data_nef_c34477_6txt save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6TXT stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ASN start . . 2 A 2 LEU middle . . 3 A 3 THR middle . . 4 A 4 LYS middle . . 5 A 5 GLN middle . . 6 A 6 LYS middle . . 7 A 7 ASP middle . . 8 A 8 ALA middle . . 9 A 9 VAL middle . . 10 A 10 SER middle . . 11 A 11 ASP middle . . 12 A 12 THR middle . . 13 A 13 GLY middle . false 14 A 14 THR middle . . 15 A 15 ALA middle . . 16 A 16 ALA middle . . 17 A 17 VAL middle . . 18 A 18 VAL middle . . 19 A 19 LYS middle . . 20 A 20 VAL middle . . 21 A 21 VAL middle . . 22 A 22 GLU middle . . 23 A 23 SER middle . . 24 A 24 GLN middle . . 25 A 25 ALA middle . . 26 A 26 GLU middle . . 27 A 27 LEU middle . . 28 A 28 TYR middle . . 29 A 29 GLU middle . . 30 A 30 LEU middle . . 31 A 31 LYS middle . . 32 A 32 ASN middle . . 33 A 33 THR middle . . 34 A 34 ASN middle . . 35 A 35 GLU middle . . 36 A 36 LYS middle . . 37 A 37 ALA middle . . 38 A 38 SER middle . . 39 A 39 LEU middle . . 40 A 40 SER middle . . 41 A 41 LYS middle . . 42 A 42 LEU middle . . 43 A 43 VAL middle . . 44 A 44 SER middle . . 45 A 45 SER middle . . 46 A 46 GLY middle . false 47 A 47 ASN middle . . 48 A 48 ILE middle . . 49 A 49 SER middle . . 50 A 50 GLN middle . . 51 A 51 LYS middle . . 52 A 52 GLN middle . . 53 A 53 ALA middle . . 54 A 54 ASP middle . . 55 A 55 SER middle . . 56 A 56 TYR middle . . 57 A 57 LYS middle . . 58 A 58 ALA middle . . 59 A 59 TYR middle . . 60 A 60 TYR middle . . 61 A 61 GLY middle . false 62 A 62 LYS middle . . 63 A 63 HIS middle . . 64 A 64 SER middle . . 65 A 65 GLY middle . false 66 A 66 GLU middle . . 67 A 67 THR middle . . 68 A 68 GLN middle . . 69 A 69 THR middle . . 70 A 70 VAL middle . . 71 A 71 ALA middle . . 72 A 72 ASN end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ASN HA H 1 4.672 0.000 A 1 ASN HBy H 1 2.824 0.000 A 1 ASN HBx H 1 2.726 0.000 A 1 ASN HD2y H 1 7.602 0.000 A 1 ASN HD2x H 1 6.921 0.000 A 1 ASN C C 13 175.166 0.000 A 1 ASN CA C 13 53.415 0.018 A 1 ASN CB C 13 38.734 0.019 A 1 ASN ND2 N 15 113.475 0.001 A 2 LEU H H 1 8.364 0.003 A 2 LEU HA H 1 4.371 0.003 A 2 LEU HBy H 1 1.649 0.002 A 2 LEU HBx H 1 1.603 0.000 A 2 LEU HDx% H 1 0.897 0.003 A 2 LEU HDy% H 1 0.835 0.004 A 2 LEU HG H 1 1.603 0.005 A 2 LEU C C 13 177.633 0.000 A 2 LEU CA C 13 55.533 0.058 A 2 LEU CB C 13 42.318 0.070 A 2 LEU CDy C 13 24.886 0.032 A 2 LEU CDx C 13 23.446 0.028 A 2 LEU CG C 13 26.944 0.018 A 2 LEU N N 15 122.770 0.009 A 3 THR H H 1 8.122 0.004 A 3 THR HA H 1 4.235 0.040 A 3 THR HB H 1 4.192 0.004 A 3 THR HG2% H 1 1.194 0.003 A 3 THR C C 13 174.471 0.000 A 3 THR CA C 13 62.168 0.051 A 3 THR CB C 13 69.804 0.046 A 3 THR CG2 C 13 21.662 0.014 A 3 THR N N 15 114.863 0.015 A 4 LYS H H 1 8.268 0.002 A 4 LYS HA H 1 4.300 0.003 A 4 LYS HBy H 1 1.825 0.002 A 4 LYS HBx H 1 1.749 0.007 A 4 LYS HDx H 1 1.676 0.005 A 4 LYS HDy H 1 1.703 0.000 A 4 LYS HGy H 1 1.418 0.001 A 4 LYS HGx H 1 1.398 0.000 A 4 LYS C C 13 176.449 0.000 A 4 LYS CA C 13 56.379 0.055 A 4 LYS CB C 13 33.016 0.057 A 4 LYS CD C 13 29.092 0.024 A 4 LYS CE C 13 42.108 0.000 A 4 LYS CG C 13 24.675 0.023 A 4 LYS N N 15 123.661 0.043 A 5 GLN H H 1 8.395 0.004 A 5 GLN HA H 1 3.860 0.002 A 5 GLN HBy H 1 2.093 0.001 A 5 GLN HBx H 1 1.980 0.002 A 5 GLN HE2y H 1 7.576 0.001 A 5 GLN HE2x H 1 6.862 0.002 A 5 GLN HGy H 1 2.377 0.000 A 5 GLN HGx H 1 2.367 0.000 A 5 GLN C C 13 176.071 0.000 A 5 GLN CA C 13 55.938 0.095 A 5 GLN CB C 13 29.448 0.025 A 5 GLN CG C 13 33.770 0.024 A 5 GLN N N 15 122.165 0.185 A 5 GLN NE2 N 15 112.325 0.237 A 6 LYS H H 1 8.412 0.007 A 6 LYS HA H 1 4.253 0.001 A 6 LYS HBy H 1 1.802 0.000 A 6 LYS HBx H 1 1.769 0.000 A 6 LYS HDx H 1 1.682 0.000 A 6 LYS HDy H 1 1.682 0.000 A 6 LYS HEx H 1 2.997 0.000 A 6 LYS HGx H 1 1.426 0.003 A 6 LYS HGy H 1 1.449 0.000 A 6 LYS C C 13 176.288 0.000 A 6 LYS CA C 13 56.754 0.102 A 6 LYS CB C 13 33.032 0.015 A 6 LYS CD C 13 29.064 0.006 A 6 LYS CE C 13 42.124 0.003 A 6 LYS CG C 13 24.713 0.054 A 6 LYS N N 15 122.887 0.027 A 7 ASP H H 1 8.333 0.003 A 7 ASP HA H 1 4.568 0.002 A 7 ASP HBy H 1 2.696 0.001 A 7 ASP HBx H 1 2.603 0.001 A 7 ASP C C 13 175.865 0.000 A 7 ASP CA C 13 54.332 0.117 A 7 ASP CB C 13 41.245 0.022 A 7 ASP N N 15 121.332 0.022 A 8 ALA H H 1 8.198 0.003 A 8 ALA HA H 1 4.325 0.002 A 8 ALA HB% H 1 1.383 0.000 A 8 ALA C C 13 177.794 0.000 A 8 ALA CA C 13 52.617 0.047 A 8 ALA CB C 13 19.355 0.039 A 8 ALA N N 15 124.102 0.011 A 9 VAL H H 1 8.143 0.059 A 9 VAL HA H 1 4.129 0.003 A 9 VAL HB H 1 2.100 0.001 A 9 VAL HGx% H 1 0.932 0.000 A 9 VAL HGy% H 1 0.939 0.000 A 9 VAL C C 13 176.365 0.000 A 9 VAL CA C 13 62.423 0.023 A 9 VAL CB C 13 32.745 0.012 A 9 VAL CGx C 13 20.599 0.005 A 9 VAL CGy C 13 21.241 0.000 A 9 VAL N N 15 119.025 0.026 A 10 SER H H 1 8.347 0.003 A 10 SER HA H 1 4.476 0.004 A 10 SER HBy H 1 3.881 0.000 A 10 SER HBx H 1 3.838 0.000 A 10 SER C C 13 174.306 0.000 A 10 SER CA C 13 58.350 0.043 A 10 SER CB C 13 63.966 0.050 A 10 SER N N 15 119.030 0.013 A 11 ASP H H 1 8.408 0.005 A 11 ASP HA H 1 4.715 0.002 A 11 ASP HBy H 1 2.744 0.001 A 11 ASP HBx H 1 2.694 0.004 A 11 ASP C C 13 176.652 0.000 A 11 ASP CA C 13 54.399 0.107 A 11 ASP CB C 13 41.388 0.123 A 11 ASP N N 15 122.900 0.016 A 12 THR H H 1 8.187 0.002 A 12 THR HA H 1 4.331 0.000 A 12 THR HB H 1 4.327 0.000 A 12 THR HG2% H 1 1.219 0.000 A 12 THR C C 13 175.550 0.000 A 12 THR CA C 13 62.337 0.004 A 12 THR CB C 13 69.604 0.065 A 12 THR N N 15 113.925 0.011 A 13 GLY H H 1 8.535 0.003 A 13 GLY HAx H 1 4.022 0.000 A 13 GLY HAy H 1 4.053 0.000 A 13 GLY C C 13 174.790 0.000 A 13 GLY CA C 13 45.847 0.032 A 13 GLY N N 15 111.130 0.009 A 14 THR H H 1 8.035 0.079 A 14 THR HA H 1 4.260 0.000 A 14 THR HB H 1 4.181 0.001 A 14 THR HG1 H 1 1.074 0.000 A 14 THR HG2% H 1 1.238 0.000 A 14 THR C C 13 174.672 0.000 A 14 THR CA C 13 62.628 0.161 A 14 THR CB C 13 69.915 0.090 A 14 THR CG2 C 13 21.949 0.000 A 14 THR N N 15 114.756 0.023 A 15 ALA H H 1 8.227 0.001 A 15 ALA HA H 1 4.034 0.002 A 15 ALA HB% H 1 1.321 0.002 A 15 ALA C C 13 178.726 0.000 A 15 ALA CA C 13 53.252 0.012 A 15 ALA CB C 13 18.758 0.025 A 15 ALA N N 15 125.055 0.048 A 16 ALA H H 1 8.217 0.002 A 16 ALA HA H 1 4.049 0.023 A 16 ALA HB% H 1 1.456 0.001 A 16 ALA C C 13 179.732 0.000 A 16 ALA CA C 13 55.188 0.029 A 16 ALA CB C 13 18.300 0.029 A 16 ALA N N 15 123.762 0.016 A 17 VAL H H 1 7.958 0.003 A 17 VAL HA H 1 3.939 0.003 A 17 VAL HB H 1 2.251 0.001 A 17 VAL HGx% H 1 1.162 0.000 A 17 VAL HGy% H 1 0.961 0.000 A 17 VAL C C 13 176.322 0.000 A 17 VAL CA C 13 64.537 0.042 A 17 VAL CB C 13 31.588 0.020 A 17 VAL CGy C 13 22.851 0.000 A 17 VAL CGx C 13 20.297 0.000 A 17 VAL N N 15 116.071 0.017 A 18 VAL H H 1 7.187 0.002 A 18 VAL HA H 1 3.789 0.001 A 18 VAL HB H 1 1.958 0.001 A 18 VAL HGx% H 1 0.956 0.006 A 18 VAL HGy% H 1 0.248 0.002 A 18 VAL C C 13 177.417 0.000 A 18 VAL CA C 13 66.936 0.026 A 18 VAL CB C 13 31.638 0.030 A 18 VAL CGx C 13 21.181 0.000 A 18 VAL CGy C 13 21.354 0.068 A 18 VAL N N 15 121.237 0.007 A 19 LYS H H 1 7.453 0.001 A 19 LYS HA H 1 4.148 0.002 A 19 LYS HBy H 1 1.909 0.008 A 19 LYS HBx H 1 1.891 0.006 A 19 LYS HDx H 1 1.683 0.000 A 19 LYS HDy H 1 1.683 0.000 A 19 LYS HEx H 1 2.965 0.000 A 19 LYS HEy H 1 3.001 0.000 A 19 LYS HGx H 1 1.488 0.000 A 19 LYS HGy H 1 1.498 0.000 A 19 LYS C C 13 179.923 0.000 A 19 LYS CA C 13 58.693 0.058 A 19 LYS CB C 13 31.957 0.063 A 19 LYS CD C 13 28.706 0.025 A 19 LYS CE C 13 42.130 0.039 A 19 LYS CG C 13 24.756 0.001 A 19 LYS N N 15 117.357 0.011 A 20 VAL H H 1 7.734 0.001 A 20 VAL HA H 1 3.731 0.000 A 20 VAL HB H 1 2.160 0.001 A 20 VAL HGx% H 1 1.078 0.000 A 20 VAL HGy% H 1 0.934 0.000 A 20 VAL C C 13 177.892 0.000 A 20 VAL CA C 13 66.499 0.033 A 20 VAL CB C 13 32.002 0.010 A 20 VAL CGy C 13 22.409 0.000 A 20 VAL CGx C 13 20.529 0.000 A 20 VAL N N 15 119.697 0.014 A 21 VAL H H 1 7.847 0.002 A 21 VAL HA H 1 3.202 0.003 A 21 VAL HB H 1 1.813 0.001 A 21 VAL HGx% H 1 0.716 0.003 A 21 VAL HGy% H 1 -0.100 0.004 A 21 VAL C C 13 177.866 0.000 A 21 VAL CA C 13 67.509 0.033 A 21 VAL CB C 13 31.480 0.070 A 21 VAL CGy C 13 23.193 0.009 A 21 VAL CGx C 13 20.500 0.034 A 21 VAL N N 15 119.950 0.009 A 22 GLU H H 1 8.623 0.003 A 22 GLU HA H 1 3.693 0.003 A 22 GLU HBy H 1 2.135 0.003 A 22 GLU HBx H 1 1.962 0.000 A 22 GLU HGy H 1 2.885 0.005 A 22 GLU HGx H 1 2.053 0.002 A 22 GLU C C 13 180.036 0.000 A 22 GLU CA C 13 60.658 0.034 A 22 GLU CB C 13 29.282 0.057 A 22 GLU CG C 13 37.710 0.050 A 22 GLU N N 15 117.588 0.006 A 23 SER H H 1 8.342 0.003 A 23 SER HA H 1 4.333 0.000 A 23 SER HBy H 1 4.041 0.002 A 23 SER HBx H 1 3.991 0.000 A 23 SER C C 13 177.565 0.000 A 23 SER CA C 13 61.947 0.050 A 23 SER CB C 13 62.736 0.116 A 23 SER N N 15 115.026 0.008 A 24 GLN H H 