data_nef_c25033_2mqh 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 NCBI AAN77901.2 PDB 2MQH stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ARG middle . . 3 A 3 GLY middle . false 4 A 4 SER middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 HIS middle . . 10 A 10 HIS middle . . 11 A 11 GLY middle . false 12 A 12 SER middle . . 13 A 13 GLY middle . false 14 A 14 GLU middle . . 15 A 15 GLN middle . . 16 A 16 LEU middle . . 17 A 17 ARG middle . . 18 A 18 GLN middle . . 19 A 19 GLN middle . . 20 A 20 GLY middle . false 21 A 21 THR middle . . 22 A 22 VAL middle . . 23 A 23 LYS middle . . 24 A 24 TRP middle . . 25 A 25 PHE middle . . 26 A 26 ASN middle . . 27 A 27 ALA middle . . 28 A 28 THR middle . . 29 A 29 LYS middle . . 30 A 30 GLY middle . false 31 A 31 PHE middle . . 32 A 32 GLY middle . false 33 A 33 PHE middle . . 34 A 34 ILE middle . . 35 A 35 THR middle . . 36 A 36 PRO middle . false 37 A 37 GLY middle . false 38 A 38 GLY middle . false 39 A 39 GLY middle . false 40 A 40 GLY middle . false 41 A 41 GLU middle . . 42 A 42 ASP middle . . 43 A 43 LEU middle . . 44 A 44 PHE middle . . 45 A 45 VAL middle . . 46 A 46 HIS middle . . 47 A 47 GLN middle . . 48 A 48 THR middle . . 49 A 49 ASN middle . . 50 A 50 ILE middle . . 51 A 51 ASN middle . . 52 A 52 SER middle . . 53 A 53 GLU middle . . 54 A 54 GLY middle . false 55 A 55 PHE middle . . 56 A 56 ARG middle . . 57 A 57 SER middle . . 58 A 58 LEU middle . . 59 A 59 ARG middle . . 60 A 60 GLU middle . . 61 A 61 GLY middle . false 62 A 62 GLU middle . . 63 A 63 VAL middle . . 64 A 64 VAL middle . . 65 A 65 GLU middle . . 66 A 66 PHE middle . . 67 A 67 GLU middle . . 68 A 68 VAL middle . . 69 A 69 GLU middle . . 70 A 70 ALA middle . . 71 A 71 GLY middle . false 72 A 72 PRO middle . false 73 A 73 ASP middle . . 74 A 74 GLY middle . false 75 A 75 ARG middle . . 76 A 76 SER middle . . 77 A 77 LYS middle . . 78 A 78 ALA middle . . 79 A 79 VAL middle . . 80 A 80 ASN middle . . 81 A 81 VAL middle . . 82 A 82 THR 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 11 GLY C C 13 174.266 0.000 A 12 SER H H 1 8.422 0.018 A 12 SER C C 13 175.271 0.000 A 12 SER CA C 13 58.570 0.000 A 12 SER CB C 13 63.984 0.000 A 12 SER N N 15 116.112 0.141 A 13 GLY H H 1 8.537 0.030 A 13 GLY HAy H 1 4.750 0.022 A 13 GLY HAx H 1 3.996 0.000 A 13 GLY C C 13 174.238 0.000 A 13 GLY CA C 13 45.520 0.000 A 13 GLY N N 15 111.178 0.090 A 14 GLU H H 1 8.285 0.002 A 14 GLU HA H 1 4.267 0.004 A 14 GLU HBx H 1 1.915 0.001 A 14 GLU HBy H 1 2.050 0.000 A 14 GLU HGx H 1 2.248 0.000 A 14 GLU HGy H 1 2.248 0.000 A 14 GLU C C 13 176.455 0.000 A 14 GLU CA C 13 56.753 0.000 A 14 GLU CB C 13 30.464 0.007 A 14 GLU CG C 13 36.110 0.000 A 14 GLU N N 15 120.547 0.038 A 15 GLN H H 1 8.444 0.015 A 15 GLN HA H 1 4.349 0.000 A 15 GLN HBx H 1 1.966 0.001 A 15 GLN HBy H 1 2.090 0.000 A 15 GLN HE2y H 1 7.614 0.004 A 15 GLN HE2x H 1 6.924 0.004 A 15 GLN HGx H 1 2.355 0.001 A 15 GLN HGy H 1 2.355 0.001 A 15 GLN C C 13 175.494 0.000 A 15 GLN CA C 13 55.670 0.000 A 15 GLN CB C 13 29.410 0.000 A 15 GLN CG C 13 33.760 0.000 A 15 GLN N N 15 121.185 0.053 A 15 GLN NE2 N 15 112.743 0.032 A 16 LEU H H 1 8.289 0.005 A 16 LEU HA H 1 4.341 0.001 A 16 LEU HBx H 1 1.600 0.000 A 16 LEU HBy H 1 1.600 0.000 A 16 LEU HDx% H 1 0.846 0.002 A 16 LEU HDy% H 1 0.904 0.000 A 16 LEU HG H 1 1.565 0.000 A 16 LEU C C 13 176.942 0.000 A 16 LEU CA C 13 55.504 0.010 A 16 LEU CB C 13 42.519 0.000 A 16 LEU CDx C 13 24.111 0.006 A 16 LEU CDy C 13 24.700 0.000 A 16 LEU CG C 13 27.285 0.000 A 16 LEU N N 15 123.934 0.156 A 17 ARG H H 1 8.216 0.007 A 17 ARG HA H 1 4.464 0.000 A 17 ARG HBx H 1 1.586 0.000 A 17 ARG HBy H 1 1.656 0.001 A 17 ARG HDx H 1 3.175 0.001 A 17 ARG HDy H 1 3.175 0.001 A 17 ARG HGx H 1 1.825 0.001 A 17 ARG HGy H 1 1.825 0.001 A 17 ARG C C 13 175.829 0.000 A 17 ARG CA C 13 55.672 0.000 A 17 ARG CB C 13 29.830 0.000 A 17 ARG CD C 13 43.453 0.000 A 17 ARG CG C 13 30.573 0.000 A 17 ARG N N 15 122.044 0.035 A 18 GLN H H 1 8.573 0.013 A 18 GLN HA H 1 4.334 0.001 A 18 GLN HBx H 1 1.593 0.000 A 18 GLN HBy H 1 1.635 0.000 A 18 GLN HGx H 1 1.941 0.001 A 18 GLN HGy H 1 1.941 0.001 A 18 GLN C C 13 172.958 0.000 A 18 GLN CA C 13 54.900 0.000 A 18 GLN CB C 13 32.620 0.000 A 18 GLN CG C 13 