data_nef_c15834_2k5f 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 CtR121 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 LYS middle . . 3 A 3 LEU middle . . 4 A 4 SER middle . . 5 A 5 GLU middle . . 6 A 6 LEU middle . . 7 A 7 LYS middle . . 8 A 8 ALA middle . . 9 A 9 GLY middle . false 10 A 10 ASP middle . . 11 A 11 ARG middle . . 12 A 12 ALA middle . . 13 A 13 GLU middle . . 14 A 14 VAL middle . . 15 A 15 THR middle . . 16 A 16 SER middle . . 17 A 17 VAL middle . . 18 A 18 ALA middle . . 19 A 19 ALA middle . . 20 A 20 GLU middle . . 21 A 21 PRO middle . false 22 A 22 ALA middle . . 23 A 23 VAL middle . . 24 A 24 ARG middle . . 25 A 25 ARG middle . . 26 A 26 ARG middle . . 27 A 27 LEU middle . . 28 A 28 MET middle . . 29 A 29 ASP middle . . 30 A 30 LEU middle . . 31 A 31 GLY middle . false 32 A 32 LEU middle . . 33 A 33 VAL middle . . 34 A 34 ARG middle . . 35 A 35 GLY middle . false 36 A 36 ALA middle . . 37 A 37 LYS middle . . 38 A 38 LEU middle . . 39 A 39 LYS middle . . 40 A 40 VAL middle . . 41 A 41 LEU middle . . 42 A 42 ARG middle . . 43 A 43 PHE middle . . 44 A 44 ALA middle . . 45 A 45 PRO middle . false 46 A 46 LEU middle . . 47 A 47 GLY middle . false 48 A 48 ASP middle . . 49 A 49 PRO middle . true 50 A 50 ILE middle . . 51 A 51 GLU middle . . 52 A 52 VAL middle . . 53 A 53 ASN middle . . 54 A 54 CYS middle . . 55 A 55 ASN middle . . 56 A 56 GLY middle . false 57 A 57 MET middle . . 58 A 58 LEU middle . . 59 A 59 LEU middle . . 60 A 60 THR middle . . 61 A 61 MET middle . . 62 A 62 ARG middle . . 63 A 63 ARG middle . . 64 A 64 ASN middle . . 65 A 65 GLU middle . . 66 A 66 ALA middle . . 67 A 67 GLU middle . . 68 A 68 GLY middle . false 69 A 69 ILE middle . . 70 A 70 THR middle . . 71 A 71 VAL middle . . 72 A 72 HIS middle . . 73 A 73 ILE middle . . 74 A 74 LEU middle . . 75 A 75 ALA middle . . 76 A 76 GLY middle . false 77 A 77 ASP middle . . 78 A 78 GLU middle . . 79 A 79 GLY middle . false 80 A 80 HIS middle . . 81 A 81 PRO middle . false 82 A 82 HIS middle . . 83 A 83 GLY middle . false 84 A 84 TRP middle . . 85 A 85 PRO middle . false 86 A 86 GLY middle . false 87 A 87 PHE middle . . 88 A 88 ARG middle . . 89 A 89 ARG middle . . 90 A 90 ARG middle . . 91 A 91 HIS middle . . 92 A 92 ARG middle . . 93 A 93 PHE middle . . 94 A 94 GLY middle . false 95 A 95 LYS middle . . 96 A 96 ARG middle . . 97 A 97 ALA middle . . 98 A 98 LEU middle . . 99 A 99 GLU middle . . 100 A 100 HIS middle . . 101 A 101 HIS middle . . 102 A 102 HIS middle . . 103 A 103 HIS middle . . 104 A 104 HIS middle . . 105 A 105 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.226 0.020 A 1 MET HBx H 1 2.157 0.020 A 1 MET HBy H 1 2.157 0.020 A 1 MET HE% H 1 2.050 0.020 A 1 MET HGx H 1 2.467 0.020 A 1 MET HGy H 1 2.467 0.020 A 1 MET C C 13 172.471 0.400 A 1 MET CA C 13 54.946 0.400 A 1 MET CB C 13 33.443 0.400 A 1 MET CE C 13 16.800 0.400 A 1 MET CG C 13 30.653 0.400 A 2 LYS H H 1 9.220 0.020 A 2 LYS HA H 1 5.341 0.020 A 2 LYS HBy H 1 2.042 0.020 A 2 LYS HBx H 1 1.740 0.020 A 2 LYS HDy H 1 1.715 0.020 A 2 LYS HDx H 1 1.462 0.020 A 2 LYS HEx H 1 2.949 0.020 A 2 LYS HEy H 1 2.949 0.020 A 2 LYS HGy H 1 1.537 0.020 A 2 LYS HGx H 1 1.466 0.020 A 2 LYS C C 13 178.833 0.400 A 2 LYS CA C 13 54.043 0.400 A 2 LYS CB C 13 34.584 0.400 A 2 LYS CD C 13 28.462 0.400 A 2 LYS CE C 13 42.009 0.400 A 2 LYS CG C 13 24.503 0.400 A 2 LYS N N 15 124.072 0.400 A 3 LEU H H 1 8.895 0.020 A 3 LEU HA H 1 3.867 0.020 A 3 LEU HB2 H 1 1.265 0.020 A 3 LEU HB3 H 1 2.332 0.020 A 3 LEU HD1% H 1 0.835 0.020 A 3 LEU HD2% H 1 0.779 0.020 A 3 LEU HG H 1 1.502 0.020 A 3 LEU C C 13 176.369 0.400 A 3 LEU CA C 13 58.172 0.400 A 3 LEU CB C 13 41.141 0.400 A 3 LEU CD1 C 13 25.370 0.400 A 3 LEU CD2 C 13 26.016 0.400 A 3 LEU CG C 13 27.598 0.400 A 3 LEU N N 15 123.303 0.400 A 4 SER H H 1 6.934 0.020 A 4 SER HA H 1 3.912 0.020 A 4 SER HBy H 1 4.145 0.020 A 4 SER HBx H 1 3.494 0.020 A 4 SER C C 13 174.073 0.400 A 4 SER CA C 13 59.303 0.400 A 4 SER CB C 13 62.241 0.400 A 4 SER N N 15 105.316 0.400 A 5 GLU H H 1 7.703 0.020 A 5 GLU HA H 1 4.375 0.020 A 5 GLU HBx H 1 2.225 0.020 A 5 GLU HBy H 1 2.225 0.020 A 5 GLU HGx H 1 2.212 0.020 A 5 GLU HGy H 1 2.212 0.020 A 5 GLU C C 13 176.407 0.400 A 5 GLU CA C 13 56.011 0.400 A 5 GLU CB C 13 30.656 0.400 A 5 GLU CG C 13 37.646 0.400 A 5 GLU N N 15 119.533 0.400 A 6 LEU H H 1 7.206 0.020 A 6 LEU HA H 1 4.265 0.020 A 6 LEU HBx H 1 1.944 0.020 A 6 LEU HBy H 1 1.944 0.020 A 6 LEU HD1% H 1 0.753 0.020 A 6 LEU HD2% H 1 0.791 0.020 A 6 LEU HG H 1 1.963 0.020 A 6 LEU C C 13 174.536 0.400 A 6 LEU CA C 13 54.942 0.400 A 6 LEU CB C 13 42.420 0.400 A 6 LEU CD1 C 13 25.860 0.400 A 6 LEU CD2 C 13 22.900 0.400 A 6 LEU CG C 13 27.558 0.400 A 6 LEU N N 15 120.218 0.400 A 7 LYS H H 1 8.817 0.020 A 7 LYS HA H 1 4.545 0.020 A 7 LYS HBx H 1 1.729 0.020 A 7 LYS HBy H 1 1.729 0.020 A 7 LYS HDx H 1 1.613 0.020 A 7 LYS HDy H 1 1.613 0.020 A 7 LYS HEx H 1 3.000 0.020 A 7 LYS HEy H 1 3.000 0.020 A 7 LYS HGy H 1 1.479 0.020 A 7 LYS HGx H 1 1.340 0.020 A 7 LYS C C 13 176.259 0.400 A 7 LYS CA C 13 53.412 0.400 A 7 LYS CB C 13 34.582 0.400 A 7 LYS CD C 13 28.484 0.400 A 7 LYS CE C 13 42.058 0.400 A 7 LYS CG C 13 23.892 0.400 A 7 LYS N N 15 117.148 0.400 A 8 ALA H H 1 8.551 0.020 A 8 ALA HA H 1 3.623 0.020 A 8 ALA HB% H 1 1.310 0.020 A 8 ALA C C 13 178.113 0.400 A 8 ALA CA C 13 53.833 0.400 A 8 ALA CB C 13 17.520 0.400 A 8 ALA N N 15 121.423 0.400 A 9 GLY H H 1 8.928 0.020 A 9 GLY HAy H 1 4.469 0.020 A 9 GLY HAx H 1 3.522 0.020 A 9 GLY C C 13 174.349 0.400 A 9 GLY CA C 13 44.750 0.400 A 9 GLY N N 15 112.833 0.400 A 10 ASP H H 1 8.113 0.020 A 10 ASP HA H 1 4.543 0.020 A 10 ASP HB2 H 1 2.925 0.020 A 10 ASP HB3 H 1 2.409 0.020 A 10 ASP C C 13 175.042 0.400 A 10 ASP CA C 13 55.588 0.400 A 10 ASP CB C 13 41.994 0.400 A 10 ASP N N 15 121.420 0.400 A 11 ARG H H 1 8.713 0.020 A 11 ARG HA H 1 5.295 0.020 A 11 ARG HBx H 1 1.795 0.020 A 11 ARG HBy H 1 1.795 0.020 A 11 ARG HDx H 1 3.226 0.020 A 11 ARG HDy H 1 3.226 0.020 A 11 ARG HGy H 1 1.800 0.020 A 11 ARG HGx H 1 1.516 0.020 A 11 ARG C C 13 175.536 0.400 A 11 ARG CA C 13 54.160 0.400 A 11 ARG CB C 13 32.837 0.400 A 11 ARG CD C 13 43.323 0.400 A 11 ARG CG C 13 28.116 0.400 A 11 ARG N N 15 119.533 0.400 A 12 ALA H H 1 8.924 0.020 A 12 ALA HA H 1 5.081 0.020 A 12 ALA HB% H 1 1.083 0.020 A 12 ALA C C 13 174.056 0.400 A 12 ALA CA C 13 50.771 0.400 A 12 ALA CB C 13 24.104 0.400 A 12 ALA N N 15 121.883 0.400 A 13 GLU H H 1 8.768 0.020 A 13 GLU HA H 1 5.466 0.020 A 13 GLU HBy H 1 1.890 0.020 A 13 GLU HBx H 1 1.825 0.020 A 13 GLU HGx H 1 2.096 0.020 A 13 GLU HGy H 1 2.096 0.020 A 13 GLU C C 13 176.173 0.400 A 13 GLU CA C 13 52.951 0.400 A 13 GLU CB C 13 33.333 0.400 A 13 GLU CG C 13 36.236 0.400 A 13 GLU N N 15 118.842 0.400 A 14 VAL H H 1 8.864 0.020 A 14 VAL HA H 1 3.933 0.020 A 14 VAL HB H 1 2.293 0.020 A 14 VAL HG1% H 1 0.598 0.020 A 14 VAL HG2% H 1 0.810 0.020 A 14 VAL C C 13 176.948 0.400 A 14 VAL CA C 13 63.639 0.400 A 14 VAL CB C 13 31.922 0.400 A 14 VAL CG1 C 13 21.428 0.400 A 14 VAL CG2 C 13 22.491 0.400 A 14 VAL N N 15 124.706 0.400 A 15 THR H H 1 9.566 0.020 A 15 THR HA H 1 4.513 0.020 A 15 THR HB H 1 4.050 0.020 A 15 THR HG2% H 1 1.007 0.020 A 15 THR C C 13 174.495 0.400 A 15 THR CA C 13 62.622 0.400 A 15 THR CB C 13 68.718 0.400 A 15 THR CG2 C 13 22.111 0.400 A 15 THR N N 15 123.302 0.400 A 16 SER H H 1 7.555 0.020 A 16 SER HA H 1 4.536 0.020 A 16 SER HBx H 1 3.823 0.020 A 16 SER HBy H 1 3.823 0.020 A 16 SER C C 13 171.666 0.400 A 16 SER CA C 13 58.621 0.400 A 16 SER CB C 13 64.368 0.400 A 16 SER N N 15 114.325 0.400 A 17 VAL H H 1 8.580 0.020 A 17 VAL HA H 1 4.328 0.020 A 17 VAL HB H 1 1.949 0.020 A 17 VAL HGx% H 1 0.747 0.020 A 17 VAL HGy% H 1 0.747 0.020 A 17 VAL C C 13 174.002 0.400 A 17 VAL CA C 13 61.865 0.400 A 17 VAL CB C 13 34.020 0.400 A 17 VAL CG1 C 13 20.557 0.400 A 17 VAL CG2 C 13 20.557 0.400 A 17 VAL N N 15 122.830 0.400 A 18 ALA H H 1 8.643 0.020 A 18 ALA HA H 1 4.682 0.020 A 18 ALA HB% H 1 1.349 0.020 A 18 ALA C C 13 175.191 0.400 A 18 ALA CA C 13 51.196 0.400 A 18 ALA CB C 13 19.265 0.400 A 18 ALA N N 15 131.826 0.400 A 19 ALA H H 1 7.682 0.020 A 19 ALA HA H 1 4.430 0.020 A 19 ALA HB% H 1 1.263 0.020 A 19 ALA C C 13 175.636 0.400 A 19 ALA CA C 13 50.909 0.400 A 19 ALA CB C 13 21.024 0.400 A 19 ALA N N 15 122.356 0.400 A 20 GLU H H 1 8.698 0.020 A 20 GLU HA H 1 4.522 0.020 A 20 GLU HB2 H 1 2.014 0.020 A 20 GLU HB3 H 1 2.261 0.020 A 20 GLU HGx H 1 2.387 0.020 A 20 GLU HGy H 1 2.387 0.020 A 20 GLU C C 13 175.232 0.400 A 20 GLU CA C 13 55.168 0.400 A 20 GLU CB C 13 28.253 0.400 A 20 GLU CG C 13 36.323 0.400 A 20 GLU N N 15 120.758 0.400 A 21 PRO HA H 1 4.113 0.020 A 21 PRO HB2 H 1 2.008 0.020 A 21 PRO HB3 H 1 2.393 0.020 A 21 PRO HD2 H 1 3.853 0.020 A 21 PRO HD3 H 1 3.950 0.020 A 21 PRO HGy H 1 2.251 0.020 A 21 PRO HGx H 1 2.083 0.020 A 21 PRO C C 13 178.465 0.400 A 21 PRO CA C 13 67.032 0.400 A 21 PRO CB C 13 31.960 0.400 A 21 PRO CD C 13 50.049 0.400 A 21 PRO CG C 13 27.474 0.400 A 22 ALA H H 1 9.026 0.020 A 22 ALA HA H 1 4.125 0.020 A 22 ALA HB% H 1 1.465 0.020 A 22 ALA C C 13 180.802 0.400 A 22 ALA CA C 13 55.184 0.400 A 22 ALA CB C 13 18.204 0.400 A 22 ALA N N 15 119.023 0.400 A 23 VAL H H 1 7.244 0.020 A 23 VAL HA H 1 3.682 0.020 A 23 VAL HB H 1 2.167 0.020 A 23 VAL HG1% H 1 0.912 0.020 A 23 VAL HG2% H 1 1.057 0.020 A 23 VAL C C 13 177.147 0.400 A 23 VAL CA C 13 65.189 0.400 A 23 VAL CB C 13 31.942 0.400 A 23 VAL CG1 C 13 20.797 0.400 A 23 VAL CG2 C 13 21.901 0.400 A 23 VAL N N 15 119.533 0.400 A 24 ARG H H 1 8.648 0.020 A 24 ARG HA H 1 3.553 0.020 A 24 ARG HB2 H 1 1.690 0.020 A 24 ARG HB3 H 1 1.816 0.020 A 24 ARG HDx H 1 3.238 0.020 A 24 ARG HDy H 1 3.238 0.020 A 24 ARG HE H 1 7.371 0.020 A 24 ARG HGx H 1 1.501 0.020 A 24 ARG HGy H 1 1.501 0.020 A 24 ARG C C 13 178.340 0.400 A 24 ARG CA C 13 60.135 0.400 A 24 ARG CB C 13 29.986 0.400 A 24 ARG CD C 13 42.908 0.400 A 24 ARG CG C 13 27.592 0.400 A 24 ARG N N 15 119.811 0.400 A 24 ARG NE N 15 84.332 0.400 A 25 ARG H H 1 8.040 0.020 A 25 ARG HA H 1 4.016 0.020 A 25 ARG HBx H 1 1.888 0.020 A 25 ARG HBy H 1 1.888 0.020 A 25 ARG HDx H 1 3.216 0.020 A 25 ARG HDy H 1 3.216 0.020 A 25 ARG HGx H 1 1.674 0.020 A 25 ARG HGy H 1 1.674 0.020 A 25 ARG C C 13 177.289 0.400 A 25 ARG CA C 13 58.775 0.400 A 25 ARG CB C 13 29.779 0.400 A 25 ARG CD C 13 42.902 0.400 A 25 ARG CG C 13 26.702 0.400 A 25 ARG N N 15 117.344 0.400 A 26 ARG H H 1 7.296 0.020 A 26 ARG HA H 1 4.116 0.020 A 26 ARG HBx H 1 1.960 0.020 A 26 ARG HBy H 1 1.960 0.020 A 26 ARG HDy H 1 3.325 0.020 A 26 ARG HDx H 1 3.174 0.020 A 26 ARG HE H 1 7.644 0.020 A 26 ARG HGx H 1 1.529 0.020 A 26 ARG HGy H 1 1.752 0.020 A 26 ARG C C 13 178.694 0.400 A 26 ARG CA C 13 59.081 0.400 A 26 ARG CB C 13 29.763 0.400 A 26 ARG CD C 13 43.121 0.400 A 26 ARG CG C 13 27.325 0.400 A 26 ARG N N 15 119.970 0.400 A 26 ARG NE N 15 83.992 0.400 A 27 LEU H H 1 8.311 0.020 A 27 LEU HA H 1 3.986 0.020 A 27 LEU HB2 H 1 1.843 0.020 A 27 LEU HB3 H 1 1.558 0.020 A 27 LEU HD1% H 1 0.698 0.020 A 27 LEU HD2% H 1 0.756 0.020 A 27 LEU HG H 1 1.925 0.020 A 27 LEU C C 13 179.103 0.400 A 27 LEU CA C 13 57.753 0.400 A 27 LEU CB C 13 40.283 0.400 A 27 LEU CD1 C 13 26.019 0.400 A 27 LEU CD2 C 13 21.903 0.400 A 27 LEU CG C 13 26.401 0.400 A 27 LEU N N 15 116.676 0.400 A 28 MET H H 1 8.423 0.020 A 28 MET HA H 1 3.840 0.020 A 28 MET HBx H 1 2.133 0.020 A 28 MET HBy H 1 2.133 0.020 A 28 MET HE% H 1 2.086 0.020 A 28 MET HGy H 1 2.617 0.020 A 28 MET HGx H 1 2.520 0.020 A 28 MET C C 13 180.112 0.400 A 28 MET CA C 13 59.096 0.400 A 28 MET CB C 13 32.393 0.400 A 28 MET CE C 13 16.655 0.400 A 28 MET CG C 13 31.509 0.400 A 28 MET N N 15 119.972 0.400 A 29 ASP H H 1 8.203 0.020 A 29 ASP HA H 1 4.392 0.020 A 29 ASP HB2 H 1 2.888 0.020 A 29 ASP HB3 H 1 2.669 0.020 A 29 ASP C C 13 177.989 0.400 A 29 ASP CA C 13 56.886 0.400 A 29 ASP CB C 13 39.837 0.400 A 29 ASP N N 15 121.889 0.400 A 30 LEU H H 1 7.359 0.020 A 30 LEU HA H 1 4.309 0.020 A 30 LEU HB2 H 1 1.874 0.020 A 30 LEU HB3 H 1 1.738 0.020 A 30 LEU HD1% H 1 0.903 0.020 A 30 LEU HD2% H 1 0.904 0.020 A 30 LEU HG H 1 1.904 0.020 A 30 LEU C C 13 176.230 0.400 A 30 LEU CA C 13 55.125 0.400 A 30 LEU CB C 13 42.455 0.400 A 30 LEU CD1 C 13 25.734 0.400 A 30 LEU CD2 C 13 22.327 0.400 A 30 LEU CG C 13 26.254 0.400 A 30 LEU N N 15 118.568 0.400 A 31 GLY H H 1 7.674 0.020 A 31 GLY HA2 H 1 3.542 0.020 A 31 GLY HA3 H 1 4.293 0.020 A 31 GLY C C 13 173.423 0.400 A 31 GLY CA C 13 44.470 0.400 A 31 GLY N N 15 104.360 0.400 A 32 LEU H H 1 7.998 0.020 A 32 LEU HA H 1 4.066 0.020 A 32 LEU HBy H 1 1.488 0.020 A 32 LEU HBx H 1 1.402 0.020 A 32 LEU HD1% H 1 0.767 0.020 A 32 LEU HD2% H 1 0.695 0.020 A 32 LEU HG H 1 1.469 0.020 A 32 LEU C C 13 172.137 0.400 A 32 LEU CA C 13 54.944 0.400 A 32 LEU CB C 13 39.412 0.400 A 32 LEU CD1 C 13 26.469 0.400 A 32 LEU CD2 C 13 25.363 0.400 A 32 LEU CG C 13 28.055 0.400 A 32 LEU N N 15 124.253 0.400 A 33 VAL H H 1 6.623 0.020 A 33 VAL HA H 1 4.355 0.020 A 33 VAL HB H 1 2.183 0.020 A 33 VAL HG1% H 1 0.849 0.020 A 33 VAL HG2% H 1 0.675 0.020 A 33 VAL C C 13 174.752 0.400 A 33 VAL CA C 13 57.745 0.400 A 33 VAL CB C 13 35.957 0.400 A 33 VAL CG1 C 13 22.324 0.400 A 33 VAL CG2 C 13 17.242 0.400 A 33 VAL N N 15 113.850 0.400 A 34 ARG H H 1 8.581 0.020 A 34 ARG HA H 1 3.534 0.020 A 34 ARG HBx H 1 1.683 0.020 A 34 ARG HBy H 1 1.683 0.020 A 34 ARG HDy H 1 3.271 0.020 A 34 ARG HDx H 1 3.202 0.020 A 34 ARG HGy H 1 1.650 0.020 A 34 ARG HGx H 1 1.449 0.020 A 34 ARG C C 13 176.783 0.400 A 34 ARG CA C 13 58.644 0.400 A 34 ARG CB C 13 29.331 0.400 A 34 ARG CD C 13 43.371 0.400 A 34 ARG CG C 13 27.121 0.400 A 34 ARG N N 15 120.945 0.400 A 35 GLY H H 1 9.098 0.020 A 35 GLY HA2 H 1 3.740 0.020 A 35 GLY HA3 H 1 4.399 0.020 A 35 GLY C C 13 174.219 0.400 A 35 GLY CA C 13 44.623 0.400 A 35 GLY N N 15 115.255 0.400 A 36 ALA H H 1 8.328 0.020 A 36 ALA HA H 1 4.385 0.020 A 36 ALA HB% H 1 1.539 0.020 A 36 ALA C C 13 176.245 0.400 A 36 ALA CA C 13 52.938 0.400 A 36 ALA CB C 13 19.710 0.400 A 36 ALA N N 15 123.595 0.400 A 37 LYS H H 1 8.231 0.020 A 37 LYS HA H 1 5.042 0.020 A 37 LYS HBy H 1 1.880 0.020 A 37 LYS HBx H 1 1.752 0.020 A 37 LYS HDx H 1 1.615 0.020 A 37 LYS HDy H 1 1.615 0.020 A 37 LYS HEx H 1 2.995 0.020 A 37 LYS HEy H 1 2.995 0.020 A 37 LYS HGy H 1 1.614 0.020 A 37 LYS HGx H 1 1.417 0.020 A 37 LYS C C 13 175.718 0.400 A 37 LYS CA C 13 54.728 0.400 A 37 LYS CB C 13 33.308 0.400 A 37 LYS CD C 13 28.897 0.400 A 37 LYS CE C 13 42.266 0.400 A 37 LYS CG C 13 25.633 0.400 A 37 LYS N N 15 119.533 0.400 A 38 LEU H H 1 9.372 0.020 A 38 LEU HA H 1 5.631 0.020 A 38 LEU HB2 H 1 1.456 0.020 A 38 LEU HB3 H 1 1.317 0.020 A 38 LEU HDx% H 1 0.613 0.020 A 38 LEU HDy% H 1 0.613 0.020 A 38 LEU HG H 1 1.611 0.020 A 38 LEU C C 13 175.923 0.400 A 38 LEU CA C 13 52.527 0.400 A 38 LEU CB C 13 45.960 0.400 A 38 LEU CD1 C 13 25.836 0.400 A 38 LEU CD2 C 13 25.836 0.400 A 38 LEU CG C 13 25.843 0.400 A 38 LEU N N 15 120.478 0.400 A 39 LYS H H 1 8.549 0.020 A 39 LYS HA H 1 5.193 0.020 A 39 LYS HBx H 1 1.672 0.020 A 39 LYS HBy H 1 1.672 0.020 A 39 LYS HDx H 1 1.556 0.020 A 39 LYS HDy H 1 1.556 0.020 A 39 LYS HEx H 1 2.862 0.020 A 39 LYS HEy H 1 2.862 0.020 A 39 LYS