data_nef_c19960_2mp1 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 2MP1 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 8 CYS SG 1 34 CYS SG 1 9 CYS SG 1 50 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 THR middle . . 3 A 3 ASN middle . . 4 A 4 ASP middle . . 5 A 5 ALA middle . . 6 A 6 GLU middle . . 7 A 7 ASP middle . . 8 A 8 CYS middle -HG . 9 A 9 CYS middle -HG . 10 A 10 LEU middle . . 11 A 11 SER middle . . 12 A 12 VAL middle . . 13 A 13 THR middle . . 14 A 14 GLN middle . . 15 A 15 LYS middle . . 16 A 16 PRO middle . false 17 A 17 ILE middle . . 18 A 18 PRO middle . false 19 A 19 GLY middle . false 20 A 20 TYR middle . . 21 A 21 ILE middle . . 22 A 22 VAL middle . . 23 A 23 ARG middle . . 24 A 24 ASN middle . . 25 A 25 PHE middle . . 26 A 26 HIS middle . . 27 A 27 TYR middle . . 28 A 28 LEU middle . . 29 A 29 LEU middle . . 30 A 30 ILE middle . . 31 A 31 LYS middle . . 32 A 32 ASP middle . . 33 A 33 GLY middle . false 34 A 34 CYS middle -HG . 35 A 35 ARG middle . . 36 A 36 VAL middle . . 37 A 37 PRO middle . false 38 A 38 ALA middle . . 39 A 39 VAL middle . . 40 A 40 VAL middle . . 41 A 41 PHE middle . . 42 A 42 THR middle . . 43 A 43 THR middle . . 44 A 44 LEU middle . . 45 A 45 ARG middle . . 46 A 46 GLY middle . false 47 A 47 ARG middle . . 48 A 48 GLN middle . . 49 A 49 LEU middle . . 50 A 50 CYS middle -HG . 51 A 51 ALA middle . . 52 A 52 PRO middle . false 53 A 53 PRO middle . false 54 A 54 ASP middle . . 55 A 55 GLN middle . . 56 A 56 PRO middle . false 57 A 57 TRP middle . . 58 A 58 VAL middle . . 59 A 59 GLU middle . . 60 A 60 ARG middle . . 61 A 61 ILE middle . . 62 A 62 ILE middle . . 63 A 63 GLN middle . . 64 A 64 ARG middle . . 65 A 65 LEU middle . . 66 A 66 GLN middle . . 67 A 67 ARG middle . . 68 A 68 THR middle . . 69 A 69 SER middle . . 70 A 70 ALA middle . . 71 A 71 LYS middle . . 72 A 72 MET middle . . 73 A 73 LYS middle . . 74 A 74 ARG middle . . 75 A 75 ARG middle . . 76 A 76 SER middle . . 77 A 77 SER end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HA2 H 1 4.030 0.02 A 1 GLY HA3 H 1 4.030 0.02 A 1 GLY CA C 13 43.816 0.1 A 2 THR H H 1 8.668 0.02 A 2 THR HA H 1 4.390 0.02 A 2 THR HB H 1 4.289 0.02 A 2 THR HG2% H 1 1.278 0.02 A 2 THR CA C 13 62.880 0.1 A 2 THR CB C 13 69.901 0.1 A 2 THR CG2 C 13 21.888 0.1 A 2 THR N N 15 114.055 0.1 A 3 ASN H H 1 8.692 0.02 A 3 ASN HA H 1 4.835 0.02 A 3 ASN HBy H 1 2.946 0.02 A 3 ASN HBx H 1 2.818 0.02 A 3 ASN HD2y H 1 7.678 0.02 A 3 ASN HD2x H 1 6.981 0.02 A 3 ASN CA C 13 53.515 0.1 A 3 ASN CB C 13 39.132 0.1 A 3 ASN N N 15 120.488 0.1 A 3 ASN ND2 N 15 112.363 0.1 A 4 ASP H H 1 8.247 0.02 A 4 ASP HA H 1 4.662 0.02 A 4 ASP HBy H 1 2.776 0.02 A 4 ASP HBx H 1 2.702 0.02 A 4 ASP CA C 13 54.853 0.1 A 4 ASP CB C 13 41.473 0.1 A 4 ASP N N 15 120.690 0.1 A 5 ALA H H 1 8.243 0.02 A 5 ALA HA H 1 4.370 0.02 A 5 ALA HB% H 1 1.453 0.02 A 5 ALA CA C 13 52.958 0.1 A 5 ALA CB C 13 19.623 0.1 A 5 ALA N N 15 123.647 0.1 A 6 GLU H H 1 8.335 0.02 A 6 GLU HA H 1 4.329 0.02 A 6 GLU HBy H 1 2.115 0.02 A 6 GLU HBx H 1 1.992 0.02 A 6 GLU HG2 H 1 2.346 0.02 A 6 GLU HG3 H 1 2.346 0.02 A 6 GLU CA C 13 56.860 0.1 A 6 GLU CB C 13 30.436 0.1 A 6 GLU CG C 13 35.978 0.1 A 6 GLU N N 15 119.584 0.1 A 7 ASP H H 1 8.377 0.02 A 7 ASP HA H 1 4.723 0.02 A 7 ASP HBy H 1 2.806 0.02 A 7 ASP HBx H 1 2.681 0.02 A 7 ASP CA C 13 54.407 0.1 A 7 ASP CB C 13 41.473 0.1 A 7 ASP N N 15 120.581 0.1 A 8 CYS H H 1 8.036 0.02 A 8 CYS HA H 1 4.514 0.02 A 8 CYS HBy H 1 3.352 0.02 A 8 CYS HBx H 1 2.787 0.02 A 8 CYS CA C 13 55.968 0.1 A 8 CYS CB C 13 39.801 0.1 A 8 CYS N N 15 116.978 0.1 A 9 CYS H H 1 8.519 0.02 A 9 CYS HA H 1 4.627 0.02 A 9 CYS HB2 H 1 3.093 0.02 A 9 CYS HB3 H 1 3.093 0.02 A 9 CYS CA C 13 57.640 0.1 A 9 CYS CB C 13 44.200 0.1 A 9 CYS N N 15 119.855 0.1 A 10 LEU H H 1 8.941 0.02 A 10 LEU HA H 1 4.389 0.02 A 10 LEU HBy H 1 1.769 0.02 A 10 LEU HBx H 1 1.705 0.02 A 10 LEU HDx% H 1 1.010 0.02 A 10 LEU HDy% H 1 0.914 0.02 A 10 LEU HG H 1 1.750 0.02 A 10 LEU CA C 13 56.024 0.1 A 10 LEU CB C 13 42.811 0.1 A 10 LEU CD1 C 13 25.183 0.1 A 10 LEU CD2 C 13 23.365 0.1 A 10 LEU CG C 13 27.797 0.1 A 10 LEU N N 15 122.580 0.1 A 11 SER H H 1 7.825 0.02 A 11 SER HA H 1 4.603 0.02 A 11 SER HB2 H 1 3.930 0.02 A 11 SER HB3 H 1 3.930 0.02 A 11 SER CA C 13 57.027 0.1 A 11 SER CB C 13 65.107 0.1 A 11 SER N N 15 111.403 0.1 A 12 VAL H H 1 8.348 0.02 A 12 VAL HA H 1 4.598 0.02 A 12 VAL HB H 1 1.886 0.02 A 12 VAL HGx% H 1 0.817 0.02 A 12 VAL HGy% H 1 0.890 0.02 A 12 VAL CA C 13 60.037 0.1 A 12 VAL CB C 13 35.230 0.1 A 12 VAL CG1 C 13 22.456 0.1 A 12 VAL CG2 C 13 19.389 0.1 A 12 VAL N N 15 114.616 0.1 A 13 THR H H 1 8.519 0.02 A 13 THR HA H 1 4.575 0.02 A 13 THR HB H 1 4.465 0.02 A 13 THR HG2% H 1 1.620 0.02 A 13 THR CA C 13 62.211 0.1 A 13 THR CB C 13 70.124 0.1 A 13 THR CG2 C 13 20.979 0.1 A 13 THR N N 15 118.420 0.1 A 14 GLN H H 1 8.572 0.02 A 14 GLN HA H 1 4.649 0.02 A 14 GLN HBy H 1 2.462 0.02 A 14 GLN HBx H 1 2.052 0.02 A 14 GLN HE2y H 1 7.612 0.02 A 14 GLN HE2x H 1 7.007 0.02 A 14 GLN HGy H 1 2.606 0.02 A 14 GLN HGx H 1 2.537 0.02 A 14 GLN CA C 13 56.024 0.1 A 14 GLN CB C 13 29.991 0.1 A 14 GLN CG C 13 34.046 0.1 A 14 GLN N N 15 122.597 0.1 A 14 GLN NE2 N 15 112.706 0.1 A 15 LYS H H 1 7.931 0.02 A 15 LYS HA H 1 4.606 0.02 A 15 LYS HBy H 1 1.736 0.02 A 15 LYS HBx H 1 1.679 0.02 A 15 LYS HD2 H 1 1.706 0.02 A 15 LYS HD3 H 1 1.706 0.02 A 15 LYS HE2 H 1 3.030 0.02 A 15 LYS HE3 H 1 3.030 0.02 A 15 LYS HG2 H 1 1.413 0.02 A 15 LYS HG3 H 1 1.413 0.02 A 15 LYS CA C 13 53.516 0.1 A 15 LYS CB C 13 33.131 0.1 A 15 LYS CD C 13 29.249 0.1 A 15 LYS CE C 13 42.191 0.1 A 15 LYS CG C 13 24.719 0.1 A 15 LYS N N 15 123.136 0.1 A 16 PRO HA H 1 4.870 0.02 A 16 PRO HBy H 1 2.463 0.02 A 16 PRO HBx H 1 2.064 0.02 A 16 PRO HDy H 1 4.175 0.02 A 16 PRO HDx H 1 3.555 0.02 A 16 PRO HGy H 1 2.285 0.02 A 16 PRO HGx H 1 2.162 0.02 A 16 PRO CA C 13 60.310 0.1 A 16 PRO CB C 13 31.837 0.1 A 16 PRO CD C 13 50.604 0.1 A 16 PRO CG C 13 27.954 0.1 A 17 ILE HA H 1 4.378 0.02 A 17 ILE HB H 1 1.616 0.02 A 17 ILE HD1% H 1 0.889 0.02 A 17 ILE HG1y H 1 1.573 0.02 A 17 ILE HG1x H 1 1.087 0.02 A 17 ILE HG2% H 1 0.839 0.02 A 17 ILE CA C 13 57.722 0.1 A 17 ILE CB C 13 40.250 0.1 A 17 ILE CD1 C 13 15.335 0.1 A 17 ILE CG1 C 13 26.337 0.1 A 17 ILE CG2 C 13 17.600 0.1 A 18 PRO HA H 1 4.306 0.02 A 18 PRO HBy H 1 2.167 0.02 A 18 PRO HBx H 1 1.354 0.02 A 18 PRO HDy H 1 3.705 0.02 A 18 PRO HDx H 1 3.460 0.02 A 18 PRO HG2 H 1 1.937 0.02 A 18 PRO HG3 H 1 1.937 0.02 A 18 PRO CA C 13 62.545 0.1 A 18 PRO CB C 13 32.332 0.1 A 18 PRO CD C 13 50.600 0.1 A 18 PRO CG C 13 27.797 0.1 A 19 GLY H H 1 8.523 0.02 A 19 GLY HAy H 1 4.030 0.02 A 19 GLY HAx H 1 3.532 0.02 A 19 GLY CA C 13 47.941 0.1 A 19 GLY N N 15 109.460 0.1 A 20 TYR H H 1 7.429 0.02 A 20 TYR HA H 1 4.516 0.02 A 20 TYR HBy H 1 3.370 0.02 A 20 TYR HBx H 1 3.038 0.02 A 20 TYR HD1 H 1 7.145 0.02 A 20 TYR HD2 H 1 7.145 0.02 A 20 TYR HE1 H 1 6.886 0.02 A 20 TYR HE2 H 1 6.886 0.02 A 20 TYR CA C 13 58.643 0.1 A 20 TYR CB C 13 37.125 0.1 A 20 TYR CD2 C 13 133.600 0.1 A 20 TYR CE2 C 13 119.105 0.1 A 20 TYR N N 15 114.046 0.1 A 21 ILE H H 1 6.841 0.02 A 21 ILE HA H 1 4.547 0.02 A 21 ILE HB H 1 2.269 0.02 A 21 ILE HD1% H 1 0.906 0.02 A 21 ILE HG1y H 1 1.455 0.02 A 21 ILE HG1x H 1 1.087 0.02 A 21 ILE HG2% H 1 0.754 0.02 A 21 ILE CA C 13 61.430 0.1 A 21 ILE CB C 13 39.132 0.1 A 21 ILE CD1 C 13 14.276 0.1 A 21 ILE CG1 C 13 26.320 0.1 A 21 ILE CG2 C 13 17.798 0.1 A 21 ILE N N 15 114.194 0.1 A 22 VAL H H 1 7.445 0.02 A 22 VAL HA H 1 3.825 0.02 A 22 VAL HB H 1 1.982 0.02 A 22 VAL HGx% H 1 0.574 0.02 A 22 VAL HGy% H 1 0.918 0.02 A 22 VAL CA C 13 64.608 0.1 A 22 VAL CB C 13 32.332 0.1 A 22 VAL CG1 C 13 22.570 0.1 A 22 VAL CG2 C 13 23.748 0.1 A 22 VAL N N 15 121.459 0.1 A 23 ARG H H 1 9.418 0.02 A 23 ARG HA H 1 4.599 0.02 A 23 ARG HBy H 1 1.732 0.02 A 23 ARG HBx H 1 1.675 0.02 A 23 ARG HDy H 1 3.308 0.02 A 23 ARG HDx H 1 3.239 0.02 A 23 ARG HGy H 1 1.677 0.02 A 23 ARG HGx H 1 1.590 0.02 A 23 ARG CA C 13 56.302 0.1 A 23 ARG CB C 13 33.455 0.1 A 23 ARG CD C 13 43.818 0.1 A 23 ARG CG C 13 26.774 0.1 A 23 ARG N N 15 125.455 0.1 A 24 ASN H H 1 8.007 0.02 A 24 ASN HA H 1 5.074 0.02 A 24 ASN HBy H 1 2.963 0.02 A 24 ASN HBx H 1 2.873 0.02 A 24 ASN HD2y H 1 7.676 0.02 A 24 ASN HD2x H 1 7.001 0.02 A 24 ASN CA C 13 52.735 0.1 A 24 ASN CB C 13 42.254 0.1 A 24 ASN N N 15 114.237 0.1 A 24 ASN ND2 N 15 113.200 0.1 A 25 PHE H H 1 8.592 0.02 A 25 PHE HA H 1 6.029 0.02 A 25 PHE HBy H 1 2.944 0.02 A 25 PHE HBx H 1 2.632 0.02 A 25 PHE HD1 H 1 7.165 0.02 A 25 PHE HD2 H 1 7.165 0.02 A 25 PHE HE1 H 1 6.752 0.02 A 25 PHE HE2 H 1 6.752 0.02 A 25 PHE HZ H 1 7.392 0.02 A 25 PHE CA C 13 56.135 0.1 A 25 PHE CB C 13 44.483 0.1 A 25 PHE CD1 C 13 131.530 0.1 A 25 PHE CE1 C 13 131.530 0.1 A 25 PHE CZ C 13 131.271 0.1 A 25 PHE N N 15 117.196 0.1 A 26 HIS H H 1 8.392 0.02 A 26 HIS HA H 1 4.416 0.02 A 26 HIS HBy H 1 3.219 0.02 A 26 HIS HBx H 1 3.154 0.02 A 26 HIS HD2 H 1 7.097 0.02 A 26 HIS HE1 H 1 8.474 0.02 A 26 HIS CA C 13 55.355 0.1 A 26 HIS CB C 13 31.551 0.1 A 26 HIS CD2 C 13 120.400 0.1 A 26 HIS CE1 C 13 136.707 0.1 A 26 HIS N N 15 114.697 0.1 A 27 TYR H H 1 9.153 0.02 A 27 TYR HA H 1 4.813 0.02 A 27 TYR HB2 H 1 2.998 0.02 A 27 TYR HB3 H 1 2.998 0.02 A 27 TYR HD1 H 1 7.238 0.02 A 27 TYR HD2 H 1 7.238 0.02 A 27 TYR HE1 H 1 6.852 0.02 A 27 TYR HE2 H 1 6.852 0.02 A 27 TYR CA C 13 59.535 0.1 A 27 TYR CB C 13 40.024 0.1 A 27 TYR CD2 C 13 133.083 0.1 A 27 TYR CE2 C 13 118.329 0.1 A 27 TYR N N 15 122.979 0.1 A 28 LEU H H 1 8.840 0.02 A 28 LEU HA H 1 4.730 0.02 A 28 LEU HBy H 1 1.834 0.02 A 28 LEU HBx H 1 1.620 0.02 A 28 LEU HDx% H 1 0.972 0.02 A 28 LEU HDy% H 1 1.003 0.02 A 28 LEU HG H 1 1.511 0.02 A 28 LEU CA C 13 54.630 0.1 A 28 LEU CB C 13 44.595 0.1 A 28 LEU CD1 C 13 26.888 0.1 A 28 LEU CD2 C 13 24.161 0.1 A 28 LEU CG C 13 27.001 0.1 A 28 LEU N N 15 125.472 0.1 A 29 LEU H H 1 9.435 0.02 A 29 LEU HA H 1 4.710 0.02 A 29 LEU HBy H 1 1.956 0.02 A 29 LEU HBx H 1 1.756 0.02 A 29 LEU HDx% H 1 0.890 0.02 A 29 LEU HDy% H 1 0.957 0.02 A 29 LEU HG H 1 1.775 0.02 A 29 LEU CA C 13 53.794 0.1 A 29 LEU CB C 13 43.814 0.1 A 29 LEU CD1 C 13 25.524 0.1 A 29 LEU CD2 C 13 22.911 0.1 A 29 LEU CG C 13 27.797 0.1 A 29 LEU N N 15 123.976 0.1 A 30 ILE H H 1 8.195 0.02 A 30 ILE HA H 1 4.365 0.02 A 30 ILE HB H 1 1.929 0.02 A 30 ILE HD1% H 1 0.913 0.02 A 30 ILE HG1y H 1 1.527 0.02 A 30 ILE HG1x H 1 1.356 0.02 A 30 ILE HG2% H 1 0.952 0.02 A 30 ILE CA C 13 64.273 0.1 A 30 ILE CB C 13 37.348 0.1 A 30 ILE CD1 C 13 12.684 0.1 A 30 ILE CG1 C 13 29.047 0.1 A 30 ILE CG2 C 13 17.584 0.1 A 30 ILE N N 15 123.633 0.1 A 31 LYS H H 1 8.269 0.02 A 31 LYS HA H 1 4.317 0.02 A 31 LYS HB2 H 1 1.912 0.02 A 31 LYS HB3 H 1 1.912 0.02 A 31 LYS HDy H 1 1.732 0.02 A 31 LYS HDx H 1 1.666 0.02 A 31 LYS HEy H 1 3.044 0.02 A 31 LYS HEx H 1 2.997 0.02 A 31 LYS HGy H 1 1.445 0.02 A 31 LYS HGx H 1 1.367 0.02 A 31 LYS CA C 13 57.919 0.1 A 31 LYS CB C 13 31.886 0.1 A 31 LYS CD C 13 29.501 0.1 A 31 LYS CE C 13 42.454 0.1 A 31 LYS CG C 13 24.274 0.1 A 31 LYS N N 15 119.398 0.1 A 32 ASP H H 1 7.641 0.02 A 32 ASP HA H 1 4.752 0.02 A 32 ASP HBx H 1 2.899 0.02 A 32 ASP HBy H 1 2.986 0.02 A 32 ASP CA C 13 55.689 0.1 A 32 ASP CB C 13 42.031 0.1 A 32 ASP N N 15 118.993 0.1 A 33 GLY H H 1 8.234 0.02 A 33 GLY HAy H 1 4.370 0.02 A 33 GLY HAx H 1 3.812 0.02 A 33 GLY CA C 13 45.266 0.1 A 33 GLY N N 15 106.885 0.1 A 34 CYS H H 1 7.352 0.02 A 34 CYS HA H 1 5.036 0.02 A 34 CYS HBy H 1 3.408 0.02 A 34 CYS HBx H 1 2.330 0.02 A 34 CYS CA C 13 52.512 0.1 A 34 CYS CB C 13 38.017 0.1 A 34 CYS N N 15 118.799 0.1 A 35 ARG H H 1 8.433 0.02 A 35 ARG HA H 1 4.232 0.02 A 35 ARG HB2 H 1 1.921 0.02 A 35 ARG HB3 H 1 1.921 0.02 A 35 ARG HD2 H 1 3.283 0.02 A 35 ARG HD3 H 1 3.283 0.02 A 35 ARG HG2 H 1 1.758 0.02 A 35 ARG HG3 H 1 1.758 0.02 A 35 ARG CA C 13 58.030 0.1 A 35 ARG CB C 13 31.105 0.1 A 35 ARG CD C 13 43.590 0.1 A 35 ARG CG C 13 27.797 0.1 A 35 ARG N N 15 121.464 0.1 A 36 VAL H H 1 8.106 0.02 A 36 VAL HA H 1 4.450 0.02 A 36 VAL HB H 1 2.161 0.02 A 36 VAL HGx% H 1 0.883 0.02 A 36 VAL HGy% H 1 0.803 0.02 A 36 VAL CA C 13 59.016 0.1 A 36 VAL CB C 13 33.131 0.1 A 36 VAL CG1 C 13 20.512 0.1 A 36 VAL CG2 C 13 21.159 0.1 A 36 VAL N N 15 119.987 0.1 A 37 PRO HA H 1 4.640 0.02 A 37 PRO HBy H 1 2.351 0.02 A 37 PRO HBx H 1 1.985 0.02 A 37 PRO HDy H 1 3.841 0.02 A 37 PRO HDx H 1 3.772 0.02 A 37 PRO HGy H 1 2.184 0.02 A 37 PRO HGx H 1 2.063 0.02 A 37 PRO CA C 13 62.545 0.1 A 37 PRO CB C 13 33.224 0.1 A 37 PRO CD C 13 50.600 0.1 A 37 PRO CG C 13 27.569 0.1 A 38 ALA H H 1 8.294 0.02 A 38 ALA HA H 1 4.796 0.02 A 38 ALA HB% H 1 1.378 0.02 A 38 ALA CA C 13 52.010 0.1 A 38 ALA CB C 13 25.085 0.1 A 38 ALA N N 15 120.571 0.1 A 39 VAL H H 1 8.610 0.02 A 39 VAL HA H 1 4.157 0.02 A 39 VAL HB H 1 1.243 0.02 A 39 VAL HGx% H 1 0.473 0.02 A 39 VAL HGy% H 1 -0.037 0.02 A 39 VAL CA C 13 61.542 0.1 A 39 VAL CB C 13 33.892 0.1 A 39 VAL CG1 C 13 22.456 0.1 A 39 VAL CG2 C 13 20.979 0.1 A 39 VAL N N 15 119.399 0.1 A 40 VAL H H 1 8.757 0.02 A 40 VAL HA H 1 4.778 0.02 A 40 VAL HB H 1 1.279 0.02 A 40 VAL HGx% H 1 0.851 0.02 A 40 VAL HGy% H 1 0.807 0.02 A 40 VAL CA C 13 60.706 0.1 A 40 VAL CB C 13 33.001 0.1 A 40 VAL CG1 C 13 22.002 0.1 A 40 VAL CG2 C 13 21.661 0.1 A 40 VAL N N 15 125.524 0.1 A 41 PHE H H 1 9.418 0.02 A 41 PHE HA H 1 5.686 0.02 A 41 PHE HBy H 1 3.165 0.02 A 41 PHE HBx H 1 2.983 0.02 A 41 PHE HD1 H 1 7.308 0.02 A 41 PHE HD2 H 1 7.308 0.02 A 41 PHE HE1 H 1 6.954 0.02 A 41 PHE HE2 H 1 6.954 0.02 A 41 PHE HZ H 1 7.268 0.02 A 41 PHE CA C 13 55.522 0.1 A 41 PHE CB C 13 41.696 0.1 A 41 PHE CD2 C 13 131.271 0.1 A 41 PHE CE2 C 13 131.271 0.1 A 41 PHE CZ C 13 130.236 0.1 A 41 PHE N N 15 127.897 0.1 A 42 THR H H 1 8.532 0.02 A 42 THR HA H 1 5.525 0.02 A 42 THR HB H 1 3.961 0.02 A 42 THR HG2% H 1 1.395 0.02 A 42 THR CA C 13 61.653 0.1 A 42 THR CB C 13 70.347 0.1 A 42 THR CG2 C 13 21.888 0.1 A 42 THR N N 15 118.170 0.1 A 43 THR H H 1 9.514 0.02 A 43 THR HA H 1 5.420 0.02 A 43 THR HB H 1 4.948 0.02 A 43 THR HG2% H 1 1.228 0.02 A 43 THR CA C 13 61.123 0.1 A 43 THR CB C 13 71.537 0.1 A 43 THR CG2 C 13 21.547 0.1 A 43 THR N N 15 118.792 0.1 A 44 LEU H H 1 8.782 0.02 A 44 LEU HA H 1 4.089 0.02 A 44 LEU HBy H 1 1.985 0.02 A 44 LEU HBx H 1 1.723 0.02 A 44 LEU HDx% H 1 1.112 0.02 A 44 LEU HDy% H 1 0.958 0.02 A 44 LEU HG H 1 1.776 0.02 A 44 LEU CA C 13 58.420 0.1 A 44 LEU CB C 13 42.031 0.1 A 44 LEU CD1 C 13 25.524 0.1 A 44 LEU CD2 C 13 23.138 0.1 A 44 LEU CG C 13 27.683 0.1 A 44 LEU N N 15 120.736 0.1 A 45 ARG H H 1 7.924 0.02 A 45 ARG HA H 1 4.523 0.02 A 45 ARG HBy H 1 2.215 0.02 A 45 ARG HBx H 1 1.881 0.02 A 45 ARG HD2 H 1 3.328 0.02 A 45 ARG HD3 H 1 3.328 0.02 A 45 ARG HGy H 1 1.850 0.02 A 45 ARG HGx H 1 1.748 0.02 A 45 ARG CA C 13 56.247 0.1 A 45 ARG CB C 13 30.325 0.1 A 45 ARG CD C 13 43.818 0.1 A 45 ARG CG C 13 28.365 0.1 A 45 ARG N N 15 114.893 0.1 A 46 GLY H H 1 8.183 0.02 A 46 GLY HAy H 1 4.307 0.02 A 46 GLY HAx H 1 3.599 0.02 A 46 GLY CA C 13 45.823 0.1 A 46 GLY N N 15 108.124 0.1 A 47 ARG H H 1 7.379 0.02 A 47 ARG HA H 1 4.496 0.02 A 47 ARG HBy H 1 1.920 0.02 A 47 ARG HBx H 1 1.872 0.02 A 47 ARG HD2 H 1 3.289 0.02 A 47 ARG HD3 H 1 3.289 0.02 A 47 ARG HG2 H 1 1.615 0.02 A 47 ARG HG3 H 1 1.615 0.02 A 47 ARG CA C 13 56.024 0.1 A 47 ARG CB C 13 31.328 0.1 A 47 ARG CD C 13 43.931 0.1 A 47 ARG CG C 13 28.024 0.1 A 47 ARG N N 15 119.974 0.1 A 48 GLN H H 1 8.637 0.02 A 48 GLN HA H 1 5.507 0.02 A 48 GLN HBy H 1 2.073 0.02 A 48 GLN HBx H 1 1.891 0.02 A 48 GLN HE2y H 1 7.364 0.02 A 48 GLN HE2x H 1 6.911 0.02 A 48 GLN HGy H 1 2.444 0.02 A 48 GLN HGx H 1 2.373 0.02 A 48 GLN CA C 13 55.076 0.1 A 48 GLN CB C 13 30.548 0.1 A 48 GLN CG C 13 34.614 0.1 A 48 GLN N N 15 121.273 0.1 A 48 GLN NE2 N 15 111.686 0.1 A 49 LEU H H 1 9.307 0.02 A 49 LEU HA H 1 4.889 0.02 A 49 LEU HB2 H 1 1.791 0.02 A 49 LEU HB3 H 1 1.791 0.02 A 49 LEU HD1% H 1 1.032 0.02 A 49 LEU HD2% H 1 1.032 0.02 A 49 LEU HG H 1 1.756 0.02 A 49 LEU CA C 13 54.073 0.1 A 49 LEU CB C 13 45.821 0.1 A 49 LEU CD1 C 13 26.547 0.1 A 49 LEU CD2 C 13 24.502 0.1 A 49 LEU CG C 13 27.342 0.1 A 49 LEU N N 15 124.631 0.1 A 50 CYS H H 1 8.937 0.02 A 50 CYS HA H 1 5.208 0.02 A 50 CYS HBy H 1 3.854 0.02 A 50 CYS HBx H 1 2.971 0.02 A 50 CYS CA C 13 57.250 0.1 A 50 CYS CB C 13 48.720 0.1 A 50 CYS N N 15 122.252 0.1 A 51 ALA H H 1 9.779 0.02 A 51 ALA HA H 1 5.210 0.02 A 51 ALA HB% H 1 1.277 0.02 A 51 ALA CA C 13 49.957 0.1 A 51 ALA CB C 13 22.130 0.1 A 51 ALA N N 15 128.706 0.1 A 52 PRO HA H 1 1.498 0.02 A 52 PRO HBy H 1 1.118 0.02 A 52 PRO HBx H 1 0.961 0.02 A 52 PRO HDy H 1 3.620 0.02 A 52 PRO HDx H 1 3.273 0.02 A 52 PRO HGy H 1 1.630 0.02 A 52 PRO HGx H 1 0.769 0.02 A 52 PRO CA C 13 62.252 0.1 A 52 PRO CB C 13 32.161 0.1 A 52 PRO CD C 13 50.604 0.1 A 52 PRO CG C 13 26.984 0.1 A 53 PRO HA H 1 4.200 0.02 A 53 PRO HB2 H 1 2.049 0.02 A 53 PRO HB3 H 1 2.049 0.02 A 53 PRO HDy H 1 4.022 0.02 A 53 PRO HDx H 1 3.762 0.02 A 53 PRO HGy H 1 1.927 0.02 A 53 PRO HGx H 1 1.764 0.02 A 53 PRO CA C 13 64.217 0.1 A 53 PRO CB C 13 32.666 0.1 A 53 PRO CD C 13 50.600 0.1 A 53 PRO CG C 13 27.797 0.1 A 54 ASP H H 1 8.256 0.02 A 54 ASP HA H 1 4.596 0.02 A 54 ASP HBy H 1 2.921 0.02 A 54 ASP HBx H 1 2.596 0.02 A 54 ASP CA C 13 53.571 0.1 A 54 ASP CB C 13 40.581 0.1 A 54 ASP N N 15 112.983 0.1 A 55 GLN H H 1 6.526 0.02 A 55 GLN HA H 1 4.755 0.02 A 55 GLN HBy H 1 2.110 0.02 A 55 GLN HBx H 1 1.249 0.02 A 55 GLN HE2y H 1 7.742 0.02 A 55 GLN HE2x H 1 7.099 0.02 A 55 GLN HGy H 1 2.598 0.02 A 55 GLN HGx H 1 2.462 0.02 A 55 GLN CA C 13 52.869 0.1 A 55 GLN CB C 13 29.896 0.1 A 55 GLN CG C 13 33.779 0.1 A 55 GLN N N 15 117.051 0.1 A 55 GLN NE2 N 15 114.504 0.1 A 56 PRO HA H 1 4.376 0.02 A 56 PRO HBy H 1 2.500 0.02 A 56 PRO HBx H 1 2.286 0.02 A 56 PRO HD2 H 1 4.064 0.02 A 56 PRO HD3 H 1 4.064 0.02 A 56 PRO HGy H 1 2.380 0.02 A 56 PRO HGx H 1 2.182 0.02 A 56 PRO CA C 13 65.860 0.1 A 56 PRO CB C 13 32.220 0.1 A 56 PRO CD C 13 51.089 0.1 A 56 PRO CG C 13 27.569 0.1 A 57 TRP H H 1 8.031 0.02 A 57 TRP HA H 1 4.434 0.02 A 57 TRP HBy H 1 3.686 0.02 A 57 TRP HBx H 1 3.410 0.02 A 57 TRP HD1 H 1 7.856 0.02 A 57 TRP HE1 H 1 10.636 0.02 A 57 TRP HE3 H 1 7.566 0.02 A 57 TRP HH2 H 1 7.114 0.02 A 57 TRP HZ2 H 1 7.335 0.02 A 57 TRP HZ3 H 1 6.950 0.02 A 57 TRP CA C 13 59.368 0.1 A 57 TRP CB C 13 27.092 0.1 A 57 TRP CD1 C 13 129.459 0.1 A 57 TRP CE3 C 13 121.953 0.1 A 57 TRP CH2 C 13 124.541 0.1 A 57 TRP CZ2 C 13 115.740 0.1 A 57 TRP CZ3 C 13 121.176 0.1 A 57 TRP N N 15 114.116 0.1 A 57 TRP NE1 N 15 130.864 0.1 A 58 VAL H H 1 6.362 0.02 A 58 VAL HA H 1 3.260 0.02 A 58 VAL HB H 1 1.891 0.02 A 58 VAL HGx% H 1 0.691 0.02 A 58 VAL HGy% H 1 -0.377 0.02 A 58 VAL CA C 13 66.336 0.1 A 58 VAL CB C 13 32.332 0.1 A 58 VAL CG1 C 13 20.411 0.1 A 58 VAL CG2 C 13 20.512 0.1 A 58 VAL N N 15 124.419 0.1 A 59 GLU H H 1 7.437 0.02 A 59 GLU HA H 1 3.883 0.02 A 59 GLU HB2 H 1 2.110 0.02 A 59 GLU HB3 H 1 2.110 0.02 A 59 GLU HGy H 1 2.340 0.02 A 59 GLU HGx H 1 2.249 0.02 A 59 GLU CA C 13 59.480 0.1 A 59 GLU CB C 13 29.210 0.1 A 59 GLU CG C 13 35.637 0.1 A 59 GLU N N 15 119.116 0.1 A 60 ARG H H 1 8.173 0.02 A 60 ARG HA H 1 4.105 0.02 A 60 ARG HB2 H 1 1.997 0.02 A 60 ARG HB3 H 1 1.997 0.02 A 60 ARG HD2 H 1 3.389 0.02 A 60 ARG HD3 H 1 3.389 0.02 A 60 ARG HGy H 1 1.915 0.02 A 60 ARG HGx H 1 1.770 0.02 A 60 ARG CA C 13 59.758 0.1 A 60 ARG CB C 13 30.882 0.1 A 60 ARG CD C 13 44.158 0.1 A 60 ARG CG C 13 28.365 0.1 A 60 ARG N N 15 116.840 0.1 A 61 ILE H H 1 7.246 0.02 A 61 ILE HA H 1 3.784 0.02 A 61 ILE HB H 1 1.965 0.02 A 61 ILE HD1% H 1 0.908 0.02 A 61 ILE HG1y H 1 2.253 0.02 A 61 ILE HG1x H 1 0.959 0.02 A 61 ILE HG2% H 1 0.573 0.02 A 61 ILE CA C 13 66.001 0.1 A 61 ILE CB C 13 38.352 0.1 A 61 ILE CD1 C 13 14.162 0.1 A 61 ILE CG1 C 13 29.728 0.1 A 61 ILE CG2 C 13 18.184 0.1 A 61 ILE N N 15 120.525 0.1 A 62 ILE H H 1 7.897 0.02 A 62 ILE HA H 1 3.061 0.02 A 62 ILE HB H 1 1.646 0.02 A 62 ILE HD1% H 1 0.493 0.02 A 62 ILE HG1y H 1 1.517 0.02 A 62 ILE HG1x H 1 -0.132 0.02 A 62 ILE HG2% H 1 0.379 0.02 A 62 ILE CA C 13 66.614 0.1 A 62 ILE CB C 13 37.909 0.1 A 62 ILE CD1 C 13 14.276 0.1 A 62 ILE CG1 C 13 29.047 0.1 A 62 ILE CG2 C 13 16.306 