1 8.044 0.002 A 24 GLN HA H 1 4.117 0.000 A 24 GLN HBy H 1 1.995 0.002 A 24 GLN HBx H 1 1.886 0.003 A 24 GLN HE2y H 1 7.572 0.002 A 24 GLN HE2x H 1 6.712 0.001 A 24 GLN HGx H 1 2.344 0.000 A 24 GLN HGy H 1 2.683 0.002 A 24 GLN C C 13 178.388 0.000 A 24 GLN CA C 13 57.832 0.059 A 24 GLN CB C 13 28.091 0.024 A 24 GLN CG C 13 33.081 0.046 A 24 GLN N N 15 120.519 0.010 A 24 GLN NE2 N 15 112.810 0.229 A 25 ALA H H 1 8.680 0.002 A 25 ALA HA H 1 3.855 0.001 A 25 ALA HB% H 1 1.372 0.000 A 25 ALA C C 13 178.394 0.000 A 25 ALA CA C 13 55.831 0.040 A 25 ALA CB C 13 19.017 0.021 A 25 ALA N N 15 123.969 0.009 A 26 GLU H H 1 7.657 0.001 A 26 GLU HA H 1 4.058 0.002 A 26 GLU HBy H 1 2.156 0.009 A 26 GLU HBx H 1 2.109 0.003 A 26 GLU HGx H 1 2.178 0.000 A 26 GLU HGy H 1 2.423 0.001 A 26 GLU C C 13 179.408 0.000 A 26 GLU CA C 13 59.452 0.046 A 26 GLU CB C 13 29.582 0.049 A 26 GLU CG C 13 36.260 0.036 A 26 GLU N N 15 117.477 0.024 A 27 LEU H H 1 7.636 0.002 A 27 LEU HA H 1 4.052 0.000 A 27 LEU HBy H 1 1.803 0.003 A 27 LEU HBx H 1 1.596 0.002 A 27 LEU HDx% H 1 0.862 0.023 A 27 LEU HDy% H 1 0.897 0.001 A 27 LEU HG H 1 1.756 0.000 A 27 LEU C C 13 179.362 0.000 A 27 LEU CA C 13 58.127 0.036 A 27 LEU CB C 13 41.811 0.020 A 27 LEU CDx C 13 23.515 0.016 A 27 LEU CDy C 13 24.692 0.000 A 27 LEU CG C 13 26.714 0.168 A 27 LEU N N 15 119.471 0.009 A 28 TYR H H 1 8.561 0.003 A 28 TYR HA H 1 3.951 0.000 A 28 TYR HBy H 1 3.276 0.003 A 28 TYR HBx H 1 2.952 0.002 A 28 TYR C C 13 178.509 0.000 A 28 TYR CA C 13 62.203 0.057 A 28 TYR CB C 13 39.441 0.013 A 28 TYR N N 15 121.113 0.003 A 29 GLU H H 1 8.226 0.001 A 29 GLU HA H 1 4.002 0.002 A 29 GLU HBy H 1 2.237 0.002 A 29 GLU HBx H 1 2.095 0.003 A 29 GLU HGx H 1 2.811 0.003 A 29 GLU HGy H 1 2.930 0.006 A 29 GLU C C 13 178.161 0.000 A 29 GLU CA C 13 59.011 0.038 A 29 GLU CB C 13 29.131 0.043 A 29 GLU CG C 13 38.039 0.064 A 29 GLU N N 15 119.034 0.022 A 30 LEU H H 1 7.812 0.001 A 30 LEU HA H 1 4.153 0.000 A 30 LEU HBy H 1 1.837 0.002 A 30 LEU HBx H 1 1.619 0.001 A 30 LEU HDx% H 1 0.886 0.000 A 30 LEU HDy% H 1 0.891 0.000 A 30 LEU HG H 1 1.755 0.000 A 30 LEU C C 13 178.612 0.000 A 30 LEU CA C 13 57.051 0.027 A 30 LEU CB C 13 42.514 0.019 A 30 LEU CDx C 13 23.715 0.016 A 30 LEU CDy C 13 24.846 0.000 A 30 LEU CG C 13 26.779 0.000 A 30 LEU N N 15 119.739 0.009 A 31 LYS H H 1 7.363 0.002 A 31 LYS HA H 1 4.115 0.001 A 31 LYS HBx H 1 1.692 0.001 A 31 LYS HBy H 1 1.695 0.001 A 31 LYS HDy H 1 1.618 0.000 A 31 LYS HDx H 1 1.604 0.001 A 31 LYS HEx H 1 2.955 0.000 A 31 LYS HGx H 1 1.311 0.004 A 31 LYS HGy H 1 1.424 0.000 A 31 LYS C C 13 176.386 0.000 A 31 LYS CA C 13 57.452 0.056 A 31 LYS CB C 13 33.451 0.041 A 31 LYS CD C 13 28.931 0.050 A 31 LYS CE C 13 42.136 0.015 A 31 LYS CG C 13 24.860 0.026 A 31 LYS N N 15 116.882 0.012 A 32 ASN H H 1 7.822 0.001 A 32 ASN HA H 1 4.804 0.001 A 32 ASN HBy H 1 2.269 0.003 A 32 ASN HBx H 1 2.157 0.003 A 32 ASN HD2y H 1 6.760 0.003 A 32 ASN HD2x H 1 5.842 0.001 A 32 ASN C C 13 173.311 0.000 A 32 ASN CA C 13 51.890 0.094 A 32 ASN CB C 13 38.467 0.011 A 32 ASN N N 15 119.279 0.007 A 32 ASN ND2 N 15 115.490 0.245 A 33 THR H H 1 7.658 0.293 A 33 THR HA H 1 4.104 0.000 A 33 THR HB H 1 4.169 0.000 A 33 THR HG2% H 1 1.242 0.000 A 33 THR C C 13 175.221 0.000 A 33 THR CA C 13 64.287 0.130 A 33 THR CB C 13 69.171 0.022 A 33 THR CG2 C 13 21.950 0.000 A 33 THR N N 15 111.489 0.010 A 34 ASN H H 1 8.751 0.002 A 34 ASN HA H 1 4.650 0.001 A 34 ASN HBy H 1 2.968 0.000 A 34 ASN HBx H 1 2.917 0.000 A 34 ASN HD2y H 1 7.626 0.002 A 34 ASN HD2x H 1 6.938 0.002 A 34 ASN C C 13 174.306 0.000 A 34 ASN CA C 13 53.822 0.309 A 34 ASN CB C 13 38.432 0.162 A 34 ASN N N 15 118.287 0.006 A 34 ASN ND2 N 15 112.578 0.237 A 35 GLU H H 1 7.940 0.002 A 35 GLU HA H 1 4.638 0.002 A 35 GLU HBy H 1 2.096 0.003 A 35 GLU HBx H 1 1.885 0.004 A 35 GLU HGx H 1 2.167 0.000 A 35 GLU HGy H 1 2.177 0.002 A 35 GLU C C 13 175.072 0.000 A 35 GLU CA C 13 55.430 0.040 A 35 GLU CB C 13 33.314 0.034 A 35 GLU CG C 13 36.171 0.005 A 35 GLU N N 15 118.881 0.013 A 36 LYS H H 1 8.440 0.004 A 36 LYS HA H 1 4.702 0.002 A 36 LYS HBy H 1 1.827 0.000 A 36 LYS HBx H 1 1.705 0.000 A 36 LYS HDx H 1 1.696 0.000 A 36 LYS HDy H 1 1.702 0.000 A 36 LYS HEx H 1 3.096 0.004 A 36 LYS HGy H 1 1.527 0.001 A 36 LYS HGx H 1 1.523 0.000 A 36 LYS C C 13 177.218 0.000 A 36 LYS CA C 13 53.472 0.016 A 36 LYS CB C 13 33.197 0.034 A 36 LYS CD C 13 27.840 0.030 A 36 LYS CE C 13 41.996 0.074 A 36 LYS CG C 13 24.022 0.040 A 36 LYS N N 15 120.015 0.017 A 37 ALA H H 1 10.629 0.003 A 37 ALA HA H 1 3.734 0.001 A 37 ALA HB% H 1 1.344 0.000 A 37 ALA C C 13 176.042 0.000 A 37 ALA CA C 13 52.749 0.039 A 37 ALA CB C 13 19.840 0.012 A 37 ALA N N 15 125.489 0.016 A 38 SER H H 1 6.536 0.001 A 38 SER HA H 1 4.804 0.001 A 38 SER HBy H 1 4.090 0.001 A 38 SER HBx H 1 3.722 0.001 A 38 SER C C 13 174.319 0.000 A 38 SER CA C 13 55.797 0.053 A 38 SER CB C 13 66.579 0.028 A 38 SER N N 15 111.505 0.008 A 39 LEU H H 1 9.924 0.001 A 39 LEU HA H 1 3.764 0.002 A 39 LEU HBy H 1 2.279 0.002 A 39 LEU HBx H 1 1.353 0.001 A 39 LEU HDx% H 1 0.481 0.003 A 39 LEU HG H 1 1.159 0.000 A 39 LEU C C 13 178.669 0.000 A 39 LEU CA C 13 58.657 0.053 A 39 LEU CB C 13 41.408 0.023 A 39 LEU CDx C 13 23.372 0.025 A 39 LEU CG C 13 26.695 0.023 A 39 LEU N N 15 123.406 0.016 A 40 SER H H 1 8.079 0.002 A 40 SER HA H 1 4.076 0.000 A 40 SER HBy H 1 3.880 0.001 A 40 SER HBx H 1 3.877 0.004 A 40 SER C C 13 177.901 0.000 A 40 SER CA C 13 61.885 0.254 A 40 SER CB C 13 62.109 0.052 A 40 SER N N 15 112.296 0.008 A 41 LYS H H 1 7.602 0.001 A 41 LYS HA H 1 4.115 0.002 A 41 LYS HBy H 1 1.628 0.003 A 41 LYS HBx H 1 1.348 0.003 A 41 LYS HDy H 1 1.750 0.002 A 41 LYS HDx H 1 1.669 0.000 A 41 LYS HEy H 1 2.997 0.002 A 41 LYS HEx H 1 2.966 0.000 A 41 LYS HGx H 1 1.385 0.000 A 41 LYS HGy H 1 1.393 0.001 A 41 LYS C C 13 179.453 0.000 A 41 LYS CA C 13 59.352 0.076 A 41 LYS CB C 13 32.755 0.127 A 41 LYS CD C 13 29.225 0.057 A 41 LYS CE C 13 42.169 0.077 A 41 LYS CG C 13 26.271 0.028 A 41 LYS N N 15 122.622 0.006 A 42 LEU H H 1 8.232 0.002 A 42 LEU HA H 1 4.028 0.003 A 42 LEU HBy H 1 1.900 0.001 A 42 LEU HBx H 1 1.160 0.004 A 42 LEU HDx% H 1 0.565 0.002 A 42 LEU HDy% H 1 0.545 0.007 A 42 LEU HG H 1 1.233 0.109 A 42 LEU C C 13 178.980 0.000 A 42 LEU CA C 13 57.575 0.046 A 42 LEU CB C 13 42.295 0.026 A 42 LEU CDx C 13 23.367 0.028 A 42 LEU CDy C 13 26.150 0.052 A 42 LEU CG C 13 26.429 0.230 A 42 LEU N N 15 120.090 0.030 A 43 VAL H H 1 8.218 0.005 A 43 VAL HA H 1 4.239 0.003 A 43 VAL HB H 1 2.010 0.002 A 43 VAL HGx% H 1 0.774 0.003 A 43 VAL HGy% H 1 0.922 0.004 A 43 VAL C C 13 181.164 0.000 A 43 VAL CA C 13 65.032 0.022 A 43 VAL CB C 13 31.976 0.018 A 43 VAL CGy C 13 23.043 0.024 A 43 VAL CGx C 13 20.960 0.033 A 43 VAL N N 15 119.979 0.037 A 44 SER H H 1 8.267 0.001 A 44 SER HA H 1 4.217 0.003 A 44 SER HBy H 1 4.015 0.000 A 44 SER HBx H 1 4.002 0.000 A 44 SER C C 13 176.547 0.000 A 44 SER CA C 13 61.822 0.000 A 44 SER CB C 13 62.537 0.140 A 44 SER N N 15 117.207 0.025 A 45 SER H H 1 8.091 0.002 A 45 SER HA H 1 4.524 0.001 A 45 SER HBy H 1 4.292 0.002 A 45 SER HBx H 1 4.185 0.004 A 45 SER C C 13 174.855 0.000 A 45 SER CA C 13 59.614 0.052 A 45 SER CB C 13 64.123 0.053 A 45 SER N N 15 113.317 0.012 A 46 GLY H H 1 7.819 0.001 A 46 GLY HAy H 1 4.203 0.001 A 46 GLY HAx H 1 3.921 0.003 A 46 GLY C C 13 174.266 0.000 A 46 GLY CA C 13 45.385 0.029 A 46 GLY N N 15 109.003 0.014 A 47 ASN H H 1 8.390 0.001 A 47 ASN HA H 1 4.371 0.003 A 47 ASN HBy H 1 2.994 0.004 A 47 ASN HBx H 1 2.503 0.001 A 47 ASN HD2y H 1 7.684 0.000 A 47 ASN HD2x H 1 7.069 0.002 A 47 ASN C C 13 175.380 0.000 A 47 ASN CA C 13 57.230 0.040 A 47 ASN CB C 13 40.768 0.032 A 47 ASN N N 15 119.578 0.011 A 47 ASN ND2 N 15 109.965 0.237 A 48 ILE H H 1 7.313 0.001 A 48 ILE HA H 1 4.678 0.002 A 48 ILE HB H 1 2.030 0.002 A 48 ILE HD1% H 1 0.589 0.003 A 48 ILE HG1y H 1 1.222 0.003 A 48 ILE HG1x H 1 0.537 0.001 A 48 ILE HG2% H 1 0.660 0.001 A 48 ILE C C 13 173.893 0.000 A 48 ILE CA C 13 58.565 0.034 A 48 ILE CB C 13 41.033 0.049 A 48 ILE CD1 C 13 14.524 0.016 A 48 ILE CG1 C 13 24.177 0.017 A 48 ILE CG2 C 13 17.311 0.013 A 48 ILE N N 15 107.429 0.007 A 49 SER H H 1 8.942 0.002 A 49 SER HA H 1 4.698 0.003 A 49 SER HBy H 1 4.410 0.000 A 49 SER HBx H 1 3.917 0.000 A 49 SER C C 13 175.622 0.000 A 49 SER CA C 13 55.954 0.018 A 49 SER CB C 13 66.092 0.019 A 49 SER N N 15 116.010 0.016 A 50 GLN H H 1 9.265 0.002 A 50 GLN HA H 1 3.854 0.003 A 50 GLN HBy H 1 2.218 0.005 A 50 GLN HBx H 1 2.045 0.003 A 50 GLN HE2y H 1 7.938 0.001 A 50 GLN HE2x H 1 6.758 0.004 A 50 GLN HGx H 1 2.398 0.002 A 50 GLN HGy H 1 2.398 0.000 A 50 GLN C C 13 177.506 0.000 A 50 GLN CA C 13 58.471 0.036 A 50 GLN CB C 13 28.263 0.027 A 50 GLN CG C 13 