data_nef_c17753_2lfh save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code TargetDB HR3111A 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 GLY middle . false 3 A 3 HIS middle . . 4 A 4 HIS middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 SER middle . . 10 A 10 HIS middle . . 11 A 11 MET middle . . 12 A 12 GLY middle . false 13 A 13 GLY middle . false 14 A 14 GLY middle . false 15 A 15 LYS middle . . 16 A 16 GLY middle . false 17 A 17 PRO middle . false 18 A 18 ALA middle . . 19 A 19 ALA middle . . 20 A 20 GLU middle . . 21 A 21 GLU middle . . 22 A 22 PRO middle . false 23 A 23 LEU middle . . 24 A 24 SER middle . . 25 A 25 LEU middle . . 26 A 26 LEU middle . . 27 A 27 ASP middle . . 28 A 28 ASP middle . . 29 A 29 MET middle . . 30 A 30 ASN middle . . 31 A 31 HIS middle . . 32 A 32 CYS middle . . 33 A 33 TYR middle . . 34 A 34 SER middle . . 35 A 35 ARG middle . . 36 A 36 LEU middle . . 37 A 37 ARG middle . . 38 A 38 GLU middle . . 39 A 39 LEU middle . . 40 A 40 VAL middle . . 41 A 41 PRO middle . false 42 A 42 GLY middle . false 43 A 43 VAL middle . . 44 A 44 PRO middle . false 45 A 45 ARG middle . . 46 A 46 GLY middle . false 47 A 47 THR middle . . 48 A 48 GLN middle . . 49 A 49 LEU middle . . 50 A 50 SER middle . . 51 A 51 GLN middle . . 52 A 52 VAL middle . . 53 A 53 GLU middle . . 54 A 54 ILE middle . . 55 A 55 LEU middle . . 56 A 56 GLN middle . . 57 A 57 ARG middle . . 58 A 58 VAL middle . . 59 A 59 ILE middle . . 60 A 60 ASP middle . . 61 A 61 TYR middle . . 62 A 62 ILE middle . . 63 A 63 LEU middle . . 64 A 64 ASP middle . . 65 A 65 LEU middle . . 66 A 66 GLN middle . . 67 A 67 VAL middle . . 68 A 68 VAL end . . 69 B 1 MET start . . 70 B 2 GLY middle . false 71 B 3 HIS middle . . 72 B 4 HIS middle . . 73 B 5 HIS middle . . 74 B 6 HIS middle . . 75 B 7 HIS middle . . 76 B 8 HIS middle . . 77 B 9 SER middle . . 78 B 10 HIS middle . . 79 B 11 MET middle . . 80 B 12 GLY middle . false 81 B 13 GLY middle . false 82 B 14 GLY middle . false 83 B 15 LYS middle . . 84 B 16 GLY middle . false 85 B 17 PRO middle . false 86 B 18 ALA middle . . 87 B 19 ALA middle . . 88 B 20 GLU middle . . 89 B 21 GLU middle . . 90 B 22 PRO middle . false 91 B 23 LEU middle . . 92 B 24 SER middle . . 93 B 25 LEU middle . . 94 B 26 LEU middle . . 95 B 27 ASP middle . . 96 B 28 ASP middle . . 97 B 29 MET middle . . 98 B 30 ASN middle . . 99 B 31 HIS middle . . 100 B 32 CYS middle . . 101 B 33 TYR middle . . 102 B 34 SER middle . . 103 B 35 ARG middle . . 104 B 36 LEU middle . . 105 B 37 ARG middle . . 106 B 38 GLU middle . . 107 B 39 LEU middle . . 108 B 40 VAL middle . . 109 B 41 PRO middle . false 110 B 42 GLY middle . false 111 B 43 VAL middle . . 112 B 44 PRO middle . false 113 B 45 ARG middle . . 114 B 46 GLY middle . false 115 B 47 THR middle . . 116 B 48 GLN middle . . 117 B 49 LEU middle . . 118 B 50 SER middle . . 119 B 51 GLN middle . . 120 B 52 VAL middle . . 121 B 53 GLU middle . . 122 B 54 ILE middle . . 123 B 55 LEU middle . . 124 B 56 GLN middle . . 125 B 57 ARG middle . . 126 B 58 VAL middle . . 127 B 59 ILE middle . . 128 B 60 ASP middle . . 129 B 61 TYR middle . . 130 B 62 ILE middle . . 131 B 63 LEU middle . . 132 B 64 ASP middle . . 133 B 65 LEU middle . . 134 B 66 GLN middle . . 135 B 67 VAL middle . . 136 B 68 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 17 PRO HA H 1 4.412 0.02 A 17 PRO HBx H 1 1.939 0.02 A 17 PRO HBy H 1 2.270 0.02 A 17 PRO HD2 H 1 3.614 0.02 A 17 PRO HD3 H 1 3.614 0.02 A 17 PRO HG2 H 1 1.999 0.02 A 17 PRO HG3 H 1 1.999 0.02 A 17 PRO C C 13 176.949 0.20 A 17 PRO CA C 13 63.098 0.20 A 17 PRO CB C 13 32.037 0.20 A 17 PRO CD C 13 49.659 0.20 A 17 PRO CG C 13 27.049 0.20 A 18 ALA H H 1 8.386 0.02 A 18 ALA HA H 1 4.300 0.02 A 18 ALA HB% H 1 1.385 0.02 A 18 ALA C C 13 177.474 0.20 A 18 ALA CA C 13 52.267 0.20 A 18 ALA CB C 13 19.106 0.20 A 18 ALA N N 15 124.049 0.20 A 19 ALA H H 1 8.188 0.02 A 19 ALA HA H 1 4.280 0.02 A 19 ALA HB% H 1 1.377 0.02 A 19 ALA C C 13 177.515 0.20 A 19 ALA CA C 13 52.326 0.20 A 19 ALA CB C 13 19.274 0.20 A 19 ALA N N 15 123.027 0.20 A 20 GLU H H 1 8.279 0.02 A 20 GLU HA H 1 4.280 0.02 A 20 GLU HBx H 1 1.904 0.02 A 20 GLU HBy H 1 2.049 0.02 A 20 GLU HG2 H 1 2.252 0.02 A 20 GLU HG3 H 1 2.252 0.02 A 20 GLU C C 13 176.129 0.20 A 20 GLU CA C 13 56.135 0.20 A 20 GLU CB C 13 30.302 0.20 A 20 GLU CG C 13 36.145 0.20 A 20 GLU N N 15 119.557 0.20 A 21 GLU H H 1 8.316 0.02 A 21 GLU HA H 1 4.590 0.02 A 21 GLU HBx H 1 1.909 0.02 A 21 GLU HBy H 1 2.043 0.02 A 21 GLU HG2 H 1 2.284 0.02 A 21 GLU HG3 H 1 2.284 0.02 A 21 GLU C C 13 174.495 0.20 A 21 GLU CA C 13 54.265 0.20 A 21 GLU CB C 13 29.716 0.20 A 21 GLU CG C 13 35.891 0.20 A 21 GLU N N 15 123.260 0.20 A 22 PRO HA H 1 4.418 0.02 A 22 PRO HBx H 1 1.927 0.02 A 22 PRO HBy H 1 2.284 0.02 A 22 PRO HDx H 1 3.703 0.02 A 22 PRO HDy H 1 3.804 0.02 A 22 PRO HG2 H 1 2.025 0.02 A 22 PRO HG3 H 1 2.025 0.02 A 22 PRO C C 13 177.141 0.20 A 22 PRO CA C 13 63.064 0.20 A 22 PRO CB C 13 32.002 0.20 A 22 PRO CD C 13 50.540 0.20 A 22 PRO CG C 13 27.339 0.20 A 23 LEU H H 1 8.406 0.02 A 23 LEU HA H 1 4.299 0.02 A 23 LEU HBx H 1 1.577 0.02 A 23 LEU HBy H 1 1.679 0.02 A 23 LEU HD1% H 1 0.927 0.02 A 23 LEU HD2% H 1 0.880 0.02 A 23 LEU HG H 1 1.687 0.02 A 23 LEU C C 13 177.794 0.20 A 23 LEU CA C 13 55.608 0.20 A 23 LEU CB C 13 42.110 0.20 A 23 LEU CD1 C 13 24.830 0.20 A 23 LEU CD2 C 13 23.547 0.20 A 23 LEU CG C 13 26.951 0.20 A 23 LEU N N 15 122.289 0.20 A 24 SER H H 1 8.384 0.02 A 24 SER HA H 1 4.450 0.02 A 24 SER HBx H 1 3.861 0.02 A 24 SER HBy H 1 3.951 0.02 A 24 SER C C 13 174.815 0.20 A 24 SER CA C 13 58.220 0.20 A 24 SER CB C 13 63.772 0.20 A 24 SER N N 15 116.217 0.20 A 25 LEU H H 1 8.195 0.02 A 25 LEU HA H 1 4.333 0.02 A 25 LEU HB2 H 1 1.619 0.02 A 25 LEU HB3 H 1 1.619 0.02 A 25 LEU HD1% H 1 0.934 0.02 A 25 LEU HD2% H 1 0.879 0.02 A 25 LEU HG H 1 1.620 0.02 A 25 LEU C C 13 177.762 0.20 A 25 LEU CA C 13 56.251 0.20 A 25 LEU CB C 13 41.872 0.20 A 25 LEU CD1 C 13 24.748 0.20 A 25 LEU CD2 C 13 23.661 0.20 A 25 LEU CG C 13 27.016 0.20 A 25 LEU N N 15 124.209 0.20 A 26 LEU H H 1 8.008 0.02 A 26 LEU HA H 1 4.221 0.02 A 26 LEU HBx H 1 1.626 0.02 A 26 LEU HBy H 1 1.669 0.02 A 26 LEU HD1% H 1 0.939 0.02 A 26 LEU HD2% H 1 0.877 0.02 A 26 LEU HG H 1 1.667 0.02 A 26 LEU C C 13 177.745 0.20 A 26 LEU CA C 13 56.219 0.20 A 26 LEU CB C 13 41.739 0.20 A 26 LEU CD1 C 13 24.705 0.20 A 26 LEU CD2 C 13 23.590 0.20 A 26 LEU CG C 13 27.010 0.20 A 26 LEU N N 15 120.147 0.20 A 27 ASP H H 1 8.037 0.02 A 27 ASP HA H 1 4.511 0.02 A 27 ASP HB2 H 1 2.704 0.02 A 27 ASP HB3 H 1 2.704 0.02 A 27 ASP C C 13 177.218 0.20 A 27 ASP CA C 13 55.834 0.20 A 27 ASP CB C 13 40.786 0.20 A 27 ASP N N 15 119.646 0.20 A 28 ASP H H 1 8.239 0.02 A 28 ASP HA H 1 4.578 0.02 A 28 ASP HB2 H 1 2.758 0.02 A 28 ASP HB3 H 1 2.758 0.02 A 28 ASP C C 13 178.403 0.20 A 28 ASP CA C 13 56.128 0.20 A 28 ASP CB C 13 41.104 0.20 A 28 ASP N N 15 120.845 0.20 A 29 MET H H 1 8.678 0.02 A 29 MET HA H 1 4.097 0.02 A 29 MET HBx H 1 2.588 0.02 A 29 MET HBy H 1 2.617 0.02 A 29 MET HE% H 1 2.151 0.02 A 29 MET HGx H 1 2.205 0.02 A 29 MET HGy H 1 2.240 0.02 A 29 MET C C 13 177.858 0.20 A 29 MET CA C 13 58.882 0.20 A 29 MET CB C 13 32.316 0.20 A 29 MET CE C 13 17.371 0.20 A 29 MET CG C 13 32.279 0.20 A 29 MET N N 15 121.781 0.20 A 30 ASN H H 1 8.616 0.02 A 30 ASN HA H 1 4.665 0.02 A 30 ASN HBx H 1 2.886 0.02 A 30 ASN HBy H 1 3.029 0.02 A 30 ASN HD2y H 1 7.955 0.02 A 30 ASN HD2x H 1 6.923 0.02 A 30 ASN C C 13 178.627 0.20 A 30 ASN CA C 13 56.540 0.20 A 30 ASN CB C 13 37.725 0.20 A 30 ASN N N 15 118.227 0.20 A 30 ASN ND2 N 15 113.261 0.20 A 31 HIS HA H 1 4.485 0.02 A 31 HIS HBx H 1 3.322 0.02 A 31 HIS HBy H 1 3.399 0.02 A 31 HIS HD2 H 1 7.064 0.02 A 31 HIS HE1 H 1 7.817 0.02 A 31 HIS C C 13 178.187 0.20 A 31 HIS CA C 13 59.653 0.20 A 31 HIS CB C 13 29.988 0.20 A 31 HIS CD2 C 13 120.535 0.20 A 31 HIS CE1 C 13 138.213 0.20 A 31 HIS ND1 N 15 219.395 0.20 A 31 HIS NE2 N 15 184.631 0.20 A 32 CYS H H 1 8.121 0.02 A 32 CYS HA H 1 3.951 0.02 A 32 CYS HB2 H 1 3.176 0.02 A 32 CYS HB3 H 1 2.356 0.02 A 32 CYS C C 13 177.250 0.20 A 32 CYS CA C 13 64.207 0.20 A 32 CYS CB C 13 27.688 0.20 A 32 CYS N N 15 117.571 0.20 A 33 TYR H H 1 8.425 0.02 A 33 TYR HA H 1 4.109 0.02 A 33 TYR HB2 H 1 3.043 0.02 A 33 TYR HB3 H 1 3.043 0.02 A 33 TYR HD1 H 1 7.123 0.02 A 33 TYR HD2 H 1 7.123 0.02 A 33 TYR HE1 H 1 6.746 0.02 A 33 TYR HE2 H 1 6.746 0.02 A 33 TYR C C 13 178.211 0.20 A 33 TYR CA C 13 63.910 0.20 A 33 TYR CB C 13 37.911 0.20 A 33 TYR CD1 C 13 132.124 0.20 A 33 TYR CD2 C 13 132.124 0.20 A 33 TYR CE1 C 13 118.457 0.20 A 33 TYR CE2 C 13 118.457 0.20 A 33 TYR N N 15 117.762 0.20 A 34 SER H H 1 8.257 0.02 A 34 SER HA H 1 4.169 0.02 A 34 SER HBx H 1 4.008 0.02 A 34 SER HBy H 1 4.055 0.02 A 34 SER C C 13 176.801 0.20 A 34 SER CA C 13 62.072 0.20 A 34 SER CB C 13 62.552 0.20 A 34 SER N N 15 115.203 0.20 A 35 ARG H H 1 7.972 0.02 A 35 ARG HA H 1 4.109 0.02 A 35 ARG HB2 H 1 1.820 0.02 A 35 ARG HB3 H 1 1.820 0.02 A 35 ARG HDx H 1 3.063 0.02 A 35 ARG HDy H 1 3.303 0.02 A 35 ARG HG2 H 1 1.573 0.02 A 35 ARG HG3 H 1 1.573 0.02 A 35 ARG C C 13 179.139 0.20 A 35 ARG CA C 13 58.067 0.20 A 35 ARG CB C 13 29.396 0.20 A 35 ARG CD C 13 42.878 0.20 A 35 ARG CG C 13 26.592 0.20 A 35 ARG N N 15 121.245 0.20 A 36 LEU H H 1 8.215 0.02 A 36 LEU HA H 1 3.912 0.02 A 36 LEU HB2 H 1 1.921 0.02 A 36 LEU HB3 H 1 1.191 0.02 A 36 LEU HD1% H 1 0.681 0.02 A 36 LEU HD2% H 1 0.793 0.02 A 36 LEU HG H 1 1.696 0.02 A 36 LEU C C 13 178.243 0.20 A 36 LEU CA C 13 58.261 0.20 A 36 LEU CB C 13 41.448 0.20 A 36 LEU CD1 C 13 25.817 0.20 A 36 LEU CD2 C 13 24.087 0.20 A 36 LEU CG C 13 26.477 0.20 A 36 LEU N N 15 118.620 0.20 A 37 ARG H H 1 8.064 0.02 A 37 ARG HA H 1 3.891 0.02 A 37 ARG HB2 H 1 2.073 0.02 A 37 ARG HB3 H 1 1.989 0.02 A 37 ARG HDy H 1 3.254 0.02 A 37 ARG HDx H 1 3.180 0.02 A 37 ARG HGx H 1 1.699 0.02 A 37 ARG HGy H 1 1.828 0.02 A 37 ARG C C 13 177.250 0.20 A 37 ARG CA C 13 58.835 0.20 A 37 ARG CB C 13 29.723 0.20 A 37 ARG CD C 13 43.429 0.20 A 37 ARG CG C 13 27.600 0.20 A 37 ARG N N 15 115.817 0.20 A 38 GLU H H 1 7.289 0.02 A 38 GLU HA H 1 4.187 0.02 A 38 GLU HB2 H 1 2.132 0.02 A 38 GLU HB3 H 1 2.180 0.02 A 38 GLU HGx H 1 2.331 0.02 A 38 GLU HGy H 1 2.484 0.02 A 38 GLU C C 13 177.698 0.20 A 38 GLU CA C 13 57.340 0.20 A 38 GLU CB C 13 30.061 0.20 A 38 GLU CG C 13 36.047 0.20 A 38 GLU N N 15 115.269 0.20 A 39 LEU H H 1 7.662 0.02 A 39 LEU HA H 1 4.263 0.02 A 39 LEU HB2 H 1 1.821 0.02 A 39 LEU HB3 H 1 1.527 0.02 A 39 LEU HD1% H 1 0.822 0.02 A 39 LEU HD2% H 1 0.894 0.02 A 39 LEU HG H 1 1.913 0.02 A 39 LEU C C 13 176.993 0.20 A 39 LEU CA C 13 55.829 0.20 A 39 LEU CB C 13 44.256 0.20 A 39 LEU CD1 C 13 26.300 0.20 A 39 LEU CD2 C 13 22.939 0.20 A 39 LEU CG C 13 26.432 0.20 A 39 LEU N N 15 118.203 0.20 A 40 VAL H H 1 7.214 0.02 A 40 VAL HA H 1 3.734 0.02 A 40 VAL HB H 1 1.943 0.02 A 40 VAL HG1% H 1 0.688 0.02 A 40 VAL HG2% H 1 0.892 0.02 A 40 VAL C C 13 173.438 0.20 A 40 VAL CA C 13 59.663 0.20 A 40 VAL CB C 13 31.773 0.20 A 40 VAL CG1 C 13 21.421 0.20 A 40 VAL CG2 C 13 21.462 0.20 A 40 VAL N N 15 117.697 0.20 A 41 PRO HA H 1 4.351 0.02 A 41 PRO HBx H 1 1.793 0.02 A 41 PRO HBy H 1 2.132 0.02 A 41 PRO HD2 H 1 2.741 0.02 A 41 PRO HD3 H 1 3.237 0.02 A 41 PRO HGx H 1 1.781 0.02 A 41 PRO HGy H 1 1.839 0.02 A 41 PRO CA C 13 62.861 0.20 A 41 PRO CB C 13 31.939 0.20 A 41 PRO CD C 13 50.226 0.20 A 41 PRO CG C 13 27.056 0.20 A 42 GLY H H 1 8.519 0.02 A 42 GLY HAx H 1 3.698 0.02 A 42 GLY HAy H 1 3.980 0.02 A 42 GLY C C 13 174.463 0.20 A 42 GLY CA C 13 45.859 0.20 A 42 GLY N N 15 107.397 0.20 A 43 VAL H H 1 7.653 0.02 A 43 VAL HA H 1 4.279 0.02 A 43 VAL HB H 1 2.109 0.02 A 43 VAL HG1% H 1 0.906 0.02 A 43 VAL HG2% H 1 0.820 0.02 A 43 VAL C C 13 174.207 0.20 A 43 VAL CA C 13 59.840 0.20 A 43 VAL CB C 13 32.285 0.20 A 43 VAL CG1 C 13 21.748 0.20 A 43 VAL CG2 C 13 21.521 0.20 A 43 VAL N N 15 120.952 0.20 A 44 PRO HA H 1 4.413 0.02 A 44 PRO HBx H 1 1.888 0.02 A 44 PRO HBy H 1 2.314 0.02 A 44 PRO HDx H 1 3.521 0.02 A 44 PRO HDy H 1 3.986 0.02 A 44 PRO HGx H 1 1.956 0.02 A 44 PRO HGy H 1 2.029 0.02 A 44 PRO CA C 13 62.996 0.20 A 44 PRO CB C 13 32.002 0.20 A 44 PRO CD C 13 51.094 0.20 A 44 PRO CG C 13 27.361 0.20 A 45 ARG HA H 1 4.212 0.02 A 45 ARG HB2 H 1 1.809 0.02 A 45 ARG HB3 H 1 1.809 0.02 A 45 ARG HD2 H 1 3.222 0.02 A 45 ARG HD3 H 1 3.222 0.02 A 45 ARG HGx H 1 1.669 0.02 A 45 ARG HGy H 1 1.752 0.02 A 45 ARG CA C 13 57.117 0.20 A 45 ARG CB C 13 30.286 0.20 A 45 ARG CD C 13 43.146 0.20 A 45 ARG CG C 13 27.251 0.20 A 46 GLY HAx H 1 3.840 0.02 A 46 GLY HAy H 1 4.061 0.02 A 46 GLY C C 13 174.515 0.20 A 46 GLY CA C 13 45.383 0.20 A 47 THR H H 1 7.450 0.02 A 47 THR HA H 1 4.257 0.02 A 47 THR HB H 1 3.984 0.02 A 47 THR HG2% H 1 1.115 0.02 A 47 THR C C 13 173.983 0.20 A 47 THR CA C 13 62.055 0.20 A 47 THR CB C 13 69.805 0.20 A 47 THR CG2 C 13 21.281 0.20 A 47 THR N N 15 114.462 0.20 A 48 GLN HA H 1 4.354 0.02 A 48 GLN HBy H 1 2.021 0.02 A 48 GLN HBx H 1 1.979 0.02 A 48 GLN HE2y H 1 7.474 0.02 A 48 GLN HE2x H 1 6.822 0.02 A 48 GLN HG2 H 1 2.319 0.02 A 48 GLN HG3 H 1 2.319 0.02 A 48 GLN C C 13 174.899 0.20 A 48 GLN CA C 13 55.563 0.20 A 48 GLN CB C 13 28.430 0.20 A 48 GLN CG C 13 33.512 0.20 A 48 GLN NE2 N 15 112.482 0.20 A 49 LEU H H 1 8.107 0.02 A 49 LEU HA H 1 4.650 0.02 A 49 LEU HB2 H 1 1.505 0.02 A 49 LEU HB3 H 1 1.505 0.02 A 49 LEU HD1% H 1 0.756 0.02 A 49 LEU HD2% H 1 0.785 0.02 A 49 LEU HG H 1 1.526 0.02 A 49 LEU C C 13 176.481 0.20 A 49 LEU CA C 13 53.728 0.20 A 49 LEU CB C 13 44.830 0.20 A 49 LEU CD1 C 13 26.137 0.20 A 49 LEU CD2 C 13 23.731 0.20 A 49 LEU CG C 13 26.732 0.20 A 49 LEU N N 15 125.002 0.20 A 50 SER H H 1 9.166 0.02 A 50 SER HA H 1 4.451 0.02 A 50 SER HBx H 1 3.986 0.02 A 50 SER HBy H 1 4.318 0.02 A 50 SER C C 13 174.431 0.20 A 50 SER CA C 13 56.939 0.20 A 50 SER CB C 13 64.870 0.20 A 