data_nef_c34432_6svc save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6SVC 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 5 SER start . . 2 A 6 LYS middle . . 3 A 7 LEU middle . . 4 A 8 PRO middle . false 5 A 9 PRO middle . false 6 A 10 GLY middle . false 7 A 11 TRP middle . . 8 A 12 GLU middle . . 9 A 13 LYS middle . . 10 A 14 ARG middle . . 11 A 15 MET middle . . 12 A 16 SER middle . . 13 A 17 ARG middle . . 14 A 18 ASN middle . . 15 A 19 SER middle . . 16 A 20 GLY middle . false 17 A 21 ARG middle . . 18 A 22 VAL middle . . 19 A 23 TYR middle . . 20 A 24 TYR middle . . 21 A 25 PHE middle . . 22 A 26 ASN middle . . 23 A 27 HIS middle . . 24 A 28 ILE middle . . 25 A 29 THR middle . . 26 A 30 ASN middle . . 27 A 31 ALA middle . . 28 A 32 SER middle . . 29 A 33 GLN middle . . 30 A 34 PHE middle . . 31 A 35 GLU middle . . 32 A 36 ARG middle . . 33 A 37 PRO middle . false 34 A 38 SER middle . . 35 A 39 GLY end . false stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 5 SER HA H 1 4.098 0.020 A 5 SER CA C 13 57.441 0.400 A 6 LYS HA H 1 4.355 0.020 A 6 LYS HBy H 1 1.825 0.020 A 6 LYS HBx H 1 1.759 0.020 A 6 LYS HD2 H 1 1.684 0.020 A 6 LYS HEx H 1 2.996 0.020 A 6 LYS HEy H 1 2.996 0.020 A 6 LYS HGx H 1 1.454 0.020 A 6 LYS HGy H 1 1.454 0.020 A 6 LYS CB C 13 33.510 0.400 A 6 LYS CD C 13 29.416 0.400 A 6 LYS CE C 13 42.187 0.400 A 6 LYS CG C 13 24.657 0.400 A 7 LEU H H 1 8.696 0.020 A 7 LEU HA H 1 4.466 0.020 A 7 LEU HB2 H 1 1.791 0.020 A 7 LEU HB3 H 1 1.386 0.020 A 7 LEU HDx% H 1 0.740 0.020 A 7 LEU HDy% H 1 1.043 0.020 A 7 LEU HG H 1 1.866 0.020 A 7 LEU CA C 13 53.207 0.400 A 7 LEU CB C 13 41.996 0.400 A 7 LEU CDy C 13 26.598 0.400 A 7 LEU CDx C 13 24.031 0.400 A 7 LEU CG C 13 27.428 0.400 A 7 LEU N N 15 125.143 0.400 A 8 PRO HA H 1 4.818 0.020 A 8 PRO HB2 H 1 1.969 0.020 A 8 PRO HB3 H 1 2.583 0.020 A 8 PRO HD2 H 1 2.979 0.020 A 8 PRO HD3 H 1 3.653 0.020 A 8 PRO HG2 H 1 1.744 0.020 A 8 PRO HG3 H 1 1.617 0.020 A 8 PRO CB C 13 29.919 0.400 A 8 PRO CD C 13 50.542 0.400 A 8 PRO CG C 13 27.543 0.400 A 9 PRO HA H 1 4.329 0.020 A 9 PRO HBy H 1 2.324 0.020 A 9 PRO HBx H 1 1.843 0.020 A 9 PRO HD2 H 1 3.613 0.020 A 9 PRO HD3 H 1 3.903 0.020 A 9 PRO HGx H 1 2.033 0.020 A 9 PRO HGy H 1 2.126 0.020 A 9 PRO CA C 13 64.420 0.400 A 9 PRO CB C 13 32.170 0.400 A 9 PRO CD C 13 50.683 0.400 A 9 PRO CG C 13 27.899 0.400 A 10 GLY H H 1 8.795 0.020 A 10 GLY HA2 H 1 3.210 0.020 A 10 GLY HA3 H 1 4.008 0.020 A 10 GLY CA C 13 45.153 0.400 A 10 GLY N N 15 112.094 0.400 A 11 TRP H H 1 7.334 0.020 A 11 TRP HA H 1 5.176 0.020 A 11 TRP HB2 H 1 3.212 0.020 A 11 TRP HB3 H 1 2.922 0.020 A 11 TRP HD1 H 1 6.928 0.020 A 11 TRP HE1 H 1 10.655 0.020 A 11 TRP HE3 H 1 7.336 0.020 A 11 TRP HH2 H 1 6.971 0.020 A 11 TRP HZ2 H 1 7.411 0.020 A 11 TRP HZ3 H 1 6.932 0.020 A 11 TRP CA C 13 57.464 0.400 A 11 TRP CB C 13 32.611 0.400 A 11 TRP CD1 C 13 127.989 0.400 A 11 TRP CE3 C 13 120.368 0.400 A 11 TRP CH2 C 13 125.402 0.400 A 11 TRP CZ2 C 13 115.036 0.400 A 11 TRP CZ3 C 13 123.048 0.400 A 11 TRP N N 15 117.765 0.400 A 11 TRP NE1 N 15 130.091 0.400 A 12 GLU H H 1 9.731 0.020 A 12 GLU HA H 1 4.813 0.020 A 12 GLU HBx H 1 2.205 0.020 A 12 GLU HBy H 1 2.205 0.020 A 12 GLU HG2 H 1 2.510 0.020 A 12 GLU HG3 H 1 2.314 0.020 A 12 GLU CA C 13 54.803 0.400 A 12 GLU CB C 13 34.609 0.400 A 12 GLU CG C 13 36.499 0.400 A 12 GLU N N 15 121.053 0.400 A 13 LYS H H 1 9.023 0.020 A 13 LYS HA H 1 4.316 0.020 A 13 LYS HB2 H 1 1.619 0.020 A 13 LYS HB3 H 1 1.771 0.020 A 13 LYS HDx H 1 1.657 0.020 A 13 LYS HDy H 1 1.727 0.020 A 13 LYS HEx H 1 2.908 0.020 A 13 LYS HEy H 1 2.908 0.020 A 13 LYS HGy H 1 1.039 0.020 A 13 LYS HGx H 1 0.967 0.020 A 13 LYS CA C 13 56.424 0.400 A 13 LYS CB C 13 33.954 0.400 A 13 LYS CD C 13 29.988 0.400 A 13 LYS CE C 13 42.106 0.400 A 13 LYS CG C 13 25.198 0.400 A 13 LYS N N 15 126.271 0.400 A 14 ARG H H 1 8.937 0.020 A 14 ARG HA H 1 4.431 0.020 A 14 ARG HB2 H 1 0.084 0.020 A 14 ARG HB3 H 1 1.307 0.020 A 14 ARG HDy H 1 2.885 0.020 A 14 ARG HDx H 1 2.620 0.020 A 14 ARG HE H 1 6.972 0.020 A 14 ARG HG2 H 1 1.370 0.020 A 14 ARG HG3 H 1 1.216 0.020 A 14 ARG CA C 13 54.684 0.400 A 14 ARG CB C 13 34.791 0.400 A 14 ARG CD C 13 43.808 0.400 A 14 ARG CG C 13 28.074 0.400 A 14 ARG N N 15 128.367 0.400 A 15 MET H H 1 8.228 0.020 A 15 MET HA H 1 4.960 0.020 A 15 MET HBx H 1 1.821 0.020 A 15 MET HBy H 1 1.821 0.020 A 15 MET HGy H 1 2.379 0.020 A 15 MET HGx H 1 2.278 0.020 A 15 MET CB C 13 34.645 0.400 A 15 MET CG C 13 31.838 0.400 A 15 MET N N 15 117.847 0.400 A 16 SER H H 1 8.982 0.020 A 16 SER HA H 1 4.647 0.020 A 16 SER HB2 H 1 4.050 0.020 A 16 SER HB3 H 1 4.113 0.020 A 16 SER CA C 13 58.442 0.400 A 16 SER CB C 13 63.671 0.400 A 16 SER N N 15 121.904 0.400 A 17 ARG H H 1 9.276 0.020 A 17 ARG HA H 1 4.080 0.020 A 17 ARG HBx H 1 1.847 0.020 A 17 ARG HBy H 1 1.847 0.020 A 17 ARG HDx H 1 3.195 0.020 A 17 ARG HDy H 1 3.195 0.020 A 17 ARG HGx H 1 1.665 0.020 A 17 ARG HGy H 1 1.710 0.020 A 17 ARG CA C 13 58.468 0.400 A 17 ARG CB C 13 30.193 0.400 A 17 ARG CD C 13 43.271 0.400 A 17 ARG CG C 13 27.350 0.400 A 17 ARG N N 15 128.523 0.400 A 18 ASN H H 1 8.606 0.020 A 18 ASN HA H 1 4.583 0.020 A 18 ASN HBx H 1 2.814 0.020 A 18 ASN HBy H 1 2.814 0.020 A 18 ASN HD21 H 1 7.825 0.020 A 18 ASN HD22 H 1 7.026 0.020 A 18 ASN CA C 13 55.303 0.400 A 18 ASN CB C 13 38.697 0.400 A 18 ASN N N 15 116.322 0.400 A 18 ASN ND2 N 15 114.156 0.400 A 19 SER HA H 1 4.509 0.020 A 19 SER HBx H 1 3.829 0.020 A 19 SER HBy H 1 3.966 0.020 A 19 SER CA C 13 58.357 0.400 A 19 SER CB C 13 65.094 0.400 A 20 GLY H H 1 8.019 0.020 A 20 GLY HAy H 1 4.029 0.020 A 20 GLY HAx H 1 3.930 0.020 A 20 GLY CA C 13 46.198 0.400 A 20 GLY N N 15 111.905 0.400 A 21 ARG H H 1 7.820 0.020 A 21 ARG HA H 1 4.358 0.020 A 21 ARG HB2 H 1 1.723 0.020 A 21 ARG HB3 H 1 1.920 0.020 A 21 ARG HD2 H 1 2.982 0.020 A 21 ARG HD3 H 1 2.827 0.020 A 21 ARG HE H 1 6.946 0.020 A 21 ARG HH2y H 1 6.357 0.020 A 21 ARG HH2x H 1 6.133 0.020 A 21 ARG CA C 13 56.555 0.400 A 21 ARG CB C 13 31.960 0.400 A 21 ARG CD C 13 43.700 0.400 A 21 ARG N N 15 119.770 0.400 A 21 ARG NH2 N 15 69.934 0.400 A 22 VAL H H 1 8.652 0.020 A 22 VAL HA H 1 4.557 0.020 A 22 VAL HB H 1 1.944 0.020 A 22 VAL HGx% H 1 0.752 0.020 A 22 VAL HGy% H 1 1.030 0.020 A 22 VAL CA C 13 62.703 0.400 A 22 VAL CB C 13 32.954 0.400 A 22 VAL CGx C 13 21.687 0.400 A 22 VAL CGy C 13 22.494 0.400 A 22 VAL N N 15 126.887 0.400 A 23 TYR H H 1 8.715 0.020 A 23 TYR HA H 1 4.797 0.020 A 23 TYR HB2 H 1 2.558 0.020 A 23 TYR HB3 H 1 2.872 0.020 A 23 TYR HD1 H 1 6.929 0.020 A 23 TYR HD2 H 1 6.929 0.020 A 23 TYR HE1 H 1 6.438 0.020 A 23 TYR HE2 H 1 6.438 0.020 A 23 TYR CA C 13 55.873 0.400 A 23 TYR CB C 13 40.221 0.400 A 23 TYR CDx C 13 134.204 0.400 A 23 TYR CEx C 13 117.581 0.400 A 23 TYR N N 15 123.244 0.400 A 24 TYR H H 1 9.158 0.020 A 24 TYR HA H 1 5.283 0.020 A 24 TYR HB2 H 1 2.624 0.020 A 24 TYR HB3 H 1 2.882 0.020 A 24 TYR HD1 H 1 6.790 0.020 A 24 TYR HD2 H 1 6.790 0.020 A 24 TYR HE1 H 1 6.703 0.020 A 24 TYR HE2 H 1 6.703 0.020 A 24 TYR CA C 13 57.113 0.400 A 24 TYR CB C 13 41.444 0.400 A 24 TYR CDx C 13 133.760 0.400 A 24 TYR CEx C 13 117.149 0.400 A 24 TYR N N 15 117.336 0.400 A 25 PHE H H 1 9.357 0.020 A 25 PHE HA H 1 5.648 0.020 A 25 PHE HB2 H 1 2.918 0.020 A 25 PHE HB3 H 1 2.531 0.020 A 25 PHE HD1 H 1 6.918 0.020 A 25 PHE HD2 H 1 6.918 0.020 A 25 PHE HE1 H 1 6.997 0.020 A 25 PHE HE2 H 1 6.997 0.020 A 25 PHE HZ H 1 7.292 0.020 A 25 PHE CA C 13 55.947 0.400 A 25 PHE CB C 13 44.597 0.400 A 25 PHE CDx C 13 131.648 0.400 A 25 PHE CEx C 13 130.824 0.400 A 25 PHE CZ C 13 130.560 0.400 A 25 PHE N N 15 124.521 0.400 A 26 ASN H H 1 8.229 0.020 A 26 ASN HA H 1 4.349 0.020 A 26 ASN HB2 H 1 -0.763 0.020 A 26 ASN HB3 H 1 1.953 0.020 A 26 ASN HD21 H 1 4.123 0.020 A 26 ASN HD22 H 1 6.600 0.020 A 26 ASN CA C 13 50.690 0.400 A 26 ASN CB C 13 38.016 0.400 A 26 ASN N N 15 129.608 0.400 A 26 ASN ND2 N 15 110.126 0.400 A 27 HIS H H 1 8.156 0.020 A 27 HIS HA H 1 4.114 0.020 A 27 HIS HBx H 1 3.115 0.020 A 27 HIS HBy H 1 3.367 0.020 A 27 HIS HD2 H 1 7.130 0.020 A 27 HIS CA C 13 57.447 0.400 A 27 HIS CB C 13 29.082 0.400 A 27 HIS CD2 C 13 120.564 0.400 A 27 HIS N N 15 120.552 0.400 A 28 ILE H H 1 8.368 0.020 A 28 ILE HA H 1 3.804 0.020 A 28 ILE HB H 1 1.959 0.020 A 28 ILE HD1% H 1 0.692 0.020 A 28 ILE HG12 H 1 0.912 0.020 A 28 ILE HG13 H 1 1.208 0.020 A 28 ILE HG2% H 1 0.734 0.020 A 28 ILE CA C 13 63.543 0.400 A 28 ILE CB C 13 37.323 0.400 A 28 ILE CD1 C 13 12.280 0.400 A 28 ILE CG1 C 13 28.031 0.400 A 28 ILE CG2 C 13 17.111 0.400 A 28 ILE N N 15 122.265 0.400 A 29 THR H H 1 7.304 0.020 A 29 THR HA H 1 4.058 0.020 A 29 THR HB H 1 4.201 0.020 A 29 THR HG1 H 1 5.104 0.020 A 29 THR HG2% H 1 0.899 0.020 A 29 THR CA C 13 61.386 0.400 A 29 THR CB C 13 70.234 0.400 A 29 THR CG2 C 13 21.240 0.400 A 29 THR N N 15 108.150 0.400 A 30 ASN H H 1 8.043 0.020 A 30 ASN HA H 1 4.102 0.020 A 30 ASN HB2 H 1 3.097 0.020 A 30 ASN HB3 H 1 2.897 0.020 A 30 ASN HD2y H 1 7.503 0.020 A 30 ASN HD2x H 1 6.885 0.020 A 30 ASN CA C 13 55.256 0.400 A 30 ASN CB C 13 37.640 0.400 A 30 ASN N N 15 118.273 0.400 A 30 ASN ND2 N 15 113.682 0.400 A 31 ALA H H 1 7.120 0.020 A 31 ALA HA H 1 4.392 0.020 A 31 ALA HB% H 1 1.221 0.020 A 31 ALA CA C 13 52.342 0.400 A 31 ALA CB C 13 20.990 0.400 A 31 ALA N N 15 122.285 0.400 A 32 SER H H 1 8.395 0.020 A 32 SER HA H 1 6.063 0.020 A 32 SER HBy H 1 3.870 0.020 A 32 SER HBx H 1 3.777 0.020 A 32 SER CA C 13 57.193 0.400 A 32 SER CB C 13 66.775 0.400 A 32 SER N N 15 112.605 0.400 A 33 GLN H H 1 9.381 0.020 A 33 GLN HA H 1 4.849 0.020 A 33 GLN HBy H 1 2.527 0.020 A 33 GLN HBx H 1 2.173 0.020 A 33 GLN HE2y H 1 7.427 0.020 A 33 GLN HE2x H 1 6.754 0.020 A 33 GLN CA C 13 54.987 0.400 A 33 GLN CB C 13 31.949 0.400 A 33 GLN N N 15 117.286 