data_nef_c27396_6ccj save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . 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 SER start . . 2 A 2 GLU middle . . 3 A 3 ALA middle . . 4 A 4 VAL middle . . 5 A 5 ILE middle . . 6 A 6 LYS middle . . 7 A 7 VAL middle . . 8 A 8 ILE middle . . 9 A 9 SER middle . . 10 A 10 SER middle . . 11 A 11 ALA middle . . 12 A 12 CYS middle . . 13 A 13 LYS middle . . 14 A 14 THR middle . . 15 A 15 TYR middle . . 16 A 16 CYS middle . . 17 A 17 GLY middle . false 18 A 18 LYS middle . . 19 A 19 THR middle . . 20 A 20 SER middle . . 21 A 21 PRO middle . false 22 A 22 SER middle . . 23 A 23 LYS middle . . 24 A 24 LYS middle . . 25 A 25 GLU middle . . 26 A 26 ILE middle . . 27 A 27 GLY middle . false 28 A 28 ALA middle . . 29 A 29 MET middle . . 30 A 30 LEU middle . . 31 A 31 SER middle . . 32 A 32 LEU middle . . 33 A 33 LEU middle . . 34 A 34 GLN middle . . 35 A 35 LYS middle . . 36 A 36 GLU middle . . 37 A 37 GLY middle . false 38 A 38 LEU middle . . 39 A 39 LEU middle . . 40 A 40 MET middle . . 41 A 41 SER middle . . 42 A 42 PRO middle . false 43 A 43 SER middle . . 44 A 44 ASP middle . . 45 A 45 LEU middle . . 46 A 46 TYR middle . . 47 A 47 SER middle . . 48 A 48 PRO middle . false 49 A 49 GLY middle . false 50 A 50 SER middle . . 51 A 51 TRP middle . . 52 A 52 ASP middle . . 53 A 53 PRO middle . false 54 A 54 ILE middle . . 55 A 55 THR middle . . 56 A 56 ALA middle . . 57 A 57 ALA middle . . 58 A 58 LEU middle . . 59 A 59 SER middle . . 60 A 60 GLN middle . . 61 A 61 ARG middle . . 62 A 62 ALA middle . . 63 A 63 MET middle . . 64 A 64 ILE middle . . 65 A 65 LEU middle . . 66 A 66 GLY middle . false 67 A 67 LYS middle . . 68 A 68 SER middle . . 69 A 69 GLY middle . false 70 A 70 GLU middle . . 71 A 71 LEU middle . . 72 A 72 LYS middle . . 73 A 73 THR middle . . 74 A 74 TRP middle . . 75 A 75 GLY middle . false 76 A 76 LEU middle . . 77 A 77 VAL middle . . 78 A 78 LEU middle . . 79 A 79 GLY middle . false 80 A 80 ALA middle . . 81 A 81 LEU middle . . 82 A 82 LYS middle . . 83 A 83 ALA middle . . 84 A 84 ALA middle . . 85 A 85 ARG middle . . 86 A 86 GLU middle . . 87 A 87 GLU end . . stop_ save_ save_assigned_chem_shift_list _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list 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 SER H1 H 1 9.236 . A 1 SER HA H 1 3.885 0.006 A 1 SER HBx H 1 3.79 0.005 A 1 SER HBy H 1 4.022 0.005 A 1 SER CA C 13 57.398 0.058 A 1 SER CB C 13 65.651 0.033 A 1 SER N N 15 123.789 . A 2 GLU H H 1 9.237 . A 2 GLU HA H 1 4.142 0.002 A 2 GLU HB2 H 1 2.064 0.001 A 2 GLU HB3 H 1 2.064 0.001 A 2 GLU HG2 H 1 2.352 0.004 A 2 GLU HG3 H 1 2.352 0.004 A 2 GLU C C 13 177.787 . A 2 GLU CA C 13 58.606 0.063 A 2 GLU CB C 13 29.762 0.019 A 2 GLU CG C 13 36.286 0.043 A 2 GLU N N 15 124.039 . A 3 ALA H H 1 8.473 0.004 A 3 ALA HA H 1 4.145 0.007 A 3 ALA HB% H 1 1.462 0.002 A 3 ALA C C 13 179.794 . A 3 ALA CA C 13 54.951 0.033 A 3 ALA CB C 13 18.617 0.045 A 3 ALA N N 15 122.469 0.019 A 4 VAL H H 1 7.705 0.006 A 4 VAL HA H 1 3.994 0.005 A 4 VAL HB H 1 1.97 0.002 A 4 VAL HGx% H 1 0.838 0.002 A 4 VAL HGy% H 1 0.929 0.003 A 4 VAL C C 13 177.983 . A 4 VAL CA C 13 65.310 0.037 A 4 VAL CB C 13 31.861 0.033 A 4 VAL CGx C 13 21.100 0.022 A 4 VAL CGy C 13 22.217 0.018 A 4 VAL N N 15 118.818 0.03 A 5 ILE H H 1 8.192 0.006 A 5 ILE HA H 1 3.498 0.005 A 5 ILE HB H 1 1.919 0.006 A 5 ILE HD1% H 1 0.888 0.001 A 5 ILE HG1x H 1 0.884 0.001 A 5 ILE HG1y H 1 1.728 0.003 A 5 ILE HG2% H 1 0.917 0.003 A 5 ILE C C 13 178.040 . A 5 ILE CA C 13 66.042 0.038 A 5 ILE CB C 13 37.658 0.037 A 5 ILE CD1 C 13 13.473 0.027 A 5 ILE CG1 C 13 30.379 0.027 A 5 ILE CG2 C 13 17.388 0.02 A 5 ILE N N 15 119.525 0.043 A 6 LYS H H 1 8.013 0.006 A 6 LYS HA H 1 3.991 0.003 A 6 LYS HBx H 1 1.997 0.006 A 6 LYS HBy H 1 1.997 0.006 A 6 LYS HD2 H 1 1.722 0.009 A 6 LYS HD3 H 1 1.722 0.009 A 6 LYS HE2 H 1 2.98 0.002 A 6 LYS HE3 H 1 2.98 0.002 A 6 LYS HGy H 1 1.597 0.003 A 6 LYS HGx H 1 1.439 0.01 A 6 LYS C C 13 179.086 . A 6 LYS CA C 13 60.288 0.092 A 6 LYS CB C 13 32.320 0.08 A 6 LYS CD C 13 29.389 0.048 A 6 LYS CE C 13 42.121 0.034 A 6 LYS CG C 13 25.454 0.057 A 6 LYS N N 15 120.545 0.046 A 7 VAL H H 1 7.665 0.001 A 7 VAL HA H 1 3.753 0.006 A 7 VAL HB H 1 2.438 0.002 A 7 VAL HGx% H 1 0.936 0.002 A 7 VAL HGy% H 1 1.113 0.003 A 7 VAL C C 13 179.519 . A 7 VAL CA C 13 66.726 0.022 A 7 VAL CB C 13 31.924 0.042 A 7 VAL CGx C 13 21.285 0.018 A 7 VAL CGy C 13 22.747 0.027 A 7 VAL N N 15 121.407 0.03 A 8 ILE H H 1 8.632 0.001 A 8 ILE HA H 1 3.714 0.006 A 8 ILE HB H 1 1.935 0.004 A 8 ILE HD1% H 1 0.775 0.006 A 8 ILE HG1x H 1 1.18 0.002 A 8 ILE HG1y H 1 1.954 0.004 A 8 ILE HG2% H 1 0.937 0.007 A 8 ILE C C 13 178.208 . A 8 ILE CA C 13 65.313 0.039 A 8 ILE CB C 13 37.875 0.025 A 8 ILE CD1 C 13 13.814 0.032 A 8 ILE CG1 C 13 28.944 0.029 A 8 ILE CG2 C 13 19.823 0.024 A 8 ILE N N 15 119.958 0.044 A 9 SER H H 1 8.994 0.003 A 9 SER HA H 1 3.958 . A 9 SER HB2 H 1 3.954 . A 9 SER HB3 H 1 3.954 . A 9 SER C C 13 176.965 . A 9 SER CA C 13 62.658 0.016 A 9 SER CB C 13 62.935 0.015 A 9 SER N N 15 115.592 0.041 A 10 SER H H 1 8.138 0.004 A 10 SER HA H 1 4.237 0.004 A 10 SER HBx H 1 3.955 0.0 A 10 SER HBy H 1 4.063 0.005 A 10 SER C C 13 176.606 . A 10 SER CA C 13 62.084 0.033 A 10 SER CB C 13 62.828 0.033 A 10 SER N N 15 116.689 0.025 A 11 ALA H H 1 8.06 0.006 A 11 ALA HA H 1 4.332 0.002 A 11 ALA HB% H 1 1.554 0.001 A 11 ALA C C 13 180.543 . A 11 ALA CA C 13 55.338 0.015 A 11 ALA CB C 13 16.975 0.047 A 11 ALA N N 15 124.834 0.027 A 12 CYS H H 1 8.712 0.003 A 12 CYS HA H 1 4.229 0.006 A 12 CYS HBx H 1 3 0.005 A 12 CYS HBy H 1 3.09 0.002 A 12 CYS C C 13 176.845 . A 12 CYS CA C 13 64.079 0.032 A 12 CYS CB C 13 27.479 0.056 A 12 CYS N N 15 116.484 0.04 A 13 LYS H H 1 8.43 0.002 A 13 LYS HA H 1 3.987 0.003 A 13 LYS HB2 H 1 1.957 0.0 A 13 LYS HB3 H 1 1.957 0.0 A 13 LYS HD2 H 1 1.666 0.001 A 13 LYS HD3 H 1 1.666 0.001 A 13 LYS HEx H 1 2.958 0.004 A 13 LYS HEy H 1 2.958 0.004 A 13 LYS HGx H 1 1.434 0.007 A 13 LYS HGy H 1 1.565 0.005 A 13 LYS C C 13 179.205 . A 13 LYS CA C 13 60.034 0.041 A 13 LYS CB C 13 31.871 0.034 A 13 LYS CD C 13 29.210 0.025 A 13 LYS CE C 13 42.165 0.013 A 13 LYS CG C 13 25.074 0.044 A 13 LYS N N 15 121.869 0.058 A 14 THR H H 1 7.693 0.005 A 14 THR HA H 1 3.829 0.004 A 14 THR HB H 1 3.948 0.006 A 14 THR HG2% H 1 0.713 0.005 A 14 THR C C 13 175.562 . A 14 THR CA C 13 66.084 0.042 A 14 THR CB C 13 69.174 0.036 A 14 THR CG2 C 13 21.312 0.051 A 14 THR N N 15 114.344 0.039 A 15 TYR H H 1 7.988 0.003 A 15 TYR HA H 1 4.57 0.003 A 15 TYR HBx H 1 2.894 0.005 A 15 TYR HBy H 1 3.11 0.005 A 15 TYR HD1 H 1 7.236 0.002 A 15 TYR HD2 H 1 7.236 0.002 A 15 TYR HE1 H 1 6.756 0.001 A 15 TYR HE2 H 1 6.756 0.001 A 15 TYR C C 13 177.136 . A 15 TYR CA C 13 60.742 0.048 A 15 TYR CB C 13 39.997 0.053 A 15 TYR CD1 C 13 133.522 0.044 A 15 TYR CD2 C 13 133.522 0.044 A 15 TYR CE1 C 13 117.974 0.017 A 15 TYR CE2 C 13 117.974 0.017 A 15 TYR CG C 13 130.026 0.029 A 15 TYR N N 15 117.792 0.038 A 16 CYS H H 1 8.928 0.001 A 16 CYS HA H 1 4.368 0.003 A 16 CYS HBx H 1 2.866 0.003 A 16 CYS HBy H 1 3.11 0.004 A 16 CYS C C 13 176.223 . A 16 CYS CA C 13 59.194 0.036 A 16 CYS CB C 13 27.964 0.064 A 16 CYS N N 15 116.189 0.033 A 17 GLY H H 1 7.776 0.003 A 17 GLY HAx H 1 3.849 0.003 A 17 GLY HAy H 1 3.976 0.005 A 17 GLY C C 13 176.374 . A 17 GLY CA C 13 46.728 0.038 A 17 GLY N N 15 108.987 0.03 A 18 LYS H H 1 8.939 0.002 A 18 LYS HA H 1 4.186 0.002 A 18 LYS HBx H 1 1.888 0.006 A 18 LYS HBy H 1 1.888 0.005 A 18 LYS HD2 H 1 1.702 . A 18 LYS HD3 H 1 1.702 . A 18 LYS HE2 H 1 3.003 . A 18 LYS HE3 H 1 3.003 . A 18 LYS HG2 H 1 1.51 0.002 A 18 LYS HG3 H 1 1.51 0.002 A 18 LYS C C 13 177.298 . A 18 LYS CA C 13 58.327 0.053 A 18 LYS CB C 13 32.390 0.074 A 18 LYS CD C 13 29.150 0.072 A 18 LYS CE C 13 42.079 . A 18 LYS CG C 13 24.936 0.036 A 18 LYS N N 15 125.854 0.049 A 19 THR H H 1 7.605 0.001 A 19 THR HA H 1 4.38 0.003 A 19 THR HB H 1 4.381 0.004 A 19 THR HG2% H 1 1.193 0.002 A 19 THR C C 13 173.466 . A 19 THR CA C 13 61.069 0.062 A 19 THR CB C 13 68.921 0.037 A 19 THR CG2 C 13 22.150 0.033 A 19 THR N N 15 109.831 0.027 A 20 SER H H 1 7.491 0.001 A 20 SER HA H 1 4.248 0.006 A 20 SER HB2 H 1 3.744 0.005 A 20 SER HB3 H 1 3.744 0.005 A 20 SER C C 13 173.137 . A 20 SER CA C 13 57.032 0.013 A 20 SER CB C 13 64.150 0.052 A 20 SER N N 15 115.755 0.021 A 21 PRO HA H 1 4.74 0.002 A 21 PRO HBx H 1 1.879 0.001 A 21 PRO HBy H 1 2.44 0.002 A 21 PRO HDy H 1 3.927 0.002 A 21 PRO HDx H 1 3.709 0.001 A 21 PRO HGx H 1 1.985 0.002 A 21 PRO HGy H 1 2.077 0.002 A 21 PRO C C 13 175.916 . A 21 PRO CA C 13 62.539 0.03 A 21 PRO CB C 13 32.755 0.028 A 21 PRO CD C 13 51.298 0.048 A 21 PRO CG C 13 27.804 0.034 A 22 SER H H 1 8.915 0.008 A 22 SER HA H 1 4.55 0.005 A 22 SER HBx H 1 4.057 0.003 A 22 SER HBy H 1 4.428 0.006 A 22 SER C C 13 175.372 . A 22 SER CA C 13 56.944 0.026 A 22 SER CB C 13 65.767 0.057 A 22 SER N N 15 118.417 0.043 A 23 LYS H H 1 9.11 0.003 A 23 LYS HA H 1 3.836 0.002 A 23 LYS HBx H 1 1.818 0.004 A 23 LYS HBy H 1 1.905 0.005 A 23 LYS HD2 H 1 1.739 0.002 A 23 LYS HD3 H 1 1.739 0.002 A 23 LYS HE2 H 1 2.972 . A 23 LYS HE3 H 1 2.972 . A 23 LYS HGx H 1 1.319 0.002 A 23 LYS HGy H 1 1.678 0.005 A 23 LYS C C 13 179.744 . A 23 LYS CA C 13 61.223 0.032 A 23 LYS CB C 13 31.947 0.043 A 23 LYS CD C 13 29.503 0.029 A 23 LYS CE C 13 41.896 0.017 A 23 LYS CG C 13 26.221 0.043 A 23 LYS N N 15 121.499 0.042 A 24 LYS H H 1 8.313 0.005 A 24 LYS HA H 1 4.063 0.002 A 24 LYS HBx H 1 1.772 0.002 A 24 LYS HBy H 1 1.874 0.002 A 24 LYS HD2 H 1 1.695 . A 24 LYS HD3 H 1 1.695 . A 24 LYS HE2 H 1 2.983 . A 24 LYS HE3 H 1 2.983 . A 24 LYS HGx H 1 1.404 0.006 A 24 LYS HGy H 1 1.52 0.004 A 24 LYS C C 13 179.560 . A 24 LYS CA C 13 59.605 0.035 A 24 LYS CB C 13 32.481 0.034 A 24 LYS CD C 13 29.318 0.052 A 24 LYS CE C 13 42.125 0.031 A 24 LYS CG C 13 25.038 0.015 A 24 LYS N N 15 120.193 0.034 A 25 GLU H H 1 7.874 0.002 A 25 GLU HA H 1 4.056 0.004 A 25 GLU HBx H 1 2.109 0.006 A 25 GLU HBy H 1 2.403 0.004 A 25 GLU HG2 H 1 2.294 0.004 A 25 GLU HG3 H 1 2.294 0.004 A 25 GLU C C 13 180.736 . A 25 GLU CA C 13 59.431 0.05 A 25 GLU CB C 13 29.479 0.013 A 25 GLU CG C 13 37.545 0.038 A 25 GLU N N 15 121.206 0.035 A 26 ILE H H 1 8.667 0.003 A 26 ILE HA H 1 3.529 0.002 A 26 ILE HB H 1 1.869 0.002 A 26 ILE HD1% H 1 0.759 0.002 A 26 ILE HG1x H 1 0.614 0.005 A 26 ILE HG1y H 1 1.826 0.003 A 26 ILE HG2% H 1 0.897 0.002 A 26 ILE C C 13 178.002 . A 26 ILE CA C 13 66.293 0.045 A 26 ILE CB C 13 38.195 0.034 A 26 ILE CD1 C 13 13.645 0.033 A 26 ILE CG1 C 13 29.595 0.025 A 26 ILE CG2 C 13 18.520 0.04 A 26 ILE N N 15 122.142 0.037 A 27 GLY H H 1 8.788 0.005 A 27 GLY HAx H 1 3.729 0.005 A 27 GLY HAy H 1 4.046 0.002 A 27 GLY C C 13 176.271 . A 27 GLY CA C 13 47.581 0.033 A 27 GLY N N 15 107.345 0.015 A 28 ALA H H 1 8.313 0.004 A 28 ALA HA H 1 4.237 0.002 A 28 ALA HB% H 1 1.554 0.002 A 28 ALA C C 13 180.710 . A 28 ALA CA C 13 55.062 0.025 A 28 ALA CB C 13 18.169 0.046 A 28 ALA N N 15 125.006 0.049 A 29 MET H H 1 7.84 0.001 A 29 MET HA H 1 3.885 0.003 A 29 MET HBx H 1 2.341 0.006 A 29 MET HBy H 1 2.571 0.002 A 29 MET HE% H 1 2.133 0.006 A 29 MET HGx H 1 2.272 0.002 A 29 MET HGy H 1 2.675 0.002 A 29 MET C C 13 177.234 . A 29 MET CA C 13 59.539 0.054 A 29 MET CB C 13 32.815 0.041 A 29 MET CE C 13 16.854 0.015 A 29 MET CG C 13 30.970 0.026 A 29 MET N N 15 119.778 0.03 A 30 LEU H H 1 8.576 0.004 A 30 LEU HA H 1 3.874 0.002 A 30 LEU HBx H 1 1.603 0.002 A 30 LEU HBy H 1 1.858 0.002 A 30 LEU HDx% H 1 0.801 0.001 A 30 LEU HDy% H 1 0.831 0.001 A 30 LEU HG H 1 1.812 0.003 A 30 LEU C C 13 179.032 . A 30 LEU CA C 13 58.679 0.04 A 30 LEU CB C 13 41.871 0.024 A 30 LEU CDx C 13 24.165 0.035 A 30 LEU CDy C 13 25.946 0.046 A 30 LEU CG C 13 26.964 0.087 A 30 LEU N N 15 118.961 0.028 A 31 SER H H 1 8.403 0.002 A 31 SER HA H 1 4.242 0.003 A 31 SER HBx H 1 3.955 0.006 A 31 SER HBy H 1 3.985 0.002 A 31 SER C C 13 176.983 . A 31 SER CA C 13 61.884 0.042 A 31 SER CB C 13 62.850 0.051 A 31 SER N N 15 113.987 0.037 A 32 LEU H H 1 7.606 0.001 A 32 LEU HA H 1 4.183 0.006 A 32 LEU HBx H 1 1.771 0.002 A 32 LEU HBy H 1 1.927 0.003 A 32 LEU HDx% H 1 0.86 0.001 A 32 LEU HDy% H 1 0.737 0.002 A 32 LEU HG H 1 1.45 0.004 A 32 LEU C C 13 178.208 . A 32 LEU CA C 13 58.198 0.05 A 32 LEU CB C 13 41.458 0.03 A 32 LEU CDx C 13 23.941 0.02 A 32 LEU CDy C 13 25.775 0.06 A 32 LEU CG C 13 27.207 0.064 A 32 LEU N N 15 122.986 0.043 A 33 LEU H H 1 8.034 0.001 A 33 LEU HA H 1 3.781 0.003 A 33 LEU HBx H 1 1.168 0.001 A 33 LEU HBy H 1 1.951 . A 33 LEU HDx% H 1 0.59 0.005 A 33 LEU HDy% H 1 0.694 0.008 A 33 LEU HG H 1 2.07 0.002 A 33 LEU C C 13 179.394 . A 33 LEU CA C 13 57.968 0.036 A 33 LEU CB C 13 41.591 0.021 A 33 LEU CDx C 13 23.654 0.026 A 33 LEU CDy C 13 26.216 0.041 A 33 LEU CG C 13 26.372 0.035 A 33 LEU N N 15 116.465 0.042 A 34 GLN H H 1 8.111 0.003 A 34 GLN HA H 1 4.361 0.001 A 34 GLN HB2 H 1 2.185 0.0 A 34 GLN HB3 H 1 2.185 0.0 A 34 GLN HE21 H 1 7.271 0.001 A 34 GLN HE22 H 1 6.858 0.001 A 34 GLN HGx H 1 2.24 0.004 A 34 GLN HGy H 1 2.463 0.002 A 34 GLN C C 13 179.872 . A 34 GLN CA C 13 59.068 0.034 A 34 GLN CB C 13 29.314 0.014 A 34 GLN CD C 13 179.779 0.018 A 34 GLN CG C 13 34.909 0.03 A 34 GLN N N 15 117.667 0.022 A 34 GLN NE2 N 15 110.056 0.021 A 35 LYS H H 1 8.354 0.002 A 35 LYS HA H 1 4.06 0.005 A 35 LYS HB2 H 1 2.035 0.007 A 35 LYS HB3 H 1 2.035 0.007 A 35 LYS HD2 H 1 1.72 . A 35 LYS HD3 H 1 1.72 . A 35 LYS HE2 H 1 2.987 0.006 A 35 LYS HE3 H 1 2.987 0.006 A 35 LYS HG2 H 1 1.573 0.006 A 35 LYS HG3 H 1 1.573 0.006 A 35 LYS C C 13 178.864 . A 35 LYS CA C 13 59.616 0.04 A 35 LYS CB C 13 32.326 0.015 A 35 LYS CD C 13 29.355 0.008 A 35 LYS CE C 13 42.183 0.022 A 35 LYS CG C 13 25.058 0.022 A 35 LYS N N 15 123.235 0.038 A 36 GLU H H 1 8.038 0.002 A 36 GLU HA H 1 4.284 0.003 A 36 GLU HBx H 1 1.728 0.001 A 36 GLU HBy H 1 2.324 0.001 A 36 GLU HGx H 1 2.114 0.001 A 36 GLU HGy H 1 2.35 0.003 A 36 GLU C C 13 176.545 . A 36 GLU CA C 13 55.941 0.009 A 36 GLU CB C 13 30.133 0.045 A 36 GLU CG C 13 36.543 0.018 A 36 GLU N N 15 114.631 0.036 A 37 GLY H H 1 7.687 0.003 A 37 GLY HAx H 1 3.845 0.003 A 37 GLY