33.760 0.000 A 18 GLN N N 15 122.488 0.028 A 19 GLN H H 1 8.146 0.003 A 19 GLN HA H 1 5.378 0.000 A 19 GLN HBx H 1 2.347 0.000 A 19 GLN HBy H 1 2.347 0.000 A 19 GLN HE2y H 1 7.546 0.002 A 19 GLN HE2x H 1 6.846 0.002 A 19 GLN HGx H 1 1.979 0.000 A 19 GLN HGy H 1 2.025 0.000 A 19 GLN C C 13 176.902 0.000 A 19 GLN CA C 13 54.215 0.001 A 19 GLN CB C 13 34.638 0.000 A 19 GLN CG C 13 32.595 0.000 A 19 GLN N N 15 116.301 0.044 A 19 GLN NE2 N 15 111.880 0.031 A 20 GLY H H 1 8.998 0.003 A 20 GLY HAx H 1 4.000 0.005 A 20 GLY HAy H 1 4.589 0.000 A 20 GLY C C 13 170.989 0.000 A 20 GLY CA C 13 45.935 0.000 A 20 GLY N N 15 109.745 0.021 A 21 THR H H 1 8.312 0.007 A 21 THR HA H 1 5.361 0.001 A 21 THR HB H 1 3.783 0.001 A 21 THR HG2% H 1 1.119 0.003 A 21 THR C C 13 174.553 0.000 A 21 THR CA C 13 60.025 0.000 A 21 THR CB C 13 71.720 0.000 A 21 THR CG2 C 13 21.995 0.000 A 21 THR N N 15 112.645 0.139 A 22 VAL H H 1 9.092 0.006 A 22 VAL HA H 1 3.649 0.002 A 22 VAL HB H 1 2.448 0.001 A 22 VAL HGx% H 1 0.520 0.001 A 22 VAL HGy% H 1 0.869 0.000 A 22 VAL C C 13 175.553 0.000 A 22 VAL CA C 13 64.618 0.000 A 22 VAL CB C 13 31.621 0.000 A 22 VAL CGx C 13 21.120 0.000 A 22 VAL CGy C 13 24.283 0.000 A 22 VAL N N 15 125.915 0.092 A 23 LYS H H 1 9.276 0.000 A 23 LYS HA H 1 4.301 0.000 A 23 LYS HBx H 1 1.940 0.004 A 23 LYS HBy H 1 1.940 0.004 A 23 LYS HDx H 1 1.610 0.001 A 23 LYS HDy H 1 1.610 0.001 A 23 LYS HEx H 1 3.032 0.000 A 23 LYS HEy H 1 3.032 0.000 A 23 LYS HGx H 1 1.557 0.000 A 23 LYS HGy H 1 1.557 0.000 A 23 LYS C C 13 176.301 0.000 A 23 LYS CA C 13 58.610 0.000 A 23 LYS CB C 13 34.300 0.000 A 23 LYS CD C 13 29.230 0.000 A 23 LYS CE C 13 41.580 0.000 A 23 LYS CG C 13 24.960 0.000 A 23 LYS N N 15 135.79 0.000 A 24 TRP H H 1 7.455 0.019 A 24 TRP HA H 1 4.623 0.001 A 24 TRP HBy H 1 3.502 0.002 A 24 TRP HBx H 1 3.428 0.002 A 24 TRP HD1 H 1 7.145 0.008 A 24 TRP HE1 H 1 10.322 0.012 A 24 TRP HZ2 H 1 7.633 0.002 A 24 TRP C C 13 173.628 0.000 A 24 TRP CA C 13 56.300 0.000 A 24 TRP CB C 13 31.260 0.000 A 24 TRP CD1 C 13 128.052 0.073 A 24 TRP CZ2 C 13 115.262 0.000 A 24 TRP N N 15 111.651 0.070 A 24 TRP NE1 N 15 130.159 0.119 A 25 PHE H H 1 9.074 0.009 A 25 PHE HA H 1 4.285 0.001 A 25 PHE HBy H 1 2.800 0.007 A 25 PHE HBx H 1 2.427 0.003 A 25 PHE HDx H 1 6.744 0.001 A 25 PHE HDy H 1 6.744 0.001 A 25 PHE HEx H 1 7.486 0.000 A 25 PHE HEy H 1 7.486 0.000 A 25 PHE C C 13 172.354 0.000 A 25 PHE CA C 13 59.372 0.000 A 25 PHE CB C 13 42.569 0.000 A 25 PHE CDy C 13 131.693 0.087 A 25 PHE CEy C 13 131.768 0.002 A 25 PHE N N 15 121.305 0.030 A 26 ASN H H 1 8.159 0.012 A 26 ASN HA H 1 4.812 0.001 A 26 ASN HBy H 1 2.536 0.002 A 26 ASN HBx H 1 2.457 0.002 A 26 ASN CA C 13 51.412 0.000 A 26 ASN CB C 13 39.086 0.000 A 26 ASN N N 15 126.976 0.092 A 27 ALA H H 1 9.036 0.020 A 27 ALA HA H 1 4.121 0.000 A 27 ALA HB% H 1 1.660 0.000 A 27 ALA C C 13 179.031 0.000 A 27 ALA CA C 13 54.425 0.000 A 27 ALA CB C 13 18.374 0.000 A 27 ALA N N 15 128.245 0.123 A 28 THR H H 1 8.065 0.004 A 28 THR HA H 1 4.068 0.002 A 28 THR HB H 1 4.314 0.004 A 28 THR HG2% H 1 1.255 0.000 A 28 THR C C 13 176.084 0.000 A 28 THR CA C 13 65.820 0.000 A 28 THR CB C 13 68.291 0.000 A 28 THR CG2 C 13 21.704 0.000 A 28 THR N N 15 113.994 0.190 A 29 LYS H H 1 7.446 0.003 A 29 LYS HA H 1 4.256 0.001 A 29 LYS HBx H 1 1.097 0.001 A 29 LYS HBy H 1 1.834 0.001 A 29 LYS HDx H 1 1.599 0.000 A 29 LYS HDy H 1 1.599 0.000 A 29 LYS HEx H 1 3.006 0.000 A 29 LYS HEy H 1 3.048 0.000 A 29 LYS HGx H 1 1.374 0.003 A 29 LYS HGy H 1 1.433 0.001 A 29 LYS C C 13 177.201 0.000 A 29 LYS CA C 13 56.888 0.000 A 29 LYS CB C 13 33.740 0.000 A 29 LYS CD C 13 29.243 0.000 A 29 LYS CE C 13 42.229 0.000 A 29 LYS CG C 13 25.912 0.000 A 29 LYS N N 15 118.922 0.019 A 30 GLY H H 1 8.115 0.004 A 30 GLY HAx H 1 3.608 0.000 A 30 GLY HAy H 1 3.987 0.007 A 30 GLY C C 13 172.004 0.000 A 30 GLY CA C 13 46.404 0.000 A 30 GLY N N 15 107.601 0.182 A 31 PHE H H 1 6.594 0.015 A 31 PHE HA H 1 5.007 0.002 A 31 PHE HBx H 1 2.832 0.007 A 31 PHE HBy H 1 2.832 0.007 A 31 PHE HDx H 1 6.907 0.001 A 31 PHE HDy H 1 6.907 0.001 A 31 PHE HEx H 1 7.552 0.000 A 31 PHE HEy H 1 7.552 0.000 A 31 PHE CA C 13 55.278 0.000 A 31 PHE CB C 13 42.388 0.000 A 31 PHE CDx C 13 132.476 0.008 A 31 PHE CDy C 13 132.476 0.000 A 31 