middle . . 36 A 36 ASP middle . . 37 A 37 ASN middle . . 38 A 38 GLY middle . false 39 A 39 VAL middle . . 40 A 40 ASP middle . . 41 A 41 GLY middle . false 42 A 42 GLU middle . . 43 A 43 TRP middle . . 44 A 44 THR middle . . 45 A 45 TYR middle . . 46 A 46 ASP middle . . 47 A 47 ASP middle . . 48 A 48 ALA middle . . 49 A 49 THR middle . . 50 A 50 LYS middle . . 51 A 51 THR middle . . 52 A 52 PHE middle . . 53 A 53 THR middle . . 54 A 54 VAL middle . . 55 A 55 THR middle . . 56 A 56 GLU middle . . 57 A 57 LEU middle . . 58 A 58 VAL middle . . 59 A 59 PRO middle . false 60 A 60 ARG middle . . 61 A 61 GLY middle . false 62 A 62 SER middle . . 63 A 63 ASP middle . . 64 A 64 ASP middle . . 65 A 65 ASP middle . . 66 A 66 ASP middle . . 67 A 67 LYS middle . . 68 A 68 THR middle . . 69 A 69 VAL middle . . 70 A 70 LEU middle . . 71 A 71 SER middle . . 72 A 72 VAL middle . . 73 A 73 GLY middle . false 74 A 74 GLY middle . false 75 A 75 GLN middle . . 76 A 76 VAL middle . . 77 A 77 ASN middle . . 78 A 78 LEU middle . . 79 A 79 LEU middle . . 80 A 80 ILE middle . . 81 A 81 GLN middle . . 82 A 82 GLN middle . . 83 A 83 ALA middle . . 84 A 84 ILE middle . . 85 A 85 ASP middle . . 86 A 86 PRO middle . false 87 A 87 LYS middle . . 88 A 88 ASN middle . . 89 A 89 LEU middle . . 90 A 90 SER middle . . 91 A 91 ARG middle . . 92 A 92 LEU middle . . 93 A 93 PHE middle . . 94 A 94 PRO middle . false 95 A 95 GLY middle . false 96 A 96 TRP middle . . 97 A 97 LYS middle . . 98 A 98 ALA middle . . 99 A 99 TRP middle . . 100 A 100 VAL end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.231 . A 1 MET HBy H 1 2.276 . A 1 MET HBx H 1 2.141 . A 1 MET HGy H 1 2.470 . A 1 MET HGx H 1 2.219 . A 1 MET HE% H 1 2.173 . A 1 MET CA C 13 54.777 . A 1 MET CB C 13 32.772 . A 1 MET CG C 13 30.795 . A 1 MET CE C 13 16.413 . A 2 GLN H H 1 8.391 . A 2 GLN HA H 1 5.020 . A 2 GLN HBy H 1 2.075 . A 2 GLN HBx H 1 2.022 . A 2 GLN HGy H 1 2.420 . A 2 GLN HGx H 1 2.147 . A 2 GLN HE2y H 1 7.880 . A 2 GLN HE2x H 1 6.954 . A 2 GLN CA C 13 56.041 . A 2 GLN CB C 13 30.522 . A 2 GLN CG C 13 35.226 . A 2 GLN N N 15 123.863 . A 2 GLN NE2 N 15 112.632 . A 3 TYR H H 1 9.126 . A 3 TYR HA H 1 5.399 . A 3 TYR HBy H 1 3.465 . A 3 TYR HBx H 1 2.775 . A 3 TYR HDx H 1 7.183 . A 3 TYR HEx H 1 6.946 . A 3 TYR CA C 13 57.366 . A 3 TYR CB C 13 43.590 . A 3 TYR CDx C 13 133.674 . A 3 TYR CEx C 13 118.145 . A 3 TYR N N 15 124.692 . A 4 LYS H H 1 9.218 . A 4 LYS HA H 1 5.294 . A 4 LYS HBx H 1 2.004 . A 4 LYS HBy H 1 2.004 . A 4 LYS HGy H 1 1.503 . A 4 LYS HGx H 1 1.367 . A 4 LYS HDx H 1 1.662 . A 4 LYS HDy H 1 1.662 . A 4 LYS HEx H 1 2.938 . A 4 LYS HEy H 1 2.938 . A 4 LYS CA C 13 55.342 . A 4 LYS CB C 13 36.065 . A 4 LYS CG C 13 25.577 . A 4 LYS CD C 13 29.236 . A 4 LYS CE C 13 42.133 . A 4 LYS N N 15 121.737 . A 5 LEU H H 1 8.582 . A 5 LEU HA H 1 4.983 . A 5 LEU HBy H 1 0.865 . A 5 LEU HBx H 1 -1.055 . A 5 LEU HG H 1 0.913 . A 5 LEU HD11 H 1 0.608 . A 5 LEU HD12 H 1 0.608 . A 5 LEU HD13 H 1 0.608 . A 5 LEU HD21 H 1 0.535 . A 5 LEU HD22 H 1 0.535 . A 5 LEU HD23 H 1 0.535 . A 5 LEU CA C 13 52.825 . A 5 LEU CB C 13 42.565 . A 5 LEU CG C 13 27.228 . A 5 LEU CDy C 13 26.048 . A 5 LEU CDx C 13 24.419 . A 5 LEU N N 15 125.830 . A 6 ALA H H 1 9.312 . A 6 ALA HA H 1 4.852 . A 6 ALA HB% H 1 1.339 . A 6 ALA CA C 13 50.685 . A 6 ALA CB C 13 19.959 . A 6 ALA N N 15 130.084 . A 7 LEU H H 1 8.595 . A 7 LEU HA H 1 4.544 . A 7 LEU HBx H 1 1.471 . A 7 LEU HBy H 1 1.471 . A 7 LEU HG H 1 1.384 . A 7 LEU HD11 H 1 0.813 . A 7 LEU HD12 H 1 0.813 . A 7 LEU HD13 H 1 0.813 . A 7 LEU HD21 H 1 0.765 . A 7 LEU HD22 H 1 0.765 . A 7 LEU HD23 H 1 0.765 . A 7 LEU CA C 13 54.451 . A 7 LEU CB C 13 42.746 . A 7 LEU CG C 13 27.449 . A 7 LEU CDy C 13 25.900 . A 7 LEU CDx C 13 25.453 . A 7 LEU N N 15 122.407 . A 8 ASN H H 1 8.845 . A 8 ASN HA H 1 5.221 . A 8 ASN HBy H 1 2.951 . A 8 ASN HBx H 1 2.656 . A 8 ASN HD2y H 1 7.172 . A 8 ASN HD2x H 1 6.901 . A 8 ASN CA C 13 51.735 . A 8 ASN CB C 13 38.790 . A 8 ASN N N 15 125.342 . A 8 ASN ND2 N 15 111.803 . A 9 GLY H H 1 8.043 . A 9 GLY HAy H 1 4.481 . A 9 GLY HAx H 1 4.070 . A 9 GLY CA C 13 44.825 . A 9 GLY N N 15 110.527 . A 10 LYS H H 1 9.119 . A 10 LYS HA H 1 4.118 . A 10 LYS HBx H 1 1.877 . A 10 LYS HBy H 1 1.877 . A 10 LYS HGx H 1 1.498 . A 10 LYS HDx H 1 1.701 . A 10 LYS HDy H 1 1.701 . A 10 LYS HEx H 1 3.044 . A 10 LYS CA C 13 59.030 . A 10 LYS CB C 13 32.762 . A 10 LYS CG C 13 25.059 . A 10 LYS CD C 13 29.301 . A 10 LYS CE C 13 42.183 . A 10 LYS N N 15 121.262 . A 11 THR H H 1 8.815 . A 11 THR HA H 1 4.408 . A 11 THR HB H 1 4.270 . A 11 THR HG2% H 1 1.207 . A 11 THR CA C 13 62.184 . A 11 THR CB C 13 69.764 . A 11 THR CG2 C 13 22.012 . A 11 THR N N 15 109.687 . A 12 LEU H H 1 7.449 . A 12 LEU HA H 1 4.454 . A 12 LEU HBy H 1 1.559 . A 12 LEU HBx H 1 1.499 . A 12 LEU HG H 1 1.470 . A 12 LEU HD11 H 1 0.848 . A 12 LEU HD12 H 1 0.848 . A 12 LEU HD13 H 1 0.848 . A 12 LEU HD21 H 1 0.922 . A 12 LEU HD22 H 1 0.922 . A 12 LEU HD23 H 1 0.922 . A 12 LEU CA C 13 55.157 . A 12 LEU CB C 13 43.716 . A 12 LEU CG C 13 27.300 . A 12 LEU CDy C 13 25.120 . A 12 LEU CDx C 13 24.262 . A 12 LEU N N 15 124.735 . A 13 LYS H H 1 8.202 . A 13 LYS HA H 1 5.055 . A 13 LYS HBy H 1 1.913 . A 13 LYS HBx H 1 1.792 . A 13 LYS HGx H 1 1.498 . A 13 LYS HDx H 1 1.767 . A 13 LYS HEy H 1 3.036 . A 13 LYS HEx H 1 3.013 . A 13 LYS CA C 13 54.378 . A 13 LYS CB C 13 35.137 . A 13 LYS CG C 13 25.110 . A 13 LYS CD C 13 29.373 . A 13 LYS CE C 13 42.622 . A 13 LYS N N 15 123.828 . A 14 GLY H H 1 8.429 . A 14 GLY HAx H 1 4.251 . A 14 GLY CA C 13 45.222 . A 14 GLY N N 15 109.873 . A 15 GLU H H 1 8.492 . A 15 GLU HA H 1 5.638 . A 15 GLU HBy H 1 2.044 . A 15 GLU HBx H 1 1.985 . A 15 GLU HGx H 1 2.209 . A 15 GLU CA C 13 54.835 . A 15 GLU CB C 13 33.686 . A 15 GLU CG C 13 36.115 . A 15 GLU N N 15 119.542 . A 16 THR H H 1 8.667 . A 16 THR HA H 1 4.779 . A 16 THR HB H 1 4.012 . A 16 THR HG2% H 1 0.613 . A 16 THR CA C 13 60.544 . A 16 THR CB C 13 69.787 . A 16 THR CG2 C 13 19.531 . A 16 THR N N 15 116.085 . A 17 THR H H 1 8.175 . A 17 THR HA H 1 5.870 . A 17 THR HB H 1 4.333 . A 17 THR HG2% H 1 1.227 . A 17 THR CA C 13 60.063 . A 17 THR CB C 13 73.266 . A 17 THR CG2 C 13 21.571 . A 17 THR N N 15 112.314 . A 18 THR H H 1 9.043 . A 18 THR HA H 1 4.724 . A 18 THR HB H 1 3.899 . A 18 THR HG2% H 1 0.550 . A 18 THR CA C 13 62.428 . A 18 THR CB C 13 70.241 . A 18 THR CG2 C 13 19.189 . A 18 THR N N 15 115.158 . A 19 GLU H H 1 7.999 . A 19 GLU HA H 1 5.221 . A 19 GLU HBy H 1 2.003 . A 19 GLU HBx H 1 1.988 . A 19 GLU HGy H 1 2.346 . A 19 GLU HGx H 1 2.116 . A 19 GLU CA C 13 54.530 . A 19 GLU CB C 13 30.440 . A 19 GLU CG C 13 35.646 . A 19 GLU N N 15 126.278 . A 20 ALA H H 1 9.383 . A 20 ALA HA H 1 4.985 . A 20 ALA HB% H 1 1.397 . A 20 ALA CA C 13 50.950 . A 20 ALA CB C 13 23.753 . A 20 ALA N N 15 127.705 . A 21 VAL H H 1 8.545 . A 21 VAL HA H 1 4.161 . A 21 VAL HB H 1 2.243 . A 21 VAL HG11 H 1 1.048 . A 21 VAL HG12 H 1 1.048 . A 21 VAL HG13 H 1 1.048 . A 21 VAL HG21 H 1 1.056 . A 21 VAL HG22 H 1 1.056 . A 21 VAL HG23 H 1 1.056 . A 21 VAL CA C 13 63.695 . A 21 VAL CB C 13 32.083 . A 21 VAL CGx C 13 20.118 . A 21 VAL CGy C 13 21.009 . A 21 VAL N N 15 116.082 . A 22 ASP H H 1 7.378 . A 22 ASP HA H 1 4.827 . A 22 ASP HBy H 1 3.090 . A 22 ASP HBx H 1 3.034 . A 22 ASP CA C 13 52.539 . A 22 ASP CB C 13 42.220 . A 22 ASP N N 15 115.392 . A 23 ALA H H 1 8.332 . A 23 ALA HA H 1 3.318 . A 23 ALA HB% H 1 1.228 . A 23 ALA CA C 13 54.667 . A 23 ALA CB C 13 17.557 . A 23 ALA N N 15 121.755 . A 24 ALA H H 1 8.108 . A 24 ALA HA H 1 4.014 . A 24 ALA HB% H 1 1.346 . A 24 ALA CA C 13 54.869 . A 24 ALA CB C 13 17.965 . A 24 ALA N N 15 120.731 . A 25 THR H H 1 8.325 . A 25 THR HA H 1 3.747 . A 25 THR HB H 1 4.074 . A 25 THR HG2% H 1 1.279 . A 25 THR CA C 13 66.974 . A 25 THR CB C 13 67.992 . A 25 THR CG2 C 13 21.155 . A 25 THR N N 15 116.624 . A 26 ALA H H 1 7.224 . A 26 ALA HA H 1 3.159 . A 26 ALA HB% H 1 0.624 . A 26 ALA CA C 13 54.947 . A 26 ALA CB C 13 17.671 . A 26 ALA N N 15 123.943 . A 27 GLU H H 1 8.379 . A 27 GLU HA H 1 2.697 . A 27 GLU HBy H 1 1.986 . A 27 GLU HBx H 1 1.714 . A 27 GLU HGx H 1 1.692 . A 27 GLU CA C 13 59.704 . A 27 GLU CB C 13 29.080 . A 27 GLU CG C 13 35.489 . A 27 GLU N N 15 116.893 . A 28 LYS H H 1 6.995 . A 28 LYS HA H 1 3.774 . A 28 LYS HBx H 1 1.887 . A 28 LYS HGy H 1 1.595 . A 28 LYS HGx H 1 1.374 . A 28 LYS HDx H 1 1.662 . A 28 LYS HEx H 1 2.937 . A 28 LYS CA C 13 59.826 . A 28 LYS CB C 13 32.361 . A 28 LYS CG C 13 25.111 . A 28 LYS CD C 13 29.256 . A 28 LYS CE C 13 42.237 . A 28 LYS N N 15 116.775 . A 29 VAL H H 1 7.372 . A 29 VAL HA H 1 3.658 . A 29 VAL HB H 1 1.798 . A 29 VAL HG11 H 1 0.825 . A 29 VAL HG12 H 1 0.825 . A 29 VAL HG13 H 1 0.825 . A 29 VAL HG21 H 1 0.950 . A 29 VAL HG22 H 1 0.950 . A 29 VAL HG23 H 1 0.950 . A 29 VAL CA C 13 66.134 . A 29 VAL CB C 13 31.803 . A 29 VAL CGx C 13 20.450 . A 29 VAL CGy C 13 21.790 . A 29 VAL N N 15 120.895 . A 30 PHE H H 1 8.534 . A 30 PHE HA H 1 4.840 . A 30 PHE HBy H 1 3.398 . A 30 PHE HBx H 1 2.909 . A 30 PHE HDx H 1 6.625 . A 30 PHE HEx H 1 7.136 . A 30 PHE HZ H 1 7.830 . A 30 PHE CA C 13 56.854 . A 30 PHE CB C 13 37.570 . A 30 PHE CDx C 13 130.035 . A 30 PHE CEx C 13 130.443 . A 30 PHE CZ C 13 132.303 . A 30 PHE N N 15 120.757 . A 31 LYS H H 1 9.151 . A 31 LYS HA H 1 4.192 . A 31 LYS HBy H 1 1.730 . A 31 LYS HBx H 1 1.604 . A 31 LYS HGy H 1 0.903 . A 31 LYS HGx H 1 0.546 . A 31 LYS HDy H 1 1.168 . A 31 LYS HDx H 1 1.088 . A 31 LYS HEy H 1 1.968 . A 31 LYS HEx H 1 1.716 . A 31 LYS CA C 13 59.881 . A 31 LYS CB C 13 31.727 . A 31 LYS CG C 13 25.794 . A 31 LYS CD C 13 28.944 . A 31 LYS CE C 13 41.461 . A 31 LYS N N 15 122.973 . A 32 GLN H H 1 7.523 . A 32 GLN HA H 1 4.102 . A 32 GLN HBy H 1 2.294 . A 32 GLN HBx H 1 2.250 . A 32 GLN HGy H 1 2.495 . A 32 GLN HGx H 1 2.469 . A 32 GLN HE2x H 1 6.933 . A 32 GLN HE2y H 1 7.976 . A 32 GLN CA C 13 58.787 . A 32 GLN CB C 13 28.225 . A 32 GLN CG C 13 33.543 . A 32 GLN N N 15 120.030 . A 32 GLN NE2 N 15 115.480 . A 33 TYR H H 1 8.249 . A 33 TYR HA H 1 4.352 . A 33 TYR HBx H 1 3.369 . A 33 TYR HDx H 1 7.030 . A 33 TYR HEx H 1 6.773 . A 33 TYR CA C 13 61.764 . A 33 TYR CB C 13 38.568 . A 33 TYR CDx C 13 132.881 . A 33 TYR CEx C 13 118.332 . A 33 TYR N N 15 120.647 . A 34 ALA H H 1 9.215 . A 34 ALA HA H 1 3.862 . A 34 ALA HB% H 1 1.893 . A 34 ALA CA C 13 56.267 . A 34 ALA CB C 13 17.929 . A 34 ALA N N 15 122.922 . A 35 ASN H H 1 8.338 . A 35 ASN HA H 1 4.504 . A 35 ASN HBy H 1 2.987 . A 35 ASN HBx H 1 2.975 . A 35 ASN HD2y H 1 7.662 . A 35 ASN HD2x H 1 7.011 . A 35 ASN CA C 13 56.975 . A 35 ASN CB C 13 38.923 . A 35 ASN N N 15 117.921 . A 35 ASN ND2 N 15 112.526 . A 36 ASP H H 1 8.934 . A 36 ASP HA H 1 4.426 . A 36 ASP HBy H 1 2.790 . A 36 ASP HBx H 1 2.632 . A 36 ASP CA C 13 56.985 . A 36 ASP CB C 13 40.114 . A 36 ASP N N 15 121.417 . A 37 ASN H H 1 7.460 . A 37 ASN HA H 1 4.684 . A 37 ASN HBy H 1 2.744 . A 37 ASN HBx H 1 2.150 . A 37 ASN HD2y H 1 6.732 . A 37 ASN HD2x H 1 6.434 . A 37 ASN CA C 13 53.835 . A 37 ASN CB C 13 40.206 . A 37 ASN N N 15 115.465 . A 37 ASN ND2 N 15 115.452 . A 38 GLY H H 1 7.841 . A 38 GLY HAx H 1 3.986 . A 38 GLY CA C 13 47.057 . A 38 GLY N N 15 108.595 . A 39 VAL H H 1 8.193 . A 39 VAL HA H 1 4.229 . A 39 VAL HB H 1 1.850 . A 39 VAL HG11 H 1 0.860 . A 39 VAL HG12 H 1 0.860 . A 39 VAL HG13 H 1 0.860 . A 39 VAL HG21 H 1 0.727 . A 39 VAL HG22 H 1 0.727 . A 39 VAL HG23 H 1 0.727 . A 39 VAL CA C 13 61.918 . A 39 VAL CB C 13 33.390 . A 39 VAL CGx C 13 