HAy H 1 4.037 0.003 A 37 GLY C C 13 174.545 . A 37 GLY CA C 13 46.004 0.02 A 37 GLY N N 15 106.778 0.032 A 38 LEU H H 1 7.886 0.001 A 38 LEU HA H 1 4.212 0.004 A 38 LEU HBx H 1 1.416 0.009 A 38 LEU HBy H 1 1.576 0.002 A 38 LEU HDx% H 1 0.741 0.001 A 38 LEU HDy% H 1 0.732 0.002 A 38 LEU HG H 1 1.463 0.001 A 38 LEU C C 13 175.409 . A 38 LEU CA C 13 55.081 0.025 A 38 LEU CB C 13 43.123 0.027 A 38 LEU CDx C 13 22.904 0.01 A 38 LEU CDy C 13 25.770 0.042 A 38 LEU CG C 13 27.445 0.032 A 38 LEU N N 15 118.852 0.029 A 39 LEU H H 1 7.071 0.002 A 39 LEU HA H 1 4.494 0.004 A 39 LEU HBx H 1 1.151 0.002 A 39 LEU HBy H 1 1.527 0.007 A 39 LEU HDx% H 1 0.833 0.001 A 39 LEU HDy% H 1 0.846 0.001 A 39 LEU HG H 1 1.32 0.001 A 39 LEU C C 13 175.832 . A 39 LEU CA C 13 53.443 0.024 A 39 LEU CB C 13 44.838 0.026 A 39 LEU CDy C 13 26.016 0.04 A 39 LEU CDx C 13 24.996 0.07 A 39 LEU CG C 13 26.864 0.059 A 39 LEU N N 15 115.715 0.026 A 40 MET H H 1 9.043 0.001 A 40 MET HA H 1 4.5 0.001 A 40 MET HBx H 1 2.102 0.005 A 40 MET HBy H 1 2.156 0.001 A 40 MET HE% H 1 2.062 0.001 A 40 MET HGx H 1 2.471 0.004 A 40 MET HGy H 1 2.661 0.002 A 40 MET C C 13 176.646 . A 40 MET CA C 13 56.646 0.032 A 40 MET CB C 13 32.174 0.059 A 40 MET CE C 13 16.976 0.004 A 40 MET CG C 13 32.449 0.02 A 40 MET N N 15 123.321 0.028 A 41 SER H H 1 7.77 0.002 A 41 SER HA H 1 4.924 0.006 A 41 SER HBx H 1 3.742 0.005 A 41 SER HBy H 1 3.854 0.005 A 41 SER C C 13 173.967 . A 41 SER CA C 13 55.242 0.014 A 41 SER CB C 13 64.637 0.039 A 41 SER N N 15 114.104 0.041 A 42 PRO HA H 1 4.121 0.0 A 42 PRO HBx H 1 1.981 0.0 A 42 PRO HBy H 1 2.221 0.001 A 42 PRO HDx H 1 3.843 0.003 A 42 PRO HDy H 1 3.949 0.001 A 42 PRO HGx H 1 1.982 0.001 A 42 PRO HGy H 1 2.22 0.002 A 42 PRO C C 13 176.313 . A 42 PRO CA C 13 65.810 0.033 A 42 PRO CB C 13 31.804 0.033 A 42 PRO CD C 13 50.682 0.023 A 42 PRO CG C 13 27.900 0.045 A 43 SER H H 1 7.703 0.004 A 43 SER HA H 1 3.723 0.005 A 43 SER HBx H 1 3.774 0.005 A 43 SER HBy H 1 4.001 0.008 A 43 SER C C 13 176.349 . A 43 SER CA C 13 60.187 0.045 A 43 SER CB C 13 62.624 0.045 A 43 SER N N 15 107.858 0.025 A 44 ASP H H 1 8.203 0.004 A 44 ASP HA H 1 4.451 0.006 A 44 ASP HBx H 1 2.836 0.005 A 44 ASP HBy H 1 2.939 0.004 A 44 ASP C C 13 177.975 . A 44 ASP CA C 13 57.133 0.017 A 44 ASP CB C 13 40.549 0.034 A 44 ASP N N 15 124.518 0.024 A 45 LEU H H 1 7.469 0.003 A 45 LEU HA H 1 4.258 0.002 A 45 LEU HBx H 1 1.481 0.002 A 45 LEU HBy H 1 1.626 0.005 A 45 LEU HDx% H 1 0.848 0.002 A 45 LEU HDy% H 1 0.897 0.008 A 45 LEU HG H 1 1.886 0.003 A 45 LEU C C 13 176.164 . A 45 LEU CA C 13 56.520 0.026 A 45 LEU CB C 13 42.120 0.038 A 45 LEU CDy C 13 25.615 0.024 A 45 LEU CDx C 13 25.286 0.038 A 45 LEU CG C 13 26.589 0.116 A 45 LEU N N 15 117.945 0.022 A 46 TYR H H 1 7.202 0.002 A 46 TYR HA H 1 4.737 0.006 A 46 TYR HBx H 1 2.992 0.002 A 46 TYR HBy H 1 3.427 0.001 A 46 TYR HD1 H 1 7.136 0.001 A 46 TYR HD2 H 1 7.136 0.001 A 46 TYR HE1 H 1 6.716 0.003 A 46 TYR HE2 H 1 6.716 0.003 A 46 TYR C C 13 176.682 . A 46 TYR CA C 13 56.975 0.012 A 46 TYR CB C 13 37.784 0.056 A 46 TYR CD1 C 13 132.261 0.056 A 46 TYR CD2 C 13 132.261 0.056 A 46 TYR CE1 C 13 117.666 0.046 A 46 TYR CE2 C 13 117.666 0.046 A 46 TYR CG C 13 129.839 0.018 A 46 TYR N N 15 112.766 0.038 A 47 SER H H 1 7.492 0.002 A 47 SER HA H 1 4.7 0.003 A 47 SER HB2 H 1 3.923 0.006 A 47 SER HB3 H 1 3.923 0.006 A 47 SER C C 13 172.908 . A 47 SER CA C 13 54.719 0.003 A 47 SER CB C 13 63.836 0.051 A 47 SER N N 15 114.240 0.027 A 48 PRO HA H 1 1.69 0.001 A 48 PRO HBx H 1 1.432 0.001 A 48 PRO HBy H 1 1.477 0.0 A 48 PRO HDx H 1 3.548 0.002 A 48 PRO HDy H 1 3.918 0.002 A 48 PRO HGy H 1 1.779 0.0 A 48 PRO HGx H 1 1.424 0.0 A 48 PRO C C 13 178.417 . A 48 PRO CA C 13 62.741 0.034 A 48 PRO CB C 13 31.700 0.021 A 48 PRO CD C 13 50.886 0.031 A 48 PRO CG C 13 27.236 0.019 A 49 GLY H H 1 7.977 0.002 A 49 GLY HAx H 1 3.715 0.002 A 49 GLY HAy H 1 3.854 0.002 A 49 GLY C C 13 175.083 . A 49 GLY CA C 13 46.090 0.035 A 49 GLY N N 15 104.892 0.037 A 50 SER H H 1 7.953 0.002 A 50 SER HA H 1 4.433 0.004 A 50 SER HBx H 1 3.894 0.005 A 50 SER HBy H 1 4.07 0.001 A 50 SER C C 13 177.022 . A 50 SER CA C 13 59.699 0.045 A 50 SER CB C 13 64.441 0.043 A 50 SER N N 15 114.849 0.024 A 51 TRP H H 1 7.249 0.002 A 51 TRP HA H 1 4.937 0.004 A 51 TRP HBx H 1 3.487 0.002 A 51 TRP HBy H 1 3.571 0.005 A 51 TRP HD1 H 1 7.103 0.003 A 51 TRP HE1 H 1 10.44 0.005 A 51 TRP HE3 H 1 7.635 0.001 A 51 TRP HH2 H 1 6.896 0.002 A 51 TRP HZ2 H 1 7.188 0.002 A 51 TRP HZ3 H 1 7.019 0.002 A 51 TRP C C 13 178.013 . A 51 TRP CA C 13 59.414 0.051 A 51 TRP CB C 13 29.648 0.018 A 51 TRP CD1 C 13 125.235 0.07 A 51 TRP CE3 C 13 121.358 0.107 A 51 TRP CH2 C 13 123.437 0.069 A 51 TRP CZ2 C 13 114.039 0.085 A 51 TRP CZ3 C 13 121.306 0.039 A 51 TRP N N 15 122.363 0.032 A 51 TRP NE1 N 15 129.371 0.029 A 52 ASP H H 1 9.311 0.003 A 52 ASP HA H 1 4.853 0.002 A 52 ASP HBx H 1 2.756 0.006 A 52 ASP HBy H 1 2.902 0.003 A 52 ASP C C 13 177.381 . A 52 ASP CA C 13 59.334 0.056 A 52 ASP CB C 13 37.472 0.018 A 52 ASP N N 15 120.163 0.022 A 53 PRO HA H 1 4.355 0.001 A 53 PRO HBx H 1 1.902 0.0 A 53 PRO HBy H 1 2.354 0.0 A 53 PRO HDx H 1 3.698 0.001 A 53 PRO HDy H 1 3.724 0.003 A 53 PRO HGx H 1 1.988 0.002 A 53 PRO HGy H 1 2.227 0.002 A 53 PRO C C 13 180.096 . A 53 PRO CA C 13 66.003 0.023 A 53 PRO CB C 13 31.367 0.025 A 53 PRO CD C 13 50.699 0.032 A 53 PRO CG C 13 28.095 0.019 A 54 ILE H H 1 7.414 0.003 A 54 ILE HA H 1 3.385 0.002 A 54 ILE HB H 1 1.72 0.002 A 54 ILE HD1% H 1 0.59 0.002 A 54 ILE HG1x H 1 0.585 0.001 A 54 ILE HG1y H 1 1.906 0.001 A 54 ILE HG2% H 1 -0.692 0.001 A 54 ILE C C 13 176.971 . A 54 ILE CA C 13 66.399 0.03 A 54 ILE CB C 13 37.553 0.036 A 54 ILE CD1 C 13 14.235 0.039 A 54 ILE CG1 C 13 30.307 0.018 A 54 ILE CG2 C 13 16.209 0.033 A 54 ILE N N 15 119.028 0.041 A 55 THR H H 1 8.65 0.003 A 55 THR HA H 1 3.718 0.001 A 55 THR HB H 1 4.553 0.003 A 55 THR HG2% H 1 1.313 0.003 A 55 THR C C 13 177.445 . A 55 THR CA C 13 67.428 0.026 A 55 THR CB C 13 68.708 0.045 A 55 THR CG2 C 13 22.670 0.019 A 55 THR N N 15 118.059 0.04 A 56 ALA H H 1 8.51 0.003 A 56 ALA HA H 1 4.13 0.003 A 56 ALA HB% H 1 1.475 0.004 A 56 ALA C C 13 180.032 . A 56 ALA CA C 13 55.508 0.018 A 56 ALA CB C 13 18.075 0.058 A 56 ALA N N 15 123.867 0.039 A 57 ALA H H 1 7.969 0.004 A 57 ALA HA H 1 4.177 0.002 A 57 ALA HB% H 1 1.465 0.003 A 57 ALA C C 13 181.795 . A 57 ALA CA C 13 55.134 0.036 A 57 ALA CB C 13 19.340 0.083 A 57 ALA N N 15 121.238 0.044 A 58 LEU H H 1 8.784 0.002 A 58 LEU HA H 1 4.072 0.002 A 58 LEU HBy H 1 1.78 0.003 A 58 LEU HBx H 1 1.245 0.002 A 58 LEU HDx% H 1 0.602 0.006 A 58 LEU HDy% H 1 0.514 0.005 A 58 LEU HG H 1 1.627 0.002 A 58 LEU C C 13 179.883 . A 58 LEU CA C 13 57.470 0.015 A 58 LEU CB C 13 41.693 0.041 A 58 LEU CDx C 13 22.294 0.025 A 58 LEU CDy C 13 25.740 0.027 A 58 LEU CG C 13 26.459 0.078 A 58 LEU N N 15 117.508 0.034 A 59 SER H H 1 8.503 0.002 A 59 SER HA H 1 4.348 0.002 A 59 SER HBy H 1 4.132 0.002 A 59 SER HBx H 1 3.991 0.004 A 59 SER C C 13 176.428 . A 59 SER CA C 13 62.432 0.037 A 59 SER CB C 13 62.608 0.067 A 59 SER N N 15 117.550 0.026 A 60 GLN H H 1 7.901 0.001 A 60 GLN HA H 1 4.171 0.002 A 60 GLN HB2 H 1 2.196 0.001 A 60 GLN HB3 H 1 2.196 0.001 A 60 GLN HE21 H 1 6.807 0.002 A 60 GLN HE22 H 1 7.397 0.004 A 60 GLN HGx H 1 2.439 0.002 A 60 GLN HGy H 1 2.484 0.004 A 60 GLN C C 13 177.998 . A 60 GLN CA C 13 59.009 0.039 A 60 GLN CB C 13 28.456 0.024 A 60 GLN CD C 13 179.911 0.005 A 60 GLN CG C 13 33.915 0.049 A 60 GLN N N 15 122.086 0.025 A 60 GLN NE2 N 15 111.168 0.037 A 61 ARG H H 1 7.833 0.003 A 61 ARG HA H 1 4.103 0.001 A 61 ARG HBx H 1 1.871 0.001 A 61 ARG HBy H 1 1.919 0.0 A 61 ARG HDx H 1 3.021 0.002 A 61 ARG HDy H 1 3.204 0.002 A 61 ARG HE H 1 7.84 0.001 A 61 ARG HG2 H 1 1.776 0.0 A 61 ARG HG3 H 1 1.776 0.0 A 61 ARG C C 13 178.012 . A 61 ARG CA C 13 58.911 0.046 A 61 ARG CB C 13 30.475 0.033 A 61 ARG CD C 13 43.504 0.035 A 61 ARG CG C 13 27.617 0.034 A 61 ARG CZ C 13 159.485 . A 61 ARG N N 15 119.246 0.034 A 61 ARG NE N 15 84.849 0.033 A 62 ALA H H 1 7.894 0.003 A 62 ALA HA H 1 3.9 0.004 A 62 ALA HB% H 1 1.51 0.001 A 62 ALA C C 13 179.719 . A 62 ALA CA C 13 55.256 0.015 A 62 ALA CB C 13 19.101 0.068 A 62 ALA N N 15 120.723 0.046 A 63 MET H H 1 7.871 0.0 A 63 MET HA H 1 4.222 0.002 A 63 MET HBx H 1 2.173 0.002 A 63 MET HBy H 1 2.197 0.003 A 63 MET HE% H 1 2.095 0.009 A 63 MET HGx H 1 2.59 0.004 A 63 MET HGy H 1 2.716 0.003 A 63 MET C C 13 177.954 . A 63 MET CA C 13 58.161 0.053 A 63 MET CB C 13 32.881 0.018 A 63 MET CE C 13 16.956 0.022 A 63 MET CG C 13 32.055 0.02 A 63 MET N N 15 116.486 0.034 A 64 ILE H H 1 8.217 0.002 A 64 ILE HA H 1 4.041 0.008 A 64 ILE HB H 1 1.949 0.001 A 64 ILE HD1% H 1 0.849 0.002 A 64 ILE HG1x H 1 1.325 0.002 A 64 ILE HG1y H 1 1.611 0.001 A 64 ILE HG2% H 1 0.932 0.003 A 64 ILE C C 13 177.792 . A 64 ILE CA C 13 62.986 0.049 A 64 ILE CB C 13 38.257 0.023 A 64 ILE CD1 C 13 12.312 0.024 A 64 ILE CG1 C 13 28.190 0.026 A 64 ILE CG2 C 13 17.396 0.03 A 64 ILE N N 15 118.047 0.043 A 65 LEU H H 1 7.96 0.005 A 65 LEU HA H 1 4.502 0.002 A 65 LEU HBx H 1 1.603 0.004 A 65 LEU HBy H 1 1.905 0.002 A 65 LEU HDx% H 1 0.904 0.001 A 65 LEU HDy% H 1 0.93 0.001 A 65 LEU HG H 1 1.757 0.003 A 65 LEU C C 13 178.396 . A 65 LEU CA C 13 55.119 0.024 A 65 LEU CB C 13 43.120 0.022 A 65 LEU CDx C 13 22.645 0.012 A 65 LEU CDy C 13 25.600 0.056 A 65 LEU CG C 13 26.926 0.057 A 65 LEU N N 15 117.134 0.045 A 66 GLY H H 1 7.614 0.005 A 66 GLY HAx H 1 3.967 0.003 A 66 GLY HAy H 1 4.111 0.004 A 66 GLY C C 13 174.543 . A 66 GLY CA C 13 46.240 0.033 A 66 GLY N N 15 107.752 0.025 A 67 LYS H H 1 7.172 0.003 A 67 LYS HA H 1 4.68 0.003 A 67 LYS HBx H 1 1.61 0.002 A 67 LYS HBy H 1 2.022 0.001 A 67 LYS HDx H 1 1.608 0.001 A 67 LYS HDy H 1 1.718 0.002 A 67 LYS HEx H 1 2.973 0.0 A 67 LYS HEy H 1 3.033 0.001 A 67 LYS HGx H 1 1.349 0.001 A 67 LYS HGy H 1 1.349 0.001 A 67 LYS C C 13 175.930 . A 67 LYS CA C 13 55.032 0.043 A 67 LYS CB C 13 32.954 0.012 A 67 LYS CD C 13 29.011 0.016 A 67 LYS CE C 13 42.396 0.025 A 67 LYS CG C 13 24.422 0.021 A 67 LYS N N 15 119.037 0.04 A 68 SER H H 1 8.525 0.003 A 68 SER HA H 1 4.496 0.005 A 68 SER HBx H 1 3.856 0.003 A 68 SER HBy H 1 4.089 0.006 A 68 SER C C 13 176.112 . A 68 SER CA C 13 58.882 0.065 A 68 SER CB C 13 64.354 0.051 A 68 SER N N 15 116.434 0.033 A 69 GLY H H 1 9.043 0.001 A 69 GLY HAx H 1 3.816 0.005 A 69 GLY HAy H 1 3.972 0.002 A 69 GLY C C 13 176.269 . A 69 GLY CA C 13 47.799 0.036 A 69 GLY N N 15 113.568 0.017 A 70 GLU H H 1 9.057 0.003 A 70 GLU HA H 1 4.299 0.0 A 70 GLU HBx H 1 1.643 0.001 A 70 GLU HBy H 1 2.167 0.001 A 70 GLU HGx H 1 2.29 0.005 A 70 GLU HGy H 1 2.384 0.002 A 70 GLU C C 13 178.297 . A 70 GLU CA C 13 60.916 0.055 A 70 GLU CB C 13 28.401 0.047 A 70 GLU CG C 13 37.167 0.031 A 70 GLU N N 15 120.695 0.038 A 71 LEU H H 1 7.648 0.003 A 71 LEU HA H 1 4.222 0.004 A 71 LEU HBx H 1 1.492 0.003 A 71 LEU HBy H 1 1.979 0.003 A 71 LEU HDx% H 1 0.967 0.006 A 71 LEU HDy% H 1 1.039 0.0 A 71 LEU HG H 1 1.657 0.005 A 71 LEU C C 13 178.898 . A 71 LEU CA C 13 57.904 0.037 A 71 LEU CB C 13 41.660 0.051 A 71 LEU CDy C 13 26.269 0.026 A 71 LEU CDx C 13 23.297 0.04 A 71 LEU CG C 13 27.108 0.065 A 71 LEU N N 15 119.704 0.041 A 72 LYS H H 1 7.938 0.004 A 72 LYS HA H 1 4.075 0.002 A 72 LYS HBx H 1 2.018 0.006 A 72 LYS HBy H 1 2.018 0.006 A 72 LYS HD2 H 1 1.681 0.004 A 72 LYS HD3 H 1 1.681 0.004 A 72 LYS HE2 H 1 2.989 0.002 A 72 LYS HE3 H 1 2.989 0.002 A 72 LYS HGy H 1 1.56 0.001 A 72 LYS HGx H 1 1.396 0.001 A 72 LYS C C 13 179.747 . A 72 LYS CA C 13 59.641 0.032 A 72 LYS CB C 13 31.667 0.055 A 72 LYS CD C 13 29.276 0.018 A 72 LYS CE C 13 42.172 0.019 A 72 LYS CG C 13 25.054 0.026 A 72 LYS N N 15 121.523 0.051 A 73 THR H H 1 8.224 0.002 A 73 THR HA H 1 3.782 0.005 A 73 THR HB H 1 4.265 0.003 A 73 THR HG2% H 1 1.176 0.001 A 73 THR C C 13 175.555 . A 73 THR CA C 13 66.941 0.035 A 73 THR CB C 13 68.158 0.026 A 73 THR CG2 C 13 23.333 0.004 A 73 THR N N 15 117.560 0.043 A 74 TRP H H 1 8.665 0.002 A 74 TRP HA H 1 4.624 0.001 A 74 TRP HBx H 1 3.247 0.001 A 74 TRP HBy H 1 3.278 0.002 A 74 TRP HD1 H 1 6.85 0.003 A 74 TRP HE1 H 1 10.298 0.005 A 74 TRP HE3 H 1 7.53 0.004 A 74 TRP HH2 H 1 6.845 0.001 A 74 TRP HZ2 H 1 7.394 0.001 A 74 TRP HZ3 H 1 6.626 0.003 A 74 TRP C C 13 175.927 . A 74 TRP CA C 13 59.216 0.049 A 74 TRP CB C 13 30.896 0.064 A 74 TRP CD1 C 13 124.701 0.021 A 74 TRP CE3 C 13 121.932 0.122 A 74 TRP CH2 C 13 124.033 0.097 A 74 TRP CZ2 C 13 115.262 0.08 A 74 TRP CZ3 C 13 120.167 0.111 A 74 TRP N N 15 121.794 0.047 A 74 TRP NE1 N 15 128.941 0.022 A 75 GLY H H 1 8.132 0.003 A 75 GLY HAx H 1 3.293 0.007 A 75 GLY HAy H 1 3.813 0.001 A 75 GLY C C 13 177.151 . A 75 GLY CA C 13 47.442 0.026 A 75 GLY N N 15 103.330 0.032 A 76 LEU H H 1 7.168 0.003 A 76 LEU HA H 1 4.113 0.002 A 76 LEU HBx H 1 1.505 0.003 A 76 LEU HBy H 1 2.031 0.001 A 76 LEU HDx% H 1 0.935 0.001 A 76 LEU HDy% H 1 0.992 0.003 A 76 LEU HG H 1 1.798 0.006 A 76 LEU C C 13 178.508 . A 76 LEU CA C 13 57.464 0.019 A 76 LEU CB C 13 42.127 0.039 A 76 LEU CDx C 13 22.912 0.017 A 76 LEU CDy C 13 26.145 0.047 A 76 LEU CG C 13 27.101 0.068 A 76 LEU N N 15 121.353 0.026 A 77 VAL H H 1 8.181 0.001 A 77 VAL HA H 1 3.232 0.003 A 77 VAL HB H 1 2.016 0.003 A 77 VAL HGx% H 1 0.742 0.004 A 77 VAL HGy% H 1 0.901 0.0 A 77 VAL C C 13 176.469 . A 77 VAL CA C 13 66.409 0.03 A 77 VAL CB C 13 31.649 0.047 A 77 VAL CGx C 13 21.738 0.037 A 77 VAL CGy C 13 23.784 0.03 A 77 VAL N N 15 120.538 0.053 A 78 LEU H H 1 8.719 0.003 A 78 LEU HA H 1 2.873 0.002 A 78 LEU HBx H 1 -0.55 0.006 A 78 LEU HBy H 1 0.752 0.002 A 78 LEU HDx% H 1 -0.083 0.005 A 78 LEU HDy% H 1 0.465 0.002 A 78 LEU HG H 1 0.668 0.015 A 78 LEU C C 13 178.373 . A 78 LEU CA C 13 57.244 0.015 A 78 LEU CB C 13 39.448 0.022 A 78 LEU CDx C 13 22.175 0.025 A 78 LEU CDy C 13 24.930 0.051 A 78 LEU CG C 13 26.093 0.079 A 78 LEU N N 15 120.124 0.031 A 79 GLY H H 1 7.038 0.005 A 79 GLY HAx H 1 3.37 0.006 A 79 GLY HAy H 1 3.67 0.001 A 79 GLY C C 13 176.110 . A 79 GLY CA C 13 46.898 0.037 A 79 GLY N N 15 102.352 0.026 A 80 ALA H H 1 7.375 0.004 A 80 ALA HA H 1 3.683 0.002 A 80 ALA HB% H 1 1.471 0.003 A 80 ALA C C 13 