PHE CEx C 13 131.264 0.000 A 31 PHE CEy C 13 131.264 0.000 A 31 PHE N N 15 112.488 0.163 A 32 GLY H H 1 8.144 0.005 A 32 GLY HAy H 1 3.935 0.000 A 32 GLY HAx H 1 2.968 0.000 A 32 GLY C C 13 170.292 0.000 A 32 GLY CA C 13 45.369 0.000 A 32 GLY N N 15 105.986 0.054 A 33 PHE H H 1 7.971 0.011 A 33 PHE HA H 1 5.463 0.002 A 33 PHE HBx H 1 2.211 0.001 A 33 PHE HBy H 1 2.614 0.000 A 33 PHE C C 13 175.037 0.000 A 33 PHE CA C 13 56.295 0.000 A 33 PHE CB C 13 44.792 0.000 A 33 PHE N N 15 115.319 0.214 A 34 ILE H H 1 9.511 0.021 A 34 ILE HA H 1 4.317 0.001 A 34 ILE HB H 1 1.011 0.001 A 34 ILE HD1% H 1 0.150 0.002 A 34 ILE HG1x H 1 0.493 0.000 A 34 ILE HG1y H 1 1.210 0.000 A 34 ILE HG2% H 1 0.209 0.003 A 34 ILE C C 13 174.526 0.000 A 34 ILE CA C 13 59.797 0.000 A 34 ILE CB C 13 42.583 0.000 A 34 ILE CD1 C 13 14.601 0.000 A 34 ILE CG1 C 13 28.106 0.000 A 34 ILE CG2 C 13 17.509 0.000 A 34 ILE N N 15 122.140 0.074 A 35 THR H H 1 9.416 0.023 A 35 THR HA H 1 5.143 0.001 A 35 THR HB H 1 3.922 0.001 A 35 THR HG2% H 1 1.350 0.000 A 35 THR CA C 13 59.330 0.000 A 35 THR CB C 13 70.258 0.000 A 35 THR CG2 C 13 22.310 0.000 A 35 THR N N 15 126.580 0.072 A 36 PRO HA H 1 4.599 0.000 A 36 PRO HBx H 1 2.292 0.000 A 36 PRO HBy H 1 2.411 0.000 A 36 PRO HDx H 1 3.725 0.000 A 36 PRO HDy H 1 4.204 0.000 A 36 PRO HGx H 1 1.933 0.000 A 36 PRO HGy H 1 2.065 0.000 A 36 PRO C C 13 177.390 0.000 A 36 PRO CA C 13 63.220 0.000 A 36 PRO CB C 13 32.470 0.000 A 36 PRO CD C 13 52.690 0.000 A 36 PRO CG C 13 27.580 0.000 A 37 GLY H H 1 9.349 0.004 A 37 GLY HAx H 1 3.602 0.001 A 37 GLY HAy H 1 3.995 0.000 A 37 GLY C C 13 169.261 0.000 A 37 GLY CA C 13 46.457 0.000 A 37 GLY N N 15 112.033 0.039 A 38 GLY H H 1 8.756 0.004 A 38 GLY C C 13 175.177 0.000 A 38 GLY N N 15 109.050 0.112 A 39 GLY H H 1 7.725 0.004 A 39 GLY HAx H 1 3.995 0.001 A 39 GLY HAy H 1 4.556 0.000 A 39 GLY C C 13 173.870 0.000 A 39 GLY CA C 13 44.258 0.000 A 39 GLY N N 15 107.730 0.043 A 40 GLY H H 1 8.096 0.006 A 40 GLY HAy H 1 4.227 0.001 A 40 GLY HAx H 1 3.923 0.001 A 40 GLY C C 13 173.067 0.000 A 40 GLY CA C 13 43.760 0.000 A 40 GLY N N 15 107.183 0.028 A 41 GLU H H 1 8.199 0.005 A 41 GLU HA H 1 4.178 0.000 A 41 GLU HBx H 1 1.985 0.001 A 41 GLU HBy H 1 2.102 0.003 A 41 GLU HGx H 1 2.414 0.000 A 41 GLU HGy H 1 2.414 0.000 A 41 GLU C C 13 175.900 0.000 A 41 GLU CA C 13 56.377 0.000 A 41 GLU CB C 13 30.600 0.000 A 41 GLU CG C 13 36.543 0.000 A 41 GLU N N 15 119.455 0.045 A 42 ASP H H 1 8.277 0.009 A 42 ASP HA H 1 4.857 0.004 A 42 ASP HBx H 1 2.411 0.002 A 42 ASP HBy H 1 2.411 0.002 A 42 ASP C C 13 176.474 0.000 A 42 ASP CA C 13 55.441 0.000 A 42 ASP CB C 13 41.488 0.000 A 42 ASP N N 15 119.784 0.083 A 43 LEU H H 1 9.423 0.005 A 43 LEU HA H 1 4.687 0.001 A 43 LEU HBx H 1 1.266 0.001 A 43 LEU HBy H 1 1.317 0.001 A 43 LEU HDx% H 1 0.695 0.002 A 43 LEU HDy% H 1 0.719 0.000 A 43 LEU HG H 1 1.629 0.000 A 43 LEU C C 13 175.759 0.000 A 43 LEU CA C 13 53.304 0.000 A 43 LEU CB C 13 45.449 0.000 A 43 LEU CDy C 13 27.511 0.000 A 43 LEU CDx C 13 25.896 0.000 A 43 LEU CG C 13 27.149 0.000 A 43 LEU N N 15 122.515 0.144 A 44 PHE H H 1 8.465 0.008 A 44 PHE HA H 1 3.922 0.002 A 44 PHE HBy H 1 3.029 0.002 A 44 PHE HBx H 1 2.777 0.001 A 44 PHE HDx H 1 6.910 0.000 A 44 PHE HDy H 1 6.910 0.000 A 44 PHE HEx H 1 7.481 0.000 A 44 PHE HEy H 1 7.481 0.000 A 44 PHE C C 13 172.844 0.000 A 44 PHE CA C 13 57.880 0.000 A 44 PHE CB C 13 40.350 0.000 A 44 PHE N N 15 125.962 0.055 A 45 VAL H H 1 7.715 0.005 A 45 VAL HA H 1 4.657 0.002 A 45 VAL HB H 1 1.584 0.001 A 45 VAL HGx% H 1 0.478 0.000 A 45 VAL HGy% H 1 0.679 0.000 A 45 VAL C C 13 177.433 0.000 A 45 VAL CA C 13 58.460 0.000 A 45 VAL CB C 13 34.884 0.000 A 45 VAL CGx C 13 18.277 0.000 A 45 VAL CGy C 13 22.890 0.000 A 45 VAL N N 15 123.552 0.072 A 46 HIS H H 1 9.104 0.015 A 46 HIS HA H 1 4.825 0.002 A 46 HIS HBx H 1 3.118 0.002 A 46 HIS HBy H 1 3.118 0.002 A 46 HIS C C 13 176.469 0.000 A 46 HIS CA C 13 55.929 0.000 A 46 HIS CB C 13 34.399 0.000 A 46 HIS N N 15 127.300 0.203 A 47 GLN H H 1 8.352 0.004 A 47 GLN N N 15 125.105 0.060 A 48 THR HA H 1 4.310 0.000 A 48 THR HB H 1 4.395 0.001 A 48 THR HG2% H 1 1.472 0.001 A 48 THR C C 13 175.568 0.000 A 48 THR CA C 13 64.770 0.001 A 48 THR CB C 13 70.054 0.000 A 48 THR CG2 C 13 22.498 0.000 