33.319 0.019 A 50 GLN N N 15 122.380 0.009 A 50 GLN NE2 N 15 115.892 0.263 A 51 LYS H H 1 8.133 0.003 A 51 LYS HA H 1 4.192 0.002 A 51 LYS HBy H 1 1.839 0.006 A 51 LYS HBx H 1 1.789 0.002 A 51 LYS HDy H 1 1.713 0.000 A 51 LYS HGy H 1 1.537 0.003 A 51 LYS HGx H 1 1.458 0.001 A 51 LYS C C 13 180.040 0.000 A 51 LYS CA C 13 59.588 0.049 A 51 LYS CB C 13 32.296 0.044 A 51 LYS CD C 13 29.163 0.000 A 51 LYS CE C 13 42.125 0.000 A 51 LYS CG C 13 25.091 0.016 A 51 LYS N N 15 117.783 0.007 A 52 GLN H H 1 7.936 0.003 A 52 GLN HA H 1 3.998 0.001 A 52 GLN HBy H 1 2.535 0.008 A 52 GLN HBx H 1 1.519 0.000 A 52 GLN HE2y H 1 7.729 0.001 A 52 GLN HE2x H 1 6.913 0.002 A 52 GLN HGy H 1 2.435 0.000 A 52 GLN HGx H 1 2.377 0.000 A 52 GLN C C 13 178.255 0.000 A 52 GLN CA C 13 59.309 0.041 A 52 GLN CB C 13 28.881 0.034 A 52 GLN CG C 13 35.182 0.018 A 52 GLN N N 15 119.913 0.005 A 52 GLN NE2 N 15 111.314 0.238 A 53 ALA H H 1 8.125 0.002 A 53 ALA HA H 1 3.866 0.001 A 53 ALA HB% H 1 1.434 0.001 A 53 ALA C C 13 179.254 0.000 A 53 ALA CA C 13 55.808 0.034 A 53 ALA CB C 13 18.253 0.016 A 53 ALA N N 15 122.316 0.010 A 54 ASP H H 1 8.991 0.001 A 54 ASP HA H 1 4.433 0.004 A 54 ASP HBy H 1 2.872 0.003 A 54 ASP HBx H 1 2.701 0.004 A 54 ASP C C 13 180.208 0.000 A 54 ASP CA C 13 57.630 0.017 A 54 ASP CB C 13 39.845 0.029 A 54 ASP N N 15 118.413 0.016 A 55 SER H H 1 8.552 0.003 A 55 SER HA H 1 4.356 0.001 A 55 SER HBx H 1 4.033 0.000 A 55 SER HBy H 1 4.139 0.002 A 55 SER C C 13 176.195 0.000 A 55 SER CA C 13 62.134 0.138 A 55 SER CB C 13 63.163 0.141 A 55 SER N N 15 119.036 0.009 A 56 TYR H H 1 8.484 0.002 A 56 TYR HA H 1 4.020 0.004 A 56 TYR HBy H 1 3.562 0.003 A 56 TYR HBx H 1 3.043 0.002 A 56 TYR C C 13 176.522 0.000 A 56 TYR CA C 13 62.359 0.043 A 56 TYR CB C 13 39.200 0.018 A 56 TYR N N 15 126.105 0.008 A 57 LYS H H 1 8.489 0.002 A 57 LYS HA H 1 4.049 0.003 A 57 LYS HBx H 1 1.973 0.003 A 57 LYS HBy H 1 1.974 0.001 A 57 LYS HDx H 1 1.791 0.000 A 57 LYS HDy H 1 1.796 0.000 A 57 LYS HEx H 1 2.998 0.000 A 57 LYS HEy H 1 2.998 0.000 A 57 LYS HGy H 1 1.948 0.000 A 57 LYS HGx H 1 1.610 0.000 A 57 LYS C C 13 180.583 0.000 A 57 LYS CA C 13 60.466 0.053 A 57 LYS CB C 13 32.621 0.039 A 57 LYS CD C 13 29.714 0.014 A 57 LYS CE C 13 42.063 0.061 A 57 LYS CG C 13 25.761 0.006 A 57 LYS N N 15 117.620 0.009 A 58 ALA H H 1 8.396 0.001 A 58 ALA HA H 1 4.163 0.001 A 58 ALA HB% H 1 1.556 0.001 A 58 ALA C C 13 180.642 0.000 A 58 ALA CA C 13 54.833 0.024 A 58 ALA CB C 13 17.964 0.024 A 58 ALA N N 15 121.655 0.015 A 59 TYR H H 1 8.073 0.002 A 59 TYR HA H 1 3.994 0.002 A 59 TYR HBy H 1 2.987 0.000 A 59 TYR HBx H 1 2.783 0.001 A 59 TYR C C 13 178.978 0.000 A 59 TYR CA C 13 62.507 0.052 A 59 TYR CB C 13 37.078 0.050 A 59 TYR N N 15 120.852 0.010 A 60 TYR H H 1 7.359 0.001 A 60 TYR HA H 1 3.932 0.001 A 60 TYR HBy H 1 3.349 0.001 A 60 TYR HBx H 1 2.596 0.003 A 60 TYR C C 13 177.585 0.000 A 60 TYR CA C 13 64.039 0.038 A 60 TYR CB C 13 37.830 0.017 A 60 TYR N N 15 118.649 0.009 A 61 GLY H H 1 8.148 0.001 A 61 GLY HAx H 1 3.852 0.002 A 61 GLY HAy H 1 3.980 0.001 A 61 GLY C C 13 174.902 0.000 A 61 GLY CA C 13 46.553 0.012 A 61 GLY N N 15 108.448 0.009 A 62 LYS H H 1 7.096 0.002 A 62 LYS HA H 1 4.255 0.002 A 62 LYS HBy H 1 1.529 0.001 A 62 LYS HBx H 1 1.527 0.005 A 62 LYS HDy H 1 1.540 0.000 A 62 LYS HDx H 1 1.533 0.000 A 62 LYS HEx H 1 2.872 0.003 A 62 LYS HEy H 1 2.933 0.000 A 62 LYS HGy H 1 1.226 0.003 A 62 LYS HGx H 1 1.112 0.003 A 62 LYS C C 13 176.305 0.000 A 62 LYS CA C 13 56.395 0.038 A 62 LYS CB C 13 33.312 0.036 A 62 LYS CD C 13 28.795 0.014 A 62 LYS CE C 13 42.041 0.023 A 62 LYS CG C 13 24.659 0.032 A 62 LYS N N 15 117.983 0.016 A 63 HIS H H 1 7.674 0.002 A 63 HIS HA H 1 4.662 0.000 A 63 HIS HBy H 1 2.829 0.001 A 63 HIS HBx H 1 2.306 0.002 A 63 HIS C C 13 174.834 0.000 A 63 HIS CA C 13 54.521 0.070 A 63 HIS CB C 13 26.781 0.040 A 63 HIS N N 15 119.724 0.011 A 64 SER H H 1 7.866 0.004 A 64 SER HA H 1 4.447 0.001 A 64 SER HBy H 1 4.005 0.000 A 64 SER HBx H 1 3.893 0.002 A 64 SER C C 13 175.582 0.000 A 64 SER CA C 13 60.475 0.021 A 64 SER CB C 13 63.287 0.052 A 64 SER N N 15 115.214 0.007 A 65 GLY H H 1 8.896 0.001 A 65 GLY HAx H 1 3.859 0.003 A 65 GLY HAy H 1 4.179 0.001 A 65 GLY C C 13 174.415 0.000 A 65 GLY CA C 13 45.102 0.037 A 65 GLY N N 15 110.439 0.028 A 66 GLU H H 1 7.793 0.001 A 66 GLU HA H 1 4.684 0.002 A 66 GLU HBx H 1 2.222 0.002 A 66 GLU HBy H 1 2.475 0.000 A 66 GLU HGy H 1 2.371 0.002 A 66 GLU HGx H 1 2.298 0.004 A 66 GLU C C 13 175.515 0.000 A 66 GLU CA C 13 55.277 0.037 A 66 GLU CB C 13 31.933 0.022 A 66 GLU CG C 13 36.838 0.002 A 66 GLU N N 15 120.435 0.008 A 67 THR H H 1 8.711 0.004 A 67 THR HA H 1 4.159 0.002 A 67 THR HB H 1 3.910 0.003 A 67 THR HG2% H 1 1.028 0.001 A 67 THR C C 13 172.887 0.000 A 67 THR CA C 13 62.602 0.086 A 67 THR CB C 13 70.126 0.083 A 67 THR CG2 C 13 21.543 0.026 A 67 THR N N 15 117.794 0.003 A 68 GLN H H 1 8.439 0.002 A 68 GLN HA H 1 2.934 0.002 A 68 GLN HBx H 1 1.288 0.002 A 68 GLN HBy H 1 1.291 0.000 A 68 GLN HE2y H 1 8.437 0.001 A 68 GLN HE2x H 1 6.881 0.003 A 68 GLN HGy H 1 1.992 0.004 A 68 GLN HGx H 1 1.833 0.007 A 68 GLN C C 13 175.806 0.000 A 68 GLN CA C 13 55.328 0.047 A 68 GLN CB C 13 28.135 0.039 A 68 GLN CG C 13 33.284 0.102 A 68 GLN N N 15 129.704 0.009 A 68 GLN NE2 N 15 110.855 0.238 A 69 THR H H 1 8.233 0.003 A 69 THR HA H 1 4.132 0.103 A 69 THR HB H 1 4.063 0.096 A 69 THR HG2% H 1 1.235 0.000 A 69 THR C C 13 174.206 0.000 A 69 THR CA C 13 64.389 0.045 A 69 THR CB C 13 69.016 0.068 A 69 THR CG2 C 13 21.760 0.000 A 69 THR N N 15 120.433 0.022 A 70 VAL H H 1 7.723 0.001 A 70 VAL HA H 1 4.127 0.004 A 70 VAL HB H 1 1.777 0.002 A 70 VAL HGx% H 1 0.659 0.001 A 70 VAL HGy% H 1 0.550 0.000 A 70 VAL C C 13 174.125 0.000 A 70 VAL CA C 13 61.665 0.051 A 70 VAL CB C 13 31.696 0.020 A 70 VAL CGy C 13 21.722 0.018 A 70 VAL CGx C 13 20.489 0.006 A 70 VAL N N 15 122.670 0.008 A 71 ALA H H 1 8.300 0.001 A 71 ALA HA H 1 4.111 0.002 A 71 ALA HB% H 1 1.424 0.001 A 71 ALA C C 13 176.203 0.000 A 71 ALA CA C 13 52.126 0.053 A 71 ALA CB C 13 19.649 0.043 A 71 ALA N N 15 129.212 0.017 A 72 ASN H H 1 8.274 0.001 A 72 ASN HA H 1 4.150 0.004 A 72 ASN HBx H 1 2.643 0.004 A 72 ASN HBy H 1 2.755 0.000 A 72 ASN HD2y H 1 7.466 0.001 A 72 ASN HD2x H 1 6.962 0.001 A 72 ASN C C 13 181.086 0.000 A 72 ASN CA C 13 57.109 0.035 A 72 ASN CB C 13 38.935 0.029 A 72 ASN N N 15 122.691 0.008 A 72 ASN ND2 N 15 111.165 0.240 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 ASN HD2x A 1 ASN HD2y 1.0 1.8 4.49 2 2 A 1 ASN HA A 1 ASN HBx 1.0 1.8 5.52 3 3 A 1 ASN HD2x A 1 ASN HBx 1.0 1.8 5.08 4 4 A 2 LEU H A 2 LEU HBy 1.0 1.8 5.14 5 5 A 2 LEU HDy% A 2 LEU HA 1.0 1.8 5.24 6 6 A 2 LEU HA A 3 THR H 1.0 1.8 5.26 7 7 A 2 LEU H A 2 LEU HA 1.0 1.8 6.45 8 8 A 2 LEU HBy A 3 THR H 1.0 1.8 5.46 9 9 A 3 THR HG2% A 3 THR HB 1.0 1.8 4.19 10 10 A 3 THR H A 3 THR HA 1.0 1.8 4.90 11 11 A 3 THR H A 3 THR HG2% 1.0 1.8 5.63 12 12 A 4 LYS H A 4 LYS HBx 1.0 1.8 5.38 13 13 A 4 LYS H A 4 LYS HA 1.0 1.8 4.84 14 14 A 4 LYS H A 4 LYS HGy 1.0 1.8 5.54 15 14 A 4 LYS H A 4 LYS HGx 1.0 1.8 5.54 16 15 A 5 GLN HGx A 6 LYS HA 1.0 1.8 5.29 17 16 A 6 LYS HA A 5 GLN HBx 1.0 1.8 5.41 18 17 A 5 GLN HBy A 6 LYS H 1.0 1.8 4.97 19 18 A 6 LYS H A 5 GLN HA 1.0 1.8 5.77 20 19 A 6 LYS H A 6 LYS HBy 1.0 1.8 5.14 21 20 A 6 LYS HA A 6 LYS HBy 1.0 1.8 4.78 22 21 A 6 LYS H A 6 LYS HBx 1.0 1.8 5.14 23 22 A 6 LYS HA A 7 ASP HBx 1.0 1.8 4.80 24 23 A 6 LYS HBy A 7 ASP H 1.0 1.8 5.40 25 24 A 6 LYS HBx A 7 ASP H 1.0 1.8 5.40 26 25 A 6 LYS H A 7 ASP HBy 1.0 1.8 5.30 27 26 A 6 LYS HA A 7 ASP H 1.0 1.8 4.39 28 27 A 7 ASP H A 7 ASP HA 1.0 1.8 5.39 29 28 A 7 ASP HBy A 7 ASP HA 1.0 1.8 4.80 30 29 A 7 ASP HBx A 7 ASP H 1.0 1.8 4.73 31 30 A 7 ASP HA A 8 ALA H 1.0 1.8 4.56 32 31 A 7 ASP HBx A 7 ASP H 1.0 1.8 5.23 33 32 A 7 ASP H A 7 ASP HA 1.0 1.8 5.04 34 33 A 7 ASP HBy A 8 ALA H 1.0 1.8 5.57 35 34 A 8 ALA H A 8 ALA HA 1.0 1.8 5.28 36 35 A 8 ALA H A 8 ALA HB% 1.0 1.8 4.72 37 36 A 8 ALA HB% A 9 VAL H 1.0 1.8 5.32 38 37 A 8 ALA HA A 9 VAL H 1.0 1.8 4.21 39 38 A 9 VAL H A 9 VAL HA 1.0 1.8 5.36 40 39 A 9 VAL HA A 9 VAL HGx% 1.0 1.8 3.66 41 40 A 9 VAL H A 9 VAL HB 1.0 1.8 4.82 42 41 A 9 VAL H A 9 VAL HGy% 1.0 1.8 4.79 43 41 A 9 VAL H A 9 VAL HGx% 1.0 1.8 4.79 44 42 A 9 VAL HB A 9 VAL HGy% 1.0 1.8 3.89 45 42 A 9 VAL HB A 9 VAL HGx% 1.0 1.8 3.89 46 43 A 9 VAL HB A 9 VAL HGx% 1.0 1.8 3.61 47 44 A 9 VAL HA A 9 VAL HB 1.0 1.8 5.40 48 45 A 9 VAL HA A 10 SER H 1.0 1.8 4.90 49 46 A 9 VAL HB A 10 SER H 1.0 1.8 5.59 50 47 A 10 SER HBy A 10 SER HA 1.0 1.8 4.93 51 48 A 10 SER HA A 11 ASP H 1.0 1.8 5.38 52 49 A 10 SER H A 10 SER HBy 1.0 1.8 4.87 53 50 A 10 SER H A 10 SER HA 1.0 1.8 5.29 54 51 A 10 SER H A 10 SER HBx 1.0 1.8 5.64 55 52 A 10 SER HBy A 11 ASP H 