data_nef_c19525_4c7q save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 4C7Q 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 0 GLY start . false 2 A 1 MET middle . . 3 A 2 ALA middle . . 4 A 3 GLU middle . . 5 A 4 VAL middle . . 6 A 5 GLU middle . . 7 A 6 TYR middle . . 8 A 7 ARG middle . . 9 A 8 CYS middle . . 10 A 9 PHE middle . . 11 A 10 VAL middle . . 12 A 11 GLY middle . false 13 A 12 GLY middle . false 14 A 13 LEU middle . . 15 A 14 ALA middle . . 16 A 15 TRP middle . . 17 A 16 ALA middle . . 18 A 17 THR middle . . 19 A 18 THR middle . . 20 A 19 ASP middle . . 21 A 20 GLN middle . . 22 A 21 THR middle . . 23 A 22 LEU middle . . 24 A 23 GLY middle . false 25 A 24 GLU middle . . 26 A 25 ALA middle . . 27 A 26 PHE middle . . 28 A 27 SER middle . . 29 A 28 GLN middle . . 30 A 29 PHE middle . . 31 A 30 GLY middle . false 32 A 31 GLU middle . . 33 A 32 ILE middle . . 34 A 33 LEU middle . . 35 A 34 ASP middle . . 36 A 35 SER middle . . 37 A 36 LYS middle . . 38 A 37 ILE middle . . 39 A 38 ILE middle . . 40 A 39 ASN middle . . 41 A 40 ASP middle . . 42 A 41 ARG middle . . 43 A 42 GLU middle . . 44 A 43 THR middle . . 45 A 44 GLY middle . false 46 A 45 ARG middle . . 47 A 46 SER middle . . 48 A 47 ARG middle . . 49 A 48 GLY middle . false 50 A 49 PHE middle . . 51 A 50 GLY middle . false 52 A 51 PHE middle . . 53 A 52 VAL middle . . 54 A 53 THR middle . . 55 A 54 PHE middle . . 56 A 55 LYS middle . . 57 A 56 ASP middle . . 58 A 57 GLU middle . . 59 A 58 LYS middle . . 60 A 59 ALA middle . . 61 A 60 MET middle . . 62 A 61 ARG middle . . 63 A 62 ASP middle . . 64 A 63 ALA middle . . 65 A 64 ILE middle . . 66 A 65 GLU middle . . 67 A 66 GLY middle . false 68 A 67 MET middle . . 69 A 68 ASN middle . . 70 A 69 GLY middle . false 71 A 70 GLN middle . . 72 A 71 ASP middle . . 73 A 72 LEU middle . . 74 A 73 ASP middle . . 75 A 74 GLY middle . false 76 A 75 ARG middle . . 77 A 76 ASN middle . . 78 A 77 ILE middle . . 79 A 78 THR middle . . 80 A 79 VAL middle . . 81 A 80 ASN middle . . 82 A 81 GLU middle . . 83 A 82 ALA middle . . 84 A 83 GLN middle . . 85 A 84 SER middle . . 86 A 85 ARG 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 0 GLY HA2 H 1 3.845 0.001 A 0 GLY HA3 H 1 3.845 0.001 A 0 GLY CA C 13 43.507 0.01 A 1 MET HA H 1 4.478 0.006 A 1 MET HBy H 1 2.098 0.009 A 1 MET HBx H 1 2.012 0.009 A 1 MET HE% H 1 1.691 0.001 A 1 MET HGx H 1 2.579 0.004 A 1 MET HGy H 1 2.612 0.009 A 1 MET CA C 13 55.682 0.034 A 1 MET CB C 13 33.139 0.047 A 1 MET CE C 13 16.144 0.01 A 1 MET CG C 13 31.833 0.067 A 2 ALA H H 1 8.473 0.002 A 2 ALA HA H 1 4.320 0.003 A 2 ALA HB% H 1 1.393 0.009 A 2 ALA C C 13 177.472 0.01 A 2 ALA CA C 13 52.489 0.029 A 2 ALA CB C 13 19.288 0.037 A 2 ALA N N 15 125.300 0.018 A 3 GLU H H 1 8.375 0.003 A 3 GLU HA H 1 4.267 0.005 A 3 GLU HBx H 1 1.912 0.02 A 3 GLU HBy H 1 2.019 0.023 A 3 GLU HGy H 1 2.272 0.009 A 3 GLU HGx H 1 2.263 0.009 A 3 GLU C C 13 176.156 0.01 A 3 GLU CA C 13 56.597 0.071 A 3 GLU CB C 13 30.204 0.066 A 3 GLU CG C 13 36.351 0.069 A 3 GLU N N 15 120.541 0.009 A 4 VAL H H 1 8.053 0.001 A 4 VAL HA H 1 3.983 0.003 A 4 VAL HB H 1 1.875 0.004 A 4 VAL HGx% H 1 0.850 0.003 A 4 VAL HGy% H 1 0.694 0.005 A 4 VAL C C 13 174.469 0.01 A 4 VAL CA C 13 62.023 0.022 A 4 VAL CB C 13 33.057 0.055 A 4 VAL CGx C 13 20.739 0.034 A 4 VAL CGy C 13 21.232 0.044 A 4 VAL N N 15 121.276 0.026 A 5 GLU H H 1 8.002 0.001 A 5 GLU HA H 1 4.272 0.009 A 5 GLU HB2 H 1 1.749 0.004 A 5 GLU HB3 H 1 1.749 0.004 A 5 GLU HGy H 1 2.075 0.003 A 5 GLU HGx H 1 2.019 0.002 A 5 GLU C C 13 175.122 0.01 A 5 GLU CA C 13 54.662 0.028 A 5 GLU CB C 13 32.400 0.038 A 5 GLU CG C 13 36.233 0.032 A 5 GLU N N 15 123.138 0.013 A 6 TYR H H 1 8.575 0.003 A 6 TYR HA H 1 4.867 0.003 A 6 TYR HBx H 1 2.929 0.008 A 6 TYR HBy H 1 3.275 0.007 A 6 TYR HDx H 1 6.977 0.001 A 6 TYR HDy H 1 6.977 0.001 A 6 TYR HEy H 1 6.807 0.001 A 6 TYR HEx H 1 6.789 0.001 A 6 TYR C C 13 174.136 0.01 A 6 TYR CA C 13 57.380 0.035 A 6 TYR CB C 13 36.940 0.054 A 6 TYR CDx C 13 132.560 0.01 A 6 TYR CDy C 13 132.698 0.01 A 6 TYR CEx C 13 118.303 0.01 A 6 TYR CEy C 13 118.303 0.01 A 6 TYR N N 15 124.449 0.013 A 7 ARG H H 1 8.435 0.003 A 7 ARG HA H 1 5.458 0.003 A 7 ARG HBx H 1 1.618 0.007 A 7 ARG HBy H 1 1.801 0.006 A 7 ARG HD2 H 1 2.832 0.005 A 7 ARG HD3 H 1 2.832 0.005 A 7 ARG HGy H 1 1.534 0.004 A 7 ARG HGx H 1 1.489 0.007 A 7 ARG C C 13 175.466 0.01 A 7 ARG CA C 13 54.838 0.037 A 7 ARG CB C 13 34.469 0.066 A 7 ARG CD C 13 43.489 0.018 A 7 ARG CG C 13 27.605 0.065 A 7 ARG N N 15 124.695 0.013 A 8 CYS H H 1 9.646 0.004 A 8 CYS HA H 1 5.244 0.003 A 8 CYS HBx H 1 2.742 0.011 A 8 CYS HBy H 1 2.789 0.008 A 8 CYS C C 13 174.079 0.01 A 8 CYS CA C 13 57.497 0.031 A 8 CYS CB C 13 30.070 0.041 A 8 CYS N N 15 121.621 0.021 A 9 PHE H H 1 9.202 0.006 A 9 PHE HA H 1 4.678 0.006 A 9 PHE HBy H 1 3.029 0.002 A 9 PHE HBx H 1 2.959 0.003 A 9 PHE HDy H 1 6.973 0.001 A 9 PHE HDx H 1 6.967 0.001 A 9 PHE C C 13 173.448 0.01 A 9 PHE CA C 13 57.528 0.036 A 9 PHE CB C 13 40.643 0.042 A 9 PHE CDx C 13 129.122 0.01 A 9 PHE CDy C 13 129.122 0.01 A 9 PHE N N 15 125.674 0.015 A 10 VAL H H 1 8.030 0.009 A 10 VAL HA H 1 4.850 0.009 A 10 VAL HB H 1 1.442 0.003 A 10 VAL HGx% H 1 0.869 0.005 A 10 VAL HGy% H 1 0.500 0.003 A 10 VAL C C 13 173.767 0.01 A 10 VAL CA C 13 59.959 0.037 A 10 VAL CB C 13 32.977 0.044 A 10 VAL CGy C 13 23.318 0.033 A 10 VAL CGx C 13 21.241 0.028 A 10 VAL N N 15 127.666 0.02 A 11 GLY H H 1 9.055 0.005 A 11 GLY HAx H 1 3.654 0.005 A 11 GLY HAy H 1 4.721 0.01 A 11 GLY C C 13 173.753 0.01 A 11 GLY CA C 13 43.427 0.037 A 11 GLY N N 15 111.765 0.02 A 12 GLY H H 1 8.210 0.003 A 12 GLY HAy H 1 4.198 0.002 A 12 GLY HAx H 1 3.735 0.004 A 12 GLY C C 13 175.168 0.01 A 12 GLY CA C 13 46.001 0.042 A 12 GLY N N 15 107.061 0.011 A 13 LEU H H 1 7.591 0.005 A 13 LEU HA H 1 4.168 0.004 A 13 LEU HBx H 1 1.069 0.005 A 13 LEU HBy H 1 1.315 0.007 A 13 LEU HDx% H 1 0.763 0.003 A 13 LEU HDy% H 1 0.417 0.005 A 13 LEU HG H 1 1.255 0.008 A 13 LEU C C 13 178.690 0.01 A 13 LEU CA C 13 54.165 0.042 A 13 LEU CB C 13 43.538 0.045 A 13 LEU CDx C 13 24.058 0.046 A 13 LEU CDy C 13 26.545 0.043 A 13 LEU CG C 13 26.729 0.149 A 13 LEU N N 15 114.980 0.01 A 14 ALA H H 1 9.683 0.002 A 14 ALA HA H 1 4.078 0.005 A 14 ALA HB% H 1 1.491 0.003 A 14 ALA C C 13 179.477 0.01 A 14 ALA CA C 13 51.547 0.036 A 14 ALA CB C 13 19.157 0.081 A 14 ALA N N 15 124.275 0.022 A 15 TRP H H 1 8.107 0.005 A 15 TRP HA H 1 4.412 0.005 A 15 TRP HBy H 1 3.370 0.023 A 15 TRP HBx H 1 3.326 0.032 A 15 TRP HD1 H 1 7.335 0.001 A 15 TRP HE1 H 1 10.198 0.001 A 15 TRP HE3 H 1 7.543 0.001 A 15 TRP HH2 H 1 7.260 0.001 A 15 TRP HZ2 H 1 7.537 0.001 A 15 TRP HZ3 H 1 7.108 0.001 A 15 TRP C C 13 177.006 0.01 A 15 TRP CA C 13 58.875 0.067 A 15 TRP CB C 13 28.661 0.058 A 15 TRP CD1 C 13 127.360 0.01 A 15 TRP CE3 C 13 120.841 0.01 A 15 TRP CH2 C 13 124.884 0.01 A 15 TRP CZ2 C 13 114.753 0.01 A 15 TRP CZ3 C 13 122.266 0.01 A 15 TRP N N 15 122.724 0.021 A 15 TRP NE1 N 15 129.251 0.01 A 16 ALA H H 1 7.474 0.002 A 16 ALA HA H 1 4.099 0.003 A 16 ALA HB% H 1 1.178 0.004 A 16 ALA C C 13 178.136 0.01 A 16 ALA CA C 13 52.619 0.033 A 16 ALA CB C 13 19.252 0.024 A 16 ALA N N 15 115.943 0.02 A 17 THR H H 1 7.325 0.005 A 17 THR HA H 1 4.049 0.003 A 17 THR HB H 1 3.904 0.002 A 17 THR HG2% H 1 1.253 0.004 A 17 THR C C 13 174.168 0.01 A 17 THR CA C 13 65.136 0.02 A 17 THR CB C 13 68.355 0.023 A 17 THR CG2 C 13 23.531 0.03 A 17 THR N N 15 117.194 0.015 A 18 THR H H 1 7.997 0.003 A 18 THR HA H 1 4.749 0.005 A 18 THR HB H 1 4.773 0.006 A 18 THR HG2% H 1 1.345 0.004 A 18 THR C C 13 174.948 0.01 A 18 THR CA C 13 59.466 0.044 A 18 THR CB C 13 73.045 0.064 A 18 THR CG2 C 13 21.712 0.029 A 18 THR N N 15 117.853 0.018 A 19 ASP H H 1 8.819 0.005 A 19 ASP HA H 1 3.897 0.003 A 19 ASP HBx H 1 2.665 0.008 A 19 ASP HBy H 1 2.866 0.01 A 19 ASP C C 13 179.140 0.01 A 19 ASP CA C 13 57.851 0.026 A 19 ASP CB C 13 40.053 0.063 A 19 ASP N N 15 119.977 0.007 A 20 GLN H H 1 8.118 0.005 A 20 GLN HA H 1 4.121 0.005 A 20 GLN HBx H 1 1.994 0.004 A 20 GLN HBy H 1 2.173 0.007 A 20 GLN HE21 H 1 7.786 0.001 A 20 GLN HE22 H 1 6.890 0.001 A 20 GLN HG2 H 1 2.403 0.001 A 20 GLN HG3 H 1 2.403 0.001 A 20 GLN C C 13 178.642 0.01 A 20 GLN CA C 13 59.043 0.024 A 20 GLN CB C 13 28.330 0.093 A 20 GLN CD C 13 180.247 0.001 A 20 GLN CG C 13 33.696 0.018 A 20 GLN N N 15 118.555 0.019 A 20 GLN NE2 N 15 112.915 0.011 A 21 THR H H 1 8.112 0.002 A 21 THR HA H 1 4.110 0.001 A 21 THR HB H 1 4.436 0.003 A 21 THR HG2% H 1 1.339 0.003 A 21 THR C C 13 177.920 0.01 A 21 THR CA C 13 65.733 0.036 A 21 THR CB C 13 68.000 0.033 A 21 THR CG2 C 13 22.764 0.031 A 21 THR N N 15 116.067 0.018 A 22 LEU H H 1 8.484 0.002 A 22 LEU HA H 1 4.093 0.005 A 22 LEU HBx H 1 1.273 0.01 A 22 LEU HBy H 1 1.744 0.009 A 22 LEU HDx% H 1 0.678 0.005 A 22 LEU HDy% H 1 0.432 0.003 A 22 LEU HG H 1 1.194 0.006 A 22 LEU C C 13 178.096 0.01 A 22 LEU CA C 13 58.445 0.055 A 22 LEU CB C 13 42.299 0.036 A 22 LEU CDy C 13 25.613 0.047 A 22 LEU CDx C 13 24.603 0.066 A 22 LEU CG C 13 26.290 0.065 A 22 LEU N N 15 123.941 0.015 A 23 GLY H H 1 7.779 0.007 A 23 GLY HAy H 1 4.023 0.004 A 23 GLY HAx H 1 3.621 0.005 A 23 GLY C C 13 176.705 0.01 A 23 GLY CA C 13 47.692 0.035 A 23 GLY N N 15 104.724 0.017 A 24 GLU H H 1 8.334 0.005 A 24 GLU HA H 1 4.045 0.006 A 24 GLU HBx H 1 2.062 0.006 A 24 GLU HBy H 1 2.151 0.01 A 24 GLU HGy H 1 2.458 0.004 A 24 GLU HGx H 1 2.311 0.005 A 24 GLU C C 13 179.898 0.01 A 24 GLU CA C 13 59.504 0.019 A 24 GLU CB C 13 29.577 0.05 A 24 GLU CG C 13 36.577 0.014 A 24 GLU N N 15 120.962 0.016 A 25 ALA H H 1 7.939 0.008 A 25 ALA HA H 1 4.284 0.002 A 25 ALA HB% H 1 1.624 0.003 A 25 ALA C C 13 179.100 0.01 A 25 ALA CA C 13 54.743 0.044 A 25 ALA CB C 13 18.897 0.053 A 25 ALA N N 15 121.172 0.01 A 26 PHE H H 1 7.994 0.007 A 26 PHE HA H 1 4.686 0.004 A 26 PHE HBx H 1 3.106 0.003 A 26 PHE HBy H 1 3.505 0.004 A 26 PHE HDx H 1 7.798 0.01 A 26 PHE HDy H 1 7.805 0.002 A 26 PHE HEy H 1 7.067 0.001 A 26 PHE HEx H 1 7.064 0.001 A 26 PHE HZ H 1 7.465 0.001 A 26 PHE C C 13 177.238 0.01 A 26 PHE CA C 13 60.745 0.071 A 26 PHE CB C 13 40.256 0.035 A 26 PHE CDy C 13 131.811 0.01 A 26 PHE CDx C 13 131.754 0.01 A 26 PHE CEx C 13 131.125 0.01 A 26 PHE CEy C 13 131.125 0.01 A 26 PHE CZ C 13 129.621 0.01 A 26 PHE N N 15 114.485 0.01 A 27 SER H H 1 8.288 0.006 A 27 SER HA H 1 4.708 0.004 A 27 SER HBx H 1 4.130 0.006 A 27 SER HBy H 1 4.186 0.006 A 27 SER C C 13 175.620 0.01 A 27 SER CA C 13 61.480 0.033 A 27 SER CB C 13 63.092 0.069 A 27 SER N N 15 117.318 0.018 A 28 GLN H H 1 7.585 0.001 A 28 GLN HA H 1 4.092 0.004 A 28 GLN HBx H 1 1.637 0.001 A 28 GLN HBy H 1 1.678 0.002 A 28 GLN HE21 H 1 7.378 0.001 A 28 GLN HE22 H 1 6.851 0.002 A 28 GLN HGx H 1 0.972 0.005 A 28 GLN HGy H 1 1.684 0.005 A 28 GLN C C 13 176.393 0.01 A 28 GLN CA C 13 57.265 0.052 A 28 GLN CB C 13 28.274 0.054 A 28 GLN CD C 13 180.086 0.001 A 28 GLN CG C 13 32.636 0.024 A 28 GLN N N 15 118.153 0.013 A 28 GLN NE2 N 15 113.194 0.018 A 29 PHE H H 1 7.683 0.006 A 29 PHE HA H 1 4.451 0.006 A 29 PHE HBx H 1 2.925 0.007 A 29 PHE HBy H 1 3.406 0.005 A 29 PHE HDx H 1 7.501 0.001 A 29 PHE HDy H 1 7.501 0.001 A 29 PHE C C 13 174.773 0.01 A 29 PHE CA C 13 59.526 0.057 A 29 PHE CB C 13 39.575 0.058 A 29 PHE CDy C 13 131.737 0.01 A 29 PHE CDx C 13 131.735 0.01 A 29 PHE N N 15 116.522 0.017 A 30 GLY H H 1 7.458 0.005 A 30 GLY HAy H 1 4.435 0.004 A 30 GLY HAx H 1 3.959 0.007 A 30 GLY C C 13 170.618 0.01 A 30 GLY CA C 13 44.592 0.032 A 30 GLY N N 15 105.157 0.009 A 31 GLU H H 1 8.186 0.005 A 31 GLU HA H 1 4.227 0.007 A 31 GLU HBx H 1 1.919 0.007 A 31 GLU HBy H 1 2.053 0.001 A 31 GLU HGx H 1 2.376 0.007 A 31 GLU HGy H 1 2.377 0.007 A 31 GLU C C 13 176.583 0.01 A 31 GLU CA C 13 57.535 0.052 A 31 GLU CB C 13 30.373 0.079 A 31 GLU CG C 13 36.281 0.058 A 31 GLU N N 15 117.248 0.005 A 32 ILE H H 1 8.641 0.002 A 32 ILE HA H 1 4.239 0.005 A 32 ILE HB H 1 1.766 0.004 A 32 ILE HD1% H 1 0.568 0.005 A 32 ILE HG1y H 1 1.541 0.006 A 32 ILE HG1x H 1 0.912 0.007 A 32 ILE HG2% H 1 0.552 0.002 A 32 ILE C C 13 176.897 0.01 A 32 ILE CA C 13 59.581 0.068 A 32 ILE CB C 13 39.093 0.057 A 32 ILE CD1 C 13 13.448 0.045 A 32 ILE CG1 C 13 27.008 0.076 A 32 ILE CG2 C 13 17.847 0.07 A 32 ILE N N 15 125.997 0.025 A 33 LEU H H 1 8.916 0.005 A 33 LEU HA H 1 4.366 0.003 A 33 LEU HBx H 1 1.336 0.007 A 33 LEU HBy H 1 1.512 0.005 A 33 LEU HDx% H 1 0.919 0.005 A 33 LEU HDy% H 1 0.864 0.004 A 33 LEU HG H 1 1.410 0.003 A 33 LEU C C 13 176.848 0.01 A 33 LEU CA C 13 55.556 0.069 A 33 LEU CB C 13 42.702 0.061 A 33 LEU CDx C 13 22.908 0.068 A 33 LEU CDy C 13 25.585 0.093 A 33 LEU CG C 13 27.255 0.079 A 33 LEU N N 15 126.303 0.019 A 34 ASP H H 1 7.385 0.006 A 34 ASP HA H 1 4.712 0.004 A 34 ASP HBx H 1 2.393 0.004 A 34 ASP HBy H 1 2.659 0.006 A 34 ASP C C 13 173.520 0.01 A 34 ASP CA C 13 53.945 0.059 A 34 ASP CB C 13 44.038 0.037 A 34 ASP N N 15 115.725 0.008 A 35 SER H H 1 8.066 0.004 A 35 SER HA H 1 4.885 0.001 A 35 SER HBx H 1 3.529 0.001 A 35 SER HBy H 1 3.605 0.002 A 35 SER C C 13 172.724 0.01 A 35 SER CA C 13 57.233 0.019 A 35 SER CB C 13 64.548 0.011 A 35 SER N N 15 117.009 0.012 A 36 LYS H H 1 8.402 0.006 A 36 LYS HA H 1 4.701 0.007 A 36 LYS HBx H 1 1.577 0.016 A 36 LYS HBy H 1 1.641 0.014 A 36 LYS HDy H 1 1.752 0.006 A 36 LYS HDx H 1 1.706 0.005 A 36 LYS HE2 H 1 3.016 0.004 A 36 LYS HE3 H 1 3.016 0.004 A 36 LYS HGx H 1 1.310 0.002 A 36 LYS HGy H 1 1.340 0.006 A 36 LYS C C 13 174.221 0.01 A 36 LYS CA C 13 54.415 0.054 A 36 LYS CB C 13 36.641 0.054 A 36 LYS CD C 13 28.853 0.04 A 36 LYS CE C 13 41.986 0.044 A 36 LYS CG C 13 23.892 0.052 A 36 LYS N N 15 123.535 0.008 A 37 ILE H H 1 8.514 0.005 A 37 ILE HA H 1 4.078 0.008 A 37 ILE HB H 1 1.785 0.004 A 37 ILE HD1% H 1 0.476 0.003 A 37 ILE HG1x H 1 1.033 0.003 A 37 ILE HG1y H 1 1.317 0.005 A 37 ILE HG2% H 1 0.723 0.005 A 37 ILE C C 13 176.047 0.01 A 37 ILE CA C 13 59.365 0.038 A 37 ILE CB C 13 38.071 0.054 A 37 ILE CD1 C 13 12.571 0.022 A 37 ILE CG1 C 13 27.523 0.043 A 37 ILE CG2 C 13 17.456 0.044 A 37 ILE N N 15 123.485 0.029 A 38 ILE H H 1 8.332 0.005 A 38 ILE HA H 1 4.043 0.003 A 38 ILE HB H 1 1.087 0.004 A 38 ILE HD1% H 1 0.826 0.008 A 38 ILE HG1y H 1 1.480 0.003 A 38 ILE HG1x H 1 1.357 0.005 A 38 ILE HG2% H 1 0.805 0.004 A 38 ILE C C 13 173.993 0.01 A 38 ILE CA C 13 58.826 0.059 A 38 ILE CB C 13 34.370 0.049 A 38 ILE CD1 C 13 9.164 0.049 A 38 ILE CG1 C 13 27.332 0.034 A 38 ILE CG2 C 13 17.814 0.059 A 38 ILE N N 15 127.310 0.02 A 39 ASN H H 1 8.292 0.003 A 39 ASN HA H 1 5.126 0.004 A 39 ASN HBx H 1 2.193 0.005 A 39 ASN HBy H 1 2.413 0.007 A 39 ASN HD21 H 1 6.477 0.003 A 39 ASN HD22 H 1 7.060 0.001 A 39 ASN C C 13 175.622 0.01 A 39 ASN CA C 13 51.458 0.031 A 39 ASN CB C 13 40.995 0.033 A 39 ASN CG C 13 174.704 0.003 A 39 ASN N N 15 124.118 0.011 A 39 ASN ND2 N 15 110.346 0.031 A 40 ASP H H 1 8.906 0.004 A 40 ASP HA H 1 4.513 0.005 A 40 ASP HBx H 1 2.523 0.003 A 40 ASP HBy H 1 3.012 0.005 A 40 ASP C C 13 177.461 0.01 A 40 ASP CA C 13 54.139 0.048 A 40 ASP CB C 13 42.875 0.023 A 40 ASP N N 15 122.643 0.028 A 41 ARG H H 1 9.006 0.001 A 41 ARG HA H 1 4.048 0.005 A 41 ARG HB2 H 1 1.923 0.002 A 41 ARG HB3 H 1 1.923 0.002 A 41 ARG HD2 H 1 3.252 0.004 A 41 ARG HD3 H 1 3.252 0.004 A 41 ARG HG2 H 1 1.716 0.006 A 41 ARG HG3 H 1 1.716 0.006 A 41 ARG C C 13 177.426 0.01 A 41 ARG CA C 13 58.669 0.054 A 41 ARG CB C 13 30.217 0.055 A 41 ARG CD C 13 43.270 0.028 A 41 ARG CG C 13 27.189 0.049 A 41 ARG N N 15 127.644 0.02 A 42 GLU H H 1 8.599 0.004 A 42 GLU HA H 1 4.275 0.003 A 42 GLU