0.1 A 62 ILE N N 15 120.093 0.1 A 63 GLN H H 1 8.373 0.02 A 63 GLN HA H 1 4.076 0.02 A 63 GLN HB2 H 1 2.156 0.02 A 63 GLN HB3 H 1 2.156 0.02 A 63 GLN HE2y H 1 7.584 0.02 A 63 GLN HE2x H 1 6.849 0.02 A 63 GLN HGy H 1 2.622 0.02 A 63 GLN HGx H 1 2.469 0.02 A 63 GLN CA C 13 59.312 0.1 A 63 GLN CB C 13 28.541 0.1 A 63 GLN CG C 13 34.426 0.1 A 63 GLN N N 15 116.841 0.1 A 63 GLN NE2 N 15 111.783 0.1 A 64 ARG H H 1 7.605 0.02 A 64 ARG HA H 1 4.165 0.02 A 64 ARG HBy H 1 2.165 0.02 A 64 ARG HBx H 1 2.039 0.02 A 64 ARG HDy H 1 3.341 0.02 A 64 ARG HDx H 1 3.209 0.02 A 64 ARG HGy H 1 1.826 0.02 A 64 ARG HGx H 1 1.673 0.02 A 64 ARG CA C 13 59.868 0.1 A 64 ARG CB C 13 29.768 0.1 A 64 ARG CD C 13 43.800 0.1 A 64 ARG CG C 13 27.569 0.1 A 64 ARG N N 15 119.677 0.1 A 65 LEU H H 1 8.296 0.02 A 65 LEU HA H 1 4.246 0.02 A 65 LEU HBy H 1 2.115 0.02 A 65 LEU HBx H 1 1.830 0.02 A 65 LEU HD1% H 1 0.921 0.02 A 65 LEU HD2% H 1 0.921 0.02 A 65 LEU HG H 1 1.905 0.02 A 65 LEU CA C 13 57.907 0.1 A 65 LEU CB C 13 42.142 0.1 A 65 LEU CD1 C 13 23.365 0.1 A 65 LEU CD2 C 13 23.138 0.1 A 65 LEU CG C 13 27.683 0.1 A 65 LEU N N 15 120.900 0.1 A 66 GLN H H 1 8.607 0.02 A 66 GLN HA H 1 4.422 0.02 A 66 GLN HBy H 1 2.333 0.02 A 66 GLN HBx H 1 2.244 0.02 A 66 GLN HE2y H 1 7.468 0.02 A 66 GLN HE2x H 1 6.972 0.02 A 66 GLN HGy H 1 2.758 0.02 A 66 GLN HGx H 1 2.608 0.02 A 66 GLN CA C 13 58.309 0.1 A 66 GLN CB C 13 29.433 0.1 A 66 GLN CG C 13 35.069 0.1 A 66 GLN N N 15 118.564 0.1 A 66 GLN NE2 N 15 111.231 0.1 A 67 ARG H H 1 8.021 0.02 A 67 ARG HA H 1 4.401 0.02 A 67 ARG HB2 H 1 2.074 0.02 A 67 ARG HB3 H 1 2.074 0.02 A 67 ARG HD2 H 1 3.322 0.02 A 67 ARG HD3 H 1 3.322 0.02 A 67 ARG HGy H 1 1.923 0.02 A 67 ARG HGx H 1 1.807 0.02 A 67 ARG CA C 13 58.309 0.1 A 67 ARG CB C 13 30.882 0.1 A 67 ARG CD C 13 44.158 0.1 A 67 ARG CG C 13 27.797 0.1 A 67 ARG N N 15 119.572 0.1 A 68 THR H H 1 8.125 0.02 A 68 THR HA H 1 4.396 0.02 A 68 THR HB H 1 4.441 0.02 A 68 THR HG2% H 1 1.379 0.02 A 68 THR CA C 13 63.772 0.1 A 68 THR CB C 13 70.124 0.1 A 68 THR CG2 C 13 22.343 0.1 A 68 THR N N 15 113.497 0.1 A 69 SER H H 1 8.222 0.02 A 69 SER HA H 1 4.526 0.02 A 69 SER HBy H 1 4.114 0.02 A 69 SER HBx H 1 4.055 0.02 A 69 SER CA C 13 59.758 0.1 A 69 SER CB C 13 63.881 0.1 A 69 SER N N 15 117.718 0.1 A 70 ALA H H 1 8.248 0.02 A 70 ALA HA H 1 4.382 0.02 A 70 ALA HB% H 1 1.544 0.02 A 70 ALA CA C 13 53.738 0.1 A 70 ALA CB C 13 19.288 0.1 A 70 ALA N N 15 125.249 0.1 A 71 LYS H H 1 8.110 0.02 A 71 LYS HA H 1 4.338 0.02 A 71 LYS HBy H 1 1.960 0.02 A 71 LYS HBx H 1 1.901 0.02 A 71 LYS HD2 H 1 1.789 0.02 A 71 LYS HD3 H 1 1.789 0.02 A 71 LYS HE2 H 1 3.093 0.02 A 71 LYS HE3 H 1 3.093 0.02 A 71 LYS HG2 H 1 1.549 0.02 A 71 LYS HG3 H 1 1.549 0.02 A 71 LYS CA C 13 57.306 0.1 A 71 LYS CB C 13 32.889 0.1 A 71 LYS CD C 13 29.501 0.1 A 71 LYS CE C 13 42.681 0.1 A 71 LYS CG C 13 25.411 0.1 A 71 LYS N N 15 119.035 0.1 A 72 MET H H 1 8.139 0.02 A 72 MET HA H 1 4.521 0.02 A 72 MET HBy H 1 2.655 0.02 A 72 MET HBx H 1 2.174 0.02 A 72 MET HGy H 1 2.738 0.02 A 72 MET HGx H 1 2.192 0.02 A 72 MET CA C 13 56.135 0.1 A 72 MET CB C 13 32.753 0.1 A 72 MET CG C 13 32.682 0.1 A 72 MET N N 15 120.059 0.1 A 73 LYS H H 1 8.228 0.02 A 73 LYS HA H 1 4.376 0.02 A 73 LYS HB2 H 1 1.919 0.02 A 73 LYS HB3 H 1 1.919 0.02 A 73 LYS HD2 H 1 1.784 0.02 A 73 LYS HD3 H 1 1.784 0.02 A 73 LYS HE2 H 1 3.097 0.02 A 73 LYS HE3 H 1 3.097 0.02 A 73 LYS HG2 H 1 1.560 0.02 A 73 LYS HG3 H 1 1.560 0.02 A 73 LYS CA C 13 56.915 0.1 A 73 LYS CB C 13 33.112 0.1 A 73 LYS CD C 13 29.501 0.1 A 73 LYS CE C 13 42.454 0.1 A 73 LYS CG C 13 25.297 0.1 A 73 LYS N N 15 122.391 0.1 A 74 ARG H H 1 8.311 0.02 A 74 ARG HA H 1 4.430 0.02 A 74 ARG HB2 H 1 1.913 0.02 A 74 ARG HB3 H 1 1.913 0.02 A 74 ARG HD2 H 1 3.298 0.02 A 74 ARG HD3 H 1 3.298 0.02 A 74 ARG HG2 H 1 1.739 0.02 A 74 ARG HG3 H 1 1.739 0.02 A 74 ARG CA C 13 56.470 0.1 A 74 ARG CB C 13 31.217 0.1 A 74 ARG CD C 13 43.931 0.1 A 74 ARG CG C 13 27.797 0.1 A 74 ARG N N 15 122.328 0.1 A 75 ARG H H 1 8.460 0.02 A 75 ARG HA H 1 4.488 0.02 A 75 ARG HB2 H 1 1.933 0.02 A 75 ARG HB3 H 1 1.933 0.02 A 75 ARG HD2 H 1 3.290 0.02 A 75 ARG HD3 H 1 3.290 0.02 A 75 ARG HG2 H 1 1.761 0.02 A 75 ARG HG3 H 1 1.761 0.02 A 75 ARG CA C 13 56.470 0.1 A 75 ARG CB C 13 31.328 0.1 A 75 ARG CD C 13 43.931 0.1 A 75 ARG CG C 13 27.342 0.1 A 75 ARG N N 15 122.788 0.1 A 76 SER H H 1 8.467 0.02 A 76 SER HA H 1 4.581 0.02 A 76 SER HB2 H 1 3.987 0.02 A 76 SER HB3 H 1 3.987 0.02 A 76 SER CA C 13 58.699 0.1 A 76 SER CB C 13 64.550 0.1 A 76 SER N N 15 117.676 0.1 A 77 SER H H 1 8.046 0.02 A 77 SER HA H 1 4.342 0.02 A 77 SER HB2 H 1 3.925 0.02 A 77 SER HB3 H 1 3.925 0.02 A 77 SER CA C 13 60.310 0.1 A 77 SER CB C 13 64.517 0.1 A 77 SER N N 15 122.974 0.1 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 2 THR H A 1 GLY HA2 1.0 . 4.65 2 1 A 1 GLY HA3 A 2 THR H 1.0 . 4.65 3 2 A 2 THR H A 1 GLY HA2 1.0 . 5.39 4 2 A 1 GLY HA3 A 2 THR H 1.0 . 5.39 5 3 A 2 THR HA A 2 THR HB 1.0 . 3.43 6 4 A 2 THR HA A 2 THR HB 1.0 . 3.99 7 5 A 2 THR HA A 2 THR HG2% 1.0 . 4.47 8 6 A 2 THR HA A 2 THR HG2% 1.0 . 5.23 9 7 A 2 THR HA A 3 ASN H 1.0 . 3.93 10 8 A 2 THR HA A 3 ASN H 1.0 . 4.56 11 9 A 2 THR HB A 2 THR HG2% 1.0 . 3.85 12 10 A 2 THR HB A 2 THR HG2% 1.0 . 4.01 13 11 A 3 ASN HA A 3 ASN HBy 1.0 . 5.47 14 12 A 3 ASN HA A 3 ASN HBx 1.0 . 4.85 15 13 A 3 ASN HBy A 3 ASN HBx 1.0 . 2.40 16 14 A 3 ASN HBy A 4 ASP H 1.0 . 5.50 17 15 A 3 ASN HBy A 3 ASN HBx 1.0 . 2.56 18 16 A 3 ASN HBx A 4 ASP H 1.0 . 5.37 19 17 A 4 ASP H A 4 ASP HA 1.0 . 3.55 20 18 A 4 ASP H A 4 ASP HA 1.0 . 3.77 21 19 A 4 ASP H A 4 ASP HBy 1.0 . 4.08 22 20 A 4 ASP H A 4 ASP HBy 1.0 . 4.30 23 21 A 4 ASP H A 4 ASP HBx 1.0 . 3.81 24 22 A 4 ASP H A 4 ASP HBx 1.0 . 4.67 25 23 A 4 ASP HA A 4 ASP HBy 1.0 . 3.81 26 24 A 4 ASP HA A 4 ASP HBy 1.0 . 4.32 27 25 A 4 ASP HA A 4 ASP HBx 1.0 . 3.98 28 26 A 4 ASP HA A 4 ASP HBx 1.0 . 4.20 29 27 A 4 ASP HA A 5 ALA H 1.0 . 3.37 30 28 A 4 ASP HBy A 4 ASP HBx 1.0 . 2.40 31 29 A 4 ASP HBy A 4 ASP HBx 1.0 . 2.40 32 30 A 4 ASP HBx A 5 ALA H 1.0 . 4.17 33 31 A 5 ALA H A 5 ALA HA 1.0 . 3.76 34 32 A 5 ALA H A 5 ALA HA 1.0 . 4.11 35 33 A 5 ALA H A 5 ALA HB% 1.0 . 3.53 36 34 A 5 ALA HA A 5 ALA HB% 1.0 . 3.51 37 35 A 5 ALA HA A 6 GLU H 1.0 . 3.10 38 36 A 5 ALA HA A 6 GLU H 1.0 . 3.49 39 37 A 5 ALA HA A 5 ALA HB% 1.0 . 3.45 40 38 A 5 ALA HB% A 6 GLU H 1.0 . 3.83 41 39 A 5 ALA HB% A 6 GLU H 1.0 . 4.06 42 40 A 6 GLU H A 6 GLU HBy 1.0 . 3.88 43 41 A 6 GLU H A 6 GLU HBy 1.0 . 4.25 44 42 A 6 GLU H A 6 GLU HBx 1.0 . 3.60 45 43 A 6 GLU H A 6 GLU HBx 1.0 . 4.25 46 44 A 6 GLU H A 6 GLU HG2 1.0 . 3.76 47 44 A 6 GLU H A 6 GLU HG3 1.0 . 3.76 48 45 A 6 GLU H A 6 GLU HG2 1.0 . 4.22 49 45 A 6 GLU H A 6 GLU HG3 1.0 . 4.22 50 46 A 6 GLU HBy A 6 GLU HA 1.0 . 3.87 51 47 A 6 GLU HBy A 6 GLU HA 1.0 . 4.21 52 48 A 6 GLU HA A 6 GLU HG2 1.0 . 3.99 53 48 A 6 GLU HG3 A 6 GLU HA 1.0 . 3.99 54 49 A 6 GLU HA A 6 GLU HG2 1.0 . 4.17 55 49 A 6 GLU HG3 A 6 GLU HA 1.0 . 4.17 56 50 A 6 GLU HA A 7 ASP H 1.0 . 3.20 57 51 A 6 GLU HA A 7 ASP H 1.0 . 3.56 58 52 A 6 GLU HBy A 6 GLU HG2 1.0 . 2.87 59 52 A 6 GLU HBy A 6 GLU HG3 1.0 . 2.87 60 53 A 6 GLU HBy A 7 ASP H 1.0 . 4.13 61 54 A 6 GLU HBy A 8 CYS H 1.0 . 5.05 62 55 A 6 GLU HBx A 6 GLU HG2 1.0 . 3.51 63 55 A 6 GLU HBx A 6 GLU HG3 1.0 . 3.51 64 56 A 6 GLU HBx A 7 ASP H 1.0 . 4.63 65 57 A 7 ASP H A 6 GLU HG2 1.0 . 4.26 66 57 A 6 GLU HG3 A 7 ASP H 1.0 . 4.26 67 58 A 7 ASP H A 7 ASP HA 1.0 . 3.74 68 59 A 7 ASP H A 7 ASP HBy 1.0 . 3.88 69 60 A 7 ASP H A 7 ASP HBy 1.0 . 4.38 70 61 A 7 ASP H A 7 ASP HBx 1.0 . 3.48 71 62 A 7 ASP H A 7 ASP HBx 1.0 . 4.60 72 63 A 7 ASP H A 8 CYS H 1.0 . 3.65 73 64 A 7 ASP H A 8 CYS H 1.0 . 3.79 74 65 A 7 ASP HA A 7 ASP HBy 1.0 . 4.15 75 66 A 7 ASP HA A 7 ASP HBy 1.0 . 4.25 76 67 A 7 ASP HA A 7 ASP HBx 1.0 . 4.14 77 68 A 7 ASP HA A 7 ASP HBx 1.0 . 4.27 78 69 A 8 CYS H A 7 ASP HA 1.0 . 3.29 79 70 A 8 CYS H A 7 ASP HA 1.0 . 4.19 80 71 A 7 ASP HA A 28 LEU HDx% 1.0 . 4.54 81 72 A 7 ASP HBy A 7 ASP HBx 1.0 . 2.49 82 73 A 8 CYS H A 7 ASP HBx 1.0 . 4.26 83 74 A 8 CYS CB A 34 CYS CB 1.0 . 3.72 84 75 A 8 CYS CB A 34 CYS CB 1.0 . 3.99 85 76 A 8 CYS CB A 34 CYS SG 1.0 . 3.10 86 77 A 8 CYS CB A 34 CYS SG 1.0 . 3.10 87 78 A 8 CYS H A 8 CYS HA 1.0 . 3.64 88 79 A 8 CYS H A 8 CYS HA 1.0 . 4.66 89 80 A 8 CYS H A 8 CYS HA 1.0 . 4.66 90 81 A 8 CYS H A 8 CYS HBy 1.0 . 3.91 91 82 A 8 CYS H A 8 CYS HBy 1.0 . 4.92 92 83 A 8 CYS H A 8 CYS HBx 1.0 . 3.36 93 84 A 8 CYS H A 8 CYS HBx 1.0 . 4.42 94 85 A 8 CYS H A 9 CYS H 1.0 . 4.71 95 86 A 8 CYS H A 28 LEU HDx% 1.0 . 4.65 96 87 A 8 CYS HA A 8 CYS HBy 1.0 . 3.93 97 88 A 8 CYS HA A 8 CYS HBy 1.0 . 4.06 98 89 A 8 CYS HA A 8 CYS HBy 1.0 . 4.47 99 90 A 8 CYS HA A 8 CYS HBx 1.0 . 4.60 100 91 A 8 CYS HA A 9 CYS H 1.0 . 3.20 101 92 A 8 CYS HA A 9 CYS H 1.0 . 3.93 102 93 A 8 CYS HA A 9 CYS H 1.0 . 3.93 103 94 A 28 LEU HDx% A 8 CYS HA 1.0 . 3.86 104 95 A 8 CYS HA A 28 LEU HDy% 1.0 . 4.44 105 96 A 8 CYS HBy A 8 CYS HBx 1.0 . 3.31 106 97 A 8 CYS HBy A 9 CYS H 1.0 . 3.75 107 98 A 8 CYS HBy A 9 CYS H 1.0 . 4.75 108 99 A 8 CYS HBy A 8 CYS HBx 1.0 . 3.51 109 100 A 8 CYS HBx A 9 CYS H 1.0 . 4.36 110 101 A 8 CYS HBx A 9 CYS H 1.0 . 5.05 111 102 A 34 CYS CB A 8 CYS SG 1.0 . 3.10 112 103 A 34 CYS CB A 8 CYS SG 1.0 . 3.10 113 104 A 34 CYS SG A 8 CYS SG 1.0 . 2.10 114 105 A 34 CYS SG A 8 CYS SG 1.0 . 2.10 115 106 A 9 CYS CB A 50 CYS CB 1.0 . 3.72 116 107 A 9 CYS CB A 50 CYS CB 1.0 . 3.99 117 108 A 9 CYS CB A 50 CYS SG 1.0 . 3.10 118 109 A 9 CYS CB A 50 CYS SG 1.0 . 3.10 119 110 A 9 CYS H A 9 CYS HA 1.0 . 3.80 120 111 A 9 CYS H A 9 CYS HA 1.0 . 4.34 121 112 A 9 CYS H A 9 CYS HB2 1.0 . 3.35 122 112 A 9 CYS H A 9 CYS HB3 1.0 . 3.35 123 113 A 9 CYS H A 9 CYS HB2 1.0 . 3.90 124 113 A 9 CYS H A 9 CYS HB3 1.0 . 3.90 125 114 A 9 CYS H A 10 LEU H 1.0 . 4.73 126 115 A 28 LEU HDx% A 9 CYS H 1.0 . 4.14 127 116 A 28 LEU HDx% A 9 CYS H 1.0 . 4.72 128 117 A 9 CYS H A 38 ALA HB% 1.0 . 4.49 129 118 A 9 CYS HA A 10 LEU H 1.0 . 3.32 130 119 A 9 CYS HA A 10 LEU H 1.0 . 3.40 131 120 A 9 CYS HA A 36 VAL HGx% 1.0 . 4.82 132 121 A 10 LEU H A 9 CYS HB2 1.0 . 4.26 133 121 A 9 CYS HB3 A 10 LEU H 1.0 . 4.26 134 122 A 10 LEU H A 9 CYS HB2 1.0 . 4.47 135 122 A 9 CYS HB3 A 10 LEU H 1.0 . 4.47 136 123 A 11 SER H A 9 CYS HB2 1.0 . 3.67 137 123 A 9 CYS HB3 A 11 SER H 1.0 . 3.67 138 124 A 11 SER H A 9 CYS HB2 1.0 . 4.31 139 124 A 9 CYS HB3 A 11 SER H 1.0 . 4.31 140 125 A 12 VAL HGx% A 9 CYS HB2 1.0 . 4.46 141 125 A 9 CYS HB3 A 12 VAL HGx% 1.0 . 4.46 142 126 A 28 LEU HDx% A 9 CYS HB2 1.0 . 5.37 143 126 A 28 LEU HDx% A 9 CYS HB3 1.0 . 5.37 144 127 A 36 VAL HGy% A 9 CYS HB2 1.0 . 5.19 145 127 A 9 CYS HB3 A 36 VAL HGy% 1.0 . 5.19 146 128 A 36 VAL HGy% A 9 CYS HB2 1.0 . 5.50 147 128 A 9 CYS HB3 A 36 VAL HGy% 1.0 . 5.50 148 129 A 38 ALA HA A 9 CYS HB2 1.0 . 5.50 149 129 A 9 CYS HB3 A 38 ALA HA 1.0 . 5.50 150 130 A 38 ALA HB% A 9 CYS HB2 1.0 . 3.57 151 130 A 9 CYS HB3 A 38 ALA HB% 1.0 . 3.57 152 131 A 38 ALA HB% A 9 CYS HB2 1.0 . 5.26 153 131 A 9 CYS HB3 A 38 ALA HB% 1.0 . 5.26 154 132 A 50 CYS H A 9 CYS HB2 1.0 . 4.76 155 132 A 9 CYS HB3 A 50 CYS H 1.0 . 4.76 156 133 A 50 CYS HBy A 9 CYS HB2 1.0 . 4.90 157 133 A 9 CYS HB3 A 50 CYS HBy 1.0 . 4.90 158 134 A 50 CYS CB A 9 CYS SG 1.0 . 3.10 159 135 A 50 CYS CB A 9 CYS SG 1.0 . 3.10 160 136 A 50 CYS SG A 9 CYS SG 1.0 . 2.10 161 137 A 50 CYS SG A 9 CYS SG 1.0 . 2.10 162 138 A 10 LEU H A 10 LEU HA 1.0 . 4.26 163 139 A 10 LEU H A 10 LEU HA 1.0 . 4.41 164 140 A 10 LEU H A 10 LEU HBy 1.0 . 3.36 165 141 A 10 LEU H A 10 LEU HBy 1.0 . 4.62 166 142 A 10 LEU H A 10 LEU HBx 1.0 . 4.59 167 143 A 10 LEU H A 10 LEU HG 1.0 . 4.74 168 144 A 10 LEU H A 10 LEU HG 1.0 . 4.74 169 145 A 10 LEU H A 10 LEU HG 1.0 . 4.82 170 146 A 10 LEU H A 10 LEU HDx% 1.0 . 4.28 171 147 A 10 LEU H A 10 LEU HDy% 1.0 . 4.43 172 148 A 10 LEU H A 11 SER H 1.0 . 3.24 173 149 A 10 LEU H A 11 SER H 1.0 . 3.66 174 150 A 10 LEU H A 36 VAL HGy% 1.0 . 4.73 175 151 A 10 LEU HA A 10 LEU HBy 1.0 . 3.75 176 152 A 10 LEU HA A 10 LEU HBy 1.0 . 4.47 177 153 A 10 LEU HA A 10 LEU HBx 1.0 . 3.82 178 154 A 10 LEU HA A 10 LEU HBx 1.0 . 4.49 179 155 A 10 LEU HA A 10 LEU HG 1.0 . 4.70 180 156 A 10 LEU HA A 10 LEU HDx% 1.0 . 4.78 181 157 A 10 LEU HA A 10 LEU HDy% 1.0 . 3.40 182 158 A 10 LEU HA A 10 LEU HDy% 1.0 . 3.47 183 159 A 11 SER H A 10 LEU HA 1.0 . 4.20 184 160 A 11 SER H A 10 LEU HA 1.0 . 4.71 185 161 A 10 LEU HBy A 10 LEU HBx 1.0 . 2.80 186 162 A 10 LEU HBy A 10 LEU HDx% 1.0 . 3.44 187 163 A 10 LEU HBy A 10 LEU HDx% 1.0 . 3.44 188 164 A 10 LEU HBy A 10 LEU HDx% 1.0 . 4.34 189 165 A 10 LEU HBy A 10 LEU HDy% 1.0 . 3.41 190 166 A 10 LEU HBy A 10 LEU HDy% 1.0 . 3.41 191 167 A 10 LEU HBy A 10 LEU HDy% 1.0 . 4.45 192 168 A 11 SER H A 10 LEU HBy 1.0 . 3.99 193 169 A 11 SER H A 10 LEU HBy 1.0 . 5.33 194 170 A 10 LEU HBy A 10 LEU HBx 1.0 . 2.92 195 171 A 10 LEU HBx A 10 LEU HDx% 1.0 . 4.40 196 172 A 10 LEU HBx A 10 LEU HDy% 1.0 . 4.52 197 173 A 11 SER H A 10 LEU HBx 1.0 . 5.24 198 174 A 10 LEU HG A 10 LEU HDx% 1.0 . 3.95 199 175 A 10 LEU HDx% A 10 LEU HDy% 1.0 . 3.31 200 176 A 10 LEU HG A 10 LEU HDy% 1.0 . 3.89 201 177 A 10 LEU HG A 10 LEU HDy% 1.0 . 3.97 202 178 A 10 LEU HDx% A 10 LEU HDy% 1.0 . 2.58 203 179 A 11 SER H A 10 LEU HDy% 1.0 . 4.62 204 180 A 11 SER H A 11 SER HA 1.0 . 3.54 205 181 A 11 SER H A 11 SER HA 1.0 . 4.23 206 182 A 11 SER H A 11 SER HB2 1.0 . 3.72 207 182 A 11 SER H A 11 SER HB3 1.0 . 3.72 208 183 A 11 SER H A 11 SER HB2 1.0 . 5.39 209 183 A 11 SER H A 11 SER HB3 1.0 . 5.39 210 184 A 11 SER H A 50 CYS H 1.0 . 4.73 211 185 A 11 SER HA A 11 SER HB2 1.0 . 3.27 212 185 A 11 SER HA A 11 SER HB3 1.0 . 3.27 213 186 A 11 SER HA A 11 SER HB2 1.0 . 5.50 214 186 A 11 SER HA A 11 SER HB3 1.0 . 5.50 215 187 A 11 SER HA A 12 VAL H 1.0 . 3.24 216 188 A 11 SER HA A 12 VAL H 1.0 . 3.33 217 189 A 36 VAL HGy% A 11 SER HA 1.0 . 4.30 218 190 A 12 VAL H A 11 SER HB2 1.0 . 3.56 219 190 A 11 SER HB3 A 12 VAL H 1.0 . 3.56 220 191 A 12 VAL H A 11 SER HB2 1.0 . 4.57 221 191 A 11 SER HB3 A 12 VAL H 1.0 . 4.57 222 192 A 12 VAL H A 12 VAL HA 1.0 . 4.43 223 193 A 12 VAL H A 12 VAL HB 1.0 . 4.40 224 194 A 12 VAL H A 12 VAL HB 1.0 . 4.98 225 195 A 12 VAL HGx% A 12 VAL H 1.0 . 4.30 226 196 A 12 VAL H A 12 VAL HGy% 1.0 . 3.61 227 197 A 12 VAL H A 12 VAL HGy% 1.0 . 3.63 228 198 A 36 VAL HGy% A 12 VAL H 1.0 . 5.50 229 199 A 12 VAL HA A 12 VAL HB 1.0 . 3.94 230 200 A 12 VAL HA A 12 VAL HB 1.0 . 3.95 231 201 A 12 VAL HGx% A 12 VAL HA 1.0 . 3.80 232 202 A 12 VAL HA A 12 VAL HGy% 1.0 . 4.07 233 203 A 12 VAL HA A 12 VAL HGy% 1.0 . 4.57 234 204 A 12 VAL HA A 13 THR H 1.0 . 3.09 235 205 A 12 VAL HA A 13 THR H 1.0 . 3.45 236 206 A 12 VAL HA A 13 THR H 1.0 . 4.28 237 207 A 12 VAL HA A 50 CYS HBx 1.0 . 4.35 238 208 A 12 VAL HGx% A 12 VAL HB 1.0 . 3.60 239 209 A 12 VAL HB A 12 VAL HGy% 1.0 . 3.55 240 210 A 12 VAL HB A 13 THR H 1.0 . 4.19 241 211 A 12 VAL HB A 16 PRO HBy 1.0 . 5.13 242 212 A 12 VAL HB A 16 PRO HDy 1.0 . 4.45 243 213 A 12 VAL HB A 16 PRO HDx 1.0 . 5.20 244 214 A 12 VAL HB A 16 PRO HGy 1.0 . 5.34 245 215 A 12 VAL HB A 51 ALA HA 1.0 . 4.29 246 216 A 12 VAL HB A 51 ALA HA 1.0 . 4.29 247 217 A 12 VAL HGx% A 12 VAL HB 1.0 . 3.71 248 218 A 12 VAL HGx% A 12 VAL HGy% 1.0 . 3.00 249 219 A 12 VAL HGx% A 13 THR H 1.0 . 4.45 250 220 A 12 VAL HGx% A 39 VAL H 1.0 . 4.58 251 221 A 12 VAL HGx% A 50 CYS HA 1.0 . 4.29 252 222 A 12 VAL HGx% A 50 CYS HBy 1.0 . 4.59 253 223 A 12 VAL HGx% A 50 CYS HBy 1.0 . 4.63 254 224 A 12 VAL HGx% A 50 CYS HBx 1.0 . 4.09 255 225 A 12 VAL HGx% A 50 CYS HBx 1.0 . 4.27 256 226 A 12 VAL HGx% A 51 ALA H 1.0 . 4.46 257 227 A 12 VAL HGx% A 51 ALA HA 1.0 . 4.73 258 228 A 12 VAL HGx% A 53 PRO HDy 1.0 . 4.88 259 229 A 12 VAL HB A 12 VAL HGy% 1.0 . 3.73 260 230 A 12 VAL HGx% A 12 VAL HGy% 1.0 . 3.01 261 231 A 12 VAL HGy% A 13 THR H 1.0 . 4.02 262 232 A 12 VAL HGy% A 13 THR H 1.0 . 4.09 263 233 A 12 VAL HGy% A 13 THR H 1.0 . 4.79 264 234 A 12 VAL HGy% A 16 PRO HDy 1.0 . 4.57 265 235 A 12 VAL HGy% A 16 PRO HDy 1.0 . 4.69 266 236 A 12 VAL HGy% A 16 PRO HGy 1.0 . 4.68 267 237 A 12 VAL HGy% A 16 PRO HGx 1.0 . 5.02 268 238 A 12 VAL HGy% A 51 ALA H 1.0 . 5.28 269 239 A 13 THR H A 13 THR HB 1.0 . 3.64 270 240 A 13 THR H A 13 THR HG2% 1.0 . 3.68 271 241 A 13 THR H A 51 ALA HA 1.0 . 4.13 272 242 A 13 THR H A 51 ALA HA 1.0 . 4.61 273 243 A 13 THR HB A 13 THR HA 1.0 . 3.11 274 244 A 13 THR HB A 13 THR HA 1.0 . 3.66 275 245 A 13 THR HG2% A 13 THR HA 1.0 . 3.80 276 246 A 13 THR HG2% A 13 THR HA 1.0 . 3.82 277 247 A 13 THR HA A 14 GLN H 1.0 . 2.99 278 248 A 13 THR HA A 14 GLN H 1.0 . 3.35 279 249 A 13 THR HB A 13 THR HG2% 1.0 . 3.69 280 250 A 13 THR HB A 14 GLN H 1.0 . 3.72 281 251 A 13 THR HB A 13 THR HG2% 1.0 . 3.57 282 252 A 13 THR HG2% A 14 GLN H 1.0 . 3.64 283 253 A 13 THR HG2% A 14 GLN H 1.0 . 4.34 284 254 A 13 THR HG2% A 15 LYS H 1.0 . 4.12 285 255 A 16 PRO HDy A 13 THR HG2% 1.0 . 4.94 286 256 A 16 PRO HDy A 13 THR HG2% 1.0 . 5.08 287 257 A 14 GLN H A 14 GLN HBy 1.0 . 4.54 288 258 A 14 GLN H A 14 GLN HBx 1.0 . 3.61 289 259 A 14 GLN H A 14 GLN HBx 1.0 . 4.00 290 260 A 14 GLN H A 14 GLN HGy 1.0 . 4.62 291 261 A 14 GLN H A 14 GLN HGx 1.0 . 4.36 292 262 A 14 GLN H A 15 LYS H 1.0 . 3.26 293 263 A 14 GLN H A 15 LYS H 1.0 . 3.33 294 264 A 14 GLN HBy A 14 GLN HA 1.0 . 4.12 295 265 A 14 GLN HBy A 14 GLN HA 1.0 . 4.12 296 266 A 14 GLN HBx A 14 GLN HA 1.0 . 4.25 297 267 A 14 GLN HBx A 14 GLN HA 1.0 . 4.47 298 268 A 14 GLN HGy A 14 GLN HA 1.0 . 4.43 299 269 A 14 GLN HGy A 14 GLN HA 1.0 . 4.57 300 270 A 14 GLN HGx A 14 GLN HA 1.0 . 4.44 301 271 A 15 LYS H A 14 GLN HA 1.0 . 4.93 302 272 A 14 GLN HBy A 14 GLN HBx 1.0 . 2.89 303 273 A 14 GLN HBy A 14 GLN HGy 1.0 . 3.28 304 274 A 14 GLN HBy A 14 GLN HGx 1.0 . 3.12 305 275 A 15 LYS H A 14 GLN HBy 1.0 . 4.87 306 276 A 14 GLN HBy A 14 GLN HBx 1.0 . 2.86 307 277 A 14 GLN HBx A 14 GLN HGy 1.0 . 3.48 308 278 A 14 GLN HBx A 14 GLN HGy 1.0 . 3.52 309 279 A 14 GLN HBx A 14 GLN HGx 1.0 . 3.43 310 280 A 15 LYS H A 14 GLN HBx 1.0 . 4.57 311 281 A 15 LYS H A 15 LYS HA 1.0 . 3.52 312 282 A 15 LYS H A 15 LYS HA 1.0 . 4.29 313 283 A 15 LYS H A 15 LYS HA 1.0 . 4.29 314 284 A 15 LYS H A 15 LYS HBy 1.0 . 4.37 315 285 A 15 LYS H A 15 LYS HBx 1.0 . 3.32 316 286 A 15 LYS H A 15 LYS HBx 1.0 . 4.37 317 287 A 15 LYS H A 15 LYS HG2 1.0 . 4.07 318 287 A 15 LYS H A 15 LYS HG3 1.0 . 4.07 319 288 A 15 LYS H A 15 LYS HG2 1.0 . 5.01 320 288 A 15 LYS H A 15 LYS HG3 1.0 . 5.01 321 289 A 15 LYS HA A 15 LYS HBy 1.0 . 3.74 322 290 A 15 LYS HA A 15 LYS HBy 1.0 . 3.95 323 291 A 15 LYS HA A 15 LYS HBx 1.0 . 3.91 324 292 A 15 LYS HA A 15 LYS HG2 1.0 . 4.12 325 292 A 15 LYS HA A 15 LYS HG3 1.0 . 4.12 326 293 A 15 LYS HA A 15 LYS HG2 1.0 . 4.74 327 293 A 15 LYS HA A 15 LYS HG3 1.0 . 4.74 328 294 A 15 LYS HA A 57 TRP HZ2 1.0 . 4.42 329 295 A 15 LYS HBy A 15 LYS HBx 1.0 . 2.40 330 296 A 15 LYS HBy A 15 LYS HE2 1.0 . 4.05 331 296 A 15 LYS HBy A 15 LYS HE3 1.0 . 4.05 332 297 A 15 LYS HBy A 15 LYS HG2 1.0 . 3.56 333 297 A 15 LYS HBy A 15 LYS HG3 1.0 . 3.56 334 298 A 15 LYS HBx A 15 LYS HE2 1.0 . 4.18 335 298 A 15 LYS HBx A 15 LYS HE3 1.0 . 4.18 336 299 A 15 LYS HBx A 15 LYS HG2 1.0 . 3.07 337 299 A 15 LYS HBx A 15 LYS HG3 1.0 . 3.07 338 300 A 15 LYS HBx A 15 LYS HG2 1.0 . 3.59 339 300 A 15 LYS HBx A 15 LYS HG3 1.0 . 3.59 340 301 A 15 LYS HD3 A 15 LYS HE2 1.0 . 3.76 341 301 A 15 LYS HD2 A 15 LYS HE2 1.0 . 3.76 342 301 A 15 LYS HE3 A 15 LYS HD2 1.0 . 3.76 343 301 A 15 LYS HE3 A 15 LYS HD3 1.0 . 3.76 344 302 A 15 LYS HD3 A 15 LYS HE2 1.0 . 4.21 345 302 A 15 LYS HD2 A 15 LYS HE2 1.0 . 4.21 346 302 A 15 LYS HE3 A 15 LYS HD2 1.0 . 4.21 347 302 A 15 LYS HE3 A 15 LYS HD3 1.0 . 4.21 348 303 A 15 LYS HD3 A 15 LYS HG2 1.0 . 3.01 349 303 A 15 LYS HD2 A 15 LYS HG2 1.0 . 3.01 350 303 A 15 LYS HG3 A 15 LYS HD2 1.0 . 3.01 351 303 A 15 LYS HG3 A 15 LYS HD3 1.0 . 3.01 352 304 A 52 PRO HDy A 15 LYS HG2 1.0 . 5.28 353 304 A 15 LYS HG3 A 52 PRO HDy 1.0 . 5.28 354 305 A 52 PRO HDx A 15 LYS HG2 1.0 . 5.03 355 305 A 15 LYS HG3 A 52 PRO HDx 1.0 . 5.03 356 306 A 16 PRO HBy A 16 PRO HA 1.0 . 4.06 357 307 A 16 PRO HA A 16 PRO HBx 1.0 . 4.32 358 308 A 16 PRO HDy A 16 PRO HA 1.0 . 5.50 359 309 A 16 PRO HDx A 16 PRO HA 1.0 . 5.50 360 310 A 16 PRO HGy A 16 PRO HA 1.0 . 