179.186 . A 80 ALA CA C 13 54.836 0.028 A 80 ALA CB C 13 19.378 0.023 A 80 ALA N N 15 124.528 0.028 A 81 LEU H H 1 8.442 0.001 A 81 LEU HA H 1 3.861 0.002 A 81 LEU HBx H 1 1.274 0.003 A 81 LEU HBy H 1 1.314 0.002 A 81 LEU HDx% H 1 0.755 0.001 A 81 LEU HDy% H 1 0.632 0.001 A 81 LEU HG H 1 1.691 0.002 A 81 LEU C C 13 180.428 . A 81 LEU CA C 13 57.604 0.045 A 81 LEU CB C 13 41.206 0.036 A 81 LEU CDx C 13 21.770 0.021 A 81 LEU CDy C 13 25.854 0.03 A 81 LEU CG C 13 26.269 0.008 A 81 LEU N N 15 118.875 0.024 A 82 LYS H H 1 8.063 0.003 A 82 LYS HA H 1 3.872 0.005 A 82 LYS HBx H 1 1.56 0.007 A 82 LYS HBy H 1 1.701 0.002 A 82 LYS HDx H 1 1.507 0.001 A 82 LYS HDy H 1 1.507 0.001 A 82 LYS HEx H 1 2.757 0.004 A 82 LYS HEy H 1 2.967 0.005 A 82 LYS HGx H 1 1.259 0.003 A 82 LYS HGy H 1 1.292 0.004 A 82 LYS C C 13 179.193 . A 82 LYS CA C 13 59.902 0.041 A 82 LYS CB C 13 32.690 0.028 A 82 LYS CD C 13 29.828 0.035 A 82 LYS CE C 13 42.058 0.022 A 82 LYS CG C 13 26.476 0.033 A 82 LYS N N 15 118.088 0.052 A 83 ALA H H 1 7.341 0.001 A 83 ALA HA H 1 3.944 0.003 A 83 ALA HB% H 1 0.939 0.002 A 83 ALA C C 13 179.458 . A 83 ALA CA C 13 54.213 0.018 A 83 ALA CB C 13 17.857 0.06 A 83 ALA N N 15 121.448 0.039 A 84 ALA H H 1 7.663 0.003 A 84 ALA HA H 1 4.147 0.004 A 84 ALA HB% H 1 1.486 0.002 A 84 ALA C C 13 178.686 . A 84 ALA CA C 13 53.434 0.028 A 84 ALA CB C 13 18.553 0.047 A 84 ALA N N 15 119.388 0.052 A 85 ARG H H 1 7.46 0.004 A 85 ARG HA H 1 4.333 0.003 A 85 ARG HBx H 1 2.003 0.001 A 85 ARG HBy H 1 2.08 0.001 A 85 ARG HDx H 1 3.365 0.002 A 85 ARG HDy H 1 3.448 0.001 A 85 ARG HE H 1 7.554 0.002 A 85 ARG HGx H 1 1.853 0.002 A 85 ARG HGy H 1 1.905 0.001 A 85 ARG C C 13 176.436 . A 85 ARG CA C 13 56.671 0.017 A 85 ARG CB C 13 30.865 0.019 A 85 ARG CD C 13 43.709 0.031 A 85 ARG CG C 13 27.364 0.03 A 85 ARG CZ C 13 159.694 . A 85 ARG N N 15 116.879 0.027 A 85 ARG NE N 15 84.327 0.055 A 86 GLU H H 1 7.884 0.002 A 86 GLU HA H 1 4.322 0.005 A 86 GLU HBx H 1 1.982 0.001 A 86 GLU HBy H 1 2.159 0.0 A 86 GLU HGx H 1 2.296 0.002 A 86 GLU HGy H 1 2.385 0.0 A 86 GLU C C 13 175.608 . A 86 GLU CA C 13 56.534 0.026 A 86 GLU CB C 13 30.124 0.041 A 86 GLU CG C 13 36.199 0.028 A 86 GLU N N 15 120.500 0.032 A 87 GLU H H 1 7.775 0.004 A 87 GLU HA H 1 4.115 0.003 A 87 GLU HBx H 1 1.941 0.001 A 87 GLU HBy H 1 2.077 0.001 A 87 GLU HG2 H 1 2.291 0.001 A 87 GLU HG3 H 1 2.291 0.001 A 87 GLU C C 13 181.169 . A 87 GLU CA C 13 58.222 0.026 A 87 GLU CB C 13 31.119 0.026 A 87 GLU CG C 13 36.567 0.033 A 87 GLU N N 15 126.284 0.047 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 37 GLY H A 39 LEU HDy% 1.0 . 5.50 2 2 A 37 GLY H A 35 LYS H 1.0 . 5.43 3 3 A 37 GLY H A 36 GLU H 1.0 . 3.57 4 4 A 37 GLY H A 38 LEU H 1.0 . 3.54 5 5 A 37 GLY H A 39 LEU H 1.0 . 4.70 6 6 A 37 GLY H A 36 GLU HBy 1.0 . 4.37 7 7 A 37 GLY H A 34 GLN HB2 1.0 . 5.12 8 7 A 37 GLY H A 34 GLN HB3 1.0 . 5.12 9 8 A 37 GLY H A 35 LYS HB2 1.0 . 4.85 10 8 A 37 GLY H A 35 LYS HB3 1.0 . 4.85 11 9 A 37 GLY H A 36 GLU HBx 1.0 . 4.40 12 10 A 37 GLY H A 38 LEU HBy 1.0 . 4.74 13 11 A 37 GLY H A 38 LEU HG 1.0 . 4.83 14 12 A 37 GLY H A 38 LEU HDx% 1.0 . 5.37 15 13 A 86 GLU H A 87 GLU H 1.0 . 3.37 16 14 A 87 GLU H A 87 GLU HG2 1.0 . 3.97 17 14 A 87 GLU H A 87 GLU HG3 1.0 . 3.97 18 15 A 87 GLU H A 87 GLU HBy 1.0 . 3.86 19 16 A 87 GLU H A 87 GLU HBx 1.0 . 3.38 20 17 A 27 GLY H A 28 ALA H 1.0 . 3.46 21 18 A 28 ALA H A 29 MET H 1.0 . 3.37 22 19 A 28 ALA H A 27 GLY HAy 1.0 . 3.23 23 20 A 28 ALA H A 29 MET HA 1.0 . 4.91 24 21 A 28 ALA H A 26 ILE HA 1.0 . 5.42 25 22 A 28 ALA H A 29 MET HBy 1.0 . 5.50 26 23 A 28 ALA H A 29 MET HBx 1.0 . 5.18 27 24 A 28 ALA H A 26 ILE HB 1.0 . 5.10 28 25 A 28 ALA H A 24 LYS HD2 1.0 . 5.24 29 25 A 28 ALA H A 24 LYS HD3 1.0 . 5.24 30 26 A 28 ALA H A 28 ALA HB% 1.0 . 3.06 31 27 A 28 ALA H A 24 LYS HGx 1.0 . 5.20 32 28 A 28 ALA H A 26 ILE HG2% 1.0 . 4.97 33 29 A 49 GLY H A 51 TRP H 1.0 . 5.30 34 30 A 49 GLY H A 50 SER HA 1.0 . 5.50 35 31 A 49 GLY H A 50 SER HBy 1.0 . 5.16 36 32 A 9 SER H A 11 ALA H 1.0 . 5.23 37 33 A 11 ALA H A 12 CYS H 1.0 . 3.31 38 34 A 11 ALA H A 10 SER HBy 1.0 . 3.23 39 35 A 11 ALA H A 8 ILE HA 1.0 . 3.74 40 36 A 11 ALA H A 12 CYS HBy 1.0 . 5.38 41 37 A 11 ALA H A 11 ALA HB% 1.0 . 3.10 42 38 A 11 ALA H A 13 LYS HGx 1.0 . 4.73 43 39 A 11 ALA H A 8 ILE HG2% 1.0 . 5.08 44 40 A 42 PRO HA A 44 ASP H 1.0 . 4.49 45 41 A 44 ASP H A 43 SER HBy 1.0 . 4.37 46 42 A 44 ASP H A 44 ASP HBy 1.0 . 3.18 47 43 A 44 ASP H A 44 ASP HBx 1.0 . 3.49 48 44 A 44 ASP H A 42 PRO HBx 1.0 . 5.50 49 45 A 44 ASP H A 45 LEU HBx 1.0 . 5.00 50 46 A 44 ASP H A 39 LEU HDx% 1.0 . 4.15 51 47 A 78 LEU H A 80 ALA H 1.0 . 4.87 52 48 A 80 ALA H A 82 LYS H 1.0 . 4.82 53 49 A 80 ALA H A 79 GLY H 1.0 . 3.65 54 50 A 80 ALA H A 12 CYS HA 1.0 . 5.50 55 51 A 80 ALA H A 76 LEU HA 1.0 . 5.50 56 52 A 80 ALA H A 79 GLY HAy 1.0 . 3.17 57 53 A 80 ALA H A 77 VAL HA 1.0 . 4.21 58 54 A 80 ALA H A 78 LEU HA 1.0 . 5.12 59 55 A 80 ALA H A 81 LEU HG 1.0 . 4.99 60 56 A 80 ALA H A 80 ALA HB% 1.0 . 3.16 61 57 A 85 ARG HE A 85 ARG HBy 1.0 . 5.50 62 58 A 56 ALA H A 58 LEU H 1.0 . 5.50 63 59 A 56 ALA H A 57 ALA H 1.0 . 3.42 64 60 A 56 ALA H A 52 ASP HA 1.0 . 4.27 65 61 A 56 ALA H A 55 THR HB 1.0 . 3.20 66 62 A 56 ALA H A 53 PRO HA 1.0 . 4.22 67 63 A 56 ALA H A 59 SER HBx 1.0 . 5.36 68 64 A 56 ALA H A 54 ILE HA 1.0 . 5.50 69 65 A 56 ALA H A 52 ASP HBx 1.0 . 5.50 70 66 A 56 ALA H A 56 ALA HB% 1.0 . 3.05 71 67 A 56 ALA H A 55 THR HG2% 1.0 . 4.19 72 68 A 56 ALA H A 54 ILE HG2% 1.0 . 5.50 73 69 A 56 ALA H A 54 ILE HB 1.0 . 5.50 74 70 A 40 MET H A 41 SER HA 1.0 . 5.50 75 71 A 40 MET H A 39 LEU HA 1.0 . 2.95 76 72 A 40 MET H A 41 SER HBx 1.0 . 5.48 77 73 A 44 ASP HBy A 40 MET H 1.0 . 5.47 78 74 A 40 MET H A 40 MET HGy 1.0 . 4.76 79 75 A 40 MET H A 40 MET HGx 1.0 . 4.20 80 76 A 40 MET H A 40 MET HBy 1.0 . 3.41 81 77 A 40 MET H A 39 LEU HBy 1.0 . 4.52 82 78 A 40 MET H A 39 LEU HG 1.0 . 5.33 83 79 A 40 MET H A 39 LEU HBx 1.0 . 4.65 84 80 A 39 LEU HDy% A 40 MET H 1.0 . 4.56 85 81 A 74 TRP H A 75 GLY H 1.0 . 3.94 86 82 A 75 GLY H A 76 LEU H 1.0 . 3.64 87 83 A 75 GLY H A 74 TRP HD1 1.0 . 5.04 88 84 A 75 GLY H A 71 LEU HA 1.0 . 4.89 89 85 A 75 GLY H A 72 LYS HA 1.0 . 4.12 90 86 A 75 GLY H A 76 LEU HBy 1.0 . 4.67 91 87 A 75 GLY H A 76 LEU HG 1.0 . 5.50 92 88 A 75 GLY H A 71 LEU HDy% 1.0 . 5.21 93 89 A 75 GLY H A 77 VAL HGy% 1.0 . 5.50 94 90 A 75 GLY H A 78 LEU HBy 1.0 . 5.50 95 91 A 44 ASP HBx A 40 MET H 1.0 . 5.12 96 92 A 35 LYS H A 32 LEU HA 1.0 . 3.87 97 93 A 35 LYS H A 33 LEU HA 1.0 . 5.03 98 94 A 35 LYS H A 34 GLN HGy 1.0 . 5.22 99 95 A 35 LYS H A 34 GLN HB2 1.0 . 3.20 100 95 A 35 LYS H A 34 GLN HB3 1.0 . 3.20 101 96 A 35 LYS H A 35 LYS HB2 1.0 . 2.81 102 96 A 35 LYS H A 35 LYS HB3 1.0 . 2.81 103 97 A 35 LYS H A 35 LYS HD2 1.0 . 4.57 104 97 A 35 LYS H A 35 LYS HD3 1.0 . 4.57 105 98 A 35 LYS H A 35 LYS HG2 1.0 . 4.07 106 98 A 35 LYS H A 35 LYS HG3 1.0 . 4.07 107 99 A 35 LYS H A 33 LEU HBx 1.0 . 5.50 108 100 A 35 LYS H A 32 LEU HDx% 1.0 . 5.37 109 101 A 31 SER HBx A 32 LEU H 1.0 . 4.51 110 102 A 32 LEU H A 33 LEU HG 1.0 . 4.55 111 103 A 32 LEU H A 32 LEU HBy 1.0 . 3.12 112 104 A 32 LEU H A 32 LEU HBx 1.0 . 3.12 113 105 A 32 LEU H A 32 LEU HG 1.0 . 4.43 114 106 A 33 LEU HBx A 32 LEU H 1.0 . 5.50 115 107 A 32 LEU HDx% A 32 LEU H 1.0 . 4.50 116 108 A 32 LEU H A 32 LEU HDy% 1.0 . 4.50 117 109 A 32 LEU H A 33 LEU HDx% 1.0 . 5.50 118 110 A 3 ALA H A 4 VAL H 1.0 . 4.11 119 111 A 3 ALA H A 4 VAL HA 1.0 . 5.50 120 112 A 3 ALA H A 2 GLU HG2 1.0 . 5.50 121 112 A 3 ALA H A 2 GLU HG3 1.0 . 5.50 122 113 A 3 ALA H A 2 GLU HB2 1.0 . 4.01 123 113 A 3 ALA H A 2 GLU HB3 1.0 . 4.01 124 114 A 3 ALA H A 6 LYS HGx 1.0 . 5.50 125 115 A 3 ALA H A 3 ALA HB% 1.0 . 3.58 126 116 A 51 TRP H A 74 TRP HH2 1.0 . 5.39 127 117 A 51 TRP H A 52 ASP H 1.0 . 3.92 128 118 A 51 TRP H A 50 SER H 1.0 . 3.24 129 119 A 51 TRP H A 51 TRP HD1 1.0 . 3.81 130 120 A 51 TRP H A 51 TRP HBy 1.0 . 4.15 131 121 A 51 TRP H A 48 PRO HA 1.0 . 4.54 132 122 A 51 TRP H A 51 TRP HE1 1.0 . 5.50 133 123 A 51 TRP H A 54 ILE HD1% 1.0 . 5.50 134 124 A 51 TRP H A 78 LEU HDx% 1.0 . 5.50 135 125 A 79 GLY H A 81 LEU H 1.0 . 5.29 136 126 A 79 GLY H A 76 LEU HA 1.0 . 4.64 137 127 A 79 GLY H A 75 GLY HAy 1.0 . 5.50 138 128 A 79 GLY H A 77 VAL HB 1.0 . 5.34 139 129 A 79 GLY H A 80 ALA HB% 1.0 . 4.95 140 130 A 79 GLY H A 77 VAL HGy% 1.0 . 5.50 141 131 A 79 GLY H A 78 LEU HBy 1.0 . 3.70 142 132 A 79 GLY H A 78 LEU HDy% 1.0 . 5.39 143 133 A 79 GLY H A 78 LEU HDx% 1.0 . 5.50 144 134 A 79 GLY H A 78 LEU HBx 1.0 . 4.31 145 135 A 27 GLY H A 26 ILE H 1.0 . 3.60 146 136 A 26 ILE H A 26 ILE HD1% 1.0 . 4.08 147 137 A 28 ALA H A 26 ILE H 1.0 . 4.53 148 138 A 26 ILE H A 25 GLU H 1.0 . 3.46 149 139 A 26 ILE H A 23 LYS HA 1.0 . 3.96 150 140 A 26 ILE H A 25 GLU HBy 1.0 . 3.78 151 141 A 26 ILE H A 25 GLU HG2 1.0 . 4.45 152 141 A 26 ILE H A 25 GLU HG3 1.0 . 4.45 153 142 A 26 ILE H A 25 GLU HBx 1.0 . 3.97 154 143 A 26 ILE HB A 26 ILE H 1.0 . 2.95 155 144 A 28 ALA HB% A 26 ILE H 1.0 . 5.50 156 145 A 26 ILE HG2% A 26 ILE H 1.0 . 3.98 157 146 A 26 ILE H A 26 ILE HG1x 1.0 . 3.85 158 147 A 58 LEU H A 60 GLN H 1.0 . 5.04 159 148 A 59 SER HBx A 60 GLN H 1.0 . 3.82 160 149 A 60 GLN H A 60 GLN HGy 1.0 . 3.88 161 149 A 60 GLN H A 60 GLN HGx 1.0 . 3.88 162 150 A 60 GLN H A 60 GLN HB2 1.0 . 2.89 163 150 A 60 GLN H A 60 GLN HB3 1.0 . 2.89 164 151 A 60 GLN H A 57 ALA HB% 1.0 . 4.64 165 152 A 74 TRP H A 73 THR H 1.0 . 3.63 166 153 A 74 TRP H A 74 TRP HE3 1.0 . 4.97 167 154 A 74 TRP H A 76 LEU H 1.0 . 5.50 168 155 A 74 TRP H A 73 THR HB 1.0 . 3.15 169 156 A 74 TRP H A 74 TRP HBx 1.0 . 2.92 170 156 A 74 TRP H A 74 TRP HBy 1.0 . 2.92 171 157 A 74 TRP H A 29 MET HGy 1.0 . 5.17 172 158 A 74 TRP H A 73 THR HG2% 1.0 . 4.38 173 159 A 74 TRP H A 71 LEU HDy% 1.0 . 5.50 174 160 A 74 TRP H A 58 LEU HDy% 1.0 . 4.89 175 161 A 12 CYS H A 13 LYS H 1.0 . 3.44 176 162 A 13 LYS H A 14 THR H 1.0 . 3.36 177 163 A 12 CYS HA A 13 LYS H 1.0 . 3.46 178 164 A 13 LYS H A 20 SER HB2 1.0 . 4.39 179 164 A 13 LYS H A 20 SER HB3 1.0 . 4.39 180 165 A 12 CYS HBy A 13 LYS H 1.0 . 3.52 181 166 A 13 LYS H A 13 LYS HB2 1.0 . 2.81 182 166 A 13 LYS H A 13 LYS HB3 1.0 . 2.81 183 167 A 13 LYS H A 13 LYS HD2 1.0 . 4.63 184 168 A 13 LYS H A 13 LYS HGy 1.0 . 3.78 185 169 A 13 LYS HGx A 13 LYS H 1.0 . 4.29 186 170 A 22 SER HBy A 23 LYS H 1.0 . 4.80 187 171 A 23 LYS H A 22 SER HBx 1.0 . 4.91 188 172 A 23 LYS H A 23 LYS HGx 1.0 . 5.19 189 172 A 23 LYS H A 23 LYS HGy 1.0 . 5.19 190 173 A 70 GLU H A 72 LYS H 1.0 . 4.76 191 174 A 72 LYS H A 71 LEU H 1.0 . 3.40 192 175 A 72 LYS H A 68 SER HA 1.0 . 4.91 193 176 A 72 LYS H A 69 GLY HAy 1.0 . 4.78 194 177 A 72 LYS H A 69 GLY HAx 1.0 . 4.05 195 178 A 72 LYS H A 74 TRP HBx 1.0 . 5.50 196 178 A 74 TRP HBy A 72 LYS H 1.0 . 5.50 197 179 A 72 LYS H A 72 LYS HBx 1.0 . 2.82 198 179 A 72 LYS H A 72 LYS HBy 1.0 . 2.82 199 180 A 72 LYS H A 72 LYS HD2 1.0 . 4.24 200 180 A 72 LYS H A 72 LYS HD3 1.0 . 4.24 201 181 A 72 LYS H A 71 LEU HDx% 1.0 . 4.75 202 182 A 15 TYR HE% A 83 ALA H 1.0 . 5.50 203 183 A 7 VAL H A 46 TYR HE% 1.0 . 5.50 204 184 A 7 VAL H A 3 ALA HA 1.0 . 4.77 205 185 A 7 VAL H A 6 LYS HA 1.0 . 3.50 206 186 A 7 VAL H A 5 ILE HA 1.0 . 5.34 207 187 A 7 VAL H A 6 LYS HE2 1.0 . 5.50 208 187 A 7 VAL H A 6 LYS HE3 1.0 . 5.50 209 188 A 7 VAL H A 7 VAL HB 1.0 . 3.14 210 189 A 7 VAL H A 6 LYS HBx 1.0 . 3.31 211 189 A 7 VAL H A 6 LYS HBy 1.0 . 3.31 212 190 A 7 VAL H A 7 VAL HGy% 1.0 . 3.43 213 191 A 7 VAL H A 7 VAL HGx% 1.0 . 4.13 214 192 A 81 LEU H A 83 ALA H 1.0 . 5.27 215 193 A 83 ALA H A 84 ALA H 1.0 . 3.44 216 194 A 83 ALA H A 15 TYR HD% 1.0 . 4.48 217 195 A 83 ALA H A 80 ALA HA 1.0 . 4.03 218 196 A 83 ALA H A 79 GLY HAx 1.0 . 5.19 219 197 A 83 ALA H A 82 LYS HBy 1.0 . 3.91 220 198 A 83 ALA H A 82 LYS HBx 1.0 . 3.57 221 199 A 83 ALA H A 83 ALA HB% 1.0 . 3.24 222 200 A 78 LEU H A 76 LEU H 1.0 . 4.70 223 201 A 76 LEU H A 77 VAL H 1.0 . 3.22 224 202 A 76 LEU H A 74 TRP HA 1.0 . 5.50 225 203 A 76 LEU H A 76 LEU HBy 1.0 . 3.24 226 204 A 76 LEU H A 76 LEU HG 1.0 . 3.34 227 205 A 76 LEU H A 72 LYS HD2 1.0 . 5.22 228 205 A 76 LEU H A 72 LYS HD3 1.0 . 5.22 229 206 A 76 LEU H A 76 LEU HBx 1.0 . 3.63 230 207 A 76 LEU H A 73 THR HG2% 1.0 . 5.50 231 208 A 76 LEU H A 76 LEU HDx% 1.0 . 3.92 232 209 A 58 LEU H A 57 ALA H 1.0 . 3.46 233 210 A 57 ALA H A 55 THR HB 1.0 . 5.17 234 211 A 57 ALA H A 53 PRO HA 1.0 . 4.50 235 212 A 57 ALA H A 55 THR HA 1.0 . 5.50 236 213 A 57 ALA H A 54 ILE HA 1.0 . 3.99 237 214 A 57 ALA H A 60 GLN HB2 1.0 . 5.50 238 214 A 57 ALA H A 60 GLN HB3 1.0 . 5.50 239 215 A 57 ALA H A 58 LEU HG 1.0 . 4.54 240 216 A 57 ALA H A 57 ALA HB% 1.0 . 2.87 241 217 A 57 ALA H A 55 THR HG2% 1.0 . 5.50 242 218 A 38 LEU HDx% A 57 ALA H 1.0 . 4.73 243 219 A 57 ALA H A 54 ILE HG2% 1.0 . 5.50 244 220 A 25 GLU H A 23 LYS H 1.0 . 5.50 245 221 A 25 GLU H A 73 THR HG2% 1.0 . 5.50 246 222 A 25 GLU H A 24 LYS H 1.0 . 3.82 247 223 A 25 GLU H A 22 SER HA 1.0 . 5.33 248 224 A 25 GLU H A 22 SER HBy 1.0 . 4.86 249 225 A 25 GLU H A 23 LYS HA 1.0 . 5.50 250 226 A 26 ILE HA A 25 GLU H 1.0 . 5.50 251 227 A 25 GLU H A 25 GLU HBy 1.0 . 3.30 252 228 A 25 GLU H A 25 GLU HG2 1.0 . 3.28 253 228 A 25 GLU H A 25 GLU HG3 1.0 . 3.28 254 229 A 25 GLU H A 25 GLU HBx 1.0 . 3.66 255 230 A 25 GLU H A 24 LYS HBx 1.0 . 3.65 256 231 A 70 GLU H A 70 GLU HGx 1.0 . 4.04 257 232 A 70 GLU H A 70 GLU HBy 1.0 . 3.46 258 233 A 70 GLU H A 72 LYS HBx 1.0 . 5.38 259 233 A 70 GLU H A 72 LYS HBy 1.0 . 5.38 260 234 A 70 GLU H A 70 GLU HBx 1.0 . 3.75 261 235 A 32 LEU HDy% A 70 GLU H 1.0 . 5.50 262 236 A 59 SER H A 62 ALA H 1.0 . 5.50 263 237 A 62 ALA H A 64 ILE H 1.0 . 5.47 264 238 A 62 ALA H A 61 ARG HDy 1.0 . 5.50 265 239 A 62 ALA H A 61 ARG HDx 1.0 . 5.50 266 240 A 62 ALA H A 63 MET HGy 1.0 . 5.50 267 241 A 62 ALA H A 61 ARG HG2 1.0 . 4.07 268 241 A 62 ALA H A 61 ARG HG3 1.0 . 4.07 269 242 A 62 ALA H A 62 ALA HB% 1.0 . 3.20 270 243 A 62 ALA H A 67 LYS HGx 1.0 . 4.94 271 243 A 62 ALA H A 67 LYS HGy 1.0 . 4.94 272 244 A 71 LEU HDx% A 62 ALA H 1.0 . 4.84 273 245 A 68 SER HA A 62 ALA H 1.0 . 4.94 274 246 A 62 ALA H A 58 LEU HBx 1.0 . 5.50 275 247 A 74 TRP HE3 A 77 VAL H 1.0 . 5.19 276 248 A 79 GLY H A 77 VAL H 1.0 . 