HBy H 1 2.155 0.002 A 42 GLU HBx H 1 2.123 0.001 A 42 GLU HGy H 1 2.318 0.006 A 42 GLU HGx H 1 2.242 0.005 A 42 GLU C C 13 178.375 0.01 A 42 GLU CA C 13 58.507 0.046 A 42 GLU CB C 13 30.230 0.034 A 42 GLU CG C 13 36.650 0.063 A 42 GLU N N 15 117.753 0.003 A 43 THR H H 1 8.140 0.004 A 43 THR HA H 1 4.396 0.008 A 43 THR HB H 1 4.304 0.004 A 43 THR HG2% H 1 1.213 0.004 A 43 THR C C 13 176.672 0.01 A 43 THR CA C 13 61.862 0.056 A 43 THR CB C 13 71.054 0.034 A 43 THR CG2 C 13 21.180 0.05 A 43 THR N N 15 107.088 0.008 A 44 GLY H H 1 8.253 0.005 A 44 GLY HAy H 1 4.151 0.001 A 44 GLY HAx H 1 3.777 0.001 A 44 GLY C C 13 173.625 0.01 A 44 GLY CA C 13 45.760 0.039 A 44 GLY N N 15 111.038 0.008 A 45 ARG H H 1 7.720 0.005 A 45 ARG HA H 1 4.310 0.005 A 45 ARG HBx H 1 1.619 0.005 A 45 ARG HBy H 1 1.780 0.006 A 45 ARG HD2 H 1 2.990 0.004 A 45 ARG HD3 H 1 2.990 0.004 A 45 ARG HG2 H 1 1.575 0.002 A 45 ARG HG3 H 1 1.575 0.002 A 45 ARG C C 13 175.931 0.01 A 45 ARG CA C 13 55.502 0.055 A 45 ARG CB C 13 31.836 0.071 A 45 ARG CD C 13 43.267 0.042 A 45 ARG CG C 13 27.312 0.064 A 45 ARG N N 15 119.437 0.014 A 46 SER H H 1 8.528 0.003 A 46 SER HA H 1 4.572 0.004 A 46 SER HBx H 1 3.868 0.005 A 46 SER HBy H 1 4.159 0.005 A 46 SER C C 13 177.040 0.01 A 46 SER CA C 13 58.399 0.08 A 46 SER CB C 13 64.626 0.034 A 46 SER N N 15 116.716 0.018 A 47 ARG H H 1 9.233 0.003 A 47 ARG HA H 1 4.465 0.009 A 47 ARG HBx H 1 1.253 0.012 A 47 ARG HBy H 1 2.237 0.01 A 47 ARG HDx H 1 3.064 0.011 A 47 ARG HDy H 1 3.248 0.008 A 47 ARG HG2 H 1 1.665 0.006 A 47 ARG HG3 H 1 1.665 0.006 A 47 ARG C C 13 177.659 0.01 A 47 ARG CA C 13 56.458 0.037 A 47 ARG CB C 13 30.727 0.092 A 47 ARG CD C 13 43.625 0.045 A 47 ARG CG C 13 27.881 0.053 A 47 ARG N N 15 124.042 0.031 A 48 GLY H H 1 9.363 0.003 A 48 GLY HAx H 1 3.379 0.003 A 48 GLY HAy H 1 4.174 0.004 A 48 GLY C C 13 172.006 0.01 A 48 GLY CA C 13 45.864 0.03 A 48 GLY N N 15 107.937 0.019 A 49 PHE H H 1 7.175 0.007 A 49 PHE HA H 1 5.294 0.004 A 49 PHE HBx H 1 2.949 0.004 A 49 PHE HBy H 1 3.205 0.005 A 49 PHE HDx H 1 6.893 0.001 A 49 PHE HDy H 1 6.893 0.001 A 49 PHE HEx H 1 7.381 0.001 A 49 PHE HEy H 1 7.382 0.001 A 49 PHE C C 13 172.407 0.01 A 49 PHE CA C 13 54.864 0.042 A 49 PHE CB C 13 41.711 0.043 A 49 PHE CDx C 13 132.874 0.01 A 49 PHE CDy C 13 132.874 0.01 A 49 PHE CEx C 13 131.752 0.01 A 49 PHE CEy C 13 131.752 0.01 A 49 PHE N N 15 113.110 0.024 A 50 GLY H H 1 8.858 0.006 A 50 GLY HAy H 1 4.167 0.002 A 50 GLY HAx H 1 3.875 0.002 A 50 GLY C C 13 169.877 0.01 A 50 GLY CA C 13 45.533 0.032 A 50 GLY N N 15 106.174 0.018 A 51 PHE H H 1 8.684 0.006 A 51 PHE HA H 1 5.759 0.004 A 51 PHE HBx H 1 2.634 0.003 A 51 PHE HBy H 1 2.819 0.005 A 51 PHE HDx H 1 7.060 0.001 A 51 PHE HDy H 1 7.060 0.001 A 51 PHE C C 13 175.340 0.01 A 51 PHE CA C 13 56.124 0.037 A 51 PHE CB C 13 44.454 0.031 A 51 PHE CDx C 13 131.791 0.01 A 51 PHE CDy C 13 131.800 0.01 A 51 PHE N N 15 113.588 0.017 A 52 VAL H H 1 8.445 0.005 A 52 VAL HA H 1 4.375 0.005 A 52 VAL HB H 1 1.242 0.003 A 52 VAL HGx% H 1 0.238 0.003 A 52 VAL HGy% H 1 0.085 0.003 A 52 VAL C C 13 174.177 0.01 A 52 VAL CA C 13 61.178 0.067 A 52 VAL CB C 13 34.880 0.048 A 52 VAL CGy C 13 22.098 0.037 A 52 VAL CGx C 13 20.449 0.033 A 52 VAL N N 15 121.034 0.015 A 53 THR H H 1 8.836 0.004 A 53 THR HA H 1 4.996 0.003 A 53 THR HB H 1 3.877 0.004 A 53 THR HG2% H 1 1.210 0.005 A 53 THR C C 13 173.641 0.01 A 53 THR CA C 13 61.663 0.035 A 53 THR CB C 13 69.398 0.059 A 53 THR CG2 C 13 22.935 0.063 A 53 THR N N 15 122.871 0.018 A 54 PHE H H 1 9.328 0.005 A 54 PHE HA H 1 5.033 0.003 A 54 PHE HBx H 1 2.890 0.002 A 54 PHE HBy H 1 3.675 0.005 A 54 PHE HDx H 1 7.149 0.001 A 54 PHE HDy H 1 7.151 0.001 A 54 PHE HEx H 1 7.295 0.001 A 54 PHE HEy H 1 7.307 0.001 A 54 PHE C C 13 173.872 0.01 A 54 PHE CA C 13 57.876 0.057 A 54 PHE CB C 13 42.660 0.042 A 54 PHE CDy C 13 131.882 0.01 A 54 PHE CDx C 13 131.850 0.01 A 54 PHE CEx C 13 131.651 0.01 A 54 PHE CEy C 13 131.653 0.01 A 54 PHE N N 15 126.352 0.011 A 55 LYS H H 1 8.481 0.005 A 55 LYS HA H 1 4.390 0.005 A 55 LYS HBx H 1 1.717 0.006 A 55 LYS HBy H 1 2.076 0.005 A 55 LYS HDy H 1 1.755 0.006 A 55 LYS HDx H 1 1.720 0.005 A 55 LYS HEy H 1 3.050 0.006 A 55 LYS HEx H 1 3.003 0.002 A 55 LYS HGx H 1 1.536 0.004 A 55 LYS HGy H 1 1.604 0.004 A 55 LYS C C 13 175.902 0.01 A 55 LYS CA C 13 58.245 0.04 A 55 LYS CB C 13 34.094 0.062 A 55 LYS CD C 13 29.508 0.053 A 55 LYS CE C 13 42.145 0.048 A 55 LYS CG C 13 25.361 0.053 A 55 LYS N N 15 119.454 0.03 A 56 ASP H H 1 8.222 0.002 A 56 ASP HA H 1 4.785 0.006 A 56 ASP HB2 H 1 2.657 0.003 A 56 ASP HB3 H 1 2.657 0.002 A 56 ASP C C 13 174.229 0.01 A 56 ASP CA C 13 52.536 0.069 A 56 ASP CB C 13 44.442 0.036 A 56 ASP N N 15 115.733 0.01 A 57 GLU H H 1 7.878 0.004 A 57 GLU HA H 1 2.905 0.004 A 57 GLU HBx H 1 1.283 0.004 A 57 GLU HBy H 1 1.563 0.004 A 57 GLU HG2 H 1 2.036 0.005 A 57 GLU HG3 H 1 2.036 0.005 A 57 GLU C C 13 177.646 0.01 A 57 GLU CA C 13 59.184 0.03 A 57 GLU CB C 13 29.622 0.034 A 57 GLU CG C 13 36.134 0.056 A 57 GLU N N 15 123.552 0.012 A 58 LYS H H 1 8.155 0.003 A 58 LYS HA H 1 3.765 0.006 A 58 LYS HBx H 1 1.768 0.004 A 58 LYS HBy H 1 1.776 0.013 A 58 LYS HD2 H 1 1.589 0.013 A 58 LYS HD3 H 1 1.589 0.013 A 58 LYS HE2 H 1 3.037 0.005 A 58 LYS HE3 H 1 3.037 0.005 A 58 LYS HG2 H 1 1.391 0.004 A 58 LYS HG3 H 1 1.391 0.004 A 58 LYS C C 13 177.470 0.01 A 58 LYS CA C 13 59.209 0.038 A 58 LYS CB C 13 32.029 0.027 A 58 LYS CD C 13 28.784 0.043 A 58 LYS CE C 13 42.370 0.02 A 58 LYS CG C 13 24.711 0.04 A 58 LYS N N 15 118.681 0.028 A 59 ALA H H 1 7.152 0.008 A 59 ALA HA H 1 3.840 0.006 A 59 ALA HB% H 1 1.325 0.004 A 59 ALA C C 13 177.859 0.01 A 59 ALA CA C 13 55.137 0.044 A 59 ALA CB C 13 20.282 0.023 A 59 ALA N N 15 120.064 0.008 A 60 MET H H 1 6.549 0.006 A 60 MET HA H 1 3.032 0.003 A 60 MET HBx H 1 1.808 0.014 A 60 MET HBy H 1 2.317 0.008 A 60 MET HE% H 1 2.136 0.001 A 60 MET HGy H 1 2.558 0.005 A 60 MET HGx H 1 2.175 0.006 A 60 MET C C 13 177.462 0.01 A 60 MET CA C 13 58.806 0.022 A 60 MET CB C 13 32.144 0.046 A 60 MET CE C 13 16.893 0.01 A 60 MET CG C 13 31.470 0.058 A 60 MET N N 15 114.818 0.011 A 61 ARG H H 1 8.267 0.004 A 61 ARG HA H 1 3.813 0.004 A 61 ARG HBx H 1 1.823 0.002 A 61 ARG HBy H 1 1.955 0.004 A 61 ARG HD2 H 1 3.119 0.005 A 61 ARG HD3 H 1 3.119 0.005 A 61 ARG HGx H 1 1.621 0.004 A 61 ARG HGy H 1 1.832 0.004 A 61 ARG C C 13 179.615 0.01 A 61 ARG CA C 13 59.438 0.052 A 61 ARG CB C 13 28.615 0.057 A 61 ARG CD C 13 42.866 0.086 A 61 ARG CG C 13 27.738 0.063 A 61 ARG N N 15 117.736 0.033 A 62 ASP H H 1 8.831 0.004 A 62 ASP HA H 1 4.234 0.004 A 62 ASP HBx H 1 2.685 0.006 A 62 ASP HBy H 1 2.845 0.008 A 62 ASP C C 13 178.720 0.01 A 62 ASP CA C 13 56.867 0.037 A 62 ASP CB C 13 39.580 0.043 A 62 ASP N N 15 121.418 0.022 A 63 ALA H H 1 8.060 0.005 A 63 ALA HA H 1 2.078 0.004 A 63 ALA HB% H 1 1.307 0.008 A 63 ALA C C 13 179.159 0.01 A 63 ALA CA C 13 54.204 0.035 A 63 ALA CB C 13 20.166 0.031 A 63 ALA N N 15 125.406 0.024 A 64 ILE H H 1 7.954 0.004 A 64 ILE HA H 1 3.377 0.005 A 64 ILE HB H 1 1.785 0.004 A 64 ILE HD1% H 1 0.932 0.007 A 64 ILE HG1x H 1 0.628 0.008 A 64 ILE HG1y H 1 1.985 0.008 A 64 ILE HG2% H 1 0.981 0.003 A 64 ILE C C 13 178.032 0.01 A 64 ILE CA C 13 66.014 0.04 A 64 ILE CB C 13 38.820 0.056 A 64 ILE CD1 C 13 15.160 0.07 A 64 ILE CG1 C 13 30.650 0.058 A 64 ILE CG2 C 13 17.231 0.05 A 64 ILE N N 15 118.842 0.016 A 65 GLU H H 1 7.535 0.006 A 65 GLU HA H 1 4.021 0.004 A 65 GLU HB2 H 1 2.001 0.002 A 65 GLU HB3 H 1 2.001 0.002 A 65 GLU HGx H 1 2.291 0.004 A 65 GLU HGy H 1 2.342 0.004 A 65 GLU C C 13 179.342 0.01 A 65 GLU CA C 13 58.645 0.046 A 65 GLU CB C 13 29.888 0.058 A 65 GLU CG C 13 36.078 0.055 A 65 GLU N N 15 116.426 0.008 A 66 GLY H H 1 8.281 0.006 A 66 GLY HAy H 1 4.060 0.006 A 66 GLY HAx H 1 3.472 0.004 A 66 GLY C C 13 174.943 0.01 A 66 GLY CA C 13 46.055 0.031 A 66 GLY N N 15 104.513 0.016 A 67 MET H H 1 8.028 0.005 A 67 MET HA H 1 4.915 0.003 A 67 MET HBx H 1 1.818 0.003 A 67 MET HBy H 1 1.962 0.006 A 67 MET HE% H 1 2.105 0.001 A 67 MET HGx H 1 1.627 0.002 A 67 MET HGy H 1 2.069 0.002 A 67 MET C C 13 177.312 0.01 A 67 MET CA C 13 53.414 0.043 A 67 MET CB C 13 33.565 0.051 A 67 MET CE C 13 16.940 0.01 A 67 MET CG C 13 32.966 0.075 A 67 MET N N 15 114.841 0.011 A 68 ASN H H 1 7.589 0.005 A 68 ASN HA H 1 4.406 0.005 A 68 ASN HBx H 1 2.990 0.007 A 68 ASN HBy H 1 3.312 0.004 A 68 ASN HD21 H 1 7.091 0.002 A 68 ASN HD22 H 1 7.866 0.002 A 68 ASN C C 13 176.819 0.01 A 68 ASN CA C 13 57.176 0.04 A 68 ASN CB C 13 38.915 0.057 A 68 ASN CG C 13 177.078 0.006 A 68 ASN N N 15 116.830 0.012 A 68 ASN ND2 N 15 115.460 0.016 A 69 GLY H H 1 9.147 0.004 A 69 GLY HAx H 1 3.875 0.003 A 69 GLY HAy H 1 4.192 0.003 A 69 GLY C C 13 174.410 0.01 A 69 GLY CA C 13 46.053 0.034 A 69 GLY N N 15 117.454 0.012 A 70 GLN H H 1 7.789 0.005 A 70 GLN HA H 1 4.370 0.005 A 70 GLN HBx H 1 2.003 0.008 A 70 GLN HBy H 1 2.219 0.007 A 70 GLN HE21 H 1 6.864 0.002 A 70 GLN HE22 H 1 7.497 0.001 A 70 GLN HGx H 1 2.107 0.006 A 70 GLN HGy H 1 2.773 0.005 A 70 GLN C C 13 174.211 0.01 A 70 GLN CA C 13 54.226 0.064 A 70 GLN CB C 13 29.387 0.035 A 70 GLN CD C 13 180.515 0.01 A 70 GLN CG C 13 33.700 0.028 A 70 GLN N N 15 119.319 0.015 A 70 GLN NE2 N 15 113.904 0.029 A 71 ASP H H 1 8.179 0.003 A 71 ASP HA H 1 4.907 0.008 A 71 ASP HBx H 1 2.418 0.004 A 71 ASP HBy H 1 2.517 0.006 A 71 ASP C C 13 176.476 0.01 A 71 ASP CA C 13 53.991 0.029 A 71 ASP CB C 13 42.524 0.053 A 71 ASP N N 15 118.980 0.018 A 72 LEU H H 1 9.089 0.004 A 72 LEU HA H 1 4.491 0.006 A 72 LEU HBx H 1 1.153 0.007 A 72 LEU HBy H 1 1.915 0.006 A 72 LEU HDx% H 1 0.822 0.004 A 72 LEU HDy% H 1 0.889 0.007 A 72 LEU HG H 1 1.399 0.006 A 72 LEU C C 13 176.402 0.01 A 72 LEU CA C 13 55.189 0.037 A 72 LEU CB C 13 44.333 0.068 A 72 LEU CDx C 13 24.177 0.059 A 72 LEU CDy C 13 26.347 0.068 A 72 LEU CG C 13 27.719 0.074 A 72 LEU N N 15 127.095 0.011 A 73 ASP H H 1 9.453 0.002 A 73 ASP HA H 1 4.226 0.005 A 73 ASP HBx H 1 2.474 0.004 A 73 ASP HBy H 1 2.822 0.002 A 73 ASP C C 13 174.949 0.01 A 73 ASP CA C 13 55.712 0.051 A 73 ASP CB C 13 39.954 0.028 A 73 ASP N N 15 126.275 0.013 A 74 GLY H H 1 8.494 0.006 A 74 GLY HAx H 1 3.797 0.001 A 74 GLY HAy H 1 4.130 0.001 A 74 GLY C C 13 174.654 0.01 A 74 GLY CA C 13 45.777 0.03 A 74 GLY N N 15 103.491 0.012 A 75 ARG H H 1 7.413 0.006 A 75 ARG HA H 1 4.594 0.007 A 75 ARG HBx H 1 1.672 0.009 A 75 ARG HBy H 1 1.960 0.006 A 75 ARG HD2 H 1 3.177 0.014 A 75 ARG HD3 H 1 3.177 0.014 A 75 ARG HGx H 1 1.540 0.009 A 75 ARG HGy H 1 1.603 0.007 A 75 ARG C C 13 174.877 0.01 A 75 ARG CA C 13 53.039 0.059 A 75 ARG CB C 13 33.183 0.049 A 75 ARG CD C 13 42.520 0.055 A 75 ARG CG C 13 26.655 0.07 A 75 ARG N N 15 119.227 0.007 A 76 ASN H H 1 8.481 0.002 A 76 ASN HA H 1 5.009 0.005 A 76 ASN HBx H 1 2.416 0.005 A 76 ASN HBy H 1 2.592 0.004 A 76 ASN HD21 H 1 6.793 0.001 A 76 ASN HD22 H 1 7.436 0.001 A 76 ASN C C 13 175.759 0.01 A 76 ASN CA C 13 53.308 0.054 A 76 ASN CB C 13 38.768 0.029 A 76 ASN CG C 13 177.323 0.001 A 76 ASN N N 15 119.625 0.055 A 76 ASN ND2 N 15 111.378 0.007 A 77 ILE H H 1 8.361 0.005 A 77 ILE HA H 1 4.714 0.003 A 77 ILE HB H 1 2.106 0.008 A 77 ILE HD1% H 1 0.804 0.005 A 77 ILE HG1y H 1 1.541 0.006 A 77 ILE HG1x H 1 1.479 0.005 A 77 ILE HG2% H 1 0.935 0.003 A 77 ILE C C 13 175.785 0.01 A 77 ILE CA C 13 61.596 0.066 A 77 ILE CB C 13 40.078 0.1 A 77 ILE CD1 C 13 14.870 0.046 A 77 ILE CG1 C 13 24.345 0.051 A 77 ILE CG2 C 13 19.305 0.066 A 77 ILE N N 15 121.591 0.018 A 78 THR H H 1 8.619 0.004 A 78 THR HA H 1 4.926 0.003 A 78 THR HB H 1 3.959 0.003 A 78 THR HG2% H 1 1.280 0.004 A 78 THR C C 13 173.554 0.01 A 78 THR CA C 13 60.724 0.051 A 78 THR CB C 13 71.262 0.033 A 78 THR CG2 C 13 21.243 0.025 A 78 THR N N 15 116.952 0.023 A 79 VAL H H 1 8.805 0.005 A 79 VAL HA H 1 5.393 0.002 A 79 VAL HB H 1 1.957 0.004 A 79 VAL HGx% H 1 1.095 0.001 A 79 VAL HGy% H 1 1.103 0.004 A 79 VAL C C 13 174.275 0.01 A 79 VAL CA C 13 60.544 0.04 A 79 VAL CB C 13 35.160 0.038 A 79 VAL CGy C 13 23.342 0.003 A 79 VAL CGx C 13 22.868 0.007 A 79 VAL N N 15 123.770 0.021 A 80 ASN H H 1 8.920 0.007 A 80 ASN HA H 1 4.960 0.004 A 80 ASN HBx H 1 2.844 0.003 A 80 ASN HBy H 1 2.978 0.002 A 80 ASN HD21 H 1 7.348 0.001 A 80 ASN HD22 H 1 6.699 0.001 A 80 ASN C C 13 173.738 0.01 A 80 ASN CA C 13 52.185 0.035 A 80 ASN CB C 13 42.350 0.044 A 80 ASN CG C 13 175.681 0.001 A 80 ASN N N 15 120.949 0.021 A 80 ASN ND2 N 15 111.943 0.005 A 81 GLU H H 1 9.233 0.005 A 81 GLU HA H 1 4.391 0.005 A 81 GLU HBy H 1 2.105 0.014 A 81 GLU HBx H 1 2.051 0.003 A 81 GLU HGy H 1 2.624 0.007 A 81 GLU HGx H 1 2.478 0.009 A 81 GLU C C 13 176.172 0.01 A 81 GLU CA C 13 57.989 0.043 A 81 GLU CB C 13 30.104 0.083 A 81 GLU CG C 13 36.199 0.039 A 81 GLU N N 15 122.731 0.014 A 82 ALA H H 1 8.797 0.003 A 82 ALA HA H 1 4.506 0.003 A 82 ALA HB% H 1 1.483 0.003 A 82 ALA C C 13 177.140 0.01 A 82 ALA CA C 13 52.517 0.036 A 82 ALA CB C 13 19.650 0.065 A 82 ALA N N 15 128.802 0.025 A 83 GLN H H 1 8.735 0.002 A 83 GLN HA H 1 4.373 0.009 A 83 GLN HBx H 1 1.984 0.006 A 83 GLN HBy H 1 2.120 0.006 A 83 GLN HE21 H 1 7.377 0.001 A 83 GLN HE22 H 1 6.852 0.001 A 83 GLN HG2 H 1 2.384 0.011 A 83 GLN HG3 H 1 2.384 0.011 A 83 GLN C C 13 176.054 0.01 A 83 GLN CA C 13 55.851 0.046 A 83 GLN CB C 13 29.749 0.059 A 83 GLN CD C 13 180.562 0.001 A 83 GLN CG C 13 33.891 0.019 A 83 GLN N N 15 120.743 0.01 A 83 GLN NE2 N 15 112.684 0.01 A 84 SER H H 1 8.478 0.003 A 84 SER HA H 1 4.407 0.009 A 84 SER HB2 H 1 3.868 0.007 A 84 SER HB3 H 1 3.868 0.007 A 84 SER C C 13 173.601 0.01 A 84 SER CA C 13 58.531 0.029 A 84 SER CB C 13 63.886 0.015 A 84 SER N N 15 118.219 0.014 A 85 ARG H H 1 8.069 0.001 A 85 ARG HA H 1 4.128 0.005 A 85 ARG HBy H 1 1.790 0.005 A 85 ARG HBx H 1 1.673 0.004 A 85 ARG HDx H 1 3.090 0.005 A 85 ARG HDy H 1 3.201 0.002 A 85 ARG HGx H 1 1.529 0.002 A 85 ARG HGy H 1 1.606 0.002 A 85 ARG CA C 13 57.563 0.033 A 85 ARG CB C 13 31.470 0.024 A 85 ARG CD C 13 43.485 0.027 A 85 ARG CG C 13 27.172 0.006 A 85 ARG N N 15 127.856 0.005 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 2 ALA H A 2 ALA HB% 1.0 0.0 3.88 2 2 A 2 ALA HA A 3 GLU H 1.0 0.0 3.27 3 3 A 2 ALA HB% A 3 GLU H 1.0 0.0 4.24 4 4 A 2 ALA HB% A 4 VAL H 1.0 0.0 4.74 5 5 A 3 GLU H A 3 GLU HGy 1.0 0.0 3.99 6 5 A 3 GLU H A 3 GLU HGx 1.0 0.0 3.99 7 6 A 3 GLU H A 4 VAL H 1.0 0.0 4.20 8 7 A 4 VAL H A 3 GLU HA 1.0 0.0 3.04 9 8 A 4 VAL H A 3 GLU HBx 1.0 0.0 4.45 10 8 A 4 VAL H A 3 GLU HBy 1.0 0.0 4.45 11 9 A 4 VAL H A 4 VAL HB 1.0 0.0 3.65 12 10 A 4 VAL H A 4 VAL HGx% 1.0 0.0 4.16 13 11 A 4 VAL H A 4 VAL HGy% 1.0 0.0 4.16 14 12 A 4 VAL HA A 4 VAL HGx% 1.0 0.0 3.63 15 13 A 4 VAL HA A 4 VAL HGy% 1.0 0.0 3.63 16 14 A 4 VAL HA A 5 GLU H 1.0 0.0 2.68 17 15 A 4 VAL HA A 5 GLU HB2 1.0 0.0 4.73 18 15 A 4 VAL HA A 5 GLU HB3 1.0 0.0 4.73 19 16 A 4 VAL HB A 5 GLU H 1.0 0.0 4.18 20 17 A 5 GLU H A 4 VAL HGx% 1.0 0.0 4.04 21 18 A 5 GLU HA A 4 VAL HGx% 1.0 0.0 5.50 22 19 A 5 GLU H A 4 VAL HGy% 1.0 0.0 4.04 23 20 A 5 GLU HA A 4 VAL HGy% 1.0 0.0 5.50 24 21 A 5 GLU H A 5 GLU HB2 1.0 0.0 3.22 25 21 A 5 GLU H A 5 GLU HB3 1.0 0.0 3.22 26 22 A 5 GLU H A 5 GLU HGy 1.0 0.0 4.42 27 23 A 5 GLU H A 5 GLU HGx 1.0 0.0 4.42 28 24 A 5 GLU H A 5 GLU HGx 1.0 0.0 3.68 29 24 A 5 GLU H A 5 GLU HGy 1.0 0.0 3.68 30 25 A 5 GLU H A 6 TYR H 1.0 0.0 4.82 31 26 A 5 GLU HA A 5 GLU HGx 1.0 0.0 3.54 32 26 A 5 GLU HA A 5 GLU HGy 1.0 0.0 3.54 33 27 A 5 GLU HA A 6 TYR H 1.0 0.0 2.93 34 28 A 5 GLU HA A 6 TYR HD% 1.0 0.0 5.27 35 29 A 5 GLU HA A 53 THR HG2% 1.0 0.0 4.62 36 30 A 6 TYR H A 5 GLU HB2 1.0 0.0 3.58 37 30 A 