0.400 A 33 GLN NE2 N 15 113.492 0.400 A 34 PHE H H 1 8.993 0.020 A 34 PHE HA H 1 4.787 0.020 A 34 PHE HB2 H 1 2.928 0.020 A 34 PHE HB3 H 1 3.399 0.020 A 34 PHE HD1 H 1 7.612 0.020 A 34 PHE HD2 H 1 7.612 0.020 A 34 PHE HE1 H 1 7.232 0.020 A 34 PHE HE2 H 1 7.232 0.020 A 34 PHE HZ H 1 7.171 0.020 A 34 PHE CA C 13 61.178 0.400 A 34 PHE CB C 13 39.879 0.400 A 34 PHE CDx C 13 131.952 0.400 A 34 PHE CEx C 13 131.607 0.400 A 34 PHE CZ C 13 130.138 0.400 A 34 PHE N N 15 119.431 0.400 A 35 GLU H H 1 8.106 0.020 A 35 GLU HA H 1 4.284 0.020 A 35 GLU HB2 H 1 1.863 0.020 A 35 GLU HB3 H 1 1.788 0.020 A 35 GLU HG2 H 1 2.291 0.020 A 35 GLU HG3 H 1 2.209 0.020 A 35 GLU CA C 13 56.293 0.400 A 35 GLU CB C 13 29.898 0.400 A 35 GLU CG C 13 36.508 0.400 A 35 GLU N N 15 119.112 0.400 A 36 ARG H H 1 8.631 0.020 A 36 ARG HA H 1 2.707 0.020 A 36 ARG HBx H 1 1.346 0.020 A 36 ARG HBy H 1 1.346 0.020 A 36 ARG HGy H 1 1.140 0.020 A 36 ARG HGx H 1 0.845 0.020 A 36 ARG CA C 13 54.393 0.400 A 36 ARG CB C 13 30.048 0.400 A 36 ARG CG C 13 27.235 0.400 A 36 ARG N N 15 126.536 0.400 A 37 PRO HA H 1 3.846 0.020 A 37 PRO HB2 H 1 0.778 0.020 A 37 PRO HB3 H 1 0.724 0.020 A 37 PRO HD2 H 1 2.155 0.020 A 37 PRO HD3 H 1 2.453 0.020 A 37 PRO HG2 H 1 0.450 0.020 A 37 PRO HG3 H 1 -0.157 0.020 A 37 PRO CA C 13 62.190 0.400 A 37 PRO CB C 13 31.457 0.400 A 37 PRO CD C 13 50.131 0.400 A 37 PRO CG C 13 25.752 0.400 A 38 SER H H 1 8.243 0.020 A 38 SER HA H 1 4.254 0.020 A 38 SER HBy H 1 3.754 0.020 A 38 SER HBx H 1 3.674 0.020 A 38 SER CA C 13 57.990 0.400 A 38 SER CB C 13 64.589 0.400 A 38 SER N N 15 116.029 0.400 A 39 GLY H H 1 7.981 0.020 A 39 GLY HAy H 1 3.734 0.020 A 39 GLY HAx H 1 3.707 0.020 A 39 GLY CA C 13 46.203 0.400 A 39 GLY N N 15 117.079 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 6 LYS HA A 6 LYS HD2 1.0 . 4.34 2 2 A 6 LYS HA A 7 LEU HG 1.0 . 3.02 3 3 A 7 LEU H A 7 LEU HA 1.0 . 2.84 4 4 A 7 LEU H A 7 LEU HB2 1.0 . 2.39 5 5 A 7 LEU H A 7 LEU HB3 1.0 . 3.30 6 6 A 7 LEU HG A 7 LEU H 1.0 . 2.02 7 7 A 7 LEU H A 7 LEU HDy% 1.0 . 3.33 8 8 A 7 LEU HA A 7 LEU HB2 1.0 . 2.71 9 9 A 7 LEU HA A 7 LEU HB3 1.0 . 2.43 10 10 A 7 LEU HG A 7 LEU HA 1.0 . 2.43 11 11 A 7 LEU HA A 7 LEU HDy% 1.0 . 2.93 12 12 A 7 LEU HA A 7 LEU HDx% 1.0 . 2.35 13 13 A 7 LEU HA A 8 PRO HD2 1.0 . 2.39 14 14 A 7 LEU HB2 A 11 TRP H 1.0 . 3.46 15 15 A 7 LEU HB2 A 11 TRP HB2 1.0 . 3.23 16 16 A 7 LEU HB2 A 11 TRP HB3 1.0 . 2.72 17 17 A 7 LEU HG A 7 LEU HB3 1.0 . 2.35 18 18 A 7 LEU HB3 A 7 LEU HDy% 1.0 . 2.31 19 19 A 7 LEU HB3 A 7 LEU HDx% 1.0 . 2.30 20 20 A 7 LEU HB3 A 8 PRO HD3 1.0 . 3.50 21 21 A 7 LEU HB3 A 11 TRP H 1.0 . 3.02 22 22 A 7 LEU HB3 A 11 TRP HB2 1.0 . 2.34 23 23 A 7 LEU HB3 A 11 TRP HB3 1.0 . 1.91 24 24 A 7 LEU HB2 A 7 LEU HDy% 1.0 . 1.80 25 25 A 7 LEU HDy% A 8 PRO HD2 1.0 . 2.50 26 26 A 7 LEU HDy% A 11 TRP HB2 1.0 . 2.98 27 27 A 7 LEU HDy% A 11 TRP HB3 1.0 . 1.90 28 28 A 7 LEU HDy% A 12 GLU H 1.0 . 2.50 29 29 A 7 LEU HDy% A 12 GLU HA 1.0 . 2.69 30 30 A 7 LEU HDy% A 37 PRO HD2 1.0 . 2.43 31 31 A 7 LEU HB2 A 7 LEU HDx% 1.0 . 2.01 32 32 A 7 LEU HDx% A 8 PRO HD3 1.0 . 3.01 33 33 A 7 LEU HDx% A 8 PRO HD2 1.0 . 2.79 34 34 A 7 LEU HDx% A 11 TRP HB2 1.0 . 2.16 35 35 A 7 LEU HDx% A 11 TRP HB3 1.0 . 1.95 36 36 A 7 LEU HDx% A 13 LYS H 1.0 . 3.74 37 37 A 7 LEU HDx% A 24 TYR HA 1.0 . 2.50 38 38 A 7 LEU HDx% A 24 TYR HB2 1.0 . 2.85 39 39 A 7 LEU HDx% A 24 TYR HD% 1.0 . 2.43 40 40 A 7 LEU HDx% A 24 TYR HE% 1.0 . 2.23 41 41 A 8 PRO HB2 A 11 TRP HD1 1.0 . 2.29 42 42 A 8 PRO HB2 A 11 TRP HE1 1.0 . 3.37 43 43 A 11 TRP HD1 A 8 PRO HG3 1.0 . 3.50 44 44 A 11 TRP HE1 A 8 PRO HG3 1.0 . 3.58 45 45 A 8 PRO HG3 A 39 GLY H 1.0 . 4.37 46 46 A 8 PRO HG2 A 38 SER HA 1.0 . 3.76 47 47 A 39 GLY H A 8 PRO HG2 1.0 . 4.08 48 48 A 8 PRO HD3 A 37 PRO HG2 1.0 . 3.45 49 49 A 8 PRO HD3 A 37 PRO HG3 1.0 . 4.78 50 50 A 8 PRO HD2 A 11 TRP HE1 1.0 . 3.52 51 51 A 8 PRO HD2 A 36 ARG HA 1.0 . 3.22 52 52 A 8 PRO HD2 A 36 ARG HGy 1.0 . 2.13 53 53 A 8 PRO HD2 A 36 ARG HGx 1.0 . 2.13 54 54 A 8 PRO HD2 A 37 PRO HG2 1.0 . 2.68 55 55 A 8 PRO HD2 A 37 PRO HD2 1.0 . 3.16 56 56 A 9 PRO HA A 10 GLY H 1.0 . 1.94 57 57 A 9 PRO HA A 10 GLY HA2 1.0 . 3.92 58 58 A 11 TRP H A 9 PRO HA 1.0 . 3.15 59 59 A 10 GLY H A 9 PRO HBy 1.0 . 3.09 60 60 A 10 GLY H A 9 PRO HBx 1.0 . 3.09 61 61 A 8 PRO HB2 A 9 PRO HD2 1.0 . 1.97 62 62 A 10 GLY H A 10 GLY HA2 1.0 . 2.16 63 63 A 10 GLY H A 10 GLY HA3 1.0 . 2.50 64 64 A 11 TRP H A 10 GLY H 1.0 . 2.50 65 65 A 10 GLY HA2 A 28 ILE HG13 1.0 . 3.08 66 66 A 10 GLY HA2 A 28 ILE HD1% 1.0 . 2.95 67 67 A 11 TRP H A 10 GLY HA3 1.0 . 2.84 68 68 A 10 GLY HA3 A 28 ILE HG12 1.0 . 4.31 69 69 A 10 GLY HA3 A 28 ILE HG13 1.0 . 3.06 70 70 A 10 GLY HA3 A 28 ILE HD1% 1.0 . 2.59 71 71 A 11 TRP H A 10 GLY HA2 1.0 . 2.49 72 72 A 11 TRP H A 26 ASN HB2 1.0 . 2.57 73 73 A 11 TRP H A 11 TRP HA 1.0 . 2.49 74 74 A 11 TRP HB2 A 11 TRP HA 1.0 . 2.56 75 75 A 11 TRP HB3 A 11 TRP HA 1.0 . 2.33 76 76 A 11 TRP HA A 11 TRP HE3 1.0 . 2.39 77 77 A 12 GLU H A 11 TRP HA 1.0 . 1.94 78 78 A 11 TRP HA A 26 ASN HA 1.0 . 2.10 79 79 A 11 TRP HA A 27 HIS H 1.0 . 3.19 80 80 A 8 PRO HD2 A 11 TRP HB2 1.0 . 2.36 81 81 A 11 TRP HB2 A 11 TRP HD1 1.0 . 2.57 82 82 A 11 TRP HB2 A 11 TRP HE3 1.0 . 3.09 83 83 A 11 TRP HB2 A 12 GLU H 1.0 . 3.52 84 84 A 11 TRP H A 11 TRP HB3 1.0 . 2.77 85 85 A 11 TRP HB3 A 11 TRP HD1 1.0 . 3.53 86 86 A 11 TRP HB3 A 12 GLU H 1.0 . 2.59 87 87 A 11 TRP HD1 A 8 PRO HB3 1.0 . 2.94 88 88 A 11 TRP H A 11 TRP HD1 1.0 . 2.32 89 89 A 24 TYR HB2 A 11 TRP HE3 1.0 . 3.22 90 90 A 11 TRP HE3 A 25 PHE H 1.0 . 2.76 91 91 A 11 TRP HE3 A 25 PHE HA 1.0 . 2.80 92 92 A 37 PRO HG3 A 11 TRP HE3 1.0 . 3.38 93 93 A 11 TRP HE1 A 8 PRO HB3 1.0 . 3.31 94 94 A 11 TRP HE1 A 26 ASN HD21 1.0 . 2.80 95 95 A 11 TRP HE1 A 26 ASN HD22 1.0 . 3.55 96 96 A 11 TRP HE1 A 37 PRO HG3 1.0 . 4.12 97 97 A 11 TRP HZ3 A 26 ASN H 1.0 . 2.35 98 98 A 26 ASN HB2 A 11 TRP HZ3 1.0 . 2.44 99 99 A 11 TRP HZ3 A 33 GLN HBy 1.0 . 2.50 100 100 A 26 ASN HD21 A 11 TRP HZ2 1.0 . 3.05 101 101 A 11 TRP HZ2 A 31 ALA HB% 1.0 . 3.31 102 102 A 31 ALA HB% A 11 TRP HH2 1.0 . 2.56 103 103 A 11 TRP H A 12 GLU H 1.0 . 3.30 104 104 A 12 GLU H A 11 TRP HE3 1.0 . 2.20 105 105 A 12 GLU H A 12 GLU HA 1.0 . 2.81 106 106 A 12 GLU H A 12 GLU HBx 1.0 . 2.42 107 106 A 12 GLU H A 12 GLU HBy 1.0 . 2.42 108 107 A 12 GLU H A 12 GLU HG2 1.0 . 3.08 109 108 A 12 GLU H A 25 PHE H 1.0 . 2.49 110 109 A 12 GLU H A 25 PHE HB2 1.0 . 3.38 111 110 A 12 GLU H A 25 PHE HB3 1.0 . 2.82 112 111 A 12 GLU H A 26 ASN HA 1.0 . 3.17 113 112 A 12 GLU HA A 12 GLU HBx 1.0 . 2.16 114 112 A 12 GLU HA A 12 GLU HBy 1.0 . 2.16 115 113 A 12 GLU HA A 13 LYS H 1.0 . 2.06 116 114 A 13 LYS H A 12 GLU HBx 1.0 . 2.88 117 114 A 13 LYS H A 12 GLU HBy 1.0 . 2.88 118 115 A 25 PHE H A 12 GLU HBx 1.0 . 2.47 119 115 A 25 PHE H A 12 GLU HBy 1.0 . 2.47 120 116 A 27 HIS HD2 A 12 GLU HBx 1.0 . 2.33 121 116 A 12 GLU HBy A 27 HIS HD2 1.0 . 2.33 122 117 A 13 LYS H A 12 GLU HG2 1.0 . 3.18 123 118 A 12 GLU HG2 A 14 ARG HG2 1.0 . 2.41 124 119 A 12 GLU H A 12 GLU HG3 1.0 . 2.74 125 120 A 7 LEU HDy% A 13 LYS H 1.0 . 2.44 126 121 A 13 LYS H A 13 LYS HB2 1.0 . 2.40 127 122 A 13 LYS H A 13 LYS HA 1.0 . 2.29 128 123 A 13 LYS HB2 A 13 LYS HA 1.0 . 1.99 129 124 A 24 TYR HA A 13 LYS HA 1.0 . 1.71 130 125 A 24 TYR HD% A 13 LYS HA 1.0 . 1.82 131 126 A 24 TYR HE% A 13 LYS HA 1.0 . 2.33 132 127 A 25 PHE H A 13 LYS HA 1.0 . 2.78 133 128 A 7 LEU HA A 13 LYS HB2 1.0 . 3.44 134 129 A 13 LYS HB2 A 14 ARG H 1.0 . 3.06 135 130 A 24 TYR HE% A 13 LYS HB2 1.0 . 2.48 136 131 A 13 LYS H A 13 LYS HB3 1.0 . 1.91 137 132 A 14 ARG H A 13 LYS HB3 1.0 . 2.91 138 133 A 24 TYR HE% A 13 LYS HB3 1.0 . 2.58 139 134 A 13 LYS HEy A 13 LYS HDx 1.0 . 2.09 140 134 A 13 LYS HDx A 13 LYS HEx 1.0 . 2.09 141 135 A 22 VAL HGy% A 13 LYS HDx 1.0 . 3.07 142 136 A 13 LYS HEy A 13 LYS HDy 1.0 . 2.09 143 136 A 13 LYS HDy A 13 LYS HEx 1.0 . 2.09 144 137 A 22 VAL HGy% A 13 LYS HDy 1.0 . 3.07 145 138 A 13 LYS H A 13 LYS HEx 1.0 . 3.56 146 138 A 13 LYS H A 13 LYS HEy 1.0 . 3.56 147 139 A 13 LYS HB2 A 13 LYS HEx 1.0 . 2.33 148 139 A 13 LYS HB2 A 13 LYS HEy 1.0 . 2.33 149 140 A 22 VAL HGy% A 13 LYS HEx 1.0 . 2.41 150 140 A 13 LYS HEy A 22 VAL HGy% 1.0 . 2.41 151 141 A 22 VAL HGx% A 13 LYS HEx 1.0 . 2.21 152 141 A 13 LYS HEy A 22 VAL HGx% 1.0 . 2.21 153 142 A 24 TYR HE% A 13 LYS HEx 1.0 . 3.18 154 142 A 24 TYR HE% A 13 LYS HEy 1.0 . 3.18 155 143 A 14 ARG H A 14 ARG HA 1.0 . 2.74 156 144 A 14 ARG H A 14 ARG HB2 1.0 . 2.43 157 145 A 14 ARG H A 14 ARG HB3 1.0 . 3.39 158 146 A 14 ARG HG2 A 14 ARG H 1.0 . 2.55 159 147 A 14 ARG H A 22 VAL HGx% 1.0 . 3.27 160 148 A 14 ARG H A 23 TYR H 1.0 . 2.83 161 149 A 24 TYR HA A 14 ARG H 1.0 . 2.84 162 150 A 14 ARG HA A 14 ARG HB2 1.0 . 2.88 163 151 A 14 ARG HG2 A 14 ARG HA 1.0 . 2.45 164 152 A 14 ARG HA A 14 ARG HDy 1.0 . 3.30 165 153 A 14 ARG HA A 14 ARG HDx 1.0 . 3.30 166 154 A 14 ARG HA A 15 MET H 1.0 . 2.19 167 155 A 14 ARG HG2 A 14 ARG HB2 1.0 . 2.33 168 156 A 14 ARG HB2 A 14 ARG HDy 1.0 . 3.02 169 157 A 14 ARG HB2 A 14 ARG HDx 1.0 . 3.02 170 158 A 14 ARG HB2 A 15 MET H 1.0 . 3.27 171 159 A 14 ARG HB2 A 23 TYR H 1.0 . 2.90 172 160 A 14 ARG HB2 A 23 TYR HE% 1.0 . 2.70 173 161 A 14 ARG HB3 A 15 MET H 1.0 . 2.24 174 162 A 14 ARG HB3 A 23 TYR HE% 1.0 . 2.97 175 163 A 14 ARG HG2 A 14 ARG HDy 1.0 . 2.45 176 164 A 14 ARG HG2 A 14 ARG HDx 1.0 . 2.45 177 165 A 12 GLU HG2 A 14 ARG HG3 1.0 . 3.04 178 166 A 14 ARG H A 14 ARG HG3 1.0 . 2.82 179 167 A 14 ARG HA A 14 ARG HG3 1.0 . 2.57 180 168 A 14 ARG HG3 A 14 ARG HDy 1.0 . 2.10 181 169 A 14 ARG HG3 A 14 ARG HDx 1.0 . 2.10 182 170 A 25 PHE H A 14 ARG HG3 1.0 . 2.99 183 171 A 25 PHE HA A 14 ARG HG3 1.0 . 3.45 184 172 A 25 PHE HB2 A 14 ARG HG3 1.0 . 2.94 185 173 A 25 PHE HB3 A 14 ARG HG3 1.0 . 2.16 186 174 A 14 ARG HB3 A 14 ARG HDy 1.0 . 2.00 187 175 A 14 ARG HB3 A 14 ARG HDx 1.0 . 