21.360 . A 39 VAL CGy C 13 21.414 . A 39 VAL N N 15 120.582 . A 40 ASP H H 1 8.537 . A 40 ASP HA H 1 4.959 . A 40 ASP HBy H 1 2.772 . A 40 ASP HBx H 1 2.669 . A 40 ASP CA C 13 52.566 . A 40 ASP CB C 13 43.370 . A 40 ASP N N 15 127.235 . A 41 GLY H H 1 8.136 . A 41 GLY HAy H 1 4.216 . A 41 GLY HAx H 1 3.890 . A 41 GLY CA C 13 45.632 . A 41 GLY N N 15 107.889 . A 42 GLU H H 1 8.343 . A 42 GLU HA H 1 4.779 . A 42 GLU HBy H 1 2.105 . A 42 GLU HBx H 1 2.030 . A 42 GLU HGy H 1 2.390 . A 42 GLU HGx H 1 2.292 . A 42 GLU CA C 13 55.549 . A 42 GLU CB C 13 31.403 . A 42 GLU CG C 13 36.194 . A 42 GLU N N 15 121.131 . A 43 TRP H H 1 9.362 . A 43 TRP HA H 1 5.393 . A 43 TRP HBy H 1 3.394 . A 43 TRP HBx H 1 3.224 . A 43 TRP HD1 H 1 7.610 . A 43 TRP HE1 H 1 10.541 . A 43 TRP HE3 H 1 7.637 . A 43 TRP HZ2 H 1 7.349 . A 43 TRP HZ3 H 1 7.038 . A 43 TRP HH2 H 1 6.781 . A 43 TRP CA C 13 57.894 . A 43 TRP CB C 13 30.454 . A 43 TRP CD1 C 13 127.166 . A 43 TRP CE3 C 13 121.136 . A 43 TRP CZ2 C 13 114.436 . A 43 TRP CZ3 C 13 121.369 . A 43 TRP CH2 C 13 123.145 . A 43 TRP N N 15 128.502 . A 43 TRP NE1 N 15 130.794 . A 44 THR H H 1 9.278 . A 44 THR HA H 1 4.859 . A 44 THR HB H 1 4.282 . A 44 THR HG2% H 1 1.254 . A 44 THR CA C 13 60.711 . A 44 THR CB C 13 72.360 . A 44 THR CG2 C 13 22.053 . A 44 THR N N 15 115.104 . A 45 TYR H H 1 8.660 . A 45 TYR HA H 1 5.045 . A 45 TYR HBy H 1 2.936 . A 45 TYR HBx H 1 2.565 . A 45 TYR HDx H 1 7.222 . A 45 TYR HEx H 1 6.388 . A 45 TYR CA C 13 57.024 . A 45 TYR CB C 13 41.646 . A 45 TYR CDx C 13 132.112 . A 45 TYR CEx C 13 117.475 . A 45 TYR N N 15 121.325 . A 46 ASP H H 1 7.508 . A 46 ASP HA H 1 4.648 . A 46 ASP HBy H 1 2.668 . A 46 ASP HBx H 1 2.325 . A 46 ASP CA C 13 51.866 . A 46 ASP CB C 13 43.215 . A 46 ASP N N 15 128.475 . A 47 ASP H H 1 8.648 . A 47 ASP HA H 1 4.213 . A 47 ASP HBx H 1 2.588 . A 47 ASP HBy H 1 2.889 . A 47 ASP CA C 13 56.368 . A 47 ASP CB C 13 42.221 . A 47 ASP N N 15 125.145 . A 48 ALA H H 1 8.400 . A 48 ALA HA H 1 4.176 . A 48 ALA HB% H 1 1.556 . A 48 ALA CA C 13 55.147 . A 48 ALA CB C 13 18.360 . A 48 ALA N N 15 120.179 . A 49 THR H H 1 7.064 . A 49 THR HA H 1 4.434 . A 49 THR HB H 1 4.444 . A 49 THR HG2% H 1 1.128 . A 49 THR CA C 13 60.530 . A 49 THR CB C 13 70.277 . A 49 THR CG2 C 13 21.292 . A 49 THR N N 15 103.662 . A 50 LYS H H 1 7.908 . A 50 LYS HA H 1 4.246 . A 50 LYS HBx H 1 2.132 . A 50 LYS HGy H 1 1.456 . A 50 LYS HGx H 1 1.284 . A 50 LYS HDy H 1 1.767 . A 50 LYS HDx H 1 1.474 . A 50 LYS HEx H 1 3.023 . A 50 LYS CA C 13 56.508 . A 50 LYS CB C 13 29.455 . A 50 LYS CG C 13 24.566 . A 50 LYS CD C 13 28.478 . A 50 LYS CE C 13 43.050 . A 50 LYS N N 15 123.189 . A 51 THR H H 1 7.400 . A 51 THR HA H 1 5.515 . A 51 THR HB H 1 3.801 . A 51 THR HG2% H 1 0.979 . A 51 THR CA C 13 62.225 . A 51 THR CB C 13 72.143 . A 51 THR CG2 C 13 20.369 . A 51 THR N N 15 111.090 . A 52 PHE H H 1 10.312 . A 52 PHE HA H 1 5.648 . A 52 PHE HBy H 1 3.331 . A 52 PHE HBx H 1 3.209 . A 52 PHE HDx H 1 7.830 . A 52 PHE HEx H 1 7.193 . A 52 PHE HZ H 1 6.982 . A 52 PHE CA C 13 57.414 . A 52 PHE CB C 13 42.108 . A 52 PHE CDx C 13 132.643 . A 52 PHE CEx C 13 132.566 . A 52 PHE CZ C 13 128.717 . A 52 PHE N N 15 131.285 . A 53 THR H H 1 9.234 . A 53 THR HA H 1 5.276 . A 53 THR HB H 1 3.880 . A 53 THR HG2% H 1 1.040 . A 53 THR CA C 13 61.651 . A 53 THR CB C 13 70.665 . A 53 THR CG2 C 13 20.990 . A 53 THR N N 15 118.766 . A 54 VAL H H 1 8.175 . A 54 VAL HA H 1 4.520 . A 54 VAL HB H 1 0.216 . A 54 VAL HG11 H 1 0.326 . A 54 VAL HG12 H 1 0.326 . A 54 VAL HG13 H 1 0.326 . A 54 VAL HG21 H 1 -0.435 . A 54 VAL HG22 H 1 -0.435 . A 54 VAL HG23 H 1 -0.435 . A 54 VAL CA C 13 58.647 . A 54 VAL CB C 13 32.433 . A 54 VAL CGx C 13 19.934 . A 54 VAL CGy C 13 20.320 . A 54 VAL N N 15 124.270 . A 55 THR H H 1 8.482 . A 55 THR HA H 1 4.745 . A 55 THR HB H 1 3.967 . A 55 THR HG2% H 1 1.227 . A 55 THR CA C 13 60.871 . A 55 THR CB C 13 70.537 . A 55 THR CG2 C 13 21.473 . A 55 THR N N 15 123.648 . A 56 GLU H H 1 8.171 . A 56 GLU HA H 1 4.466 . A 56 GLU HBy H 1 2.160 . A 56 GLU HBx H 1 2.063 . A 56 GLU HGy H 1 2.441 . A 56 GLU HGx H 1 2.363 . A 56 GLU CA C 13 56.573 . A 56 GLU CB C 13 31.289 . A 56 GLU CG C 13 36.458 . A 56 GLU N N 15 127.224 . A 57 LEU H H 1 8.644 . A 57 LEU HA H 1 4.480 . A 57 LEU HBx H 1 1.575 . A 57 LEU HBy H 1 1.688 . A 57 LEU HG H 1 1.642 . A 57 LEU HD11 H 1 0.946 . A 57 LEU HD12 H 1 0.946 . A 57 LEU HD13 H 1 0.946 . A 57 LEU HD21 H 1 0.896 . A 57 LEU HD22 H 1 0.896 . A 57 LEU HD23 H 1 0.896 . A 57 LEU CA C 13 55.157 . A 57 LEU CB C 13 42.485 . A 57 LEU CG C 13 27.171 . A 57 LEU CDy C 13 25.040 . A 57 LEU CDx C 13 23.599 . A 57 LEU N N 15 125.852 . A 58 VAL H H 1 8.291 . A 58 VAL HA H 1 4.496 . A 58 VAL HB H 1 2.116 . A 58 VAL HG11 H 1 0.965 . A 58 VAL HG12 H 1 0.965 . A 58 VAL HG13 H 1 0.965 . A 58 VAL HG21 H 1 1.005 . A 58 VAL HG22 H 1 1.005 . A 58 VAL HG23 H 1 1.005 . A 58 VAL CA C 13 59.666 . A 58 VAL CB C 13 32.905 . A 58 VAL CGx C 13 20.386 . A 58 VAL CGy C 13 20.901 . A 58 VAL N N 15 123.305 . A 59 PRO HA H 1 4.479 . A 59 PRO HBy H 1 2.347 . A 59 PRO HBx H 1 1.942 . A 59 PRO HGy H 1 2.106 . A 59 PRO HGx H 1 2.020 . A 59 PRO HDy H 1 3.900 . A 59 PRO HDx H 1 3.738 . A 59 PRO CA C 13 63.087 . A 59 PRO CB C 13 32.171 . A 59 PRO CG C 13 27.468 . A 59 PRO CD C 13 51.103 . A 60 ARG H H 1 8.553 . A 60 ARG HA H 1 4.381 . A 60 ARG HBy H 1 1.916 . A 60 ARG HBx H 1 1.841 . A 60 ARG HDx H 1 2.514 . A 60 ARG CA C 13 56.391 . A 60 ARG CB C 13 31.074 . A 60 ARG CD C 13 43.433 . A 60 ARG CG C 13 27.130 . A 60 ARG N N 15 122.358 . A 61 GLY H H 1 8.606 . A 61 GLY HAx H 1 4.012 . A 61 GLY HAy H 1 4.113 . A 61 GLY CA C 13 45.219 . A 61 GLY N N 15 110.998 . A 62 SER H H 1 8.366 . A 62 SER HA H 1 4.527 . A 62 SER HBy H 1 3.954 . A 62 SER HBx H 1 3.893 . A 62 SER CA C 13 58.475 . A 62 SER CB C 13 64.103 . A 62 SER N N 15 115.855 . A 63 ASP H H 1 8.565 . A 63 ASP HA H 1 4.679 . A 63 ASP HBy H 1 2.765 . A 63 ASP HBx H 1 2.680 . A 63 ASP CA C 13 54.672 . A 63 ASP CB C 13 41.064 . A 63 ASP N N 15 122.358 . A 64 ASP H H 1 8.248 . A 64 ASP HA H 1 4.611 . A 64 ASP HBy H 1 2.723 . A 64 ASP HBx H 1 2.683 . A 64 ASP CA C 13 54.693 . A 64 ASP CB C 13 41.069 . A 64 ASP N N 15 120.092 . A 65 ASP H H 1 8.240 . A 65 ASP HA H 1 4.639 . A 65 ASP HBy H 1 2.768 . A 65 ASP HBx H 1 2.687 . A 65 ASP CA C 13 54.693 . A 65 ASP CB C 13 41.045 . A 65 ASP N N 15 120.092 . A 66 ASP H H 1 8.313 . A 66 ASP HA H 1 4.605 . A 66 ASP HBx H 1 2.734 . A 66 ASP HBy H 1 2.778 . A 66 ASP CA C 13 54.691 . A 66 ASP CB C 13 40.747 . A 66 ASP N N 15 120.514 . A 67 LYS H H 1 8.266 . A 67 LYS HA H 1 4.381 . A 67 LYS HBx H 1 1.853 . A 67 LYS HGx H 1 1.499 . A 67 LYS HDx H 1 1.884 . A 67 LYS HEx H 1 3.063 . A 67 LYS CA C 13 56.504 . A 67 LYS CB C 13 32.638 . A 67 LYS CG C 13 24.758 . A 67 LYS CD C 13 29.081 . A 67 LYS CE C 13 41.794 . A 67 LYS N N 15 121.478 . A 68 THR H H 1 8.257 . A 68 THR HA H 1 4.320 . A 68 THR HB H 1 4.272 . A 68 THR HG2% H 1 1.257 . A 68 THR CA C 13 62.865 . A 68 THR CB C 13 69.764 . A 68 THR CG2 C 13 21.981 . A 68 THR N N 15 115.647 . A 69 VAL H H 1 8.270 . A 69 VAL HA H 1 4.099 . A 69 VAL HB H 1 2.138 . A 69 VAL HG11 H 1 1.005 . A 69 VAL HG12 H 1 1.005 . A 69 VAL HG13 H 1 1.005 . A 69 VAL HG21 H 1 0.976 . A 69 VAL HG22 H 1 0.976 . A 69 VAL HG23 H 1 0.976 . A 69 VAL CA C 13 62.991 . A 69 VAL CB C 13 32.498 . A 69 VAL CGx C 13 21.178 . A 69 VAL CGy C 13 21.284 . A 69 VAL N N 15 122.954 . A 70 LEU H H 1 8.323 . A 70 LEU HA H 1 4.462 . A 70 LEU HBy H 1 1.722 . A 70 LEU HBx H 1 1.638 . A 70 LEU HG H 1 1.739 . A 70 LEU HD11 H 1 0.960 . A 70 LEU HD12 H 1 0.960 . A 70 LEU HD13 H 1 0.960 . A 70 LEU HD21 H 1 0.895 . A 70 LEU HD22 H 1 0.895 . A 70 LEU HD23 H 1 0.895 . A 70 LEU CA C 13 55.265 . A 70 LEU CB C 13 42.890 . A 70 LEU CG C 13 27.135 . A 70 LEU CDy C 13 25.053 . A 70 LEU CDx C 13 23.701 . A 70 LEU N N 15 124.932 . A 71 SER H H 1 8.346 . A 71 SER HA H 1 4.587 . A 71 SER HBy H 1 4.289 . A 71 SER HBx H 1 4.025 . A 71 SER CA C 13 57.870 . A 71 SER CB C 13 64.500 . A 71 SER N N 15 117.602 . A 72 VAL H H 1 8.864 . A 72 VAL HA H 1 3.927 . A 72 VAL HB H 1 2.217 . A 72 VAL HG11 H 1 1.012 . A 72 VAL HG12 H 1 1.012 . A 72 VAL HG13 H 1 1.012 . A 72 VAL HG21 H 1 1.130 . A 72 VAL HG22 H 1 1.130 . A 72 VAL HG23 H 1 1.130 . A 72 VAL CA C 13 65.860 . A 72 VAL CB C 13 31.773 . A 72 VAL CGx C 13 21.551 . A 72 VAL CGy C 13 22.361 . A 72 VAL N N 15 122.371 . A 73 GLY H H 1 8.936 . A 73 GLY HAx H 1 3.969 . A 73 GLY CA C 13 47.161 . A 73 GLY N N 15 108.703 . A 74 GLY H H 1 8.295 . A 74 GLY HAx H 1 3.969 . A 74 GLY CA C 13 46.967 . A 74 GLY N N 15 109.404 . A 75 GLN H H 1 8.425 . A 75 GLN HA H 1 4.229 . A 75 GLN HBy H 1 2.285 . A 75 GLN HBx H 1 2.228 . A 75 GLN HGy H 1 2.502 . A 75 GLN HGx H 1 2.435 . A 75 GLN HE2y H 1 7.298 . A 75 GLN HE2x H 1 6.853 . A 75 GLN CA C 13 58.763 . A 75 GLN CB C 13 29.082 . A 75 GLN CG C 13 34.409 . A 75 GLN N N 15 121.920 . A 75 GLN NE2 N 15 110.772 . A 76 VAL H H 1 8.527 . A 76 VAL HA H 1 3.675 . A 76 VAL HB H 1 2.270 . A 76 VAL HG11 H 1 1.028 . A 76 VAL HG12 H 1 1.028 . A 76 VAL HG13 H 1 1.028 . A 76 VAL HG21 H 1 1.131 . A 76 VAL HG22 H 1 1.131 . A 76 VAL HG23 H 1 1.131 . A 76 VAL CA C 13 66.832 . A 76 VAL CB C 13 31.542 . A 76 VAL CGx C 13 21.828 . A 76 VAL CGy C 13 23.459 . A 76 VAL N N 15 120.204 . A 77 ASN H H 1 8.334 . A 77 ASN HA H 1 4.400 . A 77 ASN HBy H 1 2.949 . A 77 ASN HBx H 1 2.892 . A 77 ASN HD2x H 1 6.812 . A 77 ASN HD2y H 1 7.635 . A 77 ASN CA C 13 57.102 . A 77 ASN CB C 13 38.951 . A 77 ASN N N 15 118.150 . A 77 ASN ND2 N 15 111.546 . A 78 LEU H H 1 7.698 . A 78 LEU HA H 1 4.135 . A 78 LEU HBy H 1 1.880 . A 78 LEU HBx H 1 1.732 . A 78 LEU HG H 1 1.792 . A 78 LEU HD11 H 1 0.940 . A 78 LEU HD12 H 1 0.940 . A 78 LEU HD13 H 1 0.940 . A 78 LEU HD21 H 1 0.990 . A 78 LEU HD22 H 1 0.990 . A 78 LEU HD23 H 1 0.990 . A 78 LEU CA C 13 58.051 . A 78 LEU CB C 13 41.967 . A 78 LEU CG C 13 27.017 . A 78 LEU CDx C 13 23.820 . A 78 LEU CDy C 13 24.968 . A 78 LEU N N 15 118.718 . A 79 LEU H H 1 7.865 . A 79 LEU HA H 1 4.165 . A 79 LEU HBy H 1 1.991 . A 79 LEU HBx H 1 1.729 . A 79 LEU HG H 1 1.758 . A 79 LEU HD11 H 1 0.996 . A 79 LEU HD12 H 1 0.996 . A 79 LEU HD13 H 1 0.996 . A 79 LEU HD21 H 1 0.966 . A 79 LEU HD22 H 1 0.966 . A 79 LEU HD23 H 1 0.966 . A 79 LEU CA C 13 58.225 . A 79 LEU CB C 13 42.070 . A 79 LEU CG C 13 27.149 . A 79 LEU CDy C 13 25.402 . A 79 LEU CDx C 13 24.218 . A 79 LEU N N 15 119.872 . A 80 ILE H H 1 8.328 . A 80 ILE HA H 1 3.671 . A 80 ILE HB H 1 2.096 . A 80 ILE HG12 H 1 1.871 . A 80 ILE HG13 H 1 1.639 . A 80 ILE HG21 H 1 0.959 . A 80 ILE HG22 H 1 0.959 . A 80 ILE HG23 H 1 0.959 . A 80 ILE HD1% H 1 0.895 . A 80 ILE CA C 13 65.324 . A 80 ILE CB C 13 37.573 . A 80 ILE CG1 C 13 27.118 . A 80 ILE CG2 C 13 17.744 . A 80 ILE CD1 C 13 13.598 . A 80 ILE N N 15 118.300 . A 81 GLN H H 1 8.043 . A 81 GLN HA H 1 4.026 . A 81 GLN HBy H 1 2.247 . A 81 GLN HBx H 1 2.224 . A 81 GLN HGy H 1 2.618 . A 81 GLN HGx H 1 2.462 . A 81 GLN HE2y H 1 7.535 . A 81 GLN HE2x H 1 6.874 . A 81 GLN CA C 13 58.899 . A 81 GLN CB C 13 28.672 . A 81 GLN CG C 13 34.339 . A 81 GLN N N 15 116.163 . A 81 GLN NE2 N 15 111.984 . A 82 GLN H H 1 7.830 . A 82 GLN HA H 1 4.222 . A 82 GLN HBy H 1 2.268 . A 82 GLN HBx H 1 2.149 . A 82 GLN HGy H 1 2.618 . A 82 GLN HGx H 1 2.514 . A 82 GLN HE2y H 1 7.371 . A 82 GLN HE2x H 1 6.853 . A 82 GLN CA C 13 57.872 . A 82 GLN CB C 13 29.076 . A 82 GLN CG C 13 34.338 . A 82 GLN N N 15 115.768 . A 82 GLN NE2 N 15 110.784 . A 83 ALA H H 1 8.115 . A 83 ALA HA H 1 4.197 . A 83 ALA