5 GLU HB3 A 6 TYR H 1.0 0.0 3.58 38 31 A 53 THR HB A 5 GLU HB2 1.0 0.0 5.50 39 31 A 5 GLU HB3 A 53 THR HB 1.0 0.0 5.50 40 32 A 53 THR HG2% A 5 GLU HB2 1.0 0.0 3.59 41 32 A 5 GLU HB3 A 53 THR HG2% 1.0 0.0 3.59 42 33 A 5 GLU HGy A 53 THR HG2% 1.0 0.0 4.66 43 34 A 53 THR HG2% A 5 GLU HGx 1.0 0.0 4.66 44 35 A 6 TYR H A 5 GLU HGx 1.0 0.0 4.62 45 35 A 5 GLU HGy A 6 TYR H 1.0 0.0 4.62 46 36 A 6 TYR H A 6 TYR HBx 1.0 0.0 4.10 47 37 A 6 TYR H A 6 TYR HBy 1.0 0.0 4.10 48 38 A 6 TYR H A 6 TYR HBy 1.0 0.0 3.49 49 38 A 6 TYR H A 6 TYR HBx 1.0 0.0 3.49 50 39 A 6 TYR H A 6 TYR HD% 1.0 0.0 4.11 51 40 A 6 TYR H A 7 ARG H 1.0 0.0 4.71 52 41 A 6 TYR H A 53 THR HG2% 1.0 0.0 3.95 53 42 A 6 TYR H A 54 PHE H 1.0 0.0 4.67 54 43 A 6 TYR HD% A 6 TYR HA 1.0 0.0 3.62 55 44 A 7 ARG H A 6 TYR HA 1.0 0.0 3.04 56 45 A 57 GLU HA A 6 TYR HBy 1.0 0.0 3.96 57 45 A 6 TYR HBx A 57 GLU HA 1.0 0.0 3.96 58 46 A 6 TYR HBy A 60 MET HBy 1.0 0.0 3.88 59 46 A 6 TYR HBx A 60 MET HBy 1.0 0.0 3.88 60 46 A 60 MET HBx A 6 TYR HBy 1.0 0.0 3.88 61 46 A 6 TYR HBx A 60 MET HBx 1.0 0.0 3.88 62 47 A 60 MET HE% A 6 TYR HBy 1.0 0.0 4.27 63 47 A 6 TYR HBx A 60 MET HE% 1.0 0.0 4.27 64 48 A 6 TYR HD% A 7 ARG H 1.0 0.0 4.56 65 49 A 6 TYR HD% A 57 GLU H 1.0 0.0 4.57 66 50 A 6 TYR HD% A 57 GLU HA 1.0 0.0 4.32 67 51 A 6 TYR HD% A 57 GLU HBy 1.0 0.0 4.19 68 51 A 6 TYR HD% A 57 GLU HBx 1.0 0.0 4.19 69 52 A 6 TYR HD% A 57 GLU HG2 1.0 0.0 4.18 70 52 A 6 TYR HD% A 57 GLU HG3 1.0 0.0 4.18 71 53 A 6 TYR HD% A 60 MET HBy 1.0 0.0 5.34 72 53 A 6 TYR HD% A 60 MET HBx 1.0 0.0 5.34 73 54 A 6 TYR HD% A 60 MET HE% 1.0 0.0 3.92 74 55 A 57 GLU H A 6 TYR HE% 1.0 0.0 4.91 75 56 A 57 GLU HA A 6 TYR HE% 1.0 0.0 4.62 76 57 A 57 GLU HBx A 6 TYR HE% 1.0 0.0 4.53 77 58 A 6 TYR HE% A 57 GLU HBy 1.0 0.0 4.53 78 59 A 6 TYR HE% A 57 GLU HBy 1.0 0.0 3.75 79 59 A 57 GLU HBx A 6 TYR HE% 1.0 0.0 3.75 80 60 A 6 TYR HE% A 57 GLU HG2 1.0 0.0 4.18 81 60 A 57 GLU HG3 A 6 TYR HE% 1.0 0.0 4.18 82 61 A 60 MET HE% A 6 TYR HE% 1.0 0.0 4.51 83 62 A 7 ARG H A 7 ARG HBx 1.0 0.0 3.74 84 63 A 7 ARG H A 7 ARG HBy 1.0 0.0 3.74 85 64 A 7 ARG H A 82 ALA HB% 1.0 0.0 5.35 86 65 A 7 ARG HA A 8 CYS H 1.0 0.0 3.10 87 66 A 7 ARG HA A 53 THR HA 1.0 0.0 3.47 88 67 A 53 THR HG2% A 7 ARG HA 1.0 0.0 4.30 89 68 A 54 PHE H A 7 ARG HA 1.0 0.0 4.36 90 69 A 82 ALA HB% A 7 ARG HA 1.0 0.0 4.54 91 70 A 7 ARG HD3 A 7 ARG HBx 1.0 0.0 3.84 92 70 A 7 ARG HBx A 7 ARG HD2 1.0 0.0 3.84 93 71 A 8 CYS H A 7 ARG HBx 1.0 0.0 4.47 94 72 A 7 ARG HD3 A 7 ARG HBy 1.0 0.0 3.84 95 72 A 7 ARG HBy A 7 ARG HD2 1.0 0.0 3.84 96 73 A 8 CYS H A 7 ARG HBy 1.0 0.0 4.47 97 74 A 53 THR HG2% A 7 ARG HD2 1.0 0.0 5.06 98 74 A 53 THR HG2% A 7 ARG HD3 1.0 0.0 5.06 99 75 A 8 CYS H A 8 CYS HBx 1.0 0.0 4.18 100 76 A 8 CYS H A 8 CYS HBy 1.0 0.0 4.18 101 77 A 8 CYS H A 52 VAL H 1.0 0.0 3.80 102 78 A 8 CYS H A 53 THR HA 1.0 0.0 4.03 103 79 A 53 THR HG2% A 8 CYS H 1.0 0.0 5.50 104 80 A 82 ALA HB% A 8 CYS H 1.0 0.0 3.77 105 81 A 8 CYS HA A 9 PHE H 1.0 0.0 3.09 106 82 A 8 CYS HA A 64 ILE HD1% 1.0 0.0 4.52 107 83 A 8 CYS HA A 81 GLU HA 1.0 0.0 4.08 108 84 A 8 CYS HA A 82 ALA H 1.0 0.0 3.51 109 85 A 82 ALA HB% A 8 CYS HA 1.0 0.0 3.88 110 86 A 9 PHE H A 8 CYS HBx 1.0 0.0 4.62 111 87 A 9 PHE H A 8 CYS HBy 1.0 0.0 4.62 112 88 A 9 PHE H A 9 PHE HBy 1.0 0.0 3.68 113 89 A 9 PHE H A 9 PHE HBx 1.0 0.0 3.68 114 90 A 9 PHE H A 79 VAL HGx% 1.0 0.0 4.81 115 91 A 9 PHE H A 80 ASN H 1.0 0.0 4.01 116 92 A 9 PHE H A 81 GLU HA 1.0 0.0 4.38 117 93 A 9 PHE H A 82 ALA H 1.0 0.0 4.05 118 94 A 9 PHE H A 82 ALA HA 1.0 0.0 4.71 119 95 A 82 ALA HB% A 9 PHE H 1.0 0.0 3.98 120 96 A 9 PHE HA A 9 PHE HD% 1.0 0.0 4.10 121 97 A 9 PHE HA A 10 VAL H 1.0 0.0 3.15 122 98 A 9 PHE HA A 10 VAL HB 1.0 0.0 5.06 123 99 A 9 PHE HA A 51 PHE HA 1.0 0.0 3.99 124 100 A 9 PHE HA A 51 PHE HD% 1.0 0.0 4.25 125 101 A 52 VAL H A 9 PHE HA 1.0 0.0 4.76 126 102 A 82 ALA HB% A 9 PHE HA 1.0 0.0 4.44 127 103 A 82 ALA HA A 9 PHE HBy 1.0 0.0 4.16 128 104 A 82 ALA HB% A 9 PHE HBy 1.0 0.0 4.25 129 105 A 82 ALA HA A 9 PHE HBx 1.0 0.0 4.16 130 106 A 82 ALA HB% A 9 PHE HBx 1.0 0.0 4.25 131 107 A 9 PHE HD% A 10 VAL H 1.0 0.0 4.49 132 108 A 9 PHE HD% A 11 GLY H 1.0 0.0 5.15 133 109 A 80 ASN H A 9 PHE HD% 1.0 0.0 5.32 134 110 A 10 VAL H A 10 VAL HB 1.0 0.0 3.74 135 111 A 10 VAL H A 10 VAL HGx% 1.0 0.0 4.60 136 112 A 10 VAL H A 10 VAL HGy% 1.0 0.0 4.60 137 113 A 10 VAL H A 50 GLY H 1.0 0.0 4.26 138 114 A 10 VAL H A 51 PHE HA 1.0 0.0 4.26 139 115 A 10 VAL H A 51 PHE HD% 1.0 0.0 5.37 140 116 A 10 VAL HGx% A 10 VAL HA 1.0 0.0 3.97 141 117 A 10 VAL HGy% A 10 VAL HA 1.0 0.0 3.97 142 118 A 11 GLY H A 10 VAL HA 1.0 0.0 3.10 143 119 A 10 VAL HA A 79 VAL HA 1.0 0.0 3.91 144 120 A 79 VAL HGx% A 10 VAL HA 1.0 0.0 4.10 145 121 A 80 ASN H A 10 VAL HA 1.0 0.0 4.39 146 122 A 10 VAL HB A 11 GLY H 1.0 0.0 4.77 147 123 A 10 VAL HB A 13 LEU HDx% 1.0 0.0 4.47 148 124 A 10 VAL HB A 13 LEU HDy% 1.0 0.0 4.20 149 125 A 10 VAL HB A 22 LEU HDy% 1.0 0.0 4.06 150 125 A 10 VAL HB A 22 LEU HDx% 1.0 0.0 4.06 151 126 A 10 VAL HB A 50 GLY H 1.0 0.0 4.21 152 127 A 11 GLY H A 10 VAL HGx% 1.0 0.0 4.51 153 128 A 10 VAL HGx% A 26 PHE HE% 1.0 0.0 3.56 154 129 A 10 VAL HGx% A 79 VAL HA 1.0 0.0 4.59 155 130 A 10 VAL HGx% A 79 VAL HGy% 1.0 0.0 3.87 156 131 A 11 GLY H A 10 VAL HGy% 1.0 0.0 4.51 157 132 A 10 VAL HGy% A 26 PHE HE% 1.0 0.0 3.56 158 133 A 10 VAL HGy% A 79 VAL HA 1.0 0.0 4.59 159 134 A 11 GLY H A 77 ILE HB 1.0 0.0 5.34 160 135 A 11 GLY H A 78 THR H 1.0 0.0 3.89 161 136 A 11 GLY H A 78 THR HB 1.0 0.0 4.80 162 137 A 11 GLY H A 78 THR HG2% 1.0 0.0 4.49 163 138 A 11 GLY H A 79 VAL HA 1.0 0.0 4.38 164 139 A 11 GLY H A 79 VAL HGy% 1.0 0.0 5.37 165 140 A 80 ASN H A 11 GLY H 1.0 0.0 5.50 166 141 A 49 PHE HA A 11 GLY HAx 1.0 0.0 4.53 167 142 A 49 PHE HD% A 11 GLY HAx 1.0 0.0 4.59 168 143 A 49 PHE HA A 11 GLY HAy 1.0 0.0 4.53 169 144 A 49 PHE HD% A 11 GLY HAy 1.0 0.0 4.72 170 145 A 12 GLY H A 13 LEU H 1.0 0.0 3.58 171 146 A 77 ILE HA A 12 GLY HAy 1.0 0.0 4.97 172 146 A 12 GLY HAx A 77 ILE HA 1.0 0.0 4.97 173 147 A 77 ILE HG2% A 12 GLY HAy 1.0 0.0 5.12 174 147 A 12 GLY HAx A 77 ILE HG2% 1.0 0.0 5.12 175 148 A 78 THR H A 12 GLY HAy 1.0 0.0 5.01 176 148 A 78 THR H A 12 GLY HAx 1.0 0.0 5.01 177 149 A 13 LEU H A 13 LEU HBx 1.0 0.0 3.46 178 150 A 13 LEU H A 13 LEU HG 1.0 0.0 3.63 179 151 A 13 LEU HDx% A 13 LEU H 1.0 0.0 4.00 180 152 A 13 LEU HDy% A 13 LEU H 1.0 0.0 4.00 181 153 A 49 PHE HA A 13 LEU H 1.0 0.0 4.70 182 154 A 13 LEU H A 77 ILE HG2% 1.0 0.0 4.49 183 155 A 13 LEU HDx% A 13 LEU HA 1.0 0.0 4.26 184 156 A 13 LEU HDy% A 13 LEU HA 1.0 0.0 4.05 185 157 A 13 LEU HA A 14 ALA H 1.0 0.0 3.26 186 158 A 13 LEU HA A 14 ALA HB% 1.0 0.0 4.24 187 159 A 77 ILE HG2% A 13 LEU HA 1.0 0.0 3.69 188 160 A 13 LEU HBx A 14 ALA H 1.0 0.0 4.40 189 161 A 13 LEU HBx A 17 THR HB 1.0 0.0 4.62 190 162 A 13 LEU HBx A 49 PHE H 1.0 0.0 5.18 191 163 A 13 LEU HDx% A 13 LEU HBy 1.0 0.0 3.99 192 164 A 13 LEU HDy% A 13 LEU HBy 1.0 0.0 3.99 193 165 A 14 ALA H A 13 LEU HBy 1.0 0.0 4.16 194 166 A 17 THR HB A 13 LEU HBy 1.0 0.0 4.32 195 167 A 49 PHE HA A 13 LEU HG 1.0 0.0 4.35 196 168 A 77 ILE HG2% A 13 LEU HG 1.0 0.0 5.50 197 169 A 13 LEU HDx% A 17 THR HB 1.0 0.0 4.77 198 170 A 13 LEU HDx% A 17 THR HG2% 1.0 0.0 3.52 199 171 A 13 LEU HDy% A 17 THR HB 1.0 0.0 4.77 200 172 A 14 ALA H A 14 ALA HB% 1.0 0.0 3.22 201 173 A 14 ALA H A 17 THR HA 1.0 0.0 5.16 202 174 A 14 ALA H A 17 THR HB 1.0 0.0 5.04 203 175 A 14 ALA H A 17 THR HG2% 1.0 0.0 4.56 204 176 A 77 ILE HG2% A 14 ALA H 1.0 0.0 4.58 205 177 A 14 ALA HA A 15 TRP H 1.0 0.0 3.26 206 178 A 14 ALA HA A 16 ALA H 1.0 0.0 4.53 207 179 A 14 ALA HA A 75 ARG HGy 1.0 0.0 4.25 208 179 A 14 ALA HA A 75 ARG HGx 1.0 0.0 4.25 209 180 A 14 ALA HA A 75 ARG HD2 1.0 0.0 4.30 210 180 A 14 ALA HA A 75 ARG HD3 1.0 0.0 4.30 211 181 A 14 ALA HB% A 15 TRP H 1.0 0.0 3.97 212 182 A 14 ALA HB% A 16 ALA H 1.0 0.0 3.55 213 183 A 14 ALA HB% A 17 THR H 1.0 0.0 3.58 214 184 A 14 ALA HB% A 73 ASP HBx 1.0 0.0 3.58 215 185 A 14 ALA HB% A 73 ASP HBy 1.0 0.0 3.58 216 186 A 14 ALA HB% A 75 ARG H 1.0 0.0 4.48 217 187 A 14 ALA HB% A 75 ARG HBy 1.0 0.0 3.80 218 187 A 14 ALA HB% A 75 ARG HBx 1.0 0.0 3.80 219 188 A 14 ALA HB% A 75 ARG HD2 1.0 0.0 4.20 220 188 A 14 ALA HB% A 75 ARG HD3 1.0 0.0 4.20 221 189 A 77 ILE HG2% A 14 ALA HB% 1.0 0.0 4.35 222 190 A 15 TRP H A 15 TRP HD1 1.0 0.0 4.93 223 191 A 15 TRP H A 16 ALA H 1.0 0.0 4.51 224 192 A 15 TRP H A 17 THR H 1.0 0.0 5.20 225 193 A 15 TRP HD1 A 15 TRP HA 1.0 0.0 4.73 226 194 A 15 TRP HA A 15 TRP HE3 1.0 0.0 3.84 227 195 A 17 THR H A 15 TRP HA 1.0 0.0 4.48 228 196 A 16 ALA H A 15 TRP HBy 1.0 0.0 4.37 229 197 A 16 ALA H A 15 TRP HBx 1.0 0.0 4.37 230 198 A 15 TRP HE3 A 15 TRP HBy 1.0 0.0 3.67 231 198 A 15 TRP HE3 A 15 TRP HBx 1.0 0.0 3.67 232 199 A 16 ALA H A 16 ALA HB% 1.0 0.0 3.18 233 200 A 16 ALA H A 17 THR H 1.0 0.0 3.71 234 201 A 17 THR H A 16 ALA HB% 1.0 0.0 3.68 235 202 A 17 THR HB A 17 THR H 1.0 0.0 3.12 236 203 A 17 THR HG2% A 17 THR H 1.0 0.0 3.82 237 204 A 17 THR H A 18 THR H 1.0 0.0 4.63 238 205 A 17 THR HG2% A 17 THR HA 1.0 0.0 3.25 239 206 A 17 THR HA A 18 THR H 1.0 0.0 3.06 240 207 A 17 THR HA A 18 THR HG2% 1.0 0.0 4.66 241 208 A 17 THR HA A 21 THR HG2% 1.0 0.0 5.50 242 209 A 17 THR HB A 18 THR H 1.0 0.0 4.32 243 210 A 17 THR HG2% A 18 THR H 1.0 0.0 3.44 244 211 A 17 THR HG2% A 21 THR HB 1.0 0.0 5.07 245 212 A 17 THR HG2% A 22 LEU H 1.0 0.0 4.00 246 213 A 17 THR HG2% A 37 ILE HD1% 1.0 0.0 3.42 247 214 A 77 ILE HG2% A 17 THR HG2% 1.0 0.0 5.50 248 215 A 18 THR H A 18 THR HG2% 1.0 0.0 3.81 249 216 A 18 THR H A 19 ASP H 1.0 0.0 5.14 250 217 A 18 THR H A 21 THR H 1.0 0.0 4.10 251 218 A 18 THR H A 21 THR HB 1.0 0.0 4.25 252 219 A 18 THR H A 21 THR HG2% 1.0 0.0 4.30 253 220 A 18 THR H A 22 LEU H 1.0 0.0 4.42 254 221 A 18 THR HG2% A 18 THR HA 1.0 0.0 3.20 255 222 A 19 ASP H A 18 THR HA 1.0 0.0 2.85 256 223 A 37 ILE HD1% A 18 THR HA 1.0 0.0 4.33 257 224 A 19 ASP H A 18 THR HB 1.0 0.0 3.39 258 225 A 18 THR HB A 20 GLN H 1.0 0.0 3.94 259 226 A 18 THR HB A 20 GLN HA 1.0 0.0 5.50 260 227 A 18 THR HG2% A 19 ASP H 1.0 0.0 3.94 261 228 A 18 THR HG2% A 20 GLN H 1.0 0.0 4.60 262 229 A 19 ASP H A 19 ASP HBx 1.0 0.0 3.78 263 230 A 19 ASP H A 19 ASP HBy 1.0 0.0 3.78 264 231 A 19 ASP H A 20 GLN H 1.0 0.0 3.75 265 232 A 37 ILE HD1% A 19 ASP H 1.0 0.0 4.33 266 233 A 22 LEU H A 19 ASP HA 1.0 0.0 4.40 267 234 A 19 ASP HA A 22 LEU HDy% 1.0 0.0 3.93 268 234 A 22 LEU HDx% A 19 ASP HA 1.0 0.0 3.93 269 235 A 19 ASP HA A 36 LYS HA 1.0 0.0 4.27 270 236 A 19 ASP HA A 37 ILE H 1.0 0.0 4.31 271 237 A 19 ASP HA A 37 ILE HG2% 1.0 0.0 5.50 272 238 A 19 ASP HA A 37 ILE HG1x 1.0 0.0 4.22 273 239 A 19 ASP HA A 37 ILE HG1y 1.0 0.0 4.22 274 240 A 20 GLN H A 19 ASP HBx 1.0 0.0 4.22 275 241 A 19 ASP HBx A 36 LYS HA 1.0 0.0 4.57 276 242 A 20 GLN H A 19 ASP HBy 1.0 0.0 4.22 277 243 A 19 ASP HBy A 36 LYS HA 1.0 0.0 4.57 278 244 A 20 GLN H A 20 GLN HBx 1.0 0.0 3.81 279 245 A 20 GLN H A 20 GLN HBy 1.0 0.0 3.81 280 246 A 20 GLN H A 20 GLN HBy 1.0 0.0 3.21 281 246 A 20 GLN H A 20 GLN HBx 1.0 0.0 3.21 282 247 A 20 GLN H A 20 GLN HG2 1.0 0.0 4.37 283 247 A 20 GLN H A 20 GLN HG3 1.0 0.0 4.37 284 248 A 20 GLN H A 20 GLN HE22 1.0 0.0 5.14 285 248 A 20 GLN H A 20 GLN HE21 1.0 0.0 5.14 286 249 A 21 THR HG2% A 20 GLN H 1.0 0.0 5.50 287 250 A 20 GLN HA A 20 GLN HG2 1.0 0.0 3.64 288 250 A 20 GLN HA A 20 GLN HG3 1.0 0.0 3.64 289 251 A 20 GLN HA A 20 GLN HE22 1.0 0.0 4.62 290 251 A 20 GLN HA A 20 GLN HE21 1.0 0.0 4.62 291 252 A 21 THR H A 20 GLN HBx 1.0 0.0 3.91 292 253 A 21 THR H A 20 GLN HBy 1.0 0.0 3.91 293 254 A 20 GLN HBy A 20 GLN HE22 1.0 0.0 3.86 294 254 A 20 GLN HBx A 20 GLN HE22 1.0 0.0 3.86 295 254 A 20 GLN HE21 A 20 GLN HBy 1.0 0.0 3.86 296 254 A 20 GLN HBx A 20 GLN HE21 1.0 0.0 3.86 297 255 A 21 THR HG2% A 20 GLN HBy 1.0 0.0 5.34 298 255 A 21 THR HG2% A 20 GLN HBx 1.0 0.0 5.34 299 256 A 21 THR H A 20 GLN HG2 1.0 0.0 4.86 300 256 A 21 THR H A 20 GLN HG3 1.0 0.0 4.86 301 257 A 21 THR HG2% A 20 GLN HG2 1.0 0.0 4.82 302 257 A 21 THR HG2% A 20 GLN HG3 1.0 0.0 4.82 303 258 A 21 THR HB A 21 THR H 1.0 0.0 3.74 304 259 A 21 THR HG2% A 21 THR H 1.0 0.0 3.30 305 260 A 22 LEU H A 21 THR H 1.0 0.0 3.45 306 261 A 21 THR H A 23 GLY H 1.0 0.0 5.50 307 262 A 21 THR HG2% A 21 THR HA 1.0 0.0 3.31 308 263 A 21 THR HA A 24 GLU H 1.0 0.0 4.03 309 264 A 21 THR HA A 25 ALA H 1.0 0.0 4.54 310 265 A 21 THR HB A 22 LEU H 1.0 0.0 4.03 311 266 A 22 LEU H A 22 LEU HBx 1.0 0.0 3.84 312 267 A 22 LEU H A 22 LEU HBy 1.0 0.0 3.84 313 268 A 22 LEU H A 22 LEU HG 1.0 0.0 4.55 314 269 A 22 LEU HDx% A 22 LEU H 1.0 0.0 4.28 315 270 A 22 LEU H A 22 LEU HDy% 1.0 0.0 4.28 316 271 A 22 LEU H A 23 GLY H 1.0 0.0 3.63 317 272 A 22 LEU HDx% A 22 LEU HA 1.0 0.0 4.33 318 273 A 22 LEU HA A 22 LEU HDy% 1.0 0.0 4.33 319 274 A 22 LEU HA A 22 LEU HDy% 1.0 0.0 3.15 320 274 A 22 LEU HDx% A 22 LEU HA 1.0 0.0 3.15 321 275 A 25 ALA H A 22 LEU HA 1.0 0.0 4.70 322 276 A 22 LEU HA A 25 ALA HB% 1.0 0.0 3.72 323 277 A 22 LEU HA A 26 PHE H 1.0 0.0 5.13 324 278 A 22 LEU HA A 72 LEU HDx% 1.0 0.0 5.16 325 279 A 22 LEU HA A 72 LEU HDy% 1.0 0.0 5.16 326 280 A 22 LEU HA A 72 LEU HDy% 1.0 0.0 3.66 327 280 A 22 LEU HA A 72 LEU HDx% 1.0 0.0 3.66 328 281 A 22 LEU HDx% A 22 LEU HBx 1.0 0.0 4.21 329 282 A 22 LEU HBx A 22 LEU HDy% 1.0 0.0 4.21 330 283 A 22 LEU HDx% A 22 LEU HBy 1.0 0.0 4.21 331 284 A 22 LEU HBy A 22 LEU HDy% 1.0 0.0 4.21 332 285 A 23 GLY H A 22 LEU HG 1.0 0.0 5.50 333 286 A 22 LEU HG A 26 PHE HD% 1.0 0.0 5.50 334 287 A 26 PHE HE% A 22 LEU HG 1.0 0.0 5.34 335 288 A 23 GLY H A 22 LEU HDy% 1.0 0.0 4.52 336 288 A 22 LEU HDx% A 23 GLY H 1.0 0.0 4.52 337 289 A 25 ALA HB% A 22 LEU HDy% 1.0 0.0 4.28 338 289 A 22 LEU HDx% A 25 ALA HB% 1.0 0.0 4.28 339 290 A 26 PHE HD% A 22 LEU HDy% 1.0 0.0 4.02 340 290 A 22 LEU HDx% A 26 PHE HD% 1.0 0.0 4.02 341 291 A 26 PHE HE% A 22 LEU HDy% 1.0 0.0 3.56 342 291 A 22 LEU HDx% A 26 PHE HE% 1.0 0.0 3.56 343 292 A 36 LYS H A 22 LEU HDy% 1.0 0.0 4.30 344 292 A 22 LEU HDx% A 36 LYS H 1.0 0.0 4.30 345 293 A 37 ILE H A 22 LEU HDy% 1.0 0.0 4.94 346 293 A 22 LEU HDx% A 37 ILE H 1.0 0.0 4.94 347 294 A 37 ILE HA A 22 LEU HDy% 1.0 0.0 4.56 348 294 A 22 LEU HDx% A 37 ILE HA 1.0 0.0 4.56 349 295 A 38 ILE H A 22 LEU HDy% 1.0 0.0 5.30 350 295 A 22 LEU HDx% A 38 ILE H 1.0 0.0 5.30 351 296 A 50 GLY HAx A 22 LEU HDy% 1.0 0.0 3.85 352 296 A 22 LEU HDx% A 50 GLY HAx 1.0 0.0 3.85 353 297 A 51 PHE H A 22 LEU HDy% 1.0 0.0 4.17 354 297 A 22 LEU HDx% A 51 PHE H 1.0 0.0 4.17 355 298 A 23 GLY H A 24 GLU H 1.0 0.0 3.61 356 299 A 24 GLU H A 24 GLU HBx 1.0 0.0 3.60 357 300 A 24 GLU H A 24 GLU HBy 1.0 0.0 3.60 358 301 A 24 GLU H A 24 GLU HGy 1.0 0.0 4.13 359 302 A 24 GLU H A 24 GLU HGx 1.0 0.0 4.13 360 303 A 24 GLU H A 24 GLU HGx 1.0 0.0 3.51 361 303 A 24 GLU H A 24 GLU HGy 1.0 0.0 3.51 362 304 A 24 GLU H A 25 ALA H 1.0 0.0 3.38 363 305 A 24 GLU H A 25 ALA HB% 1.0 0.0 4.37 364 306 A 24 GLU HGy A 24 GLU HA 1.0 0.0 4.08 365 307 A 24 GLU HA A 24 GLU HGx 1.0 0.0 4.08 366 308 A 24 GLU HA A 24 GLU HGx 1.0 0.0 3.49 367 308 A 24 GLU HGy A 24 GLU HA 1.0 0.0 3.49 368 309 A 25 ALA H A 24 GLU HBx 1.0 0.0 4.29 369 310 A 25 ALA H A 24 GLU HBy 1.0 0.0 4.29 370 311 A 25 ALA H A 24 GLU HGx 1.0 0.0 4.96 371 311 A 25 ALA H A 24 GLU HGy 1.0 0.0 4.96 372 312 A 25 ALA H A 25 ALA HB% 1.0 0.0 2.92 373 313 A 25 ALA H A 26 PHE HD% 1.0 0.0 5.11 374 314 A 25 ALA H A 72 LEU HDy% 1.0 0.0 5.41 375 314 A 25 ALA H A 72 LEU HDx% 1.0 0.0 5.41 376 315 A 25 ALA HB% A 26 PHE H 1.0 0.0 3.52 377 316 A 25 ALA HB% A 26 PHE HA 1.0 0.0 5.50 378 317 A 25 ALA HB% A 26 PHE HD% 1.0 0.0 3.83 379 318 A 25 ALA HB% A 27 SER H 1.0 0.0 4.35 380 319 A 25 ALA HB% A 72 LEU HDx% 