HGy H 1 1.174 0.020 A 39 LYS HGx H 1 1.063 0.020 A 39 LYS C C 13 175.907 0.400 A 39 LYS CA C 13 54.686 0.400 A 39 LYS CB C 13 36.504 0.400 A 39 LYS CD C 13 29.634 0.400 A 39 LYS CE C 13 42.005 0.400 A 39 LYS CG C 13 24.941 0.400 A 39 LYS N N 15 120.917 0.400 A 40 VAL H H 1 8.848 0.020 A 40 VAL HA H 1 3.791 0.020 A 40 VAL HB H 1 2.246 0.020 A 40 VAL HG1% H 1 0.566 0.020 A 40 VAL HG2% H 1 0.799 0.020 A 40 VAL C C 13 175.501 0.400 A 40 VAL CA C 13 63.696 0.400 A 40 VAL CB C 13 31.069 0.400 A 40 VAL CG1 C 13 21.403 0.400 A 40 VAL CG2 C 13 22.329 0.400 A 40 VAL N N 15 127.328 0.400 A 41 LEU H H 1 8.978 0.020 A 41 LEU HA H 1 4.441 0.020 A 41 LEU HBy H 1 1.525 0.020 A 41 LEU HBx H 1 1.435 0.020 A 41 LEU HD1% H 1 0.809 0.020 A 41 LEU HD2% H 1 0.755 0.020 A 41 LEU HG H 1 1.544 0.020 A 41 LEU C C 13 176.826 0.400 A 41 LEU CA C 13 55.997 0.400 A 41 LEU CB C 13 42.448 0.400 A 41 LEU CD1 C 13 25.818 0.400 A 41 LEU CD2 C 13 22.320 0.400 A 41 LEU CG C 13 26.741 0.400 A 41 LEU N N 15 129.919 0.400 A 42 ARG H H 1 7.506 0.020 A 42 ARG HA H 1 4.426 0.020 A 42 ARG HBy H 1 1.946 0.020 A 42 ARG HBx H 1 1.698 0.020 A 42 ARG HDy H 1 3.140 0.020 A 42 ARG HDx H 1 3.048 0.020 A 42 ARG HE H 1 7.403 0.020 A 42 ARG HGx H 1 1.336 0.020 A 42 ARG HGy H 1 1.336 0.020 A 42 ARG C C 13 172.739 0.400 A 42 ARG CA C 13 55.582 0.400 A 42 ARG CB C 13 32.799 0.400 A 42 ARG CD C 13 43.062 0.400 A 42 ARG CG C 13 26.264 0.400 A 42 ARG N N 15 112.886 0.400 A 42 ARG NE N 15 84.480 0.400 A 43 PHE H H 1 8.759 0.020 A 43 PHE HA H 1 4.756 0.020 A 43 PHE HB2 H 1 2.857 0.020 A 43 PHE HB3 H 1 3.011 0.020 A 43 PHE HD1 H 1 7.079 0.020 A 43 PHE HD2 H 1 7.079 0.020 A 43 PHE HE1 H 1 7.168 0.020 A 43 PHE HE2 H 1 7.168 0.020 A 43 PHE HZ H 1 7.301 0.020 A 43 PHE C C 13 175.289 0.400 A 43 PHE CA C 13 56.449 0.400 A 43 PHE CB C 13 41.541 0.400 A 43 PHE CD1 C 13 131.242 0.400 A 43 PHE CD2 C 13 131.242 0.400 A 43 PHE CE1 C 13 131.264 0.400 A 43 PHE CE2 C 13 131.264 0.400 A 43 PHE CZ C 13 130.343 0.400 A 43 PHE N N 15 121.417 0.400 A 44 ALA H H 1 7.942 0.020 A 44 ALA HA H 1 4.489 0.020 A 44 ALA HB% H 1 1.391 0.020 A 44 ALA CA C 13 51.212 0.400 A 44 ALA CB C 13 17.061 0.400 A 44 ALA N N 15 125.670 0.400 A 45 PRO HA H 1 4.289 0.020 A 45 PRO HB2 H 1 1.878 0.020 A 45 PRO HB3 H 1 2.387 0.020 A 45 PRO HDy H 1 3.841 0.020 A 45 PRO HDx H 1 3.751 0.020 A 45 PRO HGy H 1 2.174 0.020 A 45 PRO HGx H 1 2.050 0.020 A 45 PRO C C 13 177.731 0.400 A 45 PRO CA C 13 65.636 0.400 A 45 PRO CB C 13 31.517 0.400 A 45 PRO CD C 13 50.022 0.400 A 45 PRO CG C 13 27.593 0.400 A 46 LEU H H 1 8.465 0.020 A 46 LEU HA H 1 4.280 0.020 A 46 LEU HB2 H 1 1.982 0.020 A 46 LEU HB3 H 1 1.752 0.020 A 46 LEU HD1% H 1 0.946 0.020 A 46 LEU HD2% H 1 0.889 0.020 A 46 LEU HG H 1 1.627 0.020 A 46 LEU C C 13 177.925 0.400 A 46 LEU CA C 13 55.561 0.400 A 46 LEU CB C 13 40.266 0.400 A 46 LEU CD1 C 13 24.960 0.400 A 46 LEU CD2 C 13 22.755 0.400 A 46 LEU CG C 13 27.138 0.400 A 46 LEU N N 15 115.257 0.400 A 47 GLY H H 1 8.609 0.020 A 47 GLY HA2 H 1 3.490 0.020 A 47 GLY HA3 H 1 4.141 0.020 A 47 GLY C C 13 172.011 0.400 A 47 GLY CA C 13 45.879 0.400 A 47 GLY N N 15 107.678 0.400 A 48 ASP H H 1 6.794 0.020 A 48 ASP HA H 1 4.901 0.020 A 48 ASP HBy H 1 2.671 0.020 A 48 ASP HBx H 1 2.527 0.020 A 48 ASP CA C 13 50.759 0.400 A 48 ASP CB C 13 44.669 0.400 A 48 ASP N N 15 117.029 0.400 A 49 PRO HA H 1 5.531 0.020 A 49 PRO HBx H 1 2.033 0.020 A 49 PRO HBy H 1 2.033 0.020 A 49 PRO HDx H 1 3.398 0.020 A 49 PRO HDy H 1 3.398 0.020 A 49 PRO HGy H 1 1.818 0.020 A 49 PRO HGx H 1 1.597 0.020 A 49 PRO C C 13 174.205 0.400 A 49 PRO CA C 13 63.501 0.400 A 49 PRO CB C 13 35.888 0.400 A 49 PRO CD C 13 50.314 0.400 A 49 PRO CG C 13 24.090 0.400 A 50 ILE H H 1 8.855 0.020 A 50 ILE HA H 1 4.246 0.020 A 50 ILE HB H 1 1.313 0.020 A 50 ILE HD1% H 1 0.523 0.020 A 50 ILE HG12 H 1 0.583 0.020 A 50 ILE HG13 H 1 1.284 0.020 A 50 ILE HG2% H 1 0.349 0.020 A 50 ILE C C 13 174.513 0.400 A 50 ILE CA C 13 60.441 0.400 A 50 ILE CB C 13 41.156 0.400 A 50 ILE CD1 C 13 14.870 0.400 A 50 ILE CG1 C 13 26.709 0.400 A 50 ILE CG2 C 13 16.635 0.400 A 50 ILE N N 15 116.672 0.400 A 51 GLU H H 1 8.697 0.020 A 51 GLU HA H 1 5.194 0.020 A 51 GLU HB2 H 1 1.834 0.020 A 51 GLU HB3 H 1 1.962 0.020 A 51 GLU HGx H 1 2.097 0.020 A 51 GLU HGy H 1 2.097 0.020 A 51 GLU C C 13 176.004 0.400 A 51 GLU CA C 13 54.885 0.400 A 51 GLU CB C 13 31.519 0.400 A 51 GLU CG C 13 36.316 0.400 A 51 GLU N N 15 125.574 0.400 A 52 VAL H H 1 9.068 0.020 A 52 VAL HA H 1 4.931 0.020 A 52 VAL HB H 1 1.913 0.020 A 52 VAL HG1% H 1 0.792 0.020 A 52 VAL HG2% H 1 0.757 0.020 A 52 VAL C C 13 172.833 0.400 A 52 VAL CA C 13 58.647 0.400 A 52 VAL CB C 13 35.747 0.400 A 52 VAL CG1 C 13 22.027 0.400 A 52 VAL CG2 C 13 20.587 0.400 A 52 VAL N N 15 119.533 0.400 A 53 ASN H H 1 9.017 0.020 A 53 ASN HA H 1 5.323 0.020 A 53 ASN HB2 H 1 2.443 0.020 A 53 ASN HB3 H 1 2.798 0.020 A 53 ASN HD21 H 1 7.247 0.020 A 53 ASN HD22 H 1 6.562 0.020 A 53 ASN C C 13 175.328 0.400 A 53 ASN CA C 13 51.625 0.400 A 53 ASN CB C 13 40.274 0.400 A 53 ASN N N 15 121.671 0.400 A 53 ASN ND2 N 15 110.027 0.400 A 54 CYS H H 1 9.442 0.020 A 54 CYS HA H 1 4.922 0.020 A 54 CYS HB2 H 1 2.167 0.020 A 54 CYS HB3 H 1 2.795 0.020 A 54 CYS HG H 1 1.813 0.020 A 54 CYS C C 13 174.715 0.400 A 54 CYS CA C 13 56.940 0.400 A 54 CYS CB C 13 27.988 0.400 A 54 CYS N N 15 127.090 0.400 A 55 ASN H H 1 9.432 0.020 A 55 ASN HA H 1 4.481 0.020 A 55 ASN HB2 H 1 2.911 0.020 A 55 ASN HB3 H 1 3.288 0.020 A 55 ASN HD21 H 1 7.708 0.020 A 55 ASN HD22 H 1 6.869 0.020 A 55 ASN C C 13 174.274 0.400 A 55 ASN CA C 13 54.255 0.400 A 55 ASN CB C 13 37.629 0.400 A 55 ASN N N 15 127.846 0.400 A 55 ASN ND2 N 15 112.828 0.400 A 56 GLY H H 1 8.027 0.020 A 56 GLY HA2 H 1 3.699 0.020 A 56 GLY HA3 H 1 4.275 0.020 A 56 GLY C C 13 173.779 0.400 A 56 GLY CA C 13 45.518 0.400 A 56 GLY N N 15 103.612 0.400 A 57 MET H H 1 7.739 0.020 A 57 MET HA H 1 4.669 0.020 A 57 MET HBx H 1 2.074 0.020 A 57 MET HBy H 1 2.074 0.020 A 57 MET HE% H 1 2.138 0.020 A 57 MET HGx H 1 2.558 0.020 A 57 MET HGy H 1 2.558 0.020 A 57 MET C C 13 174.484 0.400 A 57 MET CA C 13 53.397 0.400 A 57 MET CB C 13 34.144 0.400 A 57 MET CE C 13 16.892 0.400 A 57 MET CG C 13 31.706 0.400 A 57 MET N N 15 120.424 0.400 A 58 LEU H H 1 8.413 0.020 A 58 LEU HA H 1 4.782 0.020 A 58 LEU HBx H 1 1.570 0.020 A 58 LEU HBy H 1 1.570 0.020 A 58 LEU HD1% H 1 0.806 0.020 A 58 LEU HD2% H 1 0.760 0.020 A 58 LEU HG H 1 1.497 0.020 A 58 LEU C C 13 176.045 0.400 A 58 LEU CA C 13 54.943 0.400 A 58 LEU CB C 13 41.506 0.400 A 58 LEU CD1 C 13 24.483 0.400 A 58 LEU CD2 C 13 24.121 0.400 A 58 LEU CG C 13 27.332 0.400 A 58 LEU N N 15 125.670 0.400 A 59 LEU H H 1 9.252 0.020 A 59 LEU HA H 1 4.736 0.020 A 59 LEU HBy H 1 1.594 0.020 A 59 LEU HBx H 1 1.466 0.020 A 59 LEU HD1% H 1 0.791 0.020 A 59 LEU HD2% H 1 0.857 0.020 A 59 LEU HG H 1 1.645 0.020 A 59 LEU C C 13 175.115 0.400 A 59 LEU CA C 13 53.998 0.400 A 59 LEU CB C 13 44.657 0.400 A 59 LEU CD1 C 13 26.175 0.400 A 59 LEU CD2 C 13 25.395 0.400 A 59 LEU CG C 13 27.118 0.400 A 59 LEU N N 15 126.617 0.400 A 60 THR H H 1 8.403 0.020 A 60 THR HA H 1 4.957 0.020 A 60 THR HB H 1 3.915 0.020 A 60 THR HG2% H 1 1.097 0.020 A 60 THR C C 13 174.012 0.400 A 60 THR CA C 13 61.267 0.400 A 60 THR CB C 13 69.462 0.400 A 60 THR CG2 C 13 21.886 0.400 A 60 THR N N 15 118.128 0.400 A 61 MET H H 1 9.246 0.020 A 61 MET HA H 1 4.739 0.020 A 61 MET HBx H 1 1.912 0.020 A 61 MET HBy H 1 1.912 0.020 A 61 MET HE% H 1 1.699 0.020 A 61 MET HGx H 1 2.255 0.020 A 61 MET HGy H 1 2.255 0.020 A 61 MET C C 13 174.476 0.400 A 61 MET CA C 13 53.696 0.400 A 61 MET CB C 13 35.896 0.400 A 61 MET CE C 13 16.830 0.400 A 61 MET CG C 13 31.087 0.400 A 61 MET N N 15 124.262 0.400 A 62 ARG H H 1 8.878 0.020 A 62 ARG HA H 1 4.660 0.020 A 62 ARG HB2 H 1 1.643 0.020 A 62 ARG HB3 H 1 2.265 0.020 A 62 ARG HDy H 1 3.293 0.020 A 62 ARG HDx H 1 3.093 0.020 A 62 ARG HE H 1 7.686 0.020 A 62 ARG HGy H 1 1.870 0.020 A 62 ARG HGx H 1 1.679 0.020 A 62 ARG C C 13 178.755 0.400 A 62 ARG CA C 13 53.709 0.400 A 62 ARG CB C 13 29.886 0.400 A 62 ARG CD C 13 41.595 0.400 A 62 ARG CG C 13 26.621 0.400 A 62 ARG N N 15 120.225 0.400 A 62 ARG NE N 15 83.396 0.400 A 63 ARG H H 1 9.324 0.020 A 63 ARG HA H 1 3.794 0.020 A 63 ARG HB2 H 1 1.938 0.020 A 63 ARG HB3 H 1 1.802 0.020 A 63 ARG HDx H 1 3.248 0.020 A 63 ARG HDy H 1 3.248 0.020 A 63 ARG HGy H 1 1.670 0.020 A 63 ARG HGx H 1 1.612 0.020 A 63 ARG C C 13 177.519 0.400 A 63 ARG CA C 13 60.380 0.400 A 63 ARG CB C 13 29.325 0.400 A 63 ARG CD C 13 42.899 0.400 A 63 ARG CG C 13 27.586 0.400 A 63 ARG N N 15 125.747 0.400 A 64 ASN H H 1 8.819 0.020 A 64 ASN HA H 1 4.381 0.020 A 64 ASN HBy H 1 2.817 0.020 A 64 ASN HBx H 1 2.694 0.020 A 64 ASN HD2y H 1 7.620 0.020 A 64 ASN HD2x H 1 6.836 0.020 A 64 ASN C C 13 177.296 0.400 A 64 ASN CA C 13 55.991 0.400 A 64 ASN CB C 13 37.207 0.400 A 64 ASN N N 15 113.395 0.400 A 64 ASN ND2 N 15 112.410 0.400 A 65 GLU H H 1 7.048 0.020 A 65 GLU HA H 1 4.084 0.020 A 65 GLU HB2 H 1 2.463 0.020 A 65 GLU HB3 H 1 1.796 0.020 A 65 GLU HGy H 1 2.299 0.020 A 65 GLU HGx H 1 2.222 0.020 A 65 GLU C C 13 178.468 0.400 A 65 GLU CA C 13 57.977 0.400 A 65 GLU CB C 13 29.730 0.400 A 65 GLU CG C 13 36.768 0.400 A 65 GLU N N 15 118.745 0.400 A 66 ALA H H 1 7.934 0.020 A 66 ALA HA H 1 4.008 0.020 A 66 ALA HB% H 1 1.332 0.020 A 66 ALA C C 13 178.730 0.400 A 66 ALA CA C 13 54.518 0.400 A 66 ALA CB C 13 18.763 0.400 A 66 ALA N N 15 121.232 0.400 A 67 GLU H H 1 7.982 0.020 A 67 GLU HA H 1 4.220 0.020 A 67 GLU HBx H 1 2.062 0.020 A 67 GLU HBy H 1 2.062 0.020 A 67 GLU HGy H 1 2.475 0.020 A 67 GLU HGx H 1 2.364 0.020 A 67 GLU C C 13 176.441 0.400 A 67 GLU CA C 13 57.960 0.400 A 67 GLU CB C 13 29.922 0.400 A 67 GLU CG C 13 36.318 0.400 A 67 GLU N N 15 117.090 0.400 A 68 GLY H H 1 7.458 0.020 A 68 GLY HAy H 1 4.421 0.020 A 68 GLY HAx H 1 3.902 0.020 A 68 GLY C C 13 173.846 0.400 A 68 GLY CA C 13 44.625 0.400 A 68 GLY N N 15 102.707 0.400 A 69 ILE H H 1 7.621 0.020 A 69 ILE HA H 1 4.683 0.020 A 69 ILE HB H 1 2.091 0.020 A 69 ILE HD1% H 1 0.735 0.020 A 69 ILE HG1y H 1 1.622 0.020 A 69 ILE HG1x H 1 1.208 0.020 A 69 ILE HG2% H 1 0.813 0.020 A 69 ILE C C 13 175.181 0.400 A 69 ILE CA C 13 59.678 0.400 A 69 ILE CB C 13 38.043 0.400 A 69 ILE CD1 C 13 14.000 0.400 A 69 ILE CG1 C 13 27.121 0.400 A 69 ILE CG2 C 13 18.339 0.400 A 69 ILE N N 15 123.794 0.400 A 70 THR H H 1 8.802 0.020 A 70 THR HA H 1 4.905 0.020 A 70 THR HB H 1 4.098 0.020 A 70 THR HG2% H 1 1.197 0.020 A 70 THR C C 13 174.855 0.400 A 70 THR CA C 13 62.549 0.400 A 70 THR CB C 13 68.762 0.400 A 70 THR CG2 C 13 21.218 0.400 A 70 THR N N 15 124.231 0.400 A 71 VAL H H 1 8.807 0.020 A 71 VAL HA H 1 5.477 0.020 A 71 VAL HB H 1 1.938 0.020 A 71 VAL HG1% H 1 0.680 0.020 A 71 VAL HG2% H 1 0.440 0.020 A 71 VAL C C 13 174.111 0.400 A 71 VAL CA C 13 57.779 0.400 A 71 VAL CB C 13 35.881 0.400 A 71 VAL CG1 C 13 22.137 0.400 A 71 VAL CG2 C 13 17.507 0.400 A 71 VAL N N 15 116.680 0.400 A 72 HIS H H 1 8.848 0.020 A 72 HIS HA H 1 5.085 0.020 A 72 HIS HBx H 1 3.050 0.020 A 72 HIS HBy H 1 3.050 0.020 A 72 HIS HD2 H 1 7.092 0.020 A 72 HIS HE1 H 1 8.195 0.020 A 72 HIS C C 13 174.602 0.400 A 72 HIS CA C 13 53.402 0.400 A 72 HIS CB C 13 31.707 0.400 A 72 HIS CD2 C 13 119.891 0.400 A 72 HIS CE1 C 13 136.930 0.400 A 72 HIS N N 15 118.784 0.400 A 72 HIS ND1 N 15 195.614 0.400 A 72 HIS NE2 N 15 178.180 0.400 A 73 ILE H H 1 8.606 0.020 A 73 ILE HA H 1 4.085 0.020 A 73 ILE HB H 1 1.705 0.020 A 73 ILE HD1% H 1 0.850 0.020 A 73 ILE HG1y H 1 1.601 0.020 A 73 ILE HG1x H 1 1.150 0.020 A 73 ILE HG2% H 1 0.901 0.020 A 73 ILE C C 13 174.837 0.400 A 73 ILE CA C 13 61.719 0.400 A 73 ILE CB C 13 38.478 0.400 A 73 ILE CD1 C 13 12.924 0.400 A 73 ILE CG1 C 13 28.918 0.400 A 73 ILE CG2 C 13 17.066 0.400 A 73 ILE N N 15 127.152 0.400 A 74 LEU H H 1 8.210 0.020 A 74 LEU HA H 1 4.476 0.020 A 74 LEU HBx H 1 1.409 0.020 A 74 LEU HBy H 1 1.409 0.020 A 74 LEU HD1% H 1 0.816 0.020 A 74 LEU HD2% H 1 0.835 0.020 A 74 LEU HG H 1 1.527 0.020 A 74 LEU C C 13 175.868 0.400 A 74 LEU CA C 13 53.380 0.400 A 74 LEU CB C 13 42.860 0.400 A 74 LEU CD1 C 13 25.809 0.400 A 74 LEU CD2 C 13 22.773 0.400 A 74 LEU CG C 13 26.696 0.400 A 74 LEU N N 15 127.563 0.400 A 75 ALA H H 1 8.352 0.020 A 75 ALA HA H 1 4.373 0.020 A 75 ALA HB% H 1 1.377 0.020 A 75 ALA C C 13 177.876 0.400 A 75 ALA CA C 13 51.823 0.400 A 75 ALA CB C 13 19.704 0.400 A 75 ALA N N 15 125.186 0.400 A 76 GLY H H 1 8.430 0.020 A 76 GLY HAx H 1 3.949 0.020 A 76 GLY HAy H 1 3.949 0.020 A 76 GLY C C 13 173.784 0.400 A 76 GLY CA C 13 45.109 0.400 A 76 GLY N N 15 108.145 0.400 A 77 ASP H H 1 8.327 0.020 A 77 ASP HA H 1 4.585 0.020 A 77 ASP HBx H 1 2.633 0.020 A 77 ASP HBy H 1 2.633 0.020 A 77 ASP C C 13 176.358 0.400 A 77 ASP CA C 13 53.823 0.400 A 77 ASP CB C 13 41.163 0.400 A 77 ASP N N 15 120.248 0.400 A 78 GLU H H 1 8.516 0.020 A 78 GLU HA H 1 4.157 0.020 A 78 GLU HBy H 1 2.016 0.020 A 78 GLU HBx H 1 1.902 0.020 A 78 GLU HGx H 1 2.221 0.020 A 78 GLU HGy H 1 2.221 0.020 A 78 GLU C C 13 176.823 0.400 A 78 GLU CA C 13 56.900 0.400 A 78 GLU CB C 13 29.779 0.400 A 78 GLU CG C 13 36.103 0.400 A 78 GLU N N 15 120.952 0.400 A 79 GLY H H 1 8.378 0.020 A 79 GLY HAx H 1 3.783 0.020 A 79 GLY HAy H 1 3.783 0.020 A 79 GLY C C 13 173.428 0.400 A 79 GLY CA C 13 45.014 0.400 A 79 GLY N N 15 108.768 0.400 A 80 HIS H H 1 7.999 0.020 A 80 HIS HA H 1 4.739 0.020 A 80 HIS HBx H 1 2.834 0.020 A 80 HIS HBy H 1 2.834 0.020 A 80 HIS HD2 H 1 6.838 0.020 A 80 HIS HE1 H 1 7.926 0.020 A 80 HIS CA C 13 53.693 0.400 A 80 HIS CB C 13 29.355 0.400 A 80 HIS CD2 C 13 119.764 0.400 A 80 HIS CE1 C 13 137.455 0.400 A 80 HIS N N 15 119.160 0.400 A 80 HIS ND1 N 15 201.675 0.400 A 80 HIS NE2 N 15 177.574 0.400 A 81 PRO HA H 1 4.317 0.020 A 81 PRO HBy H 1 2.157 0.020 A 81 PRO HBx H 1 1.759 0.020 A 81 PRO HDy H 1 3.597 0.020 A 81 PRO HDx H 1 3.351 0.020 A 81 PRO HGy H 1 1.891 0.020 A 81 PRO HGx H 1 1.804 0.020 A 81 PRO C C 13 176.758 0.400 A 81 PRO CA C 13 63.167 0.400 A 81 PRO CB C 13 31.734 0.400 A 81 PRO CD C 13 50.333 0.400 A 81 PRO CG C 13 27.132 0.400 A 82 HIS H H 1 8.597 0.020 A 82 HIS HA H 1 4.514 0.020 A 82 HIS HBx H 1 3.050 0.020 A 82 HIS HBy H 1 3.050 0.020 A 82 HIS HD2 H 1 7.031 0.020 A 82 HIS C C 13 175.884 0.400 A 82 HIS CA C 13 56.381 0.400 A 82 HIS CB C 13 29.949 0.400 A 82 HIS CD2 C 13 119.822 0.400 A 82 HIS N N 15 119.278 0.400 A 82 HIS ND1 N 15 208.805 0.400 A 82 HIS NE2 N 15 178.549 0.400 A 83 GLY H H 1 8.263 0.020 A 83 GLY HAy H 1 3.901 0.020 A 83 GLY HAx H 1 3.756 0.020 A 83 GLY C C 13 173.541 0.400 A 83 GLY CA C 13 44.937 0.400 A 83 GLY N N 15 110.039 0.400 A 84 TRP H H 1 8.074 0.020 A 84 TRP HA H 1 4.885 0.020 A 84 TRP HBy H 1 3.221 0.020 A 84 TRP HBx H 1 3.160 0.020 A 84 TRP HD1 H 1 7.180 0.020 A 84 TRP HE1 H 1 10.091 0.020 A 84 TRP HE3 H 1 7.294 0.020 A 84 TRP HH2 H 1 7.060 0.020 A 84 TRP HZ2 H 1 7.277 0.020 A 84 TRP HZ3 H 1 6.938 0.020 A 84 TRP CA C 13 55.087 0.400 A 84 TRP CB C 13 28.893 0.400 A 84 TRP CD1 C 13 126.868 0.400 A 84 TRP CE3 C 13 120.331 0.400 A 84 TRP CH2 C 13 124.502 0.400 A 84 TRP CZ2 C 13 114.239 0.400 A 84 TRP CZ3 C 13 122.020 0.400 A 84 TRP N N 15 122.660 0.400 A 84 TRP NE1 N 15 129.915 0.400 A 85 PRO HA H 1 4.302 0.020 A 85 PRO