HB% H 1 1.542 . A 83 ALA CA C 13 54.391 . A 83 ALA CB C 13 19.562 . A 83 ALA N N 15 121.423 . A 84 ILE H H 1 7.497 . A 84 ILE HA H 1 4.384 . A 84 ILE HB H 1 2.164 . A 84 ILE HG12 H 1 1.477 . A 84 ILE HG13 H 1 1.466 . A 84 ILE HG21 H 1 0.946 . A 84 ILE HG22 H 1 0.946 . A 84 ILE HG23 H 1 0.946 . A 84 ILE HD1% H 1 0.873 . A 84 ILE CA C 13 60.339 . A 84 ILE CB C 13 38.121 . A 84 ILE CG1 C 13 27.298 . A 84 ILE CG2 C 13 17.736 . A 84 ILE CD1 C 13 14.025 . A 84 ILE N N 15 108.151 . A 85 ASP H H 1 7.592 . A 85 ASP HA H 1 4.883 . A 85 ASP HBy H 1 2.947 . A 85 ASP HBx H 1 2.788 . A 85 ASP CA C 13 51.638 . A 85 ASP CB C 13 38.659 . A 85 ASP N N 15 123.307 . A 86 PRO HA H 1 4.219 . A 86 PRO HBy H 1 2.442 . A 86 PRO HBx H 1 2.414 . A 86 PRO HGy H 1 2.250 . A 86 PRO HGx H 1 2.107 . A 86 PRO HDy H 1 4.118 . A 86 PRO HDx H 1 4.060 . A 86 PRO CA C 13 65.261 . A 86 PRO CB C 13 32.542 . A 86 PRO CG C 13 27.646 . A 86 PRO CD C 13 51.375 . A 87 LYS H H 1 8.686 . A 87 LYS HA H 1 4.173 . A 87 LYS HBy H 1 1.896 . A 87 LYS HBx H 1 1.816 . A 87 LYS HGy H 1 1.495 . A 87 LYS HGx H 1 1.279 . A 87 LYS HDy H 1 1.775 . A 87 LYS HDx H 1 1.473 . A 87 LYS HEx H 1 3.153 . A 87 LYS HEy H 1 3.155 . A 87 LYS CA C 13 59.168 . A 87 LYS CB C 13 31.810 . A 87 LYS CG C 13 25.232 . A 87 LYS CD C 13 28.459 . A 87 LYS CE C 13 43.038 . A 87 LYS N N 15 118.155 . A 88 ASN H H 1 8.035 . A 88 ASN HA H 1 4.736 . A 88 ASN HBy H 1 3.002 . A 88 ASN HBx H 1 2.795 . A 88 ASN HD2x H 1 7.248 . A 88 ASN HD2y H 1 8.317 . A 88 ASN CA C 13 55.065 . A 88 ASN CB C 13 38.647 . A 88 ASN N N 15 117.415 . A 88 ASN ND2 N 15 115.017 . A 89 LEU H H 1 7.982 . A 89 LEU HA H 1 4.064 . A 89 LEU HBy H 1 1.644 . A 89 LEU HBx H 1 1.269 . A 89 LEU HG H 1 1.636 . A 89 LEU HD11 H 1 0.759 . A 89 LEU HD12 H 1 0.759 . A 89 LEU HD13 H 1 0.759 . A 89 LEU HD21 H 1 0.764 . A 89 LEU HD22 H 1 0.764 . A 89 LEU HD23 H 1 0.764 . A 89 LEU CA C 13 58.291 . A 89 LEU CB C 13 41.524 . A 89 LEU CG C 13 26.814 . A 89 LEU CDy C 13 25.119 . A 89 LEU CDx C 13 23.875 . A 89 LEU N N 15 120.823 . A 90 SER H H 1 8.079 . A 90 SER HA H 1 4.238 . A 90 SER HBy H 1 4.092 . A 90 SER HBx H 1 4.035 . A 90 SER CA C 13 61.422 . A 90 SER CB C 13 63.273 . A 90 SER N N 15 111.730 . A 91 ARG H H 1 7.331 . A 91 ARG HA H 1 4.221 . A 91 ARG HBx H 1 1.986 . A 91 ARG HBy H 1 2.018 . A 91 ARG HGy H 1 1.835 . A 91 ARG HGx H 1 1.684 . A 91 ARG HDx H 1 3.326 . A 91 ARG CA C 13 57.845 . A 91 ARG CB C 13 30.423 . A 91 ARG CG C 13 27.569 . A 91 ARG CD C 13 43.596 . A 91 ARG N N 15 119.139 . A 92 LEU H H 1 7.488 . A 92 LEU HA H 1 4.107 . A 92 LEU HBy H 1 1.558 . A 92 LEU HBx H 1 1.133 . A 92 LEU HG H 1 1.529 . A 92 LEU HD11 H 1 0.881 . A 92 LEU HD12 H 1 0.881 . A 92 LEU HD13 H 1 0.881 . A 92 LEU HD21 H 1 0.817 . A 92 LEU HD22 H 1 0.817 . A 92 LEU HD23 H 1 0.817 . A 92 LEU CA C 13 56.487 . A 92 LEU CB C 13 43.313 . A 92 LEU CG C 13 27.022 . A 92 LEU CDy C 13 25.277 . A 92 LEU CDx C 13 23.943 . A 92 LEU N N 15 118.148 . A 93 PHE H H 1 7.948 . A 93 PHE HA H 1 5.120 . A 93 PHE HBy H 1 3.148 . A 93 PHE HBx H 1 2.957 . A 93 PHE HDx H 1 7.245 . A 93 PHE HEx H 1 7.226 . A 93 PHE CA C 13 54.366 . A 93 PHE CB C 13 39.482 . A 93 PHE CDx C 13 132.119 . A 93 PHE CEx C 13 130.631 . A 93 PHE N N 15 114.869 . A 94 PRO HA H 1 4.639 . A 94 PRO HBy H 1 2.446 . A 94 PRO HBx H 1 1.921 . A 94 PRO HGx H 1 2.102 . A 94 PRO HDy H 1 3.724 . A 94 PRO HDx H 1 3.556 . A 94 PRO CA C 13 64.870 . A 94 PRO CB C 13 31.676 . A 94 PRO CG C 13 27.280 . A 94 PRO CD C 13 50.146 . A 95 GLY H H 1 8.708 . A 95 GLY HAy H 1 4.178 . A 95 GLY HAx H 1 3.892 . A 95 GLY CA C 13 45.647 . A 95 GLY N N 15 108.108 . A 96 TRP H H 1 7.913 . A 96 TRP HA H 1 4.084 . A 96 TRP HBx H 1 3.254 . A 96 TRP HBy H 1 3.344 . A 96 TRP HD1 H 1 7.571 . A 96 TRP HE1 H 1 10.330 . A 96 TRP HE3 H 1 7.633 . A 96 TRP HZ2 H 1 7.438 . A 96 TRP HZ3 H 1 6.942 . A 96 TRP HH2 H 1 7.120 . A 96 TRP CA C 13 59.150 . A 96 TRP CB C 13 30.338 . A 96 TRP CD1 C 13 127.166 . A 96 TRP CE3 C 13 120.072 . A 96 TRP CZ2 C 13 114.353 . A 96 TRP CZ3 C 13 121.457 . A 96 TRP CH2 C 13 123.943 . A 96 TRP N N 15 121.349 . A 96 TRP NE1 N 15 129.668 . A 97 LYS H H 1 7.458 . A 97 LYS HA H 1 3.716 . A 97 LYS HBy H 1 1.473 . A 97 LYS HBx H 1 1.281 . A 97 LYS HGy H 1 0.708 . A 97 LYS HGx H 1 0.676 . A 97 LYS HDx H 1 1.453 . A 97 LYS HEx H 1 2.868 . A 97 LYS CA C 13 58.023 . A 97 LYS CB C 13 31.949 . A 97 LYS CG C 13 24.424 . A 97 LYS CD C 13 29.069 . A 97 LYS CE C 13 42.129 . A 97 LYS N N 15 120.127 . A 98 ALA H H 1 7.672 . A 98 ALA HA H 1 4.205 . A 98 ALA HB% H 1 1.315 . A 98 ALA CA C 13 52.747 . A 98 ALA CB C 13 18.940 . A 98 ALA N N 15 119.951 . A 99 TRP H H 1 7.991 . A 99 TRP HA H 1 4.577 . A 99 TRP HBy H 1 3.511 . A 99 TRP HBx H 1 3.349 . A 99 TRP HD1 H 1 7.321 . A 99 TRP HE1 H 1 10.563 . A 99 TRP HE3 H 1 7.031 . A 99 TRP HZ2 H 1 7.522 . A 99 TRP HZ3 H 1 6.652 . A 99 TRP HH2 H 1 7.120 . A 99 TRP CA C 13 57.941 . A 99 TRP CB C 13 30.304 . A 99 TRP CD1 C 13 126.525 . A 99 TRP CE3 C 13 118.108 . A 99 TRP CZ2 C 13 114.583 . A 99 TRP CZ3 C 13 120.667 . A 99 TRP CH2 C 13 123.943 . A 99 TRP N N 15 118.740 . A 99 TRP NE1 N 15 129.906 . A 100 VAL H H 1 7.276 . A 100 VAL HA H 1 4.238 . A 100 VAL HB H 1 2.278 . A 100 VAL HG11 H 1 1.074 . A 100 VAL HG12 H 1 1.074 . A 100 VAL HG13 H 1 1.074 . A 100 VAL HG21 H 1 1.046 . A 100 VAL HG22 H 1 1.046 . A 100 VAL HG23 H 1 1.046 . A 100 VAL CA C 13 62.663 . A 100 VAL CB C 13 33.449 . A 100 VAL CGy C 13 22.059 . A 100 VAL CGx C 13 20.417 . A 100 VAL N N 15 118.285 . 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 68 THR H A 67 LYS HBy 1.0 1.8 4.5 2 2 A 68 THR H A 67 LYS HDx 1.0 1.8 4.5 3 2 A 68 THR H A 67 LYS HDy 1.0 1.8 4.5 4 3 A 68 THR H A 67 LYS HGx 1.0 1.8 4.5 5 3 A 68 THR H A 67 LYS HGy 1.0 1.8 4.5 6 4 A 68 THR H A 68 THR HB 1.0 1.8 2.8 7 5 A 68 THR H A 68 THR HG2% 1.0 1.8 4.5 8 6 A 68 THR HG2% A 69 VAL H 1.0 1.8 2.8 9 7 A 69 VAL H A 69 VAL HA 1.0 1.8 2.8 10 8 A 69 VAL H A 69 VAL HB 1.0 1.8 4.5 11 9 A 69 VAL H A 69 VAL HG21 1.0 1.8 2.8 12 9 A 69 VAL H A 69 VAL HG11 1.0 1.8 2.8 13 10 A 68 THR HG2% A 70 LEU H 1.0 1.8 4.5 14 11 A 69 VAL HA A 70 LEU H 1.0 1.8 3.5 15 12 A 69 VAL HB A 70 LEU H 1.0 1.8 4.5 16 13 A 70 LEU H A 70 LEU HA 1.0 1.8 2.8 17 14 A 70 LEU H A 70 LEU HBy 1.0 1.8 3.5 18 14 A 70 LEU H A 70 LEU HBx 1.0 1.8 3.5 19 15 A 70 LEU H A 70 LEU HD21 1.0 1.8 2.8 20 16 A 70 LEU H A 70 LEU HG 1.0 1.8 2.8 21 17 A 68 THR HG2% A 71 SER H 1.0 1.8 4.5 22 18 A 69 VAL HA A 71 SER H 1.0 1.8 4.5 23 19 A 69 VAL HB A 71 SER H 1.0 1.8 5.5 24 20 A 69 VAL H A 71 SER H 1.0 1.8 3.5 25 21 A 70 LEU HA A 71 SER H 1.0 1.8 3.5 26 22 A 71 SER H A 70 LEU HBy 1.0 1.8 3.5 27 22 A 70 LEU HBx A 71 SER H 1.0 1.8 3.5 28 23 A 71 SER H A 70 LEU HD21 1.0 1.8 5.5 29 24 A 70 LEU HG A 71 SER H 1.0 1.8 5.5 30 25 A 71 SER H A 71 SER HA 1.0 1.8 2.8 31 26 A 71 SER H A 71 SER HBy 1.0 1.8 3.5 32 26 A 71 SER H A 71 SER HBx 1.0 1.8 3.5 33 27 A 71 SER H A 71 SER HBy 1.0 1.8 3.5 34 27 A 71 SER H A 71 SER HBx 1.0 1.8 3.5 35 28 A 71 SER H A 72 VAL HG11 1.0 1.8 4.5 36 29 A 71 SER HA A 72 VAL H 1.0 1.8 2.8 37 30 A 72 VAL H A 71 SER HBy 1.0 1.8 4.5 38 30 A 71 SER HBx A 72 VAL H 1.0 1.8 4.5 39 31 A 71 SER H A 72 VAL H 1.0 1.8 5.5 40 32 A 71 SER H A 72 VAL H 1.0 1.8 4.5 41 33 A 72 VAL H A 72 VAL HA 1.0 1.8 3.5 42 34 A 72 VAL H A 72 VAL HB 1.0 1.8 4.5 43 35 A 72 VAL HG11 A 72 VAL H 1.0 1.8 4.5 44 36 A 72 VAL H A 72 VAL HG21 1.0 1.8 3.5 45 37 A 73 GLY H A 71 SER HBy 1.0 1.8 4.5 46 37 A 71 SER HBx A 73 GLY H 1.0 1.8 4.5 47 38 A 72 VAL HB A 73 GLY H 1.0 1.8 4.5 48 39 A 72 VAL HG11 A 73 GLY H 1.0 1.8 4.5 49 40 A 72 VAL HG21 A 73 GLY H 1.0 1.8 4.5 50 41 A 72 VAL H A 73 GLY H 1.0 1.8 3.5 51 42 A 72 VAL H A 73 GLY H 1.0 1.8 3.5 52 43 A 73 GLY H A 73 GLY HAx 1.0 1.8 3.5 53 43 A 73 GLY H A 73 GLY HAy 1.0 1.8 3.5 54 44 A 72 VAL HB A 74 GLY H 1.0 1.8 5.5 55 45 A 72 VAL HG21 A 74 GLY H 1.0 1.8 4.5 56 46 A 73 GLY H A 74 GLY H 1.0 1.8 3.5 57 47 A 73 GLY H A 74 GLY H 1.0 1.8 4.5 58 48 A 74 GLY H A 74 GLY HAx 1.0 1.8 2.8 59 48 A 74 GLY H A 74 GLY HAy 1.0 1.8 2.8 60 49 A 74 GLY H A 74 GLY HAx 1.0 1.8 3.5 61 49 A 74 GLY H A 74 GLY HAy 1.0 1.8 3.5 62 50 A 74 GLY HAx A 75 GLN HE2y 1.0 1.8 4.5 63 50 A 74 GLY HAy A 75 GLN HE2y 1.0 1.8 4.5 64 50 A 75 GLN HE2x A 74 GLY HAx 1.0 1.8 4.5 65 50 A 74 GLY HAy A 75 GLN HE2x 1.0 1.8 4.5 66 51 A 75 GLN H A 74 GLY HAx 1.0 1.8 2.8 67 51 A 74 GLY HAy A 75 GLN H 1.0 1.8 2.8 68 52 A 74 GLY H A 75 GLN H 1.0 1.8 2.8 69 53 A 74 GLY H A 75 GLN H 1.0 1.8 3.5 70 54 A 75 GLN HBx A 75 GLN HE2y 1.0 1.8 4.5 71 54 A 75 GLN HBy A 75 GLN HE2y 1.0 1.8 4.5 72 54 A 75 GLN HE2x A 75 GLN HBy 1.0 1.8 4.5 73 54 A 75 GLN HE2x A 75 GLN HBx 1.0 1.8 4.5 74 55 A 75 GLN HE2x A 75 GLN HGy 1.0 1.8 3.5 75 55 A 75 GLN HE2y A 75 GLN HGy 1.0 1.8 3.5 76 55 A 75 GLN HGx A 75 GLN HE2y 1.0 1.8 3.5 77 55 A 75 GLN HE2x A 75 GLN HGx 1.0 1.8 3.5 78 56 A 75 GLN HE2x A 75 GLN HGy 1.0 1.8 3.5 79 56 A 75 GLN HE2y A 75 GLN HGy 1.0 1.8 3.5 80 56 A 75 GLN HGx A 75 GLN HE2y 1.0 1.8 3.5 81 56 A 75 GLN HE2x A 75 GLN HGx 1.0 1.8 3.5 82 57 A 75 GLN H A 75 GLN HA 1.0 1.8 2.8 83 58 A 75 GLN H A 75 GLN HBy 1.0 1.8 2.8 84 58 A 75 GLN H A 75 GLN HBx 1.0 1.8 2.8 85 59 A 75 GLN H A 75 GLN HGy 1.0 1.8 3.5 86 59 A 75 GLN H A 75 GLN HGx 1.0 1.8 3.5 87 60 A 76 VAL H A 73 GLY HAx 1.0 1.8 5.5 88 60 A 73 GLY HAy A 76 VAL H 1.0 1.8 5.5 89 61 A 75 GLN HA A 76 VAL H 1.0 1.8 4.5 90 62 A 76 VAL H A 75 GLN HGy 1.0 1.8 5.5 91 62 A 75 GLN HGx A 76 VAL H 1.0 1.8 5.5 92 63 A 75 GLN H A 76 VAL H 1.0 1.8 2.8 93 64 A 76 VAL HA A 76 VAL H 1.0 1.8 3.5 94 65 A 76 VAL HB A 76 VAL H 1.0 1.8 3.5 95 66 A 76 VAL HG11 A 76 VAL H 1.0 1.8 4.5 96 67 A 76 VAL H A 76 VAL HG21 1.0 1.8 3.5 97 68 A 76 VAL HB A 77 ASN H 1.0 1.8 3.5 98 69 A 77 ASN H A 76 VAL HG21 1.0 1.8 4.5 99 69 A 76 VAL HG11 A 77 ASN H 1.0 1.8 4.5 100 70 A 76 VAL H A 77 ASN H 1.0 1.8 2.8 101 71 A 76 VAL H A 77 ASN H 1.0 1.8 3.5 102 72 A 77 ASN HA A 77 ASN HD2y 1.0 1.8 4.5 103 72 A 77 ASN HD2x A 77 ASN HA 1.0 1.8 4.5 104 73 A 77 ASN HBx A 77 ASN HD2y 1.0 1.8 3.5 105 73 A 77 ASN HBy A 77 ASN HD2y 1.0 1.8 3.5 106 73 A 77 ASN HD2x A 77 ASN HBy 1.0 1.8 3.5 107 73 A 77 ASN HD2x A 77 ASN HBx 1.0 1.8 3.5 108 74 A 77 ASN HA A 77 ASN HD2y 1.0 1.8 5.5 109 74 A 77 ASN HD2x A 77 ASN HA 1.0 1.8 5.5 110 75 A 77 ASN HBx A 77 ASN HD2y 1.0 1.8 3.5 111 75 A 77 ASN HBy A 77 ASN HD2y 1.0 1.8 3.5 112 75 A 77 ASN HD2x A 77 ASN HBy 1.0 1.8 3.5 113 75 A 77 ASN HD2x A 77 ASN HBx 1.0 1.8 3.5 114 76 A 77 ASN HA A 77 ASN H 1.0 1.8 2.8 115 77 A 77 ASN HBx A 77 ASN H 1.0 1.8 2.8 116 77 A 77 ASN H A 77 ASN HBy 1.0 1.8 2.8 117 78 A 77 ASN HD2x A 77 ASN H 1.0 1.8 5.5 118 78 A 77 ASN H A 77 ASN HD2y 1.0 1.8 5.5 119 79 A 77 ASN HD2x A 77 ASN H 1.0 1.8 5.5 120 79 A 77 ASN H A 77 ASN HD2y 1.0 1.8 5.5 121 80 A 78 LEU H A 74 GLY HAx 1.0 1.8 5.5 122 80 A 74 GLY HAy A 78 LEU H 1.0 1.8 5.5 123 81 A 75 GLN HA A 78 LEU H 1.0 1.8 4.5 124 82 A 78 LEU HA A 77 ASN H 1.0 1.8 5.5 125 83 A 77 ASN HA A 78 LEU H 1.0 1.8 4.5 126 84 A 78 LEU H A 77 ASN HBy 1.0 1.8 3.5 127 84 A 77 ASN HBx A 78 LEU H 1.0 1.8 3.5 128 85 A 77 ASN H A 78 LEU H 1.0 1.8 2.8 129 86 A 77 ASN H A 78 LEU H 1.0 1.8 3.5 130 87 A 78 LEU HA A 78 LEU H 1.0 1.8 3.5 131 88 A 78 LEU HBx A 78 LEU H 1.0 1.8 3.5 132 88 A 78 LEU H A 78 LEU HBy 1.0 1.8 3.5 133 89 A 78 LEU HBx A 78 LEU H 1.0 1.8 3.5 134 89 A 78 LEU H A 78 LEU HBy 1.0 1.8 3.5 135 90 A 78 LEU H A 78 LEU HD11 1.0 1.8 4.5 136 91 A 78 LEU HG A 78 LEU H 1.0 1.8 4.5 137 92 A 76 VAL HA A 79 LEU H 1.0 1.8 3.5 138 93 A 78 LEU HBx A 79 LEU H 1.0 1.8 4.5 139 93 A 79 LEU H A 78 LEU HBy 1.0 1.8 4.5 140 94 A 78 LEU H A 79 LEU H 1.0 1.8 3.5 141 95 A 78 LEU