1.0 0.0 3.61 381 320 A 25 ALA HB% A 72 LEU HDy% 1.0 0.0 3.61 382 321 A 25 ALA HB% A 72 LEU HDy% 1.0 0.0 2.98 383 321 A 25 ALA HB% A 72 LEU HDx% 1.0 0.0 2.98 384 322 A 26 PHE H A 26 PHE HBx 1.0 0.0 3.38 385 323 A 26 PHE H A 26 PHE HBy 1.0 0.0 3.77 386 324 A 26 PHE H A 26 PHE HD% 1.0 0.0 3.58 387 325 A 26 PHE H A 27 SER H 1.0 0.0 3.16 388 326 A 26 PHE H A 32 ILE HD1% 1.0 0.0 4.54 389 327 A 26 PHE H A 52 VAL HGx% 1.0 0.0 5.50 390 328 A 26 PHE H A 52 VAL HGy% 1.0 0.0 5.50 391 329 A 26 PHE HD% A 26 PHE HA 1.0 0.0 4.16 392 330 A 26 PHE HA A 28 GLN H 1.0 0.0 3.88 393 331 A 26 PHE HA A 29 PHE H 1.0 0.0 4.09 394 332 A 26 PHE HA A 29 PHE HD% 1.0 0.0 4.10 395 333 A 26 PHE HA A 63 ALA HB% 1.0 0.0 4.45 396 334 A 27 SER H A 26 PHE HBx 1.0 0.0 4.26 397 335 A 26 PHE HBx A 30 GLY H 1.0 0.0 5.50 398 336 A 26 PHE HBx A 32 ILE HD1% 1.0 0.0 3.91 399 337 A 26 PHE HBx A 52 VAL HGx% 1.0 0.0 4.38 400 338 A 26 PHE HBx A 52 VAL HGy% 1.0 0.0 4.38 401 339 A 27 SER H A 26 PHE HBy 1.0 0.0 4.67 402 340 A 26 PHE HBy A 29 PHE HBy 1.0 0.0 5.20 403 340 A 26 PHE HBy A 29 PHE HBx 1.0 0.0 5.20 404 341 A 26 PHE HBy A 30 GLY H 1.0 0.0 4.38 405 342 A 26 PHE HBy A 32 ILE HD1% 1.0 0.0 3.72 406 343 A 26 PHE HBy A 54 PHE HE% 1.0 0.0 4.36 407 344 A 26 PHE HBy A 63 ALA HB% 1.0 0.0 4.95 408 345 A 26 PHE HD% A 26 PHE HZ 1.0 0.0 3.83 409 346 A 26 PHE HD% A 32 ILE HD1% 1.0 0.0 4.57 410 347 A 26 PHE HD% A 52 VAL HGx% 1.0 0.0 4.21 411 348 A 26 PHE HD% A 52 VAL HGy% 1.0 0.0 4.21 412 349 A 26 PHE HD% A 54 PHE HE% 1.0 0.0 4.16 413 350 A 26 PHE HD% A 63 ALA HB% 1.0 0.0 3.58 414 351 A 79 VAL HGx% A 26 PHE HD% 1.0 0.0 5.50 415 352 A 26 PHE HE% A 63 ALA HB% 1.0 0.0 3.84 416 353 A 26 PHE HE% A 67 MET HBx 1.0 0.0 4.02 417 354 A 26 PHE HE% A 67 MET HBy 1.0 0.0 4.02 418 355 A 26 PHE HE% A 77 ILE HD1% 1.0 0.0 4.13 419 356 A 79 VAL HGx% A 26 PHE HE% 1.0 0.0 3.50 420 357 A 26 PHE HE% A 79 VAL HGy% 1.0 0.0 3.11 421 358 A 27 SER H A 27 SER HBx 1.0 0.0 3.83 422 359 A 27 SER H A 27 SER HBy 1.0 0.0 3.83 423 360 A 27 SER H A 27 SER HBy 1.0 0.0 3.23 424 360 A 27 SER H A 27 SER HBx 1.0 0.0 3.23 425 361 A 27 SER H A 28 GLN H 1.0 0.0 3.70 426 362 A 27 SER H A 32 ILE HD1% 1.0 0.0 4.02 427 363 A 30 GLY H A 27 SER HA 1.0 0.0 3.82 428 364 A 32 ILE HD1% A 27 SER HA 1.0 0.0 3.65 429 365 A 28 GLN H A 28 GLN HBx 1.0 0.0 3.73 430 366 A 28 GLN H A 28 GLN HBy 1.0 0.0 3.73 431 367 A 28 GLN H A 28 GLN HGy 1.0 0.0 3.96 432 367 A 28 GLN H A 28 GLN HGx 1.0 0.0 3.96 433 368 A 28 GLN H A 29 PHE H 1.0 0.0 3.51 434 369 A 28 GLN H A 30 GLY H 1.0 0.0 4.49 435 370 A 28 GLN HA A 28 GLN HGy 1.0 0.0 3.67 436 370 A 28 GLN HGx A 28 GLN HA 1.0 0.0 3.67 437 371 A 30 GLY H A 28 GLN HA 1.0 0.0 5.06 438 372 A 29 PHE H A 28 GLN HBx 1.0 0.0 4.19 439 373 A 29 PHE H A 28 GLN HBy 1.0 0.0 4.19 440 374 A 29 PHE H A 28 GLN HGy 1.0 0.0 5.19 441 374 A 29 PHE H A 28 GLN HGx 1.0 0.0 5.19 442 375 A 29 PHE H A 29 PHE HBx 1.0 0.0 3.99 443 376 A 29 PHE H A 29 PHE HBy 1.0 0.0 3.99 444 377 A 29 PHE H A 29 PHE HBy 1.0 0.0 3.36 445 377 A 29 PHE H A 29 PHE HBx 1.0 0.0 3.36 446 378 A 29 PHE H A 30 GLY H 1.0 0.0 3.15 447 379 A 29 PHE H A 54 PHE HE% 1.0 0.0 5.18 448 380 A 29 PHE H A 63 ALA HB% 1.0 0.0 5.00 449 381 A 29 PHE HD% A 29 PHE HA 1.0 0.0 3.67 450 382 A 63 ALA HB% A 29 PHE HBx 1.0 0.0 4.17 451 383 A 63 ALA HB% A 29 PHE HBy 1.0 0.0 4.17 452 384 A 30 GLY H A 29 PHE HBy 1.0 0.0 3.81 453 384 A 30 GLY H A 29 PHE HBx 1.0 0.0 3.81 454 385 A 29 PHE HBy A 30 GLY HAy 1.0 0.0 4.54 455 385 A 29 PHE HBx A 30 GLY HAy 1.0 0.0 4.54 456 385 A 30 GLY HAx A 29 PHE HBy 1.0 0.0 4.54 457 385 A 29 PHE HBx A 30 GLY HAx 1.0 0.0 4.54 458 386 A 54 PHE HE% A 29 PHE HBy 1.0 0.0 4.17 459 386 A 29 PHE HBx A 54 PHE HE% 1.0 0.0 4.17 460 387 A 63 ALA HA A 29 PHE HBy 1.0 0.0 4.56 461 387 A 29 PHE HBx A 63 ALA HA 1.0 0.0 4.56 462 388 A 63 ALA HB% A 29 PHE HBy 1.0 0.0 3.50 463 388 A 63 ALA HB% A 29 PHE HBx 1.0 0.0 3.50 464 389 A 29 PHE HD% A 62 ASP HBx 1.0 0.0 4.68 465 390 A 29 PHE HD% A 62 ASP HBy 1.0 0.0 4.68 466 391 A 29 PHE HD% A 63 ALA H 1.0 0.0 5.15 467 392 A 29 PHE HD% A 63 ALA HA 1.0 0.0 4.09 468 393 A 29 PHE HD% A 63 ALA HB% 1.0 0.0 3.84 469 394 A 30 GLY H A 31 GLU H 1.0 0.0 4.48 470 395 A 32 ILE HD1% A 30 GLY H 1.0 0.0 4.70 471 396 A 30 GLY H A 54 PHE HD% 1.0 0.0 5.15 472 397 A 30 GLY H A 54 PHE HE% 1.0 0.0 3.09 473 398 A 63 ALA HB% A 30 GLY H 1.0 0.0 5.03 474 399 A 31 GLU H A 30 GLY HAy 1.0 0.0 3.26 475 400 A 54 PHE HD% A 30 GLY HAy 1.0 0.0 5.07 476 401 A 59 ALA HB% A 30 GLY HAy 1.0 0.0 3.88 477 402 A 30 GLY HAx A 31 GLU H 1.0 0.0 3.26 478 403 A 30 GLY HAx A 54 PHE HD% 1.0 0.0 5.07 479 404 A 30 GLY HAx A 59 ALA HB% 1.0 0.0 3.88 480 405 A 54 PHE HD% A 30 GLY HAy 1.0 0.0 4.31 481 405 A 30 GLY HAx A 54 PHE HD% 1.0 0.0 4.31 482 406 A 59 ALA HB% A 30 GLY HAy 1.0 0.0 3.27 483 406 A 30 GLY HAx A 59 ALA HB% 1.0 0.0 3.27 484 407 A 31 GLU H A 31 GLU HBx 1.0 0.0 3.50 485 408 A 31 GLU H A 31 GLU HBy 1.0 0.0 3.50 486 409 A 31 GLU H A 31 GLU HBy 1.0 0.0 3.02 487 409 A 31 GLU H A 31 GLU HBx 1.0 0.0 3.02 488 410 A 31 GLU H A 31 GLU HGy 1.0 0.0 4.58 489 410 A 31 GLU H A 31 GLU HGx 1.0 0.0 4.58 490 411 A 31 GLU H A 32 ILE H 1.0 0.0 4.73 491 412 A 31 GLU H A 59 ALA HB% 1.0 0.0 4.41 492 413 A 32 ILE H A 31 GLU HA 1.0 0.0 2.78 493 414 A 31 GLU HBx A 32 ILE H 1.0 0.0 4.82 494 415 A 32 ILE H A 31 GLU HBy 1.0 0.0 4.82 495 416 A 32 ILE H A 31 GLU HGy 1.0 0.0 4.83 496 416 A 31 GLU HGx A 32 ILE H 1.0 0.0 4.83 497 417 A 32 ILE H A 32 ILE HB 1.0 0.0 3.34 498 418 A 32 ILE H A 32 ILE HG2% 1.0 0.0 3.99 499 419 A 32 ILE H A 32 ILE HG1y 1.0 0.0 4.04 500 420 A 32 ILE H A 32 ILE HG1x 1.0 0.0 4.04 501 421 A 32 ILE HD1% A 32 ILE H 1.0 0.0 4.44 502 422 A 32 ILE HG2% A 32 ILE HA 1.0 0.0 3.42 503 423 A 32 ILE HA A 32 ILE HG1y 1.0 0.0 4.08 504 424 A 32 ILE HA A 32 ILE HG1x 1.0 0.0 4.08 505 425 A 32 ILE HD1% A 32 ILE HA 1.0 0.0 3.86 506 426 A 32 ILE HA A 33 LEU H 1.0 0.0 3.17 507 427 A 32 ILE HA A 34 ASP H 1.0 0.0 3.97 508 428 A 32 ILE HA A 54 PHE HA 1.0 0.0 3.67 509 429 A 32 ILE HD1% A 32 ILE HB 1.0 0.0 3.59 510 430 A 32 ILE HB A 33 LEU H 1.0 0.0 4.34 511 431 A 32 ILE HB A 34 ASP H 1.0 0.0 4.68 512 432 A 32 ILE HG2% A 33 LEU H 1.0 0.0 3.72 513 433 A 32 ILE HG2% A 33 LEU HA 1.0 0.0 4.81 514 434 A 32 ILE HG2% A 34 ASP H 1.0 0.0 3.27 515 435 A 32 ILE HG2% A 34 ASP HA 1.0 0.0 4.02 516 436 A 32 ILE HG2% A 35 SER H 1.0 0.0 4.26 517 437 A 32 ILE HG2% A 35 SER HBx 1.0 0.0 3.96 518 438 A 32 ILE HG2% A 35 SER HBy 1.0 0.0 3.96 519 439 A 32 ILE HG2% A 52 VAL HA 1.0 0.0 4.63 520 440 A 32 ILE HG2% A 52 VAL HGx% 1.0 0.0 4.77 521 441 A 32 ILE HG2% A 52 VAL HGy% 1.0 0.0 4.77 522 442 A 32 ILE HG2% A 53 THR H 1.0 0.0 4.23 523 443 A 53 THR HB A 32 ILE HG2% 1.0 0.0 4.76 524 444 A 32 ILE HG2% A 54 PHE HA 1.0 0.0 4.74 525 445 A 32 ILE HD1% A 52 VAL HGx% 1.0 0.0 5.03 526 446 A 32 ILE HD1% A 52 VAL HGy% 1.0 0.0 5.03 527 447 A 32 ILE HD1% A 54 PHE HD% 1.0 0.0 5.50 528 448 A 32 ILE HD1% A 54 PHE HE% 1.0 0.0 4.20 529 449 A 33 LEU H A 33 LEU HBx 1.0 0.0 3.89 530 450 A 33 LEU H A 33 LEU HBy 1.0 0.0 3.89 531 451 A 33 LEU H A 33 LEU HBy 1.0 0.0 3.33 532 451 A 33 LEU H A 33 LEU HBx 1.0 0.0 3.33 533 452 A 33 LEU H A 33 LEU HG 1.0 0.0 3.73 534 453 A 33 LEU H A 33 LEU HDx% 1.0 0.0 4.33 535 454 A 33 LEU H A 33 LEU HDy% 1.0 0.0 4.33 536 455 A 33 LEU H A 34 ASP H 1.0 0.0 3.12 537 456 A 53 THR HB A 33 LEU H 1.0 0.0 4.58 538 457 A 53 THR HG2% A 33 LEU H 1.0 0.0 4.53 539 458 A 33 LEU H A 54 PHE HA 1.0 0.0 3.92 540 459 A 33 LEU H A 55 LYS H 1.0 0.0 4.94 541 460 A 33 LEU HA A 33 LEU HG 1.0 0.0 3.84 542 461 A 34 ASP H A 33 LEU HBx 1.0 0.0 4.17 543 462 A 53 THR HB A 33 LEU HBx 1.0 0.0 4.40 544 463 A 34 ASP H A 33 LEU HBy 1.0 0.0 4.17 545 464 A 53 THR HB A 33 LEU HBy 1.0 0.0 4.40 546 465 A 34 ASP H A 33 LEU HBy 1.0 0.0 3.36 547 465 A 34 ASP H A 33 LEU HBx 1.0 0.0 3.36 548 466 A 34 ASP H A 33 LEU HG 1.0 0.0 5.13 549 467 A 33 LEU HG A 55 LYS HA 1.0 0.0 4.05 550 468 A 34 ASP H A 34 ASP HBx 1.0 0.0 4.14 551 469 A 34 ASP H A 34 ASP HBy 1.0 0.0 4.14 552 470 A 34 ASP H A 35 SER H 1.0 0.0 4.48 553 471 A 34 ASP H A 53 THR H 1.0 0.0 3.88 554 472 A 53 THR HA A 34 ASP H 1.0 0.0 5.25 555 473 A 53 THR HB A 34 ASP H 1.0 0.0 3.54 556 474 A 53 THR HG2% A 34 ASP H 1.0 0.0 4.16 557 475 A 34 ASP HA A 35 SER H 1.0 0.0 2.78 558 476 A 35 SER H A 34 ASP HBx 1.0 0.0 4.39 559 477 A 53 THR HB A 34 ASP HBx 1.0 0.0 4.41 560 478 A 35 SER H A 34 ASP HBy 1.0 0.0 4.39 561 479 A 53 THR HB A 34 ASP HBy 1.0 0.0 4.41 562 480 A 35 SER H A 36 LYS HGx 1.0 0.0 4.94 563 480 A 35 SER H A 36 LYS HGy 1.0 0.0 4.94 564 481 A 36 LYS H A 35 SER HA 1.0 0.0 2.99 565 482 A 52 VAL HA A 35 SER HA 1.0 0.0 3.49 566 483 A 35 SER HA A 52 VAL HGx% 1.0 0.0 4.96 567 484 A 35 SER HA A 52 VAL HGy% 1.0 0.0 4.96 568 485 A 53 THR H A 35 SER HA 1.0 0.0 4.38 569 486 A 52 VAL HA A 35 SER HBx 1.0 0.0 4.44 570 487 A 52 VAL HGx% A 35 SER HBx 1.0 0.0 5.12 571 488 A 35 SER HBx A 52 VAL HGy% 1.0 0.0 5.12 572 489 A 52 VAL HA A 35 SER HBy 1.0 0.0 4.44 573 490 A 52 VAL HGx% A 35 SER HBy 1.0 0.0 5.12 574 491 A 35 SER HBy A 52 VAL HGy% 1.0 0.0 5.12 575 492 A 36 LYS H A 36 LYS HBx 1.0 0.0 3.91 576 493 A 36 LYS H A 36 LYS HBy 1.0 0.0 3.91 577 494 A 36 LYS H A 36 LYS HGx 1.0 0.0 4.33 578 494 A 36 LYS H A 36 LYS HGy 1.0 0.0 4.33 579 495 A 36 LYS H A 51 PHE H 1.0 0.0 3.93 580 496 A 36 LYS H A 52 VAL HA 1.0 0.0 4.68 581 497 A 36 LYS HA A 36 LYS HGx 1.0 0.0 3.70 582 497 A 36 LYS HA A 36 LYS HGy 1.0 0.0 3.70 583 498 A 36 LYS HA A 36 LYS HDy 1.0 0.0 4.08 584 499 A 36 LYS HA A 36 LYS HDx 1.0 0.0 4.08 585 500 A 36 LYS HA A 36 LYS HDy 1.0 0.0 3.51 586 500 A 36 LYS HA A 36 LYS HDx 1.0 0.0 3.51 587 501 A 36 LYS HA A 36 LYS HE2 1.0 0.0 4.81 588 501 A 36 LYS HA A 36 LYS HE3 1.0 0.0 4.81 589 502 A 36 LYS HA A 37 ILE H 1.0 0.0 2.93 590 503 A 37 ILE HD1% A 36 LYS HA 1.0 0.0 4.63 591 504 A 36 LYS HE2 A 36 LYS HGx 1.0 0.0 3.85 592 504 A 36 LYS HE3 A 36 LYS HGx 1.0 0.0 3.85 593 505 A 36 LYS HGy A 36 LYS HE2 1.0 0.0 3.85 594 505 A 36 LYS HGy A 36 LYS HE3 1.0 0.0 3.85 595 506 A 36 LYS HE2 A 36 LYS HGx 1.0 0.0 3.30 596 506 A 36 LYS HE3 A 36 LYS HGx 1.0 0.0 3.30 597 506 A 36 LYS HGy A 36 LYS HE2 1.0 0.0 3.30 598 506 A 36 LYS HGy A 36 LYS HE3 1.0 0.0 3.30 599 507 A 37 ILE H A 36 LYS HDy 1.0 0.0 3.25 600 507 A 37 ILE H A 36 LYS HDx 1.0 0.0 3.25 601 508 A 38 ILE HD1% A 36 LYS HE2 1.0 0.0 4.49 602 508 A 36 LYS HE3 A 38 ILE HD1% 1.0 0.0 4.49 603 509 A 37 ILE H A 37 ILE HB 1.0 0.0 3.51 604 510 A 37 ILE H A 37 ILE HG2% 1.0 0.0 4.01 605 511 A 37 ILE H A 37 ILE HG1x 1.0 0.0 4.17 606 512 A 37 ILE H A 37 ILE HG1y 1.0 0.0 4.17 607 513 A 37 ILE HD1% A 37 ILE H 1.0 0.0 4.13 608 514 A 37 ILE H A 50 GLY HAx 1.0 0.0 5.36 609 515 A 37 ILE HG2% A 37 ILE HA 1.0 0.0 3.40 610 516 A 37 ILE HA A 37 ILE HG1x 1.0 0.0 4.07 611 517 A 37 ILE HA A 37 ILE HG1y 1.0 0.0 4.07 612 518 A 37 ILE HD1% A 37 ILE HA 1.0 0.0 3.48 613 519 A 37 ILE HA A 38 ILE H 1.0 0.0 3.18 614 520 A 37 ILE HA A 50 GLY HAx 1.0 0.0 3.81 615 521 A 37 ILE HA A 51 PHE H 1.0 0.0 4.40 616 522 A 37 ILE HD1% A 37 ILE HB 1.0 0.0 3.61 617 523 A 38 ILE H A 37 ILE HB 1.0 0.0 4.38 618 524 A 37 ILE HG2% A 38 ILE H 1.0 0.0 3.58 619 525 A 37 ILE HG2% A 46 SER HA 1.0 0.0 4.26 620 526 A 37 ILE HG2% A 46 SER HBy 1.0 0.0 3.43 621 526 A 37 ILE HG2% A 46 SER HBx 1.0 0.0 3.43 622 527 A 37 ILE HG2% A 47 ARG H 1.0 0.0 4.50 623 528 A 37 ILE HG2% A 48 GLY H 1.0 0.0 4.82 624 529 A 49 PHE H A 37 ILE HG2% 1.0 0.0 4.39 625 530 A 37 ILE HG2% A 50 GLY HAx 1.0 0.0 4.33 626 531 A 37 ILE HD1% A 50 GLY HAy 1.0 0.0 4.70 627 532 A 37 ILE HD1% A 50 GLY HAx 1.0 0.0 4.17 628 533 A 38 ILE H A 38 ILE HB 1.0 0.0 3.61 629 534 A 38 ILE H A 38 ILE HG2% 1.0 0.0 3.97 630 535 A 38 ILE H A 38 ILE HG1y 1.0 0.0 4.26 631 536 A 38 ILE H A 38 ILE HG1x 1.0 0.0 4.26 632 537 A 38 ILE H A 38 ILE HD1% 1.0 0.0 4.44 633 538 A 49 PHE H A 38 ILE H 1.0 0.0 5.02 634 539 A 38 ILE H A 50 GLY HAx 1.0 0.0 4.18 635 540 A 38 ILE HG2% A 38 ILE HA 1.0 0.0 3.38 636 541 A 38 ILE HD1% A 38 ILE HA 1.0 0.0 3.18 637 542 A 38 ILE HA A 39 ASN H 1.0 0.0 2.79 638 543 A 38 ILE HB A 39 ASN H 1.0 0.0 4.69 639 544 A 49 PHE H A 38 ILE HB 1.0 0.0 5.50 640 545 A 49 PHE HD% A 38 ILE HB 1.0 0.0 4.96 641 546 A 38 ILE HB A 49 PHE HE% 1.0 0.0 4.63 642 547 A 38 ILE HG2% A 38 ILE HG1y 1.0 0.0 3.67 643 548 A 38 ILE HG2% A 38 ILE HG1x 1.0 0.0 3.67 644 549 A 38 ILE HG2% A 39 ASN H 1.0 0.0 3.43 645 550 A 38 ILE HG2% A 47 ARG HG2 1.0 0.0 3.78 646 550 A 38 ILE HG2% A 47 ARG HG3 1.0 0.0 3.78 647 551 A 38 ILE HG2% A 47 ARG HDx 1.0 0.0 4.31 648 552 A 38 ILE HG2% A 47 ARG HDy 1.0 0.0 4.31 649 553 A 38 ILE HG2% A 47 ARG HDy 1.0 0.0 3.46 650 553 A 38 ILE HG2% A 47 ARG HDx 1.0 0.0 3.46 651 554 A 49 PHE HD% A 38 ILE HG2% 1.0 0.0 4.67 652 555 A 38 ILE HG2% A 49 PHE HE% 1.0 0.0 3.68 653 556 A 50 GLY HAy A 38 ILE HG1y 1.0 0.0 4.30 654 557 A 50 GLY HAx A 38 ILE HG1y 1.0 0.0 4.90 655 558 A 50 GLY HAy A 38 ILE HG1x 1.0 0.0 4.30 656 559 A 38 ILE HD1% A 39 ASN H 1.0 0.0 4.03 657 560 A 38 ILE HD1% A 49 PHE HE% 1.0 0.0 4.70 658 561 A 38 ILE HD1% A 50 GLY HAy 1.0 0.0 5.34 659 562 A 50 GLY HAx A 38 ILE HD1% 1.0 0.0 5.11 660 563 A 51 PHE HD% A 38 ILE HD1% 1.0 0.0 3.76 661 564 A 39 ASN H A 39 ASN HBx 1.0 0.0 3.91 662 565 A 39 ASN H A 39 ASN HBy 1.0 0.0 3.91 663 566 A 39 ASN H A 39 ASN HBy 1.0 0.0 3.39 664 566 A 39 ASN H A 39 ASN HBx 1.0 0.0 3.39 665 567 A 39 ASN H A 39 ASN HD22 1.0 0.0 4.53 666 567 A 39 ASN H A 39 ASN HD21 1.0 0.0 4.53 667 568 A 39 ASN H A 40 ASP H 1.0 0.0 5.14 668 569 A 40 ASP H A 39 ASN HA 1.0 0.0 3.27 669 570 A 46 SER HA A 39 ASN HA 1.0 0.0 3.42 670 571 A 47 ARG H A 39 ASN HA 1.0 0.0 3.81 671 572 A 39 ASN HA A 47 ARG HG2 1.0 0.0 4.15 672 572 A 47 ARG HG3 A 39 ASN HA 1.0 0.0 4.15 673 573 A 39 ASN HBx A 40 ASP H 1.0 0.0 4.18 674 574 A 46 SER HA A 39 ASN HBx 1.0 0.0 4.96 675 575 A 40 ASP H A 39 ASN HBy 1.0 0.0 4.18 676 576 A 46 SER HA A 39 ASN HBy 1.0 0.0 4.96 677 577 A 39 ASN HBx A 39 ASN HD22 1.0 0.0 3.21 678 577 A 39 ASN HD21 A 39 ASN HBy 1.0 0.0 3.21 679 577 A 39 ASN HBx A 39 ASN HD21 1.0 0.0 3.21 680 577 A 39 ASN HBy A 39 ASN HD22 1.0 0.0 3.21 681 578 A 40 ASP H A 39 ASN HBy 1.0 0.0 3.54 682 578 A 39 ASN HBx A 40 ASP H 1.0 0.0 3.54 683 579 A 45 ARG H A 39 ASN HBy 1.0 0.0 4.67 684 579 A 39 ASN HBx A 45 ARG H 1.0 0.0 4.67 685 580 A 46 SER HA A 39 ASN HBy 1.0 0.0 4.25 686 580 A 46 SER HA A 39 ASN HBx 1.0 0.0 4.25 687 581 A 40 ASP H A 40 ASP HBx 1.0 0.0 3.62 688 582 A 40 ASP H A 40 ASP HBy 1.0 0.0 3.62 689 583 A 40 ASP H A 45 ARG H 1.0 0.0 4.74 690 584 A 46 SER HA A 40 ASP H 1.0 0.0 4.40 691 585 A 40 ASP H A 47 ARG HG2 1.0 0.0 4.14 692 585 A 47 ARG HG3 A 40 ASP H 1.0 0.0 4.14 693 586 A 40 ASP HA A 42 GLU H 1.0 0.0 5.04 694 587 A 40 ASP HA A 47 ARG HG2 1.0 0.0 4.35 695 587 A 47 ARG HG3 A 40 ASP HA 1.0 0.0 4.35 696 588 A 40 ASP HA A 47 ARG HDy 1.0 0.0 3.90 697 588 A 47 ARG HDx A 40 ASP HA 1.0 0.0 3.90 698 589 A 41 ARG H A 41 ARG HG2 1.0 0.0 4.32 699 589 A 41 ARG H A 41 ARG HG3 1.0 0.0 4.32 700 590 A 42 GLU H A 41 ARG H 1.0 0.0 4.34 701 591 A 41 ARG HA A 41 ARG HG2 1.0 0.0 3.64 702 591 A 41 ARG HG3 A 41 ARG HA 1.0 0.0 3.64 703 592 A 41 ARG HA A 41 ARG HD2 1.0 0.0 4.48 704 592 A 41 ARG HA A 41 ARG HD3 1.0 0.0 4.48 705 593 A 42 GLU H A 41 ARG HB2 1.0 0.0 4.70 706 594 A 42 GLU H A 41 ARG HB3 1.0 0.0 4.70 707 595 A 42 GLU H A 41 ARG HB3 1.0 0.0 4.06 708 595 A 42 GLU H A 41 ARG HB2 1.0 0.0 4.06 709 596 A 42 GLU H A 42 GLU HGy 1.0 0.0 4.73 710 597 A 42 GLU H A 42 GLU HGx 1.0 0.0 4.73 711 598 A 42 GLU H A 43 THR H 1.0 0.0 3.32 712 599 A 42 GLU H A 43 THR HG2% 1.0 0.0 4.81 713 600 A 42 GLU H A 44 GLY H 1.0 0.0 4.45 714 601 A 42 GLU HA A 42 GLU HGy 1.0 0.0 4.00 715 602 A 42 GLU HA A 42 GLU HGx 1.0 0.0 4.00 716 603 A 42 GLU HA A 42 GLU HGx 1.0 0.0 3.45 717 603 A 42 