5.08 361 311 A 16 PRO HGx A 16 PRO HA 1.0 . 5.50 362 312 A 16 PRO HBy A 16 PRO HA 1.0 . 4.96 363 313 A 16 PRO HBy A 16 PRO HBx 1.0 . 3.15 364 314 A 16 PRO HBy A 16 PRO HDy 1.0 . 5.08 365 315 A 16 PRO HBy A 16 PRO HDx 1.0 . 5.03 366 316 A 16 PRO HBy A 16 PRO HGy 1.0 . 3.59 367 317 A 16 PRO HBy A 16 PRO HGx 1.0 . 3.49 368 318 A 16 PRO HA A 16 PRO HBx 1.0 . 5.50 369 319 A 16 PRO HBy A 16 PRO HBx 1.0 . 3.15 370 320 A 16 PRO HDy A 16 PRO HBx 1.0 . 5.06 371 321 A 16 PRO HDx A 16 PRO HBx 1.0 . 4.78 372 322 A 16 PRO HGy A 16 PRO HBx 1.0 . 3.48 373 323 A 16 PRO HGx A 16 PRO HBx 1.0 . 3.10 374 324 A 16 PRO HDy A 16 PRO HA 1.0 . 4.60 375 325 A 16 PRO HBy A 16 PRO HDy 1.0 . 5.28 376 326 A 16 PRO HDy A 16 PRO HBx 1.0 . 5.13 377 327 A 16 PRO HDy A 16 PRO HDx 1.0 . 3.15 378 328 A 16 PRO HDy A 16 PRO HGy 1.0 . 4.27 379 329 A 16 PRO HDy A 16 PRO HGx 1.0 . 4.34 380 330 A 16 PRO HDy A 51 ALA HA 1.0 . 3.66 381 331 A 16 PRO HDy A 51 ALA HA 1.0 . 3.76 382 332 A 16 PRO HDy A 51 ALA HB% 1.0 . 3.93 383 333 A 16 PRO HDy A 51 ALA HB% 1.0 . 4.17 384 334 A 16 PRO HDy A 57 TRP HZ2 1.0 . 4.15 385 335 A 16 PRO HDy A 57 TRP HZ2 1.0 . 4.99 386 336 A 16 PRO HDy A 58 VAL HGy% 1.0 . 5.01 387 337 A 16 PRO HDx A 16 PRO HA 1.0 . 5.50 388 338 A 16 PRO HBy A 16 PRO HDx 1.0 . 5.46 389 339 A 16 PRO HDx A 16 PRO HBx 1.0 . 5.50 390 340 A 16 PRO HDy A 16 PRO HDx 1.0 . 3.11 391 341 A 16 PRO HDx A 16 PRO HGy 1.0 . 4.30 392 342 A 16 PRO HDx A 16 PRO HGx 1.0 . 4.21 393 343 A 16 PRO HDx A 51 ALA HA 1.0 . 3.86 394 344 A 16 PRO HDx A 51 ALA HA 1.0 . 4.05 395 345 A 16 PRO HDx A 51 ALA HB% 1.0 . 3.80 396 346 A 16 PRO HDx A 57 TRP HZ2 1.0 . 4.37 397 347 A 16 PRO HDx A 57 TRP HZ2 1.0 . 4.81 398 348 A 16 PRO HGy A 16 PRO HA 1.0 . 5.50 399 349 A 16 PRO HBy A 16 PRO HGy 1.0 . 3.41 400 350 A 16 PRO HGy A 16 PRO HBx 1.0 . 3.71 401 351 A 16 PRO HDy A 16 PRO HGy 1.0 . 4.25 402 352 A 16 PRO HDx A 16 PRO HGy 1.0 . 4.37 403 353 A 16 PRO HGy A 16 PRO HGx 1.0 . 2.82 404 354 A 16 PRO HGy A 57 TRP HE1 1.0 . 5.04 405 355 A 16 PRO HGy A 58 VAL HGy% 1.0 . 4.92 406 356 A 16 PRO HGx A 16 PRO HA 1.0 . 5.50 407 357 A 16 PRO HBy A 16 PRO HGx 1.0 . 3.81 408 358 A 16 PRO HGx A 16 PRO HBx 1.0 . 3.54 409 359 A 16 PRO HDy A 16 PRO HGx 1.0 . 4.43 410 360 A 16 PRO HDx A 16 PRO HGx 1.0 . 4.13 411 361 A 16 PRO HGy A 16 PRO HGx 1.0 . 2.83 412 362 A 16 PRO HGx A 52 PRO HDy 1.0 . 5.50 413 363 A 16 PRO HGx A 58 VAL HGy% 1.0 . 4.60 414 364 A 17 ILE HA A 17 ILE HB 1.0 . 3.80 415 365 A 17 ILE HA A 17 ILE HB 1.0 . 4.13 416 366 A 17 ILE HA A 17 ILE HG1y 1.0 . 4.90 417 367 A 17 ILE HA A 17 ILE HG1x 1.0 . 4.38 418 368 A 17 ILE HA A 17 ILE HG1x 1.0 . 5.08 419 369 A 17 ILE HA A 17 ILE HD1% 1.0 . 4.43 420 370 A 17 ILE HA A 17 ILE HD1% 1.0 . 5.50 421 371 A 17 ILE HA A 17 ILE HG2% 1.0 . 3.89 422 372 A 17 ILE HA A 17 ILE HG2% 1.0 . 3.96 423 373 A 17 ILE HA A 18 PRO HDy 1.0 . 3.37 424 374 A 17 ILE HA A 18 PRO HDy 1.0 . 3.40 425 375 A 17 ILE HA A 18 PRO HDx 1.0 . 3.72 426 376 A 17 ILE HA A 18 PRO HDx 1.0 . 4.22 427 377 A 17 ILE HB A 17 ILE HG1x 1.0 . 4.25 428 378 A 17 ILE HB A 17 ILE HD1% 1.0 . 3.30 429 379 A 17 ILE HB A 17 ILE HD1% 1.0 . 3.52 430 380 A 17 ILE HB A 17 ILE HG2% 1.0 . 3.53 431 381 A 17 ILE HB A 18 PRO HDy 1.0 . 4.23 432 382 A 17 ILE HB A 18 PRO HDy 1.0 . 4.51 433 383 A 17 ILE HB A 18 PRO HDx 1.0 . 3.96 434 384 A 17 ILE HB A 18 PRO HDx 1.0 . 4.02 435 385 A 17 ILE HB A 21 ILE HD1% 1.0 . 4.28 436 386 A 17 ILE HB A 21 ILE HD1% 1.0 . 4.81 437 387 A 17 ILE HG1y A 17 ILE HG1x 1.0 . 3.26 438 388 A 17 ILE HG1y A 57 TRP HH2 1.0 . 5.28 439 389 A 17 ILE HG1y A 57 TRP HZ3 1.0 . 4.95 440 390 A 17 ILE HG1y A 17 ILE HG1x 1.0 . 3.18 441 391 A 17 ILE HG1x A 17 ILE HD1% 1.0 . 3.06 442 392 A 17 ILE HG1x A 18 PRO HDy 1.0 . 5.27 443 393 A 17 ILE HG1x A 21 ILE HD1% 1.0 . 3.35 444 394 A 17 ILE HG1x A 43 THR HG2% 1.0 . 3.38 445 395 A 17 ILE HG1y A 17 ILE HD1% 1.0 . 3.52 446 396 A 17 ILE HG1x A 17 ILE HD1% 1.0 . 2.94 447 397 A 17 ILE HD1% A 41 PHE HBx 1.0 . 4.33 448 398 A 17 ILE HD1% A 41 PHE HBx 1.0 . 5.07 449 399 A 17 ILE HD1% A 41 PHE HD% 1.0 . 4.35 450 400 A 17 ILE HD1% A 43 THR HG2% 1.0 . 3.70 451 401 A 17 ILE HD1% A 49 LEU HB2 1.0 . 4.17 452 401 A 17 ILE HD1% A 49 LEU HB3 1.0 . 4.17 453 402 A 17 ILE HD1% A 57 TRP HH2 1.0 . 3.74 454 403 A 17 ILE HD1% A 57 TRP HH2 1.0 . 4.55 455 404 A 57 TRP HZ2 A 17 ILE HD1% 1.0 . 4.50 456 405 A 17 ILE HD1% A 57 TRP HZ3 1.0 . 4.38 457 406 A 17 ILE HB A 17 ILE HG2% 1.0 . 3.79 458 407 A 17 ILE HG1y A 17 ILE HG2% 1.0 . 4.54 459 408 A 17 ILE HG1x A 17 ILE HG2% 1.0 . 3.76 460 409 A 17 ILE HG1x A 17 ILE HG2% 1.0 . 4.05 461 410 A 17 ILE HD1% A 17 ILE HG2% 1.0 . 2.77 462 411 A 17 ILE HD1% A 17 ILE HG2% 1.0 . 3.40 463 412 A 17 ILE HG2% A 18 PRO HDy 1.0 . 4.20 464 413 A 17 ILE HG2% A 18 PRO HDy 1.0 . 4.64 465 414 A 17 ILE HG2% A 18 PRO HDx 1.0 . 4.23 466 415 A 18 PRO HA A 18 PRO HBy 1.0 . 3.93 467 416 A 18 PRO HA A 18 PRO HBx 1.0 . 4.46 468 417 A 18 PRO HDy A 18 PRO HA 1.0 . 4.94 469 418 A 18 PRO HDx A 18 PRO HA 1.0 . 5.50 470 419 A 18 PRO HA A 18 PRO HG2 1.0 . 4.42 471 419 A 18 PRO HA A 18 PRO HG3 1.0 . 4.42 472 420 A 18 PRO HA A 19 GLY H 1.0 . 3.17 473 421 A 18 PRO HA A 19 GLY H 1.0 . 3.27 474 422 A 18 PRO HA A 20 TYR H 1.0 . 5.32 475 423 A 18 PRO HA A 18 PRO HBy 1.0 . 3.62 476 424 A 18 PRO HBy A 18 PRO HBx 1.0 . 3.25 477 425 A 18 PRO HDy A 18 PRO HBy 1.0 . 4.48 478 426 A 18 PRO HDx A 18 PRO HBy 1.0 . 4.81 479 427 A 18 PRO HBy A 18 PRO HG2 1.0 . 3.18 480 427 A 18 PRO HBy A 18 PRO HG3 1.0 . 3.18 481 428 A 18 PRO HBy A 19 GLY H 1.0 . 4.47 482 429 A 18 PRO HBy A 19 GLY H 1.0 . 5.15 483 430 A 21 ILE HD1% A 18 PRO HBy 1.0 . 4.42 484 431 A 18 PRO HA A 18 PRO HBx 1.0 . 4.22 485 432 A 18 PRO HBy A 18 PRO HBx 1.0 . 3.24 486 433 A 18 PRO HDy A 18 PRO HBx 1.0 . 4.85 487 434 A 18 PRO HDx A 18 PRO HBx 1.0 . 4.66 488 435 A 18 PRO HBx A 18 PRO HG2 1.0 . 3.53 489 435 A 18 PRO HBx A 18 PRO HG3 1.0 . 3.53 490 436 A 18 PRO HBx A 19 GLY H 1.0 . 4.73 491 437 A 18 PRO HBx A 20 TYR H 1.0 . 4.59 492 438 A 18 PRO HBx A 20 TYR H 1.0 . 5.48 493 439 A 21 ILE HD1% A 18 PRO HBx 1.0 . 5.20 494 440 A 18 PRO HBx A 21 ILE HG2% 1.0 . 4.76 495 441 A 18 PRO HDy A 18 PRO HA 1.0 . 4.98 496 442 A 18 PRO HDy A 18 PRO HBy 1.0 . 4.93 497 443 A 18 PRO HDy A 18 PRO HBx 1.0 . 5.50 498 444 A 18 PRO HDy A 18 PRO HDx 1.0 . 2.97 499 445 A 18 PRO HDy A 18 PRO HG2 1.0 . 3.64 500 445 A 18 PRO HDy A 18 PRO HG3 1.0 . 3.64 501 446 A 18 PRO HDy A 21 ILE HD1% 1.0 . 5.27 502 447 A 18 PRO HDx A 18 PRO HA 1.0 . 5.07 503 448 A 18 PRO HDx A 18 PRO HBy 1.0 . 5.37 504 449 A 18 PRO HDx A 18 PRO HBx 1.0 . 4.85 505 450 A 18 PRO HDy A 18 PRO HDx 1.0 . 2.94 506 451 A 18 PRO HDx A 18 PRO HG2 1.0 . 3.69 507 451 A 18 PRO HDx A 18 PRO HG3 1.0 . 3.69 508 452 A 18 PRO HDx A 21 ILE HG1y 1.0 . 5.08 509 453 A 18 PRO HDx A 21 ILE HD1% 1.0 . 4.44 510 454 A 18 PRO HDx A 21 ILE HG2% 1.0 . 5.49 511 455 A 18 PRO HA A 18 PRO HG2 1.0 . 4.29 512 455 A 18 PRO HA A 18 PRO HG3 1.0 . 4.29 513 456 A 18 PRO HBy A 18 PRO HG2 1.0 . 3.41 514 456 A 18 PRO HBy A 18 PRO HG3 1.0 . 3.41 515 457 A 18 PRO HBx A 18 PRO HG2 1.0 . 3.70 516 457 A 18 PRO HBx A 18 PRO HG3 1.0 . 3.70 517 458 A 18 PRO HDy A 18 PRO HG2 1.0 . 3.54 518 458 A 18 PRO HDy A 18 PRO HG3 1.0 . 3.54 519 459 A 18 PRO HDx A 18 PRO HG2 1.0 . 3.67 520 459 A 18 PRO HDx A 18 PRO HG3 1.0 . 3.67 521 460 A 21 ILE HB A 18 PRO HG2 1.0 . 5.50 522 460 A 18 PRO HG3 A 21 ILE HB 1.0 . 5.50 523 461 A 21 ILE HD1% A 18 PRO HG2 1.0 . 4.26 524 461 A 21 ILE HD1% A 18 PRO HG3 1.0 . 4.26 525 462 A 21 ILE HG2% A 18 PRO HG2 1.0 . 4.25 526 462 A 18 PRO HG3 A 21 ILE HG2% 1.0 . 4.25 527 463 A 21 ILE HG2% A 18 PRO HG2 1.0 . 4.40 528 463 A 18 PRO HG3 A 21 ILE HG2% 1.0 . 4.40 529 464 A 19 GLY H A 19 GLY HAy 1.0 . 3.44 530 465 A 19 GLY H A 19 GLY HAy 1.0 . 3.64 531 466 A 19 GLY H A 19 GLY HAx 1.0 . 3.84 532 467 A 19 GLY H A 19 GLY HAx 1.0 . 3.92 533 468 A 19 GLY H A 20 TYR H 1.0 . 3.98 534 469 A 19 GLY H A 20 TYR H 1.0 . 4.11 535 470 A 19 GLY H A 22 VAL HGx% 1.0 . 4.85 536 471 A 19 GLY H A 61 ILE HD1% 1.0 . 4.38 537 472 A 19 GLY HAy A 19 GLY HAx 1.0 . 2.98 538 473 A 20 TYR H A 19 GLY HAy 1.0 . 4.02 539 474 A 20 TYR H A 19 GLY HAy 1.0 . 4.59 540 475 A 19 GLY HAy A 61 ILE HG1x 1.0 . 4.85 541 476 A 19 GLY HAy A 61 ILE HD1% 1.0 . 4.08 542 477 A 19 GLY HAy A 61 ILE HD1% 1.0 . 5.17 543 478 A 19 GLY HAy A 61 ILE HG2% 1.0 . 5.32 544 479 A 19 GLY HAy A 19 GLY HAx 1.0 . 3.03 545 480 A 20 TYR H A 19 GLY HAx 1.0 . 4.46 546 481 A 20 TYR H A 19 GLY HAx 1.0 . 4.93 547 482 A 19 GLY HAx A 22 VAL HGx% 1.0 . 4.73 548 483 A 19 GLY HAx A 61 ILE HG1y 1.0 . 5.44 549 484 A 19 GLY HAx A 61 ILE HG1x 1.0 . 4.89 550 485 A 19 GLY HAx A 61 ILE HD1% 1.0 . 3.88 551 486 A 19 GLY HAx A 61 ILE HD1% 1.0 . 4.66 552 487 A 19 GLY HAx A 61 ILE HG2% 1.0 . 4.78 553 488 A 20 TYR H A 20 TYR HA 1.0 . 3.73 554 489 A 20 TYR H A 20 TYR HA 1.0 . 4.08 555 490 A 20 TYR H A 20 TYR HBy 1.0 . 3.95 556 491 A 20 TYR H A 20 TYR HBy 1.0 . 4.37 557 492 A 20 TYR H A 20 TYR HBx 1.0 . 3.56 558 493 A 20 TYR H A 20 TYR HBx 1.0 . 4.09 559 494 A 20 TYR H A 20 TYR HD% 1.0 . 3.90 560 495 A 20 TYR H A 21 ILE H 1.0 . 3.82 561 496 A 20 TYR H A 21 ILE H 1.0 . 4.02 562 497 A 20 TYR H A 61 ILE HB 1.0 . 5.23 563 498 A 20 TYR H A 61 ILE HD1% 1.0 . 5.13 564 499 A 20 TYR H A 61 ILE HG2% 1.0 . 5.48 565 500 A 20 TYR HA A 20 TYR HBy 1.0 . 3.41 566 501 A 20 TYR HA A 20 TYR HBy 1.0 . 3.56 567 502 A 20 TYR HA A 20 TYR HBx 1.0 . 3.56 568 503 A 20 TYR HA A 20 TYR HD% 1.0 . 3.81 569 504 A 20 TYR HA A 20 TYR HD% 1.0 . 5.00 570 505 A 20 TYR HA A 21 ILE H 1.0 . 4.42 571 506 A 20 TYR HA A 21 ILE H 1.0 . 4.60 572 507 A 20 TYR HA A 22 VAL H 1.0 . 4.32 573 508 A 20 TYR HBy A 20 TYR HBx 1.0 . 2.83 574 509 A 20 TYR HBy A 20 TYR HD% 1.0 . 3.36 575 510 A 20 TYR HBy A 20 TYR HE% 1.0 . 4.39 576 511 A 20 TYR HBy A 20 TYR HBx 1.0 . 2.87 577 512 A 20 TYR HBx A 20 TYR HD% 1.0 . 3.26 578 513 A 61 ILE HG2% A 20 TYR HBx 1.0 . 5.01 579 514 A 20 TYR HBy A 20 TYR HD% 1.0 . 4.25 580 515 A 20 TYR HBx A 20 TYR HD% 1.0 . 4.15 581 516 A 20 TYR HD% A 20 TYR HE% 1.0 . 2.40 582 517 A 20 TYR HBy A 20 TYR HE% 1.0 . 5.15 583 518 A 20 TYR HBx A 20 TYR HE% 1.0 . 5.02 584 519 A 20 TYR HD% A 20 TYR HE% 1.0 . 2.51 585 520 A 21 ILE H A 21 ILE HA 1.0 . 4.60 586 521 A 21 ILE HB A 21 ILE H 1.0 . 4.88 587 522 A 21 ILE HG1y A 21 ILE H 1.0 . 4.23 588 523 A 21 ILE HG1y A 21 ILE H 1.0 . 4.27 589 524 A 21 ILE H A 21 ILE HG1x 1.0 . 4.69 590 525 A 21 ILE H A 21 ILE HG1x 1.0 . 4.69 591 526 A 21 ILE HG2% A 21 ILE H 1.0 . 4.40 592 527 A 21 ILE H A 22 VAL H 1.0 . 3.79 593 528 A 21 ILE HB A 21 ILE HA 1.0 . 3.60 594 529 A 21 ILE HB A 21 ILE HA 1.0 . 4.04 595 530 A 21 ILE HG1y A 21 ILE HA 1.0 . 4.60 596 531 A 21 ILE HG1y A 21 ILE HA 1.0 . 5.50 597 532 A 21 ILE HA A 21 ILE HG1x 1.0 . 4.00 598 533 A 21 ILE HA A 21 ILE HG1x 1.0 . 5.50 599 534 A 21 ILE HD1% A 21 ILE HA 1.0 . 4.37 600 535 A 21 ILE HD1% A 21 ILE HA 1.0 . 5.50 601 536 A 21 ILE HG2% A 21 ILE HA 1.0 . 3.60 602 537 A 21 ILE HG2% A 21 ILE HA 1.0 . 3.67 603 538 A 22 VAL H A 21 ILE HA 1.0 . 4.45 604 539 A 21 ILE HA A 44 LEU H 1.0 . 4.67 605 540 A 21 ILE HA A 44 LEU HDx% 1.0 . 4.31 606 541 A 21 ILE HG1y A 21 ILE HB 1.0 . 4.84 607 542 A 21 ILE HG1y A 21 ILE HB 1.0 . 5.27 608 543 A 21 ILE HB A 21 ILE HG1x 1.0 . 4.26 609 544 A 21 ILE HB A 21 ILE HG1x 1.0 . 4.26 610 545 A 21 ILE HB A 21 ILE HG1x 1.0 . 4.45 611 546 A 21 ILE HD1% A 21 ILE HB 1.0 . 3.67 612 547 A 21 ILE HD1% A 21 ILE HB 1.0 . 4.25 613 548 A 21 ILE HG2% A 21 ILE HB 1.0 . 3.35 614 549 A 21 ILE HB A 43 THR HB 1.0 . 5.22 615 550 A 21 ILE HB A 44 LEU H 1.0 . 4.57 616 551 A 21 ILE HG1y A 21 ILE HG1x 1.0 . 3.06 617 552 A 21 ILE HD1% A 21 ILE HG1y 1.0 . 3.80 618 553 A 21 ILE HG1y A 22 VAL H 1.0 . 4.85 619 554 A 21 ILE HG1y A 21 ILE HG1x 1.0 . 3.09 620 555 A 22 VAL H A 21 ILE HG1x 1.0 . 4.80 621 556 A 22 VAL H A 21 ILE HG1x 1.0 . 5.50 622 557 A 21 ILE HD1% A 21 ILE HG1y 1.0 . 3.52 623 558 A 21 ILE HD1% A 43 THR HA 1.0 . 5.30 624 559 A 21 ILE HD1% A 43 THR HB 1.0 . 5.26 625 560 A 21 ILE HD1% A 43 THR HG2% 1.0 . 4.58 626 561 A 21 ILE HG2% A 21 ILE HB 1.0 . 3.90 627 562 A 21 ILE HG2% A 21 ILE HG1y 1.0 . 3.93 628 563 A 21 ILE HG2% A 21 ILE HG1x 1.0 . 4.23 629 564 A 21 ILE HD1% A 21 ILE HG2% 1.0 . 3.07 630 565 A 21 ILE HG2% A 22 VAL H 1.0 . 4.78 631 566 A 21 ILE HG2% A 22 VAL H 1.0 . 4.92 632 567 A 21 ILE HG2% A 43 THR HB 1.0 . 5.31 633 568 A 22 VAL H A 22 VAL HA 1.0 . 4.13 634 569 A 22 VAL H A 22 VAL HA 1.0 . 4.69 635 570 A 22 VAL H A 22 VAL HB 1.0 . 3.52 636 571 A 22 VAL H A 22 VAL HB 1.0 . 3.85 637 572 A 22 VAL HGx% A 22 VAL H 1.0 . 3.58 638 573 A 22 VAL HGx% A 22 VAL H 1.0 . 3.83 639 574 A 22 VAL H A 22 VAL HGy% 1.0 . 4.18 640 575 A 22 VAL H A 22 VAL HGy% 1.0 . 4.69 641 576 A 22 VAL H A 23 ARG H 1.0 . 5.26 642 577 A 22 VAL H A 23 ARG H 1.0 . 5.34 643 578 A 22 VAL HA A 22 VAL HB 1.0 . 4.61 644 579 A 22 VAL HGx% A 22 VAL HA 1.0 . 3.81 645 580 A 22 VAL HGx% A 22 VAL HA 1.0 . 3.83 646 581 A 22 VAL HA A 22 VAL HGy% 1.0 . 3.70 647 582 A 22 VAL HA A 22 VAL HGy% 1.0 . 3.88 648 583 A 22 VAL HA A 23 ARG H 1.0 . 3.13 649 584 A 22 VAL HA A 23 ARG H 1.0 . 3.48 650 585 A 22 VAL HA A 24 ASN H 1.0 . 4.41 651 586 A 22 VAL HA A 24 ASN H 1.0 . 4.98 652 587 A 22 VAL HA A 42 THR H 1.0 . 4.77 653 588 A 43 THR HA A 22 VAL HA 1.0 . 3.61 654 589 A 43 THR HA A 22 VAL HA 1.0 . 3.84 655 590 A 43 THR HG2% A 22 VAL HA 1.0 . 4.70 656 591 A 43 THR HG2% A 22 VAL HA 1.0 . 4.80 657 592 A 44 LEU H A 22 VAL HA 1.0 . 4.75 658 593 A 44 LEU H A 22 VAL HA 1.0 . 5.09 659 594 A 22 VAL HA A 65 LEU HD1% 1.0 . 4.33 660 595 A 22 VAL HB A 22 VAL HGy% 1.0 . 3.58 661 596 A 22 VAL HB A 23 ARG H 1.0 . 5.01 662 597 A 22 VAL HGx% A 22 VAL HB 1.0 . 3.35 663 598 A 22 VAL HGx% A 22 VAL HGy% 1.0 . 3.03 664 599 A 22 VAL HGx% A 23 ARG H 1.0 . 4.56 665 600 A 22 VAL HGx% A 23 ARG H 1.0 . 5.11 666 601 A 22 VAL HGx% A 24 ASN H 1.0 . 4.90 667 602 A 22 VAL HGx% A 41 PHE HA 1.0 . 5.28 668 603 A 22 VAL HGx% A 41 PHE HBy 1.0 . 4.50 669 604 A 22 VAL HGx% A 41 PHE HBy 1.0 . 4.53 670 605 A 41 PHE HBx A 22 VAL HGx% 1.0 . 4.82 671 606 A 41 PHE HBx A 22 VAL HGx% 1.0 . 5.10 672 607 A 41 PHE HD% A 22 VAL HGx% 1.0 . 3.94 673 608 A 41 PHE HD% A 22 VAL HGx% 1.0 . 4.89 674 609 A 22 VAL HGx% A 41 PHE HE% 1.0 . 4.07 675 610 A 22 VAL HGx% A 43 THR HA 1.0 . 5.11 676 611 A 22 VAL HGx% A 43 THR HA 1.0 . 5.24 677 612 A 43 THR HG2% A 22 VAL HGx% 1.0 . 4.38 678 613 A 22 VAL HB A 22 VAL HGy% 1.0 . 3.45 679 614 A 22 VAL HGx% A 22 VAL HGy% 1.0 . 3.01 680 615 A 22 VAL HGy% A 23 ARG H 1.0 . 3.78 681 616 A 22 VAL HGy% A 23 ARG H 1.0 . 4.08 682 617 A 22 VAL HGy% A 24 ASN H 1.0 . 3.33 683 618 A 22 VAL HGy% A 24 ASN H 1.0 . 3.88 684 619 A 22 VAL HGy% A 25 PHE H 1.0 . 4.66 685 620 A 22 VAL HGy% A 25 PHE HA 1.0 . 5.37 686 621 A 22 VAL HGy% A 25 PHE HBy 1.0 . 4.38 687 622 A 22 VAL HGy% A 25 PHE HBx 1.0 . 4.76 688 623 A 22 VAL HGy% A 41 PHE HA 1.0 . 4.58 689 624 A 22 VAL HGy% A 41 PHE HBy 1.0 . 4.06 690 625 A 22 VAL HGy% A 41 PHE HBy 1.0 . 4.07 691 626 A 41 PHE HBx A 22 VAL HGy% 1.0 . 4.43 692 627 A 41 PHE HD% A 22 VAL HGy% 1.0 . 3.27 693 628 A 41 PHE HD% A 22 VAL HGy% 1.0 . 4.02 694 629 A 22 VAL HGy% A 41 PHE HE% 1.0 . 5.11 695 630 A 22 VAL HGy% A 42 THR H 1.0 . 4.57 696 631 A 22 VAL HGy% A 42 THR HB 1.0 . 5.27 697 632 A 23 ARG H A 23 ARG HA 1.0 . 3.90 698 633 A 23 ARG H A 23 ARG HBy 1.0 . 4.54 699 634 A 23 ARG H A 23 ARG HBx 1.0 . 3.60 700 635 A 23 ARG H A 23 ARG HBx 1.0 . 4.52 701 636 A 23 ARG H A 23 ARG HGy 1.0 . 5.08 702 637 A 23 ARG H A 23 ARG HGx 1.0 . 5.30 703 638 A 23 ARG H A 24 ASN H 1.0 . 3.21 704 639 A 23 ARG H A 24 ASN H 1.0 . 3.35 705 640 A 23 ARG H A 42 THR H 1.0 . 4.65 706 641 A 23 ARG H A 42 THR H 1.0 . 4.90 707 642 A 43 THR HA A 23 ARG H 1.0 . 3.60 708 643 A 43 THR HA A 23 ARG H 1.0 . 4.40 709 644 A 43 THR HG2% A 23 ARG H 1.0 . 4.78 710 645 A 44 LEU H A 23 ARG H 1.0 . 4.97 711 646 A 23 ARG H A 44 LEU HDy% 1.0 . 4.88 712 647 A 23 ARG H A 44 LEU HDy% 1.0 . 5.06 713 648 A 23 ARG H A 65 LEU HD1% 1.0 . 4.32 714 649 A 23 ARG HA A 23 ARG HBy 1.0 . 3.82 715 650 A 23 ARG HA A 23 ARG HBy 1.0 . 3.90 716 651 A 23 ARG HA A 23 ARG HBx 1.0 . 3.82 717 652 A 23 ARG HA A 23 ARG HDy 1.0 . 5.04 718 653 A 23 ARG HA A 23 ARG HDy 1.0 . 5.48 719 654 A 23 ARG HA A 23 ARG HDx 1.0 . 5.50 720 655 A 23 ARG HA A 23 ARG HGy 1.0 . 4.66 721 656 A 23 ARG HA A 23 ARG HGx 1.0 . 4.44 722 657 A 23 ARG HA A 23 ARG HGx 1.0 . 4.44 723 658 A 23 ARG HA A 23 ARG HGx 1.0 . 4.67 724 659 A 24 ASN H A 23 ARG HA 1.0 . 4.30 725 660 A 23 ARG HA A 44 LEU HDy% 1.0 . 4.25 726 661 A 65 LEU HD1% A 23 ARG HA 1.0 . 4.58 727 662 A 23 ARG HBy A 23 ARG HBx 1.0 . 2.40 728 663 A 23 ARG HBy A 23 ARG HDy 1.0 . 4.87 729 664 A 23 ARG HBy A 23 ARG HDx 1.0 . 4.59 730 665 A 23 ARG HBy A 23 ARG HGy 1.0 . 3.10 731 666 A 23 ARG HBy A 23 ARG HGx 1.0 . 3.03 732 667 A 23 ARG HBy A 23 ARG HGx 1.0 . 3.11 733 668 A 42 THR HB A 23 ARG HBy 1.0 . 4.81 734 669 A 23 ARG HBy A 42 THR HG2% 1.0 . 3.33 735 670 A 23 ARG HBy A 44 LEU HA 1.0 . 3.44 736 671 A 23 ARG HBy A 44 LEU HA 1.0 . 4.77 737 672 A 23 ARG HBy A 44 LEU HDy% 1.0 . 3.47 738 673 A 23 ARG HBy A 44 LEU HDy% 1.0 . 4.41 739 674 A 23 ARG HBy A 23 ARG HBx 1.0 . 2.42 740 675 A 23 ARG HBx A 23 ARG HDy 1.0 . 3.55 741 676 A 23 ARG HBx A 23 ARG HDy 1.0 . 4.67 742 677 A 23 ARG HBx A 23 ARG HDx 1.0 . 3.88 743 678 A 23 ARG HBx A 23 ARG HDx 1.0 . 4.39 744 679 A 23 ARG HBx A 23 ARG HGx 1.0 . 3.16 745 680 A 24 ASN H A 23 ARG HBx 1.0 . 3.78 746 681 A 23 ARG HBx A 42 THR HG2% 1.0 . 3.53 747 682 A 23 ARG HBx A 44 LEU HA 1.0 . 4.84 748 683 A 23 ARG HBx A 44 LEU HDy% 1.0 . 4.49 749 684 A 23 ARG HDy A 23 ARG HDx 1.0 . 2.40 750 685 A 23 ARG HGy A 23 ARG HDy 1.0 . 4.43 751 686 A 23 ARG HGy A 23 ARG HDx 1.0 . 4.39 752 687 A 23 ARG HGy A 23 ARG HGx 1.0 . 2.57 753 688 A 24 ASN H A 23 ARG HGy 1.0 . 5.35 754 689 A 23 ARG HGy A 44 LEU HA 1.0 . 5.17 755 690 A 23 ARG HGx A 23 ARG HDy 1.0 . 3.64 756 691 A 23 ARG HGx A 23 ARG HDy 1.0 . 3.94 757 692 A 23 ARG HGx A 23 ARG HDy 1.0 . 3.94 758 693 A 23 ARG HGx A 23 ARG HDy 1.0 . 4.43 759 694 A 23 ARG HGx A 23 ARG HDx 1.0 . 4.36 760 695 A 23 ARG HGy A 23 ARG HGx 1.0 . 2.60 761 696 A 24 ASN H A 23 ARG HGx 1.0 . 5.50 762 697 A 23 ARG HGx A 44 LEU HA 1.0 . 5.32 763 698 A 24 ASN H A 24 ASN HA 1.0 . 3.86 764 699 A 24 ASN H A 24 ASN HA 1.0 . 4.15 765 700 A 24 ASN H A 24 ASN HBy 1.0 . 4.22 766 701 A 24 ASN H A 24 ASN HBx 1.0 . 4.28 767 702 A 24 ASN H A 42 THR H 1.0 . 3.71 768 703 A 24 ASN H A 42 THR H 1.0 . 3.94 769 704 A 24 ASN H A 42 THR HB 1.0 . 3.86 770 705 A 24 ASN H A 42 THR HB 1.0 . 4.38 771 706 A 24 ASN H A 65 LEU HD1% 1.0 . 4.22 772 707 A 24 ASN HA A 24 ASN HBy 1.0 . 3.92 773 708 A 24 ASN HA A 24 ASN HBy 1.0 . 4.20 774 709 A 24 ASN HA A 24 ASN HBx 1.0 . 3.85 775 710 A 24 ASN HA A 24 ASN HBx 1.0 . 4.13 776 711 A 25 PHE H A 24 ASN HA 1.0 . 3.47 777 712 A 25 PHE H A 24 ASN HA 1.0 . 3.60 778 713 A 65 LEU HD1% A 24 ASN HA 1.0 . 4.62 779 714 A 24 ASN HBy A 24 ASN HBx 1.0 . 2.60 780 715 A 24 ASN HBy A 24 ASN HBx 1.0 . 2.82 781 716 A 25 PHE H A 24 ASN HBy 1.0 . 3.89 782 717 A 25 PHE H A 24 ASN HBy 1.0 . 4.48 783 718 A 42 THR HB A 24 ASN HBy 1.0 . 4.44 784 719 A 42 THR HG2% A 24 ASN HBy 1.0 . 4.64 785 720 A 24 ASN HBy A 24 ASN HBx 1.0 . 2.66 786 721 A 24 ASN HBy A 24 ASN HBx 1.0 . 2.79 787 722 A 25 PHE H A 24 ASN HBx 1.0 . 4.02 788 723 A 25 PHE H A 24 ASN HBx 1.0 . 4.46 789 724 A 42 THR HB A 24 ASN HBx 1.0 . 4.60 790 725 A 42 THR HG2% A 24 ASN HBx 1.0 . 5.10 791 726 A 25 PHE H A 25 PHE HA 1.0 . 4.30 792 727 A 25 PHE H A 25 PHE HBy 1.0 . 5.20 793 728 A 25 PHE H A 25 PHE HBx 1.0 . 5.10 794 729 A 25 PHE H A 25 PHE HE% 1.0 . 4.10 795 730 A 25 PHE H A 25 PHE HE% 1.0 . 4.50 796 731 A 25 PHE HA A 25 PHE HBy 1.0 . 3.80 797 732 A 25 PHE HA A 25 PHE HBy 1.0 . 4.02 798 733 A 25 PHE HA A 25 PHE HBx 1.0 . 3.78 799 734 A 25 PHE HA A 25 PHE HBx 1.0 . 3.98 800 735 A 25 PHE HA A 26 HIS H 1.0 . 3.18 801 736 A 25 PHE HA A 26 HIS H 1.0 . 3.56 802 737 A 25 PHE HA A 39 VAL HGy% 1.0 . 5.29 803 738 A 41 PHE HA A 25 PHE HA 1.0 . 3.91 804 739 A 41 PHE HA A 25 PHE HA 1.0 . 4.02 805 740 A 41 PHE HD% A 25 PHE HA 1.0 . 4.54 806 741 A 41 PHE HD% A 25 PHE HA 1.0 . 4.71 807 742 A 42 THR H A 25 PHE HA 1.0 . 4.50 808 743 A 25 PHE HBy A 25 PHE HBx 1.0 . 3.19 809 744 A 25 PHE HBy A 25 PHE HD% 1.0 . 4.48 810 745 A 25 PHE HBy A 26 HIS H 1.0 . 4.19 811 746 A 25 PHE HBy A 26 HIS H 1.0 . 