4.75 277 249 A 77 VAL H A 74 TRP HA 1.0 . 4.16 278 250 A 77 VAL H A 73 THR HA 1.0 . 5.25 279 251 A 77 VAL H A 29 MET HE% 1.0 . 5.50 280 252 A 77 VAL HB A 77 VAL H 1.0 . 2.98 281 253 A 76 LEU HG A 77 VAL H 1.0 . 4.70 282 254 A 77 VAL H A 76 LEU HBx 1.0 . 3.89 283 255 A 73 THR HG2% A 77 VAL H 1.0 . 5.50 284 256 A 77 VAL HGy% A 77 VAL H 1.0 . 3.41 285 257 A 77 VAL H A 77 VAL HGx% 1.0 . 4.08 286 258 A 78 LEU HBx A 77 VAL H 1.0 . 5.29 287 259 A 7 VAL H A 6 LYS H 1.0 . 3.45 288 260 A 3 ALA HA A 6 LYS H 1.0 . 3.90 289 261 A 6 LYS H A 7 VAL HA 1.0 . 5.50 290 262 A 6 LYS H A 6 LYS HE2 1.0 . 5.50 291 262 A 6 LYS HE3 A 6 LYS H 1.0 . 5.50 292 263 A 7 VAL HB A 6 LYS H 1.0 . 5.18 293 264 A 6 LYS H A 6 LYS HBx 1.0 . 2.90 294 264 A 6 LYS HBy A 6 LYS H 1.0 . 2.90 295 265 A 6 LYS H A 6 LYS HD2 1.0 . 4.24 296 265 A 6 LYS H A 6 LYS HD3 1.0 . 4.24 297 266 A 6 LYS HGx A 6 LYS H 1.0 . 3.98 298 267 A 6 LYS H A 6 LYS HGy 1.0 . 4.16 299 268 A 7 VAL HGy% A 6 LYS H 1.0 . 5.42 300 269 A 6 LYS H A 5 ILE HG2% 1.0 . 3.98 301 270 A 86 GLU H A 86 GLU HBy 1.0 . 4.09 302 271 A 86 GLU H A 86 GLU HBx 1.0 . 3.25 303 272 A 86 GLU H A 86 GLU HGx 1.0 . 4.26 304 273 A 52 ASP H A 51 TRP HE3 1.0 . 5.50 305 274 A 52 ASP H A 54 ILE H 1.0 . 5.33 306 275 A 52 ASP H A 51 TRP HD1 1.0 . 5.50 307 276 A 52 ASP H A 53 PRO HDx 1.0 . 3.44 308 277 A 52 ASP H A 51 TRP HBy 1.0 . 3.81 309 278 A 52 ASP H A 52 ASP HBy 1.0 . 3.59 310 279 A 52 ASP HBx A 52 ASP H 1.0 . 3.87 311 280 A 52 ASP H A 53 PRO HGy 1.0 . 5.50 312 281 A 52 ASP H A 50 SER H 1.0 . 5.39 313 282 A 78 LEU H A 77 VAL H 1.0 . 3.50 314 283 A 78 LEU H A 74 TRP HE3 1.0 . 4.90 315 284 A 78 LEU H A 79 GLY H 1.0 . 3.70 316 285 A 78 LEU H A 74 TRP HZ3 1.0 . 5.50 317 286 A 78 LEU H A 74 TRP HA 1.0 . 4.45 318 287 A 78 LEU H A 76 LEU HA 1.0 . 5.36 319 288 A 78 LEU H A 79 GLY HAy 1.0 . 5.50 320 289 A 78 LEU H A 77 VAL HB 1.0 . 3.35 321 290 A 78 LEU H A 76 LEU HBx 1.0 . 5.45 322 291 A 78 LEU H A 77 VAL HGy% 1.0 . 4.21 323 292 A 78 LEU H A 78 LEU HBy 1.0 . 3.01 324 293 A 78 LEU H A 78 LEU HDy% 1.0 . 4.61 325 294 A 78 LEU H A 78 LEU HDx% 1.0 . 4.69 326 295 A 78 LEU H A 78 LEU HBx 1.0 . 3.25 327 296 A 23 LYS H A 24 LYS H 1.0 . 5.44 328 297 A 24 LYS H A 22 SER HA 1.0 . 5.50 329 298 A 22 SER HBy A 24 LYS H 1.0 . 4.81 330 299 A 24 LYS H A 24 LYS HBy 1.0 . 3.66 331 300 A 24 LYS H A 24 LYS HBx 1.0 . 3.91 332 301 A 24 LYS HGx A 24 LYS H 1.0 . 5.50 333 302 A 8 ILE H A 10 SER H 1.0 . 4.97 334 303 A 6 LYS H A 8 ILE H 1.0 . 5.23 335 304 A 7 VAL H A 8 ILE H 1.0 . 3.43 336 305 A 6 LYS HA A 8 ILE H 1.0 . 4.49 337 306 A 5 ILE HA A 8 ILE H 1.0 . 4.26 338 307 A 7 VAL HB A 8 ILE H 1.0 . 3.44 339 308 A 8 ILE H A 8 ILE HB 1.0 . 2.83 340 309 A 11 ALA HB% A 8 ILE H 1.0 . 5.50 341 310 A 8 ILE H A 8 ILE HG1x 1.0 . 3.65 342 311 A 7 VAL HGx% A 8 ILE H 1.0 . 3.63 343 312 A 8 ILE H A 8 ILE HD1% 1.0 . 4.01 344 313 A 29 MET H A 32 LEU H 1.0 . 5.36 345 314 A 29 MET H A 27 GLY HAy 1.0 . 4.61 346 315 A 29 MET H A 27 GLY HAx 1.0 . 4.91 347 316 A 29 MET H A 26 ILE HA 1.0 . 4.08 348 317 A 29 MET H A 29 MET HBy 1.0 . 3.29 349 318 A 29 MET H A 29 MET HBx 1.0 . 3.23 350 319 A 29 MET H A 29 MET HE% 1.0 . 4.70 351 320 A 29 MET H A 30 LEU HBy 1.0 . 4.21 352 321 A 29 MET H A 28 ALA HB% 1.0 . 3.63 353 322 A 29 MET H A 73 THR HG2% 1.0 . 5.50 354 323 A 29 MET H A 26 ILE HG2% 1.0 . 5.50 355 324 A 70 GLU H A 71 LEU H 1.0 . 3.49 356 325 A 73 THR H A 71 LEU H 1.0 . 5.22 357 326 A 71 LEU H A 68 SER HA 1.0 . 4.17 358 327 A 71 LEU H A 74 TRP HBx 1.0 . 5.15 359 327 A 74 TRP HBy A 71 LEU H 1.0 . 5.15 360 328 A 71 LEU H A 70 GLU HBy 1.0 . 4.08 361 329 A 71 LEU H A 71 LEU HBy 1.0 . 3.20 362 330 A 71 LEU H A 70 GLU HBx 1.0 . 3.81 363 331 A 71 LEU H A 58 LEU HBx 1.0 . 4.70 364 332 A 58 LEU HDy% A 71 LEU H 1.0 . 5.50 365 333 A 3 ALA H A 5 ILE H 1.0 . 5.50 366 334 A 6 LYS H A 5 ILE H 1.0 . 3.51 367 335 A 4 VAL H A 5 ILE H 1.0 . 3.28 368 336 A 5 ILE H A 2 GLU HA 1.0 . 3.82 369 337 A 5 ILE H A 1 SER HA 1.0 . 5.18 370 338 A 5 ILE H A 1 SER HBx 1.0 . 5.50 371 339 A 5 ILE H A 6 LYS HE2 1.0 . 5.50 372 339 A 6 LYS HE3 A 5 ILE H 1.0 . 5.50 373 340 A 5 ILE H A 2 GLU HG2 1.0 . 5.50 374 340 A 2 GLU HG3 A 5 ILE H 1.0 . 5.50 375 341 A 5 ILE H A 5 ILE HB 1.0 . 2.98 376 342 A 5 ILE H A 5 ILE HG1y 1.0 . 3.32 377 343 A 6 LYS HGx A 5 ILE H 1.0 . 5.39 378 344 A 3 ALA HB% A 5 ILE H 1.0 . 4.82 379 345 A 58 LEU H A 61 ARG H 1.0 . 5.50 380 346 A 59 SER H A 61 ARG H 1.0 . 4.96 381 347 A 64 ILE H A 61 ARG H 1.0 . 5.50 382 348 A 61 ARG H A 59 SER HA 1.0 . 5.36 383 349 A 61 ARG HDy A 61 ARG H 1.0 . 5.13 384 350 A 61 ARG HDx A 61 ARG H 1.0 . 4.98 385 351 A 61 ARG H A 60 GLN HGy 1.0 . 5.05 386 351 A 60 GLN HGx A 61 ARG H 1.0 . 5.05 387 352 A 61 ARG H A 60 GLN HB2 1.0 . 3.39 388 352 A 60 GLN HB3 A 61 ARG H 1.0 . 3.39 389 353 A 61 ARG H A 61 ARG HBy 1.0 . 3.13 390 354 A 61 ARG H A 64 ILE HG1y 1.0 . 5.39 391 355 A 62 ALA HB% A 61 ARG H 1.0 . 4.89 392 356 A 58 LEU HBx A 61 ARG H 1.0 . 5.50 393 357 A 61 ARG H A 58 LEU HDx% 1.0 . 5.49 394 358 A 82 LYS H A 84 ALA H 1.0 . 4.64 395 359 A 15 TYR HE% A 84 ALA H 1.0 . 5.50 396 360 A 84 ALA H A 81 LEU HA 1.0 . 3.78 397 361 A 84 ALA H A 80 ALA HA 1.0 . 4.64 398 362 A 84 ALA H A 85 ARG HGy 1.0 . 5.40 399 363 A 84 ALA H A 84 ALA HB% 1.0 . 3.09 400 364 A 84 ALA H A 83 ALA HB% 1.0 . 3.65 401 365 A 84 ALA H A 81 LEU HDx% 1.0 . 5.50 402 366 A 29 MET H A 30 LEU H 1.0 . 3.48 403 367 A 32 LEU H A 30 LEU H 1.0 . 5.44 404 368 A 30 LEU H A 28 ALA HA 1.0 . 5.10 405 369 A 27 GLY HAx A 30 LEU H 1.0 . 4.16 406 370 A 26 ILE HA A 30 LEU H 1.0 . 4.72 407 371 A 29 MET HBy A 30 LEU H 1.0 . 3.58 408 372 A 29 MET HBx A 30 LEU H 1.0 . 3.81 409 373 A 29 MET HE% A 30 LEU H 1.0 . 4.25 410 374 A 30 LEU HBy A 30 LEU H 1.0 . 2.93 411 375 A 30 LEU H A 30 LEU HBx 1.0 . 3.47 412 376 A 73 THR HG2% A 30 LEU H 1.0 . 5.50 413 377 A 30 LEU H A 30 LEU HDy% 1.0 . 3.99 414 378 A 56 ALA H A 54 ILE H 1.0 . 4.61 415 379 A 57 ALA H A 54 ILE H 1.0 . 5.41 416 380 A 54 ILE H A 51 TRP HA 1.0 . 5.21 417 381 A 55 THR HB A 54 ILE H 1.0 . 5.05 418 382 A 54 ILE H A 53 PRO HDx 1.0 . 4.07 419 383 A 51 TRP HBy A 54 ILE H 1.0 . 5.50 420 384 A 54 ILE H A 53 PRO HGy 1.0 . 5.50 421 385 A 54 ILE H A 54 ILE HG1y 1.0 . 3.42 422 386 A 54 ILE HB A 54 ILE H 1.0 . 3.19 423 387 A 57 ALA HB% A 54 ILE H 1.0 . 5.50 424 388 A 38 LEU HDx% A 54 ILE H 1.0 . 5.03 425 389 A 54 ILE HD1% A 54 ILE H 1.0 . 3.70 426 390 A 54 ILE HG2% A 54 ILE H 1.0 . 4.32 427 391 A 67 LYS H A 68 SER H 1.0 . 5.25 428 392 A 67 LYS H A 65 LEU HA 1.0 . 5.50 429 393 A 67 LYS H A 62 ALA HA 1.0 . 3.59 430 394 A 67 LYS H A 67 LYS HBy 1.0 . 4.02 431 395 A 67 LYS H A 65 LEU HBy 1.0 . 4.14 432 396 A 67 LYS H A 65 LEU HBx 1.0 . 3.45 433 397 A 67 LYS H A 67 LYS HGx 1.0 . 3.95 434 397 A 67 LYS HGy A 67 LYS H 1.0 . 3.95 435 398 A 67 LYS H A 65 LEU HDy% 1.0 . 5.44 436 399 A 81 LEU H A 84 ALA H 1.0 . 5.50 437 400 A 80 ALA H A 81 LEU H 1.0 . 3.38 438 401 A 81 LEU H A 79 GLY HAx 1.0 . 5.50 439 402 A 77 VAL HA A 81 LEU H 1.0 . 5.08 440 403 A 78 LEU HA A 81 LEU H 1.0 . 3.97 441 404 A 81 LEU HG A 81 LEU H 1.0 . 3.27 442 405 A 80 ALA HB% A 81 LEU H 1.0 . 3.62 443 406 A 81 LEU H A 81 LEU HBx 1.0 . 3.16 444 407 A 8 ILE HG2% A 81 LEU H 1.0 . 5.01 445 408 A 81 LEU H A 81 LEU HDx% 1.0 . 3.94 446 409 A 81 LEU H A 81 LEU HDy% 1.0 . 4.25 447 410 A 78 LEU HDx% A 81 LEU H 1.0 . 5.33 448 411 A 38 LEU H A 39 LEU H 1.0 . 3.23 449 412 A 38 LEU H A 39 LEU HA 1.0 . 4.98 450 413 A 38 LEU H A 34 GLN HA 1.0 . 4.11 451 414 A 38 LEU H A 36 GLU HBy 1.0 . 4.45 452 415 A 38 LEU H A 34 GLN HB2 1.0 . 5.44 453 415 A 38 LEU H A 34 GLN HB3 1.0 . 5.44 454 416 A 38 LEU H A 33 LEU HBy 1.0 . 4.97 455 417 A 38 LEU H A 36 GLU HBx 1.0 . 4.14 456 418 A 38 LEU H A 38 LEU HBy 1.0 . 3.31 457 419 A 38 LEU H A 38 LEU HG 1.0 . 3.33 458 420 A 38 LEU H A 38 LEU HDx% 1.0 . 3.89 459 421 A 4 VAL H A 1 SER HA 1.0 . 5.29 460 422 A 4 VAL H A 1 SER HBx 1.0 . 4.74 461 423 A 4 VAL H A 5 ILE HA 1.0 . 5.50 462 424 A 4 VAL H A 5 ILE HG1y 1.0 . 4.82 463 425 A 4 VAL H A 3 ALA HB% 1.0 . 3.83 464 426 A 4 VAL H A 4 VAL HB 1.0 . 3.15 465 427 A 4 VAL H A 6 LYS HGx 1.0 . 5.50 466 428 A 26 ILE H A 22 SER H 1.0 . 5.28 467 429 A 25 GLU H A 22 SER H 1.0 . 4.11 468 430 A 22 SER HBy A 22 SER H 1.0 . 3.77 469 431 A 22 SER HBx A 22 SER H 1.0 . 3.20 470 432 A 22 SER H A 21 PRO HDy 1.0 . 5.50 471 433 A 25 GLU HBy A 22 SER H 1.0 . 3.20 472 434 A 22 SER H A 25 GLU HG2 1.0 . 3.92 473 434 A 25 GLU HG3 A 22 SER H 1.0 . 3.92 474 435 A 25 GLU HBx A 22 SER H 1.0 . 3.73 475 436 A 22 SER H A 21 PRO HBx 1.0 . 3.81 476 437 A 73 THR HG2% A 22 SER H 1.0 . 5.50 477 438 A 26 ILE HD1% A 22 SER H 1.0 . 5.50 478 439 A 56 ALA H A 55 THR H 1.0 . 3.38 479 440 A 57 ALA H A 55 THR H 1.0 . 4.87 480 441 A 54 ILE H A 55 THR H 1.0 . 3.28 481 442 A 52 ASP HA A 55 THR H 1.0 . 4.03 482 443 A 55 THR HB A 55 THR H 1.0 . 3.14 483 444 A 51 TRP HBy A 55 THR H 1.0 . 5.17 484 445 A 54 ILE HB A 55 THR H 1.0 . 3.37 485 446 A 56 ALA HB% A 55 THR H 1.0 . 4.68 486 447 A 55 THR HG2% A 55 THR H 1.0 . 4.31 487 448 A 38 LEU HDx% A 55 THR H 1.0 . 5.50 488 449 A 54 ILE HD1% A 55 THR H 1.0 . 4.58 489 450 A 54 ILE HG2% A 55 THR H 1.0 . 4.25 490 451 A 64 ILE H A 65 LEU HA 1.0 . 5.50 491 452 A 64 ILE H A 60 GLN HGy 1.0 . 5.50 492 452 A 60 GLN HGx A 64 ILE H 1.0 . 5.50 493 453 A 64 ILE H A 63 MET HBx 1.0 . 3.50 494 454 A 64 ILE H A 64 ILE HB 1.0 . 3.23 495 455 A 64 ILE H A 64 ILE HG1y 1.0 . 3.74 496 456 A 64 ILE H A 62 ALA HB% 1.0 . 5.32 497 457 A 64 ILE H A 64 ILE HG1x 1.0 . 3.86 498 458 A 64 ILE H A 62 ALA HA 1.0 . 5.33 499 459 A 64 ILE H A 63 MET HGy 1.0 . 5.50 500 460 A 64 ILE H A 63 MET HGx 1.0 . 5.40 501 461 A 64 ILE H A 64 ILE HG2% 1.0 . 4.25 502 462 A 82 LYS H A 81 LEU H 1.0 . 3.45 503 463 A 82 LYS H A 83 ALA H 1.0 . 3.34 504 464 A 82 LYS H A 79 GLY H 1.0 . 5.50 505 465 A 82 LYS H A 80 ALA HA 1.0 . 5.07 506 466 A 82 LYS H A 79 GLY HAx 1.0 . 4.51 507 467 A 82 LYS H A 78 LEU HA 1.0 . 4.56 508 468 A 82 LYS H A 82 LYS HEx 1.0 . 5.50 509 469 A 82 LYS H A 82 LYS HBy 1.0 . 4.19 510 470 A 82 LYS H A 82 LYS HBx 1.0 . 3.15 511 471 A 82 LYS H A 81 LEU HBx 1.0 . 3.04 512 472 A 82 LYS H A 83 ALA HB% 1.0 . 5.50 513 473 A 82 LYS H A 81 LEU HDy% 1.0 . 5.50 514 474 A 82 LYS H A 78 LEU HDx% 1.0 . 4.77 515 475 A 44 ASP H A 45 LEU H 1.0 . 3.45 516 476 A 45 LEU H A 43 SER H 1.0 . 4.29 517 477 A 45 LEU H A 46 TYR H 1.0 . 3.69 518 478 A 42 PRO HA A 45 LEU H 1.0 . 4.51 519 479 A 43 SER HBy A 45 LEU H 1.0 . 5.19 520 480 A 45 LEU H A 43 SER HA 1.0 . 4.09 521 481 A 44 ASP HBy A 45 LEU H 1.0 . 4.11 522 482 A 44 ASP HBx A 45 LEU H 1.0 . 4.49 523 483 A 45 LEU HBx A 45 LEU H 1.0 . 3.43 524 484 A 39 LEU HDx% A 45 LEU H 1.0 . 3.75 525 485 A 15 TYR H A 16 CYS H 1.0 . 3.26 526 486 A 13 LYS H A 15 TYR H 1.0 . 5.07 527 487 A 15 TYR HD% A 15 TYR H 1.0 . 4.11 528 488 A 15 TYR HE% A 15 TYR H 1.0 . 5.20 529 489 A 12 CYS HA A 15 TYR H 1.0 . 4.63 530 490 A 15 TYR H A 14 THR HB 1.0 . 3.27 531 491 A 80 ALA HA A 15 TYR H 1.0 . 4.94 532 492 A 15 TYR H A 15 TYR HBy 1.0 . 3.66 533 493 A 15 TYR H A 15 TYR HBx 1.0 . 3.35 534 494 A 15 TYR H A 13 LYS HB2 1.0 . 5.30 535 494 A 13 LYS HB3 A 15 TYR H 1.0 . 5.30 536 495 A 80 ALA HB% A 15 TYR H 1.0 . 4.48 537 496 A 15 TYR H A 14 THR HG2% 1.0 . 4.30 538 497 A 58 LEU H A 59 SER H 1.0 . 3.42 539 498 A 60 GLN H A 59 SER H 1.0 . 3.29 540 499 A 59 SER H A 59 SER HBy 1.0 . 3.15 541 500 A 59 SER HBx A 59 SER H 1.0 . 3.52 542 501 A 55 THR HA A 59 SER H 1.0 . 4.67 543 502 A 59 SER H A 60 GLN HB2 1.0 . 4.54 544 502 A 60 GLN HB3 A 59 SER H 1.0 . 4.54 545 503 A 59 SER H A 61 ARG HBy 1.0 . 5.50 546 504 A 59 SER H A 58 LEU HBy 1.0 . 3.81 547 505 A 58 LEU HG A 59 SER H 1.0 . 4.47 548 506 A 59 SER H A 58 LEU HBx 1.0 . 4.15 549 507 A 71 LEU HDy% A 59 SER H 1.0 . 4.44 550 508 A 73 THR H A 70 GLU H 1.0 . 5.50 551 509 A 73 THR H A 72 LYS H 1.0 . 3.49 552 510 A 73 THR H A 73 THR HB 1.0 . 3.04 553 511 A 73 THR H A 74 TRP HBx 1.0 . 4.58 554 511 A 73 THR H A 74 TRP HBy 1.0 . 4.58 555 512 A 73 THR H A 72 LYS HBx 1.0 . 3.20 556 512 A 73 THR H A 72 LYS HBy 1.0 . 3.20 557 513 A 73 THR H A 72 LYS HD2 1.0 . 5.50 558 513 A 73 THR H A 72 LYS HD3 1.0 . 5.50 559 514 A 73 THR H A 73 THR HG2% 1.0 . 4.47 560 515 A 73 THR H A 76 LEU HDy% 1.0 . 5.50 561 516 A 35 LYS H A 34 GLN H 1.0 . 3.50 562 517 A 32 LEU H A 34 GLN H 1.0 . 5.50 563 518 A 34 GLN H A 31 SER HA 1.0 . 4.16 564 519 A 34 GLN HGy A 34 GLN H 1.0 . 3.82 565 520 A 34 GLN H A 34 GLN HB2 1.0 . 3.09 566 520 A 34 GLN HB3 A 34 GLN H 1.0 . 3.09 567 521 A 39 LEU HDy% A 34 GLN H 1.0 . 5.06 568 522 A 33 LEU HBx A 34 GLN H 1.0 . 4.19 569 523 A 58 LEU H A 59 SER HA 1.0 . 5.39 570 524 A 58 LEU H A 55 THR HA 1.0 . 4.63 571 525 A 58 LEU H A 54 ILE HA 1.0 . 5.05 572 526 A 58 LEU H A 61 ARG HBy 1.0 . 5.41 573 527 A 58 LEU H A 58 LEU HBy 1.0 . 3.39 574 528 A 58 LEU H A 58 LEU HG 1.0 . 3.33 575 529 A 58 LEU H A 57 ALA HB% 1.0 . 3.69 576 530 A 58 LEU H A 58 LEU HBx 1.0 . 3.80 577 531 A 58 LEU H A 71 LEU HDy% 1.0 . 5.27 578 532 A 58 LEU H A 38 LEU HDy% 1.0 . 5.05 579 533 A 58 LEU H A 58 LEU HDx% 1.0 . 4.22 580 534 A 58 LEU H A 54 ILE HG2% 1.0 . 5.14 581 535 A 76 LEU H A 73 THR H 1.0 . 5.50 582 536 A 64 ILE H A 65 LEU H 1.0 . 3.40 583 537 A 67 LYS H A 65 LEU H 1.0 . 4.74 584 538 A 65 LEU H A 63 MET HA 1.0 . 4.88 585 539 A 62 ALA HA A 65 LEU H 1.0 . 4.35 586 540 A 65 LEU HBy A 65 LEU H 1.0 . 3.16 587 541 A 65 LEU HBx A 65 LEU H 1.0 . 3.59 588 542 A 64 ILE HG1x A 65 LEU H 1.0 . 5.26 589 543 A 64 ILE HG2% A 65 LEU H 1.0 . 3.78 590 544 A 9 SER H A 10 SER H 1.0 . 3.36 591 545 A 12 CYS H A 10 SER H 1.0 . 4.35 592 546 A 13 LYS H A 10 SER H 1.0 . 4.69 593 547 A 7 VAL H A 10 SER H 1.0 . 5.50 594 548 A 10 SER HBy A 10 SER H 1.0 . 2.92 595 549 A 7 VAL HA A 10 SER H 1.0 . 3.97 596 550 A 12 CYS HBy A 10 SER H 1.0 . 5.50 597 551 A 10 SER H A 8 ILE HB 1.0 . 4.95 598 552 A 11 ALA HB% A 10 SER H 1.0 . 4.94 599 553 A 8 ILE HG2% A 10 SER H 1.0 . 4.82 600 554 A 26 ILE HD1% A 10 SER H 1.0 . 5.45 601 555 A 12 CYS H A 14 THR H 1.0 . 5.18 602 556 A 12 CYS H A 10 SER HBy 1.0 . 5.50 603 557 A 12 CYS H A 9 SER HA 1.0 . 4.44 604 558 A 12 CYS H A 8 ILE HA 1.0 . 4.27 605 559 A 12 CYS H A 12 CYS HBy 1.0 . 3.30 606 560 A 12 CYS H A 13 LYS HB2 1.0 . 5.00 607 560 A 12 CYS H A 13 LYS HB3 1.0 . 5.00 608 561 A 12 CYS H A 13 LYS HD2 1.0 . 5.50 609 562 A 12 CYS H A 11 ALA HB% 1.0 . 