GLU HA A 42 GLU HGy 1.0 0.0 3.45 718 604 A 44 GLY H A 42 GLU HA 1.0 0.0 4.97 719 605 A 43 THR H A 42 GLU HBy 1.0 0.0 4.15 720 606 A 43 THR H A 42 GLU HBx 1.0 0.0 4.15 721 607 A 43 THR H A 42 GLU HBx 1.0 0.0 3.43 722 607 A 43 THR H A 42 GLU HBy 1.0 0.0 3.43 723 608 A 43 THR HG2% A 42 GLU HBx 1.0 0.0 3.55 724 608 A 43 THR HG2% A 42 GLU HBy 1.0 0.0 3.55 725 609 A 44 GLY H A 42 GLU HBx 1.0 0.0 5.02 726 609 A 44 GLY H A 42 GLU HBy 1.0 0.0 5.02 727 610 A 43 THR HG2% A 42 GLU HGx 1.0 0.0 4.88 728 610 A 43 THR HG2% A 42 GLU HGy 1.0 0.0 4.88 729 611 A 43 THR H A 43 THR HG2% 1.0 0.0 3.41 730 612 A 43 THR H A 44 GLY H 1.0 0.0 3.46 731 613 A 43 THR HG2% A 43 THR HA 1.0 0.0 3.19 732 614 A 44 GLY H A 43 THR HB 1.0 0.0 5.20 733 615 A 45 ARG H A 43 THR HB 1.0 0.0 4.20 734 616 A 43 THR HB A 45 ARG HG2 1.0 0.0 4.03 735 616 A 43 THR HB A 45 ARG HG3 1.0 0.0 4.03 736 617 A 43 THR HB A 45 ARG HD2 1.0 0.0 4.42 737 617 A 43 THR HB A 45 ARG HD3 1.0 0.0 4.42 738 618 A 43 THR HG2% A 44 GLY H 1.0 0.0 4.28 739 619 A 45 ARG H A 43 THR HG2% 1.0 0.0 4.46 740 620 A 43 THR HG2% A 45 ARG HD2 1.0 0.0 5.15 741 620 A 43 THR HG2% A 45 ARG HD3 1.0 0.0 5.15 742 621 A 45 ARG H A 44 GLY H 1.0 0.0 3.72 743 622 A 45 ARG H A 45 ARG HBx 1.0 0.0 4.02 744 623 A 45 ARG H A 45 ARG HBy 1.0 0.0 4.02 745 624 A 45 ARG H A 45 ARG HBy 1.0 0.0 3.52 746 624 A 45 ARG H A 45 ARG HBx 1.0 0.0 3.52 747 625 A 45 ARG H A 45 ARG HG2 1.0 0.0 3.23 748 625 A 45 ARG H A 45 ARG HG3 1.0 0.0 3.23 749 626 A 45 ARG H A 45 ARG HD2 1.0 0.0 5.05 750 626 A 45 ARG H A 45 ARG HD3 1.0 0.0 5.05 751 627 A 45 ARG HA A 45 ARG HG2 1.0 0.0 3.51 752 627 A 45 ARG HG3 A 45 ARG HA 1.0 0.0 3.51 753 628 A 45 ARG HA A 45 ARG HD2 1.0 0.0 4.45 754 628 A 45 ARG HD3 A 45 ARG HA 1.0 0.0 4.45 755 629 A 45 ARG HA A 46 SER H 1.0 0.0 3.20 756 630 A 45 ARG HD3 A 45 ARG HBx 1.0 0.0 4.08 757 630 A 45 ARG HBx A 45 ARG HD2 1.0 0.0 4.08 758 631 A 45 ARG HD3 A 45 ARG HBy 1.0 0.0 4.08 759 631 A 45 ARG HBy A 45 ARG HD2 1.0 0.0 4.08 760 632 A 45 ARG HBx A 45 ARG HD2 1.0 0.0 3.56 761 632 A 45 ARG HBy A 45 ARG HD2 1.0 0.0 3.56 762 632 A 45 ARG HD3 A 45 ARG HBy 1.0 0.0 3.56 763 632 A 45 ARG HD3 A 45 ARG HBx 1.0 0.0 3.56 764 633 A 46 SER H A 45 ARG HBy 1.0 0.0 4.02 765 633 A 45 ARG HBx A 46 SER H 1.0 0.0 4.02 766 634 A 46 SER H A 45 ARG HG2 1.0 0.0 4.12 767 634 A 45 ARG HG3 A 46 SER H 1.0 0.0 4.12 768 635 A 46 SER HBx A 46 SER H 1.0 0.0 3.75 769 636 A 46 SER H A 46 SER HBy 1.0 0.0 3.75 770 637 A 46 SER HA A 47 ARG H 1.0 0.0 3.28 771 638 A 48 GLY H A 46 SER HBy 1.0 0.0 4.50 772 638 A 46 SER HBx A 48 GLY H 1.0 0.0 4.50 773 639 A 47 ARG H A 47 ARG HG2 1.0 0.0 4.09 774 639 A 47 ARG H A 47 ARG HG3 1.0 0.0 4.09 775 640 A 47 ARG H A 48 GLY H 1.0 0.0 3.97 776 641 A 49 PHE H A 47 ARG H 1.0 0.0 4.90 777 642 A 47 ARG HA A 47 ARG HG2 1.0 0.0 3.45 778 642 A 47 ARG HG3 A 47 ARG HA 1.0 0.0 3.45 779 643 A 47 ARG HA A 47 ARG HDy 1.0 0.0 4.92 780 643 A 47 ARG HDx A 47 ARG HA 1.0 0.0 4.92 781 644 A 49 PHE HD% A 47 ARG HBx 1.0 0.0 4.14 782 645 A 49 PHE HE% A 47 ARG HBx 1.0 0.0 5.50 783 646 A 49 PHE HD% A 47 ARG HBy 1.0 0.0 4.63 784 647 A 49 PHE H A 48 GLY H 1.0 0.0 3.67 785 648 A 49 PHE HD% A 49 PHE H 1.0 0.0 4.20 786 649 A 49 PHE HA A 49 PHE HD% 1.0 0.0 4.22 787 650 A 50 GLY H A 49 PHE HA 1.0 0.0 3.31 788 651 A 50 GLY H A 49 PHE HBx 1.0 0.0 4.29 789 652 A 50 GLY H A 49 PHE HBy 1.0 0.0 4.29 790 653 A 50 GLY H A 49 PHE HBy 1.0 0.0 3.54 791 653 A 50 GLY H A 49 PHE HBx 1.0 0.0 3.54 792 654 A 50 GLY H A 49 PHE HD% 1.0 0.0 4.19 793 655 A 49 PHE HD% A 50 GLY HAy 1.0 0.0 5.38 794 656 A 50 GLY H A 51 PHE H 1.0 0.0 4.66 795 657 A 51 PHE H A 50 GLY HAy 1.0 0.0 3.56 796 658 A 51 PHE HD% A 50 GLY HAy 1.0 0.0 4.68 797 659 A 50 GLY HAx A 51 PHE H 1.0 0.0 3.39 798 660 A 51 PHE H A 51 PHE HBy 1.0 0.0 3.63 799 660 A 51 PHE H A 51 PHE HBx 1.0 0.0 3.63 800 661 A 51 PHE HD% A 51 PHE H 1.0 0.0 4.49 801 662 A 52 VAL H A 51 PHE H 1.0 0.0 4.81 802 663 A 51 PHE HA A 51 PHE HD% 1.0 0.0 4.11 803 664 A 52 VAL H A 51 PHE HA 1.0 0.0 3.12 804 665 A 52 VAL H A 51 PHE HBy 1.0 0.0 4.08 805 665 A 52 VAL H A 51 PHE HBx 1.0 0.0 4.08 806 666 A 52 VAL H A 51 PHE HD% 1.0 0.0 4.58 807 667 A 82 ALA HB% A 51 PHE HD% 1.0 0.0 4.16 808 668 A 52 VAL H A 52 VAL HB 1.0 0.0 4.06 809 669 A 52 VAL H A 52 VAL HGx% 1.0 0.0 4.59 810 670 A 52 VAL H A 52 VAL HGy% 1.0 0.0 4.59 811 671 A 52 VAL H A 53 THR H 1.0 0.0 4.58 812 672 A 52 VAL HA A 52 VAL HGx% 1.0 0.0 3.55 813 673 A 52 VAL HA A 52 VAL HGy% 1.0 0.0 3.55 814 674 A 52 VAL HA A 53 THR H 1.0 0.0 3.02 815 675 A 53 THR H A 52 VAL HGx% 1.0 0.0 4.38 816 676 A 54 PHE HE% A 52 VAL HGx% 1.0 0.0 5.18 817 677 A 53 THR H A 52 VAL HGy% 1.0 0.0 4.38 818 678 A 54 PHE HE% A 52 VAL HGy% 1.0 0.0 5.18 819 679 A 53 THR HB A 53 THR H 1.0 0.0 3.26 820 680 A 53 THR HG2% A 53 THR H 1.0 0.0 4.09 821 681 A 53 THR HG2% A 53 THR HA 1.0 0.0 3.47 822 682 A 54 PHE H A 53 THR HA 1.0 0.0 3.09 823 683 A 53 THR HA A 54 PHE HBx 1.0 0.0 4.52 824 684 A 53 THR HG2% A 54 PHE H 1.0 0.0 3.69 825 685 A 53 THR HG2% A 54 PHE HBy 1.0 0.0 5.20 826 686 A 54 PHE H A 54 PHE HBx 1.0 0.0 4.20 827 687 A 54 PHE H A 54 PHE HBy 1.0 0.0 3.66 828 688 A 54 PHE H A 54 PHE HD% 1.0 0.0 3.91 829 689 A 54 PHE HD% A 54 PHE HA 1.0 0.0 4.05 830 690 A 54 PHE HA A 55 LYS H 1.0 0.0 3.24 831 691 A 54 PHE HA A 56 ASP H 1.0 0.0 4.72 832 692 A 55 LYS H A 54 PHE HBx 1.0 0.0 3.90 833 693 A 54 PHE HBx A 56 ASP H 1.0 0.0 4.20 834 694 A 59 ALA HB% A 54 PHE HBx 1.0 0.0 4.64 835 695 A 54 PHE HBx A 60 MET H 1.0 0.0 4.75 836 696 A 55 LYS H A 54 PHE HBy 1.0 0.0 4.15 837 697 A 54 PHE HBy A 56 ASP H 1.0 0.0 4.04 838 698 A 54 PHE HBy A 60 MET HBy 1.0 0.0 4.59 839 698 A 60 MET HBx A 54 PHE HBy 1.0 0.0 4.59 840 699 A 54 PHE HD% A 55 LYS H 1.0 0.0 4.48 841 700 A 54 PHE HD% A 56 ASP H 1.0 0.0 4.69 842 701 A 54 PHE HD% A 59 ALA HB% 1.0 0.0 3.34 843 702 A 54 PHE HD% A 60 MET HA 1.0 0.0 3.99 844 703 A 54 PHE HD% A 60 MET HBy 1.0 0.0 5.34 845 703 A 60 MET HBx A 54 PHE HD% 1.0 0.0 5.34 846 704 A 54 PHE HD% A 60 MET HGy 1.0 0.0 4.74 847 705 A 54 PHE HD% A 60 MET HGx 1.0 0.0 4.74 848 706 A 63 ALA HB% A 54 PHE HD% 1.0 0.0 4.03 849 707 A 54 PHE HE% A 60 MET HA 1.0 0.0 4.29 850 708 A 54 PHE HE% A 60 MET HGx 1.0 0.0 5.20 851 708 A 54 PHE HE% A 60 MET HGy 1.0 0.0 5.20 852 709 A 63 ALA HB% A 54 PHE HE% 1.0 0.0 3.48 853 710 A 55 LYS H A 55 LYS HBx 1.0 0.0 3.57 854 711 A 55 LYS H A 55 LYS HBy 1.0 0.0 3.57 855 712 A 55 LYS H A 55 LYS HBy 1.0 0.0 3.12 856 712 A 55 LYS H A 55 LYS HBx 1.0 0.0 3.12 857 713 A 55 LYS H A 56 ASP H 1.0 0.0 3.48 858 714 A 55 LYS HA A 55 LYS HGx 1.0 0.0 3.62 859 714 A 55 LYS HA A 55 LYS HGy 1.0 0.0 3.62 860 715 A 55 LYS HA A 55 LYS HDy 1.0 0.0 4.40 861 715 A 55 LYS HA A 55 LYS HDx 1.0 0.0 4.40 862 716 A 56 ASP H A 55 LYS HBx 1.0 0.0 4.07 863 717 A 56 ASP H A 55 LYS HBy 1.0 0.0 4.07 864 718 A 59 ALA HB% A 56 ASP H 1.0 0.0 3.81 865 719 A 57 GLU H A 56 ASP HA 1.0 0.0 2.97 866 720 A 57 GLU H A 57 GLU HBx 1.0 0.0 3.66 867 721 A 57 GLU H A 57 GLU HBy 1.0 0.0 3.66 868 722 A 57 GLU H A 57 GLU HBy 1.0 0.0 3.05 869 722 A 57 GLU H A 57 GLU HBx 1.0 0.0 3.05 870 723 A 57 GLU H A 57 GLU HG2 1.0 0.0 4.19 871 723 A 57 GLU H A 57 GLU HG3 1.0 0.0 4.19 872 724 A 57 GLU H A 58 LYS H 1.0 0.0 3.57 873 725 A 57 GLU H A 58 LYS HBy 1.0 0.0 4.74 874 725 A 57 GLU H A 58 LYS HBx 1.0 0.0 4.74 875 726 A 57 GLU HA A 57 GLU HG2 1.0 0.0 3.57 876 726 A 57 GLU HA A 57 GLU HG3 1.0 0.0 3.57 877 727 A 57 GLU HA A 60 MET H 1.0 0.0 4.63 878 728 A 57 GLU HA A 60 MET HBx 1.0 0.0 4.31 879 729 A 57 GLU HA A 60 MET HBy 1.0 0.0 4.31 880 730 A 57 GLU HA A 60 MET HE% 1.0 0.0 4.07 881 731 A 57 GLU HBx A 58 LYS H 1.0 0.0 4.10 882 732 A 58 LYS H A 57 GLU HBy 1.0 0.0 4.10 883 733 A 58 LYS H A 57 GLU HBy 1.0 0.0 3.50 884 733 A 57 GLU HBx A 58 LYS H 1.0 0.0 3.50 885 734 A 59 ALA H A 57 GLU HBy 1.0 0.0 5.34 886 734 A 57 GLU HBx A 59 ALA H 1.0 0.0 5.34 887 735 A 60 MET HE% A 57 GLU HBy 1.0 0.0 4.69 888 735 A 60 MET HE% A 57 GLU HBx 1.0 0.0 4.69 889 736 A 60 MET H A 57 GLU HG2 1.0 0.0 5.36 890 736 A 57 GLU HG3 A 60 MET H 1.0 0.0 5.36 891 737 A 58 LYS H A 58 LYS HBx 1.0 0.0 3.50 892 738 A 58 LYS H A 58 LYS HBy 1.0 0.0 3.50 893 739 A 58 LYS H A 58 LYS HBy 1.0 0.0 2.74 894 739 A 58 LYS H A 58 LYS HBx 1.0 0.0 2.74 895 740 A 58 LYS H A 58 LYS HG2 1.0 0.0 4.08 896 740 A 58 LYS H A 58 LYS HG3 1.0 0.0 4.08 897 741 A 58 LYS H A 59 ALA H 1.0 0.0 3.37 898 742 A 58 LYS HA A 58 LYS HG2 1.0 0.0 3.55 899 742 A 58 LYS HG3 A 58 LYS HA 1.0 0.0 3.55 900 743 A 58 LYS HA A 58 LYS HD2 1.0 0.0 5.25 901 743 A 58 LYS HA A 58 LYS HD3 1.0 0.0 5.25 902 744 A 58 LYS HA A 61 ARG H 1.0 0.0 4.16 903 745 A 58 LYS HA A 62 ASP H 1.0 0.0 4.48 904 746 A 59 ALA H A 58 LYS HBy 1.0 0.0 3.34 905 746 A 58 LYS HBx A 59 ALA H 1.0 0.0 3.34 906 747 A 58 LYS HE2 A 58 LYS HG2 1.0 0.0 3.52 907 747 A 58 LYS HE3 A 58 LYS HG2 1.0 0.0 3.52 908 747 A 58 LYS HG3 A 58 LYS HE2 1.0 0.0 3.52 909 747 A 58 LYS HG3 A 58 LYS HE3 1.0 0.0 3.52 910 748 A 62 ASP H A 58 LYS HG2 1.0 0.0 5.18 911 748 A 58 LYS HG3 A 62 ASP H 1.0 0.0 5.18 912 749 A 59 ALA HB% A 59 ALA H 1.0 0.0 3.02 913 750 A 60 MET H A 59 ALA H 1.0 0.0 3.36 914 751 A 59 ALA H A 60 MET HBy 1.0 0.0 5.34 915 751 A 60 MET HBx A 59 ALA H 1.0 0.0 5.34 916 752 A 59 ALA H A 61 ARG H 1.0 0.0 4.86 917 753 A 62 ASP H A 59 ALA HA 1.0 0.0 4.67 918 754 A 63 ALA H A 59 ALA HA 1.0 0.0 4.69 919 755 A 59 ALA HB% A 60 MET H 1.0 0.0 3.46 920 756 A 60 MET HBx A 60 MET H 1.0 0.0 3.52 921 757 A 60 MET H A 60 MET HBy 1.0 0.0 3.52 922 758 A 60 MET H A 60 MET HGx 1.0 0.0 4.50 923 758 A 60 MET H A 60 MET HGy 1.0 0.0 4.50 924 759 A 60 MET HE% A 60 MET H 1.0 0.0 4.40 925 760 A 60 MET H A 61 ARG H 1.0 0.0 3.59 926 761 A 63 ALA H A 60 MET H 1.0 0.0 4.89 927 762 A 60 MET HA A 60 MET HGx 1.0 0.0 3.69 928 762 A 60 MET HA A 60 MET HGy 1.0 0.0 3.69 929 763 A 63 ALA H A 60 MET HA 1.0 0.0 4.20 930 764 A 63 ALA HB% A 60 MET HA 1.0 0.0 3.62 931 765 A 61 ARG H A 60 MET HBy 1.0 0.0 3.68 932 765 A 60 MET HBx A 61 ARG H 1.0 0.0 3.68 933 766 A 64 ILE HD1% A 60 MET HGy 1.0 0.0 4.34 934 767 A 64 ILE HD1% A 60 MET HGx 1.0 0.0 4.34 935 768 A 61 ARG H A 60 MET HGx 1.0 0.0 4.77 936 768 A 60 MET HGy A 61 ARG H 1.0 0.0 4.77 937 769 A 64 ILE HD1% A 60 MET HGx 1.0 0.0 3.78 938 769 A 64 ILE HD1% A 60 MET HGy 1.0 0.0 3.78 939 770 A 60 MET HE% A 61 ARG H 1.0 0.0 3.91 940 771 A 60 MET HE% A 61 ARG HA 1.0 0.0 4.37 941 772 A 60 MET HE% A 61 ARG HGx 1.0 0.0 3.76 942 772 A 60 MET HE% A 61 ARG HGy 1.0 0.0 3.76 943 773 A 60 MET HE% A 61 ARG HD2 1.0 0.0 4.25 944 773 A 60 MET HE% A 61 ARG HD3 1.0 0.0 4.25 945 774 A 60 MET HE% A 64 ILE HD1% 1.0 0.0 3.35 946 775 A 61 ARG H A 61 ARG HGx 1.0 0.0 3.71 947 775 A 61 ARG H A 61 ARG HGy 1.0 0.0 3.71 948 776 A 61 ARG H A 61 ARG HD2 1.0 0.0 4.51 949 776 A 61 ARG H A 61 ARG HD3 1.0 0.0 4.51 950 777 A 61 ARG H A 62 ASP H 1.0 0.0 3.47 951 778 A 63 ALA H A 61 ARG H 1.0 0.0 4.82 952 779 A 63 ALA HB% A 61 ARG H 1.0 0.0 5.03 953 780 A 64 ILE HD1% A 61 ARG H 1.0 0.0 5.34 954 781 A 61 ARG HA A 61 ARG HGx 1.0 0.0 3.58 955 781 A 61 ARG HA A 61 ARG HGy 1.0 0.0 3.58 956 782 A 61 ARG HA A 61 ARG HD2 1.0 0.0 3.70 957 782 A 61 ARG HA A 61 ARG HD3 1.0 0.0 3.70 958 783 A 63 ALA H A 61 ARG HA 1.0 0.0 4.44 959 784 A 61 ARG HA A 64 ILE H 1.0 0.0 4.21 960 785 A 61 ARG HA A 64 ILE HB 1.0 0.0 3.41 961 786 A 61 ARG HA A 64 ILE HG2% 1.0 0.0 4.76 962 787 A 64 ILE HD1% A 61 ARG HA 1.0 0.0 3.57 963 788 A 61 ARG HA A 65 GLU H 1.0 0.0 4.63 964 789 A 61 ARG HBx A 61 ARG HD2 1.0 0.0 3.82 965 789 A 61 ARG HD3 A 61 ARG HBx 1.0 0.0 3.82 966 790 A 62 ASP H A 61 ARG HBx 1.0 0.0 3.73 967 791 A 61 ARG HBy A 61 ARG HD2 1.0 0.0 3.82 968 791 A 61 ARG HD3 A 61 ARG HBy 1.0 0.0 3.82 969 792 A 62 ASP H A 61 ARG HBy 1.0 0.0 3.73 970 793 A 62 ASP H A 61 ARG HGx 1.0 0.0 5.34 971 793 A 62 ASP H A 61 ARG HGy 1.0 0.0 5.34 972 794 A 64 ILE HD1% A 61 ARG HD2 1.0 0.0 4.13 973 794 A 64 ILE HD1% A 61 ARG HD3 1.0 0.0 4.13 974 795 A 62 ASP H A 62 ASP HBx 1.0 0.0 3.67 975 796 A 62 ASP H A 62 ASP HBy 1.0 0.0 3.67 976 797 A 63 ALA H A 62 ASP H 1.0 0.0 3.43 977 798 A 65 GLU H A 62 ASP HA 1.0 0.0 4.25 978 799 A 62 ASP HA A 66 GLY H 1.0 0.0 4.92 979 800 A 63 ALA H A 62 ASP HBx 1.0 0.0 4.08 980 801 A 63 ALA H A 62 ASP HBy 1.0 0.0 4.08 981 802 A 63 ALA HB% A 63 ALA H 1.0 0.0 3.07 982 803 A 63 ALA H A 64 ILE H 1.0 0.0 3.53 983 804 A 63 ALA H A 64 ILE HA 1.0 0.0 5.17 984 805 A 63 ALA H A 64 ILE HB 1.0 0.0 5.04 985 806 A 64 ILE HD1% A 63 ALA H 1.0 0.0 4.85 986 807 A 63 ALA H A 65 GLU H 1.0 0.0 4.57 987 808 A 63 ALA HA A 64 ILE HA 1.0 0.0 5.05 988 809 A 63 ALA HA A 66 GLY H 1.0 0.0 4.80 989 810 A 63 ALA HB% A 64 ILE H 1.0 0.0 3.59 990 811 A 63 ALA HB% A 64 ILE HA 1.0 0.0 3.87 991 812 A 63 ALA HB% A 66 GLY H 1.0 0.0 5.42 992 813 A 64 ILE H A 64 ILE HB 1.0 0.0 3.17 993 814 A 64 ILE H A 64 ILE HG2% 1.0 0.0 4.03 994 815 A 64 ILE H A 64 ILE HG1x 1.0 0.0 3.84 995 816 A 64 ILE H A 64 ILE HG1y 1.0 0.0 3.23 996 817 A 64 ILE HD1% A 64 ILE H 1.0 0.0 3.59 997 818 A 64 ILE H A 65 GLU H 1.0 0.0 3.50 998 819 A 64 ILE H A 66 GLY H 1.0 0.0 4.82 999 820 A 79 VAL HGx% A 64 ILE H 1.0 0.0 4.21 1000 821 A 64 ILE HG2% A 64 ILE HA 1.0 0.0 3.39 1001 822 A 64 ILE HA A 64 ILE HG1x 1.0 0.0 3.81 1002 823 A 64 ILE HA A 64 ILE HG1y 1.0 0.0 4.06 1003 824 A 64 ILE HD1% A 64 ILE HA 1.0 0.0 4.27 1004 825 A 64 ILE HA A 67 MET H 1.0 0.0 4.49 1005 826 A 64 ILE HA A 68 ASN H 1.0 0.0 5.50 1006 827 A 64 ILE HA A 79 VAL HB 1.0 0.0 4.07 1007 828 A 79 VAL HGx% A 64 ILE HA 1.0 0.0 3.29 1008 829 A 64 ILE HD1% A 64 ILE HB 1.0 0.0 3.42 1009 830 A 64 ILE HB A 65 GLU H 1.0 0.0 3.33 1010 831 A 79 VAL HGx% A 64 ILE HB 1.0 0.0 4.60 1011 832 A 64 ILE HG2% A 65 GLU H 1.0 0.0 3.86 1012 833 A 64 ILE HG2% A 65 GLU HA 1.0 0.0 4.10 1013 834 A 64 ILE HG2% A 68 ASN H 1.0 0.0 5.11 1014 835 A 64 ILE HG2% A 79 VAL HB 1.0 0.0 4.09 1015 836 A 64 ILE HG2% A 80 ASN HA 1.0 0.0 3.60 1016 837 A 64 ILE HG2% A 81 GLU H 1.0 0.0 4.53 1017 838 A 79 VAL HGx% A 64 ILE HG1x 1.0 0.0 3.57 1018 839 A 64 ILE HG1x A 80 ASN HA 1.0 0.0 4.19 1019 840 A 79 VAL HGx% A 64 ILE HG1y 1.0 0.0 4.05 1020 841 A 64 ILE HD1% A 80 ASN HA 1.0 0.0 4.36 1021 842 A 64 ILE HD1% A 81 GLU H 1.0 0.0 3.73 1022 843 A 64 ILE HD1% A 81 GLU HA 1.0 0.0 3.85 1023 844 A 64 ILE HD1% A 81 GLU HBx 1.0 0.0 4.02 1024 844 A 64 ILE HD1% A 81 GLU HBy 1.0 0.0 4.02 1025 845 A 64 ILE HD1% A 82 ALA H 1.0 0.0 4.62 1026 846 A 82 ALA HB% A 64 ILE HD1% 1.0 0.0 5.42 1027 847 A 65 GLU H A 65 GLU HB3 1.0 0.0 2.97 1028 847 A 65 GLU H A 65 GLU HB2 1.0 0.0 2.97 1029 848 A 65 GLU H A 65 GLU HGx 1.0 0.0 4.68 1030 849 A 65 GLU H A 65 GLU HGy 1.0 0.0 4.68 1031 850 A 65 GLU H A 65 GLU HGy 1.0 0.0 4.01 1032 850 A 65 GLU H A 65 GLU HGx 1.0 0.0 4.01 1033 851 A 65 GLU H A 66 GLY H 1.0 0.0 3.39 1034 852 A 65 GLU HA A 65 GLU HGx 1.0 0.0 4.06 1035 853 A 65 GLU HA A 65 GLU HGy 1.0 0.0 4.06 1036 854 A 65 GLU HA A 65 GLU HGy 1.0 0.0 3.43 1037 854 A 65 GLU HA A 65 GLU HGx 1.0 0.0 3.43 1038 855 A 67 MET H A 65 GLU HA 1.0 0.0 4.81 1039 856 A 68 ASN H A 65 GLU HA 1.0 0.0 4.27 1040 857 A 66 GLY H A 65 GLU HB3 1.0 0.0 4.22 1041 857 A 66 GLY H A 65 GLU HB2 1.0 0.0 4.22 1042 858 A 66 GLY H A 65 GLU HGy 1.0 0.0 4.87 1043 858 A 66 GLY H A 65 GLU HGx 1.0 0.0 4.87 1044 859 A 66 GLY H A 67 MET H 1.0 0.0 3.47 1045 860 A 67 MET H A 68 ASN H 1.0 0.0 3.23 1046 861 A 79 VAL HGx% A 67 MET H 1.0 0.0 5.01 1047 862 A 79 VAL HGy% A 67 MET H 1.0 0.0 4.60 1048 863 A 67 MET HA A 67 MET HE% 1.0 0.0 4.75 1049 864 A 67 MET HA A 70 GLN H 1.0 0.0 4.55 1050 865 A 67 MET HA A 70 GLN HBx 1.0 0.0 5.09 1051 866 A 67 MET HA A 70 GLN HBy 1.0 0.0 4.72 1052 867 A 77 ILE HD1% A 67 MET HA 1.0 0.0 4.71 1053 868 A 68 ASN H A 68 ASN HBx 1.0 0.0 3.35 1054 869 A 68 ASN H A 68 ASN HBy 1.0 0.0 3.35 1055 870 A 68 ASN H A 68 