HBy H 1 2.152 0.020 A 85 PRO HBx H 1 1.756 0.020 A 85 PRO HDy H 1 3.793 0.020 A 85 PRO HDx H 1 3.406 0.020 A 85 PRO HGx H 1 1.845 0.020 A 85 PRO HGy H 1 1.845 0.020 A 85 PRO C C 13 177.125 0.400 A 85 PRO CA C 13 63.474 0.400 A 85 PRO CB C 13 31.535 0.400 A 85 PRO CD C 13 50.758 0.400 A 85 PRO CG C 13 27.124 0.400 A 86 GLY H H 1 7.132 0.020 A 86 GLY HAx H 1 3.451 0.020 A 86 GLY HAy H 1 3.451 0.020 A 86 GLY C C 13 173.958 0.400 A 86 GLY CA C 13 45.049 0.400 A 86 GLY N N 15 106.987 0.400 A 87 PHE H H 1 7.787 0.020 A 87 PHE HA H 1 4.493 0.020 A 87 PHE HBy H 1 3.085 0.020 A 87 PHE HBx H 1 2.990 0.020 A 87 PHE HD1 H 1 7.215 0.020 A 87 PHE HD2 H 1 7.215 0.020 A 87 PHE HE1 H 1 7.242 0.020 A 87 PHE HE2 H 1 7.242 0.020 A 87 PHE C C 13 175.770 0.400 A 87 PHE CA C 13 57.787 0.400 A 87 PHE CB C 13 39.218 0.400 A 87 PHE CD1 C 13 131.674 0.400 A 87 PHE CD2 C 13 131.674 0.400 A 87 PHE CE1 C 13 129.605 0.400 A 87 PHE CE2 C 13 129.605 0.400 A 87 PHE N N 15 119.515 0.400 A 88 ARG H H 1 8.072 0.020 A 88 ARG HA H 1 4.198 0.020 A 88 ARG HBy H 1 1.759 0.020 A 88 ARG HBx H 1 1.632 0.020 A 88 ARG HDx H 1 3.069 0.020 A 88 ARG HDy H 1 3.069 0.020 A 88 ARG HGx H 1 1.485 0.020 A 88 ARG HGy H 1 1.485 0.020 A 88 ARG C C 13 175.808 0.400 A 88 ARG CA C 13 56.014 0.400 A 88 ARG CB C 13 30.566 0.400 A 88 ARG CD C 13 43.123 0.400 A 88 ARG CG C 13 26.894 0.400 A 88 ARG N N 15 121.911 0.400 A 89 ARG H H 1 8.110 0.020 A 89 ARG N N 15 121.671 0.400 A 92 ARG HA H 1 4.194 0.020 A 92 ARG HBx H 1 1.588 0.020 A 92 ARG HBy H 1 1.588 0.020 A 92 ARG C C 13 175.654 0.400 A 92 ARG CA C 13 56.072 0.400 A 92 ARG CB C 13 30.627 0.400 A 93 PHE H H 1 8.308 0.020 A 93 PHE HA H 1 4.627 0.020 A 93 PHE HBy H 1 3.170 0.020 A 93 PHE HBx H 1 2.962 0.020 A 93 PHE HD1 H 1 7.223 0.020 A 93 PHE HD2 H 1 7.223 0.020 A 93 PHE C C 13 176.108 0.400 A 93 PHE CA C 13 57.349 0.400 A 93 PHE CB C 13 39.392 0.400 A 93 PHE CD1 C 13 131.675 0.400 A 93 PHE CD2 C 13 131.675 0.400 A 93 PHE N N 15 120.758 0.400 A 94 GLY H H 1 8.302 0.020 A 94 GLY HAx H 1 3.919 0.020 A 94 GLY HAy H 1 3.919 0.020 A 94 GLY C C 13 173.871 0.400 A 94 GLY CA C 13 44.905 0.400 A 94 GLY N N 15 110.066 0.400 A 95 LYS H H 1 8.187 0.020 A 95 LYS HA H 1 4.255 0.020 A 95 LYS HBy H 1 1.805 0.020 A 95 LYS HBx H 1 1.716 0.020 A 95 LYS HDx H 1 1.649 0.020 A 95 LYS HDy H 1 1.649 0.020 A 95 LYS HEx H 1 2.963 0.020 A 95 LYS HEy H 1 2.963 0.020 A 95 LYS HGx H 1 1.395 0.020 A 95 LYS HGy H 1 1.395 0.020 A 95 LYS C C 13 176.703 0.400 A 95 LYS CA C 13 56.232 0.400 A 95 LYS CB C 13 32.843 0.400 A 95 LYS CD C 13 28.875 0.400 A 95 LYS CE C 13 42.008 0.400 A 95 LYS CG C 13 24.523 0.400 A 95 LYS N N 15 121.017 0.400 A 96 ARG H H 1 8.335 0.020 A 96 ARG HA H 1 4.256 0.020 A 96 ARG HBy H 1 1.810 0.020 A 96 ARG HBx H 1 1.716 0.020 A 96 ARG HDx H 1 3.133 0.020 A 96 ARG HDy H 1 3.133 0.020 A 96 ARG HGx H 1 1.584 0.020 A 96 ARG HGy H 1 1.584 0.020 A 96 ARG C C 13 176.006 0.400 A 96 ARG CA C 13 56.127 0.400 A 96 ARG CB C 13 30.585 0.400 A 96 ARG CD C 13 43.180 0.400 A 96 ARG CG C 13 26.829 0.400 A 96 ARG N N 15 121.918 0.400 A 97 ALA H H 1 8.244 0.020 A 97 ALA HA H 1 4.235 0.020 A 97 ALA HB% H 1 1.336 0.020 A 97 ALA C C 13 177.517 0.400 A 97 ALA CA C 13 52.498 0.400 A 97 ALA CB C 13 18.864 0.400 A 97 ALA N N 15 125.163 0.400 A 98 LEU H H 1 8.116 0.020 A 98 LEU HA H 1 4.233 0.020 A 98 LEU HBy H 1 1.563 0.020 A 98 LEU HBx H 1 1.482 0.020 A 98 LEU HD1% H 1 0.864 0.020 A 98 LEU HD2% H 1 0.803 0.020 A 98 LEU HG H 1 1.561 0.020 A 98 LEU C C 13 177.222 0.400 A 98 LEU CA C 13 55.110 0.400 A 98 LEU CB C 13 42.010 0.400 A 98 LEU CD1 C 13 24.945 0.400 A 98 LEU CD2 C 13 23.173 0.400 A 98 LEU CG C 13 26.717 0.400 A 98 LEU N N 15 120.936 0.400 A 99 GLU H H 1 8.225 0.020 A 99 GLU HA H 1 4.163 0.020 A 99 GLU HBx H 1 1.856 0.020 A 99 GLU HBy H 1 1.856 0.020 A 99 GLU HGy H 1 2.189 0.020 A 99 GLU HGx H 1 2.110 0.020 A 99 GLU CA C 13 56.271 0.400 A 99 GLU CB C 13 30.190 0.400 A 99 GLU CG C 13 36.135 0.400 A 99 GLU N N 15 121.172 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 14 VAL H A 14 VAL HB 1.0 . 3.26 2 2 A 46 LEU HB3 A 47 GLY H 1.0 . 5.17 3 3 A 52 VAL HA A 53 ASN H 1.0 . 3.23 4 4 A 53 ASN H A 53 ASN HB3 1.0 . 3.66 5 5 A 53 ASN H A 52 VAL HB 1.0 . 3.80 6 6 A 54 CYS HA A 55 ASN H 1.0 . 3.55 7 7 A 6 LEU HA A 7 LYS H 1.0 . 3.19 8 8 A 42 ARG HA A 43 PHE H 1.0 . 2.94 9 9 A 60 THR HB A 61 MET H 1.0 . 4.56 10 10 A 21 PRO HB2 A 22 ALA H 1.0 . 3.88 11 11 A 27 LEU HB3 A 28 MET H 1.0 . 4.02 12 12 A 28 MET H A 27 LEU HB2 1.0 . 3.62 13 13 A 51 GLU H A 51 GLU HB3 1.0 . 3.95 14 14 A 51 GLU H A 50 ILE HA 1.0 . 3.12 15 15 A 7 LYS HA A 8 ALA H 1.0 . 3.01 16 16 A 64 ASN H A 64 ASN HBy 1.0 . 3.73 17 17 A 59 LEU HA A 60 THR H 1.0 . 2.90 18 18 A 60 THR HB A 60 THR H 1.0 . 3.52 19 19 A 72 HIS HA A 73 ILE H 1.0 . 3.01 20 20 A 73 ILE H A 73 ILE HB 1.0 . 3.26 21 21 A 17 VAL HB A 18 ALA H 1.0 . 5.68 22 22 A 19 ALA HA A 20 GLU H 1.0 . 3.08 23 23 A 20 GLU H A 20 GLU HB3 1.0 . 3.66 24 24 A 61 MET HA A 62 ARG H 1.0 . 3.08 25 25 A 3 LEU HB3 A 4 SER H 1.0 . 3.95 26 26 A 41 LEU HBy A 42 ARG H 1.0 . 3.77 27 27 A 51 GLU HA A 52 VAL H 1.0 . 2.94 28 28 A 18 ALA HA A 19 ALA H 1.0 . 2.90 29 29 A 33 VAL HA A 34 ARG H 1.0 . 3.12 30 30 A 10 ASP H A 10 ASP HB2 1.0 . 3.37 31 31 A 26 ARG H A 27 LEU H 1.0 . 3.34 32 32 A 26 ARG H A 25 ARG H 1.0 . 3.52 33 33 A 11 ARG HA A 12 ALA H 1.0 . 3.12 34 34 A 75 ALA HA A 76 GLY H 1.0 . 3.44 35 35 A 48 ASP H A 48 ASP HBy 1.0 . 3.91 36 36 A 48 ASP H A 48 ASP HBx 1.0 . 3.91 37 37 A 65 GLU H A 65 GLU HB2 1.0 . 3.48 38 38 A 65 GLU H A 64 ASN HBx 1.0 . 4.85 39 39 A 64 ASN HBy A 65 GLU H 1.0 . 4.85 40 40 A 23 VAL HB A 24 ARG H 1.0 . 3.55 41 41 A 24 ARG H A 24 ARG HB2 1.0 . 3.41 42 42 A 24 ARG H A 24 ARG HB3 1.0 . 3.48 43 43 A 24 ARG H A 23 VAL H 1.0 . 3.16 44 44 A 55 ASN HB3 A 56 GLY H 1.0 . 5.78 45 45 A 70 THR HA A 71 VAL H 1.0 . 2.98 46 46 A 71 VAL H A 70 THR HB 1.0 . 4.34 47 47 A 40 VAL HA A 41 LEU H 1.0 . 3.19 48 48 A 71 VAL HA A 72 HIS H 1.0 . 3.12 49 49 A 72 HIS H A 71 VAL HB 1.0 . 3.37 50 50 A 78 GLU HBy A 79 GLY H 1.0 . 5.50 51 51 A 79 GLY H A 78 GLU HBx 1.0 . 5.50 52 52 A 22 ALA H A 25 ARG H 1.0 . 5.50 53 53 A 28 MET H A 25 ARG H 1.0 . 4.60 54 54 A 25 ARG H A 24 ARG H 1.0 . 3.59 55 55 A 29 ASP H A 29 ASP HB3 1.0 . 3.66 56 56 A 29 ASP H A 29 ASP HB2 1.0 . 3.19 57 57 A 17 VAL HB A 17 VAL H 1.0 . 3.59 58 58 A 17 VAL H A 16 SER HA 1.0 . 3.05 59 59 A 2 LYS H A 2 LYS HBy 1.0 . 4.13 60 60 A 4 SER HBy A 5 GLU H 1.0 . 5.32 61 61 A 5 GLU H A 4 SER HBx 1.0 . 5.32 62 62 A 69 ILE HB A 70 THR H 1.0 . 5.50 63 63 A 70 THR HB A 70 THR H 1.0 . 3.55 64 64 A 62 ARG HB3 A 63 ARG H 1.0 . 3.95 65 65 A 63 ARG H A 63 ARG HB2 1.0 . 3.55 66 66 A 64 ASN H A 63 ARG H 1.0 . 3.84 67 67 A 63 ARG H A 62 ARG HA 1.0 . 3.37 68 68 A 50 ILE H A 49 PRO HA 1.0 . 3.41 69 69 A 2 LYS HBx A 3 LEU H 1.0 . 4.42 70 70 A 3 LEU H A 3 LEU HB2 1.0 . 3.41 71 71 A 3 LEU HB3 A 3 LEU H 1.0 . 3.48 72 72 A 14 VAL HB A 15 THR H 1.0 . 5.32 73 73 A 15 THR H A 14 VAL HA 1.0 . 3.08 74 74 A 22 ALA H A 23 VAL H 1.0 . 3.77 75 75 A 43 PHE HA A 44 ALA H 1.0 . 3.05 76 76 A 44 ALA H A 43 PHE HB2 1.0 . 4.63 77 77 A 8 ALA HA A 9 GLY H 1.0 . 2.98 78 78 A 98 LEU HA A 99 GLU H 1.0 . 3.34 79 79 A 30 LEU HB2 A 31 GLY H 1.0 . 4.27 80 80 A 54 CYS H A 54 CYS HB2 1.0 . 4.02 81 81 A 36 ALA HA A 37 LYS H 1.0 . 2.90 82 82 A 37 LYS H A 37 LYS HBx 1.0 . 3.95 83 83 A 2 LYS H A 5 GLU H 1.0 . 4.96 84 84 A 3 LEU H A 66 ALA HA 1.0 . 5.06 85 85 A 3 LEU H A 67 GLU HA 1.0 . 5.35 86 86 A 70 THR HA A 3 LEU H 1.0 . 4.42 87 87 A 3 LEU H A 69 ILE H 1.0 . 4.34 88 88 A 4 SER H A 2 LYS HBx 1.0 . 3.98 89 89 A 4 SER H A 2 LYS HBy 1.0 . 3.98 90 90 A 4 SER H A 5 GLU H 1.0 . 3.66 91 91 A 4 SER H A 3 LEU H 1.0 . 3.80 92 92 A 5 GLU H A 2 LYS HA 1.0 . 5.75 93 93 A 5 GLU H A 6 LEU H 1.0 . 3.23 94 94 A 7 LYS H A 10 ASP HB2 1.0 . 4.16 95 95 A 7 LYS H A 6 LEU H 1.0 . 4.74 96 96 A 8 ALA H A 9 GLY H 1.0 . 4.78 97 97 A 10 ASP H A 8 ALA HA 1.0 . 4.09 98 98 A 10 ASP H A 9 GLY H 1.0 . 3.48 99 99 A 10 ASP H A 11 ARG H 1.0 . 4.92 100 100 A 11 ARG H A 74 LEU H 1.0 . 5.17 101 101 A 12 ALA H A 74 LEU H 1.0 . 4.92 102 102 A 14 VAL H A 37 LYS HA 1.0 . 4.34 103 103 A 14 VAL H A 36 ALA H 1.0 . 4.16 104 104 A 14 VAL H A 38 LEU H 1.0 . 4.74 105 105 A 14 VAL H A 15 THR H 1.0 . 4.81 106 106 A 15 THR H A 16 SER H 1.0 . 2.98 107 107 A 14 VAL HA A 16 SER H 1.0 . 4.02 108 108 A 70 THR H A 16 SER H 1.0 . 3.77 109 109 A 17 VAL H A 16 SER H 1.0 . 4.92 110 110 A 20 GLU H A 23 VAL HB 1.0 . 3.91 111 111 A 20 GLU H A 19 ALA H 1.0 . 4.88 112 112 A 24 ARG HB2 A 23 VAL H 1.0 . 4.81 113 113 A 25 ARG H A 23 VAL H 1.0 . 4.78 114 114 A 24 ARG H A 21 PRO HA 1.0 . 4.27 115 115 A 26 ARG H A 23 VAL HA 1.0 . 4.06 116 116 A 26 ARG H A 24 ARG HA 1.0 . 5.53 117 117 A 28 MET H A 26 ARG H 1.0 . 4.49 118 118 A 26 ARG H A 24 ARG H 1.0 . 4.52 119 119 A 27 LEU H A 24 ARG HA 1.0 . 4.49 120 120 A 28 MET H A 24 ARG HA 1.0 . 4.88 121 121 A 28 MET H A 27 LEU H 1.0 . 3.48 122 122 A 29 ASP H A 30 LEU H 1.0 . 3.44 123 123 A 29 ASP H A 31 GLY H 1.0 . 4.49 124 124 A 28 MET H A 29 ASP H 1.0 . 3.30 125 125 A 30 LEU H A 28 MET HA 1.0 . 4.78 126 126 A 30 LEU H A 26 ARG HA 1.0 . 4.92 127 127 A 31 GLY H A 30 LEU H 1.0 . 3.23 128 128 A 30 LEU H A 32 LEU H 1.0 . 4.09 129 129 A 28 MET H A 30 LEU H 1.0 . 4.81 130 130 A 73 ILE H A 71 VAL HB 1.0 . 5.89 131 131 A 54 CYS HB3 A 57 MET H 1.0 . 4.92 132 132 A 57 MET H A 55 ASN HB2 1.0 . 5.28 133 133 A 57 MET H A 55 ASN HA 1.0 . 5.32 134 134 A 87 PHE H A 88 ARG H 1.0 . 5.24 135 135 A 54 CYS HA A 57 MET H 1.0 . 5.28 136 136 A 57 MET H A 53 ASN HA 1.0 . 4.70 137 137 A 56 GLY H A 57 MET H 1.0 . 3.41 138 138 A 58 LEU H A 57 MET H 1.0 . 4.45 139 139 A 31 GLY H A 32 LEU H 1.0 . 3.23 140 140 A 51 GLU HA A 59 LEU H 1.0 . 5.06 141 141 A 60 THR H A 59 LEU H 1.0 . 4.42 142 142 A 52 VAL H A 59 LEU H 1.0 . 3.66 143 143 A 31 GLY HA2 A 33 VAL H 1.0 . 5.42 144 144 A 60 THR H A 51 GLU HA 1.0 . 5.32 145 145 A 28 MET HA A 33 VAL H 1.0 . 5.53 146 146 A 32 LEU H A 33 VAL H 1.0 . 4.52 147 147 A 34 ARG H A 33 VAL H 1.0 . 5.14 148 148 A 33 VAL H A 35 GLY H 1.0 . 5.93 149 149 A 61 MET H A 51 GLU HA 1.0 . 4.16 150 150 A 62 ARG H A 65 GLU H 1.0 . 4.96 151 151 A 62 ARG H A 66 ALA H 1.0 . 5.50 152 152 A 61 MET H A 62 ARG H 1.0 . 4.78 153 153 A 35 GLY H A 15 THR HA 1.0 . 4.60 154 154 A 63 ARG H A 48 ASP HA 1.0 . 4.52 155 155 A 36 ALA H A 35 GLY H 1.0 . 3.48 156 156 A 63 ARG H A 49 PRO HA 1.0 . 4.52 157 157 A 34 ARG H A 35 GLY H 1.0 . 4.74 158 158 A 14 VAL H A 35 GLY H 1.0 . 4.24 159 159 A 64 ASN H A 65 GLU H 1.0 . 3.70 160 160 A 64 ASN H A 66 ALA H 1.0 . 4.92 161 161 A 14 VAL HA A 36 ALA H 1.0 . 5.82 162 162 A 36 ALA H A 33 VAL H 1.0 . 4.38 163 163 A 65 GLU H A 63 ARG HA 1.0 . 5.03 164 164 A 65 GLU H A 62 ARG HA 1.0 . 5.57 165 165 A 37 LYS H A 13 GLU HA 1.0 . 5.68 166 166 A 14 VAL H A 37 LYS H 1.0 . 5.17 167 167 A 11 ARG HA A 38 LEU H 1.0 . 4.96 168 168 A 37 LYS H A 38 LEU H 1.0 . 5.06 169 169 A 66 ALA H A 63 ARG HA 1.0 . 4.34 170 170 A 12 ALA H A 38 LEU H 1.0 . 3.73 171 171 A 66 ALA H A 64 ASN HA 1.0 . 5.14 172 172 A 65 GLU H A 66 ALA H 1.0 . 3.12 173 173 A 66 ALA H A 68 GLY H 1.0 . 5.39 174 174 A 54 CYS HA A 39 LYS H 1.0 . 4.52 175 175 A 63 ARG H A 66 ALA H 1.0 . 5.86 176 176 A 53 ASN H A 39 LYS H 1.0 . 3.62 177 177 A 63 ARG HA A 67 GLU H 1.0 . 5.32 178 178 A 64 ASN HA A 67 GLU H 1.0 . 4.02 179 179 A 68 GLY H A 67 GLU H 1.0 . 3.70 180 180 A 69 ILE H A 67 GLU H 1.0 . 4.45 181 181 A 8 ALA HA A 40 VAL H 1.0 . 5.68 182 182 A 11 ARG HA A 40 VAL H 1.0 . 4.34 183 183 A 68 GLY H A 69 ILE HA 1.0 . 5.78 184 184 A 52 VAL HA A 41 LEU H 1.0 . 3.59 185 185 A 51 GLU HA A 41 LEU H 1.0 . 5.60 186 186 A 42 ARG H A 41 LEU H 1.0 . 3.26 187 187 A 67 GLU HA A 69 ILE H 1.0 . 4.78 188 188 A 70 THR HA A 69 ILE H 1.0 . 5.46 189 189 A 69 ILE H A 2 LYS HA 1.0 . 5.53 190 190 A 42 ARG H A 8 ALA HA 1.0 . 5.50 191 191 A 18 ALA H A 69 ILE H 1.0 . 5.32 192 192 A 50 ILE HA A 42 ARG H 1.0 . 4.99 193 193 A 42 ARG H A 43 PHE HA 1.0 . 5.68 194 194 A 70 THR H A 69 ILE H 1.0 . 4.88 195 195 A 52 VAL HA A 42 ARG H 1.0 . 4.81 196 196 A 69 ILE H A 68 GLY H 1.0 . 3.37 197 197 A 42 ARG H A 51 GLU HA 1.0 . 5.39 198 198 A 70 THR H A 14 VAL HA 1.0 . 5.42 199 199 A 70 THR H A 2 LYS HA 1.0 . 5.68 200 200 A 43 PHE H A 42 ARG H 1.0 . 4.67 201 201 A 43 PHE H A 44 ALA H 1.0 . 4.88 202 202 A 70 THR H A 15 THR H 1.0 . 5.14 203 203 A 71 VAL H A 3 LEU HA 1.0 . 5.32 204 204 A 47 GLY H A 44 ALA H 1.0 . 4.56 205 205 A 72 HIS H A 14 VAL HA 1.0 . 4.60 206 206 A 48 ASP H A 46 LEU H 1.0 . 5.03 207 207 A 72 HIS H A 15 THR H 1.0 . 4.63 208 208 A 47 GLY H A 46 LEU H 1.0 . 3.73 209 209 A 47 GLY H A 48 ASP H 1.0 . 3.41 210 210 A 74 LEU H A 12 ALA HA 1.0 . 3.41 211 211 A 73 ILE H A 74 LEU H 1.0 . 4.56 212 212 A 74 LEU H A 13 GLU H 1.0 . 4.42 213 213 A 48 ASP H A 46 LEU HB2 1.0 . 4.52 214 214 A 48 ASP H A 46 LEU HA 1.0 . 5.14 215 215 A 48 ASP H A 49 PRO HA 1.0 . 4.88 216 216 A 2 LYS H A 5 GLU HA 1.0 . 5.21 217 217 A 5 GLU H A 3 LEU H 1.0 . 5.14 218 218 A 62 ARG HA A 50 ILE H 1.0 . 4.74 219 219 A 50 ILE H A 48 ASP HA 1.0 . 3.88 220 220 A 61 MET H A 50 ILE H 1.0 . 3.77 221 221 A 51 GLU H A 43 PHE HA 1.0 . 4.34 222 222 A 51 GLU H A 42 ARG H 1.0 . 3.91 223 223 A 7 LYS H A 10 ASP H 1.0 . 5.39 224 224 A 51 GLU H A 52 VAL H 1.0 . 4.52 225 225 A 11 ARG H A 73 ILE HA 1.0 . 5.93 226 226 A 11 ARG H A 39 LYS HA 1.0 . 5.28 227 227 A 12 ALA H A 38 LEU HA 1.0 . 5.75 228 228 A 12 ALA H A 39 LYS H 1.0 . 5.32 229 229 A 12 ALA H A 13 GLU H 1.0 . 4.96 230 230 A 12 ALA H A 11 ARG H 1.0 . 5.32 231 231 A 38 LEU H A 13 GLU H 1.0 . 5.24 232 232 A 53 ASN H A 40 VAL HA 1.0 . 4.63 233 233 A 53 ASN H A 39 LYS HA 1.0 . 4.99 234 234 A 14 VAL H A 35 GLY HA2 1.0 . 6.00 235 235 A 53 ASN H A 38 LEU HA 1.0 . 5.46 236 236 A 16 SER H A 17 VAL HA 1.0 . 5.28 237 237 A 20 GLU H A 24 ARG HB2 1.0 . 5.17 238 238 A 20 GLU H A 23 VAL H 1.0 . 5.60 239 239 A 22 ALA H A 20 GLU HA 1.0 . 5.57 240 240 A 22 ALA H A 24 ARG H 1.0 . 5.03 241 241 A 23 VAL H A 24 ARG HA 1.0 . 5.71 242 242 A 27 LEU HB2 A 27 LEU H 1.0 . 3.19 243 243 A 28 MET H A 26 ARG HA 1.0 . 5.10 244 244 A 54 CYS H A 38 LEU HA 1.0 . 5.28 245 245 A 27 LEU H A 30 LEU H 1.0 . 4.74 246 246 A 54 CYS H A 57 MET H 1.0 . 3.70 247 247 A 38 LEU H A 39 LYS H 1.0 . 5.82 248 248 A 55 ASN H A 54 CYS HB2 1.0 . 5.21 249 249 A 55 ASN H A 38 LEU HA 1.0 . 4.99 250 250 A 55 ASN H A 56 GLY H 1.0 . 4.27 251 251 A 48 ASP H A 44 ALA H 1.0 . 5.42 252 252 A 55 ASN H A 37 LYS H 1.0 . 5.57 253 253 A 42 ARG HA A 51 GLU H 1.0 . 5.50 254 254 A 53 ASN H A 58 LEU HA 1.0 . 5.24 255 255 A 53 ASN H A 54 CYS H 1.0 . 4.81 256 256 A 53 ASN HB3 A 56 GLY H 1.0 . 5.50 257 257 A 56 GLY H A 55 ASN HB2 1.0 . 5.64 258 258 A 54 CYS HA A 56 GLY H 1.0 . 5.06 259 259 A 65 GLU H A 63 ARG H 1.0 . 5.53 260 260 A 56 GLY H A 38 LEU HA 1.0 . 6.00 261 261 A 56 GLY H A 53 ASN HA 1.0 . 6.00 262 262 A 55 ASN HB3 A 57 MET H 1.0 . 5.78 263 263 A 53 ASN H A 53 ASN HD21 1.0 . 6.00 264 264 A 53 ASN HA A 53 ASN HD21 1.0 . 5.35 265 265 A 39 LYS H A 39 LYS HGx 1.0 . 6.00 266 266 A 39 LYS H A 39 LYS HGy 1.0 . 6.00 267 267 A 55 ASN HB2 A 55 ASN HD22 1.0 . 4.09 268 268 A 38 LEU H A 38 LEU HG 1.0 . 3.01 269 269 A 53 ASN HB2 A 53 ASN HD22 1.0 . 3.98 270 270 A 42 ARG HBx A 42 ARG HE 1.0 . 6.00 271 271 A 24 ARG H A 24 ARG HE 1.0 . 5.71 272 272 A 62 ARG HB3 A 62 ARG HE 1.0 . 