3.65 610 563 A 12 CYS H A 8 ILE HG2% 1.0 . 4.93 611 564 A 31 SER H A 33 LEU H 1.0 . 5.11 612 565 A 32 LEU H A 33 LEU H 1.0 . 3.53 613 566 A 33 LEU H A 30 LEU HA 1.0 . 3.94 614 567 A 33 LEU HG A 33 LEU H 1.0 . 3.26 615 568 A 33 LEU HBy A 33 LEU H 1.0 . 3.58 616 569 A 32 LEU HBx A 33 LEU H 1.0 . 4.03 617 570 A 32 LEU HG A 33 LEU H 1.0 . 4.80 618 571 A 33 LEU HBx A 33 LEU H 1.0 . 3.81 619 572 A 32 LEU HDx% A 33 LEU H 1.0 . 4.51 620 573 A 33 LEU H A 33 LEU HDy% 1.0 . 4.03 621 574 A 33 LEU HDx% A 33 LEU H 1.0 . 4.11 622 575 A 64 ILE H A 63 MET H 1.0 . 3.32 623 576 A 63 MET HGy A 63 MET H 1.0 . 3.98 624 577 A 63 MET HGx A 63 MET H 1.0 . 4.10 625 578 A 63 MET H A 60 GLN HGy 1.0 . 5.12 626 578 A 60 GLN HGx A 63 MET H 1.0 . 5.12 627 579 A 63 MET H A 63 MET HBx 1.0 . 2.91 628 580 A 64 ILE HB A 63 MET H 1.0 . 4.69 629 581 A 62 ALA HB% A 63 MET H 1.0 . 3.50 630 582 A 71 LEU HDx% A 63 MET H 1.0 . 5.47 631 583 A 68 SER H A 67 LYS HGx 1.0 . 5.50 632 583 A 67 LYS HGy A 68 SER H 1.0 . 5.50 633 584 A 68 SER H A 67 LYS HBy 1.0 . 5.50 634 585 A 13 LYS H A 16 CYS H 1.0 . 5.50 635 586 A 16 CYS H A 17 GLY H 1.0 . 3.22 636 587 A 15 TYR HD% A 16 CYS H 1.0 . 4.64 637 588 A 12 CYS HA A 16 CYS H 1.0 . 3.83 638 589 A 16 CYS H A 15 TYR HBy 1.0 . 3.46 639 590 A 16 CYS H A 16 CYS HBx 1.0 . 3.29 640 591 A 80 ALA HB% A 16 CYS H 1.0 . 5.09 641 592 A 16 CYS H A 14 THR HG2% 1.0 . 5.50 642 593 A 18 LYS H A 20 SER H 1.0 . 5.50 643 594 A 17 GLY H A 20 SER H 1.0 . 5.50 644 595 A 20 SER H A 19 THR H 1.0 . 3.24 645 596 A 20 SER H A 19 THR HA 1.0 . 3.32 646 597 A 20 SER H A 20 SER HB2 1.0 . 2.93 647 597 A 20 SER HB3 A 20 SER H 1.0 . 2.93 648 598 A 20 SER H A 16 CYS HBy 1.0 . 4.20 649 599 A 16 CYS HBx A 20 SER H 1.0 . 4.30 650 600 A 20 SER H A 19 THR HG2% 1.0 . 4.84 651 601 A 76 LEU HDx% A 20 SER H 1.0 . 5.50 652 602 A 39 LEU H A 40 MET H 1.0 . 4.68 653 603 A 39 LEU H A 34 GLN HA 1.0 . 3.95 654 604 A 39 LEU H A 37 GLY HAx 1.0 . 5.50 655 605 A 39 LEU H A 38 LEU HBy 1.0 . 3.92 656 606 A 39 LEU H A 39 LEU HG 1.0 . 4.60 657 607 A 39 LEU H A 39 LEU HBx 1.0 . 3.87 658 608 A 39 LEU HDy% A 39 LEU H 1.0 . 4.82 659 609 A 39 LEU H A 38 LEU HDy% 1.0 . 5.08 660 610 A 9 SER H A 8 ILE H 1.0 . 3.53 661 611 A 9 SER H A 6 LYS H 1.0 . 4.89 662 612 A 9 SER H A 7 VAL H 1.0 . 4.79 663 613 A 9 SER H A 10 SER HA 1.0 . 5.50 664 614 A 9 SER H A 9 SER HB2 1.0 . 2.84 665 614 A 9 SER H A 9 SER HB3 1.0 . 2.84 666 615 A 9 SER H A 5 ILE HA 1.0 . 4.52 667 616 A 9 SER H A 7 VAL HB 1.0 . 5.16 668 617 A 9 SER H A 8 ILE HB 1.0 . 3.32 669 618 A 9 SER H A 8 ILE HG1x 1.0 . 5.21 670 619 A 9 SER H A 8 ILE HG2% 1.0 . 3.89 671 620 A 50 SER H A 51 TRP HD1 1.0 . 4.77 672 621 A 50 SER H A 51 TRP HA 1.0 . 5.50 673 622 A 50 SER HBy A 50 SER H 1.0 . 3.46 674 623 A 50 SER H A 50 SER HBx 1.0 . 3.68 675 624 A 50 SER H A 51 TRP HBy 1.0 . 5.05 676 625 A 50 SER H A 48 PRO HA 1.0 . 4.59 677 626 A 50 SER H A 54 ILE HD1% 1.0 . 5.50 678 627 A 36 GLU H A 38 LEU HG 1.0 . 4.69 679 628 A 35 LYS H A 36 GLU H 1.0 . 3.57 680 629 A 36 GLU H A 33 LEU HA 1.0 . 4.29 681 630 A 36 GLU H A 36 GLU HBy 1.0 . 3.24 682 631 A 36 GLU H A 35 LYS HB2 1.0 . 3.47 683 631 A 36 GLU H A 35 LYS HB3 1.0 . 3.47 684 632 A 36 GLU H A 36 GLU HBx 1.0 . 3.36 685 633 A 36 GLU H A 35 LYS HG2 1.0 . 4.61 686 633 A 36 GLU H A 35 LYS HG3 1.0 . 4.61 687 634 A 36 GLU H A 32 LEU HDx% 1.0 . 5.17 688 635 A 36 GLU H A 33 LEU HDx% 1.0 . 5.50 689 636 A 14 THR H A 16 CYS H 1.0 . 5.35 690 637 A 14 THR H A 15 TYR H 1.0 . 3.87 691 638 A 14 THR H A 15 TYR HD% 1.0 . 5.41 692 639 A 14 THR H A 15 TYR HE% 1.0 . 5.50 693 640 A 14 THR H A 11 ALA HA 1.0 . 4.05 694 641 A 12 CYS HA A 14 THR H 1.0 . 4.40 695 642 A 14 THR H A 14 THR HB 1.0 . 2.94 696 643 A 12 CYS HBy A 14 THR H 1.0 . 5.05 697 644 A 14 THR H A 15 TYR HBx 1.0 . 5.15 698 645 A 14 THR H A 13 LYS HB2 1.0 . 3.21 699 645 A 14 THR H A 13 LYS HB3 1.0 . 3.21 700 646 A 11 ALA HB% A 14 THR H 1.0 . 5.05 701 647 A 13 LYS HGx A 14 THR H 1.0 . 4.96 702 648 A 14 THR H A 14 THR HG2% 1.0 . 4.09 703 649 A 49 GLY H A 47 SER H 1.0 . 5.50 704 650 A 47 SER H A 48 PRO HDx 1.0 . 5.44 705 651 A 45 LEU HBx A 47 SER H 1.0 . 5.40 706 652 A 40 MET H A 41 SER H 1.0 . 3.09 707 653 A 44 ASP H A 41 SER H 1.0 . 4.57 708 654 A 41 SER H A 40 MET HA 1.0 . 3.57 709 655 A 41 SER H A 42 PRO HDy 1.0 . 4.80 710 656 A 41 SER H A 41 SER HBy 1.0 . 3.64 711 657 A 41 SER HBx A 41 SER H 1.0 . 3.67 712 658 A 44 ASP HBy A 41 SER H 1.0 . 4.74 713 659 A 40 MET HGx A 41 SER H 1.0 . 5.50 714 660 A 40 MET HBy A 41 SER H 1.0 . 3.56 715 661 A 39 LEU HBy A 41 SER H 1.0 . 4.54 716 662 A 39 LEU HG A 41 SER H 1.0 . 5.16 717 663 A 39 LEU HBx A 41 SER H 1.0 . 5.01 718 664 A 39 LEU HDy% A 41 SER H 1.0 . 4.70 719 665 A 47 SER H A 44 ASP HA 1.0 . 4.52 720 666 A 47 SER H A 45 LEU HA 1.0 . 4.61 721 667 A 47 SER H A 47 SER HB2 1.0 . 3.02 722 667 A 47 SER H A 47 SER HB3 1.0 . 3.02 723 668 A 47 SER H A 46 TYR HBy 1.0 . 4.60 724 669 A 47 SER H A 46 TYR HBx 1.0 . 4.30 725 670 A 44 ASP HBx A 47 SER H 1.0 . 5.50 726 671 A 81 LEU HDy% A 47 SER H 1.0 . 5.50 727 672 A 30 LEU H A 31 SER H 1.0 . 3.39 728 673 A 34 GLN H A 31 SER H 1.0 . 5.48 729 674 A 29 MET H A 31 SER H 1.0 . 5.05 730 675 A 32 LEU H A 31 SER H 1.0 . 3.34 731 676 A 31 SER H A 31 SER HBy 1.0 . 3.26 732 677 A 27 GLY HAx A 31 SER H 1.0 . 4.63 733 678 A 29 MET HBy A 31 SER H 1.0 . 5.50 734 679 A 30 LEU HBy A 31 SER H 1.0 . 3.40 735 680 A 30 LEU HBx A 31 SER H 1.0 . 3.56 736 681 A 30 LEU HDy% A 31 SER H 1.0 . 4.48 737 682 A 68 SER H A 69 GLY H 1.0 . 5.50 738 683 A 69 GLY H A 68 SER HBy 1.0 . 5.50 739 684 A 51 TRP HE1 A 46 TYR H 1.0 . 5.50 740 685 A 44 ASP H A 46 TYR H 1.0 . 5.05 741 686 A 46 TYR H A 47 SER H 1.0 . 3.09 742 687 A 46 TYR HE% A 46 TYR H 1.0 . 5.50 743 688 A 46 TYR H A 44 ASP HA 1.0 . 4.50 744 689 A 46 TYR H A 47 SER HB2 1.0 . 4.58 745 689 A 46 TYR H A 47 SER HB3 1.0 . 4.58 746 690 A 46 TYR H A 43 SER HA 1.0 . 4.45 747 691 A 46 TYR H A 46 TYR HBy 1.0 . 3.72 748 692 A 46 TYR H A 46 TYR HBx 1.0 . 3.35 749 693 A 44 ASP HBx A 46 TYR H 1.0 . 5.45 750 694 A 46 TYR H A 45 LEU HG 1.0 . 5.50 751 695 A 46 TYR H A 45 LEU HBy 1.0 . 4.26 752 696 A 45 LEU HBx A 46 TYR H 1.0 . 4.10 753 697 A 46 TYR H A 45 LEU HDx% 1.0 . 5.50 754 698 A 81 LEU HDy% A 46 TYR H 1.0 . 5.50 755 699 A 60 GLN HA A 60 GLN HE22 1.0 . 5.19 756 700 A 60 GLN HE22 A 60 GLN HB2 1.0 . 5.50 757 700 A 60 GLN HB3 A 60 GLN HE22 1.0 . 5.50 758 701 A 64 ILE HG1y A 60 GLN HE22 1.0 . 5.50 759 702 A 60 GLN HE22 A 64 ILE HD1% 1.0 . 5.50 760 703 A 64 ILE HD1% A 60 GLN HE21 1.0 . 5.50 761 704 A 31 SER HA A 34 GLN HE21 1.0 . 5.50 762 705 A 34 GLN HE21 A 42 PRO HGx 1.0 . 5.49 763 706 A 34 GLN HE22 A 42 PRO HDx 1.0 . 5.09 764 707 A 39 LEU HDy% A 34 GLN HE22 1.0 . 5.11 765 708 A 41 SER HA A 34 GLN HE21 1.0 . 5.46 766 709 A 40 MET HA A 34 GLN HE21 1.0 . 4.99 767 710 A 34 GLN HA A 34 GLN HE21 1.0 . 5.50 768 711 A 34 GLN HE21 A 42 PRO HDx 1.0 . 5.36 769 712 A 34 GLN HE21 A 34 GLN HGx 1.0 . 4.04 770 713 A 39 LEU HDy% A 34 GLN HE21 1.0 . 5.40 771 714 A 41 SER HA A 34 GLN HE22 1.0 . 5.35 772 715 A 42 PRO HGx A 34 GLN HE22 1.0 . 5.22 773 716 A 18 LYS H A 19 THR H 1.0 . 5.13 774 717 A 19 THR H A 17 GLY HAy 1.0 . 4.90 775 718 A 19 THR H A 20 SER HB2 1.0 . 5.50 776 718 A 20 SER HB3 A 19 THR H 1.0 . 5.50 777 719 A 19 THR H A 16 CYS HBy 1.0 . 4.83 778 720 A 16 CYS HBx A 19 THR H 1.0 . 5.22 779 721 A 19 THR H A 18 LYS HBx 1.0 . 4.07 780 721 A 19 THR H A 18 LYS HBy 1.0 . 4.07 781 722 A 19 THR H A 18 LYS HD2 1.0 . 5.50 782 722 A 19 THR H A 18 LYS HD3 1.0 . 5.50 783 723 A 19 THR H A 18 LYS HG2 1.0 . 4.81 784 723 A 19 THR H A 18 LYS HG3 1.0 . 4.81 785 724 A 19 THR H A 19 THR HG2% 1.0 . 3.96 786 725 A 76 LEU HDx% A 19 THR H 1.0 . 5.50 787 726 A 49 GLY H A 51 TRP HE1 1.0 . 5.50 788 727 A 51 TRP HE1 A 47 SER H 1.0 . 4.79 789 728 A 74 TRP HH2 A 51 TRP HE1 1.0 . 4.41 790 729 A 51 TRP HE1 A 45 LEU HA 1.0 . 4.13 791 730 A 50 SER HBy A 51 TRP HE1 1.0 . 5.37 792 731 A 51 TRP HE1 A 45 LEU HG 1.0 . 5.24 793 732 A 48 PRO HA A 51 TRP HE1 1.0 . 4.67 794 733 A 51 TRP HE1 A 81 LEU HBx 1.0 . 5.47 795 734 A 51 TRP HE1 A 45 LEU HDy% 1.0 . 4.85 796 735 A 51 TRP HE1 A 81 LEU HDy% 1.0 . 4.04 797 736 A 51 TRP HE1 A 78 LEU HDy% 1.0 . 5.50 798 737 A 51 TRP HE1 A 78 LEU HDx% 1.0 . 5.47 799 738 A 15 TYR H A 17 GLY H 1.0 . 5.05 800 739 A 17 GLY H A 16 CYS HBy 1.0 . 4.28 801 740 A 17 GLY H A 16 CYS HBx 1.0 . 4.02 802 741 A 17 GLY H A 13 LYS HB2 1.0 . 5.50 803 741 A 13 LYS HB3 A 17 GLY H 1.0 . 5.50 804 742 A 14 THR HG2% A 17 GLY H 1.0 . 5.50 805 743 A 55 THR H A 74 TRP HE1 1.0 . 4.03 806 744 A 56 ALA H A 74 TRP HE1 1.0 . 5.45 807 745 A 51 TRP HD1 A 74 TRP HE1 1.0 . 5.50 808 746 A 55 THR HB A 74 TRP HE1 1.0 . 4.52 809 747 A 55 THR HA A 74 TRP HE1 1.0 . 3.40 810 748 A 74 TRP HE1 A 74 TRP HBx 1.0 . 5.07 811 748 A 74 TRP HBy A 74 TRP HE1 1.0 . 5.07 812 749 A 54 ILE HB A 74 TRP HE1 1.0 . 5.19 813 750 A 55 THR HG2% A 74 TRP HE1 1.0 . 4.21 814 751 A 71 LEU HDy% A 74 TRP HE1 1.0 . 5.42 815 752 A 78 LEU HDy% A 74 TRP HE1 1.0 . 4.03 816 753 A 78 LEU HDx% A 74 TRP HE1 1.0 . 5.50 817 754 A 78 LEU HBx A 74 TRP HE1 1.0 . 5.20 818 755 A 54 ILE HG2% A 74 TRP HE1 1.0 . 4.60 819 756 A 44 ASP H A 43 SER H 1.0 . 3.58 820 757 A 41 SER HA A 43 SER H 1.0 . 4.84 821 758 A 43 SER HBy A 43 SER H 1.0 . 3.58 822 759 A 44 ASP HBy A 43 SER H 1.0 . 5.50 823 760 A 43 SER H A 42 PRO HGy 1.0 . 4.17 824 761 A 43 SER H A 42 PRO HGx 1.0 . 4.90 825 762 A 43 SER H A 4 VAL HGy% 1.0 . 4.82 826 763 A 64 ILE H A 66 GLY H 1.0 . 4.70 827 764 A 65 LEU H A 66 GLY H 1.0 . 3.36 828 765 A 67 LYS H A 66 GLY H 1.0 . 3.49 829 766 A 66 GLY H A 67 LYS HA 1.0 . 5.50 830 767 A 65 LEU HBy A 66 GLY H 1.0 . 4.14 831 768 A 66 GLY H A 65 LEU HG 1.0 . 5.50 832 769 A 65 LEU HBx A 66 GLY H 1.0 . 4.26 833 770 A 66 GLY H A 67 LYS HGx 1.0 . 5.17 834 770 A 67 LYS HGy A 66 GLY H 1.0 . 5.17 835 771 A 65 LEU HDy% A 66 GLY H 1.0 . 4.93 836 772 A 63 MET HA A 66 GLY H 1.0 . 4.59 837 773 A 27 GLY H A 25 GLU H 1.0 . 4.81 838 774 A 27 GLY H A 25 GLU HBy 1.0 . 5.50 839 775 A 27 GLY H A 26 ILE HB 1.0 . 3.25 840 776 A 27 GLY H A 24 LYS HD2 1.0 . 4.90 841 776 A 27 GLY H A 24 LYS HD3 1.0 . 4.90 842 777 A 27 GLY H A 28 ALA HB% 1.0 . 4.87 843 778 A 27 GLY H A 73 THR HG2% 1.0 . 5.50 844 779 A 27 GLY H A 26 ILE HG2% 1.0 . 3.66 845 780 A 27 GLY H A 26 ILE HD1% 1.0 . 4.72 846 781 A 27 GLY H A 26 ILE HG1x 1.0 . 5.15 847 782 A 41 SER HA A 41 SER HBy 1.0 . 2.93 848 783 A 51 TRP HD1 A 50 SER HBx 1.0 . 4.54 849 784 A 54 ILE HD1% A 50 SER HBx 1.0 . 4.12 850 785 A 67 LYS HEy A 67 LYS HGx 1.0 . 3.87 851 785 A 67 LYS HGy A 67 LYS HEy 1.0 . 3.87 852 786 A 67 LYS HEx A 67 LYS HGx 1.0 . 3.76 853 786 A 67 LYS HGy A 67 LYS HEx 1.0 . 3.76 854 787 A 65 LEU HDy% A 67 LYS HGx 1.0 . 4.49 855 787 A 67 LYS HGy A 65 LEU HDy% 1.0 . 4.49 856 788 A 67 LYS HA A 67 LYS HGx 1.0 . 3.27 857 788 A 67 LYS HGy A 67 LYS HA 1.0 . 3.27 858 789 A 68 SER HA A 68 SER HBy 1.0 . 2.85 859 790 A 71 LEU HBy A 68 SER HBy 1.0 . 4.24 860 791 A 71 LEU HDx% A 68 SER HBy 1.0 . 4.58 861 792 A 50 SER HBy A 51 TRP HD1 1.0 . 4.22 862 793 A 50 SER HA A 50 SER HBy 1.0 . 2.95 863 794 A 50 SER HBy A 54 ILE HG1y 1.0 . 4.79 864 795 A 50 SER HBy A 54 ILE HD1% 1.0 . 4.02 865 796 A 50 SER HA A 50 SER HBx 1.0 . 2.92 866 797 A 50 SER HBx A 53 PRO HGx 1.0 . 4.70 867 798 A 68 SER HA A 68 SER HBx 1.0 . 2.85 868 799 A 62 ALA HB% A 68 SER HBx 1.0 . 3.63 869 800 A 71 LEU HBy A 68 SER HBx 1.0 . 4.62 870 801 A 30 LEU HDx% A 42 PRO HBy 1.0 . 4.20 871 802 A 30 LEU HA A 30 LEU HDx% 1.0 . 3.13 872 803 A 42 PRO HBx A 30 LEU HDx% 1.0 . 5.27 873 804 A 30 LEU HBx A 30 LEU HDx% 1.0 . 3.50 874 805 A 12 CYS HA A 15 TYR HD% 1.0 . 4.50 875 806 A 12 CYS HBx A 20 SER HB2 1.0 . 3.81 876 806 A 20 SER HB3 A 12 CYS HBx 1.0 . 3.81 877 807 A 20 SER HA A 20 SER HB2 1.0 . 2.96 878 807 A 20 SER HB3 A 20 SER HA 1.0 . 2.96 879 808 A 13 LYS HA A 20 SER HB2 1.0 . 3.28 880 808 A 20 SER HB3 A 13 LYS HA 1.0 . 3.28 881 809 A 12 CYS HBy A 20 SER HB2 1.0 . 3.45 882 809 A 12 CYS HBy A 20 SER HB3 1.0 . 3.45 883 810 A 16 CYS HBx A 20 SER HB2 1.0 . 3.42 884 810 A 20 SER HB3 A 16 CYS HBx 1.0 . 3.42 885 811 A 13 LYS HB3 A 20 SER HB2 1.0 . 4.47 886 811 A 13 LYS HB2 A 20 SER HB2 1.0 . 4.47 887 811 A 20 SER HB3 A 13 LYS HB2 1.0 . 4.47 888 811 A 20 SER HB3 A 13 LYS HB3 1.0 . 4.47 889 812 A 76 LEU HDy% A 20 SER HB2 1.0 . 4.99 890 812 A 20 SER HB3 A 76 LEU HDy% 1.0 . 4.99 891 813 A 12 CYS HA A 16 CYS HBx 1.0 . 4.16 892 814 A 21 PRO HDy A 20 SER HB2 1.0 . 3.50 893 814 A 20 SER HB3 A 21 PRO HDy 1.0 . 3.50 894 815 A 13 LYS HGy A 20 SER HB2 1.0 . 5.06 895 815 A 20 SER HB3 A 13 LYS HGy 1.0 . 5.06 896 816 A 13 LYS HGx A 20 SER HB2 1.0 . 4.63 897 816 A 13 LYS HGx A 20 SER HB3 1.0 . 4.63 898 817 A 76 LEU HA A 77 VAL HGy% 1.0 . 5.50 899 818 A 77 VAL HGy% A 73 THR HA 1.0 . 4.24 900 819 A 32 LEU HA A 32 LEU HDx% 1.0 . 3.09 901 820 A 32 LEU HDx% A 32 LEU HBx 1.0 . 3.42 902 821 A 32 LEU HDx% A 32 LEU HBy 1.0 . 3.77 903 822 A 74 TRP HH2 A 45 LEU HDx% 1.0 . 4.68 904 823 A 47 SER HA A 47 SER HB2 1.0 . 2.80 905 823 A 47 SER HB3 A 47 SER HA 1.0 . 2.80 906 824 A 44 ASP HA A 47 SER HB2 1.0 . 3.42 907 824 A 44 ASP HA A 47 SER HB3 1.0 . 3.42 908 825 A 48 PRO HDx A 47 SER HB2 1.0 . 4.23 909 825 A 48 PRO HDx A 47 SER HB3 1.0 . 4.23 910 826 A 26 ILE HA A 77 VAL HGy% 1.0 . 4.61 911 827 A 54 ILE HA A 33 LEU HDx% 1.0 . 4.44 912 828 A 38 LEU HBy A 33 LEU HDx% 1.0 . 4.09 913 829 A 33 LEU HBx A 33 LEU HDx% 1.0 . 3.73 914 830 A 33 LEU HDx% A 38 LEU HDy% 1.0 . 3.25 915 831 A 54 ILE HG2% A 33 LEU HDx% 1.0 . 3.56 916 832 A 33 LEU HDx% A 58 LEU HG 1.0 . 4.21 917 833 A 33 LEU HDx% A 58 LEU HDy% 1.0 . 3.71 918 834 A 51 TRP HZ2 A 85 ARG HDy 1.0 . 4.50 919 835 A 51 TRP HZ3 A 85 ARG HDx 1.0 . 4.66 920 836 A 85 ARG HDy A 51 TRP HH2 1.0 . 4.84 921 837 A 85 ARG HDx A 51 TRP HH2 1.0 . 4.71 922 838 A 51 TRP HH2 A 48 PRO HBx 1.0 . 4.34 923 839 A 61 ARG HDy A 61 ARG HBx 1.0 . 3.67 924 840 A 61 ARG HDy A 65 LEU HDy% 1.0 . 5.31 925 841 A 32 LEU HDx% A 61 ARG HDy 1.0 . 4.92 926 842 A 32 LEU HDy% A 61 ARG HDy 1.0 . 4.18 927 843 A 61 ARG HDx A 58 LEU HA 1.0 . 4.25 928 844 A 32 LEU HDy% A 61 ARG HDx 1.0 . 4.30 929 845 A 61 ARG HDx A 61 ARG HBx 1.0 . 3.74 930 846 A 32 LEU HDx% A 61 ARG HDx 1.0 . 5.42 931 847 A 73 THR HG2% A 74 TRP HA 1.0 . 4.64 932 848 A 73 THR HG2% A 73 THR HA 1.0 . 