1.0 1.8 5.77 56 53 A 11 ASP HA A 11 ASP HBx 1.0 1.8 4.40 57 54 A 11 ASP H A 11 ASP HBx 1.0 1.8 5.30 58 55 A 11 ASP H A 11 ASP HA 1.0 1.8 5.91 59 56 A 11 ASP HA A 12 THR H 1.0 1.8 5.06 60 57 A 11 ASP HBx A 12 THR H 1.0 1.8 5.57 61 58 A 12 THR HB A 12 THR HG2% 1.0 1.8 3.92 62 59 A 12 THR HA A 13 GLY H 1.0 1.8 5.53 63 60 A 12 THR HB A 13 GLY H 1.0 1.8 5.53 64 61 A 12 THR H A 12 THR HB 1.0 1.8 4.98 65 62 A 12 THR H A 12 THR HG2% 1.0 1.8 5.27 66 63 A 12 THR H A 12 THR HA 1.0 1.8 4.98 67 64 A 13 GLY H A 13 GLY HAx 1.0 1.8 4.92 68 65 A 13 GLY H A 13 GLY HAy 1.0 1.8 4.92 69 66 A 13 GLY HAy A 15 ALA H 1.0 1.8 4.23 70 67 A 13 GLY HAx A 15 ALA H 1.0 1.8 4.23 71 68 A 13 GLY HAy A 17 VAL H 1.0 1.8 3.94 72 69 A 13 GLY HAx A 17 VAL H 1.0 1.8 3.94 73 70 A 13 GLY H A 13 GLY HAx 1.0 1.8 5.01 74 71 A 15 ALA H A 14 THR HA 1.0 1.8 4.52 75 72 A 15 ALA H A 14 THR HG2% 1.0 1.8 4.74 76 73 A 17 VAL H A 14 THR HA 1.0 1.8 5.33 77 74 A 14 THR HA A 17 VAL HGx% 1.0 1.8 5.08 78 75 A 15 ALA H A 15 ALA HB% 1.0 1.8 4.39 79 76 A 15 ALA H A 15 ALA HA 1.0 1.8 5.08 80 77 A 15 ALA H A 16 ALA HA 1.0 1.8 5.08 81 78 A 15 ALA HA A 16 ALA H 1.0 1.8 4.73 82 79 A 17 VAL H A 15 ALA HA 1.0 1.8 3.94 83 80 A 15 ALA HB% A 18 VAL H 1.0 1.8 4.53 84 81 A 15 ALA H A 18 VAL H 1.0 1.8 5.54 85 82 A 15 ALA HA A 18 VAL H 1.0 1.8 3.98 86 83 A 16 ALA HA A 16 ALA H 1.0 1.8 4.73 87 84 A 16 ALA H A 16 ALA HB% 1.0 1.8 4.75 88 85 A 16 ALA HA A 16 ALA HB% 1.0 1.8 4.02 89 86 A 17 VAL H A 16 ALA HB% 1.0 1.8 4.58 90 87 A 17 VAL H A 16 ALA HA 1.0 1.8 4.73 91 88 A 18 VAL H A 16 ALA HB% 1.0 1.8 4.84 92 89 A 16 ALA H A 18 VAL H 1.0 1.8 5.54 93 90 A 16 ALA HA A 18 VAL H 1.0 1.8 3.98 94 91 A 17 VAL H A 17 VAL HB 1.0 1.8 4.20 95 92 A 17 VAL H A 17 VAL HGy% 1.0 1.8 4.43 96 93 A 17 VAL H A 17 VAL HA 1.0 1.8 4.90 97 94 A 17 VAL HB A 17 VAL HA 1.0 1.8 4.39 98 95 A 17 VAL H A 17 VAL HGx% 1.0 1.8 5.04 99 96 A 17 VAL H A 17 VAL HA 1.0 1.8 4.87 100 97 A 17 VAL HGx% A 17 VAL HB 1.0 1.8 4.43 101 98 A 17 VAL HB A 17 VAL HGy% 1.0 1.8 4.48 102 99 A 17 VAL H A 17 VAL HB 1.0 1.8 4.67 103 100 A 17 VAL H A 17 VAL HGy% 1.0 1.8 4.94 104 101 A 18 VAL H A 17 VAL HGy% 1.0 1.8 4.42 105 102 A 17 VAL H A 18 VAL H 1.0 1.8 4.78 106 103 A 18 VAL H A 17 VAL HB 1.0 1.8 5.48 107 104 A 17 VAL H A 19 LYS H 1.0 1.8 5.30 108 105 A 17 VAL HA A 20 VAL HGy% 1.0 1.8 3.73 109 106 A 17 VAL HGx% A 56 TYR HA 1.0 1.8 3.89 110 107 A 17 VAL HGx% A 56 TYR H 1.0 1.8 4.50 111 108 A 17 VAL HGy% A 56 TYR HBy 1.0 1.8 5.13 112 109 A 17 VAL HGy% A 56 TYR H 1.0 1.8 4.68 113 110 A 17 VAL HGy% A 57 LYS H 1.0 1.8 5.08 114 111 A 18 VAL HGy% A 59 TYR H 1.0 1.8 5.89 115 112 A 18 VAL HGx% A 22 GLU HGy 1.0 1.8 5.29 116 113 A 18 VAL HA A 21 VAL HB 1.0 1.8 4.73 117 114 A 18 VAL H A 18 VAL HGx% 1.0 1.8 4.42 118 115 A 18 VAL H A 18 VAL HA 1.0 1.8 5.06 119 116 A 18 VAL HGy% A 18 VAL HB 1.0 1.8 4.40 120 117 A 18 VAL H A 18 VAL HB 1.0 1.8 4.10 121 118 A 18 VAL HGx% A 18 VAL HB 1.0 1.8 4.22 122 119 A 18 VAL H A 18 VAL HGy% 1.0 1.8 4.27 123 120 A 19 LYS H A 18 VAL HGx% 1.0 1.8 4.90 124 121 A 19 LYS H A 18 VAL HGy% 1.0 1.8 5.42 125 122 A 18 VAL H A 19 LYS H 1.0 1.8 4.48 126 123 A 18 VAL H A 20 VAL H 1.0 1.8 5.03 127 124 A 19 LYS HA A 22 GLU H 1.0 1.8 4.35 128 125 A 19 LYS HA A 22 GLU HBx 1.0 1.8 4.90 129 126 A 19 LYS H A 19 LYS HGx 1.0 1.8 4.70 130 126 A 19 LYS H A 19 LYS HGy 1.0 1.8 4.70 131 127 A 19 LYS H A 19 LYS HBy 1.0 1.8 4.02 132 128 A 19 LYS H A 19 LYS HBx 1.0 1.8 4.02 133 129 A 19 LYS H A 19 LYS HBx 1.0 1.8 3.67 134 129 A 19 LYS H A 19 LYS HBy 1.0 1.8 3.67 135 130 A 19 LYS H A 19 LYS HA 1.0 1.8 4.37 136 131 A 19 LYS HA A 19 LYS HDx 1.0 1.8 5.03 137 131 A 19 LYS HA A 19 LYS HDy 1.0 1.8 5.03 138 132 A 20 VAL H A 19 LYS HBx 1.0 1.8 4.88 139 133 A 19 LYS H A 20 VAL H 1.0 1.8 4.60 140 134 A 20 VAL H A 19 LYS HA 1.0 1.8 5.22 141 135 A 20 VAL H A 19 LYS HBy 1.0 1.8 4.88 142 136 A 23 SER H A 19 LYS HGx 1.0 1.8 5.07 143 136 A 19 LYS HGy A 23 SER H 1.0 1.8 5.07 144 137 A 19 LYS H A 21 VAL H 1.0 1.8 5.96 145 138 A 20 VAL HA A 24 GLN H 1.0 1.8 5.27 146 139 A 23 SER H A 20 VAL HA 1.0 1.8 4.22 147 140 A 20 VAL HA A 23 SER HBy 1.0 1.8 5.01 148 141 A 20 VAL H A 20 VAL HA 1.0 1.8 4.73 149 142 A 20 VAL HB A 20 VAL HGx% 1.0 1.8 4.42 150 143 A 20 VAL HGy% A 20 VAL H 1.0 1.8 4.85 151 144 A 20 VAL HGy% A 20 VAL HA 1.0 1.8 4.94 152 145 A 20 VAL HGy% A 20 VAL HB 1.0 1.8 4.38 153 146 A 20 VAL HA A 20 VAL HGx% 1.0 1.8 4.16 154 147 A 21 VAL H A 20 VAL HB 1.0 1.8 4.96 155 148 A 21 VAL H A 20 VAL HGx% 1.0 1.8 5.20 156 149 A 20 VAL HGy% A 21 VAL H 1.0 1.8 5.04 157 150 A 21 VAL H A 20 VAL HA 1.0 1.8 5.24 158 151 A 20 VAL H A 22 GLU H 1.0 1.8 5.56 159 152 A 20 VAL HGy% A 52 GLN HE2y 1.0 1.8 4.57 160 153 A 20 VAL H A 52 GLN HGy 1.0 1.8 4.75 161 154 A 20 VAL HA A 52 GLN HE2y 1.0 1.8 3.94 162 155 A 20 VAL HGy% A 56 TYR HBy 1.0 1.8 5.13 163 156 A 20 VAL HGy% A 56 TYR H 1.0 1.8 5.08 164 157 A 21 VAL HA A 25 ALA H 1.0 1.8 5.02 165 158 A 21 VAL HA A 48 ILE HG2% 1.0 1.8 4.31 166 159 A 56 TYR H A 21 VAL HGx% 1.0 1.8 4.81 167 160 A 57 LYS H A 21 VAL HGx% 1.0 1.8 5.46 168 161 A 21 VAL HGx% A 56 TYR HBx 1.0 1.8 4.41 169 162 A 21 VAL HA A 48 ILE HD1% 1.0 1.8 5.26 170 163 A 56 TYR HBy A 21 VAL HGx% 1.0 1.8 4.72 171 164 A 21 VAL HGx% A 39 LEU HA 1.0 1.8 5.34 172 165 A 56 TYR HA A 21 VAL HGx% 1.0 1.8 4.74 173 166 A 21 VAL HGx% A 25 ALA HA 1.0 1.8 4.01 174 167 A 21 VAL HB A 21 VAL H 1.0 1.8 4.84 175 168 A 21 VAL H A 21 VAL HA 1.0 1.8 4.92 176 169 A 21 VAL H A 21 VAL HGx% 1.0 1.8 4.32 177 170 A 21 VAL HB A 21 VAL HA 1.0 1.8 5.53 178 171 A 21 VAL HB A 21 VAL HGx% 1.0 1.8 4.57 179 172 A 21 VAL HB A 22 GLU H 1.0 1.8 5.17 180 173 A 22 GLU H A 21 VAL H 1.0 1.8 4.86 181 174 A 23 SER H A 21 VAL HA 1.0 1.8 5.62 182 175 A 21 VAL HGx% A 39 LEU HG 1.0 1.8 4.20 183 176 A 21 VAL HGx% A 53 ALA HA 1.0 1.8 4.18 184 177 A 56 TYR H A 21 VAL HB 1.0 1.8 5.68 185 178 A 21 VAL HGx% A 70 VAL H 1.0 1.8 5.43 186 179 A 22 GLU H A 21 VAL HA 1.0 1.8 5.24 187 180 A 22 GLU HA A 25 ALA HB% 1.0 1.8 3.99 188 181 A 22 GLU H A 70 VAL HGx% 1.0 1.8 5.01 189 182 A 22 GLU HA A 70 VAL HGx% 1.0 1.8 4.13 190 183 A 25 ALA H A 22 GLU HA 1.0 1.8 4.65 191 184 A 22 GLU HGy A 70 VAL HGx% 1.0 1.8 5.76 192 185 A 70 VAL HGx% A 22 GLU HGx 1.0 1.8 4.54 193 186 A 22 GLU HGy A 22 GLU H 1.0 1.8 5.28 194 187 A 22 GLU HBx A 22 GLU HA 1.0 1.8 5.29 195 188 A 22 GLU HGy A 22 GLU HA 1.0 1.8 5.29 196 189 A 22 GLU HA A 22 GLU HGx 1.0 1.8 5.42 197 190 A 22 GLU H A 22 GLU HBy 1.0 1.8 4.90 198 191 A 22 GLU HGy A 22 GLU H 1.0 1.8 4.76 199 192 A 22 GLU H A 22 GLU HA 1.0 1.8 4.80 200 193 A 22 GLU HGy A 22 GLU HBx 1.0 1.8 5.33 201 194 A 23 SER H A 22 GLU HBy 1.0 1.8 4.76 202 195 A 22 GLU HBy A 23 SER HA 1.0 1.8 4.60 203 196 A 22 GLU HBx A 23 SER H 1.0 1.8 4.64 204 197 A 23 SER H A 22 GLU HA 1.0 1.8 5.06 205 198 A 22 GLU H A 23 SER H 1.0 1.8 5.00 206 199 A 24 GLN H A 22 GLU HA 1.0 1.8 5.27 207 200 A 22 GLU H A 25 ALA HB% 1.0 1.8 4.75 208 201 A 22 GLU H A 22 GLU HBx 1.0 1.8 4.92 209 202 A 22 GLU HGy A 22 GLU HGx 1.0 1.8 5.16 210 203 A 23 SER HA A 27 LEU H 1.0 1.8 4.49 211 204 A 23 SER HA A 26 GLU H 1.0 1.8 4.43 212 205 A 23 SER HA A 26 GLU HBx 1.0 1.8 3.83 213 206 A 23 SER HA A 26 GLU HBy 1.0 1.8 4.36 214 207 A 23 SER HA A 23 SER HBx 1.0 1.8 4.75 215 208 A 23 SER H A 23 SER HA 1.0 1.8 4.58 216 209 A 23 SER H A 23 SER HBy 1.0 1.8 4.00 217 210 A 24 GLN H A 23 SER HBx 1.0 1.8 4.24 218 211 A 23 SER H A 25 ALA H 1.0 1.8 5.18 219 212 A 23 SER HBy A 26 GLU HBx 1.0 1.8 5.71 220 213 A 24 GLN H A 23 SER HA 1.0 1.8 4.93 221 214 A 25 ALA H A 23 SER HA 1.0 1.8 5.78 222 215 A 24 GLN H A 27 LEU H 1.0 1.8 5.33 223 216 A 24 GLN H A 48 ILE HG2% 1.0 1.8 4.71 224 217 A 24 GLN HGy A 27 LEU HDy% 1.0 1.8 5.88 225 218 A 24 GLN H A 24 GLN HGy 1.0 1.8 5.47 226 219 A 24 GLN HGy A 24 GLN HBx 1.0 1.8 5.27 227 220 A 25 ALA H A 24 GLN HBx 1.0 1.8 4.80 228 221 A 25 ALA H A 24 GLN HA 1.0 1.8 5.27 229 222 A 24 GLN H A 25 ALA H 1.0 1.8 4.81 230 223 A 24 GLN H A 26 GLU H 1.0 1.8 5.20 231 224 A 24 GLN HGx A 42 LEU HDx% 1.0 1.8 6.43 232 225 A 24 GLN HGy A 42 LEU HDx% 1.0 1.8 7.67 233 226 A 48 ILE HG2% A 24 GLN HGx 1.0 1.8 5.58 234 227 A 48 ILE HG2% A 24 GLN HBx 1.0 1.8 4.07 235 228 A 48 ILE HD1% A 24 GLN HGx 1.0 1.8 6.78 236 229 A 24 GLN HA A 24 GLN HGx 1.0 1.8 5.03 237 230 A 24 GLN HBx A 24 GLN HA 1.0 1.8 5.30 238 231 A 24 GLN H A 24 GLN HBy 1.0 1.8 5.12 239 232 A 24 GLN HA A 24 GLN HBy 1.0 1.8 5.11 240 233 A 24 GLN HGy A 24 GLN HGx 1.0 1.8 5.01 241 234 A 25 ALA H A 37 ALA HB% 1.0 1.8 5.53 242 235 A 25 ALA H A 42 LEU HDx% 1.0 1.8 5.39 243 236 A 25 ALA HA A 28 TYR HBy 1.0 1.8 4.12 244 237 A 25 ALA H A 42 LEU HDy% 1.0 1.8 5.31 245 238 A 25 ALA HA A 29 GLU H 1.0 1.8 5.20 246 239 A 25 ALA HB% A 29 GLU H 1.0 1.8 4.50 247 240 A 25 ALA H A 25 ALA HB% 1.0 1.8 4.04 248 241 A 25 ALA H A 25 ALA HA 1.0 1.8 4.87 249 242 A 25 ALA H A 25 