4.83 812 747 A 25 PHE HBy A 39 VAL HGy% 1.0 . 4.59 813 748 A 25 PHE HBy A 39 VAL HGy% 1.0 . 5.15 814 749 A 41 PHE HA A 25 PHE HBy 1.0 . 5.46 815 750 A 41 PHE HD% A 25 PHE HBy 1.0 . 3.43 816 751 A 41 PHE HD% A 25 PHE HBy 1.0 . 4.26 817 752 A 41 PHE HE% A 25 PHE HBy 1.0 . 4.01 818 753 A 41 PHE HE% A 25 PHE HBy 1.0 . 4.94 819 754 A 42 THR H A 25 PHE HBy 1.0 . 4.45 820 755 A 25 PHE HBy A 25 PHE HBx 1.0 . 3.20 821 756 A 25 PHE HBx A 25 PHE HD% 1.0 . 4.11 822 757 A 25 PHE HBx A 26 HIS H 1.0 . 4.40 823 758 A 25 PHE HBx A 39 VAL HGx% 1.0 . 4.91 824 759 A 25 PHE HBx A 39 VAL HGy% 1.0 . 4.19 825 760 A 25 PHE HBx A 39 VAL HGy% 1.0 . 4.66 826 761 A 41 PHE HA A 25 PHE HBx 1.0 . 5.18 827 762 A 41 PHE HA A 25 PHE HBx 1.0 . 5.47 828 763 A 41 PHE HD% A 25 PHE HBx 1.0 . 4.03 829 764 A 41 PHE HD% A 25 PHE HBx 1.0 . 4.60 830 765 A 41 PHE HE% A 25 PHE HBx 1.0 . 4.51 831 766 A 41 PHE HE% A 25 PHE HBx 1.0 . 5.46 832 767 A 25 PHE HZ A 62 ILE HG2% 1.0 . 4.49 833 768 A 25 PHE HZ A 66 GLN HBy 1.0 . 4.66 834 769 A 25 PHE HZ A 66 GLN HGx 1.0 . 4.50 835 770 A 25 PHE HE% A 25 PHE HD% 1.0 . 2.85 836 771 A 25 PHE HD% A 39 VAL HGx% 1.0 . 4.36 837 772 A 39 VAL HGy% A 25 PHE HD% 1.0 . 4.45 838 773 A 25 PHE HD% A 62 ILE HG2% 1.0 . 4.34 839 774 A 25 PHE HD% A 62 ILE HG2% 1.0 . 4.74 840 775 A 25 PHE HD% A 65 LEU HBy 1.0 . 4.34 841 776 A 25 PHE HD% A 65 LEU HBy 1.0 . 5.50 842 777 A 25 PHE HD% A 65 LEU HBx 1.0 . 5.50 843 778 A 65 LEU HD1% A 25 PHE HD% 1.0 . 4.01 844 779 A 25 PHE HE% A 25 PHE HZ 1.0 . 3.57 845 780 A 25 PHE HE% A 25 PHE HZ 1.0 . 3.91 846 781 A 25 PHE HE% A 25 PHE HD% 1.0 . 2.69 847 782 A 25 PHE HE% A 39 VAL HGy% 1.0 . 4.03 848 783 A 25 PHE HE% A 39 VAL HGy% 1.0 . 4.76 849 784 A 25 PHE HE% A 62 ILE HD1% 1.0 . 3.96 850 785 A 25 PHE HE% A 62 ILE HD1% 1.0 . 5.07 851 786 A 25 PHE HE% A 62 ILE HG2% 1.0 . 5.50 852 787 A 25 PHE HE% A 65 LEU HBy 1.0 . 4.45 853 788 A 25 PHE HE% A 65 LEU HBy 1.0 . 5.16 854 789 A 25 PHE HE% A 65 LEU HBx 1.0 . 4.26 855 790 A 25 PHE HE% A 65 LEU HBx 1.0 . 5.41 856 791 A 65 LEU HD1% A 25 PHE HE% 1.0 . 3.57 857 792 A 25 PHE HE% A 66 GLN HA 1.0 . 4.52 858 793 A 25 PHE HE% A 66 GLN HGx 1.0 . 3.62 859 794 A 26 HIS H A 26 HIS HA 1.0 . 4.01 860 795 A 26 HIS H A 26 HIS HA 1.0 . 4.28 861 796 A 26 HIS H A 26 HIS HBy 1.0 . 5.02 862 797 A 26 HIS H A 26 HIS HBx 1.0 . 5.15 863 798 A 26 HIS H A 39 VAL HA 1.0 . 5.11 864 799 A 26 HIS H A 39 VAL HGy% 1.0 . 4.18 865 800 A 26 HIS H A 39 VAL HGy% 1.0 . 5.06 866 801 A 26 HIS H A 40 VAL H 1.0 . 3.74 867 802 A 26 HIS H A 40 VAL H 1.0 . 3.84 868 803 A 26 HIS H A 40 VAL HB 1.0 . 5.17 869 804 A 26 HIS H A 40 VAL HGx% 1.0 . 4.39 870 805 A 26 HIS HA A 26 HIS HBy 1.0 . 3.77 871 806 A 26 HIS HA A 26 HIS HBy 1.0 . 4.03 872 807 A 26 HIS HA A 26 HIS HBx 1.0 . 3.82 873 808 A 26 HIS HA A 26 HIS HBx 1.0 . 4.03 874 809 A 26 HIS HA A 26 HIS HD2 1.0 . 4.49 875 810 A 26 HIS HA A 27 TYR H 1.0 . 3.29 876 811 A 26 HIS HA A 27 TYR H 1.0 . 3.63 877 812 A 26 HIS HBy A 26 HIS HBx 1.0 . 2.74 878 813 A 26 HIS HBy A 26 HIS HD2 1.0 . 4.83 879 814 A 26 HIS HBy A 27 TYR H 1.0 . 4.52 880 815 A 26 HIS HBy A 26 HIS HBx 1.0 . 2.77 881 816 A 26 HIS HBx A 26 HIS HD2 1.0 . 4.95 882 817 A 26 HIS HBx A 27 TYR H 1.0 . 4.72 883 818 A 26 HIS HBx A 40 VAL HGy% 1.0 . 5.19 884 819 A 26 HIS HD2 A 26 HIS HE1 1.0 . 4.59 885 820 A 26 HIS HD2 A 26 HIS HE1 1.0 . 4.31 886 821 A 40 VAL HGy% A 26 HIS HE1 1.0 . 4.50 887 822 A 27 TYR H A 27 TYR HA 1.0 . 3.98 888 823 A 27 TYR H A 27 TYR HB2 1.0 . 3.32 889 823 A 27 TYR H A 27 TYR HB3 1.0 . 3.32 890 824 A 27 TYR H A 27 TYR HB2 1.0 . 4.01 891 824 A 27 TYR H A 27 TYR HB3 1.0 . 4.01 892 825 A 27 TYR H A 27 TYR HD% 1.0 . 4.04 893 826 A 27 TYR HA A 27 TYR HB2 1.0 . 3.86 894 826 A 27 TYR HA A 27 TYR HB3 1.0 . 3.86 895 827 A 27 TYR HA A 27 TYR HB2 1.0 . 5.50 896 827 A 27 TYR HA A 27 TYR HB3 1.0 . 5.50 897 828 A 27 TYR HA A 27 TYR HD% 1.0 . 3.69 898 829 A 27 TYR HA A 27 TYR HE% 1.0 . 4.12 899 830 A 27 TYR HA A 28 LEU H 1.0 . 3.08 900 831 A 39 VAL HA A 27 TYR HA 1.0 . 3.78 901 832 A 27 TYR HA A 39 VAL HB 1.0 . 5.24 902 833 A 39 VAL HGy% A 27 TYR HA 1.0 . 5.42 903 834 A 40 VAL H A 27 TYR HA 1.0 . 3.91 904 835 A 27 TYR HD% A 27 TYR HB2 1.0 . 3.11 905 835 A 27 TYR HB3 A 27 TYR HD% 1.0 . 3.11 906 836 A 27 TYR HE% A 27 TYR HB2 1.0 . 4.09 907 836 A 27 TYR HB3 A 27 TYR HE% 1.0 . 4.09 908 837 A 28 LEU H A 27 TYR HB2 1.0 . 3.83 909 837 A 27 TYR HB3 A 28 LEU H 1.0 . 3.83 910 838 A 28 LEU H A 27 TYR HB2 1.0 . 4.40 911 838 A 27 TYR HB3 A 28 LEU H 1.0 . 4.40 912 839 A 27 TYR HD% A 27 TYR HB2 1.0 . 3.95 913 839 A 27 TYR HB3 A 27 TYR HD% 1.0 . 3.95 914 840 A 27 TYR HD% A 27 TYR HE% 1.0 . 2.51 915 841 A 27 TYR HD% A 28 LEU H 1.0 . 4.76 916 842 A 39 VAL HA A 27 TYR HD% 1.0 . 4.26 917 843 A 39 VAL HA A 27 TYR HD% 1.0 . 5.36 918 844 A 27 TYR HD% A 39 VAL HB 1.0 . 4.55 919 845 A 27 TYR HD% A 39 VAL HB 1.0 . 5.50 920 846 A 39 VAL HGx% A 27 TYR HD% 1.0 . 3.54 921 847 A 39 VAL HGx% A 27 TYR HD% 1.0 . 4.42 922 848 A 39 VAL HGy% A 27 TYR HD% 1.0 . 4.45 923 849 A 27 TYR HD% A 53 PRO HB2 1.0 . 4.53 924 849 A 27 TYR HD% A 53 PRO HB3 1.0 . 4.53 925 850 A 62 ILE HD1% A 27 TYR HD% 1.0 . 4.79 926 851 A 62 ILE HG2% A 27 TYR HD% 1.0 . 4.97 927 852 A 27 TYR HD% A 27 TYR HE% 1.0 . 2.55 928 853 A 39 VAL HGx% A 27 TYR HE% 1.0 . 3.25 929 854 A 39 VAL HGx% A 27 TYR HE% 1.0 . 4.26 930 855 A 39 VAL HGy% A 27 TYR HE% 1.0 . 4.39 931 856 A 27 TYR HE% A 53 PRO HA 1.0 . 4.62 932 857 A 27 TYR HE% A 53 PRO HA 1.0 . 5.50 933 858 A 27 TYR HE% A 53 PRO HB2 1.0 . 3.90 934 858 A 27 TYR HE% A 53 PRO HB3 1.0 . 3.90 935 859 A 27 TYR HE% A 53 PRO HB2 1.0 . 5.34 936 859 A 27 TYR HE% A 53 PRO HB3 1.0 . 5.34 937 860 A 27 TYR HE% A 62 ILE HG1y 1.0 . 4.69 938 861 A 62 ILE HD1% A 27 TYR HE% 1.0 . 4.47 939 862 A 62 ILE HG2% A 27 TYR HE% 1.0 . 5.09 940 863 A 28 LEU H A 28 LEU HBy 1.0 . 4.03 941 864 A 28 LEU H A 28 LEU HBy 1.0 . 4.81 942 865 A 28 LEU H A 28 LEU HBx 1.0 . 3.64 943 866 A 28 LEU H A 28 LEU HBx 1.0 . 4.37 944 867 A 28 LEU H A 28 LEU HG 1.0 . 4.32 945 868 A 28 LEU H A 28 LEU HG 1.0 . 5.49 946 869 A 28 LEU HDx% A 28 LEU H 1.0 . 4.86 947 870 A 28 LEU HDy% A 28 LEU H 1.0 . 5.34 948 871 A 28 LEU H A 38 ALA H 1.0 . 4.37 949 872 A 28 LEU H A 38 ALA H 1.0 . 4.44 950 873 A 38 ALA HB% A 28 LEU H 1.0 . 5.41 951 874 A 39 VAL HA A 28 LEU H 1.0 . 4.10 952 875 A 28 LEU HBy A 28 LEU HA 1.0 . 4.26 953 876 A 28 LEU HBy A 28 LEU HA 1.0 . 4.66 954 877 A 28 LEU HBx A 28 LEU HA 1.0 . 4.45 955 878 A 28 LEU HBx A 28 LEU HA 1.0 . 5.17 956 879 A 28 LEU HG A 28 LEU HA 1.0 . 5.02 957 880 A 28 LEU HG A 28 LEU HA 1.0 . 5.49 958 881 A 28 LEU HDx% A 28 LEU HA 1.0 . 4.18 959 882 A 28 LEU HDy% A 28 LEU HA 1.0 . 3.52 960 883 A 28 LEU HA A 29 LEU H 1.0 . 3.36 961 884 A 28 LEU HA A 29 LEU H 1.0 . 4.13 962 885 A 28 LEU HA A 32 ASP HBx 1.0 . 4.46 963 886 A 28 LEU HBy A 28 LEU HBx 1.0 . 3.08 964 887 A 28 LEU HBy A 28 LEU HG 1.0 . 3.93 965 888 A 28 LEU HBy A 28 LEU HG 1.0 . 4.56 966 889 A 28 LEU HDx% A 28 LEU HBy 1.0 . 3.68 967 890 A 28 LEU HDx% A 28 LEU HBy 1.0 . 4.04 968 891 A 28 LEU HDy% A 28 LEU HBy 1.0 . 3.90 969 892 A 28 LEU HBy A 38 ALA H 1.0 . 5.48 970 893 A 40 VAL HGx% A 28 LEU HBy 1.0 . 4.83 971 894 A 28 LEU HBy A 28 LEU HBx 1.0 . 3.12 972 895 A 28 LEU HBx A 28 LEU HG 1.0 . 3.39 973 896 A 28 LEU HBx A 28 LEU HG 1.0 . 3.81 974 897 A 28 LEU HDx% A 28 LEU HBx 1.0 . 3.37 975 898 A 28 LEU HDx% A 28 LEU HBx 1.0 . 4.00 976 899 A 28 LEU HDy% A 28 LEU HBx 1.0 . 4.21 977 900 A 28 LEU HBx A 29 LEU H 1.0 . 4.90 978 901 A 28 LEU HBx A 38 ALA H 1.0 . 4.32 979 902 A 28 LEU HBx A 38 ALA H 1.0 . 5.40 980 903 A 40 VAL HGx% A 28 LEU HBx 1.0 . 4.58 981 904 A 28 LEU HDx% A 28 LEU HG 1.0 . 2.68 982 905 A 28 LEU HDy% A 28 LEU HG 1.0 . 3.57 983 906 A 28 LEU HDx% A 28 LEU HG 1.0 . 2.80 984 907 A 28 LEU HDx% A 29 LEU H 1.0 . 4.40 985 908 A 28 LEU HDx% A 29 LEU H 1.0 . 5.50 986 909 A 28 LEU HDy% A 29 LEU H 1.0 . 5.02 987 910 A 29 LEU H A 29 LEU HBy 1.0 . 4.34 988 911 A 29 LEU H A 29 LEU HBy 1.0 . 5.24 989 912 A 29 LEU H A 29 LEU HBx 1.0 . 4.46 990 913 A 29 LEU H A 29 LEU HG 1.0 . 4.37 991 914 A 29 LEU H A 29 LEU HG 1.0 . 4.92 992 915 A 29 LEU HBy A 29 LEU HA 1.0 . 4.13 993 916 A 29 LEU HBy A 29 LEU HA 1.0 . 4.38 994 917 A 29 LEU HBx A 29 LEU HA 1.0 . 4.54 995 918 A 29 LEU HBx A 29 LEU HA 1.0 . 4.59 996 919 A 29 LEU HBx A 29 LEU HA 1.0 . 4.86 997 920 A 29 LEU HA A 29 LEU HDx% 1.0 . 4.51 998 921 A 29 LEU HA A 29 LEU HDx% 1.0 . 5.02 999 922 A 29 LEU HA A 29 LEU HDy% 1.0 . 3.46 1000 923 A 29 LEU HA A 29 LEU HDy% 1.0 . 3.86 1001 924 A 29 LEU HA A 29 LEU HDy% 1.0 . 4.17 1002 925 A 29 LEU HBy A 29 LEU HBx 1.0 . 3.20 1003 926 A 29 LEU HBy A 29 LEU HG 1.0 . 2.41 1004 927 A 29 LEU HBy A 29 LEU HDx% 1.0 . 3.80 1005 928 A 29 LEU HBy A 29 LEU HDx% 1.0 . 3.99 1006 929 A 29 LEU HBy A 29 LEU HDy% 1.0 . 3.69 1007 930 A 29 LEU HBy A 29 LEU HDy% 1.0 . 4.03 1008 931 A 29 LEU HBy A 29 LEU HDy% 1.0 . 4.03 1009 932 A 29 LEU HBy A 29 LEU HDy% 1.0 . 4.11 1010 933 A 29 LEU HBy A 30 ILE H 1.0 . 3.91 1011 934 A 29 LEU HBy A 29 LEU HBx 1.0 . 3.07 1012 935 A 29 LEU HBy A 29 LEU HBx 1.0 . 3.12 1013 936 A 29 LEU HBx A 29 LEU HDx% 1.0 . 3.62 1014 937 A 29 LEU HBx A 29 LEU HDx% 1.0 . 3.74 1015 938 A 29 LEU HBx A 29 LEU HDx% 1.0 . 3.74 1016 939 A 29 LEU HBx A 29 LEU HDy% 1.0 . 3.11 1017 940 A 29 LEU HBx A 29 LEU HDy% 1.0 . 3.16 1018 941 A 29 LEU HBx A 29 LEU HDy% 1.0 . 3.40 1019 942 A 29 LEU HBx A 29 LEU HDy% 1.0 . 4.13 1020 943 A 29 LEU HBx A 30 ILE H 1.0 . 4.25 1021 944 A 29 LEU HBx A 31 LYS H 1.0 . 4.35 1022 945 A 29 LEU HBx A 32 ASP H 1.0 . 5.50 1023 946 A 29 LEU HG A 30 ILE H 1.0 . 4.76 1024 947 A 29 LEU HG A 32 ASP H 1.0 . 4.92 1025 948 A 29 LEU HDx% A 29 LEU HDy% 1.0 . 2.40 1026 949 A 29 LEU HDx% A 30 ILE H 1.0 . 5.50 1027 950 A 29 LEU HG A 29 LEU HDy% 1.0 . 3.36 1028 951 A 29 LEU HG A 29 LEU HDy% 1.0 . 3.70 1029 952 A 29 LEU HDx% A 29 LEU HDy% 1.0 . 2.56 1030 953 A 29 LEU HDy% A 30 ILE H 1.0 . 3.68 1031 954 A 29 LEU HDy% A 30 ILE H 1.0 . 4.49 1032 955 A 29 LEU HDy% A 30 ILE H 1.0 . 5.26 1033 956 A 29 LEU HDy% A 37 PRO HA 1.0 . 4.34 1034 957 A 29 LEU HDy% A 37 PRO HBy 1.0 . 4.10 1035 958 A 29 LEU HDy% A 37 PRO HBy 1.0 . 4.40 1036 959 A 29 LEU HDy% A 37 PRO HBx 1.0 . 4.07 1037 960 A 38 ALA H A 29 LEU HDy% 1.0 . 3.56 1038 961 A 38 ALA H A 29 LEU HDy% 1.0 . 4.33 1039 962 A 30 ILE H A 30 ILE HA 1.0 . 3.85 1040 963 A 30 ILE H A 30 ILE HA 1.0 . 4.01 1041 964 A 30 ILE H A 30 ILE HB 1.0 . 2.98 1042 965 A 30 ILE H A 30 ILE HB 1.0 . 3.52 1043 966 A 30 ILE H A 30 ILE HG1y 1.0 . 3.73 1044 967 A 30 ILE H A 30 ILE HG1y 1.0 . 4.15 1045 968 A 30 ILE H A 30 ILE HG1y 1.0 . 4.15 1046 969 A 30 ILE H A 30 ILE HG1x 1.0 . 3.94 1047 970 A 30 ILE H A 30 ILE HG1x 1.0 . 4.39 1048 971 A 30 ILE H A 30 ILE HD1% 1.0 . 4.70 1049 972 A 30 ILE H A 30 ILE HG2% 1.0 . 4.24 1050 973 A 30 ILE H A 37 PRO HBy 1.0 . 4.23 1051 974 A 30 ILE H A 37 PRO HBy 1.0 . 4.80 1052 975 A 30 ILE HA A 30 ILE HB 1.0 . 4.09 1053 976 A 30 ILE HA A 30 ILE HB 1.0 . 4.18 1054 977 A 30 ILE HA A 30 ILE HG1y 1.0 . 4.65 1055 978 A 30 ILE HA A 30 ILE HG1y 1.0 . 4.65 1056 979 A 30 ILE HA A 30 ILE HG1y 1.0 . 4.70 1057 980 A 30 ILE HA A 30 ILE HG1x 1.0 . 4.09 1058 981 A 30 ILE HA A 30 ILE HG1x 1.0 . 4.42 1059 982 A 30 ILE HA A 30 ILE HD1% 1.0 . 3.96 1060 983 A 30 ILE HA A 30 ILE HD1% 1.0 . 4.51 1061 984 A 30 ILE HA A 30 ILE HG2% 1.0 . 3.45 1062 985 A 30 ILE HA A 30 ILE HG2% 1.0 . 3.63 1063 986 A 31 LYS H A 30 ILE HA 1.0 . 3.61 1064 987 A 30 ILE HA A 33 GLY H 1.0 . 3.83 1065 988 A 30 ILE HA A 34 CYS H 1.0 . 3.80 1066 989 A 30 ILE HA A 34 CYS H 1.0 . 4.54 1067 990 A 30 ILE HB A 30 ILE HG1y 1.0 . 3.96 1068 991 A 30 ILE HB A 30 ILE HG1y 1.0 . 4.02 1069 992 A 30 ILE HB A 30 ILE HG1x 1.0 . 4.27 1070 993 A 30 ILE HB A 30 ILE HG1x 1.0 . 4.38 1071 994 A 30 ILE HB A 30 ILE HD1% 1.0 . 3.81 1072 995 A 30 ILE HB A 30 ILE HD1% 1.0 . 3.96 1073 996 A 30 ILE HB A 30 ILE HG2% 1.0 . 3.27 1074 997 A 31 LYS H A 30 ILE HB 1.0 . 3.36 1075 998 A 30 ILE HG1y A 30 ILE HG1x 1.0 . 2.91 1076 999 A 30 ILE HG1y A 30 ILE HD1% 1.0 . 3.84 1077 1000 A 30 ILE HG1y A 30 ILE HG1x 1.0 . 2.87 1078 1001 A 30 ILE HG1x A 30 ILE HD1% 1.0 . 3.66 1079 1002 A 31 LYS H A 30 ILE HG1x 1.0 . 4.43 1080 1003 A 30 ILE HG1y A 30 ILE HD1% 1.0 . 3.81 1081 1004 A 30 ILE HG1x A 30 ILE HD1% 1.0 . 3.93 1082 1005 A 30 ILE HD1% A 35 ARG HA 1.0 . 3.50 1083 1006 A 30 ILE HD1% A 35 ARG HA 1.0 . 4.85 1084 1007 A 30 ILE HD1% A 36 VAL HA 1.0 . 5.30 1085 1008 A 30 ILE HD1% A 37 PRO HDx 1.0 . 4.52 1086 1009 A 30 ILE HD1% A 37 PRO HGx 1.0 . 4.59 1087 1010 A 30 ILE HB A 30 ILE HG2% 1.0 . 3.32 1088 1011 A 30 ILE HG1y A 30 ILE HG2% 1.0 . 3.72 1089 1012 A 30 ILE HG1y A 30 ILE HG2% 1.0 . 4.82 1090 1013 A 30 ILE HG1x A 30 ILE HG2% 1.0 . 3.71 1091 1014 A 30 ILE HG1x A 30 ILE HG2% 1.0 . 4.32 1092 1015 A 30 ILE HD1% A 30 ILE HG2% 1.0 . 2.40 1093 1016 A 30 ILE HD1% A 30 ILE HG2% 1.0 . 2.40 1094 1017 A 31 LYS H A 30 ILE HG2% 1.0 . 4.08 1095 1018 A 30 ILE HG2% A 33 GLY H 1.0 . 4.83 1096 1019 A 30 ILE HG2% A 33 GLY HAx 1.0 . 5.03 1097 1020 A 31 LYS H A 31 LYS HA 1.0 . 3.96 1098 1021 A 31 LYS H A 31 LYS HGy 1.0 . 4.03 1099 1022 A 31 LYS H A 31 LYS HGy 1.0 . 4.92 1100 1023 A 31 LYS H A 31 LYS HGx 1.0 . 5.20 1101 1024 A 31 LYS H A 31 LYS HB2 1.0 . 4.39 1102 1024 A 31 LYS H A 31 LYS HB3 1.0 . 4.39 1103 1025 A 31 LYS H A 32 ASP H 1.0 . 3.77 1104 1026 A 31 LYS H A 32 ASP H 1.0 . 4.23 1105 1027 A 31 LYS HA A 31 LYS HDy 1.0 . 5.00 1106 1028 A 31 LYS HA A 31 LYS HDy 1.0 . 5.50 1107 1029 A 31 LYS HA A 31 LYS HDx 1.0 . 5.41 1108 1030 A 31 LYS HA A 31 LYS HDx 1.0 . 5.50 1109 1031 A 31 LYS HA A 31 LYS HEy 1.0 . 5.50 1110 1032 A 31 LYS HA A 31 LYS HEy 1.0 . 5.50 1111 1033 A 31 LYS HA A 31 LYS HEx 1.0 . 5.50 1112 1034 A 31 LYS HA A 31 LYS HEx 1.0 . 5.50 1113 1035 A 31 LYS HA A 31 LYS HGy 1.0 . 4.95 1114 1036 A 31 LYS HA A 31 LYS HGy 1.0 . 5.50 1115 1037 A 31 LYS HA A 31 LYS HGx 1.0 . 5.01 1116 1038 A 31 LYS HA A 31 LYS HGx 1.0 . 5.50 1117 1039 A 31 LYS HA A 31 LYS HB2 1.0 . 3.33 1118 1039 A 31 LYS HA A 31 LYS HB3 1.0 . 3.33 1119 1040 A 31 LYS HA A 31 LYS HB2 1.0 . 3.88 1120 1040 A 31 LYS HA A 31 LYS HB3 1.0 . 3.88 1121 1041 A 32 ASP H A 31 LYS HA 1.0 . 4.40 1122 1042 A 32 ASP H A 31 LYS HA 1.0 . 4.64 1123 1043 A 31 LYS HDy A 31 LYS HDx 1.0 . 2.40 1124 1044 A 31 LYS HDy A 31 LYS HEx 1.0 . 3.90 1125 1045 A 31 LYS HDy A 31 LYS HEx 1.0 . 4.13 1126 1046 A 31 LYS HDy A 31 LYS HDx 1.0 . 2.40 1127 1047 A 31 LYS HDx A 31 LYS HEy 1.0 . 4.08 1128 1048 A 31 LYS HDx A 31 LYS HEx 1.0 . 5.13 1129 1049 A 31 LYS HDx A 31 LYS HEx 1.0 . 5.13 1130 1050 A 31 LYS HEy A 31 LYS HEx 1.0 . 2.40 1131 1051 A 31 LYS HEy A 31 LYS HEx 1.0 . 2.40 1132 1052 A 31 LYS HGy A 31 LYS HDy 1.0 . 3.08 1133 1053 A 31 LYS HGy A 31 LYS HDy 1.0 . 3.46 1134 1054 A 31 LYS HGy A 31 LYS HDx 1.0 . 3.49 1135 1055 A 31 LYS HGy A 31 LYS HDx 1.0 . 3.51 1136 1056 A 31 LYS HGy A 31 LYS HEy 1.0 . 4.31 1137 1057 A 31 LYS HGy A 31 LYS HEy 1.0 . 4.74 1138 1058 A 31 LYS HGy A 31 LYS HEx 1.0 . 4.54 1139 1059 A 31 LYS HGy A 31 LYS HEx 1.0 . 5.05 1140 1060 A 31 LYS HGy A 31 LYS HGx 1.0 . 2.63 1141 1061 A 31 LYS HGx A 31 LYS HDy 1.0 . 3.55 1142 1062 A 31 LYS HGx A 31 LYS HDy 1.0 . 3.94 1143 1063 A 31 LYS HGx A 31 LYS HDx 1.0 . 3.76 1144 1064 A 31 LYS HGx A 31 LYS HDx 1.0 . 5.00 1145 1065 A 31 LYS HGx A 31 LYS HEy 1.0 . 4.39 1146 1066 A 31 LYS HGx A 31 LYS HEy 1.0 . 4.94 1147 1067 A 31 LYS HGx A 31 LYS HEx 1.0 . 4.72 1148 1068 A 31 LYS HGx A 31 LYS HEx 1.0 . 5.07 1149 1069 A 31 LYS HGy A 31 LYS HGx 1.0 . 2.41 1150 1070 A 32 ASP H A 31 LYS HGx 1.0 . 4.87 1151 1071 A 31 LYS HDy A 31 LYS HB2 1.0 . 3.43 1152 1071 A 31 LYS HB3 A 31 LYS HDy 1.0 . 3.43 1153 1072 A 31 LYS HDy A 31 LYS HB2 1.0 . 4.57 1154 1072 A 31 LYS HB3 A 31 LYS HDy 1.0 . 4.57 1155 1073 A 31 LYS HDx A 31 LYS HB2 1.0 . 4.10 1156 1073 A 31 LYS HB3 A 31 LYS HDx 1.0 . 4.10 1157 1074 A 31 LYS HDx A 31 LYS HB2 1.0 . 4.50 1158 1074 A 31 LYS HB3 A 31 LYS HDx 1.0 . 4.50 1159 1075 A 31 LYS HEy A 31 LYS HB2 1.0 . 5.19 1160 1075 A 31 LYS HB3 A 31 LYS HEy 1.0 . 5.19 1161 1076 A 31 LYS HEy A 31 LYS HB2 1.0 . 5.50 1162 1076 A 31 LYS HB3 A 31 LYS HEy 1.0 . 5.50 1163 1077 A 31 LYS HEx A 31 LYS HB2 1.0 . 5.30 1164 1077 A 31 LYS HB3 A 31 LYS HEx 1.0 . 5.30 1165 1078 A 31 LYS HEx A 31 LYS HB2 1.0 . 5.50 1166 1078 A 31 LYS HB3 A 31 LYS HEx 1.0 . 5.50 1167 1079 A 31 LYS HGy A 31 LYS HB2 1.0 . 4.12 1168 1079 A 31 LYS HGy A 31 LYS HB3 1.0 . 4.12 1169 1080 A 31 LYS HGy A 31 LYS HB2 1.0 . 4.30 1170 1080 A 31 LYS HGy A 31 LYS HB3 1.0 . 4.30 1171 1081 A 31 LYS HGx A 31 LYS HB2 1.0 . 4.08 1172 1081 A 31 LYS HGx A 31 LYS HB3 1.0 . 4.08 1173 1082 A 31 LYS HGx A 31 LYS HB2 1.0 . 4.37 1174 1082 A 31 LYS HGx A 31 LYS HB3 1.0 . 4.37 1175 1083 A 32 ASP H A 31 LYS HB2 1.0 . 4.63 1176 1083 A 32 ASP H A 31 LYS HB3 1.0 . 4.63 1177 1084 A 32 ASP H A 32 ASP HA 1.0 . 4.43 1178 1085 A 32 ASP HBx A 32 ASP H 1.0 . 4.06 1179 1086 A 32 ASP HBx A 32 ASP H 1.0 . 5.05 1180 1087 A 32 ASP H A 32 ASP HBy 1.0 . 4.40 1181 1088 A 32 ASP H A 32 ASP HBy 1.0 . 4.69 1182 1089 A 32 ASP H A 33 GLY H 1.0 . 3.70 1183 1090 A 32 ASP HBx A 32 ASP HA 1.0 . 5.50 1184 1091 A 32 ASP HA A 32 ASP HBy 1.0 . 4.48 1185 1092 A 32 ASP HA A 32 ASP HBy 1.0 . 5.47 1186 1093 A 33 GLY H A 32 ASP HA 1.0 . 4.17 1187 1094 A 32 ASP HBx A 33 GLY H 1.0 . 4.76 1188 1095 A 33 GLY H A 33 GLY HAy 1.0 . 4.00 1189 1096 A 33 GLY H A 33 GLY HAx 1.0 . 3.65 1190 1097 A 33 GLY H A 33 GLY HAx 1.0 . 3.75 1191 1098 A 33 GLY H A 34 CYS H 1.0 . 3.57 1192 1099 A 33 GLY H A 34 CYS H 1.0 . 3.75 1193 1100 A 33 GLY HAx A 33 GLY HAy 1.0 . 3.05 1194 1101 A 34 CYS H A 33 GLY HAy 1.0 . 4.93 1195 1102 A 33 GLY HAx A 33 GLY HAy 1.0 . 3.05 1196 1103 A 34 CYS H A 33 GLY HAx 1.0 . 4.46 1197 1104 A 34 CYS H A 33 GLY HAx 1.0 . 4.78 1198 1105 A 34 CYS H A 34 CYS HA 1.0 . 4.01 1199 1106 A 34 CYS H A 34 CYS HA 1.0 . 4.64 1200 1107 A 34 CYS H A 34 CYS HBy 1.0 . 4.36 1201 1108 A 34 CYS H A 34 CYS HBy 1.0 . 4.68 1202 1109 A 34 CYS H A 34 CYS HBx 1.0 . 3.79 1203 1110 A 34 CYS H A 34 CYS HBx 1.0 . 4.52 1204 1111 A 34 CYS HA A 34 CYS HBy 1.0 . 3.96 1205 1112 A 34 CYS HA A 34 CYS HBy 1.0 . 4.00 1206 1113 A 34 CYS HA A 34 CYS HBx 1.0 . 4.53 1207 1114 A 34 CYS HA A 34 CYS HBx 1.0 . 4.58 1208 1115 A 34 CYS HA A 35 ARG H 1.0 . 3.23 1209 1116 A 34 CYS HA A 35 ARG H 1.0 . 3.42 1210 1117 A 34 CYS HBy A 34 CYS HBx 1.0 . 3.25 1211 1118 A 34 CYS HBy A 35 ARG H 1.0 . 4.13 1212 1119 A 34 CYS HBy A 35 ARG H 1.0 . 4.65 1213 1120 A 34 CYS HBy A 36 VAL H 1.0 . 4.79 1214 1121 A 34 CYS HBy A 36 VAL H 1.0 . 4.88 1215 1122 A 34 CYS HBy A 34 CYS HBx 1.0 . 3.19 1216 1123 A 34 CYS HBx A 35 ARG H 1.0 . 4.80 1217 1124 A 34 CYS HBx A 35 ARG H 1.0 . 5.19 1218 1125 A 34 CYS HBx A 36 VAL H 1.0 . 5.42 1219 1126 A 35 ARG HA A 35 ARG H 1.0 . 3.92 1220 1127 A 35 ARG HA A 35 ARG H 1.0 . 4.18 1221 1128 A 35 ARG H A 35 ARG HB2 1.0 . 3.48 1222 1128 A 35 ARG H A 35 ARG HB3 1.0 . 3.48 1223 1129 A 35 ARG H A 35 ARG HB2 1.0 . 3.98 1224 1129 A 35 ARG H A 35 ARG HB3 1.0 . 3.98 1225 1130 A 35 ARG H A 35 ARG HB2 1.0 . 3.98 1226 1130 A 35 ARG H A 35 ARG HB3 1.0 . 3.98 1227 1131 A 35 ARG H A 35 ARG HG2 1.0 . 4.16 1228 1131 A 35 ARG H A 35 ARG HG3 1.0 . 4.16 1229 1132 A 35 ARG H A 35 ARG HG2 1.0 . 4.60 1230 1132 A 35 ARG H A 35 ARG HG3 1.0 . 4.60 1231 1133 A 35 ARG H A 36 VAL H 1.0 . 3.60 1232 1134 A 35 ARG H A 36 VAL H 1.0 . 3.90 1233 1135 A 35 ARG HA A 35 ARG HB2 1.0 . 3.41 1234 1135 A 35 ARG HA A 35 ARG HB3 1.0 . 3.41 1235 1136 A 35 ARG HA A 35 ARG HB2 1.0 . 3.59 1236 1136 A 35 ARG HA A 35 ARG HB3 1.0 . 3.59 1237 1137 A 35 ARG HA A 35 ARG HB2 1.0 . 4.00 1238 1137 A 35 ARG HA A 35 ARG HB3 1.0 . 4.00 1239 1138 A 35 ARG HA A 35 ARG HD2 1.0 . 5.12 1240 1138 A 35 ARG HA A 35 ARG HD3 1.0 . 5.12 1241 1139 A 35 ARG HA A 35 ARG HD2 1.0 . 5.50 1242 1139 A 35 ARG HA A 35 ARG HD3 1.0 . 5.50 1243 1140 A 35 ARG HA A 35 ARG HG2 1.0 . 4.22 1244 1140 A 35 ARG HA A 35 ARG HG3 1.0 . 4.22 1245 1141 A 35 ARG HA A 35 ARG HG2 1.0 . 4.61 1246 1141 A 35 ARG HA A 35 ARG HG3 1.0 . 4.61 1247 1142 A 35 ARG HA A 36 VAL H 1.0 . 4.60 1248 1143 A 35 ARG HA A 36 VAL H 1.0 . 4.60 1249 1144 A 35 ARG HB3 A 35 ARG HD2 1.0 . 3.64 1250 1144 A 35 ARG HB2 A 35 ARG HD2 1.0 . 3.64 1251 1144 A 35 ARG HD3 A 35 ARG HB2 1.0 . 3.64 1252 1144 A 35 ARG HB3 A 35 ARG HD3 1.0 . 3.64 1253 1145 A 35 ARG HB2 A 35 ARG HD2 1.0 . 