3.21 933 849 A 26 ILE HA A 73 THR HG2% 1.0 . 3.41 934 850 A 77 VAL HA A 73 THR HG2% 1.0 . 5.50 935 851 A 29 MET HBy A 73 THR HG2% 1.0 . 4.31 936 852 A 73 THR HG2% A 21 PRO HBy 1.0 . 3.53 937 853 A 29 MET HBx A 73 THR HG2% 1.0 . 3.97 938 854 A 73 THR HG2% A 29 MET HGx 1.0 . 4.06 939 855 A 73 THR HG2% A 29 MET HE% 1.0 . 3.76 940 856 A 73 THR HG2% A 21 PRO HGy 1.0 . 3.73 941 857 A 73 THR HG2% A 21 PRO HGx 1.0 . 3.89 942 858 A 73 THR HG2% A 21 PRO HBx 1.0 . 3.66 943 859 A 77 VAL HGy% A 73 THR HG2% 1.0 . 3.60 944 860 A 26 ILE HG1x A 73 THR HG2% 1.0 . 3.55 945 861 A 71 LEU HDy% A 58 LEU HA 1.0 . 4.33 946 862 A 59 SER HBx A 71 LEU HDy% 1.0 . 4.60 947 863 A 71 LEU HDy% A 55 THR HA 1.0 . 4.12 948 864 A 71 LEU HDy% A 58 LEU HDx% 1.0 . 3.68 949 865 A 71 LEU HDy% A 58 LEU HDy% 1.0 . 4.06 950 866 A 74 TRP HD1 A 71 LEU HDy% 1.0 . 3.39 951 867 A 71 LEU HDy% A 59 SER HA 1.0 . 3.66 952 868 A 71 LEU HA A 71 LEU HDy% 1.0 . 3.12 953 869 A 71 LEU HDy% A 59 SER HBy 1.0 . 4.16 954 870 A 71 LEU HDy% A 74 TRP HBx 1.0 . 3.92 955 870 A 71 LEU HDy% A 74 TRP HBy 1.0 . 3.92 956 871 A 65 LEU HBy A 67 LYS HGx 1.0 . 4.85 957 871 A 67 LYS HGy A 65 LEU HBy 1.0 . 4.85 958 872 A 65 LEU HBy A 65 LEU HDy% 1.0 . 3.32 959 873 A 38 LEU HBy A 33 LEU HA 1.0 . 3.90 960 874 A 65 LEU HBx A 65 LEU HDx% 1.0 . 3.31 961 875 A 38 LEU HBy A 38 LEU HDy% 1.0 . 3.28 962 876 A 38 LEU HBy A 33 LEU HBx 1.0 . 4.46 963 877 A 39 LEU HG A 38 LEU HBx 1.0 . 3.45 964 878 A 38 LEU HDx% A 38 LEU HBx 1.0 . 3.19 965 879 A 38 LEU HBx A 54 ILE HG1x 1.0 . 3.55 966 880 A 33 LEU HA A 38 LEU HBx 1.0 . 4.42 967 881 A 39 LEU HDx% A 38 LEU HBx 1.0 . 5.21 968 882 A 39 LEU HDy% A 38 LEU HBy 1.0 . 4.92 969 883 A 46 TYR HE% A 7 VAL HGy% 1.0 . 4.51 970 884 A 4 VAL HA A 7 VAL HGy% 1.0 . 3.79 971 885 A 7 VAL HGy% A 6 LYS HBx 1.0 . 4.16 972 885 A 6 LYS HBy A 7 VAL HGy% 1.0 . 4.16 973 886 A 7 VAL HGy% A 46 TYR HD% 1.0 . 5.46 974 887 A 76 LEU HA A 76 LEU HDx% 1.0 . 2.94 975 888 A 76 LEU HDx% A 73 THR HA 1.0 . 5.50 976 889 A 76 LEU HDx% A 16 CYS HBy 1.0 . 4.27 977 890 A 76 LEU HBy A 76 LEU HDx% 1.0 . 3.58 978 891 A 76 LEU HBx A 76 LEU HDx% 1.0 . 3.64 979 892 A 38 LEU HDx% A 53 PRO HA 1.0 . 5.21 980 893 A 36 GLU HBx A 38 LEU HDx% 1.0 . 4.57 981 894 A 38 LEU HBy A 38 LEU HDx% 1.0 . 3.84 982 895 A 38 LEU HDx% A 54 ILE HG1x 1.0 . 3.89 983 896 A 31 SER HA A 31 SER HBy 1.0 . 2.40 984 897 A 26 ILE HD1% A 9 SER HA 1.0 . 3.16 985 898 A 48 PRO HA A 51 TRP HE3 1.0 . 4.51 986 899 A 48 PRO HA A 51 TRP HZ3 1.0 . 4.72 987 900 A 48 PRO HA A 51 TRP HH2 1.0 . 4.88 988 901 A 59 SER HBx A 55 THR HG2% 1.0 . 4.79 989 902 A 55 THR HG2% A 74 TRP HD1 1.0 . 4.07 990 903 A 55 THR HG2% A 56 ALA HA 1.0 . 3.79 991 904 A 55 THR HG2% A 55 THR HA 1.0 . 3.00 992 905 A 56 ALA HB% A 55 THR HG2% 1.0 . 4.15 993 906 A 55 THR HG2% A 71 LEU HDy% 1.0 . 4.41 994 907 A 67 LYS HEy A 65 LEU HDx% 1.0 . 5.47 995 908 A 73 THR HG2% A 21 PRO HA 1.0 . 4.71 996 909 A 76 LEU HDy% A 21 PRO HA 1.0 . 4.83 997 910 A 43 SER HBy A 46 TYR HD% 1.0 . 3.85 998 911 A 43 SER HBy A 46 TYR HE% 1.0 . 4.00 999 912 A 43 SER HBy A 43 SER HA 1.0 . 2.92 1000 913 A 46 TYR HD% A 43 SER HBx 1.0 . 4.31 1001 914 A 46 TYR HE% A 43 SER HBx 1.0 . 4.26 1002 915 A 43 SER HA A 43 SER HBx 1.0 . 2.98 1003 916 A 56 ALA HB% A 59 SER HBy 1.0 . 5.50 1004 917 A 74 TRP HD1 A 58 LEU HDx% 1.0 . 5.31 1005 918 A 58 LEU HDx% A 58 LEU HA 1.0 . 3.01 1006 919 A 33 LEU HA A 58 LEU HDx% 1.0 . 5.29 1007 920 A 58 LEU HDx% A 74 TRP HBx 1.0 . 4.54 1008 920 A 74 TRP HBy A 58 LEU HDx% 1.0 . 4.54 1009 921 A 61 ARG HDy A 58 LEU HDx% 1.0 . 4.25 1010 922 A 61 ARG HDx A 58 LEU HDx% 1.0 . 3.98 1011 923 A 58 LEU HDx% A 58 LEU HBy 1.0 . 3.62 1012 924 A 57 ALA HB% A 58 LEU HDx% 1.0 . 4.46 1013 925 A 58 LEU HBx A 58 LEU HDx% 1.0 . 3.74 1014 926 A 32 LEU HDx% A 58 LEU HDx% 1.0 . 4.29 1015 927 A 32 LEU HDy% A 58 LEU HDx% 1.0 . 3.24 1016 928 A 54 ILE HG2% A 58 LEU HDx% 1.0 . 4.40 1017 929 A 59 SER HA A 59 SER HBy 1.0 . 3.00 1018 930 A 76 LEU HBy A 21 PRO HDy 1.0 . 4.81 1019 931 A 4 VAL HGy% A 46 TYR HD% 1.0 . 4.92 1020 932 A 46 TYR HE% A 4 VAL HGy% 1.0 . 4.00 1021 933 A 4 VAL HA A 4 VAL HGy% 1.0 . 3.08 1022 934 A 1 SER HA A 4 VAL HGy% 1.0 . 5.32 1023 935 A 42 PRO HDx A 4 VAL HGy% 1.0 . 5.50 1024 936 A 4 VAL HGy% A 43 SER HBx 1.0 . 3.68 1025 937 A 43 SER HA A 4 VAL HGy% 1.0 . 3.76 1026 938 A 4 VAL HGy% A 42 PRO HBy 1.0 . 3.77 1027 939 A 58 LEU HDx% A 70 GLU HA 1.0 . 5.14 1028 940 A 78 LEU HDx% A 51 TRP HE3 1.0 . 3.90 1029 941 A 78 LEU HDx% A 74 TRP HZ2 1.0 . 3.78 1030 942 A 51 TRP HD1 A 78 LEU HDx% 1.0 . 5.00 1031 943 A 78 LEU HDx% A 51 TRP HZ3 1.0 . 5.03 1032 944 A 74 TRP HH2 A 78 LEU HDx% 1.0 . 4.24 1033 945 A 78 LEU HDx% A 74 TRP HZ3 1.0 . 5.16 1034 946 A 78 LEU HDx% A 51 TRP HA 1.0 . 4.55 1035 947 A 78 LEU HDx% A 82 LYS HA 1.0 . 5.26 1036 948 A 51 TRP HBy A 78 LEU HDx% 1.0 . 4.02 1037 949 A 78 LEU HDx% A 51 TRP HBx 1.0 . 3.80 1038 950 A 78 LEU HDx% A 82 LYS HEy 1.0 . 4.40 1039 951 A 78 LEU HA A 78 LEU HDx% 1.0 . 3.22 1040 952 A 78 LEU HBy A 78 LEU HDx% 1.0 . 3.73 1041 953 A 78 LEU HDx% A 78 LEU HBx 1.0 . 3.80 1042 954 A 78 LEU HDx% A 82 LYS HBy 1.0 . 4.90 1043 955 A 45 LEU HBy A 45 LEU HDy% 1.0 . 3.39 1044 956 A 76 LEU HBx A 21 PRO HDx 1.0 . 4.45 1045 957 A 76 LEU HBx A 76 LEU HDy% 1.0 . 3.60 1046 958 A 45 LEU HBx A 46 TYR HD% 1.0 . 4.76 1047 959 A 45 LEU HBx A 45 LEU HDy% 1.0 . 3.54 1048 960 A 45 LEU HBx A 81 LEU HDy% 1.0 . 4.49 1049 961 A 19 THR HG2% A 18 LYS HD2 1.0 . 4.84 1050 961 A 19 THR HG2% A 18 LYS HD3 1.0 . 4.84 1051 962 A 19 THR HG2% A 18 LYS HG2 1.0 . 4.67 1052 962 A 19 THR HG2% A 18 LYS HG3 1.0 . 4.67 1053 963 A 76 LEU HDy% A 19 THR HG2% 1.0 . 4.24 1054 964 A 76 LEU HDx% A 19 THR HG2% 1.0 . 3.24 1055 965 A 77 VAL HGy% A 74 TRP HE3 1.0 . 4.48 1056 966 A 11 ALA HB% A 10 SER HA 1.0 . 5.04 1057 967 A 32 LEU HA A 35 LYS HE2 1.0 . 3.87 1058 967 A 32 LEU HA A 35 LYS HE3 1.0 . 3.87 1059 968 A 6 LYS HBx A 6 LYS HE2 1.0 . 3.78 1060 968 A 6 LYS HBy A 6 LYS HE2 1.0 . 3.78 1061 968 A 6 LYS HE3 A 6 LYS HBx 1.0 . 3.78 1062 968 A 6 LYS HE3 A 6 LYS HBy 1.0 . 3.78 1063 969 A 6 LYS HGx A 6 LYS HE2 1.0 . 3.38 1064 969 A 6 LYS HGx A 6 LYS HE3 1.0 . 3.38 1065 970 A 18 LYS HE2 A 18 LYS HG2 1.0 . 3.26 1066 970 A 18 LYS HE3 A 18 LYS HG2 1.0 . 3.26 1067 970 A 18 LYS HG3 A 18 LYS HE2 1.0 . 3.26 1068 970 A 18 LYS HG3 A 18 LYS HE3 1.0 . 3.26 1069 971 A 76 LEU HDy% A 72 LYS HE2 1.0 . 4.17 1070 971 A 76 LEU HDy% A 72 LYS HE3 1.0 . 4.17 1071 972 A 32 LEU HDx% A 35 LYS HE2 1.0 . 4.59 1072 972 A 32 LEU HDx% A 35 LYS HE3 1.0 . 4.59 1073 973 A 26 ILE HG2% A 30 LEU HBy 1.0 . 4.26 1074 974 A 30 LEU HBy A 30 LEU HDy% 1.0 . 3.40 1075 975 A 19 THR HG2% A 18 LYS HA 1.0 . 4.99 1076 976 A 30 LEU HBx A 31 SER HA 1.0 . 5.01 1077 977 A 34 GLN HGy A 31 SER HA 1.0 . 4.84 1078 978 A 51 TRP HE3 A 82 LYS HEy 1.0 . 4.29 1079 979 A 51 TRP HZ3 A 82 LYS HEy 1.0 . 4.08 1080 980 A 78 LEU HDy% A 82 LYS HEy 1.0 . 4.75 1081 981 A 51 TRP HE3 A 82 LYS HEx 1.0 . 4.63 1082 982 A 82 LYS HEx A 51 TRP HZ3 1.0 . 4.78 1083 983 A 82 LYS HEx A 78 LEU HG 1.0 . 4.18 1084 984 A 78 LEU HDy% A 82 LYS HEx 1.0 . 3.97 1085 985 A 78 LEU HDx% A 82 LYS HEx 1.0 . 3.87 1086 986 A 54 ILE HG2% A 58 LEU HBx 1.0 . 5.07 1087 987 A 81 LEU HDx% A 51 TRP HZ2 1.0 . 4.32 1088 988 A 81 LEU HA A 81 LEU HDx% 1.0 . 2.98 1089 989 A 74 TRP HE3 A 77 VAL HGx% 1.0 . 3.97 1090 990 A 81 LEU HDx% A 46 TYR HD% 1.0 . 3.90 1091 991 A 81 LEU HDx% A 51 TRP HH2 1.0 . 5.50 1092 992 A 46 TYR HE% A 81 LEU HDx% 1.0 . 4.12 1093 993 A 77 VAL HGx% A 74 TRP HZ3 1.0 . 3.77 1094 994 A 74 TRP HA A 77 VAL HGx% 1.0 . 4.00 1095 995 A 77 VAL HA A 77 VAL HGx% 1.0 . 3.26 1096 996 A 78 LEU HA A 77 VAL HGx% 1.0 . 4.05 1097 997 A 29 MET HE% A 77 VAL HGx% 1.0 . 3.53 1098 998 A 80 ALA HB% A 81 LEU HDx% 1.0 . 4.05 1099 999 A 78 LEU HDx% A 81 LEU HDx% 1.0 . 4.87 1100 1000 A 33 LEU HBy A 33 LEU HDy% 1.0 . 3.63 1101 1001 A 33 LEU HDx% A 33 LEU HBy 1.0 . 3.75 1102 1002 A 68 SER HA A 71 LEU HBx 1.0 . 4.04 1103 1003 A 71 LEU HDy% A 71 LEU HBx 1.0 . 3.76 1104 1004 A 71 LEU HDx% A 71 LEU HBx 1.0 . 3.40 1105 1005 A 32 LEU HBx A 70 GLU HGy 1.0 . 4.70 1106 1006 A 51 TRP HH2 A 81 LEU HBy 1.0 . 4.64 1107 1007 A 7 VAL HGx% A 46 TYR HD% 1.0 . 4.75 1108 1008 A 46 TYR HE% A 7 VAL HGx% 1.0 . 3.62 1109 1009 A 7 VAL HGx% A 7 VAL HA 1.0 . 3.15 1110 1010 A 15 TYR HD% A 14 THR HG2% 1.0 . 4.12 1111 1011 A 15 TYR HE% A 14 THR HG2% 1.0 . 3.93 1112 1012 A 14 THR HG2% A 11 ALA HA 1.0 . 4.42 1113 1013 A 14 THR HG2% A 14 THR HA 1.0 . 3.05 1114 1014 A 15 TYR HBy A 14 THR HG2% 1.0 . 5.38 1115 1015 A 26 ILE HD1% A 23 LYS HA 1.0 . 3.49 1116 1016 A 23 LYS HA A 5 ILE HG2% 1.0 . 3.67 1117 1017 A 78 LEU HA A 81 LEU HBx 1.0 . 3.61 1118 1018 A 78 LEU HDx% A 81 LEU HBx 1.0 . 4.23 1119 1019 A 51 TRP HZ2 A 81 LEU HBy 1.0 . 3.79 1120 1020 A 81 LEU HDx% A 81 LEU HBy 1.0 . 3.43 1121 1021 A 81 LEU HBx A 81 LEU HDy% 1.0 . 3.28 1122 1022 A 42 PRO HA A 4 VAL HGx% 1.0 . 4.70 1123 1023 A 4 VAL HA A 4 VAL HGx% 1.0 . 3.28 1124 1024 A 42 PRO HBy A 4 VAL HGx% 1.0 . 3.98 1125 1025 A 3 ALA HB% A 4 VAL HGx% 1.0 . 5.16 1126 1026 A 14 THR HG2% A 15 TYR HA 1.0 . 4.20 1127 1027 A 76 LEU HDx% A 19 THR HA 1.0 . 5.04 1128 1028 A 19 THR HA A 19 THR HG2% 1.0 . 3.14 1129 1029 A 29 MET HA A 70 GLU HA 1.0 . 4.31 1130 1030 A 70 GLU HA A 70 GLU HGy 1.0 . 3.70 1131 1031 A 70 GLU HGx A 70 GLU HA 1.0 . 3.44 1132 1032 A 15 TYR HD% A 15 TYR HA 1.0 . 3.07 1133 1033 A 80 ALA HA A 15 TYR HA 1.0 . 4.74 1134 1034 A 80 ALA HB% A 15 TYR HA 1.0 . 5.13 1135 1035 A 44 ASP HBy A 39 LEU HBy 1.0 . 4.74 1136 1036 A 44 ASP HBy A 39 LEU HDx% 1.0 . 3.74 1137 1037 A 51 TRP HD1 A 74 TRP HZ3 1.0 . 4.84 1138 1038 A 77 VAL HB A 74 TRP HZ3 1.0 . 5.08 1139 1039 A 74 TRP HZ3 A 45 LEU HDx% 1.0 . 4.25 1140 1040 A 74 TRP HZ3 A 33 LEU HDy% 1.0 . 5.41 1141 1041 A 74 TRP HZ3 A 81 LEU HDy% 1.0 . 4.50 1142 1042 A 6 LYS HA A 6 LYS HBx 1.0 . 2.86 1143 1042 A 6 LYS HA A 6 LYS HBy 1.0 . 2.86 1144 1043 A 6 LYS HA A 6 LYS HGy 1.0 . 3.63 1145 1044 A 43 SER HA A 46 TYR HD% 1.0 . 3.88 1146 1045 A 46 TYR HE% A 43 SER HA 1.0 . 4.10 1147 1046 A 43 SER HA A 4 VAL HGx% 1.0 . 4.27 1148 1047 A 12 CYS HA A 15 TYR HBx 1.0 . 4.57 1149 1048 A 11 ALA HB% A 15 TYR HBx 1.0 . 5.50 1150 1049 A 83 ALA HB% A 15 TYR HBx 1.0 . 4.41 1151 1050 A 12 CYS HBy A 13 LYS HA 1.0 . 4.71 1152 1051 A 51 TRP HZ3 A 82 LYS HA 1.0 . 4.04 1153 1052 A 51 TRP HH2 A 82 LYS HA 1.0 . 3.92 1154 1053 A 85 ARG HDy A 82 LYS HA 1.0 . 4.80 1155 1054 A 85 ARG HDx A 82 LYS HA 1.0 . 4.30 1156 1055 A 12 CYS HA A 15 TYR HBy 1.0 . 4.22 1157 1056 A 8 ILE HG2% A 9 SER HA 1.0 . 4.01 1158 1057 A 8 ILE HG2% A 29 MET HE% 1.0 . 4.45 1159 1058 A 11 ALA HB% A 8 ILE HG2% 1.0 . 4.76 1160 1059 A 8 ILE HG2% A 80 ALA HB% 1.0 . 4.96 1161 1060 A 8 ILE HG2% A 81 LEU HDy% 1.0 . 4.98 1162 1061 A 8 ILE HG2% A 46 TYR HE% 1.0 . 5.41 1163 1062 A 8 ILE HG2% A 5 ILE HA 1.0 . 4.71 1164 1063 A 8 ILE HG2% A 8 ILE HG1x 1.0 . 3.82 1165 1064 A 50 SER HA A 53 PRO HGy 1.0 . 4.12 1166 1065 A 72 LYS HA A 72 LYS HE2 1.0 . 4.51 1167 1065 A 72 LYS HA A 72 LYS HE3 1.0 . 4.51 1168 1066 A 35 LYS HA A 35 LYS HB2 1.0 . 2.63 1169 1066 A 35 LYS HB3 A 35 LYS HA 1.0 . 2.63 1170 1067 A 51 TRP HA A 74 TRP HZ2 1.0 . 3.42 1171 1068 A 51 TRP HD1 A 51 TRP HA 1.0 . 3.06 1172 1069 A 74 TRP HH2 A 51 TRP HA 1.0 . 4.00 1173 1070 A 78 LEU HDy% A 51 TRP HA 1.0 . 5.09 1174 1071 A 25 GLU HA A 25 GLU HG2 1.0 . 3.04 1175 1071 A 25 GLU HG3 A 25 GLU HA 1.0 . 3.04 1176 1072 A 72 LYS HA A 72 LYS HGy 1.0 . 2.95 1177 1072 A 72 LYS HA A 72 LYS HGx 1.0 . 2.95 1178 1073 A 73 THR HG2% A 25 GLU HA 1.0 . 4.94 1179 1074 A 29 MET HA A 29 MET HE% 1.0 . 4.52 1180 1075 A 29 MET HA A 73 THR HG2% 1.0 . 5.04 1181 1076 A 29 MET HA A 32 LEU HDy% 1.0 . 4.39 1182 1077 A 29 MET HA A 33 LEU HDy% 1.0 . 5.50 1183 1078 A 80 ALA HB% A 15 TYR HD% 1.0 . 3.57 1184 1079 A 80 ALA HB% A 15 TYR HE% 1.0 . 4.53 1185 1080 A 12 CYS HA A 80 ALA HB% 1.0 . 2.96 1186 1081 A 80 ALA HB% A 15 TYR HBy 1.0 . 3.64 1187 1082 A 80 ALA HB% A 15 TYR HBx 1.0 . 3.73 1188 1083 A 38 LEU HDx% A 57 ALA HB% 1.0 . 2.97 1189 1084 A 78 LEU HBy A 75 GLY HAy 1.0 . 5.08 1190 1085 A 78 LEU HBy A 79 GLY HAx 1.0 . 5.17 1191 1086 A 78 LEU HBy A 75 GLY HAx 1.0 . 4.21 1192 1087 A 78 LEU HBx A 75 GLY HAx 1.0 . 4.79 1193 1088 A 52 ASP HA A 55 THR HB 1.0 . 3.31 1194 1089 A 74 TRP HE3 A 74 TRP HA 1.0 . 3.10 1195 1090 A 74 TRP HD1 A 74 TRP HA 1.0 . 4.66 1196 1091 A 74 TRP HA A 74 TRP HZ3 1.0 . 4.47 1197 1092 A 77 VAL HGy% A 74 TRP HA 1.0 . 3.89 1198 1093 A 71 LEU HDy% A 62 ALA HB% 1.0 . 4.29 1199 1094 A 68 SER HA A 62 ALA HB% 1.0 . 3.22 1200 1095 A 62 ALA HB% A 59 SER HA 1.0 . 3.39 1201 1096 A 62 ALA HB% A 68 SER HBy 1.0 . 3.69 1202 1097 A 33 LEU HA A 34 GLN HA 1.0 . 5.21 1203 1098 A 33 LEU HBx A 34 GLN HA 1.0 . 4.37 1204 1099 A 39 LEU HDy% A 34 GLN HA 1.0 . 4.50 1205 1100 A 63 MET HGy A 60 GLN HA 1.0 . 4.88 1206 1101 A 60 GLN HGx A 60 GLN HA 1.0 . 3.94 1207 1102 A 64 ILE HG1y A 61 ARG HA 1.0 . 4.44 1208 1103 A 68 SER HA A 71 LEU HBy 1.0 . 3.81 1209 1104 A 68 SER HA A 71 LEU HDx% 1.0 . 4.28 1210 1105 A 61 ARG HDy A 61 ARG HA 1.0 . 4.45 1211 1106 A 61 ARG HDx A 61 ARG HA 1.0 . 4.82 1212 1107 A 29 MET HGy A 30 LEU HA 1.0 . 5.11 1213 1108 A 33 LEU HG A 30 LEU HA 1.0 . 4.44 1214 1109 A 42 PRO HBx A 30 LEU HA 1.0 . 4.25 1215 1110 A 33 LEU HBx A 30 LEU HA 1.0 . 4.07 1216 1111 A 33 LEU HDx% A 30 LEU HA 1.0 . 4.67 1217 1112 A 15 TYR HD% A 84 ALA HB% 1.0 . 4.23 1218 1113 A 15 TYR HE% A 84 ALA HB% 1.0 . 3.54 1219 1114 A 84 ALA HB% A 85 ARG HA 1.0 . 4.04 1220 1115 A 81 LEU HA A 84 ALA HB% 1.0 . 3.40 1221 1116 A 84 ALA HB% A 81 LEU HDx% 1.0 . 4.26 1222 1117 A 80 ALA HA A 84 ALA HB% 1.0 . 5.29 1223 1118 A 84 ALA HB% A 85 ARG HDx 1.0 . 5.50 1224 1119 A 3 ALA HB% A 6 LYS HE2 1.0 . 5.04 1225 1119 A 3 ALA HB% A 6 LYS HE3 1.0 . 5.04 1226 1120 A 3 ALA HB% A 7 VAL HGy% 1.0 . 4.72 1227 1121 A 4 VAL HA A 3 ALA HB% 1.0 . 4.53 1228 1122 A 27 GLY HAy A 26 ILE HG2% 1.0 . 4.98 1229 1123 A 26 ILE HG2% A 23 LYS HA 1.0 . 4.45 1230 1124 A 26 ILE HG2% A 26 ILE HD1% 1.0 . 3.31 1231 1125 A 26 ILE HG2% A 27 GLY HAx 1.0 . 5.02 1232 1126 A 26 ILE HG2% A 29 MET HE% 1.0 . 3.74 1233 1127 A 2 GLU HA A 5 ILE HD1% 1.0 . 3.48 1234 1128 A 32 LEU HA A 32 LEU HBy 1.0 . 2.78 1235 1129 A 64 ILE HB A 61 ARG HA 1.0 . 3.88 1236 1130 A 64 ILE HB A 64 ILE HD1% 1.0 . 