6.00 273 273 A 69 ILE H A 69 ILE HG1x 1.0 . 3.80 274 274 A 74 LEU H A 74 LEU HG 1.0 . 3.44 275 275 A 11 ARG H A 11 ARG HGx 1.0 . 4.63 276 276 A 84 TRP H A 84 TRP HD1 1.0 . 6.00 277 277 A 5 GLU H A 3 LEU HG 1.0 . 5.75 278 278 A 9 GLY H A 40 VAL HB 1.0 . 3.91 279 279 A 12 ALA H A 38 LEU HG 1.0 . 4.42 280 280 A 13 GLU H A 74 LEU HG 1.0 . 3.91 281 281 A 71 VAL HB A 15 THR H 1.0 . 5.64 282 282 A 19 ALA H A 24 ARG HB2 1.0 . 5.96 283 283 A 20 GLU H A 21 PRO HD3 1.0 . 5.93 284 284 A 20 GLU H A 21 PRO HD2 1.0 . 6.00 285 285 A 22 ALA H A 21 PRO HD2 1.0 . 5.10 286 286 A 24 ARG HB3 A 24 ARG HE 1.0 . 6.00 287 287 A 33 VAL H A 54 CYS HG 1.0 . 6.00 288 288 A 14 VAL HB A 33 VAL H 1.0 . 6.00 289 289 A 61 MET H A 50 ILE HB 1.0 . 4.52 290 290 A 35 GLY H A 34 ARG HGx 1.0 . 4.70 291 291 A 14 VAL HB A 35 GLY H 1.0 . 3.59 292 292 A 14 VAL HB A 36 ALA H 1.0 . 3.12 293 293 A 64 ASN H A 64 ASN HD2y 1.0 . 6.00 294 294 A 36 ALA H A 55 ASN HD21 1.0 . 5.82 295 295 A 39 LYS H A 53 ASN HB2 1.0 . 5.82 296 296 A 53 ASN HB3 A 39 LYS H 1.0 . 4.31 297 297 A 52 VAL HB A 40 VAL H 1.0 . 6.00 298 298 A 3 LEU HB3 A 69 ILE H 1.0 . 4.96 299 299 A 70 THR H A 69 ILE HG1y 1.0 . 6.00 300 300 A 42 ARG HE A 42 ARG HBy 1.0 . 6.00 301 301 A 47 GLY H A 46 LEU HG 1.0 . 6.00 302 302 A 73 ILE H A 72 HIS HD2 1.0 . 6.00 303 303 A 48 ASP H A 46 LEU HG 1.0 . 6.00 304 304 A 48 ASP H A 43 PHE HB2 1.0 . 6.00 305 305 A 7 LYS H A 40 VAL HB 1.0 . 6.00 306 306 A 12 ALA H A 38 LEU HB3 1.0 . 5.60 307 307 A 53 ASN H A 41 LEU HG 1.0 . 3.91 308 308 A 53 ASN HD21 A 56 GLY HA2 1.0 . 5.35 309 309 A 53 ASN HD22 A 56 GLY HA2 1.0 . 4.52 310 310 A 44 ALA H A 50 ILE HG13 1.0 . 4.92 311 311 A 54 CYS HG A 55 ASN HD21 1.0 . 6.00 312 312 A 53 ASN H A 38 LEU HB3 1.0 . 6.00 313 313 A 36 ALA HA A 55 ASN HD21 1.0 . 4.88 314 314 A 55 ASN HD21 A 31 GLY HA3 1.0 . 6.00 315 315 A 55 ASN HA A 55 ASN HD21 1.0 . 6.00 316 316 A 55 ASN HD22 A 54 CYS HG 1.0 . 6.00 317 317 A 36 ALA HA A 55 ASN HD22 1.0 . 3.88 318 318 A 37 LYS H A 55 ASN HD22 1.0 . 4.67 319 319 A 64 ASN H A 64 ASN HD2x 1.0 . 6.00 320 320 A 14 VAL H A 14 VAL HG2% 1.0 . 3.78 321 321 A 98 LEU H A 98 LEU HD2% 1.0 . 5.65 322 322 A 36 ALA H A 36 ALA HB% 1.0 . 3.56 323 323 A 22 ALA H A 22 ALA HB% 1.0 . 3.92 324 324 A 67 GLU H A 66 ALA HB% 1.0 . 4.43 325 325 A 8 ALA H A 8 ALA HB% 1.0 . 3.45 326 326 A 18 ALA H A 18 ALA HB% 1.0 . 3.78 327 327 A 76 GLY H A 75 ALA HB% 1.0 . 4.82 328 328 A 66 ALA H A 66 ALA HB% 1.0 . 3.67 329 329 A 71 VAL H A 71 VAL HG2% 1.0 . 3.96 330 330 A 71 VAL H A 71 VAL HG1% 1.0 . 4.82 331 331 A 40 VAL H A 40 VAL HG2% 1.0 . 4.03 332 332 A 40 VAL H A 40 VAL HG1% 1.0 . 5.36 333 333 A 50 ILE H A 50 ILE HG2% 1.0 . 5.11 334 334 A 15 THR H A 15 THR HG2% 1.0 . 4.53 335 335 A 23 VAL H A 23 VAL HG1% 1.0 . 5.00 336 336 A 23 VAL H A 22 ALA HB% 1.0 . 4.25 337 337 A 23 VAL H A 23 VAL HG2% 1.0 . 3.78 338 338 A 44 ALA H A 44 ALA HB% 1.0 . 3.63 339 339 A 37 LYS H A 36 ALA HB% 1.0 . 3.99 340 340 A 3 LEU H A 71 VAL HG2% 1.0 . 5.33 341 341 A 3 LEU H A 71 VAL HG1% 1.0 . 4.82 342 342 A 4 SER H A 3 LEU HD2% 1.0 . 5.54 343 343 A 8 ALA H A 40 VAL HG1% 1.0 . 5.22 344 344 A 9 GLY H A 40 VAL HG1% 1.0 . 5.00 345 345 A 9 GLY H A 40 VAL HG2% 1.0 . 6.23 346 346 A 10 ASP H A 40 VAL HG1% 1.0 . 5.80 347 347 A 10 ASP H A 40 VAL HG2% 1.0 . 5.00 348 348 A 11 ARG H A 12 ALA HB% 1.0 . 6.59 349 349 A 13 GLU H A 71 VAL HG2% 1.0 . 7.02 350 350 A 13 GLU H A 71 VAL HG1% 1.0 . 6.19 351 351 A 15 THR H A 14 VAL HG1% 1.0 . 4.46 352 352 A 15 THR H A 70 THR HG2% 1.0 . 7.02 353 353 A 16 SER H A 15 THR HG2% 1.0 . 5.72 354 354 A 16 SER H A 70 THR HG2% 1.0 . 6.12 355 355 A 17 VAL H A 14 VAL HG1% 1.0 . 6.23 356 356 A 19 ALA H A 18 ALA HB% 1.0 . 4.50 357 357 A 20 GLU H A 23 VAL HG1% 1.0 . 6.05 358 358 A 20 GLU H A 23 VAL HG2% 1.0 . 5.87 359 359 A 22 ALA H A 23 VAL HG2% 1.0 . 6.80 360 360 A 24 ARG H A 23 VAL HG2% 1.0 . 5.40 361 361 A 24 ARG H A 19 ALA HB% 1.0 . 4.64 362 362 A 25 ARG H A 23 VAL HG1% 1.0 . 7.02 363 363 A 26 ARG H A 27 LEU HD2% 1.0 . 6.48 364 364 A 26 ARG H A 23 VAL HG1% 1.0 . 6.73 365 365 A 28 MET H A 33 VAL HG1% 1.0 . 5.90 366 366 A 29 ASP H A 33 VAL HG1% 1.0 . 6.44 367 367 A 30 LEU H A 59 LEU HD1% 1.0 . 5.83 368 368 A 31 GLY H A 33 VAL HG2% 1.0 . 6.73 369 369 A 32 LEU H A 33 VAL HG1% 1.0 . 5.04 370 370 A 34 ARG H A 33 VAL HG2% 1.0 . 4.57 371 371 A 35 GLY H A 14 VAL HG2% 1.0 . 5.97 372 372 A 63 ARG H A 50 ILE HD1% 1.0 . 6.41 373 373 A 36 ALA H A 14 VAL HG2% 1.0 . 5.00 374 374 A 37 LYS H A 14 VAL HG2% 1.0 . 7.02 375 375 A 66 ALA H A 50 ILE HD1% 1.0 . 6.01 376 376 A 66 ALA H A 69 ILE HD1% 1.0 . 5.90 377 377 A 38 LEU H A 12 ALA HB% 1.0 . 5.97 378 378 A 66 ALA H A 61 MET HE% 1.0 . 5.69 379 379 A 67 GLU H A 69 ILE HD1% 1.0 . 7.02 380 380 A 68 GLY H A 69 ILE HD1% 1.0 . 6.30 381 381 A 41 LEU H A 40 VAL HG1% 1.0 . 4.82 382 382 A 42 ARG H A 50 ILE HG2% 1.0 . 6.12 383 383 A 42 ARG H A 40 VAL HG1% 1.0 . 4.61 384 384 A 70 THR H A 71 VAL HG1% 1.0 . 5.22 385 385 A 44 ALA H A 50 ILE HD1% 1.0 . 7.02 386 386 A 71 VAL H A 70 THR HG2% 1.0 . 4.32 387 387 A 72 HIS H A 71 VAL HG2% 1.0 . 5.40 388 388 A 72 HIS H A 71 VAL HG1% 1.0 . 5.04 389 389 A 46 LEU H A 44 ALA HB% 1.0 . 5.61 390 390 A 76 GLY H A 73 ILE HG2% 1.0 . 6.98 391 391 A 75 ALA HB% A 77 ASP H 1.0 . 7.02 392 392 A 2 LYS H A 71 VAL HG2% 1.0 . 6.33 393 393 A 4 SER H A 50 ILE HD1% 1.0 . 7.02 394 394 A 4 SER H A 71 VAL HG2% 1.0 . 7.02 395 395 A 51 GLU H A 50 ILE HG2% 1.0 . 4.35 396 396 A 5 GLU H A 71 VAL HG2% 1.0 . 7.02 397 397 A 51 GLU H A 52 VAL HG1% 1.0 . 5.90 398 398 A 6 LEU H A 71 VAL HG2% 1.0 . 7.02 399 399 A 52 VAL H A 60 THR HG2% 1.0 . 7.02 400 400 A 11 ARG H A 75 ALA HB% 1.0 . 6.66 401 401 A 14 VAL H A 15 THR HG2% 1.0 . 7.02 402 402 A 15 THR H A 71 VAL HG2% 1.0 . 6.98 403 403 A 31 GLY H A 57 MET HE% 1.0 . 7.02 404 404 A 55 ASN H A 36 ALA HB% 1.0 . 7.02 405 405 A 55 ASN HD21 A 33 VAL HG2% 1.0 . 7.02 406 406 A 55 ASN HD21 A 57 MET HE% 1.0 . 7.02 407 407 A 55 ASN HD22 A 36 ALA HB% 1.0 . 5.07 408 408 A 57 MET H A 59 LEU HD2% 1.0 . 7.02 409 409 A 62 ARG H A 23 VAL HG1% 1.0 . 7.02 410 410 A 64 ASN H A 66 ALA HB% 1.0 . 7.02 411 411 A 12 ALA HA A 13 GLU H 1.0 . 3.19 412 412 A 2 LYS H A 2 LYS HBx 1.0 . 4.13 413 413 A 40 VAL H A 39 LYS HA 1.0 . 3.16 414 414 A 14 VAL H A 13 GLU HA 1.0 . 2.98 415 415 A 29 ASP HB3 A 26 ARG HA 1.0 . 4.56 416 416 A 29 ASP HB3 A 30 LEU H 1.0 . 4.24 417 417 A 29 ASP HB2 A 26 ARG HA 1.0 . 3.95 418 418 A 29 ASP HB2 A 30 LEU H 1.0 . 3.95 419 419 A 51 GLU H A 51 GLU HB2 1.0 . 3.70 420 420 A 52 VAL H A 51 GLU HB2 1.0 . 5.10 421 421 A 2 LYS HBy A 3 LEU H 1.0 . 4.42 422 422 A 53 ASN H A 53 ASN HB2 1.0 . 3.98 423 423 A 54 CYS H A 53 ASN HB2 1.0 . 4.74 424 424 A 61 MET H A 60 THR HA 1.0 . 3.05 425 425 A 65 GLU HB2 A 66 ALA H 1.0 . 3.73 426 426 A 43 PHE H A 43 PHE HB3 1.0 . 4.09 427 427 A 44 ALA H A 43 PHE HB3 1.0 . 4.06 428 428 A 43 PHE H A 43 PHE HB2 1.0 . 3.62 429 429 A 24 ARG HB2 A 21 PRO HA 1.0 . 4.31 430 430 A 24 ARG HB3 A 21 PRO HA 1.0 . 3.80 431 431 A 47 GLY H A 46 LEU HB2 1.0 . 4.92 432 432 A 46 LEU H A 46 LEU HB2 1.0 . 3.84 433 433 A 51 GLU HB3 A 52 VAL H 1.0 . 4.81 434 434 A 64 ASN H A 63 ARG HB2 1.0 . 4.24 435 435 A 40 VAL H A 40 VAL HB 1.0 . 3.55 436 436 A 4 SER H A 3 LEU HB2 1.0 . 5.14 437 437 A 23 VAL HB A 23 VAL H 1.0 . 3.19 438 438 A 25 ARG H A 24 ARG HB2 1.0 . 4.63 439 439 A 33 VAL H A 32 LEU HA 1.0 . 2.87 440 440 A 33 VAL H A 32 LEU HBx 1.0 . 5.46 441 441 A 32 LEU H A 32 LEU HBx 1.0 . 3.98 442 442 A 11 ARG H A 10 ASP HA 1.0 . 2.98 443 443 A 58 LEU H A 57 MET HA 1.0 . 2.90 444 444 A 34 ARG H A 33 VAL HB 1.0 . 3.16 445 445 A 60 THR H A 59 LEU HBx 1.0 . 3.95 446 446 A 25 ARG H A 24 ARG HB3 1.0 . 4.09 447 447 A 30 LEU HB2 A 30 LEU H 1.0 . 3.98 448 448 A 39 LYS H A 38 LEU HB2 1.0 . 3.77 449 449 A 43 PHE H A 42 ARG HBx 1.0 . 4.27 450 450 A 10 ASP H A 10 ASP HB3 1.0 . 3.80 451 451 A 11 ARG H A 10 ASP HB3 1.0 . 3.88 452 452 A 39 LYS H A 38 LEU HA 1.0 . 3.12 453 453 A 33 VAL H A 32 LEU HBy 1.0 . 5.46 454 454 A 32 LEU H A 32 LEU HBy 1.0 . 3.98 455 455 A 69 ILE HB A 69 ILE H 1.0 . 3.30 456 456 A 27 LEU HB3 A 24 ARG HA 1.0 . 5.17 457 457 A 27 LEU HB3 A 27 LEU H 1.0 . 3.66 458 458 A 27 LEU HB2 A 24 ARG HA 1.0 . 4.74 459 459 A 65 GLU H A 65 GLU HB3 1.0 . 3.88 460 460 A 66 ALA H A 65 GLU HB3 1.0 . 4.24 461 461 A 43 PHE H A 42 ARG HBy 1.0 . 4.27 462 462 A 60 THR H A 59 LEU HBy 1.0 . 3.95 463 463 A 35 GLY H A 34 ARG HA 1.0 . 2.90 464 464 A 70 THR H A 69 ILE HA 1.0 . 3.01 465 465 A 53 ASN HB3 A 54 CYS H 1.0 . 5.28 466 466 A 42 ARG H A 41 LEU HBx 1.0 . 3.77 467 467 A 18 ALA H A 17 VAL HA 1.0 . 3.01 468 468 A 37 LYS HBx A 38 LEU H 1.0 . 4.27 469 469 A 2 LYS H A 1 MET HA 1.0 . 3.12 470 470 A 62 ARG H A 62 ARG HB2 1.0 . 4.09 471 471 A 63 ARG H A 62 ARG HB2 1.0 . 4.99 472 472 A 20 GLU H A 20 GLU HB2 1.0 . 3.41 473 473 A 10 ASP HB2 A 11 ARG H 1.0 . 4.42 474 474 A 30 LEU H A 30 LEU HB3 1.0 . 3.62 475 475 A 31 GLY H A 30 LEU HB3 1.0 . 5.21 476 476 A 3 LEU H A 2 LYS HA 1.0 . 3.26 477 477 A 22 ALA H A 21 PRO HB3 1.0 . 4.34 478 478 A 38 LEU H A 37 LYS HBy 1.0 . 4.27 479 479 A 37 LYS H A 37 LYS HBy 1.0 . 3.95 480 480 A 37 LYS HA A 38 LEU H 1.0 . 2.98 481 481 A 54 CYS H A 53 ASN HA 1.0 . 3.05 482 482 A 73 ILE HB A 74 LEU H 1.0 . 4.49 483 483 A 16 SER H A 15 THR HB 1.0 . 4.34 484 484 A 75 ALA H A 74 LEU HA 1.0 . 2.98 485 485 A 64 ASN H A 63 ARG HB3 1.0 . 3.80 486 486 A 63 ARG H A 63 ARG HB3 1.0 . 3.70 487 487 A 51 GLU H A 50 ILE HB 1.0 . 5.35 488 488 A 50 ILE H A 50 ILE HB 1.0 . 3.84 489 489 A 64 ASN H A 64 ASN HBx 1.0 . 3.73 490 490 A 74 LEU H A 73 ILE HA 1.0 . 2.98 491 491 A 71 VAL H A 2 LYS HA 1.0 . 4.13 492 492 A 6 LEU H A 3 LEU HA 1.0 . 5.21 493 493 A 5 GLU H A 3 LEU HA 1.0 . 5.35 494 494 A 3 LEU HB3 A 2 LYS HA 1.0 . 5.89 495 495 A 3 LEU HB2 A 2 LYS HA 1.0 . 6.00 496 496 A 67 GLU H A 4 SER HA 1.0 . 5.50 497 497 A 6 LEU HA A 10 ASP HB3 1.0 . 5.75 498 498 A 7 LYS H A 10 ASP HB3 1.0 . 4.67 499 499 A 38 LEU H A 13 GLU HA 1.0 . 4.06 500 500 A 71 VAL HA A 14 VAL HA 1.0 . 3.77 501 501 A 14 VAL HB A 13 GLU HA 1.0 . 4.81 502 502 A 69 ILE HA A 17 VAL HA 1.0 . 3.98 503 503 A 70 THR H A 17 VAL HA 1.0 . 4.31 504 504 A 20 GLU HB3 A 23 VAL H 1.0 . 5.46 505 505 A 22 ALA H A 20 GLU HB3 1.0 . 5.89 506 506 A 23 VAL H A 20 GLU HB2 1.0 . 4.13 507 507 A 20 GLU HA A 21 PRO HB3 1.0 . 5.89 508 508 A 25 ARG H A 22 ALA HA 1.0 . 3.77 509 509 A 23 VAL HA A 22 ALA HA 1.0 . 5.14 510 510 A 25 ARG H A 23 VAL HA 1.0 . 5.42 511 511 A 27 LEU H A 23 VAL HA 1.0 . 4.74 512 512 A 23 VAL HB A 24 ARG HA 1.0 . 4.92 513 513 A 29 ASP H A 25 ARG HA 1.0 . 5.06 514 514 A 28 MET H A 25 ARG HA 1.0 . 4.31 515 515 A 29 ASP H A 26 ARG HA 1.0 . 4.02 516 516 A 30 LEU H A 27 LEU HA 1.0 . 4.16 517 517 A 32 LEU H A 27 LEU HA 1.0 . 5.14 518 518 A 31 GLY H A 28 MET HA 1.0 . 4.27 519 519 A 28 MET HA A 32 LEU H 1.0 . 3.80 520 520 A 28 MET H A 29 ASP HB2 1.0 . 5.60 521 521 A 30 LEU HB2 A 27 LEU HA 1.0 . 4.60 522 522 A 30 LEU HB2 A 32 LEU H 1.0 . 5.24 523 523 A 30 LEU HB3 A 27 LEU HA 1.0 . 4.92 524 524 A 32 LEU H A 30 LEU HB3 1.0 . 4.88 525 525 A 30 LEU H A 31 GLY HA2 1.0 . 4.85 526 526 A 33 VAL HB A 34 ARG HA 1.0 . 5.75 527 527 A 36 ALA H A 34 ARG HA 1.0 . 4.13 528 528 A 14 VAL H A 34 ARG HA 1.0 . 5.60 529 529 A 15 THR H A 34 ARG HA 1.0 . 5.78 530 530 A 37 LYS HA A 13 GLU HA 1.0 . 3.55 531 531 A 54 CYS HA A 38 LEU HA 1.0 . 3.80 532 532 A 39 LYS HA A 38 LEU HA 1.0 . 5.39 533 533 A 37 LYS HA A 38 LEU HB3 1.0 . 5.60 534 534 A 42 ARG H A 40 VAL HA 1.0 . 4.49 535 535 A 47 GLY H A 43 PHE HB3 1.0 . 4.99 536 536 A 47 GLY H A 43 PHE HB2 1.0 . 5.68 537 537 A 47 GLY H A 45 PRO HA 1.0 . 5.14 538 538 A 46 LEU HB3 A 48 ASP H 1.0 . 4.88 539 539 A 43 PHE HB2 A 47 GLY HA2 1.0 . 5.17 540 540 A 43 PHE HB3 A 47 GLY HA2 1.0 . 4.45 541 541 A 48 ASP HBy A 49 PRO HA 1.0 . 5.57 542 542 A 48 ASP HBx A 49 PRO HA 1.0 . 5.57 543 543 A 62 ARG HA A 49 PRO HA 1.0 . 4.27 544 544 A 49 PRO HA A 48 ASP HA 1.0 . 3.34 545 545 A 50 ILE HA A 43 PHE HA 1.0 . 3.88 546 546 A 50 ILE HA A 44 ALA H 1.0 . 4.24 547 547 A 48 ASP HA A 50 ILE HB 1.0 . 5.78 548 548 A 49 PRO HA A 50 ILE HB 1.0 . 5.93 549 549 A 51 GLU HA A 60 THR HA 1.0 . 3.70 550 550 A 52 VAL HA A 40 VAL HA 1.0 . 3.84 551 551 A 53 ASN HA A 58 LEU HA 1.0 . 3.84 552 552 A 53 ASN HA A 59 LEU H 1.0 . 4.24 553 553 A 52 VAL HA A 53 ASN HB3 1.0 . 5.75 554 554 A 52 VAL HA A 53 ASN HB2 1.0 . 5.78 555 555 A 54 CYS HB3 A 53 ASN HA 1.0 . 5.39 556 556 A 52 VAL H A 60 THR HA 1.0 . 4.63 557 557 A 65 GLU H A 62 ARG HB3 1.0 . 4.92 558 558 A 65 GLU H A 62 ARG HB2 1.0 . 3.88 559 559 A 63 ARG HB2 A 62 ARG HA 1.0 . 5.86 560 560 A 68 GLY H A 65 GLU HA 1.0 . 4.92 561 561 A 62 ARG H A 65 GLU HB2 1.0 . 4.16 562 562 A 66 ALA HA A 68 GLY H 1.0 . 5.68 563 563 A 66 ALA HA A 69 ILE H 1.0 . 4.34 564 564 A 4 SER H A 67 GLU HA 1.0 . 4.70 565 565 A 69 ILE HB A 66 ALA HA 1.0 . 4.42 566 566 A 70 THR HA A 2 LYS HA 1.0 . 3.73 567 567 A 71 VAL HA A 16 SER H 1.0 . 4.42 568 568 A 71 VAL HA A 15 THR H 1.0 . 3.48 569 569 A 12 ALA HA A 73 ILE HA 1.0 . 3.55 570 570 A 13 GLU H A 73 ILE HA 1.0 . 4.52 571 571 A 96 ARG HBx A 97 ALA H 1.0 . 5.21 572 572 A 97 ALA H A 96 ARG HBy 1.0 . 5.21 573 573 A 4 SER H A 2 LYS HA 1.0 . 4.88 574 574 A 14 VAL HA A 35 GLY H 1.0 . 5.68 575 575 A 23 VAL H A 21 PRO HA 1.0 . 5.28 576 576 A 24 ARG HB3 A 23 VAL H 1.0 . 4.81 577 577 A 29 ASP H A 27 LEU HA 1.0 . 5.57 578 578 A 27 LEU HB2 A 28 MET HA 1.0 . 5.46 579 579 A 28 MET H A 29 ASP HB3 1.0 . 5.93 580 580 A 30 LEU HB2 A 31 GLY HA2 1.0 . 5.82 581 581 A 31 GLY HA2 A 32 LEU HA 1.0 . 5.60 582 582 A 28 MET HA A 32 LEU HA 1.0 . 5.39 583 583 A 36 ALA H A 33 VAL HB 1.0 . 5.71 584 584 A 16 SER H A 34 ARG HA 1.0 . 5.50 585 585 A 42 ARG HA A 8 ALA HA 1.0 . 4.96 586 586 A 43 PHE HB3 A 47 GLY HA3 1.0 . 6.00 587 587 A 50 ILE HA A 49 PRO HA 1.0 . 5.75 588 588 A 52 VAL HA A 51 GLU HB2 1.0 . 6.00 589 589 A 52 VAL HB A 54 CYS H 1.0 . 5.96 590 590 A 65 GLU HB2 A 66 ALA HA 1.0 . 5.28 591 591 A 12 ALA H A 73 ILE HA 1.0 . 5.50 592 592 A 6 LEU H A 6 LEU HG 1.0 . 4.06 593 593 A 80 HIS HA A 81 PRO HDx 1.0 . 3.37 594 594 A 53 ASN HD21 A 53 ASN HB2 1.0 . 3.48 595 595 A 65 GLU H A 65 GLU HGy 1.0 . 4.34 596 596 A 65 GLU HA A 65 GLU HGy 1.0 . 4.06 597 597 A 26 ARG HA A 26 ARG HGy 1.0 . 3.84 598 598 A 84 TRP HA A 85 PRO HDy 1.0 . 3.41 599 599 A 3 LEU HB2 A 3 LEU HG 1.0 . 2.98 600 600 A 30 LEU H A 30 LEU HG 1.0 . 4.02 601 601 A 7 LYS H A 7 LYS HGx 1.0 . 4.02 602 602 A 20 GLU HA A 21 PRO HD3 1.0 . 2.72 603 603 A 20 GLU HA A 21 PRO HD2 1.0 . 3.19 604 604 A 32 LEU HA A 32 LEU HG 1.0 . 4.16 605 605 A 32 LEU H A 32 LEU HG 1.0 . 4.60 606 606 A 65 GLU H A 65 GLU HGx 1.0 . 4.34 607 607 A 65 GLU HA A 65 GLU HGx 1.0 . 4.06 608 608 A 67 GLU HA A 67 GLU HGx 1.0 . 4.20 609 609 A 2 LYS H A 2 LYS HGy 1.0 . 4.67 610 610 A 27 LEU H A 27 LEU HG 1.0 . 3.80 611 611 A 80 HIS HA A 81 PRO HDy 1.0 . 3.37 612 612 A 67 GLU H A 67 GLU HGy 1.0 . 4.02 613 613 A 67 GLU HA A 67 GLU HGy 1.0 . 4.20 614 614 A 3 LEU HA A 3 LEU HG 1.0 . 4.24 615 615 A 11 ARG HA A 11 ARG HGx 1.0 . 4.20 616 616 A 84 TRP HA A 85 PRO HDx 1.0 . 3.41 617 617 A 11 ARG HA A 11 ARG HGy 1.0 . 4.20 618 618 A 11 ARG H A 11 ARG HGy 1.0 . 4.63 619 619 A 59 LEU H A 59 LEU HG 1.0 . 4.34 620 620 A 98 LEU H A 98 LEU HG 1.0 . 5.03 621 621 A 26 ARG HA A 26 ARG HDy 1.0 . 5.46 622 622 A 26 ARG H A 26 ARG HDy 1.0 . 6.00 623 623 A 46 LEU H A 46 LEU HG 1.0 . 3.98 624 624 A 58 LEU HA A 58 LEU HG 1.0 . 