A 49 ASN H H 1 8.452 0.004 A 49 ASN HA H 1 5.160 0.000 A 49 ASN HBy H 1 3.529 0.001 A 49 ASN HBx H 1 2.874 0.000 A 49 ASN HD2x H 1 7.238 0.002 A 49 ASN HD2y H 1 8.164 0.004 A 49 ASN C C 13 172.914 0.000 A 49 ASN CA C 13 54.351 0.000 A 49 ASN CB C 13 40.527 0.000 A 49 ASN N N 15 118.142 0.043 A 49 ASN ND2 N 15 110.371 0.046 A 50 ILE H H 1 7.354 0.002 A 50 ILE HA H 1 4.112 0.001 A 50 ILE HB H 1 1.852 0.001 A 50 ILE HD1% H 1 0.497 0.001 A 50 ILE HG1x H 1 1.625 0.013 A 50 ILE HG1y H 1 1.625 0.013 A 50 ILE HG2% H 1 0.670 0.002 A 50 ILE CA C 13 61.606 0.000 A 50 ILE CB C 13 38.362 0.000 A 50 ILE CD1 C 13 14.470 0.000 A 50 ILE CG1 C 13 27.422 0.000 A 50 ILE CG2 C 13 17.530 0.000 A 50 ILE N N 15 119.226 0.027 A 51 ASN H H 1 9.266 0.000 A 51 ASN C C 13 174.614 0.000 A 51 ASN N N 15 128.460 0.000 A 52 SER H H 1 7.973 0.003 A 52 SER HA H 1 4.413 0.004 A 52 SER HBx H 1 3.787 0.000 A 52 SER HBy H 1 3.827 0.000 A 52 SER C C 13 174.139 0.000 A 52 SER CA C 13 58.378 0.000 A 52 SER CB C 13 64.371 0.000 A 52 SER N N 15 117.246 0.033 A 53 GLU H H 1 8.641 0.004 A 53 GLU HA H 1 4.298 0.000 A 53 GLU HBx H 1 1.958 0.000 A 53 GLU HBy H 1 2.078 0.000 A 53 GLU HGx H 1 2.277 0.001 A 53 GLU HGy H 1 2.277 0.001 A 53 GLU C C 13 176.960 0.000 A 53 GLU CA C 13 57.270 0.000 A 53 GLU CB C 13 29.861 0.000 A 53 GLU CG C 13 36.700 0.000 A 53 GLU N N 15 123.628 0.071 A 54 GLY H H 1 8.225 0.004 A 54 GLY HAx H 1 3.795 0.000 A 54 GLY HAy H 1 4.352 0.001 A 54 GLY CA C 13 44.600 0.000 A 54 GLY N N 15 110.282 0.043 A 55 PHE HA H 1 4.820 0.001 A 55 PHE HBx H 1 2.611 0.000 A 55 PHE HBy H 1 2.801 0.000 A 55 PHE C C 13 175.836 0.000 A 55 PHE CA C 13 52.690 0.000 A 55 PHE CB C 13 38.095 0.000 A 56 ARG H H 1 8.153 0.003 A 56 ARG HA H 1 4.264 0.002 A 56 ARG HBx H 1 1.502 0.001 A 56 ARG HBy H 1 1.657 0.000 A 56 ARG HDx H 1 2.789 0.000 A 56 ARG HDy H 1 3.101 0.001 A 56 ARG HGx H 1 1.137 0.000 A 56 ARG HGy H 1 1.458 0.001 A 56 ARG C C 13 175.618 0.000 A 56 ARG CA C 13 55.510 0.000 A 56 ARG CB C 13 32.020 0.000 A 56 ARG CD C 13 43.860 0.000 A 56 ARG CG C 13 27.010 0.000 A 56 ARG N N 15 120.907 0.050 A 57 SER H H 1 7.834 0.009 A 57 SER N N 15 123.117 0.044 A 58 LEU HA H 1 4.280 0.001 A 58 LEU HBx H 1 0.445 0.001 A 58 LEU HBy H 1 0.935 0.000 A 58 LEU HDx% H 1 0.352 0.000 A 58 LEU HDy% H 1 0.266 0.000 A 58 LEU HG H 1 0.763 0.000 A 58 LEU C C 13 174.842 0.000 A 58 LEU CA C 13 53.760 0.000 A 58 LEU CB C 13 42.580 0.000 A 58 LEU CDx C 13 21.930 0.000 A 58 LEU CDy C 13 25.250 0.000 A 58 LEU CG C 13 26.600 0.000 A 59 ARG H H 1 8.529 0.003 A 59 ARG HA H 1 4.585 0.001 A 59 ARG HBx H 1 1.635 0.002 A 59 ARG HBy H 1 1.790 0.002 A 59 ARG HDx H 1 3.140 0.000 A 59 ARG HDy H 1 3.193 0.000 A 59 ARG HGx H 1 1.589 0.000 A 59 ARG HGy H 1 1.589 0.000 A 59 ARG C C 13 175.256 0.000 A 59 ARG CA C 13 54.112 0.000 A 59 ARG CB C 13 32.970 0.000 A 59 ARG CD C 13 43.440 0.000 A 59 ARG CG C 13 27.120 0.000 A 59 ARG N N 15 119.557 0.020 A 60 GLU H H 1 8.691 0.006 A 60 GLU HA H 1 3.581 0.005 A 60 GLU HBy H 1 2.120 0.002 A 60 GLU HBx H 1 2.028 0.003 A 60 GLU HGx H 1 2.322 0.001 A 60 GLU HGy H 1 2.563 0.001 A 60 GLU C C 13 177.281 0.000 A 60 GLU CA C 13 58.301 0.000 A 60 GLU CB C 13 29.261 0.000 A 60 GLU CG C 13 36.110 0.000 A 60 GLU N N 15 121.597 0.111 A 61 GLY H H 1 9.151 0.007 A 61 GLY HAx H 1 3.582 0.000 A 61 GLY HAy H 1 4.355 0.002 A 61 GLY C C 13 174.068 0.000 A 61 GLY CA C 13 45.243 0.000 A 61 GLY N N 15 113.554 0.053 A 62 GLU H H 1 7.889 0.003 A 62 GLU HA H 1 4.204 0.001 A 62 GLU HBy H 1 2.128 0.001 A 62 GLU HBx H 1 1.909 0.000 A 62 GLU HGx H 1 2.235 0.001 A 62 GLU HGy H 1 2.235 0.001 A 62 GLU C C 13 175.439 0.000 A 62 GLU CA C 13 57.342 0.000 A 62 GLU CB C 13 30.925 0.000 A 62 GLU CG C 13 36.988 0.000 A 62 GLU N N 15 121.639 0.042 A 63 VAL H H 1 8.477 0.004 A 63 VAL HA H 1 4.748 0.000 A 63 VAL HB H 1 1.993 0.000 A 63 VAL HGx% H 1 1.043 0.000 A 63 VAL HGy% H 1 0.981 0.000 A 63 VAL C C 13 176.639 0.000 A 63 VAL CA C 13 62.631 0.000 A 63 VAL CB C 13 32.357 0.000 A 63 VAL CGx C 13 21.610 0.001 A 63 VAL CGy C 13 21.615 0.000 A 63 VAL N N 15 125.003 0.051 A 64 VAL H H 1 8.686 0.007 A 64 VAL HA H 1 5.004 0.001 A 64 VAL HB H 1 2.188 0.001 A 64 VAL HGx% H 1 0.628 0.001 A 64 VAL HGy% H 1 0.551 0.000 A 64 VAL C C 13 173.790 0.000 A 64 VAL CA C 13 58.609 