2.00 188 176 A 23 TYR HE% A 14 ARG HDx 1.0 . 2.85 189 177 A 14 ARG HG2 A 14 ARG HE 1.0 . 2.54 190 178 A 14 ARG HE A 14 ARG HDy 1.0 . 2.41 191 179 A 14 ARG HE A 14 ARG HDx 1.0 . 2.41 192 180 A 14 ARG HG2 A 15 MET H 1.0 . 3.17 193 181 A 15 MET H A 15 MET HBx 1.0 . 2.29 194 181 A 15 MET H A 15 MET HBy 1.0 . 2.29 195 182 A 15 MET H A 23 TYR HE% 1.0 . 3.53 196 183 A 15 MET H A 15 MET HA 1.0 . 2.94 197 184 A 15 MET HA A 15 MET HBx 1.0 . 2.52 198 184 A 15 MET HBy A 15 MET HA 1.0 . 2.52 199 185 A 15 MET HA A 16 SER H 1.0 . 2.05 200 186 A 14 ARG HA A 15 MET HBx 1.0 . 2.50 201 186 A 14 ARG HA A 15 MET HBy 1.0 . 2.50 202 187 A 16 SER H A 15 MET HBx 1.0 . 3.15 203 187 A 15 MET HBy A 16 SER H 1.0 . 3.15 204 188 A 20 GLY H A 15 MET HBx 1.0 . 3.25 205 188 A 15 MET HBy A 20 GLY H 1.0 . 3.25 206 189 A 22 VAL HA A 15 MET HBx 1.0 . 2.38 207 189 A 15 MET HBy A 22 VAL HA 1.0 . 2.38 208 190 A 15 MET H A 15 MET HGy 1.0 . 2.92 209 191 A 16 SER H A 15 MET HGy 1.0 . 2.49 210 192 A 20 GLY H A 15 MET HGy 1.0 . 2.23 211 193 A 22 VAL HA A 15 MET HGy 1.0 . 1.22 212 194 A 22 VAL HGy% A 15 MET HGy 1.0 . 3.13 213 195 A 15 MET H A 15 MET HGx 1.0 . 2.92 214 196 A 16 SER H A 15 MET HGx 1.0 . 2.49 215 197 A 22 VAL HGy% A 15 MET HGx 1.0 . 3.13 216 198 A 15 MET H A 16 SER H 1.0 . 3.25 217 199 A 16 SER H A 16 SER HA 1.0 . 2.71 218 200 A 16 SER H A 21 ARG H 1.0 . 3.22 219 201 A 16 SER H A 22 VAL HA 1.0 . 3.29 220 202 A 16 SER H A 23 TYR HD% 1.0 . 2.79 221 203 A 23 TYR HE% A 16 SER H 1.0 . 2.94 222 204 A 16 SER HA A 17 ARG H 1.0 . 2.05 223 205 A 23 TYR HE% A 16 SER HA 1.0 . 2.31 224 206 A 16 SER H A 16 SER HB3 1.0 . 2.24 225 207 A 21 ARG H A 16 SER HB3 1.0 . 2.67 226 208 A 16 SER H A 16 SER HB2 1.0 . 1.91 227 209 A 23 TYR HD% A 16 SER HB2 1.0 . 2.27 228 210 A 23 TYR HE% A 16 SER HB2 1.0 . 2.36 229 211 A 17 ARG H A 17 ARG HA 1.0 . 2.68 230 212 A 17 ARG H A 17 ARG HBx 1.0 . 2.16 231 212 A 17 ARG H A 17 ARG HBy 1.0 . 2.16 232 213 A 17 ARG H A 18 ASN H 1.0 . 2.90 233 214 A 17 ARG HA A 17 ARG HBx 1.0 . 2.22 234 214 A 17 ARG HA A 17 ARG HBy 1.0 . 2.22 235 215 A 17 ARG HA A 17 ARG HDx 1.0 . 4.05 236 215 A 17 ARG HA A 17 ARG HDy 1.0 . 4.05 237 216 A 17 ARG HA A 18 ASN H 1.0 . 2.59 238 217 A 17 ARG HA A 18 ASN HA 1.0 . 3.80 239 218 A 17 ARG HA A 18 ASN HBx 1.0 . 3.23 240 218 A 17 ARG HA A 18 ASN HBy 1.0 . 3.23 241 219 A 16 SER HA A 17 ARG HBx 1.0 . 2.55 242 219 A 16 SER HA A 17 ARG HBy 1.0 . 2.55 243 220 A 18 ASN H A 17 ARG HBx 1.0 . 1.71 244 220 A 17 ARG HBy A 18 ASN H 1.0 . 1.71 245 221 A 18 ASN HA A 17 ARG HBx 1.0 . 2.93 246 221 A 17 ARG HBy A 18 ASN HA 1.0 . 2.93 247 222 A 18 ASN H A 17 ARG HGx 1.0 . 0.92 248 223 A 18 ASN HA A 17 ARG HGx 1.0 . 2.17 249 224 A 17 ARG H A 17 ARG HDx 1.0 . 2.76 250 224 A 17 ARG H A 17 ARG HDy 1.0 . 2.76 251 225 A 18 ASN H A 18 ASN HA 1.0 . 2.46 252 226 A 18 ASN H A 18 ASN HBx 1.0 . 2.41 253 226 A 18 ASN H A 18 ASN HBy 1.0 . 2.41 254 227 A 18 ASN HA A 18 ASN HBx 1.0 . 2.18 255 227 A 18 ASN HA A 18 ASN HBy 1.0 . 2.18 256 228 A 19 SER HA A 18 ASN HBx 1.0 . 2.78 257 228 A 18 ASN HBy A 19 SER HA 1.0 . 2.78 258 229 A 18 ASN HBy A 19 SER HBx 1.0 . 2.55 259 229 A 19 SER HBx A 18 ASN HBx 1.0 . 2.55 260 230 A 18 ASN HBy A 19 SER HBy 1.0 . 2.55 261 230 A 18 ASN HBx A 19 SER HBy 1.0 . 2.55 262 231 A 20 GLY H A 18 ASN HBx 1.0 . 3.02 263 231 A 20 GLY H A 18 ASN HBy 1.0 . 3.02 264 232 A 18 ASN H A 18 ASN HD21 1.0 . 2.93 265 233 A 18 ASN HA A 18 ASN HD21 1.0 . 3.27 266 234 A 19 SER HA A 19 SER HBx 1.0 . 2.26 267 235 A 19 SER HA A 19 SER HBy 1.0 . 2.26 268 236 A 20 GLY H A 19 SER HA 1.0 . 2.95 269 237 A 20 GLY H A 19 SER HBx 1.0 . 2.93 270 238 A 20 GLY H A 19 SER HBy 1.0 . 2.93 271 239 A 20 GLY H A 21 ARG H 1.0 . 2.66 272 240 A 15 MET HBy A 20 GLY HAx 1.0 . 2.95 273 240 A 15 MET HBx A 20 GLY HAx 1.0 . 2.95 274 241 A 21 ARG H A 19 SER HA 1.0 . 3.58 275 242 A 21 ARG H A 19 SER HBy 1.0 . 1.07 276 243 A 21 ARG H A 21 ARG HA 1.0 . 2.88 277 244 A 21 ARG H A 21 ARG HB2 1.0 . 2.32 278 245 A 21 ARG HA A 21 ARG HB2 1.0 . 2.61 279 246 A 21 ARG HA A 21 ARG HB3 1.0 . 2.70 280 247 A 21 ARG HA A 21 ARG HD2 1.0 . 4.02 281 248 A 21 ARG HA A 22 VAL HB 1.0 . 3.38 282 249 A 22 VAL HGy% A 21 ARG HA 1.0 . 3.00 283 250 A 21 ARG H A 21 ARG HB3 1.0 . 3.15 284 251 A 21 ARG HB3 A 21 ARG HD3 1.0 . 3.33 285 252 A 21 ARG HB3 A 21 ARG HD2 1.0 . 3.69 286 253 A 21 ARG H A 21 ARG HD3 1.0 . 3.21 287 254 A 21 ARG HB2 A 21 ARG HD3 1.0 . 2.18 288 255 A 21 ARG H A 21 ARG HD2 1.0 . 3.68 289 256 A 21 ARG HB2 A 21 ARG HD2 1.0 . 3.14 290 257 A 21 ARG HB2 A 21 ARG HE 1.0 . 3.12 291 258 A 21 ARG HB3 A 21 ARG HE 1.0 . 3.21 292 259 A 21 ARG HD3 A 21 ARG HE 1.0 . 2.60 293 260 A 21 ARG H A 22 VAL H 1.0 . 3.07 294 261 A 21 ARG HB2 A 22 VAL H 1.0 . 2.77 295 262 A 21 ARG HB3 A 22 VAL H 1.0 . 2.38 296 263 A 21 ARG HD2 A 22 VAL H 1.0 . 4.29 297 264 A 22 VAL HGy% A 22 VAL H 1.0 . 1.93 298 265 A 22 VAL HGx% A 22 VAL H 1.0 . 2.61 299 266 A 22 VAL HGy% A 22 VAL HA 1.0 . 2.30 300 267 A 22 VAL HGx% A 22 VAL HA 1.0 . 2.33 301 268 A 23 TYR H A 22 VAL HA 1.0 . 2.01 302 269 A 23 TYR H A 22 VAL HB 1.0 . 2.50 303 270 A 14 ARG H A 22 VAL HGy% 1.0 . 2.08 304 271 A 22 VAL HGy% A 15 MET HBx 1.0 . 2.42 305 271 A 22 VAL HGy% A 15 MET HBy 1.0 . 2.42 306 272 A 22 VAL HGy% A 23 TYR H 1.0 . 2.40 307 273 A 22 VAL HGy% A 23 TYR HA 1.0 . 2.41 308 274 A 22 VAL HGx% A 15 MET HBx 1.0 . 2.70 309 274 A 22 VAL HGx% A 15 MET HBy 1.0 . 2.70 310 275 A 22 VAL HGx% A 23 TYR H 1.0 . 2.36 311 276 A 22 VAL HGx% A 23 TYR HA 1.0 . 1.62 312 277 A 23 TYR H A 23 TYR HA 1.0 . 2.66 313 278 A 23 TYR H A 23 TYR HB2 1.0 . 3.72 314 279 A 23 TYR H A 23 TYR HD% 1.0 . 2.48 315 280 A 23 TYR HA A 23 TYR HB2 1.0 . 2.11 316 281 A 23 TYR HA A 23 TYR HB3 1.0 . 2.16 317 282 A 23 TYR HB2 A 24 TYR H 1.0 . 2.07 318 283 A 23 TYR HB2 A 34 PHE HA 1.0 . 1.80 319 284 A 23 TYR H A 23 TYR HB3 1.0 . 2.64 320 285 A 22 VAL HA A 23 TYR HD% 1.0 . 2.91 321 286 A 23 TYR HD% A 23 TYR HA 1.0 . 2.13 322 287 A 23 TYR HD% A 24 TYR H 1.0 . 2.64 323 288 A 23 TYR HD% A 32 SER H 1.0 . 3.47 324 289 A 23 TYR HD% A 32 SER HA 1.0 . 2.07 325 290 A 23 TYR HE% A 14 ARG HDy 1.0 . 2.85 326 291 A 23 TYR H A 23 TYR HE% 1.0 . 3.06 327 292 A 25 PHE HB2 A 23 TYR HE% 1.0 . 2.24 328 293 A 25 PHE HB3 A 23 TYR HE% 1.0 . 3.06 329 294 A 23 TYR HB3 A 24 TYR H 1.0 . 2.37 330 295 A 24 TYR HA A 24 TYR H 1.0 . 2.75 331 296 A 24 TYR HB2 A 24 TYR H 1.0 . 2.28 332 297 A 24 TYR HD% A 24 TYR H 1.0 . 2.36 333 298 A 24 TYR H A 33 GLN H 1.0 . 2.68 334 299 A 24 TYR HA A 24 TYR HB2 1.0 . 2.58 335 300 A 24 TYR HA A 25 PHE H 1.0 . 1.98 336 301 A 11 TRP HE3 A 24 TYR HB3 1.0 . 1.66 337 302 A 24 TYR HB3 A 33 GLN HBy 1.0 . 3.72 338 303 A 24 TYR HB3 A 33 GLN HBx 1.0 . 3.72 339 304 A 37 PRO HD2 A 24 TYR HB3 1.0 . 3.09 340 305 A 24 TYR HB3 A 37 PRO HD3 1.0 . 2.42 341 306 A 7 LEU HDy% A 24 TYR HD% 1.0 . 2.36 342 307 A 11 TRP H A 24 TYR HD% 1.0 . 3.04 343 308 A 24 TYR HD% A 11 TRP HE1 1.0 . 2.64 344 309 A 24 TYR HD% A 23 TYR H 1.0 . 2.59 345 310 A 24 TYR HA A 24 TYR HD% 1.0 . 1.90 346 311 A 24 TYR HD% A 25 PHE H 1.0 . 3.11 347 312 A 24 TYR HD% A 36 ARG HA 1.0 . 2.49 348 313 A 37 PRO HD2 A 24 TYR HD% 1.0 . 2.76 349 314 A 7 LEU HDy% A 24 TYR HE% 1.0 . 2.16 350 315 A 24 TYR HE% A 22 VAL HGx% 1.0 . 2.39 351 316 A 24 TYR HE% A 24 TYR H 1.0 . 2.34 352 317 A 24 TYR HE% A 35 GLU HA 1.0 . 2.77 353 318 A 24 TYR HE% A 36 ARG H 1.0 . 3.22 354 319 A 24 TYR HE% A 36 ARG HA 1.0 . 2.64 355 320 A 24 TYR HE% A 36 ARG HBx 1.0 . 2.76 356 320 A 24 TYR HE% A 36 ARG HBy 1.0 . 2.76 357 321 A 24 TYR HE% A 36 ARG HGy 1.0 . 2.82 358 322 A 24 TYR HE% A 36 ARG HGx 1.0 . 2.82 359 323 A 37 PRO HD2 A 24 TYR HE% 1.0 . 3.34 360 324 A 24 TYR HB2 A 25 PHE H 1.0 . 2.49 361 325 A 25 PHE H A 25 PHE HA 1.0 . 2.70 362 326 A 25 PHE H A 25 PHE HB2 1.0 . 2.70 363 327 A 25 PHE H A 25 PHE HB3 1.0 . 2.28 364 328 A 25 PHE HA A 11 TRP HZ3 1.0 . 2.15 365 329 A 25 PHE HA A 25 PHE HB2 1.0 . 2.21 366 330 A 25 PHE HA A 25 PHE HB3 1.0 . 2.64 367 331 A 25 PHE HA A 25 PHE HD% 1.0 . 2.31 368 332 A 25 PHE HA A 26 ASN H 1.0 . 1.98 369 333 A 25 PHE HA A 32 SER H 1.0 . 3.72 370 334 A 25 PHE HA A 32 SER HA 1.0 . 2.25 371 335 A 25 PHE HA A 33 GLN H 1.0 . 2.99 372 336 A 26 ASN H A 25 PHE HB2 1.0 . 3.65 373 337 A 25 PHE HB2 A 32 SER HA 1.0 . 2.88 374 338 A 26 ASN H A 25 PHE HB3 1.0 . 3.79 375 339 A 25 PHE H A 25 PHE HD% 1.0 . 2.75 376 340 A 27 HIS H A 25 PHE HE% 1.0 . 3.62 377 341 A 25 PHE HE% A 27 HIS HA 1.0 . 2.65 378 342 A 25 PHE HE% A 27 HIS HBx 1.0 . 3.12 379 343 A 25 PHE HE% A 27 HIS HBy 1.0 . 3.12 380 344 A 25 PHE HE% A 30 ASN HA 1.0 . 3.08 381 345 A 26 ASN HB2 A 26 ASN H 1.0 . 2.46 382 346 A 26 ASN H A 31 ALA H 1.0 . 3.14 383 347 A 26 ASN H A 32 SER HA 1.0 . 3.26 384 348 A 26 ASN HA A 26 ASN H 1.0 . 2.16 385 349 A 26 ASN HB2 A 26 ASN HA 1.0 . 2.33 386 350 A 26 ASN HA A 27 HIS H 1.0 . 2.00 387 351 A 26 ASN HB2 A 11 TRP HE3 1.0 . 2.49 388 352 A 26 ASN HB2 A 11 TRP HZ2 1.0 . 2.74 389 353 A 26 ASN HB2 A 26 ASN HD21 1.0 . 2.16 390 354 A 26 ASN HB2 A 26 ASN HD22 1.0 . 3.44 391 355 A 26 ASN HB2 A 27 HIS H 1.0 . 3.33 392 356 A 26 ASN HB2 A 28 ILE H 1.0 . 3.77 393 357 A 26 ASN HB2 A 31 ALA H 1.0 . 3.66 394 358 A 26 ASN H A 26 ASN HB3 1.0 . 1.93 395 359 A 26 ASN HA A 26 ASN HB3 1.0 . 2.05 396 360 A 26 ASN HD21 A 26 ASN HB3 1.0 . 2.51 397 361 A 26 ASN HB3 A 30 ASN H 1.0 . 2.40 398 362 A 30 ASN HA A 26 ASN HB3 1.0 . 3.42 399 363 A 31 ALA H A 26 ASN HB3 1.0 . 2.04 400 364 A 31 ALA HB% A 26 ASN HB3 1.0 . 2.49 401 365 A 26 ASN HD21 A 26 ASN H 1.0 . 2.98 402 366 A 10 GLY HA3 A 26 ASN HD22 1.0 . 2.33 403 367 A 26 ASN HD22 A 29 THR H 1.0 . 3.14 404 368 A 26 ASN HD22 A 29 THR HG2% 1.0 . 2.83 405 369 A 27 HIS H A 27 HIS HA 1.0 . 2.65 406 370 A 27 HIS H A 27 HIS HBx 1.0 . 2.49 407 371 A 27 HIS H A 27 HIS HBy 1.0 . 2.49 408 372 A 27 HIS H A 27 HIS HD2 1.0 . 2.95 409 373 A 27 HIS H A 28 ILE H 1.0 . 2.57 410 374 A 27 HIS HA A 27 HIS HBx 1.0 . 