3.95 625 625 A 3 LEU H A 3 LEU HG 1.0 . 6.00 626 626 A 50 ILE H A 50 ILE HG12 1.0 . 5.50 627 627 A 50 ILE H A 50 ILE HG13 1.0 . 4.27 628 628 A 69 ILE H A 69 ILE HG1y 1.0 . 3.80 629 629 A 69 ILE HA A 69 ILE HG1y 1.0 . 4.13 630 630 A 7 LYS H A 7 LYS HGy 1.0 . 4.02 631 631 A 62 ARG H A 62 ARG HGx 1.0 . 4.06 632 632 A 26 ARG HA A 26 ARG HDx 1.0 . 5.46 633 633 A 26 ARG H A 26 ARG HDx 1.0 . 6.00 634 634 A 46 LEU HA A 46 LEU HG 1.0 . 4.27 635 635 A 21 PRO HD3 A 20 GLU HB2 1.0 . 4.92 636 636 A 21 PRO HD2 A 20 GLU HB2 1.0 . 4.42 637 637 A 2 LYS HA A 2 LYS HDy 1.0 . 4.56 638 638 A 2 LYS HA A 2 LYS HDx 1.0 . 4.56 639 639 A 55 ASN HB2 A 55 ASN HD21 1.0 . 3.41 640 640 A 62 ARG H A 62 ARG HGy 1.0 . 4.06 641 641 A 67 GLU H A 67 GLU HGx 1.0 . 4.02 642 642 A 2 LYS H A 2 LYS HGx 1.0 . 4.67 643 643 A 3 LEU HA A 6 LEU HG 1.0 . 3.55 644 644 A 69 ILE HB A 3 LEU HB2 1.0 . 4.13 645 645 A 3 LEU HB2 A 66 ALA HA 1.0 . 5.53 646 646 A 3 LEU HB2 A 69 ILE H 1.0 . 6.00 647 647 A 4 SER H A 3 LEU HG 1.0 . 4.56 648 648 A 10 ASP HB2 A 6 LEU HG 1.0 . 5.42 649 649 A 7 LYS H A 6 LEU HG 1.0 . 4.88 650 650 A 8 ALA H A 7 LYS HGy 1.0 . 6.00 651 651 A 8 ALA H A 7 LYS HGx 1.0 . 6.00 652 652 A 8 ALA HA A 40 VAL HB 1.0 . 4.06 653 653 A 12 ALA H A 11 ARG HGy 1.0 . 5.71 654 654 A 12 ALA HA A 74 LEU HG 1.0 . 3.62 655 655 A 71 VAL HB A 14 VAL HA 1.0 . 5.17 656 656 A 14 VAL HB A 34 ARG HA 1.0 . 4.09 657 657 A 26 ARG HA A 26 ARG HGx 1.0 . 3.84 658 658 A 25 ARG HA A 28 MET HGy 1.0 . 6.00 659 659 A 33 VAL HA A 28 MET HGy 1.0 . 6.00 660 660 A 25 ARG HA A 28 MET HGx 1.0 . 6.00 661 661 A 33 VAL HA A 28 MET HGx 1.0 . 6.00 662 662 A 33 VAL H A 32 LEU HG 1.0 . 5.82 663 663 A 28 MET HA A 33 VAL HB 1.0 . 5.96 664 664 A 35 GLY H A 34 ARG HGy 1.0 . 4.70 665 665 A 54 CYS H A 59 LEU HG 1.0 . 6.00 666 666 A 38 LEU HA A 54 CYS HG 1.0 . 6.00 667 667 A 54 CYS HB2 A 38 LEU HA 1.0 . 5.10 668 668 A 54 CYS HB3 A 38 LEU HA 1.0 . 6.00 669 669 A 54 CYS HA A 38 LEU HB2 1.0 . 5.53 670 670 A 53 ASN HA A 38 LEU HB2 1.0 . 6.00 671 671 A 54 CYS HB3 A 38 LEU HB2 1.0 . 6.00 672 672 A 54 CYS HA A 38 LEU HB3 1.0 . 4.92 673 673 A 11 ARG HA A 38 LEU HG 1.0 . 6.00 674 674 A 40 VAL H A 39 LYS HGy 1.0 . 4.20 675 675 A 40 VAL H A 39 LYS HGx 1.0 . 4.20 676 676 A 10 ASP H A 40 VAL HB 1.0 . 3.52 677 677 A 52 VAL HA A 41 LEU HBy 1.0 . 6.00 678 678 A 52 VAL HA A 41 LEU HBx 1.0 . 6.00 679 679 A 40 VAL HA A 41 LEU HG 1.0 . 5.75 680 680 A 52 VAL HA A 41 LEU HG 1.0 . 4.24 681 681 A 42 ARG H A 41 LEU HG 1.0 . 5.89 682 682 A 43 PHE HB3 A 50 ILE HG12 1.0 . 6.00 683 683 A 46 LEU HG A 45 PRO HB3 1.0 . 5.14 684 684 A 66 ALA HA A 69 ILE HG1y 1.0 . 4.31 685 685 A 48 ASP HBy A 63 ARG H 1.0 . 6.00 686 686 A 48 ASP HBx A 63 ARG H 1.0 . 6.00 687 687 A 49 PRO HA A 50 ILE HG13 1.0 . 5.28 688 688 A 43 PHE HA A 50 ILE HB 1.0 . 6.00 689 689 A 43 PHE HA A 50 ILE HG13 1.0 . 5.53 690 690 A 48 ASP HA A 50 ILE HG13 1.0 . 5.46 691 691 A 51 GLU H A 50 ILE HG13 1.0 . 6.00 692 692 A 63 ARG H A 50 ILE HG13 1.0 . 6.00 693 693 A 63 ARG HA A 50 ILE HG12 1.0 . 6.00 694 694 A 43 PHE HA A 50 ILE HG12 1.0 . 5.86 695 695 A 51 GLU H A 50 ILE HG12 1.0 . 4.49 696 696 A 51 GLU HB3 A 42 ARG H 1.0 . 4.78 697 697 A 42 ARG H A 51 GLU HB2 1.0 . 3.52 698 698 A 52 VAL HB A 39 LYS H 1.0 . 6.00 699 699 A 53 ASN HB3 A 58 LEU HA 1.0 . 6.00 700 700 A 53 ASN HB2 A 41 LEU HG 1.0 . 4.56 701 701 A 58 LEU HA A 53 ASN HB2 1.0 . 6.00 702 702 A 55 ASN HB3 A 54 CYS HG 1.0 . 6.00 703 703 A 55 ASN HB2 A 54 CYS HG 1.0 . 5.35 704 704 A 53 ASN HD21 A 58 LEU HG 1.0 . 5.78 705 705 A 52 VAL HB A 38 LEU HB2 1.0 . 4.60 706 706 A 52 VAL HB A 40 VAL HA 1.0 . 5.03 707 707 A 52 VAL HB A 39 LYS HA 1.0 . 5.78 708 708 A 63 ARG H A 62 ARG HDy 1.0 . 6.00 709 709 A 63 ARG H A 62 ARG HDx 1.0 . 6.00 710 710 A 48 ASP HBx A 63 ARG HB2 1.0 . 4.96 711 711 A 48 ASP HBy A 63 ARG HB2 1.0 . 4.96 712 712 A 63 ARG HB2 A 48 ASP HA 1.0 . 5.71 713 713 A 48 ASP HA A 63 ARG HB3 1.0 . 6.00 714 714 A 66 ALA H A 65 GLU HGy 1.0 . 6.00 715 715 A 62 ARG H A 65 GLU HGy 1.0 . 6.00 716 716 A 66 ALA H A 65 GLU HGx 1.0 . 6.00 717 717 A 62 ARG H A 65 GLU HGx 1.0 . 6.00 718 718 A 66 ALA HA A 69 ILE HG1x 1.0 . 4.31 719 719 A 3 LEU HB3 A 66 ALA HA 1.0 . 4.27 720 720 A 64 ASN HA A 67 GLU HGy 1.0 . 4.49 721 721 A 64 ASN HA A 67 GLU HGx 1.0 . 4.49 722 722 A 69 ILE HB A 3 LEU HA 1.0 . 6.00 723 723 A 69 ILE HB A 3 LEU H 1.0 . 4.63 724 724 A 68 GLY H A 69 ILE HG1x 1.0 . 6.00 725 725 A 70 THR H A 69 ILE HG1x 1.0 . 6.00 726 726 A 70 THR HB A 16 SER H 1.0 . 3.95 727 727 A 70 THR HB A 15 THR H 1.0 . 5.64 728 728 A 3 LEU HG A 4 SER HA 1.0 . 6.00 729 729 A 14 VAL HB A 35 GLY HA2 1.0 . 6.00 730 730 A 14 VAL HB A 32 LEU HA 1.0 . 6.00 731 731 A 24 ARG HA A 27 LEU HG 1.0 . 4.78 732 732 A 28 MET H A 27 LEU HG 1.0 . 6.00 733 733 A 54 CYS HG A 32 LEU HA 1.0 . 5.89 734 734 A 12 ALA H A 38 LEU HB2 1.0 . 5.89 735 735 A 54 CYS HB2 A 38 LEU HB3 1.0 . 5.10 736 736 A 54 CYS HB2 A 38 LEU HB2 1.0 . 6.00 737 737 A 51 GLU HB3 A 41 LEU HBy 1.0 . 4.52 738 738 A 51 GLU HB3 A 41 LEU HBx 1.0 . 4.52 739 739 A 46 LEU HG A 45 PRO HA 1.0 . 5.75 740 740 A 62 ARG HB3 A 49 PRO HA 1.0 . 6.00 741 741 A 51 GLU HB3 A 41 LEU H 1.0 . 6.00 742 742 A 41 LEU H A 51 GLU HB2 1.0 . 5.89 743 743 A 54 CYS HB3 A 38 LEU HB3 1.0 . 6.00 744 744 A 53 ASN HD22 A 56 GLY HA3 1.0 . 5.68 745 745 A 59 LEU H A 58 LEU HG 1.0 . 6.00 746 746 A 69 ILE HA A 69 ILE HG1x 1.0 . 4.13 747 747 A 3 LEU HB3 A 69 ILE HB 1.0 . 4.16 748 748 A 46 LEU HB2 A 46 LEU HG 1.0 . 2.98 749 749 A 68 GLY H A 69 ILE HG1y 1.0 . 6.00 750 750 A 12 ALA H A 11 ARG HGx 1.0 . 5.71 751 751 A 14 VAL H A 14 VAL HG1% 1.0 . 5.98 752 752 A 14 VAL HA A 14 VAL HG1% 1.0 . 4.00 753 753 A 50 ILE HA A 50 ILE HD1% 1.0 . 5.40 754 754 A 50 ILE H A 50 ILE HD1% 1.0 . 5.36 755 755 A 59 LEU H A 59 LEU HD2% 1.0 . 5.97 756 756 A 30 LEU HA A 30 LEU HD2% 1.0 . 3.42 757 757 A 30 LEU H A 30 LEU HD2% 1.0 . 5.33 758 758 A 32 LEU H A 32 LEU HD1% 1.0 . 6.16 759 759 A 58 LEU HA A 58 LEU HD1% 1.0 . 4.75 760 760 A 58 LEU H A 58 LEU HD1% 1.0 . 6.51 761 761 A 74 LEU H A 74 LEU HD1% 1.0 . 5.90 762 762 A 50 ILE HA A 50 ILE HG2% 1.0 . 4.10 763 763 A 73 ILE H A 73 ILE HD1% 1.0 . 5.94 764 764 A 73 ILE HA A 73 ILE HD1% 1.0 . 4.79 765 765 A 30 LEU HA A 30 LEU HD1% 1.0 . 5.51 766 766 A 30 LEU H A 30 LEU HD1% 1.0 . 5.33 767 767 A 46 LEU HB3 A 46 LEU HD2% 1.0 . 4.14 768 768 A 46 LEU H A 46 LEU HD2% 1.0 . 5.36 769 769 A 71 VAL HA A 71 VAL HG1% 1.0 . 4.03 770 770 A 15 THR HA A 15 THR HG2% 1.0 . 3.89 771 771 A 20 GLU H A 19 ALA HB% 1.0 . 3.67 772 772 A 32 LEU HA A 32 LEU HD2% 1.0 . 4.39 773 773 A 98 LEU H A 97 ALA HB% 1.0 . 5.04 774 774 A 14 VAL HA A 14 VAL HG2% 1.0 . 3.96 775 775 A 27 LEU H A 27 LEU HD2% 1.0 . 4.97 776 776 A 27 LEU HD2% A 27 LEU HA 1.0 . 3.53 777 777 A 33 VAL HA A 33 VAL HG1% 1.0 . 3.85 778 778 A 33 VAL H A 33 VAL HG1% 1.0 . 4.43 779 779 A 32 LEU H A 32 LEU HD2% 1.0 . 6.26 780 780 A 63 ARG HA A 66 ALA HB% 1.0 . 4.07 781 781 A 13 GLU H A 12 ALA HB% 1.0 . 3.85 782 782 A 40 VAL HA A 40 VAL HG2% 1.0 . 3.60 783 783 A 6 LEU H A 6 LEU HD2% 1.0 . 4.97 784 784 A 75 ALA HB% A 75 ALA H 1.0 . 3.74 785 785 A 98 LEU HA A 98 LEU HD1% 1.0 . 6.70 786 786 A 73 ILE H A 73 ILE HG2% 1.0 . 4.75 787 787 A 73 ILE HA A 73 ILE HG2% 1.0 . 4.17 788 788 A 46 LEU HB2 A 46 LEU HD1% 1.0 . 3.96 789 789 A 46 LEU HA A 46 LEU HD1% 1.0 . 5.33 790 790 A 46 LEU HB3 A 46 LEU HD1% 1.0 . 4.03 791 791 A 46 LEU H A 46 LEU HD1% 1.0 . 6.26 792 792 A 59 LEU HA A 59 LEU HD1% 1.0 . 5.83 793 793 A 59 LEU H A 59 LEU HD1% 1.0 . 6.37 794 794 A 33 VAL HA A 33 VAL HG2% 1.0 . 4.25 795 795 A 33 VAL H A 33 VAL HG2% 1.0 . 3.74 796 796 A 3 LEU H A 3 LEU HD2% 1.0 . 5.43 797 797 A 3 LEU HB3 A 3 LEU HD2% 1.0 . 4.21 798 798 A 3 LEU HA A 3 LEU HD1% 1.0 . 3.89 799 799 A 3 LEU H A 3 LEU HD1% 1.0 . 5.69 800 800 A 52 VAL H A 52 VAL HG2% 1.0 . 4.25 801 801 A 70 THR HA A 70 THR HG2% 1.0 . 4.25 802 802 A 57 MET HE% A 57 MET HA 1.0 . 6.41 803 803 A 57 MET H A 57 MET HE% 1.0 . 6.80 804 804 A 23 VAL HA A 23 VAL HG2% 1.0 . 3.67 805 805 A 58 LEU HA A 58 LEU HD2% 1.0 . 4.68 806 806 A 58 LEU H A 58 LEU HD2% 1.0 . 6.30 807 807 A 74 LEU H A 74 LEU HD2% 1.0 . 5.00 808 808 A 74 LEU HA A 74 LEU HD2% 1.0 . 3.56 809 809 A 41 LEU HA A 41 LEU HD2% 1.0 . 3.60 810 810 A 69 ILE H A 69 ILE HG2% 1.0 . 5.33 811 811 A 69 ILE HA A 69 ILE HG2% 1.0 . 4.10 812 812 A 46 LEU HA A 46 LEU HD2% 1.0 . 3.60 813 813 A 40 VAL HA A 40 VAL HG1% 1.0 . 4.21 814 814 A 6 LEU H A 6 LEU HD1% 1.0 . 5.58 815 815 A 6 LEU HA A 6 LEU HD1% 1.0 . 5.54 816 816 A 60 THR HG2% A 60 THR HA 1.0 . 4.07 817 817 A 60 THR H A 60 THR HG2% 1.0 . 5.33 818 818 A 9 GLY H A 8 ALA HB% 1.0 . 4.46 819 819 A 23 VAL HA A 23 VAL HG1% 1.0 . 3.89 820 820 A 27 LEU H A 27 LEU HD1% 1.0 . 5.43 821 821 A 50 ILE HB A 50 ILE HD1% 1.0 . 4.18 822 822 A 69 ILE H A 69 ILE HD1% 1.0 . 5.47 823 823 A 69 ILE HA A 69 ILE HD1% 1.0 . 4.75 824 824 A 28 MET H A 28 MET HE% 1.0 . 6.77 825 825 A 28 MET HA A 28 MET HE% 1.0 . 6.44 826 826 A 61 MET HE% A 3 LEU HD1% 1.0 . 5.45 827 827 A 65 GLU HB2 A 61 MET HE% 1.0 . 5.07 828 828 A 66 ALA HA A 61 MET HE% 1.0 . 4.61 829 829 A 62 ARG H A 61 MET HE% 1.0 . 6.15 830 830 A 61 MET H A 61 MET HE% 1.0 . 6.80 831 831 A 65 GLU H A 61 MET HE% 1.0 . 6.98 832 832 A 2 LYS HA A 71 VAL HG2% 1.0 . 5.22 833 833 A 2 LYS HA A 71 VAL HG1% 1.0 . 5.80 834 834 A 2 LYS HA A 70 THR HG2% 1.0 . 5.72 835 835 A 3 LEU HA A 71 VAL HG2% 1.0 . 4.28 836 836 A 3 LEU HA A 71 VAL HG1% 1.0 . 4.54 837 837 A 3 LEU HB2 A 71 VAL HG1% 1.0 . 5.08 838 838 A 6 LEU H A 3 LEU HD1% 1.0 . 6.41 839 839 A 66 ALA HA A 3 LEU HD2% 1.0 . 4.17 840 840 A 3 LEU HD2% A 4 SER HA 1.0 . 6.41 841 841 A 66 ALA HB% A 4 SER HA 1.0 . 4.64 842 842 A 4 SER HBy A 50 ILE HD1% 1.0 . 5.65 843 843 A 4 SER HBx A 50 ILE HD1% 1.0 . 5.65 844 844 A 71 VAL HG2% A 6 LEU HG 1.0 . 5.83 845 845 A 12 ALA HB% A 6 LEU HD1% 1.0 . 5.95 846 846 A 71 VAL HG2% A 6 LEU HD1% 1.0 . 5.81 847 847 A 10 ASP HB3 A 6 LEU HD1% 1.0 . 4.86 848 848 A 10 ASP HB2 A 6 LEU HD1% 1.0 . 5.47 849 849 A 3 LEU HA A 6 LEU HD1% 1.0 . 4.39 850 850 A 12 ALA HA A 6 LEU HD1% 1.0 . 6.51 851 851 A 11 ARG HA A 6 LEU HD1% 1.0 . 7.02 852 852 A 5 GLU H A 6 LEU HD1% 1.0 . 7.02 853 853 A 71 VAL HG2% A 6 LEU HD2% 1.0 . 5.91 854 854 A 10 ASP HB2 A 6 LEU HD2% 1.0 . 4.68 855 855 A 5 GLU H A 6 LEU HD2% 1.0 . 7.02 856 856 A 7 LYS H A 6 LEU HD2% 1.0 . 3.99 857 857 A 7 LYS HA A 40 VAL HG1% 1.0 . 5.08 858 858 A 8 ALA HA A 40 VAL HG1% 1.0 . 4.00 859 859 A 8 ALA HA A 40 VAL HG2% 1.0 . 5.58 860 860 A 42 ARG HA A 8 ALA HB% 1.0 . 4.07 861 861 A 7 LYS HA A 8 ALA HB% 1.0 . 5.29 862 862 A 42 ARG H A 8 ALA HB% 1.0 . 6.37 863 863 A 43 PHE H A 8 ALA HB% 1.0 . 5.15 864 864 A 10 ASP H A 8 ALA HB% 1.0 . 7.02 865 865 A 71 VAL HG2% A 12 ALA HB% 1.0 . 5.91 866 866 A 11 ARG HA A 12 ALA HB% 1.0 . 5.54 867 867 A 71 VAL HA A 12 ALA HB% 1.0 . 5.04 868 868 A 74 LEU H A 12 ALA HB% 1.0 . 4.89 869 869 A 73 ILE H A 12 ALA HB% 1.0 . 5.83 870 870 A 14 VAL HA A 15 THR HG2% 1.0 . 6.91 871 871 A 14 VAL HB A 36 ALA HB% 1.0 . 4.68 872 872 A 16 SER H A 14 VAL HG1% 1.0 . 4.10 873 873 A 36 ALA H A 14 VAL HG1% 1.0 . 7.02 874 874 A 35 GLY H A 14 VAL HG1% 1.0 . 4.97 875 875 A 14 VAL HG2% A 32 LEU HA 1.0 . 5.29 876 876 A 13 GLU HA A 14 VAL HG2% 1.0 . 5.07 877 877 A 33 VAL H A 14 VAL HG2% 1.0 . 6.26 878 878 A 38 LEU H A 14 VAL HG2% 1.0 . 6.73 879 879 A 15 THR H A 14 VAL HG2% 1.0 . 5.87 880 880 A 15 THR HG2% A 14 VAL HG1% 1.0 . 8.04 881 881 A 72 HIS HD2 A 15 THR HG2% 1.0 . 7.02 882 882 A 17 VAL HA A 18 ALA HB% 1.0 . 5.69 883 883 A 18 ALA HB% A 68 GLY HAx 1.0 . 4.68 884 884 A 24 ARG HA A 19 ALA HB% 1.0 . 4.75 885 885 A 23 VAL H A 19 ALA HB% 1.0 . 5.51 886 886 A 20 GLU HB3 A 23 VAL HG2% 1.0 . 5.90 887 887 A 19 ALA HB% A 20 GLU HB2 1.0 . 6.77 888 888 A 22 ALA HB% A 23 VAL HG2% 1.0 . 6.81 889 889 A 23 VAL HA A 22 ALA HB% 1.0 . 5.76 890 890 A 24 ARG H A 22 ALA HB% 1.0 . 6.66 891 891 A 23 VAL HA A 27 LEU HD1% 1.0 . 6.08 892 892 A 23 VAL HA A 19 ALA HB% 1.0 . 6.41 893 893 A 23 VAL HB A 19 ALA HB% 1.0 . 4.21 894 894 A 23 VAL HG1% A 19 ALA HB% 1.0 . 6.02 895 895 A 24 ARG HA A 23 VAL HG1% 1.0 . 5.72 896 896 A 27 LEU H A 23 VAL HG1% 1.0 . 5.51 897 897 A 24 ARG H A 23 VAL HG1% 1.0 . 5.26 898 898 A 23 VAL HG2% A 20 GLU HB2 1.0 . 4.89 899 899 A 24 ARG HB3 A 19 ALA HB% 1.0 . 5.47 900 900 A 24 ARG HB2 A 19 ALA HB% 1.0 . 5.33 901 901 A 19 ALA HB% A 27 LEU HD1% 1.0 . 6.81 902 902 A 24 ARG HA A 27 LEU HD1% 1.0 . 5.08 903 903 A 24 ARG H A 27 LEU HD1% 1.0 . 6.16 904 904 A 33 VAL HG1% A 28 MET HGy 1.0 . 4.97 905 905 A 33 VAL HG1% A 28 MET HGx 1.0 . 4.97 906 906 A 33 VAL HG2% A 28 MET HE% 1.0 . 7.86 907 907 A 33 VAL HG1% A 28 MET HE% 1.0 . 6.96 908 908 A 25 ARG HA A 28 MET HE% 1.0 . 5.29 909 909 A 33 VAL HA A 28 MET HE% 1.0 . 5.83 910 910 A 29 ASP H A 28 MET HE% 1.0 . 7.02 911 911 A 34 ARG H A 28 MET HE% 1.0 . 7.02 912 912 A 29 ASP HB2 A 30 LEU HD2% 1.0 . 7.02 913 913 A 27 LEU HA A 30 LEU HD1% 1.0 . 4.36 914 914 A 27 LEU HA A 30 LEU HD2% 1.0 . 7.02 915 915 A 54 CYS HB3 A 32 LEU HD2% 1.0 . 6.95 916 916 A 33 VAL HA A 32 LEU HD2% 1.0 . 6.01 917 917 A 16 SER HA A 32 LEU HD2% 1.0 . 7.02 918 918 A 33 VAL H A 32 LEU HD2% 1.0 . 5.76 919 919 A 31 GLY HA2 A 33 VAL HG1% 1.0 . 6.05 920 920 A 28 MET HA A 33 VAL HG1% 1.0 . 4.03 921 921 A 31 GLY H A 33 VAL HG1% 1.0 . 5.72 922 922 A 34 ARG H A 33 VAL HG1% 1.0 . 4.90 923 923 A 36 ALA HB% A 33 VAL HG2% 1.0 . 6.63 924 924 A 31 GLY HA2 A 33 VAL HG2% 1.0 . 5.69 925 925 A 33 VAL HG2% A 32 LEU HA 1.0 . 5.33 926 926 A 55 ASN HD22 A 33 VAL HG2% 1.0 . 6.73 927 927 A 32 LEU H A 33 VAL HG2% 1.0 . 6.73 928 928 A 36 ALA H A 33 VAL HG2% 1.0 . 5.15 929 929 A 35 GLY H A 33 VAL HG2% 1.0 . 7.02 930 930 A 14 VAL HG1% A 34 ARG HA 1.0 . 4.07 931 931 A 36 ALA HB% A 32 LEU HA 1.0 . 4.10 932 932 A 37 LYS HA A 36 ALA HB% 1.0 . 6.26 933 933 A 33 VAL H A 36 ALA HB% 1.0 . 3.67 934 934 A 55 ASN HD21 A 36 ALA HB% 1.0 . 5.69 935 935 A 14 VAL H A 36 ALA HB% 1.0 . 5.43 936 936 A 35 GLY H A 36 ALA HB% 1.0 . 6.26 937 937 A 40 VAL HG1% A 43 PHE HZ 1.0 . 5.87 938 938 A 39 LYS HA A 40 VAL HG2% 1.0 . 5.87 939 939 A 53 ASN HB2 A 41 LEU HD1% 1.0 . 4.54 940 940 A 53 ASN HA A 41 LEU HD1% 1.0 . 5.90 941 941 A 38 LEU H A 74 LEU HD1% 1.0 . 6.33 942 942 A 59 LEU H A 41 LEU HD1% 1.0 . 6.55 943 943 A 53 ASN HB2 A 41 LEU HD2% 1.0 . 5.04 944 944 A 52 VAL HA A 41 LEU HD2% 1.0 . 7.02 945 945 A 42 ARG HA A 40 VAL HG1% 1.0 . 5.33 946 946 A 44 ALA HB% A 43 PHE HB3 1.0 . 6.69 947 947 A 50 ILE HA A 44 ALA HB% 1.0 . 6.15 948 948 A 43 PHE HA A 44 ALA HB% 1.0 . 5.51 949 949 A 48 ASP HA A 44 ALA HB% 1.0 . 6.44 950 950 A 48 ASP H A 44 ALA HB% 1.0 . 4.64 951 951 A 47 GLY H A 44 ALA HB% 1.0 . 5.54 952 952 A 45 PRO HB3 A 46 LEU HD2% 1.0 . 6.51 953 953 A 49 PRO HA A 44 ALA HB% 1.0 . 6.87 954 954 A 50 ILE HG2% A 52 VAL HG1% 1.0 . 5.63 955 955 A 50 ILE HG2% A 4 SER HA 1.0 . 7.02 956 956 A 42 ARG HA A 50 ILE HG2% 1.0 . 7.02 957 957 A 43 PHE HA A 50 ILE HG2% 1.0 . 5.25 958 958 A 51 GLU HA A 50 ILE HG2% 1.0 . 6.51 959 959 A 44 ALA H A 50 ILE HG2% 1.0 . 7.02 960 960 A 41 LEU H A 50 ILE HG2% 1.0 . 6.44 961 961 A 52 VAL H A 50 ILE HG2% 1.0 . 6.73 962 962 A 61 MET H A 50 ILE HG2% 1.0 . 6.30 963 963 A 3 LEU HG A 50 ILE HD1% 1.0 . 5.04 964 964 A 50 ILE HD1% A 63 ARG HB3 1.0 . 6.12 965 965 A 50 ILE HD1% A 4 SER HA 1.0 . 4.50 966 966 A 43 PHE HA A 50 ILE HD1% 1.0 . 6.08 967 967 A 48 ASP HA A 50 ILE HD1% 1.0 . 6.16 968 968 A 49 PRO HA A 50 ILE HD1% 1.0 . 