H A 79 LEU H 1.0 1.8 3.5 142 96 A 79 LEU HA A 79 LEU H 1.0 1.8 2.8 143 97 A 79 LEU HBx A 79 LEU H 1.0 1.8 2.8 144 97 A 79 LEU H A 79 LEU HBy 1.0 1.8 2.8 145 98 A 79 LEU HBx A 79 LEU H 1.0 1.8 2.8 146 98 A 79 LEU H A 79 LEU HBy 1.0 1.8 2.8 147 99 A 79 LEU HD21 A 79 LEU H 1.0 1.8 3.5 148 99 A 79 LEU H A 79 LEU HD11 1.0 1.8 3.5 149 100 A 80 ILE HG21 A 77 ASN HD2y 1.0 1.8 5.5 150 100 A 77 ASN HD2x A 80 ILE HG21 1.0 1.8 5.5 151 101 A 79 LEU H A 80 ILE H 1.0 1.8 3.5 152 102 A 79 LEU H A 80 ILE H 1.0 1.8 3.5 153 103 A 80 ILE HA A 80 ILE H 1.0 1.8 2.8 154 104 A 80 ILE HB A 80 ILE H 1.0 1.8 4.5 155 105 A 80 ILE HD1% A 80 ILE H 1.0 1.8 5.5 156 106 A 80 ILE HG13 A 80 ILE H 1.0 1.8 4.5 157 106 A 80 ILE H A 80 ILE HG12 1.0 1.8 4.5 158 107 A 80 ILE HG13 A 80 ILE H 1.0 1.8 4.5 159 107 A 80 ILE H A 80 ILE HG12 1.0 1.8 4.5 160 108 A 77 ASN HD2x A 81 GLN HGy 1.0 1.8 5.5 161 108 A 77 ASN HD2y A 81 GLN HGy 1.0 1.8 5.5 162 108 A 81 GLN HGx A 77 ASN HD2y 1.0 1.8 5.5 163 108 A 77 ASN HD2x A 81 GLN HGx 1.0 1.8 5.5 164 109 A 77 ASN HD2x A 81 GLN HGy 1.0 1.8 4.5 165 109 A 77 ASN HD2y A 81 GLN HGy 1.0 1.8 4.5 166 109 A 81 GLN HGx A 77 ASN HD2y 1.0 1.8 4.5 167 109 A 77 ASN HD2x A 81 GLN HGx 1.0 1.8 4.5 168 110 A 77 ASN HA A 81 GLN H 1.0 1.8 5.5 169 111 A 78 LEU HA A 81 GLN H 1.0 1.8 3.5 170 112 A 80 ILE HG21 A 81 GLN HE2y 1.0 1.8 4.5 171 112 A 80 ILE HG21 A 81 GLN HE2x 1.0 1.8 4.5 172 113 A 81 GLN HE2x A 80 ILE H 1.0 1.8 3.5 173 113 A 80 ILE H A 81 GLN HE2y 1.0 1.8 3.5 174 114 A 80 ILE HB A 81 GLN H 1.0 1.8 4.5 175 115 A 80 ILE HG21 A 81 GLN H 1.0 1.8 3.5 176 116 A 80 ILE H A 81 GLN H 1.0 1.8 3.5 177 117 A 80 ILE H A 81 GLN H 1.0 1.8 3.5 178 118 A 81 GLN HBx A 81 GLN HE2y 1.0 1.8 4.5 179 118 A 81 GLN HBy A 81 GLN HE2y 1.0 1.8 4.5 180 118 A 81 GLN HE2x A 81 GLN HBy 1.0 1.8 4.5 181 118 A 81 GLN HE2x A 81 GLN HBx 1.0 1.8 4.5 182 119 A 81 GLN HE2y A 81 GLN HGy 1.0 1.8 5.5 183 119 A 81 GLN HE2x A 81 GLN HGy 1.0 1.8 5.5 184 119 A 81 GLN HGx A 81 GLN HE2y 1.0 1.8 5.5 185 119 A 81 GLN HGx A 81 GLN HE2x 1.0 1.8 5.5 186 120 A 81 GLN HE2y A 81 GLN HGy 1.0 1.8 2.8 187 120 A 81 GLN HE2x A 81 GLN HGy 1.0 1.8 2.8 188 120 A 81 GLN HGx A 81 GLN HE2y 1.0 1.8 2.8 189 120 A 81 GLN HGx A 81 GLN HE2x 1.0 1.8 2.8 190 121 A 81 GLN HE2y A 81 GLN HGy 1.0 1.8 3.5 191 121 A 81 GLN HE2x A 81 GLN HGy 1.0 1.8 3.5 192 121 A 81 GLN HGx A 81 GLN HE2y 1.0 1.8 3.5 193 121 A 81 GLN HGx A 81 GLN HE2x 1.0 1.8 3.5 194 122 A 81 GLN HA A 81 GLN H 1.0 1.8 3.5 195 123 A 81 GLN HBx A 81 GLN H 1.0 1.8 2.8 196 123 A 81 GLN H A 81 GLN HBy 1.0 1.8 2.8 197 124 A 81 GLN HGx A 81 GLN H 1.0 1.8 4.5 198 124 A 81 GLN H A 81 GLN HGy 1.0 1.8 4.5 199 125 A 81 GLN HGx A 81 GLN H 1.0 1.8 3.5 200 125 A 81 GLN H A 81 GLN HGy 1.0 1.8 3.5 201 126 A 81 GLN HGx A 81 GLN H 1.0 1.8 4.5 202 126 A 81 GLN H A 81 GLN HGy 1.0 1.8 4.5 203 127 A 81 GLN HA A 82 GLN H 1.0 1.8 4.5 204 128 A 81 GLN H A 82 GLN H 1.0 1.8 3.5 205 129 A 81 GLN H A 82 GLN H 1.0 1.8 4.5 206 130 A 82 GLN HA A 82 GLN HE2y 1.0 1.8 4.5 207 130 A 82 GLN HE2x A 82 GLN HA 1.0 1.8 4.5 208 131 A 82 GLN HBx A 82 GLN HE2y 1.0 1.8 4.5 209 131 A 82 GLN HE2x A 82 GLN HBy 1.0 1.8 4.5 210 131 A 82 GLN HE2x A 82 GLN HBx 1.0 1.8 4.5 211 131 A 82 GLN HBy A 82 GLN HE2y 1.0 1.8 4.5 212 132 A 82 GLN HE2x A 82 GLN HGy 1.0 1.8 3.5 213 132 A 82 GLN HE2y A 82 GLN HGy 1.0 1.8 3.5 214 132 A 82 GLN HGx A 82 GLN HE2y 1.0 1.8 3.5 215 132 A 82 GLN HE2x A 82 GLN HGx 1.0 1.8 3.5 216 133 A 82 GLN HE2y A 82 GLN HGy 1.0 1.8 4.5 217 133 A 82 GLN HGx A 82 GLN HE2y 1.0 1.8 4.5 218 133 A 82 GLN HE2x A 82 GLN HGx 1.0 1.8 4.5 219 133 A 82 GLN HE2x A 82 GLN HGy 1.0 1.8 4.5 220 134 A 82 GLN HA A 82 GLN H 1.0 1.8 3.5 221 135 A 82 GLN HBx A 82 GLN H 1.0 1.8 2.8 222 135 A 82 GLN H A 82 GLN HBy 1.0 1.8 2.8 223 136 A 82 GLN HBx A 82 GLN H 1.0 1.8 3.5 224 136 A 82 GLN H A 82 GLN HBy 1.0 1.8 3.5 225 137 A 82 GLN HGx A 82 GLN H 1.0 1.8 3.5 226 137 A 82 GLN H A 82 GLN HGy 1.0 1.8 3.5 227 138 A 82 GLN HGx A 82 GLN H 1.0 1.8 3.5 228 138 A 82 GLN H A 82 GLN HGy 1.0 1.8 3.5 229 139 A 80 ILE HA A 83 ALA H 1.0 1.8 4.5 230 140 A 83 ALA HB% A 82 GLN HE2y 1.0 1.8 4.5 231 140 A 82 GLN HE2x A 83 ALA HB% 1.0 1.8 4.5 232 141 A 83 ALA HB% A 82 GLN HE2y 1.0 1.8 4.5 233 141 A 82 GLN HE2x A 83 ALA HB% 1.0 1.8 4.5 234 142 A 83 ALA HB% A 82 GLN H 1.0 1.8 4.5 235 143 A 83 ALA H A 82 GLN HBy 1.0 1.8 3.5 236 143 A 82 GLN HBx A 83 ALA H 1.0 1.8 3.5 237 144 A 83 ALA H A 82 GLN HBy 1.0 1.8 4.5 238 144 A 82 GLN HBx A 83 ALA H 1.0 1.8 4.5 239 145 A 83 ALA H A 82 GLN HGy 1.0 1.8 5.5 240 145 A 82 GLN HGx A 83 ALA H 1.0 1.8 5.5 241 146 A 82 GLN H A 83 ALA H 1.0 1.8 2.8 242 147 A 82 GLN H A 83 ALA H 1.0 1.8 2.8 243 148 A 83 ALA HA A 83 ALA H 1.0 1.8 2.8 244 149 A 83 ALA HB% A 83 ALA H 1.0 1.8 2.8 245 150 A 84 ILE HG13 A 81 GLN H 1.0 1.8 4.5 246 150 A 81 GLN H A 84 ILE HG12 1.0 1.8 4.5 247 151 A 83 ALA HA A 84 ILE H 1.0 1.8 4.5 248 152 A 84 ILE H A 83 ALA H 1.0 1.8 3.5 249 153 A 84 ILE H A 83 ALA H 1.0 1.8 3.5 250 154 A 84 ILE H A 84 ILE HA 1.0 1.8 4.5 251 155 A 84 ILE H A 84 ILE HB 1.0 1.8 4.5 252 156 A 84 ILE H A 84 ILE HG12 1.0 1.8 3.5 253 156 A 84 ILE HG13 A 84 ILE H 1.0 1.8 3.5 254 157 A 84 ILE HA A 85 ASP H 1.0 1.8 3.5 255 158 A 85 ASP H A 84 ILE HG21 1.0 1.8 5.5 256 159 A 84 ILE H A 85 ASP H 1.0 1.8 3.5 257 160 A 84 ILE H A 85 ASP H 1.0 1.8 4.5 258 161 A 85 ASP H A 85 ASP HA 1.0 1.8 4.5 259 162 A 85 ASP H A 85 ASP HBy 1.0 1.8 3.5 260 162 A 85 ASP H A 85 ASP HBx 1.0 1.8 3.5 261 163 A 85 ASP H A 85 ASP HBy 1.0 1.8 3.5 262 163 A 85 ASP H A 85 ASP HBx 1.0 1.8 3.5 263 164 A 87 LYS H A 86 PRO HBy 1.0 1.8 4.5 264 164 A 87 LYS H A 86 PRO HBx 1.0 1.8 4.5 265 165 A 87 LYS H A 86 PRO HDy 1.0 1.8 4.5 266 165 A 87 LYS H A 86 PRO HDx 1.0 1.8 4.5 267 166 A 87 LYS H A 86 PRO HGy 1.0 1.8 4.5 268 166 A 87 LYS H A 86 PRO HGx 1.0 1.8 4.5 269 167 A 87 LYS H A 86 PRO HGy 1.0 1.8 4.5 270 167 A 87 LYS H A 86 PRO HGx 1.0 1.8 4.5 271 168 A 87 LYS H A 87 LYS HA 1.0 1.8 2.8 272 169 A 87 LYS H A 87 LYS HBy 1.0 1.8 2.8 273 169 A 87 LYS H A 87 LYS HBx 1.0 1.8 2.8 274 170 A 87 LYS H A 87 LYS HBy 1.0 1.8 2.8 275 170 A 87 LYS H A 87 LYS HBx 1.0 1.8 2.8 276 171 A 87 LYS H A 87 LYS HGy 1.0 1.8 3.5 277 171 A 87 LYS H A 87 LYS HGx 1.0 1.8 3.5 278 172 A 87 LYS H A 87 LYS HGy 1.0 1.8 5.5 279 172 A 87 LYS H A 87 LYS HGx 1.0 1.8 5.5 280 173 A 86 PRO HA A 88 ASN HD2y 1.0 1.8 5.5 281 173 A 88 ASN HD2x A 86 PRO HA 1.0 1.8 5.5 282 174 A 86 PRO HA A 88 ASN H 1.0 1.8 3.5 283 175 A 88 ASN H A 86 PRO HBy 1.0 1.8 5.5 284 175 A 86 PRO HBx A 88 ASN H 1.0 1.8 5.5 285 176 A 88 ASN H A 86 PRO HGy 1.0 1.8 5.5 286 176 A 86 PRO HGx A 88 ASN H 1.0 1.8 5.5 287 177 A 87 LYS HGy A 88 ASN HD2y 1.0 1.8 5.5 288 177 A 87 LYS HGx A 88 ASN HD2y 1.0 1.8 5.5 289 177 A 88 ASN HD2x A 87 LYS HGy 1.0 1.8 5.5 290 177 A 87 LYS HGx A 88 ASN HD2x 1.0 1.8 5.5 291 178 A 87 LYS H A 88 ASN HD2y 1.0 1.8 5.5 292 178 A 87 LYS H A 88 ASN HD2x 1.0 1.8 5.5 293 179 A 87 LYS HA A 88 ASN H 1.0 1.8 3.5 294 180 A 88 ASN H A 87 LYS HBy 1.0 1.8 4.5 295 180 A 87 LYS HBx A 88 ASN H 1.0 1.8 4.5 296 181 A 88 ASN H A 87 LYS HBy 1.0 1.8 4.5 297 181 A 87 LYS HBx A 88 ASN H 1.0 1.8 4.5 298 182 A 88 ASN H A 87 LYS HGy 1.0 1.8 4.5 299 182 A 87 LYS HGx A 88 ASN H 1.0 1.8 4.5 300 183 A 88 ASN H A 87 LYS HGy 1.0 1.8 4.5 301 183 A 87 LYS HGx A 88 ASN H 1.0 1.8 4.5 302 184 A 88 ASN H A 87 LYS HGy 1.0 1.8 5.5 303 184 A 87 LYS HGx A 88 ASN H 1.0 1.8 5.5 304 185 A 87 LYS H A 88 ASN H 1.0 1.8 2.8 305 186 A 87 LYS H A 88 ASN H 1.0 1.8 2.8 306 187 A 88 ASN HA A 88 ASN HD2y 1.0 1.8 5.5 307 187 A 88 ASN HD2x A 88 ASN HA 1.0 1.8 5.5 308 188 A 88 ASN HBy A 88 ASN HD2y 1.0 1.8 4.5 309 188 A 88 ASN HBx A 88 ASN HD2y 1.0 1.8 4.5 310 188 A 88 ASN HD2x A 88 ASN HBy 1.0 1.8 4.5 311 188 A 88 ASN HD2x A 88 ASN HBx 1.0 1.8 4.5 312 189 A 88 ASN HBy A 88 ASN HD2y 1.0 1.8 4.5 313 189 A 88 ASN HBx A 88 ASN HD2y 1.0 1.8 4.5 314 189 A 88 ASN HD2x A 88 ASN HBy 1.0 1.8 4.5 315 189 A 88 ASN HD2x A 88 ASN HBx 1.0 1.8 4.5 316 190 A 88 ASN HBy A 88 ASN HD2y 1.0 1.8 4.5 317 190 A 88 ASN HBx A 88 ASN HD2y 1.0 1.8 4.5 318 190 A 88 ASN HD2x A 88 ASN HBy 1.0 1.8 4.5 319 190 A 88 ASN HD2x A 88 ASN HBx 1.0 1.8 4.5 320 191 A 88 ASN HBy A 88 ASN HD2y 1.0 1.8 4.5 321 191 A 88 ASN HBx A 88 ASN HD2y 1.0 1.8 4.5 322 191 A 88 ASN HD2x A 88 ASN HBy 1.0 1.8 4.5 323 191 A 88 ASN HD2x A 88 ASN HBx 1.0 1.8 4.5 324 192 A 88 ASN H A 88 ASN HA 1.0 1.8 3.5 325 193 A 88 ASN H A 88 ASN HBy 1.0 1.8 3.5 326 193 A 88 ASN H A 88 ASN HBx 1.0 1.8 3.5 327 194 A 88 ASN H A 88 ASN HBy 1.0 1.8 3.5 328 194 A 88 ASN H A 88 ASN HBx 1.0 1.8 3.5 329 195 A 88 ASN H A 88 ASN HD2y 1.0 1.8 5.5 330 195 A 88 ASN HD2x A 88 ASN H 1.0 1.8 5.5 331 196 A 86 PRO HA A 89 LEU H 1.0 1.8 3.5 332 197 A 89 LEU HA A 88 ASN HD2y 1.0 1.8 5.5 333 197 A 88 ASN HD2x A 89 LEU HA 1.0 1.8 5.5 334 198 A 88 ASN H A 89 LEU HBy 1.0 1.8 4.5 335 198 A 88 ASN H A 89 LEU HBx 1.0 1.8 4.5 336 199 A 88 ASN HA A 89 LEU H 1.0 1.8 4.5 337 200 A 89 LEU H A 88 ASN HBy 1.0 1.8 4.5 338 200 A 88 ASN HBx A 89 LEU H 1.0 1.8 4.5 339 201 A 89 LEU H A 88 ASN HBy 1.0 1.8 4.5 340 201 A 88 ASN HBx A 89 LEU H 1.0 1.8 4.5 341 202 A 89 LEU H A 89 LEU HA 1.0 1.8 3.5 342 203 A 89 LEU H A 89 LEU HBy 1.0 1.8 3.5 343 203 A 89 LEU H A 89 LEU HBx 1.0 1.8 3.5 344 204 A 89 LEU H A 89 LEU HD11 1.0 1.8 4.5 345 204 A 89 LEU H A 89 LEU HD21 1.0 1.8 4.5 346 205 A 89 LEU HBx A 90 SER H 1.0 1.8 4.5 347 205 A 90 SER H A 89 LEU HBy 1.0 1.8 4.5 348 206 A 90 SER H A 89 LEU HD11 1.0 1.8 4.5 349 206 A 89 LEU HD21 A 90 SER H 1.0 1.8 4.5 350 207 A 89 LEU H A 90 SER H 1.0 1.8 2.8 351 208 A 89 LEU H A 90 SER H 1.0 1.8 2.8 352 209 A 90 SER HA A 90 SER H 1.0 1.8 2.8 353 210 A 90 SER HBx A 90 SER H 1.0 1.8 2.8 354 210 A 90 SER H A 90 SER HBy 1.0 1.8 2.8 355 211 A 88 ASN HA A 91 ARG H 1.0 1.8 4.5 356 212 A 91 ARG H A 89 LEU HBy 1.0 1.8 5.5 357 212 A 89 LEU HBx A 91 ARG H 1.0 1.8 5.5 358 213 A 91 ARG H A 90 SER HBy 1.0 1.8 3.5 359 213 A 90 SER HBx A 91 ARG H 1.0 1.8 3.5 360 214 A 90 SER H A 91 ARG H 1.0 1.8 3.5 361 215 A 90 SER H A 91 ARG H 1.0 1.8 3.5 362 216 A 91 ARG HBy A 91 ARG H 1.0 1.8 2.8 363 216 A 91 ARG H A 91 ARG HBx 1.0 1.8 2.8 364 217 A 91 ARG HDy A 91 ARG H 1.0 1.8 4.5 365 217 A 91 ARG H A 91 ARG HDx 1.0 1.8 4.5 366 218 A 91 ARG HGx A 91 ARG H 1.0 1.8 5.5 367 218 A 91 ARG H A 91 ARG HGy 1.0 1.8 5.5 368 219 A 91 ARG HGx A 91 ARG H 1.0 1.8 4.5 369 219 A 91 ARG H A 91 ARG HGy 1.0 1.8 4.5 370 220 A 92 LEU H A 91 ARG HBx 1.0 1.8 3.5 371 220 A 91 ARG HBy A 92 LEU H 1.0 1.8 3.5 372 221 A 91 ARG H A 92 LEU H 1.0 1.8 3.5 373 222 A 91 ARG H A 92 LEU H 1.0 1.8 2.8 374 223 A 92 LEU HA A 92 LEU H 1.0 1.8 3.5 375 224 A 92 LEU HBx A 92 LEU H 1.0 1.8 3.5 376 224 A 92 LEU H A 92 LEU HBy 1.0 1.8 3.5 377 225 A 92 LEU HD21 A 92 LEU H 1.0 1.8 4.5 378 225 A 92 LEU H A 92 LEU HD11 1.0 1.8 4.5 379 226 A 92 LEU HG A 92 LEU H 1.0 1.8 2.8 380 227 A 93 PHE H A 91 ARG HBx 1.0 1.8 5.5 381 227 A 91 ARG HBy A 93 PHE H 1.0 1.8 5.5 382 228 A 93 PHE H A 91 ARG H 1.0 1.8 4.5 383 229 A 93 PHE H A 91 ARG H 1.0 1.8 5.5 384 230 A 93 PHE HD% A 92 LEU H 1.0 1.8 5.5 385 231 A 92 LEU HA A 93 PHE H 1.0 1.8 3.5 386 232 A 93 PHE H A 92 LEU HBy 1.0 1.8 3.5 387 232 A 92 LEU HBx A 93 PHE H 1.0 1.8 3.5 388 233 A 92 LEU HG A 93 PHE H 1.0 1.8 4.5 389 234 A 93 PHE H A 92 LEU H 1.0 1.8 2.8 390 235 A 93 PHE H A 92 LEU H 1.0 1.8 2.8 391 236 A 93 PHE H A 93 PHE HA 1.0 1.8 4.5 392 237 A 93 PHE H A 93 PHE HBy 1.0 1.8 4.5 393 237 A 93 PHE H A 93 PHE HBx 1.0 1.8 4.5 394 238 A 93 PHE H A 93 PHE HBy 1.0 1.8 4.5 395 238 A 93 PHE H A 93 PHE HBx 1.0 1.8 4.5 396 239 A 93 PHE H A 93 PHE HD% 1.0 1.8 5.5 397 240 A 93 PHE HA A 95 GLY H 1.0 1.8 5.5 398 241 A 95 GLY H A 94 PRO