2.25 411 375 A 27 HIS HA A 27 HIS HBy 1.0 . 2.25 412 376 A 27 HIS HA A 28 ILE H 1.0 . 3.02 413 377 A 27 HIS HD2 A 27 HIS HBy 1.0 . 2.49 414 378 A 28 ILE H A 27 HIS HBy 1.0 . 2.87 415 379 A 27 HIS HD2 A 27 HIS HBx 1.0 . 2.49 416 380 A 26 ASN HA A 28 ILE H 1.0 . 2.53 417 381 A 28 ILE H A 27 HIS HBx 1.0 . 2.87 418 382 A 27 HIS HD2 A 28 ILE H 1.0 . 3.52 419 383 A 28 ILE H A 28 ILE HA 1.0 . 2.71 420 384 A 28 ILE H A 28 ILE HB 1.0 . 2.25 421 385 A 28 ILE H A 28 ILE HG2% 1.0 . 3.29 422 386 A 28 ILE HG12 A 28 ILE H 1.0 . 3.09 423 387 A 28 ILE HG13 A 28 ILE H 1.0 . 2.51 424 388 A 28 ILE HD1% A 28 ILE H 1.0 . 3.36 425 389 A 28 ILE H A 29 THR H 1.0 . 2.16 426 390 A 28 ILE H A 29 THR HA 1.0 . 3.79 427 391 A 28 ILE H A 30 ASN H 1.0 . 3.35 428 392 A 28 ILE HA A 28 ILE HB 1.0 . 2.57 429 393 A 28 ILE HA A 28 ILE HG2% 1.0 . 2.19 430 394 A 28 ILE HG12 A 28 ILE HA 1.0 . 2.00 431 395 A 28 ILE HG13 A 28 ILE HA 1.0 . 3.05 432 396 A 28 ILE HD1% A 28 ILE HA 1.0 . 2.54 433 397 A 29 THR H A 28 ILE HA 1.0 . 3.31 434 398 A 28 ILE HG12 A 28 ILE HB 1.0 . 2.60 435 399 A 28 ILE HG13 A 28 ILE HB 1.0 . 2.55 436 400 A 28 ILE HD1% A 28 ILE HB 1.0 . 2.25 437 401 A 29 THR H A 28 ILE HB 1.0 . 2.29 438 402 A 29 THR H A 28 ILE HG2% 1.0 . 3.06 439 403 A 28 ILE HG2% A 29 THR HA 1.0 . 3.06 440 404 A 10 GLY HA2 A 28 ILE HG12 1.0 . 3.06 441 405 A 28 ILE HG12 A 27 HIS H 1.0 . 3.80 442 406 A 28 ILE HG12 A 27 HIS HD2 1.0 . 3.03 443 407 A 28 ILE HG13 A 27 HIS H 1.0 . 2.88 444 408 A 28 ILE HG13 A 27 HIS HD2 1.0 . 2.56 445 409 A 28 ILE HG13 A 28 ILE HG2% 1.0 . 2.55 446 410 A 28 ILE HG13 A 29 THR H 1.0 . 3.13 447 411 A 28 ILE HG13 A 29 THR HA 1.0 . 3.70 448 412 A 10 GLY H A 28 ILE HD1% 1.0 . 2.69 449 413 A 28 ILE HD1% A 26 ASN HD22 1.0 . 2.48 450 414 A 28 ILE HD1% A 27 HIS H 1.0 . 3.13 451 415 A 28 ILE HD1% A 27 HIS HD2 1.0 . 2.63 452 416 A 27 HIS H A 29 THR H 1.0 . 3.26 453 417 A 29 THR H A 29 THR HA 1.0 . 2.59 454 418 A 29 THR H A 29 THR HB 1.0 . 3.44 455 419 A 29 THR H A 29 THR HG2% 1.0 . 2.20 456 420 A 30 ASN H A 29 THR H 1.0 . 2.13 457 421 A 29 THR HA A 29 THR HB 1.0 . 2.34 458 422 A 29 THR HG2% A 29 THR HA 1.0 . 2.21 459 423 A 31 ALA H A 29 THR HB 1.0 . 3.27 460 424 A 31 ALA HB% A 29 THR HB 1.0 . 2.87 461 425 A 26 ASN HD21 A 29 THR HG2% 1.0 . 2.33 462 426 A 30 ASN H A 29 THR HG2% 1.0 . 3.66 463 427 A 31 ALA H A 29 THR HG2% 1.0 . 2.69 464 428 A 29 THR HG2% A 29 THR HG1 1.0 . 2.14 465 429 A 31 ALA H A 29 THR HG1 1.0 . 2.59 466 430 A 31 ALA HB% A 29 THR HG1 1.0 . 2.30 467 431 A 27 HIS HA A 30 ASN H 1.0 . 2.58 468 432 A 30 ASN H A 29 THR HA 1.0 . 2.57 469 433 A 30 ASN H A 29 THR HB 1.0 . 3.20 470 434 A 31 ALA H A 30 ASN H 1.0 . 2.49 471 435 A 25 PHE HD% A 30 ASN HA 1.0 . 2.11 472 436 A 30 ASN HA A 31 ALA H 1.0 . 2.72 473 437 A 31 ALA HB% A 30 ASN HA 1.0 . 3.88 474 438 A 30 ASN H A 30 ASN HB3 1.0 . 2.63 475 439 A 30 ASN HB3 A 30 ASN HD2y 1.0 . 2.45 476 440 A 30 ASN HB3 A 30 ASN HD2x 1.0 . 2.45 477 441 A 31 ALA H A 30 ASN HB3 1.0 . 3.10 478 442 A 31 ALA HB% A 30 ASN HB3 1.0 . 3.57 479 443 A 25 PHE HE% A 30 ASN HB2 1.0 . 2.68 480 444 A 30 ASN H A 30 ASN HB2 1.0 . 2.57 481 445 A 30 ASN HD2y A 30 ASN HB2 1.0 . 3.03 482 446 A 30 ASN HD2x A 30 ASN HB2 1.0 . 3.03 483 447 A 31 ALA H A 30 ASN HB2 1.0 . 2.99 484 448 A 31 ALA H A 29 THR HA 1.0 . 3.46 485 449 A 31 ALA HB% A 31 ALA H 1.0 . 2.12 486 450 A 32 SER H A 31 ALA H 1.0 . 3.88 487 451 A 32 SER H A 31 ALA HA 1.0 . 2.06 488 452 A 32 SER HA A 31 ALA HA 1.0 . 3.08 489 453 A 26 ASN H A 31 ALA HB% 1.0 . 2.20 490 454 A 26 ASN HB2 A 31 ALA HB% 1.0 . 1.98 491 455 A 31 ALA HB% A 30 ASN H 1.0 . 2.76 492 456 A 31 ALA HB% A 32 SER H 1.0 . 2.44 493 457 A 31 ALA HB% A 32 SER HA 1.0 . 2.37 494 458 A 32 SER H A 32 SER HA 1.0 . 2.71 495 459 A 32 SER H A 33 GLN H 1.0 . 4.10 496 460 A 11 TRP HZ3 A 32 SER HA 1.0 . 2.11 497 461 A 32 SER HA A 33 GLN H 1.0 . 2.09 498 462 A 32 SER HA A 33 GLN HBy 1.0 . 3.72 499 463 A 32 SER HA A 33 GLN HBx 1.0 . 3.72 500 464 A 23 TYR HD% A 32 SER HBy 1.0 . 1.90 501 465 A 23 TYR HE% A 32 SER HBy 1.0 . 2.41 502 466 A 25 PHE HA A 32 SER HBy 1.0 . 2.68 503 467 A 25 PHE HD% A 32 SER HBy 1.0 . 0.51 504 468 A 32 SER H A 32 SER HBy 1.0 . 2.34 505 469 A 33 GLN H A 32 SER HBy 1.0 . 2.40 506 470 A 23 TYR HD% A 32 SER HBx 1.0 . 1.90 507 471 A 23 TYR HE% A 32 SER HBx 1.0 . 2.41 508 472 A 25 PHE HA A 32 SER HBx 1.0 . 2.68 509 473 A 32 SER H A 32 SER HBx 1.0 . 2.34 510 474 A 33 GLN H A 32 SER HBx 1.0 . 2.40 511 475 A 11 TRP HZ3 A 33 GLN H 1.0 . 2.26 512 476 A 23 TYR HB2 A 33 GLN H 1.0 . 2.43 513 477 A 23 TYR HD% A 33 GLN H 1.0 . 2.04 514 478 A 23 TYR HE% A 33 GLN H 1.0 . 3.08 515 479 A 33 GLN H A 33 GLN HA 1.0 . 2.65 516 480 A 33 GLN H A 33 GLN HBy 1.0 . 2.55 517 481 A 33 GLN H A 33 GLN HBx 1.0 . 2.55 518 482 A 33 GLN HA A 33 GLN HBy 1.0 . 2.17 519 483 A 33 GLN HA A 33 GLN HBx 1.0 . 2.17 520 484 A 33 GLN HA A 34 PHE H 1.0 . 2.12 521 485 A 33 GLN HE2y A 33 GLN HBy 1.0 . 2.20 522 486 A 33 GLN HE2x A 33 GLN HBy 1.0 . 2.20 523 487 A 34 PHE H A 33 GLN HBy 1.0 . 2.51 524 488 A 35 GLU H A 33 GLN HBy 1.0 . 1.28 525 489 A 11 TRP HZ3 A 33 GLN HBx 1.0 . 2.50 526 490 A 11 TRP HH2 A 33 GLN HBx 1.0 . 0.84 527 491 A 33 GLN HE2y A 33 GLN HBx 1.0 . 2.20 528 492 A 33 GLN HE2x A 33 GLN HBx 1.0 . 2.20 529 493 A 34 PHE H A 33 GLN HBx 1.0 . 2.51 530 494 A 33 GLN HE2y A 35 GLU H 1.0 . 3.57 531 495 A 33 GLN HE2y A 37 PRO HA 1.0 . 2.57 532 496 A 37 PRO HG3 A 33 GLN HE2y 1.0 . 3.73 533 497 A 37 PRO HD2 A 33 GLN HE2y 1.0 . 1.66 534 498 A 37 PRO HD3 A 33 GLN HE2y 1.0 . 2.49 535 499 A 33 GLN HE2x A 35 GLU H 1.0 . 3.57 536 500 A 33 GLN HE2x A 37 PRO HA 1.0 . 2.57 537 501 A 37 PRO HG3 A 33 GLN HE2x 1.0 . 3.73 538 502 A 37 PRO HD3 A 33 GLN HE2x 1.0 . 2.49 539 503 A 34 PHE HA A 34 PHE H 1.0 . 2.70 540 504 A 34 PHE H A 34 PHE HB2 1.0 . 2.28 541 505 A 34 PHE H A 34 PHE HB3 1.0 . 3.10 542 506 A 34 PHE H A 34 PHE HD% 1.0 . 2.60 543 507 A 34 PHE H A 35 GLU H 1.0 . 2.32 544 508 A 22 VAL HGx% A 34 PHE HA 1.0 . 3.15 545 509 A 34 PHE HA A 34 PHE HB2 1.0 . 2.61 546 510 A 34 PHE HA A 34 PHE HB3 1.0 . 2.29 547 511 A 34 PHE HA A 34 PHE HD% 1.0 . 2.25 548 512 A 35 GLU H A 34 PHE HB2 1.0 . 2.73 549 513 A 35 GLU H A 34 PHE HB3 1.0 . 3.55 550 514 A 23 TYR HA A 34 PHE HD% 1.0 . 2.16 551 515 A 23 TYR HB2 A 34 PHE HD% 1.0 . 2.31 552 516 A 23 TYR HB3 A 34 PHE HD% 1.0 . 2.06 553 517 A 21 ARG HB2 A 34 PHE HE% 1.0 . 4.07 554 518 A 21 ARG HD3 A 34 PHE HE% 1.0 . 3.64 555 519 A 23 TYR HB3 A 34 PHE HE% 1.0 . 2.82 556 520 A 34 PHE HA A 35 GLU H 1.0 . 2.06 557 521 A 35 GLU HA A 35 GLU H 1.0 . 2.67 558 522 A 35 GLU HA A 36 ARG H 1.0 . 2.06 559 523 A 36 ARG HA A 35 GLU HA 1.0 . 3.11 560 524 A 35 GLU HA A 36 ARG HBx 1.0 . 3.73 561 524 A 35 GLU HA A 36 ARG HBy 1.0 . 3.73 562 525 A 33 GLN HE2y A 35 GLU HB2 1.0 . 2.33 563 526 A 33 GLN HE2x A 35 GLU HB2 1.0 . 2.33 564 527 A 35 GLU H A 35 GLU HB2 1.0 . 1.87 565 528 A 35 GLU HA A 35 GLU HB2 1.0 . 2.16 566 529 A 35 GLU H A 35 GLU HB3 1.0 . 2.52 567 530 A 36 ARG H A 35 GLU HB3 1.0 . 2.29 568 531 A 35 GLU H A 35 GLU HG2 1.0 . 2.82 569 532 A 35 GLU HA A 35 GLU HG2 1.0 . 3.03 570 533 A 35 GLU H A 35 GLU HG3 1.0 . 2.19 571 534 A 35 GLU HA A 35 GLU HG3 1.0 . 2.10 572 535 A 36 ARG H A 35 GLU HG3 1.0 . 3.23 573 536 A 36 ARG H A 35 GLU H 1.0 . 3.56 574 537 A 36 ARG HA A 36 ARG H 1.0 . 2.62 575 538 A 36 ARG H A 36 ARG HBx 1.0 . 1.96 576 538 A 36 ARG H A 36 ARG HBy 1.0 . 1.96 577 539 A 36 ARG H A 36 ARG HGy 1.0 . 3.63 578 540 A 36 ARG H A 36 ARG HGx 1.0 . 3.63 579 541 A 36 ARG HA A 36 ARG HBx 1.0 . 2.10 580 541 A 36 ARG HA A 36 ARG HBy 1.0 . 2.10 581 542 A 36 ARG HA A 36 ARG HGy 1.0 . 2.49 582 543 A 36 ARG HA A 36 ARG HGx 1.0 . 2.49 583 544 A 37 PRO HD2 A 36 ARG HBx 1.0 . 3.23 584 544 A 37 PRO HD2 A 36 ARG HBy 1.0 . 3.23 585 545 A 37 PRO HD3 A 36 ARG HBx 1.0 . 3.09 586 545 A 37 PRO HD3 A 36 ARG HBy 1.0 . 3.09 587 546 A 37 PRO HD2 A 36 ARG HGy 1.0 . 2.53 588 547 A 37 PRO HD3 A 36 ARG HGy 1.0 . 4.07 589 548 A 37 PRO HD2 A 36 ARG HGx 1.0 . 2.53 590 549 A 37 PRO HD3 A 36 ARG HGx 1.0 . 4.07 591 550 A 37 PRO HA A 38 SER H 1.0 . 2.08 592 551 A 8 PRO HG3 A 37 PRO HB2 1.0 . 2.21 593 552 A 39 GLY H A 37 PRO HB2 1.0 . 3.30 594 553 A 11 TRP HE3 A 37 PRO HB3 1.0 . 2.81 595 554 A 11 TRP HZ2 A 37 PRO HB3 1.0 . 2.60 596 555 A 33 GLN HE2y A 37 PRO HB3 1.0 . 2.50 597 556 A 33 GLN HE2x A 37 PRO HB3 1.0 . 2.50 598 557 A 11 TRP HB2 A 37 PRO HG2 1.0 . 3.01 599 558 A 11 TRP HB3 A 37 PRO HG2 1.0 . 2.76 600 559 A 7 LEU HDx% A 37 PRO HG3 1.0 . 2.74 601 560 A 8 PRO HD2 A 37 PRO HG3 1.0 . 2.83 602 561 A 11 TRP HB2 A 37 PRO HG3 1.0 . 3.10 603 562 A 24 TYR HB2 A 37 PRO HG3 1.0 . 2.69 604 563 A 37 PRO HG3 A 33 GLN HBy 1.0 . 3.39 605 564 A 37 PRO HG3 A 33 GLN HBx 1.0 . 3.39 606 565 A 7 LEU HDx% A 37 PRO HD2 1.0 . 2.19 607 566 A 37 PRO HD2 A 24 TYR HB2 1.0 . 2.65 608 567 A 24 TYR HB2 A 37 PRO HD3 1.0 . 2.08 609 568 A 37 PRO HD3 A 36 ARG H 1.0 . 3.79 610 569 A 38 SER HA A 38 SER H 1.0 . 2.79 611 570 A 39 GLY H A 38 SER H 1.0 . 3.20 612 571 A 39 GLY H A 38 SER HA 1.0 . 2.53 613 572 A 38 SER HA A 38 SER HBy 1.0 . 2.13 614 573 A 38 SER H A 38 SER HBx 1.0 . 2.39 615 574 A 38 SER HA A 38 SER HBx 1.0 . 2.13 616 575 A 39 GLY H A 37 PRO HA 1.0 . 3.49 617 576 A 39 GLY H A 39 GLY HAy 1.0 . 2.16 618 577 A 39 GLY H A 39 GLY HAx 1.0 . 2.16 619 578 A 7 LEU H A 6 LYS HBy 1.0 . 2.95 620 579 A 7 LEU H A 6 LYS HBx 1.0 . 2.95 621 580 A 7 LEU H A 6 LYS HGx 1.0 . 3.23 622 580 A 7 LEU H A 6 LYS HGy 1.0 . 3.23 623 581 A 7 LEU HA A 8 PRO HG2 1.0 . 3.68 624 582 A 7 LEU HDx% A 24 TYR HB3 1.0 . 3.64 625 583 A 8 PRO HG3 A 37 PRO HB3 1.0 . 3.02 626 584 A 8 PRO HG3 A 39 GLY HAy 1.0 . 2.81 627 585 A 8 PRO HG3 A 39 GLY HAx 1.0 . 2.81 628 586 A 8 PRO HD3 A 37 PRO HB2 1.0 . 3.29 629 587 A 8 PRO HD2 A 37 PRO HB2 1.0 . 2.68 630 588 A 11 TRP HE1 A 8 PRO HG2 1.0 . 3.67 631 589 A 11 TRP HE1 A 37 PRO HB2 1.0 . 3.10 632 590 A 11 TRP HE1 A 37 PRO HB3 1.0 . 