ASN HD21 1.0 0.0 4.91 1056 871 A 68 ASN H A 69 GLY H 1.0 0.0 4.74 1057 872 A 68 ASN H A 79 VAL HB 1.0 0.0 4.55 1058 873 A 79 VAL HGy% A 68 ASN H 1.0 0.0 4.30 1059 874 A 69 GLY H A 68 ASN HA 1.0 0.0 3.16 1060 875 A 70 GLN H A 68 ASN HA 1.0 0.0 4.45 1061 876 A 68 ASN HA A 78 THR HA 1.0 0.0 4.37 1062 877 A 68 ASN HA A 79 VAL H 1.0 0.0 3.66 1063 878 A 79 VAL HB A 68 ASN HA 1.0 0.0 4.00 1064 879 A 79 VAL HGy% A 68 ASN HA 1.0 0.0 3.47 1065 880 A 69 GLY H A 68 ASN HBx 1.0 0.0 4.69 1066 881 A 69 GLY H A 68 ASN HBy 1.0 0.0 4.69 1067 882 A 70 GLN H A 69 GLY H 1.0 0.0 3.55 1068 883 A 69 GLY H A 78 THR HA 1.0 0.0 3.96 1069 884 A 69 GLY H A 79 VAL H 1.0 0.0 4.38 1070 885 A 79 VAL HB A 69 GLY H 1.0 0.0 5.50 1071 886 A 79 VAL HGy% A 69 GLY H 1.0 0.0 4.34 1072 887 A 70 GLN HA A 69 GLY HAx 1.0 0.0 4.64 1073 887 A 69 GLY HAy A 70 GLN HA 1.0 0.0 4.64 1074 888 A 70 GLN H A 70 GLN HBx 1.0 0.0 3.85 1075 889 A 70 GLN H A 70 GLN HBy 1.0 0.0 3.77 1076 890 A 70 GLN H A 70 GLN HGx 1.0 0.0 4.45 1077 891 A 70 GLN H A 70 GLN HGy 1.0 0.0 4.45 1078 892 A 70 GLN H A 71 ASP H 1.0 0.0 4.75 1079 893 A 70 GLN H A 77 ILE H 1.0 0.0 4.61 1080 894 A 77 ILE HD1% A 70 GLN H 1.0 0.0 4.67 1081 895 A 79 VAL HGy% A 70 GLN H 1.0 0.0 5.50 1082 896 A 70 GLN HA A 71 ASP H 1.0 0.0 3.06 1083 897 A 70 GLN HA A 71 ASP HA 1.0 0.0 4.76 1084 898 A 70 GLN HBx A 71 ASP H 1.0 0.0 4.02 1085 899 A 70 GLN HBy A 71 ASP H 1.0 0.0 4.02 1086 900 A 70 GLN HGx A 71 ASP H 1.0 0.0 4.80 1087 901 A 70 GLN HGy A 71 ASP H 1.0 0.0 4.80 1088 902 A 71 ASP H A 71 ASP HBx 1.0 0.0 3.80 1089 903 A 71 ASP H A 71 ASP HBy 1.0 0.0 3.80 1090 904 A 71 ASP H A 71 ASP HBy 1.0 0.0 3.27 1091 904 A 71 ASP H A 71 ASP HBx 1.0 0.0 3.27 1092 905 A 71 ASP H A 72 LEU H 1.0 0.0 4.89 1093 906 A 71 ASP H A 76 ASN HA 1.0 0.0 5.50 1094 907 A 71 ASP HA A 72 LEU H 1.0 0.0 3.17 1095 908 A 71 ASP HBx A 72 LEU H 1.0 0.0 4.64 1096 909 A 72 LEU H A 71 ASP HBy 1.0 0.0 4.64 1097 910 A 72 LEU H A 72 LEU HBx 1.0 0.0 4.02 1098 911 A 72 LEU H A 72 LEU HBy 1.0 0.0 4.02 1099 912 A 72 LEU H A 72 LEU HDy% 1.0 0.0 5.07 1100 912 A 72 LEU HDx% A 72 LEU H 1.0 0.0 5.07 1101 913 A 72 LEU H A 73 ASP H 1.0 0.0 5.03 1102 914 A 72 LEU H A 74 GLY H 1.0 0.0 4.60 1103 915 A 75 ARG H A 72 LEU H 1.0 0.0 3.66 1104 916 A 72 LEU H A 76 ASN HA 1.0 0.0 4.16 1105 917 A 77 ILE H A 72 LEU H 1.0 0.0 4.57 1106 918 A 77 ILE HG2% A 72 LEU H 1.0 0.0 3.97 1107 919 A 72 LEU HA A 72 LEU HG 1.0 0.0 4.16 1108 920 A 72 LEU HDx% A 72 LEU HA 1.0 0.0 4.37 1109 921 A 72 LEU HA A 72 LEU HDy% 1.0 0.0 4.37 1110 922 A 72 LEU HA A 72 LEU HDy% 1.0 0.0 3.13 1111 922 A 72 LEU HDx% A 72 LEU HA 1.0 0.0 3.13 1112 923 A 73 ASP H A 72 LEU HA 1.0 0.0 3.03 1113 924 A 72 LEU HA A 73 ASP HA 1.0 0.0 4.58 1114 925 A 74 GLY H A 72 LEU HA 1.0 0.0 4.56 1115 926 A 73 ASP H A 72 LEU HG 1.0 0.0 4.50 1116 927 A 73 ASP H A 72 LEU HDy% 1.0 0.0 3.68 1117 927 A 72 LEU HDx% A 73 ASP H 1.0 0.0 3.68 1118 928 A 73 ASP HA A 72 LEU HDy% 1.0 0.0 4.10 1119 928 A 72 LEU HDx% A 73 ASP HA 1.0 0.0 4.10 1120 929 A 72 LEU HDx% A 73 ASP HBy 1.0 0.0 4.65 1121 929 A 72 LEU HDy% A 73 ASP HBy 1.0 0.0 4.65 1122 929 A 73 ASP HBx A 72 LEU HDy% 1.0 0.0 4.65 1123 929 A 72 LEU HDx% A 73 ASP HBx 1.0 0.0 4.65 1124 930 A 74 GLY H A 72 LEU HDy% 1.0 0.0 5.44 1125 930 A 72 LEU HDx% A 74 GLY H 1.0 0.0 5.44 1126 931 A 73 ASP H A 74 GLY H 1.0 0.0 3.72 1127 932 A 74 GLY H A 73 ASP HA 1.0 0.0 3.53 1128 933 A 74 GLY H A 73 ASP HBx 1.0 0.0 5.25 1129 934 A 74 GLY H A 73 ASP HBy 1.0 0.0 5.25 1130 935 A 75 ARG H A 74 GLY H 1.0 0.0 3.35 1131 936 A 75 ARG H A 75 ARG HGy 1.0 0.0 4.73 1132 936 A 75 ARG HGx A 75 ARG H 1.0 0.0 4.73 1133 937 A 75 ARG H A 75 ARG HD2 1.0 0.0 4.93 1134 937 A 75 ARG HD3 A 75 ARG H 1.0 0.0 4.93 1135 938 A 75 ARG H A 76 ASN H 1.0 0.0 4.45 1136 939 A 77 ILE HG2% A 75 ARG H 1.0 0.0 5.02 1137 940 A 75 ARG HA A 75 ARG HGy 1.0 0.0 3.65 1138 940 A 75 ARG HGx A 75 ARG HA 1.0 0.0 3.65 1139 941 A 75 ARG HA A 75 ARG HD2 1.0 0.0 3.53 1140 941 A 75 ARG HD3 A 75 ARG HA 1.0 0.0 3.53 1141 942 A 76 ASN H A 75 ARG HA 1.0 0.0 2.92 1142 943 A 75 ARG HBx A 76 ASN H 1.0 0.0 4.25 1143 944 A 76 ASN H A 75 ARG HBy 1.0 0.0 4.25 1144 945 A 76 ASN H A 75 ARG HBy 1.0 0.0 3.57 1145 945 A 75 ARG HBx A 76 ASN H 1.0 0.0 3.57 1146 946 A 76 ASN H A 75 ARG HD2 1.0 0.0 4.35 1147 946 A 75 ARG HD3 A 76 ASN H 1.0 0.0 4.35 1148 947 A 76 ASN H A 76 ASN HBx 1.0 0.0 3.68 1149 948 A 76 ASN H A 76 ASN HBy 1.0 0.0 3.68 1150 949 A 76 ASN H A 76 ASN HBy 1.0 0.0 3.11 1151 949 A 76 ASN H A 76 ASN HBx 1.0 0.0 3.11 1152 950 A 77 ILE H A 76 ASN H 1.0 0.0 4.71 1153 951 A 76 ASN HA A 76 ASN HD22 1.0 0.0 4.10 1154 951 A 76 ASN HA A 76 ASN HD21 1.0 0.0 4.10 1155 952 A 77 ILE H A 76 ASN HA 1.0 0.0 3.09 1156 953 A 77 ILE HG2% A 76 ASN HA 1.0 0.0 4.31 1157 954 A 77 ILE H A 76 ASN HBx 1.0 0.0 4.50 1158 955 A 77 ILE H A 76 ASN HBy 1.0 0.0 4.50 1159 956 A 77 ILE HG2% A 77 ILE H 1.0 0.0 3.59 1160 957 A 77 ILE H A 77 ILE HG1y 1.0 0.0 3.82 1161 958 A 77 ILE H A 77 ILE HG1x 1.0 0.0 3.82 1162 959 A 77 ILE HD1% A 77 ILE H 1.0 0.0 4.20 1163 960 A 78 THR H A 77 ILE H 1.0 0.0 5.04 1164 961 A 79 VAL HGy% A 77 ILE H 1.0 0.0 5.50 1165 962 A 77 ILE HA A 77 ILE HG2% 1.0 0.0 3.43 1166 963 A 77 ILE HA A 77 ILE HD1% 1.0 0.0 4.39 1167 964 A 78 THR H A 77 ILE HA 1.0 0.0 3.12 1168 965 A 77 ILE HB A 77 ILE HD1% 1.0 0.0 3.64 1169 966 A 77 ILE HB A 78 THR H 1.0 0.0 3.32 1170 967 A 79 VAL HGy% A 77 ILE HB 1.0 0.0 4.84 1171 968 A 77 ILE HG2% A 77 ILE HG1y 1.0 0.0 3.88 1172 969 A 77 ILE HG2% A 77 ILE HG1x 1.0 0.0 3.88 1173 970 A 78 THR H A 77 ILE HG2% 1.0 0.0 4.17 1174 971 A 78 THR H A 77 ILE HD1% 1.0 0.0 4.62 1175 972 A 79 VAL HGy% A 77 ILE HD1% 1.0 0.0 3.65 1176 973 A 78 THR H A 78 THR HB 1.0 0.0 3.68 1177 974 A 78 THR H A 78 THR HG2% 1.0 0.0 4.10 1178 975 A 78 THR H A 79 VAL H 1.0 0.0 4.80 1179 976 A 79 VAL HGy% A 78 THR H 1.0 0.0 4.68 1180 977 A 78 THR HG2% A 78 THR HA 1.0 0.0 3.64 1181 978 A 78 THR HA A 79 VAL H 1.0 0.0 3.04 1182 979 A 79 VAL HA A 78 THR HA 1.0 0.0 4.97 1183 980 A 79 VAL HGy% A 78 THR HA 1.0 0.0 4.46 1184 981 A 78 THR HB A 79 VAL H 1.0 0.0 4.34 1185 982 A 78 THR HG2% A 79 VAL H 1.0 0.0 3.81 1186 983 A 79 VAL HA A 78 THR HG2% 1.0 0.0 4.41 1187 984 A 80 ASN H A 78 THR HG2% 1.0 0.0 5.01 1188 985 A 79 VAL HB A 79 VAL H 1.0 0.0 3.76 1189 986 A 79 VAL HGy% A 79 VAL H 1.0 0.0 3.70 1190 987 A 80 ASN H A 79 VAL H 1.0 0.0 4.68 1191 988 A 79 VAL HGx% A 79 VAL HA 1.0 0.0 3.48 1192 989 A 79 VAL HA A 79 VAL HGy% 1.0 0.0 3.77 1193 990 A 80 ASN H A 79 VAL HA 1.0 0.0 2.96 1194 991 A 79 VAL HA A 80 ASN HA 1.0 0.0 5.33 1195 992 A 80 ASN H A 79 VAL HB 1.0 0.0 4.38 1196 993 A 79 VAL HGx% A 80 ASN H 1.0 0.0 3.41 1197 994 A 81 GLU HA A 80 ASN H 1.0 0.0 5.36 1198 995 A 80 ASN HA A 81 GLU H 1.0 0.0 3.30 1199 996 A 81 GLU H A 80 ASN HBx 1.0 0.0 4.10 1200 997 A 81 GLU H A 80 ASN HBy 1.0 0.0 4.10 1201 998 A 81 GLU H A 81 GLU HBy 1.0 0.0 3.61 1202 999 A 81 GLU H A 81 GLU HBx 1.0 0.0 3.61 1203 1000 A 81 GLU H A 81 GLU HBx 1.0 0.0 3.04 1204 1000 A 81 GLU H A 81 GLU HBy 1.0 0.0 3.04 1205 1001 A 81 GLU H A 81 GLU HGy 1.0 0.0 4.72 1206 1002 A 81 GLU H A 81 GLU HGx 1.0 0.0 4.72 1207 1003 A 82 ALA H A 81 GLU H 1.0 0.0 4.77 1208 1004 A 81 GLU H A 83 GLN H 1.0 0.0 5.50 1209 1005 A 81 GLU HA A 81 GLU HGx 1.0 0.0 3.57 1210 1005 A 81 GLU HA A 81 GLU HGy 1.0 0.0 3.57 1211 1006 A 81 GLU HA A 82 ALA H 1.0 0.0 3.02 1212 1007 A 82 ALA HB% A 81 GLU HA 1.0 0.0 4.36 1213 1008 A 82 ALA H A 81 GLU HBy 1.0 0.0 4.51 1214 1009 A 82 ALA H A 81 GLU HBx 1.0 0.0 4.51 1215 1010 A 82 ALA H A 81 GLU HBx 1.0 0.0 3.96 1216 1010 A 82 ALA H A 81 GLU HBy 1.0 0.0 3.96 1217 1011 A 83 GLN H A 81 GLU HBx 1.0 0.0 4.39 1218 1011 A 81 GLU HBy A 83 GLN H 1.0 0.0 4.39 1219 1012 A 82 ALA H A 81 GLU HGx 1.0 0.0 3.81 1220 1012 A 82 ALA H A 81 GLU HGy 1.0 0.0 3.81 1221 1013 A 82 ALA HB% A 82 ALA H 1.0 0.0 3.23 1222 1014 A 82 ALA HA A 83 GLN H 1.0 0.0 3.56 1223 1015 A 82 ALA HB% A 83 GLN H 1.0 0.0 4.10 1224 1016 A 83 GLN H A 83 GLN HBx 1.0 0.0 3.63 1225 1016 A 83 GLN H A 83 GLN HBy 1.0 0.0 3.63 1226 1017 A 83 GLN H A 83 GLN HG2 1.0 0.0 4.28 1227 1017 A 83 GLN H A 83 GLN HG3 1.0 0.0 4.28 1228 1018 A 83 GLN HA A 83 GLN HG2 1.0 0.0 3.87 1229 1018 A 83 GLN HG3 A 83 GLN HA 1.0 0.0 3.87 1230 1019 A 84 SER H A 83 GLN HG2 1.0 0.0 4.96 1231 1019 A 83 GLN HG3 A 84 SER H 1.0 0.0 4.96 1232 1020 A 84 SER H A 84 SER HB2 1.0 0.0 3.83 1233 1020 A 84 SER H A 84 SER HB3 1.0 0.0 3.83 1234 1021 A 84 SER HA A 85 ARG H 1.0 0.0 3.20 1235 1022 A 85 ARG H A 84 SER HB2 1.0 0.0 3.87 1236 1022 A 84 SER HB3 A 85 ARG H 1.0 0.0 3.87 1237 1023 A 85 ARG H A 85 ARG HBy 1.0 0.0 4.01 1238 1024 A 85 ARG H A 85 ARG HBx 1.0 0.0 4.01 1239 1025 A 85 ARG H A 85 ARG HBy 1.0 0.0 3.41 1240 1025 A 85 ARG H A 85 ARG HBx 1.0 0.0 3.41 1241 1026 A 85 ARG H A 85 ARG HGx 1.0 0.0 3.66 1242 1026 A 85 ARG H A 85 ARG HGy 1.0 0.0 3.66 1243 1027 A 85 ARG HA A 85 ARG HGx 1.0 0.0 3.58 1244 1027 A 85 ARG HGy A 85 ARG HA 1.0 0.0 3.58 1245 1028 A 85 ARG HA A 85 ARG HDx 1.0 0.0 4.39 1246 1028 A 85 ARG HA A 85 ARG HDy 1.0 0.0 4.39 1247 1029 A 3 GLU H A 4 VAL HB 1.0 0.0 4.55 1248 1030 A 5 GLU HA A 33 LEU HDx% 1.0 0.0 4.45 1249 1031 A 33 LEU HDx% A 5 GLU HB2 1.0 0.0 3.77 1250 1031 A 5 GLU HB3 A 33 LEU HDx% 1.0 0.0 3.77 1251 1032 A 33 LEU HDx% A 5 GLU HGx 1.0 0.0 5.06 1252 1032 A 5 GLU HGy A 33 LEU HDx% 1.0 0.0 5.06 1253 1033 A 51 PHE HD% A 7 ARG HGy 1.0 0.0 4.67 1254 1034 A 51 PHE HD% A 7 ARG HGx 1.0 0.0 4.67 1255 1035 A 8 CYS H A 8 CYS HBy 1.0 0.0 3.51 1256 1035 A 8 CYS H A 8 CYS HBx 1.0 0.0 3.51 1257 1036 A 8 CYS H A 52 VAL HB 1.0 0.0 5.50 1258 1037 A 52 VAL H A 8 CYS HBx 1.0 0.0 4.80 1259 1038 A 52 VAL H A 8 CYS HBy 1.0 0.0 4.80 1260 1039 A 9 PHE H A 8 CYS HBy 1.0 0.0 3.75 1261 1039 A 9 PHE H A 8 CYS HBx 1.0 0.0 3.75 1262 1040 A 52 VAL H A 8 CYS HBy 1.0 0.0 4.16 1263 1040 A 52 VAL H A 8 CYS HBx 1.0 0.0 4.16 1264 1041 A 52 VAL HB A 8 CYS HBy 1.0 0.0 4.92 1265 1041 A 52 VAL HB A 8 CYS HBx 1.0 0.0 4.92 1266 1042 A 79 VAL HGx% A 8 CYS HBy 1.0 0.0 4.48 1267 1042 A 79 VAL HGx% A 8 CYS HBx 1.0 0.0 4.48 1268 1043 A 82 ALA HB% A 8 CYS HBy 1.0 0.0 4.76 1269 1043 A 82 ALA HB% A 8 CYS HBx 1.0 0.0 4.76 1270 1044 A 9 PHE H A 9 PHE HBx 1.0 0.0 3.19 1271 1044 A 9 PHE H A 9 PHE HBy 1.0 0.0 3.19 1272 1045 A 9 PHE H A 83 GLN H 1.0 0.0 5.50 1273 1046 A 82 ALA H A 9 PHE HBx 1.0 0.0 5.34 1274 1046 A 82 ALA H A 9 PHE HBy 1.0 0.0 5.34 1275 1047 A 82 ALA HA A 9 PHE HBx 1.0 0.0 3.64 1276 1047 A 82 ALA HA A 9 PHE HBy 1.0 0.0 3.64 1277 1048 A 82 ALA HB% A 9 PHE HBx 1.0 0.0 3.65 1278 1048 A 82 ALA HB% A 9 PHE HBy 1.0 0.0 3.65 1279 1049 A 10 VAL HB A 52 VAL HGy% 1.0 0.0 4.56 1280 1049 A 10 VAL HB A 52 VAL HGx% 1.0 0.0 4.56 1281 1050 A 10 VAL HGx% A 26 PHE HZ 1.0 0.0 5.50 1282 1051 A 10 VAL HGx% A 50 GLY H 1.0 0.0 4.55 1283 1052 A 10 VAL HGx% A 78 THR H 1.0 0.0 4.33 1284 1053 A 10 VAL HGx% A 79 VAL H 1.0 0.0 5.28 1285 1054 A 51 PHE HA A 10 VAL HGy% 1.0 0.0 4.38 1286 1055 A 52 VAL H A 10 VAL HGy% 1.0 0.0 4.36 1287 1056 A 10 VAL HGy% A 52 VAL HB 1.0 0.0 5.33 1288 1057 A 10 VAL HGy% A 79 VAL HB 1.0 0.0 5.50 1289 1058 A 79 VAL HGx% A 10 VAL HGy% 1.0 0.0 3.46 1290 1059 A 13 LEU HDy% A 17 THR HG2% 1.0 0.0 3.50 1291 1060 A 17 THR HG2% A 22 LEU HBy 1.0 0.0 3.94 1292 1060 A 17 THR HG2% A 22 LEU HBx 1.0 0.0 3.94 1293 1061 A 17 THR HG2% A 22 LEU HDy% 1.0 0.0 4.60 1294 1061 A 22 LEU HDx% A 17 THR HG2% 1.0 0.0 4.60 1295 1062 A 18 THR H A 19 ASP HA 1.0 0.0 5.42 1296 1063 A 19 ASP H A 22 LEU HBy 1.0 0.0 5.33 1297 1063 A 19 ASP H A 22 LEU HBx 1.0 0.0 5.33 1298 1064 A 19 ASP HA A 22 LEU HBx 1.0 0.0 4.12 1299 1065 A 19 ASP HA A 22 LEU HBy 1.0 0.0 4.12 1300 1066 A 21 THR H A 22 LEU HBy 1.0 0.0 4.76 1301 1066 A 21 THR H A 22 LEU HBx 1.0 0.0 4.76 1302 1067 A 21 THR HA A 24 GLU HBy 1.0 0.0 3.68 1303 1067 A 21 THR HA A 24 GLU HBx 1.0 0.0 3.68 1304 1068 A 22 LEU H A 72 LEU HDy% 1.0 0.0 5.44 1305 1068 A 22 LEU H A 72 LEU HDx% 1.0 0.0 5.44 1306 1069 A 23 GLY H A 22 LEU HBy 1.0 0.0 3.50 1307 1069 A 23 GLY H A 22 LEU HBx 1.0 0.0 3.50 1308 1070 A 22 LEU HBx A 52 VAL HGy% 1.0 0.0 5.27 1309 1070 A 22 LEU HBy A 52 VAL HGy% 1.0 0.0 5.27 1310 1070 A 52 VAL HGx% A 22 LEU HBy 1.0 0.0 5.27 1311 1070 A 52 VAL HGx% A 22 LEU HBx 1.0 0.0 5.27 1312 1071 A 22 LEU HG A 52 VAL HGy% 1.0 0.0 4.58 1313 1071 A 22 LEU HG A 52 VAL HGx% 1.0 0.0 4.58 1314 1072 A 22 LEU HDy% A 52 VAL HGy% 1.0 0.0 3.18 1315 1072 A 22 LEU HDx% A 52 VAL HGy% 1.0 0.0 3.18 1316 1072 A 52 VAL HGx% A 22 LEU HDy% 1.0 0.0 3.18 1317 1072 A 22 LEU HDx% A 52 VAL HGx% 1.0 0.0 3.18 1318 1073 A 32 ILE HG2% A 23 GLY HAy 1.0 0.0 4.42 1319 1074 A 32 ILE HD1% A 23 GLY HAy 1.0 0.0 5.09 1320 1075 A 32 ILE HG2% A 23 GLY HAx 1.0 0.0 4.42 1321 1076 A 32 ILE HD1% A 23 GLY HAx 1.0 0.0 5.09 1322 1077 A 26 PHE H A 23 GLY HAy 1.0 0.0 4.42 1323 1077 A 26 PHE H A 23 GLY HAx 1.0 0.0 4.42 1324 1078 A 24 GLU H A 24 GLU HBy 1.0 0.0 3.01 1325 1078 A 24 GLU H A 24 GLU HBx 1.0 0.0 3.01 1326 1079 A 26 PHE HBx A 52 VAL HGy% 1.0 0.0 3.63 1327 1079 A 26 PHE HBx A 52 VAL HGx% 1.0 0.0 3.63 1328 1080 A 26 PHE HBy A 52 VAL HGy% 1.0 0.0 4.15 1329 1080 A 26 PHE HBy A 52 VAL HGx% 1.0 0.0 4.15 1330 1081 A 26 PHE HE% A 52 VAL HGy% 1.0 0.0 4.38 1331 1081 A 26 PHE HE% A 52 VAL HGx% 1.0 0.0 4.38 1332 1082 A 26 PHE HE% A 77 ILE HG2% 1.0 0.0 5.50 1333 1083 A 28 GLN H A 27 SER HBy 1.0 0.0 4.12 1334 1083 A 28 GLN H A 27 SER HBx 1.0 0.0 4.12 1335 1084 A 31 GLU HGx A 32 ILE H 1.0 0.0 5.50 1336 1085 A 32 ILE H A 31 GLU HGy 1.0 0.0 5.50 1337 1086 A 32 ILE HA A 52 VAL HGy% 1.0 0.0 4.83 1338 1086 A 32 ILE HA A 52 VAL HGx% 1.0 0.0 4.83 1339 1087 A 32 ILE HB A 52 VAL HGy% 1.0 0.0 5.26 1340 1087 A 32 ILE HB A 52 VAL HGx% 1.0 0.0 5.26 1341 1088 A 32 ILE HG2% A 52 VAL HGy% 1.0 0.0 3.52 1342 1088 A 32 ILE HG2% A 52 VAL HGx% 1.0 0.0 3.52 1343 1089 A 32 ILE HD1% A 52 VAL HGy% 1.0 0.0 3.75 1344 1089 A 32 ILE HD1% A 52 VAL HGx% 1.0 0.0 3.75 1345 1090 A 53 THR HA A 33 LEU H 1.0 0.0 4.94 1346 1091 A 33 LEU HA A 33 LEU HDy% 1.0 0.0 2.94 1347 1092 A 53 THR HG2% A 33 LEU HA 1.0 0.0 4.60 1348 1093 A 53 THR HA A 33 LEU HG 1.0 0.0 5.50 1349 1094 A 34 ASP H A 33 LEU HDx% 1.0 0.0 5.05 1350 1095 A 53 THR HB A 33 LEU HDx% 1.0 0.0 4.63 1351 1096 A 33 LEU HDx% A 55 LYS H 1.0 0.0 5.39 1352 1097 A 33 LEU HDx% A 55 LYS HA 1.0 0.0 3.25 1353 1098 A 33 LEU HDx% A 55 LYS HBy 1.0 0.0 4.88 1354 1098 A 33 LEU HDx% A 55 LYS HBx 1.0 0.0 4.88 1355 1099 A 33 LEU HDy% A 55 LYS HBy 1.0 0.0 4.19 1356 1099 A 33 LEU HDy% A 55 LYS HBx 1.0 0.0 4.19 1357 1100 A 33 LEU HDy% A 55 LYS HDy 1.0 0.0 4.26 1358 1100 A 33 LEU HDy% A 55 LYS HDx 1.0 0.0 4.26 1359 1101 A 33 LEU HDy% A 55 LYS HEy 1.0 0.0 4.31 1360 1101 A 33 LEU HDy% A 55 LYS HEx 1.0 0.0 4.31 1361 1102 A 35 SER HA A 52 VAL HGy% 1.0 0.0 3.83 1362 1102 A 35 SER HA A 52 VAL HGx% 1.0 0.0 3.83 1363 1103 A 36 LYS H A 52 VAL HGy% 1.0 0.0 4.85 1364 1103 A 36 LYS H A 52 VAL HGx% 1.0 0.0 4.85 1365 1104 A 38 ILE HA A 39 ASN HD22 1.0 0.0 5.34 1366 1104 A 38 ILE HA A 39 ASN HD21 1.0 0.0 5.34 1367 1105 A 39 ASN HBx A 47 ARG HG2 1.0 0.0 4.47 1368 1105 A 39 ASN HBy A 47 ARG HG2 1.0 0.0 4.47 1369 1105 A 47 ARG HG3 A 39 ASN HBy 1.0 0.0 4.47 1370 1105 A 47 ARG HG3 A 39 ASN HBx 1.0 0.0 4.47 1371 1106 A 47 ARG HDx A 40 ASP HA 1.0 0.0 4.55 1372 1107 A 40 ASP HA A 47 ARG HDy 1.0 0.0 4.55 1373 1108 A 47 ARG H A 47 ARG HBy 1.0 0.0 3.63 1374 1108 A 47 ARG H A 47 ARG HBx 1.0 0.0 3.63 1375 1109 A 49 PHE HE% A 47 ARG HBy 1.0 0.0 4.31 1376 1110 A 49 PHE H A 47 ARG HBy 1.0 0.0 4.42 1377 1110 A 49 PHE H A 47 ARG HBx 1.0 0.0 4.42 1378 1111 A 49 PHE HD% A 47 ARG HBy 1.0 0.0 3.64 1379 1111 A 49 PHE HD% A 47 ARG HBx 1.0 0.0 3.64 1380 1112 A 49 PHE HE% A 47 ARG HBy 1.0 0.0 3.72 1381 1112 A 49 PHE HE% A 47 ARG HBx 1.0 0.0 3.72 1382 1113 A 49 PHE HE% A 47 