ALA HA 1.0 1.8 5.05 250 243 A 25 ALA HB% A 26 GLU H 1.0 1.8 4.38 251 244 A 25 ALA H A 26 GLU HBx 1.0 1.8 5.39 252 245 A 25 ALA H A 26 GLU H 1.0 1.8 4.63 253 246 A 25 ALA HB% A 26 GLU HA 1.0 1.8 5.06 254 247 A 25 ALA HA A 27 LEU H 1.0 1.8 4.69 255 248 A 25 ALA H A 27 LEU H 1.0 1.8 3.91 256 249 A 25 ALA HA A 28 TYR HBx 1.0 1.8 4.33 257 250 A 25 ALA HB% A 28 TYR H 1.0 1.8 4.67 258 251 A 25 ALA H A 28 TYR HBx 1.0 1.8 5.43 259 252 A 25 ALA HA A 29 GLU HGy 1.0 1.8 4.33 260 253 A 25 ALA HA A 37 ALA HB% 1.0 1.8 3.35 261 254 A 25 ALA HA A 42 LEU HDx% 1.0 1.8 3.85 262 255 A 25 ALA HB% A 70 VAL HA 1.0 1.8 3.95 263 256 A 25 ALA HA A 70 VAL HGy% 1.0 1.8 3.55 264 257 A 26 GLU H A 26 GLU HA 1.0 1.8 4.36 265 258 A 26 GLU HBx A 26 GLU HA 1.0 1.8 4.68 266 259 A 26 GLU H A 26 GLU HGy 1.0 1.8 5.04 267 260 A 26 GLU H A 26 GLU HBy 1.0 1.8 3.77 268 261 A 26 GLU HA A 26 GLU HGy 1.0 1.8 5.03 269 262 A 26 GLU HGy A 27 LEU HA 1.0 1.8 5.03 270 263 A 26 GLU HBx A 27 LEU HA 1.0 1.8 4.68 271 264 A 27 LEU H A 26 GLU HGy 1.0 1.8 5.14 272 265 A 27 LEU H A 26 GLU HBx 1.0 1.8 4.58 273 266 A 27 LEU H A 26 GLU HA 1.0 1.8 4.16 274 267 A 26 GLU H A 28 TYR H 1.0 1.8 3.88 275 268 A 26 GLU H A 42 LEU HDy% 1.0 1.8 4.54 276 268 A 26 GLU H A 42 LEU HDx% 1.0 1.8 4.54 277 269 A 27 LEU H A 27 LEU HA 1.0 1.8 4.16 278 270 A 27 LEU HDx% A 27 LEU HBx 1.0 1.8 4.12 279 271 A 27 LEU H A 27 LEU HDy% 1.0 1.8 4.80 280 272 A 28 TYR H A 27 LEU HBy 1.0 1.8 4.74 281 273 A 28 TYR H A 27 LEU HBx 1.0 1.8 5.10 282 274 A 27 LEU H A 28 TYR H 1.0 1.8 4.66 283 275 A 27 LEU H A 29 GLU H 1.0 1.8 5.40 284 276 A 27 LEU HG A 30 LEU H 1.0 1.8 4.35 285 277 A 37 ALA HB% A 28 TYR HBy 1.0 1.8 5.29 286 278 A 28 TYR HBy A 42 LEU HDx% 1.0 1.8 4.20 287 279 A 37 ALA HB% A 28 TYR H 1.0 1.8 4.67 288 280 A 28 TYR HBx A 28 TYR H 1.0 1.8 4.42 289 281 A 28 TYR HBy A 28 TYR HA 1.0 1.8 5.53 290 282 A 28 TYR HBy A 28 TYR H 1.0 1.8 5.16 291 283 A 28 TYR HBy A 28 TYR H 1.0 1.8 4.51 292 284 A 28 TYR HBx A 28 TYR H 1.0 1.8 5.00 293 285 A 28 TYR H A 28 TYR HA 1.0 1.8 4.20 294 286 A 29 GLU H A 28 TYR HBx 1.0 1.8 4.49 295 287 A 28 TYR HBy A 29 GLU H 1.0 1.8 4.93 296 288 A 28 TYR H A 29 GLU HGy 1.0 1.8 4.42 297 289 A 28 TYR H A 30 LEU H 1.0 1.8 5.41 298 290 A 28 TYR HBx A 31 LYS H 1.0 1.8 5.55 299 291 A 28 TYR HA A 31 LYS HBy 1.0 1.8 4.45 300 292 A 28 TYR HA A 31 LYS HBx 1.0 1.8 4.45 301 293 A 28 TYR H A 31 LYS H 1.0 1.8 6.34 302 294 A 28 TYR H A 32 ASN H 1.0 1.8 5.41 303 295 A 37 ALA HB% A 28 TYR HBx 1.0 1.8 4.42 304 296 A 28 TYR HBx A 38 SER H 1.0 1.8 4.88 305 297 A 28 TYR HBx A 42 LEU HDy% 1.0 1.8 4.17 306 297 A 28 TYR HBx A 42 LEU HDx% 1.0 1.8 4.17 307 298 A 28 TYR HBy A 42 LEU HDy% 1.0 1.8 4.31 308 298 A 28 TYR HBy A 42 LEU HDx% 1.0 1.8 4.31 309 299 A 28 TYR HBx A 42 LEU HA 1.0 1.8 4.75 310 300 A 28 TYR HBy A 28 TYR HBx 1.0 1.8 5.34 311 301 A 29 GLU H A 29 GLU HGx 1.0 1.8 4.98 312 302 A 29 GLU HGy A 29 GLU HBx 1.0 1.8 5.53 313 303 A 29 GLU H A 29 GLU HBy 1.0 1.8 4.80 314 304 A 29 GLU HGy A 29 GLU HA 1.0 1.8 5.10 315 305 A 29 GLU HGx A 29 GLU HBy 1.0 1.8 5.46 316 306 A 29 GLU HBy A 29 GLU HA 1.0 1.8 4.20 317 307 A 29 GLU H A 29 GLU HBx 1.0 1.8 4.50 318 308 A 29 GLU H A 29 GLU HGy 1.0 1.8 5.40 319 309 A 29 GLU HGx A 29 GLU HA 1.0 1.8 5.11 320 310 A 29 GLU H A 29 GLU HBy 1.0 1.8 5.53 321 311 A 29 GLU HBx A 29 GLU HA 1.0 1.8 5.12 322 312 A 29 GLU H A 29 GLU HGy 1.0 1.8 4.49 323 313 A 29 GLU H A 29 GLU HA 1.0 1.8 4.33 324 314 A 29 GLU H A 29 GLU HBx 1.0 1.8 5.35 325 315 A 29 GLU H A 30 LEU HBy 1.0 1.8 5.46 326 316 A 29 GLU HGy A 31 LYS H 1.0 1.8 5.55 327 317 A 29 GLU H A 31 LYS H 1.0 1.8 5.11 328 318 A 31 LYS H A 29 GLU HBy 1.0 1.8 5.45 329 319 A 29 GLU HGy A 33 THR HA 1.0 1.8 5.41 330 320 A 29 GLU HBx A 36 LYS HA 1.0 1.8 4.98 331 321 A 29 GLU HGy A 37 ALA H 1.0 1.8 4.08 332 322 A 37 ALA HB% A 29 GLU HGy 1.0 1.8 3.95 333 323 A 29 GLU HA A 37 ALA H 1.0 1.8 4.74 334 324 A 29 GLU HBx A 37 ALA H 1.0 1.8 5.23 335 325 A 29 GLU H A 37 ALA H 1.0 1.8 5.40 336 326 A 37 ALA HB% A 29 GLU HA 1.0 1.8 4.62 337 327 A 37 ALA HB% A 29 GLU HGx 1.0 1.8 4.48 338 328 A 29 GLU HBy A 37 ALA H 1.0 1.8 5.26 339 329 A 29 GLU HGx A 37 ALA H 1.0 1.8 4.07 340 330 A 37 ALA HB% A 29 GLU H 1.0 1.8 4.50 341 331 A 29 GLU HGy A 29 GLU HBy 1.0 1.8 4.86 342 332 A 30 LEU H A 29 GLU HBy 1.0 1.8 5.64 343 333 A 30 LEU H A 30 LEU HBy 1.0 1.8 4.80 344 334 A 30 LEU HBy A 30 LEU HBx 1.0 1.8 4.99 345 335 A 30 LEU H A 30 LEU HDx% 1.0 1.8 4.97 346 335 A 30 LEU H A 30 LEU HDy% 1.0 1.8 4.97 347 336 A 30 LEU H A 30 LEU HBx 1.0 1.8 5.00 348 337 A 30 LEU H A 30 LEU HG 1.0 1.8 5.22 349 338 A 30 LEU HBx A 30 LEU HA 1.0 1.8 5.17 350 339 A 30 LEU HA A 30 LEU HDx% 1.0 1.8 4.01 351 339 A 30 LEU HDy% A 30 LEU HA 1.0 1.8 4.01 352 340 A 30 LEU H A 30 LEU HA 1.0 1.8 4.10 353 341 A 30 LEU H A 31 LYS HBy 1.0 1.8 5.02 354 342 A 30 LEU HG A 31 LYS HA 1.0 1.8 4.27 355 343 A 30 LEU H A 31 LYS HBx 1.0 1.8 5.02 356 344 A 30 LEU H A 31 LYS H 1.0 1.8 4.02 357 345 A 30 LEU HBx A 31 LYS HA 1.0 1.8 5.17 358 346 A 31 LYS H A 30 LEU HBy 1.0 1.8 4.84 359 347 A 31 LYS H A 31 LYS HBx 1.0 1.8 4.40 360 348 A 31 LYS HA A 31 LYS HBx 1.0 1.8 4.33 361 349 A 31 LYS HA A 31 LYS HGx 1.0 1.8 3.98 362 350 A 31 LYS H A 31 LYS HBy 1.0 1.8 4.40 363 351 A 31 LYS H A 31 LYS HGy 1.0 1.8 5.35 364 352 A 31 LYS H A 31 LYS HBy 1.0 1.8 3.71 365 352 A 31 LYS H A 31 LYS HBx 1.0 1.8 3.71 366 353 A 31 LYS HA A 31 LYS HBy 1.0 1.8 4.33 367 354 A 31 LYS HA A 31 LYS HDx 1.0 1.8 5.50 368 355 A 31 LYS H A 31 LYS HA 1.0 1.8 4.26 369 356 A 32 ASN H A 31 LYS HA 1.0 1.8 5.10 370 357 A 31 LYS H A 32 ASN H 1.0 1.8 4.02 371 358 A 32 ASN H A 31 LYS HBy 1.0 1.8 5.02 372 359 A 32 ASN H A 31 LYS HBx 1.0 1.8 5.02 373 360 A 31 LYS H A 31 LYS HGy 1.0 1.8 5.33 374 361 A 32 ASN H A 32 ASN HBy 1.0 1.8 5.54 375 362 A 32 ASN H A 32 ASN HD2y 1.0 1.8 5.56 376 363 A 32 ASN H A 32 ASN HD2x 1.0 1.8 5.23 377 364 A 32 ASN HBy A 32 ASN HA 1.0 1.8 5.42 378 365 A 32 ASN H A 32 ASN HA 1.0 1.8 4.87 379 366 A 32 ASN H A 33 THR HA 1.0 1.8 5.10 380 367 A 32 ASN HA A 34 ASN H 1.0 1.8 4.27 381 368 A 34 ASN H A 32 ASN HBx 1.0 1.8 4.70 382 369 A 32 ASN HBx A 35 GLU H 1.0 1.8 3.47 383 370 A 32 ASN HA A 35 GLU H 1.0 1.8 5.02 384 371 A 32 ASN HD2y A 32 ASN HBx 1.0 1.8 5.46 385 372 A 34 ASN H A 33 THR HG2% 1.0 1.8 5.33 386 373 A 33 THR HA A 34 ASN H 1.0 1.8 4.22 387 374 A 33 THR HA A 35 GLU H 1.0 1.8 4.25 388 375 A 34 ASN H A 34 ASN HA 1.0 1.8 4.28 389 376 A 34 ASN H A 35 GLU H 1.0 1.8 4.56 390 377 A 35 GLU H A 34 ASN HBy 1.0 1.8 5.10 391 378 A 34 ASN HBx A 35 GLU HGx 1.0 1.8 5.47 392 379 A 34 ASN HBx A 35 GLU HGy 1.0 1.8 5.47 393 380 A 35 GLU HBx A 35 GLU HA 1.0 1.8 5.05 394 381 A 35 GLU HA A 35 GLU HBy 1.0 1.8 5.14 395 382 A 35 GLU H A 35 GLU HGy 1.0 1.8 5.35 396 383 A 35 GLU H A 35 GLU HBx 1.0 1.8 5.33 397 384 A 35 GLU HGy A 35 GLU HA 1.0 1.8 4.81 398 385 A 35 GLU HGx A 35 GLU HA 1.0 1.8 4.81 399 386 A 35 GLU H A 35 GLU HGx 1.0 1.8 4.16 400 387 A 35 GLU HGx A 35 GLU HBx 1.0 1.8 4.12 401 388 A 35 GLU H A 35 GLU HGx 1.0 1.8 5.35 402 389 A 35 GLU H A 35 GLU HGy 1.0 1.8 4.16 403 390 A 35 GLU HGy A 35 GLU HBx 1.0 1.8 4.12 404 391 A 35 GLU HGy A 36 LYS H 1.0 1.8 5.48 405 392 A 35 GLU HA A 36 LYS H 1.0 1.8 3.67 406 393 A 35 GLU HGx A 36 LYS H 1.0 1.8 5.48 407 394 A 37 ALA H A 35 GLU HBy 1.0 1.8 5.23 408 395 A 36 LYS HA A 36 LYS HDx 1.0 1.8 4.36 409 395 A 36 LYS HA A 36 LYS HDy 1.0 1.8 4.36 410 396 A 36 LYS H A 36 LYS HDx 1.0 1.8 4.22 411 396 A 36 LYS H A 36 LYS HDy 1.0 1.8 4.22 412 397 A 36 LYS HA A 36 LYS HGy 1.0 1.8 5.30 413 397 A 36 LYS HA A 36 LYS HGx 1.0 1.8 5.30 414 398 A 36 LYS H A 36 LYS HGy 1.0 1.8 4.63 415 398 A 36 LYS H A 36 LYS HGx 1.0 1.8 4.63 416 399 A 36 LYS H A 36 LYS HBy 1.0 1.8 4.38 417 400 A 36 LYS HA A 36 LYS HBx 1.0 1.8 4.36 418 401 A 36 LYS H A 36 LYS HBx 1.0 1.8 4.22 419 402 A 36 LYS H A 36 LYS HGy 1.0 1.8 5.24 420 403 A 36 LYS H A 36 LYS HGx 1.0 1.8 5.24 421 404 A 36 LYS HA A 37 ALA H 1.0 1.8 4.12 422 405 A 37 ALA H A 36 LYS HBy 1.0 1.8 4.87 423 406 A 37 ALA H A 36 LYS HGy 1.0 1.8 5.45 424 406 A 37 ALA H A 36 LYS HGx 1.0 1.8 5.45 425 407 A 37 ALA H A 36 LYS HDx 1.0 1.8 5.00 426 407 A 37 ALA H A 36 LYS HDy 1.0 1.8 5.00 427 408 A 36 LYS HBx A 37 ALA HA 1.0 1.8 4.82 428 409 A 37 ALA H A 36 LYS HBx 1.0 1.8 5.00 429 410 A 36 LYS H A 71 ALA H 1.0 1.8 5.29 430 411 A 36 LYS HA A 36 LYS H 1.0 1.8 4.84 431 412 A 37 ALA H A 42 LEU HDy% 1.0 1.8 5.25 432 412 A 42 LEU HDx% A 37 ALA H 1.0 1.8 5.25 433 413 A 37 ALA HA A 41 LYS HDx 1.0 1.8 4.02 434 414 A 37 ALA HA A 41 LYS HDy 1.0 1.8 5.00 435 415 A 37 ALA HB% A 37 ALA HA 1.0 1.8 4.27 436 416 A 37 ALA HB% A 37 ALA H 1.0 1.8 4.13 437 417 A 38 SER H A 37 ALA HA 1.0 1.8 3.95 438 418 A 37 ALA HB% A 38 SER H 1.0 1.8 3.92 439 419 A 37 ALA HB% A 70 VAL HGy% 1.0 1.8 3.42 440 420 A 70 VAL HGy% A 37 ALA HA 1.0 1.8 4.41 441 421 A 70 VAL