3.07 633 591 A 12 GLU HA A 12 GLU HG3 1.0 . 2.58 634 592 A 13 LYS H A 12 GLU HG3 1.0 . 3.39 635 593 A 13 LYS HA A 13 LYS HEx 1.0 . 3.81 636 593 A 13 LYS HA A 13 LYS HEy 1.0 . 3.81 637 594 A 13 LYS HB3 A 13 LYS HEx 1.0 . 3.26 638 594 A 13 LYS HB3 A 13 LYS HEy 1.0 . 3.26 639 595 A 14 ARG H A 13 LYS HGy 1.0 . 2.74 640 596 A 14 ARG H A 13 LYS HGx 1.0 . 2.74 641 597 A 15 MET H A 14 ARG HG3 1.0 . 4.21 642 598 A 15 MET HBy A 20 GLY HAy 1.0 . 2.95 643 598 A 20 GLY HAy A 15 MET HBx 1.0 . 2.95 644 599 A 17 ARG H A 16 SER HB3 1.0 . 2.59 645 600 A 17 ARG H A 16 SER HB2 1.0 . 2.97 646 601 A 17 ARG H A 17 ARG HGx 1.0 . 2.59 647 602 A 17 ARG H A 17 ARG HGy 1.0 . 2.59 648 603 A 17 ARG HA A 17 ARG HGx 1.0 . 2.74 649 604 A 17 ARG HA A 17 ARG HGy 1.0 . 2.74 650 605 A 20 GLY H A 16 SER HB3 1.0 . 3.04 651 606 A 20 GLY H A 16 SER HB2 1.0 . 2.93 652 607 A 21 ARG H A 16 SER HB2 1.0 . 2.40 653 608 A 21 ARG H A 20 GLY HAy 1.0 . 2.80 654 609 A 21 ARG H A 20 GLY HAx 1.0 . 2.80 655 610 A 16 SER HB3 A 21 ARG HB2 1.0 . 3.00 656 611 A 16 SER HB2 A 21 ARG HB2 1.0 . 2.41 657 612 A 16 SER HB3 A 21 ARG HB3 1.0 . 3.06 658 613 A 16 SER HB2 A 21 ARG HB3 1.0 . 2.83 659 614 A 22 VAL HA A 22 VAL H 1.0 . 2.15 660 615 A 22 VAL HGx% A 15 MET HGy 1.0 . 3.58 661 616 A 22 VAL HGx% A 15 MET HGx 1.0 . 3.58 662 617 A 23 TYR HD% A 16 SER HB3 1.0 . 2.24 663 618 A 23 TYR HE% A 16 SER HB3 1.0 . 2.38 664 619 A 24 TYR H A 24 TYR HB3 1.0 . 2.60 665 620 A 24 TYR HE% A 13 LYS HGy 1.0 . 2.57 666 621 A 24 TYR HE% A 13 LYS HGx 1.0 . 2.57 667 622 A 24 TYR HE% A 13 LYS HDx 1.0 . 1.26 668 623 A 25 PHE H A 24 TYR HB3 1.0 . 2.41 669 624 A 28 ILE H A 26 ASN HB3 1.0 . 3.54 670 625 A 30 ASN HA A 25 PHE HZ 1.0 . 2.57 671 626 A 33 GLN HE2y A 35 GLU HB3 1.0 . 2.81 672 627 A 33 GLN HE2y A 37 PRO HB2 1.0 . 2.95 673 628 A 33 GLN HE2x A 35 GLU HB3 1.0 . 2.81 674 629 A 33 GLN HE2x A 37 PRO HB2 1.0 . 2.95 675 630 A 36 ARG H A 35 GLU HB2 1.0 . 3.06 676 631 A 36 ARG H A 35 GLU HG2 1.0 . 3.93 677 632 A 37 PRO HG2 A 24 TYR HB3 1.0 . 3.56 678 633 A 37 PRO HG3 A 24 TYR HB3 1.0 . 2.75 679 634 A 38 SER H A 37 PRO HB2 1.0 . 2.86 680 635 A 38 SER H A 37 PRO HB3 1.0 . 3.12 681 636 A 38 SER H A 38 SER HBy 1.0 . 2.39 682 637 A 39 GLY H A 38 SER HBy 1.0 . 3.06 683 638 A 39 GLY H A 38 SER HBx 1.0 . 3.06 684 639 A 8 PRO HG3 A 39 GLY HAx 1.0 . 2.55 685 639 A 8 PRO HG3 A 39 GLY HAy 1.0 . 2.55 686 640 A 10 GLY H A 9 PRO HBx 1.0 . 2.87 687 640 A 10 GLY H A 9 PRO HBy 1.0 . 2.87 688 641 A 11 TRP HZ3 A 33 GLN HBx 1.0 . 2.41 689 641 A 11 TRP HZ3 A 33 GLN HBy 1.0 . 2.41 690 642 A 11 TRP HH2 A 33 GLN HBx 1.0 . 0.84 691 642 A 11 TRP HH2 A 33 GLN HBy 1.0 . 0.84 692 643 A 11 TRP HH2 A 33 GLN HBy 1.0 . 0.84 693 644 A 22 VAL HGy% A 13 LYS HDy 1.0 . 2.87 694 644 A 22 VAL HGy% A 13 LYS HDx 1.0 . 2.87 695 645 A 24 TYR HE% A 13 LYS HDy 1.0 . 1.26 696 645 A 24 TYR HE% A 13 LYS HDx 1.0 . 1.26 697 646 A 24 TYR HE% A 13 LYS HDy 1.0 . 1.26 698 647 A 14 ARG HG2 A 14 ARG HDx 1.0 . 2.23 699 647 A 14 ARG HG2 A 14 ARG HDy 1.0 . 2.23 700 648 A 23 TYR HE% A 14 ARG HDx 1.0 . 2.60 701 648 A 23 TYR HE% A 14 ARG HDy 1.0 . 2.60 702 649 A 15 MET H A 15 MET HGy 1.0 . 2.70 703 649 A 15 MET H A 15 MET HGx 1.0 . 2.70 704 650 A 15 MET HBy A 20 GLY HAx 1.0 . 2.67 705 650 A 15 MET HBx A 20 GLY HAx 1.0 . 2.67 706 650 A 20 GLY HAy A 15 MET HBx 1.0 . 2.67 707 650 A 15 MET HBy A 20 GLY HAy 1.0 . 2.67 708 651 A 20 GLY H A 15 MET HGy 1.0 . 2.21 709 651 A 20 GLY H A 15 MET HGx 1.0 . 2.21 710 652 A 20 GLY H A 15 MET HGx 1.0 . 2.23 711 653 A 22 VAL HA A 15 MET HGy 1.0 . 1.22 712 653 A 22 VAL HA A 15 MET HGx 1.0 . 1.22 713 654 A 22 VAL HA A 15 MET HGx 1.0 . 1.22 714 655 A 22 VAL HGx% A 15 MET HGy 1.0 . 3.24 715 655 A 22 VAL HGx% A 15 MET HGx 1.0 . 3.24 716 656 A 18 ASN H A 17 ARG HGy 1.0 . 0.92 717 656 A 18 ASN H A 17 ARG HGx 1.0 . 0.92 718 657 A 18 ASN H A 17 ARG HGy 1.0 . 0.92 719 658 A 18 ASN HA A 17 ARG HGy 1.0 . 2.16 720 658 A 18 ASN HA A 17 ARG HGx 1.0 . 2.16 721 659 A 18 ASN HA A 17 ARG HGy 1.0 . 2.17 722 660 A 21 ARG H A 19 SER HBy 1.0 . 1.07 723 660 A 21 ARG H A 19 SER HBx 1.0 . 1.07 724 661 A 21 ARG H A 19 SER HBx 1.0 . 1.07 725 662 A 23 TYR HD% A 32 SER HBx 1.0 . 1.75 726 662 A 23 TYR HD% A 32 SER HBy 1.0 . 1.75 727 663 A 23 TYR HE% A 32 SER HBx 1.0 . 2.23 728 663 A 23 TYR HE% A 32 SER HBy 1.0 . 2.23 729 664 A 24 TYR HB3 A 33 GLN HBx 1.0 . 3.42 730 664 A 24 TYR HB3 A 33 GLN HBy 1.0 . 3.42 731 665 A 25 PHE HA A 32 SER HBx 1.0 . 2.47 732 665 A 25 PHE HA A 32 SER HBy 1.0 . 2.47 733 666 A 25 PHE HD% A 32 SER HBx 1.0 . 0.51 734 666 A 25 PHE HD% A 32 SER HBy 1.0 . 0.51 735 667 A 25 PHE HD% A 32 SER HBx 1.0 . 0.51 736 668 A 25 PHE HE% A 27 HIS HBy 1.0 . 2.85 737 668 A 25 PHE HE% A 27 HIS HBx 1.0 . 2.85 738 669 A 28 ILE H A 27 HIS HBy 1.0 . 2.74 739 669 A 28 ILE H A 27 HIS HBx 1.0 . 2.74 740 670 A 30 ASN HD2y A 30 ASN HB2 1.0 . 2.91 741 670 A 30 ASN HD2x A 30 ASN HB2 1.0 . 2.91 742 671 A 32 SER H A 32 SER HBx 1.0 . 2.20 743 671 A 32 SER H A 32 SER HBy 1.0 . 2.20 744 672 A 32 SER HA A 33 GLN HBx 1.0 . 3.45 745 672 A 32 SER HA A 33 GLN HBy 1.0 . 3.45 746 673 A 33 GLN H A 33 GLN HBx 1.0 . 2.35 747 673 A 33 GLN H A 33 GLN HBy 1.0 . 2.35 748 674 A 34 PHE H A 33 GLN HBx 1.0 . 2.36 749 674 A 34 PHE H A 33 GLN HBy 1.0 . 2.36 750 675 A 35 GLU H A 33 GLN HBx 1.0 . 1.27 751 675 A 35 GLU H A 33 GLN HBy 1.0 . 1.27 752 676 A 35 GLU H A 33 GLN HBx 1.0 . 1.28 753 677 A 33 GLN HE2y A 35 GLU H 1.0 . 3.37 754 677 A 33 GLN HE2x A 35 GLU H 1.0 . 3.37 755 678 A 33 GLN HE2y A 35 GLU HB2 1.0 . 2.17 756 678 A 33 GLN HE2x A 35 GLU HB2 1.0 . 2.17 757 679 A 33 GLN HE2y A 35 GLU HB3 1.0 . 2.66 758 679 A 33 GLN HE2x A 35 GLU HB3 1.0 . 2.66 759 680 A 33 GLN HE2y A 37 PRO HA 1.0 . 2.38 760 680 A 33 GLN HE2x A 37 PRO HA 1.0 . 2.38 761 681 A 33 GLN HE2y A 37 PRO HB2 1.0 . 2.68 762 681 A 33 GLN HE2x A 37 PRO HB2 1.0 . 2.68 763 682 A 33 GLN HE2y A 37 PRO HB3 1.0 . 2.28 764 682 A 33 GLN HE2x A 37 PRO HB3 1.0 . 2.28 765 683 A 37 PRO HG3 A 33 GLN HE2y 1.0 . 3.46 766 683 A 37 PRO HG3 A 33 GLN HE2x 1.0 . 3.46 767 684 A 37 PRO HD2 A 33 GLN HE2y 1.0 . 1.65 768 684 A 37 PRO HD2 A 33 GLN HE2x 1.0 . 1.65 769 685 A 37 PRO HD2 A 33 GLN HE2x 1.0 . 1.66 770 686 A 37 PRO HD3 A 33 GLN HE2y 1.0 . 2.28 771 686 A 37 PRO HD3 A 33 GLN HE2x 1.0 . 2.28 772 687 A 36 ARG H A 36 ARG HGx 1.0 . 3.36 773 687 A 36 ARG H A 36 ARG HGy 1.0 . 3.36 774 688 A 36 ARG HA A 36 ARG HGx 1.0 . 2.30 775 688 A 36 ARG HA A 36 ARG HGy 1.0 . 2.30 776 689 A 37 PRO HD2 A 36 ARG HGx 1.0 . 2.30 777 689 A 37 PRO HD2 A 36 ARG HGy 1.0 . 2.30 778 690 A 37 PRO HD3 A 36 ARG HGx 1.0 . 3.72 779 690 A 37 PRO HD3 A 36 ARG HGy 1.0 . 3.72 780 691 A 6 LYS HA A 6 LYS HD2 1.0 . 6.50 781 692 A 6 LYS HA A 7 LEU H 1.0 . 2.67 782 693 A 6 LYS HA A 7 LEU HG 1.0 . 4.53 783 694 A 7 LEU H A 7 LEU HB2 1.0 . 2.39 784 695 A 7 LEU H A 7 LEU HB3 1.0 . 3.30 785 696 A 7 LEU HG A 7 LEU H 1.0 . 3.04 786 697 A 7 LEU H A 7 LEU HDy% 1.0 . 3.96 787 698 A 7 LEU HA A 7 LEU HB3 1.0 . 2.43 788 699 A 7 LEU HG A 7 LEU HA 1.0 . 3.64 789 700 A 7 LEU HA A 7 LEU HDy% 1.0 . 3.47 790 701 A 7 LEU HA A 7 LEU HDx% 1.0 . 2.79 791 702 A 7 LEU HA A 8 PRO HG3 1.0 . 5.33 792 703 A 7 LEU HA A 8 PRO HD3 1.0 . 2.00 793 704 A 7 LEU HA A 8 PRO HD2 1.0 . 2.39 794 705 A 7 LEU HB2 A 11 TRP H 1.0 . 5.18 795 706 A 7 LEU HB2 A 11 TRP HB2 1.0 . 3.23 796 707 A 7 LEU HB2 A 11 TRP HB3 1.0 . 4.07 797 708 A 7 LEU HB3 A 7 LEU HDy% 1.0 . 2.74 798 709 A 7 LEU HB3 A 7 LEU HDx% 1.0 . 2.73 799 710 A 7 LEU HB3 A 8 PRO HD3 1.0 . 3.50 800 711 A 7 LEU HB3 A 11 TRP H 1.0 . 4.53 801 712 A 7 LEU HB3 A 11 TRP HB2 1.0 . 2.34 802 713 A 7 LEU HB3 A 11 TRP HB3 1.0 . 2.87 803 714 A 7 LEU HB2 A 7 LEU HDy% 1.0 . 3.20 804 715 A 7 LEU HDy% A 8 PRO HD2 1.0 . 4.46 805 716 A 7 LEU HDy% A 11 TRP HB2 1.0 . 3.54 806 717 A 7 LEU HDy% A 11 TRP HB3 1.0 . 3.38 807 718 A 7 LEU HDy% A 12 GLU H 1.0 . 4.45 808 719 A 7 LEU HDy% A 12 GLU HA 1.0 . 3.19 809 720 A 7 LEU HDy% A 37 PRO HD2 1.0 . 4.33 810 721 A 7 LEU HB2 A 7 LEU HDx% 1.0 . 3.58 811 722 A 7 LEU HDx% A 8 PRO HD3 1.0 . 3.56 812 723 A 7 LEU HDx% A 8 PRO HD2 1.0 . 3.31 813 724 A 7 LEU HDx% A 11 TRP HB2 1.0 . 3.83 814 725 A 7 LEU HDx% A 11 TRP HB3 1.0 . 3.47 815 726 A 7 LEU HDx% A 13 LYS H 1.0 . 4.45 816 727 A 7 LEU HDx% A 24 TYR HA 1.0 . 4.45 817 728 A 7 LEU HDx% A 24 TYR HB2 1.0 . 5.07 818 729 A 7 LEU HDx% A 24 TYR HD% 1.0 . 3.19 819 730 A 7 LEU HDx% A 24 TYR HE% 1.0 . 2.91 820 731 A 8 PRO HA A 9 PRO HD3 1.0 . 2.90 821 732 A 8 PRO HB2 A 11 TRP HD1 1.0 . 2.29 822 733 A 8 PRO HB2 A 11 TRP HE1 1.0 . 3.37 823 734 A 11 TRP HD1 A 8 PRO HG3 1.0 . 3.50 824 735 A 11 TRP HE1 A 8 PRO HG3 1.0 . 3.58 825 736 A 8 PRO HG3 A 39 GLY H 1.0 . 4.37 826 737 A 8 PRO HG2 A 38 SER HA 1.0 . 5.64 827 738 A 39 GLY H A 8 PRO HG2 1.0 . 6.12 828 739 A 8 PRO HD3 A 37 PRO HG2 1.0 . 3.45 829 740 A 8 PRO HD3 A 37 PRO HG3 1.0 . 4.78 830 741 A 8 PRO HD2 A 11 TRP HE1 1.0 . 5.27 831 742 A 8 PRO HD2 A 36 ARG HA 1.0 . 4.83 832 743 A 8 PRO HD2 A 36 ARG HGy 1.0 . 3.26 833 744 A 8 PRO HD2 A 36 ARG HGx 1.0 . 3.26 834 745 A 8 PRO HD2 A 37 PRO HG2 1.0 . 2.68 835 746 A 8 PRO HD2 A 37 PRO HD2 1.0 . 4.75 836 747 A 9 PRO HA A 10 GLY H 1.0 . 1.94 837 748 A 9 PRO HA A 10 GLY HA2 1.0 . 3.92 838 749 A 11 TRP H A 9 PRO HA 1.0 . 3.15 839 750 A 10 GLY H A 9 PRO HBy 1.0 . 3.73 840 751 A 10 GLY H A 9 PRO HBx 1.0 . 3.73 841 752 A 8 PRO HB2 A 9 PRO HD2 1.0 . 2.95 842 753 A 10 GLY H A 10 GLY HA2 1.0 . 2.16 843 754 A 10 GLY H A 10 GLY HA3 1.0 . 2.50 844 755 A 11 TRP H A 10 GLY H 1.0 . 2.50 845 756 A 10 GLY HA2 A 28 ILE HG13 1.0 . 3.08 846 757 A 10 GLY HA2 A 28 ILE HD1% 1.0 . 3.49 847 758 A 11 TRP H A 10 GLY HA3 1.0 . 2.84 848 759 A 10 GLY HA3 A 28 ILE HG12 1.0 . 4.31 849 760 A 10 GLY HA3 A 28 ILE HG13 1.0 . 3.06 850 761 A 10 GLY HA3 A 28 ILE HD1% 1.0 . 3.07 851 762 A 11 TRP H A 26 ASN HB2 1.0 . 3.85 852 763 A 11 TRP HB2 A 11 TRP HA 1.0 . 