50 SER N N 15 119.384 0.20 A 51 GLN H H 1 8.669 0.02 A 51 GLN HA H 1 3.604 0.02 A 51 GLN HBx H 1 1.671 0.02 A 51 GLN HBy H 1 1.896 0.02 A 51 GLN HE2y H 1 6.911 0.02 A 51 GLN HE2x H 1 6.699 0.02 A 51 GLN HGx H 1 1.297 0.02 A 51 GLN HGy H 1 2.176 0.02 A 51 GLN C C 13 178.114 0.20 A 51 GLN CA C 13 60.206 0.20 A 51 GLN CB C 13 27.662 0.20 A 51 GLN CG C 13 34.026 0.20 A 51 GLN N N 15 119.789 0.20 A 51 GLN NE2 N 15 110.380 0.20 A 52 VAL H H 1 8.076 0.02 A 52 VAL HA H 1 3.750 0.02 A 52 VAL HB H 1 1.998 0.02 A 52 VAL HG1% H 1 0.912 0.02 A 52 VAL HG2% H 1 1.041 0.02 A 52 VAL C C 13 176.673 0.20 A 52 VAL CA C 13 65.948 0.20 A 52 VAL CB C 13 31.600 0.20 A 52 VAL CG1 C 13 20.721 0.20 A 52 VAL CG2 C 13 23.383 0.20 A 52 VAL N N 15 116.659 0.20 A 53 GLU H H 1 7.454 0.02 A 53 GLU HA H 1 4.034 0.02 A 53 GLU HB2 H 1 2.292 0.02 A 53 GLU HB3 H 1 1.986 0.02 A 53 GLU HGx H 1 2.215 0.02 A 53 GLU HGy H 1 2.343 0.02 A 53 GLU C C 13 179.876 0.20 A 53 GLU CA C 13 59.216 0.20 A 53 GLU CB C 13 30.023 0.20 A 53 GLU CG C 13 37.891 0.20 A 53 GLU N N 15 120.433 0.20 A 54 ILE H H 1 8.127 0.02 A 54 ILE HA H 1 3.527 0.02 A 54 ILE HB H 1 2.150 0.02 A 54 ILE HD1% H 1 0.862 0.02 A 54 ILE HG1x H 1 0.776 0.02 A 54 ILE HG1y H 1 1.890 0.02 A 54 ILE HG2% H 1 0.927 0.02 A 54 ILE C C 13 177.442 0.20 A 54 ILE CA C 13 65.867 0.20 A 54 ILE CB C 13 37.769 0.20 A 54 ILE CD1 C 13 13.744 0.20 A 54 ILE CG1 C 13 30.276 0.20 A 54 ILE CG2 C 13 17.346 0.20 A 54 ILE N N 15 118.823 0.20 A 55 LEU H H 1 8.251 0.02 A 55 LEU HA H 1 3.902 0.02 A 55 LEU HB2 H 1 2.238 0.02 A 55 LEU HB3 H 1 1.047 0.02 A 55 LEU HD1% H 1 0.579 0.02 A 55 LEU HD2% H 1 0.580 0.02 A 55 LEU HG H 1 2.163 0.02 A 55 LEU C C 13 179.075 0.20 A 55 LEU CA C 13 58.237 0.20 A 55 LEU CB C 13 40.879 0.20 A 55 LEU CD1 C 13 25.750 0.20 A 55 LEU CD2 C 13 21.340 0.20 A 55 LEU CG C 13 25.831 0.20 A 55 LEU N N 15 117.279 0.20 A 56 GLN H H 1 8.700 0.02 A 56 GLN HA H 1 3.935 0.02 A 56 GLN HBx H 1 2.025 0.02 A 56 GLN HBy H 1 2.267 0.02 A 56 GLN HE2y H 1 7.320 0.02 A 56 GLN HE2x H 1 6.594 0.02 A 56 GLN HGy H 1 2.614 0.02 A 56 GLN HGx H 1 2.313 0.02 A 56 GLN C C 13 178.595 0.20 A 56 GLN CA C 13 59.226 0.20 A 56 GLN CB C 13 27.953 0.20 A 56 GLN CG C 13 34.142 0.20 A 56 GLN N N 15 117.833 0.20 A 56 GLN NE2 N 15 111.668 0.20 A 57 ARG H H 1 7.918 0.02 A 57 ARG HA H 1 4.219 0.02 A 57 ARG HBx H 1 1.840 0.02 A 57 ARG HBy H 1 1.998 0.02 A 57 ARG HDx H 1 3.039 0.02 A 57 ARG HDy H 1 3.178 0.02 A 57 ARG HGx H 1 1.809 0.02 A 57 ARG HGy H 1 1.852 0.02 A 57 ARG C C 13 179.812 0.20 A 57 ARG CA C 13 58.494 0.20 A 57 ARG CB C 13 29.662 0.20 A 57 ARG CD C 13 43.139 0.20 A 57 ARG CG C 13 28.190 0.20 A 57 ARG N N 15 117.804 0.20 A 58 VAL H H 1 8.500 0.02 A 58 VAL HA H 1 3.673 0.02 A 58 VAL HB H 1 2.453 0.02 A 58 VAL HG1% H 1 0.970 0.02 A 58 VAL HG2% H 1 1.079 0.02 A 58 VAL C C 13 176.897 0.20 A 58 VAL CA C 13 66.837 0.20 A 58 VAL CB C 13 31.155 0.20 A 58 VAL CG1 C 13 22.781 0.20 A 58 VAL CG2 C 13 24.726 0.20 A 58 VAL N N 15 121.835 0.20 A 59 ILE H H 1 8.334 0.02 A 59 ILE HA H 1 3.328 0.02 A 59 ILE HB H 1 1.949 0.02 A 59 ILE HD1% H 1 0.913 0.02 A 59 ILE HG1x H 1 0.605 0.02 A 59 ILE HG1y H 1 1.835 0.02 A 59 ILE HG2% H 1 0.843 0.02 A 59 ILE C C 13 176.641 0.20 A 59 ILE CA C 13 66.452 0.20 A 59 ILE CB C 13 38.065 0.20 A 59 ILE CD1 C 13 14.349 0.20 A 59 ILE CG1 C 13 31.459 0.20 A 59 ILE CG2 C 13 16.823 0.20 A 59 ILE N N 15 121.048 0.20 A 60 ASP H H 1 7.824 0.02 A 60 ASP HA H 1 4.354 0.02 A 60 ASP HB2 H 1 2.706 0.02 A 60 ASP HB3 H 1 2.706 0.02 A 60 ASP C C 13 178.307 0.20 A 60 ASP CA C 13 57.561 0.20 A 60 ASP CB C 13 40.358 0.20 A 60 ASP N N 15 117.165 0.20 A 61 TYR H H 1 7.998 0.02 A 61 TYR HA H 1 4.619 0.02 A 61 TYR HBx H 1 3.195 0.02 A 61 TYR HBy H 1 3.276 0.02 A 61 TYR HD1 H 1 7.116 0.02 A 61 TYR HD2 H 1 7.116 0.02 A 61 TYR HE1 H 1 6.749 0.02 A 61 TYR HE2 H 1 6.749 0.02 A 61 TYR C C 13 176.993 0.20 A 61 TYR CA C 13 59.333 0.20 A 61 TYR CB C 13 38.843 0.20 A 61 TYR CD1 C 13 132.431 0.20 A 61 TYR CD2 C 13 132.431 0.20 A 61 TYR CE1 C 13 118.193 0.20 A 61 TYR CE2 C 13 118.193 0.20 A 61 TYR N N 15 120.419 0.20 A 62 ILE H H 1 8.458 0.02 A 62 ILE HA H 1 3.297 0.02 A 62 ILE HB H 1 1.972 0.02 A 62 ILE HD1% H 1 0.821 0.02 A 62 ILE HG1x H 1 0.904 0.02 A 62 ILE HG1y H 1 1.954 0.02 A 62 ILE HG2% H 1 0.922 0.02 A 62 ILE C C 13 178.403 0.20 A 62 ILE CA C 13 65.801 0.20 A 62 ILE CB C 13 37.379 0.20 A 62 ILE CD1 C 13 14.104 0.20 A 62 ILE CG1 C 13 29.381 0.20 A 62 ILE CG2 C 13 18.571 0.20 A 62 ILE N N 15 118.460 0.20 A 63 LEU H H 1 8.318 0.02 A 63 LEU HA H 1 3.994 0.02 A 63 LEU HB2 H 1 1.968 0.02 A 63 LEU HB3 H 1 1.407 0.02 A 63 LEU HD1% H 1 0.884 0.02 A 63 LEU HD2% H 1 0.870 0.02 A 63 LEU HG H 1 1.870 0.02 A 63 LEU C C 13 180.100 0.20 A 63 LEU CA C 13 58.042 0.20 A 63 LEU CB C 13 41.222 0.20 A 63 LEU CD1 C 13 25.975 0.20 A 63 LEU CD2 C 13 23.205 0.20 A 63 LEU CG C 13 26.465 0.20 A 63 LEU N N 15 118.472 0.20 A 64 ASP H H 1 7.826 0.02 A 64 ASP HA H 1 4.523 0.02 A 64 ASP HBx H 1 2.730 0.02 A 64 ASP HBy H 1 2.963 0.02 A 64 ASP C C 13 178.435 0.20 A 64 ASP CA C 13 56.735 0.20 A 64 ASP CB C 13 40.883 0.20 A 64 ASP N N 15 119.683 0.20 A 65 LEU H H 1 7.888 0.02 A 65 LEU HA H 1 4.094 0.02 A 65 LEU HB2 H 1 1.715 0.02 A 65 LEU HB3 H 1 1.332 0.02 A 65 LEU HD1% H 1 0.337 0.02 A 65 LEU HD2% H 1 0.671 0.02 A 65 LEU HG H 1 1.357 0.02 A 65 LEU C C 13 178.544 0.20 A 65 LEU CA C 13 56.127 0.20 A 65 LEU CB C 13 42.786 0.20 A 65 LEU CD1 C 13 25.190 0.20 A 65 LEU CD2 C 13 22.510 0.20 A 65 LEU CG C 13 26.312 0.20 A 65 LEU N N 15 119.551 0.20 A 66 GLN H H 1 7.767 0.02 A 66 GLN HA H 1 4.194 0.02 A 66 GLN HBx H 1 2.098 0.02 A 66 GLN HBy H 1 2.150 0.02 A 66 GLN HE2y H 1 7.444 0.02 A 66 GLN HE2x H 1 6.687 0.02 A 66 GLN HGx H 1 2.419 0.02 A 66 GLN HGy H 1 2.708 0.02 A 66 GLN C C 13 176.065 0.20 A 66 GLN CA C 13 56.408 0.20 A 66 GLN CB C 13 28.817 0.20 A 66 GLN CG C 13 34.059 0.20 A 66 GLN N N 15 116.843 0.20 A 66 GLN NE2 N 15 109.589 0.20 A 67 VAL H H 1 7.675 0.02 A 67 VAL HA H 1 4.110 0.02 A 67 VAL HB H 1 2.182 0.02 A 67 VAL HG1% H 1 0.964 0.02 A 67 VAL HG2% H 1 1.047 0.02 A 67 VAL C C 13 175.360 0.20 A 67 VAL CA C 13 62.891 0.20 A 67 VAL CB C 13 32.208 0.20 A 67 VAL CG1 C 13 21.199 0.20 A 67 VAL CG2 C 13 20.818 0.20 A 67 VAL N N 15 120.428 0.20 A 68 VAL H H 1 7.671 0.02 A 68 VAL HA H 1 4.049 0.02 A 68 VAL HB H 1 2.072 0.02 A 68 VAL HG1% H 1 0.937 0.02 A 68 VAL HG2% H 1 0.923 0.02 A 68 VAL C C 13 181.061 0.20 A 68 VAL CA C 13 63.735 0.20 A 68 VAL CB C 13 33.065 0.20 A 68 VAL CG1 C 13 21.502 0.20 A 68 VAL CG2 C 13 20.265 0.20 A 68 VAL N N 15 128.306 0.20 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 18 ALA H A 18 ALA HB% 1.0 0.0 4.23 2 2 B 18 ALA H B 18 ALA HB1 1.0 0.0 4.23 3 3 A 18 ALA HB% A 19 ALA H 1.0 0.0 4.16 4 4 B 18 ALA HB1 B 19 ALA H 1.0 0.0 4.16 5 5 A 19 ALA HA A 20 GLU H 1.0 0.0 3.59 6 6 B 19 ALA HA B 20 GLU H 1.0 0.0 3.59 7 7 A 20 GLU H A 20 GLU HG2 1.0 0.0 4.62 8 7 A 20 GLU H A 20 GLU HG3 1.0 0.0 4.62 9 8 B 20 GLU H B 20 GLU HGx 1.0 0.0 4.62 10 8 B 20 GLU H B 20 GLU HGy 1.0 0.0 4.62 11 9 A 20 GLU H A 19 ALA HB% 1.0 0.0 4.39 12 10 B 20 GLU H B 19 ALA HB1 1.0 0.0 4.39 13 11 A 20 GLU HA A 21 GLU H 1.0 0.0 3.31 14 12 B 20 GLU HA B 21 GLU H 1.0 0.0 3.31 15 13 A 21 GLU H A 21 GLU HG2 1.0 0.0 4.51 16 13 A 21 GLU H A 21 GLU HG3 1.0 0.0 4.51 17 14 B 21 GLU H B 21 GLU HGx 1.0 0.0 4.51 18 14 B 21 GLU H B 21 GLU HGy 1.0 0.0 4.51 19 15 A 21 GLU H A 20 GLU HBy 1.0 0.0 4.44 20 16 B 21 GLU H B 20 GLU HBy 1.0 0.0 4.44 21 17 A 21 GLU H A 20 GLU HBx 1.0 0.0 4.44 22 18 B 21 GLU H B 20 GLU HBx 1.0 0.0 4.44 23 19 A 22 PRO HA A 23 LEU H 1.0 0.0 3.08 24 20 B 22 PRO HA B 23 LEU H 1.0 0.0 3.08 25 21 A 23 LEU H A 22 PRO HBy 1.0 0.0 4.61 26 22 B 23 LEU H B 22 PRO HBy 1.0 0.0 4.61 27 23 A 23 LEU H A 22 PRO HBx 1.0 0.0 4.61 28 24 B 23 LEU H B 22 PRO HBx 1.0 0.0 4.61 29 25 A 23 LEU H A 23 LEU HG 1.0 0.0 3.21 30 26 B 23 LEU H B 23 LEU HG 1.0 0.0 3.21 31 27 A 23 LEU H A 23 LEU HD1% 1.0 0.0 4.66 32 28 B 23 LEU H B 23 LEU HD11 1.0 0.0 4.66 33 29 A 23 LEU H A 23 LEU HD2% 1.0 0.0 5.11 34 30 B 23 LEU H B 23 LEU HD21 1.0 0.0 5.11 35 31 A 25 LEU H A 25 LEU HB2 1.0 0.0 3.86 36 31 A 25 LEU H A 25 LEU HB3 1.0 0.0 3.86 37 32 B 25 LEU H B 25 LEU HBx 1.0 0.0 3.86 38 32 B 25 LEU H B 25 LEU HBy 1.0 0.0 3.86 39 33 A 61 TYR H A 62 ILE H 1.0 0.0 3.70 40 34 B 61 TYR H B 62 ILE H 1.0 0.0 3.70 41 35 A 61 TYR H A 60 ASP H 1.0 0.0 3.64 42 36 B 61 TYR H B 60 ASP H 1.0 0.0 3.64 43 37 A 61 TYR H A 61 TYR HBy 1.0 0.0 3.51 44 38 B 61 TYR H B 61 TYR HBy 1.0 0.0 3.51 45 39 A 61 TYR H A 60 ASP HB2 1.0 0.0 3.76 46 39 A 61 TYR H A 60 ASP HB3 1.0 0.0 3.76 47 40 B 61 TYR H B 60 ASP HBx 1.0 0.0 3.76 48 40 B 61 TYR H B 60 ASP HBy 1.0 0.0 3.76 49 41 A 26 LEU H A 25 LEU HB2 1.0 0.0 3.86 50 41 A 25 LEU HB3 A 26 LEU H 1.0 0.0 3.86 51 42 B 26 LEU H B 25 LEU HBx 1.0 0.0 3.86 52 42 B 25 LEU HBy B 26 LEU H 1.0 0.0 3.86 53 43 A 27 ASP H A 27 ASP HB2 1.0 0.0 3.56 54 43 A 27 ASP H A 27 ASP HB3 1.0 0.0 3.56 55 44 B 27 ASP H B 27 ASP HBx 1.0 0.0 3.56 56 44 B 27 ASP H B 27 ASP HBy 1.0 0.0 3.56 57 45 A 27 ASP H A 26 LEU HBx 1.0 0.0 4.64 58 46 B 27 ASP H B 26 LEU HBx 1.0 0.0 4.64 59 47 A 28 ASP H A 28 ASP HB2 1.0 0.0 3.38 60 47 A 28 ASP H A 28 ASP HB3 1.0 0.0 3.38 61 48 B 28 ASP H B 28 ASP HBx 1.0 0.0 3.38 62 48 B 28 ASP H B 28 ASP HBy 1.0 0.0 3.38 63 49 A 29 MET H A 28 ASP HB2 1.0 0.0 4.66 64 49 A 28 ASP HB3 A 29 MET H 1.0 0.0 4.66 65 50 B 29 MET H B 28 ASP HBx 1.0 0.0 4.66 66 50 B 28 ASP HBy B 29 MET H 1.0 0.0 4.66 67 51 A 29 MET H A 29 MET HGx 1.0 0.0 5.05 68 52 B 29 MET H B 29 MET HGx 1.0 0.0 5.05 69 53 A 27 ASP HA A 30 ASN H 1.0 0.0 4.60 70 54 B 27 ASP HA B 30 ASN H 1.0 0.0 4.60 71 55 A 30 ASN H A 30 ASN HBy 1.0 0.0 4.17 72 56 B 30 ASN H B 30 ASN HBy 1.0 0.0 4.17 73 57 A 30 ASN H A 30 ASN HBx 1.0 0.0 4.17 74 58 B 30 ASN H B 30 ASN HBx 1.0 0.0 4.17 75 59 A 32 CYS H A 33 TYR H 1.0 0.0 3.85 76 60 B 32 CYS H B 33 TYR H 1.0 0.0 3.85 77 61 A 32 CYS H A 29 MET HA 1.0 0.0 4.58 78 62 B 32 CYS H B 29 MET HA 1.0 0.0 4.58 79 63 A 32 CYS H A 31 HIS HBy 1.0 0.0 4.42 80 64 B 32 CYS H B 31 HIS HBy 1.0 0.0 4.42 81 65 A 32 CYS H A 32 CYS HB2 1.0 0.0 3.99 82 66 B 32 CYS H B 32 CYS HBx 1.0 0.0 3.99 83 67 A 32 CYS H A 32 CYS HB3 1.0 0.0 4.20 84 68 B 32 CYS H B 32 CYS HBy 1.0 0.0 4.20 85 69 A 33 TYR H A 33 TYR HD% 1.0 0.0 4.12 86 70 B 33 TYR H B 33 TYR HD% 1.0 0.0 4.12 87 71 A 33 TYR H A 33 TYR HB2 1.0 0.0 3.56 88 71 A 33 TYR H A 33 TYR HB3 1.0 0.0 3.56 89 72 B 33 TYR H B 33 TYR HBx 1.0 0.0 3.56 90 72 B 33 TYR H B 33 TYR HBy 1.0 0.0 3.56 91 73 A 33 TYR H A 34 SER H 1.0 0.0 3.68 92 74 B 33 TYR H B 34 SER H 1.0 0.0 3.68 93 75 A 34 SER H A 35 ARG H 1.0 0.0 3.63 94 76 B 34 SER H B 35 ARG H 1.0 0.0 3.63 95 77 A 34 SER H A 34 SER HBx 1.0 0.0 4.01 96 78 B 34 SER H B 34 SER HBx 1.0 0.0 4.01 97 79 A 34 SER H A 33 TYR HB2 1.0 0.0 3.79 98 79 A 33 TYR HB3 A 34 SER H 1.0 0.0 3.79 99 80 B 34 SER H B 33 TYR HBx 1.0 0.0 3.79 100 80 B 33 TYR HBy B 34 SER H 1.0 0.0 3.79 101 81 A 35 ARG H A 36 LEU H 1.0 0.0 3.85 102 82 B 35 ARG H B 36 LEU H 1.0 0.0 3.85 103 83 A 35 ARG H A 33 TYR HB2 1.0 0.0 5.83 104 83 A 33 TYR HB3 A 35 ARG H 1.0 0.0 5.83 105 84 B 35 ARG H B 33 TYR HBx 1.0 0.0 5.83 106 84 B 33 TYR HBy B 35 ARG H 1.0 0.0 5.83 107 85 A 35 ARG H A 35 ARG HB2 1.0 0.0 3.38 108 85 A 35 ARG H A 35 ARG HB3 1.0 0.0 3.38 109 86 B 35 ARG H B 35 ARG HBx 1.0 0.0 3.38 110 86 B 35 ARG H B 35 ARG HBy 1.0 0.0 3.38 111 87 A 35 ARG H A 35 ARG HG2 1.0 0.0 3.73 112 87 A 35 ARG H A 35 ARG HG3 1.0 0.0 3.73 113 88 B 35 ARG H B 35 ARG HGx 1.0 0.0 3.73 114 88 B 35 ARG H B 35 ARG HGy 1.0 0.0 3.73 115 89 B 35 ARG H A 59 ILE HD1% 1.0 0.0 4.60 116 90 A 35 ARG H B 59 ILE HD11 1.0 0.0 4.60 117 91 A 36 LEU H A 33 TYR HA 1.0 0.0 4.20 118 92 B 36 LEU H B 33 TYR HA 1.0 0.0 4.20 119 93 A 36 LEU H A 36 LEU HB2 1.0 0.0 3.57 120 94 B 36 LEU H B 36 LEU HBx 1.0 0.0 3.57 121 95 A 36 LEU H A 36 LEU HG 1.0 0.0 3.68 122 96 B 36 LEU H B 36 LEU HG 1.0 0.0 3.68 123 97 A 36 LEU H A 36 LEU HB3 1.0 0.0 4.11 124 98 B 36 LEU H B 36 LEU HBy 1.0 0.0 4.11 125 99 B 36 LEU H A 59 ILE HD1% 1.0 0.0 4.21 126 100 A 36 LEU H B 59 ILE HD11 1.0 0.0 4.21 127 101 A 36 LEU H A 36 LEU HD2% 1.0 0.0 4.37 128 102 B 36 LEU H B 36 LEU HD21 1.0 0.0 4.37 129 103 A 36 LEU H A 36 LEU HD1% 1.0 0.0 4.22 130 104 B 36 LEU H B 36 LEU HD11 1.0 0.0 4.22 131 105 A 34 SER HA A 37 ARG H 1.0 0.0 4.14 132 106 B 34 SER HA B 37 ARG H 1.0 0.0 4.14 133 107 A 36 LEU HB2 A 37 ARG H 1.0 0.0 3.65 134 108 B 36 LEU HBx B 37 ARG H 1.0 0.0 3.65 135 109 A 36 LEU HG A 37 ARG H 1.0 0.0 5.46 136 110 B 36 LEU HG B 37 ARG H 1.0 0.0 5.46 137 111 A 36 LEU HB3 A 37 ARG H 1.0 0.0 4.55 138 112 B 36 LEU HBy B 37 ARG H 1.0 0.0 4.55 139 113 A 37 ARG H A 40 VAL HG2% 1.0 0.0 4.90 140 114 B 37 ARG H B 40 VAL HG21 1.0 0.0 4.90 141 115 A 37 ARG H A 54 ILE HG2% 1.0 0.0 5.10 142 116 B 37 ARG H B 54 ILE HG21 1.0 0.0 5.10 143 117 A 36 LEU HD2% A 37 ARG H 1.0 0.0 4.80 144 118 B 36 LEU HD21 B 37 ARG H 1.0 0.0 4.80 145 119 A 37 ARG H A 38 GLU H 1.0 0.0 3.64 146 120 B 37 ARG H B 38 GLU H 1.0 0.0 3.64 147 121 A 38 GLU H A 39 LEU H 1.0 0.0 3.35 148 122 B 38 GLU H B 39 LEU H 1.0 0.0 3.35 149 123 A 38 GLU H A 36 LEU HA 1.0 0.0 4.78 150 124 B 38 GLU H B 36 LEU HA 1.0 0.0 4.78 151 125 A 38 GLU H A 38 GLU HGy 1.0 0.0 3.99 152 126 B 38 GLU H B 38 GLU HGy 1.0 0.0 3.99 153 127 A 38 GLU H A 38 GLU HGx 1.0 0.0 3.99 154 128 B 38 GLU H B 38 GLU HGx 1.0 0.0 3.99 155 129 A 38 GLU H A 38 GLU HB2 1.0 0.0 3.35 156 130 B 38 GLU H B 38 GLU HBx 1.0 0.0 3.35 157 131 A 38 GLU H A 37 ARG HB3 1.0 0.0 4.14 158 132 B 38 GLU H B 37 ARG HBy 1.0 0.0 4.14 159 133 A 38 GLU H A 35 ARG HB2 1.0 0.0 5.46 160 133 A 35 ARG HB3 A 38 GLU H 1.0 0.0 5.46 161 134 B 38 GLU H B 35 ARG HBx 1.0 0.0 5.46 162 134 B 35 ARG HBy B 38 GLU H 1.0 0.0 5.46 163 135 A 38 GLU H A 39 LEU HB2 1.0 0.0 5.79 164 136 B 38 GLU H B 39 LEU HBx 1.0 0.0 5.79 165 137 A 40 VAL HG2% A 38 GLU H 1.0 0.0 4.47 166 138 B 40 VAL HG21 B 38 GLU H 1.0 0.0 4.47 167 139 A 39 LEU H A 36 LEU HA 1.0 0.0 4.40 168 140 