HGx% A 37 ALA HB% 1.0 1.8 3.41 442 422 A 38 SER H A 41 LYS H 1.0 1.8 4.84 443 423 A 70 VAL HGy% A 38 SER H 1.0 1.8 4.05 444 424 A 38 SER H A 42 LEU H 1.0 1.8 4.56 445 425 A 70 VAL HGy% A 38 SER HBx 1.0 1.8 4.41 446 426 A 38 SER H A 38 SER HBx 1.0 1.8 3.95 447 427 A 38 SER H A 38 SER HBy 1.0 1.8 5.45 448 428 A 38 SER HBx A 38 SER HA 1.0 1.8 4.58 449 429 A 38 SER HBy A 38 SER HA 1.0 1.8 4.68 450 430 A 38 SER H A 38 SER HA 1.0 1.8 4.97 451 431 A 38 SER HBy A 39 LEU H 1.0 1.8 5.32 452 432 A 38 SER HBx A 39 LEU H 1.0 1.8 5.50 453 433 A 38 SER HBy A 40 SER H 1.0 1.8 3.69 454 434 A 38 SER HA A 40 SER H 1.0 1.8 4.60 455 435 A 38 SER H A 41 LYS HEy 1.0 1.8 4.88 456 435 A 38 SER H A 41 LYS HEx 1.0 1.8 4.88 457 436 A 38 SER H A 41 LYS HGy 1.0 1.8 4.96 458 437 A 41 LYS H A 38 SER HA 1.0 1.8 4.73 459 438 A 41 LYS H A 38 SER HBx 1.0 1.8 4.73 460 439 A 38 SER H A 41 LYS HBy 1.0 1.8 3.57 461 440 A 41 LYS HDy A 38 SER HBx 1.0 1.8 5.00 462 441 A 38 SER H A 41 LYS HBx 1.0 1.8 3.27 463 442 A 38 SER H A 41 LYS HA 1.0 1.8 4.54 464 443 A 41 LYS H A 38 SER HBy 1.0 1.8 3.71 465 444 A 38 SER H A 41 LYS HGx 1.0 1.8 4.96 466 445 A 38 SER H A 42 LEU HDy% 1.0 1.8 4.05 467 445 A 42 LEU HDx% A 38 SER H 1.0 1.8 4.05 468 446 A 38 SER H A 42 LEU HBy 1.0 1.8 5.16 469 447 A 70 VAL H A 38 SER HA 1.0 1.8 5.48 470 448 A 70 VAL HGy% A 38 SER HA 1.0 1.8 4.20 471 449 A 70 VAL HGy% A 38 SER HBy 1.0 1.8 3.86 472 450 A 71 ALA H A 38 SER HBx 1.0 1.8 4.81 473 451 A 71 ALA H A 38 SER HA 1.0 1.8 4.83 474 452 A 38 SER HA A 71 ALA HB% 1.0 1.8 4.81 475 453 A 38 SER HBx A 71 ALA HB% 1.0 1.8 4.89 476 454 A 38 SER H A 38 SER HBy 1.0 1.8 5.93 477 455 A 38 SER HBx A 38 SER HBy 1.0 1.8 4.92 478 456 A 38 SER H A 39 LEU H 1.0 1.8 5.65 479 457 A 39 LEU H A 72 ASN H 1.0 1.8 5.90 480 458 A 70 VAL HGy% A 39 LEU H 1.0 1.8 4.57 481 459 A 57 LYS H A 39 LEU HDx% 1.0 1.8 5.31 482 460 A 56 TYR H A 39 LEU HDx% 1.0 1.8 4.97 483 461 A 39 LEU HDx% A 58 ALA HB% 1.0 1.8 4.98 484 462 A 39 LEU H A 71 ALA HB% 1.0 1.8 5.37 485 463 A 56 TYR HBy A 39 LEU HDx% 1.0 1.8 5.02 486 464 A 71 ALA H A 39 LEU H 1.0 1.8 5.95 487 465 A 39 LEU HA A 39 LEU HBx 1.0 1.8 5.20 488 466 A 39 LEU HA A 39 LEU HBy 1.0 1.8 5.44 489 467 A 39 LEU HDx% A 39 LEU HBx 1.0 1.8 4.80 490 468 A 39 LEU HDx% A 39 LEU HBy 1.0 1.8 5.34 491 469 A 39 LEU HG A 39 LEU HDx% 1.0 1.8 4.62 492 470 A 39 LEU H A 39 LEU HBy 1.0 1.8 5.48 493 471 A 39 LEU HA A 39 LEU HDx% 1.0 1.8 4.36 494 472 A 39 LEU HG A 39 LEU HBx 1.0 1.8 4.99 495 473 A 39 LEU HG A 39 LEU HBy 1.0 1.8 4.97 496 474 A 40 SER H A 39 LEU HBy 1.0 1.8 4.62 497 475 A 40 SER H A 39 LEU HBx 1.0 1.8 4.66 498 476 A 39 LEU HA A 41 LYS H 1.0 1.8 4.73 499 477 A 41 LYS H A 39 LEU H 1.0 1.8 5.76 500 478 A 39 LEU HA A 42 LEU HBy 1.0 1.8 4.84 501 479 A 39 LEU HA A 42 LEU H 1.0 1.8 4.33 502 480 A 39 LEU HA A 43 VAL H 1.0 1.8 4.33 503 481 A 53 ALA HA A 39 LEU HDx% 1.0 1.8 4.22 504 482 A 56 TYR HBx A 39 LEU HG 1.0 1.8 4.75 505 483 A 56 TYR HBy A 39 LEU HG 1.0 1.8 4.91 506 484 A 57 LYS H A 39 LEU HG 1.0 1.8 4.60 507 485 A 39 LEU HG A 57 LYS HA 1.0 1.8 5.02 508 486 A 39 LEU HBx A 39 LEU HBy 1.0 1.8 5.22 509 487 A 40 SER H A 40 SER HA 1.0 1.8 4.43 510 488 A 40 SER H A 40 SER HBy 1.0 1.8 4.28 511 488 A 40 SER H A 40 SER HBx 1.0 1.8 4.28 512 489 A 41 LYS H A 40 SER HBy 1.0 1.8 4.92 513 489 A 41 LYS H A 40 SER HBx 1.0 1.8 4.92 514 490 A 41 LYS H A 40 SER H 1.0 1.8 4.85 515 491 A 40 SER H A 41 LYS HGx 1.0 1.8 4.66 516 491 A 40 SER H A 41 LYS HGy 1.0 1.8 4.66 517 492 A 41 LYS H A 41 LYS HBy 1.0 1.8 4.51 518 493 A 41 LYS H A 41 LYS HGy 1.0 1.8 5.10 519 494 A 41 LYS H A 41 LYS HA 1.0 1.8 4.99 520 495 A 41 LYS H A 41 LYS HGx 1.0 1.8 3.88 521 495 A 41 LYS H A 41 LYS HGy 1.0 1.8 3.88 522 496 A 41 LYS HBy A 41 LYS HA 1.0 1.8 4.36 523 497 A 41 LYS H A 41 LYS HGx 1.0 1.8 5.10 524 498 A 41 LYS HEy A 41 LYS HGx 1.0 1.8 4.73 525 498 A 41 LYS HGy A 41 LYS HEy 1.0 1.8 4.73 526 498 A 41 LYS HEx A 41 LYS HGy 1.0 1.8 4.73 527 498 A 41 LYS HEx A 41 LYS HGx 1.0 1.8 4.73 528 499 A 41 LYS HA A 41 LYS HGy 1.0 1.8 4.80 529 500 A 41 LYS HA A 41 LYS HGx 1.0 1.8 4.01 530 500 A 41 LYS HA A 41 LYS HGy 1.0 1.8 4.01 531 501 A 41 LYS HBx A 41 LYS HA 1.0 1.8 4.01 532 502 A 41 LYS H A 41 LYS HA 1.0 1.8 4.45 533 503 A 41 LYS HA A 41 LYS HGx 1.0 1.8 4.80 534 504 A 41 LYS H A 42 LEU H 1.0 1.8 4.57 535 505 A 41 LYS H A 42 LEU HBy 1.0 1.8 5.46 536 506 A 42 LEU H A 41 LYS HA 1.0 1.8 4.90 537 507 A 41 LYS H A 43 VAL H 1.0 1.8 3.81 538 508 A 41 LYS HA A 43 VAL H 1.0 1.8 4.08 539 509 A 44 SER H A 41 LYS HGx 1.0 1.8 5.18 540 509 A 41 LYS HGy A 44 SER H 1.0 1.8 5.18 541 510 A 45 SER H A 41 LYS HGx 1.0 1.8 5.76 542 510 A 41 LYS HGy A 45 SER H 1.0 1.8 5.76 543 511 A 41 LYS HA A 45 SER H 1.0 1.8 5.11 544 512 A 48 ILE HG2% A 42 LEU HBx 1.0 1.8 3.90 545 513 A 48 ILE HD1% A 42 LEU HBy 1.0 1.8 4.19 546 514 A 42 LEU HBx A 42 LEU HDy% 1.0 1.8 4.30 547 514 A 42 LEU HDx% A 42 LEU HBx 1.0 1.8 4.30 548 515 A 42 LEU HBy A 42 LEU HDy% 1.0 1.8 4.28 549 515 A 42 LEU HDx% A 42 LEU HBy 1.0 1.8 4.28 550 516 A 42 LEU HDx% A 42 LEU H 1.0 1.8 5.38 551 517 A 42 LEU HDx% A 42 LEU HA 1.0 1.8 4.38 552 518 A 42 LEU HDx% A 42 LEU HBx 1.0 1.8 4.70 553 519 A 42 LEU HDx% A 42 LEU HBy 1.0 1.8 4.42 554 520 A 42 LEU H A 42 LEU HBy 1.0 1.8 5.02 555 521 A 42 LEU HA A 42 LEU H 1.0 1.8 4.80 556 522 A 42 LEU HA A 42 LEU HBx 1.0 1.8 5.44 557 523 A 42 LEU H A 42 LEU HBx 1.0 1.8 5.47 558 524 A 43 VAL H A 42 LEU HBx 1.0 1.8 5.47 559 525 A 42 LEU HDx% A 43 VAL H 1.0 1.8 5.38 560 526 A 42 LEU H A 43 VAL HB 1.0 1.8 4.18 561 527 A 42 LEU H A 43 VAL HA 1.0 1.8 4.68 562 528 A 42 LEU HA A 43 VAL H 1.0 1.8 4.80 563 529 A 42 LEU HBy A 43 VAL H 1.0 1.8 5.02 564 530 A 45 SER H A 42 LEU HDy% 1.0 1.8 5.42 565 530 A 42 LEU HDx% A 45 SER H 1.0 1.8 5.42 566 531 A 42 LEU HA A 45 SER H 1.0 1.8 3.78 567 532 A 42 LEU HBx A 47 ASN H 1.0 1.8 4.81 568 533 A 42 LEU HA A 47 ASN HBx 1.0 1.8 4.70 569 534 A 42 LEU HDx% A 47 ASN HBx 1.0 1.8 4.29 570 535 A 42 LEU HBx A 47 ASN HBx 1.0 1.8 7.80 571 536 A 42 LEU HBy A 48 ILE HG1x 1.0 1.8 3.57 572 537 A 42 LEU HBx A 48 ILE HG1x 1.0 1.8 3.58 573 538 A 42 LEU HBy A 48 ILE HG1y 1.0 1.8 5.06 574 539 A 42 LEU HDx% A 68 GLN HE2x 1.0 1.8 5.17 575 540 A 42 LEU HBy A 42 LEU HBx 1.0 1.8 5.87 576 541 A 43 VAL HGx% A 50 GLN H 1.0 1.8 5.00 577 542 A 43 VAL HA A 48 ILE H 1.0 1.8 4.47 578 543 A 43 VAL HGx% A 53 ALA HB% 1.0 1.8 3.56 579 544 A 43 VAL HGx% A 54 ASP H 1.0 1.8 5.54 580 545 A 43 VAL HGx% A 48 ILE H 1.0 1.8 5.73 581 546 A 43 VAL HA A 43 VAL HGx% 1.0 1.8 4.58 582 547 A 43 VAL H A 43 VAL HGy% 1.0 1.8 4.81 583 548 A 43 VAL H A 43 VAL HA 1.0 1.8 4.68 584 549 A 43 VAL HB A 43 VAL HGx% 1.0 1.8 4.33 585 550 A 43 VAL H A 43 VAL HA 1.0 1.8 4.69 586 551 A 43 VAL HA A 43 VAL HGy% 1.0 1.8 4.31 587 552 A 43 VAL HB A 43 VAL HGy% 1.0 1.8 4.36 588 553 A 43 VAL HB A 43 VAL HA 1.0 1.8 5.00 589 554 A 43 VAL H A 43 VAL HB 1.0 1.8 4.18 590 555 A 43 VAL H A 43 VAL HGx% 1.0 1.8 4.42 591 556 A 44 SER H A 43 VAL HGx% 1.0 1.8 5.18 592 557 A 44 SER H A 43 VAL HA 1.0 1.8 4.30 593 558 A 44 SER H A 43 VAL HB 1.0 1.8 4.20 594 559 A 43 VAL HB A 44 SER HA 1.0 1.8 5.28 595 560 A 44 SER H A 43 VAL HGy% 1.0 1.8 4.91 596 561 A 43 VAL H A 44 SER HA 1.0 1.8 4.69 597 562 A 45 SER H A 43 VAL HGx% 1.0 1.8 5.99 598 563 A 45 SER H A 43 VAL HGy% 1.0 1.8 5.66 599 564 A 45 SER H A 43 VAL HB 1.0 1.8 5.29 600 565 A 43 VAL HGy% A 46 GLY H 1.0 1.8 4.67 601 566 A 43 VAL HA A 46 GLY H 1.0 1.8 3.47 602 567 A 43 VAL HA A 47 ASN H 1.0 1.8 3.94 603 568 A 43 VAL HB A 47 ASN H 1.0 1.8 5.84 604 569 A 48 ILE HG2% A 43 VAL HGy% 1.0 1.8 4.59 605 570 A 48 ILE HD1% A 43 VAL H 1.0 1.8 4.92 606 571 A 48 ILE H A 43 VAL HGy% 1.0 1.8 5.42 607 572 A 48 ILE HD1% A 43 VAL HA 1.0 1.8 5.10 608 573 A 43 VAL HA A 50 GLN H 1.0 1.8 5.36 609 574 A 43 VAL HGx% A 50 GLN HA 1.0 1.8 3.86 610 575 A 43 VAL HGx% A 50 GLN HBy 1.0 1.8 5.03 611 576 A 43 VAL HGx% A 50 GLN HE2x 1.0 1.8 7.93 612 577 A 50 GLN H A 43 VAL HGy% 1.0 1.8 4.37 613 578 A 43 VAL HGx% A 50 GLN HE2y 1.0 1.8 7.33 614 579 A 43 VAL HGy% A 50 GLN HBx 1.0 1.8 4.83 615 580 A 53 ALA HB% A 43 VAL HGy% 1.0 1.8 4.28 616 581 A 43 VAL HB A 53 ALA H 1.0 1.8 4.81 617 582 A 43 VAL HA A 53 ALA HB% 1.0 1.8 5.31 618 583 A 44 SER H A 44 SER HBx 1.0 1.8 3.31 619 584 A 44 SER H A 44 SER HBx 1.0 1.8 3.89 620 584 A 44 SER H A 44 SER HBy 1.0 1.8 3.89 621 585 A 44 SER H A 44 SER HBy 1.0 1.8 3.31 622 586 A 44 SER H A 44 SER HA 1.0 1.8 4.30 623 587 A 45 SER H A 44 SER HA 1.0 1.8 4.04 624 588 A 45 SER H A 44 SER HBx 1.0 1.8 4.54 625 588 A 45 SER H A 44 SER HBy 1.0 1.8 4.54 626 589 A 44 SER HA A 46 GLY H 1.0 1.8 3.47 627 590 A 44 SER H A 46 GLY H 1.0 1.8 4.30 628 591 A 45 SER HA A 45 SER HBx 1.0 1.8 4.30 629 592 A 45 SER HA A 45 SER HBy 1.0 1.8 4.69 630 593 A 45 SER H A 45 SER HA 1.0 1.8 4.86 631 594 A 45 SER H A 45 SER HA 1.0 1.8 4.88 