ARG HG2 1.0 0.0 4.77 1383 1113 A 49 PHE HE% A 47 ARG HG3 1.0 0.0 4.77 1384 1114 A 49 PHE HE% A 47 ARG HDy 1.0 0.0 4.69 1385 1114 A 49 PHE HE% A 47 ARG HDx 1.0 0.0 4.69 1386 1115 A 52 VAL H A 52 VAL HGy% 1.0 0.0 3.70 1387 1115 A 52 VAL H A 52 VAL HGx% 1.0 0.0 3.70 1388 1116 A 53 THR H A 52 VAL HGy% 1.0 0.0 3.60 1389 1116 A 53 THR H A 52 VAL HGx% 1.0 0.0 3.60 1390 1117 A 53 THR HA A 52 VAL HGy% 1.0 0.0 4.34 1391 1117 A 53 THR HA A 52 VAL HGx% 1.0 0.0 4.34 1392 1118 A 54 PHE HD% A 52 VAL HGy% 1.0 0.0 4.29 1393 1118 A 54 PHE HD% A 52 VAL HGx% 1.0 0.0 4.29 1394 1119 A 54 PHE HE% A 52 VAL HGy% 1.0 0.0 3.92 1395 1119 A 54 PHE HE% A 52 VAL HGx% 1.0 0.0 3.92 1396 1120 A 56 ASP H A 59 ALA H 1.0 0.0 5.09 1397 1121 A 59 ALA H A 56 ASP HB2 1.0 0.0 4.45 1398 1122 A 59 ALA HB% A 56 ASP HB2 1.0 0.0 4.62 1399 1123 A 59 ALA H A 56 ASP HB3 1.0 0.0 4.57 1400 1124 A 59 ALA HB% A 56 ASP HB3 1.0 0.0 5.29 1401 1125 A 57 GLU HA A 60 MET HBy 1.0 0.0 3.78 1402 1125 A 57 GLU HA A 60 MET HBx 1.0 0.0 3.78 1403 1126 A 60 MET HBx A 61 ARG H 1.0 0.0 4.16 1404 1127 A 61 ARG H A 60 MET HBy 1.0 0.0 4.16 1405 1128 A 60 MET HE% A 63 ALA HB% 1.0 0.0 5.50 1406 1129 A 62 ASP HA A 65 GLU HB3 1.0 0.0 3.84 1407 1129 A 62 ASP HA A 65 GLU HB2 1.0 0.0 3.84 1408 1130 A 67 MET H A 67 MET HBy 1.0 0.0 3.46 1409 1130 A 67 MET H A 67 MET HBx 1.0 0.0 3.46 1410 1131 A 67 MET H A 67 MET HGy 1.0 0.0 4.49 1411 1131 A 67 MET H A 67 MET HGx 1.0 0.0 4.49 1412 1132 A 67 MET HA A 67 MET HGy 1.0 0.0 3.61 1413 1132 A 67 MET HA A 67 MET HGx 1.0 0.0 3.61 1414 1133 A 68 ASN H A 67 MET HBy 1.0 0.0 4.08 1415 1133 A 68 ASN H A 67 MET HBx 1.0 0.0 4.08 1416 1134 A 77 ILE HD1% A 67 MET HBy 1.0 0.0 4.17 1417 1134 A 77 ILE HD1% A 67 MET HBx 1.0 0.0 4.17 1418 1135 A 79 VAL HGy% A 67 MET HBy 1.0 0.0 3.46 1419 1135 A 79 VAL HGy% A 67 MET HBx 1.0 0.0 3.46 1420 1136 A 68 ASN H A 67 MET HGy 1.0 0.0 5.34 1421 1136 A 68 ASN H A 67 MET HGx 1.0 0.0 5.34 1422 1137 A 67 MET HE% A 70 GLN HE22 1.0 0.0 4.53 1423 1138 A 69 GLY H A 77 ILE HG1x 1.0 0.0 4.62 1424 1139 A 70 GLN H A 70 GLN HE21 1.0 0.0 5.32 1425 1140 A 70 GLN H A 77 ILE HG1x 1.0 0.0 4.21 1426 1141 A 77 ILE HD1% A 70 GLN HE21 1.0 0.0 4.55 1427 1142 A 75 ARG HGx A 76 ASN H 1.0 0.0 4.10 1428 1143 A 76 ASN H A 75 ARG HGy 1.0 0.0 4.10 1429 1144 A 76 ASN HA A 77 ILE HG1x 1.0 0.0 4.39 1430 1145 A 78 THR HG2% A 77 ILE HA 1.0 0.0 5.50 1431 1146 A 78 THR H A 77 ILE HG1y 1.0 0.0 5.50 1432 1147 A 78 THR H A 77 ILE HG1x 1.0 0.0 4.54 1433 1148 A 3 GLU HA A 4 VAL HGy% 1.0 0.0 5.16 1434 1148 A 3 GLU HA A 4 VAL HGx% 1.0 0.0 5.16 1435 1149 A 4 VAL H A 4 VAL HGy% 1.0 0.0 3.54 1436 1149 A 4 VAL H A 4 VAL HGx% 1.0 0.0 3.54 1437 1150 A 5 GLU H A 4 VAL HGy% 1.0 0.0 3.40 1438 1150 A 5 GLU H A 4 VAL HGx% 1.0 0.0 3.40 1439 1151 A 5 GLU HA A 4 VAL HGy% 1.0 0.0 4.46 1440 1151 A 5 GLU HA A 4 VAL HGx% 1.0 0.0 4.46 1441 1152 A 6 TYR HD% A 4 VAL HGy% 1.0 0.0 4.57 1442 1152 A 6 TYR HD% A 4 VAL HGx% 1.0 0.0 4.57 1443 1153 A 6 TYR HE% A 4 VAL HGy% 1.0 0.0 4.28 1444 1153 A 6 TYR HE% A 4 VAL HGx% 1.0 0.0 4.28 1445 1154 A 6 TYR HD% A 83 GLN HA 1.0 0.0 5.50 1446 1155 A 6 TYR HE% A 83 GLN HA 1.0 0.0 5.50 1447 1156 A 7 ARG HA A 7 ARG HGx 1.0 0.0 3.54 1448 1156 A 7 ARG HA A 7 ARG HGy 1.0 0.0 3.54 1449 1157 A 9 PHE HA A 7 ARG HGx 1.0 0.0 5.34 1450 1157 A 9 PHE HA A 7 ARG HGy 1.0 0.0 5.34 1451 1158 A 7 ARG HGy A 51 PHE HBy 1.0 0.0 4.16 1452 1158 A 7 ARG HGx A 51 PHE HBy 1.0 0.0 4.16 1453 1158 A 51 PHE HBx A 7 ARG HGx 1.0 0.0 4.16 1454 1158 A 51 PHE HBx A 7 ARG HGy 1.0 0.0 4.16 1455 1159 A 51 PHE HD% A 7 ARG HGx 1.0 0.0 4.57 1456 1159 A 51 PHE HD% A 7 ARG HGy 1.0 0.0 4.57 1457 1160 A 53 THR HA A 7 ARG HGx 1.0 0.0 4.88 1458 1160 A 53 THR HA A 7 ARG HGy 1.0 0.0 4.88 1459 1161 A 10 VAL HGy% A 8 CYS HBy 1.0 0.0 4.15 1460 1161 A 10 VAL HGy% A 8 CYS HBx 1.0 0.0 4.15 1461 1162 A 81 GLU HA A 9 PHE HBx 1.0 0.0 4.88 1462 1162 A 81 GLU HA A 9 PHE HBy 1.0 0.0 4.88 1463 1163 A 10 VAL HGx% A 52 VAL HGy% 1.0 0.0 4.71 1464 1163 A 10 VAL HGx% A 52 VAL HGx% 1.0 0.0 4.71 1465 1164 A 13 LEU H A 11 GLY HAx 1.0 0.0 4.30 1466 1164 A 13 LEU H A 11 GLY HAy 1.0 0.0 4.30 1467 1165 A 13 LEU HG A 11 GLY HAx 1.0 0.0 4.68 1468 1165 A 13 LEU HG A 11 GLY HAy 1.0 0.0 4.68 1469 1166 A 49 PHE HA A 11 GLY HAx 1.0 0.0 3.91 1470 1166 A 49 PHE HA A 11 GLY HAy 1.0 0.0 3.91 1471 1167 A 11 GLY HAy A 49 PHE HBy 1.0 0.0 3.72 1472 1167 A 11 GLY HAx A 49 PHE HBy 1.0 0.0 3.72 1473 1167 A 49 PHE HBx A 11 GLY HAx 1.0 0.0 3.72 1474 1167 A 49 PHE HBx A 11 GLY HAy 1.0 0.0 3.72 1475 1168 A 50 GLY H A 11 GLY HAx 1.0 0.0 4.94 1476 1168 A 50 GLY H A 11 GLY HAy 1.0 0.0 4.94 1477 1169 A 13 LEU HG A 12 GLY HAy 1.0 0.0 5.34 1478 1169 A 12 GLY HAx A 13 LEU HG 1.0 0.0 5.34 1479 1170 A 13 LEU HDx% A 13 LEU HBx 1.0 0.0 3.43 1480 1171 A 13 LEU HDx% A 37 ILE HG2% 1.0 0.0 3.72 1481 1172 A 13 LEU HDx% A 49 PHE H 1.0 0.0 4.52 1482 1173 A 13 LEU HDx% A 49 PHE HA 1.0 0.0 3.94 1483 1174 A 50 GLY H A 13 LEU HDx% 1.0 0.0 3.89 1484 1175 A 13 LEU HDx% A 50 GLY HAx 1.0 0.0 4.04 1485 1176 A 13 LEU HDy% A 14 ALA H 1.0 0.0 3.88 1486 1177 A 13 LEU HDy% A 26 PHE HE% 1.0 0.0 4.77 1487 1178 A 13 LEU HDy% A 77 ILE HA 1.0 0.0 5.50 1488 1179 A 13 LEU HDy% A 77 ILE HB 1.0 0.0 4.47 1489 1180 A 37 ILE HD1% A 19 ASP HA 1.0 0.0 3.88 1490 1181 A 21 THR HG2% A 24 GLU HBy 1.0 0.0 5.34 1491 1181 A 21 THR HG2% A 24 GLU HBx 1.0 0.0 5.34 1492 1182 A 37 ILE HD1% A 22 LEU HBx 1.0 0.0 3.80 1493 1183 A 22 LEU HG A 35 SER HBy 1.0 0.0 5.33 1494 1183 A 22 LEU HG A 35 SER HBx 1.0 0.0 5.33 1495 1184 A 22 LEU HDx% A 35 SER HBy 1.0 0.0 4.08 1496 1184 A 22 LEU HDy% A 35 SER HBy 1.0 0.0 4.08 1497 1184 A 35 SER HBx A 22 LEU HDy% 1.0 0.0 4.08 1498 1184 A 22 LEU HDx% A 35 SER HBx 1.0 0.0 4.08 1499 1185 A 23 GLY HAy A 52 VAL HGy% 1.0 0.0 5.25 1500 1185 A 52 VAL HGx% A 23 GLY HAy 1.0 0.0 5.25 1501 1185 A 52 VAL HGx% A 23 GLY HAx 1.0 0.0 5.25 1502 1185 A 23 GLY HAx A 52 VAL HGy% 1.0 0.0 5.25 1503 1186 A 25 ALA H A 24 GLU HBy 1.0 0.0 3.58 1504 1186 A 25 ALA H A 24 GLU HBx 1.0 0.0 3.58 1505 1187 A 79 VAL HGy% A 26 PHE HD% 1.0 0.0 5.33 1506 1188 A 26 PHE HE% A 67 MET HGy 1.0 0.0 3.99 1507 1188 A 26 PHE HE% A 67 MET HGx 1.0 0.0 3.99 1508 1189 A 26 PHE HE% A 68 ASN H 1.0 0.0 5.50 1509 1190 A 26 PHE HE% A 72 LEU HDy% 1.0 0.0 5.24 1510 1190 A 26 PHE HE% A 72 LEU HDx% 1.0 0.0 5.24 1511 1191 A 27 SER HA A 32 ILE HG1y 1.0 0.0 4.21 1512 1192 A 27 SER HA A 32 ILE HG1x 1.0 0.0 4.21 1513 1193 A 32 ILE HD1% A 27 SER HBx 1.0 0.0 5.50 1514 1194 A 32 ILE HD1% A 27 SER HBy 1.0 0.0 5.50 1515 1195 A 32 ILE HD1% A 27 SER HBy 1.0 0.0 4.81 1516 1195 A 32 ILE HD1% A 27 SER HBx 1.0 0.0 4.81 1517 1196 A 28 GLN H A 28 GLN HBy 1.0 0.0 2.96 1518 1196 A 28 GLN H A 28 GLN HBx 1.0 0.0 2.96 1519 1197 A 28 GLN H A 28 GLN HGx 1.0 0.0 4.70 1520 1198 A 28 GLN H A 28 GLN HGy 1.0 0.0 4.70 1521 1199 A 30 GLY H A 28 GLN HBy 1.0 0.0 5.34 1522 1199 A 30 GLY H A 28 GLN HBx 1.0 0.0 5.34 1523 1200 A 31 GLU H A 31 GLU HGx 1.0 0.0 5.31 1524 1201 A 31 GLU H A 31 GLU HGy 1.0 0.0 5.31 1525 1202 A 32 ILE HG2% A 35 SER HBy 1.0 0.0 3.41 1526 1202 A 32 ILE HG2% A 35 SER HBx 1.0 0.0 3.41 1527 1203 A 33 LEU H A 34 ASP HBy 1.0 0.0 5.08 1528 1203 A 33 LEU H A 34 ASP HBx 1.0 0.0 5.08 1529 1204 A 33 LEU HBy A 34 ASP HBy 1.0 0.0 4.76 1530 1204 A 33 LEU HBx A 34 ASP HBy 1.0 0.0 4.76 1531 1204 A 34 ASP HBx A 33 LEU HBy 1.0 0.0 4.76 1532 1204 A 33 LEU HBx A 34 ASP HBx 1.0 0.0 4.76 1533 1205 A 53 THR HB A 33 LEU HBy 1.0 0.0 3.76 1534 1205 A 53 THR HB A 33 LEU HBx 1.0 0.0 3.76 1535 1206 A 34 ASP H A 34 ASP HBy 1.0 0.0 3.60 1536 1206 A 34 ASP H A 34 ASP HBx 1.0 0.0 3.60 1537 1207 A 35 SER H A 34 ASP HBy 1.0 0.0 3.53 1538 1207 A 35 SER H A 34 ASP HBx 1.0 0.0 3.53 1539 1208 A 53 THR H A 34 ASP HBy 1.0 0.0 4.72 1540 1208 A 53 THR H A 34 ASP HBx 1.0 0.0 4.72 1541 1209 A 53 THR HB A 34 ASP HBy 1.0 0.0 3.65 1542 1209 A 53 THR HB A 34 ASP HBx 1.0 0.0 3.65 1543 1210 A 53 THR HG2% A 34 ASP HBy 1.0 0.0 5.26 1544 1210 A 53 THR HG2% A 34 ASP HBx 1.0 0.0 5.26 1545 1211 A 36 LYS H A 35 SER HBy 1.0 0.0 4.22 1546 1211 A 36 LYS H A 35 SER HBx 1.0 0.0 4.22 1547 1212 A 52 VAL HA A 35 SER HBy 1.0 0.0 3.74 1548 1212 A 52 VAL HA A 35 SER HBx 1.0 0.0 3.74 1549 1213 A 52 VAL HB A 35 SER HBy 1.0 0.0 5.33 1550 1213 A 52 VAL HB A 35 SER HBx 1.0 0.0 5.33 1551 1214 A 50 GLY HAx A 38 ILE HG1x 1.0 0.0 5.50 1552 1215 A 42 GLU H A 42 GLU HBx 1.0 0.0 2.99 1553 1215 A 42 GLU H A 42 GLU HBy 1.0 0.0 2.99 1554 1216 A 42 GLU H A 42 GLU HGx 1.0 0.0 4.08 1555 1216 A 42 GLU H A 42 GLU HGy 1.0 0.0 4.08 1556 1217 A 56 ASP H A 56 ASP HB3 1.0 0.0 3.48 1557 1217 A 56 ASP H A 56 ASP HB2 1.0 0.0 3.48 1558 1218 A 57 GLU H A 56 ASP HB3 1.0 0.0 3.63 1559 1218 A 57 GLU H A 56 ASP HB2 1.0 0.0 3.63 1560 1219 A 58 LYS H A 56 ASP HB3 1.0 0.0 3.89 1561 1219 A 58 LYS H A 56 ASP HB2 1.0 0.0 3.89 1562 1220 A 56 ASP HB3 A 58 LYS HBy 1.0 0.0 4.15 1563 1220 A 56 ASP HB2 A 58 LYS HBy 1.0 0.0 4.15 1564 1220 A 58 LYS HBx A 56 ASP HB3 1.0 0.0 4.15 1565 1220 A 58 LYS HBx A 56 ASP HB2 1.0 0.0 4.15 1566 1221 A 59 ALA H A 56 ASP HB3 1.0 0.0 3.88 1567 1221 A 59 ALA H A 56 ASP HB2 1.0 0.0 3.88 1568 1222 A 59 ALA HA A 62 ASP HBx 1.0 0.0 4.48 1569 1223 A 59 ALA HA A 62 ASP HBy 1.0 0.0 4.48 1570 1224 A 63 ALA H A 66 GLY H 1.0 0.0 5.47 1571 1225 A 63 ALA HA A 66 GLY HAy 1.0 0.0 4.83 1572 1225 A 63 ALA HA A 66 GLY HAx 1.0 0.0 4.83 1573 1226 A 64 ILE HD1% A 81 GLU HBy 1.0 0.0 4.78 1574 1227 A 64 ILE HD1% A 81 GLU HBx 1.0 0.0 4.78 1575 1228 A 79 VAL HGy% A 67 MET HBx 1.0 0.0 3.58 1576 1229 A 79 VAL HGy% A 67 MET HBy 1.0 0.0 3.58 1577 1230 A 77 ILE HG1y A 70 GLN HE21 1.0 0.0 5.22 1578 1231 A 72 LEU H A 71 ASP HBy 1.0 0.0 4.03 1579 1231 A 71 ASP HBx A 72 LEU H 1.0 0.0 4.03 1580 1232 A 75 ARG H A 75 ARG HBy 1.0 0.0 3.65 1581 1232 A 75 ARG H A 75 ARG HBx 1.0 0.0 3.65 1582 1233 A 78 THR HG2% A 80 ASN HD21 1.0 0.0 4.84 1583 1234 A 78 THR HG2% A 80 ASN HD22 1.0 0.0 4.84 1584 1235 A 81 GLU H A 81 GLU HGx 1.0 0.0 4.04 1585 1235 A 81 GLU H A 81 GLU HGy 1.0 0.0 4.04 1586 1236 A 82 ALA H A 81 GLU HGy 1.0 0.0 4.45 1587 1237 A 82 ALA H A 81 GLU HGx 1.0 0.0 4.45 1588 1238 A 83 GLN HA A 84 SER H 1.0 0.0 3.52 1589 1239 A 3 GLU HBx A 4 VAL HGy% 1.0 0.0 4.93 1590 1239 A 3 GLU HBy A 4 VAL HGy% 1.0 0.0 4.93 1591 1239 A 4 VAL HGx% A 3 GLU HBx 1.0 0.0 4.93 1592 1239 A 3 GLU HBy A 4 VAL HGx% 1.0 0.0 4.93 1593 1240 A 5 GLU HA A 5 GLU HGy 1.0 0.0 4.04 1594 1241 A 5 GLU HA A 5 GLU HGx 1.0 0.0 4.04 1595 1242 A 6 TYR H A 54 PHE HBy 1.0 0.0 4.58 1596 1243 A 6 TYR HA A 7 ARG HBy 1.0 0.0 4.72 1597 1243 A 6 TYR HA A 7 ARG HBx 1.0 0.0 4.72 1598 1244 A 6 TYR HD% A 7 ARG HBy 1.0 0.0 4.87 1599 1244 A 6 TYR HD% A 7 ARG HBx 1.0 0.0 4.87 1600 1245 A 7 ARG H A 7 ARG HBy 1.0 0.0 3.27 1601 1245 A 7 ARG H A 7 ARG HBx 1.0 0.0 3.27 1602 1246 A 7 ARG H A 7 ARG HGx 1.0 0.0 4.89 1603 1246 A 7 ARG H A 7 ARG HGy 1.0 0.0 4.89 1604 1247 A 7 ARG HBy A 7 ARG HD2 1.0 0.0 3.35 1605 1247 A 7 ARG HBx A 7 ARG HD2 1.0 0.0 3.35 1606 1247 A 7 ARG HD3 A 7 ARG HBy 1.0 0.0 3.35 1607 1247 A 7 ARG HD3 A 7 ARG HBx 1.0 0.0 3.35 1608 1248 A 53 THR HA A 7 ARG HBy 1.0 0.0 5.19 1609 1248 A 53 THR HA A 7 ARG HBx 1.0 0.0 5.19 1610 1249 A 82 ALA HB% A 7 ARG HBy 1.0 0.0 4.23 1611 1249 A 82 ALA HB% A 7 ARG HBx 1.0 0.0 4.23 1612 1250 A 52 VAL H A 7 ARG HGx 1.0 0.0 4.31 1613 1250 A 52 VAL H A 7 ARG HGy 1.0 0.0 4.31 1614 1251 A 9 PHE HBy A 80 ASN HD22 1.0 0.0 4.41 1615 1251 A 80 ASN HD21 A 9 PHE HBx 1.0 0.0 4.41 1616 1251 A 80 ASN HD22 A 9 PHE HBx 1.0 0.0 4.41 1617 1251 A 9 PHE HBy A 80 ASN HD21 1.0 0.0 4.41 1618 1252 A 11 GLY H A 13 LEU HG 1.0 0.0 5.03 1619 1253 A 12 GLY H A 11 GLY HAx 1.0 0.0 3.08 1620 1253 A 12 GLY H A 11 GLY HAy 1.0 0.0 3.08 1621 1254 A 13 LEU HBx A 48 GLY HAx 1.0 0.0 4.66 1622 1255 A 13 LEU HBx A 48 GLY HAy 1.0 0.0 4.91 1623 1256 A 77 ILE HA A 13 LEU HG 1.0 0.0 5.50 1624 1257 A 13 LEU HDx% A 17 THR H 1.0 0.0 5.50 1625 1258 A 16 ALA HB% A 73 ASP HBy 1.0 0.0 4.72 1626 1258 A 16 ALA HB% A 73 ASP HBx 1.0 0.0 4.72 1627 1259 A 37 ILE HD1% A 22 LEU HBy 1.0 0.0 3.80 1628 1260 A 23 GLY HAy A 35 SER HBy 1.0 0.0 3.87 1629 1260 A 23 GLY HAx A 35 SER HBy 1.0 0.0 3.87 1630 1260 A 35 SER HBx A 23 GLY HAy 1.0 0.0 3.87 1631 1260 A 23 GLY HAx A 35 SER HBx 1.0 0.0 3.87 1632 1261 A 26 PHE HD% A 67 MET HGy 1.0 0.0 4.31 1633 1261 A 26 PHE HD% A 67 MET HGx 1.0 0.0 4.31 1634 1262 A 26 PHE HE% A 67 MET H 1.0 0.0 5.50 1635 1263 A 26 PHE HZ A 52 VAL HGy% 1.0 0.0 5.32 1636 1263 A 26 PHE HZ A 52 VAL HGx% 1.0 0.0 5.32 1637 1264 A 29 PHE HD% A 28 GLN HBy 1.0 0.0 5.08 1638 1264 A 29 PHE HD% A 28 GLN HBx 1.0 0.0 5.08 1639 1265 A 32 ILE H A 31 GLU HBy 1.0 0.0 3.99 1640 1265 A 31 GLU HBx A 32 ILE H 1.0 0.0 3.99 1641 1266 A 32 ILE HD1% A 35 SER HBy 1.0 0.0 4.43 1642 1266 A 32 ILE HD1% A 35 SER HBx 1.0 0.0 4.43 1643 1267 A 35 SER HBy A 52 VAL HGy% 1.0 0.0 3.38 1644 1267 A 35 SER HBx A 52 VAL HGy% 1.0 0.0 3.38 1645 1267 A 52 VAL HGx% A 35 SER HBy 1.0 0.0 3.38 1646 1267 A 52 VAL HGx% A 35 SER HBx 1.0 0.0 3.38 1647 1268 A 37 ILE HG2% A 46 SER HBx 1.0 0.0 4.18 1648 1269 A 37 ILE HG2% A 46 SER HBy 1.0 0.0 4.18 1649 1270 A 49 PHE HD% A 38 ILE HG1x 1.0 0.0 4.50 1650 1271 A 38 ILE HG1x A 49 PHE HE% 1.0 0.0 3.72 1651 1272 A 51 PHE H A 38 ILE HG1x 1.0 0.0 5.05 1652 1273 A 51 PHE HD% A 38 ILE HG1x 1.0 0.0 4.34 1653 1274 A 40 ASP H A 40 ASP HBy 1.0 0.0 3.15 1654 1274 A 40 ASP H A 40 ASP HBx 1.0 0.0 3.15 1655 1275 A 45 ARG H A 40 ASP HBx 1.0 0.0 5.11 1656 1276 A 45 ARG H A 40 ASP HBy 1.0 0.0 4.81 1657 1277 A 42 GLU H A 40 ASP HBy 1.0 0.0 4.82 1658 1277 A 42 GLU H A 40 ASP HBx 1.0 0.0 4.82 1659 1278 A 43 THR H A 40 ASP HBy 1.0 0.0 4.27 1660 1278 A 43 THR H A 40 ASP HBx 1.0 0.0 4.27 1661 1279 A 43 THR HG2% A 40 ASP HBy 1.0 0.0 4.52 1662 1279 A 43 THR HG2% A 40 ASP HBx 1.0 0.0 4.52 1663 1280 A 44 GLY H A 40 ASP HBy 1.0 0.0 4.20 1664 1280 A 44 GLY H A 40 ASP HBx 1.0 0.0 4.20 1665 1281 A 45 ARG H A 40 ASP HBy 1.0 0.0 4.18 1666 1281 A 45 ARG H A 40 ASP HBx 1.0 0.0 4.18 1667 1282 A 40 ASP HBy A 47 ARG HG2 1.0 0.0 4.01 1668 1282 A 40 ASP HBx A 47 ARG HG2 1.0 0.0 4.01 1669 1282 A 47 ARG HG3 A 40 ASP HBy 1.0 0.0 4.01 1670 1282 A 47 ARG HG3 A 40 ASP HBx 1.0 0.0 4.01 1671 1283 A 40 ASP HBy A 47 ARG HDy 1.0 0.0 4.29 1672 1283 A 40 ASP HBx A 47 ARG HDy 1.0 0.0 4.29 1673 1283 A 47 ARG HDx A 40 ASP HBy 1.0 0.0 4.29 1674 1283 A 47 ARG HDx A 40 ASP HBx 1.0 0.0 4.29 1675 1284 A 54 PHE HBy A 60 MET H 1.0 0.0 4.50 1676 1285 A 58 LYS HA A 57 GLU HBy 1.0 0.0 4.97 1677 1285 A 57 GLU HBx A 58 LYS HA 1.0 0.0 4.97 1678 1286 A 61 ARG H A 61 ARG HBx 1.0 0.0 3.46 1679 1287 A 64 ILE HG2% A 68 ASN HBy 1.0 0.0 4.41 1680 1287 A 64 ILE HG2% A 68 ASN HBx 1.0 0.0 4.41 1681 1288 A 64 ILE HG2% A 80 ASN HBy 1.0 0.0 5.19 1682 1289 A 65 GLU H A 68 ASN HBy 1.0 0.0 5.31 1683 1289 A 65 GLU H A 68 ASN HBx 1.0 0.0 5.31 1684 1290 A 65 GLU HA A 68 ASN HBy 1.0 0.0 4.31 1685 1290 A 65 GLU HA A 68 ASN HBx 1.0 0.0 4.31 1686 1291 A 67 MET H A 68 ASN HBy 1.0 0.0 5.34 1687 1291 A 67 MET H A 68 ASN HBx 1.0 0.0 5.34 1688 1292 A 79 VAL HGy% A 67 MET HA 1.0 0.0 4.61 1689 1293 A 79 VAL HGy% A 67 MET HGy 1.0 0.0 4.44 1690 1293 A 79 VAL HGy% A 67 MET HGx 1.0 0.0 4.44 1691 1294 A 79 VAL H A 68 ASN HBy 1.0 0.0 4.51 1692 1294 A 79 VAL H A 68 ASN HBx 1.0 0.0 4.51 1693 1295 A 79 VAL HB A 68 ASN HBy 1.0 0.0 3.79 1694 1295 A 79 VAL HB A 68 ASN HBx 1.0 0.0 3.79 1695 1296 A 79 VAL HGx% A 68 ASN HBy 1.0 0.0 4.82 1696 1296 A 79 VAL HGx% A 68 ASN HBx 1.0 0.0 4.82 1697 1297 A 79 VAL HGy% A 68 ASN HBy 1.0 0.0 5.13 1698 1297 A 79 VAL HGy% A 68 ASN HBx 1.0 0.0 5.13 1699 1298 A 70 GLN HE21 A 72 LEU HDy% 1.0 0.0 5.10 1700 1298 A 72 LEU HDx% A 70 GLN HE21 1.0 0.0 5.10 1701 1299 A 72 LEU H A 72 LEU HBy 1.0 0.0 3.48 1702 1299 A 72 LEU H A 72 LEU HBx 1.0 0.0 3.48 1703 1300 A 