4.01 1254 1145 A 35 ARG HD3 A 35 ARG HB2 1.0 . 4.01 1255 1145 A 35 ARG HB3 A 35 ARG HD3 1.0 . 4.01 1256 1145 A 35 ARG HB3 A 35 ARG HD2 1.0 . 4.01 1257 1146 A 35 ARG HB3 A 35 ARG HD2 1.0 . 4.03 1258 1146 A 35 ARG HB2 A 35 ARG HD2 1.0 . 4.03 1259 1146 A 35 ARG HD3 A 35 ARG HB2 1.0 . 4.03 1260 1146 A 35 ARG HB3 A 35 ARG HD3 1.0 . 4.03 1261 1147 A 35 ARG HB3 A 35 ARG HD2 1.0 . 4.03 1262 1147 A 35 ARG HB2 A 35 ARG HD2 1.0 . 4.03 1263 1147 A 35 ARG HD3 A 35 ARG HB2 1.0 . 4.03 1264 1147 A 35 ARG HB3 A 35 ARG HD3 1.0 . 4.03 1265 1148 A 35 ARG HB3 A 35 ARG HD2 1.0 . 4.03 1266 1148 A 35 ARG HB2 A 35 ARG HD2 1.0 . 4.03 1267 1148 A 35 ARG HD3 A 35 ARG HB2 1.0 . 4.03 1268 1148 A 35 ARG HB3 A 35 ARG HD3 1.0 . 4.03 1269 1149 A 35 ARG HB3 A 35 ARG HG2 1.0 . 2.42 1270 1149 A 35 ARG HB2 A 35 ARG HG2 1.0 . 2.42 1271 1149 A 35 ARG HG3 A 35 ARG HB2 1.0 . 2.42 1272 1149 A 35 ARG HB3 A 35 ARG HG3 1.0 . 2.42 1273 1150 A 35 ARG HB3 A 35 ARG HG2 1.0 . 2.57 1274 1150 A 35 ARG HB2 A 35 ARG HG2 1.0 . 2.57 1275 1150 A 35 ARG HG3 A 35 ARG HB2 1.0 . 2.57 1276 1150 A 35 ARG HB3 A 35 ARG HG3 1.0 . 2.57 1277 1151 A 35 ARG HB3 A 35 ARG HG2 1.0 . 2.68 1278 1151 A 35 ARG HG3 A 35 ARG HB2 1.0 . 2.68 1279 1151 A 35 ARG HB3 A 35 ARG HG3 1.0 . 2.68 1280 1151 A 35 ARG HB2 A 35 ARG HG2 1.0 . 2.68 1281 1152 A 35 ARG HB3 A 35 ARG HG2 1.0 . 2.68 1282 1152 A 35 ARG HG3 A 35 ARG HB2 1.0 . 2.68 1283 1152 A 35 ARG HB3 A 35 ARG HG3 1.0 . 2.68 1284 1152 A 35 ARG HB2 A 35 ARG HG2 1.0 . 2.68 1285 1153 A 35 ARG HB3 A 35 ARG HG2 1.0 . 2.71 1286 1153 A 35 ARG HG3 A 35 ARG HB2 1.0 . 2.71 1287 1153 A 35 ARG HB3 A 35 ARG HG3 1.0 . 2.71 1288 1153 A 35 ARG HB2 A 35 ARG HG2 1.0 . 2.71 1289 1154 A 35 ARG HB3 A 35 ARG HG2 1.0 . 2.74 1290 1154 A 35 ARG HB2 A 35 ARG HG2 1.0 . 2.74 1291 1154 A 35 ARG HG3 A 35 ARG HB2 1.0 . 2.74 1292 1154 A 35 ARG HB3 A 35 ARG HG3 1.0 . 2.74 1293 1155 A 36 VAL H A 35 ARG HB2 1.0 . 4.72 1294 1155 A 36 VAL H A 35 ARG HB3 1.0 . 4.72 1295 1156 A 35 ARG HD3 A 35 ARG HG2 1.0 . 3.08 1296 1156 A 35 ARG HD2 A 35 ARG HG2 1.0 . 3.08 1297 1156 A 35 ARG HG3 A 35 ARG HD2 1.0 . 3.08 1298 1156 A 35 ARG HG3 A 35 ARG HD3 1.0 . 3.08 1299 1157 A 35 ARG HD3 A 35 ARG HG2 1.0 . 3.31 1300 1157 A 35 ARG HD2 A 35 ARG HG2 1.0 . 3.31 1301 1157 A 35 ARG HG3 A 35 ARG HD2 1.0 . 3.31 1302 1157 A 35 ARG HG3 A 35 ARG HD3 1.0 . 3.31 1303 1158 A 35 ARG HD2 A 35 ARG HG2 1.0 . 3.78 1304 1158 A 35 ARG HD3 A 35 ARG HG2 1.0 . 3.78 1305 1158 A 35 ARG HG3 A 35 ARG HD2 1.0 . 3.78 1306 1158 A 35 ARG HG3 A 35 ARG HD3 1.0 . 3.78 1307 1159 A 35 ARG HD2 A 35 ARG HG2 1.0 . 4.00 1308 1159 A 35 ARG HD3 A 35 ARG HG2 1.0 . 4.00 1309 1159 A 35 ARG HG3 A 35 ARG HD2 1.0 . 4.00 1310 1159 A 35 ARG HG3 A 35 ARG HD3 1.0 . 4.00 1311 1160 A 36 VAL HA A 36 VAL H 1.0 . 4.41 1312 1161 A 36 VAL HA A 36 VAL H 1.0 . 4.41 1313 1162 A 36 VAL H A 36 VAL HB 1.0 . 3.91 1314 1163 A 36 VAL HGx% A 36 VAL H 1.0 . 3.88 1315 1164 A 36 VAL HGx% A 36 VAL H 1.0 . 4.21 1316 1165 A 36 VAL HGy% A 36 VAL H 1.0 . 5.13 1317 1166 A 36 VAL HA A 36 VAL HB 1.0 . 4.26 1318 1167 A 36 VAL HA A 36 VAL HB 1.0 . 4.46 1319 1168 A 36 VAL HGx% A 36 VAL HA 1.0 . 3.55 1320 1169 A 36 VAL HGx% A 36 VAL HA 1.0 . 3.69 1321 1170 A 36 VAL HGy% A 36 VAL HA 1.0 . 3.65 1322 1171 A 36 VAL HGy% A 36 VAL HA 1.0 . 3.65 1323 1172 A 36 VAL HA A 37 PRO HDy 1.0 . 3.35 1324 1173 A 36 VAL HGx% A 36 VAL HB 1.0 . 3.28 1325 1174 A 36 VAL HGy% A 36 VAL HB 1.0 . 3.33 1326 1175 A 36 VAL HB A 37 PRO HDy 1.0 . 4.98 1327 1176 A 36 VAL HGx% A 36 VAL HB 1.0 . 3.54 1328 1177 A 36 VAL HGx% A 36 VAL HGy% 1.0 . 2.40 1329 1178 A 36 VAL HGx% A 37 PRO HDy 1.0 . 5.06 1330 1179 A 36 VAL HGy% A 36 VAL HB 1.0 . 3.48 1331 1180 A 36 VAL HGx% A 36 VAL HGy% 1.0 . 2.81 1332 1181 A 36 VAL HGy% A 37 PRO HDy 1.0 . 4.13 1333 1182 A 37 PRO HA A 37 PRO HBy 1.0 . 3.89 1334 1183 A 37 PRO HA A 37 PRO HBx 1.0 . 4.24 1335 1184 A 37 PRO HA A 37 PRO HDy 1.0 . 5.50 1336 1185 A 37 PRO HA A 37 PRO HDx 1.0 . 5.19 1337 1186 A 37 PRO HA A 37 PRO HGy 1.0 . 5.43 1338 1187 A 37 PRO HA A 37 PRO HGx 1.0 . 5.24 1339 1188 A 38 ALA H A 37 PRO HA 1.0 . 3.11 1340 1189 A 38 ALA H A 37 PRO HA 1.0 . 3.35 1341 1190 A 37 PRO HA A 37 PRO HBy 1.0 . 3.73 1342 1191 A 37 PRO HBy A 37 PRO HBx 1.0 . 2.96 1343 1192 A 37 PRO HBy A 37 PRO HDy 1.0 . 4.95 1344 1193 A 37 PRO HBy A 37 PRO HDx 1.0 . 4.69 1345 1194 A 37 PRO HBy A 37 PRO HGy 1.0 . 3.18 1346 1195 A 37 PRO HBy A 37 PRO HGy 1.0 . 3.22 1347 1196 A 37 PRO HBy A 37 PRO HGx 1.0 . 3.57 1348 1197 A 38 ALA H A 37 PRO HBy 1.0 . 4.07 1349 1198 A 38 ALA H A 37 PRO HBy 1.0 . 4.87 1350 1199 A 37 PRO HA A 37 PRO HBx 1.0 . 4.10 1351 1200 A 37 PRO HBy A 37 PRO HBx 1.0 . 2.99 1352 1201 A 37 PRO HBx A 37 PRO HDy 1.0 . 4.60 1353 1202 A 37 PRO HBx A 37 PRO HDx 1.0 . 3.81 1354 1203 A 37 PRO HBx A 37 PRO HGy 1.0 . 3.45 1355 1204 A 37 PRO HBx A 37 PRO HGx 1.0 . 3.23 1356 1205 A 38 ALA H A 37 PRO HBx 1.0 . 4.83 1357 1206 A 37 PRO HA A 37 PRO HDy 1.0 . 4.30 1358 1207 A 37 PRO HBy A 37 PRO HDy 1.0 . 4.62 1359 1208 A 37 PRO HBx A 37 PRO HDy 1.0 . 4.57 1360 1209 A 37 PRO HDx A 37 PRO HDy 1.0 . 2.71 1361 1210 A 37 PRO HDy A 37 PRO HGy 1.0 . 3.88 1362 1211 A 37 PRO HGx A 37 PRO HDy 1.0 . 3.83 1363 1212 A 37 PRO HA A 37 PRO HDx 1.0 . 4.24 1364 1213 A 37 PRO HBy A 37 PRO HDx 1.0 . 4.58 1365 1214 A 37 PRO HBx A 37 PRO HDx 1.0 . 4.54 1366 1215 A 37 PRO HDx A 37 PRO HDy 1.0 . 2.78 1367 1216 A 37 PRO HDx A 37 PRO HGy 1.0 . 3.92 1368 1217 A 37 PRO HDx A 37 PRO HGx 1.0 . 3.80 1369 1218 A 37 PRO HBy A 37 PRO HGy 1.0 . 3.99 1370 1219 A 37 PRO HBx A 37 PRO HGy 1.0 . 3.32 1371 1220 A 37 PRO HDy A 37 PRO HGy 1.0 . 4.06 1372 1221 A 37 PRO HDx A 37 PRO HGy 1.0 . 3.94 1373 1222 A 37 PRO HGx A 37 PRO HGy 1.0 . 2.86 1374 1223 A 37 PRO HA A 37 PRO HGx 1.0 . 4.81 1375 1224 A 37 PRO HBy A 37 PRO HGx 1.0 . 3.57 1376 1225 A 37 PRO HBx A 37 PRO HGx 1.0 . 3.35 1377 1226 A 37 PRO HGx A 37 PRO HDy 1.0 . 4.02 1378 1227 A 37 PRO HDx A 37 PRO HGx 1.0 . 3.51 1379 1228 A 37 PRO HDx A 37 PRO HGx 1.0 . 3.51 1380 1229 A 37 PRO HGx A 37 PRO HGy 1.0 . 2.79 1381 1230 A 38 ALA HA A 38 ALA H 1.0 . 3.81 1382 1231 A 38 ALA HB% A 38 ALA H 1.0 . 3.55 1383 1232 A 38 ALA HB% A 38 ALA H 1.0 . 3.97 1384 1233 A 38 ALA HB% A 38 ALA HA 1.0 . 3.24 1385 1234 A 38 ALA HA A 39 VAL H 1.0 . 3.23 1386 1235 A 38 ALA HA A 53 PRO HGx 1.0 . 5.00 1387 1236 A 38 ALA HA A 53 PRO HB2 1.0 . 5.50 1388 1236 A 38 ALA HA A 53 PRO HB3 1.0 . 5.50 1389 1237 A 38 ALA HB% A 38 ALA HA 1.0 . 5.50 1390 1238 A 38 ALA HB% A 39 VAL H 1.0 . 3.41 1391 1239 A 38 ALA HB% A 39 VAL H 1.0 . 3.57 1392 1240 A 38 ALA HB% A 50 CYS HA 1.0 . 4.86 1393 1241 A 38 ALA HB% A 50 CYS HA 1.0 . 5.04 1394 1242 A 38 ALA HB% A 50 CYS HBy 1.0 . 4.99 1395 1243 A 38 ALA HB% A 50 CYS HBx 1.0 . 4.49 1396 1244 A 38 ALA HB% A 51 ALA H 1.0 . 4.18 1397 1245 A 38 ALA HB% A 51 ALA H 1.0 . 4.38 1398 1246 A 38 ALA HB% A 53 PRO HDy 1.0 . 4.84 1399 1247 A 38 ALA HB% A 53 PRO HDy 1.0 . 4.99 1400 1248 A 39 VAL H A 39 VAL HA 1.0 . 4.03 1401 1249 A 39 VAL H A 39 VAL HA 1.0 . 4.50 1402 1250 A 39 VAL H A 39 VAL HB 1.0 . 3.65 1403 1251 A 39 VAL H A 39 VAL HB 1.0 . 3.96 1404 1252 A 39 VAL H A 39 VAL HGx% 1.0 . 4.07 1405 1253 A 39 VAL H A 39 VAL HGx% 1.0 . 4.34 1406 1254 A 39 VAL H A 39 VAL HGy% 1.0 . 4.37 1407 1255 A 39 VAL H A 39 VAL HGy% 1.0 . 5.14 1408 1256 A 39 VAL H A 51 ALA H 1.0 . 4.12 1409 1257 A 39 VAL H A 51 ALA H 1.0 . 4.15 1410 1258 A 39 VAL H A 51 ALA HB% 1.0 . 5.02 1411 1259 A 39 VAL H A 53 PRO HDy 1.0 . 4.51 1412 1260 A 39 VAL H A 53 PRO HDy 1.0 . 4.71 1413 1261 A 39 VAL H A 53 PRO HDx 1.0 . 5.42 1414 1262 A 39 VAL HA A 39 VAL HB 1.0 . 4.39 1415 1263 A 39 VAL HA A 39 VAL HB 1.0 . 4.48 1416 1264 A 39 VAL HGx% A 39 VAL HA 1.0 . 3.63 1417 1265 A 39 VAL HGx% A 39 VAL HA 1.0 . 3.93 1418 1266 A 39 VAL HGy% A 39 VAL HA 1.0 . 4.01 1419 1267 A 39 VAL HGy% A 39 VAL HA 1.0 . 4.27 1420 1268 A 39 VAL HA A 40 VAL H 1.0 . 3.09 1421 1269 A 39 VAL HA A 40 VAL H 1.0 . 3.44 1422 1270 A 51 ALA H A 39 VAL HA 1.0 . 5.19 1423 1271 A 39 VAL HGx% A 39 VAL HB 1.0 . 3.85 1424 1272 A 39 VAL HGy% A 39 VAL HB 1.0 . 4.06 1425 1273 A 51 ALA H A 39 VAL HB 1.0 . 5.36 1426 1274 A 39 VAL HB A 58 VAL HGx% 1.0 . 4.42 1427 1275 A 39 VAL HGx% A 39 VAL HB 1.0 . 3.78 1428 1276 A 39 VAL HGy% A 39 VAL HGx% 1.0 . 3.56 1429 1277 A 39 VAL HGx% A 40 VAL H 1.0 . 4.35 1430 1278 A 39 VAL HGx% A 40 VAL H 1.0 . 4.76 1431 1279 A 39 VAL HGx% A 53 PRO HA 1.0 . 3.61 1432 1280 A 39 VAL HGx% A 53 PRO HGx 1.0 . 4.99 1433 1281 A 39 VAL HGx% A 53 PRO HB2 1.0 . 4.21 1434 1281 A 39 VAL HGx% A 53 PRO HB3 1.0 . 4.21 1435 1282 A 39 VAL HGy% A 39 VAL HB 1.0 . 3.70 1436 1283 A 39 VAL HGy% A 39 VAL HGx% 1.0 . 3.34 1437 1284 A 39 VAL HGy% A 40 VAL H 1.0 . 3.78 1438 1285 A 39 VAL HGy% A 40 VAL H 1.0 . 4.57 1439 1286 A 51 ALA H A 39 VAL HGy% 1.0 . 5.00 1440 1287 A 39 VAL HGy% A 53 PRO HA 1.0 . 5.02 1441 1288 A 39 VAL HGy% A 62 ILE HD1% 1.0 . 3.58 1442 1289 A 40 VAL H A 40 VAL HB 1.0 . 3.55 1443 1290 A 40 VAL H A 40 VAL HB 1.0 . 4.26 1444 1291 A 40 VAL H A 40 VAL HGx% 1.0 . 3.60 1445 1292 A 40 VAL H A 40 VAL HGx% 1.0 . 3.97 1446 1293 A 40 VAL H A 40 VAL HGy% 1.0 . 4.75 1447 1294 A 40 VAL HB A 40 VAL HA 1.0 . 4.81 1448 1295 A 40 VAL HB A 40 VAL HA 1.0 . 5.50 1449 1296 A 40 VAL HGx% A 40 VAL HA 1.0 . 3.75 1450 1297 A 40 VAL HGx% A 40 VAL HA 1.0 . 5.50 1451 1298 A 40 VAL HGy% A 40 VAL HA 1.0 . 3.88 1452 1299 A 40 VAL HGy% A 40 VAL HA 1.0 . 5.50 1453 1300 A 40 VAL HA A 41 PHE H 1.0 . 3.17 1454 1301 A 40 VAL HA A 49 LEU H 1.0 . 4.96 1455 1302 A 50 CYS HA A 40 VAL HA 1.0 . 4.20 1456 1303 A 51 ALA H A 40 VAL HA 1.0 . 4.54 1457 1304 A 40 VAL HB A 40 VAL HGx% 1.0 . 3.02 1458 1305 A 40 VAL HB A 40 VAL HGy% 1.0 . 3.20 1459 1306 A 40 VAL HB A 41 PHE H 1.0 . 4.92 1460 1307 A 40 VAL HB A 40 VAL HGx% 1.0 . 3.55 1461 1308 A 40 VAL HGx% A 40 VAL HGy% 1.0 . 2.40 1462 1309 A 40 VAL HGx% A 41 PHE H 1.0 . 4.87 1463 1310 A 40 VAL HGx% A 48 GLN HBx 1.0 . 4.89 1464 1311 A 50 CYS H A 40 VAL HGx% 1.0 . 4.74 1465 1312 A 50 CYS HA A 40 VAL HGx% 1.0 . 4.64 1466 1313 A 50 CYS HA A 40 VAL HGx% 1.0 . 4.75 1467 1314 A 40 VAL HB A 40 VAL HGy% 1.0 . 3.57 1468 1315 A 40 VAL HGx% A 40 VAL HGy% 1.0 . 2.40 1469 1316 A 40 VAL HGy% A 41 PHE H 1.0 . 3.73 1470 1317 A 40 VAL HGy% A 41 PHE H 1.0 . 4.13 1471 1318 A 40 VAL HGy% A 48 GLN HA 1.0 . 5.48 1472 1319 A 40 VAL HGy% A 48 GLN HBy 1.0 . 4.72 1473 1320 A 40 VAL HGy% A 48 GLN HBy 1.0 . 4.95 1474 1321 A 40 VAL HGy% A 48 GLN HBx 1.0 . 3.80 1475 1322 A 40 VAL HGy% A 48 GLN HBx 1.0 . 3.95 1476 1323 A 40 VAL HGy% A 48 GLN HBx 1.0 . 4.70 1477 1324 A 40 VAL HGy% A 48 GLN HGx 1.0 . 4.65 1478 1325 A 40 VAL HGy% A 49 LEU H 1.0 . 4.20 1479 1326 A 40 VAL HGy% A 49 LEU H 1.0 . 4.42 1480 1327 A 41 PHE HA A 41 PHE H 1.0 . 4.20 1481 1328 A 41 PHE HA A 41 PHE H 1.0 . 4.59 1482 1329 A 41 PHE HBy A 41 PHE H 1.0 . 4.25 1483 1330 A 41 PHE HBy A 41 PHE H 1.0 . 4.62 1484 1331 A 41 PHE HBx A 41 PHE H 1.0 . 3.75 1485 1332 A 41 PHE HBx A 41 PHE H 1.0 . 4.08 1486 1333 A 41 PHE HD% A 41 PHE H 1.0 . 4.63 1487 1334 A 41 PHE H A 49 LEU HB2 1.0 . 4.59 1488 1334 A 49 LEU HB3 A 41 PHE H 1.0 . 4.59 1489 1335 A 50 CYS HA A 41 PHE H 1.0 . 5.22 1490 1336 A 41 PHE HA A 41 PHE HBy 1.0 . 4.21 1491 1337 A 41 PHE HA A 41 PHE HBy 1.0 . 4.45 1492 1338 A 41 PHE HBx A 41 PHE HA 1.0 . 4.40 1493 1339 A 41 PHE HBx A 41 PHE HA 1.0 . 4.82 1494 1340 A 41 PHE HD% A 41 PHE HA 1.0 . 3.49 1495 1341 A 41 PHE HD% A 41 PHE HA 1.0 . 3.84 1496 1342 A 41 PHE HA A 41 PHE HE% 1.0 . 4.28 1497 1343 A 42 THR H A 41 PHE HA 1.0 . 3.25 1498 1344 A 42 THR H A 41 PHE HA 1.0 . 3.56 1499 1345 A 41 PHE HBx A 41 PHE HBy 1.0 . 3.27 1500 1346 A 41 PHE HD% A 41 PHE HBy 1.0 . 4.03 1501 1347 A 42 THR H A 41 PHE HBy 1.0 . 4.52 1502 1348 A 42 THR H A 41 PHE HBy 1.0 . 5.10 1503 1349 A 41 PHE HBy A 49 LEU HB2 1.0 . 4.90 1504 1349 A 49 LEU HB3 A 41 PHE HBy 1.0 . 4.90 1505 1350 A 41 PHE HBx A 41 PHE HBy 1.0 . 3.19 1506 1351 A 41 PHE HBx A 42 THR H 1.0 . 5.10 1507 1352 A 41 PHE HBx A 49 LEU H 1.0 . 4.86 1508 1353 A 41 PHE HBx A 49 LEU HB2 1.0 . 4.40 1509 1353 A 41 PHE HBx A 49 LEU HB3 1.0 . 4.40 1510 1354 A 41 PHE HBx A 49 LEU HB2 1.0 . 4.48 1511 1354 A 41 PHE HBx A 49 LEU HB3 1.0 . 4.48 1512 1355 A 41 PHE HZ A 58 VAL HA 1.0 . 4.29 1513 1356 A 41 PHE HZ A 58 VAL HA 1.0 . 4.39 1514 1357 A 58 VAL HGx% A 41 PHE HZ 1.0 . 3.88 1515 1358 A 58 VAL HGx% A 41 PHE HZ 1.0 . 3.97 1516 1359 A 58 VAL HGy% A 41 PHE HZ 1.0 . 4.55 1517 1360 A 61 ILE HB A 41 PHE HZ 1.0 . 4.13 1518 1361 A 61 ILE HG1x A 41 PHE HZ 1.0 . 4.82 1519 1362 A 61 ILE HD1% A 41 PHE HZ 1.0 . 4.23 1520 1363 A 61 ILE HD1% A 41 PHE HZ 1.0 . 4.43 1521 1364 A 61 ILE HD1% A 41 PHE HZ 1.0 . 4.61 1522 1365 A 62 ILE HG1y A 41 PHE HZ 1.0 . 4.93 1523 1366 A 62 ILE HG1y A 41 PHE HZ 1.0 . 4.93 1524 1367 A 41 PHE HZ A 62 ILE HG1x 1.0 . 5.50 1525 1368 A 41 PHE HD% A 41 PHE HBy 1.0 . 4.48 1526 1369 A 41 PHE HBx A 41 PHE HD% 1.0 . 4.33 1527 1370 A 41 PHE HD% A 41 PHE HE% 1.0 . 2.74 1528 1371 A 41 PHE HD% A 42 THR H 1.0 . 4.22 1529 1372 A 41 PHE HD% A 49 LEU HB2 1.0 . 5.50 1530 1372 A 41 PHE HD% A 49 LEU HB3 1.0 . 5.50 1531 1373 A 51 ALA HB% A 41 PHE HD% 1.0 . 3.82 1532 1374 A 58 VAL HGy% A 41 PHE HD% 1.0 . 5.39 1533 1375 A 41 PHE HD% A 65 LEU HD1% 1.0 . 4.47 1534 1376 A 41 PHE HE% A 41 PHE HZ 1.0 . 3.39 1535 1377 A 41 PHE HD% A 41 PHE HE% 1.0 . 2.70 1536 1378 A 51 ALA HB% A 41 PHE HE% 1.0 . 4.00 1537 1379 A 51 ALA HB% A 41 PHE HE% 1.0 . 4.03 1538 1380 A 57 TRP HH2 A 41 PHE HE% 1.0 . 3.20 1539 1381 A 57 TRP HZ2 A 41 PHE HE% 1.0 . 4.34 1540 1382 A 41 PHE HE% A 58 VAL HA 1.0 . 4.49 1541 1383 A 41 PHE HE% A 58 VAL HA 1.0 . 5.01 1542 1384 A 41 PHE HE% A 58 VAL HGx% 1.0 . 4.42 1543 1385 A 58 VAL HGy% A 41 PHE HE% 1.0 . 4.44 1544 1386 A 58 VAL HGy% A 41 PHE HE% 1.0 . 4.56 1545 1387 A 61 ILE HD1% A 41 PHE HE% 1.0 . 3.71 1546 1388 A 61 ILE HD1% A 41 PHE HE% 1.0 . 3.89 1547 1389 A 61 ILE HD1% A 41 PHE HE% 1.0 . 4.19 1548 1390 A 41 PHE HE% A 62 ILE HG1y 1.0 . 5.15 1549 1391 A 41 PHE HE% A 62 ILE HG1y 1.0 . 5.15 1550 1392 A 41 PHE HE% A 62 ILE HG1x 1.0 . 5.45 1551 1393 A 42 THR H A 42 THR HA 1.0 . 4.10 1552 1394 A 42 THR H A 42 THR HA 1.0 . 4.65 1553 1395 A 42 THR H A 42 THR HB 1.0 . 3.61 1554 1396 A 42 THR H A 42 THR HB 1.0 . 4.01 1555 1397 A 42 THR H A 42 THR HG2% 1.0 . 4.62 1556 1398 A 42 THR H A 42 THR HG2% 1.0 . 4.71 1557 1399 A 42 THR H A 43 THR H 1.0 . 5.12 1558 1400 A 42 THR HB A 42 THR HA 1.0 . 4.40 1559 1401 A 42 THR HB A 42 THR HA 1.0 . 4.56 1560 1402 A 42 THR HG2% A 42 THR HA 1.0 . 3.63 1561 1403 A 42 THR HG2% A 42 THR HA 1.0 . 3.88 1562 1404 A 42 THR HA A 43 THR H 1.0 . 3.03 1563 1405 A 42 THR HA A 43 THR H 1.0 . 3.41 1564 1406 A 42 THR HA A 47 ARG H 1.0 . 5.21 1565 1407 A 48 GLN HGx A 42 THR HA 1.0 . 4.59 1566 1408 A 48 GLN HGx A 42 THR HA 1.0 . 5.09 1567 1409 A 49 LEU H A 42 THR HA 1.0 . 4.94 1568 1410 A 42 THR HB A 42 THR HG2% 1.0 . 3.37 1569 1411 A 42 THR HB A 43 THR H 1.0 . 4.89 1570 1412 A 42 THR HB A 43 THR H 1.0 . 5.37 1571 1413 A 42 THR HB A 42 THR HG2% 1.0 . 3.67 1572 1414 A 42 THR HG2% A 43 THR H 1.0 . 3.71 1573 1415 A 42 THR HG2% A 43 THR H 1.0 . 3.93 1574 1416 A 42 THR HG2% A 46 GLY H 1.0 . 4.32 1575 1417 A 42 THR HG2% A 46 GLY H 1.0 . 4.32 1576 1418 A 42 THR HG2% A 46 GLY HAy 1.0 . 4.42 1577 1419 A 42 THR HG2% A 46 GLY HAy 1.0 . 4.50 1578 1420 A 42 THR HG2% A 46 GLY HAx 1.0 . 4.06 1579 1421 A 42 THR HG2% A 47 ARG H 1.0 . 4.54 1580 1422 A 42 THR HG2% A 47 ARG H 1.0 . 4.99 1581 1423 A 43 THR HA A 43 THR H 1.0 . 3.84 1582 1424 A 43 THR HA A 43 THR H 1.0 . 4.81 1583 1425 A 43 THR HB A 43 THR H 1.0 . 4.84 1584 1426 A 43 THR HG2% A 43 THR H 1.0 . 3.28 1585 1427 A 43 THR HG2% A 43 THR H 1.0 . 3.80 1586 1428 A 43 THR H A 46 GLY H 1.0 . 5.20 1587 1429 A 43 THR H A 47 ARG H 1.0 . 4.04 1588 1430 A 43 THR H A 47 ARG H 1.0 . 4.07 1589 1431 A 43 THR H A 47 ARG HBx 1.0 . 4.66 1590 1432 A 48 GLN HA A 43 THR H 1.0 . 4.90 1591 1433 A 43 THR HB A 43 THR HA 1.0 . 4.05 1592 1434 A 43 THR HB A 43 THR HA 1.0 . 4.20 1593 1435 A 43 THR HG2% A 43 THR HA 1.0 . 3.86 1594 1436 A 43 THR HG2% A 43 THR HA 1.0 . 4.04 1595 1437 A 44 LEU H A 43 THR HA 1.0 . 3.35 1596 1438 A 44 LEU H A 43 THR HA 1.0 . 4.26 1597 1439 A 43 THR HA A 45 ARG H 1.0 . 5.00 1598 1440 A 43 THR HG2% A 43 THR HB 1.0 . 3.61 1599 1441 A 44 LEU H A 43 THR HB 1.0 . 3.38 1600 1442 A 44 LEU H A 43 THR HB 1.0 . 4.00 1601 1443 A 43 THR HB A 45 ARG H 1.0 . 4.21 1602 1444 A 43 THR HG2% A 43 THR HB 1.0 . 3.93 1603 1445 A 43 THR HG2% A 44 LEU H 1.0 . 4.22 1604 1446 A 43 THR HG2% A 44 LEU H 1.0 . 4.99 1605 1447 A 43 THR HG2% A 45 ARG H 1.0 . 4.82 1606 1448 A 43 THR HG2% A 47 ARG H 1.0 . 4.35 1607 1449 A 43 THR HG2% A 47 ARG H 1.0 . 5.36 1608 1450 A 43 THR HG2% A 47 ARG HBx 1.0 . 4.35 1609 1451 A 43 THR HG2% A 48 GLN HA 1.0 . 5.40 1610 1452 A 44 LEU H A 44 LEU HA 1.0 . 3.95 1611 1453 A 44 LEU H A 44 LEU HA 1.0 . 4.17 1612 1454 A 44 LEU H A 44 LEU HBy 1.0 . 3.68 1613 1455 A 44 LEU H A 44 LEU HBy 1.0 . 4.23 1614 1456 A 44 LEU H A 44 LEU HBx 1.0 . 3.38 1615 1457 A 44 LEU H A 44 LEU HBx 1.0 . 4.56 1616 1458 A 44 LEU H A 44 LEU HG 1.0 . 4.18 1617 1459 A 44 LEU H A 44 LEU HG 1.0 . 5.06 1618 1460 A 44 LEU H A 44 LEU HDx% 1.0 . 4.51 1619 1461 A 44 LEU H A 44 LEU HDy% 1.0 . 4.20 1620 1462 A 44 LEU H A 44 LEU HDy% 1.0 . 4.42 1621 1463 A 44 LEU H A 44 LEU HDy% 1.0 . 4.48 1622 1464 A 44 LEU H A 45 ARG H 1.0 . 4.04 1623 1465 A 44 LEU H A 45 ARG H 1.0 . 4.19 1624 1466 A 44 LEU HA A 44 LEU HBy 1.0 . 4.02 1625 1467 A 44 LEU HA A 44 LEU HBy 1.0 . 4.38 1626 1468 A 44 LEU HA A 44 LEU HBx 1.0 . 4.22 1627 1469 A 44 LEU HA A 44 LEU HG 1.0 . 4.03 1628 1470 A 44 LEU HDx% A 44 LEU HA 1.0 . 4.77 1629 1471 A 44 LEU HDx% A 44 LEU HA 1.0 . 5.50 1630 1472 A 44 LEU HDy% A 44 LEU HA 1.0 . 3.48 1631 1473 A 44 LEU HDy% A 44 LEU HA 1.0 . 3.61 1632 1474 A 44 LEU HDy% A 44 LEU HA 1.0 . 3.64 1633 1475 A 44 LEU HA A 45 ARG H 1.0 . 4.41 1634 1476 A 44 LEU HA A 45 ARG H 1.0 . 4.78 1635 1477 A 44 LEU HA A 46 GLY H 1.0 . 4.72 1636 1478 A 44 LEU HA A 46 GLY H 1.0 . 5.50 1637 1479 A 44 LEU HBy A 44 LEU HBx 1.0 . 3.02 1638 1480 A 44 LEU HBy A 44 LEU HG 1.0 . 2.59 1639 1481 A 44 LEU HBy A 44 LEU HG 1.0 . 3.35 1640 1482 A 44 LEU HDx% A 44 LEU HBy 1.0 . 4.01 1641 1483 A 44 LEU HDx% A 44 LEU HBy 1.0 . 4.08 1642 1484 A 44 LEU HDy% A 44 LEU HBy 1.0 . 4.48 1643 1485 A 45 ARG H A 44 LEU HBy 1.0 . 3.92 1644 1486 A 45 ARG H A 44 LEU HBy 1.0 . 4.67 1645 1487 A 44 LEU HBy A 44 LEU HBx 1.0 . 3.17 1646 1488 A 44 LEU HDx% A 44 LEU HBx 1.0 . 4.09 1647 1489 A 44 LEU HDy% A 44 LEU HBx 1.0 . 3.89 1648 1490 A 45 ARG H A 44 LEU HBx 1.0 . 3.73 1649 1491 A 45 ARG H A 44 LEU HBx 1.0 . 5.18 1650 1492 A 44 LEU HDx% A 44 LEU HG 1.0 . 4.54 1651 1493 A 45 ARG H A 44 LEU HG 1.0 . 5.03 1652 1494 A 45 ARG H A 44 LEU HG 1.0 . 5.03 1653 1495 A 45 ARG H A 44 LEU HG 1.0 . 5.03 1654 1496 A 44 LEU HDx% A 44 LEU HG 1.0 . 5.50 1655 1497 A 44 LEU HDx% A 44 LEU HDy% 1.0 . 2.87 1656 1498 A 44 LEU HDx% A 44 LEU HDy% 1.0 . 3.41 1657 1499 A 44 LEU HDy% A 45 ARG H 1.0 . 4.93 1658 1500 A 45 ARG H A 45 ARG HA 1.0 . 3.71 1659 1501 A 45 ARG H A 45 ARG HA 1.0 . 4.42 1660 1502 A 45 ARG H A 45 ARG HBy 1.0 . 4.91 1661 1503 A 45 ARG H A 45 ARG HBx 1.0 . 3.30 1662 1504 A 45 ARG H A 45 ARG HBx 1.0 . 4.42 1663 1505 A 45 ARG H A 45 ARG HBx 1.0 . 4.47 1664 1506 A 45 ARG H A 45 ARG HGy 1.0 . 5.02 1665 1507 A 45 ARG H A 45 ARG HGx 1.0 . 5.27 1666 1508 A 45 ARG H A 45 ARG HD2 1.0 . 5.07 1667 1508 A 45 ARG H A 45 ARG HD3 1.0 . 5.07 1668 1509 A 46 GLY H A 45 ARG H 1.0 . 3.51 1669 1510 A 46 GLY H A 45 ARG H 1.0 . 3.60 1670 1511 A 47 ARG H A 45 ARG H 1.0 . 4.69 1671 1512 A 45 ARG HA A 45 ARG HBy 1.0 . 3.44 1672 1513 A 45 ARG HA A 45 ARG HBy 1.0 . 3.44 1673 1514 A 45 ARG HA A 45 ARG HBy 1.0 . 3.97 1674 1515 A 45 ARG HA A 45 ARG HBx 1.0 . 3.41 1675 1516 A 45 ARG HA A 45 ARG HBx 1.0 . 4.45 1676 1517 A 45 ARG HA A 45 ARG HBx 1.0 . 4.51 1677 1518 A 45 ARG HA A 45 ARG HGy 1.0 . 3.76 1678 1519 A 45 ARG HA A 45 ARG HGy 1.0 . 4.46 1679 1520 A 45 ARG HA A 45 ARG HGx 1.0 . 3.75 1680 1521 A 45 ARG HA A 45 ARG HGx 1.0 . 4.24 1681 1522 A 45 ARG HA A 45 ARG HD2 1.0 . 4.21 1682 1522 A 45 ARG HA A 45 ARG HD3 1.0 . 4.21 1683 1523 A 46 GLY H A 45 ARG HA 1.0 . 4.01 1684 1524 A 46 GLY H A 45 ARG HA 1.0 . 4.10 1685 1525 A 45 ARG HBy A 45 ARG HBx 1.0 . 3.09 1686 1526 A 45 ARG HBy A 45 ARG HGy 1.0 . 3.33 1687 1527 A 45 ARG HBy A 45 ARG HGy 1.0 . 