632 595 A 45 SER H A 45 SER HBy 1.0 1.8 5.23 633 596 A 46 GLY H A 45 SER HA 1.0 1.8 5.46 634 597 A 45 SER H A 46 GLY H 1.0 1.8 4.70 635 598 A 47 ASN H A 45 SER HA 1.0 1.8 5.32 636 599 A 46 GLY H A 45 SER HBx 1.0 1.8 6.22 637 600 A 46 GLY H A 46 GLY HAy 1.0 1.8 4.16 638 601 A 46 GLY HAy A 46 GLY HAx 1.0 1.8 3.79 639 602 A 46 GLY H A 46 GLY HAx 1.0 1.8 4.70 640 603 A 46 GLY H A 46 GLY HAx 1.0 1.8 4.25 641 604 A 47 ASN H A 46 GLY HAy 1.0 1.8 4.73 642 605 A 47 ASN H A 46 GLY HAx 1.0 1.8 4.80 643 606 A 47 ASN H A 46 GLY H 1.0 1.8 4.60 644 607 A 48 ILE H A 46 GLY H 1.0 1.8 5.15 645 608 A 47 ASN HBy A 47 ASN HA 1.0 1.8 5.17 646 609 A 47 ASN HBx A 47 ASN HA 1.0 1.8 5.50 647 610 A 47 ASN H A 47 ASN HBx 1.0 1.8 4.43 648 611 A 47 ASN H A 47 ASN HBx 1.0 1.8 5.29 649 612 A 47 ASN H A 47 ASN HBy 1.0 1.8 4.88 650 613 A 47 ASN H A 47 ASN HA 1.0 1.8 4.72 651 614 A 47 ASN HBx A 48 ILE HG1x 1.0 1.8 4.79 652 615 A 48 ILE HG2% A 47 ASN HBy 1.0 1.8 4.87 653 616 A 48 ILE HG1x A 47 ASN HBy 1.0 1.8 5.39 654 617 A 47 ASN H A 48 ILE H 1.0 1.8 4.26 655 618 A 47 ASN H A 47 ASN HD2x 1.0 1.8 5.85 656 619 A 47 ASN HBx A 47 ASN HBy 1.0 1.8 4.98 657 620 A 47 ASN HBx A 48 ILE H 1.0 1.8 5.06 658 621 A 48 ILE HD1% A 53 ALA H 1.0 1.8 4.03 659 622 A 48 ILE HG2% A 52 GLN HBx 1.0 1.8 4.22 660 623 A 48 ILE HD1% A 53 ALA HB% 1.0 1.8 3.50 661 624 A 53 ALA H A 48 ILE HB 1.0 1.8 4.81 662 625 A 48 ILE HD1% A 48 ILE HB 1.0 1.8 5.06 663 626 A 48 ILE HG2% A 48 ILE HB 1.0 1.8 4.39 664 627 A 48 ILE HG2% A 48 ILE HA 1.0 1.8 4.90 665 628 A 48 ILE HB A 48 ILE HA 1.0 1.8 4.97 666 629 A 48 ILE HG1y A 48 ILE HB 1.0 1.8 5.51 667 630 A 48 ILE HG2% A 49 SER H 1.0 1.8 4.70 668 631 A 48 ILE HB A 49 SER H 1.0 1.8 4.52 669 632 A 48 ILE HA A 49 SER H 1.0 1.8 4.30 670 633 A 48 ILE HD1% A 52 GLN HA 1.0 1.8 5.18 671 634 A 48 ILE HD1% A 52 GLN HBx 1.0 1.8 4.76 672 635 A 48 ILE H A 49 SER H 1.0 1.8 5.82 673 636 A 49 SER H A 52 GLN H 1.0 1.8 4.58 674 637 A 49 SER H A 49 SER HA 1.0 1.8 4.30 675 638 A 49 SER H A 49 SER HA 1.0 1.8 5.54 676 639 A 49 SER H A 49 SER HBx 1.0 1.8 5.06 677 640 A 50 GLN H A 49 SER HA 1.0 1.8 4.45 678 641 A 50 GLN H A 49 SER HBy 1.0 1.8 5.00 679 642 A 49 SER H A 51 LYS H 1.0 1.8 5.34 680 643 A 49 SER HA A 51 LYS H 1.0 1.8 5.17 681 644 A 49 SER H A 51 LYS HGy 1.0 1.8 4.35 682 645 A 49 SER HBy A 51 LYS H 1.0 1.8 4.45 683 646 A 49 SER H A 52 GLN HBy 1.0 1.8 3.69 684 647 A 52 GLN HBx A 49 SER H 1.0 1.8 4.35 685 648 A 52 GLN H A 49 SER HBy 1.0 1.8 5.27 686 649 A 53 ALA H A 49 SER HA 1.0 1.8 5.17 687 650 A 53 ALA H A 49 SER HBy 1.0 1.8 5.55 688 651 A 53 ALA H A 49 SER H 1.0 1.8 5.34 689 652 A 50 GLN HA A 50 GLN HGx 1.0 1.8 5.11 690 653 A 50 GLN HBy A 50 GLN HGx 1.0 1.8 4.43 691 654 A 50 GLN H A 50 GLN HA 1.0 1.8 4.63 692 655 A 50 GLN H A 50 GLN HGy 1.0 1.8 5.02 693 656 A 50 GLN H A 50 GLN HGx 1.0 1.8 5.02 694 657 A 50 GLN HBy A 50 GLN HGy 1.0 1.8 4.43 695 658 A 50 GLN HA A 50 GLN HGy 1.0 1.8 5.11 696 659 A 50 GLN H A 50 GLN HBy 1.0 1.8 4.68 697 660 A 50 GLN H A 50 GLN HBx 1.0 1.8 4.63 698 661 A 50 GLN HBy A 51 LYS H 1.0 1.8 5.45 699 662 A 51 LYS H A 50 GLN HGx 1.0 1.8 5.30 700 663 A 50 GLN HBx A 51 LYS H 1.0 1.8 4.99 701 664 A 50 GLN H A 51 LYS H 1.0 1.8 5.06 702 665 A 51 LYS H A 50 GLN HGy 1.0 1.8 5.30 703 666 A 50 GLN H A 52 GLN H 1.0 1.8 5.55 704 667 A 53 ALA HB% A 50 GLN HA 1.0 1.8 3.38 705 668 A 50 GLN HBx A 53 ALA H 1.0 1.8 4.77 706 669 A 53 ALA HB% A 50 GLN HE2y 1.0 1.8 3.97 707 670 A 50 GLN H A 53 ALA HB% 1.0 1.8 5.22 708 671 A 50 GLN HA A 53 ALA H 1.0 1.8 3.75 709 672 A 53 ALA HB% A 50 GLN HE2x 1.0 1.8 4.79 710 673 A 50 GLN H A 53 ALA H 1.0 1.8 4.22 711 674 A 50 GLN HBy A 53 ALA H 1.0 1.8 5.26 712 675 A 54 ASP H A 50 GLN HE2x 1.0 1.8 5.71 713 676 A 54 ASP H A 50 GLN HE2y 1.0 1.8 4.76 714 677 A 54 ASP H A 50 GLN HGy 1.0 1.8 4.97 715 678 A 54 ASP H A 50 GLN HGx 1.0 1.8 4.97 716 679 A 54 ASP H A 50 GLN HA 1.0 1.8 4.56 717 680 A 50 GLN H A 50 GLN HBy 1.0 1.8 5.03 718 681 A 50 GLN HE2y A 50 GLN HGx 1.0 1.8 6.16 719 682 A 54 ASP H A 51 LYS H 1.0 1.8 3.96 720 683 A 51 LYS HBy A 51 LYS HA 1.0 1.8 4.42 721 684 A 51 LYS H A 51 LYS HBy 1.0 1.8 4.81 722 685 A 51 LYS H A 51 LYS HBy 1.0 1.8 3.90 723 686 A 51 LYS H A 51 LYS HA 1.0 1.8 4.73 724 687 A 52 GLN HBx A 51 LYS H 1.0 1.8 4.96 725 688 A 53 ALA H A 51 LYS HBx 1.0 1.8 5.20 726 689 A 53 ALA H A 51 LYS HA 1.0 1.8 5.05 727 690 A 54 ASP H A 51 LYS HA 1.0 1.8 4.38 728 691 A 51 LYS HA A 54 ASP HBy 1.0 1.8 4.32 729 692 A 51 LYS HA A 55 SER H 1.0 1.8 5.23 730 693 A 52 GLN H A 51 LYS HA 1.0 1.8 4.85 731 694 A 52 GLN HA A 52 GLN HGx 1.0 1.8 5.47 732 695 A 52 GLN HBx A 52 GLN HGx 1.0 1.8 5.28 733 696 A 52 GLN HGy A 52 GLN HBx 1.0 1.8 5.24 734 697 A 52 GLN HGy A 52 GLN HA 1.0 1.8 5.42 735 698 A 52 GLN HA A 52 GLN H 1.0 1.8 4.64 736 699 A 53 ALA H A 52 GLN HBy 1.0 1.8 4.61 737 700 A 53 ALA HB% A 52 GLN H 1.0 1.8 4.76 738 701 A 54 ASP H A 52 GLN H 1.0 1.8 4.76 739 702 A 53 ALA H A 52 GLN HA 1.0 1.8 4.87 740 703 A 53 ALA HA A 53 ALA H 1.0 1.8 4.50 741 704 A 53 ALA HB% A 53 ALA H 1.0 1.8 4.69 742 705 A 53 ALA HA A 53 ALA HB% 1.0 1.8 4.06 743 706 A 53 ALA HB% A 53 ALA H 1.0 1.8 3.95 744 707 A 54 ASP H A 53 ALA H 1.0 1.8 4.70 745 708 A 53 ALA HA A 54 ASP H 1.0 1.8 5.47 746 709 A 53 ALA HB% A 54 ASP H 1.0 1.8 4.30 747 710 A 53 ALA HA A 55 SER H 1.0 1.8 4.96 748 711 A 53 ALA H A 55 SER H 1.0 1.8 5.13 749 712 A 53 ALA HB% A 55 SER H 1.0 1.8 5.00 750 713 A 56 TYR H A 53 ALA HA 1.0 1.8 4.73 751 714 A 56 TYR H A 53 ALA HB% 1.0 1.8 5.03 752 715 A 56 TYR HBx A 53 ALA HA 1.0 1.8 4.87 753 716 A 56 TYR HBy A 53 ALA HA 1.0 1.8 4.69 754 717 A 57 LYS H A 53 ALA HB% 1.0 1.8 5.03 755 718 A 57 LYS H A 53 ALA HA 1.0 1.8 4.96 756 719 A 57 LYS H A 54 ASP HA 1.0 1.8 3.98 757 720 A 54 ASP H A 54 ASP HA 1.0 1.8 4.82 758 721 A 54 ASP H A 54 ASP HBx 1.0 1.8 4.76 759 722 A 54 ASP H A 54 ASP HBx 1.0 1.8 5.09 760 723 A 54 ASP H A 54 ASP HBy 1.0 1.8 5.06 761 724 A 54 ASP HBy A 54 ASP HA 1.0 1.8 4.58 762 725 A 54 ASP H A 54 ASP HBy 1.0 1.8 4.38 763 726 A 54 ASP H A 54 ASP HA 1.0 1.8 4.75 764 727 A 54 ASP HA A 54 ASP HBx 1.0 1.8 4.32 765 728 A 54 ASP HBy A 55 SER H 1.0 1.8 4.90 766 729 A 54 ASP H A 55 SER H 1.0 1.8 4.64 767 730 A 54 ASP H A 55 SER HBx 1.0 1.8 5.52 768 731 A 55 SER H A 54 ASP HBx 1.0 1.8 5.21 769 732 A 56 TYR H A 54 ASP HA 1.0 1.8 3.98 770 733 A 56 TYR H A 54 ASP H 1.0 1.8 5.54 771 734 A 56 TYR H A 54 ASP HBy 1.0 1.8 5.08 772 735 A 54 ASP H A 57 LYS HBy 1.0 1.8 5.16 773 735 A 54 ASP H A 57 LYS HBx 1.0 1.8 5.16 774 736 A 54 ASP HA A 57 LYS HBy 1.0 1.8 4.49 775 737 A 54 ASP HA A 57 LYS HBy 1.0 1.8 3.75 776 737 A 54 ASP HA A 57 LYS HBx 1.0 1.8 3.75 777 738 A 54 ASP HA A 57 LYS HDx 1.0 1.8 4.12 778 738 A 54 ASP HA A 57 LYS HDy 1.0 1.8 4.12 779 739 A 54 ASP HA A 57 LYS HDy 1.0 1.8 4.65 780 740 A 54 ASP HA A 57 LYS HBx 1.0 1.8 4.49 781 741 A 54 ASP HA A 57 LYS HDx 1.0 1.8 4.65 782 742 A 58 ALA HB% A 54 ASP HA 1.0 1.8 4.72 783 743 A 55 SER H A 55 SER HBy 1.0 1.8 4.39 784 744 A 55 SER H A 55 SER HA 1.0 1.8 4.49 785 745 A 55 SER H A 55 SER HBx 1.0 1.8 4.60 786 746 A 56 TYR H A 55 SER HA 1.0 1.8 4.91 787 747 A 56 TYR HA A 55 SER HA 1.0 1.8 4.75 788 748 A 56 TYR H A 55 SER HBx 1.0 1.8 4.27 789 749 A 58 ALA HB% A 55 SER H 1.0 1.8 5.04 790 750 A 58 ALA HB% A 55 SER HA 1.0 1.8 3.80 791 751 A 55 SER HA A 58 ALA H 1.0 1.8 4.16 792 752 A 59 TYR H A 55 SER HA 1.0 1.8 5.16 793 753 A 56 TYR HA A 56 TYR H 1.0 1.8 4.56 794 754 A 56 TYR HA A 56 TYR H 1.0 1.8 4.27 795 755 A 56 TYR H A 56 TYR HBy 1.0 1.8 4.39 796 756 A 56 TYR HA A 56 TYR HBy 1.0 1.8 5.32 797 757 A 56 TYR H A 56 TYR HBx 1.0 1.8 4.44 798 758 A 56 TYR H A 56 TYR HBx 1.0 1.8 4.67 799 759 A 56 TYR H A 56 TYR HBy 1.0 1.8 4.62 800 760 A 56 TYR HA A 56 TYR HBx 1.0 1.8 5.05 801 761 A 56 TYR HA A 57 LYS H 1.0 1.8 4.56 802 762 A 56 TYR H A 57 LYS HBx 1.0 1.8 4.74 803 763 A 57 LYS H A 56 TYR HBx 1.0 1.8 4.67 804 764 A 56 TYR HBy A 57 LYS H 1.0 1.8 4.62 805 765 A 56 TYR H A 57 LYS HBy 1.0 1.8 4.74 806 766 A 56 TYR H A 58 ALA HB% 1.0 1.8 5.22 807 767 A 56 TYR HBy A 58 ALA H 1.0 1.8 5.78 808 768 A 56 TYR HA A 59 TYR H 1.0 1.8 3.62 809 769 A 56 TYR H A 59 TYR H 1.0 1.8 5.30 810 770 A 56 TYR HBy A 56 TYR HBx 1.0 1.8 5.59 811 771 A 57 LYS H A 57 LYS HDx 1.0 1.8 5.20 812 771 A 57 LYS H A 57 LYS HDy 1.0 1.8 5.20 813 772 A 57 LYS HA A 57 LYS HBy 1.0 1.8 5.09 814 773 A 57 LYS H A 57 LYS HGy 1.0 1.8 5.04 815 774 A 57 LYS H A 57 LYS HBy 1.0 1.8 4.74 816 775 A 57 LYS H A 57 LYS HDx 1.0 1.8 5.39 817 776 A 57 LYS H A 57 LYS HBx 1.0 1.8 4.74 818 777 A 57 LYS H A 57 LYS HDy 1.0 1.8 5.39 819 778 A 57 LYS HA A 57 LYS HBx 1.0 1.8 5.09 820 779 A 57 LYS HEy A 57 LYS HBy 1.0 1.8 5.42 821 779 A 57 LYS HBy A 57 LYS HEx 1.0 1.8 5.42 822 780 A 57 LYS HBx A 57 LYS HEy 1.0 1.8 5.42 823 780 A 57 LYS HBx A 57 LYS HEx 1.0 1.8 5.42 824 781 A 57 LYS H A 57 LYS HBy 