HA 1.0 1.8 3.5 399 242 A 95 GLY H A 94 PRO HBy 1.0 1.8 5.5 400 242 A 95 GLY H A 94 PRO HBx 1.0 1.8 5.5 401 243 A 95 GLY H A 94 PRO HBy 1.0 1.8 4.5 402 243 A 95 GLY H A 94 PRO HBx 1.0 1.8 4.5 403 244 A 95 GLY H A 94 PRO HDy 1.0 1.8 5.5 404 244 A 95 GLY H A 94 PRO HDx 1.0 1.8 5.5 405 245 A 95 GLY H A 94 PRO HDy 1.0 1.8 5.5 406 245 A 95 GLY H A 94 PRO HDx 1.0 1.8 5.5 407 246 A 95 GLY H A 94 PRO HGx 1.0 1.8 4.5 408 246 A 95 GLY H A 94 PRO HGy 1.0 1.8 4.5 409 247 A 95 GLY H A 95 GLY HAy 1.0 1.8 2.8 410 247 A 95 GLY H A 95 GLY HAx 1.0 1.8 2.8 411 248 A 91 ARG HA A 96 TRP HE3 1.0 1.8 4.5 412 248 A 96 TRP HE1 A 91 ARG HA 1.0 1.8 4.5 413 249 A 91 ARG HA A 96 TRP H 1.0 1.8 4.5 414 250 A 93 PHE HA A 96 TRP H 1.0 1.8 5.5 415 251 A 96 TRP H A 93 PHE HBy 1.0 1.8 5.5 416 251 A 93 PHE HBx A 96 TRP H 1.0 1.8 5.5 417 252 A 94 PRO HA A 96 TRP H 1.0 1.8 4.5 418 253 A 96 TRP H A 95 GLY HAy 1.0 1.8 4.5 419 253 A 95 GLY HAx A 96 TRP H 1.0 1.8 4.5 420 254 A 95 GLY H A 96 TRP H 1.0 1.8 3.5 421 255 A 95 GLY H A 96 TRP H 1.0 1.8 3.5 422 256 A 96 TRP HA A 96 TRP HE3 1.0 1.8 4.5 423 256 A 96 TRP HE1 A 96 TRP HA 1.0 1.8 4.5 424 257 A 96 TRP HD1 A 96 TRP HE3 1.0 1.8 2.8 425 257 A 96 TRP HE1 A 96 TRP HD1 1.0 1.8 2.8 426 258 A 96 TRP H A 96 TRP HBx 1.0 1.8 3.5 427 258 A 96 TRP H A 96 TRP HBy 1.0 1.8 3.5 428 259 A 96 TRP H A 96 TRP HD1 1.0 1.8 2.8 429 260 A 96 TRP H A 96 TRP HE3 1.0 1.8 5.5 430 260 A 96 TRP HE1 A 96 TRP H 1.0 1.8 5.5 431 261 A 96 TRP H A 96 TRP HE3 1.0 1.8 5.5 432 261 A 96 TRP HE1 A 96 TRP H 1.0 1.8 5.5 433 262 A 96 TRP HZ2 A 96 TRP HE3 1.0 1.8 2.8 434 262 A 96 TRP HE1 A 96 TRP HZ2 1.0 1.8 2.8 435 263 A 95 GLY H A 97 LYS H 1.0 1.8 4.5 436 264 A 96 TRP HA A 97 LYS H 1.0 1.8 3.5 437 265 A 96 TRP HBy A 97 LYS H 1.0 1.8 4.5 438 265 A 97 LYS H A 96 TRP HBx 1.0 1.8 4.5 439 266 A 96 TRP HBy A 97 LYS H 1.0 1.8 4.5 440 266 A 97 LYS H A 96 TRP HBx 1.0 1.8 4.5 441 267 A 96 TRP H A 97 LYS H 1.0 1.8 3.5 442 268 A 96 TRP H A 97 LYS H 1.0 1.8 3.5 443 269 A 97 LYS HA A 97 LYS H 1.0 1.8 2.8 444 270 A 97 LYS HBx A 97 LYS H 1.0 1.8 2.8 445 270 A 97 LYS H A 97 LYS HBy 1.0 1.8 2.8 446 271 A 97 LYS HBx A 97 LYS H 1.0 1.8 2.8 447 271 A 97 LYS H A 97 LYS HBy 1.0 1.8 2.8 448 272 A 97 LYS HEy A 97 LYS H 1.0 1.8 5.5 449 272 A 97 LYS H A 97 LYS HEx 1.0 1.8 5.5 450 273 A 97 LYS HGx A 97 LYS H 1.0 1.8 2.8 451 273 A 97 LYS H A 97 LYS HGy 1.0 1.8 2.8 452 274 A 96 TRP HA A 98 ALA H 1.0 1.8 3.5 453 275 A 98 ALA H A 96 TRP HBx 1.0 1.8 4.5 454 275 A 96 TRP HBy A 98 ALA H 1.0 1.8 4.5 455 276 A 97 LYS HA A 98 ALA H 1.0 1.8 3.5 456 277 A 98 ALA H A 97 LYS HBy 1.0 1.8 3.5 457 277 A 97 LYS HBx A 98 ALA H 1.0 1.8 3.5 458 278 A 98 ALA H A 97 LYS HGy 1.0 1.8 4.5 459 278 A 97 LYS HGx A 98 ALA H 1.0 1.8 4.5 460 279 A 98 ALA H A 97 LYS H 1.0 1.8 2.8 461 280 A 98 ALA H A 97 LYS H 1.0 1.8 3.5 462 281 A 98 ALA H A 98 ALA HA 1.0 1.8 2.8 463 282 A 98 ALA H A 98 ALA HB% 1.0 1.8 2.8 464 283 A 96 TRP HA A 99 TRP HE3 1.0 1.8 3.5 465 283 A 96 TRP HA A 99 TRP HE1 1.0 1.8 3.5 466 284 A 96 TRP HA A 99 TRP H 1.0 1.8 4.5 467 285 A 97 LYS HA A 99 TRP H 1.0 1.8 4.5 468 286 A 98 ALA H A 99 TRP HA 1.0 1.8 4.5 469 287 A 98 ALA H A 99 TRP HD1 1.0 1.8 3.5 470 288 A 98 ALA HB% A 99 TRP HE3 1.0 1.8 3.5 471 288 A 98 ALA HB% A 99 TRP HE1 1.0 1.8 3.5 472 289 A 98 ALA H A 99 TRP HE3 1.0 1.8 4.5 473 289 A 98 ALA H A 99 TRP HE1 1.0 1.8 4.5 474 290 A 98 ALA HA A 99 TRP H 1.0 1.8 4.5 475 291 A 98 ALA HB% A 99 TRP H 1.0 1.8 2.8 476 292 A 98 ALA H A 99 TRP H 1.0 1.8 2.8 477 293 A 98 ALA H A 99 TRP H 1.0 1.8 2.8 478 294 A 99 TRP HA A 99 TRP HE3 1.0 1.8 4.5 479 294 A 99 TRP HE1 A 99 TRP HA 1.0 1.8 4.5 480 295 A 99 TRP HD1 A 99 TRP HE3 1.0 1.8 2.8 481 295 A 99 TRP HE1 A 99 TRP HD1 1.0 1.8 2.8 482 296 A 99 TRP H A 99 TRP HA 1.0 1.8 2.8 483 297 A 99 TRP H A 99 TRP HBy 1.0 1.8 2.8 484 297 A 99 TRP H A 99 TRP HBx 1.0 1.8 2.8 485 298 A 99 TRP H A 99 TRP HBy 1.0 1.8 2.8 486 298 A 99 TRP H A 99 TRP HBx 1.0 1.8 2.8 487 299 A 99 TRP H A 99 TRP HE3 1.0 1.8 5.5 488 299 A 99 TRP HE1 A 99 TRP H 1.0 1.8 5.5 489 300 A 99 TRP H A 99 TRP HE3 1.0 1.8 4.5 490 300 A 99 TRP HE1 A 99 TRP H 1.0 1.8 4.5 491 301 A 99 TRP HZ2 A 99 TRP HE3 1.0 1.8 2.8 492 301 A 99 TRP HE1 A 99 TRP HZ2 1.0 1.8 2.8 493 302 A 97 LYS HA A 100 VAL H 1.0 1.8 4.5 494 303 A 98 ALA HB% A 100 VAL H 1.0 1.8 4.5 495 304 A 98 ALA H A 100 VAL H 1.0 1.8 5.5 496 305 A 99 TRP H A 100 VAL HG21 1.0 1.8 4.5 497 305 A 99 TRP H A 100 VAL HG11 1.0 1.8 4.5 498 306 A 99 TRP HA A 100 VAL H 1.0 1.8 3.5 499 307 A 100 VAL H A 99 TRP HBy 1.0 1.8 3.5 500 307 A 99 TRP HBx A 100 VAL H 1.0 1.8 3.5 501 308 A 100 VAL H A 99 TRP HBy 1.0 1.8 3.5 502 308 A 99 TRP HBx A 100 VAL H 1.0 1.8 3.5 503 309 A 99 TRP H A 100 VAL H 1.0 1.8 2.8 504 310 A 99 TRP H A 100 VAL H 1.0 1.8 2.8 505 311 A 100 VAL H A 100 VAL HA 1.0 1.8 2.8 506 312 A 100 VAL H A 100 VAL HB 1.0 1.8 3.5 507 313 A 100 VAL H A 100 VAL HG21 1.0 1.8 2.8 508 313 A 100 VAL H A 100 VAL HG11 1.0 1.8 2.8 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 68 THR H A 68 THR HA 1.0 1.8 4.5 2 1 A 68 THR H A 67 LYS HA 1.0 1.8 4.5 3 2 A 68 THR HB A 69 VAL H 1.0 1.8 2.8 4 2 A 69 VAL H A 68 THR HA 1.0 1.8 2.8 5 3 A 73 GLY H A 73 GLY HAx 1.0 1.8 2.8 6 3 A 73 GLY H A 73 GLY HAy 1.0 1.8 2.8 7 3 A 72 VAL HA A 73 GLY H 1.0 1.8 2.8 8 4 A 74 GLY H A 76 VAL HG21 1.0 1.8 5.5 9 4 A 72 VAL HG21 A 74 GLY H 1.0 1.8 5.5 10 5 A 75 GLN H A 76 VAL HG21 1.0 1.8 5.5 11 5 A 72 VAL HG21 A 75 GLN H 1.0 1.8 5.5 12 6 A 77 ASN H A 74 GLY HAx 1.0 1.8 2.8 13 6 A 77 ASN H A 73 GLY HAx 1.0 1.8 2.8 14 6 A 73 GLY HAy A 77 ASN H 1.0 1.8 2.8 15 6 A 74 GLY HAy A 77 ASN H 1.0 1.8 2.8 16 7 A 80 ILE HD1% A 80 ILE H 1.0 1.8 2.8 17 7 A 80 ILE HG21 A 80 ILE H 1.0 1.8 2.8 18 8 A 80 ILE HA A 81 GLN H 1.0 1.8 5.5 19 8 A 76 VAL HA A 81 GLN H 1.0 1.8 5.5 20 9 A 80 ILE HG21 A 82 GLN H 1.0 1.8 4.5 21 9 A 84 ILE HG21 A 82 GLN H 1.0 1.8 4.5 22 10 A 80 ILE HG21 A 83 ALA H 1.0 1.8 5.5 23 10 A 84 ILE HG21 A 83 ALA H 1.0 1.8 5.5 24 11 A 84 ILE H A 84 ILE HG21 1.0 1.8 4.5 25 11 A 84 ILE H A 84 ILE HD1% 1.0 1.8 4.5 26 12 A 89 LEU H A 89 LEU HBy 1.0 1.8 2.8 27 12 A 89 LEU H A 89 LEU HG 1.0 1.8 2.8 28 12 A 89 LEU H A 89 LEU HBx 1.0 1.8 2.8 29 13 A 89 LEU HBx A 90 SER H 1.0 1.8 3.5 30 13 A 90 SER H A 89 LEU HBy 1.0 1.8 3.5 31 13 A 89 LEU HG A 90 SER H 1.0 1.8 3.5 32 14 A 90 SER HA A 91 ARG H 1.0 1.8 2.8 33 14 A 91 ARG HA A 91 ARG H 1.0 1.8 2.8 34 15 A 90 SER HA A 92 LEU H 1.0 1.8 4.5 35 15 A 91 ARG HA A 92 LEU H 1.0 1.8 4.5 36 16 A 93 PHE H A 91 ARG HA 1.0 1.8 4.5 37 16 A 90 SER HA A 93 PHE H 1.0 1.8 4.5 38 17 A 95 GLY H A 95 GLY HAy 1.0 1.8 3.5 39 17 A 95 GLY H A 95 GLY HAx 1.0 1.8 3.5 40 17 A 92 LEU HA A 95 GLY H 1.0 1.8 3.5 41 18 A 96 TRP H A 96 TRP HBx 1.0 1.8 2.8 42 18 A 96 TRP H A 93 PHE HBy 1.0 1.8 2.8 43 18 A 96 TRP H A 96 TRP HBy 1.0 1.8 2.8 44 18 A 93 PHE HBx A 96 TRP H 1.0 1.8 2.8 45 19 A 96 TRP H A 95 GLY HAy 1.0 1.8 2.8 46 19 A 96 TRP H A 96 TRP HA 1.0 1.8 2.8 47 19 A 95 GLY HAx A 96 TRP H 1.0 1.8 2.8 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 68 THR HG2% A 68 THR HA 1.0 1.8 2.8 2 2 A 68 THR HG2% A 68 THR HA 1.0 1.8 2.8 3 3 A 68 THR HB A 68 THR HG2% 1.0 1.8 2.8 4 4 A 68 THR HA A 69 VAL HG21 1.0 1.8 3.5 5 4 A 69 VAL HG11 A 68 THR HA 1.0 1.8 3.5 6 5 A 69 VAL HA A 69 VAL HB 1.0 1.8 3.5 7 6 A 69 VAL HA A 69 VAL HB 1.0 1.8 2.8 8 7 A 69 VAL HB A 69 VAL HG11 1.0 1.8 2.8 9 8 A 69 VAL HA A 69 VAL HG21 1.0 1.8 2.8 10 8 A 69 VAL HA A 69 VAL HG11 1.0 1.8 2.8 11 9 A 69 VAL HB A 69 VAL HG21 1.0 1.8 2.8 12 9 A 69 VAL HB A 69 VAL HG11 1.0 1.8 2.8 13 10 A 69 VAL HB A 69 VAL HG21 1.0 1.8 2.8 14 11 A 69 VAL H A 69 VAL HG11 1.0 1.8 2.8 15 12 A 70 LEU HA A 70 LEU HBy 1.0 1.8 3.5 16 12 A 70 LEU HA A 70 LEU HBx 1.0 1.8 3.5 17 13 A 70 LEU HA A 70 LEU HBy 1.0 1.8 3.5 18 13 A 70 LEU HA A 70 LEU HBx 1.0 1.8 3.5 19 14 A 70 LEU HBx A 70 LEU HD11 1.0 1.8 2.8 20 14 A 70 LEU HBy A 70 LEU HD11 1.0 1.8 2.8 21 15 A 70 LEU HA A 70 LEU HD21 1.0 1.8 2.8 22 16 A 70 LEU HBx A 70 LEU HD11 1.0 1.8 2.8 23 16 A 70 LEU HBy A 70 LEU HD11 1.0 1.8 2.8 24 16 A 70 LEU HD21 A 70 LEU HBy 1.0 1.8 2.8 25 16 A 70 LEU HBx A 70 LEU HD21 1.0 1.8 2.8 26 17 A 70 LEU HBx A 70 LEU HD11 1.0 1.8 2.8 27 17 A 70 LEU HBy A 70 LEU HD11 1.0 1.8 2.8 28 17 A 70 LEU HD21 A 70 LEU HBy 1.0 1.8 2.8 29 17 A 70 LEU HBx A 70 LEU HD21 1.0 1.8 2.8 30 18 A 70 LEU HD21 A 70 LEU HBy 1.0 1.8 2.8 31 18 A 70 LEU HBx A 70 LEU HD21 1.0 1.8 2.8 32 19 A 70 LEU HA A 70 LEU HG 1.0 1.8 3.5 33 20 A 70 LEU HG A 70 LEU HD11 1.0 1.8 2.8 34 20 A 70 LEU HG A 70 LEU HD21 1.0 1.8 2.8 35 21 A 70 LEU H A 70 LEU HBy 1.0 1.8 3.5 36 21 A 70 LEU H A 70 LEU HBx 1.0 1.8 3.5 37 22 A 70 LEU H A 70 LEU HD21 1.0 1.8 2.8 38 23 A 70 LEU H A 70 LEU HG 1.0 1.8 2.8 39 24 A 71 SER H A 70 LEU HBy 1.0 1.8 3.5 40 24 A 70 LEU HBx A 71 SER H 1.0 1.8 3.5 41 25 A 71 SER HA A 71 SER HBy 1.0 1.8 3.5 42 25 A 71 SER HA A 71 SER HBx 1.0 1.8 3.5 43 26 A 71 SER HA A 71 SER HBy 1.0 1.8 5.5 44 26 A 71 SER HA A 71 SER HBx 1.0 1.8 5.5 45 27 A 71 SER HA A 71 SER HBy 1.0 1.8 3.5 46 27 A 71 SER HA A 71 SER HBx 1.0 1.8 3.5 47 28 A 71 SER HA A 72 VAL HB 1.0 1.8 5.5 48 29 A 71 SER HA A 72 VAL HG11 1.0 1.8 3.5 49 30 A 71 SER HA A 72 VAL HG21 1.0 1.8 4.5 50 31 A 71 SER HA A 72 VAL HG21 1.0 1.8 3.5 51 32 A 71 SER HA A 72 VAL H 1.0 1.8 2.8 52 33 A 72 VAL HA A 72 VAL HB 1.0 1.8 3.5 53 34 A 72 VAL HA A 72 VAL HB 1.0 1.8 3.5 54 35 A 72 VAL HG11 A 72 VAL HA 1.0 1.8 2.8 55 36 A 72 VAL HG11 A 72 VAL HB 1.0 1.8 2.8 56 37 A 72 VAL HA A 72 VAL HG21 1.0 1.8 4.5 57 38 A 72 VAL HA A 72 VAL HG21 1.0 1.8 3.5 58 39 A 72 VAL HB A 72 VAL HG21 1.0 1.8 2.8 59 40 A 72 VAL HB A 72 VAL HG21 1.0 1.8 2.8 60 41 A 72 VAL H A 72 VAL HG21 1.0 1.8 2.8 61 42 A 72 VAL HA A 73 GLY H 1.0 1.8 4.5 62 43 A 73 GLY H A 73 GLY HAx 1.0 1.8 4.5 63 43 A 73 GLY H A 73 GLY HAy 1.0 1.8 4.5 64 44 A 74 GLY H A 74 GLY HAx 1.0 1.8 4.5 65 44 A 74 GLY H A 74 GLY HAy 1.0 1.8 4.5 66 45 A 72 VAL HA A 75 GLN HGy 1.0 1.8 5.5 67 45 A 72 VAL HA A 75 GLN HGx 1.0 1.8 5.5 68 46 A 72 VAL HA A 75 GLN H 1.0 1.8 5.5 69 47 A 75 GLN HA A 75 GLN HBy 1.0 1.8 5.5 70 47 A 75 GLN HBx A 75 GLN HA 1.0 1.8 5.5 71 48 A 75 GLN HA A 75 GLN HBy 1.0 1.8 3.5 72 48 A 75 GLN HBx A 75 GLN HA 1.0 1.8 3.5 73 49 A 75 GLN HA A 75 GLN HBy 1.0 1.8 5.5 74 49 A 75 GLN HBx A 75 GLN HA 1.0 1.8 5.5 75 50 A 75 GLN HA A 75 GLN HGy 1.0 1.8 2.8 76 50 A 75 GLN HGx A 75 GLN HA 1.0 1.8 2.8 77 51 A 75 GLN HBy A 75 GLN HGy 1.0 1.8 2.8 78 51 A 75 GLN HBx A 75 GLN HGy 1.0 1.8 2.8 79 51 A 75 GLN HGx A 75 GLN HBy 1.0 1.8 2.8 80 51 A 75 GLN HBx A 75 GLN HGx 1.0 1.8 2.8 81 52 A 75 GLN HA A 75 GLN HGy 1.0 1.8 4.5 82 52 A 75 GLN HGx A 75 GLN HA 1.0 1.8 4.5 83 53 A 75 GLN HA A 75 GLN HGy 1.0 1.8 4.5 84 53 A 75 GLN HGx A 75 GLN HA 1.0 1.8 4.5 85 54 A 75 GLN HBy A 75 GLN HGy 1.0 1.8 4.5 86 54 A 75 GLN HBx A 75 GLN HGy 1.0 1.8 4.5 87 54 A 75 GLN HGx A 75 GLN HBy 1.0 1.8 4.5 88 54 A 75 GLN HBx A 75 GLN HGx 1.0 1.8 4.5 89 55 A 75 GLN HBy A 75 GLN HGy 1.0 1.8 3.5 90 55 A 75 GLN HBx A 75 GLN HGy 1.0 1.8 3.5 91 55 A 75 GLN HGx A 75 GLN HBy 1.0 1.8 3.5 92 55 A 75 GLN HBx A 75 GLN HGx 1.0 1.8 3.5 93 56 A 75 GLN HBy A 75 GLN HGy 1.0 1.8 2.8 94 56 A 75 GLN HBx A 75 GLN HGy 1.0 1.8 2.8 95 56 A 75 GLN HGx A 75 GLN HBy 1.0 1.8 2.8 96 56 A 75 GLN HBx A 75 GLN HGx 1.0 1.8 2.8 97 57 A 75 GLN HE2x A 75 GLN HGy 1.0 1.8 5.5 98 57 A 75 GLN HE2y A 75 GLN HGy 1.0 1.8 5.5 99 57 A 75 GLN HGx A 75 GLN HE2y 1.0 1.8 5.5 100 57 A 75 GLN HE2x A 75 GLN HGx 1.0 1.8 5.5 101 58 A 75 GLN HE2x A 75 GLN HGy 1.0 1.8 5.5 102 58 A 75 GLN HE2y A 75 GLN HGy 1.0 1.8 5.5 103 58 A 75 GLN HGx A 75 GLN HE2y 1.0 1.8 5.5 104 58 A 75 GLN HE2x A 75 GLN HGx 1.0 1.8 5.5 105 59 A 75 GLN H A 75 GLN HA 1.0 1.8 4.5 106 60 A 75 GLN