2.56 853 764 A 11 TRP HB3 A 11 TRP HA 1.0 . 2.33 854 765 A 11 TRP HA A 11 TRP HE3 1.0 . 3.58 855 766 A 12 GLU H A 11 TRP HA 1.0 . 1.94 856 767 A 11 TRP HA A 26 ASN HA 1.0 . 2.10 857 768 A 11 TRP HA A 27 HIS H 1.0 . 4.78 858 769 A 8 PRO HD2 A 11 TRP HB2 1.0 . 3.54 859 770 A 11 TRP H A 11 TRP HB2 1.0 . 2.61 860 771 A 11 TRP HB2 A 11 TRP HD1 1.0 . 2.57 861 772 A 11 TRP HB2 A 12 GLU H 1.0 . 3.52 862 773 A 11 TRP HB3 A 11 TRP HE3 1.0 . 2.76 863 774 A 11 TRP HB3 A 12 GLU H 1.0 . 2.59 864 775 A 11 TRP HD1 A 8 PRO HB3 1.0 . 4.41 865 776 A 11 TRP H A 11 TRP HD1 1.0 . 3.47 866 777 A 24 TYR HB2 A 11 TRP HE3 1.0 . 3.22 867 778 A 11 TRP HE3 A 25 PHE H 1.0 . 2.76 868 779 A 11 TRP HE3 A 25 PHE HA 1.0 . 4.20 869 780 A 37 PRO HG3 A 11 TRP HE3 1.0 . 3.38 870 781 A 11 TRP HE1 A 8 PRO HB3 1.0 . 4.97 871 782 A 11 TRP HE1 A 26 ASN HD21 1.0 . 2.80 872 783 A 11 TRP HE1 A 26 ASN HD22 1.0 . 3.55 873 784 A 11 TRP HE1 A 37 PRO HG3 1.0 . 4.12 874 785 A 11 TRP HZ3 A 26 ASN H 1.0 . 3.52 875 786 A 26 ASN HB2 A 11 TRP HZ3 1.0 . 3.66 876 787 A 26 ASN HD21 A 11 TRP HZ2 1.0 . 3.05 877 788 A 11 TRP HZ2 A 31 ALA HB% 1.0 . 3.93 878 789 A 31 ALA HB% A 11 TRP HH2 1.0 . 3.03 879 790 A 11 TRP H A 12 GLU H 1.0 . 4.95 880 791 A 12 GLU H A 11 TRP HE3 1.0 . 3.31 881 792 A 12 GLU H A 12 GLU HBx 1.0 . 2.67 882 792 A 12 GLU H A 12 GLU HBy 1.0 . 2.67 883 793 A 12 GLU H A 12 GLU HG2 1.0 . 3.08 884 794 A 12 GLU H A 25 PHE H 1.0 . 2.49 885 795 A 12 GLU H A 25 PHE HB2 1.0 . 5.06 886 796 A 12 GLU H A 25 PHE HB3 1.0 . 4.24 887 797 A 12 GLU H A 26 ASN HA 1.0 . 3.17 888 798 A 12 GLU HA A 12 GLU HBx 1.0 . 2.38 889 798 A 12 GLU HA A 12 GLU HBy 1.0 . 2.38 890 799 A 12 GLU HA A 13 LYS H 1.0 . 2.06 891 800 A 13 LYS H A 12 GLU HBx 1.0 . 3.18 892 800 A 13 LYS H A 12 GLU HBy 1.0 . 3.18 893 801 A 25 PHE H A 12 GLU HBx 1.0 . 4.09 894 801 A 25 PHE H A 12 GLU HBy 1.0 . 4.09 895 802 A 27 HIS HD2 A 12 GLU HBx 1.0 . 3.85 896 802 A 12 GLU HBy A 27 HIS HD2 1.0 . 3.85 897 803 A 13 LYS H A 12 GLU HG2 1.0 . 3.18 898 804 A 12 GLU HG2 A 14 ARG HG2 1.0 . 3.60 899 805 A 12 GLU H A 12 GLU HG3 1.0 . 4.10 900 806 A 7 LEU HDy% A 13 LYS H 1.0 . 4.34 901 807 A 13 LYS H A 13 LYS HB2 1.0 . 2.40 902 808 A 13 LYS HA A 14 ARG H 1.0 . 2.38 903 809 A 24 TYR HA A 13 LYS HA 1.0 . 2.57 904 810 A 24 TYR HD% A 13 LYS HA 1.0 . 3.02 905 811 A 24 TYR HE% A 13 LYS HA 1.0 . 3.85 906 812 A 25 PHE H A 13 LYS HA 1.0 . 4.17 907 813 A 7 LEU HA A 13 LYS HB2 1.0 . 5.16 908 814 A 13 LYS HB2 A 14 ARG H 1.0 . 4.61 909 815 A 24 TYR HE% A 13 LYS HB2 1.0 . 2.74 910 816 A 13 LYS H A 13 LYS HB3 1.0 . 2.86 911 817 A 14 ARG H A 13 LYS HB3 1.0 . 4.37 912 818 A 24 TYR HE% A 13 LYS HB3 1.0 . 4.29 913 819 A 13 LYS H A 13 LYS HEx 1.0 . 5.91 914 819 A 13 LYS H A 13 LYS HEy 1.0 . 5.91 915 820 A 13 LYS HB2 A 13 LYS HEx 1.0 . 3.86 916 820 A 13 LYS HB2 A 13 LYS HEy 1.0 . 3.86 917 821 A 22 VAL HGy% A 13 LYS HEx 1.0 . 4.74 918 821 A 13 LYS HEy A 22 VAL HGy% 1.0 . 4.74 919 822 A 22 VAL HGx% A 13 LYS HEx 1.0 . 4.34 920 822 A 13 LYS HEy A 22 VAL HGx% 1.0 . 4.34 921 823 A 24 TYR HE% A 13 LYS HEx 1.0 . 3.88 922 823 A 24 TYR HE% A 13 LYS HEy 1.0 . 3.88 923 824 A 14 ARG H A 14 ARG HB2 1.0 . 2.43 924 825 A 14 ARG H A 14 ARG HB3 1.0 . 3.39 925 826 A 14 ARG HG2 A 14 ARG H 1.0 . 3.82 926 827 A 14 ARG H A 22 VAL HGx% 1.0 . 3.88 927 828 A 14 ARG H A 23 TYR H 1.0 . 2.83 928 829 A 24 TYR HA A 14 ARG H 1.0 . 2.84 929 830 A 14 ARG HG2 A 14 ARG HA 1.0 . 2.45 930 831 A 14 ARG HA A 14 ARG HDy 1.0 . 3.93 931 832 A 14 ARG HA A 14 ARG HDx 1.0 . 3.93 932 833 A 14 ARG HA A 15 MET H 1.0 . 2.19 933 834 A 14 ARG HG2 A 14 ARG HB2 1.0 . 2.33 934 835 A 14 ARG HB2 A 14 ARG HDy 1.0 . 3.25 935 836 A 14 ARG HB2 A 14 ARG HDx 1.0 . 3.25 936 837 A 14 ARG HB2 A 15 MET H 1.0 . 3.27 937 838 A 14 ARG HB2 A 23 TYR H 1.0 . 4.36 938 839 A 14 ARG HB2 A 23 TYR HE% 1.0 . 2.98 939 840 A 14 ARG HB3 A 15 MET H 1.0 . 2.24 940 841 A 14 ARG HB3 A 23 TYR HE% 1.0 . 3.28 941 842 A 14 ARG HG2 A 14 ARG HDy 1.0 . 2.68 942 843 A 14 ARG HG2 A 14 ARG HDx 1.0 . 2.68 943 844 A 12 GLU HG2 A 14 ARG HG3 1.0 . 4.56 944 845 A 14 ARG H A 14 ARG HG3 1.0 . 4.24 945 846 A 14 ARG HB2 A 14 ARG HG3 1.0 . 2.65 946 847 A 25 PHE H A 14 ARG HG3 1.0 . 4.48 947 848 A 25 PHE HA A 14 ARG HG3 1.0 . 5.18 948 849 A 25 PHE HB2 A 14 ARG HG3 1.0 . 4.41 949 850 A 25 PHE HB3 A 14 ARG HG3 1.0 . 3.24 950 851 A 14 ARG HB3 A 14 ARG HDy 1.0 . 3.39 951 852 A 14 ARG HB3 A 14 ARG HDx 1.0 . 3.39 952 853 A 14 ARG HG2 A 15 MET H 1.0 . 4.75 953 854 A 15 MET H A 15 MET HBx 1.0 . 2.54 954 854 A 15 MET H A 15 MET HBy 1.0 . 2.54 955 855 A 15 MET H A 23 TYR HE% 1.0 . 3.90 956 856 A 15 MET HA A 16 SER H 1.0 . 3.08 957 857 A 14 ARG HA A 15 MET HBx 1.0 . 4.15 958 857 A 14 ARG HA A 15 MET HBy 1.0 . 4.15 959 858 A 16 SER H A 15 MET HBx 1.0 . 3.48 960 858 A 15 MET HBy A 16 SER H 1.0 . 3.48 961 859 A 20 GLY H A 15 MET HBx 1.0 . 5.39 962 859 A 15 MET HBy A 20 GLY H 1.0 . 5.39 963 860 A 22 VAL HA A 15 MET HBx 1.0 . 3.94 964 860 A 15 MET HBy A 22 VAL HA 1.0 . 3.94 965 861 A 15 MET H A 15 MET HGy 1.0 . 4.75 966 862 A 16 SER H A 15 MET HGy 1.0 . 3.80 967 863 A 22 VAL HGy% A 15 MET HGy 1.0 . 5.58 968 864 A 15 MET H A 15 MET HGx 1.0 . 4.75 969 865 A 16 SER H A 15 MET HGx 1.0 . 3.80 970 866 A 22 VAL HGy% A 15 MET HGx 1.0 . 5.58 971 867 A 15 MET H A 16 SER H 1.0 . 4.87 972 868 A 16 SER H A 21 ARG H 1.0 . 3.22 973 869 A 16 SER H A 22 VAL HA 1.0 . 3.29 974 870 A 16 SER H A 23 TYR HD% 1.0 . 3.08 975 871 A 23 TYR HE% A 16 SER H 1.0 . 3.24 976 872 A 16 SER HA A 17 ARG H 1.0 . 2.05 977 873 A 23 TYR HE% A 16 SER HA 1.0 . 2.56 978 874 A 16 SER H A 16 SER HB3 1.0 . 3.35 979 875 A 21 ARG H A 16 SER HB3 1.0 . 4.00 980 876 A 16 SER H A 16 SER HB2 1.0 . 2.85 981 877 A 23 TYR HD% A 16 SER HB2 1.0 . 3.76 982 878 A 23 TYR HE% A 16 SER HB2 1.0 . 3.92 983 879 A 17 ARG H A 17 ARG HBx 1.0 . 2.40 984 879 A 17 ARG H A 17 ARG HBy 1.0 . 2.40 985 880 A 17 ARG H A 18 ASN H 1.0 . 2.90 986 881 A 17 ARG HA A 17 ARG HBx 1.0 . 2.45 987 881 A 17 ARG HA A 17 ARG HBy 1.0 . 2.45 988 882 A 17 ARG HA A 17 ARG HDx 1.0 . 4.48 989 882 A 17 ARG HA A 17 ARG HDy 1.0 . 4.48 990 883 A 17 ARG HA A 18 ASN H 1.0 . 2.59 991 884 A 17 ARG HA A 18 ASN HA 1.0 . 5.70 992 885 A 17 ARG HA A 18 ASN HBx 1.0 . 5.35 993 885 A 17 ARG HA A 18 ASN HBy 1.0 . 5.35 994 886 A 16 SER HA A 17 ARG HBx 1.0 . 4.23 995 886 A 16 SER HA A 17 ARG HBy 1.0 . 4.23 996 887 A 17 ARG HBy A 17 ARG HDx 1.0 . 3.09 997 887 A 17 ARG HBx A 17 ARG HDx 1.0 . 3.09 998 887 A 17 ARG HDy A 17 ARG HBx 1.0 . 3.09 999 887 A 17 ARG HBy A 17 ARG HDy 1.0 . 3.09 1000 888 A 18 ASN H A 17 ARG HBx 1.0 . 2.84 1001 888 A 17 ARG HBy A 18 ASN H 1.0 . 2.84 1002 889 A 18 ASN HA A 17 ARG HBx 1.0 . 4.86 1003 889 A 17 ARG HBy A 18 ASN HA 1.0 . 4.86 1004 890 A 17 ARG H A 17 ARG HDx 1.0 . 4.58 1005 890 A 17 ARG H A 17 ARG HDy 1.0 . 4.58 1006 891 A 18 ASN H A 18 ASN HA 1.0 . 2.46 1007 892 A 18 ASN H A 18 ASN HBx 1.0 . 2.67 1008 892 A 18 ASN H A 18 ASN HBy 1.0 . 2.67 1009 893 A 18 ASN HA A 18 ASN HBx 1.0 . 2.41 1010 893 A 18 ASN HA A 18 ASN HBy 1.0 . 2.41 1011 894 A 19 SER HA A 18 ASN HBx 1.0 . 4.61 1012 894 A 18 ASN HBy A 19 SER HA 1.0 . 4.61 1013 895 A 19 SER HBx A 18 ASN HBx 1.0 . 4.30 1014 895 A 18 ASN HBy A 19 SER HBx 1.0 . 4.30 1015 896 A 18 ASN HBy A 19 SER HBy 1.0 . 4.30 1016 896 A 18 ASN HBx A 19 SER HBy 1.0 . 4.30 1017 897 A 20 GLY H A 18 ASN HBx 1.0 . 5.01 1018 897 A 20 GLY H A 18 ASN HBy 1.0 . 5.01 1019 898 A 18 ASN H A 18 ASN HD21 1.0 . 4.40 1020 899 A 18 ASN HA A 18 ASN HD21 1.0 . 4.90 1021 900 A 19 SER HA A 19 SER HBx 1.0 . 2.43 1022 901 A 19 SER HA A 19 SER HBy 1.0 . 2.43 1023 902 A 20 GLY H A 19 SER HA 1.0 . 2.95 1024 903 A 20 GLY H A 19 SER HBx 1.0 . 4.52 1025 904 A 20 GLY H A 19 SER HBy 1.0 . 4.52 1026 905 A 20 GLY H A 21 ARG H 1.0 . 2.66 1027 906 A 15 MET HBy A 20 GLY HAx 1.0 . 5.07 1028 906 A 15 MET HBx A 20 GLY HAx 1.0 . 5.07 1029 907 A 21 ARG H A 19 SER HA 1.0 . 5.36 1030 908 A 21 ARG H A 21 ARG HB2 1.0 . 2.32 1031 909 A 21 ARG HA A 21 ARG HB2 1.0 . 2.61 1032 910 A 21 ARG HA A 21 ARG HD2 1.0 . 4.02 1033 911 A 21 ARG HA A 22 VAL HB 1.0 . 5.07 1034 912 A 22 VAL HGy% A 21 ARG HA 1.0 . 5.35 1035 913 A 21 ARG H A 21 ARG HB3 1.0 . 3.15 1036 914 A 21 ARG HB3 A 21 ARG HD3 1.0 . 3.33 1037 915 A 21 ARG HB3 A 21 ARG HD2 1.0 . 3.69 1038 916 A 21 ARG H A 21 ARG HD3 1.0 . 4.81 1039 917 A 21 ARG HB2 A 21 ARG HD3 1.0 . 3.27 1040 918 A 21 ARG H A 21 ARG HD2 1.0 . 5.52 1041 919 A 21 ARG HB2 A 21 ARG HD2 1.0 . 3.14 1042 920 A 21 ARG HB2 A 21 ARG HE 1.0 . 4.68 1043 921 A 21 ARG HB3 A 21 ARG HE 1.0 . 4.82 1044 922 A 21 ARG HD3 A 21 ARG HH2y 1.0 . 4.42 1045 923 A 21 ARG HD3 A 21 ARG HH2x 1.0 . 4.42 1046 924 A 21 ARG H A 22 VAL H 1.0 . 4.61 1047 925 A 21 ARG HA A 22 VAL H 1.0 . 2.58 1048 926 A 21 ARG HB2 A 22 VAL H 1.0 . 4.15 1049 927 A 21 ARG HB3 A 22 VAL H 1.0 . 3.57 1050 928 A 21 ARG HD2 A 22 VAL H 1.0 . 6.44 1051 929 A 22 VAL HB A 22 VAL H 1.0 . 2.69 1052 930 A 22 VAL HGy% A 22 VAL H 1.0 . 3.44 1053 931 A 22 VAL HGx% A 22 VAL H 1.0 . 4.64 1054 932 A 22 VAL HGy% A 22 VAL HA 1.0 . 2.73 1055 933 A 22 VAL HGx% A 22 VAL HA 1.0 . 2.76 1056 934 A 23 TYR H A 22 VAL HA 1.0 . 2.01 1057 935 A 23 TYR H A 22 VAL HB 1.0 . 3.75 1058 936 A 14 ARG H A 22 VAL HGy% 1.0 . 3.70 1059 937 A 22 VAL HGy% A 15 MET HBx 1.0 . 4.77 1060 937 A 22 VAL HGy% A 15 MET HBy 1.0 . 4.77 1061 938 A 22 VAL HGy% A 23 TYR H 1.0 . 4.27 1062 939 A 22 VAL HGy% A 23 TYR HA 1.0 . 4.30 1063 940 A 22 VAL HGx% A 15 MET HBx 1.0 . 5.31 1064 940 A 22 VAL HGx% A 15 MET HBy 1.0 . 5.31 1065 941 A 22 VAL HGx% A 23 TYR H 1.0 . 2.81 1066 942 A 22 VAL HGx% A 23 TYR HA 1.0 . 2.89 1067 943 A 23 TYR H A 23 TYR HB2 1.0 . 3.72 1068 944 A 23 TYR H A 23 TYR HD% 1.0 . 2.74 1069 945 A 23 TYR HA A 23 TYR HB2 1.0 . 2.11 1070 946 A 23 TYR HA A 23 TYR HB3 1.0 . 2.16 1071 947 A 23 TYR HB2 A 24 TYR H 1.0 . 2.07 1072 948 A 23 TYR HB2 A 34 PHE HA 1.0 . 2.70 1073 949 A 22 VAL HA A 23 TYR HD% 1.0 . 