7.02 969 969 A 50 ILE HD1% A 43 PHE HZ 1.0 . 5.62 970 970 A 51 GLU H A 50 ILE HD1% 1.0 . 7.02 971 971 A 51 GLU HB3 A 41 LEU HD1% 1.0 . 5.97 972 972 A 51 GLU HB3 A 60 THR HG2% 1.0 . 7.02 973 973 A 51 GLU HB2 A 41 LEU HD1% 1.0 . 6.19 974 974 A 61 MET H A 52 VAL HG1% 1.0 . 6.55 975 975 A 54 CYS HB3 A 52 VAL HG2% 1.0 . 6.26 976 976 A 51 GLU HA A 52 VAL HG2% 1.0 . 5.65 977 977 A 54 CYS H A 52 VAL HG2% 1.0 . 6.30 978 978 A 55 ASN HB3 A 36 ALA HB% 1.0 . 7.02 979 979 A 55 ASN HB2 A 36 ALA HB% 1.0 . 7.02 980 980 A 57 MET HE% A 59 LEU HD2% 1.0 . 6.74 981 981 A 58 LEU H A 57 MET HE% 1.0 . 6.98 982 982 A 53 ASN HB2 A 58 LEU HD2% 1.0 . 6.15 983 983 A 53 ASN HA A 58 LEU HD2% 1.0 . 5.47 984 984 A 53 ASN HD22 A 58 LEU HD2% 1.0 . 7.02 985 985 A 53 ASN HD21 A 58 LEU HD2% 1.0 . 6.87 986 986 A 59 LEU H A 58 LEU HD2% 1.0 . 6.05 987 987 A 54 CYS HB3 A 59 LEU HD1% 1.0 . 4.57 988 988 A 60 THR H A 59 LEU HD1% 1.0 . 6.08 989 989 A 54 CYS H A 59 LEU HD1% 1.0 . 6.12 990 990 A 59 LEU HD2% A 30 LEU HB3 1.0 . 4.97 991 991 A 54 CYS HB3 A 59 LEU HD2% 1.0 . 5.15 992 992 A 54 CYS HA A 59 LEU HD2% 1.0 . 6.55 993 993 A 54 CYS H A 59 LEU HD2% 1.0 . 6.41 994 994 A 50 ILE HA A 60 THR HG2% 1.0 . 6.95 995 995 A 61 MET HA A 60 THR HG2% 1.0 . 4.68 996 996 A 51 GLU HA A 60 THR HG2% 1.0 . 6.12 997 997 A 50 ILE H A 60 THR HG2% 1.0 . 5.33 998 998 A 61 MET H A 60 THR HG2% 1.0 . 4.57 999 999 A 71 VAL HG2% A 1 MET HE% 1.0 . 7.86 1000 1000 A 3 LEU HA A 1 MET HE% 1.0 . 7.02 1001 1001 A 6 LEU HA A 1 MET HE% 1.0 . 4.93 1002 1002 A 72 HIS HA A 1 MET HE% 1.0 . 7.02 1003 1003 A 6 LEU H A 1 MET HE% 1.0 . 7.02 1004 1004 A 5 GLU H A 1 MET HE% 1.0 . 7.02 1005 1005 A 73 ILE H A 1 MET HE% 1.0 . 6.33 1006 1006 A 7 LYS H A 1 MET HE% 1.0 . 6.87 1007 1007 A 2 LYS H A 1 MET HE% 1.0 . 6.30 1008 1008 A 63 ARG HA A 50 ILE HD1% 1.0 . 4.10 1009 1009 A 63 ARG HB2 A 50 ILE HD1% 1.0 . 4.93 1010 1010 A 23 VAL HG1% A 65 GLU HA 1.0 . 5.62 1011 1011 A 65 GLU HB2 A 66 ALA HB% 1.0 . 6.55 1012 1012 A 23 VAL HG1% A 65 GLU HB3 1.0 . 5.98 1013 1013 A 23 VAL HG1% A 65 GLU HGy 1.0 . 5.69 1014 1014 A 23 VAL HG2% A 65 GLU HGy 1.0 . 6.73 1015 1015 A 23 VAL HG1% A 65 GLU HGx 1.0 . 5.69 1016 1016 A 23 VAL HG2% A 65 GLU HGx 1.0 . 6.73 1017 1017 A 66 ALA HB% A 50 ILE HD1% 1.0 . 5.77 1018 1018 A 3 LEU HB3 A 66 ALA HB% 1.0 . 4.50 1019 1019 A 4 SER H A 66 ALA HB% 1.0 . 5.04 1020 1020 A 65 GLU H A 66 ALA HB% 1.0 . 5.36 1021 1021 A 18 ALA HB% A 68 GLY HAy 1.0 . 4.68 1022 1022 A 3 LEU HB3 A 69 ILE HG2% 1.0 . 5.07 1023 1023 A 14 VAL HA A 69 ILE HG2% 1.0 . 5.11 1024 1024 A 66 ALA HA A 69 ILE HG2% 1.0 . 5.47 1025 1025 A 17 VAL HA A 69 ILE HG2% 1.0 . 5.72 1026 1026 A 70 THR HA A 69 ILE HG2% 1.0 . 6.48 1027 1027 A 71 VAL HA A 69 ILE HG2% 1.0 . 6.62 1028 1028 A 70 THR H A 69 ILE HG2% 1.0 . 4.32 1029 1029 A 3 LEU H A 69 ILE HG2% 1.0 . 5.54 1030 1030 A 15 THR H A 69 ILE HG2% 1.0 . 6.26 1031 1031 A 3 LEU HG A 69 ILE HD1% 1.0 . 4.90 1032 1032 A 3 LEU HB3 A 69 ILE HD1% 1.0 . 5.58 1033 1033 A 66 ALA HA A 69 ILE HD1% 1.0 . 4.10 1034 1034 A 17 VAL HA A 69 ILE HD1% 1.0 . 5.18 1035 1035 A 18 ALA H A 69 ILE HD1% 1.0 . 6.12 1036 1036 A 70 THR H A 69 ILE HD1% 1.0 . 6.34 1037 1037 A 3 LEU H A 69 ILE HD1% 1.0 . 7.02 1038 1038 A 70 THR HB A 69 ILE HG2% 1.0 . 5.97 1039 1039 A 71 VAL HA A 14 VAL HG2% 1.0 . 5.25 1040 1040 A 71 VAL HA A 15 THR HG2% 1.0 . 5.11 1041 1041 A 71 VAL HB A 12 ALA HB% 1.0 . 3.60 1042 1042 A 3 LEU HB3 A 71 VAL HG1% 1.0 . 5.26 1043 1043 A 14 VAL HA A 71 VAL HG1% 1.0 . 4.14 1044 1044 A 70 THR HA A 71 VAL HG1% 1.0 . 6.12 1045 1045 A 15 THR H A 71 VAL HG1% 1.0 . 5.08 1046 1046 A 3 LEU HB3 A 71 VAL HG2% 1.0 . 6.08 1047 1047 A 70 THR HA A 71 VAL HG2% 1.0 . 5.15 1048 1048 A 72 HIS HA A 71 VAL HG2% 1.0 . 5.40 1049 1049 A 73 ILE H A 71 VAL HG2% 1.0 . 6.66 1050 1050 A 73 ILE HA A 71 VAL HG2% 1.0 . 6.05 1051 1051 A 73 ILE HA A 12 ALA HB% 1.0 . 4.03 1052 1052 A 73 ILE HB A 71 VAL HG2% 1.0 . 7.02 1053 1053 A 71 VAL HG2% A 73 ILE HG1y 1.0 . 6.05 1054 1054 A 71 VAL HG2% A 73 ILE HG1x 1.0 . 6.05 1055 1055 A 75 ALA HB% A 73 ILE HG2% 1.0 . 5.91 1056 1056 A 73 ILE HG2% A 1 MET HE% 1.0 . 7.17 1057 1057 A 73 ILE HG2% A 10 ASP HB3 1.0 . 6.55 1058 1058 A 75 ALA HA A 73 ILE HG2% 1.0 . 5.83 1059 1059 A 73 ILE HG2% A 74 LEU HA 1.0 . 5.54 1060 1060 A 12 ALA HA A 73 ILE HG2% 1.0 . 5.47 1061 1061 A 74 LEU H A 73 ILE HG2% 1.0 . 4.28 1062 1062 A 73 ILE HG2% A 75 ALA H 1.0 . 5.83 1063 1063 A 11 ARG H A 73 ILE HG2% 1.0 . 5.72 1064 1064 A 73 ILE HD1% A 1 MET HE% 1.0 . 6.63 1065 1065 A 10 ASP HB3 A 73 ILE HD1% 1.0 . 4.82 1066 1066 A 10 ASP HB2 A 73 ILE HD1% 1.0 . 6.34 1067 1067 A 6 LEU HA A 73 ILE HD1% 1.0 . 6.19 1068 1068 A 10 ASP HA A 73 ILE HD1% 1.0 . 6.70 1069 1069 A 12 ALA HA A 73 ILE HD1% 1.0 . 6.48 1070 1070 A 74 LEU H A 73 ILE HD1% 1.0 . 5.98 1071 1071 A 11 ARG H A 73 ILE HD1% 1.0 . 6.55 1072 1072 A 7 LYS H A 73 ILE HD1% 1.0 . 6.77 1073 1073 A 13 GLU HA A 74 LEU HD1% 1.0 . 6.30 1074 1074 A 53 ASN HD21 A 41 LEU HD1% 1.0 . 6.66 1075 1075 A 13 GLU H A 74 LEU HD1% 1.0 . 6.26 1076 1076 A 72 HIS HD2 A 74 LEU HD2% 1.0 . 5.22 1077 1077 A 75 ALA H A 74 LEU HD2% 1.0 . 4.97 1078 1078 A 13 GLU H A 74 LEU HD2% 1.0 . 5.47 1079 1079 A 23 VAL HB A 22 ALA HB% 1.0 . 5.58 1080 1080 A 66 ALA HB% A 3 LEU HD2% 1.0 . 5.48 1081 1081 A 3 LEU HG A 50 ILE HG2% 1.0 . 5.90 1082 1082 A 66 ALA HA A 3 LEU HD1% 1.0 . 5.83 1083 1083 A 10 ASP HA A 6 LEU HD1% 1.0 . 7.02 1084 1084 A 12 ALA H A 6 LEU HD1% 1.0 . 5.65 1085 1085 A 7 LYS H A 6 LEU HD1% 1.0 . 6.08 1086 1086 A 12 ALA HA A 6 LEU HD2% 1.0 . 6.05 1087 1087 A 10 ASP HB2 A 40 VAL HG1% 1.0 . 7.02 1088 1088 A 40 VAL HG1% A 10 ASP HB3 1.0 . 7.02 1089 1089 A 12 ALA HB% A 10 ASP HB3 1.0 . 6.80 1090 1090 A 14 VAL HA A 71 VAL HG2% 1.0 . 6.84 1091 1091 A 70 THR H A 14 VAL HG1% 1.0 . 5.94 1092 1092 A 14 VAL HG2% A 36 ALA HB% 1.0 . 5.84 1093 1093 A 15 THR HA A 14 VAL HG1% 1.0 . 5.29 1094 1094 A 17 VAL HB A 14 VAL HG1% 1.0 . 5.76 1095 1095 A 19 ALA HB% A 65 GLU HA 1.0 . 7.02 1096 1096 A 18 ALA HA A 19 ALA HB% 1.0 . 7.02 1097 1097 A 22 ALA HB% A 21 PRO HB3 1.0 . 6.66 1098 1098 A 65 GLU HB2 A 23 VAL HG1% 1.0 . 6.59 1099 1099 A 27 LEU HB2 A 23 VAL HG1% 1.0 . 6.55 1100 1100 A 65 GLU HB2 A 27 LEU HD1% 1.0 . 6.59 1101 1101 A 27 LEU HA A 27 LEU HD1% 1.0 . 4.82 1102 1102 A 28 MET H A 27 LEU HD1% 1.0 . 7.02 1103 1103 A 32 LEU H A 27 LEU HD2% 1.0 . 6.80 1104 1104 A 28 MET HA A 33 VAL HG2% 1.0 . 6.30 1105 1105 A 57 MET HE% A 30 LEU HA 1.0 . 6.77 1106 1106 A 59 LEU HA A 30 LEU HD1% 1.0 . 7.02 1107 1107 A 57 MET HE% A 30 LEU HD2% 1.0 . 8.04 1108 1108 A 29 ASP HB3 A 30 LEU HD2% 1.0 . 6.55 1109 1109 A 31 GLY HA2 A 36 ALA HB% 1.0 . 6.84 1110 1110 A 14 VAL HB A 32 LEU HD2% 1.0 . 6.08 1111 1111 A 14 VAL HG2% A 34 ARG HA 1.0 . 5.87 1112 1112 A 35 GLY HA2 A 36 ALA HB% 1.0 . 7.02 1113 1113 A 13 GLU HA A 36 ALA HB% 1.0 . 7.02 1114 1114 A 34 ARG H A 36 ALA HB% 1.0 . 7.02 1115 1115 A 40 VAL HA A 50 ILE HG2% 1.0 . 5.72 1116 1116 A 40 VAL HG1% A 50 ILE HG2% 1.0 . 6.89 1117 1117 A 52 VAL HA A 41 LEU HD1% 1.0 . 5.94 1118 1118 A 52 VAL H A 41 LEU HD1% 1.0 . 6.51 1119 1119 A 45 PRO HA A 46 LEU HD2% 1.0 . 6.77 1120 1120 A 62 ARG HA A 50 ILE HD1% 1.0 . 7.02 1121 1121 A 60 THR HG2% A 51 GLU HB2 1.0 . 7.02 1122 1122 A 40 VAL HA A 52 VAL HG1% 1.0 . 5.58 1123 1123 A 59 LEU HD2% A 57 MET HA 1.0 . 4.57 1124 1124 A 59 LEU HD1% A 57 MET HE% 1.0 . 7.32 1125 1125 A 55 ASN HB2 A 57 MET HE% 1.0 . 7.02 1126 1126 A 55 ASN HB3 A 57 MET HE% 1.0 . 7.02 1127 1127 A 49 PRO HA A 60 THR HG2% 1.0 . 7.02 1128 1128 A 66 ALA HA A 50 ILE HD1% 1.0 . 7.02 1129 1129 A 66 ALA HB% A 50 ILE HG2% 1.0 . 7.35 1130 1130 A 3 LEU H A 66 ALA HB% 1.0 . 6.73 1131 1131 A 17 VAL HB A 69 ILE HG2% 1.0 . 5.83 1132 1132 A 70 THR HB A 14 VAL HG1% 1.0 . 6.73 1133 1133 A 71 VAL HA A 70 THR HG2% 1.0 . 6.59 1134 1134 A 71 VAL HG2% A 73 ILE HD1% 1.0 . 7.21 1135 1135 A 43 PHE HB2 A 8 ALA HB% 1.0 . 7.02 1136 1136 A 32 LEU H A 36 ALA HB% 1.0 . 7.02 1137 1137 A 42 ARG H A 41 LEU HD2% 1.0 . 7.02 1138 1138 A 85 PRO HDx A 84 TRP HE3 1.0 . 6.00 1139 1139 A 4 SER HA A 43 PHE HZ 1.0 . 5.03 1140 1140 A 72 HIS H A 72 HIS HD2 1.0 . 6.00 1141 1141 A 84 TRP HA A 84 TRP HE3 1.0 . 5.68 1142 1142 A 85 PRO HDy A 84 TRP HE3 1.0 . 6.00 1143 1143 A 82 HIS HA A 82 HIS HD2 1.0 . 6.00 1144 1144 A 72 HIS HA A 72 HIS HD2 1.0 . 5.39 1145 1145 A 50 ILE HG2% A 43 PHE HZ 1.0 . 6.69 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-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 3 LEU H A 69 ILE O 1.0 . 2.0 2 2 A 69 ILE O A 3 LEU N 1.0 . 3.0 3 3 A 9 GLY H A 40 VAL O 1.0 . 2.0 4 4 A 40 VAL O A 9 GLY N 1.0 . 3.0 5 5 A 12 ALA H A 38 LEU O 1.0 . 2.0 6 6 A 38 LEU O A 12 ALA N 1.0 . 3.0 7 7 A 13 GLU H A 72 HIS O 1.0 . 2.0 8 8 A 72 HIS O A 13 GLU N 1.0 . 3.0 9 9 A 14 VAL H A 36 ALA O 1.0 . 2.0 10 10 A 36 ALA O A 14 VAL N 1.0 . 3.0 11 11 A 15 THR H A 70 THR O 1.0 . 2.0 12 12 A 70 THR O A 15 THR N 1.0 . 3.0 13 13 A 18 ALA H A 68 GLY O 1.0 . 2.0 14 14 A 68 GLY O A 18 ALA N 1.0 . 3.0 15 15 A 24 ARG H A 20 GLU O 1.0 . 2.0 16 16 A 20 GLU O A 24 ARG N 1.0 . 3.0 17 17 A 27 LEU H A 23 VAL O 1.0 . 2.0 18 18 A 23 VAL O A 27 LEU N 1.0 . 3.0 19 19 A 28 MET H A 24 ARG O 1.0 . 2.0 20 20 A 24 ARG O A 28 MET N 1.0 . 3.0 21 21 A 29 ASP H A 25 ARG O 1.0 . 2.0 22 22 A 25 ARG O A 29 ASP N 1.0 . 3.0 23 23 A 32 LEU H A 27 LEU O 1.0 . 2.0 24 24 A 27 LEU O A 32 LEU N 1.0 . 3.0 25 25 A 35 GLY H A 14 VAL O 1.0 . 2.0 26 26 A 14 VAL O A 35 GLY N 1.0 . 3.0 27 27 A 38 LEU H A 12 ALA O 1.0 . 2.0 28 28 A 12 ALA O A 38 LEU N 1.0 . 3.0 29 29 A 39 LYS H A 53 ASN O 1.0 . 2.0 30 30 A 53 ASN O A 39 LYS N 1.0 . 3.0 31 31 A 40 VAL H A 10 ASP O 1.0 . 2.0 32 32 A 10 ASP O A 40 VAL N 1.0 . 3.0 33 33 A 50 ILE H A 61 MET O 1.0 . 2.0 34 34 A 61 MET O A 50 ILE N 1.0 . 3.0 35 35 A 51 GLU H A 42 ARG O 1.0 . 2.0 36 36 A 42 ARG O A 51 GLU N 1.0 . 3.0 37 37 A 52 VAL H A 59 LEU O 1.0 . 2.0 38 38 A 59 LEU O A 52 VAL N 1.0 . 3.0 39 39 A 54 CYS H A 57 MET O 1.0 . 2.0 40 40 A 57 MET O A 54 CYS N 1.0 . 3.0 41 41 A 59 LEU H A 52 VAL O 1.0 . 2.0 42 42 A 52 VAL O A 59 LEU N 1.0 . 3.0 43 43 A 61 MET H A 50 ILE O 1.0 . 2.0 44 44 A 50 ILE O A 61 MET N 1.0 . 3.0 45 45 A 67 GLU H A 63 ARG O 1.0 . 2.0 46 46 A 63 ARG O A 67 GLU N 1.0 . 3.0 47 47 A 70 THR H A 16 SER O 1.0 . 2.0 48 48 A 16 SER O A 70 THR N 1.0 . 3.0 49 49 A 71 VAL H A 1 MET O 1.0 . 2.0 50 50 A 1 MET O A 71 VAL N 1.0 . 3.0 51 51 A 72 HIS H A 13 GLU O 1.0 . 2.0 52 52 A 13 GLU O A 72 HIS N 1.0 . 3.0 53 53 A 3 LEU H A 69 ILE O 1.0 . 1.8 54 54 A 69 ILE O A 3 LEU N 1.0 . 2.7 55 55 A 9 GLY H A 40 VAL O 1.0 . 1.8 56 56 A 40 VAL O A 9 GLY N 1.0 . 2.7 57 57 A 12 ALA H A 38 LEU O 1.0 . 1.8 58 58 A 38 LEU O A 12 ALA N 1.0 . 2.7 59 59 A 13 GLU H A 72 HIS O 1.0 . 1.8 60 60 A 72 HIS O A 13 GLU N 1.0 . 2.7 61 61 A 14 VAL H A 36 ALA O 1.0 . 1.8 62 62 A 36 ALA O A 14 VAL N 1.0 . 2.7 63 63 A 15 THR H A 70 THR O 1.0 . 1.8 64 64 A 70 THR O A 15 THR N 1.0 . 2.7 65 65 A 18 ALA H A 68 GLY O 1.0 . 1.8 66 66 A 68 GLY O A 18 ALA N 1.0 . 2.7 67 67 A 24 ARG H A 20 GLU O 1.0 . 1.8 68 68 A 20 GLU O A 24 ARG N 1.0 . 2.7 69 69 A 27 LEU H A 23 VAL O 1.0 . 1.8 70 70 A 23 VAL O A 27 LEU N 1.0 . 2.7 71 71 A 28 MET H A 24 ARG O 1.0 . 1.8 72 72 A 24 ARG O A 28 MET N 1.0 . 2.7 73 73 A 29 ASP H A 25 ARG O 1.0 . 1.8 74 74 A 25 ARG O A 29 ASP N 1.0 . 2.7 75 75 A 32 LEU H A 27 LEU O 1.0 . 1.8 76 76 A 27 LEU O A 32 LEU N 1.0 . 2.7 77 77 A 35 GLY H A 14 VAL O 1.0 . 1.8 78 78 A 14 VAL O A 35 GLY N 1.0 . 2.7 79 79 A 38 LEU H A 12 ALA O 1.0 . 1.8 80 80 A 12 ALA O A 38 LEU N 1.0 . 2.7 81 81 A 39 LYS H A 53 ASN O 1.0 . 1.8 82 82 A 53 ASN O A 39 LYS N 1.0 . 2.7 83 83 A 40 VAL H A 10 ASP O 1.0 . 1.8 84 84 A 10 ASP O A 40 VAL N 1.0 . 2.7 85 85 A 50 ILE H A 61 MET O 1.0 . 1.8 86 86 A 61 MET O A 50 ILE N 1.0 . 2.7 87 87 A 51 GLU H A 42 ARG O 1.0 . 1.8 88 88 A 42 ARG O A 51 GLU N 1.0 . 2.7 89 89 A 52 VAL H A 59 LEU O 1.0 . 1.8 90 90 A 59 LEU O A 52 VAL N 1.0 . 2.7 91 91 A 54 CYS H A 57 MET O 1.0 . 1.8 92 92 A 57 MET O A 54 CYS N 1.0 . 2.7 93 93 A 59 LEU H A 52 VAL O 1.0 . 1.8 94 94 A 52 VAL O A 59 LEU N 1.0 . 2.7 95 95 A 61 MET H A 50 ILE O 1.0 . 1.8 96 96 A 50 ILE O A 61 MET N 1.0 . 2.7 97 97 A 67 GLU H A 63 ARG O 1.0 . 1.8 98 98 A 63 ARG O A 67 GLU N 1.0 . 2.7 99 99 A 70 THR H A 16 SER O 1.0 . 1.8 100 100 A 16 SER O A 70 THR N 1.0 . 2.7 101 101 A 71 VAL H A 1 MET O 1.0 . 1.8 102 102 A 1 MET O A 71 VAL N 1.0 . 2.7 103 103 A 72 HIS H A 13 GLU O 1.0 . 1.8 104 104 A 13 GLU O A 72 HIS N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.potential_type undefined _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 1 MET N A 1 MET CA A 1 MET C A 2 LYS N 1.0 -85.0 195.0 PSI 2 2 A 1 MET C A 2 LYS N A 2 LYS CA A 2 LYS C 1.0 45.0 295.0 PHI 3 3 A 1 MET C A 2 LYS N A 2 LYS CA A 2 LYS C 1.0 -175.0 75.0 PHI 4 4 A 1 MET C A 2 LYS N A 2 LYS CA A 2 LYS C 1.0 -105.0 225.0 PHI 5 5 A 2 LYS N A 2 LYS CA A 2 LYS C A 3 LEU N 1.0 -85.0 205.0 PSI 6 6 A 2 LYS C A 3 LEU N A 3 LEU CA A 3 LEU C 1.0 -185.0 -45.0 PHI 7 7 A 2 LYS C A 3 LEU N A 3 LEU CA A 3 LEU C 1.0 -65.0 185.0 PHI 8 8 A 3 LEU N A 3 LEU CA A 3 LEU C A 4 SER N 1.0 -335.0 -15.0 PSI 9 9 A 3 LEU N A 3 LEU CA A 3 LEU C A 4 SER N 1.0 -85.0 195.0 PSI 10 10 A 3 LEU C A 4 SER N A 4 SER CA A 4 SER C 1.0 -315.0 -45.0 PHI 11 11 A 3 LEU C A 4 SER N A 4 SER CA A 4 SER C 1.0 -185.0 55.0 PHI 12 12 A 3 LEU C A 4 SER N A 4 SER CA A 4 SER C 1.0 -85.0 205.0 PHI 13 13 A 4 SER N A 4 SER CA A 4 SER C A 5 GLU N 1.0 -345.0 5.0 PSI 14 14 A 4 SER N A 4 SER CA A 4 SER C A 5 GLU N 1.0 -85.0 205.0 PSI 15 15 A 4 SER C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 45.0 295.0 PHI 16 16 A 4 SER C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 -165.0 75.0 PHI 17 17 A 5 GLU N A 5 GLU CA A 5 GLU C A 6 LEU N 1.0 -85.0 195.0 PSI 18 18 A 5 GLU C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 45.0 305.0 PHI 19 19 A 5 GLU C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -185.0 75.0 PHI 20 20 A 5 GLU C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -85.0 215.0 PHI 21 21 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 LYS N 1.0 -85.0 205.0 PSI 22 22 A 6 LEU C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -315.0 -45.0 PHI 23 23 A 6 LEU C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -185.0 75.0 PHI 24 24 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 ALA N 1.0 -85.0 195.0 PSI 25 25 A 7 LYS C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -315.0 -45.0 PHI 26 26 A 7 LYS C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -185.0 75.0 PHI 27 27 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 GLY N 1.0 -85.0 205.0 PSI 28 28 A 8 ALA C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 -315.0 -45.0 PHI 29 29 A 8 ALA C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 -275.0 75.0 PHI 30 30 A 8 ALA C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 -235.0 115.0 PHI 31 31 A 8 ALA C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 -175.0 175.0 PHI 32 32 A 8 ALA C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 -115.0 235.0 PHI 33 33 A 8 ALA C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 -75.0 275.0 PHI 34 34 A 9 GLY C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -315.0 -45.0 PHI 35 35 A 9 GLY C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -185.0 75.0 PHI 36 36 A 10 ASP N A 10 ASP CA A 10 ASP C A 11 ARG N 1.0 -85.0 205.0 PSI 