1.0 1.8 3.88 825 781 A 57 LYS H A 57 LYS HBx 1.0 1.8 3.88 826 782 A 57 LYS H A 57 LYS HA 1.0 1.8 4.57 827 783 A 57 LYS HA A 57 LYS HDy 1.0 1.8 5.48 828 784 A 57 LYS HA A 57 LYS HDx 1.0 1.8 5.48 829 785 A 58 ALA H A 57 LYS HBy 1.0 1.8 4.22 830 785 A 57 LYS HBx A 58 ALA H 1.0 1.8 4.22 831 786 A 57 LYS HA A 58 ALA H 1.0 1.8 4.79 832 787 A 57 LYS H A 59 TYR H 1.0 1.8 5.52 833 788 A 60 TYR H A 57 LYS HBy 1.0 1.8 4.86 834 788 A 57 LYS HBx A 60 TYR H 1.0 1.8 4.86 835 789 A 57 LYS HDy A 57 LYS HEy 1.0 1.8 5.83 836 789 A 57 LYS HDy A 57 LYS HEx 1.0 1.8 5.83 837 790 A 57 LYS HGy A 57 LYS HGx 1.0 1.8 5.13 838 791 A 58 ALA HB% A 58 ALA HA 1.0 1.8 4.06 839 792 A 58 ALA HB% A 58 ALA H 1.0 1.8 3.78 840 793 A 58 ALA HB% A 58 ALA H 1.0 1.8 4.18 841 794 A 58 ALA H A 58 ALA HA 1.0 1.8 4.67 842 795 A 59 TYR H A 58 ALA HB% 1.0 1.8 5.09 843 796 A 58 ALA HB% A 59 TYR HA 1.0 1.8 5.04 844 797 A 59 TYR H A 58 ALA HA 1.0 1.8 5.35 845 798 A 58 ALA HB% A 60 TYR H 1.0 1.8 5.10 846 799 A 58 ALA H A 60 TYR H 1.0 1.8 5.09 847 800 A 58 ALA HA A 61 GLY H 1.0 1.8 4.22 848 801 A 58 ALA HA A 61 GLY HAx 1.0 1.8 4.47 849 802 A 58 ALA HB% A 61 GLY H 1.0 1.8 4.55 850 803 A 58 ALA HA A 61 GLY HAy 1.0 1.8 4.75 851 804 A 59 TYR H A 59 TYR HA 1.0 1.8 4.24 852 805 A 59 TYR HA A 59 TYR HBy 1.0 1.8 4.07 853 806 A 59 TYR H A 59 TYR HA 1.0 1.8 4.34 854 807 A 59 TYR H A 60 TYR H 1.0 1.8 5.03 855 808 A 60 TYR H A 59 TYR HA 1.0 1.8 4.40 856 809 A 60 TYR H A 59 TYR HBy 1.0 1.8 4.91 857 810 A 60 TYR H A 59 TYR HBx 1.0 1.8 5.23 858 811 A 59 TYR HA A 62 LYS H 1.0 1.8 3.96 859 812 A 60 TYR H A 60 TYR HBy 1.0 1.8 5.00 860 813 A 60 TYR H A 60 TYR HBy 1.0 1.8 5.51 861 814 A 60 TYR HA A 60 TYR HBx 1.0 1.8 5.30 862 815 A 60 TYR HBy A 60 TYR HA 1.0 1.8 5.11 863 816 A 60 TYR H A 60 TYR HBx 1.0 1.8 5.34 864 817 A 60 TYR H A 60 TYR HA 1.0 1.8 5.16 865 818 A 60 TYR H A 60 TYR HBx 1.0 1.8 4.62 866 819 A 60 TYR H A 61 GLY H 1.0 1.8 4.98 867 820 A 60 TYR H A 61 GLY HAy 1.0 1.8 4.40 868 821 A 60 TYR H A 62 LYS H 1.0 1.8 4.84 869 822 A 60 TYR H A 62 LYS HBx 1.0 1.8 5.10 870 822 A 60 TYR H A 62 LYS HBy 1.0 1.8 5.10 871 823 A 60 TYR HA A 63 HIS HBy 1.0 1.8 4.79 872 824 A 60 TYR HA A 63 HIS H 1.0 1.8 4.06 873 825 A 60 TYR HA A 68 GLN HA 1.0 1.8 5.33 874 826 A 60 TYR H A 68 GLN H 1.0 1.8 5.09 875 827 A 60 TYR HA A 68 GLN H 1.0 1.8 4.71 876 828 A 60 TYR H A 68 GLN HE2y 1.0 1.8 5.09 877 829 A 60 TYR HA A 68 GLN HBx 1.0 1.8 5.52 878 830 A 60 TYR HA A 68 GLN HBy 1.0 1.8 5.52 879 831 A 60 TYR HBy A 72 ASN HD2x 1.0 1.8 4.12 880 832 A 60 TYR HBx A 72 ASN HD2x 1.0 1.8 4.20 881 833 A 60 TYR HBy A 60 TYR HBx 1.0 1.8 5.07 882 834 A 61 GLY H A 60 TYR HBy 1.0 1.8 5.29 883 835 A 61 GLY H A 61 GLY HAy 1.0 1.8 4.38 884 836 A 61 GLY HAx A 61 GLY HAy 1.0 1.8 3.79 885 837 A 61 GLY H A 61 GLY HAy 1.0 1.8 4.85 886 838 A 61 GLY H A 61 GLY HAx 1.0 1.8 4.31 887 839 A 61 GLY H A 62 LYS HBx 1.0 1.8 5.46 888 839 A 61 GLY H A 62 LYS HBy 1.0 1.8 5.46 889 840 A 61 GLY H A 62 LYS H 1.0 1.8 4.70 890 841 A 61 GLY H A 63 HIS H 1.0 1.8 5.25 891 842 A 61 GLY H A 72 ASN HD2x 1.0 1.8 5.75 892 843 A 61 GLY HAy A 62 LYS H 1.0 1.8 5.03 893 844 A 62 LYS H A 62 LYS HBx 1.0 1.8 4.67 894 845 A 62 LYS H A 62 LYS HA 1.0 1.8 4.88 895 846 A 62 LYS HEx A 62 LYS HBx 1.0 1.8 4.06 896 846 A 62 LYS HBy A 62 LYS HEx 1.0 1.8 4.06 897 847 A 62 LYS HA A 62 LYS HDy 1.0 1.8 5.35 898 848 A 62 LYS H A 62 LYS HBy 1.0 1.8 4.67 899 849 A 62 LYS HGx A 62 LYS HBx 1.0 1.8 4.54 900 849 A 62 LYS HBy A 62 LYS HGx 1.0 1.8 4.54 901 850 A 62 LYS HGx A 62 LYS HBx 1.0 1.8 4.87 902 851 A 62 LYS HBy A 62 LYS HGx 1.0 1.8 4.87 903 852 A 62 LYS HBy A 62 LYS HA 1.0 1.8 4.42 904 853 A 62 LYS HBy A 62 LYS HGy 1.0 1.8 4.78 905 854 A 62 LYS HGy A 62 LYS HBx 1.0 1.8 4.78 906 855 A 62 LYS HA A 62 LYS HDx 1.0 1.8 5.35 907 856 A 62 LYS HA A 62 LYS HBx 1.0 1.8 4.42 908 857 A 62 LYS HGy A 62 LYS HBx 1.0 1.8 4.27 909 857 A 62 LYS HBy A 62 LYS HGy 1.0 1.8 4.27 910 858 A 62 LYS HEx A 62 LYS HDy 1.0 1.8 5.53 911 858 A 62 LYS HEx A 62 LYS HDx 1.0 1.8 5.53 912 859 A 62 LYS H A 63 HIS H 1.0 1.8 4.56 913 860 A 63 HIS H A 62 LYS HA 1.0 1.8 5.36 914 861 A 62 LYS HA A 62 LYS HGx 1.0 1.8 4.84 915 862 A 62 LYS HEx A 62 LYS HDy 1.0 1.8 5.31 916 863 A 62 LYS HBy A 63 HIS H 1.0 1.8 4.97 917 864 A 63 HIS H A 63 HIS HA 1.0 1.8 5.34 918 865 A 63 HIS HBy A 63 HIS H 1.0 1.8 5.27 919 866 A 63 HIS HBy A 63 HIS HA 1.0 1.8 5.35 920 867 A 63 HIS HA A 64 SER H 1.0 1.8 4.72 921 868 A 63 HIS HBy A 66 GLU H 1.0 1.8 5.09 922 869 A 63 HIS HBy A 66 GLU HGx 1.0 1.8 3.41 923 870 A 63 HIS HBy A 63 HIS H 1.0 1.8 5.46 924 871 A 63 HIS HBy A 63 HIS HBx 1.0 1.8 5.16 925 872 A 64 SER H A 63 HIS HBx 1.0 1.8 5.71 926 873 A 63 HIS H A 64 SER H 1.0 1.8 5.71 927 874 A 64 SER H A 64 SER HBy 1.0 1.8 5.22 928 875 A 64 SER H A 64 SER HA 1.0 1.8 5.03 929 876 A 64 SER H A 64 SER HBx 1.0 1.8 4.99 930 877 A 66 GLU H A 64 SER HBx 1.0 1.8 4.46 931 878 A 66 GLU H A 64 SER HA 1.0 1.8 4.77 932 879 A 64 SER HA A 65 GLY H 1.0 1.8 4.93 933 880 A 64 SER H A 65 GLY H 1.0 1.8 5.63 934 881 A 64 SER HBy A 65 GLY H 1.0 1.8 5.42 935 882 A 65 GLY HAx A 65 GLY HAy 1.0 1.8 3.73 936 883 A 65 GLY H A 65 GLY HAy 1.0 1.8 5.30 937 884 A 65 GLY H A 65 GLY HAx 1.0 1.8 5.11 938 885 A 65 GLY H A 65 GLY HAy 1.0 1.8 5.53 939 886 A 65 GLY H A 65 GLY HAx 1.0 1.8 5.51 940 887 A 66 GLU H A 65 GLY HAx 1.0 1.8 5.35 941 888 A 66 GLU H A 65 GLY H 1.0 1.8 5.24 942 889 A 66 GLU H A 65 GLY HAy 1.0 1.8 5.39 943 890 A 66 GLU H A 66 GLU HA 1.0 1.8 4.79 944 891 A 66 GLU HA A 66 GLU HGy 1.0 1.8 5.24 945 892 A 66 GLU H A 67 THR HA 1.0 1.8 5.39 946 893 A 66 GLU HBy A 67 THR H 1.0 1.8 5.11 947 894 A 66 GLU HA A 67 THR H 1.0 1.8 4.16 948 895 A 66 GLU HA A 66 GLU HBx 1.0 1.8 5.00 949 896 A 66 GLU H A 66 GLU HGy 1.0 1.8 5.06 950 897 A 66 GLU H A 66 GLU HBy 1.0 1.8 5.35 951 898 A 66 GLU H A 66 GLU HA 1.0 1.8 4.89 952 899 A 67 THR HA A 67 THR H 1.0 1.8 5.04 953 900 A 67 THR HA A 67 THR HB 1.0 1.8 4.66 954 901 A 67 THR H A 67 THR HG2% 1.0 1.8 5.41 955 902 A 67 THR HA A 67 THR HG2% 1.0 1.8 4.57 956 903 A 67 THR HB A 67 THR HG2% 1.0 1.8 4.16 957 904 A 67 THR H A 67 THR HB 1.0 1.8 4.37 958 905 A 67 THR HA A 67 THR H 1.0 1.8 5.18 959 906 A 68 GLN H A 67 THR HA 1.0 1.8 3.76 960 907 A 68 GLN H A 67 THR H 1.0 1.8 5.50 961 908 A 68 GLN H A 67 THR HG2% 1.0 1.8 4.69 962 909 A 68 GLN HA A 68 GLN HBx 1.0 1.8 4.99 963 910 A 68 GLN HA A 68 GLN HBy 1.0 1.8 4.99 964 911 A 68 GLN HE2y A 68 GLN HBx 1.0 1.8 4.55 965 912 A 68 GLN HE2y A 68 GLN HBy 1.0 1.8 4.55 966 913 A 68 GLN HBx A 68 GLN HGy 1.0 1.8 5.09 967 914 A 68 GLN H A 68 GLN HBy 1.0 1.8 4.01 968 915 A 68 GLN H A 68 GLN HBx 1.0 1.8 4.01 969 916 A 68 GLN HA A 68 GLN H 1.0 1.8 5.21 970 917 A 68 GLN HA A 68 GLN H 1.0 1.8 5.11 971 918 A 68 GLN HBx A 68 GLN HGx 1.0 1.8 4.99 972 919 A 68 GLN HA A 68 GLN HGx 1.0 1.8 5.18 973 920 A 68 GLN H A 68 GLN HBy 1.0 1.8 4.55 974 921 A 68 GLN HA A 68 GLN HE2y 1.0 1.8 5.11 975 922 A 68 GLN HBy A 68 GLN HGx 1.0 1.8 4.99 976 923 A 68 GLN H A 68 GLN HBx 1.0 1.8 4.55 977 924 A 68 GLN HBy A 68 GLN HGy 1.0 1.8 5.09 978 925 A 68 GLN HA A 69 THR H 1.0 1.8 4.21 979 926 A 70 VAL H A 68 GLN H 1.0 1.8 5.16 980 927 A 70 VAL H A 68 GLN HGy 1.0 1.8 4.24 981 928 A 70 VAL H A 68 GLN HE2y 1.0 1.8 5.16 982 929 A 70 VAL H A 68 GLN HBx 1.0 1.8 4.31 983 930 A 70 VAL H A 68 GLN HBy 1.0 1.8 4.31 984 931 A 70 VAL H A 68 GLN HA 1.0 1.8 4.82 985 932 A 72 ASN H A 68 GLN HE2x 1.0 1.8 4.60 986 933 A 72 ASN H A 68 GLN H 1.0 1.8 5.55 987 934 A 68 GLN H A 72 ASN HD2x 1.0 1.8 4.99 988 935 A 68 GLN H A 68 GLN HGx 1.0 1.8 5.27 989 936 A 69 THR H A 69 THR HG2% 1.0 1.8 4.74 990 937 A 70 VAL H A 69 THR H 1.0 1.8 4.73 991 938 A 70 VAL H A 69 THR HA 1.0 1.8 4.58 992 939 A 69 THR HG2% A 69 THR HA 1.0 1.8 5.57 993 940 A 70 VAL HGy% A 70 VAL HB 1.0 1.8 4.27 994 941 A 70 VAL HGx% A 70 VAL HA 1.0 1.8 4.60 995 942 A 70 VAL H A 70 VAL HGx% 1.0 1.8 5.05 996 943 A 70 VAL HGx% A 70 VAL HB 1.0 1.8 4.56 997 944 A 70 VAL H A 70 VAL HGx% 1.0 1.8 4.27 998 945 A 70 VAL H A 70 VAL HB 1.0 1.8 4.28 999 946 A 70 VAL H A 70 VAL HA 1.0 1.8 4.58 1000 947 A 70 VAL H A 70 VAL HB 1.0 1.8 5.02 1001 948 A 70 VAL HA A 70 VAL HGy% 1.0 1.8 4.63 1002 949 A 71 ALA H A 70 VAL HB 1.0 1.8 5.54 1003 950 A 70 VAL HGy% A 71 ALA H 1.0 1.8 4.38 1004 951 A 70 VAL HGx% A 71 ALA HA 1.0 1.8 4.60 1005 952 A 70 VAL HGy% A 71 ALA HA 1.0 1.8 4.63 1006 953 A 70 VAL HGy% A 72 ASN H 1.0 1.8 4.50 1007 954 A 71 ALA HB% A 71 ALA HA 1.0 1.8 3.92 1008 955 A 71 ALA H A 71 ALA HB% 1.0 1.8 3.90 1009 956 A 72 ASN H A 71 ALA HA 1.0 1.8 3.80 1010 957 A 71 ALA HB% A 72 ASN H 1.0 1.8 3.91 1011 958 A 72 ASN H A 72 ASN HBx 1.0 1.8 4.00 1012 959 A 72 ASN HD2x A 72 ASN HD2y 1.0 1.8 4.87 1013 960 A 72 ASN H A 72 ASN HBy 1.0 1.8 5.09 1014 961 A 72 ASN H A 72 ASN HBx 1.0 1.8 4.92 1015 962 A 72 ASN H A 72 ASN HD2y 1.0 1.8 6.03 stop_ save_