0.000 A 64 VAL CB C 13 36.360 0.000 A 64 VAL CGy C 13 22.679 0.003 A 64 VAL CGx C 13 18.060 0.000 A 64 VAL N N 15 120.113 0.045 A 65 GLU H H 1 9.003 0.014 A 65 GLU HA H 1 5.447 0.000 A 65 GLU HBx H 1 1.886 0.000 A 65 GLU HBy H 1 1.937 0.000 A 65 GLU HGy H 1 2.209 0.001 A 65 GLU HGx H 1 2.087 0.002 A 65 GLU C C 13 175.584 0.000 A 65 GLU CA C 13 54.390 0.000 A 65 GLU CB C 13 34.003 0.000 A 65 GLU CG C 13 37.755 0.000 A 65 GLU N N 15 120.433 0.043 A 66 PHE H H 1 8.172 0.006 A 66 PHE HA H 1 5.061 0.001 A 66 PHE HBy H 1 3.253 0.002 A 66 PHE HBx H 1 3.056 0.003 A 66 PHE HDx H 1 6.689 0.001 A 66 PHE HDy H 1 6.689 0.001 A 66 PHE HEx H 1 6.770 0.000 A 66 PHE HEy H 1 6.770 0.000 A 66 PHE HZ H 1 7.283 0.000 A 66 PHE C C 13 173.001 0.000 A 66 PHE CA C 13 56.857 0.000 A 66 PHE CB C 13 41.432 0.000 A 66 PHE CDx C 13 131.970 0.000 A 66 PHE CDy C 13 131.970 0.000 A 66 PHE CEx C 13 128.785 0.000 A 66 PHE CEy C 13 128.785 0.000 A 66 PHE CZ C 13 129.861 0.000 A 66 PHE N N 15 116.104 0.039 A 67 GLU H H 1 8.668 0.010 A 67 GLU HA H 1 4.872 0.002 A 67 GLU HBy H 1 2.135 0.001 A 67 GLU HBx H 1 1.860 0.001 A 67 GLU HGx H 1 2.195 0.000 A 67 GLU HGy H 1 2.343 0.000 A 67 GLU C C 13 175.327 0.000 A 67 GLU CA C 13 54.641 0.000 A 67 GLU CB C 13 33.020 0.000 A 67 GLU CG C 13 37.360 0.000 A 67 GLU N N 15 117.574 0.042 A 68 VAL H H 1 8.748 0.003 A 68 VAL HA H 1 5.012 0.003 A 68 VAL HB H 1 2.007 0.001 A 68 VAL HGx% H 1 0.976 0.000 A 68 VAL HGy% H 1 1.120 0.002 A 68 VAL C C 13 176.140 0.000 A 68 VAL CA C 13 62.338 0.000 A 68 VAL CB C 13 34.006 0.000 A 68 VAL CGx C 13 21.620 0.000 A 68 VAL CGy C 13 22.440 0.000 A 68 VAL N N 15 120.881 0.083 A 69 GLU H H 1 9.070 0.011 A 69 GLU HA H 1 4.705 0.001 A 69 GLU HBx H 1 1.838 0.000 A 69 GLU HBy H 1 1.972 0.001 A 69 GLU HGy H 1 2.199 0.000 A 69 GLU HGx H 1 2.126 0.000 A 69 GLU C C 13 174.573 0.000 A 69 GLU CA C 13 54.953 0.000 A 69 GLU CB C 13 34.290 0.000 A 69 GLU CG C 13 36.780 0.000 A 69 GLU N N 15 128.110 0.070 A 70 ALA H H 1 8.671 0.008 A 70 ALA HA H 1 5.004 0.000 A 70 ALA HB% H 1 0.688 0.000 A 70 ALA C C 13 178.073 0.000 A 70 ALA CA C 13 50.959 0.000 A 70 ALA CB C 13 19.489 0.000 A 70 ALA N N 15 127.944 0.055 A 71 GLY H H 1 8.445 0.022 A 71 GLY HAx H 1 3.919 0.000 A 71 GLY HAy H 1 4.231 0.000 A 71 GLY CA C 13 44.016 0.000 A 71 GLY N N 15 110.340 0.035 A 72 PRO HA H 1 4.417 0.002 A 72 PRO HBx H 1 1.970 0.000 A 72 PRO HBy H 1 2.293 0.000 A 72 PRO HDx H 1 3.667 0.004 A 72 PRO HDy H 1 3.667 0.004 A 72 PRO HGx H 1 1.971 0.000 A 72 PRO HGy H 1 1.971 0.000 A 72 PRO C C 13 176.835 0.000 A 72 PRO CA C 13 64.160 0.000 A 72 PRO CB C 13 31.880 0.000 A 72 PRO CD C 13 50.110 0.000 A 72 PRO CG C 13 26.742 0.000 A 73 ASP H H 1 8.248 0.027 A 73 ASP HA H 1 4.515 0.001 A 73 ASP HBx H 1 2.682 0.000 A 73 ASP HBy H 1 2.866 0.000 A 73 ASP C C 13 176.775 0.000 A 73 ASP CA C 13 53.547 0.000 A 73 ASP CB C 13 40.234 0.000 A 73 ASP N N 15 116.498 0.039 A 74 GLY H H 1 8.153 0.004 A 74 GLY HAx H 1 3.701 0.001 A 74 GLY HAy H 1 4.209 0.001 A 74 GLY C C 13 174.331 0.000 A 74 GLY CA C 13 45.578 0.000 A 74 GLY N N 15 107.369 0.123 A 75 ARG H H 1 7.670 0.013 A 75 ARG HA H 1 4.542 0.000 A 75 ARG HBy H 1 1.876 0.007 A 75 ARG HBx H 1 1.813 0.000 A 75 ARG HDx H 1 3.125 0.000 A 75 ARG HDy H 1 3.192 0.004 A 75 ARG HGy H 1 1.655 0.001 A 75 ARG HGx H 1 1.614 0.000 A 75 ARG C C 13 176.652 0.000 A 75 ARG CA C 13 55.658 0.000 A 75 ARG CB C 13 30.909 0.000 A 75 ARG CD C 13 43.150 0.000 A 75 ARG CG C 13 27.072 0.000 A 75 ARG N N 15 120.942 0.052 A 76 SER H H 1 8.808 0.025 A 76 SER HA H 1 5.035 0.001 A 76 SER HBx H 1 3.695 0.000 A 76 SER HBy H 1 3.751 0.000 A 76 SER C C 13 172.816 0.000 A 76 SER CA C 13 59.080 0.000 A 76 SER CB C 13 64.850 0.000 A 76 SER N N 15 120.181 0.094 A 77 LYS H H 1 8.982 0.013 A 77 LYS HA H 1 5.174 0.000 A 77 LYS HBy H 1 1.984 0.000 A 77 LYS HBx H 1 1.876 0.002 A 77 LYS HDy H 1 1.750 0.001 A 77 LYS HDx H 1 1.668 0.000 A 77 LYS HEx H 1 2.831 0.001 A 77 LYS HEy H 1 2.831 0.001 A 77 LYS HGy H 1 1.448 0.000 A 77 LYS HGx H 1 1.284 0.001 A 77 LYS C C 13 173.706 0.000 A 77 LYS CA C 13 54.599 0.000 A 77 LYS CB C 13 36.035 0.000 A 77 LYS CD C 13 29.828 0.000 A 77 LYS CE C 13 41.975 0.000 A 77 LYS CG C 13 24.227 0.000 A 77 LYS N N 15 121.202 0.090 A 78 ALA H H 1 8.706 0.015 A 78 ALA HA H 1 5.004 