B 39 LEU H B 36 LEU HA 1.0 0.0 4.40 169 141 A 39 LEU H A 37 ARG HA 1.0 0.0 4.91 170 142 B 39 LEU H B 37 ARG HA 1.0 0.0 4.91 171 143 A 39 LEU H A 38 GLU HB2 1.0 0.0 3.99 172 144 B 39 LEU H B 38 GLU HBx 1.0 0.0 3.99 173 145 A 39 LEU H A 39 LEU HG 1.0 0.0 3.58 174 146 B 39 LEU H B 39 LEU HG 1.0 0.0 3.58 175 147 A 39 LEU H A 39 LEU HB3 1.0 0.0 3.95 176 148 B 39 LEU H B 39 LEU HBy 1.0 0.0 3.95 177 149 A 40 VAL HG2% A 39 LEU H 1.0 0.0 3.80 178 150 B 40 VAL HG21 B 39 LEU H 1.0 0.0 3.80 179 151 A 39 LEU H A 40 VAL H 1.0 0.0 3.35 180 152 B 39 LEU H B 40 VAL H 1.0 0.0 3.35 181 153 A 37 ARG HA A 40 VAL H 1.0 0.0 4.26 182 154 B 37 ARG HA B 40 VAL H 1.0 0.0 4.26 183 155 A 40 VAL H A 41 PRO HD3 1.0 0.0 4.67 184 156 B 40 VAL H B 41 PRO HDy 1.0 0.0 4.67 185 157 A 40 VAL H A 40 VAL HB 1.0 0.0 3.31 186 158 B 40 VAL H B 40 VAL HB 1.0 0.0 3.31 187 159 A 39 LEU HB3 A 40 VAL H 1.0 0.0 4.33 188 160 B 39 LEU HBy B 40 VAL H 1.0 0.0 4.33 189 161 A 40 VAL HG2% A 40 VAL H 1.0 0.0 3.32 190 162 B 40 VAL HG21 B 40 VAL H 1.0 0.0 3.32 191 163 A 43 VAL H A 43 VAL HB 1.0 0.0 3.31 192 164 B 43 VAL H B 43 VAL HB 1.0 0.0 3.31 193 165 A 43 VAL H A 43 VAL HG2% 1.0 0.0 3.32 194 166 B 43 VAL H B 43 VAL HG21 1.0 0.0 3.32 195 167 A 43 VAL H A 40 VAL HG1% 1.0 0.0 4.60 196 168 B 43 VAL H B 40 VAL HG11 1.0 0.0 4.60 197 169 A 49 LEU H A 49 LEU HB2 1.0 0.0 4.38 198 169 A 49 LEU H A 49 LEU HB3 1.0 0.0 4.38 199 170 B 49 LEU H B 49 LEU HBx 1.0 0.0 4.38 200 170 B 49 LEU H B 49 LEU HBy 1.0 0.0 4.38 201 171 A 49 LEU H A 49 LEU HG 1.0 0.0 4.66 202 172 B 49 LEU H B 49 LEU HG 1.0 0.0 4.66 203 173 A 49 LEU HA A 50 SER H 1.0 0.0 3.41 204 174 B 49 LEU HA B 50 SER H 1.0 0.0 3.41 205 175 A 50 SER H A 53 GLU HB2 1.0 0.0 4.01 206 176 B 50 SER H B 53 GLU HBx 1.0 0.0 4.01 207 177 A 50 SER H A 53 GLU HB3 1.0 0.0 4.47 208 178 B 50 SER H B 53 GLU HBy 1.0 0.0 4.47 209 179 A 50 SER H A 49 LEU HB2 1.0 0.0 4.05 210 179 A 49 LEU HB3 A 50 SER H 1.0 0.0 4.05 211 180 B 50 SER H B 49 LEU HBx 1.0 0.0 4.05 212 180 B 49 LEU HBy B 50 SER H 1.0 0.0 4.05 213 181 A 51 GLN H A 50 SER HBy 1.0 0.0 4.69 214 182 B 51 GLN H B 50 SER HBy 1.0 0.0 4.69 215 183 A 51 GLN H A 50 SER HBx 1.0 0.0 4.69 216 184 B 51 GLN H B 50 SER HBx 1.0 0.0 4.69 217 185 A 51 GLN H A 51 GLN HGy 1.0 0.0 4.76 218 186 B 51 GLN H B 51 GLN HGy 1.0 0.0 4.76 219 187 A 29 MET HE% B 51 GLN HE2y 1.0 0.0 4.95 220 188 A 51 GLN HE2x B 29 MET HE1 1.0 0.0 4.95 221 189 A 51 GLN H A 52 VAL H 1.0 0.0 4.24 222 190 B 51 GLN H B 52 VAL H 1.0 0.0 4.24 223 191 A 52 VAL H A 52 VAL HB 1.0 0.0 3.31 224 192 B 52 VAL H B 52 VAL HB 1.0 0.0 3.31 225 193 A 52 VAL H A 51 GLN HBx 1.0 0.0 4.54 226 194 B 52 VAL H B 51 GLN HBx 1.0 0.0 4.54 227 195 A 52 VAL H A 53 GLU H 1.0 0.0 3.64 228 196 B 52 VAL H B 53 GLU H 1.0 0.0 3.64 229 197 A 53 GLU HB2 A 53 GLU H 1.0 0.0 4.04 230 198 B 53 GLU HBx B 53 GLU H 1.0 0.0 4.04 231 199 A 53 GLU H A 53 GLU HGy 1.0 0.0 4.51 232 200 B 53 GLU H B 53 GLU HGy 1.0 0.0 4.51 233 201 A 52 VAL HB A 53 GLU H 1.0 0.0 3.80 234 202 B 52 VAL HB B 53 GLU H 1.0 0.0 3.80 235 203 A 53 GLU HB3 A 53 GLU H 1.0 0.0 4.09 236 204 B 53 GLU HBy B 53 GLU H 1.0 0.0 4.09 237 205 A 53 GLU H A 54 ILE H 1.0 0.0 3.79 238 206 B 53 GLU H B 54 ILE H 1.0 0.0 3.79 239 207 A 54 ILE H A 54 ILE HB 1.0 0.0 3.49 240 208 B 54 ILE H B 54 ILE HB 1.0 0.0 3.49 241 209 A 54 ILE H A 54 ILE HG1y 1.0 0.0 3.91 242 210 B 54 ILE H B 54 ILE HG1y 1.0 0.0 3.91 243 211 A 54 ILE H A 49 LEU HB2 1.0 0.0 4.71 244 211 A 49 LEU HB3 A 54 ILE H 1.0 0.0 4.71 245 212 B 54 ILE H B 49 LEU HBx 1.0 0.0 4.71 246 212 B 49 LEU HBy B 54 ILE H 1.0 0.0 4.71 247 213 A 54 ILE H A 54 ILE HG1x 1.0 0.0 3.91 248 214 B 54 ILE H B 54 ILE HG1x 1.0 0.0 3.91 249 215 A 52 VAL HA A 55 LEU H 1.0 0.0 4.26 250 216 B 52 VAL HA B 55 LEU H 1.0 0.0 4.26 251 217 A 54 ILE HB A 55 LEU H 1.0 0.0 3.60 252 218 B 54 ILE HB B 55 LEU H 1.0 0.0 3.60 253 219 A 55 LEU H A 55 LEU HG 1.0 0.0 3.77 254 220 B 55 LEU H B 55 LEU HG 1.0 0.0 3.77 255 221 A 55 LEU H A 55 LEU HB3 1.0 0.0 4.20 256 222 B 55 LEU H B 55 LEU HBy 1.0 0.0 4.20 257 223 A 54 ILE HG2% A 55 LEU H 1.0 0.0 4.07 258 224 B 54 ILE HG21 B 55 LEU H 1.0 0.0 4.07 259 225 A 56 GLN HE2y A 56 GLN HGy 1.0 0.0 4.22 260 226 B 56 GLN HE2x B 56 GLN HGx 1.0 0.0 4.22 261 227 A 56 GLN HE2y A 56 GLN HGx 1.0 0.0 4.22 262 228 B 56 GLN HE2x B 56 GLN HGy 1.0 0.0 4.22 263 229 A 56 GLN HE2y A 52 VAL HG1% 1.0 0.0 4.22 264 230 B 56 GLN HE2x B 52 VAL HG11 1.0 0.0 4.22 265 231 A 55 LEU H A 56 GLN H 1.0 0.0 3.85 266 232 B 55 LEU H B 56 GLN H 1.0 0.0 3.85 267 233 A 56 GLN H A 57 ARG H 1.0 0.0 3.83 268 234 B 56 GLN H B 57 ARG H 1.0 0.0 3.83 269 235 A 52 VAL HA A 56 GLN H 1.0 0.0 4.68 270 236 B 52 VAL HA B 56 GLN H 1.0 0.0 4.68 271 237 A 56 GLN H A 56 GLN HGy 1.0 0.0 4.34 272 238 B 56 GLN H B 56 GLN HGx 1.0 0.0 4.34 273 239 A 56 GLN H A 55 LEU HB2 1.0 0.0 4.02 274 240 B 56 GLN H B 55 LEU HBx 1.0 0.0 4.02 275 241 A 56 GLN H A 56 GLN HBx 1.0 0.0 4.21 276 242 B 56 GLN H B 56 GLN HBx 1.0 0.0 4.21 277 243 A 55 LEU HB3 A 56 GLN H 1.0 0.0 4.44 278 244 B 55 LEU HBy B 56 GLN H 1.0 0.0 4.44 279 245 A 52 VAL HG1% A 56 GLN H 1.0 0.0 4.43 280 246 B 52 VAL HG11 B 56 GLN H 1.0 0.0 4.43 281 247 A 56 GLN HE2x A 56 GLN HGy 1.0 0.0 4.22 282 248 B 56 GLN HE2y B 56 GLN HGx 1.0 0.0 4.22 283 249 A 56 GLN HE2x A 56 GLN HGx 1.0 0.0 4.22 284 250 B 56 GLN HE2y B 56 GLN HGy 1.0 0.0 4.22 285 251 A 52 VAL HG1% A 56 GLN HE2x 1.0 0.0 4.22 286 252 B 52 VAL HG11 B 56 GLN HE2y 1.0 0.0 4.22 287 253 A 57 ARG H A 58 VAL H 1.0 0.0 3.70 288 254 B 57 ARG H B 58 VAL H 1.0 0.0 3.70 289 255 A 57 ARG H A 54 ILE HA 1.0 0.0 4.46 290 256 B 57 ARG H B 54 ILE HA 1.0 0.0 4.46 291 257 A 57 ARG H A 56 GLN HBy 1.0 0.0 4.04 292 258 B 57 ARG H B 56 GLN HBy 1.0 0.0 4.04 293 259 A 57 ARG H A 56 GLN HBx 1.0 0.0 4.04 294 260 B 57 ARG H B 56 GLN HBx 1.0 0.0 4.04 295 261 A 57 ARG H A 57 ARG HBy 1.0 0.0 4.00 296 262 B 57 ARG H B 57 ARG HBy 1.0 0.0 4.00 297 263 A 57 ARG H A 57 ARG HBx 1.0 0.0 4.00 298 264 B 57 ARG H B 57 ARG HBx 1.0 0.0 4.00 299 265 A 58 VAL H A 59 ILE H 1.0 0.0 3.81 300 266 B 58 VAL H B 59 ILE H 1.0 0.0 3.81 301 267 A 58 VAL H A 55 LEU HA 1.0 0.0 4.29 302 268 B 58 VAL H B 55 LEU HA 1.0 0.0 4.29 303 269 A 58 VAL H A 58 VAL HB 1.0 0.0 3.54 304 270 B 58 VAL H B 58 VAL HB 1.0 0.0 3.54 305 271 A 58 VAL H A 57 ARG HBy 1.0 0.0 4.25 306 272 B 58 VAL H B 57 ARG HBy 1.0 0.0 4.25 307 273 A 58 VAL H A 57 ARG HBx 1.0 0.0 4.25 308 274 B 58 VAL H B 57 ARG HBx 1.0 0.0 4.25 309 275 A 58 VAL H A 58 VAL HG1% 1.0 0.0 4.00 310 276 B 58 VAL H B 58 VAL HG11 1.0 0.0 4.00 311 277 A 59 ILE H A 55 LEU HA 1.0 0.0 4.79 312 278 B 59 ILE H B 55 LEU HA 1.0 0.0 4.79 313 279 A 59 ILE H A 58 VAL HB 1.0 0.0 3.98 314 280 B 59 ILE H B 58 VAL HB 1.0 0.0 3.98 315 281 A 59 ILE H A 59 ILE HB 1.0 0.0 3.48 316 282 B 59 ILE H B 59 ILE HB 1.0 0.0 3.48 317 283 A 59 ILE HD1% A 59 ILE H 1.0 0.0 3.99 318 284 B 59 ILE HD11 B 59 ILE H 1.0 0.0 3.99 319 285 A 59 ILE H A 59 ILE HG1x 1.0 0.0 4.16 320 286 B 59 ILE H B 59 ILE HG1x 1.0 0.0 4.16 321 287 A 60 ASP H A 59 ILE H 1.0 0.0 3.74 322 288 B 60 ASP H B 59 ILE H 1.0 0.0 3.74 323 289 A 60 ASP H A 57 ARG HA 1.0 0.0 4.23 324 290 B 60 ASP H B 57 ARG HA 1.0 0.0 4.23 325 291 A 60 ASP H A 56 GLN HA 1.0 0.0 4.62 326 292 B 60 ASP H B 56 GLN HA 1.0 0.0 4.62 327 293 A 60 ASP H A 60 ASP HB2 1.0 0.0 3.31 328 293 A 60 ASP H A 60 ASP HB3 1.0 0.0 3.31 329 294 B 60 ASP H B 60 ASP HBx 1.0 0.0 3.31 330 294 B 60 ASP H B 60 ASP HBy 1.0 0.0 3.31 331 295 A 60 ASP H A 59 ILE HB 1.0 0.0 3.57 332 296 B 60 ASP H B 59 ILE HB 1.0 0.0 3.57 333 297 A 60 ASP H A 59 ILE HG2% 1.0 0.0 3.85 334 298 B 60 ASP H B 59 ILE HG21 1.0 0.0 3.85 335 299 A 61 TYR H A 58 VAL HA 1.0 0.0 4.15 336 300 B 61 TYR H B 58 VAL HA 1.0 0.0 4.15 337 301 A 62 ILE H A 64 ASP H 1.0 0.0 4.49 338 302 B 62 ILE H B 64 ASP H 1.0 0.0 4.49 339 303 A 62 ILE H A 62 ILE HG1y 1.0 0.0 3.66 340 304 B 62 ILE H B 62 ILE HG1y 1.0 0.0 3.66 341 305 A 62 ILE H A 62 ILE HG1x 1.0 0.0 3.66 342 306 B 62 ILE H B 62 ILE HG1x 1.0 0.0 3.66 343 307 A 62 ILE H A 63 LEU H 1.0 0.0 3.68 344 308 B 62 ILE H B 63 LEU H 1.0 0.0 3.68 345 309 A 63 LEU H A 59 ILE HA 1.0 0.0 4.92 346 310 B 63 LEU H B 59 ILE HA 1.0 0.0 4.92 347 311 A 63 LEU H A 62 ILE HB 1.0 0.0 3.28 348 312 B 63 LEU H B 62 ILE HB 1.0 0.0 3.28 349 313 A 63 LEU H A 63 LEU HB3 1.0 0.0 3.90 350 314 B 63 LEU H B 63 LEU HBy 1.0 0.0 3.90 351 315 A 63 LEU H A 63 LEU HD2% 1.0 0.0 3.48 352 316 B 63 LEU H B 63 LEU HD21 1.0 0.0 3.48 353 317 A 64 ASP H A 63 LEU H 1.0 0.0 3.61 354 318 B 64 ASP H B 63 LEU H 1.0 0.0 3.61 355 319 A 64 ASP H A 64 ASP HBy 1.0 0.0 3.52 356 320 B 64 ASP H B 64 ASP HBy 1.0 0.0 3.52 357 321 A 64 ASP H A 63 LEU HB2 1.0 0.0 3.85 358 322 B 64 ASP H B 63 LEU HBx 1.0 0.0 3.85 359 323 A 64 ASP H A 63 LEU HB3 1.0 0.0 4.37 360 324 B 64 ASP H B 63 LEU HBy 1.0 0.0 4.37 361 325 A 64 ASP H A 65 LEU HG 1.0 0.0 4.77 362 326 B 64 ASP H B 65 LEU HG 1.0 0.0 4.77 363 327 A 64 ASP H A 63 LEU HD1% 1.0 0.0 5.49 364 328 B 64 ASP H B 63 LEU HD11 1.0 0.0 5.49 365 329 A 62 ILE HA A 65 LEU H 1.0 0.0 4.30 366 330 B 62 ILE HA B 65 LEU H 1.0 0.0 4.30 367 331 A 65 LEU H A 64 ASP HBy 1.0 0.0 4.09 368 332 B 65 LEU H B 64 ASP HBy 1.0 0.0 4.09 369 333 A 65 LEU H A 64 ASP HBx 1.0 0.0 4.09 370 334 B 65 LEU H B 64 ASP HBx 1.0 0.0 4.09 371 335 A 65 LEU H A 65 LEU HB2 1.0 0.0 3.51 372 336 B 65 LEU H B 65 LEU HBx 1.0 0.0 3.51 373 337 A 65 LEU HG A 65 LEU H 1.0 0.0 3.32 374 338 B 65 LEU HG B 65 LEU H 1.0 0.0 3.32 375 339 A 65 LEU H A 65 LEU HD1% 1.0 0.0 4.07 376 340 B 65 LEU H B 65 LEU HD11 1.0 0.0 4.07 377 341 A 39 LEU HD2% B 66 GLN HE2x 1.0 0.0 4.70 378 342 A 66 GLN HE2y B 39 LEU HD21 1.0 0.0 4.70 379 343 A 66 GLN H A 66 GLN HGy 1.0 0.0 4.09 380 344 B 66 GLN H B 66 GLN HGy 1.0 0.0 4.09 381 345 A 66 GLN H A 66 GLN HGx 1.0 0.0 4.09 382 346 B 66 GLN H B 66 GLN HGx 1.0 0.0 4.09 383 347 A 66 GLN H A 66 GLN HBx 1.0 0.0 3.99 384 348 B 66 GLN H B 66 GLN HBx 1.0 0.0 3.99 385 349 A 65 LEU HB2 A 66 GLN H 1.0 0.0 4.23 386 350 B 65 LEU HBx B 66 GLN H 1.0 0.0 4.23 387 351 A 66 GLN H A 65 LEU HB3 1.0 0.0 4.70 388 352 B 66 GLN H B 65 LEU HBy 1.0 0.0 4.70 389 353 A 65 LEU HG A 66 GLN H 1.0 0.0 4.96 390 354 B 65 LEU HG B 66 GLN H 1.0 0.0 4.96 391 355 A 67 VAL H A 67 VAL HB 1.0 0.0 3.89 392 356 B 67 VAL H B 67 VAL HB 1.0 0.0 3.89 393 357 A 67 VAL HB A 68 VAL H 1.0 0.0 4.45 394 358 B 67 VAL HB B 68 VAL H 1.0 0.0 4.45 395 359 A 68 VAL H A 68 VAL HB 1.0 0.0 3.89 396 360 B 68 VAL H B 68 VAL HB 1.0 0.0 3.89 397 361 A 68 VAL H A 67 VAL HG1% 1.0 0.0 3.85 398 362 B 68 VAL H B 67 VAL HG11 1.0 0.0 3.85 399 363 A 23 LEU H A 22 PRO HG2 1.0 0.0 5.00 400 363 A 23 LEU H A 22 PRO HG3 1.0 0.0 5.00 401 364 B 23 LEU H B 22 PRO HGx 1.0 0.0 5.00 402 364 B 23 LEU H B 22 PRO HGy 1.0 0.0 5.00 403 365 A 26 LEU H A 25 LEU HD1% 1.0 0.0 5.45 404 366 B 26 LEU H B 25 LEU HD11 1.0 0.0 5.45 405 367 A 26 LEU H A 26 LEU HD1% 1.0 0.0 5.92 406 368 B 26 LEU H B 26 LEU HD11 1.0 0.0 5.92 407 369 A 61 TYR H A 40 VAL HG1% 1.0 0.0 4.70 408 370 B 61 TYR H B 40 VAL HG11 1.0 0.0 4.70 409 371 A 27 ASP H A 28 ASP H 1.0 0.0 4.11 410 372 B 27 ASP H B 28 ASP H 1.0 0.0 4.11 411 373 B 32 CYS H A 59 ILE HD1% 1.0 0.0 4.87 412 374 A 32 CYS H B 59 ILE HD11 1.0 0.0 4.87 413 375 A 32 CYS H A 31 HIS HBx 1.0 0.0 4.42 414 376 B 32 CYS H B 31 HIS HBx 1.0 0.0 4.42 415 377 A 33 TYR H A 32 CYS HB3 1.0 0.0 4.96 416 378 B 33 TYR H B 32 CYS HBy 1.0 0.0 4.96 417 379 A 33 TYR H A 32 CYS HB2 1.0 0.0 4.17 418 380 B 33 TYR H B 32 CYS HBx 1.0 0.0 4.17 419 381 A 33 TYR HD% A 34 SER H 1.0 0.0 4.83 420 382 B 33 TYR HD% B 34 SER H 1.0 0.0 4.83 421 383 A 35 ARG H A 34 SER HBx 1.0 0.0 4.47 422 384 B 35 ARG H B 34 SER HBx 1.0 0.0 4.47 423 385 A 36 LEU H A 35 ARG HB2 1.0 0.0 3.93 424 385 A 36 LEU H A 35 ARG HB3 1.0 0.0 3.93 425 386 B 36 LEU H B 35 ARG HBx 1.0 0.0 3.93 426 386 B 36 LEU H B 35 ARG HBy 1.0 0.0 3.93 427 387 A 37 ARG H A 37 ARG HB2 1.0 0.0 3.65 428 388 B 37 ARG H B 37 ARG HBx 1.0 0.0 3.65 429 389 A 36 LEU H A 37 ARG H 1.0 0.0 3.70 430 390 B 36 LEU H B 37 ARG H 1.0 0.0 3.70 431 391 A 38 GLU H A 35 ARG HG2 1.0 0.0 4.99 432 391 A 35 ARG HG3 A 38 GLU H 1.0 0.0 4.99 433 392 B 38 GLU H B 35 ARG HGx 1.0 0.0 4.99 434 392 B 35 ARG HGy B 38 GLU H 1.0 0.0 4.99 435 393 A 38 GLU H A 37 ARG HB2 1.0 0.0 3.96 436 394 B 38 GLU H B 37 ARG HBx 1.0 0.0 3.96 437 395 A 39 LEU H A 39 LEU HB2 1.0 0.0 3.57 438 396 B 39 LEU H B 39 LEU HBx 1.0 0.0 3.57 439 397 A 39 LEU HB2 A 40 VAL H 1.0 0.0 4.04 440 398 B 39 LEU HBx B 40 VAL H 1.0 0.0 4.04 441 399 A 43 VAL H A 43 VAL HG1% 1.0 0.0 4.26 442 400 B 43 VAL H B 43 VAL HG11 1.0 0.0 4.26 443 401 A 43 VAL H A 42 GLY H 1.0 0.0 4.65 444 402 B 43 VAL H B 42 GLY H 1.0 0.0 4.65 445 403 A 51 GLN H A 51 GLN HGx 1.0 0.0 4.76 446 404 B 51 GLN H B 51 GLN HGx 1.0 0.0 4.76 447 405 A 52 VAL H A 51 GLN HBy 1.0 0.0 4.54 448 406 B 52 VAL H B 51 GLN HBy 1.0 0.0 4.54 449 407 A 53 GLU H A 53 GLU HGx 1.0 0.0 4.51 450 408 B 53 GLU H B 53 GLU HGx 1.0 0.0 4.51 451 409 A 53 GLU HB3 A 54 ILE H 1.0 0.0 4.28 452 410 B 53 GLU HBy B 54 ILE H 1.0 0.0 4.28 453 411 A 53 GLU HB2 A 54 ILE H 1.0 0.0 4.08 454 412 B 53 GLU HBx B 54 ILE H 1.0 0.0 4.08 455 413 A 54 ILE H A 52 VAL HA 1.0 0.0 4.82 456 414 B 54 ILE H B 52 VAL HA 1.0 0.0 4.82 457 415 A 54 ILE H A 55 LEU H 1.0 0.0 3.74 458 416 B 54 ILE H B 55 LEU H 1.0 0.0 3.74 459 417 A 55 LEU H A 33 TYR HE% 1.0 0.0 4.74 460 418 B 55 LEU H B 33 TYR HE% 1.0 0.0 4.74 461 419 A 56 GLN H A 55 LEU HD1% 1.0 0.0 5.19 462 420 B 56 GLN H B 55 LEU HD11 1.0 0.0 5.19 463 421 A 56 GLN H A 55 LEU HD2% 1.0 0.0 5.68 464 422 B 56 GLN H B 55 LEU HD21 1.0 0.0 5.68 465 423 A 54 ILE HG2% A 57 ARG H 1.0 0.0 4.86 466 424 B 54 ILE HG21 B 57 ARG H 1.0 0.0 4.86 467 425 A 57 ARG H A 58 VAL HG2% 1.0 0.0 4.88 468 426 B 57 ARG H B 58 VAL HG21 1.0 0.0 4.88 469 427 A 59 ILE H A 59 ILE HG2% 1.0 0.0 4.01 470 428 B 59 ILE H B 59 ILE HG21 1.0 0.0 4.01 471 429 A 59 ILE H A 59 ILE HG1y 1.0 0.0 4.16 472 430 B 59 ILE H B 59 ILE HG1y 1.0 0.0 4.16 473 431 A 61 TYR H A 61 TYR HBx 1.0 0.0 3.51 474 432 B 61 TYR H B 61 TYR HBx 1.0 0.0 3.51 475 