H A 75 GLN HGy 1.0 1.8 4.5 107 60 A 75 GLN H A 75 GLN HGx 1.0 1.8 4.5 108 61 A 75 GLN H A 75 GLN HGy 1.0 1.8 3.5 109 61 A 75 GLN H A 75 GLN HGx 1.0 1.8 3.5 110 62 A 75 GLN H A 76 VAL HG21 1.0 1.8 3.5 111 63 A 76 VAL HA A 76 VAL HB 1.0 1.8 5.5 112 64 A 76 VAL HA A 76 VAL HG11 1.0 1.8 3.5 113 65 A 76 VAL HB A 76 VAL HG11 1.0 1.8 3.5 114 66 A 76 VAL HA A 76 VAL HG21 1.0 1.8 3.5 115 67 A 76 VAL HA A 76 VAL HG21 1.0 1.8 2.8 116 68 A 76 VAL HB A 76 VAL HG21 1.0 1.8 3.5 117 69 A 76 VAL HB A 76 VAL HG21 1.0 1.8 2.8 118 70 A 76 VAL HA A 76 VAL H 1.0 1.8 5.5 119 71 A 76 VAL HB A 76 VAL H 1.0 1.8 4.5 120 72 A 76 VAL H A 76 VAL HG21 1.0 1.8 2.8 121 73 A 76 VAL HB A 77 ASN H 1.0 1.8 4.5 122 74 A 77 ASN HA A 77 ASN HBy 1.0 1.8 4.5 123 74 A 77 ASN HA A 77 ASN HBx 1.0 1.8 4.5 124 75 A 77 ASN HA A 77 ASN HBy 1.0 1.8 3.5 125 75 A 77 ASN HA A 77 ASN HBx 1.0 1.8 3.5 126 76 A 77 ASN HA A 77 ASN HBy 1.0 1.8 4.5 127 76 A 77 ASN HA A 77 ASN HBx 1.0 1.8 4.5 128 77 A 77 ASN HBx A 77 ASN HD2y 1.0 1.8 5.5 129 77 A 77 ASN HBy A 77 ASN HD2y 1.0 1.8 5.5 130 77 A 77 ASN HD2x A 77 ASN HBy 1.0 1.8 5.5 131 77 A 77 ASN HD2x A 77 ASN HBx 1.0 1.8 5.5 132 78 A 77 ASN HA A 77 ASN HD2y 1.0 1.8 3.5 133 78 A 77 ASN HD2x A 77 ASN HA 1.0 1.8 3.5 134 79 A 77 ASN HA A 77 ASN H 1.0 1.8 2.8 135 80 A 77 ASN HBx A 77 ASN H 1.0 1.8 3.5 136 80 A 77 ASN H A 77 ASN HBy 1.0 1.8 3.5 137 81 A 77 ASN HBx A 77 ASN H 1.0 1.8 3.5 138 81 A 77 ASN H A 77 ASN HBy 1.0 1.8 3.5 139 82 A 75 GLN HGx A 78 LEU HBy 1.0 1.8 5.5 140 82 A 75 GLN HGy A 78 LEU HBy 1.0 1.8 5.5 141 82 A 78 LEU HBx A 75 GLN HGy 1.0 1.8 5.5 142 82 A 75 GLN HGx A 78 LEU HBx 1.0 1.8 5.5 143 83 A 75 GLN HGx A 78 LEU HBy 1.0 1.8 5.5 144 83 A 75 GLN HGy A 78 LEU HBy 1.0 1.8 5.5 145 83 A 78 LEU HBx A 75 GLN HGy 1.0 1.8 5.5 146 83 A 75 GLN HGx A 78 LEU HBx 1.0 1.8 5.5 147 84 A 75 GLN HA A 78 LEU HD21 1.0 1.8 3.5 148 85 A 75 GLN HGx A 78 LEU HD21 1.0 1.8 3.5 149 85 A 78 LEU HD21 A 75 GLN HGy 1.0 1.8 3.5 150 86 A 75 GLN HGx A 78 LEU HD21 1.0 1.8 3.5 151 86 A 78 LEU HD21 A 75 GLN HGy 1.0 1.8 3.5 152 87 A 77 ASN HBx A 78 LEU H 1.0 1.8 5.5 153 87 A 78 LEU H A 77 ASN HBy 1.0 1.8 5.5 154 88 A 77 ASN HBx A 78 LEU H 1.0 1.8 4.5 155 88 A 78 LEU H A 77 ASN HBy 1.0 1.8 4.5 156 89 A 78 LEU HA A 78 LEU HBy 1.0 1.8 3.5 157 89 A 78 LEU HA A 78 LEU HBx 1.0 1.8 3.5 158 90 A 78 LEU HA A 78 LEU HBy 1.0 1.8 4.5 159 90 A 78 LEU HA A 78 LEU HBx 1.0 1.8 4.5 160 91 A 78 LEU HA A 78 LEU HBy 1.0 1.8 3.5 161 91 A 78 LEU HA A 78 LEU HBx 1.0 1.8 3.5 162 92 A 78 LEU HBx A 78 LEU HD11 1.0 1.8 2.8 163 92 A 78 LEU HBy A 78 LEU HD11 1.0 1.8 2.8 164 93 A 78 LEU HBx A 78 LEU HD11 1.0 1.8 2.8 165 93 A 78 LEU HBy A 78 LEU HD11 1.0 1.8 2.8 166 94 A 78 LEU HA A 78 LEU HD11 1.0 1.8 2.8 167 94 A 78 LEU HA A 78 LEU HD21 1.0 1.8 2.8 168 95 A 78 LEU HA A 78 LEU HD21 1.0 1.8 4.5 169 96 A 78 LEU HBx A 78 LEU HD11 1.0 1.8 3.5 170 96 A 78 LEU HBy A 78 LEU HD11 1.0 1.8 3.5 171 96 A 78 LEU HD21 A 78 LEU HBy 1.0 1.8 3.5 172 96 A 78 LEU HBx A 78 LEU HD21 1.0 1.8 3.5 173 97 A 78 LEU HD21 A 78 LEU HBy 1.0 1.8 3.5 174 97 A 78 LEU HBx A 78 LEU HD21 1.0 1.8 3.5 175 98 A 78 LEU HD21 A 78 LEU HBy 1.0 1.8 3.5 176 98 A 78 LEU HBx A 78 LEU HD21 1.0 1.8 3.5 177 99 A 78 LEU HA A 78 LEU HG 1.0 1.8 3.5 178 100 A 78 LEU HG A 78 LEU HD11 1.0 1.8 2.8 179 100 A 78 LEU HG A 78 LEU HD21 1.0 1.8 2.8 180 101 A 78 LEU HA A 78 LEU H 1.0 1.8 4.5 181 102 A 78 LEU HBx A 78 LEU H 1.0 1.8 5.5 182 102 A 78 LEU H A 78 LEU HBy 1.0 1.8 5.5 183 103 A 78 LEU HBx A 78 LEU H 1.0 1.8 4.5 184 103 A 78 LEU H A 78 LEU HBy 1.0 1.8 4.5 185 104 A 78 LEU HG A 78 LEU H 1.0 1.8 5.5 186 105 A 76 VAL HA A 79 LEU HBy 1.0 1.8 5.5 187 105 A 76 VAL HA A 79 LEU HBx 1.0 1.8 5.5 188 106 A 76 VAL HA A 79 LEU HBy 1.0 1.8 5.5 189 106 A 76 VAL HA A 79 LEU HBx 1.0 1.8 5.5 190 107 A 79 LEU HA A 79 LEU HBy 1.0 1.8 5.5 191 107 A 79 LEU HA A 79 LEU HBx 1.0 1.8 5.5 192 108 A 79 LEU HA A 79 LEU HD11 1.0 1.8 2.8 193 109 A 79 LEU HA A 79 LEU HD11 1.0 1.8 2.8 194 109 A 79 LEU HA A 79 LEU HD21 1.0 1.8 2.8 195 110 A 79 LEU HBy A 79 LEU HD11 1.0 1.8 3.5 196 110 A 79 LEU HBx A 79 LEU HD11 1.0 1.8 3.5 197 110 A 79 LEU HD21 A 79 LEU HBy 1.0 1.8 3.5 198 110 A 79 LEU HBx A 79 LEU HD21 1.0 1.8 3.5 199 111 A 79 LEU HA A 79 LEU H 1.0 1.8 4.5 200 112 A 79 LEU HA A 79 LEU H 1.0 1.8 4.5 201 113 A 79 LEU HBx A 79 LEU H 1.0 1.8 4.5 202 113 A 79 LEU H A 79 LEU HBy 1.0 1.8 4.5 203 114 A 79 LEU HBx A 79 LEU H 1.0 1.8 3.5 204 114 A 79 LEU H A 79 LEU HBy 1.0 1.8 3.5 205 115 A 77 ASN HA A 80 ILE HG21 1.0 1.8 5.5 206 116 A 80 ILE H A 79 LEU HBy 1.0 1.8 4.5 207 116 A 79 LEU HBx A 80 ILE H 1.0 1.8 4.5 208 117 A 80 ILE HA A 80 ILE HD1% 1.0 1.8 5.5 209 118 A 80 ILE HB A 80 ILE HD1% 1.0 1.8 4.5 210 119 A 80 ILE HB A 80 ILE HG12 1.0 1.8 5.5 211 119 A 80 ILE HB A 80 ILE HG13 1.0 1.8 5.5 212 120 A 80 ILE HG21 A 80 ILE HA 1.0 1.8 3.5 213 121 A 80 ILE HG21 A 80 ILE HA 1.0 1.8 3.5 214 122 A 80 ILE HG21 A 80 ILE HB 1.0 1.8 3.5 215 123 A 80 ILE HG21 A 80 ILE HB 1.0 1.8 2.8 216 124 A 80 ILE HG21 A 80 ILE HG12 1.0 1.8 5.5 217 124 A 80 ILE HG21 A 80 ILE HG13 1.0 1.8 5.5 218 125 A 80 ILE HG21 A 80 ILE HG12 1.0 1.8 3.5 219 125 A 80 ILE HG21 A 80 ILE HG13 1.0 1.8 3.5 220 126 A 80 ILE HA A 80 ILE H 1.0 1.8 5.5 221 127 A 80 ILE HB A 80 ILE H 1.0 1.8 4.5 222 128 A 80 ILE HD1% A 80 ILE H 1.0 1.8 5.5 223 129 A 80 ILE HG21 A 80 ILE H 1.0 1.8 3.5 224 130 A 80 ILE HD1% A 81 GLN HA 1.0 1.8 3.5 225 131 A 80 ILE HD1% A 81 GLN HGy 1.0 1.8 4.5 226 131 A 80 ILE HD1% A 81 GLN HGx 1.0 1.8 4.5 227 132 A 81 GLN HA A 81 GLN HBy 1.0 1.8 2.8 228 132 A 81 GLN HBx A 81 GLN HA 1.0 1.8 2.8 229 133 A 81 GLN HA A 81 GLN HBy 1.0 1.8 3.5 230 133 A 81 GLN HBx A 81 GLN HA 1.0 1.8 3.5 231 134 A 81 GLN HA A 81 GLN HE2y 1.0 1.8 4.5 232 134 A 81 GLN HE2x A 81 GLN HA 1.0 1.8 4.5 233 135 A 81 GLN HBx A 81 GLN HE2y 1.0 1.8 4.5 234 135 A 81 GLN HBy A 81 GLN HE2y 1.0 1.8 4.5 235 135 A 81 GLN HE2x A 81 GLN HBy 1.0 1.8 4.5 236 135 A 81 GLN HE2x A 81 GLN HBx 1.0 1.8 4.5 237 136 A 81 GLN HA A 81 GLN HGy 1.0 1.8 4.5 238 136 A 81 GLN HGx A 81 GLN HA 1.0 1.8 4.5 239 137 A 81 GLN HA A 81 GLN HGy 1.0 1.8 5.5 240 137 A 81 GLN HGx A 81 GLN HA 1.0 1.8 5.5 241 138 A 81 GLN HBy A 81 GLN HGy 1.0 1.8 5.5 242 138 A 81 GLN HBx A 81 GLN HGy 1.0 1.8 5.5 243 138 A 81 GLN HGx A 81 GLN HBy 1.0 1.8 5.5 244 138 A 81 GLN HGx A 81 GLN HBx 1.0 1.8 5.5 245 139 A 81 GLN HE2y A 81 GLN HGy 1.0 1.8 4.5 246 139 A 81 GLN HE2x A 81 GLN HGy 1.0 1.8 4.5 247 139 A 81 GLN HGx A 81 GLN HE2y 1.0 1.8 4.5 248 139 A 81 GLN HGx A 81 GLN HE2x 1.0 1.8 4.5 249 140 A 81 GLN HE2y A 81 GLN HGy 1.0 1.8 5.5 250 140 A 81 GLN HE2x A 81 GLN HGy 1.0 1.8 5.5 251 140 A 81 GLN HGx A 81 GLN HE2y 1.0 1.8 5.5 252 140 A 81 GLN HGx A 81 GLN HE2x 1.0 1.8 5.5 253 141 A 81 GLN HA A 81 GLN HGy 1.0 1.8 4.5 254 141 A 81 GLN HGx A 81 GLN HA 1.0 1.8 4.5 255 142 A 81 GLN HBy A 81 GLN HGy 1.0 1.8 2.8 256 142 A 81 GLN HBx A 81 GLN HGy 1.0 1.8 2.8 257 142 A 81 GLN HGx A 81 GLN HBy 1.0 1.8 2.8 258 142 A 81 GLN HGx A 81 GLN HBx 1.0 1.8 2.8 259 143 A 81 GLN HE2y A 81 GLN HGy 1.0 1.8 5.5 260 143 A 81 GLN HE2x A 81 GLN HGy 1.0 1.8 5.5 261 143 A 81 GLN HGx A 81 GLN HE2y 1.0 1.8 5.5 262 143 A 81 GLN HGx A 81 GLN HE2x 1.0 1.8 5.5 263 144 A 81 GLN HE2y A 81 GLN HGy 1.0 1.8 4.5 264 144 A 81 GLN HE2x A 81 GLN HGy 1.0 1.8 4.5 265 144 A 81 GLN HGx A 81 GLN HE2y 1.0 1.8 4.5 266 144 A 81 GLN HGx A 81 GLN HE2x 1.0 1.8 4.5 267 145 A 81 GLN HA A 81 GLN H 1.0 1.8 3.5 268 146 A 81 GLN HBx A 81 GLN H 1.0 1.8 5.5 269 146 A 81 GLN H A 81 GLN HBy 1.0 1.8 5.5 270 147 A 81 GLN HBx A 81 GLN H 1.0 1.8 4.5 271 147 A 81 GLN H A 81 GLN HBy 1.0 1.8 4.5 272 148 A 81 GLN HGx A 81 GLN H 1.0 1.8 4.5 273 148 A 81 GLN H A 81 GLN HGy 1.0 1.8 4.5 274 149 A 81 GLN HGx A 81 GLN H 1.0 1.8 4.5 275 149 A 81 GLN H A 81 GLN HGy 1.0 1.8 4.5 276 150 A 82 GLN H A 81 GLN HBy 1.0 1.8 5.5 277 150 A 81 GLN HBx A 82 GLN H 1.0 1.8 5.5 278 151 A 82 GLN HA A 82 GLN HBy 1.0 1.8 3.5 279 151 A 82 GLN HA A 82 GLN HBx 1.0 1.8 3.5 280 152 A 82 GLN HA A 82 GLN HBy 1.0 1.8 3.5 281 152 A 82 GLN HA A 82 GLN HBx 1.0 1.8 3.5 282 153 A 82 GLN HA A 82 GLN HGy 1.0 1.8 3.5 283 153 A 82 GLN HA A 82 GLN HGx 1.0 1.8 3.5 284 154 A 82 GLN HBx A 82 GLN HGy 1.0 1.8 2.8 285 154 A 82 GLN HBy A 82 GLN HGy 1.0 1.8 2.8 286 154 A 82 GLN HGx A 82 GLN HBy 1.0 1.8 2.8 287 154 A 82 GLN HBx A 82 GLN HGx 1.0 1.8 2.8 288 155 A 82 GLN HA A 82 GLN HGy 1.0 1.8 3.5 289 155 A 82 GLN HA A 82 GLN HGx 1.0 1.8 3.5 290 156 A 82 GLN HE2y A 82 GLN HGy 1.0 1.8 4.5 291 156 A 82 GLN HGx A 82 GLN HE2y 1.0 1.8 4.5 292 156 A 82 GLN HE2x A 82 GLN HGx 1.0 1.8 4.5 293 156 A 82 GLN HE2x A 82 GLN HGy 1.0 1.8 4.5 294 157 A 82 GLN HA A 82 GLN H 1.0 1.8 3.5 295 158 A 82 GLN HGx A 82 GLN H 1.0 1.8 4.5 296 158 A 82 GLN H A 82 GLN HGy 1.0 1.8 4.5 297 159 A 82 GLN HGx A 82 GLN H 1.0 1.8 4.5 298 159 A 82 GLN H A 82 GLN HGy 1.0 1.8 4.5 299 160 A 80 ILE HA A 83 ALA HB% 1.0 1.8 3.5 300 161 A 80 ILE HA A 83 ALA HB% 1.0 1.8 5.5 301 162 A 83 ALA HB% A 80 ILE H 1.0 1.8 5.5 302 163 A 83 ALA HA A 82 GLN HBy 1.0 1.8 5.5 303 163 A 82 GLN HBx A 83 ALA HA 1.0 1.8 5.5 304 164 A 83 ALA HA A 82 GLN HGy 1.0 1.8 5.5 305 164 A 82 GLN HGx A 83 ALA HA 1.0 1.8 5.5 306 165 A 83 ALA HB% A 82 GLN H 1.0 1.8 4.5 307 166 A 83 ALA HB% A 83 ALA HA 1.0 1.8 2.8 308 167 A 83 ALA HB% A 83 ALA HA 1.0 1.8 2.8 309 168 A 83 ALA HA A 83 ALA H 1.0 1.8 3.5 310 169 A 83 ALA HB% A 83 ALA H 1.0 1.8 2.8 311 170 A 81 GLN HA A 84 ILE HG12 1.0 1.8 3.5 312 170 A 81 GLN HA A 84 ILE HG13 1.0 1.8 3.5 313 171 A 83 ALA HB% A 84 ILE HB 1.0 1.8 5.5 314 172 A 83 ALA HA A 84 ILE H 1.0 1.8 5.5 315 173 A 83 ALA HB% A 84 ILE H 1.0 1.8 3.5 316 174 A 84 ILE HA A 84 ILE HB 1.0 1.8 4.5 317 175 A 84 ILE HA A 84 ILE HB 1.0 1.8 4.5 318 176 A 84 ILE HA A 84 ILE HD1% 1.0 1.8 4.5 319 177 A 84 ILE HA A 84 ILE HD1% 1.0 1.8 3.5 320 178 A 84 ILE HB A 84 ILE HD1% 1.0 1.8 3.5 321 179 A 84 ILE HB A 84 ILE HG12 1.0 1.8 5.5 322 179 A 84 ILE HG13 A 84 ILE HB 1.0 1.8 5.5 323 180 A 84 ILE HD1% A 84 ILE HG12 1.0 1.8 2.8 324 180 A 84 ILE HG13 A 84 ILE HD1% 1.0 1.8 2.8 325 181 A 84 ILE HA A 84 ILE HG12 1.0 1.8 5.5 326 181 A 84 ILE HG13 A 84 ILE HA 1.0 1.8 5.5 327 182 A 84 ILE HB A 84 ILE HG12 1.0 1.8 3.5 328 182 A 84 ILE HG13 A 84 ILE HB 1.0 1.8 3.5 329 183 A 84 ILE HD1% A 84 ILE HG12 1.0 1.8 2.8 330 183 A 84 ILE HG13 A 84 ILE HD1% 1.0 1.8 2.8 331 184 A 84 ILE HA A 84 ILE HG21 1.0 1.8 3.5 332 185 A 84 ILE HA A 84 ILE HG21 1.0 1.8 2.8 333 186 A 84 ILE HB A 84 ILE HG21 1.0 1.8 2.8 334 187 A 84 ILE HB A 84 ILE HG21 1.0 1.8 2.8 335 188 A 84 ILE HG21 A 84 ILE HG12 1.0 1.8 2.8 336 188 A 84 ILE HG13 A 84 ILE HG21 1.0 1.8 2.8 337 189 A 84 ILE H A 84 ILE HA 1.0 1.8 5.5 338 190 A 84 ILE H A 84 ILE HB 1.0 1.8 5.5 339 191 A 84 ILE H A 84 ILE HG21 1.0 1.8 3.5 340 192 A 86 PRO HA A 86 PRO HBy 1.0 1.8 4.5 341 192 A 86 PRO HBx A 86 PRO HA 1.0 1.8 4.5 342 193 A 86 PRO HA A 86 PRO HBy 1.0 1.8 4.5 343 193 A 86 PRO HBx A 86 PRO HA 1.0 1.8 4.5 344 194 A 86 PRO HA A 86 PRO HGy 1.0 1.8 3.5 345 194 A 86 PRO HGx A 86 PRO HA 1.0 1.8 3.5 346 195 A 86 PRO HBy A 86 PRO HGy 1.0 1.8 3.5 347 195 A 86 PRO HBx A 86 PRO HGy 1.0 1.8 3.5 348 195 A 86 PRO HGx A 86 PRO HBy 1.0 1.8 3.5 349 195 A 86 PRO HBx A 86 PRO HGx 1.0 1.8 3.5 350 196 A 86 PRO HDx A 86 PRO HGy 1.0 1.8 3.5 351 196 A 86 PRO HGx A 86 PRO HDy 1.0 1.8 3.5 352 196 A 86 PRO HDx A 86 PRO HGx 1.0 1.8 3.5 353 196 A 86 PRO HDy A 86 PRO HGy 1.0 1.8 3.5 354 197 A 86 PRO HBy A 86 PRO HGy 1.0 1.8 3.5 355 197 A 86 PRO HBx A 86 PRO HGy 1.0 1.8 3.5 356 197 A 86 PRO HGx A 86 PRO HBy 1.0 1.8 3.5 357 197 A 86 PRO HBx A 86 PRO HGx 1.0 1.8 3.5 358 198 A 86 PRO HDx A 86 PRO HGy 1.0 1.8 3.5 359 198 A 86 PRO HGx A 86 PRO HDy 1.0 1.8 