0.001 A 78 ALA HB% H 1 0.688 0.001 A 78 ALA C C 13 175.979 0.000 A 78 ALA CA C 13 50.445 0.000 A 78 ALA CB C 13 20.136 0.000 A 78 ALA N N 15 124.064 0.137 A 79 VAL H H 1 9.165 0.005 A 79 VAL HA H 1 4.843 0.002 A 79 VAL HB H 1 2.229 0.002 A 79 VAL HGx% H 1 0.756 0.000 A 79 VAL HGy% H 1 0.827 0.000 A 79 VAL C C 13 174.744 0.000 A 79 VAL CA C 13 59.073 0.000 A 79 VAL CB C 13 35.596 0.000 A 79 VAL CGx C 13 19.208 0.001 A 79 VAL CGy C 13 21.759 0.000 A 79 VAL N N 15 113.264 0.105 A 80 ASN H H 1 8.923 0.008 A 80 ASN HA H 1 4.356 0.002 A 80 ASN HBx H 1 2.659 0.003 A 80 ASN HBy H 1 3.055 0.001 A 80 ASN HD2y H 1 7.859 0.005 A 80 ASN HD2x H 1 6.806 0.004 A 80 ASN C C 13 175.391 0.000 A 80 ASN CA C 13 53.734 0.000 A 80 ASN CB C 13 37.121 0.000 A 80 ASN N N 15 120.084 0.049 A 80 ASN ND2 N 15 113.279 0.021 A 81 VAL H H 1 8.282 0.006 A 81 VAL HA H 1 4.747 0.001 A 81 VAL HB H 1 1.917 0.001 A 81 VAL HGx% H 1 0.687 0.001 A 81 VAL HGy% H 1 0.792 0.000 A 81 VAL C C 13 176.340 0.000 A 81 VAL CA C 13 63.160 0.000 A 81 VAL CB C 13 32.130 0.000 A 81 VAL CGx C 13 21.730 0.000 A 81 VAL CGy C 13 21.730 0.000 A 81 VAL N N 15 119.178 0.020 A 82 THR H H 1 9.198 0.006 A 82 THR HA H 1 4.336 0.000 A 82 THR HB H 1 4.187 0.000 A 82 THR HG2% H 1 1.163 0.001 A 82 THR CA C 13 63.515 0.000 A 82 THR CB C 13 71.769 0.000 A 82 THR CG2 C 13 21.810 0.000 A 82 THR N N 15 125.434 0.041 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 81 VAL H A 81 VAL HB 1.0 . 3.09 2 2 A 80 ASN H A 80 ASN HA 1.0 . 2.92 3 3 A 77 LYS H A 77 LYS HGy 1.0 . 4.42 4 4 A 69 GLU H A 69 GLU HBy 1.0 . 3.69 5 5 A 69 GLU H A 69 GLU HBx 1.0 . 3.69 6 6 A 68 VAL H A 68 VAL HB 1.0 . 3.09 7 7 A 66 PHE H A 66 PHE HBx 1.0 . 4.13 8 8 A 62 GLU H A 62 GLU HBy 1.0 . 3.27 9 9 A 60 GLU HA A 61 GLY H 1.0 . 2.75 10 10 A 41 GLU H A 41 GLU HGx 1.0 . 3.26 11 10 A 41 GLU H A 41 GLU HGy 1.0 . 3.26 12 11 A 82 THR H A 82 THR HG2% 1.0 . 4.04 13 12 A 63 VAL H A 63 VAL HGx% 1.0 . 4.31 14 13 A 63 VAL H A 63 VAL HGy% 1.0 . 4.31 15 14 A 31 PHE H A 31 PHE HBx 1.0 . 3.93 16 14 A 31 PHE H A 31 PHE HBy 1.0 . 3.93 17 15 A 28 THR H A 28 THR HB 1.0 . 3.78 18 16 A 59 ARG H A 59 ARG HBx 1.0 . 4.14 19 17 A 45 VAL H A 45 VAL HB 1.0 . 3.91 20 18 A 44 PHE H A 44 PHE HBy 1.0 . 3.72 21 19 A 44 PHE H A 44 PHE HBx 1.0 . 3.72 22 20 A 43 LEU H A 43 LEU HBx 1.0 . 3.81 23 21 A 42 ASP H A 42 ASP HBx 1.0 . 2.88 24 21 A 42 ASP H A 42 ASP HBy 1.0 . 2.88 25 22 A 35 THR H A 35 THR HB 1.0 . 3.65 26 23 A 35 THR H A 35 THR HG2% 1.0 . 4.10 27 24 A 34 ILE H A 45 VAL HGx% 1.0 . 4.90 28 25 A 34 ILE H A 34 ILE HG2% 1.0 . 4.28 29 26 A 50 ILE H A 50 ILE HB 1.0 . 3.38 30 27 A 62 GLU H A 62 GLU HBx 1.0 . 3.27 31 28 A 26 ASN H A 26 ASN HBy 1.0 . 4.17 32 29 A 26 ASN H A 26 ASN HBx 1.0 . 4.17 33 30 A 22 VAL H A 22 VAL HB 1.0 . 3.32 34 31 A 21 THR H A 21 THR HB 1.0 . 3.73 35 32 A 21 THR H A 21 THR HG2% 1.0 . 3.89 36 33 A 15 GLN HA A 16 LEU H 1.0 . 2.90 37 34 A 22 VAL H A 22 VAL HGx% 1.0 . 3.82 38 35 A 62 GLU H A 62 GLU HGx 1.0 . 4.09 39 35 A 62 GLU H A 62 GLU HGy 1.0 . 4.09 40 36 A 62 GLU H A 61 GLY HAy 1.0 . 3.21 41 37 A 59 ARG H A 59 ARG HBy 1.0 . 4.14 42 38 A 16 LEU H A 16 LEU HBx 1.0 . 2.95 43 38 A 16 LEU H A 16 LEU HBy 1.0 . 2.95 44 39 A 16 LEU H A 16 LEU HDy% 1.0 . 5.15 45 40 A 16 LEU H A 16 LEU HDx% 1.0 . 5.15 46 41 A 18 GLN H A 18 GLN HBx 1.0 . 3.17 47 42 A 18 GLN H A 18 GLN HBy 1.0 . 3.20 48 43 A 18 GLN H A 18 GLN HGx 1.0 . 4.34 49 43 A 18 GLN H A 18 GLN HGy 1.0 . 4.34 50 44 A 25 PHE H A 25 PHE HBy 1.0 . 3.95 51 45 A 25 PHE H A 25 PHE HBx 1.0 . 3.95 52 46 A 34 ILE H A 34 ILE HB 1.0 . 3.41 53 47 A 34 ILE H A 34 ILE HD1% 1.0 . 4.28 54 48 A 45 VAL H A 45 VAL HGx% 1.0 . 3.58 55 49 A 45 VAL H A 45 VAL HGy% 1.0 . 4.47 56 50 A 49 ASN H A 49 ASN HBy 1.0 . 4.06 57 51 A 49 ASN H A 49 ASN HBx 1.0 . 4.06 58 52 A 50 ILE H A 50 ILE HG2% 1.0 . 4.00 59 53 A 59 ARG H A 59 ARG HGx 1.0 . 4.26 60 53 A 59 ARG H A 59 ARG HGy 1.0 . 4.26 61 54 A 63 VAL H A 63 VAL HB 1.0 . 2.97 62 55 A 65 GLU H A 65 GLU HBy 1.0 . 3.48 63 56 A 68 VAL H A 68 VAL HGy% 1.0 . 4.10 64 57 A 68 VAL H A 68 VAL HGx% 1.0 . 4.10 65 58 A 69 GLU HA A 70 ALA H 1.0 . 2.89 66 59 A 75 ARG H A 75 ARG HBx 1.0 . 2.89 67 60 A 75 ARG H A 75 ARG HGx 1.0 . 4.33 68 61 A 75 ARG H A 75 ARG HGy 1.0 . 4.33 69 62 A 77 LYS H A 77 LYS HGx 1.0 . 4.42 70 63 A 78 ALA H A 78 ALA HB% 1.0 . 