37 37 A 10 ASP C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 45.0 285.0 PHI 38 38 A 10 ASP C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -165.0 75.0 PHI 39 39 A 10 ASP C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -172.2 -79.6 PHI 40 40 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 ALA N 1.0 -85.0 195.0 PSI 41 41 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 ALA N 1.0 120.7 177.8 PSI 42 42 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 45.0 295.0 PHI 43 43 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -175.0 75.0 PHI 44 44 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -105.0 225.0 PHI 45 45 A 11 ARG C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -175.6 -119.3 PHI 46 46 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 GLU N 1.0 -85.0 205.0 PSI 47 47 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 GLU N 1.0 119.0 186.2 PSI 48 48 A 12 ALA C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 45.0 285.0 PHI 49 49 A 12 ALA C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -165.0 75.0 PHI 50 50 A 12 ALA C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -159.3 -80.8 PHI 51 51 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 VAL N 1.0 -85.0 195.0 PSI 52 52 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 VAL N 1.0 113.4 172.3 PSI 53 53 A 13 GLU C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -315.0 -45.0 PHI 54 54 A 13 GLU C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -185.0 75.0 PHI 55 55 A 13 GLU C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -85.0 205.0 PHI 56 56 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 THR N 1.0 -345.0 5.0 PSI 57 57 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 THR N 1.0 -85.0 195.0 PSI 58 58 A 14 VAL C A 15 THR N A 15 THR CA A 15 THR C 1.0 45.0 285.0 PHI 59 59 A 14 VAL C A 15 THR N A 15 THR CA A 15 THR C 1.0 -165.0 75.0 PHI 60 60 A 15 THR N A 15 THR CA A 15 THR C A 16 SER N 1.0 -85.0 195.0 PSI 61 61 A 15 THR C A 16 SER N A 16 SER CA A 16 SER C 1.0 -315.0 -45.0 PHI 62 62 A 15 THR C A 16 SER N A 16 SER CA A 16 SER C 1.0 -185.0 75.0 PHI 63 63 A 15 THR C A 16 SER N A 16 SER CA A 16 SER C 1.0 -85.0 205.0 PHI 64 64 A 16 SER N A 16 SER CA A 16 SER C A 17 VAL N 1.0 -85.0 205.0 PSI 65 65 A 16 SER C A 17 VAL N A 17 VAL CA A 17 VAL C 1.0 45.0 285.0 PHI 66 66 A 16 SER C A 17 VAL N A 17 VAL CA A 17 VAL C 1.0 -165.0 75.0 PHI 67 67 A 16 SER C A 17 VAL N A 17 VAL CA A 17 VAL C 1.0 -159.9 -74.0 PHI 68 68 A 17 VAL N A 17 VAL CA A 17 VAL C A 18 ALA N 1.0 -85.0 195.0 PSI 69 69 A 17 VAL N A 17 VAL CA A 17 VAL C A 18 ALA N 1.0 110.5 144.9 PSI 70 70 A 17 VAL C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 45.0 295.0 PHI 71 71 A 17 VAL C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -175.0 75.0 PHI 72 72 A 17 VAL C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -105.0 225.0 PHI 73 73 A 17 VAL C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -133.8 -71.6 PHI 74 74 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 ALA N 1.0 -85.0 205.0 PSI 75 75 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 ALA N 1.0 93.0 157.6 PSI 76 76 A 18 ALA C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -315.0 -45.0 PHI 77 77 A 18 ALA C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -185.0 75.0 PHI 78 78 A 18 ALA C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -85.0 205.0 PHI 79 79 A 18 ALA C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -173.9 -75.3 PHI 80 80 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLU N 1.0 -345.0 5.0 PSI 81 81 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLU N 1.0 -85.0 205.0 PSI 82 82 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLU N 1.0 90.9 182.6 PSI 83 83 A 19 ALA C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -185.0 -45.0 PHI 84 84 A 19 ALA C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -75.0 195.0 PHI 85 85 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 PRO N 1.0 55.0 165.0 PSI 86 86 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 PRO N 1.0 -215.0 85.0 PSI 87 87 A 21 PRO N A 21 PRO CA A 21 PRO C A 22 ALA N 1.0 -295.0 5.0 PSI 88 88 A 21 PRO N A 21 PRO CA A 21 PRO C A 22 ALA N 1.0 -55.0 195.0 PSI 89 89 A 21 PRO C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -185.0 -45.0 PHI 90 90 A 21 PRO C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -75.0 195.0 PHI 91 91 A 21 PRO C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -77.0 -57.0 PHI 92 92 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 VAL N 1.0 -335.0 -5.0 PSI 93 93 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 VAL N 1.0 -85.0 205.0 PSI 94 94 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 VAL N 1.0 -48.7 -27.0 PSI 95 95 A 22 ALA C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 45.0 295.0 PHI 96 96 A 22 ALA C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -175.0 75.0 PHI 97 97 A 22 ALA C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -105.0 225.0 PHI 98 98 A 22 ALA C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -75.0 -55.0 PHI 99 99 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 ARG N 1.0 -85.0 195.0 PSI 100 100 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 ARG N 1.0 -54.7 -34.7 PSI 101 101 A 23 VAL C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -185.0 -45.0 PHI 102 102 A 23 VAL C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -65.0 185.0 PHI 103 103 A 23 VAL C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -71.6 -51.6 PHI 104 104 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 ARG N 1.0 -335.0 -15.0 PSI 105 105 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 ARG N 1.0 -85.0 195.0 PSI 106 106 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 ARG N 1.0 -51.2 -31.2 PSI 107 107 A 24 ARG C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -185.0 -45.0 PHI 108 108 A 24 ARG C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -75.0 195.0 PHI 109 109 A 24 ARG C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -72.1 -52.1 PHI 110 110 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 ARG N 1.0 -335.0 -5.0 PSI 111 111 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 ARG N 1.0 -85.0 195.0 PSI 112 112 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 ARG N 1.0 -56.9 -26.3 PSI 113 113 A 25 ARG C A 26 ARG N A 26 ARG CA A 26 ARG C 1.0 -185.0 -45.0 PHI 114 114 A 25 ARG C A 26 ARG N A 26 ARG CA A 26 ARG C 1.0 -75.0 195.0 PHI 115 115 A 25 ARG C A 26 ARG N A 26 ARG CA A 26 ARG C 1.0 -78.7 -52.5 PHI 116 116 A 26 ARG N A 26 ARG CA A 26 ARG C A 27 LEU N 1.0 -335.0 -5.0 PSI 117 117 A 26 ARG N A 26 ARG CA A 26 ARG C A 27 LEU N 1.0 -85.0 195.0 PSI 118 118 A 26 ARG N A 26 ARG CA A 26 ARG C A 27 LEU N 1.0 -56.6 -30.8 PSI 119 119 A 26 ARG C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -185.0 -45.0 PHI 120 120 A 26 ARG C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -75.0 195.0 PHI 121 121 A 26 ARG C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -82.2 -49.8 PHI 122 122 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 MET N 1.0 -335.0 -5.0 PSI 123 123 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 MET N 1.0 -85.0 205.0 PSI 124 124 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 MET N 1.0 -51.9 -28.5 PSI 125 125 A 27 LEU C A 28 MET N A 28 MET CA A 28 MET C 1.0 -185.0 -45.0 PHI 126 126 A 27 LEU C A 28 MET N A 28 MET CA A 28 MET C 1.0 -75.0 195.0 PHI 127 127 A 27 LEU C A 28 MET N A 28 MET CA A 28 MET C 1.0 -81.2 -46.9 PHI 128 128 A 28 MET N A 28 MET CA A 28 MET C A 29 ASP N 1.0 -335.0 -5.0 PSI 129 129 A 28 MET N A 28 MET CA A 28 MET C A 29 ASP N 1.0 -85.0 195.0 PSI 130 130 A 28 MET N A 28 MET CA A 28 MET C A 29 ASP N 1.0 -55.9 -22.1 PSI 131 131 A 28 MET C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -185.0 -45.0 PHI 132 132 A 28 MET C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -75.0 195.0 PHI 133 133 A 28 MET C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -73.8 -53.8 PHI 134 134 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 LEU N 1.0 -335.0 -5.0 PSI 135 135 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 LEU N 1.0 -85.0 205.0 PSI 136 136 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 LEU N 1.0 -45.8 -7.8 PSI 137 137 A 29 ASP C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 45.0 295.0 PHI 138 138 A 29 ASP C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -175.0 75.0 PHI 139 139 A 29 ASP C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -105.0 225.0 PHI 140 140 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 GLY N 1.0 -85.0 205.0 PSI 141 141 A 30 LEU C A 31 GLY N A 31 GLY CA A 31 GLY C 1.0 -315.0 -45.0 PHI 142 142 A 30 LEU C A 31 GLY N A 31 GLY CA A 31 GLY C 1.0 -215.0 105.0 PHI 143 143 A 30 LEU C A 31 GLY N A 31 GLY CA A 31 GLY C 1.0 -175.0 175.0 PHI 144 144 A 30 LEU C A 31 GLY N A 31 GLY CA A 31 GLY C 1.0 -105.0 215.0 PHI 145 145 A 30 LEU C A 31 GLY N A 31 GLY CA A 31 GLY C 1.0 -75.0 275.0 PHI 146 146 A 31 GLY C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 45.0 295.0 PHI 147 147 A 31 GLY C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -175.0 75.0 PHI 148 148 A 31 GLY C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -105.0 225.0 PHI 149 149 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 VAL N 1.0 -85.0 205.0 PSI 150 150 A 32 LEU C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 45.0 285.0 PHI 151 151 A 32 LEU C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -165.0 75.0 PHI 152 152 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 ARG N 1.0 -85.0 195.0 PSI 153 153 A 33 VAL C A 34 ARG N A 34 ARG CA A 34 ARG C 1.0 -315.0 -45.0 PHI 154 154 A 33 VAL C A 34 ARG N A 34 ARG CA A 34 ARG C 1.0 -185.0 75.0 PHI 155 155 A 34 ARG N A 34 ARG CA A 34 ARG C A 35 GLY N 1.0 -85.0 205.0 PSI 156 156 A 34 ARG C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 -315.0 -45.0 PHI 157 157 A 34 ARG C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 -205.0 115.0 PHI 158 158 A 34 ARG C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 -175.0 175.0 PHI 159 159 A 34 ARG C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 -115.0 205.0 PHI 160 160 A 34 ARG C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 84.7 105.7 PHI 161 161 A 35 GLY C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -185.0 -45.0 PHI 162 162 A 35 GLY C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -75.0 195.0 PHI 163 163 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 LYS N 1.0 -335.0 -5.0 PSI 164 164 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 LYS N 1.0 -85.0 205.0 PSI 165 165 A 36 ALA C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 45.0 295.0 PHI 166 166 A 36 ALA C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -175.0 75.0 PHI 167 167 A 36 ALA C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -143.1 -62.0 PHI 168 168 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 LEU N 1.0 -85.0 205.0 PSI 169 169 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 LEU N 1.0 99.6 169.3 PSI 170 170 A 37 LYS C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 45.0 285.0 PHI 171 171 A 37 LYS C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -165.0 75.0 PHI 172 172 A 37 LYS C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -142.7 -103.7 PHI 173 173 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 LYS N 1.0 -85.0 205.0 PSI 174 174 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 LYS N 1.0 123.1 170.7 PSI 175 175 A 38 LEU C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -315.0 -45.0 PHI 176 176 A 38 LEU C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -185.0 75.0 PHI 177 177 A 38 LEU C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -163.3 -103.5 PHI 178 178 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 VAL N 1.0 -85.0 205.0 PSI 179 179 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 VAL N 1.0 98.0 161.5 PSI 180 180 A 39 LYS C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 45.0 305.0 PHI 181 181 A 39 LYS C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -185.0 75.0 PHI 182 182 A 39 LYS C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -95.0 215.0 PHI 183 183 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 LEU N 1.0 -85.0 195.0 PSI 184 184 A 40 VAL C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 45.0 295.0 PHI 185 185 A 40 VAL C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -175.0 75.0 PHI 186 186 A 40 VAL C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -115.0 235.0 PHI 187 187 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 ARG N 1.0 -85.0 205.0 PSI 188 188 A 41 LEU C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -315.0 -45.0 PHI 189 189 A 41 LEU C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -185.0 75.0 PHI 190 190 A 41 LEU C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -85.0 215.0 PHI 191 191 A 42 ARG N A 42 ARG CA A 42 ARG C A 43 PHE N 1.0 -85.0 195.0 PSI 192 192 A 42 ARG C A 43 PHE N A 43 PHE CA A 43 PHE C 1.0 45.0 295.0 PHI 193 193 A 42 ARG C A 43 PHE N A 43 PHE CA A 43 PHE C 1.0 -165.0 75.0 PHI 194 194 A 43 PHE N A 43 PHE CA A 43 PHE C A 44 ALA N 1.0 -85.0 195.0 PSI 195 195 A 43 PHE C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -185.0 -45.0 PHI 196 196 A 43 PHE C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -85.0 205.0 PHI 197 197 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 PRO N 1.0 55.0 165.0 PSI 198 198 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 PRO N 1.0 -215.0 85.0 PSI 199 199 A 45 PRO N A 45 PRO CA A 45 PRO C A 46 LEU N 1.0 -295.0 5.0 PSI 200 200 A 45 PRO N A 45 PRO CA A 45 PRO C A 46 LEU N 1.0 -55.0 195.0 PSI 201 201 A 45 PRO C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 45.0 305.0 PHI 202 202 A 45 PRO C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 -175.0 75.0 PHI 203 203 A 45 PRO C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 -95.0 225.0 PHI 204 204 A 46 LEU N A 46 LEU CA A 46 LEU C A 47 GLY N 1.0 -85.0 205.0 PSI 205 205 A 46 LEU C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 -315.0 -45.0 PHI 206 206 A 46 LEU C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 -205.0 95.0 PHI 207 207 A 46 LEU C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 -95.0 205.0 PHI 208 208 A 49 PRO N A 49 PRO CA A 49 PRO C A 50 ILE N 1.0 -255.0 -5.0 PSI 209 209 A 49 PRO N A 49 PRO CA A 49 PRO C A 50 ILE N 1.0 -55.0 195.0 PSI 210 210 A 49 PRO C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 45.0 285.0 PHI 211 211 A 49 PRO C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -165.0 75.0 PHI 212 212 A 49 PRO C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -158.5 -92.1 PHI 213 213 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 GLU N 1.0 -85.0 195.0 PSI 214 214 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 GLU N 1.0 105.2 168.9 PSI 215 215 A 50 ILE C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 45.0 295.0 PHI 216 216 A 50 ILE C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -165.0 75.0 PHI 217 217 A 50 ILE C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -143.7 -80.8 PHI 218 218 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 