433 A 62 ILE H A 62 ILE HD1% 1.0 0.0 3.90 476 434 B 62 ILE H B 62 ILE HD11 1.0 0.0 3.90 477 435 A 63 LEU H A 63 LEU HG 1.0 0.0 3.51 478 436 B 63 LEU H B 63 LEU HG 1.0 0.0 3.51 479 437 A 64 ASP H A 63 LEU HG 1.0 0.0 4.80 480 438 B 64 ASP H B 63 LEU HG 1.0 0.0 4.80 481 439 A 66 GLN H A 62 ILE HG2% 1.0 0.0 5.03 482 440 B 66 GLN H B 62 ILE HG21 1.0 0.0 5.03 483 441 A 63 LEU HD2% A 66 GLN H 1.0 0.0 5.42 484 442 B 63 LEU HD21 B 66 GLN H 1.0 0.0 5.42 485 443 A 66 GLN H A 63 LEU HA 1.0 0.0 4.11 486 444 B 66 GLN H B 63 LEU HA 1.0 0.0 4.11 487 445 A 66 GLN H A 64 ASP HA 1.0 0.0 4.67 488 446 B 66 GLN H B 64 ASP HA 1.0 0.0 4.67 489 447 A 18 ALA H A 17 PRO HA 1.0 0.0 3.42 490 448 B 18 ALA H B 17 PRO HA 1.0 0.0 3.42 491 449 A 19 ALA HB% A 20 GLU HG2 1.0 0.0 4.50 492 449 A 20 GLU HG3 A 19 ALA HB% 1.0 0.0 4.50 493 450 B 19 ALA HB1 B 20 GLU HGx 1.0 0.0 4.50 494 450 B 20 GLU HGy B 19 ALA HB1 1.0 0.0 4.50 495 451 A 20 GLU HA A 20 GLU HG2 1.0 0.0 3.90 496 451 A 20 GLU HG3 A 20 GLU HA 1.0 0.0 3.90 497 452 B 20 GLU HA B 20 GLU HGx 1.0 0.0 3.90 498 452 B 20 GLU HGy B 20 GLU HA 1.0 0.0 3.90 499 453 A 21 GLU HA A 21 GLU HG2 1.0 0.0 4.19 500 453 A 21 GLU HG3 A 21 GLU HA 1.0 0.0 4.19 501 454 B 21 GLU HA B 21 GLU HGx 1.0 0.0 4.19 502 454 B 21 GLU HGy B 21 GLU HA 1.0 0.0 4.19 503 455 A 20 GLU HG3 A 20 GLU HBy 1.0 0.0 3.00 504 455 A 20 GLU HBy A 20 GLU HG2 1.0 0.0 3.00 505 456 B 20 GLU HGy B 20 GLU HBy 1.0 0.0 3.00 506 456 B 20 GLU HBy B 20 GLU HGx 1.0 0.0 3.00 507 457 A 20 GLU HG3 A 20 GLU HBx 1.0 0.0 3.00 508 457 A 20 GLU HBx A 20 GLU HG2 1.0 0.0 3.00 509 458 B 20 GLU HGy B 20 GLU HBx 1.0 0.0 3.00 510 458 B 20 GLU HBx B 20 GLU HGx 1.0 0.0 3.00 511 459 A 21 GLU HA A 22 PRO HDy 1.0 0.0 3.22 512 460 B 21 GLU HA B 22 PRO HDy 1.0 0.0 3.22 513 461 A 21 GLU HA A 22 PRO HDx 1.0 0.0 3.22 514 462 B 21 GLU HA B 22 PRO HDx 1.0 0.0 3.22 515 463 A 22 PRO HDx A 21 GLU HBy 1.0 0.0 4.79 516 464 B 22 PRO HDx B 21 GLU HBy 1.0 0.0 4.79 517 465 A 25 LEU HD1% A 25 LEU HA 1.0 0.0 4.25 518 466 B 25 LEU HD11 B 25 LEU HA 1.0 0.0 4.25 519 467 A 27 ASP H A 26 LEU HBy 1.0 0.0 4.64 520 468 B 27 ASP H B 26 LEU HBy 1.0 0.0 4.64 521 469 A 26 LEU H A 25 LEU HD2% 1.0 0.0 4.78 522 470 B 26 LEU H B 25 LEU HD21 1.0 0.0 4.78 523 471 A 27 ASP H A 26 LEU HD2% 1.0 0.0 4.99 524 472 B 27 ASP H B 26 LEU HD21 1.0 0.0 4.99 525 473 A 23 LEU HD2% A 23 LEU HA 1.0 0.0 3.09 526 474 B 23 LEU HD21 B 23 LEU HA 1.0 0.0 3.09 527 475 A 63 LEU HD2% A 63 LEU HA 1.0 0.0 3.04 528 476 B 63 LEU HD21 B 63 LEU HA 1.0 0.0 3.04 529 477 A 25 LEU HD2% A 25 LEU HB2 1.0 0.0 3.03 530 477 A 25 LEU HB3 A 25 LEU HD2% 1.0 0.0 3.03 531 478 B 25 LEU HD21 B 25 LEU HBx 1.0 0.0 3.03 532 478 B 25 LEU HBy B 25 LEU HD21 1.0 0.0 3.03 533 479 A 63 LEU HB3 A 63 LEU HD2% 1.0 0.0 3.58 534 480 B 63 LEU HBy B 63 LEU HD21 1.0 0.0 3.58 535 481 A 25 LEU HD1% A 25 LEU HB2 1.0 0.0 3.78 536 481 A 25 LEU HB3 A 25 LEU HD1% 1.0 0.0 3.78 537 482 B 25 LEU HD11 B 25 LEU HBx 1.0 0.0 3.78 538 482 B 25 LEU HBy B 25 LEU HD11 1.0 0.0 3.78 539 483 A 26 LEU H A 26 LEU HG 1.0 0.0 5.31 540 484 B 26 LEU H B 26 LEU HG 1.0 0.0 5.31 541 485 A 27 ASP H A 26 LEU HG 1.0 0.0 5.57 542 486 B 27 ASP H B 26 LEU HG 1.0 0.0 5.57 543 487 A 23 LEU HG A 23 LEU HA 1.0 0.0 4.00 544 488 B 23 LEU HG B 23 LEU HA 1.0 0.0 4.00 545 489 A 25 LEU HA A 25 LEU HG 1.0 0.0 3.81 546 490 B 25 LEU HA B 25 LEU HG 1.0 0.0 3.81 547 491 A 25 LEU HA A 25 LEU HD2% 1.0 0.0 4.73 548 492 B 25 LEU HA B 25 LEU HD21 1.0 0.0 4.73 549 493 A 66 GLN HA A 66 GLN HGx 1.0 0.0 4.19 550 494 B 66 GLN HA B 66 GLN HGx 1.0 0.0 4.19 551 495 A 26 LEU HG A 26 LEU HA 1.0 0.0 3.58 552 496 B 26 LEU HG B 26 LEU HA 1.0 0.0 3.58 553 497 A 26 LEU HD2% A 26 LEU HA 1.0 0.0 3.50 554 498 B 26 LEU HD21 B 26 LEU HA 1.0 0.0 3.50 555 499 A 26 LEU HD1% A 26 LEU HA 1.0 0.0 3.91 556 500 B 26 LEU HD11 B 26 LEU HA 1.0 0.0 3.91 557 501 A 28 ASP H A 27 ASP HB2 1.0 0.0 4.53 558 501 A 27 ASP HB3 A 28 ASP H 1.0 0.0 4.53 559 502 B 28 ASP H B 27 ASP HBx 1.0 0.0 4.53 560 502 B 27 ASP HBy B 28 ASP H 1.0 0.0 4.53 561 503 A 64 ASP H A 64 ASP HBx 1.0 0.0 3.52 562 504 B 64 ASP H B 64 ASP HBx 1.0 0.0 3.52 563 505 A 30 ASN H A 29 MET HBy 1.0 0.0 5.62 564 506 B 30 ASN H B 29 MET HBy 1.0 0.0 5.62 565 507 A 33 TYR HE% A 29 MET HBy 1.0 0.0 5.13 566 508 B 33 TYR HE% B 29 MET HBy 1.0 0.0 5.13 567 509 A 52 VAL HG2% B 29 MET HBy 1.0 0.0 4.51 568 510 B 52 VAL HG21 A 29 MET HBy 1.0 0.0 4.51 569 511 A 52 VAL HG1% B 29 MET HBy 1.0 0.0 5.16 570 512 B 52 VAL HG11 A 29 MET HBy 1.0 0.0 5.16 571 513 A 55 LEU HD1% B 29 MET HBy 1.0 0.0 5.12 572 514 B 55 LEU HD11 A 29 MET HBy 1.0 0.0 5.12 573 515 A 29 MET H A 29 MET HE% 1.0 0.0 5.54 574 516 B 29 MET H B 29 MET HE1 1.0 0.0 5.54 575 517 A 51 GLN H B 29 MET HE1 1.0 0.0 5.97 576 518 B 51 GLN H A 29 MET HE% 1.0 0.0 5.97 577 519 B 29 MET HE1 A 52 VAL H 1.0 0.0 3.95 578 520 A 29 MET HE% B 52 VAL H 1.0 0.0 3.95 579 521 A 33 TYR HD% A 29 MET HE% 1.0 0.0 4.23 580 522 B 33 TYR HD% B 29 MET HE1 1.0 0.0 4.23 581 523 B 29 MET HE1 A 51 GLN HE2y 1.0 0.0 4.95 582 524 A 29 MET HE% B 51 GLN HE2x 1.0 0.0 4.95 583 525 A 29 MET HE% A 33 TYR HE% 1.0 0.0 3.34 584 526 B 29 MET HE1 B 33 TYR HE% 1.0 0.0 3.34 585 527 A 29 MET HA A 29 MET HE% 1.0 0.0 3.92 586 528 B 29 MET HA B 29 MET HE1 1.0 0.0 3.92 587 529 B 29 MET HE1 A 52 VAL HA 1.0 0.0 3.82 588 530 A 29 MET HE% B 52 VAL HA 1.0 0.0 3.82 589 531 A 29 MET HE% A 29 MET HBx 1.0 0.0 4.37 590 532 B 29 MET HE1 B 29 MET HBx 1.0 0.0 4.37 591 533 A 29 MET HE% A 29 MET HBy 1.0 0.0 4.37 592 534 B 29 MET HE1 B 29 MET HBy 1.0 0.0 4.37 593 535 B 29 MET HE1 A 52 VAL HG2% 1.0 0.0 3.36 594 536 A 29 MET HE% B 52 VAL HG21 1.0 0.0 3.36 595 537 B 29 MET HE1 A 52 VAL HG1% 1.0 0.0 3.40 596 538 A 29 MET HE% B 52 VAL HG11 1.0 0.0 3.40 597 539 B 29 MET HE1 A 55 LEU HD1% 1.0 0.0 3.01 598 540 A 29 MET HE% B 55 LEU HD11 1.0 0.0 3.01 599 541 A 30 ASN H A 29 MET HBx 1.0 0.0 5.62 600 542 B 30 ASN H B 29 MET HBx 1.0 0.0 5.62 601 543 A 33 TYR HE% A 29 MET HBx 1.0 0.0 5.13 602 544 B 33 TYR HE% B 29 MET HBx 1.0 0.0 5.13 603 545 A 52 VAL HG1% B 29 MET HBx 1.0 0.0 5.16 604 546 B 52 VAL HG11 A 29 MET HBx 1.0 0.0 5.16 605 547 A 55 LEU HD1% B 29 MET HBx 1.0 0.0 5.12 606 548 B 55 LEU HD11 A 29 MET HBx 1.0 0.0 5.12 607 549 A 29 MET H A 29 MET HGy 1.0 0.0 5.05 608 550 B 29 MET H B 29 MET HGy 1.0 0.0 5.05 609 551 A 34 SER H A 31 HIS HA 1.0 0.0 4.18 610 552 B 34 SER H B 31 HIS HA 1.0 0.0 4.18 611 553 A 68 VAL H A 67 VAL HA 1.0 0.0 2.86 612 554 B 68 VAL H B 67 VAL HA 1.0 0.0 2.86 613 555 A 33 TYR HA A 36 LEU HB2 1.0 0.0 4.29 614 556 B 33 TYR HA B 36 LEU HBx 1.0 0.0 4.29 615 557 A 34 SER H A 34 SER HBy 1.0 0.0 4.01 616 558 B 34 SER H B 34 SER HBy 1.0 0.0 4.01 617 559 A 35 ARG H A 34 SER HBy 1.0 0.0 4.47 618 560 B 35 ARG H B 34 SER HBy 1.0 0.0 4.47 619 561 A 35 ARG HA A 35 ARG HG2 1.0 0.0 4.15 620 561 A 35 ARG HG3 A 35 ARG HA 1.0 0.0 4.15 621 562 B 35 ARG HA B 35 ARG HGx 1.0 0.0 4.15 622 562 B 35 ARG HGy B 35 ARG HA 1.0 0.0 4.15 623 563 A 59 ILE HG2% B 35 ARG HGx 1.0 0.0 3.80 624 563 B 35 ARG HGy A 59 ILE HG2% 1.0 0.0 3.80 625 564 B 59 ILE HG21 A 35 ARG HG2 1.0 0.0 3.80 626 564 A 35 ARG HG3 B 59 ILE HG21 1.0 0.0 3.80 627 565 A 35 ARG HA A 35 ARG HDx 1.0 0.0 4.30 628 566 B 35 ARG HA B 35 ARG HDx 1.0 0.0 4.30 629 567 A 35 ARG HA A 35 ARG HDy 1.0 0.0 4.30 630 568 B 35 ARG HA B 35 ARG HDy 1.0 0.0 4.30 631 569 A 33 TYR HA A 36 LEU HD1% 1.0 0.0 4.12 632 570 B 33 TYR HA B 36 LEU HD11 1.0 0.0 4.12 633 571 A 36 LEU HD1% A 36 LEU HA 1.0 0.0 4.70 634 572 B 36 LEU HD11 B 36 LEU HA 1.0 0.0 4.70 635 573 A 36 LEU HD1% A 55 LEU HA 1.0 0.0 5.43 636 574 B 36 LEU HD11 B 55 LEU HA 1.0 0.0 5.43 637 575 B 36 LEU HD11 A 55 LEU HA 1.0 0.0 5.17 638 576 A 36 LEU HD1% B 55 LEU HA 1.0 0.0 5.17 639 577 A 36 LEU HB2 A 36 LEU HD1% 1.0 0.0 3.85 640 578 B 36 LEU HBx B 36 LEU HD11 1.0 0.0 3.85 641 579 A 36 LEU HB3 A 36 LEU HD1% 1.0 0.0 4.08 642 580 B 36 LEU HBy B 36 LEU HD11 1.0 0.0 4.08 643 581 A 36 LEU HD1% A 58 VAL HG2% 1.0 0.0 3.65 644 582 B 36 LEU HD11 B 58 VAL HG21 1.0 0.0 3.65 645 583 A 36 LEU HD1% A 54 ILE HG2% 1.0 0.0 3.45 646 584 B 36 LEU HD11 B 54 ILE HG21 1.0 0.0 3.45 647 585 A 36 LEU HB2 A 40 VAL HG2% 1.0 0.0 4.46 648 586 B 36 LEU HBx B 40 VAL HG21 1.0 0.0 4.46 649 587 A 49 LEU HA A 49 LEU HD2% 1.0 0.0 3.31 650 588 B 49 LEU HA B 49 LEU HD21 1.0 0.0 3.31 651 589 A 36 LEU HD2% A 36 LEU HA 1.0 0.0 3.33 652 590 B 36 LEU HD21 B 36 LEU HA 1.0 0.0 3.33 653 591 B 36 LEU HD21 A 59 ILE HA 1.0 0.0 4.15 654 592 A 36 LEU HD2% B 59 ILE HA 1.0 0.0 4.15 655 593 A 36 LEU HB2 A 36 LEU HD2% 1.0 0.0 3.65 656 594 B 36 LEU HBx B 36 LEU HD21 1.0 0.0 3.65 657 595 A 53 GLU HB3 A 49 LEU HD2% 1.0 0.0 4.00 658 596 B 53 GLU HBy B 49 LEU HD21 1.0 0.0 4.00 659 597 A 49 LEU HD2% A 49 LEU HB2 1.0 0.0 3.29 660 597 A 49 LEU HB3 A 49 LEU HD2% 1.0 0.0 3.29 661 598 B 49 LEU HD21 B 49 LEU HBx 1.0 0.0 3.29 662 598 B 49 LEU HBy B 49 LEU HD21 1.0 0.0 3.29 663 599 A 49 LEU HD2% A 47 THR HG2% 1.0 0.0 3.17 664 600 B 49 LEU HD21 B 47 THR HG21 1.0 0.0 3.17 665 601 A 36 LEU HB3 A 54 ILE HG2% 1.0 0.0 4.99 666 602 B 36 LEU HBy B 54 ILE HG21 1.0 0.0 4.99 667 603 A 37 ARG HA A 37 ARG HDy 1.0 0.0 4.60 668 604 B 37 ARG HA B 37 ARG HDx 1.0 0.0 4.60 669 605 A 37 ARG HA A 40 VAL HB 1.0 0.0 4.56 670 606 B 37 ARG HA B 40 VAL HB 1.0 0.0 4.56 671 607 A 37 ARG HA A 37 ARG HGy 1.0 0.0 4.40 672 608 B 37 ARG HA B 37 ARG HGy 1.0 0.0 4.40 673 609 A 37 ARG HA A 37 ARG HGx 1.0 0.0 4.40 674 610 B 37 ARG HA B 37 ARG HGx 1.0 0.0 4.40 675 611 A 40 VAL HG2% A 37 ARG HA 1.0 0.0 3.72 676 612 B 40 VAL HG21 B 37 ARG HA 1.0 0.0 3.72 677 613 A 54 ILE HD1% A 37 ARG HDy 1.0 0.0 4.57 678 614 B 54 ILE HD11 B 37 ARG HDx 1.0 0.0 4.57 679 615 A 37 ARG H A 37 ARG HB3 1.0 0.0 4.21 680 616 B 37 ARG H B 37 ARG HBy 1.0 0.0 4.21 681 617 A 37 ARG HB3 A 38 GLU HA 1.0 0.0 4.47 682 618 B 37 ARG HBy B 38 GLU HA 1.0 0.0 4.47 683 619 A 37 ARG HA A 37 ARG HDx 1.0 0.0 4.60 684 620 B 37 ARG HA B 37 ARG HDy 1.0 0.0 4.60 685 621 A 38 GLU HA A 38 GLU HGx 1.0 0.0 4.02 686 622 B 38 GLU HA B 38 GLU HGx 1.0 0.0 4.02 687 623 A 39 LEU H A 38 GLU HB3 1.0 0.0 4.57 688 624 B 39 LEU H B 38 GLU HBy 1.0 0.0 4.57 689 625 A 38 GLU H A 38 GLU HB3 1.0 0.0 4.21 690 626 B 38 GLU H B 38 GLU HBy 1.0 0.0 4.21 691 627 A 38 GLU HB2 A 39 LEU HG 1.0 0.0 3.72 692 628 B 38 GLU HBx B 39 LEU HG 1.0 0.0 3.72 693 629 A 38 GLU HA A 38 GLU HGy 1.0 0.0 4.02 694 630 B 38 GLU HA B 38 GLU HGy 1.0 0.0 4.02 695 631 A 39 LEU H A 39 LEU HD1% 1.0 0.0 4.17 696 632 B 39 LEU H B 39 LEU HD11 1.0 0.0 4.17 697 633 A 39 LEU HD1% A 39 LEU HA 1.0 0.0 4.39 698 634 B 39 LEU HD11 B 39 LEU HA 1.0 0.0 4.39 699 635 A 36 LEU HA A 39 LEU HD1% 1.0 0.0 4.06 700 636 B 36 LEU HA B 39 LEU HD11 1.0 0.0 4.06 701 637 A 59 ILE HA B 39 LEU HD11 1.0 0.0 4.23 702 638 B 59 ILE HA A 39 LEU HD1% 1.0 0.0 4.23 703 639 A 38 GLU HB2 A 39 LEU HD1% 1.0 0.0 4.68 704 640 B 38 GLU HBx B 39 LEU HD11 1.0 0.0 4.68 705 641 A 39 LEU HB3 A 39 LEU HD1% 1.0 0.0 3.66 706 642 B 39 LEU HBy B 39 LEU HD11 1.0 0.0 3.66 707 643 B 39 LEU HBx A 62 ILE HG2% 1.0 0.0 5.25 708 644 A 39 LEU HB2 B 62 ILE HG21 1.0 0.0 5.25 709 645 A 39 LEU H A 39 LEU HD2% 1.0 0.0 4.38 710 646 B 39 LEU H B 39 LEU HD21 1.0 0.0 4.38 711 647 A 41 PRO HD3 A 40 VAL HA 1.0 0.0 3.52 712 648 B 41 PRO HDy B 40 VAL HA 1.0 0.0 3.52 713 649 A 43 VAL HG1% A 43 VAL HA 1.0 0.0 3.44 714 650 B 43 VAL HG11 B 43 VAL HA 1.0 0.0 3.44 715 651 A 40 VAL HG2% A 40 VAL HA 1.0 0.0 3.74 716 652 B 40 VAL HG21 B 40 VAL HA 1.0 0.0 3.74 717 653 A 40 VAL HG2% A 58 VAL HA 1.0 0.0 3.99 718 654 B 40 VAL HG21 B 58 VAL HA 1.0 0.0 3.99 719 655 A 43 VAL HG1% A 44 PRO HDx 1.0 0.0 3.71 720 656 B 43 VAL HG11 B 44 PRO HDx 1.0 0.0 3.71 721 657 A 40 VAL H A 40 VAL HG1% 1.0 0.0 4.01 722 658 B 40 VAL H B 40 VAL HG11 1.0 0.0 4.01 723 659 A 40 VAL HG1% A 61 TYR HD% 1.0 0.0 4.29 724 660 B 40 VAL HG11 B 61 TYR HD% 1.0 0.0 4.29 725 661 A 40 VAL HG1% A 40 VAL HA 1.0 0.0 3.58 726 662 B 40 VAL HG11 B 40 VAL HA 1.0 0.0 3.58 727 663 A 40 VAL HG1% A 41 PRO HD2 1.0 0.0 3.90 728 664 B 40 VAL HG11 B 41 PRO HDx 1.0 0.0 3.90 729 665 A 40 VAL HG1% A 58 VAL HG2% 1.0 0.0 3.82 730 666 B 40 VAL HG11 B 58 VAL HG21 1.0 0.0 3.82 731 667 A 40 VAL HA A 41 PRO HD2 1.0 0.0 3.64 732 668 B 40 VAL HA B 41 PRO HDx 1.0 0.0 3.64 733 669 A 43 VAL HA A 44 PRO HDy 1.0 0.0 3.54 734 670 B 43 VAL HA B 44 PRO HDy 1.0 0.0 3.54 735 671 A 40 VAL H A 43 VAL HG2% 1.0 0.0 4.69 736 672 B 40 VAL H B 43 VAL HG21 1.0 0.0 4.69 737 673 A 43 VAL HG2% A 43 VAL HA 1.0 0.0 3.50 738 674 B 43 VAL HG21 B 43 VAL HA 1.0 0.0 3.50 739 675 A 37 ARG HA A 43 VAL HG2% 1.0 0.0 4.24 740 676 B 37 ARG HA B 43 VAL HG21 1.0 0.0 4.24 741 677 A 43 VAL HG2% A 44 PRO HDx 1.0 0.0 4.69 742 678 B 43 VAL HG21 B 44 PRO HDx 1.0 0.0 4.69 743 679 A 43 VAL HG2% A 57 ARG HDy 1.0 0.0 4.77 744 680 B 43 VAL HG21 B 57 ARG HDy 1.0 0.0 4.77 745 681 A 40 VAL HB A 43 VAL HG2% 1.0 0.0 3.53 746 682 B 40 VAL HB B 43 VAL HG21 1.0 0.0 3.53 747 683 A 43 VAL HG1% A 44 PRO HDy 1.0 0.0 3.71 748 684 B 43 VAL HG11 B 44 PRO HDy 1.0 0.0 3.71 749 685 A 43 VAL HA A 44 PRO HDx 1.0 0.0 3.54 750 686 B 43 VAL HA B 44 PRO HDx 1.0 0.0 3.54 751 687 A 43 VAL HG2% A 44 PRO HDy 1.0 0.0 4.69 752 688 B 43 VAL HG21 B 44 PRO HDy 1.0 0.0 4.69 753 689 A 45 ARG HA A 45 ARG HD2 1.0 0.0 4.07 754 689 A 45 ARG HA A 45 ARG HD3 1.0 0.0 4.07 755 690 B 45 ARG HA B 45 ARG HDx 1.0 0.0 4.07 756 690 B 45 ARG HA B 45 ARG HDy 1.0 0.0 4.07 757 691 A 43 VAL HG1% A 47 THR HB 1.0 0.0 4.05 758 692 B 43 VAL HG11 B 47 THR HB 1.0 0.0 4.05 759 693 A 49 LEU HD2% A 47 THR HB 1.0 0.0 4.83 760 694 B 49 LEU HD21 B 47 THR HB 1.0 0.0 4.83 761 695 A 47 THR HG2% A 47 THR HA 1.0 0.0 3.46 762 696 B 47 THR HG21 B 47 THR HA 1.0 0.0 3.46 763 697 A 49 LEU HG A 47 THR HG2% 1.0 0.0 3.98 764 698 B 49 LEU HG B 47 THR HG21 1.0 0.0 3.98 765 699 A 49 LEU H A 48 GLN HA 1.0 0.0 3.61 766 700 B 49 LEU H B 48 GLN HA 1.0 0.0 3.61 767 701 A 48 GLN HA A 48 GLN HG2 1.0 0.0 3.99 768 701 A 48 GLN HA A 48 GLN HG3 1.0 0.0 3.99 769 702 B 48 GLN HA B 48 GLN HGx 1.0 0.0 3.99 770 702 B 48 GLN HA B 48 GLN HGy 1.0 0.0 3.99 771 703 A 