3.48 1237 1131 A 26 ILE HB A 23 LYS HA 1.0 . 3.32 1238 1132 A 28 ALA HB% A 25 GLU HA 1.0 . 3.19 1239 1133 A 29 MET HBx A 28 ALA HB% 1.0 . 4.43 1240 1134 A 5 ILE HB A 5 ILE HD1% 1.0 . 2.94 1241 1135 A 53 PRO HA A 56 ALA HB% 1.0 . 3.15 1242 1136 A 56 ALA HB% A 55 THR HA 1.0 . 5.04 1243 1137 A 74 TRP HD1 A 71 LEU HA 1.0 . 4.33 1244 1138 A 71 LEU HA A 74 TRP HBx 1.0 . 3.29 1245 1138 A 71 LEU HA A 74 TRP HBy 1.0 . 3.29 1246 1139 A 71 LEU HA A 71 LEU HG 1.0 . 3.75 1247 1140 A 71 LEU HA A 58 LEU HBx 1.0 . 4.08 1248 1141 A 71 LEU HA A 71 LEU HDx% 1.0 . 4.04 1249 1142 A 71 LEU HA A 58 LEU HDx% 1.0 . 4.42 1250 1143 A 71 LEU HA A 58 LEU HDy% 1.0 . 3.66 1251 1144 A 33 LEU HA A 38 LEU HDy% 1.0 . 3.51 1252 1145 A 36 GLU HBy A 33 LEU HA 1.0 . 4.12 1253 1146 A 33 LEU HA A 33 LEU HG 1.0 . 4.11 1254 1147 A 33 LEU HA A 33 LEU HDy% 1.0 . 4.05 1255 1148 A 33 LEU HA A 33 LEU HDx% 1.0 . 3.10 1256 1149 A 15 TYR HD% A 83 ALA HB% 1.0 . 3.54 1257 1150 A 83 ALA HB% A 15 TYR HA 1.0 . 4.66 1258 1151 A 80 ALA HA A 83 ALA HB% 1.0 . 3.42 1259 1152 A 83 ALA HB% A 15 TYR HBy 1.0 . 4.01 1260 1153 A 83 ALA HB% A 84 ALA HB% 1.0 . 4.18 1261 1154 A 15 TYR HE% A 83 ALA HB% 1.0 . 3.57 1262 1155 A 81 LEU HA A 81 LEU HDy% 1.0 . 4.10 1263 1156 A 2 GLU HA A 5 ILE HB 1.0 . 3.31 1264 1157 A 1 SER HA A 4 VAL HGx% 1.0 . 5.13 1265 1158 A 81 LEU HG A 81 LEU HA 1.0 . 3.89 1266 1159 A 73 THR HG2% A 25 GLU HG2 1.0 . 4.69 1267 1159 A 25 GLU HG3 A 73 THR HG2% 1.0 . 4.69 1268 1160 A 54 ILE HB A 51 TRP HD1 1.0 . 4.71 1269 1161 A 54 ILE HB A 74 TRP HH2 1.0 . 4.65 1270 1162 A 54 ILE HB A 51 TRP HA 1.0 . 3.64 1271 1163 A 54 ILE HB A 54 ILE HD1% 1.0 . 3.31 1272 1164 A 54 ILE HB A 74 TRP HZ2 1.0 . 3.90 1273 1165 A 61 ARG HDy A 58 LEU HA 1.0 . 4.65 1274 1166 A 61 ARG HBy A 58 LEU HA 1.0 . 3.56 1275 1167 A 61 ARG HBx A 58 LEU HA 1.0 . 3.63 1276 1168 A 58 LEU HDy% A 58 LEU HA 1.0 . 4.14 1277 1169 A 58 LEU HG A 58 LEU HA 1.0 . 3.91 1278 1170 A 28 ALA HB% A 25 GLU HG2 1.0 . 4.70 1279 1170 A 28 ALA HB% A 25 GLU HG3 1.0 . 4.70 1280 1171 A 65 LEU HA A 64 ILE HG2% 1.0 . 4.21 1281 1172 A 64 ILE HG2% A 61 ARG HA 1.0 . 4.22 1282 1173 A 64 ILE HG2% A 64 ILE HA 1.0 . 3.07 1283 1174 A 6 LYS HA A 5 ILE HG2% 1.0 . 3.91 1284 1175 A 5 ILE HA A 5 ILE HG2% 1.0 . 3.37 1285 1176 A 78 LEU HA A 81 LEU HG 1.0 . 4.41 1286 1177 A 78 LEU HA A 81 LEU HDy% 1.0 . 3.83 1287 1178 A 46 TYR HE% A 46 TYR HA 1.0 . 4.46 1288 1179 A 39 LEU HDx% A 44 ASP HA 1.0 . 4.77 1289 1180 A 32 LEU HDy% A 70 GLU HGy 1.0 . 4.03 1290 1181 A 11 ALA HB% A 12 CYS HA 1.0 . 4.34 1291 1182 A 11 ALA HB% A 81 LEU HA 1.0 . 4.63 1292 1183 A 11 ALA HB% A 8 ILE HG1y 1.0 . 5.06 1293 1184 A 46 TYR HD% A 46 TYR HA 1.0 . 3.04 1294 1185 A 81 LEU HDx% A 46 TYR HA 1.0 . 4.53 1295 1186 A 81 LEU HDy% A 46 TYR HA 1.0 . 4.68 1296 1187 A 12 CYS HBx A 20 SER HA 1.0 . 4.20 1297 1188 A 29 MET HE% A 74 TRP HBx 1.0 . 4.75 1298 1188 A 74 TRP HBy A 29 MET HE% 1.0 . 4.75 1299 1189 A 77 VAL HA A 29 MET HE% 1.0 . 4.79 1300 1190 A 29 MET HE% A 29 MET HGx 1.0 . 3.22 1301 1191 A 29 MET HE% A 30 LEU HDx% 1.0 . 3.56 1302 1192 A 33 LEU HDx% A 29 MET HE% 1.0 . 4.44 1303 1193 A 58 LEU HDy% A 29 MET HE% 1.0 . 4.79 1304 1194 A 63 MET HA A 63 MET HE% 1.0 . 4.58 1305 1195 A 60 GLN HA A 63 MET HE% 1.0 . 4.65 1306 1196 A 11 ALA HB% A 15 TYR HD% 1.0 . 3.98 1307 1197 A 11 ALA HB% A 15 TYR HE% 1.0 . 4.33 1308 1198 A 8 ILE HA A 11 ALA HB% 1.0 . 3.44 1309 1199 A 11 ALA HB% A 7 VAL HGy% 1.0 . 5.50 1310 1200 A 11 ALA HB% A 7 VAL HGx% 1.0 . 3.96 1311 1201 A 11 ALA HB% A 81 LEU HDx% 1.0 . 3.89 1312 1202 A 74 TRP HE3 A 29 MET HE% 1.0 . 3.58 1313 1203 A 29 MET HE% A 74 TRP HZ3 1.0 . 4.31 1314 1204 A 74 TRP HA A 29 MET HE% 1.0 . 3.99 1315 1205 A 29 MET HE% A 30 LEU HA 1.0 . 3.81 1316 1206 A 26 ILE HA A 29 MET HE% 1.0 . 3.84 1317 1207 A 29 MET HGy A 29 MET HE% 1.0 . 3.80 1318 1208 A 29 MET HBy A 29 MET HE% 1.0 . 3.42 1319 1209 A 77 VAL HGy% A 29 MET HE% 1.0 . 3.04 1320 1210 A 29 MET HE% A 8 ILE HD1% 1.0 . 3.46 1321 1211 A 29 MET HE% A 33 LEU HDy% 1.0 . 3.71 1322 1212 A 40 MET HA A 34 GLN HGx 1.0 . 4.97 1323 1213 A 85 ARG HDy A 85 ARG HA 1.0 . 4.58 1324 1214 A 85 ARG HDx A 85 ARG HA 1.0 . 4.76 1325 1215 A 36 GLU HA A 36 GLU HGy 1.0 . 3.49 1326 1216 A 32 LEU HDx% A 36 GLU HGy 1.0 . 3.98 1327 1217 A 40 MET HGy A 40 MET HA 1.0 . 4.23 1328 1218 A 40 MET HGx A 40 MET HA 1.0 . 3.83 1329 1219 A 40 MET HA A 40 MET HE% 1.0 . 3.48 1330 1220 A 81 LEU HDy% A 45 LEU HA 1.0 . 5.16 1331 1221 A 2 GLU HA A 2 GLU HG2 1.0 . 3.50 1332 1221 A 2 GLU HG3 A 2 GLU HA 1.0 . 3.50 1333 1222 A 2 GLU HG2 A 6 LYS HE2 1.0 . 4.84 1334 1222 A 2 GLU HG3 A 6 LYS HE2 1.0 . 4.84 1335 1222 A 6 LYS HE3 A 2 GLU HG2 1.0 . 4.84 1336 1222 A 2 GLU HG3 A 6 LYS HE3 1.0 . 4.84 1337 1223 A 1 SER HA A 2 GLU HG2 1.0 . 5.13 1338 1223 A 2 GLU HG3 A 1 SER HA 1.0 . 5.13 1339 1224 A 2 GLU HB3 A 2 GLU HG2 1.0 . 2.49 1340 1224 A 2 GLU HB2 A 2 GLU HG2 1.0 . 2.49 1341 1224 A 2 GLU HG3 A 2 GLU HB2 1.0 . 2.49 1342 1224 A 2 GLU HG3 A 2 GLU HB3 1.0 . 2.49 1343 1225 A 36 GLU HA A 36 GLU HGx 1.0 . 4.06 1344 1226 A 32 LEU HDx% A 36 GLU HGx 1.0 . 4.47 1345 1227 A 32 LEU HDy% A 36 GLU HGx 1.0 . 4.49 1346 1228 A 83 ALA HA A 86 GLU HGy 1.0 . 4.79 1347 1229 A 86 GLU HGx A 86 GLU HA 1.0 . 3.51 1348 1230 A 54 ILE HG2% A 74 TRP HE3 1.0 . 4.93 1349 1231 A 54 ILE HG2% A 74 TRP HZ2 1.0 . 4.43 1350 1232 A 54 ILE HG2% A 74 TRP HH2 1.0 . 4.30 1351 1233 A 54 ILE HG2% A 74 TRP HZ3 1.0 . 5.02 1352 1234 A 54 ILE HG2% A 51 TRP HA 1.0 . 4.73 1353 1235 A 54 ILE HG2% A 33 LEU HA 1.0 . 5.33 1354 1236 A 54 ILE HG2% A 55 THR HA 1.0 . 4.21 1355 1237 A 54 ILE HA A 54 ILE HG2% 1.0 . 3.37 1356 1238 A 54 ILE HG2% A 74 TRP HBx 1.0 . 4.89 1357 1238 A 54 ILE HG2% A 74 TRP HBy 1.0 . 4.89 1358 1239 A 54 ILE HG2% A 54 ILE HG1y 1.0 . 4.06 1359 1240 A 54 ILE HG2% A 58 LEU HG 1.0 . 3.98 1360 1241 A 54 ILE HG2% A 57 ALA HB% 1.0 . 4.87 1361 1242 A 39 LEU HDx% A 54 ILE HG2% 1.0 . 4.98 1362 1243 A 54 ILE HG2% A 38 LEU HDy% 1.0 . 4.07 1363 1244 A 54 ILE HG2% A 33 LEU HDy% 1.0 . 3.72 1364 1245 A 54 ILE HG2% A 54 ILE HD1% 1.0 . 2.94 1365 1246 A 54 ILE HG2% A 58 LEU HDy% 1.0 . 3.51 1366 1247 A 15 TYR HD% A 11 ALA HA 1.0 . 3.99 1367 1248 A 15 TYR HE% A 11 ALA HA 1.0 . 4.26 1368 1249 A 51 TRP HD1 A 74 TRP HZ2 1.0 . 4.17 1369 1250 A 51 TRP HBy A 74 TRP HZ2 1.0 . 4.26 1370 1251 A 41 SER HA A 42 PRO HDy 1.0 . 3.06 1371 1252 A 41 SER HA A 42 PRO HDx 1.0 . 2.72 1372 1253 A 68 SER HA A 62 ALA HA 1.0 . 3.68 1373 1254 A 71 LEU HDx% A 62 ALA HA 1.0 . 4.63 1374 1255 A 65 LEU HA A 65 LEU HDx% 1.0 . 2.96 1375 1256 A 29 MET HBx A 28 ALA HA 1.0 . 5.50 1376 1257 A 38 LEU HDx% A 38 LEU HA 1.0 . 2.90 1377 1258 A 54 ILE HG1x A 38 LEU HA 1.0 . 4.17 1378 1259 A 60 GLN HGx A 57 ALA HA 1.0 . 4.67 1379 1260 A 57 ALA HA A 60 GLN HB2 1.0 . 3.49 1380 1260 A 60 GLN HB3 A 57 ALA HA 1.0 . 3.49 1381 1261 A 46 TYR HBy A 47 SER HA 1.0 . 5.04 1382 1262 A 3 ALA HA A 6 LYS HE2 1.0 . 4.70 1383 1262 A 3 ALA HA A 6 LYS HE3 1.0 . 4.70 1384 1263 A 3 ALA HA A 7 VAL HGy% 1.0 . 4.97 1385 1264 A 15 TYR HE% A 80 ALA HA 1.0 . 4.62 1386 1265 A 34 GLN HGy A 34 GLN HA 1.0 . 3.84 1387 1266 A 39 LEU HDy% A 34 GLN HGy 1.0 . 4.29 1388 1267 A 34 GLN HA A 34 GLN HGx 1.0 . 3.41 1389 1268 A 39 LEU HDy% A 34 GLN HGx 1.0 . 4.65 1390 1269 A 47 SER HA A 48 PRO HDy 1.0 . 2.73 1391 1270 A 47 SER HA A 48 PRO HGy 1.0 . 4.26 1392 1271 A 62 ALA HB% A 67 LYS HA 1.0 . 5.17 1393 1272 A 15 TYR HD% A 80 ALA HA 1.0 . 3.74 1394 1273 A 80 ALA HA A 15 TYR HBy 1.0 . 3.64 1395 1274 A 80 ALA HA A 15 TYR HBx 1.0 . 3.59 1396 1275 A 11 ALA HB% A 80 ALA HA 1.0 . 4.90 1397 1276 A 51 TRP HZ2 A 48 PRO HDy 1.0 . 5.38 1398 1277 A 54 ILE HD1% A 74 TRP HZ2 1.0 . 4.47 1399 1278 A 51 TRP HD1 A 54 ILE HD1% 1.0 . 4.07 1400 1279 A 74 TRP HH2 A 54 ILE HD1% 1.0 . 4.19 1401 1280 A 54 ILE HD1% A 74 TRP HZ3 1.0 . 4.69 1402 1281 A 54 ILE HD1% A 45 LEU HA 1.0 . 4.94 1403 1282 A 54 ILE HD1% A 51 TRP HBx 1.0 . 5.50 1404 1283 A 38 LEU HG A 54 ILE HD1% 1.0 . 5.01 1405 1284 A 39 LEU HBx A 54 ILE HD1% 1.0 . 4.99 1406 1285 A 39 LEU HDx% A 54 ILE HD1% 1.0 . 3.69 1407 1286 A 54 ILE HD1% A 51 TRP HA 1.0 . 3.86 1408 1287 A 50 SER HA A 54 ILE HD1% 1.0 . 5.14 1409 1288 A 54 ILE HD1% A 38 LEU HBx 1.0 . 4.71 1410 1289 A 54 ILE HD1% A 45 LEU HDy% 1.0 . 4.31 1411 1290 A 48 PRO HA A 51 TRP HZ2 1.0 . 4.73 1412 1291 A 64 ILE HG1x A 60 GLN HGy 1.0 . 5.11 1413 1292 A 60 GLN HGx A 60 GLN HB3 1.0 . 2.64 1414 1292 A 60 GLN HGx A 60 GLN HB2 1.0 . 2.64 1415 1293 A 8 ILE HD1% A 46 TYR HD% 1.0 . 4.93 1416 1294 A 46 TYR HE% A 8 ILE HD1% 1.0 . 4.19 1417 1295 A 8 ILE HB A 8 ILE HD1% 1.0 . 3.01 1418 1296 A 64 ILE HG1y A 60 GLN HGy 1.0 . 4.95 1419 1297 A 60 GLN HA A 60 GLN HGy 1.0 . 3.27 1420 1298 A 64 ILE HG2% A 60 GLN HGy 1.0 . 4.84 1421 1299 A 64 ILE HD1% A 60 GLN HGy 1.0 . 4.10 1422 1300 A 63 MET HE% A 60 GLN HGy 1.0 . 5.06 1423 1301 A 26 ILE HA A 26 ILE HD1% 1.0 . 3.86 1424 1302 A 7 VAL HB A 8 ILE HD1% 1.0 . 4.33 1425 1303 A 26 ILE HB A 26 ILE HD1% 1.0 . 3.08 1426 1304 A 8 ILE HG2% A 8 ILE HD1% 1.0 . 3.05 1427 1305 A 12 CYS HBy A 26 ILE HD1% 1.0 . 4.80 1428 1306 A 26 ILE HD1% A 9 SER HB2 1.0 . 3.02 1429 1306 A 26 ILE HD1% A 9 SER HB3 1.0 . 3.02 1430 1307 A 27 GLY HAy A 5 ILE HD1% 1.0 . 3.69 1431 1308 A 27 GLY HAx A 5 ILE HD1% 1.0 . 3.72 1432 1309 A 44 ASP HBy A 39 LEU HA 1.0 . 4.71 1433 1310 A 44 ASP HBx A 39 LEU HA 1.0 . 4.42 1434 1311 A 39 LEU HA A 39 LEU HG 1.0 . 4.16 1435 1312 A 15 TYR HE% A 84 ALA HA 1.0 . 3.66 1436 1313 A 85 ARG HA A 84 ALA HA 1.0 . 4.99 1437 1314 A 83 ALA HB% A 84 ALA HA 1.0 . 4.75 1438 1315 A 15 TYR HD% A 84 ALA HA 1.0 . 4.77 1439 1316 A 62 ALA HA A 67 LYS HBy 1.0 . 5.24 1440 1317 A 73 THR HA A 21 PRO HBy 1.0 . 4.43 1441 1318 A 77 VAL HGy% A 21 PRO HBy 1.0 . 5.09 1442 1319 A 26 ILE HD1% A 21 PRO HBy 1.0 . 4.77 1443 1320 A 29 MET HBx A 29 MET HE% 1.0 . 4.13 1444 1321 A 64 ILE HD1% A 63 MET HBy 1.0 . 4.94 1445 1321 A 64 ILE HD1% A 63 MET HBx 1.0 . 4.94 1446 1322 A 63 MET HA A 63 MET HBy 1.0 . 2.89 1447 1322 A 63 MET HA A 63 MET HBx 1.0 . 2.89 1448 1323 A 60 GLN HA A 63 MET HBy 1.0 . 3.43 1449 1323 A 60 GLN HA A 63 MET HBx 1.0 . 3.43 1450 1324 A 21 PRO HBx A 76 LEU HDy% 1.0 . 4.91 1451 1325 A 77 VAL HGy% A 21 PRO HBx 1.0 . 4.70 1452 1326 A 26 ILE HD1% A 21 PRO HBx 1.0 . 3.96 1453 1327 A 26 ILE HG1x A 21 PRO HBx 1.0 . 4.76 1454 1328 A 67 LYS HEy A 67 LYS HBx 1.0 . 5.12 1455 1329 A 79 GLY HAx A 82 LYS HBy 1.0 . 4.40 1456 1330 A 82 LYS HBy A 82 LYS HEy 1.0 . 4.93 1457 1331 A 82 LYS HBy A 82 LYS HEx 1.0 . 4.83 1458 1332 A 79 GLY HAx A 82 LYS HBx 1.0 . 4.27 1459 1333 A 82 LYS HBx A 82 LYS HEy 1.0 . 4.89 1460 1334 A 3 ALA HA A 6 LYS HBx 1.0 . 3.28 1461 1334 A 3 ALA HA A 6 LYS HBy 1.0 . 3.28 1462 1335 A 18 LYS HBx A 18 LYS HG2 1.0 . 2.95 1463 1335 A 18 LYS HBy A 18 LYS HG2 1.0 . 2.95 1464 1335 A 18 LYS HG3 A 18 LYS HBx 1.0 . 2.95 1465 1335 A 18 LYS HBy A 18 LYS HG3 1.0 . 2.95 1466 1336 A 24 LYS HBy A 24 LYS HA 1.0 . 2.98 1467 1337 A 60 GLN HGx A 64 ILE HD1% 1.0 . 4.74 1468 1338 A 64 ILE HD1% A 63 MET HE% 1.0 . 4.90 1469 1339 A 60 GLN HA A 64 ILE HD1% 1.0 . 4.81 1470 1340 A 64 ILE HG2% A 64 ILE HD1% 1.0 . 3.30 1471 1341 A 63 MET HGy A 63 MET HA 1.0 . 3.91 1472 1342 A 63 MET HGy A 62 ALA HB% 1.0 . 5.50 1473 1343 A 63 MET HGx A 63 MET HA 1.0 . 3.79 1474 1344 A 63 MET HGx A 60 GLN HA 1.0 . 5.11 1475 1345 A 46 TYR HE% A 7 VAL HB 1.0 . 4.40 1476 1346 A 10 SER HA A 13 LYS HB2 1.0 . 3.62 1477 1346 A 13 LYS HB3 A 10 SER HA 1.0 . 3.62 1478 1347 A 13 LYS HA A 13 LYS HB2 1.0 . 2.67 1479 1347 A 13 LYS HB3 A 13 LYS HA 1.0 . 2.67 1480 1348 A 77 VAL HB A 73 THR HG2% 1.0 . 4.99 1481 1349 A 51 TRP HE3 A 48 PRO HBy 1.0 . 4.27 1482 1350 A 51 TRP HZ2 A 48 PRO HBy 1.0 . 4.81 1483 1351 A 51 TRP HZ3 A 48 PRO HBy 1.0 . 4.12 1484 1352 A 51 TRP HH2 A 48 PRO HBy 1.0 . 4.37 1485 1353 A 77 VAL HB A 74 TRP HE3 1.0 . 3.74 1486 1354 A 77 VAL HB A 74 TRP HA 1.0 . 3.14 1487 1355 A 72 LYS HA A 72 LYS HBx 1.0 . 2.77 1488 1355 A 72 LYS HA A 72 LYS HBy 1.0 . 2.77 1489 1356 A 21 PRO HDy A 20 SER HA 1.0 . 3.25 1490 1357 A 12 CYS HBy A 21 PRO HDy 1.0 . 4.27 1491 1358 A 21 PRO HDy A 12 CYS HBx 1.0 . 4.26 1492 1359 A 21 PRO HDy A 76 LEU HDy% 1.0 . 3.73 1493 1360 A 76 LEU HBx A 21 PRO HDy 1.0 . 4.03 1494 1361 A 76 LEU HDx% A 21 PRO HDy 1.0 . 4.56 1495 1362 A 20 SER HA A 21 PRO HDx 1.0 . 3.24 1496 1363 A 12 CYS HBy A 21 PRO HDx 1.0 . 3.92 1497 1364 A 76 LEU HDx% A 21 PRO HDx 1.0 . 5.07 1498 1365 A 77 VAL HGy% A 21 PRO HDx 1.0 . 5.50 1499 1366 A 26 ILE HD1% A 21 PRO HDx 1.0 . 5.05 1500 1367 A 50 SER HA A 53 PRO HBy 1.0 . 5.46 1501 1368 A 57 ALA HB% A 53 PRO HBy 1.0 . 4.61 1502 1369 A 38 LEU HDx% A 53 PRO HBy 1.0 . 4.47 1503 1370 A 87 GLU HBy A 87 GLU HG2 1.0 . 2.59 1504 1370 A 87 GLU HG3 A 87 GLU HBy 1.0 . 2.59 1505 1371 A 48 PRO HDx A 47 SER HA 1.0 . 3.05 1506 1372 A 74 TRP HE3 A 74 TRP HBx 1.0 . 3.88 1507 1372 A 74 TRP HE3 A 74 TRP HBy 1.0 . 3.88 1508 1373 A 74 TRP HD1 A 74 TRP HBx 1.0 . 3.41 1509 1373 A 74 TRP HD1 A 74 TRP HBy 1.0 . 3.41 1510 1374 A 73 THR HB A 29 MET HGy 1.0 . 4.41 1511 1375 A 29 MET HA A 29 MET HGy 1.0 . 3.67 1512 1376 A 29 MET HGy A 74 TRP HBx 1.0 . 4.52 1513 1376 A 74 TRP HBy A 29 MET HGy 1.0 . 4.52 1514 1377 A 29 MET HGy A 70 GLU HBx 1.0 . 4.60 1515 1378 A 29 MET HGy A 73 THR HG2% 1.0 . 4.65 1516 1379 A 32 LEU HDy% A 29 MET HGy 1.0 . 5.50 1517 1380 A 29 MET HGy A 33 LEU HDy% 1.0 . 4.66 1518 1381 A 33 LEU HDx% A 29 MET HGy 1.0 . 5.03 1519 1382 A 29 MET HA A 29 MET HGx 1.0 . 3.68 1520 1383 A 33 LEU HDy% A 29 MET HGx 1.0 . 4.18 1521 1384 A 33 LEU HDx% A 29 MET HGx 1.0 . 4.79 1522 1385 A 51 TRP HH2 A 85 ARG HBx 1.0 . 4.98 1523 1385 A 51 TRP HH2 A 85 ARG HBy 1.0 . 4.98 1524 1386 A 42 PRO HDy A 4 VAL HGy% 1.0 . 5.46 1525 1387 A 77 VAL HB A 74 TRP HBx 1.0 . 5.50 1526 1387 A 77 VAL HB A 74 TRP HBy 1.0 . 5.50 1527 1388 A 85 ARG HA A 85 ARG HBx 1.0 . 3.01 1528 1388 A 85 ARG HA A 85 ARG HBy 1.0 . 3.01 1529 1389 A 85 ARG HDy A 85 ARG HBx 1.0 . 4.00 1530 1389 A 85 ARG HDy A 85 ARG HBy 1.0 . 4.00 1531 1390 A 50 SER HA A 53 PRO HDy 1.0 . 3.82 1532 1390 A 50 SER HA A 53 PRO HDx 1.0 . 3.82 1533 1391 A 52 ASP HBy A 53 PRO HDy 1.0 . 3.15 1534 1391 A 52 ASP HBy A 53 PRO HDx 1.0 . 3.15 1535 1392 A 52 ASP HBx A 53 PRO HDy 1.0 . 3.41 1536 1392 A 52 ASP HBx A 53 PRO HDx 1.0 . 3.41 1537 1393 A 51 TRP HA A 54 ILE HG1y 1.0 . 4.92 1538 1394 A 54 ILE HG1y A 50 SER HBx 1.0 . 