3.00 71 64 A 82 THR H A 82 THR HB 1.0 . 3.89 72 65 A 65 GLU H A 64 VAL HB 1.0 . 3.07 73 66 A 65 GLU H A 65 GLU HBx 1.0 . 3.70 74 67 A 60 GLU H A 60 GLU HBy 1.0 . 3.60 75 68 A 60 GLU H A 60 GLU HBx 1.0 . 3.03 76 69 A 60 GLU H A 60 GLU HGx 1.0 . 4.24 77 70 A 29 LYS H A 29 LYS HGy 1.0 . 3.63 78 71 A 29 LYS H A 29 LYS HGx 1.0 . 3.63 79 72 A 43 LEU H A 43 LEU HBy 1.0 . 3.81 80 73 A 22 VAL H A 22 VAL HGy% 1.0 . 3.06 81 74 A 82 THR H A 81 VAL HA 1.0 . 2.96 82 75 A 82 THR H A 65 GLU HBy 1.0 . 4.65 83 76 A 81 VAL HB A 82 THR H 1.0 . 5.03 84 77 A 82 THR H A 81 VAL HGy% 1.0 . 4.44 85 78 A 82 THR H A 81 VAL HGx% 1.0 . 3.63 86 79 A 80 ASN H A 79 VAL HB 1.0 . 3.11 87 80 A 80 ASN H A 79 VAL HGy% 1.0 . 3.69 88 81 A 80 ASN H A 79 VAL HGx% 1.0 . 4.05 89 82 A 80 ASN H A 79 VAL HA 1.0 . 3.53 90 83 A 81 VAL H A 66 PHE HBx 1.0 . 4.42 91 84 A 81 VAL H A 80 ASN HBy 1.0 . 4.87 92 85 A 81 VAL H A 80 ASN HBx 1.0 . 4.87 93 86 A 81 VAL H A 79 VAL HB 1.0 . 5.15 94 87 A 78 ALA HA A 79 VAL H 1.0 . 2.89 95 88 A 78 ALA H A 77 LYS HA 1.0 . 3.04 96 89 A 78 ALA H A 77 LYS HBy 1.0 . 4.30 97 90 A 78 ALA H A 77 LYS HBx 1.0 . 4.30 98 91 A 77 LYS H A 76 SER HA 1.0 . 2.98 99 92 A 77 LYS H A 76 SER HBy 1.0 . 3.78 100 93 A 75 ARG HA A 76 SER H 1.0 . 3.24 101 94 A 76 SER H A 76 SER HBy 1.0 . 3.84 102 95 A 76 SER H A 75 ARG HBy 1.0 . 3.55 103 96 A 75 ARG HBx A 76 SER H 1.0 . 4.00 104 97 A 70 ALA H A 69 GLU HGy 1.0 . 4.24 105 98 A 70 ALA H A 69 GLU HGx 1.0 . 4.24 106 99 A 70 ALA H A 69 GLU HBy 1.0 . 4.40 107 100 A 70 ALA H A 69 GLU HBx 1.0 . 4.40 108 101 A 69 GLU H A 68 VAL HGy% 1.0 . 4.43 109 102 A 69 GLU H A 68 VAL HGx% 1.0 . 4.43 110 103 A 69 GLU H A 68 VAL HA 1.0 . 2.70 111 104 A 68 VAL H A 67 GLU HBy 1.0 . 3.54 112 105 A 68 VAL H A 67 GLU HBx 1.0 . 4.10 113 106 A 66 PHE HA A 67 GLU H 1.0 . 2.97 114 107 A 66 PHE H A 65 GLU HGy 1.0 . 4.13 115 108 A 66 PHE H A 65 GLU HGx 1.0 . 4.13 116 109 A 66 PHE H A 65 GLU HBx 1.0 . 4.42 117 110 A 66 PHE H A 65 GLU HBy 1.0 . 3.89 118 111 A 65 GLU H A 64 VAL HGx% 1.0 . 3.91 119 112 A 65 GLU H A 64 VAL HGy% 1.0 . 3.69 120 113 A 63 VAL HA A 64 VAL H 1.0 . 3.37 121 114 A 63 VAL H A 62 GLU HA 1.0 . 2.70 122 115 A 63 VAL H A 62 GLU HGx 1.0 . 3.85 123 115 A 63 VAL H A 62 GLU HGy 1.0 . 3.85 124 116 A 63 VAL H A 62 GLU HBy 1.0 . 4.66 125 117 A 63 VAL H A 62 GLU HBx 1.0 . 4.66 126 118 A 61 GLY H A 60 GLU HBy 1.0 . 4.19 127 119 A 61 GLY H A 60 GLU HBx 1.0 . 4.43 128 120 A 60 GLU H A 59 ARG HA 1.0 . 2.66 129 121 A 60 GLU H A 59 ARG HBy 1.0 . 3.94 130 122 A 60 GLU H A 59 ARG HBx 1.0 . 3.94 131 123 A 60 GLU H A 59 ARG HGx 1.0 . 3.61 132 123 A 59 ARG HGy A 60 GLU H 1.0 . 3.61 133 124 A 45 VAL H A 44 PHE HA 1.0 . 3.02 134 125 A 45 VAL H A 44 PHE HBy 1.0 . 4.26 135 126 A 45 VAL H A 44 PHE HBx 1.0 . 4.26 136 127 A 44 PHE H A 43 LEU HA 1.0 . 2.98 137 128 A 44 PHE H A 43 LEU HBx 1.0 . 4.36 138 129 A 44 PHE H A 43 LEU HBy 1.0 . 4.36 139 130 A 44 PHE H A 43 LEU HDx% 1.0 . 5.45 140 131 A 44 PHE H A 43 LEU HDy% 1.0 . 5.45 141 132 A 43 LEU H A 42 ASP HA 1.0 . 3.26 142 133 A 43 LEU H A 42 ASP HBx 1.0 . 3.47 143 133 A 43 LEU H A 42 ASP HBy 1.0 . 3.47 144 134 A 42 ASP H A 41 GLU HA 1.0 . 2.71 145 135 A 35 THR H A 34 ILE HA 1.0 . 3.52 146 136 A 35 THR H A 34 ILE HG2% 1.0 . 3.59 147 137 A 35 THR H A 34 ILE HD1% 1.0 . 3.82 148 138 A 34 ILE H A 33 PHE HA 1.0 . 3.28 149 139 A 34 ILE H A 33 PHE HBy 1.0 . 4.39 150 140 A 31 PHE HA A 32 GLY H 1.0 . 3.36 151 141 A 32 GLY H A 31 PHE HBx 1.0 . 3.46 152 141 A 31 PHE HBy A 32 GLY H 1.0 . 3.46 153 142 A 30 GLY H A 29 LYS HBy 1.0 . 4.49 154 143 A 30 GLY H A 29 LYS HGy 1.0 . 5.29 155 144 A 30 GLY H A 29 LYS HGx 1.0 . 5.29 156 145 A 28 THR HB A 29 LYS H 1.0 . 3.18 157 146 A 26 ASN H A 25 PHE HA 1.0 . 3.24 158 147 A 25 PHE H A 24 TRP HA 1.0 . 3.03 159 148 A 24 TRP H A 24 TRP HBy 1.0 . 4.21 160 149 A 24 TRP H A 24 TRP HBx 1.0 . 4.21 161 150 A 25 PHE H A 24 TRP HBy 1.0 . 4.49 162 151 A 25 PHE H A 24 TRP HBx 1.0 . 4.49 163 152 A 22 VAL H A 21 THR HA 1.0 . 2.95 164 153 A 22 VAL H A 21 THR HG2% 1.0 . 3.59 165 154 A 22 VAL H A 21 THR HB 1.0 . 3.76 166 155 A 21 THR H A 20 GLY HAx 1.0 . 3.30 167 156 A 21 THR H A 20 GLY HAy 1.0 . 3.30 168 157 A 18 GLN HA A 19 GLN H 1.0 . 2.82 169 158 A 19 GLN H A 18 GLN HGx 1.0 . 2.93 170 158 A 18 GLN HGy A 19 GLN H 1.0 . 