3.92 1688 1528 A 45 ARG HBy A 45 ARG HGx 1.0 . 3.81 1689 1529 A 45 ARG HBy A 45 ARG HGx 1.0 . 3.93 1690 1530 A 45 ARG HBy A 45 ARG HD2 1.0 . 3.69 1691 1530 A 45 ARG HBy A 45 ARG HD3 1.0 . 3.69 1692 1531 A 45 ARG HBy A 45 ARG HD2 1.0 . 4.52 1693 1531 A 45 ARG HBy A 45 ARG HD3 1.0 . 4.52 1694 1532 A 47 ARG H A 45 ARG HBy 1.0 . 5.19 1695 1533 A 45 ARG HBy A 45 ARG HBx 1.0 . 3.00 1696 1534 A 45 ARG HBx A 45 ARG HGy 1.0 . 2.66 1697 1535 A 45 ARG HBx A 45 ARG HGy 1.0 . 2.95 1698 1536 A 45 ARG HBx A 45 ARG HGx 1.0 . 2.56 1699 1537 A 45 ARG HBx A 45 ARG HGx 1.0 . 3.36 1700 1538 A 45 ARG HBx A 45 ARG HGx 1.0 . 3.42 1701 1539 A 45 ARG HBx A 45 ARG HD2 1.0 . 4.50 1702 1539 A 45 ARG HBx A 45 ARG HD3 1.0 . 4.50 1703 1540 A 45 ARG HBx A 45 ARG HD2 1.0 . 4.68 1704 1540 A 45 ARG HBx A 45 ARG HD3 1.0 . 4.68 1705 1541 A 46 GLY H A 45 ARG HBx 1.0 . 4.32 1706 1542 A 47 ARG H A 45 ARG HBx 1.0 . 3.40 1707 1543 A 47 ARG H A 45 ARG HBx 1.0 . 5.24 1708 1544 A 45 ARG HGy A 45 ARG HGx 1.0 . 2.61 1709 1545 A 45 ARG HGy A 45 ARG HD2 1.0 . 3.06 1710 1545 A 45 ARG HGy A 45 ARG HD3 1.0 . 3.06 1711 1546 A 45 ARG HGy A 45 ARG HD2 1.0 . 3.16 1712 1546 A 45 ARG HGy A 45 ARG HD3 1.0 . 3.16 1713 1547 A 45 ARG HGy A 45 ARG HD2 1.0 . 3.91 1714 1547 A 45 ARG HGy A 45 ARG HD3 1.0 . 3.91 1715 1548 A 45 ARG HGy A 45 ARG HGx 1.0 . 2.69 1716 1549 A 45 ARG HGx A 45 ARG HD2 1.0 . 3.07 1717 1549 A 45 ARG HGx A 45 ARG HD3 1.0 . 3.07 1718 1550 A 45 ARG HGx A 45 ARG HD2 1.0 . 3.21 1719 1550 A 45 ARG HGx A 45 ARG HD3 1.0 . 3.21 1720 1551 A 45 ARG HGx A 45 ARG HD2 1.0 . 3.67 1721 1551 A 45 ARG HGx A 45 ARG HD3 1.0 . 3.67 1722 1552 A 46 GLY H A 45 ARG HGx 1.0 . 4.71 1723 1553 A 46 GLY H A 45 ARG HGx 1.0 . 4.89 1724 1554 A 46 GLY H A 46 GLY HAy 1.0 . 3.59 1725 1555 A 46 GLY H A 46 GLY HAy 1.0 . 3.86 1726 1556 A 46 GLY H A 46 GLY HAx 1.0 . 3.29 1727 1557 A 46 GLY H A 46 GLY HAx 1.0 . 3.64 1728 1558 A 47 ARG H A 46 GLY H 1.0 . 3.46 1729 1559 A 47 ARG H A 46 GLY H 1.0 . 3.60 1730 1560 A 46 GLY HAy A 46 GLY HAx 1.0 . 2.82 1731 1561 A 47 ARG H A 46 GLY HAy 1.0 . 4.52 1732 1562 A 47 ARG H A 46 GLY HAy 1.0 . 4.65 1733 1563 A 46 GLY HAy A 46 GLY HAx 1.0 . 2.81 1734 1564 A 47 ARG H A 46 GLY HAx 1.0 . 4.35 1735 1565 A 47 ARG H A 46 GLY HAx 1.0 . 4.68 1736 1566 A 47 ARG H A 47 ARG HA 1.0 . 3.89 1737 1567 A 47 ARG H A 47 ARG HA 1.0 . 4.29 1738 1568 A 47 ARG H A 47 ARG HA 1.0 . 4.43 1739 1569 A 47 ARG H A 47 ARG HBy 1.0 . 4.19 1740 1570 A 47 ARG H A 47 ARG HBy 1.0 . 4.19 1741 1571 A 47 ARG H A 47 ARG HBx 1.0 . 4.30 1742 1572 A 47 ARG H A 47 ARG HG2 1.0 . 4.26 1743 1573 A 47 ARG H A 47 ARG HG2 1.0 . 4.74 1744 1574 A 47 ARG HA A 47 ARG HBy 1.0 . 3.69 1745 1575 A 47 ARG HA A 47 ARG HBy 1.0 . 3.97 1746 1576 A 47 ARG HA A 47 ARG HBy 1.0 . 4.09 1747 1577 A 47 ARG HBx A 47 ARG HA 1.0 . 4.25 1748 1578 A 47 ARG HA A 47 ARG HG2 1.0 . 4.24 1749 1579 A 47 ARG HA A 47 ARG HG2 1.0 . 4.24 1750 1580 A 47 ARG HA A 47 ARG HG2 1.0 . 4.72 1751 1581 A 47 ARG HA A 47 ARG HG2 1.0 . 4.72 1752 1582 A 47 ARG HA A 47 ARG HD2 1.0 . 5.43 1753 1582 A 47 ARG HA A 47 ARG HD3 1.0 . 5.43 1754 1583 A 47 ARG HA A 47 ARG HD2 1.0 . 5.50 1755 1583 A 47 ARG HA A 47 ARG HD3 1.0 . 5.50 1756 1584 A 47 ARG HA A 47 ARG HD2 1.0 . 5.50 1757 1584 A 47 ARG HA A 47 ARG HD3 1.0 . 5.50 1758 1585 A 47 ARG HA A 48 GLN H 1.0 . 3.11 1759 1586 A 47 ARG HA A 48 GLN H 1.0 . 3.36 1760 1587 A 47 ARG HBx A 47 ARG HBy 1.0 . 2.40 1761 1588 A 47 ARG HBy A 47 ARG HG2 1.0 . 3.19 1762 1589 A 47 ARG HBy A 47 ARG HG2 1.0 . 3.19 1763 1590 A 47 ARG HBy A 47 ARG HG2 1.0 . 3.45 1764 1591 A 47 ARG HBy A 47 ARG HG2 1.0 . 3.45 1765 1592 A 47 ARG HBy A 47 ARG HD2 1.0 . 3.55 1766 1592 A 47 ARG HBy A 47 ARG HD3 1.0 . 3.55 1767 1593 A 47 ARG HBy A 47 ARG HD2 1.0 . 3.55 1768 1593 A 47 ARG HBy A 47 ARG HD3 1.0 . 3.55 1769 1594 A 47 ARG HBy A 47 ARG HD2 1.0 . 3.55 1770 1594 A 47 ARG HBy A 47 ARG HD3 1.0 . 3.55 1771 1595 A 47 ARG HBy A 48 GLN H 1.0 . 4.77 1772 1596 A 47 ARG HBx A 47 ARG HG2 1.0 . 3.89 1773 1597 A 47 ARG HBx A 47 ARG HD2 1.0 . 4.39 1774 1597 A 47 ARG HBx A 47 ARG HD3 1.0 . 4.39 1775 1598 A 47 ARG HBx A 48 GLN H 1.0 . 3.63 1776 1599 A 47 ARG HBx A 48 GLN H 1.0 . 4.76 1777 1600 A 47 ARG HG2 A 47 ARG HD2 1.0 . 4.18 1778 1600 A 47 ARG HG2 A 47 ARG HD3 1.0 . 4.18 1779 1601 A 47 ARG HG2 A 47 ARG HD2 1.0 . 4.18 1780 1601 A 47 ARG HG2 A 47 ARG HD3 1.0 . 4.18 1781 1602 A 47 ARG HG2 A 48 GLN H 1.0 . 4.68 1782 1603 A 47 ARG HG2 A 48 GLN H 1.0 . 5.31 1783 1604 A 48 GLN HA A 48 GLN H 1.0 . 4.08 1784 1605 A 48 GLN HA A 48 GLN H 1.0 . 4.55 1785 1606 A 48 GLN HBy A 48 GLN H 1.0 . 3.63 1786 1607 A 48 GLN HBy A 48 GLN H 1.0 . 4.13 1787 1608 A 48 GLN HBx A 48 GLN H 1.0 . 4.62 1788 1609 A 48 GLN H A 48 GLN HGy 1.0 . 4.32 1789 1610 A 48 GLN H A 48 GLN HGy 1.0 . 4.96 1790 1611 A 48 GLN HGx A 48 GLN H 1.0 . 4.57 1791 1612 A 48 GLN HGx A 48 GLN H 1.0 . 5.03 1792 1613 A 48 GLN HA A 48 GLN HBy 1.0 . 4.19 1793 1614 A 48 GLN HA A 48 GLN HBy 1.0 . 4.23 1794 1615 A 48 GLN HBx A 48 GLN HA 1.0 . 3.86 1795 1616 A 48 GLN HBx A 48 GLN HA 1.0 . 3.94 1796 1617 A 48 GLN HBx A 48 GLN HA 1.0 . 4.84 1797 1618 A 48 GLN HA A 48 GLN HGy 1.0 . 4.30 1798 1619 A 48 GLN HA A 48 GLN HGy 1.0 . 4.50 1799 1620 A 48 GLN HA A 48 GLN HGx 1.0 . 4.45 1800 1621 A 49 LEU H A 48 GLN HA 1.0 . 3.16 1801 1622 A 49 LEU H A 48 GLN HA 1.0 . 3.39 1802 1623 A 48 GLN HBx A 48 GLN HBy 1.0 . 2.83 1803 1624 A 48 GLN HBy A 48 GLN HGy 1.0 . 3.87 1804 1625 A 48 GLN HBy A 48 GLN HGy 1.0 . 3.89 1805 1626 A 48 GLN HBy A 48 GLN HGx 1.0 . 3.69 1806 1627 A 48 GLN HBy A 48 GLN HGx 1.0 . 3.95 1807 1628 A 49 LEU H A 48 GLN HBy 1.0 . 4.81 1808 1629 A 49 LEU H A 48 GLN HBy 1.0 . 5.29 1809 1630 A 48 GLN HBx A 48 GLN HBy 1.0 . 2.76 1810 1631 A 48 GLN HBx A 48 GLN HGy 1.0 . 4.10 1811 1632 A 48 GLN HBx A 48 GLN HGy 1.0 . 4.41 1812 1633 A 48 GLN HBx A 48 GLN HGx 1.0 . 4.00 1813 1634 A 48 GLN HBx A 48 GLN HGx 1.0 . 4.39 1814 1635 A 49 LEU H A 48 GLN HBx 1.0 . 4.12 1815 1636 A 49 LEU H A 48 GLN HBx 1.0 . 4.92 1816 1637 A 48 GLN HGx A 48 GLN HGy 1.0 . 2.52 1817 1638 A 48 GLN HGx A 48 GLN HGy 1.0 . 2.67 1818 1639 A 49 LEU H A 49 LEU HA 1.0 . 4.34 1819 1640 A 49 LEU H A 49 LEU HB2 1.0 . 3.70 1820 1640 A 49 LEU HB3 A 49 LEU H 1.0 . 3.70 1821 1641 A 49 LEU H A 49 LEU HB2 1.0 . 4.20 1822 1641 A 49 LEU HB3 A 49 LEU H 1.0 . 4.20 1823 1642 A 49 LEU H A 49 LEU HD1% 1.0 . 4.66 1824 1643 A 49 LEU HA A 49 LEU HG 1.0 . 4.55 1825 1644 A 49 LEU HA A 49 LEU HG 1.0 . 4.64 1826 1645 A 49 LEU HA A 49 LEU HB2 1.0 . 3.99 1827 1645 A 49 LEU HB3 A 49 LEU HA 1.0 . 3.99 1828 1646 A 49 LEU HA A 49 LEU HB2 1.0 . 4.20 1829 1646 A 49 LEU HB3 A 49 LEU HA 1.0 . 4.20 1830 1647 A 49 LEU HA A 49 LEU HD1% 1.0 . 4.48 1831 1648 A 49 LEU HA A 49 LEU HD1% 1.0 . 5.50 1832 1649 A 49 LEU HA A 49 LEU HD2% 1.0 . 4.23 1833 1650 A 50 CYS H A 49 LEU HA 1.0 . 3.27 1834 1651 A 49 LEU HD1% A 49 LEU HG 1.0 . 3.81 1835 1652 A 49 LEU HG A 49 LEU HD2% 1.0 . 4.06 1836 1653 A 50 CYS H A 49 LEU HG 1.0 . 4.27 1837 1654 A 49 LEU HG A 49 LEU HB2 1.0 . 2.40 1838 1654 A 49 LEU HB3 A 49 LEU HG 1.0 . 2.40 1839 1655 A 49 LEU HG A 49 LEU HB2 1.0 . 2.62 1840 1655 A 49 LEU HB3 A 49 LEU HG 1.0 . 2.62 1841 1656 A 49 LEU HD1% A 49 LEU HB2 1.0 . 3.61 1842 1656 A 49 LEU HB3 A 49 LEU HD1% 1.0 . 3.61 1843 1657 A 49 LEU HD1% A 49 LEU HB2 1.0 . 3.71 1844 1657 A 49 LEU HB3 A 49 LEU HD1% 1.0 . 3.71 1845 1658 A 49 LEU HD2% A 49 LEU HB2 1.0 . 4.04 1846 1658 A 49 LEU HB3 A 49 LEU HD2% 1.0 . 4.04 1847 1659 A 50 CYS H A 49 LEU HB2 1.0 . 3.76 1848 1659 A 50 CYS H A 49 LEU HB3 1.0 . 3.76 1849 1660 A 50 CYS H A 49 LEU HB2 1.0 . 4.75 1850 1660 A 50 CYS H A 49 LEU HB3 1.0 . 4.75 1851 1661 A 49 LEU HD1% A 49 LEU HG 1.0 . 5.14 1852 1662 A 50 CYS H A 49 LEU HD1% 1.0 . 4.27 1853 1663 A 50 CYS H A 50 CYS HA 1.0 . 4.62 1854 1664 A 50 CYS H A 50 CYS HBy 1.0 . 3.55 1855 1665 A 50 CYS H A 50 CYS HBy 1.0 . 4.06 1856 1666 A 50 CYS H A 50 CYS HBx 1.0 . 4.07 1857 1667 A 50 CYS H A 50 CYS HBx 1.0 . 4.56 1858 1668 A 50 CYS HBy A 50 CYS HA 1.0 . 4.55 1859 1669 A 50 CYS HBy A 50 CYS HA 1.0 . 4.64 1860 1670 A 50 CYS HBx A 50 CYS HA 1.0 . 4.40 1861 1671 A 50 CYS HA A 51 ALA H 1.0 . 3.66 1862 1672 A 50 CYS HBy A 50 CYS HBx 1.0 . 3.22 1863 1673 A 50 CYS HBy A 51 ALA H 1.0 . 5.25 1864 1674 A 50 CYS HBy A 51 ALA H 1.0 . 5.50 1865 1675 A 50 CYS HBy A 50 CYS HBx 1.0 . 3.34 1866 1676 A 50 CYS HBx A 51 ALA H 1.0 . 4.55 1867 1677 A 50 CYS HBx A 51 ALA H 1.0 . 5.01 1868 1678 A 51 ALA HA A 51 ALA H 1.0 . 4.68 1869 1679 A 51 ALA H A 51 ALA HB% 1.0 . 3.59 1870 1680 A 51 ALA HA A 51 ALA HB% 1.0 . 3.41 1871 1681 A 51 ALA HA A 51 ALA HB% 1.0 . 3.57 1872 1682 A 51 ALA HB% A 57 TRP HH2 1.0 . 3.55 1873 1683 A 51 ALA HB% A 57 TRP HH2 1.0 . 3.98 1874 1684 A 57 TRP HZ2 A 51 ALA HB% 1.0 . 3.93 1875 1685 A 57 TRP HZ2 A 51 ALA HB% 1.0 . 3.95 1876 1686 A 51 ALA HB% A 57 TRP HZ3 1.0 . 4.41 1877 1687 A 51 ALA HB% A 58 VAL HB 1.0 . 4.96 1878 1688 A 51 ALA HB% A 58 VAL HGy% 1.0 . 3.44 1879 1689 A 51 ALA HB% A 58 VAL HGy% 1.0 . 3.49 1880 1690 A 52 PRO HA A 52 PRO HBy 1.0 . 4.20 1881 1691 A 52 PRO HA A 52 PRO HBx 1.0 . 4.10 1882 1692 A 52 PRO HDy A 52 PRO HA 1.0 . 5.50 1883 1693 A 52 PRO HDx A 52 PRO HA 1.0 . 5.17 1884 1694 A 52 PRO HA A 52 PRO HGy 1.0 . 4.06 1885 1695 A 52 PRO HA A 52 PRO HGx 1.0 . 4.45 1886 1696 A 52 PRO HA A 52 PRO HBy 1.0 . 4.85 1887 1697 A 52 PRO HBy A 52 PRO HBx 1.0 . 3.02 1888 1698 A 52 PRO HDy A 52 PRO HBy 1.0 . 5.18 1889 1699 A 52 PRO HDx A 52 PRO HBy 1.0 . 4.54 1890 1700 A 52 PRO HBy A 52 PRO HGy 1.0 . 3.93 1891 1701 A 52 PRO HBy A 52 PRO HGx 1.0 . 4.34 1892 1702 A 52 PRO HA A 52 PRO HBx 1.0 . 4.29 1893 1703 A 52 PRO HBy A 52 PRO HBx 1.0 . 2.95 1894 1704 A 52 PRO HDy A 52 PRO HBx 1.0 . 5.49 1895 1705 A 52 PRO HDx A 52 PRO HBx 1.0 . 5.00 1896 1706 A 52 PRO HBx A 52 PRO HGy 1.0 . 4.01 1897 1707 A 52 PRO HBx A 52 PRO HGx 1.0 . 3.41 1898 1708 A 52 PRO HDy A 52 PRO HA 1.0 . 5.50 1899 1709 A 52 PRO HDy A 52 PRO HBy 1.0 . 5.34 1900 1710 A 52 PRO HDy A 52 PRO HBx 1.0 . 5.25 1901 1711 A 52 PRO HDy A 52 PRO HDx 1.0 . 3.02 1902 1712 A 52 PRO HDy A 52 PRO HGy 1.0 . 4.09 1903 1713 A 52 PRO HDy A 52 PRO HGx 1.0 . 4.20 1904 1714 A 52 PRO HDy A 57 TRP HE1 1.0 . 5.13 1905 1715 A 52 PRO HDx A 52 PRO HA 1.0 . 5.50 1906 1716 A 52 PRO HDx A 52 PRO HBy 1.0 . 4.50 1907 1717 A 52 PRO HDx A 52 PRO HBx 1.0 . 4.85 1908 1718 A 52 PRO HDy A 52 PRO HDx 1.0 . 2.99 1909 1719 A 52 PRO HDx A 52 PRO HGy 1.0 . 3.67 1910 1720 A 52 PRO HDx A 52 PRO HGx 1.0 . 4.26 1911 1721 A 52 PRO HBy A 52 PRO HGy 1.0 . 4.27 1912 1722 A 52 PRO HBx A 52 PRO HGy 1.0 . 4.34 1913 1723 A 52 PRO HDy A 52 PRO HGy 1.0 . 4.39 1914 1724 A 52 PRO HDx A 52 PRO HGy 1.0 . 4.01 1915 1725 A 52 PRO HGy A 52 PRO HGx 1.0 . 3.30 1916 1726 A 57 TRP HE1 A 52 PRO HGy 1.0 . 5.24 1917 1727 A 57 TRP HZ2 A 52 PRO HGy 1.0 . 3.67 1918 1728 A 52 PRO HA A 52 PRO HGx 1.0 . 5.11 1919 1729 A 52 PRO HBy A 52 PRO HGx 1.0 . 3.89 1920 1730 A 52 PRO HBx A 52 PRO HGx 1.0 . 3.76 1921 1731 A 52 PRO HDy A 52 PRO HGx 1.0 . 4.08 1922 1732 A 52 PRO HDx A 52 PRO HGx 1.0 . 4.13 1923 1733 A 52 PRO HGy A 52 PRO HGx 1.0 . 2.97 1924 1734 A 52 PRO HGx A 57 TRP HD1 1.0 . 4.42 1925 1735 A 57 TRP HE1 A 52 PRO HGx 1.0 . 4.61 1926 1736 A 53 PRO HDy A 53 PRO HA 1.0 . 4.58 1927 1737 A 53 PRO HA A 53 PRO HDx 1.0 . 4.75 1928 1738 A 53 PRO HA A 53 PRO HGy 1.0 . 4.75 1929 1739 A 53 PRO HA A 53 PRO HGy 1.0 . 4.75 1930 1740 A 53 PRO HA A 53 PRO HGx 1.0 . 4.34 1931 1741 A 53 PRO HA A 53 PRO HB2 1.0 . 3.84 1932 1741 A 53 PRO HB3 A 53 PRO HA 1.0 . 3.84 1933 1742 A 53 PRO HA A 54 ASP H 1.0 . 3.90 1934 1743 A 53 PRO HA A 54 ASP H 1.0 . 4.34 1935 1744 A 53 PRO HA A 55 GLN H 1.0 . 5.50 1936 1745 A 53 PRO HA A 58 VAL HGx% 1.0 . 3.83 1937 1746 A 53 PRO HA A 58 VAL HGx% 1.0 . 4.02 1938 1747 A 58 VAL HGy% A 53 PRO HA 1.0 . 5.11 1939 1748 A 53 PRO HDy A 53 PRO HA 1.0 . 5.18 1940 1749 A 53 PRO HDy A 53 PRO HDx 1.0 . 2.91 1941 1750 A 53 PRO HDy A 53 PRO HGy 1.0 . 4.34 1942 1751 A 53 PRO HDy A 53 PRO HGy 1.0 . 4.34 1943 1752 A 53 PRO HDy A 53 PRO HGx 1.0 . 4.19 1944 1753 A 53 PRO HDy A 53 PRO HB2 1.0 . 4.93 1945 1753 A 53 PRO HDy A 53 PRO HB3 1.0 . 4.93 1946 1754 A 53 PRO HDy A 54 ASP H 1.0 . 4.83 1947 1755 A 53 PRO HA A 53 PRO HDx 1.0 . 4.90 1948 1756 A 53 PRO HDy A 53 PRO HDx 1.0 . 3.06 1949 1757 A 53 PRO HDx A 53 PRO HGy 1.0 . 3.62 1950 1758 A 53 PRO HGx A 53 PRO HDx 1.0 . 4.28 1951 1759 A 53 PRO HDx A 53 PRO HB2 1.0 . 5.33 1952 1759 A 53 PRO HB3 A 53 PRO HDx 1.0 . 5.33 1953 1760 A 53 PRO HDx A 54 ASP H 1.0 . 4.30 1954 1761 A 53 PRO HDx A 54 ASP H 1.0 . 4.48 1955 1762 A 53 PRO HA A 53 PRO HGy 1.0 . 4.55 1956 1763 A 53 PRO HDy A 53 PRO HGy 1.0 . 4.12 1957 1764 A 53 PRO HDx A 53 PRO HGy 1.0 . 3.61 1958 1765 A 53 PRO HGy A 53 PRO HB2 1.0 . 3.53 1959 1765 A 53 PRO HB3 A 53 PRO HGy 1.0 . 3.53 1960 1766 A 53 PRO HGy A 54 ASP H 1.0 . 4.26 1961 1767 A 53 PRO HGy A 54 ASP H 1.0 . 4.93 1962 1768 A 53 PRO HGy A 54 ASP H 1.0 . 4.93 1963 1769 A 53 PRO HGy A 54 ASP H 1.0 . 4.94 1964 1770 A 53 PRO HA A 53 PRO HGx 1.0 . 5.09 1965 1771 A 53 PRO HDy A 53 PRO HGx 1.0 . 4.30 1966 1772 A 53 PRO HGx A 53 PRO HDx 1.0 . 4.28 1967 1773 A 53 PRO HGx A 53 PRO HGy 1.0 . 2.78 1968 1774 A 53 PRO HGx A 53 PRO HB2 1.0 . 3.85 1969 1774 A 53 PRO HB3 A 53 PRO HGx 1.0 . 3.85 1970 1775 A 53 PRO HGx A 54 ASP H 1.0 . 4.79 1971 1776 A 53 PRO HA A 53 PRO HB2 1.0 . 3.58 1972 1776 A 53 PRO HB3 A 53 PRO HA 1.0 . 3.58 1973 1777 A 53 PRO HDy A 53 PRO HB2 1.0 . 4.38 1974 1777 A 53 PRO HDy A 53 PRO HB3 1.0 . 4.38 1975 1778 A 53 PRO HGy A 53 PRO HB2 1.0 . 2.81 1976 1778 A 53 PRO HB3 A 53 PRO HGy 1.0 . 2.81 1977 1779 A 53 PRO HGy A 53 PRO HB2 1.0 . 2.93 1978 1779 A 53 PRO HB3 A 53 PRO HGy 1.0 . 2.93 1979 1780 A 53 PRO HGx A 53 PRO HB2 1.0 . 3.02 1980 1780 A 53 PRO HB3 A 53 PRO HGx 1.0 . 3.02 1981 1781 A 54 ASP H A 53 PRO HB2 1.0 . 3.77 1982 1781 A 53 PRO HB3 A 54 ASP H 1.0 . 3.77 1983 1782 A 54 ASP H A 53 PRO HB2 1.0 . 5.14 1984 1782 A 53 PRO HB3 A 54 ASP H 1.0 . 5.14 1985 1783 A 54 ASP H A 54 ASP HA 1.0 . 3.74 1986 1784 A 54 ASP H A 54 ASP HA 1.0 . 4.07 1987 1785 A 54 ASP H A 54 ASP HA 1.0 . 4.07 1988 1786 A 54 ASP H A 54 ASP HBy 1.0 . 4.38 1989 1787 A 54 ASP H A 54 ASP HBy 1.0 . 4.83 1990 1788 A 54 ASP H A 54 ASP HBx 1.0 . 4.08 1991 1789 A 54 ASP H A 54 ASP HBx 1.0 . 4.62 1992 1790 A 54 ASP H A 55 GLN H 1.0 . 3.60 1993 1791 A 54 ASP H A 55 GLN H 1.0 . 3.68 1994 1792 A 54 ASP HA A 54 ASP HBy 1.0 . 3.61 1995 1793 A 54 ASP HA A 54 ASP HBy 1.0 . 3.77 1996 1794 A 54 ASP HA A 54 ASP HBx 1.0 . 3.62 1997 1795 A 54 ASP HA A 54 ASP HBx 1.0 . 3.72 1998 1796 A 55 GLN H A 54 ASP HA 1.0 . 4.16 1999 1797 A 55 GLN H A 54 ASP HA 1.0 . 4.57 2000 1798 A 54 ASP HBy A 54 ASP HBx 1.0 . 2.79 2001 1799 A 54 ASP HBy A 54 ASP HBx 1.0 . 2.83 2002 1800 A 55 GLN H A 54 ASP HBx 1.0 . 4.51 2003 1801 A 55 GLN H A 55 GLN HA 1.0 . 4.18 2004 1802 A 55 GLN H A 55 GLN HBy 1.0 . 4.10 2005 1803 A 55 GLN H A 55 GLN HBy 1.0 . 4.61 2006 1804 A 55 GLN H A 55 GLN HBx 1.0 . 3.74 2007 1805 A 55 GLN H A 55 GLN HBx 1.0 . 4.18 2008 1806 A 55 GLN H A 55 GLN HGy 1.0 . 4.90 2009 1807 A 55 GLN H A 55 GLN HGy 1.0 . 5.17 2010 1808 A 55 GLN H A 55 GLN HGx 1.0 . 4.03 2011 1809 A 55 GLN H A 55 GLN HGx 1.0 . 4.63 2012 1810 A 55 GLN H A 56 PRO HD2 1.0 . 5.00 2013 1810 A 55 GLN H A 56 PRO HD3 1.0 . 5.00 2014 1811 A 58 VAL HB A 55 GLN H 1.0 . 4.21 2015 1812 A 58 VAL HB A 55 GLN H 1.0 . 4.95 2016 1813 A 58 VAL HGy% A 55 GLN H 1.0 . 4.67 2017 1814 A 58 VAL HGy% A 55 GLN H 1.0 . 5.09 2018 1815 A 55 GLN HA A 55 GLN HBy 1.0 . 4.25 2019 1816 A 55 GLN HA A 55 GLN HBy 1.0 . 5.50 2020 1817 A 55 GLN HA A 55 GLN HBx 1.0 . 4.51 2021 1818 A 55 GLN HA A 55 GLN HBx 1.0 . 5.50 2022 1819 A 55 GLN HA A 55 GLN HGy 1.0 . 4.83 2023 1820 A 55 GLN HA A 55 GLN HGx 1.0 . 4.57 2024 1821 A 55 GLN HA A 55 GLN HGx 1.0 . 5.50 2025 1822 A 55 GLN HA A 56 PRO HD2 1.0 . 4.48 2026 1822 A 55 GLN HA A 56 PRO HD3 1.0 . 4.48 2027 1823 A 55 GLN HBy A 55 GLN HBx 1.0 . 3.14 2028 1824 A 55 GLN HBy A 55 GLN HGy 1.0 . 3.70 2029 1825 A 55 GLN HBy A 55 GLN HGy 1.0 . 3.99 2030 1826 A 55 GLN HBy A 55 GLN HGx 1.0 . 3.89 2031 1827 A 55 GLN HBy A 55 GLN HGx 1.0 . 3.93 2032 1828 A 55 GLN HBy A 56 PRO HD2 1.0 . 4.46 2033 1828 A 55 GLN HBy A 56 PRO HD3 1.0 . 4.46 2034 1829 A 55 GLN HBy A 57 TRP H 1.0 . 4.32 2035 1830 A 55 GLN HBy A 57 TRP H 1.0 . 4.79 2036 1831 A 55 GLN HBy A 58 VAL H 1.0 . 4.25 2037 1832 A 55 GLN HBy A 58 VAL H 1.0 . 5.17 2038 1833 A 58 VAL HGy% A 55 GLN HBy 1.0 . 4.40 2039 1834 A 58 VAL HGy% A 55 GLN HBy 1.0 . 4.73 2040 1835 A 55 GLN HBy A 55 GLN HBx 1.0 . 3.21 2041 1836 A 55 GLN HBx A 55 GLN HGy 1.0 . 4.12 2042 1837 A 55 GLN HBx A 55 GLN HGy 1.0 . 4.17 2043 1838 A 55 GLN HBx A 55 GLN HGy 1.0 . 4.45 2044 1839 A 55 GLN HBx A 55 GLN HGx 1.0 . 4.22 2045 1840 A 55 GLN HBx A 55 GLN HGx 1.0 . 4.24 2046 1841 A 55 GLN HBx A 56 PRO HD2 1.0 . 4.98 2047 1841 A 55 GLN HBx A 56 PRO HD3 1.0 . 4.98 2048 1842 A 55 GLN HBx A 57 TRP H 1.0 . 4.88 2049 1843 A 55 GLN HBx A 58 VAL H 1.0 . 4.50 2050 1844 A 55 GLN HBx A 58 VAL H 1.0 . 5.03 2051 1845 A 58 VAL HGy% A 55 GLN HBx 1.0 . 4.31 2052 1846 A 55 GLN HGy A 55 GLN HGx 1.0 . 2.74 2053 1847 A 55 GLN HGy A 55 GLN HGx 1.0 . 2.66 2054 1848 A 55 GLN HGy A 55 GLN HGx 1.0 . 2.82 2055 1849 A 56 PRO HA A 56 PRO HBy 1.0 . 3.77 2056 1850 A 56 PRO HA A 56 PRO HBx 1.0 . 4.16 2057 1851 A 56 PRO HA A 56 PRO HGy 1.0 . 5.26 2058 1852 A 56 PRO HA A 56 PRO HGx 1.0 . 4.89 2059 1853 A 56 PRO HA A 56 PRO HGx 1.0 . 4.89 2060 1854 A 56 PRO HA A 56 PRO HD2 1.0 . 5.00 2061 1854 A 56 PRO HD3 A 56 PRO HA 1.0 . 5.00 2062 1855 A 56 PRO HA A 59 GLU H 1.0 . 4.42 2063 1856 A 56 PRO HA A 59 GLU HB2 1.0 . 4.37 2064 1856 A 56 PRO HA A 59 GLU HB3 1.0 . 4.37 2065 1857 A 56 PRO HA A 56 PRO HBy 1.0 . 4.25 2066 1858 A 56 PRO HBy A 56 PRO HBx 1.0 . 3.15 2067 1859 A 56 PRO HBy A 56 PRO HGy 1.0 . 4.04 2068 1860 A 56 PRO HBy A 56 PRO HGx 1.0 . 3.99 2069 1861 A 56 PRO HBy A 56 PRO HD2 1.0 . 4.90 2070 1861 A 56 PRO HD3 A 56 PRO HBy 1.0 . 4.90 2071 1862 A 57 TRP H A 56 PRO HBy 1.0 . 4.48 2072 1863 A 57 TRP H A 56 PRO HBy 1.0 . 4.94 2073 1864 A 56 PRO HA A 56 PRO HBx 1.0 . 4.54 2074 1865 A 56 PRO HBy A 56 PRO HBx 1.0 . 2.99 2075 1866 A 56 PRO HBx A 56 PRO HGy 1.0 . 3.60 2076 1867 A 56 PRO HBx A 56 PRO HGx 1.0 . 3.36 2077 1868 A 56 PRO HBx A 56 PRO HD2 1.0 . 4.63 2078 1868 A 56 PRO HD3 A 56 PRO HBx 1.0 . 4.63 2079 1869 A 57 TRP H A 56 PRO HBx 1.0 . 3.96 2080 1870 A 57 TRP H A 56 PRO HBx 1.0 . 4.48 2081 1871 A 56 PRO HA A 56 PRO HGy 1.0 . 5.27 2082 1872 A 56 PRO HBy A 56 PRO HGy 1.0 . 3.54 2083 1873 A 56 PRO HBx A 56 PRO HGy 1.0 . 3.70 2084 1874 A 56 PRO HBx A 56 PRO HGy 1.0 . 3.70 2085 1875 A 56 PRO HGy A 56 PRO HD2 1.0 . 4.10 2086 1875 A 56 PRO HD3 A 56 PRO HGy 1.0 . 4.10 2087 1876 A 56 PRO HA A 56 PRO HGx 1.0 . 4.41 2088 1877 A 56 PRO HBy A 56 PRO HGx 1.0 . 3.63 2089 1878 A 56 PRO HGy A 56 PRO HGx 1.0 . 3.45 2090 1879 A 56 PRO HGx A 56 PRO HD2 1.0 . 4.13 2091 1879 A 56 PRO HD3 A 56 PRO HGx 1.0 . 4.13 2092 1880 A 56 PRO HA A 56 PRO HD2 1.0 . 5.30 2093 1880 A 56 PRO HD3 A 56 PRO HA 1.0 . 5.30 2094 1881 A 56 PRO HBy A 56 PRO HD2 1.0 . 4.51 2095 1881 A 56 PRO HD3 A 56 PRO HBy 1.0 . 4.51 2096 1882 A 56 PRO HBx A 56 PRO HD2 1.0 . 4.40 2097 1882 A 56 PRO HD3 A 56 PRO HBx 1.0 . 4.40 2098 1883 A 56 PRO HGy A 56 PRO HD2 1.0 . 3.95 2099 1883 A 56 PRO HD3 A 56 PRO HGy 1.0 . 3.95 2100 1884 A 56 PRO HGx A 56 PRO HD2 1.0 . 4.05 2101 1884 A 56 PRO HD3 A 56 PRO HGx 1.0 . 4.05 2102 1885 A 56 PRO HGx A 56 PRO HD2 1.0 . 4.05 2103 1885 A 56 PRO HD3 A 56 PRO HGx 1.0 . 4.05 2104 1886 A 57 TRP H A 56 PRO HD2 1.0 . 4.32 2105 1886 A 56 PRO HD3 A 57 TRP H 1.0 . 4.32 2106 1887 A 57 TRP H A 57 TRP HA 1.0 . 3.98 2107 1888 A 57 TRP H A 57 TRP HA 1.0 . 4.11 2108 1889 A 57 TRP H A 57 TRP HBy 1.0 . 4.22 2109 1890 A 57 TRP H A 57 TRP HBy 1.0 . 4.53 2110 1891 A 57 TRP H A 57 TRP HBx 1.0 . 3.73 2111 1892 A 57 TRP H A 57 TRP HBx 1.0 . 4.14 2112 1893 A 57 TRP HD1 A 57 TRP H 1.0 . 3.86 2113 1894 A 57 TRP H A 58 VAL H 1.0 . 3.97 2114 1895 A 57 TRP H A 58 VAL H 1.0 . 4.04 2115 1896 A 57 TRP HA A 57 TRP HBy 1.0 . 3.43 2116 1897 A 57 TRP HA A 57 TRP HBy 1.0 . 3.66 2117 1898 A 57 TRP HA A 57 TRP HBx 1.0 . 3.46 2118 1899 A 57 TRP HA A 57 TRP HBx 1.0 . 3.68 2119 1900 A 58 VAL H A 57 TRP HA 1.0 . 4.69 2120 1901 A 58 VAL H A 57 TRP HA 1.0 . 5.04 2121 1902 A 57 TRP HA A 60 ARG H 1.0 . 