5.29 1539 1395 A 61 ARG HDy A 61 ARG HBy 1.0 . 3.64 1540 1396 A 61 ARG HDx A 61 ARG HBy 1.0 . 3.64 1541 1397 A 61 ARG HBx A 61 ARG HG2 1.0 . 2.78 1542 1397 A 61 ARG HG3 A 61 ARG HBx 1.0 . 2.78 1543 1398 A 38 LEU HDx% A 54 ILE HG1y 1.0 . 4.10 1544 1399 A 62 ALA HA A 61 ARG HBx 1.0 . 4.84 1545 1400 A 5 ILE HA A 5 ILE HG1y 1.0 . 3.72 1546 1401 A 27 GLY HAx A 5 ILE HG1x 1.0 . 4.71 1547 1402 A 5 ILE HA A 5 ILE HG1x 1.0 . 3.77 1548 1403 A 38 LEU HG A 54 ILE HG1x 1.0 . 5.18 1549 1404 A 54 ILE HG2% A 54 ILE HG1x 1.0 . 4.07 1550 1405 A 36 GLU HBy A 32 LEU HDx% 1.0 . 4.73 1551 1406 A 36 GLU HBy A 38 LEU HDy% 1.0 . 3.83 1552 1407 A 86 GLU HBy A 83 ALA HA 1.0 . 5.05 1553 1408 A 36 GLU HBx A 33 LEU HA 1.0 . 4.00 1554 1409 A 86 GLU HBx A 83 ALA HA 1.0 . 4.68 1555 1410 A 74 TRP HZ2 A 51 TRP HBx 1.0 . 4.03 1556 1411 A 25 GLU HBx A 25 GLU HG2 1.0 . 2.83 1557 1411 A 25 GLU HG3 A 25 GLU HBx 1.0 . 2.83 1558 1412 A 2 GLU HA A 2 GLU HB2 1.0 . 2.84 1559 1412 A 2 GLU HB3 A 2 GLU HA 1.0 . 2.84 1560 1413 A 3 ALA HB% A 2 GLU HB2 1.0 . 5.09 1561 1413 A 2 GLU HB3 A 3 ALA HB% 1.0 . 5.09 1562 1414 A 5 ILE HD1% A 2 GLU HB2 1.0 . 4.38 1563 1414 A 2 GLU HB3 A 5 ILE HD1% 1.0 . 4.38 1564 1415 A 51 TRP HE3 A 82 LYS HDx 1.0 . 5.03 1565 1415 A 51 TRP HE3 A 82 LYS HDy 1.0 . 5.03 1566 1416 A 51 TRP HZ3 A 82 LYS HDx 1.0 . 4.22 1567 1416 A 51 TRP HZ3 A 82 LYS HDy 1.0 . 4.22 1568 1417 A 82 LYS HA A 82 LYS HDx 1.0 . 3.83 1569 1417 A 82 LYS HA A 82 LYS HDy 1.0 . 3.83 1570 1418 A 79 GLY HAx A 82 LYS HDx 1.0 . 4.25 1571 1418 A 79 GLY HAx A 82 LYS HDy 1.0 . 4.25 1572 1419 A 78 LEU HG A 82 LYS HDx 1.0 . 4.22 1573 1419 A 78 LEU HG A 82 LYS HDy 1.0 . 4.22 1574 1420 A 78 LEU HDy% A 82 LYS HDx 1.0 . 4.45 1575 1420 A 78 LEU HDy% A 82 LYS HDy 1.0 . 4.45 1576 1421 A 78 LEU HDx% A 82 LYS HDx 1.0 . 4.14 1577 1421 A 78 LEU HDx% A 82 LYS HDy 1.0 . 4.14 1578 1422 A 26 ILE HG2% A 26 ILE HG1x 1.0 . 3.75 1579 1423 A 51 TRP HBy A 51 TRP HE3 1.0 . 3.67 1580 1424 A 25 GLU HBy A 21 PRO HBx 1.0 . 4.58 1581 1425 A 73 THR HG2% A 26 ILE HG1y 1.0 . 5.07 1582 1426 A 26 ILE HG2% A 26 ILE HG1y 1.0 . 3.81 1583 1427 A 78 LEU HBy A 82 LYS HDx 1.0 . 5.46 1584 1427 A 78 LEU HBy A 82 LYS HDy 1.0 . 5.46 1585 1428 A 25 GLU HBy A 73 THR HG2% 1.0 . 5.15 1586 1429 A 25 GLU HBx A 73 THR HG2% 1.0 . 4.43 1587 1430 A 34 GLN HA A 34 GLN HB2 1.0 . 2.88 1588 1430 A 34 GLN HB3 A 34 GLN HA 1.0 . 2.88 1589 1431 A 31 SER HA A 34 GLN HB2 1.0 . 3.27 1590 1431 A 34 GLN HB3 A 31 SER HA 1.0 . 3.27 1591 1432 A 34 GLN HB2 A 35 LYS HG2 1.0 . 5.00 1592 1432 A 34 GLN HB3 A 35 LYS HG2 1.0 . 5.00 1593 1432 A 35 LYS HG3 A 34 GLN HB2 1.0 . 5.00 1594 1432 A 34 GLN HB3 A 35 LYS HG3 1.0 . 5.00 1595 1433 A 39 LEU HDy% A 34 GLN HB2 1.0 . 4.39 1596 1433 A 39 LEU HDy% A 34 GLN HB3 1.0 . 4.39 1597 1434 A 3 ALA HA A 6 LYS HD2 1.0 . 4.15 1598 1434 A 3 ALA HA A 6 LYS HD3 1.0 . 4.15 1599 1435 A 23 LYS HA A 23 LYS HD2 1.0 . 4.27 1600 1435 A 23 LYS HA A 23 LYS HD3 1.0 . 4.27 1601 1436 A 6 LYS HD2 A 6 LYS HE2 1.0 . 2.52 1602 1436 A 6 LYS HD3 A 6 LYS HE2 1.0 . 2.52 1603 1436 A 6 LYS HE3 A 6 LYS HD2 1.0 . 2.52 1604 1436 A 6 LYS HE3 A 6 LYS HD3 1.0 . 2.52 1605 1437 A 15 TYR HD% A 14 THR HB 1.0 . 3.77 1606 1438 A 15 TYR HE% A 14 THR HB 1.0 . 4.20 1607 1439 A 14 THR HB A 15 TYR HA 1.0 . 4.62 1608 1440 A 14 THR HB A 11 ALA HA 1.0 . 3.26 1609 1441 A 14 THR HB A 14 THR HA 1.0 . 2.97 1610 1442 A 11 ALA HB% A 14 THR HB 1.0 . 4.50 1611 1443 A 32 LEU HA A 35 LYS HD2 1.0 . 3.71 1612 1443 A 32 LEU HA A 35 LYS HD3 1.0 . 3.71 1613 1444 A 18 LYS HD2 A 18 LYS HG2 1.0 . 2.40 1614 1444 A 18 LYS HD3 A 18 LYS HG2 1.0 . 2.40 1615 1444 A 18 LYS HG3 A 18 LYS HD2 1.0 . 2.40 1616 1444 A 18 LYS HD3 A 18 LYS HG3 1.0 . 2.40 1617 1445 A 32 LEU HDx% A 35 LYS HD2 1.0 . 4.20 1618 1445 A 35 LYS HD3 A 32 LEU HDx% 1.0 . 4.20 1619 1446 A 32 LEU HDy% A 35 LYS HD2 1.0 . 4.94 1620 1446 A 35 LYS HD3 A 32 LEU HDy% 1.0 . 4.94 1621 1447 A 8 ILE HA A 8 ILE HG1y 1.0 . 3.73 1622 1448 A 8 ILE HG2% A 8 ILE HG1y 1.0 . 3.83 1623 1449 A 46 TYR HE% A 8 ILE HG1y 1.0 . 4.55 1624 1450 A 46 TYR HE% A 8 ILE HG1x 1.0 . 4.59 1625 1451 A 11 ALA HB% A 8 ILE HG1x 1.0 . 5.50 1626 1452 A 8 ILE HA A 8 ILE HG1x 1.0 . 3.51 1627 1453 A 76 LEU HDy% A 19 THR HB 1.0 . 4.57 1628 1454 A 76 LEU HDx% A 19 THR HB 1.0 . 4.05 1629 1455 A 55 THR HB A 56 ALA HA 1.0 . 4.52 1630 1456 A 55 THR HB A 56 ALA HB% 1.0 . 4.57 1631 1457 A 60 GLN HA A 60 GLN HB2 1.0 . 2.68 1632 1457 A 60 GLN HB3 A 60 GLN HA 1.0 . 2.68 1633 1458 A 60 GLN HB2 A 60 GLN HGy 1.0 . 3.00 1634 1458 A 60 GLN HB3 A 60 GLN HGy 1.0 . 3.00 1635 1459 A 32 LEU HDy% A 70 GLU HBy 1.0 . 4.18 1636 1460 A 32 LEU HDy% A 70 GLU HBx 1.0 . 4.30 1637 1461 A 29 MET HA A 70 GLU HBx 1.0 . 4.15 1638 1462 A 57 ALA HB% A 60 GLN HB2 1.0 . 4.36 1639 1462 A 60 GLN HB3 A 57 ALA HB% 1.0 . 4.36 1640 1463 A 64 ILE HD1% A 60 GLN HB2 1.0 . 4.18 1641 1463 A 60 GLN HB3 A 64 ILE HD1% 1.0 . 4.18 1642 1464 A 70 GLU HBy A 58 LEU HDx% 1.0 . 4.34 1643 1465 A 70 GLU HBx A 58 LEU HDx% 1.0 . 4.23 1644 1466 A 58 LEU HDy% A 70 GLU HBx 1.0 . 4.98 1645 1467 A 64 ILE HG1x A 61 ARG HA 1.0 . 5.18 1646 1468 A 53 PRO HGy A 54 ILE HG1y 1.0 . 3.58 1647 1469 A 64 ILE HG1y A 64 ILE HA 1.0 . 3.73 1648 1470 A 64 ILE HG1y A 64 ILE HG2% 1.0 . 3.69 1649 1471 A 64 ILE HG1x A 64 ILE HA 1.0 . 3.53 1650 1472 A 64 ILE HG1x A 64 ILE HG2% 1.0 . 3.59 1651 1473 A 29 MET HA A 73 THR HB 1.0 . 5.07 1652 1474 A 29 MET HBy A 73 THR HB 1.0 . 4.63 1653 1475 A 29 MET HBx A 73 THR HB 1.0 . 4.18 1654 1476 A 73 THR HB A 29 MET HGx 1.0 . 4.69 1655 1477 A 73 THR HB A 29 MET HE% 1.0 . 4.89 1656 1478 A 42 PRO HGy A 4 VAL HGx% 1.0 . 4.35 1657 1479 A 16 CYS HBy A 16 CYS HA 1.0 . 2.97 1658 1480 A 16 CYS HBy A 20 SER HA 1.0 . 3.45 1659 1481 A 16 CYS HBx A 20 SER HA 1.0 . 3.40 1660 1482 A 76 LEU HDx% A 16 CYS HBx 1.0 . 4.84 1661 1483 A 42 PRO HGy A 4 VAL HGy% 1.0 . 4.41 1662 1484 A 76 LEU HDy% A 21 PRO HGy 1.0 . 4.18 1663 1485 A 1 SER HBx A 42 PRO HGx 1.0 . 4.26 1664 1486 A 77 VAL HGy% A 21 PRO HGx 1.0 . 3.81 1665 1487 A 26 ILE HD1% A 21 PRO HGx 1.0 . 4.05 1666 1488 A 12 CYS HBx A 21 PRO HGx 1.0 . 4.93 1667 1489 A 42 PRO HGx A 4 VAL HGx% 1.0 . 4.29 1668 1490 A 69 GLY HAy A 72 LYS HBx 1.0 . 4.84 1669 1490 A 69 GLY HAy A 72 LYS HBy 1.0 . 4.84 1670 1491 A 69 GLY HAx A 72 LYS HBx 1.0 . 4.11 1671 1491 A 69 GLY HAx A 72 LYS HBy 1.0 . 4.11 1672 1492 A 61 ARG HA A 61 ARG HG2 1.0 . 3.19 1673 1492 A 61 ARG HG3 A 61 ARG HA 1.0 . 3.19 1674 1493 A 27 GLY HAy A 30 LEU HBy 1.0 . 5.05 1675 1494 A 58 LEU HDy% A 55 THR HA 1.0 . 4.64 1676 1495 A 74 TRP HD1 A 55 THR HA 1.0 . 3.45 1677 1496 A 55 THR HA A 58 LEU HBy 1.0 . 4.04 1678 1497 A 12 CYS HBy A 9 SER HA 1.0 . 3.30 1679 1498 A 12 CYS HBx A 21 PRO HDx 1.0 . 3.52 1680 1499 A 51 TRP HH2 A 85 ARG HGy 1.0 . 5.02 1681 1499 A 51 TRP HH2 A 85 ARG HGx 1.0 . 5.02 1682 1500 A 85 ARG HA A 85 ARG HGy 1.0 . 3.33 1683 1500 A 85 ARG HA A 85 ARG HGx 1.0 . 3.33 1684 1501 A 32 LEU HA A 32 LEU HG 1.0 . 3.52 1685 1502 A 38 LEU HG A 33 LEU HA 1.0 . 4.40 1686 1503 A 36 GLU HBy A 38 LEU HG 1.0 . 3.89 1687 1504 A 55 THR HA A 58 LEU HBx 1.0 . 5.01 1688 1505 A 30 LEU HA A 30 LEU HG 1.0 . 3.63 1689 1506 A 29 MET HE% A 30 LEU HG 1.0 . 4.30 1690 1507 A 51 TRP HH2 A 48 PRO HGx 1.0 . 4.71 1691 1508 A 76 LEU HBy A 73 THR HA 1.0 . 3.88 1692 1509 A 76 LEU HG A 73 THR HA 1.0 . 4.72 1693 1510 A 79 GLY HAy A 80 ALA HB% 1.0 . 5.31 1694 1511 A 65 LEU HA A 65 LEU HG 1.0 . 3.75 1695 1512 A 73 THR HA A 21 PRO HA 1.0 . 4.47 1696 1513 A 74 TRP HA A 73 THR HA 1.0 . 5.00 1697 1514 A 76 LEU HBx A 73 THR HA 1.0 . 4.65 1698 1515 A 45 LEU HA A 45 LEU HG 1.0 . 4.25 1699 1516 A 81 LEU HDy% A 45 LEU HG 1.0 . 4.73 1700 1517 A 10 SER HBy A 7 VAL HA 1.0 . 4.46 1701 1518 A 7 VAL HGy% A 7 VAL HA 1.0 . 3.06 1702 1519 A 74 TRP HZ3 A 45 LEU HG 1.0 . 4.97 1703 1520 A 51 TRP HE3 A 82 LYS HGx 1.0 . 4.67 1704 1520 A 51 TRP HE3 A 82 LYS HGy 1.0 . 4.67 1705 1521 A 51 TRP HZ3 A 82 LYS HGx 1.0 . 3.85 1706 1521 A 51 TRP HZ3 A 82 LYS HGy 1.0 . 3.85 1707 1522 A 51 TRP HH2 A 82 LYS HGx 1.0 . 4.71 1708 1522 A 51 TRP HH2 A 82 LYS HGy 1.0 . 4.71 1709 1523 A 82 LYS HA A 82 LYS HGx 1.0 . 3.25 1710 1523 A 82 LYS HA A 82 LYS HGy 1.0 . 3.25 1711 1524 A 82 LYS HEx A 82 LYS HGx 1.0 . 4.08 1712 1524 A 82 LYS HEx A 82 LYS HGy 1.0 . 4.08 1713 1525 A 82 LYS HDy A 82 LYS HGx 1.0 . 3.00 1714 1525 A 82 LYS HDx A 82 LYS HGx 1.0 . 3.00 1715 1525 A 82 LYS HGy A 82 LYS HDx 1.0 . 3.00 1716 1525 A 82 LYS HDy A 82 LYS HGy 1.0 . 3.00 1717 1526 A 77 VAL HA A 76 LEU HDy% 1.0 . 5.50 1718 1527 A 33 LEU HG A 29 MET HGy 1.0 . 4.97 1719 1528 A 82 LYS HEy A 82 LYS HGx 1.0 . 3.74 1720 1528 A 82 LYS HEy A 82 LYS HGy 1.0 . 3.74 1721 1529 A 26 ILE HA A 29 MET HBy 1.0 . 4.00 1722 1530 A 26 ILE HA A 26 ILE HG1y 1.0 . 3.61 1723 1531 A 26 ILE HA A 26 ILE HG1x 1.0 . 3.75 1724 1532 A 54 ILE HA A 54 ILE HG1y 1.0 . 3.53 1725 1533 A 54 ILE HA A 57 ALA HB% 1.0 . 3.53 1726 1534 A 38 LEU HDx% A 54 ILE HA 1.0 . 3.51 1727 1535 A 54 ILE HA A 54 ILE HG1x 1.0 . 3.11 1728 1536 A 77 VAL HA A 80 ALA HB% 1.0 . 3.50 1729 1537 A 77 VAL HA A 77 VAL HGy% 1.0 . 3.10 1730 1538 A 23 LYS HA A 23 LYS HGx 1.0 . 3.76 1731 1538 A 23 LYS HA A 23 LYS HGy 1.0 . 3.76 1732 1539 A 81 LEU HG A 81 LEU HBx 1.0 . 2.97 1733 1540 A 5 ILE HG2% A 23 LYS HGx 1.0 . 4.11 1734 1540 A 23 LYS HGy A 5 ILE HG2% 1.0 . 4.11 1735 1541 A 23 LYS HE2 A 23 LYS HGx 1.0 . 4.22 1736 1541 A 23 LYS HGy A 23 LYS HE2 1.0 . 4.22 1737 1541 A 23 LYS HGy A 23 LYS HE3 1.0 . 4.22 1738 1541 A 23 LYS HE3 A 23 LYS HGx 1.0 . 4.22 1739 1542 A 76 LEU HDy% A 20 SER HA 1.0 . 3.91 1740 1543 A 76 LEU HA A 76 LEU HDy% 1.0 . 3.81 1741 1544 A 71 LEU HDx% A 68 SER HBx 1.0 . 4.56 1742 1545 A 71 LEU HDx% A 71 LEU HBy 1.0 . 3.27 1743 1546 A 71 LEU HDx% A 62 ALA HB% 1.0 . 3.16 1744 1547 A 71 LEU HDx% A 59 SER HA 1.0 . 3.23 1745 1548 A 58 LEU HDy% A 71 LEU HDx% 1.0 . 5.50 1746 1549 A 38 LEU HDx% A 37 GLY HAy 1.0 . 5.10 1747 1550 A 65 LEU HA A 66 GLY HAx 1.0 . 4.60 1748 1551 A 26 ILE HA A 29 MET HBx 1.0 . 4.49 1749 1552 A 26 ILE HA A 26 ILE HG2% 1.0 . 2.93 1750 1553 A 73 THR HA A 76 LEU HDy% 1.0 . 3.54 1751 1554 A 76 LEU HDy% A 21 PRO HDx 1.0 . 4.14 1752 1555 A 76 LEU HDy% A 21 PRO HBy 1.0 . 4.36 1753 1556 A 76 LEU HBy A 76 LEU HDy% 1.0 . 3.48 1754 1557 A 39 LEU HDx% A 39 LEU HA 1.0 . 3.94 1755 1558 A 44 ASP HBx A 39 LEU HDx% 1.0 . 4.48 1756 1559 A 30 LEU HA A 33 LEU HDy% 1.0 . 3.68 1757 1560 A 33 LEU HBx A 33 LEU HDy% 1.0 . 3.90 1758 1561 A 74 TRP HE3 A 33 LEU HDy% 1.0 . 5.18 1759 1562 A 5 ILE HA A 4 VAL HGx% 1.0 . 3.69 1760 1563 A 30 LEU HDy% A 30 LEU HA 1.0 . 4.43 1761 1564 A 27 GLY HAx A 30 LEU HDy% 1.0 . 4.20 1762 1565 A 39 LEU HDx% A 34 GLN HGy 1.0 . 4.56 1763 1566 A 42 PRO HA A 4 VAL HGy% 1.0 . 4.49 1764 1567 A 32 LEU HA A 32 LEU HDy% 1.0 . 3.71 1765 1568 A 32 LEU HBy A 32 LEU HDy% 1.0 . 3.52 1766 1569 A 32 LEU HBx A 32 LEU HDy% 1.0 . 3.46 1767 1570 A 54 ILE HA A 38 LEU HDy% 1.0 . 3.81 1768 1571 A 81 LEU HDy% A 51 TRP HZ2 1.0 . 4.27 1769 1572 A 81 LEU HDy% A 46 TYR HD% 1.0 . 4.60 1770 1573 A 46 TYR HE% A 81 LEU HDy% 1.0 . 5.37 1771 1574 A 74 TRP HD1 A 58 LEU HDy% 1.0 . 4.07 1772 1575 A 58 LEU HDy% A 74 TRP HA 1.0 . 4.76 1773 1576 A 54 ILE HA A 58 LEU HDy% 1.0 . 4.99 1774 1577 A 58 LEU HDy% A 74 TRP HBx 1.0 . 3.41 1775 1577 A 74 TRP HBy A 58 LEU HDy% 1.0 . 3.41 1776 1578 A 29 MET HGy A 58 LEU HDy% 1.0 . 4.74 1777 1579 A 58 LEU HDy% A 29 MET HGx 1.0 . 5.21 1778 1580 A 58 LEU HDy% A 58 LEU HBy 1.0 . 3.66 1779 1581 A 58 LEU HDy% A 58 LEU HBx 1.0 . 3.73 1780 1582 A 22 SER HBx A 22 SER HA 1.0 . 2.92 1781 1583 A 22 SER HBx A 25 GLU HG2 1.0 . 5.04 1782 1583 A 25 GLU HG3 A 22 SER HBx 1.0 . 5.04 1783 1584 A 65 LEU HA A 65 LEU HDy% 1.0 . 4.01 1784 1585 A 65 LEU HDy% A 67 LYS HEy 1.0 . 4.62 1785 1586 A 1 SER HA A 1 SER HBx 1.0 . 2.79 1786 1587 A 1 SER HBx A 42 PRO HGy 1.0 . 4.49 1787 1588 A 1 SER HBx A 4 VAL HGx% 1.0 . 5.14 1788 1589 A 6 LYS HGx A 3 ALA HA 1.0 . 4.59 1789 1590 A 65 LEU HDy% A 67 LYS HEx 1.0 . 5.09 1790 1591 A 65 LEU HDy% A 61 ARG HA 1.0 . 4.15 1791 1592 A 74 TRP HH2 A 45 LEU HDy% 1.0 . 4.21 1792 1593 A 74 TRP HZ3 A 45 LEU HDy% 1.0 . 3.84 1793 1594 A 45 LEU HA A 45 LEU HDy% 1.0 . 3.39 1794 1595 A 74 TRP HH2 A 51 TRP HD1 1.0 . 4.07 1795 1596 A 51 TRP HD1 A 45 LEU HDy% 1.0 . 5.16 1796 1597 A 8 ILE HA A 7 VAL HGy% 1.0 . 5.50 1797 1598 A 8 ILE HA A 8 ILE HG2% 1.0 . 3.20 1798 1599 A 13 LYS HGx A 13 LYS HA 1.0 . 3.50 1799 1600 A 74 TRP HE3 A 45 LEU HDy% 1.0 . 4.89 1800 1601 A 29 MET HE% A 45 LEU HDy% 1.0 . 4.11 1801 1602 A 54 ILE HG2% A 45 LEU HDy% 1.0 . 5.11 1802 1603 A 4 VAL HA A 46 TYR HE% 1.0 . 4.78 1803 1604 A 4 VAL HA A 7 VAL HB 1.0 . 3.44 1804 1605 A 8 ILE HA A 8 ILE HD1% 1.0 . 3.77 1805 1606 A 6 LYS HGx A 6 LYS HA 1.0 . 3.60 1806 1607 A 76 LEU HDy% A 72 LYS HGy 1.0 . 5.38 1807 1607 A 76 LEU HDy% A 72 LYS HGx 1.0 . 5.38 1808 1608 A 35 LYS HE3 A 35 LYS HG2 1.0 . 3.19 1809 1608 A 35 LYS HE2 A 35 LYS HG2 1.0 . 3.19 1810 1608 A 35 LYS HG3 A 35 LYS HE2 1.0 . 3.19 1811 1608 A 35 LYS HG3 A 35 LYS HE3 1.0 . 3.19 1812 1609 A 24 LYS HGx A 24 LYS HA 1.0 . 3.35 1813 1610 A 39 LEU HDy% A 39 LEU HA 1.0 . 3.72 1814 1611 A 39 LEU HDy% A 42 PRO HA 1.0 . 3.85 1815 1612 A 39 LEU HDy% A 44 ASP HBy 1.0 . 3.72 1816 1613 A 39 LEU HDy% A 44 ASP HBx 1.0 . 3.91 1817 1614 A 39 LEU HDy% A 39 LEU HBy 1.0 . 3.75 1818 1615 A 78 LEU HDy% A 75 GLY HAx 1.0 . 4.68 1819 1616 A 78 LEU HDy% A 51 TRP HE3 1.0 . 5.21 1820 1617 A 78 LEU HDy% A 74 TRP HZ2 1.0 . 3.99 1821 1618 A 74 TRP HD1 A 78 LEU HDy% 1.0 . 4.68 1822 1619 A 51 TRP HBy A 78 LEU HDy% 1.0 . 5.31 1823 1620 A 78 LEU HA A 78 LEU HDy% 1.0 . 4.16 1824 1621 A 78 LEU HDy% A 82 LYS HGx 1.0 . 4.47 1825 1621 A 78 LEU HDy% A 82 LYS HGy 1.0 . 4.47 1826 1622 A 78 LEU HDy% A 78 LEU HBx 1.0 . 3.57 1827 1623 A 18 LYS HA A 18 LYS HG2 1.0 . 3.40 1828 1623 A 18 LYS HG3 A 18 LYS HA 1.0 . 3.40 1829 1624 A 39 LEU HDy% A 39 LEU HBx 1.0 . 3.45 1830 1625 A 39 LEU HBx A 34 GLN HA 1.0 . 4.79 1831 1626 A 39 LEU HBx A 34 GLN HGx 1.0 . 4.76 1832 1627 A 78 LEU HDy% A 51 TRP HBx 1.0 . 4.77 1833 1628 A 78 LEU HBy A 78 LEU HDy% 1.0 . 3.63 stop_ save_ save_peak_list _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode peak_list _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 2 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 . . . 3857.01171875 . . . . 2 . . . 1418.81396484 . . . . stop_ save_