3.5 360 198 A 86 PRO HDx A 86 PRO HGx 1.0 1.8 3.5 361 198 A 86 PRO HDy A 86 PRO HGy 1.0 1.8 3.5 362 199 A 86 PRO HDx A 86 PRO HGy 1.0 1.8 5.5 363 199 A 86 PRO HDy A 86 PRO HGy 1.0 1.8 5.5 364 199 A 86 PRO HGx A 86 PRO HDy 1.0 1.8 5.5 365 199 A 86 PRO HDx A 86 PRO HGx 1.0 1.8 5.5 366 200 A 87 LYS HA A 87 LYS HBy 1.0 1.8 2.8 367 200 A 87 LYS HA A 87 LYS HBx 1.0 1.8 2.8 368 201 A 87 LYS HA A 87 LYS HBy 1.0 1.8 4.5 369 201 A 87 LYS HA A 87 LYS HBx 1.0 1.8 4.5 370 202 A 87 LYS HA A 87 LYS HBy 1.0 1.8 4.5 371 202 A 87 LYS HA A 87 LYS HBx 1.0 1.8 4.5 372 203 A 87 LYS HDy A 87 LYS HEx 1.0 1.8 4.5 373 203 A 87 LYS HDx A 87 LYS HEx 1.0 1.8 4.5 374 203 A 87 LYS HEy A 87 LYS HDy 1.0 1.8 4.5 375 203 A 87 LYS HDx A 87 LYS HEy 1.0 1.8 4.5 376 204 A 87 LYS HDy A 87 LYS HEx 1.0 1.8 5.5 377 204 A 87 LYS HDx A 87 LYS HEx 1.0 1.8 5.5 378 204 A 87 LYS HEy A 87 LYS HDy 1.0 1.8 5.5 379 204 A 87 LYS HDx A 87 LYS HEy 1.0 1.8 5.5 380 205 A 87 LYS HA A 87 LYS HGy 1.0 1.8 3.5 381 205 A 87 LYS HA A 87 LYS HGx 1.0 1.8 3.5 382 206 A 87 LYS HBx A 87 LYS HGy 1.0 1.8 5.5 383 206 A 87 LYS HBy A 87 LYS HGy 1.0 1.8 5.5 384 206 A 87 LYS HGx A 87 LYS HBy 1.0 1.8 5.5 385 206 A 87 LYS HBx A 87 LYS HGx 1.0 1.8 5.5 386 207 A 87 LYS HEx A 87 LYS HGy 1.0 1.8 5.5 387 207 A 87 LYS HEy A 87 LYS HGy 1.0 1.8 5.5 388 207 A 87 LYS HGx A 87 LYS HEx 1.0 1.8 5.5 389 207 A 87 LYS HGx A 87 LYS HEy 1.0 1.8 5.5 390 208 A 87 LYS H A 87 LYS HA 1.0 1.8 3.5 391 209 A 87 LYS H A 87 LYS HBy 1.0 1.8 5.5 392 209 A 87 LYS H A 87 LYS HBx 1.0 1.8 5.5 393 210 A 87 LYS HA A 88 ASN H 1.0 1.8 5.5 394 211 A 88 ASN HA A 88 ASN HBy 1.0 1.8 3.5 395 211 A 88 ASN HA A 88 ASN HBx 1.0 1.8 3.5 396 212 A 88 ASN HA A 88 ASN HBy 1.0 1.8 5.5 397 212 A 88 ASN HA A 88 ASN HBx 1.0 1.8 5.5 398 213 A 88 ASN HBy A 88 ASN HD2y 1.0 1.8 3.5 399 213 A 88 ASN HBx A 88 ASN HD2y 1.0 1.8 3.5 400 213 A 88 ASN HD2x A 88 ASN HBy 1.0 1.8 3.5 401 213 A 88 ASN HD2x A 88 ASN HBx 1.0 1.8 3.5 402 214 A 88 ASN HBy A 88 ASN HD2y 1.0 1.8 5.5 403 214 A 88 ASN HBx A 88 ASN HD2y 1.0 1.8 5.5 404 214 A 88 ASN HD2x A 88 ASN HBy 1.0 1.8 5.5 405 214 A 88 ASN HD2x A 88 ASN HBx 1.0 1.8 5.5 406 215 A 88 ASN H A 88 ASN HBy 1.0 1.8 5.5 407 215 A 88 ASN H A 88 ASN HBx 1.0 1.8 5.5 408 216 A 86 PRO HA A 89 LEU HBy 1.0 1.8 5.5 409 216 A 86 PRO HA A 89 LEU HBx 1.0 1.8 5.5 410 217 A 86 PRO HA A 89 LEU HD11 1.0 1.8 4.5 411 217 A 86 PRO HA A 89 LEU HD21 1.0 1.8 4.5 412 218 A 86 PRO HA A 89 LEU H 1.0 1.8 5.5 413 219 A 88 ASN HD2x A 89 LEU HD21 1.0 1.8 4.5 414 219 A 89 LEU HD21 A 88 ASN HD2y 1.0 1.8 4.5 415 220 A 89 LEU HA A 89 LEU HBy 1.0 1.8 4.5 416 220 A 89 LEU HA A 89 LEU HBx 1.0 1.8 4.5 417 221 A 89 LEU HA A 89 LEU HBy 1.0 1.8 5.5 418 221 A 89 LEU HA A 89 LEU HBx 1.0 1.8 5.5 419 222 A 89 LEU HA A 89 LEU HD11 1.0 1.8 4.5 420 223 A 89 LEU HA A 89 LEU HD11 1.0 1.8 4.5 421 223 A 89 LEU HA A 89 LEU HD21 1.0 1.8 4.5 422 224 A 89 LEU HA A 89 LEU HD21 1.0 1.8 5.5 423 225 A 89 LEU HBy A 89 LEU HD11 1.0 1.8 4.5 424 225 A 89 LEU HBx A 89 LEU HD11 1.0 1.8 4.5 425 225 A 89 LEU HD21 A 89 LEU HBy 1.0 1.8 4.5 426 225 A 89 LEU HBx A 89 LEU HD21 1.0 1.8 4.5 427 226 A 89 LEU HBy A 89 LEU HD11 1.0 1.8 5.5 428 226 A 89 LEU HBx A 89 LEU HD11 1.0 1.8 5.5 429 226 A 89 LEU HD21 A 89 LEU HBy 1.0 1.8 5.5 430 226 A 89 LEU HBx A 89 LEU HD21 1.0 1.8 5.5 431 227 A 89 LEU HBx A 89 LEU HD21 1.0 1.8 4.5 432 227 A 89 LEU HD21 A 89 LEU HBy 1.0 1.8 4.5 433 228 A 89 LEU HA A 89 LEU HG 1.0 1.8 3.5 434 229 A 89 LEU HG A 89 LEU HBy 1.0 1.8 5.5 435 229 A 89 LEU HBx A 89 LEU HG 1.0 1.8 5.5 436 230 A 89 LEU HG A 89 LEU HD11 1.0 1.8 2.8 437 231 A 89 LEU HG A 89 LEU HD11 1.0 1.8 3.5 438 231 A 89 LEU HD21 A 89 LEU HG 1.0 1.8 3.5 439 232 A 89 LEU H A 89 LEU HA 1.0 1.8 4.5 440 233 A 89 LEU H A 89 LEU HBy 1.0 1.8 5.5 441 233 A 89 LEU H A 89 LEU HBx 1.0 1.8 5.5 442 234 A 89 LEU H A 89 LEU HD11 1.0 1.8 4.5 443 235 A 89 LEU H A 89 LEU HD21 1.0 1.8 4.5 444 236 A 89 LEU H A 89 LEU HG 1.0 1.8 5.5 445 237 A 90 SER HA A 89 LEU HG 1.0 1.8 4.5 446 238 A 90 SER HA A 90 SER HBy 1.0 1.8 3.5 447 238 A 90 SER HA A 90 SER HBx 1.0 1.8 3.5 448 239 A 90 SER HA A 90 SER H 1.0 1.8 4.5 449 240 A 90 SER HBx A 90 SER H 1.0 1.8 5.5 450 240 A 90 SER H A 90 SER HBy 1.0 1.8 5.5 451 241 A 90 SER HBx A 90 SER H 1.0 1.8 5.5 452 241 A 90 SER H A 90 SER HBy 1.0 1.8 5.5 453 242 A 88 ASN HA A 91 ARG HDx 1.0 1.8 5.5 454 242 A 88 ASN HA A 91 ARG HDy 1.0 1.8 5.5 455 243 A 91 ARG HA A 91 ARG HBx 1.0 1.8 3.5 456 243 A 91 ARG HBy A 91 ARG HA 1.0 1.8 3.5 457 244 A 91 ARG HA A 91 ARG HBx 1.0 1.8 2.8 458 244 A 91 ARG HBy A 91 ARG HA 1.0 1.8 2.8 459 245 A 91 ARG HA A 91 ARG HBx 1.0 1.8 3.5 460 245 A 91 ARG HBy A 91 ARG HA 1.0 1.8 3.5 461 246 A 91 ARG HA A 91 ARG HDx 1.0 1.8 5.5 462 246 A 91 ARG HDy A 91 ARG HA 1.0 1.8 5.5 463 247 A 91 ARG HBx A 91 ARG HDx 1.0 1.8 4.5 464 247 A 91 ARG HBy A 91 ARG HDx 1.0 1.8 4.5 465 247 A 91 ARG HDy A 91 ARG HBx 1.0 1.8 4.5 466 247 A 91 ARG HBy A 91 ARG HDy 1.0 1.8 4.5 467 248 A 91 ARG HBx A 91 ARG HDx 1.0 1.8 3.5 468 248 A 91 ARG HBy A 91 ARG HDx 1.0 1.8 3.5 469 248 A 91 ARG HDy A 91 ARG HBx 1.0 1.8 3.5 470 248 A 91 ARG HBy A 91 ARG HDy 1.0 1.8 3.5 471 249 A 91 ARG HA A 91 ARG HGy 1.0 1.8 3.5 472 249 A 91 ARG HGx A 91 ARG HA 1.0 1.8 3.5 473 250 A 91 ARG HA A 91 ARG HGy 1.0 1.8 5.5 474 250 A 91 ARG HGx A 91 ARG HA 1.0 1.8 5.5 475 251 A 91 ARG HBy A 91 ARG HGy 1.0 1.8 3.5 476 251 A 91 ARG HBx A 91 ARG HGy 1.0 1.8 3.5 477 251 A 91 ARG HGx A 91 ARG HBx 1.0 1.8 3.5 478 251 A 91 ARG HBy A 91 ARG HGx 1.0 1.8 3.5 479 252 A 91 ARG HDx A 91 ARG HGy 1.0 1.8 4.5 480 252 A 91 ARG HDy A 91 ARG HGy 1.0 1.8 4.5 481 252 A 91 ARG HGx A 91 ARG HDx 1.0 1.8 4.5 482 252 A 91 ARG HDy A 91 ARG HGx 1.0 1.8 4.5 483 253 A 91 ARG HDx A 91 ARG HGy 1.0 1.8 3.5 484 253 A 91 ARG HDy A 91 ARG HGy 1.0 1.8 3.5 485 253 A 91 ARG HGx A 91 ARG HDx 1.0 1.8 3.5 486 253 A 91 ARG HDy A 91 ARG HGx 1.0 1.8 3.5 487 254 A 91 ARG HA A 91 ARG HGy 1.0 1.8 4.5 488 254 A 91 ARG HGx A 91 ARG HA 1.0 1.8 4.5 489 255 A 91 ARG HA A 91 ARG HGy 1.0 1.8 4.5 490 255 A 91 ARG HGx A 91 ARG HA 1.0 1.8 4.5 491 256 A 91 ARG HBy A 91 ARG HGy 1.0 1.8 3.5 492 256 A 91 ARG HBx A 91 ARG HGy 1.0 1.8 3.5 493 256 A 91 ARG HGx A 91 ARG HBx 1.0 1.8 3.5 494 256 A 91 ARG HBy A 91 ARG HGx 1.0 1.8 3.5 495 257 A 91 ARG HDx A 91 ARG HGy 1.0 1.8 3.5 496 257 A 91 ARG HDy A 91 ARG HGy 1.0 1.8 3.5 497 257 A 91 ARG HGx A 91 ARG HDx 1.0 1.8 3.5 498 257 A 91 ARG HDy A 91 ARG HGx 1.0 1.8 3.5 499 258 A 91 ARG HDx A 91 ARG HGy 1.0 1.8 4.5 500 258 A 91 ARG HDy A 91 ARG HGy 1.0 1.8 4.5 501 258 A 91 ARG HGx A 91 ARG HDx 1.0 1.8 4.5 502 258 A 91 ARG HDy A 91 ARG HGx 1.0 1.8 4.5 503 259 A 91 ARG HA A 91 ARG H 1.0 1.8 3.5 504 260 A 91 ARG HBy A 91 ARG H 1.0 1.8 4.5 505 260 A 91 ARG H A 91 ARG HBx 1.0 1.8 4.5 506 261 A 91 ARG HBy A 91 ARG H 1.0 1.8 4.5 507 261 A 91 ARG H A 91 ARG HBx 1.0 1.8 4.5 508 262 A 91 ARG HDy A 91 ARG H 1.0 1.8 5.5 509 262 A 91 ARG H A 91 ARG HDx 1.0 1.8 5.5 510 263 A 91 ARG HGx A 91 ARG H 1.0 1.8 5.5 511 263 A 91 ARG H A 91 ARG HGy 1.0 1.8 5.5 512 264 A 92 LEU HG A 91 ARG HBx 1.0 1.8 5.5 513 264 A 91 ARG HBy A 92 LEU HG 1.0 1.8 5.5 514 265 A 92 LEU HA A 92 LEU HBy 1.0 1.8 3.5 515 265 A 92 LEU HA A 92 LEU HBx 1.0 1.8 3.5 516 266 A 92 LEU HA A 92 LEU HBy 1.0 1.8 5.5 517 266 A 92 LEU HA A 92 LEU HBx 1.0 1.8 5.5 518 267 A 92 LEU HA A 92 LEU HBy 1.0 1.8 3.5 519 267 A 92 LEU HA A 92 LEU HBx 1.0 1.8 3.5 520 268 A 92 LEU HA A 92 LEU HBy 1.0 1.8 5.5 521 268 A 92 LEU HA A 92 LEU HBx 1.0 1.8 5.5 522 269 A 92 LEU HA A 92 LEU HD11 1.0 1.8 5.5 523 270 A 92 LEU HA A 92 LEU HD11 1.0 1.8 2.8 524 270 A 92 LEU HA A 92 LEU HD21 1.0 1.8 2.8 525 271 A 92 LEU HA A 92 LEU HD21 1.0 1.8 2.8 526 272 A 92 LEU HBy A 92 LEU HD11 1.0 1.8 3.5 527 272 A 92 LEU HBx A 92 LEU HD11 1.0 1.8 3.5 528 272 A 92 LEU HD21 A 92 LEU HBy 1.0 1.8 3.5 529 272 A 92 LEU HBx A 92 LEU HD21 1.0 1.8 3.5 530 273 A 92 LEU HBy A 92 LEU HD11 1.0 1.8 5.5 531 273 A 92 LEU HBx A 92 LEU HD11 1.0 1.8 5.5 532 273 A 92 LEU HD21 A 92 LEU HBy 1.0 1.8 5.5 533 273 A 92 LEU HBx A 92 LEU HD21 1.0 1.8 5.5 534 274 A 92 LEU HA A 92 LEU HG 1.0 1.8 3.5 535 275 A 92 LEU HG A 92 LEU HBy 1.0 1.8 3.5 536 275 A 92 LEU HBx A 92 LEU HG 1.0 1.8 3.5 537 276 A 92 LEU HG A 92 LEU HD11 1.0 1.8 2.8 538 276 A 92 LEU HD21 A 92 LEU HG 1.0 1.8 2.8 539 277 A 92 LEU HA A 92 LEU H 1.0 1.8 4.5 540 278 A 92 LEU HBx A 92 LEU H 1.0 1.8 4.5 541 278 A 92 LEU H A 92 LEU HBy 1.0 1.8 4.5 542 279 A 92 LEU HD21 A 92 LEU H 1.0 1.8 3.5 543 280 A 92 LEU HG A 92 LEU H 1.0 1.8 4.5 544 281 A 92 LEU HA A 93 PHE HA 1.0 1.8 5.5 545 282 A 92 LEU HG A 93 PHE H 1.0 1.8 5.5 546 283 A 93 PHE HA A 93 PHE HBy 1.0 1.8 5.5 547 283 A 93 PHE HA A 93 PHE HBx 1.0 1.8 5.5 548 284 A 93 PHE HA A 93 PHE HBy 1.0 1.8 3.5 549 284 A 93 PHE HA A 93 PHE HBx 1.0 1.8 3.5 550 285 A 93 PHE HA A 93 PHE HBy 1.0 1.8 5.5 551 285 A 93 PHE HA A 93 PHE HBx 1.0 1.8 5.5 552 286 A 93 PHE H A 93 PHE HBy 1.0 1.8 5.5 553 286 A 93 PHE H A 93 PHE HBx 1.0 1.8 5.5 554 287 A 93 PHE HA A 94 PRO HGx 1.0 1.8 5.5 555 287 A 93 PHE HA A 94 PRO HGy 1.0 1.8 5.5 556 288 A 94 PRO HA A 94 PRO HBy 1.0 1.8 3.5 557 288 A 94 PRO HA A 94 PRO HBx 1.0 1.8 3.5 558 289 A 94 PRO HA A 94 PRO HBy 1.0 1.8 5.5 559 289 A 94 PRO HA A 94 PRO HBx 1.0 1.8 5.5 560 290 A 94 PRO HA A 94 PRO HBy 1.0 1.8 4.5 561 290 A 94 PRO HA A 94 PRO HBx 1.0 1.8 4.5 562 291 A 94 PRO HA A 94 PRO HDy 1.0 1.8 5.5 563 291 A 94 PRO HA A 94 PRO HDx 1.0 1.8 5.5 564 292 A 94 PRO HBy A 94 PRO HGx 1.0 1.8 3.5 565 292 A 94 PRO HBx A 94 PRO HGx 1.0 1.8 3.5 566 292 A 94 PRO HGy A 94 PRO HBy 1.0 1.8 3.5 567 292 A 94 PRO HBx A 94 PRO HGy 1.0 1.8 3.5 568 293 A 94 PRO HBy A 94 PRO HGx 1.0 1.8 3.5 569 293 A 94 PRO HBx A 94 PRO HGx 1.0 1.8 3.5 570 293 A 94 PRO HGy A 94 PRO HBy 1.0 1.8 3.5 571 293 A 94 PRO HBx A 94 PRO HGy 1.0 1.8 3.5 572 294 A 94 PRO HDy A 94 PRO HGx 1.0 1.8 5.5 573 294 A 94 PRO HDx A 94 PRO HGx 1.0 1.8 5.5 574 294 A 94 PRO HGy A 94 PRO HDy 1.0 1.8 5.5 575 294 A 94 PRO HDx A 94 PRO HGy 1.0 1.8 5.5 576 295 A 94 PRO HDy A 94 PRO HGx 1.0 1.8 5.5 577 295 A 94 PRO HDx A 94 PRO HGx 1.0 1.8 5.5 578 295 A 94 PRO HGy A 94 PRO HDy 1.0 1.8 5.5 579 295 A 94 PRO HDx A 94 PRO HGy 1.0 1.8 5.5 580 296 A 94 PRO HBy A 95 GLY HAy 1.0 1.8 4.5 581 296 A 94 PRO HBx A 95 GLY HAy 1.0 1.8 4.5 582 296 A 95 GLY HAx A 94 PRO HBy 1.0 1.8 4.5 583 296 A 94 PRO HBx A 95 GLY HAx 1.0 1.8 4.5 584 297 A 95 GLY H A 94 PRO HA 1.0 1.8 4.5 585 298 A 95 GLY H A 95 GLY HAy 1.0 1.8 5.5 586 298 A 95 GLY H A 95 GLY HAx 1.0 1.8 5.5 587 299 A 96 TRP HA A 96 TRP HBx 1.0 1.8 3.5 588 299 A 96 TRP HA A 96 TRP HBy 1.0 1.8 3.5 589 300 A 97 LYS HA A 97 LYS HBy 1.0 1.8 5.5 590 300 A 97 LYS HA A 97 LYS HBx 1.0 1.8 5.5 591 301 A 97 LYS HA A 97 LYS HBy 1.0 1.8 5.5 592 301 A 97 LYS HA A 97 LYS HBx 1.0 1.8 5.5 593 302 A 97 LYS HA A 97 LYS HBy 1.0 1.8 3.5 594 302 A 97 LYS HA A 97 LYS HBx 1.0 1.8 3.5 595 303 A 97 LYS HA A 97 LYS HDx 1.0 1.8 5.5 596 303 A 97 LYS HA A 97 LYS HDy 1.0 1.8 5.5 597 304 A 97 LYS HDx A 97 LYS HEx 1.0 1.8 2.8 598 304 A 97 LYS HDy A 97 LYS HEx 1.0 1.8 2.8 599 304 A 97 LYS HEy A 97 LYS HDx 1.0 1.8 2.8 600 304 A 97 LYS HEy A 97 LYS HDy 1.0 1.8 2.8 601 305 A 97 LYS HDx A 97 LYS HEx 1.0 1.8 2.8 602 305 A 97 LYS HDy A 97 LYS HEx 1.0 1.8 2.8 603 305 A 97 LYS HEy A 97 LYS HDx 1.0 1.8 2.8 604 305 A 97 LYS HEy A 97 LYS HDy 1.0 1.8 2.8 605 306 A 97 LYS HEy A 97 LYS HGy 1.0 1.8 5.5 606 306 A 97 LYS HEx A 97 LYS HGy 1.0 1.8 5.5 607 306 A 97 LYS HGx A 97 LYS HEx 1.0 1.8 5.5 608 306 A 97 LYS HEy A 97 LYS HGx 1.0 1.8 5.5 609 307 A 97 LYS HA A 97 LYS HGy 1.0 1.8 4.5 610 307 A 97 LYS HA A 97 LYS HGx 1.0 1.8 4.5 611 308 A 97 LYS HBy A 97 LYS HGy 1.0 1.8 5.5 612 308 A 97 