7.13 1074 950 A 23 TYR HD% A 23 TYR HA 1.0 . 7.13 1075 951 A 23 TYR HD% A 24 TYR H 1.0 . 2.91 1076 952 A 23 TYR HD% A 32 SER H 1.0 . 7.13 1077 953 A 23 TYR HD% A 32 SER HA 1.0 . 7.13 1078 954 A 23 TYR H A 23 TYR HE% 1.0 . 7.13 1079 955 A 25 PHE HB2 A 23 TYR HE% 1.0 . 2.47 1080 956 A 25 PHE HB3 A 23 TYR HE% 1.0 . 3.39 1081 957 A 23 TYR HA A 24 TYR H 1.0 . 2.25 1082 958 A 23 TYR HB3 A 24 TYR H 1.0 . 3.55 1083 959 A 24 TYR HB2 A 24 TYR H 1.0 . 2.28 1084 960 A 24 TYR HD% A 24 TYR H 1.0 . 2.61 1085 961 A 24 TYR H A 33 GLN H 1.0 . 2.68 1086 962 A 24 TYR HA A 24 TYR HB2 1.0 . 2.58 1087 963 A 24 TYR HA A 25 PHE H 1.0 . 1.98 1088 964 A 11 TRP HE3 A 24 TYR HB3 1.0 . 2.49 1089 965 A 24 TYR HA A 24 TYR HB3 1.0 . 2.48 1090 966 A 37 PRO HD2 A 24 TYR HB3 1.0 . 4.64 1091 967 A 24 TYR HB3 A 37 PRO HD3 1.0 . 3.64 1092 968 A 7 LEU HDy% A 24 TYR HD% 1.0 . 7.13 1093 969 A 11 TRP H A 24 TYR HD% 1.0 . 7.13 1094 970 A 24 TYR HD% A 11 TRP HE1 1.0 . 7.13 1095 971 A 24 TYR HD% A 23 TYR H 1.0 . 7.13 1096 972 A 24 TYR HA A 24 TYR HD% 1.0 . 7.13 1097 973 A 24 TYR HD% A 25 PHE H 1.0 . 7.13 1098 974 A 24 TYR HD% A 36 ARG HA 1.0 . 7.13 1099 975 A 37 PRO HD2 A 24 TYR HD% 1.0 . 7.13 1100 976 A 7 LEU HDy% A 24 TYR HE% 1.0 . 7.13 1101 977 A 24 TYR HE% A 22 VAL HGx% 1.0 . 7.13 1102 978 A 24 TYR HE% A 24 TYR H 1.0 . 7.13 1103 979 A 24 TYR HE% A 35 GLU HA 1.0 . 7.13 1104 980 A 24 TYR HE% A 36 ARG H 1.0 . 3.55 1105 981 A 24 TYR HE% A 36 ARG HA 1.0 . 2.91 1106 982 A 24 TYR HE% A 36 ARG HBx 1.0 . 3.38 1107 982 A 24 TYR HE% A 36 ARG HBy 1.0 . 3.38 1108 983 A 37 PRO HD2 A 24 TYR HE% 1.0 . 3.69 1109 984 A 24 TYR HB2 A 25 PHE H 1.0 . 3.73 1110 985 A 25 PHE H A 25 PHE HB2 1.0 . 2.70 1111 986 A 25 PHE H A 25 PHE HB3 1.0 . 2.28 1112 987 A 25 PHE HA A 11 TRP HZ3 1.0 . 3.23 1113 988 A 25 PHE HA A 25 PHE HB2 1.0 . 2.21 1114 989 A 25 PHE HA A 25 PHE HB3 1.0 . 2.64 1115 990 A 25 PHE HA A 25 PHE HD% 1.0 . 2.55 1116 991 A 25 PHE HA A 26 ASN H 1.0 . 1.98 1117 992 A 25 PHE HA A 32 SER H 1.0 . 5.59 1118 993 A 25 PHE HA A 32 SER HA 1.0 . 2.25 1119 994 A 25 PHE HA A 33 GLN H 1.0 . 4.49 1120 995 A 26 ASN H A 25 PHE HB2 1.0 . 3.65 1121 996 A 25 PHE HB2 A 32 SER HA 1.0 . 4.31 1122 997 A 26 ASN H A 25 PHE HB3 1.0 . 3.79 1123 998 A 25 PHE H A 25 PHE HD% 1.0 . 7.13 1124 999 A 27 HIS H A 25 PHE HE% 1.0 . 7.13 1125 1000 A 25 PHE HE% A 27 HIS HA 1.0 . 7.13 1126 1001 A 25 PHE HE% A 27 HIS HBx 1.0 . 7.13 1127 1002 A 25 PHE HE% A 27 HIS HBy 1.0 . 7.13 1128 1003 A 25 PHE HE% A 30 ASN HA 1.0 . 3.41 1129 1004 A 26 ASN HB2 A 26 ASN H 1.0 . 2.46 1130 1005 A 26 ASN H A 31 ALA H 1.0 . 3.14 1131 1006 A 26 ASN H A 32 SER HA 1.0 . 3.26 1132 1007 A 26 ASN HB2 A 26 ASN HA 1.0 . 2.33 1133 1008 A 26 ASN HA A 27 HIS H 1.0 . 2.00 1134 1009 A 26 ASN HB2 A 11 TRP HE3 1.0 . 3.72 1135 1010 A 26 ASN HB2 A 11 TRP HZ2 1.0 . 4.12 1136 1011 A 26 ASN HB2 A 26 ASN HD21 1.0 . 2.16 1137 1012 A 26 ASN HB2 A 26 ASN HD22 1.0 . 3.44 1138 1013 A 26 ASN HB2 A 27 HIS H 1.0 . 4.99 1139 1014 A 26 ASN HB2 A 28 ILE H 1.0 . 5.65 1140 1015 A 26 ASN HB2 A 31 ALA H 1.0 . 3.66 1141 1016 A 26 ASN H A 26 ASN HB3 1.0 . 2.90 1142 1017 A 26 ASN HB3 A 30 ASN H 1.0 . 3.60 1143 1018 A 30 ASN HA A 26 ASN HB3 1.0 . 5.12 1144 1019 A 31 ALA H A 26 ASN HB3 1.0 . 3.06 1145 1020 A 31 ALA HB% A 26 ASN HB3 1.0 . 4.43 1146 1021 A 26 ASN HD21 A 26 ASN H 1.0 . 4.47 1147 1022 A 10 GLY HA3 A 26 ASN HD22 1.0 . 3.50 1148 1023 A 26 ASN HD22 A 29 THR H 1.0 . 4.72 1149 1024 A 26 ASN HD22 A 29 THR HG2% 1.0 . 3.36 1150 1025 A 27 HIS H A 27 HIS HBx 1.0 . 2.89 1151 1026 A 27 HIS H A 27 HIS HBy 1.0 . 2.89 1152 1027 A 27 HIS H A 27 HIS HD2 1.0 . 2.95 1153 1028 A 27 HIS H A 28 ILE H 1.0 . 2.57 1154 1029 A 27 HIS HA A 27 HIS HBx 1.0 . 2.43 1155 1030 A 27 HIS HA A 27 HIS HBy 1.0 . 2.43 1156 1031 A 27 HIS HA A 28 ILE H 1.0 . 3.02 1157 1032 A 26 ASN HA A 28 ILE H 1.0 . 3.80 1158 1033 A 27 HIS HD2 A 28 ILE H 1.0 . 5.28 1159 1034 A 28 ILE H A 28 ILE HB 1.0 . 2.25 1160 1035 A 28 ILE H A 28 ILE HG2% 1.0 . 3.89 1161 1036 A 28 ILE HG12 A 28 ILE H 1.0 . 3.09 1162 1037 A 28 ILE HG13 A 28 ILE H 1.0 . 2.51 1163 1038 A 28 ILE HD1% A 28 ILE H 1.0 . 3.98 1164 1039 A 28 ILE H A 29 THR H 1.0 . 2.16 1165 1040 A 28 ILE H A 29 THR HA 1.0 . 5.68 1166 1041 A 28 ILE H A 30 ASN H 1.0 . 3.35 1167 1042 A 28 ILE HA A 28 ILE HB 1.0 . 2.57 1168 1043 A 28 ILE HA A 28 ILE HG2% 1.0 . 2.59 1169 1044 A 28 ILE HG12 A 28 ILE HA 1.0 . 2.99 1170 1045 A 28 ILE HG13 A 28 ILE HA 1.0 . 3.05 1171 1046 A 28 ILE HD1% A 28 ILE HA 1.0 . 4.53 1172 1047 A 28 ILE HG12 A 28 ILE HB 1.0 . 2.60 1173 1048 A 28 ILE HG13 A 28 ILE HB 1.0 . 2.55 1174 1049 A 28 ILE HD1% A 28 ILE HB 1.0 . 2.66 1175 1050 A 29 THR H A 28 ILE HB 1.0 . 2.29 1176 1051 A 29 THR H A 28 ILE HG2% 1.0 . 3.63 1177 1052 A 28 ILE HG2% A 29 THR HA 1.0 . 3.63 1178 1053 A 10 GLY HA2 A 28 ILE HG12 1.0 . 4.59 1179 1054 A 28 ILE HG12 A 27 HIS H 1.0 . 5.70 1180 1055 A 28 ILE HG12 A 27 HIS HD2 1.0 . 4.55 1181 1056 A 28 ILE HG13 A 27 HIS H 1.0 . 4.31 1182 1057 A 28 ILE HG13 A 27 HIS HD2 1.0 . 3.83 1183 1058 A 28 ILE HG13 A 29 THR H 1.0 . 4.69 1184 1059 A 28 ILE HG13 A 29 THR HA 1.0 . 5.55 1185 1060 A 10 GLY H A 28 ILE HD1% 1.0 . 4.78 1186 1061 A 28 ILE HD1% A 26 ASN HD22 1.0 . 4.41 1187 1062 A 28 ILE HD1% A 27 HIS H 1.0 . 5.57 1188 1063 A 28 ILE HD1% A 27 HIS HD2 1.0 . 4.68 1189 1064 A 27 HIS H A 29 THR H 1.0 . 4.88 1190 1065 A 29 THR H A 29 THR HA 1.0 . 2.59 1191 1066 A 29 THR H A 29 THR HB 1.0 . 3.44 1192 1067 A 29 THR H A 29 THR HG2% 1.0 . 2.60 1193 1068 A 30 ASN H A 29 THR H 1.0 . 2.13 1194 1069 A 29 THR HA A 29 THR HB 1.0 . 2.34 1195 1070 A 29 THR HG2% A 29 THR HA 1.0 . 2.63 1196 1071 A 31 ALA H A 29 THR HB 1.0 . 3.27 1197 1072 A 31 ALA HB% A 29 THR HB 1.0 . 3.39 1198 1073 A 26 ASN HD21 A 29 THR HG2% 1.0 . 4.16 1199 1074 A 30 ASN H A 29 THR HG2% 1.0 . 4.35 1200 1075 A 31 ALA H A 29 THR HG2% 1.0 . 4.78 1201 1076 A 31 ALA H A 29 THR HG1 1.0 . 3.89 1202 1077 A 31 ALA HB% A 29 THR HG1 1.0 . 4.08 1203 1078 A 27 HIS HA A 30 ASN H 1.0 . 3.88 1204 1079 A 30 ASN H A 29 THR HB 1.0 . 4.80 1205 1080 A 30 ASN HA A 30 ASN H 1.0 . 1.98 1206 1081 A 31 ALA H A 30 ASN H 1.0 . 2.49 1207 1082 A 25 PHE HD% A 30 ASN HA 1.0 . 3.50 1208 1083 A 30 ASN HA A 31 ALA H 1.0 . 2.72 1209 1084 A 31 ALA HB% A 30 ASN HA 1.0 . 4.61 1210 1085 A 31 ALA H A 30 ASN HB3 1.0 . 4.65 1211 1086 A 31 ALA HB% A 30 ASN HB3 1.0 . 6.36 1212 1087 A 25 PHE HE% A 30 ASN HB2 1.0 . 4.45 1213 1088 A 31 ALA H A 30 ASN HB2 1.0 . 4.50 1214 1089 A 31 ALA H A 29 THR HA 1.0 . 5.19 1215 1090 A 31 ALA HB% A 31 ALA H 1.0 . 2.51 1216 1091 A 32 SER H A 31 ALA H 1.0 . 3.88 1217 1092 A 32 SER H A 31 ALA HA 1.0 . 2.06 1218 1093 A 32 SER HA A 31 ALA HA 1.0 . 4.61 1219 1094 A 26 ASN H A 31 ALA HB% 1.0 . 3.90 1220 1095 A 26 ASN HB2 A 31 ALA HB% 1.0 . 3.51 1221 1096 A 31 ALA HB% A 30 ASN H 1.0 . 4.92 1222 1097 A 31 ALA HB% A 32 SER H 1.0 . 2.89 1223 1098 A 31 ALA HB% A 32 SER HA 1.0 . 4.21 1224 1099 A 32 SER H A 33 GLN H 1.0 . 4.10 1225 1100 A 11 TRP HZ3 A 32 SER HA 1.0 . 3.17 1226 1101 A 32 SER HA A 33 GLN H 1.0 . 2.09 1227 1102 A 32 SER HA A 33 GLN HBy 1.0 . 4.40 1228 1103 A 32 SER HA A 33 GLN HBx 1.0 . 4.40 1229 1104 A 23 TYR HD% A 32 SER HBy 1.0 . 3.41 1230 1105 A 23 TYR HE% A 32 SER HBy 1.0 . 4.37 1231 1106 A 25 PHE HA A 32 SER HBy 1.0 . 4.37 1232 1107 A 33 GLN H A 32 SER HBy 1.0 . 3.63 1233 1108 A 23 TYR HD% A 32 SER HBx 1.0 . 3.41 1234 1109 A 23 TYR HE% A 32 SER HBx 1.0 . 4.37 1235 1110 A 25 PHE HA A 32 SER HBx 1.0 . 4.37 1236 1111 A 33 GLN H A 32 SER HBx 1.0 . 3.63 1237 1112 A 11 TRP HZ3 A 33 GLN H 1.0 . 3.39 1238 1113 A 23 TYR HB2 A 33 GLN H 1.0 . 3.65 1239 1114 A 23 TYR HD% A 33 GLN H 1.0 . 3.38 1240 1115 A 23 TYR HE% A 33 GLN H 1.0 . 5.11 1241 1116 A 33 GLN H A 33 GLN HBy 1.0 . 3.02 1242 1117 A 33 GLN H A 33 GLN HBx 1.0 . 3.02 1243 1118 A 33 GLN HA A 33 GLN HBy 1.0 . 2.42 1244 1119 A 33 GLN HA A 33 GLN HBx 1.0 . 2.42 1245 1120 A 33 GLN HA A 34 PHE H 1.0 . 3.18 1246 1121 A 33 GLN HE2y A 33 GLN HBy 1.0 . 3.84 1247 1122 A 33 GLN HE2x A 33 GLN HBy 1.0 . 3.84 1248 1123 A 34 PHE H A 33 GLN HBy 1.0 . 3.27 1249 1124 A 33 GLN HE2y A 33 GLN HBx 1.0 . 3.84 1250 1125 A 33 GLN HE2x A 33 GLN HBx 1.0 . 3.84 1251 1126 A 34 PHE H A 33 GLN HBx 1.0 . 3.27 1252 1127 A 33 GLN HE2y A 37 PRO HA 1.0 . 3.06 1253 1128 A 37 PRO HG3 A 33 GLN HE2y 1.0 . 4.27 1254 1129 A 37 PRO HD3 A 33 GLN HE2y 1.0 . 3.97 1255 1130 A 33 GLN HE2x A 37 PRO HA 1.0 . 3.06 1256 1131 A 37 PRO HG3 A 33 GLN HE2x 1.0 . 4.27 1257 1132 A 37 PRO HD3 A 33 GLN HE2x 1.0 . 3.97 1258 1133 A 34 PHE H A 34 PHE HB2 1.0 . 2.28 1259 1134 A 34 PHE H A 34 PHE HB3 1.0 . 3.10 1260 1135 A 34 PHE H A 34 PHE HD% 1.0 . 2.88 1261 1136 A 34 PHE H A 35 GLU H 1.0 . 2.32 1262 1137 A 22 VAL HGx% A 34 PHE HA 1.0 . 5.61 1263 1138 A 34 PHE HA A 34 PHE HB2 1.0 . 2.61 1264 1139 A 34 PHE HA A 34 PHE HB3 1.0 . 2.29 1265 1140 A 34 PHE HA A 34 PHE HD% 1.0 . 2.49 1266 1141 A 35 GLU H A 34 PHE HB2 1.0 . 2.73 1267 1142 A 35 GLU H A 34 PHE HB3 1.0 . 3.55 1268 1143 A 23 TYR HA A 34 PHE HD% 1.0 . 7.13 1269 1144 A 23 TYR HB2 A 34 PHE HD% 1.0 . 7.13 1270 1145 A 23 TYR HB3 A 34 PHE HD% 1.0 . 7.13 1271 1146 A 21 ARG HB2 A 34 PHE HE% 1.0 . 7.13 1272 1147 A 21 ARG HD3 A 34 PHE HE% 1.0 . 7.13 1273 1148 A 23 TYR HB3 A 34 PHE HE% 1.0 . 7.13 1274 1149 A 34 PHE HA A 35 GLU H 1.0 . 3.08 1275 1150 A 35 GLU HA A 36 ARG H 1.0 . 2.06 1276 1151 A 36 ARG HA A 35 GLU HA 1.0 . 4.67 1277 1152 A 35 GLU HA A 36 ARG HBx 1.0 . 4.12 1278 1152 A 35 GLU HA A 36 ARG HBy 1.0 . 4.12 1279 1153 A 33 GLN HE2y A 35 GLU HB2 1.0 . 3.92 1280 1154 A 33 GLN HE2x A 35 GLU HB2 1.0 . 3.92 1281 1155 A 35 GLU H A 35 GLU HB2 1.0 . 2.82 1282 1156 A 36 ARG H A 35 GLU HB3 1.0 . 3.44 1283 1157 A 35 GLU H A 35 GLU HG2 1.0 . 4.24 1284 1158 A 35 GLU H A 35 GLU HG3 1.0 . 3.29 1285 1159 A 35 GLU HA A 35 GLU HG3 1.0 . 3.16 1286 1160 A 36 ARG H A 35 GLU HG3 1.0 . 