73 ASP H A 72 LEU HBy 1.0 0.0 4.16 1704 1300 A 73 ASP H A 72 LEU HBx 1.0 0.0 4.16 1705 1301 A 74 GLY H A 72 LEU HBy 1.0 0.0 5.29 1706 1301 A 74 GLY H A 72 LEU HBx 1.0 0.0 5.29 1707 1302 A 77 ILE HG2% A 72 LEU HBy 1.0 0.0 3.43 1708 1302 A 77 ILE HG2% A 72 LEU HBx 1.0 0.0 3.43 1709 1303 A 77 ILE HD1% A 72 LEU HBy 1.0 0.0 4.22 1710 1303 A 77 ILE HD1% A 72 LEU HBx 1.0 0.0 4.22 1711 1304 A 78 THR HB A 77 ILE HA 1.0 0.0 5.50 1712 1305 A 79 VAL H A 80 ASN HBy 1.0 0.0 5.50 1713 1306 A 79 VAL HGx% A 80 ASN HBy 1.0 0.0 5.50 1714 1307 A 4 VAL HB A 6 TYR HE% 1.0 0.0 5.50 1715 1308 A 6 TYR HD% A 7 ARG HBy 1.0 0.0 5.50 1716 1309 A 8 CYS H A 7 ARG HGx 1.0 0.0 3.92 1717 1309 A 8 CYS H A 7 ARG HGy 1.0 0.0 3.92 1718 1310 A 51 PHE HD% A 9 PHE HBx 1.0 0.0 5.34 1719 1310 A 51 PHE HD% A 9 PHE HBy 1.0 0.0 5.34 1720 1311 A 10 VAL HGy% A 67 MET HBy 1.0 0.0 5.34 1721 1311 A 10 VAL HGy% A 67 MET HBx 1.0 0.0 5.34 1722 1312 A 10 VAL HGy% A 79 VAL HGy% 1.0 0.0 3.93 1723 1313 A 11 GLY H A 49 PHE HD% 1.0 0.0 5.50 1724 1314 A 13 LEU HDx% A 11 GLY HAx 1.0 0.0 5.34 1725 1314 A 13 LEU HDx% A 11 GLY HAy 1.0 0.0 5.34 1726 1315 A 13 LEU HBx A 48 GLY HAx 1.0 0.0 3.91 1727 1315 A 13 LEU HBx A 48 GLY HAy 1.0 0.0 3.91 1728 1316 A 13 LEU HBy A 48 GLY HAx 1.0 0.0 5.34 1729 1316 A 13 LEU HBy A 48 GLY HAy 1.0 0.0 5.34 1730 1317 A 13 LEU HDx% A 50 GLY HAy 1.0 0.0 4.75 1731 1318 A 18 THR HA A 19 ASP HBy 1.0 0.0 5.09 1732 1319 A 19 ASP H A 37 ILE HG1y 1.0 0.0 3.38 1733 1319 A 19 ASP H A 37 ILE HG1x 1.0 0.0 3.38 1734 1320 A 19 ASP HA A 22 LEU HBy 1.0 0.0 3.65 1735 1320 A 19 ASP HA A 22 LEU HBx 1.0 0.0 3.65 1736 1321 A 19 ASP HBy A 37 ILE H 1.0 0.0 4.71 1737 1322 A 37 ILE HD1% A 19 ASP HBy 1.0 0.0 4.73 1738 1323 A 22 LEU HA A 26 PHE HD% 1.0 0.0 4.97 1739 1324 A 22 LEU HDy% A 37 ILE HG1y 1.0 0.0 3.78 1740 1324 A 22 LEU HDx% A 37 ILE HG1y 1.0 0.0 3.78 1741 1324 A 37 ILE HG1x A 22 LEU HDy% 1.0 0.0 3.78 1742 1324 A 22 LEU HDx% A 37 ILE HG1x 1.0 0.0 3.78 1743 1325 A 50 GLY HAy A 22 LEU HDy% 1.0 0.0 5.18 1744 1325 A 22 LEU HDx% A 50 GLY HAy 1.0 0.0 5.18 1745 1326 A 26 PHE HE% A 67 MET HGx 1.0 0.0 4.55 1746 1327 A 26 PHE HE% A 67 MET HGy 1.0 0.0 4.55 1747 1328 A 27 SER H A 32 ILE HG1x 1.0 0.0 5.03 1748 1328 A 27 SER H A 32 ILE HG1y 1.0 0.0 5.03 1749 1329 A 27 SER HA A 32 ILE HG1x 1.0 0.0 3.45 1750 1329 A 27 SER HA A 32 ILE HG1y 1.0 0.0 3.45 1751 1330 A 27 SER HBx A 32 ILE HG1x 1.0 0.0 4.03 1752 1330 A 27 SER HBy A 32 ILE HG1x 1.0 0.0 4.03 1753 1330 A 32 ILE HG1y A 27 SER HBy 1.0 0.0 4.03 1754 1330 A 27 SER HBx A 32 ILE HG1y 1.0 0.0 4.03 1755 1331 A 29 PHE HD% A 62 ASP HBy 1.0 0.0 3.99 1756 1331 A 29 PHE HD% A 62 ASP HBx 1.0 0.0 3.99 1757 1332 A 30 GLY H A 59 ALA HB% 1.0 0.0 5.09 1758 1333 A 31 GLU HA A 31 GLU HGy 1.0 0.0 3.69 1759 1333 A 31 GLU HGx A 31 GLU HA 1.0 0.0 3.69 1760 1334 A 31 GLU HA A 32 ILE HG1x 1.0 0.0 4.31 1761 1334 A 31 GLU HA A 32 ILE HG1y 1.0 0.0 4.31 1762 1335 A 32 ILE H A 32 ILE HG1x 1.0 0.0 3.38 1763 1335 A 32 ILE H A 32 ILE HG1y 1.0 0.0 3.38 1764 1336 A 33 LEU HDy% A 55 LYS HGx 1.0 0.0 3.67 1765 1336 A 33 LEU HDy% A 55 LYS HGy 1.0 0.0 3.67 1766 1337 A 35 SER HA A 36 LYS HBx 1.0 0.0 4.35 1767 1338 A 37 ILE H A 36 LYS HBx 1.0 0.0 4.43 1768 1339 A 36 LYS HBy A 38 ILE HD1% 1.0 0.0 4.15 1769 1340 A 51 PHE H A 36 LYS HBy 1.0 0.0 5.44 1770 1341 A 37 ILE H A 37 ILE HG1y 1.0 0.0 3.51 1771 1341 A 37 ILE H A 37 ILE HG1x 1.0 0.0 3.51 1772 1342 A 37 ILE HG2% A 37 ILE HG1y 1.0 0.0 3.31 1773 1342 A 37 ILE HG2% A 37 ILE HG1x 1.0 0.0 3.31 1774 1343 A 43 THR H A 45 ARG HD2 1.0 0.0 5.30 1775 1343 A 43 THR H A 45 ARG HD3 1.0 0.0 5.30 1776 1344 A 52 VAL H A 51 PHE HBx 1.0 0.0 4.56 1777 1345 A 52 VAL H A 51 PHE HBy 1.0 0.0 4.56 1778 1346 A 59 ALA HB% A 56 ASP HB3 1.0 0.0 3.92 1779 1346 A 59 ALA HB% A 56 ASP HB2 1.0 0.0 3.92 1780 1347 A 59 ALA HA A 62 ASP HBy 1.0 0.0 3.67 1781 1347 A 59 ALA HA A 62 ASP HBx 1.0 0.0 3.67 1782 1348 A 62 ASP H A 62 ASP HBy 1.0 0.0 3.10 1783 1348 A 62 ASP H A 62 ASP HBx 1.0 0.0 3.10 1784 1349 A 63 ALA H A 62 ASP HBy 1.0 0.0 3.42 1785 1349 A 63 ALA H A 62 ASP HBx 1.0 0.0 3.42 1786 1350 A 63 ALA HA A 67 MET H 1.0 0.0 4.94 1787 1351 A 65 GLU H A 65 GLU HB2 1.0 0.0 3.44 1788 1352 A 65 GLU H A 65 GLU HB3 1.0 0.0 3.44 1789 1353 A 67 MET HA A 70 GLN HGx 1.0 0.0 3.74 1790 1354 A 68 ASN H A 67 MET HBx 1.0 0.0 4.64 1791 1355 A 68 ASN H A 67 MET HBy 1.0 0.0 4.64 1792 1356 A 79 VAL HGy% A 67 MET HGx 1.0 0.0 4.83 1793 1357 A 79 VAL HGy% A 67 MET HGy 1.0 0.0 4.83 1794 1358 A 68 ASN H A 70 GLN HGx 1.0 0.0 5.50 1795 1359 A 70 GLN HA A 70 GLN HGy 1.0 0.0 3.94 1796 1360 A 70 GLN HBx A 71 ASP HA 1.0 0.0 4.82 1797 1361 A 77 ILE HD1% A 70 GLN HBx 1.0 0.0 5.16 1798 1362 A 70 GLN HBy A 70 GLN HE21 1.0 0.0 4.65 1799 1363 A 79 VAL HGy% A 70 GLN HGx 1.0 0.0 5.07 1800 1364 A 70 GLN HGy A 77 ILE H 1.0 0.0 4.82 1801 1365 A 70 GLN HGy A 77 ILE HG1y 1.0 0.0 4.64 1802 1366 A 70 GLN HGy A 77 ILE HG1x 1.0 0.0 4.26 1803 1367 A 77 ILE HD1% A 72 LEU H 1.0 0.0 5.50 1804 1368 A 77 ILE HG1y A 72 LEU HBy 1.0 0.0 4.36 1805 1368 A 77 ILE HG1y A 72 LEU HBx 1.0 0.0 4.36 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 5 GLU C A 6 TYR N A 6 TYR CA A 6 TYR C 1.0 -128.0 -72.0 PHI 2 2 A 6 TYR N A 6 TYR CA A 6 TYR C A 7 ARG N 1.0 90.0 154.0 PSI 3 3 A 6 TYR C A 7 ARG N A 7 ARG CA A 7 ARG C 1.0 -144.0 -86.0 PHI 4 4 A 7 ARG N A 7 ARG CA A 7 ARG C A 8 CYS N 1.0 113.0 159.0 PSI 5 5 A 7 ARG C A 8 CYS N A 8 CYS CA A 8 CYS C 1.0 -142.0 -96.0 PHI 6 6 A 8 CYS N A 8 CYS CA A 8 CYS C A 9 PHE N 1.0 111.0 147.0 PSI 7 7 A 8 CYS C A 9 PHE N A 9 PHE CA A 9 PHE C 1.0 -132.0 -76.0 PHI 8 8 A 9 PHE N A 9 PHE CA A 9 PHE C A 10 VAL N 1.0 104.0 148.0 PSI 9 9 A 9 PHE C A 10 VAL N A 10 VAL CA A 10 VAL C 1.0 -143.0 -97.0 PHI 10 10 A 10 VAL N A 10 VAL CA A 10 VAL C A 11 GLY N 1.0 115.0 147.0 PSI 11 11 A 12 GLY C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -123.0 -59.0 PHI 12 12 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 ALA N 1.0 103.0 175.0 PSI 13 13 A 14 ALA C A 15 TRP N A 15 TRP CA A 15 TRP C 1.0 -78.0 -44.0 PHI 14 14 A 15 TRP N A 15 TRP CA A 15 TRP C A 16 ALA N 1.0 -51.0 -7.0 PSI 15 15 A 15 TRP C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -125.0 -77.0 PHI 16 16 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 THR N 1.0 -32.0 38.0 PSI 17 17 A 16 ALA C A 17 THR N A 17 THR CA A 17 THR C 1.0 -80.0 -52.0 PHI 18 18 A 17 THR N A 17 THR CA A 17 THR C A 18 THR N 1.0 119.0 161.0 PSI 19 19 A 17 THR C A 18 THR N A 18 THR CA A 18 THR C 1.0 -128.0 -70.0 PHI 20 20 A 18 THR N A 18 THR CA A 18 THR C A 19 ASP N 1.0 146.0 184.0 PSI 21 21 A 18 THR C A 19 ASP N A 19 ASP CA A 19 ASP C 1.0 -74.0 -48.0 PHI 22 22 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 GLN N 1.0 -53.0 -21.0 PSI 23 23 A 19 ASP C A 20 GLN N A 20 GLN CA A 20 GLN C 1.0 -79.0 -49.0 PHI 24 24 A 20 GLN N A 20 GLN CA A 20 GLN C A 21 THR N 1.0 -59.0 -25.0 PSI 25 25 A 20 GLN C A 21 THR N A 21 THR CA A 21 THR C 1.0 -78.0 -50.0 PHI 26 26 A 21 THR N A 21 THR CA A 21 THR C A 22 LEU N 1.0 -58.0 -28.0 PSI 27 27 A 21 THR C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -77.0 -47.0 PHI 28 28 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 GLY N 1.0 -56.0 -28.0 PSI 29 29 A 22 LEU C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 -76.0 -48.0 PHI 30 30 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 GLU N 1.0 -57.0 -23.0 PSI 31 31 A 23 GLY C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -80.0 -50.0 PHI 32 32 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 ALA N 1.0 -57.0 -29.0 PSI 33 33 A 24 GLU C A 25 ALA N A 25 ALA CA A 25 ALA C 1.0 -85.0 -47.0 PHI 34 34 A 25 ALA N A 25 ALA CA A 25 ALA C A 26 PHE N 1.0 -60.0 -16.0 PSI 35 35 A 25 ALA C A 26 PHE N A 26 PHE CA A 26 PHE C 1.0 -88.0 -52.0 PHI 36 36 A 26 PHE N A 26 PHE CA A 26 PHE C A 27 SER N 1.0 -55.0 -11.0 PSI 37 37 A 26 PHE C A 27 SER N A 27 SER CA A 27 SER C 1.0 -81.0 -51.0 PHI 38 38 A 27 SER N A 27 SER CA A 27 SER C A 28 GLN N 1.0 -56.0 -14.0 PSI 39 39 A 27 SER C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -85.0 -55.0 PHI 40 40 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 PHE N 1.0 -48.0 -2.0 PSI 41 41 A 28 GLN C A 29 PHE N A 29 PHE CA A 29 PHE C 1.0 -114.0 -60.0 PHI 42 42 A 29 PHE N A 29 PHE CA A 29 PHE C A 30 GLY N 1.0 -44.0 20.0 PSI 43 43 A 30 GLY C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -149.0 -65.0 PHI 44 44 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 ILE N 1.0 100.0 162.0 PSI 45 45 A 31 GLU C A 32 ILE N A 32 ILE CA A 32 ILE C 1.0 -144.0 -66.0 PHI 46 46 A 32 ILE N A 32 ILE CA A 32 ILE C A 33 LEU N 1.0 81.0 163.0 PSI 47 47 A 32 ILE C A 33 LEU N A 33 LEU CA A 33 LEU C 1.0 -120.0 -72.0 PHI 48 48 A 33 LEU N A 33 LEU CA A 33 LEU C A 34 ASP N 1.0 -52.0 0.0 PSI 49 49 A 33 LEU C A 34 ASP N A 34 ASP CA A 34 ASP C 1.0 -179.0 -131.0 PHI 50 50 A 34 ASP N A 34 ASP CA A 34 ASP C A 35 SER N 1.0 136.0 168.0 PSI 51 51 A 34 ASP C A 35 SER N A 35 SER CA A 35 SER C 1.0 -154.0 -102.0 PHI 52 52 A 35 SER N A 35 SER CA A 35 SER C A 36 LYS N 1.0 102.0 166.0 PSI 53 53 A 35 SER C A 36 LYS N A 36 LYS CA A 36 LYS C 1.0 -149.0 -107.0 PHI 54 54 A 36 LYS N A 36 LYS CA A 36 LYS C A 37 ILE N 1.0 116.0 164.0 PSI 55 55 A 36 LYS C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -122.0 -74.0 PHI 56 56 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 ILE N 1.0 109.0 147.0 PSI 57 57 A 37 ILE C A 38 ILE N A 38 ILE CA A 38 ILE C 1.0 -120.0 -68.0 PHI 58 58 A 38 ILE N A 38 ILE CA A 38 ILE C A 39 ASN N 1.0 71.0 143.0 PSI 59 59 A 38 ILE C A 39 ASN N A 39 ASN CA A 39 ASN C 1.0 -137.0 -81.0 PHI 60 60 A 39 ASN N A 39 ASN CA A 39 ASN C A 40 ASP N 1.0 107.0 167.0 PSI 61 61 A 39 ASN C A 40 ASP N A 40 ASP CA A 40 ASP C 1.0 -100.0 -56.0 PHI 62 62 A 40 ASP N A 40 ASP CA A 40 ASP C A 41 ARG N 1.0 109.0 161.0 PSI 63 63 A 40 ASP C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -71.0 -45.0 PHI 64 64 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 GLU N 1.0 -50.0 -8.0 PSI 65 65 A 41 ARG C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -101.0 -55.0 PHI 66 66 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 THR N 1.0 -63.0 -3.0 PSI 67 67 A 42 GLU C A 43 THR N A 43 THR CA A 43 THR C 1.0 -121.0 -83.0 PHI 68 68 A 43 THR N A 43 THR CA A 43 THR C A 44 GLY N 1.0 -35.0 25.0 PSI 69 69 A 43 THR C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 59.0 123.0 PHI 70 70 A 44 GLY N A 44 GLY CA A 44 GLY C A 45 ARG N 1.0 -16.0 32.0 PSI 71 71 A 45 ARG C A 46 SER N A 46 SER CA A 46 SER C 1.0 -144.0 -60.0 PHI 72 72 A 46 SER N A 46 SER CA A 46 SER C A 47 ARG N 1.0 103.0 179.0 PSI 73 73 A 46 SER C A 47 ARG N A 47 ARG CA A 47 ARG C 1.0 -122.0 -70.0 PHI 74 74 A 47 ARG N A 47 ARG CA A 47 ARG C A 48 GLY N 1.0 -48.0 30.0 PSI 75 75 A 47 ARG C A 48 GLY N A 48 GLY CA A 48 GLY C 1.0 50.0 98.0 PHI 76 76 A 48 GLY N A 48 GLY CA A 48 GLY C A 49 PHE N 1.0 -10.0 56.0 PSI 77 77 A 48 GLY C A 49 PHE N A 49 PHE CA A 49 PHE C 1.0 -167.0 -99.0 PHI 78 78 A 49 PHE N A 49 PHE CA A 49 PHE C A 50 GLY N 1.0 141.0 175.0 PSI 79 79 A 50 GLY C A 51 PHE N A 51 PHE CA A 51 PHE C 1.0 -165.0 -109.0 PHI 80 80 A 51 PHE N A 51 PHE CA A 51 PHE C A 52 VAL N 1.0 134.0 170.0 PSI 81 81 A 51 PHE C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -159.0 -113.0 PHI 82 82 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 THR N 1.0 109.0 149.0 PSI 83 83 A 52 VAL C A 53 THR N A 53 THR CA A 53 THR C 1.0 -118.0 -80.0 PHI 84 84 A 53 THR N A 53 THR CA A 53 THR C A 54 PHE N 1.0 111.0 141.0 PSI 85 85 A 54 PHE C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -112.0 -60.0 PHI 86 86 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 ASP N 1.0 -50.0 -2.0 PSI 87 87 A 55 LYS C A 56 ASP N A 56 ASP CA A 56 ASP C 1.0 -175.0 -105.0 PHI 88 88 A 56 ASP N A 56 ASP CA A 56 ASP C A 57 GLU N 1.0 138.0 182.0 PSI 89 89 A 56 ASP C A 57 GLU N A 57 GLU CA A 57 GLU C 1.0 -81.0 -43.0 PHI 90 90 A 57 GLU N A 57 GLU CA A 57 GLU C A 58 LYS N 1.0 -58.0 -16.0 PSI 91 91 A 57 GLU C A 58 LYS N A 58 LYS CA A 58 LYS C 1.0 -79.0 -47.0 PHI 92 92 A 58 LYS N A 58 LYS CA A 58 LYS C A 59 ALA N 1.0 -60.0 -16.0 PSI 93 93 A 58 LYS C A 59 ALA N A 59 ALA CA A 59 ALA C 1.0 -83.0 -49.0 PHI 94 94 A 59 ALA N A 59 ALA CA A 59 ALA C A 60 MET N 1.0 -61.0 -19.0 PSI 95 95 A 59 ALA C A 60 MET N A 60 MET CA A 60 MET C 1.0 -78.0 -42.0 PHI 96 96 A 60 MET N A 60 MET CA A 60 MET C A 61 ARG N 1.0 -61.0 -25.0 PSI 97 97 A 60 MET C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -77.0 -47.0 PHI 98 98 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 ASP N 1.0 -58.0 -26.0 PSI 99 99 A 61 ARG C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -80.0 -50.0 PHI 100 100 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 ALA N 1.0 -54.0 -26.0 PSI 101 101 A 62 ASP C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -98.0 -46.0 PHI 102 102 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 ILE N 1.0 -58.0 -18.0 PSI 103 103 A 63 ALA C A 64 ILE N A 64 ILE CA A 64 ILE C 1.0 -75.0 -51.0 PHI 104 104 A 64 ILE N A 64 ILE CA A 64 ILE C A 65 GLU N 1.0 -56.0 -26.0 PSI 105 105 A 64 ILE C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -79.0 -51.0 PHI 106 106 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 GLY N 1.0 -59.0 -17.0 PSI 107 107 A 65 GLU C A 66 GLY N A 66 GLY CA A 66 GLY C 1.0 -105.0 -45.0 PHI 108 108 A 66 GLY N A 66 GLY CA A 66 GLY C A 67 MET N 1.0 -51.0 -5.0 PSI 109 109 A 66 GLY C A 67 MET N A 67 MET CA A 67 MET C 1.0 -120.0 -78.0 PHI 110 110 A 67 MET N A 67 MET CA A 67 MET C A 68 ASN N 1.0 -25.0 21.0 PSI 111 111 A 67 MET C A 68 ASN N A 68 ASN CA A 68 ASN C 1.0 -73.0 -41.0 PHI 112 112 A 68 ASN N A 68 ASN CA A 68 ASN C A 69 GLY N 1.0 117.0 147.0 PSI 113 113 A 68 ASN C A 69 GLY N A 69 GLY CA A 69 GLY C 1.0 65.0 111.0 PHI 114 114 A 69 GLY N A 69 GLY CA A 69 GLY C A 70 GLN N 1.0 -30.0 12.0 PSI 115 115 A 69 GLY C A 70 GLN N A 70 GLN CA A 70 GLN C 1.0 -113.0 -59.0 PHI 116 116 A 70 GLN N A 70 GLN CA A 70 GLN C A 71 ASP N 1.0 88.0 182.0 PSI 117 117 A 70 GLN C A 71 ASP N A 71 ASP CA A 71 ASP C 1.0 -145.0 -71.0 PHI 118 118 A 71 ASP N A 71 ASP CA A 71 ASP C A 72 LEU N 1.0 96.0 160.0 PSI 119 119 A 71 ASP C A 72 LEU N A 72 LEU CA A 72 LEU C 1.0 -163.0 -85.0 PHI 120 120 A 72 LEU N A 72 LEU CA A 72 LEU C A 73 ASP N 1.0 109.0 143.0 PSI 121 121 A 72 LEU C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 37.0 67.0 PHI 122 122 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 GLY N 1.0 28.0 56.0 PSI 123 123 A 73 ASP C A 74 GLY N A 74 GLY CA A 74 GLY C 1.0 55.0 97.0 PHI 124 124 A 74 GLY N A 74 GLY CA A 74 GLY C A 75 ARG N 1.0 -21.0 29.0 PSI 125 125 A 74 GLY C A 75 ARG N A 75 ARG CA A 75 ARG C 1.0 -138.0 -86.0 PHI 126 126 A 75 ARG N A 75 ARG CA A 75 ARG C A 76 ASN N 1.0 129.0 177.0 PSI 127 127 A 75 ARG C A 76 ASN N A 76 ASN CA A 76 ASN C 1.0 -108.0 -58.0 PHI 128 128 A 76 ASN N A 76 ASN CA A 76 ASN C A 77 ILE N 1.0 109.0 163.0 PSI 129 129 A 76 ASN C A 77 ILE N A 77 ILE CA A 77 ILE C 1.0 -134.0 -70.0 PHI 130 130 A 77 ILE N A 77 ILE CA A 77 ILE C A 78 THR N 1.0 104.0 178.0 PSI 131 131 A 77 ILE C A 78 THR N A 78 THR CA A 78 THR C 1.0 -147.0 -101.0 PHI 132 132 A 78 THR N A 78 THR CA A 78 THR C A 79 VAL N 1.0 116.0 168.0 PSI 133 133 A 78 THR C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -154.0 -110.0 PHI 134 134 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 ASN N 1.0 116.0 166.0 PSI 135 135 A 79 VAL C A 80 ASN N A 80 ASN CA A 80 ASN C 1.0 -155.0 -117.0 PHI 136 136 A 80 ASN N A 80 ASN CA A 80 ASN C A 81 GLU N 1.0 108.0 172.0 PSI 137 137 A 80 ASN C A 81 GLU N A 81 GLU CA A 81 GLU C 1.0 -119.0 -49.0 PHI 138 138 A 81 GLU N A 81 GLU CA A 81 GLU C A 82 ALA N 1.0 112.0 150.0 PSI stop_ save_