VAL N 1.0 -85.0 195.0 PSI 219 219 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 VAL N 1.0 101.8 169.7 PSI 220 220 A 51 GLU C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 45.0 285.0 PHI 221 221 A 51 GLU C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -165.0 75.0 PHI 222 222 A 51 GLU C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -155.3 -112.8 PHI 223 223 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 ASN N 1.0 -85.0 195.0 PSI 224 224 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 ASN N 1.0 129.2 180.4 PSI 225 225 A 52 VAL C A 53 ASN N A 53 ASN CA A 53 ASN C 1.0 45.0 285.0 PHI 226 226 A 52 VAL C A 53 ASN N A 53 ASN CA A 53 ASN C 1.0 -165.0 75.0 PHI 227 227 A 52 VAL C A 53 ASN N A 53 ASN CA A 53 ASN C 1.0 -146.1 -78.2 PHI 228 228 A 53 ASN N A 53 ASN CA A 53 ASN C A 54 CYS N 1.0 -85.0 205.0 PSI 229 229 A 53 ASN N A 53 ASN CA A 53 ASN C A 54 CYS N 1.0 102.0 149.9 PSI 230 230 A 53 ASN C A 54 CYS N A 54 CYS CA A 54 CYS C 1.0 45.0 295.0 PHI 231 231 A 53 ASN C A 54 CYS N A 54 CYS CA A 54 CYS C 1.0 -175.0 75.0 PHI 232 232 A 53 ASN C A 54 CYS N A 54 CYS CA A 54 CYS C 1.0 -139.8 -52.2 PHI 233 233 A 54 CYS N A 54 CYS CA A 54 CYS C A 55 ASN N 1.0 -85.0 195.0 PSI 234 234 A 54 CYS N A 54 CYS CA A 54 CYS C A 55 ASN N 1.0 86.0 159.2 PSI 235 235 A 54 CYS C A 55 ASN N A 55 ASN CA A 55 ASN C 1.0 -315.0 -45.0 PHI 236 236 A 54 CYS C A 55 ASN N A 55 ASN CA A 55 ASN C 1.0 -185.0 75.0 PHI 237 237 A 55 ASN N A 55 ASN CA A 55 ASN C A 56 GLY N 1.0 -85.0 205.0 PSI 238 238 A 55 ASN C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 -315.0 -45.0 PHI 239 239 A 55 ASN C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 -205.0 95.0 PHI 240 240 A 55 ASN C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 -95.0 205.0 PHI 241 241 A 56 GLY C A 57 MET N A 57 MET CA A 57 MET C 1.0 45.0 285.0 PHI 242 242 A 56 GLY C A 57 MET N A 57 MET CA A 57 MET C 1.0 -165.0 75.0 PHI 243 243 A 57 MET N A 57 MET CA A 57 MET C A 58 LEU N 1.0 -85.0 205.0 PSI 244 244 A 57 MET C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 45.0 305.0 PHI 245 245 A 57 MET C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -185.0 75.0 PHI 246 246 A 57 MET C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -95.0 215.0 PHI 247 247 A 57 MET C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -128.9 -50.8 PHI 248 248 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 LEU N 1.0 -85.0 205.0 PSI 249 249 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 LEU N 1.0 90.2 156.0 PSI 250 250 A 58 LEU C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 45.0 285.0 PHI 251 251 A 58 LEU C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 -165.0 75.0 PHI 252 252 A 58 LEU C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 -147.1 -58.8 PHI 253 253 A 59 LEU N A 59 LEU CA A 59 LEU C A 60 THR N 1.0 -85.0 205.0 PSI 254 254 A 59 LEU N A 59 LEU CA A 59 LEU C A 60 THR N 1.0 97.8 155.8 PSI 255 255 A 59 LEU C A 60 THR N A 60 THR CA A 60 THR C 1.0 45.0 285.0 PHI 256 256 A 59 LEU C A 60 THR N A 60 THR CA A 60 THR C 1.0 -165.0 75.0 PHI 257 257 A 59 LEU C A 60 THR N A 60 THR CA A 60 THR C 1.0 -137.7 -72.9 PHI 258 258 A 60 THR N A 60 THR CA A 60 THR C A 61 MET N 1.0 -85.0 195.0 PSI 259 259 A 60 THR N A 60 THR CA A 60 THR C A 61 MET N 1.0 120.9 142.2 PSI 260 260 A 60 THR C A 61 MET N A 61 MET CA A 61 MET C 1.0 -315.0 -45.0 PHI 261 261 A 60 THR C A 61 MET N A 61 MET CA A 61 MET C 1.0 -185.0 75.0 PHI 262 262 A 60 THR C A 61 MET N A 61 MET CA A 61 MET C 1.0 -163.9 -91.6 PHI 263 263 A 61 MET N A 61 MET CA A 61 MET C A 62 ARG N 1.0 -85.0 205.0 PSI 264 264 A 61 MET N A 61 MET CA A 61 MET C A 62 ARG N 1.0 119.5 187.3 PSI 265 265 A 61 MET C A 62 ARG N A 62 ARG CA A 62 ARG C 1.0 45.0 305.0 PHI 266 266 A 61 MET C A 62 ARG N A 62 ARG CA A 62 ARG C 1.0 -185.0 75.0 PHI 267 267 A 61 MET C A 62 ARG N A 62 ARG CA A 62 ARG C 1.0 -95.0 215.0 PHI 268 268 A 61 MET C A 62 ARG N A 62 ARG CA A 62 ARG C 1.0 -111.2 -51.0 PHI 269 269 A 62 ARG N A 62 ARG CA A 62 ARG C A 63 ARG N 1.0 -85.0 195.0 PSI 270 270 A 62 ARG N A 62 ARG CA A 62 ARG C A 63 ARG N 1.0 109.8 196.4 PSI 271 271 A 62 ARG C A 63 ARG N A 63 ARG CA A 63 ARG C 1.0 -185.0 -45.0 PHI 272 272 A 62 ARG C A 63 ARG N A 63 ARG CA A 63 ARG C 1.0 -65.0 185.0 PHI 273 273 A 62 ARG C A 63 ARG N A 63 ARG CA A 63 ARG C 1.0 -66.5 -46.5 PHI 274 274 A 63 ARG N A 63 ARG CA A 63 ARG C A 64 ASN N 1.0 -335.0 -15.0 PSI 275 275 A 63 ARG N A 63 ARG CA A 63 ARG C A 64 ASN N 1.0 -85.0 195.0 PSI 276 276 A 63 ARG N A 63 ARG CA A 63 ARG C A 64 ASN N 1.0 -49.1 -29.1 PSI 277 277 A 63 ARG C A 64 ASN N A 64 ASN CA A 64 ASN C 1.0 -185.0 -45.0 PHI 278 278 A 63 ARG C A 64 ASN N A 64 ASN CA A 64 ASN C 1.0 -75.0 195.0 PHI 279 279 A 63 ARG C A 64 ASN N A 64 ASN CA A 64 ASN C 1.0 -71.4 -48.5 PHI 280 280 A 64 ASN N A 64 ASN CA A 64 ASN C A 65 GLU N 1.0 -335.0 -5.0 PSI 281 281 A 64 ASN N A 64 ASN CA A 64 ASN C A 65 GLU N 1.0 -85.0 205.0 PSI 282 282 A 64 ASN N A 64 ASN CA A 64 ASN C A 65 GLU N 1.0 -49.5 -28.6 PSI 283 283 A 64 ASN C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 45.0 305.0 PHI 284 284 A 64 ASN C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -175.0 75.0 PHI 285 285 A 64 ASN C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -95.0 215.0 PHI 286 286 A 64 ASN C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -74.7 -53.4 PHI 287 287 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 ALA N 1.0 -85.0 195.0 PSI 288 288 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 ALA N 1.0 -53.5 -31.4 PSI 289 289 A 65 GLU C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -185.0 -45.0 PHI 290 290 A 65 GLU C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -75.0 195.0 PHI 291 291 A 65 GLU C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -80.5 -44.8 PHI 292 292 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 GLU N 1.0 -335.0 -5.0 PSI 293 293 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 GLU N 1.0 -85.0 205.0 PSI 294 294 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 GLU N 1.0 -53.3 -26.6 PSI 295 295 A 66 ALA C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -185.0 -45.0 PHI 296 296 A 66 ALA C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -65.0 195.0 PHI 297 297 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 GLY N 1.0 -335.0 -15.0 PSI 298 298 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 GLY N 1.0 -85.0 195.0 PSI 299 299 A 67 GLU C A 68 GLY N A 68 GLY CA A 68 GLY C 1.0 -315.0 -45.0 PHI 300 300 A 67 GLU C A 68 GLY N A 68 GLY CA A 68 GLY C 1.0 -215.0 65.0 PHI 301 301 A 67 GLU C A 68 GLY N A 68 GLY CA A 68 GLY C 1.0 -65.0 215.0 PHI 302 302 A 68 GLY N A 68 GLY CA A 68 GLY C A 69 ILE N 1.0 -355.0 -5.0 PSI 303 303 A 68 GLY C A 69 ILE N A 69 ILE CA A 69 ILE C 1.0 45.0 285.0 PHI 304 304 A 68 GLY C A 69 ILE N A 69 ILE CA A 69 ILE C 1.0 -165.0 75.0 PHI 305 305 A 68 GLY C A 69 ILE N A 69 ILE CA A 69 ILE C 1.0 -144.2 -73.7 PHI 306 306 A 69 ILE N A 69 ILE CA A 69 ILE C A 70 THR N 1.0 -85.0 195.0 PSI 307 307 A 69 ILE N A 69 ILE CA A 69 ILE C A 70 THR N 1.0 92.2 177.3 PSI 308 308 A 69 ILE C A 70 THR N A 70 THR CA A 70 THR C 1.0 45.0 295.0 PHI 309 309 A 69 ILE C A 70 THR N A 70 THR CA A 70 THR C 1.0 -165.0 75.0 PHI 310 310 A 70 THR N A 70 THR CA A 70 THR C A 71 VAL N 1.0 -85.0 195.0 PSI 311 311 A 70 THR C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -315.0 -45.0 PHI 312 312 A 70 THR C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -185.0 75.0 PHI 313 313 A 70 THR C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -161.3 -110.0 PHI 314 314 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 HIS N 1.0 -85.0 195.0 PSI 315 315 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 HIS N 1.0 155.9 180.1 PSI 316 316 A 71 VAL C A 72 HIS N A 72 HIS CA A 72 HIS C 1.0 45.0 285.0 PHI 317 317 A 71 VAL C A 72 HIS N A 72 HIS CA A 72 HIS C 1.0 -165.0 75.0 PHI 318 318 A 71 VAL C A 72 HIS N A 72 HIS CA A 72 HIS C 1.0 -157.1 -93.3 PHI 319 319 A 72 HIS N A 72 HIS CA A 72 HIS C A 73 ILE N 1.0 -85.0 195.0 PSI 320 320 A 72 HIS N A 72 HIS CA A 72 HIS C A 73 ILE N 1.0 107.3 153.3 PSI 321 321 A 72 HIS C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -315.0 -45.0 PHI 322 322 A 72 HIS C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -185.0 65.0 PHI 323 323 A 72 HIS C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -85.0 205.0 PHI 324 324 A 72 HIS C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -146.6 -53.0 PHI 325 325 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 LEU N 1.0 -345.0 5.0 PSI 326 326 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 LEU N 1.0 -85.0 195.0 PSI 327 327 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 LEU N 1.0 104.6 149.8 PSI 328 328 A 73 ILE C A 74 LEU N A 74 LEU CA A 74 LEU C 1.0 45.0 285.0 PHI 329 329 A 73 ILE C A 74 LEU N A 74 LEU CA A 74 LEU C 1.0 -165.0 75.0 PHI 330 330 A 74 LEU N A 74 LEU CA A 74 LEU C A 75 ALA N 1.0 -85.0 205.0 PSI 331 331 A 74 LEU C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -315.0 -45.0 PHI 332 332 A 74 LEU C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -185.0 75.0 PHI 333 333 A 75 ALA N A 75 ALA CA A 75 ALA C A 76 GLY N 1.0 -85.0 205.0 PSI 334 334 A 75 ALA C A 76 GLY N A 76 GLY CA A 76 GLY C 1.0 -315.0 -45.0 PHI 335 335 A 76 GLY C A 77 ASP N A 77 ASP CA A 77 ASP C 1.0 -315.0 -45.0 PHI 336 336 A 76 GLY C A 77 ASP N A 77 ASP CA A 77 ASP C 1.0 -185.0 75.0 PHI 337 337 A 77 ASP N A 77 ASP CA A 77 ASP C A 78 GLU N 1.0 -85.0 205.0 PSI 338 338 A 77 ASP C A 78 GLU N A 78 GLU CA A 78 GLU C 1.0 -315.0 -45.0 PHI 339 339 A 77 ASP C A 78 GLU N A 78 GLU CA A 78 GLU C 1.0 -185.0 75.0 PHI 340 340 A 78 GLU N A 78 GLU CA A 78 GLU C A 79 GLY N 1.0 -85.0 205.0 PSI 341 341 A 78 GLU C A 79 GLY N A 79 GLY CA A 79 GLY C 1.0 -315.0 -45.0 PHI 342 342 A 79 GLY C A 80 HIS N A 80 HIS CA A 80 HIS C 1.0 -315.0 -45.0 PHI 343 343 A 79 GLY C A 80 HIS N A 80 HIS CA A 80 HIS C 1.0 -185.0 75.0 PHI 344 344 A 80 HIS N A 80 HIS CA A 80 HIS C A 81 PRO N 1.0 55.0 165.0 PSI 345 345 A 80 HIS N A 80 HIS CA A 80 HIS C A 81 PRO N 1.0 -215.0 85.0 PSI 346 346 A 81 PRO N A 81 PRO CA A 81 PRO C A 82 HIS N 1.0 -295.0 5.0 PSI 347 347 A 81 PRO N A 81 PRO CA A 81 PRO C A 82 HIS N 1.0 -55.0 195.0 PSI 348 348 A 81 PRO C A 82 HIS N A 82 HIS CA A 82 HIS C 1.0 -315.0 -45.0 PHI 349 349 A 81 PRO C A 82 HIS N A 82 HIS CA A 82 HIS C 1.0 -185.0 75.0 PHI 350 350 A 82 HIS N A 82 HIS CA A 82 HIS C A 83 GLY N 1.0 -85.0 195.0 PSI 351 351 A 82 HIS C A 83 GLY N A 83 GLY CA A 83 GLY C 1.0 -315.0 -45.0 PHI 352 352 A 83 GLY C A 84 TRP N A 84 TRP CA A 84 TRP C 1.0 -315.0 -45.0 PHI 353 353 A 83 GLY C A 84 TRP N A 84 TRP CA A 84 TRP C 1.0 -185.0 75.0 PHI 354 354 A 84 TRP N A 84 TRP CA A 84 TRP C A 85 PRO N 1.0 55.0 165.0 PSI 355 355 A 84 TRP N A 84 TRP CA A 84 TRP C A 85 PRO N 1.0 -215.0 85.0 PSI 356 356 A 85 PRO N A 85 PRO CA A 85 PRO C A 86 GLY N 1.0 -295.0 5.0 PSI 357 357 A 85 PRO N A 85 PRO CA A 85 PRO C A 86 GLY N 1.0 -55.0 195.0 PSI 358 358 A 85 PRO C A 86 GLY N A 86 GLY CA A 86 GLY C 1.0 -315.0 -45.0 PHI 359 359 A 86 GLY C A 87 PHE N A 87 PHE CA A 87 PHE C 1.0 -315.0 -45.0 PHI 360 360 A 86 GLY C A 87 PHE N A 87 PHE CA A 87 PHE C 1.0 -185.0 75.0 PHI 361 361 A 87 PHE N A 87 PHE CA A 87 PHE C A 88 ARG N 1.0 -85.0 195.0 PSI 362 362 A 87 PHE C A 88 ARG N A 88 ARG CA A 88 ARG C 1.0 -315.0 -45.0 PHI 363 363 A 87 PHE C A 88 ARG N A 88 ARG CA A 88 ARG C 1.0 -185.0 75.0 PHI 364 364 A 88 ARG N A 88 ARG CA A 88 ARG C A 89 ARG N 1.0 -85.0 195.0 PSI 365 365 A 88 ARG C A 89 ARG N A 89 ARG CA A 89 ARG C 1.0 -315.0 -45.0 PHI 366 366 A 88 ARG C A 89 ARG N A 89 ARG CA A 89 ARG C 1.0 -185.0 75.0 PHI 367 367 A 89 ARG N A 89 ARG CA A 89 ARG C A 90 ARG N 1.0 -85.0 195.0 PSI 368 368 A 89 ARG C A 90 ARG N A 90 ARG CA A 90 ARG C 1.0 -315.0 -45.0 PHI 369 369 A 89 ARG C A 90 ARG N A 90 ARG CA A 90 ARG C 1.0 -185.0 75.0 PHI 370 370 A 90 ARG N A 90 ARG CA A 90 ARG C A 91 HIS N 1.0 -85.0 195.0 PSI 371 371 A 90 ARG C A 91 HIS N A 91 HIS CA A 91 HIS C 1.0 -315.0 -45.0 PHI 372 372 A 90 ARG C A 91 HIS N A 91 HIS CA A 91 HIS C 1.0 -185.0 75.0 PHI 373 373 A 91 HIS N A 91 HIS CA A 91 HIS C A 92 ARG N 1.0 -85.0 195.0 PSI 374 374 A 91 HIS C A 92 ARG N A 92 ARG CA A 92 ARG C 1.0 -315.0 -45.0 PHI 375 375 A 91 HIS C A 92 ARG N A 92 ARG CA A 92 ARG C 1.0 -185.0 75.0 PHI 376 376 A 92 ARG N A 92 ARG CA A 92 ARG C A 93 PHE N 1.0 -85.0 195.0 PSI 377 377 A 92 ARG C A 93 PHE N A 93 PHE CA A 93 PHE C 1.0 -315.0 -45.0 PHI 378 378 A 92 ARG C A 93 PHE N A 93 PHE CA A 93 PHE C 1.0 -185.0 75.0 PHI 379 379 A 93 PHE N A 93 PHE CA A 93 PHE C A 94 GLY N 1.0 -85.0 195.0 PSI 380 380 A 93 PHE C A 94 GLY N A 94 GLY CA A 94 GLY C 1.0 -315.0 -45.0 PHI 381 381 A 94 GLY C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -315.0 -45.0 PHI 382 382 A 94 GLY C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -185.0 75.0 PHI 383 383 A 95 LYS N A 95 LYS CA A 95 LYS C A 96 ARG N 1.0 -85.0 205.0 PSI 384 384 A 95 LYS C A 96 ARG N A 96 ARG CA A 96 ARG C 1.0 -315.0 -45.0 PHI 385 385 A 95 LYS C A 96 ARG N A 96 ARG CA A 96 ARG C 1.0 -185.0 75.0 PHI 386 386 A 96 ARG N A 96 ARG CA A 96 ARG C A 97 ALA N 1.0 -85.0 195.0 PSI 387 387 A 96 ARG C A 97 ALA N A 97 ALA CA A 97 ALA C 1.0 -315.0 -45.0 PHI 388 388 A 96 ARG C A 97 ALA N A 97 ALA CA A 97 ALA C 1.0 -185.0 75.0 PHI 389 389 A 97 ALA N A 97 ALA CA A 97 ALA C A 98 LEU N 1.0 -85.0 205.0 PSI 390 390 A 97 ALA C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -315.0 -45.0 PHI 391 391 A 97 ALA C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -185.0 75.0 PHI 392 392 A 98 LEU N A 98 LEU CA A 98 LEU C A 99 GLU N 1.0 -85.0 205.0 PSI 393 393 A 98 LEU C A 99 GLU N A 99 GLU CA A 99 GLU C 1.0 -315.0 -45.0 PHI 394 394 A 98 LEU C A 99 GLU N A 99 GLU CA A 99 GLU C 1.0 -185.0 75.0 PHI 395 395 A 99 GLU N A 99 GLU CA A 99 GLU C A 100 HIS N 1.0 -85.0 195.0 PSI 396 396 A 99 GLU C A 100 HIS N A 100 HIS CA A 100 HIS C 1.0 -315.0 -45.0 PHI 397 397 A 99 GLU C A 100 HIS N A 100 HIS CA A 100 HIS C 1.0 -185.0 75.0 PHI 398 398 A 100 HIS N A 100 HIS CA A 100 HIS C A 101 HIS N 1.0 -85.0 195.0 PSI 399 399 A 100 HIS C A 101 HIS N A 101 HIS CA A 101 HIS C 1.0 -315.0 -45.0 PHI 400 400 A 100 HIS C A 101 HIS N A 101 HIS CA A 101 HIS C 1.0 -185.0 75.0 PHI 401 401 A 101 HIS N A 101 HIS CA A 101 HIS C A 102 HIS N 1.0 -85.0 195.0 PSI 402 402 A 101 HIS C A 102 HIS N A 102 HIS CA A 102 HIS C 1.0 -315.0 -45.0 PHI 403 403 A 101 HIS C A 102 HIS N A 102 HIS CA A 102 HIS C 1.0 -185.0 75.0 PHI 404 404 A 102 HIS N A 102 HIS CA A 102 HIS C A 103 HIS N 1.0 -85.0 195.0 PSI 405 405 A 102 HIS C A 103 HIS N A 103 HIS CA A 103 HIS C 1.0 -315.0 -45.0 PHI 406 406 A 102 HIS C A 103 HIS N A 103 HIS CA A 103 HIS C 1.0 -185.0 75.0 PHI 407 407 A 103 HIS N A 103 HIS CA A 103 HIS C A 104 HIS N 1.0 -85.0 195.0 PSI 408 408 A 103 HIS C A 104 HIS N A 104 HIS CA A 104 HIS C 1.0 -315.0 -45.0 PHI 409 409 A 103 HIS C A 104 HIS N A 104 HIS CA A 104 HIS C 1.0 -185.0 75.0 PHI 410 410 A 104 HIS N A 104 HIS CA A 104 HIS C A 105 HIS N 1.0 -85.0 195.0 PSI 411 411 A 104 HIS C A 105 HIS N A 105 HIS CA A 105 HIS C 1.0 -315.0 -45.0 PHI 412 412 A 104 HIS C A 105 HIS N A 105 HIS CA A 105 HIS C 1.0 -185.0 75.0 PHI 413 413 A 35 GLY N A 35 GLY CA A 35 GLY C A 36 ALA N 1.0 -30.0 0.0 PSI stop_ save_