49 LEU HA A 49 LEU HD1% 1.0 0.0 4.76 772 704 B 49 LEU HA B 49 LEU HD11 1.0 0.0 4.76 773 705 A 54 ILE HA A 49 LEU HD1% 1.0 0.0 5.03 774 706 B 54 ILE HA B 49 LEU HD11 1.0 0.0 5.03 775 707 A 49 LEU HD1% A 57 ARG HDy 1.0 0.0 4.82 776 708 B 49 LEU HD11 B 57 ARG HDy 1.0 0.0 4.82 777 709 A 49 LEU HD1% A 49 LEU HB2 1.0 0.0 3.42 778 709 A 49 LEU HB3 A 49 LEU HD1% 1.0 0.0 3.42 779 710 B 49 LEU HD11 B 49 LEU HBx 1.0 0.0 3.42 780 710 B 49 LEU HBy B 49 LEU HD11 1.0 0.0 3.42 781 711 A 50 SER H A 49 LEU HD2% 1.0 0.0 4.24 782 712 B 50 SER H B 49 LEU HD21 1.0 0.0 4.24 783 713 A 53 GLU HB2 A 49 LEU HD2% 1.0 0.0 4.12 784 714 B 53 GLU HBx B 49 LEU HD21 1.0 0.0 4.12 785 715 A 54 ILE H A 51 GLN HA 1.0 0.0 5.53 786 716 B 54 ILE H B 51 GLN HA 1.0 0.0 5.53 787 717 A 51 GLN HA A 51 GLN HGy 1.0 0.0 4.22 788 718 B 51 GLN HA B 51 GLN HGy 1.0 0.0 4.22 789 719 A 54 ILE HB A 51 GLN HA 1.0 0.0 4.53 790 720 B 54 ILE HB B 51 GLN HA 1.0 0.0 4.53 791 721 A 51 GLN HA A 51 GLN HGx 1.0 0.0 4.22 792 722 B 51 GLN HA B 51 GLN HGx 1.0 0.0 4.22 793 723 A 52 VAL HA A 55 LEU HD1% 1.0 0.0 4.06 794 724 B 52 VAL HA B 55 LEU HD11 1.0 0.0 4.06 795 725 A 29 MET H B 52 VAL HG21 1.0 0.0 4.50 796 726 B 29 MET H A 52 VAL HG2% 1.0 0.0 4.50 797 727 A 51 GLN H A 52 VAL HG2% 1.0 0.0 5.11 798 728 B 51 GLN H B 52 VAL HG21 1.0 0.0 5.11 799 729 A 28 ASP H B 52 VAL HG21 1.0 0.0 5.95 800 730 B 28 ASP H A 52 VAL HG2% 1.0 0.0 5.95 801 731 A 55 LEU H A 52 VAL HG2% 1.0 0.0 6.30 802 732 B 55 LEU H B 52 VAL HG21 1.0 0.0 6.30 803 733 A 52 VAL H A 52 VAL HG2% 1.0 0.0 3.51 804 734 B 52 VAL H B 52 VAL HG21 1.0 0.0 3.51 805 735 A 53 GLU H A 52 VAL HG2% 1.0 0.0 4.64 806 736 B 53 GLU H B 52 VAL HG21 1.0 0.0 4.64 807 737 A 29 MET HA B 52 VAL HG21 1.0 0.0 3.61 808 738 B 29 MET HA A 52 VAL HG2% 1.0 0.0 3.61 809 739 A 52 VAL HA A 52 VAL HG2% 1.0 0.0 3.28 810 740 B 52 VAL HA B 52 VAL HG21 1.0 0.0 3.28 811 741 B 52 VAL HG21 A 28 ASP HB2 1.0 0.0 3.57 812 741 A 28 ASP HB3 B 52 VAL HG21 1.0 0.0 3.57 813 742 A 52 VAL HG2% B 28 ASP HBx 1.0 0.0 3.57 814 742 B 28 ASP HBy A 52 VAL HG2% 1.0 0.0 3.57 815 743 B 52 VAL HG21 A 29 MET HBx 1.0 0.0 4.51 816 744 A 52 VAL HG2% B 29 MET HBx 1.0 0.0 4.51 817 745 A 55 LEU HD1% A 52 VAL HG2% 1.0 0.0 4.00 818 746 B 55 LEU HD11 B 52 VAL HG21 1.0 0.0 4.00 819 747 A 52 VAL H A 52 VAL HG1% 1.0 0.0 3.99 820 748 B 52 VAL H B 52 VAL HG11 1.0 0.0 3.99 821 749 A 68 VAL H A 68 VAL HG2% 1.0 0.0 3.73 822 750 B 68 VAL H B 68 VAL HG21 1.0 0.0 3.73 823 751 A 53 GLU H A 52 VAL HG1% 1.0 0.0 3.78 824 752 B 53 GLU H B 52 VAL HG11 1.0 0.0 3.78 825 753 A 68 VAL HG2% A 68 VAL HA 1.0 0.0 3.92 826 754 B 68 VAL HG21 B 68 VAL HA 1.0 0.0 3.92 827 755 B 52 VAL HG11 A 28 ASP HB2 1.0 0.0 3.87 828 755 A 28 ASP HB3 B 52 VAL HG11 1.0 0.0 3.87 829 756 A 52 VAL HG1% B 28 ASP HBx 1.0 0.0 3.87 830 756 B 28 ASP HBy A 52 VAL HG1% 1.0 0.0 3.87 831 757 A 52 VAL HG1% A 56 GLN HGy 1.0 0.0 4.37 832 758 B 52 VAL HG11 B 56 GLN HGx 1.0 0.0 4.37 833 759 A 52 VAL HG1% A 56 GLN HGx 1.0 0.0 4.37 834 760 B 52 VAL HG11 B 56 GLN HGy 1.0 0.0 4.37 835 761 A 56 GLN H A 53 GLU HA 1.0 0.0 4.47 836 762 B 56 GLN H B 53 GLU HA 1.0 0.0 4.47 837 763 A 53 GLU HB3 A 49 LEU HB2 1.0 0.0 4.36 838 763 A 49 LEU HB3 A 53 GLU HB3 1.0 0.0 4.36 839 764 B 53 GLU HBy B 49 LEU HBx 1.0 0.0 4.36 840 764 B 49 LEU HBy B 53 GLU HBy 1.0 0.0 4.36 841 765 A 55 LEU H A 54 ILE HD1% 1.0 0.0 4.65 842 766 B 55 LEU H B 54 ILE HD11 1.0 0.0 4.65 843 767 A 54 ILE H A 54 ILE HD1% 1.0 0.0 4.08 844 768 B 54 ILE H B 54 ILE HD11 1.0 0.0 4.08 845 769 A 54 ILE HD1% A 51 GLN HA 1.0 0.0 3.92 846 770 B 54 ILE HD11 B 51 GLN HA 1.0 0.0 3.92 847 771 A 54 ILE HD1% A 37 ARG HDx 1.0 0.0 4.57 848 772 B 54 ILE HD11 B 37 ARG HDy 1.0 0.0 4.57 849 773 A 54 ILE HD1% A 33 TYR HB2 1.0 0.0 4.32 850 773 A 33 TYR HB3 A 54 ILE HD1% 1.0 0.0 4.32 851 774 B 54 ILE HD11 B 33 TYR HBx 1.0 0.0 4.32 852 774 B 33 TYR HBy B 54 ILE HD11 1.0 0.0 4.32 853 775 A 54 ILE HB A 54 ILE HD1% 1.0 0.0 3.60 854 776 B 54 ILE HB B 54 ILE HD11 1.0 0.0 3.60 855 777 A 54 ILE HD1% A 49 LEU HB2 1.0 0.0 4.06 856 777 A 49 LEU HB3 A 54 ILE HD1% 1.0 0.0 4.06 857 778 B 54 ILE HD11 B 49 LEU HBx 1.0 0.0 4.06 858 778 B 49 LEU HBy B 54 ILE HD11 1.0 0.0 4.06 859 779 A 54 ILE HG2% A 54 ILE H 1.0 0.0 4.06 860 780 B 54 ILE HG21 B 54 ILE H 1.0 0.0 4.06 861 781 A 54 ILE HG2% A 55 LEU HA 1.0 0.0 4.08 862 782 B 54 ILE HG21 B 55 LEU HA 1.0 0.0 4.08 863 783 A 54 ILE HG2% A 54 ILE HA 1.0 0.0 3.52 864 784 B 54 ILE HG21 B 54 ILE HA 1.0 0.0 3.52 865 785 A 36 LEU HB2 A 54 ILE HG2% 1.0 0.0 3.66 866 786 B 36 LEU HBx B 54 ILE HG21 1.0 0.0 3.66 867 787 A 55 LEU H A 55 LEU HD1% 1.0 0.0 3.93 868 788 B 55 LEU H B 55 LEU HD11 1.0 0.0 3.93 869 789 A 55 LEU HA A 55 LEU HD1% 1.0 0.0 4.32 870 790 B 55 LEU HA B 55 LEU HD11 1.0 0.0 4.32 871 791 A 32 CYS HB2 B 55 LEU HD11 1.0 0.0 4.33 872 792 B 32 CYS HBx A 55 LEU HD1% 1.0 0.0 4.33 873 793 A 55 LEU HB3 A 55 LEU HD1% 1.0 0.0 3.63 874 794 B 55 LEU HBy B 55 LEU HD11 1.0 0.0 3.63 875 795 A 52 VAL HG1% A 55 LEU HD1% 1.0 0.0 4.13 876 796 B 52 VAL HG11 B 55 LEU HD11 1.0 0.0 4.13 877 797 A 55 LEU H A 55 LEU HD2% 1.0 0.0 4.06 878 798 B 55 LEU H B 55 LEU HD21 1.0 0.0 4.06 879 799 A 33 TYR HA B 55 LEU HD21 1.0 0.0 4.81 880 800 B 33 TYR HA A 55 LEU HD2% 1.0 0.0 4.81 881 801 A 55 LEU HA A 55 LEU HD2% 1.0 0.0 3.32 882 802 B 55 LEU HA B 55 LEU HD21 1.0 0.0 3.32 883 803 A 58 VAL HB A 55 LEU HD2% 1.0 0.0 4.55 884 804 B 58 VAL HB B 55 LEU HD21 1.0 0.0 4.55 885 805 A 55 LEU HB3 A 55 LEU HD2% 1.0 0.0 3.78 886 806 B 55 LEU HBy B 55 LEU HD21 1.0 0.0 3.78 887 807 A 55 LEU HD2% A 58 VAL HG2% 1.0 0.0 4.25 888 808 B 55 LEU HD21 B 58 VAL HG21 1.0 0.0 4.25 889 809 A 54 ILE HG2% A 55 LEU HD2% 1.0 0.0 3.58 890 810 B 54 ILE HG21 B 55 LEU HD21 1.0 0.0 3.58 891 811 A 59 ILE HB A 56 GLN HA 1.0 0.0 4.12 892 812 B 59 ILE HB B 56 GLN HA 1.0 0.0 4.12 893 813 A 56 GLN H A 56 GLN HBy 1.0 0.0 4.21 894 814 B 56 GLN H B 56 GLN HBy 1.0 0.0 4.21 895 815 A 56 GLN HA A 56 GLN HGy 1.0 0.0 4.24 896 816 B 56 GLN HA B 56 GLN HGx 1.0 0.0 4.24 897 817 A 56 GLN H A 56 GLN HGx 1.0 0.0 4.34 898 818 B 56 GLN H B 56 GLN HGy 1.0 0.0 4.34 899 819 A 56 GLN HA A 56 GLN HGx 1.0 0.0 4.24 900 820 B 56 GLN HA B 56 GLN HGy 1.0 0.0 4.24 901 821 A 57 ARG HA A 60 ASP HB2 1.0 0.0 4.03 902 821 A 60 ASP HB3 A 57 ARG HA 1.0 0.0 4.03 903 822 B 57 ARG HA B 60 ASP HBx 1.0 0.0 4.03 904 822 B 60 ASP HBy B 57 ARG HA 1.0 0.0 4.03 905 823 A 57 ARG HA A 57 ARG HGx 1.0 0.0 4.00 906 824 B 57 ARG HA B 57 ARG HGx 1.0 0.0 4.00 907 825 A 57 ARG HA A 57 ARG HGy 1.0 0.0 4.00 908 826 B 57 ARG HA B 57 ARG HGy 1.0 0.0 4.00 909 827 A 57 ARG H A 57 ARG HGy 1.0 0.0 5.16 910 828 B 57 ARG H B 57 ARG HGy 1.0 0.0 5.16 911 829 A 58 VAL HA A 61 TYR HBx 1.0 0.0 4.62 912 830 B 58 VAL HA B 61 TYR HBx 1.0 0.0 4.62 913 831 A 40 VAL HG1% A 58 VAL HA 1.0 0.0 4.23 914 832 B 40 VAL HG11 B 58 VAL HA 1.0 0.0 4.23 915 833 A 58 VAL H A 58 VAL HG2% 1.0 0.0 3.38 916 834 B 58 VAL H B 58 VAL HG21 1.0 0.0 3.38 917 835 A 59 ILE H A 58 VAL HG2% 1.0 0.0 4.50 918 836 B 59 ILE H B 58 VAL HG21 1.0 0.0 4.50 919 837 A 55 LEU HA A 58 VAL HG2% 1.0 0.0 3.77 920 838 B 55 LEU HA B 58 VAL HG21 1.0 0.0 3.77 921 839 A 58 VAL HA A 58 VAL HG2% 1.0 0.0 3.42 922 840 B 58 VAL HA B 58 VAL HG21 1.0 0.0 3.42 923 841 A 36 LEU HB2 A 58 VAL HG2% 1.0 0.0 4.04 924 842 B 36 LEU HBx B 58 VAL HG21 1.0 0.0 4.04 925 843 A 62 ILE H A 58 VAL HG1% 1.0 0.0 4.68 926 844 B 62 ILE H B 58 VAL HG11 1.0 0.0 4.68 927 845 A 59 ILE H A 58 VAL HG1% 1.0 0.0 4.34 928 846 B 59 ILE H B 58 VAL HG11 1.0 0.0 4.34 929 847 A 55 LEU HA A 58 VAL HG1% 1.0 0.0 4.22 930 848 B 55 LEU HA B 58 VAL HG11 1.0 0.0 4.22 931 849 A 58 VAL HG1% A 58 VAL HA 1.0 0.0 3.63 932 850 B 58 VAL HG11 B 58 VAL HA 1.0 0.0 3.63 933 851 A 58 VAL HG1% A 59 ILE HA 1.0 0.0 4.26 934 852 B 58 VAL HG11 B 59 ILE HA 1.0 0.0 4.26 935 853 A 55 LEU HA A 58 VAL HB 1.0 0.0 4.22 936 854 B 55 LEU HA B 58 VAL HB 1.0 0.0 4.22 937 855 A 36 LEU HD1% B 58 VAL HB 1.0 0.0 4.66 938 856 B 36 LEU HD11 A 58 VAL HB 1.0 0.0 4.66 939 857 A 59 ILE HA A 62 ILE HB 1.0 0.0 4.43 940 858 B 59 ILE HA B 62 ILE HB 1.0 0.0 4.43 941 859 A 62 ILE H A 59 ILE HA 1.0 0.0 4.88 942 860 B 62 ILE H B 59 ILE HA 1.0 0.0 4.88 943 861 A 59 ILE HA A 59 ILE HG1y 1.0 0.0 4.18 944 862 B 59 ILE HA B 59 ILE HG1y 1.0 0.0 4.18 945 863 A 59 ILE HA A 59 ILE HG1x 1.0 0.0 4.18 946 864 B 59 ILE HA B 59 ILE HG1x 1.0 0.0 4.18 947 865 B 59 ILE HD11 A 32 CYS HA 1.0 0.0 3.49 948 866 A 59 ILE HD1% B 32 CYS HA 1.0 0.0 3.49 949 867 A 59 ILE HD1% A 56 GLN HA 1.0 0.0 3.82 950 868 B 59 ILE HD11 B 56 GLN HA 1.0 0.0 3.82 951 869 A 32 CYS HB3 B 59 ILE HD11 1.0 0.0 4.36 952 870 B 32 CYS HBy A 59 ILE HD1% 1.0 0.0 4.36 953 871 B 59 ILE HD11 A 35 ARG HB2 1.0 0.0 3.61 954 871 A 35 ARG HB3 B 59 ILE HD11 1.0 0.0 3.61 955 872 A 59 ILE HD1% B 35 ARG HBx 1.0 0.0 3.61 956 872 B 35 ARG HBy A 59 ILE HD1% 1.0 0.0 3.61 957 873 B 59 ILE HD11 A 35 ARG HG2 1.0 0.0 4.23 958 873 A 35 ARG HG3 B 59 ILE HD11 1.0 0.0 4.23 959 874 A 59 ILE HD1% B 35 ARG HGx 1.0 0.0 4.23 960 874 B 35 ARG HGy A 59 ILE HD1% 1.0 0.0 4.23 961 875 B 59 ILE HG21 A 32 CYS HA 1.0 0.0 5.65 962 876 A 59 ILE HG2% B 32 CYS HA 1.0 0.0 5.65 963 877 A 36 LEU HA B 59 ILE HG21 1.0 0.0 6.30 964 878 B 36 LEU HA A 59 ILE HG2% 1.0 0.0 6.30 965 879 A 56 GLN HA A 59 ILE HG2% 1.0 0.0 6.29 966 880 B 56 GLN HA B 59 ILE HG21 1.0 0.0 6.29 967 881 A 59 ILE HG2% A 59 ILE HA 1.0 0.0 3.55 968 882 B 59 ILE HG21 B 59 ILE HA 1.0 0.0 3.55 969 883 A 59 ILE HG2% A 59 ILE HG1x 1.0 0.0 4.12 970 884 B 59 ILE HG21 B 59 ILE HG1x 1.0 0.0 4.12 971 885 A 63 LEU H A 60 ASP HA 1.0 0.0 4.27 972 886 B 63 LEU H B 60 ASP HA 1.0 0.0 4.27 973 887 A 63 LEU HB2 A 60 ASP HA 1.0 0.0 3.93 974 888 B 63 LEU HBx B 60 ASP HA 1.0 0.0 3.93 975 889 A 59 ILE HG2% A 60 ASP HA 1.0 0.0 4.18 976 890 B 59 ILE HG21 B 60 ASP HA 1.0 0.0 4.18 977 891 A 62 ILE H A 62 ILE HB 1.0 0.0 4.06 978 892 B 62 ILE H B 62 ILE HB 1.0 0.0 4.06 979 893 A 62 ILE HA A 65 LEU HB2 1.0 0.0 4.47 980 894 B 62 ILE HA B 65 LEU HBx 1.0 0.0 4.47 981 895 A 65 LEU HG A 62 ILE HA 1.0 0.0 4.51 982 896 B 65 LEU HG B 62 ILE HA 1.0 0.0 4.51 983 897 A 59 ILE H A 62 ILE HD1% 1.0 0.0 5.09 984 898 B 59 ILE H B 62 ILE HD11 1.0 0.0 5.09 985 899 A 63 LEU H A 62 ILE HD1% 1.0 0.0 5.46 986 900 B 63 LEU H B 62 ILE HD11 1.0 0.0 5.46 987 901 A 62 ILE HD1% A 61 TYR HD% 1.0 0.0 4.08 988 902 B 62 ILE HD11 B 61 TYR HD% 1.0 0.0 4.08 989 903 B 36 LEU HA A 62 ILE HD1% 1.0 0.0 4.86 990 904 A 36 LEU HA B 62 ILE HD11 1.0 0.0 4.86 991 905 A 58 VAL HA A 62 ILE HD1% 1.0 0.0 4.74 992 906 B 58 VAL HA B 62 ILE HD11 1.0 0.0 4.74 993 907 A 59 ILE HA A 62 ILE HD1% 1.0 0.0 3.76 994 908 B 59 ILE HA B 62 ILE HD11 1.0 0.0 3.76 995 909 A 62 ILE HB A 62 ILE HD1% 1.0 0.0 3.37 996 910 B 62 ILE HB B 62 ILE HD11 1.0 0.0 3.37 997 911 A 62 ILE H A 62 ILE HG2% 1.0 0.0 4.21 998 912 B 62 ILE H B 62 ILE HG21 1.0 0.0 4.21 999 913 A 63 LEU H A 62 ILE HG2% 1.0 0.0 4.45 1000 914 B 63 LEU H B 62 ILE HG21 1.0 0.0 4.45 1001 915 A 62 ILE HG2% A 61 TYR HD% 1.0 0.0 4.54 1002 916 B 62 ILE HG21 B 61 TYR HD% 1.0 0.0 4.54 1003 917 B 62 ILE HG21 A 61 TYR HE% 1.0 0.0 3.75 1004 918 A 62 ILE HG2% B 61 TYR HE% 1.0 0.0 3.75 1005 919 A 62 ILE HA A 62 ILE HG2% 1.0 0.0 3.52 1006 920 B 62 ILE HA B 62 ILE HG21 1.0 0.0 3.52 1007 921 A 39 LEU HB3 B 62 ILE HG21 1.0 0.0 3.98 1008 922 B 39 LEU HBy A 62 ILE HG2% 1.0 0.0 3.98 1009 923 B 62 ILE HG21 A 39 LEU HD1% 1.0 0.0 3.42 1010 924 A 62 ILE HG2% B 39 LEU HD11 1.0 0.0 3.42 1011 925 A 62 ILE HD1% A 62 ILE HG2% 1.0 0.0 3.72 1012 926 B 62 ILE HD11 B 62 ILE HG21 1.0 0.0 3.72 1013 927 A 65 LEU HD1% A 62 ILE HG2% 1.0 0.0 4.15 1014 928 B 65 LEU HD11 B 62 ILE HG21 1.0 0.0 4.15 1015 929 A 63 LEU H A 63 LEU HD1% 1.0 0.0 4.51 1016 930 B 63 LEU H B 63 LEU HD11 1.0 0.0 4.51 1017 931 A 63 LEU HD1% A 60 ASP HA 1.0 0.0 3.98 1018 932 B 63 LEU HD11 B 60 ASP HA 1.0 0.0 3.98 1019 933 A 63 LEU HD1% A 63 LEU HA 1.0 0.0 4.44 1020 934 B 63 LEU HD11 B 63 LEU HA 1.0 0.0 4.44 1021 935 A 63 LEU HB3 A 63 LEU HD1% 1.0 0.0 3.81 1022 936 B 63 LEU HBy B 63 LEU HD11 1.0 0.0 3.81 1023 937 A 63 LEU H A 63 LEU HB2 1.0 0.0 4.23 1024 938 B 63 LEU H B 63 LEU HBx 1.0 0.0 4.23 1025 939 A 63 LEU HB2 A 63 LEU HD1% 1.0 0.0 3.97 1026 940 B 63 LEU HBx B 63 LEU HD11 1.0 0.0 3.97 1027 941 A 65 LEU HD1% A 65 LEU HA 1.0 0.0 4.49 1028 942 B 65 LEU HD11 B 65 LEU HA 1.0 0.0 4.49 1029 943 A 62 ILE HA A 65 LEU HD1% 1.0 0.0 3.73 1030 944 B 62 ILE HA B 65 LEU HD11 1.0 0.0 3.73 1031 945 A 65 LEU HB2 A 65 LEU HD1% 1.0 0.0 3.61 1032 946 B 65 LEU HBx B 65 LEU HD11 1.0 0.0 3.61 1033 947 A 65 LEU HD1% A 65 LEU HB3 1.0 0.0 3.72 1034 948 B 65 LEU HD11 B 65 LEU HBy 1.0 0.0 3.72 1035 949 A 65 LEU H A 65 LEU HD2% 1.0 0.0 3.97 1036 950 B 65 LEU H B 65 LEU HD21 1.0 0.0 3.97 1037 951 A 61 TYR HE% A 65 LEU HD2% 1.0 0.0 3.93 1038 952 B 61 TYR HE% B 65 LEU HD21 1.0 0.0 3.93 1039 953 A 65 LEU HA A 65 LEU HD2% 1.0 0.0 2.98 1040 954 B 65 LEU HA B 65 LEU HD21 1.0 0.0 2.98 1041 955 A 62 ILE HA A 65 LEU HD2% 1.0 0.0 4.63 1042 956 B 62 ILE HA B 65 LEU HD21 1.0 0.0 4.63 1043 957 A 65 LEU HB2 A 65 LEU HD2% 1.0 0.0 3.73 1044 958 B 65 LEU HBx B 65 LEU HD21 1.0 0.0 3.73 1045 959 A 65 LEU HB3 A 65 LEU HD2% 1.0 0.0 3.35 1046 960 B 65 LEU HBy B 65 LEU HD21 1.0 0.0 3.35 1047 961 A 65 LEU H A 65 LEU HB3 1.0 0.0 4.27 1048 962 B 65 LEU H B 65 LEU HBy 1.0 0.0 4.27 1049 963 A 65 LEU HG A 65 LEU HA 1.0 0.0 4.36 1050 964 B 65 LEU HG B 65 LEU HA 1.0 0.0 4.36 1051 965 A 66 GLN H A 66 GLN HBy 1.0 0.0 3.99 1052 966 B 66 GLN H B 66 GLN HBy 1.0 0.0 3.99 1053 967 A 66 GLN HA A 66 GLN HGy 1.0 0.0 4.19 1054 968 B 66 GLN HA B 66 GLN HGy 1.0 0.0 4.19 1055 969 A 67 VAL H A 67 VAL HG2% 1.0 0.0 3.19 1056 970 B 67 VAL H B 67 VAL HG21 1.0 0.0 3.19 1057 971 A 67 VAL HA A 67 VAL HG2% 1.0 0.0 3.35 1058 972 B 67 VAL HA B 67 VAL HG21 1.0 0.0 3.35 1059 973 A 67 VAL H A 67 VAL HG1% 1.0 0.0 4.44 1060 974 B 67 VAL H B 67 VAL HG11 1.0 0.0 4.44 1061 975 A 67 VAL HG1% A 67 VAL HA 1.0 0.0 3.45 1062 976 B 67 VAL HG11 B 67 VAL HA 1.0 0.0 3.45 1063 977 A 68 VAL HA A 68 VAL HG1% 1.0 0.0 3.89 1064 978 B 68 