4.46 2122 1903 A 57 TRP HA A 60 ARG H 1.0 . 4.49 2123 1904 A 57 TRP HA A 60 ARG HGy 1.0 . 5.29 2124 1905 A 57 TRP HA A 60 ARG HB2 1.0 . 3.91 2125 1905 A 57 TRP HA A 60 ARG HB3 1.0 . 3.91 2126 1906 A 57 TRP HBy A 57 TRP HBx 1.0 . 3.06 2127 1907 A 57 TRP HD1 A 57 TRP HBy 1.0 . 4.01 2128 1908 A 57 TRP HD1 A 57 TRP HBy 1.0 . 4.94 2129 1909 A 57 TRP HBy A 57 TRP HE3 1.0 . 3.89 2130 1910 A 57 TRP HBy A 57 TRP HE3 1.0 . 4.56 2131 1911 A 57 TRP HD1 A 57 TRP HBx 1.0 . 3.53 2132 1912 A 57 TRP HD1 A 57 TRP HBx 1.0 . 4.52 2133 1913 A 57 TRP HBx A 57 TRP HE3 1.0 . 4.50 2134 1914 A 57 TRP HBx A 57 TRP HE3 1.0 . 5.18 2135 1915 A 57 TRP HE1 A 57 TRP HD1 1.0 . 3.39 2136 1916 A 57 TRP HE1 A 57 TRP HD1 1.0 . 3.68 2137 1917 A 57 TRP HZ2 A 57 TRP HE1 1.0 . 4.16 2138 1918 A 57 TRP HZ3 A 57 TRP HE3 1.0 . 3.63 2139 1919 A 61 ILE HD1% A 57 TRP HE3 1.0 . 3.41 2140 1920 A 61 ILE HD1% A 57 TRP HE3 1.0 . 3.97 2141 1921 A 61 ILE HD1% A 57 TRP HE3 1.0 . 4.43 2142 1922 A 57 TRP HZ2 A 57 TRP HH2 1.0 . 3.01 2143 1923 A 57 TRP HH2 A 57 TRP HZ3 1.0 . 3.52 2144 1924 A 57 TRP HZ2 A 57 TRP HE1 1.0 . 3.94 2145 1925 A 57 TRP HZ2 A 57 TRP HH2 1.0 . 3.11 2146 1926 A 57 TRP HZ3 A 57 TRP HE3 1.0 . 3.70 2147 1927 A 57 TRP HZ3 A 61 ILE HD1% 1.0 . 3.56 2148 1928 A 57 TRP HZ3 A 61 ILE HG2% 1.0 . 4.34 2149 1929 A 58 VAL HA A 58 VAL H 1.0 . 4.08 2150 1930 A 58 VAL HA A 58 VAL H 1.0 . 4.73 2151 1931 A 58 VAL HB A 58 VAL H 1.0 . 3.38 2152 1932 A 58 VAL HB A 58 VAL H 1.0 . 4.19 2153 1933 A 58 VAL HGx% A 58 VAL H 1.0 . 4.35 2154 1934 A 58 VAL HGx% A 58 VAL H 1.0 . 4.79 2155 1935 A 58 VAL HGy% A 58 VAL H 1.0 . 3.52 2156 1936 A 58 VAL HGy% A 58 VAL H 1.0 . 3.97 2157 1937 A 58 VAL H A 59 GLU H 1.0 . 3.53 2158 1938 A 58 VAL H A 59 GLU H 1.0 . 3.57 2159 1939 A 58 VAL H A 60 ARG H 1.0 . 4.89 2160 1940 A 58 VAL H A 60 ARG H 1.0 . 4.96 2161 1941 A 58 VAL HA A 58 VAL HB 1.0 . 4.59 2162 1942 A 58 VAL HA A 58 VAL HB 1.0 . 4.96 2163 1943 A 58 VAL HGx% A 58 VAL HA 1.0 . 3.75 2164 1944 A 58 VAL HGx% A 58 VAL HA 1.0 . 4.02 2165 1945 A 58 VAL HGy% A 58 VAL HA 1.0 . 3.84 2166 1946 A 58 VAL HA A 59 GLU H 1.0 . 4.90 2167 1947 A 58 VAL HA A 59 GLU H 1.0 . 5.22 2168 1948 A 58 VAL HA A 61 ILE H 1.0 . 4.98 2169 1949 A 61 ILE HD1% A 58 VAL HA 1.0 . 4.39 2170 1950 A 61 ILE HD1% A 58 VAL HA 1.0 . 4.94 2171 1951 A 58 VAL HGx% A 58 VAL HB 1.0 . 3.47 2172 1952 A 58 VAL HGy% A 58 VAL HB 1.0 . 3.73 2173 1953 A 58 VAL HB A 59 GLU H 1.0 . 3.43 2174 1954 A 58 VAL HB A 59 GLU H 1.0 . 4.33 2175 1955 A 58 VAL HGy% A 58 VAL HGx% 1.0 . 3.46 2176 1956 A 58 VAL HGx% A 59 GLU H 1.0 . 4.33 2177 1957 A 58 VAL HGx% A 59 GLU H 1.0 . 4.49 2178 1958 A 58 VAL HGx% A 62 ILE H 1.0 . 4.93 2179 1959 A 62 ILE HD1% A 58 VAL HGx% 1.0 . 3.86 2180 1960 A 58 VAL HGy% A 58 VAL HB 1.0 . 3.92 2181 1961 A 58 VAL HGy% A 58 VAL HGx% 1.0 . 3.27 2182 1962 A 58 VAL HGy% A 59 GLU H 1.0 . 4.60 2183 1963 A 58 VAL HGy% A 59 GLU H 1.0 . 5.02 2184 1964 A 59 GLU H A 59 GLU HA 1.0 . 3.75 2185 1965 A 59 GLU H A 59 GLU HA 1.0 . 4.07 2186 1966 A 59 GLU H A 59 GLU HGy 1.0 . 3.83 2187 1967 A 59 GLU H A 59 GLU HGy 1.0 . 4.87 2188 1968 A 59 GLU H A 59 GLU HGx 1.0 . 3.97 2189 1969 A 59 GLU H A 59 GLU HGx 1.0 . 4.85 2190 1970 A 59 GLU H A 59 GLU HB2 1.0 . 3.31 2191 1970 A 59 GLU H A 59 GLU HB3 1.0 . 3.31 2192 1971 A 59 GLU H A 59 GLU HB2 1.0 . 4.01 2193 1971 A 59 GLU H A 59 GLU HB3 1.0 . 4.01 2194 1972 A 59 GLU H A 60 ARG H 1.0 . 3.63 2195 1973 A 59 GLU H A 60 ARG H 1.0 . 3.78 2196 1974 A 62 ILE HD1% A 59 GLU H 1.0 . 5.14 2197 1975 A 62 ILE HD1% A 59 GLU H 1.0 . 5.38 2198 1976 A 59 GLU HA A 59 GLU HGy 1.0 . 4.57 2199 1977 A 59 GLU HA A 59 GLU HGx 1.0 . 4.15 2200 1978 A 59 GLU HA A 59 GLU HGx 1.0 . 5.01 2201 1979 A 59 GLU HA A 59 GLU HB2 1.0 . 3.56 2202 1979 A 59 GLU HB3 A 59 GLU HA 1.0 . 3.56 2203 1980 A 59 GLU HA A 59 GLU HB2 1.0 . 4.02 2204 1980 A 59 GLU HB3 A 59 GLU HA 1.0 . 4.02 2205 1981 A 60 ARG H A 59 GLU HA 1.0 . 4.36 2206 1982 A 60 ARG H A 59 GLU HA 1.0 . 5.02 2207 1983 A 62 ILE H A 59 GLU HA 1.0 . 4.18 2208 1984 A 62 ILE H A 59 GLU HA 1.0 . 4.92 2209 1985 A 59 GLU HA A 62 ILE HB 1.0 . 3.75 2210 1986 A 59 GLU HA A 62 ILE HB 1.0 . 3.91 2211 1987 A 62 ILE HG1y A 59 GLU HA 1.0 . 4.99 2212 1988 A 62 ILE HG1y A 59 GLU HA 1.0 . 5.01 2213 1989 A 62 ILE HD1% A 59 GLU HA 1.0 . 4.03 2214 1990 A 62 ILE HD1% A 59 GLU HA 1.0 . 4.04 2215 1991 A 62 ILE HG2% A 59 GLU HA 1.0 . 4.72 2216 1992 A 62 ILE HG2% A 59 GLU HA 1.0 . 4.94 2217 1993 A 59 GLU HA A 63 GLN H 1.0 . 4.68 2218 1994 A 59 GLU HA A 63 GLN H 1.0 . 5.12 2219 1995 A 59 GLU HGy A 59 GLU HGx 1.0 . 2.73 2220 1996 A 60 ARG H A 59 GLU HGy 1.0 . 5.05 2221 1997 A 59 GLU HGy A 59 GLU HGx 1.0 . 2.75 2222 1998 A 60 ARG H A 59 GLU HGx 1.0 . 4.56 2223 1999 A 59 GLU HGy A 59 GLU HB2 1.0 . 2.83 2224 1999 A 59 GLU HB3 A 59 GLU HGy 1.0 . 2.83 2225 2000 A 59 GLU HGy A 59 GLU HB2 1.0 . 3.34 2226 2000 A 59 GLU HB3 A 59 GLU HGy 1.0 . 3.34 2227 2001 A 59 GLU HGx A 59 GLU HB2 1.0 . 3.26 2228 2001 A 59 GLU HB3 A 59 GLU HGx 1.0 . 3.26 2229 2002 A 59 GLU HGx A 59 GLU HB2 1.0 . 3.51 2230 2002 A 59 GLU HB3 A 59 GLU HGx 1.0 . 3.51 2231 2003 A 60 ARG H A 59 GLU HB2 1.0 . 3.66 2232 2003 A 59 GLU HB3 A 60 ARG H 1.0 . 3.66 2233 2004 A 60 ARG H A 59 GLU HB2 1.0 . 4.53 2234 2004 A 59 GLU HB3 A 60 ARG H 1.0 . 4.53 2235 2005 A 60 ARG H A 60 ARG HA 1.0 . 3.54 2236 2006 A 60 ARG H A 60 ARG HA 1.0 . 4.05 2237 2007 A 60 ARG H A 60 ARG HGy 1.0 . 4.51 2238 2008 A 60 ARG H A 60 ARG HGx 1.0 . 4.19 2239 2009 A 60 ARG H A 60 ARG HB2 1.0 . 3.21 2240 2009 A 60 ARG H A 60 ARG HB3 1.0 . 3.21 2241 2010 A 60 ARG H A 60 ARG HB2 1.0 . 3.67 2242 2010 A 60 ARG H A 60 ARG HB3 1.0 . 3.67 2243 2011 A 60 ARG H A 61 ILE H 1.0 . 3.87 2244 2012 A 60 ARG H A 61 ILE H 1.0 . 3.91 2245 2013 A 60 ARG HGy A 60 ARG HA 1.0 . 4.09 2246 2014 A 60 ARG HGy A 60 ARG HA 1.0 . 4.37 2247 2015 A 60 ARG HA A 60 ARG HGx 1.0 . 4.20 2248 2016 A 60 ARG HA A 60 ARG HGx 1.0 . 4.27 2249 2017 A 60 ARG HA A 60 ARG HB2 1.0 . 3.57 2250 2017 A 60 ARG HB3 A 60 ARG HA 1.0 . 3.57 2251 2018 A 60 ARG HA A 60 ARG HB2 1.0 . 3.60 2252 2018 A 60 ARG HB3 A 60 ARG HA 1.0 . 3.60 2253 2019 A 60 ARG HA A 60 ARG HD2 1.0 . 5.32 2254 2019 A 60 ARG HA A 60 ARG HD3 1.0 . 5.32 2255 2020 A 60 ARG HA A 60 ARG HD2 1.0 . 5.50 2256 2020 A 60 ARG HA A 60 ARG HD3 1.0 . 5.50 2257 2021 A 61 ILE H A 60 ARG HA 1.0 . 4.83 2258 2022 A 63 GLN H A 60 ARG HA 1.0 . 4.45 2259 2023 A 60 ARG HA A 63 GLN HGy 1.0 . 4.50 2260 2024 A 60 ARG HA A 63 GLN HGx 1.0 . 4.36 2261 2025 A 60 ARG HGy A 60 ARG HGx 1.0 . 2.59 2262 2026 A 60 ARG HGy A 60 ARG HD2 1.0 . 4.28 2263 2026 A 60 ARG HGy A 60 ARG HD3 1.0 . 4.28 2264 2027 A 60 ARG HGy A 60 ARG HD2 1.0 . 4.33 2265 2027 A 60 ARG HGy A 60 ARG HD3 1.0 . 4.33 2266 2028 A 60 ARG HGy A 60 ARG HGx 1.0 . 2.94 2267 2029 A 60 ARG HGx A 60 ARG HD2 1.0 . 3.87 2268 2029 A 60 ARG HGx A 60 ARG HD3 1.0 . 3.87 2269 2030 A 60 ARG HGx A 60 ARG HD2 1.0 . 4.57 2270 2030 A 60 ARG HGx A 60 ARG HD3 1.0 . 4.57 2271 2031 A 61 ILE H A 60 ARG HGx 1.0 . 5.50 2272 2032 A 60 ARG HGy A 60 ARG HB2 1.0 . 2.45 2273 2032 A 60 ARG HGy A 60 ARG HB3 1.0 . 2.45 2274 2033 A 60 ARG HGy A 60 ARG HB2 1.0 . 2.64 2275 2033 A 60 ARG HGy A 60 ARG HB3 1.0 . 2.64 2276 2034 A 60 ARG HGx A 60 ARG HB2 1.0 . 2.82 2277 2034 A 60 ARG HB3 A 60 ARG HGx 1.0 . 2.82 2278 2035 A 60 ARG HGx A 60 ARG HB2 1.0 . 2.99 2279 2035 A 60 ARG HB3 A 60 ARG HGx 1.0 . 2.99 2280 2036 A 60 ARG HB2 A 60 ARG HD2 1.0 . 4.13 2281 2036 A 60 ARG HB3 A 60 ARG HD2 1.0 . 4.13 2282 2036 A 60 ARG HD3 A 60 ARG HB2 1.0 . 4.13 2283 2036 A 60 ARG HB3 A 60 ARG HD3 1.0 . 4.13 2284 2037 A 60 ARG HB2 A 60 ARG HD2 1.0 . 4.49 2285 2037 A 60 ARG HB3 A 60 ARG HD2 1.0 . 4.49 2286 2037 A 60 ARG HD3 A 60 ARG HB2 1.0 . 4.49 2287 2037 A 60 ARG HB3 A 60 ARG HD3 1.0 . 4.49 2288 2038 A 61 ILE H A 60 ARG HB2 1.0 . 3.38 2289 2038 A 60 ARG HB3 A 61 ILE H 1.0 . 3.38 2290 2039 A 61 ILE H A 61 ILE HA 1.0 . 4.03 2291 2040 A 61 ILE H A 61 ILE HA 1.0 . 4.45 2292 2041 A 61 ILE HB A 61 ILE H 1.0 . 3.65 2293 2042 A 61 ILE HG1y A 61 ILE H 1.0 . 3.69 2294 2043 A 61 ILE HG1y A 61 ILE H 1.0 . 3.97 2295 2044 A 61 ILE HD1% A 61 ILE H 1.0 . 4.12 2296 2045 A 61 ILE HG2% A 61 ILE H 1.0 . 4.14 2297 2046 A 61 ILE HG2% A 61 ILE H 1.0 . 4.43 2298 2047 A 61 ILE H A 62 ILE H 1.0 . 3.64 2299 2048 A 61 ILE H A 62 ILE H 1.0 . 3.79 2300 2049 A 61 ILE H A 63 GLN H 1.0 . 5.13 2301 2050 A 61 ILE HB A 61 ILE HA 1.0 . 4.35 2302 2051 A 61 ILE HB A 61 ILE HA 1.0 . 4.37 2303 2052 A 61 ILE HG1y A 61 ILE HA 1.0 . 4.25 2304 2053 A 61 ILE HG1x A 61 ILE HA 1.0 . 4.31 2305 2054 A 61 ILE HD1% A 61 ILE HA 1.0 . 4.76 2306 2055 A 61 ILE HG2% A 61 ILE HA 1.0 . 3.92 2307 2056 A 62 ILE H A 61 ILE HA 1.0 . 4.46 2308 2057 A 62 ILE H A 61 ILE HA 1.0 . 5.41 2309 2058 A 61 ILE HA A 64 ARG H 1.0 . 4.32 2310 2059 A 61 ILE HA A 64 ARG H 1.0 . 5.06 2311 2060 A 61 ILE HA A 65 LEU H 1.0 . 4.86 2312 2061 A 61 ILE HG1y A 61 ILE HB 1.0 . 3.75 2313 2062 A 61 ILE HG1x A 61 ILE HB 1.0 . 4.85 2314 2063 A 61 ILE HD1% A 61 ILE HB 1.0 . 3.61 2315 2064 A 61 ILE HD1% A 61 ILE HB 1.0 . 3.78 2316 2065 A 61 ILE HG2% A 61 ILE HB 1.0 . 3.25 2317 2066 A 61 ILE HB A 62 ILE H 1.0 . 3.62 2318 2067 A 61 ILE HB A 62 ILE H 1.0 . 4.39 2319 2068 A 61 ILE HG1x A 61 ILE HG1y 1.0 . 3.32 2320 2069 A 61 ILE HG1y A 62 ILE H 1.0 . 4.88 2321 2070 A 61 ILE HG1x A 61 ILE HG1y 1.0 . 3.12 2322 2071 A 61 ILE HD1% A 61 ILE HG1y 1.0 . 3.20 2323 2072 A 61 ILE HD1% A 61 ILE HG1x 1.0 . 3.26 2324 2073 A 61 ILE HD1% A 62 ILE H 1.0 . 4.49 2325 2074 A 61 ILE HG2% A 61 ILE HB 1.0 . 3.57 2326 2075 A 61 ILE HG2% A 61 ILE HG1y 1.0 . 4.15 2327 2076 A 61 ILE HG2% A 61 ILE HG1y 1.0 . 4.20 2328 2077 A 61 ILE HG1x A 61 ILE HG2% 1.0 . 4.13 2329 2078 A 61 ILE HD1% A 61 ILE HG2% 1.0 . 2.91 2330 2079 A 61 ILE HD1% A 61 ILE HG2% 1.0 . 3.07 2331 2080 A 61 ILE HD1% A 61 ILE HG2% 1.0 . 3.41 2332 2081 A 61 ILE HG2% A 62 ILE H 1.0 . 4.26 2333 2082 A 61 ILE HG2% A 62 ILE H 1.0 . 4.90 2334 2083 A 61 ILE HG2% A 64 ARG H 1.0 . 5.32 2335 2084 A 61 ILE HG2% A 65 LEU H 1.0 . 5.50 2336 2085 A 62 ILE H A 62 ILE HA 1.0 . 3.79 2337 2086 A 62 ILE H A 62 ILE HA 1.0 . 4.60 2338 2087 A 62 ILE H A 62 ILE HB 1.0 . 3.29 2339 2088 A 62 ILE H A 62 ILE HB 1.0 . 3.90 2340 2089 A 62 ILE HG1y A 62 ILE H 1.0 . 3.39 2341 2090 A 62 ILE HG1y A 62 ILE H 1.0 . 4.09 2342 2091 A 62 ILE HG1y A 62 ILE H 1.0 . 4.24 2343 2092 A 62 ILE HG1x A 62 ILE H 1.0 . 4.01 2344 2093 A 62 ILE HG1x A 62 ILE H 1.0 . 4.67 2345 2094 A 62 ILE HD1% A 62 ILE H 1.0 . 4.04 2346 2095 A 62 ILE HD1% A 62 ILE H 1.0 . 4.72 2347 2096 A 62 ILE HG2% A 62 ILE H 1.0 . 4.21 2348 2097 A 62 ILE HG2% A 62 ILE H 1.0 . 4.77 2349 2098 A 62 ILE H A 63 GLN H 1.0 . 3.69 2350 2099 A 62 ILE H A 63 GLN H 1.0 . 3.85 2351 2100 A 62 ILE HB A 62 ILE HA 1.0 . 4.25 2352 2101 A 62 ILE HB A 62 ILE HA 1.0 . 4.63 2353 2102 A 62 ILE HG1y A 62 ILE HA 1.0 . 4.38 2354 2103 A 62 ILE HG1x A 62 ILE HA 1.0 . 3.88 2355 2104 A 62 ILE HG1x A 62 ILE HA 1.0 . 4.20 2356 2105 A 62 ILE HD1% A 62 ILE HA 1.0 . 4.53 2357 2106 A 62 ILE HD1% A 62 ILE HA 1.0 . 4.96 2358 2107 A 62 ILE HG2% A 62 ILE HA 1.0 . 3.75 2359 2108 A 62 ILE HG2% A 62 ILE HA 1.0 . 3.80 2360 2109 A 63 GLN H A 62 ILE HA 1.0 . 4.66 2361 2110 A 65 LEU H A 62 ILE HA 1.0 . 4.29 2362 2111 A 65 LEU HBy A 62 ILE HA 1.0 . 4.17 2363 2112 A 65 LEU HBx A 62 ILE HA 1.0 . 4.84 2364 2113 A 62 ILE HA A 66 GLN H 1.0 . 4.71 2365 2114 A 62 ILE HG1y A 62 ILE HB 1.0 . 3.88 2366 2115 A 62 ILE HG1y A 62 ILE HB 1.0 . 3.90 2367 2116 A 62 ILE HG1x A 62 ILE HB 1.0 . 4.35 2368 2117 A 62 ILE HG1x A 62 ILE HB 1.0 . 4.57 2369 2118 A 62 ILE HD1% A 62 ILE HB 1.0 . 3.71 2370 2119 A 62 ILE HD1% A 62 ILE HB 1.0 . 3.88 2371 2120 A 62 ILE HG2% A 62 ILE HB 1.0 . 3.42 2372 2121 A 62 ILE HB A 63 GLN H 1.0 . 3.63 2373 2122 A 62 ILE HB A 63 GLN H 1.0 . 4.02 2374 2123 A 62 ILE HG1y A 62 ILE HG1x 1.0 . 3.27 2375 2124 A 62 ILE HD1% A 62 ILE HG1y 1.0 . 3.64 2376 2125 A 62 ILE HG1y A 62 ILE HG1x 1.0 . 3.22 2377 2126 A 62 ILE HD1% A 62 ILE HG1x 1.0 . 3.54 2378 2127 A 62 ILE HD1% A 62 ILE HG1y 1.0 . 3.83 2379 2128 A 62 ILE HD1% A 62 ILE HG1x 1.0 . 3.91 2380 2129 A 62 ILE HD1% A 63 GLN H 1.0 . 4.80 2381 2130 A 62 ILE HD1% A 63 GLN H 1.0 . 5.38 2382 2131 A 62 ILE HG2% A 62 ILE HB 1.0 . 3.59 2383 2132 A 62 ILE HG2% A 62 ILE HG1y 1.0 . 4.22 2384 2133 A 62 ILE HG2% A 62 ILE HG1y 1.0 . 4.25 2385 2134 A 62 ILE HG2% A 62 ILE HG1x 1.0 . 3.68 2386 2135 A 62 ILE HG2% A 62 ILE HG1x 1.0 . 4.12 2387 2136 A 62 ILE HG2% A 62 ILE HD1% 1.0 . 2.85 2388 2137 A 62 ILE HG2% A 62 ILE HD1% 1.0 . 2.97 2389 2138 A 62 ILE HG2% A 63 GLN H 1.0 . 4.09 2390 2139 A 62 ILE HG2% A 63 GLN H 1.0 . 4.60 2391 2140 A 62 ILE HG2% A 66 GLN HGy 1.0 . 4.15 2392 2141 A 62 ILE HG2% A 66 GLN HGy 1.0 . 4.53 2393 2142 A 62 ILE HG2% A 66 GLN HGx 1.0 . 4.72 2394 2143 A 63 GLN H A 63 GLN HA 1.0 . 3.52 2395 2144 A 63 GLN H A 63 GLN HA 1.0 . 3.91 2396 2145 A 63 GLN H A 63 GLN HGy 1.0 . 3.72 2397 2146 A 63 GLN H A 63 GLN HGy 1.0 . 4.35 2398 2147 A 63 GLN H A 63 GLN HGx 1.0 . 4.15 2399 2148 A 63 GLN H A 63 GLN HGx 1.0 . 4.51 2400 2149 A 63 GLN H A 63 GLN HB2 1.0 . 3.23 2401 2149 A 63 GLN H A 63 GLN HB3 1.0 . 3.23 2402 2150 A 63 GLN H A 63 GLN HB2 1.0 . 3.94 2403 2150 A 63 GLN H A 63 GLN HB3 1.0 . 3.94 2404 2151 A 63 GLN H A 64 ARG H 1.0 . 3.62 2405 2152 A 63 GLN H A 66 GLN H 1.0 . 4.55 2406 2153 A 63 GLN HGy A 63 GLN HA 1.0 . 4.24 2407 2154 A 63 GLN HGx A 63 GLN HA 1.0 . 4.06 2408 2155 A 63 GLN HA A 63 GLN HB2 1.0 . 3.47 2409 2155 A 63 GLN HA A 63 GLN HB3 1.0 . 3.47 2410 2156 A 63 GLN HA A 63 GLN HB2 1.0 . 3.86 2411 2156 A 63 GLN HA A 63 GLN HB3 1.0 . 3.86 2412 2157 A 64 ARG H A 63 GLN HA 1.0 . 4.30 2413 2158 A 66 GLN H A 63 GLN HA 1.0 . 4.23 2414 2159 A 66 GLN H A 63 GLN HA 1.0 . 4.75 2415 2160 A 66 GLN HBy A 63 GLN HA 1.0 . 5.05 2416 2161 A 63 GLN HA A 66 GLN HBx 1.0 . 4.68 2417 2162 A 66 GLN HGy A 63 GLN HA 1.0 . 5.39 2418 2163 A 66 GLN HGx A 63 GLN HA 1.0 . 5.14 2419 2164 A 63 GLN HA A 67 ARG H 1.0 . 4.82 2420 2165 A 63 GLN HGy A 63 GLN HGx 1.0 . 2.48 2421 2166 A 63 GLN HGy A 64 ARG H 1.0 . 4.51 2422 2167 A 63 GLN HGy A 63 GLN HGx 1.0 . 2.48 2423 2168 A 63 GLN HGx A 64 ARG H 1.0 . 4.81 2424 2169 A 63 GLN HGy A 63 GLN HB2 1.0 . 3.55 2425 2169 A 63 GLN HGy A 63 GLN HB3 1.0 . 3.55 2426 2170 A 63 GLN HGy A 63 GLN HB2 1.0 . 4.22 2427 2170 A 63 GLN HGy A 63 GLN HB3 1.0 . 4.22 2428 2171 A 63 GLN HGx A 63 GLN HB2 1.0 . 3.50 2429 2171 A 63 GLN HGx A 63 GLN HB3 1.0 . 3.50 2430 2172 A 63 GLN HGx A 63 GLN HB2 1.0 . 3.77 2431 2172 A 63 GLN HGx A 63 GLN HB3 1.0 . 3.77 2432 2173 A 64 ARG H A 63 GLN HB2 1.0 . 3.17 2433 2173 A 64 ARG H A 63 GLN HB3 1.0 . 3.17 2434 2174 A 64 ARG H A 63 GLN HB2 1.0 . 4.49 2435 2174 A 64 ARG H A 63 GLN HB3 1.0 . 4.49 2436 2175 A 64 ARG H A 64 ARG HA 1.0 . 3.58 2437 2176 A 64 ARG H A 64 ARG HA 1.0 . 4.34 2438 2177 A 64 ARG H A 64 ARG HBy 1.0 . 4.15 2439 2178 A 64 ARG H A 64 ARG HBx 1.0 . 3.48 2440 2179 A 64 ARG H A 64 ARG HBx 1.0 . 3.98 2441 2180 A 64 ARG H A 64 ARG HBx 1.0 . 4.10 2442 2181 A 64 ARG H A 64 ARG HGy 1.0 . 4.39 2443 2182 A 64 ARG H A 65 LEU H 1.0 . 3.45 2444 2183 A 64 ARG H A 65 LEU H 1.0 . 3.47 2445 2184 A 64 ARG HA A 64 ARG HBy 1.0 . 4.34 2446 2185 A 64 ARG HA A 64 ARG HBx 1.0 . 4.02 2447 2186 A 64 ARG HA A 64 ARG HBx 1.0 . 4.07 2448 2187 A 64 ARG HA A 64 ARG HDy 1.0 . 4.36 2449 2188 A 64 ARG HA A 64 ARG HDy 1.0 . 5.37 2450 2189 A 64 ARG HA A 64 ARG HDx 1.0 . 5.50 2451 2190 A 64 ARG HA A 64 ARG HDx 1.0 . 5.50 2452 2191 A 64 ARG HA A 64 ARG HGy 1.0 . 4.26 2453 2192 A 64 ARG HA A 64 ARG HGy 1.0 . 4.35 2454 2193 A 64 ARG HA A 64 ARG HGx 1.0 . 4.56 2455 2194 A 64 ARG HA A 64 ARG HGx 1.0 . 5.11 2456 2195 A 67 ARG H A 64 ARG HA 1.0 . 4.33 2457 2196 A 64 ARG HA A 67 ARG HB2 1.0 . 4.69 2458 2196 A 64 ARG HA A 67 ARG HB3 1.0 . 4.69 2459 2197 A 64 ARG HBy A 64 ARG HBx 1.0 . 2.87 2460 2198 A 64 ARG HBy A 64 ARG HDy 1.0 . 3.97 2461 2199 A 64 ARG HBy A 64 ARG HDy 1.0 . 5.50 2462 2200 A 64 ARG HBy A 64 ARG HDx 1.0 . 4.81 2463 2201 A 64 ARG HBy A 64 ARG HDx 1.0 . 5.50 2464 2202 A 64 ARG HBy A 64 ARG HGy 1.0 . 3.68 2465 2203 A 64 ARG HBy A 64 ARG HGy 1.0 . 3.99 2466 2204 A 64 ARG HBy A 64 ARG HGx 1.0 . 4.82 2467 2205 A 64 ARG HBy A 64 ARG HGx 1.0 . 5.50 2468 2206 A 65 LEU H A 64 ARG HBy 1.0 . 4.73 2469 2207 A 64 ARG HBy A 64 ARG HBx 1.0 . 3.10 2470 2208 A 64 ARG HBx A 64 ARG HDy 1.0 . 3.80 2471 2209 A 64 ARG HBx A 64 ARG HDy 1.0 . 5.50 2472 2210 A 64 ARG HBx A 64 ARG HDx 1.0 . 5.28 2473 2211 A 64 ARG HBx A 64 ARG HDx 1.0 . 5.50 2474 2212 A 64 ARG HBx A 64 ARG HGy 1.0 . 3.39 2475 2213 A 64 ARG HBx A 64 ARG HGy 1.0 . 3.82 2476 2214 A 64 ARG HBx A 64 ARG HGx 1.0 . 4.74 2477 2215 A 64 ARG HBx A 64 ARG HGx 1.0 . 5.50 2478 2216 A 65 LEU H A 64 ARG HBx 1.0 . 4.59 2479 2217 A 65 LEU H A 64 ARG HBx 1.0 . 5.49 2480 2218 A 64 ARG HDy A 64 ARG HDx 1.0 . 2.40 2481 2219 A 64 ARG HDy A 64 ARG HDx 1.0 . 2.60 2482 2220 A 64 ARG HGy A 64 ARG HDy 1.0 . 3.78 2483 2221 A 64 ARG HGy A 64 ARG HDy 1.0 . 3.79 2484 2222 A 64 ARG HGy A 64 ARG HDx 1.0 . 4.09 2485 2223 A 64 ARG HGy A 64 ARG HDx 1.0 . 4.80 2486 2224 A 64 ARG HGy A 64 ARG HGx 1.0 . 2.86 2487 2225 A 64 ARG HDy A 64 ARG HGx 1.0 . 3.68 2488 2226 A 64 ARG HDy A 64 ARG HGx 1.0 . 4.26 2489 2227 A 64 ARG HDx A 64 ARG HGx 1.0 . 4.94 2490 2228 A 64 ARG HGy A 64 ARG HGx 1.0 . 3.01 2491 2229 A 65 LEU H A 65 LEU HA 1.0 . 3.65 2492 2230 A 65 LEU H A 65 LEU HA 1.0 . 4.41 2493 2231 A 65 LEU H A 65 LEU HA 1.0 . 4.41 2494 2232 A 65 LEU HBy A 65 LEU H 1.0 . 3.21 2495 2233 A 65 LEU HBy A 65 LEU H 1.0 . 3.99 2496 2234 A 65 LEU HBx A 65 LEU H 1.0 . 4.29 2497 2235 A 65 LEU H A 65 LEU HG 1.0 . 4.35 2498 2236 A 65 LEU HD1% A 65 LEU H 1.0 . 3.67 2499 2237 A 65 LEU H A 66 GLN H 1.0 . 3.50 2500 2238 A 65 LEU H A 66 GLN H 1.0 . 3.53 2501 2239 A 65 LEU H A 67 ARG H 1.0 . 4.26 2502 2240 A 65 LEU HBy A 65 LEU HA 1.0 . 4.33 2503 2241 A 65 LEU HBy A 65 LEU HA 1.0 . 4.46 2504 2242 A 65 LEU HBx A 65 LEU HA 1.0 . 3.81 2505 2243 A 65 LEU HBx A 65 LEU HA 1.0 . 3.96 2506 2244 A 65 LEU HA A 65 LEU HG 1.0 . 4.60 2507 2245 A 65 LEU HA A 65 LEU HD2% 1.0 . 3.25 2508 2246 A 65 LEU HA A 65 LEU HD2% 1.0 . 3.82 2509 2247 A 66 GLN H A 65 LEU HA 1.0 . 4.38 2510 2248 A 66 GLN H A 65 LEU HA 1.0 . 4.98 2511 2249 A 65 LEU HA A 68 THR H 1.0 . 4.60 2512 2250 A 65 LEU HBy A 65 LEU HBx 1.0 . 3.11 2513 2251 A 65 LEU HBy A 65 LEU HG 1.0 . 3.27 2514 2252 A 65 LEU HBy A 65 LEU HG 1.0 . 3.30 2515 2253 A 65 LEU HD1% A 65 LEU HBy 1.0 . 3.98 2516 2254 A 65 LEU HD1% A 65 LEU HBy 1.0 . 4.57 2517 2255 A 65 LEU HD1% A 65 LEU HBy 1.0 . 5.50 2518 2256 A 65 LEU HBy A 66 GLN H 1.0 . 3.67 2519 2257 A 65 LEU HBy A 66 GLN H 1.0 . 4.64 2520 2258 A 65 LEU HBx A 65 LEU HG 1.0 . 3.03 2521 2259 A 65 LEU HD1% A 65 LEU HBx 1.0 . 3.56 2522 2260 A 65 LEU HD1% A 65 LEU HBx 1.0 . 3.68 2523 2261 A 65 LEU HD1% A 65 LEU HBx 1.0 . 4.02 2524 2262 A 65 LEU HBx A 66 GLN H 1.0 . 4.18 2525 2263 A 65 LEU HBx A 66 GLN H 1.0 . 4.84 2526 2264 A 65 LEU HD1% A 65 LEU HG 1.0 . 3.52 2527 2265 A 65 LEU HD1% A 65 LEU HG 1.0 . 4.16 2528 2266 A 65 LEU HD1% A 65 LEU HG 1.0 . 3.21 2529 2267 A 65 LEU HD1% A 66 GLN H 1.0 . 5.01 2530 2268 A 66 GLN HA A 66 GLN H 1.0 . 3.62 2531 2269 A 66 GLN HA A 66 GLN H 1.0 . 3.93 2532 2270 A 66 GLN HA A 66 GLN H 1.0 . 4.81 2533 2271 A 66 GLN HBy A 66 GLN H 1.0 . 3.39 2534 2272 A 66 GLN HBy A 66 GLN H 1.0 . 4.30 2535 2273 A 66 GLN H A 66 GLN HBx 1.0 . 4.36 2536 2274 A 66 GLN H A 66 GLN HGy 1.0 . 3.55 2537 2275 A 66 GLN H A 66 GLN HGy 1.0 . 4.32 2538 2276 A 66 GLN HGx A 66 GLN H 1.0 . 4.01 2539 2277 A 66 GLN HGx A 66 GLN H 1.0 . 4.49 2540 2278 A 66 GLN H A 67 ARG H 1.0 . 3.42 2541 2279 A 66 GLN H A 67 ARG H 1.0 . 3.42 2542 2280 A 66 GLN HBy A 66 GLN HA 1.0 . 3.97 2543 2281 A 66 GLN HBy A 66 GLN HA 1.0 . 4.32 2544 2282 A 66 GLN HA A 66 GLN HBx 1.0 . 3.70 2545 2283 A 66 GLN HA A 66 GLN HBx 1.0 . 4.15 2546 2284 A 66 GLN HA A 66 GLN HGy 1.0 . 4.26 2547 2285 A 66 GLN HA A 66 GLN HGy 1.0 . 4.29 2548 2286 A 66 GLN HGx A 66 GLN HA 1.0 . 3.91 2549 2287 A 66 GLN HA A 67 ARG H 1.0 . 3.66 2550 2288 A 66 GLN HA A 67 ARG H 1.0 . 3.75 2551 2289 A 66 GLN HA A 68 THR H 1.0 . 4.23 2552 2290 A 66 GLN HBy A 66 GLN HBx 1.0 . 2.87 2553 2291 A 66 GLN HBy A 66 GLN HGy 1.0 . 3.73 2554 2292 A 66 GLN HBy A 66 GLN HGy 1.0 . 4.32 2555 2293 A 66 GLN HBy A 66 GLN HGx 1.0 . 3.63 2556 2294 A 66 GLN HBy A 66 GLN HGx 1.0 . 4.00 2557 2295 A 66 GLN HBy A 67 ARG H 1.0 . 