4.86 1287 1161 A 36 ARG H A 35 GLU H 1.0 . 5.35 1288 1162 A 36 ARG HA A 36 ARG H 1.0 . 2.62 1289 1163 A 36 ARG H A 36 ARG HBx 1.0 . 2.16 1290 1163 A 36 ARG H A 36 ARG HBy 1.0 . 2.16 1291 1164 A 36 ARG H A 36 ARG HGy 1.0 . 4.18 1292 1165 A 36 ARG H A 36 ARG HGx 1.0 . 4.18 1293 1166 A 36 ARG HA A 36 ARG HBx 1.0 . 2.32 1294 1166 A 36 ARG HA A 36 ARG HBy 1.0 . 2.32 1295 1167 A 36 ARG HA A 36 ARG HGy 1.0 . 2.96 1296 1168 A 36 ARG HA A 36 ARG HGx 1.0 . 2.96 1297 1169 A 37 PRO HG2 A 36 ARG HA 1.0 . 4.70 1298 1170 A 37 PRO HD2 A 36 ARG HBx 1.0 . 3.57 1299 1170 A 37 PRO HD2 A 36 ARG HBy 1.0 . 3.57 1300 1171 A 37 PRO HD3 A 36 ARG HBx 1.0 . 5.12 1301 1171 A 37 PRO HD3 A 36 ARG HBy 1.0 . 5.12 1302 1172 A 37 PRO HD2 A 36 ARG HGy 1.0 . 2.76 1303 1173 A 37 PRO HD3 A 36 ARG HGy 1.0 . 4.44 1304 1174 A 37 PRO HD2 A 36 ARG HGx 1.0 . 2.76 1305 1175 A 37 PRO HD3 A 36 ARG HGx 1.0 . 4.44 1306 1176 A 37 PRO HA A 38 SER H 1.0 . 2.08 1307 1177 A 8 PRO HG3 A 37 PRO HB2 1.0 . 3.31 1308 1178 A 39 GLY H A 37 PRO HB2 1.0 . 4.95 1309 1179 A 11 TRP HE3 A 37 PRO HB3 1.0 . 4.21 1310 1180 A 11 TRP HZ2 A 37 PRO HB3 1.0 . 3.89 1311 1181 A 33 GLN HE2y A 37 PRO HB3 1.0 . 3.95 1312 1182 A 33 GLN HE2x A 37 PRO HB3 1.0 . 3.95 1313 1183 A 11 TRP HB2 A 37 PRO HG2 1.0 . 4.51 1314 1184 A 11 TRP HB3 A 37 PRO HG2 1.0 . 4.14 1315 1185 A 7 LEU HDx% A 37 PRO HG3 1.0 . 4.88 1316 1186 A 8 PRO HD2 A 37 PRO HG3 1.0 . 4.26 1317 1187 A 11 TRP HB2 A 37 PRO HG3 1.0 . 4.64 1318 1188 A 24 TYR HB2 A 37 PRO HG3 1.0 . 4.04 1319 1189 A 37 PRO HG3 A 33 GLN HBy 1.0 . 5.17 1320 1190 A 37 PRO HG3 A 33 GLN HBx 1.0 . 5.17 1321 1191 A 7 LEU HDx% A 37 PRO HD2 1.0 . 3.90 1322 1192 A 37 PRO HD2 A 24 TYR HB2 1.0 . 3.98 1323 1193 A 24 TYR HB2 A 37 PRO HD3 1.0 . 3.14 1324 1194 A 37 PRO HD3 A 36 ARG H 1.0 . 5.68 1325 1195 A 39 GLY H A 38 SER H 1.0 . 3.20 1326 1196 A 39 GLY H A 38 SER HA 1.0 . 2.53 1327 1197 A 38 SER H A 38 SER HBx 1.0 . 3.68 1328 1198 A 39 GLY H A 37 PRO HA 1.0 . 5.25 1329 1199 A 7 LEU H A 6 LYS HBy 1.0 . 4.44 1330 1200 A 7 LEU H A 6 LYS HBx 1.0 . 4.44 1331 1201 A 7 LEU H A 6 LYS HGx 1.0 . 5.36 1332 1201 A 7 LEU H A 6 LYS HGy 1.0 . 5.36 1333 1202 A 7 LEU HDx% A 24 TYR HB3 1.0 . 6.48 1334 1203 A 8 PRO HG3 A 37 PRO HB3 1.0 . 4.53 1335 1204 A 8 PRO HG3 A 39 GLY HAy 1.0 . 4.39 1336 1205 A 8 PRO HG3 A 39 GLY HAx 1.0 . 4.39 1337 1206 A 8 PRO HD3 A 37 PRO HB2 1.0 . 4.94 1338 1207 A 8 PRO HD2 A 37 PRO HB2 1.0 . 4.03 1339 1208 A 11 TRP HE1 A 8 PRO HG2 1.0 . 5.50 1340 1209 A 11 TRP HE1 A 37 PRO HB2 1.0 . 4.64 1341 1210 A 11 TRP HE1 A 37 PRO HB3 1.0 . 4.61 1342 1211 A 13 LYS H A 12 GLU HG3 1.0 . 5.10 1343 1212 A 13 LYS HA A 13 LYS HEx 1.0 . 6.33 1344 1212 A 13 LYS HA A 13 LYS HEy 1.0 . 6.33 1345 1213 A 13 LYS HB3 A 13 LYS HEx 1.0 . 5.41 1346 1213 A 13 LYS HB3 A 13 LYS HEy 1.0 . 5.41 1347 1214 A 14 ARG H A 13 LYS HGy 1.0 . 4.13 1348 1215 A 14 ARG H A 13 LYS HGx 1.0 . 4.13 1349 1216 A 15 MET H A 14 ARG HG3 1.0 . 6.33 1350 1217 A 15 MET HBy A 20 GLY HAy 1.0 . 5.07 1351 1217 A 20 GLY HAy A 15 MET HBx 1.0 . 5.07 1352 1218 A 17 ARG H A 16 SER HB3 1.0 . 3.88 1353 1219 A 17 ARG H A 16 SER HB2 1.0 . 4.45 1354 1220 A 17 ARG H A 17 ARG HGx 1.0 . 4.01 1355 1221 A 17 ARG H A 17 ARG HGy 1.0 . 4.01 1356 1222 A 20 GLY H A 16 SER HB3 1.0 . 4.56 1357 1223 A 20 GLY H A 16 SER HB2 1.0 . 4.39 1358 1224 A 21 ARG H A 16 SER HB2 1.0 . 3.59 1359 1225 A 16 SER HB3 A 21 ARG HB2 1.0 . 4.50 1360 1226 A 16 SER HB2 A 21 ARG HB2 1.0 . 3.62 1361 1227 A 16 SER HB3 A 21 ARG HB3 1.0 . 4.60 1362 1228 A 16 SER HB2 A 21 ARG HB3 1.0 . 4.25 1363 1229 A 23 TYR HD% A 16 SER HB3 1.0 . 7.13 1364 1230 A 23 TYR HE% A 16 SER HB3 1.0 . 7.13 1365 1231 A 24 TYR HE% A 13 LYS HGy 1.0 . 7.13 1366 1232 A 24 TYR HE% A 13 LYS HGx 1.0 . 7.13 1367 1233 A 25 PHE H A 24 TYR HB3 1.0 . 3.61 1368 1234 A 28 ILE H A 26 ASN HB3 1.0 . 5.30 1369 1235 A 30 ASN HA A 25 PHE HZ 1.0 . 3.87 1370 1236 A 33 GLN HE2y A 37 PRO HB2 1.0 . 4.63 1371 1237 A 33 GLN HE2x A 37 PRO HB2 1.0 . 4.63 1372 1238 A 36 ARG H A 35 GLU HB2 1.0 . 4.58 1373 1239 A 36 ARG H A 35 GLU HG2 1.0 . 5.89 1374 1240 A 37 PRO HG2 A 24 TYR HB3 1.0 . 5.35 1375 1241 A 37 PRO HG3 A 24 TYR HB3 1.0 . 4.12 1376 1242 A 38 SER H A 38 SER HBy 1.0 . 3.68 1377 1243 A 39 GLY H A 38 SER HBy 1.0 . 4.61 1378 1244 A 39 GLY H A 38 SER HBx 1.0 . 4.61 1379 1245 A 8 PRO HG3 A 39 GLY HAx 1.0 . 3.82 1380 1245 A 8 PRO HG3 A 39 GLY HAy 1.0 . 3.82 1381 1246 A 10 GLY H A 9 PRO HBx 1.0 . 3.16 1382 1246 A 10 GLY H A 9 PRO HBy 1.0 . 3.16 1383 1247 A 11 TRP HZ3 A 33 GLN HBx 1.0 . 3.63 1384 1247 A 11 TRP HZ3 A 33 GLN HBy 1.0 . 3.63 1385 1248 A 11 TRP HH2 A 33 GLN HBx 1.0 . 3.54 1386 1248 A 11 TRP HH2 A 33 GLN HBy 1.0 . 3.54 1387 1249 A 22 VAL HGy% A 13 LYS HDy 1.0 . 5.10 1388 1249 A 22 VAL HGy% A 13 LYS HDx 1.0 . 5.10 1389 1250 A 24 TYR HE% A 13 LYS HDy 1.0 . 6.82 1390 1250 A 24 TYR HE% A 13 LYS HDx 1.0 . 6.82 1391 1251 A 14 ARG HB3 A 14 ARG HDx 1.0 . 2.82 1392 1251 A 14 ARG HB3 A 14 ARG HDy 1.0 . 2.82 1393 1252 A 14 ARG HG2 A 14 ARG HDx 1.0 . 2.33 1394 1252 A 14 ARG HG2 A 14 ARG HDy 1.0 . 2.33 1395 1253 A 23 TYR HE% A 14 ARG HDx 1.0 . 3.48 1396 1253 A 23 TYR HE% A 14 ARG HDy 1.0 . 3.48 1397 1254 A 15 MET H A 15 MET HGy 1.0 . 4.04 1398 1254 A 15 MET H A 15 MET HGx 1.0 . 4.04 1399 1255 A 15 MET HBy A 20 GLY HAx 1.0 . 4.43 1400 1255 A 15 MET HBx A 20 GLY HAx 1.0 . 4.43 1401 1255 A 20 GLY HAy A 15 MET HBx 1.0 . 4.43 1402 1255 A 15 MET HBy A 20 GLY HAy 1.0 . 4.43 1403 1256 A 20 GLY H A 15 MET HGy 1.0 . 5.50 1404 1256 A 20 GLY H A 15 MET HGx 1.0 . 5.50 1405 1257 A 22 VAL HA A 15 MET HGy 1.0 . 4.08 1406 1257 A 22 VAL HA A 15 MET HGx 1.0 . 4.08 1407 1258 A 22 VAL HGx% A 15 MET HGy 1.0 . 5.76 1408 1258 A 22 VAL HGx% A 15 MET HGx 1.0 . 5.76 1409 1259 A 17 ARG H A 17 ARG HGy 1.0 . 3.52 1410 1259 A 17 ARG H A 17 ARG HGx 1.0 . 3.52 1411 1260 A 18 ASN H A 17 ARG HGy 1.0 . 3.66 1412 1260 A 18 ASN H A 17 ARG HGx 1.0 . 3.66 1413 1261 A 18 ASN HA A 17 ARG HGy 1.0 . 5.42 1414 1261 A 18 ASN HA A 17 ARG HGx 1.0 . 5.42 1415 1262 A 20 GLY H A 19 SER HBy 1.0 . 3.97 1416 1262 A 20 GLY H A 19 SER HBx 1.0 . 3.97 1417 1263 A 21 ARG H A 19 SER HBy 1.0 . 3.87 1418 1263 A 21 ARG H A 19 SER HBx 1.0 . 3.87 1419 1264 A 21 ARG HD3 A 21 ARG HH2y 1.0 . 3.88 1420 1264 A 21 ARG HD3 A 21 ARG HH2x 1.0 . 3.88 1421 1265 A 23 TYR HD% A 32 SER HBx 1.0 . 2.90 1422 1265 A 23 TYR HD% A 32 SER HBy 1.0 . 2.90 1423 1266 A 23 TYR HE% A 32 SER HBx 1.0 . 3.70 1424 1266 A 23 TYR HE% A 32 SER HBy 1.0 . 3.70 1425 1267 A 24 TYR HB3 A 33 GLN HBx 1.0 . 5.13 1426 1267 A 24 TYR HB3 A 33 GLN HBy 1.0 . 5.13 1427 1268 A 24 TYR HE% A 36 ARG HGx 1.0 . 3.59 1428 1268 A 24 TYR HE% A 36 ARG HGy 1.0 . 3.59 1429 1269 A 25 PHE HA A 32 SER HBx 1.0 . 3.71 1430 1269 A 25 PHE HA A 32 SER HBy 1.0 . 3.71 1431 1270 A 25 PHE HD% A 32 SER HBx 1.0 . 3.39 1432 1270 A 25 PHE HD% A 32 SER HBy 1.0 . 3.39 1433 1271 A 27 HIS HD2 A 27 HIS HBy 1.0 . 2.98 1434 1271 A 27 HIS HD2 A 27 HIS HBx 1.0 . 2.98 1435 1272 A 28 ILE H A 27 HIS HBy 1.0 . 3.46 1436 1272 A 28 ILE H A 27 HIS HBx 1.0 . 3.46 1437 1273 A 32 SER H A 32 SER HBx 1.0 . 3.22 1438 1273 A 32 SER H A 32 SER HBy 1.0 . 3.22 1439 1274 A 32 SER HA A 33 GLN HBx 1.0 . 3.72 1440 1274 A 32 SER HA A 33 GLN HBy 1.0 . 3.72 1441 1275 A 33 GLN H A 33 GLN HBx 1.0 . 2.58 1442 1275 A 33 GLN H A 33 GLN HBy 1.0 . 2.58 1443 1276 A 33 GLN HE2x A 33 GLN HBy 1.0 . 2.55 1444 1276 A 33 GLN HE2y A 33 GLN HBx 1.0 . 2.55 1445 1276 A 33 GLN HE2y A 33 GLN HBy 1.0 . 2.55 1446 1276 A 33 GLN HE2x A 33 GLN HBx 1.0 . 2.55 1447 1277 A 34 PHE H A 33 GLN HBx 1.0 . 2.69 1448 1277 A 34 PHE H A 33 GLN HBy 1.0 . 2.69 1449 1278 A 35 GLU H A 33 GLN HBx 1.0 . 3.25 1450 1278 A 35 GLU H A 33 GLN HBy 1.0 . 3.25 1451 1279 A 33 GLN HE2y A 35 GLU H 1.0 . 3.57 1452 1279 A 33 GLN HE2x A 35 GLU H 1.0 . 3.57 1453 1280 A 33 GLN HE2y A 35 GLU HB2 1.0 . 3.26 1454 1280 A 33 GLN HE2x A 35 GLU HB2 1.0 . 3.26 1455 1281 A 33 GLN HE2y A 35 GLU HB3 1.0 . 3.99 1456 1281 A 33 GLN HE2x A 35 GLU HB3 1.0 . 3.99 1457 1282 A 33 GLN HE2y A 37 PRO HA 1.0 . 2.61 1458 1282 A 33 GLN HE2x A 37 PRO HA 1.0 . 2.61 1459 1283 A 33 GLN HE2y A 37 PRO HB2 1.0 . 4.03 1460 1283 A 33 GLN HE2x A 37 PRO HB2 1.0 . 4.03 1461 1284 A 33 GLN HE2y A 37 PRO HB3 1.0 . 3.42 1462 1284 A 33 GLN HE2x A 37 PRO HB3 1.0 . 3.42 1463 1285 A 37 PRO HG3 A 33 GLN HE2y 1.0 . 3.60 1464 1285 A 37 PRO HG3 A 33 GLN HE2x 1.0 . 3.60 1465 1286 A 37 PRO HD2 A 33 GLN HE2y 1.0 . 4.67 1466 1286 A 37 PRO HD2 A 33 GLN HE2x 1.0 . 4.67 1467 1287 A 37 PRO HD3 A 33 GLN HE2y 1.0 . 3.42 1468 1287 A 37 PRO HD3 A 33 GLN HE2x 1.0 . 3.42 1469 1288 A 36 ARG H A 36 ARG HGx 1.0 . 3.55 1470 1288 A 36 ARG H A 36 ARG HGy 1.0 . 3.55 1471 1289 A 36 ARG HA A 36 ARG HGx 1.0 . 2.53 1472 1289 A 36 ARG HA A 36 ARG HGy 1.0 . 2.53 1473 1290 A 36 ARG HBx A 36 ARG HGx 1.0 . 2.16 1474 1290 A 36 ARG HBy A 36 ARG HGx 1.0 . 2.16 1475 1290 A 36 ARG HGy A 36 ARG HBx 1.0 . 2.16 1476 1290 A 36 ARG HBy A 36 ARG HGy 1.0 . 2.16 1477 1291 A 37 PRO HD2 A 36 ARG HGx 1.0 . 2.40 1478 1291 A 37 PRO HD2 A 36 ARG HGy 1.0 . 2.40 1479 1292 A 37 PRO HD3 A 36 ARG HGx 1.0 . 3.84 1480 1292 A 37 PRO HD3 A 36 ARG HGy 1.0 . 3.84 1481 1293 A 38 SER H A 38 SER HBx 1.0 . 3.23 1482 1293 A 38 SER H A 38 SER HBy 1.0 . 3.23 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 11 TRP C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -200.0 -80.0 PHI 2 2 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 LYS N 1.0 40.0 220.0 PSI 3 3 A 13 LYS C A 14 ARG N A 14 ARG CA A 14 ARG C 1.0 -200.0 -80.0 PHI 4 4 A 14 ARG N A 14 ARG CA A 14 ARG C A 15 MET N 1.0 40.0 220.0 PSI 5 5 A 22 VAL C A 23 TYR N A 23 TYR CA A 23 TYR C 1.0 -200.0 -80.0 PHI 6 6 A 23 TYR N A 23 TYR CA A 23 TYR C A 24 TYR N 1.0 40.0 220.0 PSI 7 7 A 24 TYR C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -200.0 -80.0 PHI 8 8 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 ASN N 1.0 40.0 220.0 PSI stop_ save_