VAL HA B 68 VAL HG11 1.0 0.0 3.89 1065 979 A 22 PRO HA A 23 LEU HG 1.0 0.0 4.44 1066 980 B 22 PRO HA B 23 LEU HG 1.0 0.0 4.44 1067 981 A 21 GLU HBy A 22 PRO HDy 1.0 0.0 4.79 1068 982 B 21 GLU HBy B 22 PRO HDy 1.0 0.0 4.79 1069 983 A 39 LEU H A 40 VAL HB 1.0 0.0 5.16 1070 984 B 39 LEU H B 40 VAL HB 1.0 0.0 5.16 1071 985 A 22 PRO HDx A 21 GLU HBx 1.0 0.0 4.79 1072 986 B 22 PRO HDx B 21 GLU HBx 1.0 0.0 4.79 1073 987 A 21 GLU HBx A 22 PRO HDy 1.0 0.0 4.79 1074 988 B 21 GLU HBx B 22 PRO HDy 1.0 0.0 4.79 1075 989 B 29 MET HA A 55 LEU HD1% 1.0 0.0 4.67 1076 990 A 29 MET HA B 55 LEU HD11 1.0 0.0 4.67 1077 991 B 29 MET HE1 A 51 GLN HA 1.0 0.0 4.42 1078 992 A 29 MET HE% B 51 GLN HA 1.0 0.0 4.42 1079 993 A 28 ASP HA A 31 HIS HBx 1.0 0.0 5.31 1080 994 B 28 ASP HA B 31 HIS HBx 1.0 0.0 5.31 1081 995 A 28 ASP HA A 31 HIS HBy 1.0 0.0 5.31 1082 996 B 28 ASP HA B 31 HIS HBy 1.0 0.0 5.31 1083 997 A 32 CYS HA A 35 ARG HB2 1.0 0.0 4.68 1084 997 A 35 ARG HB3 A 32 CYS HA 1.0 0.0 4.68 1085 998 B 32 CYS HA B 35 ARG HBx 1.0 0.0 4.68 1086 998 B 35 ARG HBy B 32 CYS HA 1.0 0.0 4.68 1087 999 B 32 CYS HBy A 55 LEU HB3 1.0 0.0 4.96 1088 1000 A 32 CYS HB3 B 55 LEU HBy 1.0 0.0 4.96 1089 1001 A 33 TYR HA A 54 ILE HG2% 1.0 0.0 4.56 1090 1002 B 33 TYR HA B 54 ILE HG21 1.0 0.0 4.56 1091 1003 A 35 ARG HA A 38 GLU HB3 1.0 0.0 4.32 1092 1004 B 35 ARG HA B 38 GLU HBy 1.0 0.0 4.32 1093 1005 A 38 GLU H A 35 ARG HA 1.0 0.0 4.69 1094 1006 B 38 GLU H B 35 ARG HA 1.0 0.0 4.69 1095 1007 A 33 TYR HA A 36 LEU HB3 1.0 0.0 4.91 1096 1008 B 33 TYR HA B 36 LEU HBy 1.0 0.0 4.91 1097 1009 B 36 LEU HD21 A 58 VAL HB 1.0 0.0 4.67 1098 1010 A 36 LEU HD2% B 58 VAL HB 1.0 0.0 4.67 1099 1011 B 36 LEU HD21 A 59 ILE H 1.0 0.0 4.65 1100 1012 A 36 LEU HD2% B 59 ILE H 1.0 0.0 4.65 1101 1013 A 39 LEU HB2 A 39 LEU HD1% 1.0 0.0 3.53 1102 1014 B 39 LEU HBx B 39 LEU HD11 1.0 0.0 3.53 1103 1015 A 39 LEU HB3 A 39 LEU HD2% 1.0 0.0 3.56 1104 1016 B 39 LEU HBy B 39 LEU HD21 1.0 0.0 3.56 1105 1017 A 39 LEU HD2% A 39 LEU HA 1.0 0.0 3.20 1106 1018 B 39 LEU HD21 B 39 LEU HA 1.0 0.0 3.20 1107 1019 B 39 LEU HD21 A 66 GLN HE2x 1.0 0.0 4.70 1108 1020 A 39 LEU HD2% B 66 GLN HE2y 1.0 0.0 4.70 1109 1021 A 40 VAL HG2% A 39 LEU HB2 1.0 0.0 3.69 1110 1022 B 40 VAL HG21 B 39 LEU HBx 1.0 0.0 3.69 1111 1023 A 40 VAL HG2% A 41 PRO HD2 1.0 0.0 5.01 1112 1024 B 40 VAL HG21 B 41 PRO HDx 1.0 0.0 5.01 1113 1025 A 40 VAL HG2% A 61 TYR HD% 1.0 0.0 4.13 1114 1026 B 40 VAL HG21 B 61 TYR HD% 1.0 0.0 4.13 1115 1027 A 41 PRO HD3 A 40 VAL HG1% 1.0 0.0 5.00 1116 1028 B 41 PRO HDy B 40 VAL HG11 1.0 0.0 5.00 1117 1029 A 43 VAL HG2% A 57 ARG HDx 1.0 0.0 4.77 1118 1030 B 43 VAL HG21 B 57 ARG HDx 1.0 0.0 4.77 1119 1031 A 45 ARG HB3 A 45 ARG HD2 1.0 0.0 3.49 1120 1031 A 45 ARG HB2 A 45 ARG HD2 1.0 0.0 3.49 1121 1031 A 45 ARG HD3 A 45 ARG HB2 1.0 0.0 3.49 1122 1031 A 45 ARG HD3 A 45 ARG HB3 1.0 0.0 3.49 1123 1032 B 45 ARG HBx B 45 ARG HDx 1.0 0.0 3.49 1124 1032 B 45 ARG HBy B 45 ARG HDx 1.0 0.0 3.49 1125 1032 B 45 ARG HDy B 45 ARG HBx 1.0 0.0 3.49 1126 1032 B 45 ARG HDy B 45 ARG HBy 1.0 0.0 3.49 1127 1033 A 53 GLU HB3 A 49 LEU HD1% 1.0 0.0 5.26 1128 1034 B 53 GLU HBy B 49 LEU HD11 1.0 0.0 5.26 1129 1035 A 49 LEU HD1% A 57 ARG HDx 1.0 0.0 4.82 1130 1036 B 49 LEU HD11 B 57 ARG HDx 1.0 0.0 4.82 1131 1037 A 49 LEU H A 49 LEU HD1% 1.0 0.0 5.19 1132 1038 B 49 LEU H B 49 LEU HD11 1.0 0.0 5.19 1133 1039 A 54 ILE H A 49 LEU HD1% 1.0 0.0 5.72 1134 1040 B 54 ILE H B 49 LEU HD11 1.0 0.0 5.72 1135 1041 A 49 LEU H A 49 LEU HD2% 1.0 0.0 4.87 1136 1042 B 49 LEU H B 49 LEU HD21 1.0 0.0 4.87 1137 1043 A 52 VAL HA A 52 VAL HG1% 1.0 0.0 3.84 1138 1044 B 52 VAL HA B 52 VAL HG11 1.0 0.0 3.84 1139 1045 A 53 GLU HA A 53 GLU HGy 1.0 0.0 4.23 1140 1046 B 53 GLU HA B 53 GLU HGy 1.0 0.0 4.23 1141 1047 A 53 GLU HA A 53 GLU HGx 1.0 0.0 4.23 1142 1048 B 53 GLU HA B 53 GLU HGx 1.0 0.0 4.23 1143 1049 A 53 GLU HB3 A 54 ILE HA 1.0 0.0 5.42 1144 1050 B 53 GLU HBy B 54 ILE HA 1.0 0.0 5.42 1145 1051 A 54 ILE HA A 54 ILE HD1% 1.0 0.0 4.39 1146 1052 B 54 ILE HA B 54 ILE HD11 1.0 0.0 4.39 1147 1053 A 37 ARG HA A 54 ILE HD1% 1.0 0.0 5.33 1148 1054 B 37 ARG HA B 54 ILE HD11 1.0 0.0 5.33 1149 1055 A 33 TYR HA A 54 ILE HD1% 1.0 0.0 4.90 1150 1056 B 33 TYR HA B 54 ILE HD11 1.0 0.0 4.90 1151 1057 A 52 VAL HA A 55 LEU HB2 1.0 0.0 5.02 1152 1058 B 52 VAL HA B 55 LEU HBx 1.0 0.0 5.02 1153 1059 A 55 LEU HB2 A 55 LEU HD1% 1.0 0.0 4.02 1154 1060 B 55 LEU HBx B 55 LEU HD11 1.0 0.0 4.02 1155 1061 A 32 CYS HB3 B 55 LEU HD11 1.0 0.0 4.16 1156 1062 B 32 CYS HBy A 55 LEU HD1% 1.0 0.0 4.16 1157 1063 A 33 TYR HA B 55 LEU HD11 1.0 0.0 5.79 1158 1064 B 33 TYR HA A 55 LEU HD1% 1.0 0.0 5.79 1159 1065 A 55 LEU HB2 A 55 LEU HD2% 1.0 0.0 4.08 1160 1066 B 55 LEU HBx B 55 LEU HD21 1.0 0.0 4.08 1161 1067 A 33 TYR HD% A 55 LEU HD2% 1.0 0.0 5.29 1162 1068 B 33 TYR HD% B 55 LEU HD21 1.0 0.0 5.29 1163 1069 A 33 TYR HD% B 55 LEU HD21 1.0 0.0 5.59 1164 1070 B 33 TYR HD% A 55 LEU HD2% 1.0 0.0 5.59 1165 1071 A 59 ILE H A 56 GLN HA 1.0 0.0 4.84 1166 1072 B 59 ILE H B 56 GLN HA 1.0 0.0 4.84 1167 1073 A 58 VAL HA A 61 TYR HBy 1.0 0.0 4.62 1168 1074 B 58 VAL HA B 61 TYR HBy 1.0 0.0 4.62 1169 1075 A 58 VAL HG1% A 61 TYR HD% 1.0 0.0 4.90 1170 1076 B 58 VAL HG11 B 61 TYR HD% 1.0 0.0 4.90 1171 1077 A 33 TYR HD% A 58 VAL HG2% 1.0 0.0 5.01 1172 1078 B 33 TYR HD% B 58 VAL HG21 1.0 0.0 5.01 1173 1079 A 59 ILE HD1% A 59 ILE HA 1.0 0.0 4.13 1174 1080 B 59 ILE HD11 B 59 ILE HA 1.0 0.0 4.13 1175 1081 B 59 ILE HG21 A 35 ARG HB2 1.0 0.0 3.68 1176 1081 A 35 ARG HB3 B 59 ILE HG21 1.0 0.0 3.68 1177 1082 A 59 ILE HG2% B 35 ARG HBx 1.0 0.0 3.68 1178 1082 B 35 ARG HBy A 59 ILE HG2% 1.0 0.0 3.68 1179 1083 A 59 ILE HG2% A 59 ILE HG1y 1.0 0.0 4.12 1180 1084 B 59 ILE HG21 B 59 ILE HG1y 1.0 0.0 4.12 1181 1085 A 59 ILE HD1% A 59 ILE HB 1.0 0.0 3.64 1182 1086 B 59 ILE HD11 B 59 ILE HB 1.0 0.0 3.64 1183 1087 B 59 ILE HD11 A 36 LEU HG 1.0 0.0 4.11 1184 1088 A 59 ILE HD1% B 36 LEU HG 1.0 0.0 4.11 1185 1089 A 32 CYS HB2 B 59 ILE HD11 1.0 0.0 4.84 1186 1090 B 32 CYS HBx A 59 ILE HD1% 1.0 0.0 4.84 1187 1091 A 62 ILE HA A 62 ILE HD1% 1.0 0.0 4.39 1188 1092 B 62 ILE HA B 62 ILE HD11 1.0 0.0 4.39 1189 1093 A 62 ILE HG2% A 63 LEU HA 1.0 0.0 4.81 1190 1094 B 62 ILE HG21 B 63 LEU HA 1.0 0.0 4.81 1191 1095 A 63 LEU HG A 63 LEU HA 1.0 0.0 4.32 1192 1096 B 63 LEU HG B 63 LEU HA 1.0 0.0 4.32 1193 1097 A 64 ASP H A 63 LEU HD2% 1.0 0.0 4.78 1194 1098 B 64 ASP H B 63 LEU HD21 1.0 0.0 4.78 1195 1099 A 65 LEU HD1% A 66 GLN H 1.0 0.0 4.84 1196 1100 B 65 LEU HD11 B 66 GLN H 1.0 0.0 4.84 1197 1101 A 61 TYR HD% A 65 LEU HD2% 1.0 0.0 4.82 1198 1102 B 61 TYR HD% B 65 LEU HD21 1.0 0.0 4.82 1199 1103 A 66 GLN H A 65 LEU HD2% 1.0 0.0 4.53 1200 1104 B 66 GLN H B 65 LEU HD21 1.0 0.0 4.53 1201 1105 A 57 ARG H A 57 ARG HGx 1.0 0.0 5.16 1202 1106 B 57 ARG H B 57 ARG HGx 1.0 0.0 5.16 1203 1107 A 31 HIS HA A 31 HIS HD2 1.0 0.0 4.34 1204 1108 B 31 HIS HA B 31 HIS HD2 1.0 0.0 4.34 1205 1109 A 26 LEU HD2% A 31 HIS HD2 1.0 0.0 4.13 1206 1110 B 26 LEU HD21 B 31 HIS HD2 1.0 0.0 4.13 1207 1111 A 41 PRO HD3 A 61 TYR HE% 1.0 0.0 4.37 1208 1112 B 41 PRO HDy B 61 TYR HE% 1.0 0.0 4.37 1209 1113 A 62 ILE HA A 61 TYR HE% 1.0 0.0 4.73 1210 1114 B 62 ILE HA B 61 TYR HE% 1.0 0.0 4.73 1211 1115 A 55 LEU HG A 33 TYR HE% 1.0 0.0 3.89 1212 1116 B 55 LEU HG B 33 TYR HE% 1.0 0.0 3.89 1213 1117 A 54 ILE HG2% A 33 TYR HE% 1.0 0.0 2.91 1214 1118 B 54 ILE HG21 B 33 TYR HE% 1.0 0.0 2.91 1215 1119 B 33 TYR HE% A 55 LEU HD1% 1.0 0.0 3.37 1216 1120 A 33 TYR HE% B 55 LEU HD11 1.0 0.0 3.37 1217 1121 A 33 TYR HE% A 55 LEU HD2% 1.0 0.0 3.46 1218 1122 B 33 TYR HE% B 55 LEU HD21 1.0 0.0 3.46 1219 1123 A 65 LEU HD1% A 61 TYR HE% 1.0 0.0 3.72 1220 1124 B 65 LEU HD11 B 61 TYR HE% 1.0 0.0 3.72 1221 1125 A 62 ILE H A 61 TYR HD% 1.0 0.0 3.89 1222 1126 B 62 ILE H B 61 TYR HD% 1.0 0.0 3.89 1223 1127 A 61 TYR HD% A 61 TYR HA 1.0 0.0 3.07 1224 1128 B 61 TYR HD% B 61 TYR HA 1.0 0.0 3.07 1225 1129 A 33 TYR HD% A 33 TYR HA 1.0 0.0 3.56 1226 1130 B 33 TYR HD% B 33 TYR HA 1.0 0.0 3.56 1227 1131 A 33 TYR HD% A 54 ILE HB 1.0 0.0 4.85 1228 1132 B 33 TYR HD% B 54 ILE HB 1.0 0.0 4.85 1229 1133 A 33 TYR HD% A 54 ILE HG2% 1.0 0.0 3.34 1230 1134 B 33 TYR HD% B 54 ILE HG21 1.0 0.0 3.34 1231 1135 A 33 TYR HD% A 36 LEU HD1% 1.0 0.0 3.60 1232 1136 B 33 TYR HD% B 36 LEU HD11 1.0 0.0 3.60 1233 1137 B 33 TYR HD% A 55 LEU HD1% 1.0 0.0 4.04 1234 1138 A 33 TYR HD% B 55 LEU HD11 1.0 0.0 4.04 1235 1139 A 61 TYR HD% A 41 PRO HD2 1.0 0.0 4.03 1236 1140 B 61 TYR HD% B 41 PRO HDx 1.0 0.0 4.03 1237 1141 A 65 LEU HD1% A 61 TYR HD% 1.0 0.0 4.17 1238 1142 B 65 LEU HD11 B 61 TYR HD% 1.0 0.0 4.17 1239 1143 A 33 TYR HD% A 54 ILE HD1% 1.0 0.0 3.65 1240 1144 B 33 TYR HD% B 54 ILE HD11 1.0 0.0 3.65 1241 1145 A 33 TYR HD% A 36 LEU HG 1.0 0.0 4.26 1242 1146 B 33 TYR HD% B 36 LEU HG 1.0 0.0 4.26 1243 1147 A 58 VAL HA A 61 TYR HD% 1.0 0.0 4.17 1244 1148 B 58 VAL HA B 61 TYR HD% 1.0 0.0 4.17 1245 1149 A 61 TYR H A 61 TYR HD% 1.0 0.0 4.30 1246 1150 B 61 TYR H B 61 TYR HD% 1.0 0.0 4.30 1247 1151 A 36 LEU HD1% A 33 TYR HE% 1.0 0.0 3.53 1248 1152 B 36 LEU HD11 B 33 TYR HE% 1.0 0.0 3.53 1249 1153 A 62 ILE HD1% B 61 TYR HE% 1.0 0.0 4.02 1250 1154 B 62 ILE HD11 A 61 TYR HE% 1.0 0.0 4.02 1251 1155 A 61 TYR HE% A 41 PRO HGx 1.0 0.0 4.83 1252 1156 B 61 TYR HE% B 41 PRO HGx 1.0 0.0 4.83 1253 1157 A 61 TYR HE% A 41 PRO HGy 1.0 0.0 4.83 1254 1158 B 61 TYR HE% B 41 PRO HGy 1.0 0.0 4.83 1255 1159 A 20 GLU H A 20 GLU HBx 1.0 0.0 3.74 1256 1159 A 20 GLU H A 20 GLU HBy 1.0 0.0 3.74 1257 1160 A 21 GLU H A 20 GLU HBx 1.0 0.0 3.90 1258 1160 A 21 GLU H A 20 GLU HBy 1.0 0.0 3.90 1259 1161 A 21 GLU HA A 22 PRO HDy 1.0 0.0 2.81 1260 1161 A 21 GLU HA A 22 PRO HDx 1.0 0.0 2.81 1261 1162 A 21 GLU HBy A 22 PRO HDy 1.0 0.0 3.39 1262 1162 A 21 GLU HBx A 22 PRO HDy 1.0 0.0 3.39 1263 1162 A 22 PRO HDx A 21 GLU HBx 1.0 0.0 3.39 1264 1162 A 22 PRO HDx A 21 GLU HBy 1.0 0.0 3.39 1265 1163 A 21 GLU HG2 A 22 PRO HDy 1.0 0.0 4.68 1266 1163 A 21 GLU HG3 A 22 PRO HDy 1.0 0.0 4.68 1267 1163 A 22 PRO HDx A 21 GLU HG2 1.0 0.0 4.68 1268 1163 A 21 GLU HG3 A 22 PRO HDx 1.0 0.0 4.68 1269 1164 A 23 LEU H A 23 LEU HBx 1.0 0.0 3.82 1270 1164 A 23 LEU H A 23 LEU HBy 1.0 0.0 3.82 1271 1165 A 24 SER H A 23 LEU HBx 1.0 0.0 3.93 1272 1165 A 23 LEU HBy A 24 SER H 1.0 0.0 3.93 1273 1166 A 24 SER HA A 23 LEU HBx 1.0 0.0 4.54 1274 1166 A 23 LEU HBy A 24 SER HA 1.0 0.0 4.54 1275 1167 A 26 LEU H A 26 LEU HBx 1.0 0.0 3.75 1276 1167 A 26 LEU H A 26 LEU HBy 1.0 0.0 3.75 1277 1168 A 26 LEU HD1% A 26 LEU HBx 1.0 0.0 3.48 1278 1168 A 26 LEU HD1% A 26 LEU HBy 1.0 0.0 3.48 1279 1169 A 27 ASP H A 26 LEU HBx 1.0 0.0 4.05 1280 1169 A 27 ASP H A 26 LEU HBy 1.0 0.0 4.05 1281 1170 A 28 ASP H A 26 LEU HBx 1.0 0.0 4.68 1282 1170 A 28 ASP H A 26 LEU HBy 1.0 0.0 4.68 1283 1171 A 27 ASP HA A 30 ASN HBx 1.0 0.0 4.40 1284 1171 A 27 ASP HA A 30 ASN HBy 1.0 0.0 4.40 1285 1172 A 28 ASP HA A 31 HIS HBy 1.0 0.0 4.58 1286 1172 A 28 ASP HA A 31 HIS HBx 1.0 0.0 4.58 1287 1173 A 29 MET HA A 29 MET HGy 1.0 0.0 3.60 1288 1173 A 29 MET HA A 29 MET HGx 1.0 0.0 3.60 1289 1174 A 29 MET HE% A 29 MET HBx 1.0 0.0 3.75 1290 1174 A 29 MET HE% A 29 MET HBy 1.0 0.0 3.75 1291 1175 A 33 TYR HE% A 29 MET HBx 1.0 0.0 4.43 1292 1175 A 33 TYR HE% A 29 MET HBy 1.0 0.0 4.43 1293 1176 B 52 VAL HG11 A 29 MET HBx 1.0 0.0 4.46 1294 1176 B 52 VAL HG11 A 29 MET HBy 1.0 0.0 4.46 1295 1177 B 52 VAL HG21 A 29 MET HBx 1.0 0.0 3.92 1296 1177 B 52 VAL HG21 A 29 MET HBy 1.0 0.0 3.92 1297 1178 B 55 LEU HD11 A 29 MET HBx 1.0 0.0 4.34 1298 1178 B 55 LEU HD11 A 29 MET HBy 1.0 0.0 4.34 1299 1179 A 30 ASN H A 29 MET HGy 1.0 0.0 4.30 1300 1179 A 30 ASN H A 29 MET HGx 1.0 0.0 4.30 1301 1180 B 52 VAL HA A 29 MET HGy 1.0 0.0 4.88 1302 1180 B 52 VAL HA A 29 MET HGx 1.0 0.0 4.88 1303 1181 B 55 LEU HD11 A 29 MET HGy 1.0 0.0 4.24 1304 1181 B 55 LEU HD11 A 29 MET HGx 1.0 0.0 4.24 1305 1182 A 29 MET HE% B 51 GLN HBy 1.0 0.0 3.27 1306 1182 A 29 MET HE% B 51 GLN HBx 1.0 0.0 3.27 1307 1183 A 29 MET HE% B 51 GLN HGx 1.0 0.0 4.34 1308 1183 A 29 MET HE% B 51 GLN HGy 1.0 0.0 4.34 1309 1184 A 29 MET HE% B 51 GLN HE2x 1.0 0.0 4.24 1310 1184 A 29 MET HE% B 51 GLN HE2y 1.0 0.0 4.24 1311 1185 A 30 ASN H A 30 ASN HBx 1.0 0.0 3.53 1312 1185 A 30 ASN H A 30 ASN HBy 1.0 0.0 3.53 1313 1186 A 31 HIS HA A 34 SER HBx 1.0 0.0 3.90 1314 1186 A 31 HIS HA A 34 SER HBy 1.0 0.0 3.90 1315 1187 A 31 HIS HD2 A 31 HIS HBy 1.0 0.0 3.62 1316 1187 A 31 HIS HD2 A 31 HIS HBx 1.0 0.0 3.62 1317 1188 A 32 CYS H A 31 HIS HBy 1.0 0.0 3.87 1318 1188 A 32 CYS H A 31 HIS HBx 1.0 0.0 3.87 1319 1189 A 34 SER H A 34 SER HBx 1.0 0.0 3.20 1320 1189 A 34 SER H A 34 SER HBy 1.0 0.0 3.20 1321 1190 A 35 ARG H A 34 SER HBx 1.0 0.0 3.77 1322 1190 A 35 ARG H A 34 SER HBy 1.0 0.0 3.77 1323 1191 A 35 ARG H A 35 ARG HDy 1.0 0.0 6.03 1324 1191 A 35 ARG H A 35 ARG HDx 1.0 0.0 6.03 1325 1192 A 35 ARG HA A 35 ARG HDy 1.0 0.0 3.68 1326 1192 A 35 ARG HA A 35 ARG HDx 1.0 0.0 3.68 1327 1193 A 35 ARG HA A 38 GLU HGx 1.0 0.0 4.84 1328 1193 A 35 ARG HA A 38 GLU HGy 1.0 0.0 4.84 1329 1194 A 35 ARG HB2 A 35 ARG HDy 1.0 0.0 3.83 1330 1194 A 35 ARG HB3 A 35 ARG HDy 1.0 0.0 3.83 1331 1194 A 35 ARG HDx A 35 ARG HB2 1.0 0.0 3.83 1332 1194 A 35 ARG HB3 A 35 ARG HDx 1.0 0.0 3.83 1333 1195 B 59 ILE HG21 A 35 ARG HDy 1.0 0.0 4.35 1334 1195 B 59 ILE HG21 A 35 ARG HDx 1.0 0.0 4.35 1335 1196 B 59 ILE HD11 A 35 ARG HDy 1.0 0.0 4.79 1336 1196 B 59 ILE HD11 A 35 ARG HDx 1.0 0.0 4.79 1337 1197 A 36 LEU HD2% B 59 ILE HG1y 1.0 0.0 3.45 1338 1197 A 36 LEU HD2% B 59 ILE HG1x 1.0 0.0 3.45 1339 1198 A 37 ARG H A 37 ARG HGy 1.0 0.0 3.85 1340 1198 A 37 ARG H A 37 ARG HGx 1.0 0.0 3.85 1341 1199 A 37 ARG HA A 37 ARG HGy 1.0 0.0 3.83 1342 1199 A 37 ARG HA A 37 ARG HGx 1.0 0.0 3.83 1343 1200 A 37 ARG HA A 37 ARG HDx 1.0 0.0 3.95 1344 1200 A 37 ARG HA A 37 ARG HDy 1.0 0.0 3.95 1345 1201 A 37 ARG HB3 A 37 ARG HDx 1.0 0.0 3.91 1346 1201 A 37 ARG HB3 A 37 ARG HDy 1.0 0.0 3.91 1347 1202 A 37 ARG HDx A 54 ILE HG1y 1.0 