3.96 2558 2296 A 66 GLN HBy A 67 ARG H 1.0 . 5.02 2559 2297 A 66 GLN HBy A 66 GLN HBx 1.0 . 2.89 2560 2298 A 66 GLN HGy A 66 GLN HBx 1.0 . 3.99 2561 2299 A 66 GLN HGy A 66 GLN HBx 1.0 . 4.27 2562 2300 A 66 GLN HGx A 66 GLN HBx 1.0 . 3.93 2563 2301 A 66 GLN HGx A 66 GLN HBx 1.0 . 3.94 2564 2302 A 66 GLN HBx A 67 ARG H 1.0 . 4.08 2565 2303 A 66 GLN HBx A 67 ARG H 1.0 . 4.82 2566 2304 A 66 GLN HGx A 66 GLN HGy 1.0 . 2.75 2567 2305 A 66 GLN HGy A 67 ARG H 1.0 . 5.07 2568 2306 A 66 GLN HGx A 66 GLN HGy 1.0 . 2.81 2569 2307 A 66 GLN HGx A 67 ARG H 1.0 . 5.14 2570 2308 A 67 ARG H A 67 ARG HA 1.0 . 3.22 2571 2309 A 67 ARG H A 67 ARG HGy 1.0 . 3.81 2572 2310 A 67 ARG H A 67 ARG HGy 1.0 . 4.59 2573 2311 A 67 ARG H A 67 ARG HGy 1.0 . 4.59 2574 2312 A 67 ARG H A 67 ARG HGy 1.0 . 4.59 2575 2313 A 67 ARG H A 67 ARG HGx 1.0 . 4.13 2576 2314 A 67 ARG H A 67 ARG HGx 1.0 . 4.86 2577 2315 A 67 ARG H A 67 ARG HGx 1.0 . 4.93 2578 2316 A 67 ARG H A 67 ARG HB2 1.0 . 3.12 2579 2316 A 67 ARG H A 67 ARG HB3 1.0 . 3.12 2580 2317 A 67 ARG H A 67 ARG HB2 1.0 . 3.81 2581 2317 A 67 ARG H A 67 ARG HB3 1.0 . 3.81 2582 2318 A 67 ARG H A 67 ARG HD2 1.0 . 5.00 2583 2318 A 67 ARG H A 67 ARG HD3 1.0 . 5.00 2584 2319 A 67 ARG H A 68 THR H 1.0 . 3.30 2585 2320 A 67 ARG HA A 67 ARG HGy 1.0 . 4.14 2586 2321 A 67 ARG HA A 67 ARG HGy 1.0 . 4.14 2587 2322 A 67 ARG HA A 67 ARG HGy 1.0 . 4.14 2588 2323 A 67 ARG HA A 67 ARG HGy 1.0 . 4.28 2589 2324 A 67 ARG HA A 67 ARG HGx 1.0 . 4.60 2590 2325 A 67 ARG HA A 67 ARG HB2 1.0 . 3.54 2591 2325 A 67 ARG HB3 A 67 ARG HA 1.0 . 3.54 2592 2326 A 67 ARG HA A 67 ARG HB2 1.0 . 3.82 2593 2326 A 67 ARG HB3 A 67 ARG HA 1.0 . 3.82 2594 2327 A 67 ARG HA A 67 ARG HD2 1.0 . 5.14 2595 2327 A 67 ARG HA A 67 ARG HD3 1.0 . 5.14 2596 2328 A 67 ARG HA A 67 ARG HD2 1.0 . 5.35 2597 2328 A 67 ARG HA A 67 ARG HD3 1.0 . 5.35 2598 2329 A 67 ARG HA A 67 ARG HD2 1.0 . 5.42 2599 2329 A 67 ARG HA A 67 ARG HD3 1.0 . 5.42 2600 2330 A 67 ARG HA A 69 SER H 1.0 . 4.97 2601 2331 A 67 ARG HA A 70 ALA HB% 1.0 . 3.35 2602 2332 A 67 ARG HA A 70 ALA HB% 1.0 . 4.47 2603 2333 A 67 ARG HGy A 67 ARG HGx 1.0 . 2.45 2604 2334 A 67 ARG HGy A 67 ARG HD2 1.0 . 3.58 2605 2334 A 67 ARG HGy A 67 ARG HD3 1.0 . 3.58 2606 2335 A 67 ARG HGy A 67 ARG HD2 1.0 . 3.76 2607 2335 A 67 ARG HGy A 67 ARG HD3 1.0 . 3.76 2608 2336 A 67 ARG HGy A 67 ARG HD2 1.0 . 3.76 2609 2336 A 67 ARG HGy A 67 ARG HD3 1.0 . 3.76 2610 2337 A 68 THR H A 67 ARG HGy 1.0 . 4.87 2611 2338 A 68 THR H A 67 ARG HGy 1.0 . 4.87 2612 2339 A 67 ARG HGy A 67 ARG HGx 1.0 . 2.44 2613 2340 A 67 ARG HGx A 67 ARG HD2 1.0 . 3.69 2614 2340 A 67 ARG HGx A 67 ARG HD3 1.0 . 3.69 2615 2341 A 67 ARG HGy A 67 ARG HB2 1.0 . 2.87 2616 2341 A 67 ARG HB3 A 67 ARG HGy 1.0 . 2.87 2617 2342 A 67 ARG HGx A 67 ARG HB2 1.0 . 3.13 2618 2342 A 67 ARG HB3 A 67 ARG HGx 1.0 . 3.13 2619 2343 A 67 ARG HGx A 67 ARG HB2 1.0 . 3.37 2620 2343 A 67 ARG HB3 A 67 ARG HGx 1.0 . 3.37 2621 2344 A 67 ARG HB2 A 67 ARG HD2 1.0 . 3.85 2622 2344 A 67 ARG HB3 A 67 ARG HD2 1.0 . 3.85 2623 2344 A 67 ARG HD3 A 67 ARG HB2 1.0 . 3.85 2624 2344 A 67 ARG HB3 A 67 ARG HD3 1.0 . 3.85 2625 2345 A 67 ARG HB2 A 67 ARG HD2 1.0 . 4.14 2626 2345 A 67 ARG HB3 A 67 ARG HD2 1.0 . 4.14 2627 2345 A 67 ARG HD3 A 67 ARG HB2 1.0 . 4.14 2628 2345 A 67 ARG HB3 A 67 ARG HD3 1.0 . 4.14 2629 2346 A 68 THR H A 67 ARG HB2 1.0 . 3.76 2630 2346 A 67 ARG HB3 A 68 THR H 1.0 . 3.76 2631 2347 A 68 THR H A 67 ARG HB2 1.0 . 4.79 2632 2347 A 67 ARG HB3 A 68 THR H 1.0 . 4.79 2633 2348 A 68 THR H A 68 THR HA 1.0 . 3.17 2634 2349 A 68 THR H A 68 THR HA 1.0 . 4.15 2635 2350 A 68 THR H A 68 THR HB 1.0 . 4.32 2636 2351 A 68 THR H A 68 THR HG2% 1.0 . 3.97 2637 2352 A 68 THR H A 69 SER H 1.0 . 3.37 2638 2353 A 68 THR H A 69 SER H 1.0 . 4.61 2639 2354 A 68 THR HA A 68 THR HB 1.0 . 2.43 2640 2355 A 68 THR HA A 68 THR HB 1.0 . 2.72 2641 2356 A 68 THR HA A 68 THR HG2% 1.0 . 3.75 2642 2357 A 69 SER H A 68 THR HA 1.0 . 3.28 2643 2358 A 69 SER H A 68 THR HA 1.0 . 4.31 2644 2359 A 69 SER H A 68 THR HB 1.0 . 4.70 2645 2360 A 68 THR HB A 68 THR HG2% 1.0 . 3.46 2646 2361 A 69 SER H A 68 THR HG2% 1.0 . 4.31 2647 2362 A 69 SER H A 69 SER HA 1.0 . 3.57 2648 2363 A 69 SER H A 69 SER HA 1.0 . 3.67 2649 2364 A 69 SER H A 69 SER HBy 1.0 . 4.26 2650 2365 A 69 SER H A 69 SER HBx 1.0 . 3.42 2651 2366 A 69 SER H A 69 SER HBx 1.0 . 4.05 2652 2367 A 69 SER HA A 69 SER HBy 1.0 . 3.62 2653 2368 A 69 SER HA A 69 SER HBy 1.0 . 3.69 2654 2369 A 69 SER HA A 69 SER HBx 1.0 . 3.49 2655 2370 A 69 SER HA A 69 SER HBx 1.0 . 3.59 2656 2371 A 69 SER HA A 70 ALA H 1.0 . 3.50 2657 2372 A 69 SER HBy A 69 SER HBx 1.0 . 2.40 2658 2373 A 69 SER HBy A 69 SER HBx 1.0 . 2.40 2659 2374 A 69 SER HBx A 70 ALA H 1.0 . 4.05 2660 2375 A 70 ALA H A 70 ALA HA 1.0 . 3.47 2661 2376 A 70 ALA H A 70 ALA HA 1.0 . 4.14 2662 2377 A 70 ALA HB% A 70 ALA H 1.0 . 3.17 2663 2378 A 70 ALA HB% A 70 ALA H 1.0 . 3.69 2664 2379 A 70 ALA H A 71 LYS H 1.0 . 3.51 2665 2380 A 70 ALA H A 71 LYS H 1.0 . 3.62 2666 2381 A 70 ALA HA A 71 LYS H 1.0 . 4.02 2667 2382 A 70 ALA HB% A 70 ALA HA 1.0 . 3.47 2668 2383 A 70 ALA HB% A 71 LYS H 1.0 . 3.55 2669 2384 A 70 ALA HB% A 71 LYS H 1.0 . 4.48 2670 2385 A 71 LYS H A 71 LYS HA 1.0 . 3.32 2671 2386 A 71 LYS H A 71 LYS HA 1.0 . 3.93 2672 2387 A 71 LYS H A 71 LYS HBy 1.0 . 4.55 2673 2388 A 71 LYS H A 71 LYS HBx 1.0 . 3.44 2674 2389 A 71 LYS H A 71 LYS HBx 1.0 . 4.27 2675 2390 A 71 LYS H A 71 LYS HBx 1.0 . 4.75 2676 2391 A 71 LYS HA A 71 LYS HBy 1.0 . 3.82 2677 2392 A 71 LYS HA A 71 LYS HBy 1.0 . 4.43 2678 2393 A 71 LYS HA A 71 LYS HBx 1.0 . 4.03 2679 2394 A 71 LYS HA A 71 LYS HBx 1.0 . 4.50 2680 2395 A 71 LYS HA A 71 LYS HD2 1.0 . 4.99 2681 2395 A 71 LYS HA A 71 LYS HD3 1.0 . 4.99 2682 2396 A 71 LYS HA A 71 LYS HD2 1.0 . 5.19 2683 2396 A 71 LYS HA A 71 LYS HD3 1.0 . 5.19 2684 2397 A 71 LYS HA A 71 LYS HE2 1.0 . 5.50 2685 2397 A 71 LYS HA A 71 LYS HE3 1.0 . 5.50 2686 2398 A 71 LYS HA A 71 LYS HG2 1.0 . 5.04 2687 2398 A 71 LYS HA A 71 LYS HG3 1.0 . 5.04 2688 2399 A 71 LYS HA A 72 MET H 1.0 . 3.49 2689 2400 A 71 LYS HBy A 71 LYS HD2 1.0 . 5.44 2690 2400 A 71 LYS HBy A 71 LYS HD3 1.0 . 5.44 2691 2401 A 71 LYS HBy A 71 LYS HE2 1.0 . 5.50 2692 2401 A 71 LYS HBy A 71 LYS HE3 1.0 . 5.50 2693 2402 A 71 LYS HBy A 71 LYS HG2 1.0 . 4.17 2694 2402 A 71 LYS HBy A 71 LYS HG3 1.0 . 4.17 2695 2403 A 71 LYS HBy A 71 LYS HG2 1.0 . 4.85 2696 2403 A 71 LYS HBy A 71 LYS HG3 1.0 . 4.85 2697 2404 A 71 LYS HBy A 72 MET H 1.0 . 4.18 2698 2405 A 71 LYS HBy A 71 LYS HBx 1.0 . 2.61 2699 2406 A 71 LYS HBx A 71 LYS HD2 1.0 . 3.40 2700 2406 A 71 LYS HBx A 71 LYS HD3 1.0 . 3.40 2701 2407 A 71 LYS HBx A 71 LYS HD2 1.0 . 3.52 2702 2407 A 71 LYS HBx A 71 LYS HD3 1.0 . 3.52 2703 2408 A 71 LYS HBx A 71 LYS HD2 1.0 . 3.80 2704 2408 A 71 LYS HBx A 71 LYS HD3 1.0 . 3.80 2705 2409 A 71 LYS HBx A 71 LYS HD2 1.0 . 3.90 2706 2409 A 71 LYS HBx A 71 LYS HD3 1.0 . 3.90 2707 2410 A 71 LYS HBx A 71 LYS HE2 1.0 . 5.11 2708 2410 A 71 LYS HBx A 71 LYS HE3 1.0 . 5.11 2709 2411 A 71 LYS HBx A 71 LYS HE2 1.0 . 5.50 2710 2411 A 71 LYS HBx A 71 LYS HE3 1.0 . 5.50 2711 2412 A 71 LYS HBx A 71 LYS HE2 1.0 . 5.50 2712 2412 A 71 LYS HBx A 71 LYS HE3 1.0 . 5.50 2713 2413 A 71 LYS HBx A 71 LYS HG2 1.0 . 3.68 2714 2413 A 71 LYS HBx A 71 LYS HG3 1.0 . 3.68 2715 2414 A 71 LYS HBx A 71 LYS HG2 1.0 . 4.40 2716 2414 A 71 LYS HBx A 71 LYS HG3 1.0 . 4.40 2717 2415 A 71 LYS HBx A 71 LYS HG2 1.0 . 4.43 2718 2415 A 71 LYS HBx A 71 LYS HG3 1.0 . 4.43 2719 2416 A 71 LYS HBx A 71 LYS HG2 1.0 . 4.54 2720 2416 A 71 LYS HBx A 71 LYS HG3 1.0 . 4.54 2721 2417 A 71 LYS HD2 A 71 LYS HE2 1.0 . 3.95 2722 2417 A 71 LYS HD3 A 71 LYS HE2 1.0 . 3.95 2723 2417 A 71 LYS HE3 A 71 LYS HD2 1.0 . 3.95 2724 2417 A 71 LYS HD3 A 71 LYS HE3 1.0 . 3.95 2725 2418 A 71 LYS HD2 A 71 LYS HE2 1.0 . 4.38 2726 2418 A 71 LYS HD3 A 71 LYS HE2 1.0 . 4.38 2727 2418 A 71 LYS HE3 A 71 LYS HD2 1.0 . 4.38 2728 2418 A 71 LYS HD3 A 71 LYS HE3 1.0 . 4.38 2729 2419 A 71 LYS HD2 A 71 LYS HE2 1.0 . 4.38 2730 2419 A 71 LYS HD3 A 71 LYS HE2 1.0 . 4.38 2731 2419 A 71 LYS HE3 A 71 LYS HD2 1.0 . 4.38 2732 2419 A 71 LYS HD3 A 71 LYS HE3 1.0 . 4.38 2733 2420 A 71 LYS HD2 A 71 LYS HE2 1.0 . 4.43 2734 2420 A 71 LYS HD3 A 71 LYS HE2 1.0 . 4.43 2735 2420 A 71 LYS HE3 A 71 LYS HD2 1.0 . 4.43 2736 2420 A 71 LYS HD3 A 71 LYS HE3 1.0 . 4.43 2737 2421 A 71 LYS HD3 A 71 LYS HG2 1.0 . 2.54 2738 2421 A 71 LYS HD2 A 71 LYS HG2 1.0 . 2.54 2739 2421 A 71 LYS HG3 A 71 LYS HD2 1.0 . 2.54 2740 2421 A 71 LYS HD3 A 71 LYS HG3 1.0 . 2.54 2741 2422 A 71 LYS HD3 A 71 LYS HG2 1.0 . 2.54 2742 2422 A 71 LYS HD2 A 71 LYS HG2 1.0 . 2.54 2743 2422 A 71 LYS HG3 A 71 LYS HD2 1.0 . 2.54 2744 2422 A 71 LYS HD3 A 71 LYS HG3 1.0 . 2.54 2745 2423 A 71 LYS HD3 A 71 LYS HG2 1.0 . 2.93 2746 2423 A 71 LYS HD2 A 71 LYS HG2 1.0 . 2.93 2747 2423 A 71 LYS HG3 A 71 LYS HD2 1.0 . 2.93 2748 2423 A 71 LYS HD3 A 71 LYS HG3 1.0 . 2.93 2749 2424 A 71 LYS HD3 A 71 LYS HG2 1.0 . 2.93 2750 2424 A 71 LYS HD2 A 71 LYS HG2 1.0 . 2.93 2751 2424 A 71 LYS HG3 A 71 LYS HD2 1.0 . 2.93 2752 2424 A 71 LYS HD3 A 71 LYS HG3 1.0 . 2.93 2753 2425 A 71 LYS HE2 A 71 LYS HG2 1.0 . 4.32 2754 2425 A 71 LYS HG3 A 71 LYS HE2 1.0 . 4.32 2755 2425 A 71 LYS HE3 A 71 LYS HG3 1.0 . 4.32 2756 2425 A 71 LYS HE3 A 71 LYS HG2 1.0 . 4.32 2757 2426 A 71 LYS HE2 A 71 LYS HG2 1.0 . 5.44 2758 2426 A 71 LYS HG3 A 71 LYS HE2 1.0 . 5.44 2759 2426 A 71 LYS HE3 A 71 LYS HG3 1.0 . 5.44 2760 2426 A 71 LYS HE3 A 71 LYS HG2 1.0 . 5.44 2761 2427 A 71 LYS HE2 A 71 LYS HG2 1.0 . 5.50 2762 2427 A 71 LYS HG3 A 71 LYS HE2 1.0 . 5.50 2763 2427 A 71 LYS HE3 A 71 LYS HG3 1.0 . 5.50 2764 2427 A 71 LYS HE3 A 71 LYS HG2 1.0 . 5.50 2765 2428 A 72 MET H A 72 MET HA 1.0 . 3.65 2766 2429 A 72 MET H A 72 MET HBy 1.0 . 4.54 2767 2430 A 72 MET H A 72 MET HBx 1.0 . 3.36 2768 2431 A 72 MET HA A 72 MET HBy 1.0 . 5.50 2769 2432 A 72 MET HA A 72 MET HBx 1.0 . 3.86 2770 2433 A 72 MET HA A 72 MET HBx 1.0 . 4.83 2771 2434 A 72 MET HA A 72 MET HBx 1.0 . 4.83 2772 2435 A 72 MET HA A 72 MET HGy 1.0 . 4.88 2773 2436 A 72 MET HA A 72 MET HGy 1.0 . 5.50 2774 2437 A 72 MET HA A 73 LYS H 1.0 . 3.32 2775 2438 A 72 MET HBy A 72 MET HBx 1.0 . 3.67 2776 2439 A 72 MET HBy A 72 MET HBx 1.0 . 3.82 2777 2440 A 72 MET HBy A 72 MET HGy 1.0 . 2.92 2778 2441 A 72 MET HBy A 72 MET HGy 1.0 . 2.97 2779 2442 A 72 MET HBy A 72 MET HBx 1.0 . 3.59 2780 2443 A 72 MET HBx A 72 MET HGy 1.0 . 3.65 2781 2444 A 72 MET HBx A 72 MET HGy 1.0 . 3.67 2782 2445 A 72 MET HBx A 72 MET HGy 1.0 . 3.77 2783 2446 A 72 MET HBx A 72 MET HGy 1.0 . 3.87 2784 2447 A 72 MET HBx A 73 LYS H 1.0 . 4.35 2785 2448 A 73 LYS H A 73 LYS HA 1.0 . 3.64 2786 2449 A 73 LYS H A 73 LYS HG2 1.0 . 4.38 2787 2449 A 73 LYS H A 73 LYS HG3 1.0 . 4.38 2788 2450 A 73 LYS HA A 73 LYS HB2 1.0 . 4.17 2789 2450 A 73 LYS HA A 73 LYS HB3 1.0 . 4.17 2790 2451 A 73 LYS HA A 73 LYS HB2 1.0 . 4.17 2791 2451 A 73 LYS HA A 73 LYS HB3 1.0 . 4.17 2792 2452 A 73 LYS HA A 73 LYS HD2 1.0 . 5.13 2793 2452 A 73 LYS HA A 73 LYS HD3 1.0 . 5.13 2794 2453 A 73 LYS HA A 73 LYS HD2 1.0 . 5.42 2795 2453 A 73 LYS HA A 73 LYS HD3 1.0 . 5.42 2796 2454 A 73 LYS HA A 73 LYS HE2 1.0 . 5.50 2797 2454 A 73 LYS HA A 73 LYS HE3 1.0 . 5.50 2798 2455 A 73 LYS HA A 73 LYS HE2 1.0 . 5.50 2799 2455 A 73 LYS HA A 73 LYS HE3 1.0 . 5.50 2800 2456 A 73 LYS HA A 73 LYS HG2 1.0 . 4.53 2801 2456 A 73 LYS HA A 73 LYS HG3 1.0 . 4.53 2802 2457 A 73 LYS HA A 73 LYS HG2 1.0 . 5.13 2803 2457 A 73 LYS HA A 73 LYS HG3 1.0 . 5.13 2804 2458 A 73 LYS HA A 74 ARG H 1.0 . 3.44 2805 2459 A 74 ARG H A 73 LYS HB2 1.0 . 5.50 2806 2459 A 73 LYS HB3 A 74 ARG H 1.0 . 5.50 2807 2460 A 74 ARG H A 74 ARG HG2 1.0 . 4.50 2808 2460 A 74 ARG H A 74 ARG HG3 1.0 . 4.50 2809 2461 A 74 ARG HA A 74 ARG HB2 1.0 . 4.40 2810 2461 A 74 ARG HA A 74 ARG HB3 1.0 . 4.40 2811 2462 A 74 ARG HA A 74 ARG HB2 1.0 . 4.48 2812 2462 A 74 ARG HA A 74 ARG HB3 1.0 . 4.48 2813 2463 A 74 ARG HA A 74 ARG HD2 1.0 . 5.50 2814 2463 A 74 ARG HA A 74 ARG HD3 1.0 . 5.50 2815 2464 A 74 ARG HA A 74 ARG HG2 1.0 . 5.00 2816 2464 A 74 ARG HG3 A 74 ARG HA 1.0 . 5.00 2817 2465 A 74 ARG HA A 75 ARG H 1.0 . 3.57 2818 2466 A 74 ARG HA A 75 ARG H 1.0 . 4.50 2819 2467 A 75 ARG H A 74 ARG HB2 1.0 . 4.21 2820 2467 A 74 ARG HB3 A 75 ARG H 1.0 . 4.21 2821 2468 A 75 ARG H A 74 ARG HB2 1.0 . 4.33 2822 2468 A 74 ARG HB3 A 75 ARG H 1.0 . 4.33 2823 2469 A 74 ARG HD3 A 74 ARG HG2 1.0 . 3.07 2824 2469 A 74 ARG HG3 A 74 ARG HD2 1.0 . 3.07 2825 2469 A 74 ARG HG3 A 74 ARG HD3 1.0 . 3.07 2826 2469 A 74 ARG HD2 A 74 ARG HG2 1.0 . 3.07 2827 2470 A 75 ARG H A 74 ARG HG2 1.0 . 4.57 2828 2470 A 74 ARG HG3 A 75 ARG H 1.0 . 4.57 2829 2471 A 75 ARG H A 75 ARG HA 1.0 . 4.35 2830 2472 A 75 ARG H A 75 ARG HB2 1.0 . 4.43 2831 2472 A 75 ARG H A 75 ARG HB3 1.0 . 4.43 2832 2473 A 75 ARG HA A 75 ARG HG2 1.0 . 5.15 2833 2473 A 75 ARG HA A 75 ARG HG3 1.0 . 5.15 2834 2474 A 75 ARG HA A 76 SER H 1.0 . 4.01 2835 2475 A 75 ARG HB2 A 75 ARG HG2 1.0 . 2.72 2836 2475 A 75 ARG HB3 A 75 ARG HG2 1.0 . 2.72 2837 2475 A 75 ARG HG3 A 75 ARG HB2 1.0 . 2.72 2838 2475 A 75 ARG HB3 A 75 ARG HG3 1.0 . 2.72 2839 2476 A 75 ARG HD3 A 75 ARG HG2 1.0 . 3.99 2840 2476 A 75 ARG HD2 A 75 ARG HG2 1.0 . 3.99 2841 2476 A 75 ARG HG3 A 75 ARG HD2 1.0 . 3.99 2842 2476 A 75 ARG HG3 A 75 ARG HD3 1.0 . 3.99 2843 2477 A 76 SER HA A 76 SER HB2 1.0 . 5.02 2844 2477 A 76 SER HA A 76 SER HB3 1.0 . 5.02 2845 2478 A 76 SER HA A 76 SER HB2 1.0 . 5.50 2846 2478 A 76 SER HA A 76 SER HB3 1.0 . 5.50 2847 2479 A 76 SER HA A 77 SER H 1.0 . 4.38 2848 2480 A 77 SER HA A 77 SER HB2 1.0 . 4.71 2849 2480 A 77 SER HA A 77 SER HB3 1.0 . 4.71 2850 2481 A 77 SER HA A 77 SER HB2 1.0 . 5.27 2851 2481 A 77 SER HA A 77 SER HB3 1.0 . 5.27 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 4 ASP C A 5 ALA N A 5 ALA CA A 5 ALA C 1.0 -95.0 -44.0 PHI 2 2 A 5 ALA N A 5 ALA CA A 5 ALA C A 6 GLU N 1.0 -62.5 -4.9 PSI 3 3 A 7 ASP C A 8 CYS N A 8 CYS CA A 8 CYS C 1.0 -180.9 -82.6 PHI 4 4 A 8 CYS N A 8 CYS CA A 8 CYS C A 9 CYS N 1.0 122.6 197.8 PSI 5 5 A 10 LEU C A 11 SER N A 11 SER CA A 11 SER C 1.0 -176.7 -88.4 PHI 6 6 A 11 SER N A 11 SER CA A 11 SER C A 12 VAL N 1.0 131.0 186.0 PSI 7 7 A 11 SER C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -154.8 -99.3 PHI 8 8 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 THR N 1.0 133.7 173.7 PSI 9 9 A 12 VAL C A 13 THR N A 13 THR CA A 13 THR C 1.0 -105.2 -55.5 PHI 10 10 A 13 THR N A 13 THR CA A 13 THR C A 14 GLN N 1.0 114.1 176.9 PSI 11 11 A 16 PRO C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -153.6 -51.4 PHI 12 12 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 PRO N 1.0 77.9 180.6 PSI 13 13 A 18 PRO N A 18 PRO CA A 18 PRO C A 19 GLY N 1.0 128.9 168.9 PSI 14 14 A 18 PRO C A 19 GLY N A 19 GLY CA A 19 GLY C 1.0 -79.7 -29.4 PHI 15 15 A 19 GLY N A 19 GLY CA A 19 GLY C A 20 TYR N 1.0 -63.3 0.3 PSI 16 16 A 19 GLY C A 20 TYR N A 20 TYR CA A 20 TYR C 1.0 -98.2 -58.2 PHI 17 17 A 20 TYR N A 20 TYR CA A 20 TYR C A 21 ILE N 1.0 -60.2 2.4 PSI 18 18 A 20 TYR C A 21 ILE N A 21 ILE CA A 21 ILE C 1.0 -127.5 -67.1 PHI 19 19 A 21 ILE N A 21 ILE CA A 21 ILE C A 22 VAL N 1.0 -34.6 19.0 PSI 20 20 A 21 ILE C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -148.8 -35.2 PHI 21 21 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 ARG N 1.0 76.9 184.7 PSI 22 22 A 22 VAL C A 23 ARG N A 23 ARG CA A 23 ARG C 1.0 -117.3 -66.8 PHI 23 23 A 23 ARG N A 23 ARG CA A 23 ARG C A 24 ASN N 1.0 -55.5 -14.0 PSI 24 24 A 24 ASN C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -178.9 -89.4 PHI 25 25 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 HIS N 1.0 135.1 176.8 PSI 26 26 A 25 PHE C A 26 HIS N A 26 HIS CA A 26 HIS C 1.0 -183.0 -76.9 PHI 27 27 A 26 HIS N A 26 HIS CA A 26 HIS C A 27 TYR N 1.0 112.9 175.5 PSI 28 28 A 26 HIS C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -130.2 -59.0 PHI 29 29 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 LEU N 1.0 89.0 187.5 PSI 30 30 A 27 TYR C A 28 LEU N A 28 LEU CA A 28 LEU C 1.0 -162.8 -78.3 PHI 31 31 A 28 LEU N A 28 LEU CA A 28 LEU C A 29 LEU N 1.0 118.0 164.3 PSI 32 32 A 28 LEU C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -140.5 -46.0 PHI 33 33 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 ILE N 1.0 114.1 191.4 PSI 34 34 A 29 LEU C A 30 ILE N A 30 ILE CA A 30 ILE C 1.0 -77.5 -37.5 PHI 35 35 A 30 ILE N A 30 ILE CA A 30 ILE C A 31 LYS N 1.0 -53.6 -13.6 PSI 36 36 A 30 ILE C A 31 LYS N A 31 LYS CA A 31 LYS C 1.0 -90.7 -50.7 PHI 37 37 A 31 LYS N A 31 LYS CA A 31 LYS C A 32 ASP N 1.0 -55.0 6.1 PSI 38 38 A 31 LYS C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -113.1 -49.0 PHI 39 39 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 GLY N 1.0 -57.0 4.1 PSI 40 40 A 37 PRO N A 37 PRO CA A 37 PRO C A 38 ALA N 1.0 130.9 173.3 PSI 41 41 A 38 ALA C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -156.9 -99.8 PHI 42 42 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 VAL N 1.0 100.9 157.9 PSI 43 43 A 39 VAL C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -134.6 -75.8 PHI 44 44 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 PHE N 1.0 100.6 149.7 PSI 45 45 A 40 VAL C A 41 PHE N A 41 PHE CA A 41 PHE C 1.0 -135.5 -86.1 PHI 46 46 A 41 PHE N A 41 PHE CA A 41 PHE C A 42 THR N 1.0 104.3 168.2 PSI 47 47 A 45 ARG C A 46 GLY N A 46 GLY CA A 46 GLY C 1.0 74.1 116.0 PHI 48 48 A 46 GLY N A 46 GLY CA A 46 GLY C A 47 ARG N 1.0 -24.2 15.8 PSI 49 49 A 47 ARG C A 48 GLN N A 48 GLN CA A 48 GLN C 1.0 -158.6 -59.4 PHI 50 50 A 48 GLN N A 48 GLN CA A 48 GLN C A 49 LEU N 1.0 104.0 177.2 PSI 51 51 A 48 GLN C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -170.4 -74.2 PHI 52 52 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 CYS N 1.0 114.6 191.2 PSI 53 53 A 49 LEU C A 50 CYS N A 50 CYS CA A 50 CYS C 1.0 -150.7 -78.2 PHI 54 54 A 50 CYS N A 50 CYS CA A 50 CYS C A 51 ALA N 1.0 114.7 171.3 PSI 55 55 A 52 PRO N A 52 PRO CA A 52 PRO C A 53 PRO N 1.0 108.3 181.4 PSI 56 56 A 53 PRO N A 53 PRO CA A 53 PRO C A 54 ASP N 1.0 -41.3 -1.3 PSI 57 57 A 53 PRO C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -123.2 -52.2 PHI 58 58 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 GLN N 1.0 -48.5 30.6 PSI 59 59 A 56 PRO N A 56 PRO CA A 56 PRO C A 57 TRP N 1.0 -56.5 -8.2 PSI 60 60 A 56 PRO C A 57 TRP N A 57 TRP CA A 57 TRP C 1.0 -88.0 -48.0 PHI 61 61 A 57 TRP N A 57 TRP CA A 57 TRP C A 58 VAL N 1.0 -57.8 -11.8 PSI 62 62 A 58 VAL C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -81.9 -41.9 PHI 63 63 A 59 GLU N A 59 GLU CA A 59 GLU C A 60 ARG N 1.0 -65.4 -25.4 PSI 64 64 A 59 GLU C A 60 ARG N A 60 ARG CA A 60 ARG C 1.0 -83.9 -43.9 PHI 65 65 A 60 ARG N A 60 ARG CA A 60 ARG C A 61 ILE N 1.0 -59.9 -19.9 PSI 66 66 A 60 ARG C A 61 ILE N A 61 ILE CA A 61 ILE C 1.0 -84.7 -44.7 PHI 67 67 A 61 ILE N A 61 ILE CA A 61 ILE C A 62 ILE N 1.0 -65.4 -25.4 PSI 68 68 A 61 ILE C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -78.9 -38.9 PHI 69 69 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 GLN N 1.0 -66.6 -26.6 PSI 70 70 A 62 ILE C A 63 GLN N A 63 GLN CA A 63 GLN C 1.0 -80.5 -40.5 PHI 71 71 A 63 GLN N A 63 GLN CA A 63 GLN C A 64 ARG N 1.0 -58.3 -18.3 PSI 72 72 A 63 GLN C A 64 ARG N A 64 ARG CA A 64 ARG C 1.0 -82.4 -42.4 PHI 73 73 A 64 ARG N A 64 ARG CA A 64 ARG C A 65 LEU N 1.0 -62.0 -22.0 PSI 74 74 A 64 ARG C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -84.0 -44.0 PHI 75 75 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 GLN N 1.0 -62.6 -22.6 PSI 76 76 A 65 LEU C A 66 GLN N A 66 GLN CA A 66 GLN C 1.0 -84.0 -44.0 PHI 77 77 A 66 GLN N A 66 GLN CA A 66 GLN C A 67 ARG N 1.0 -60.6 -20.6 PSI 78 78 A 66 GLN C A 67 ARG N A 67 ARG CA A 67 ARG C 1.0 -83.8 -43.8 PHI 79 79 A 67 ARG N A 67 ARG CA A 67 ARG C A 68 THR N 1.0 -63.8 -7.3 PSI 80 80 A 67 ARG C A 68 THR N A 68 THR CA A 68 THR C 1.0 -84.4 -44.4 PHI 81 81 A 68 THR N A 68 THR CA A 68 THR C A 69 SER N 1.0 -65.4 -20.2 PSI 82 82 A 68 THR C A 69 SER N A 69 SER CA A 69 SER C 1.0 -86.4 -46.4 PHI 83 83 A 69 SER N A 69 SER CA A 69 SER C A 70 ALA N 1.0 -58.1 -12.5 PSI 84 84 A 69 SER C A 70 ALA N A 70 ALA CA A 70 ALA C 1.0 -84.7 -44.7 PHI 85 85 A 70 ALA N A 70 ALA CA A 70 ALA C A 71 LYS N 1.0 -59.5 -19.5 PSI stop_ save_