LYS HGx A 97 LYS HBy 1.0 1.8 5.5 613 308 A 97 LYS HBx A 97 LYS HGx 1.0 1.8 5.5 614 308 A 97 LYS HBx A 97 LYS HGy 1.0 1.8 5.5 615 309 A 97 LYS HBy A 97 LYS HGy 1.0 1.8 4.5 616 309 A 97 LYS HGx A 97 LYS HBy 1.0 1.8 4.5 617 309 A 97 LYS HBx A 97 LYS HGx 1.0 1.8 4.5 618 309 A 97 LYS HBx A 97 LYS HGy 1.0 1.8 4.5 619 310 A 97 LYS HDy A 97 LYS HGy 1.0 1.8 5.5 620 310 A 97 LYS HDx A 97 LYS HGy 1.0 1.8 5.5 621 310 A 97 LYS HGx A 97 LYS HDx 1.0 1.8 5.5 622 310 A 97 LYS HGx A 97 LYS HDy 1.0 1.8 5.5 623 311 A 97 LYS HDy A 97 LYS HGy 1.0 1.8 2.8 624 311 A 97 LYS HDx A 97 LYS HGy 1.0 1.8 2.8 625 311 A 97 LYS HGx A 97 LYS HDx 1.0 1.8 2.8 626 311 A 97 LYS HGx A 97 LYS HDy 1.0 1.8 2.8 627 312 A 97 LYS HEy A 97 LYS HGy 1.0 1.8 5.5 628 312 A 97 LYS HEx A 97 LYS HGy 1.0 1.8 5.5 629 312 A 97 LYS HGx A 97 LYS HEx 1.0 1.8 5.5 630 312 A 97 LYS HEy A 97 LYS HGx 1.0 1.8 5.5 631 313 A 97 LYS HEy A 97 LYS HGy 1.0 1.8 2.8 632 313 A 97 LYS HEx A 97 LYS HGy 1.0 1.8 2.8 633 313 A 97 LYS HGx A 97 LYS HEx 1.0 1.8 2.8 634 313 A 97 LYS HEy A 97 LYS HGx 1.0 1.8 2.8 635 314 A 97 LYS HA A 97 LYS H 1.0 1.8 3.5 636 315 A 97 LYS HBx A 97 LYS H 1.0 1.8 5.5 637 315 A 97 LYS H A 97 LYS HBy 1.0 1.8 5.5 638 316 A 97 LYS HBx A 97 LYS H 1.0 1.8 5.5 639 316 A 97 LYS H A 97 LYS HBy 1.0 1.8 5.5 640 317 A 97 LYS HDy A 97 LYS H 1.0 1.8 5.5 641 317 A 97 LYS H A 97 LYS HDx 1.0 1.8 5.5 642 318 A 97 LYS HEy A 97 LYS H 1.0 1.8 3.5 643 318 A 97 LYS H A 97 LYS HEx 1.0 1.8 3.5 644 319 A 97 LYS HA A 98 ALA H 1.0 1.8 5.5 645 320 A 98 ALA HA A 98 ALA HB% 1.0 1.8 2.8 646 321 A 98 ALA HA A 98 ALA HB% 1.0 1.8 2.8 647 322 A 98 ALA H A 98 ALA HA 1.0 1.8 3.5 648 323 A 98 ALA H A 98 ALA HB% 1.0 1.8 2.8 649 324 A 98 ALA HA A 99 TRP HD1 1.0 1.8 5.5 650 325 A 98 ALA HB% A 99 TRP HD1 1.0 1.8 3.5 651 326 A 98 ALA HA A 99 TRP H 1.0 1.8 3.5 652 327 A 98 ALA HB% A 99 TRP H 1.0 1.8 3.5 653 328 A 99 TRP HA A 99 TRP HBy 1.0 1.8 3.5 654 328 A 99 TRP HA A 99 TRP HBx 1.0 1.8 3.5 655 329 A 99 TRP HA A 99 TRP HBy 1.0 1.8 5.5 656 329 A 99 TRP HA A 99 TRP HBx 1.0 1.8 5.5 657 330 A 99 TRP HA A 99 TRP HBy 1.0 1.8 3.5 658 330 A 99 TRP HA A 99 TRP HBx 1.0 1.8 3.5 659 331 A 99 TRP HA A 99 TRP HBy 1.0 1.8 5.5 660 331 A 99 TRP HA A 99 TRP HBx 1.0 1.8 5.5 661 332 A 99 TRP HA A 99 TRP HD1 1.0 1.8 3.5 662 333 A 99 TRP H A 99 TRP HA 1.0 1.8 3.5 663 334 A 97 LYS HA A 100 VAL HG11 1.0 1.8 4.5 664 335 A 100 VAL HA A 100 VAL HB 1.0 1.8 2.8 665 336 A 100 VAL HA A 100 VAL HB 1.0 1.8 2.8 666 337 A 100 VAL HA A 100 VAL HG21 1.0 1.8 2.8 667 337 A 100 VAL HG11 A 100 VAL HA 1.0 1.8 2.8 668 338 A 100 VAL HG11 A 100 VAL HA 1.0 1.8 2.8 669 339 A 100 VAL HG11 A 100 VAL HB 1.0 1.8 2.8 670 340 A 100 VAL HB A 100 VAL HG21 1.0 1.8 2.8 671 340 A 100 VAL HG11 A 100 VAL HB 1.0 1.8 2.8 672 341 A 100 VAL HB A 100 VAL HG21 1.0 1.8 2.8 673 342 A 100 VAL H A 100 VAL HA 1.0 1.8 2.8 674 343 A 100 VAL H A 100 VAL HB 1.0 1.8 4.5 675 344 A 100 VAL H A 100 VAL HG11 1.0 1.8 2.8 676 345 A 100 VAL H A 100 VAL HG21 1.0 1.8 2.8 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _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 69 VAL H A 68 THR HA 1.0 1.8 2.8 2 1 A 68 THR H A 68 THR HA 1.0 1.8 2.8 3 2 A 68 THR HB A 69 VAL H 1.0 1.8 2.8 4 2 A 68 THR H A 68 THR HB 1.0 1.8 2.8 5 3 A 68 THR HG2% A 69 VAL H 1.0 1.8 2.8 6 3 A 68 THR H A 68 THR HG2% 1.0 1.8 2.8 7 4 A 69 VAL HA A 70 LEU H 1.0 1.8 2.8 8 4 A 69 VAL H A 69 VAL HA 1.0 1.8 2.8 9 5 A 70 LEU H A 69 VAL HG21 1.0 1.8 2.8 10 5 A 69 VAL H A 69 VAL HG21 1.0 1.8 2.8 11 6 A 70 LEU HA A 70 LEU HBy 1.0 1.8 2.8 12 6 A 70 LEU HA A 70 LEU HG 1.0 1.8 2.8 13 6 A 70 LEU HA A 70 LEU HBx 1.0 1.8 2.8 14 7 A 71 SER H A 71 SER HA 1.0 1.8 2.8 15 7 A 70 LEU H A 71 SER HA 1.0 1.8 2.8 16 8 A 70 LEU HA A 71 SER H 1.0 1.8 2.8 17 8 A 70 LEU H A 70 LEU HA 1.0 1.8 2.8 18 9 A 72 VAL HB A 73 GLY H 1.0 1.8 3.5 19 9 A 72 VAL H A 72 VAL HB 1.0 1.8 3.5 20 10 A 79 LEU HA A 78 LEU HBy 1.0 1.8 3.5 21 10 A 78 LEU HA A 78 LEU HBy 1.0 1.8 3.5 22 10 A 78 LEU HBx A 79 LEU HA 1.0 1.8 3.5 23 10 A 78 LEU HA A 78 LEU HBx 1.0 1.8 3.5 24 11 A 78 LEU HBx A 79 LEU HD11 1.0 1.8 2.8 25 11 A 78 LEU HBy A 79 LEU HD11 1.0 1.8 2.8 26 11 A 78 LEU HD21 A 78 LEU HBy 1.0 1.8 2.8 27 11 A 78 LEU HBx A 78 LEU HD21 1.0 1.8 2.8 28 12 A 83 ALA HB% A 84 ILE HD1% 1.0 1.8 3.5 29 12 A 80 ILE HD1% A 83 ALA HB% 1.0 1.8 3.5 30 13 A 86 PRO HA A 89 LEU HBy 1.0 1.8 4.5 31 13 A 86 PRO HA A 89 LEU HG 1.0 1.8 4.5 32 13 A 86 PRO HA A 89 LEU HBx 1.0 1.8 4.5 33 14 A 88 ASN H A 88 ASN HBy 1.0 1.8 4.5 34 14 A 89 LEU H A 88 ASN HBy 1.0 1.8 4.5 35 14 A 88 ASN HBx A 89 LEU H 1.0 1.8 4.5 36 14 A 88 ASN H A 88 ASN HBx 1.0 1.8 4.5 37 15 A 89 LEU HD21 A 89 LEU HBy 1.0 1.8 2.8 38 15 A 89 LEU HBx A 89 LEU HD21 1.0 1.8 2.8 39 15 A 89 LEU HD21 A 89 LEU HG 1.0 1.8 2.8 40 16 A 92 LEU HBx A 92 LEU HD11 1.0 1.8 2.8 41 16 A 92 LEU HG A 92 LEU HD11 1.0 1.8 2.8 42 16 A 92 LEU HBy A 92 LEU HD11 1.0 1.8 2.8 43 17 A 92 LEU HD21 A 92 LEU HBy 1.0 1.8 2.8 44 17 A 92 LEU HD21 A 92 LEU HG 1.0 1.8 2.8 45 17 A 92 LEU HBx A 92 LEU HD21 1.0 1.8 2.8 46 18 A 94 PRO HA A 94 PRO HGx 1.0 1.8 3.5 47 18 A 94 PRO HA A 94 PRO HGy 1.0 1.8 3.5 48 18 A 94 PRO HA A 94 PRO HBx 1.0 1.8 3.5 49 18 A 94 PRO HA A 94 PRO HBy 1.0 1.8 3.5 50 19 A 91 ARG HA A 93 PHE HBy 1.0 1.8 5.5 51 19 A 91 ARG HA A 96 TRP HBx 1.0 1.8 5.5 52 19 A 91 ARG HA A 96 TRP HBy 1.0 1.8 5.5 53 19 A 93 PHE HBx A 91 ARG HA 1.0 1.8 5.5 54 20 A 97 LYS HA A 97 LYS HBy 1.0 1.8 3.5 55 20 A 97 LYS HA A 97 LYS HDx 1.0 1.8 3.5 56 20 A 97 LYS HA A 97 LYS HDy 1.0 1.8 3.5 57 20 A 97 LYS HA A 97 LYS HBx 1.0 1.8 3.5 58 21 A 97 LYS HBy A 97 LYS HGy 1.0 1.8 4.5 59 21 A 97 LYS HDy A 97 LYS HGy 1.0 1.8 4.5 60 21 A 97 LYS HGx A 97 LYS HDy 1.0 1.8 4.5 61 21 A 97 LYS HBx A 97 LYS HGx 1.0 1.8 4.5 62 21 A 97 LYS HGx A 97 LYS HDx 1.0 1.8 4.5 63 21 A 97 LYS HBx A 97 LYS HGy 1.0 1.8 4.5 64 21 A 97 LYS HDx A 97 LYS HGy 1.0 1.8 4.5 65 21 A 97 LYS HGx A 97 LYS HBy 1.0 1.8 4.5 66 22 A 93 PHE HD% A 93 PHE HA 1.0 1.8 4.5 67 23 A 93 PHE HD% A 93 PHE HBy 1.0 1.8 4.5 68 23 A 93 PHE HD% A 93 PHE HBx 1.0 1.8 4.5 69 24 A 93 PHE HD% A 93 PHE HBy 1.0 1.8 4.5 70 24 A 93 PHE HD% A 93 PHE HBx 1.0 1.8 4.5 71 25 A 93 PHE HE% A 93 PHE HBy 1.0 1.8 5.5 72 25 A 93 PHE HBx A 93 PHE HE% 1.0 1.8 5.5 73 26 A 96 TRP HD1 A 95 GLY HAy 1.0 1.8 4.5 74 26 A 95 GLY HAx A 96 TRP HD1 1.0 1.8 4.5 75 27 A 96 TRP HD1 A 96 TRP HBx 1.0 1.8 5.5 76 27 A 96 TRP HD1 A 96 TRP HBy 1.0 1.8 5.5 77 28 A 96 TRP HD1 A 96 TRP HE3 1.0 1.8 2.8 78 28 A 96 TRP HE1 A 96 TRP HD1 1.0 1.8 2.8 79 29 A 96 TRP H A 96 TRP HD1 1.0 1.8 4.5 80 30 A 96 TRP HZ2 A 96 TRP HE3 1.0 1.8 5.5 81 30 A 96 TRP HE1 A 96 TRP HZ2 1.0 1.8 5.5 82 31 A 96 TRP HZ2 A 96 TRP HH2 1.0 1.8 2.8 83 32 A 96 TRP HZ2 A 96 TRP HH2 1.0 1.8 2.8 84 33 A 96 TRP HH2 A 96 TRP HZ3 1.0 1.8 2.8 85 34 A 96 TRP HH2 A 96 TRP HZ3 1.0 1.8 5.5 86 35 A 96 TRP HZ2 A 96 TRP HZ3 1.0 1.8 5.5 87 36 A 96 TRP HZ2 A 96 TRP HZ3 1.0 1.8 5.5 88 37 A 98 ALA HB% A 99 TRP HD1 1.0 1.8 4.5 89 38 A 98 ALA H A 99 TRP HD1 1.0 1.8 3.5 90 39 A 99 TRP HD1 A 99 TRP HBy 1.0 1.8 5.5 91 39 A 99 TRP HD1 A 99 TRP HBx 1.0 1.8 5.5 92 40 A 99 TRP HD1 A 99 TRP HBy 1.0 1.8 4.5 93 40 A 99 TRP HD1 A 99 TRP HBx 1.0 1.8 4.5 94 41 A 99 TRP HD1 A 99 TRP HE3 1.0 1.8 2.8 95 41 A 99 TRP HE1 A 99 TRP HD1 1.0 1.8 2.8 96 42 A 99 TRP H A 99 TRP HD1 1.0 1.8 2.8 97 43 A 99 TRP HZ2 A 99 TRP HE3 1.0 1.8 4.5 98 43 A 99 TRP HE1 A 99 TRP HZ2 1.0 1.8 4.5 99 44 A 99 TRP HZ2 A 99 TRP HH2 1.0 1.8 2.8 100 45 A 99 TRP HZ2 A 99 TRP HH2 1.0 1.8 2.8 101 46 A 99 TRP HZ3 A 99 TRP HE3 1.0 1.8 5.5 102 47 A 93 PHE HD% A 96 TRP H 1.0 1.8 4.5 103 47 A 93 PHE H A 93 PHE HD% 1.0 1.8 4.5 stop_ save_ save_CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 72 VAL O A 76 VAL H 1.0 1.8 2.3 2 2 A 72 VAL O A 76 VAL N 1.0 2.6 3.1 3 3 A 73 GLY O A 77 ASN H 1.0 1.8 2.3 4 4 A 73 GLY O A 77 ASN N 1.0 2.7 3.3 5 5 A 74 GLY O A 78 LEU H 1.0 1.8 2.3 6 6 A 74 GLY O A 78 LEU N 1.0 2.6 3.1 7 7 A 75 GLN O A 79 LEU H 1.0 1.8 2.3 8 8 A 75 GLN O A 79 LEU N 1.0 2.7 3.3 9 9 A 76 VAL O A 80 ILE H 1.0 1.8 2.3 10 10 A 76 VAL O A 80 ILE N 1.0 2.6 3.1 11 11 A 77 ASN O A 81 GLN H 1.0 1.8 2.3 12 12 A 77 ASN O A 81 GLN N 1.0 2.7 3.3 13 13 A 78 LEU O A 82 GLN H 1.0 1.8 2.3 14 14 A 78 LEU O A 82 GLN N 1.0 2.6 3.1 15 15 A 79 LEU O A 83 ALA H 1.0 1.8 2.3 16 16 A 79 LEU O A 83 ALA N 1.0 2.7 3.3 17 17 A 86 PRO O A 90 SER H 1.0 1.8 2.3 18 18 A 86 PRO O A 90 SER N 1.0 2.6 3.1 19 19 A 87 LYS O A 91 ARG H 1.0 1.8 2.3 20 20 A 87 LYS O A 91 ARG N 1.0 2.6 3.1 21 21 A 88 ASN O A 92 LEU H 1.0 1.8 2.3 22 22 A 88 ASN O A 92 LEU N 1.0 2.7 3.3 23 23 A 94 PRO O A 97 LYS H 1.0 1.8 2.3 24 24 A 94 PRO O A 97 LYS N 1.0 2.6 3.1 stop_ save_ save_CNS/XPLOR_dihedral_6 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_6 _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 71 SER C A 72 VAL N A 72 VAL CA A 72 VAL C 1.0 -95.0 -35.0 PHI 2 2 A 72 VAL C A 73 GLY N A 73 GLY CA A 73 GLY C 1.0 -95.0 -35.0 PHI 3 3 A 73 GLY C A 74 GLY N A 74 GLY CA A 74 GLY C 1.0 -95.0 -35.0 PHI 4 4 A 74 GLY C A 75 GLN N A 75 GLN CA A 75 GLN C 1.0 -95.0 -35.0 PHI 5 5 A 75 GLN C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -95.0 -35.0 PHI 6 6 A 76 VAL C A 77 ASN N A 77 ASN CA A 77 ASN C 1.0 -95.0 -35.0 PHI 7 7 A 77 ASN C A 78 LEU N A 78 LEU CA A 78 LEU C 1.0 -95.0 -35.0 PHI 8 8 A 78 LEU C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -95.0 -35.0 PHI 9 9 A 79 LEU C A 80 ILE N A 80 ILE CA A 80 ILE C 1.0 -95.0 -35.0 PHI 10 10 A 80 ILE C A 81 GLN N A 81 GLN CA A 81 GLN C 1.0 -95.0 -35.0 PHI 11 11 A 81 GLN C A 82 GLN N A 82 GLN CA A 82 GLN C 1.0 -95.0 -35.0 PHI 12 12 A 82 GLN C A 83 ALA N A 83 ALA CA A 83 ALA C 1.0 -95.0 -35.0 PHI 13 13 A 86 PRO C A 87 LYS N A 87 LYS CA A 87 LYS C 1.0 -95.0 -35.0 PHI 14 14 A 87 LYS C A 88 ASN N A 88 ASN CA A 88 ASN C 1.0 -95.0 -35.0 PHI 15 15 A 88 ASN C A 89 LEU N A 89 LEU CA A 89 LEU C 1.0 -95.0 -35.0 PHI 16 16 A 89 LEU C A 90 SER N A 90 SER CA A 90 SER C 1.0 -95.0 -35.0 PHI 17 17 A 90 SER C A 91 ARG N A 91 ARG CA A 91 ARG C 1.0 -95.0 -35.0 PHI 18 18 A 91 ARG C A 92 LEU N A 92 LEU CA A 92 LEU C 1.0 -95.0 -35.0 PHI 19 19 A 95 GLY C A 96 TRP N A 96 TRP CA A 96 TRP C 1.0 -95.0 -35.0 PHI 20 20 A 96 TRP C A 97 LYS N A 97 LYS CA A 97 LYS C 1.0 -95.0 -35.0 PHI 21 21 A 72 VAL N A 72 VAL CA A 72 VAL C A 73 GLY N 1.0 -70.0 -10.0 PSI 22 22 A 73 GLY N A 73 GLY CA A 73 GLY C A 74 GLY N 1.0 -70.0 -10.0 PSI 23 23 A 74 GLY N A 74 GLY CA A 74 GLY C A 75 GLN N 1.0 -70.0 -10.0 PSI 24 24 A 75 GLN N A 75 GLN CA A 75 GLN C A 76 VAL N 1.0 -70.0 -10.0 PSI 25 25 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 ASN N 1.0 -70.0 -10.0 PSI 26 26 A 77 ASN N A 77 ASN CA A 77 ASN C A 78 LEU N 1.0 -70.0 -10.0 PSI 27 27 A 78 LEU N A 78 LEU CA A 78 LEU C A 79 LEU N 1.0 -70.0 -10.0 PSI 28 28 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 ILE N 1.0 -70.0 -10.0 PSI 29 29 A 80 ILE N A 80 ILE CA A 80 ILE C A 81 GLN N 1.0 -70.0 -10.0 PSI 30 30 A 81 GLN N A 81 GLN CA A 81 GLN C A 82 GLN N 1.0 -70.0 -10.0 PSI 31 31 A 83 ALA N A 83 ALA CA A 83 ALA C A 84 ILE N 1.0 -70.0 -10.0 PSI 32 32 A 82 GLN N A 82 GLN CA A 82 GLN C A 83 ALA N 1.0 -70.0 -10.0 PSI 33 33 A 87 LYS N A 87 LYS CA A 87 LYS C A 88 ASN N 1.0 -70.0 -10.0 PSI 34 34 A 88 ASN N A 88 ASN CA A 88 ASN C A 89 LEU N 1.0 -70.0 -10.0 PSI 35 35 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 SER N 1.0 -70.0 -10.0 PSI 36 36 A 90 SER N A 90 SER CA A 90 SER C A 91 ARG N 1.0 -70.0 -10.0 PSI 37 37 A 91 ARG N A 91 ARG CA A 91 ARG C A 92 LEU N 1.0 -70.0 -10.0 PSI 38 38 A 97 LYS N A 97 LYS CA A 97 LYS C A 98 ALA N 1.0 -70.0 -10.0 PSI 39 39 A 96 TRP N A 96 TRP CA A 96 TRP C A 97 LYS N 1.0 -70.0 -10.0 PSI stop_ save_