0.0 4.20 1348 1202 A 37 ARG HDy A 54 ILE HG1y 1.0 0.0 4.20 1349 1202 A 54 ILE HG1x A 37 ARG HDx 1.0 0.0 4.20 1350 1202 A 37 ARG HDy A 54 ILE HG1x 1.0 0.0 4.20 1351 1203 A 38 GLU H A 38 GLU HGx 1.0 0.0 3.50 1352 1203 A 38 GLU H A 38 GLU HGy 1.0 0.0 3.50 1353 1204 A 38 GLU HA A 38 GLU HGx 1.0 0.0 3.52 1354 1204 A 38 GLU HA A 38 GLU HGy 1.0 0.0 3.52 1355 1205 A 39 LEU HD2% B 66 GLN HGx 1.0 0.0 5.34 1356 1205 A 39 LEU HD2% B 66 GLN HGy 1.0 0.0 5.34 1357 1206 A 39 LEU HD2% B 66 GLN HE2x 1.0 0.0 3.93 1358 1206 A 39 LEU HD2% B 66 GLN HE2y 1.0 0.0 3.93 1359 1207 A 40 VAL HA A 41 PRO HGy 1.0 0.0 4.33 1360 1207 A 40 VAL HA A 41 PRO HGx 1.0 0.0 4.33 1361 1208 A 40 VAL HG1% A 57 ARG HBx 1.0 0.0 3.59 1362 1208 A 40 VAL HG1% A 57 ARG HBy 1.0 0.0 3.59 1363 1209 A 40 VAL HG1% A 61 TYR HBy 1.0 0.0 3.58 1364 1209 A 40 VAL HG1% A 61 TYR HBx 1.0 0.0 3.58 1365 1210 A 40 VAL HG2% A 61 TYR HBy 1.0 0.0 3.82 1366 1210 A 40 VAL HG2% A 61 TYR HBx 1.0 0.0 3.82 1367 1211 A 61 TYR HD% A 41 PRO HGy 1.0 0.0 4.11 1368 1211 A 61 TYR HD% A 41 PRO HGx 1.0 0.0 4.11 1369 1212 A 61 TYR HE% A 41 PRO HGy 1.0 0.0 4.00 1370 1212 A 61 TYR HE% A 41 PRO HGx 1.0 0.0 4.00 1371 1213 A 43 VAL HG2% A 42 GLY HAx 1.0 0.0 4.96 1372 1213 A 43 VAL HG2% A 42 GLY HAy 1.0 0.0 4.96 1373 1214 A 43 VAL HG2% A 44 PRO HDy 1.0 0.0 4.06 1374 1214 A 43 VAL HG2% A 44 PRO HDx 1.0 0.0 4.06 1375 1215 A 43 VAL HG2% A 57 ARG HBx 1.0 0.0 5.05 1376 1215 A 43 VAL HG2% A 57 ARG HBy 1.0 0.0 5.05 1377 1216 A 43 VAL HG2% A 57 ARG HGy 1.0 0.0 4.97 1378 1216 A 43 VAL HG2% A 57 ARG HGx 1.0 0.0 4.97 1379 1217 A 43 VAL HG2% A 57 ARG HDy 1.0 0.0 3.99 1380 1217 A 43 VAL HG2% A 57 ARG HDx 1.0 0.0 3.99 1381 1218 A 47 THR HB A 44 PRO HBx 1.0 0.0 5.22 1382 1218 A 47 THR HB A 44 PRO HBy 1.0 0.0 5.22 1383 1219 A 47 THR HG2% A 44 PRO HBx 1.0 0.0 4.44 1384 1219 A 47 THR HG2% A 44 PRO HBy 1.0 0.0 4.44 1385 1220 A 47 THR HB A 44 PRO HGx 1.0 0.0 4.60 1386 1220 A 47 THR HB A 44 PRO HGy 1.0 0.0 4.60 1387 1221 A 47 THR HG2% A 44 PRO HGx 1.0 0.0 4.64 1388 1221 A 47 THR HG2% A 44 PRO HGy 1.0 0.0 4.64 1389 1222 A 49 LEU HD1% A 44 PRO HDy 1.0 0.0 4.65 1390 1222 A 49 LEU HD1% A 44 PRO HDx 1.0 0.0 4.65 1391 1223 A 49 LEU HD2% A 44 PRO HDy 1.0 0.0 4.46 1392 1223 A 49 LEU HD2% A 44 PRO HDx 1.0 0.0 4.46 1393 1224 A 45 ARG HA A 45 ARG HGx 1.0 0.0 3.91 1394 1224 A 45 ARG HA A 45 ARG HGy 1.0 0.0 3.91 1395 1225 A 49 LEU HD1% A 54 ILE HG1y 1.0 0.0 5.10 1396 1225 A 49 LEU HD1% A 54 ILE HG1x 1.0 0.0 5.10 1397 1226 A 49 LEU HD1% A 57 ARG HBx 1.0 0.0 5.47 1398 1226 A 49 LEU HD1% A 57 ARG HBy 1.0 0.0 5.47 1399 1227 A 49 LEU HD1% A 57 ARG HGy 1.0 0.0 5.53 1400 1227 A 49 LEU HD1% A 57 ARG HGx 1.0 0.0 5.53 1401 1228 A 49 LEU HD1% A 57 ARG HDy 1.0 0.0 4.00 1402 1228 A 49 LEU HD1% A 57 ARG HDx 1.0 0.0 4.00 1403 1229 A 49 LEU HD2% A 57 ARG HDy 1.0 0.0 5.50 1404 1229 A 49 LEU HD2% A 57 ARG HDx 1.0 0.0 5.50 1405 1230 A 50 SER H A 50 SER HBx 1.0 0.0 3.84 1406 1230 A 50 SER H A 50 SER HBy 1.0 0.0 3.84 1407 1231 A 51 GLN H A 50 SER HBx 1.0 0.0 4.12 1408 1231 A 51 GLN H A 50 SER HBy 1.0 0.0 4.12 1409 1232 A 52 VAL H A 50 SER HBx 1.0 0.0 4.51 1410 1232 A 52 VAL H A 50 SER HBy 1.0 0.0 4.51 1411 1233 A 51 GLN H A 51 GLN HGx 1.0 0.0 3.94 1412 1233 A 51 GLN H A 51 GLN HGy 1.0 0.0 3.94 1413 1234 A 51 GLN HA A 51 GLN HGx 1.0 0.0 3.70 1414 1234 A 51 GLN HA A 51 GLN HGy 1.0 0.0 3.70 1415 1235 A 52 VAL H A 51 GLN HBy 1.0 0.0 3.83 1416 1235 A 52 VAL H A 51 GLN HBx 1.0 0.0 3.83 1417 1236 A 52 VAL HG2% A 51 GLN HBy 1.0 0.0 4.51 1418 1236 A 52 VAL HG2% A 51 GLN HBx 1.0 0.0 4.51 1419 1237 B 29 MET HE1 A 51 GLN HBy 1.0 0.0 3.27 1420 1237 B 29 MET HE1 A 51 GLN HBx 1.0 0.0 3.27 1421 1238 B 29 MET HE1 A 51 GLN HGx 1.0 0.0 4.34 1422 1238 B 29 MET HE1 A 51 GLN HGy 1.0 0.0 4.34 1423 1239 B 29 MET HE1 A 51 GLN HE2y 1.0 0.0 4.24 1424 1239 A 51 GLN HE2x B 29 MET HE1 1.0 0.0 4.24 1425 1240 A 52 VAL HA B 29 MET HGy 1.0 0.0 4.88 1426 1240 A 52 VAL HA B 29 MET HGx 1.0 0.0 4.88 1427 1241 A 52 VAL HG1% A 56 GLN HGy 1.0 0.0 3.60 1428 1241 A 52 VAL HG1% A 56 GLN HGx 1.0 0.0 3.60 1429 1242 A 52 VAL HG1% B 29 MET HBx 1.0 0.0 4.46 1430 1242 A 52 VAL HG1% B 29 MET HBy 1.0 0.0 4.46 1431 1243 A 56 GLN HE2y A 52 VAL HG2% 1.0 0.0 4.77 1432 1243 A 56 GLN HE2x A 52 VAL HG2% 1.0 0.0 4.77 1433 1244 A 52 VAL HG2% B 29 MET HBx 1.0 0.0 3.92 1434 1244 A 52 VAL HG2% B 29 MET HBy 1.0 0.0 3.92 1435 1245 A 53 GLU H A 53 GLU HGx 1.0 0.0 3.77 1436 1245 A 53 GLU H A 53 GLU HGy 1.0 0.0 3.77 1437 1246 A 53 GLU HA A 53 GLU HGx 1.0 0.0 3.66 1438 1246 A 53 GLU HA A 53 GLU HGy 1.0 0.0 3.66 1439 1247 A 54 ILE H A 54 ILE HG1y 1.0 0.0 3.34 1440 1247 A 54 ILE H A 54 ILE HG1x 1.0 0.0 3.34 1441 1248 A 54 ILE HA A 54 ILE HG1y 1.0 0.0 3.72 1442 1248 A 54 ILE HA A 54 ILE HG1x 1.0 0.0 3.72 1443 1249 A 54 ILE HA A 57 ARG HBx 1.0 0.0 4.70 1444 1249 A 54 ILE HA A 57 ARG HBy 1.0 0.0 4.70 1445 1250 A 55 LEU HD1% B 29 MET HBx 1.0 0.0 4.34 1446 1250 A 55 LEU HD1% B 29 MET HBy 1.0 0.0 4.34 1447 1251 A 55 LEU HD1% B 29 MET HGy 1.0 0.0 4.24 1448 1251 A 55 LEU HD1% B 29 MET HGx 1.0 0.0 4.24 1449 1252 A 56 GLN H A 56 GLN HBy 1.0 0.0 3.53 1450 1252 A 56 GLN H A 56 GLN HBx 1.0 0.0 3.53 1451 1253 A 56 GLN H A 56 GLN HGy 1.0 0.0 3.60 1452 1253 A 56 GLN H A 56 GLN HGx 1.0 0.0 3.60 1453 1254 A 57 ARG H A 56 GLN HBy 1.0 0.0 3.38 1454 1254 A 57 ARG H A 56 GLN HBx 1.0 0.0 3.38 1455 1255 A 56 GLN HE2y A 56 GLN HGx 1.0 0.0 3.21 1456 1255 A 56 GLN HE2x A 56 GLN HGx 1.0 0.0 3.21 1457 1255 A 56 GLN HE2x A 56 GLN HGy 1.0 0.0 3.21 1458 1255 A 56 GLN HE2y A 56 GLN HGy 1.0 0.0 3.21 1459 1256 A 57 ARG H A 56 GLN HGy 1.0 0.0 4.92 1460 1256 A 57 ARG H A 56 GLN HGx 1.0 0.0 4.92 1461 1257 A 57 ARG H A 57 ARG HBx 1.0 0.0 3.37 1462 1257 A 57 ARG H A 57 ARG HBy 1.0 0.0 3.37 1463 1258 A 57 ARG H A 57 ARG HGy 1.0 0.0 4.39 1464 1258 A 57 ARG H A 57 ARG HGx 1.0 0.0 4.39 1465 1259 A 57 ARG HA A 57 ARG HDy 1.0 0.0 4.56 1466 1259 A 57 ARG HA A 57 ARG HDx 1.0 0.0 4.56 1467 1260 A 57 ARG HBx A 57 ARG HDy 1.0 0.0 3.43 1468 1260 A 57 ARG HBy A 57 ARG HDy 1.0 0.0 3.43 1469 1260 A 57 ARG HDx A 57 ARG HBx 1.0 0.0 3.43 1470 1260 A 57 ARG HBy A 57 ARG HDx 1.0 0.0 3.43 1471 1261 A 58 VAL HG2% A 57 ARG HBx 1.0 0.0 4.43 1472 1261 A 58 VAL HG2% A 57 ARG HBy 1.0 0.0 4.43 1473 1262 A 58 VAL HA A 61 TYR HBy 1.0 0.0 4.00 1474 1262 A 58 VAL HA A 61 TYR HBx 1.0 0.0 4.00 1475 1263 A 58 VAL HG1% A 59 ILE HG1y 1.0 0.0 4.30 1476 1263 A 58 VAL HG1% A 59 ILE HG1x 1.0 0.0 4.30 1477 1264 A 58 VAL HG1% A 62 ILE HG1y 1.0 0.0 3.90 1478 1264 A 58 VAL HG1% A 62 ILE HG1x 1.0 0.0 3.90 1479 1265 A 59 ILE H A 59 ILE HG1y 1.0 0.0 3.50 1480 1265 A 59 ILE H A 59 ILE HG1x 1.0 0.0 3.50 1481 1266 A 59 ILE HG2% A 59 ILE HG1y 1.0 0.0 3.36 1482 1266 A 59 ILE HG2% A 59 ILE HG1x 1.0 0.0 3.36 1483 1267 A 59 ILE HG2% B 35 ARG HDy 1.0 0.0 4.35 1484 1267 A 59 ILE HG2% B 35 ARG HDx 1.0 0.0 4.35 1485 1268 A 60 ASP H A 59 ILE HG1y 1.0 0.0 4.30 1486 1268 A 60 ASP H A 59 ILE HG1x 1.0 0.0 4.30 1487 1269 B 36 LEU HD21 A 59 ILE HG1y 1.0 0.0 3.45 1488 1269 B 36 LEU HD21 A 59 ILE HG1x 1.0 0.0 3.45 1489 1270 A 59 ILE HD1% B 35 ARG HDy 1.0 0.0 4.79 1490 1270 A 59 ILE HD1% B 35 ARG HDx 1.0 0.0 4.79 1491 1271 A 61 TYR H A 62 ILE HG1y 1.0 0.0 4.51 1492 1271 A 61 TYR H A 62 ILE HG1x 1.0 0.0 4.51 1493 1272 A 61 TYR HA A 64 ASP HBx 1.0 0.0 4.14 1494 1272 A 61 TYR HA A 64 ASP HBy 1.0 0.0 4.14 1495 1273 A 62 ILE H A 61 TYR HBy 1.0 0.0 3.93 1496 1273 A 62 ILE H A 61 TYR HBx 1.0 0.0 3.93 1497 1274 A 61 TYR HD% A 62 ILE HG1y 1.0 0.0 3.85 1498 1274 A 61 TYR HD% A 62 ILE HG1x 1.0 0.0 3.85 1499 1275 A 61 TYR HE% A 62 ILE HG1y 1.0 0.0 4.08 1500 1275 A 61 TYR HE% A 62 ILE HG1x 1.0 0.0 4.08 1501 1276 A 62 ILE H A 62 ILE HG1y 1.0 0.0 3.04 1502 1276 A 62 ILE H A 62 ILE HG1x 1.0 0.0 3.04 1503 1277 A 62 ILE HA A 62 ILE HG1y 1.0 0.0 3.84 1504 1277 A 62 ILE HA A 62 ILE HG1x 1.0 0.0 3.84 1505 1278 A 62 ILE HG2% A 66 GLN HGx 1.0 0.0 4.11 1506 1278 A 62 ILE HG2% A 66 GLN HGy 1.0 0.0 4.11 1507 1279 A 66 GLN HE2y A 62 ILE HG2% 1.0 0.0 4.46 1508 1279 A 62 ILE HG2% A 66 GLN HE2x 1.0 0.0 4.46 1509 1280 A 63 LEU HA A 66 GLN HBy 1.0 0.0 4.58 1510 1280 A 63 LEU HA A 66 GLN HBx 1.0 0.0 4.58 1511 1281 A 63 LEU HD2% A 66 GLN HBy 1.0 0.0 4.30 1512 1281 A 63 LEU HD2% A 66 GLN HBx 1.0 0.0 4.30 1513 1282 A 63 LEU HD2% A 66 GLN HGx 1.0 0.0 6.10 1514 1282 A 63 LEU HD2% A 66 GLN HGy 1.0 0.0 6.10 1515 1283 A 64 ASP H A 64 ASP HBx 1.0 0.0 3.03 1516 1283 A 64 ASP H A 64 ASP HBy 1.0 0.0 3.03 1517 1284 A 65 LEU HD2% A 64 ASP HBx 1.0 0.0 4.73 1518 1284 A 65 LEU HD2% A 64 ASP HBy 1.0 0.0 4.73 1519 1285 A 65 LEU HD1% A 66 GLN HGx 1.0 0.0 4.53 1520 1285 A 65 LEU HD1% A 66 GLN HGy 1.0 0.0 4.53 1521 1286 A 66 GLN H A 66 GLN HBy 1.0 0.0 3.13 1522 1286 A 66 GLN H A 66 GLN HBx 1.0 0.0 3.13 1523 1287 A 66 GLN H A 66 GLN HGx 1.0 0.0 3.40 1524 1287 A 66 GLN H A 66 GLN HGy 1.0 0.0 3.40 1525 1288 A 66 GLN HA A 66 GLN HGx 1.0 0.0 3.61 1526 1288 A 66 GLN HA A 66 GLN HGy 1.0 0.0 3.61 1527 1289 A 67 VAL H A 66 GLN HBy 1.0 0.0 3.36 1528 1289 A 67 VAL H A 66 GLN HBx 1.0 0.0 3.36 1529 1290 A 66 GLN HE2y A 66 GLN HGy 1.0 0.0 3.21 1530 1290 A 66 GLN HE2y A 66 GLN HGx 1.0 0.0 3.21 1531 1290 A 66 GLN HE2x A 66 GLN HGy 1.0 0.0 3.21 1532 1290 A 66 GLN HE2x A 66 GLN HGx 1.0 0.0 3.21 1533 1291 B 39 LEU HD21 A 66 GLN HGx 1.0 0.0 5.34 1534 1291 B 39 LEU HD21 A 66 GLN HGy 1.0 0.0 5.34 1535 1292 A 66 GLN HE2y B 39 LEU HD21 1.0 0.0 3.93 1536 1292 B 39 LEU HD21 A 66 GLN HE2x 1.0 0.0 3.93 1537 1293 B 20 GLU H B 20 GLU HBx 1.0 0.0 3.74 1538 1293 B 20 GLU H B 20 GLU HBy 1.0 0.0 3.74 1539 1294 B 21 GLU H B 20 GLU HBx 1.0 0.0 3.90 1540 1294 B 21 GLU H B 20 GLU HBy 1.0 0.0 3.90 1541 1295 B 21 GLU HA B 22 PRO HDy 1.0 0.0 2.81 1542 1295 B 21 GLU HA B 22 PRO HDx 1.0 0.0 2.81 1543 1296 B 21 GLU HBy B 22 PRO HDy 1.0 0.0 3.39 1544 1296 B 21 GLU HBx B 22 PRO HDy 1.0 0.0 3.39 1545 1296 B 22 PRO HDx B 21 GLU HBx 1.0 0.0 3.39 1546 1296 B 22 PRO HDx B 21 GLU HBy 1.0 0.0 3.39 1547 1297 B 21 GLU HGx B 22 PRO HDy 1.0 0.0 4.68 1548 1297 B 21 GLU HGy B 22 PRO HDy 1.0 0.0 4.68 1549 1297 B 22 PRO HDx B 21 GLU HGx 1.0 0.0 4.68 1550 1297 B 21 GLU HGy B 22 PRO HDx 1.0 0.0 4.68 1551 1298 B 23 LEU H B 23 LEU HBx 1.0 0.0 3.82 1552 1298 B 23 LEU H B 23 LEU HBy 1.0 0.0 3.82 1553 1299 B 24 SER H B 23 LEU HBx 1.0 0.0 3.93 1554 1299 B 23 LEU HBy B 24 SER H 1.0 0.0 3.93 1555 1300 B 24 SER HA B 23 LEU HBx 1.0 0.0 4.54 1556 1300 B 23 LEU HBy B 24 SER HA 1.0 0.0 4.54 1557 1301 B 26 LEU H B 26 LEU HBx 1.0 0.0 3.75 1558 1301 B 26 LEU H B 26 LEU HBy 1.0 0.0 3.75 1559 1302 B 26 LEU HD11 B 26 LEU HBx 1.0 0.0 3.48 1560 1302 B 26 LEU HD11 B 26 LEU HBy 1.0 0.0 3.48 1561 1303 B 27 ASP H B 26 LEU HBx 1.0 0.0 4.05 1562 1303 B 27 ASP H B 26 LEU HBy 1.0 0.0 4.05 1563 1304 B 28 ASP H B 26 LEU HBx 1.0 0.0 4.68 1564 1304 B 28 ASP H B 26 LEU HBy 1.0 0.0 4.68 1565 1305 B 27 ASP HA B 30 ASN HBx 1.0 0.0 4.40 1566 1305 B 27 ASP HA B 30 ASN HBy 1.0 0.0 4.40 1567 1306 B 28 ASP HA B 31 HIS HBy 1.0 0.0 4.58 1568 1306 B 28 ASP HA B 31 HIS HBx 1.0 0.0 4.58 1569 1307 B 29 MET HA B 29 MET HGy 1.0 0.0 3.60 1570 1307 B 29 MET HA B 29 MET HGx 1.0 0.0 3.60 1571 1308 B 29 MET HE1 B 29 MET HBx 1.0 0.0 3.75 1572 1308 B 29 MET HE1 B 29 MET HBy 1.0 0.0 3.75 1573 1309 B 33 TYR HE% B 29 MET HBx 1.0 0.0 4.43 1574 1309 B 33 TYR HE% B 29 MET HBy 1.0 0.0 4.43 1575 1310 B 30 ASN H B 29 MET HGy 1.0 0.0 4.30 1576 1310 B 30 ASN H B 29 MET HGx 1.0 0.0 4.30 1577 1311 B 30 ASN H B 30 ASN HBx 1.0 0.0 3.53 1578 1311 B 30 ASN H B 30 ASN HBy 1.0 0.0 3.53 1579 1312 B 31 HIS HA B 34 SER HBx 1.0 0.0 3.90 1580 1312 B 31 HIS HA B 34 SER HBy 1.0 0.0 3.90 1581 1313 B 31 HIS HD2 B 31 HIS HBy 1.0 0.0 3.62 1582 1313 B 31 HIS HD2 B 31 HIS HBx 1.0 0.0 3.62 1583 1314 B 32 CYS H B 31 HIS HBy 1.0 0.0 3.87 1584 1314 B 32 CYS H B 31 HIS HBx 1.0 0.0 3.87 1585 1315 B 34 SER H B 34 SER HBx 1.0 0.0 3.20 1586 1315 B 34 SER H B 34 SER HBy 1.0 0.0 3.20 1587 1316 B 35 ARG H B 34 SER HBx 1.0 0.0 3.77 1588 1316 B 35 ARG H B 34 SER HBy 1.0 0.0 3.77 1589 1317 B 35 ARG H B 35 ARG HDy 1.0 0.0 6.03 1590 1317 B 35 ARG H B 35 ARG HDx 1.0 0.0 6.03 1591 1318 B 35 ARG HA B 35 ARG HDy 1.0 0.0 3.68 1592 1318 B 35 ARG HA B 35 ARG HDx 1.0 0.0 3.68 1593 1319 B 35 ARG HA B 38 GLU HGx 1.0 0.0 4.84 1594 1319 B 35 ARG HA B 38 GLU HGy 1.0 0.0 4.84 1595 1320 B 35 ARG HBx B 35 ARG HDy 1.0 0.0 3.83 1596 1320 B 35 ARG HDx B 35 ARG HBx 1.0 0.0 3.83 1597 1320 B 35 ARG HBy B 35 ARG HDx 1.0 0.0 3.83 1598 1320 B 35 ARG HBy B 35 ARG HDy 1.0 0.0 3.83 1599 1321 B 37 ARG H B 37 ARG HGy 1.0 0.0 3.85 1600 1321 B 37 ARG H B 37 ARG HGx 1.0 0.0 3.85 1601 1322 B 37 ARG HA B 37 ARG HGy 1.0 0.0 3.83 1602 1322 B 37 ARG HA B 37 ARG HGx 1.0 0.0 3.83 1603 1323 B 37 ARG HA B 37 ARG HDy 1.0 0.0 3.95 1604 1323 B 37 ARG HA B 37 ARG HDx 1.0 0.0 3.95 1605 1324 B 37 ARG HBy B 37 ARG HDy 1.0 0.0 3.91 1606 1324 B 37 ARG HBy B 37 ARG HDx 1.0 0.0 3.91 1607 1325 B 37 ARG HDx B 54 ILE HG1y 1.0 0.0 4.20 1608 1325 B 37 ARG HDy B 54 ILE HG1y 1.0 0.0 4.20 1609 1325 B 54 ILE HG1x B 37 ARG HDy 1.0 0.0 4.20 1610 1325 B 37 ARG HDx B 54 ILE HG1x 1.0 0.0 4.20 1611 1326 B 38 GLU H B 38 GLU HGx 1.0 0.0 3.50 1612 1326 B 38 GLU H B 38 GLU HGy 1.0 0.0 3.50 1613 1327 B 38 GLU HA B 38 GLU HGx 1.0 0.0 3.52 1614 1327 B 38 GLU HA B 38 GLU HGy 1.0 0.0 3.52 1615 1328 B 40 VAL HA B 41 PRO HGy 1.0 0.0 4.33 1616 1328 B 40 VAL HA B 41 PRO HGx 1.0 0.0 4.33 1617 1329 B 40 VAL HG11 B 57 ARG HBx 1.0 0.0 3.59 1618 1329 B 40 VAL HG11 B 57 ARG HBy 1.0 0.0 3.59 1619 1330 B 40 VAL HG11 B 61 TYR HBy 1.0 0.0 3.58 1620 1330 B 40 VAL HG11 B 61 TYR HBx 1.0 0.0 3.58 1621 1331 B 40 VAL HG21 B 61 TYR HBy 1.0 0.0 3.82 1622 1331 B 40 VAL HG21 B 61 TYR HBx 1.0 0.0 3.82 1623 1332 B 61 TYR HD% B 41 PRO HGy 1.0 0.0 4.11 1624 1332 B 61 TYR HD% B 41 PRO HGx 1.0 0.0 4.11 1625 1333 B 61 TYR HE% B 41 PRO HGy 1.0 0.0 4.00 1626 1333 B 61 TYR HE% B 41 PRO HGx 1.0 0.0 4.00 1627 1334 B 43 VAL HG21 B 42 GLY HAx 1.0 0.0 4.96 1628 1334 B 43 VAL HG21 B 42 GLY HAy 1.0 0.0 4.96 1629 1335 B 43 VAL HG21 B 44 PRO HDy 1.0 0.0 4.06 1630 1335 B 43 VAL HG21 B 44 PRO HDx 1.0 0.0 4.06 1631 1336 B 43 VAL HG21 B 57 ARG HBx 1.0 0.0 5.05 1632 1336 B 43 VAL HG21 B 57 ARG HBy 1.0 0.0 5.05 1633 1337 B 43 VAL HG21 B 57 ARG HGy 1.0 0.0 4.97 1634 1337 B 43 VAL HG21 B 57 ARG HGx 1.0 0.0 4.97 1635 1338 B 43 VAL HG21 B 57 ARG HDy 1.0 0.0 3.99 1636 1338 B 43 VAL HG21 B 57 ARG HDx 1.0 0.0 3.99 1637 1339 B 47 THR HB B 44 PRO HBx 1.0 0.0 5.22 1638 1339 B 47 THR HB B 44 PRO HBy 1.0 0.0 5.22 1639 1340 B 47 THR HG21 B 44 PRO HBx 1.0 0.0 4.44 1640 1340 B 47 THR HG21 B 44 PRO HBy 1.0 0.0 4.44 1641 1341 B 47 THR HB B 44 PRO HGx 1.0 0.0 4.60 1642 1341 B 47 THR HB B 44 PRO HGy 1.0 0.0 4.60 1643 1342 B 47 THR HG21 B 44 PRO HGx 1.0 0.0 4.64 1644 1342 B 47 THR HG21 B 44 PRO HGy 1.0 0.0 4.64 1645 1343 B 49 LEU HD11 B 44 PRO HDy 1.0 0.0 4.65 1646 1343 B 49 LEU HD11 B 44 PRO HDx 1.0 0.0 4.65 1647 1344 B 49 LEU HD21 B 44 PRO HDy 1.0 0.0 4.46 1648 1344 B 49 LEU HD21 B 44 PRO HDx 1.0 0.0 4.46 1649 1345 B 45 ARG HA B 45 ARG HGx 1.0 0.0 3.91 1650 1345 B 45 ARG HA B 45 ARG HGy 1.0 0.0 3.91 1651 1346 B 49 LEU HD11 B 54 ILE HG1y 1.0 0.0 5.10 1652 1346 B 49 LEU HD11 B 54 ILE HG1x 1.0 0.0 5.10 1653 1347 B 49 LEU HD11 B 57 ARG HBx 1.0 0.0 5.47 1654 1347 B 49 LEU HD11 B 57 ARG HBy 1.0 0.0 5.47 1655 1348 B 49 LEU HD11 B 57 ARG HGy 1.0 0.0 5.53 1656 1348 B 49 LEU HD11 B 57 ARG HGx 1.0 0.0 5.53 1657 1349 B 49 LEU HD11 B 57 ARG HDy 1.0 0.0 4.00 1658 1349 B 49 LEU HD11 B 57 ARG HDx 1.0 0.0 4.00 1659 1350 B 49 LEU HD21 B 57 ARG HDy 1.0 0.0 5.50 1660 1350 B 49 LEU HD21 B 57 ARG HDx 1.0 0.0 5.50 1661 1351 B 50 SER H B 50 SER HBx 1.0 0.0 3.84 1662 1351 B 50 SER H B 50 SER HBy 1.0 0.0 3.84 1663 1352 B 51 GLN H B 50 SER HBx 1.0 0.0 4.12 1664 1352 B 51 GLN H B 50 SER HBy 1.0 0.0 4.12 1665 1353 B 52 VAL H B 50 SER HBx 1.0 0.0 4.51 1666 1353 B 52 VAL H B 50 SER HBy 1.0 0.0 4.51 1667 1354 B 51 GLN H B 51 GLN HGx 1.0 0.0 3.94 1668 1354 B 51 GLN H B 51 GLN HGy 1.0 0.0 3.94 1669 1355 B 51 GLN HA B 51 GLN HGx 1.0 0.0 3.70 1670 1355 B 51 GLN HA B 51 GLN HGy 1.0 0.0 3.70 1671 1356 B 52 VAL H B 51 GLN HBy 1.0 0.0 3.83 1672 1356 B 52 VAL H B 51 GLN HBx 1.0 0.0 3.83 1673 1357 B 52 VAL HG21 B 51 GLN HBy 1.0 0.0 4.51 1674 1357 B 52 VAL HG21 B 51 GLN HBx 1.0 0.0 4.51 1675 1358 B 52 VAL HG11 B 56 GLN HGx 1.0 0.0 3.60 1676 1358 B 52 VAL HG11 B 56 GLN HGy 1.0 0.0 3.60 1677 1359 B 56 GLN HE2x B 52 VAL HG21 1.0 0.0 4.77 1678 1359 B 56 GLN HE2y B 52 VAL HG21 1.0 0.0 4.77 1679 1360 B 53 GLU H B 53 GLU HGx 1.0 0.0 3.77 1680 1360 B 53 GLU H B 53 GLU HGy 1.0 0.0 3.77 1681 1361 B 53 GLU HA B 53 GLU HGx 1.0 0.0 3.66 1682 1361 B 53 GLU HA B 53 GLU HGy 1.0 0.0 3.66 1683 1362 B 54 ILE H B 54 ILE HG1y 1.0 0.0 3.34 1684 1362 B 54 ILE H B 54 ILE HG1x 1.0 0.0 3.34 1685 1363 B 54 ILE HA B 54 ILE HG1y 1.0 0.0 3.72 1686 1363 B 54 ILE HA B 54 ILE HG1x 1.0 0.0 3.72 1687 1364 B 54 ILE HA B 57 ARG HBx 1.0 0.0 4.70 1688 1364 B 54 ILE HA B 57 ARG HBy 1.0 0.0 4.70 1689 1365 B 56 GLN H B 56 GLN HBy 1.0 0.0 3.53 1690 1365 B 56 GLN H B 56 GLN HBx 1.0 0.0 3.53 1691 1366 B 56 GLN H B 56 GLN HGx 1.0 0.0 3.60 1692 1366 B 56 GLN H B 56 GLN HGy 1.0 0.0 3.60 1693 1367 B 57 ARG H B 56 GLN HBy 1.0 0.0 3.38 1694 1367 B 57 ARG H B 56 GLN HBx 1.0 0.0 3.38 1695 1368 B 56 GLN HE2x B 56 GLN HGx 1.0 0.0 3.21 1696 1368 B 56 GLN HE2x B 56 GLN HGy 1.0 0.0 3.21 1697 1368 B 56 GLN HE2y B 56 GLN HGy 1.0 0.0 3.21 1698 1368 B 56 GLN HE2y B 56 GLN HGx 1.0 0.0 3.21 1699 1369 B 57 ARG H B 56 GLN HGx 1.0 0.0 4.92 1700 1369 B 57 ARG H B 56 GLN HGy 1.0 0.0 4.92 1701 1370 B 57 ARG H B 57 ARG HBx 1.0 0.0 3.37 1702 1370 B 57 ARG H B 57 ARG HBy 1.0 0.0 3.37 1703 1371 B 57 ARG H B 57 ARG HGy 1.0 0.0 4.39 1704 1371 B 57 ARG H B 57 ARG HGx 1.0 0.0 4.39 1705 1372 B 57 ARG HA B 57 ARG HDy 1.0 0.0 4.56 1706 1372 B 57 ARG HA B 57 ARG HDx 1.0 0.0 4.56 1707 1373 B 57 ARG HBy B 57 ARG HDy 1.0 0.0 3.43 1708 1373 B 57 ARG HBx B 57 ARG HDy 1.0 0.0 3.43 1709 1373 B 57 ARG HDx B 57 ARG HBx 1.0 0.0 3.43 1710 1373 B 57 ARG HBy B 57 ARG HDx 1.0 0.0 3.43 1711 1374 B 58 VAL HG21 B 57 ARG HBx 1.0 0.0 4.43 1712 1374 B 58 VAL HG21 B 57 ARG HBy 1.0 0.0 4.43 1713 1375 B 58 VAL HA B 61 TYR HBy 1.0 0.0 4.00 1714 1375 B 58 VAL HA B 61 TYR HBx 1.0 0.0 4.00 1715 1376 B 58 VAL HG11 B 59 ILE HG1y 1.0 0.0 4.30 1716 1376 B 58 VAL HG11 B 59 ILE HG1x 1.0 0.0 4.30 1717 1377 B 58 VAL HG11 B 62 ILE HG1y 1.0 0.0 3.90 1718 1377 B 58 VAL HG11 B 62 ILE HG1x 1.0 0.0 3.90 1719 1378 B 59 ILE H B 59 ILE HG1y 1.0 0.0 3.50 1720 1378 B 59 ILE H B 59 ILE HG1x 1.0 0.0 3.50 1721 1379 B 59 ILE HG21 B 59 ILE HG1y 1.0 0.0 3.36 1722 1379 B 59 ILE HG21 B 59 ILE HG1x 1.0 0.0 3.36 1723 1380 B 60 ASP H B 59 ILE HG1y 1.0 0.0 4.30 1724 1380 B 60 ASP H B 59 ILE HG1x 1.0 0.0 4.30 1725 1381 B 61 TYR H B 62 ILE HG1y 1.0 0.0 4.51 1726 1381 B 61 TYR H B 62 ILE HG1x 1.0 0.0 4.51 1727 1382 B 61 TYR HA B 64 ASP HBx 1.0 0.0 4.14 1728 1382 B 61 TYR HA B 64 ASP HBy 1.0 0.0 4.14 1729 1383 B 62 ILE H B 61 TYR HBy 1.0 0.0 3.93 1730 1383 B 62 ILE H B 61 TYR HBx 1.0 0.0 3.93 1731 1384 B 61 TYR HD% B 62 ILE HG1y 1.0 0.0 3.85 1732 1384 B 61 TYR HD% B 62 ILE HG1x 1.0 0.0 3.85 1733 1385 B 61 TYR HE% B 62 ILE HG1y 1.0 0.0 4.08 1734 1385 B 61 TYR HE% B 62 ILE HG1x 1.0 0.0 4.08 1735 1386 B 62 ILE H B 62 ILE HG1y 1.0 0.0 3.04 1736 1386 B 62 ILE H B 62 ILE HG1x 1.0 0.0 3.04 1737 1387 B 62 ILE HA B 62 ILE HG1y 1.0 0.0 3.84 1738 1387 B 62 ILE HA B 62 ILE HG1x 1.0 0.0 3.84 1739 1388 B 62 ILE HG21 B 66 GLN HGx 1.0 0.0 4.11 1740 1388 B 62 ILE HG21 B 66 GLN HGy 1.0 0.0 4.11 1741 1389 B 66 GLN HE2x B 62 ILE HG21 1.0 0.0 4.46 1742 1389 B 62 ILE HG21 B 66 GLN HE2y 1.0 0.0 4.46 1743 1390 B 63 LEU HA B 66 GLN HBy 1.0 0.0 4.58 1744 1390 B 63 LEU HA B 66 GLN HBx 1.0 0.0 4.58 1745 1391 B 63 LEU HD21 B 66 GLN HBy 1.0 0.0 4.30 1746 1391 B 63 LEU HD21 B 66 GLN HBx 1.0 0.0 4.30 1747 1392 B 63 LEU HD21 B 66 GLN HGx 1.0 0.0 6.10 1748 1392 B 63 LEU HD21 B 66 GLN HGy 1.0 0.0 6.10 1749 1393 B 64 ASP H B 64 ASP HBx 1.0 0.0 3.03 1750 1393 B 64 ASP H B 64 ASP HBy 1.0 0.0 3.03 1751 1394 B 65 LEU HD21 B 64 ASP HBx 1.0 0.0 4.73 1752 1394 B 65 LEU HD21 B 64 ASP HBy 1.0 0.0 4.73 1753 1395 B 65 LEU HD11 B 66 GLN HGx 1.0 0.0 4.53 1754 1395 B 65 LEU HD11 B 66 GLN HGy 1.0 0.0 4.53 1755 1396 B 66 GLN H B 66 GLN HBy 1.0 0.0 3.13 1756 1396 B 66 GLN H B 66 GLN HBx 1.0 0.0 3.13 1757 1397 B 66 GLN H B 66 GLN HGx 1.0 0.0 3.40 1758 1397 B 66 GLN H B 66 GLN HGy 1.0 0.0 3.40 1759 1398 B 66 GLN HA B 66 GLN HGx 1.0 0.0 3.61 1760 1398 B 66 GLN HA B 66 GLN HGy 1.0 0.0 3.61 1761 1399 B 67 VAL H B 66 GLN HBy 1.0 0.0 3.36 1762 1399 B 67 VAL H B 66 GLN HBx 1.0 0.0 3.36 1763 1400 B 66 GLN HE2y B 66 GLN HGx 1.0 0.0 3.21 1764 1400 B 66 GLN HE2x B 66 GLN HGy 1.0 0.0 3.21 1765 1400 B 66 GLN HE2y B 66 GLN HGy 1.0 0.0 3.21 1766 1400 B 66 GLN HE2x B 66 GLN HGx 1.0 0.0 3.21 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 27 ASP C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -80.1 -52.3 PHI 2 2 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 MET N 1.0 -53.7 -22.3 PSI 3 3 A 28 ASP C A 29 MET N A 29 MET CA A 29 MET C 1.0 -75.6 -52.2 PHI 4 4 A 29 MET N A 29 MET CA A 29 MET C A 30 ASN N 1.0 -53.9 -30.1 PSI 5 5 A 29 MET C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -78.3 -47.9 PHI 6 6 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 HIS N 1.0 -54.8 -28.2 PSI 7 7 A 30 ASN C A 31 HIS N A 31 HIS CA A 31 HIS C 1.0 -77.5 -51.1 PHI 8 8 A 31 HIS N A 31 HIS CA A 31 HIS C A 32 CYS N 1.0 -53.8 -29.6 PSI 9 9 A 31 HIS C A 32 CYS N A 32 CYS CA A 32 CYS C 1.0 -74.2 -54.2 PHI 10 10 A 32 CYS N A 32 CYS CA A 32 CYS C A 33 TYR N 1.0 -56.6 -32.0 PSI 11 11 A 32 CYS C A 33 TYR N A 33 TYR CA A 33 TYR C 1.0 -70.1 -50.1 PHI 12 12 A 33 TYR N A 33 TYR CA A 33 TYR C A 34 SER N 1.0 -54.3 -31.1 PSI 13 13 A 33 TYR C A 34 SER N A 34 SER CA A 34 SER C 1.0 -75.5 -49.9 PHI 14 14 A 34 SER N A 34 SER CA A 34 SER C A 35 ARG N 1.0 -54.0 -28.6 PSI 15 15 A 34 SER C A 35 ARG N A 35 ARG CA A 35 ARG C 1.0 -74.7 -54.7 PHI 16 16 A 35 ARG N A 35 ARG CA A 35 ARG C A 36 LEU N 1.0 -59.0 -25.6 PSI 17 17 A 35 ARG C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -78.2 -53.6 PHI 18 18 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 ARG N 1.0 -56.6 -25.4 PSI 19 19 A 51 GLN C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -71.6 -51.6 PHI 20 20 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 GLU N 1.0 -51.1 -31.1 PSI 21 21 A 52 VAL C A 53 GLU N A 53 GLU CA A 53 GLU C 1.0 -74.0 -54.0 PHI 22 22 A 53 GLU N A 53 GLU CA A 53 GLU C A 54 ILE N 1.0 -54.5 -27.5 PSI 23 23 A 53 GLU C A 54 ILE N A 54 ILE CA A 54 ILE C 1.0 -73.8 -51.2 PHI 24 24 A 54 ILE N A 54 ILE CA A 54 ILE C A 55 LEU N 1.0 -55.5 -28.7 PSI 25 25 A 54 ILE C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -69.7 -49.7 PHI 26 26 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 GLN N 1.0 -48.7 -28.7 PSI 27 27 A 55 LEU C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -71.7 -51.5 PHI 28 28 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 ARG N 1.0 -57.2 -36.4 PSI 29 29 A 56 GLN C A 57 ARG N A 57 ARG CA A 57 ARG C 1.0 -74.1 -54.1 PHI 30 30 A 57 ARG N A 57 ARG CA A 57 ARG C A 58 VAL N 1.0 -60.0 -21.0 PSI 31 31 A 57 ARG C A 58 VAL N A 58 VAL CA A 58 VAL C 1.0 -83.8 -48.2 PHI 32 32 A 58 VAL N A 58 VAL CA A 58 VAL C A 59 ILE N 1.0 -55.9 -27.3 PSI 33 33 A 58 VAL C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -71.9 -51.9 PHI 34 34 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 ASP N 1.0 -58.3 -31.3 PSI 35 35 A 59 ILE C A 60 ASP N A 60 ASP CA A 60 ASP C 1.0 -79.4 -45.8 PHI 36 36 A 60 ASP N A 60 ASP CA A 60 ASP C A 61 TYR N 1.0 -58.0 -18.8 PSI 37 37 A 60 ASP C A 61 TYR N A 61 TYR CA A 61 TYR C 1.0 -77.2 -57.2 PHI 38 38 A 61 TYR N A 61 TYR CA A 61 TYR C A 62 ILE N 1.0 -55.2 -31.2 PSI 39 39 A 61 TYR C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -74.0 -54.0 PHI 40 40 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 LEU N 1.0 -55.3 -27.3 PSI 41 41 A 62 ILE C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -69.4 -49.4 PHI 42 42 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 ASP N 1.0 -50.6 -30.6 PSI 43 43 A 63 LEU C A 64 ASP N A 64 ASP CA A 64 ASP C 1.0 -74.2 -54.2 PHI 44 44 A 64 ASP N A 64 ASP CA A 64 ASP C A 65 LEU N 1.0 -51.5 -31.5 PSI 45 45 B 27 ASP C B 28 ASP N B 28 ASP CA B 28 ASP C 1.0 -80.1 -52.3 PHI 46 46 B 28 ASP N B 28 ASP CA B 28 ASP C B 29 MET N 1.0 -53.7 -22.3 PSI 47 47 B 28 ASP C B 29 MET N B 29 MET CA B 29 MET C 1.0 -75.6 -52.2 PHI 48 48 B 29 MET N B 29 MET CA B 29 MET C B 30 ASN N 1.0 -53.9 -30.1 PSI 49 49 B 29 MET C B 30 ASN N B 30 ASN CA B 30 ASN C 1.0 -78.3 -47.9 PHI 50 50 B 30 ASN N B 30 ASN CA B 30 ASN C B 31 HIS N 1.0 -54.8 -28.2 PSI 51 51 B 30 ASN C B 31 HIS N B 31 HIS CA B 31 HIS C 1.0 -77.5 -51.1 PHI 52 52 B 31 HIS N B 31 HIS CA B 31 HIS C B 32 CYS N 1.0 -53.8 -29.6 PSI 53 53 B 31 HIS C B 32 CYS N B 32 CYS CA B 32 CYS C 1.0 -74.2 -54.2 PHI 54 54 B 32 CYS N B 32 CYS CA B 32 CYS C B 33 TYR N 1.0 -56.6 -32.0 PSI 55 55 B 32 CYS C B 33 TYR N B 33 TYR CA B 33 TYR C 1.0 -70.1 -50.1 PHI 56 56 B 33 TYR N B 33 TYR CA B 33 TYR C B 34 SER N 1.0 -54.3 -31.1 PSI 57 57 B 33 TYR C B 34 SER N B 34 SER CA B 34 SER C 1.0 -75.5 -49.9 PHI 58 58 B 34 SER N B 34 SER CA B 34 SER C B 35 ARG N 1.0 -54.0 -28.6 PSI 59 59 B 34 SER C B 35 ARG N B 35 ARG CA B 35 ARG C 1.0 -74.7 -54.7 PHI 60 60 B 35 ARG N B 35 ARG CA B 35 ARG C B 36 LEU N 1.0 -59.0 -25.6 PSI 61 61 B 35 ARG C B 36 LEU N B 36 LEU CA B 36 LEU C 1.0 -78.2 -53.6 PHI 62 62 B 36 LEU N B 36 LEU CA B 36 LEU C B 37 ARG N 1.0 -56.6 -25.4 PSI 63 63 B 51 GLN N B 51 GLN CA B 51 GLN C B 52 VAL N 1.0 -55.3 -25.7 PSI 64 64 B 51 GLN C B 52 VAL N B 52 VAL CA B 52 VAL C 1.0 -71.6 -51.6 PHI 65 65 B 52 VAL N B 52 VAL CA B 52 VAL C B 53 GLU N 1.0 -51.1 -31.1 PSI 66 66 B 52 VAL C B 53 GLU N B 53 GLU CA B 53 GLU C 1.0 -74.0 -54.0 PHI 67 67 B 53 GLU N B 53 GLU CA B 53 GLU C B 54 ILE N 1.0 -54.5 -27.5 PSI 68 68 B 53 GLU C B 54 ILE N B 54 ILE CA B 54 ILE C 1.0 -73.8 -51.2 PHI 69 69 B 54 ILE N B 54 ILE CA B 54 ILE C B 55 LEU N 1.0 -55.5 -28.7 PSI 70 70 B 54 ILE C B 55 LEU N B 55 LEU CA B 55 LEU C 1.0 -69.7 -49.7 PHI 71 71 B 55 LEU N B 55 LEU CA B 55 LEU C B 56 GLN N 1.0 -48.7 -28.7 PSI 72 72 B 55 LEU C B 56 GLN N B 56 GLN CA B 56 GLN C 1.0 -71.7 -51.5 PHI 73 73 B 56 GLN N B 56 GLN CA B 56 GLN C B 57 ARG N 1.0 -57.2 -36.4 PSI 74 74 B 56 GLN C B 57 ARG N B 57 ARG CA B 57 ARG C 1.0 -74.1 -54.1 PHI 75 75 B 57 ARG N B 57 ARG CA B 57 ARG C B 58 VAL N 1.0 -60.0 -21.0 PSI 76 76 B 57 ARG C B 58 VAL N B 58 VAL CA B 58 VAL C 1.0 -83.8 -48.2 PHI 77 77 B 58 VAL N B 58 VAL CA B 58 VAL C B 59 ILE N 1.0 -55.9 -27.3 PSI 78 78 B 58 VAL C B 59 ILE N B 59 ILE CA B 59 ILE C 1.0 -71.9 -51.9 PHI 79 79 B 59 ILE N B 59 ILE CA B 59 ILE C B 60 ASP N 1.0 -58.3 -31.3 PSI 80 80 B 59 ILE C B 60 ASP N B 60 ASP CA B 60 ASP C 1.0 -79.4 -45.8 PHI 81 81 B 60 ASP N B 60 ASP CA B 60 ASP C B 61 TYR N 1.0 -58.0 -18.8 PSI 82 82 B 60 ASP C B 61 TYR N B 61 TYR CA B 61 TYR C 1.0 -77.2 -57.2 PHI 83 83 B 61 TYR N B 61 TYR CA B 61 TYR C B 62 ILE N 1.0 -55.2 -31.2 PSI 84 84 B 61 TYR C B 62 ILE N B 62 ILE CA B 62 ILE C 1.0 -74.0 -54.0 PHI 85 85 B 62 ILE N B 62 ILE CA B 62 ILE C B 63 LEU N 1.0 -55.3 -27.3 PSI 86 86 B 62 ILE C B 63 LEU N B 63 LEU CA B 63 LEU C 1.0 -69.4 -49.4 PHI 87 87 B 63 LEU N B 63 LEU CA B 63 LEU C B 64 ASP N 1.0 -50.6 -30.6 PSI 88 88 B 63 LEU C B 64 ASP N B 64 ASP CA B 64 ASP C 1.0 -74.2 -54.2 PHI 89 89 B 64 ASP N B 64 ASP CA B 64 ASP C B 65 LEU N 1.0 -51.5 -31.5 PSI stop_ save_ save_n _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode n _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 3685.3 2 1H 7370.5 3 15N 1940 stop_ save_ save_ali _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode ali _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 3685.3 2 1H 7370.5 3 13C 7099.8 stop_ save_ save_aro _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode aro _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 3685.3 2 1H 7370.5 3 13C 7099.8 stop_ save_