2.93 171 159 A 18 GLN H A 17 ARG HA 1.0 . 2.75 172 160 A 16 LEU HA A 17 ARG H 1.0 . 2.83 173 161 A 17 ARG H A 16 LEU HDx% 1.0 . 5.30 174 162 A 17 ARG H A 16 LEU HDy% 1.0 . 5.30 175 163 A 16 LEU H A 15 GLN HGx 1.0 . 4.59 176 163 A 16 LEU H A 15 GLN HGy 1.0 . 4.59 177 164 A 16 LEU H A 15 GLN HBy 1.0 . 4.78 178 165 A 16 LEU H A 15 GLN HBx 1.0 . 4.78 179 166 A 14 GLU HA A 15 GLN H 1.0 . 3.30 180 167 A 15 GLN H A 15 GLN HGx 1.0 . 4.19 181 167 A 15 GLN HGy A 15 GLN H 1.0 . 4.19 182 168 A 81 VAL H A 81 VAL HGy% 1.0 . 2.91 183 169 A 81 VAL H A 81 VAL HGx% 1.0 . 4.32 184 170 A 81 VAL H A 82 THR H 1.0 . 4.54 185 171 A 79 VAL HGx% A 79 VAL H 1.0 . 4.06 186 172 A 79 VAL HGy% A 79 VAL H 1.0 . 3.16 187 173 A 78 ALA HB% A 79 VAL H 1.0 . 3.26 188 174 A 81 VAL H A 80 ASN H 1.0 . 3.53 189 175 A 80 ASN H A 79 VAL H 1.0 . 4.52 190 176 A 79 VAL H A 67 GLU H 1.0 . 3.90 191 177 A 77 LYS H A 78 ALA H 1.0 . 4.84 192 178 A 78 ALA H A 79 VAL H 1.0 . 4.76 193 179 A 75 ARG H A 76 SER H 1.0 . 4.80 194 180 A 75 ARG H A 74 GLY H 1.0 . 3.17 195 181 A 74 GLY H A 73 ASP H 1.0 . 5.06 196 182 A 70 ALA H A 71 GLY H 1.0 . 4.45 197 183 A 69 GLU H A 70 ALA H 1.0 . 4.52 198 184 A 68 VAL H A 67 GLU HA 1.0 . 3.00 199 185 A 69 GLU H A 68 VAL H 1.0 . 4.65 200 186 A 67 GLU HBx A 67 GLU H 1.0 . 3.49 201 187 A 67 GLU HBy A 67 GLU H 1.0 . 4.00 202 188 A 67 GLU H A 67 GLU HGx 1.0 . 3.96 203 189 A 67 GLU H A 67 GLU HGy 1.0 . 3.96 204 190 A 66 PHE HBx A 67 GLU H 1.0 . 3.81 205 191 A 67 GLU H A 66 PHE HBy 1.0 . 3.14 206 192 A 66 PHE H A 65 GLU HA 1.0 . 3.00 207 193 A 65 GLU H A 64 VAL HA 1.0 . 2.91 208 194 A 66 PHE H A 65 GLU H 1.0 . 4.58 209 195 A 63 VAL HB A 64 VAL H 1.0 . 4.55 210 196 A 64 VAL H A 63 VAL HGx% 1.0 . 4.05 211 197 A 64 VAL H A 63 VAL HGy% 1.0 . 4.05 212 198 A 64 VAL HGx% A 64 VAL H 1.0 . 5.50 213 199 A 64 VAL HGy% A 64 VAL H 1.0 . 3.07 214 200 A 62 GLU H A 63 VAL H 1.0 . 4.56 215 201 A 62 GLU H A 61 GLY H 1.0 . 3.38 216 202 A 61 GLY H A 60 GLU H 1.0 . 4.99 217 203 A 50 ILE H A 49 ASN H 1.0 . 3.36 218 204 A 45 VAL H A 46 HIS H 1.0 . 4.67 219 205 A 43 LEU H A 42 ASP H 1.0 . 4.76 220 206 A 39 GLY H A 40 GLY H 1.0 . 4.46 221 207 A 43 LEU H A 34 ILE H 1.0 . 4.73 222 208 A 31 PHE H A 30 GLY H 1.0 . 2.95 223 209 A 29 LYS H A 30 GLY H 1.0 . 3.02 224 210 A 28 THR H A 29 LYS H 1.0 . 3.41 225 211 A 25 PHE H A 24 TRP H 1.0 . 4.55 226 212 A 22 VAL H A 21 THR H 1.0 . 4.73 227 213 A 21 THR H A 20 GLY H 1.0 . 4.45 228 214 A 19 GLN H A 20 GLY H 1.0 . 4.46 229 215 A 66 PHE H A 18 GLN H 1.0 . 3.34 230 216 A 18 GLN H A 19 GLN H 1.0 . 4.71 231 217 A 18 GLN H A 17 ARG H 1.0 . 4.48 232 218 A 16 LEU H A 17 ARG H 1.0 . 3.82 233 219 A 15 GLN H A 14 GLU H 1.0 . 5.24 234 220 A 16 LEU H A 15 GLN H 1.0 . 5.50 235 221 A 46 HIS HA A 47 GLN H 1.0 . 3.48 236 222 A 47 GLN H A 46 HIS HBx 1.0 . 4.05 237 222 A 47 GLN H A 46 HIS HBy 1.0 . 4.05 238 223 A 45 VAL HGy% A 46 HIS H 1.0 . 3.86 239 224 A 82 THR H A 65 GLU H 1.0 . 3.93 240 225 A 82 THR H A 66 PHE HA 1.0 . 4.35 241 226 A 82 THR H A 64 VAL HB 1.0 . 4.33 242 227 A 81 VAL H A 50 ILE HA 1.0 . 3.81 243 228 A 81 VAL H A 80 ASN HA 1.0 . 3.13 244 229 A 81 VAL H A 66 PHE HBy 1.0 . 4.65 245 230 A 80 ASN H A 49 ASN HA 1.0 . 5.19 246 231 A 80 ASN H A 49 ASN HBy 1.0 . 4.34 247 232 A 80 ASN H A 49 ASN HBx 1.0 . 4.34 248 233 A 80 ASN H A 50 ILE HA 1.0 . 4.76 249 234 A 79 VAL H A 66 PHE HBy 1.0 . 4.13 250 235 A 66 PHE HBx A 79 VAL H 1.0 . 4.85 251 236 A 61 GLY H A 22 VAL HB 1.0 . 3.82 252 237 A 78 ALA H A 77 LYS HEx 1.0 . 5.17 253 237 A 78 ALA H A 77 LYS HEy 1.0 . 5.17 254 238 A 78 ALA H A 79 VAL HGx% 1.0 . 4.75 255 239 A 77 LYS H A 69 GLU HA 1.0 . 4.80 256 240 A 77 LYS H A 70 ALA HB% 1.0 . 5.50 257 241 A 77 LYS H A 78 ALA HB% 1.0 . 5.50 258 242 A 77 LYS H A 76 SER H 1.0 . 4.54 259 243 A 75 ARG H A 73 ASP HBy 1.0 . 4.70 260 244 A 75 ARG H A 73 ASP HBx 1.0 . 4.70 261 245 A 73 ASP H A 72 PRO HDx 1.0 . 4.29 262 245 A 73 ASP H A 72 PRO HDy 1.0 . 4.29 263 246 A 73 ASP H A 72 PRO HGx 1.0 . 4.19 264 246 A 73 ASP H A 72 PRO HGy 1.0 . 4.19 265 247 A 75 ARG H A 71 GLY H 1.0 . 4.37 266 248 A 71 GLY H A 72 PRO HDx 1.0 . 4.82 267 248 A 71 GLY H A 72 PRO HDy 1.0 . 4.82 268 249 A 77 LYS H A 69 GLU H 1.0 . 3.92 269 250 A 68 VAL H A 16 LEU HA 1.0 . 5.01 270 251 A 68 VAL H A 78 ALA HB% 1.0 . 5.21 271 252 A 68 VAL H A 16 LEU HBx 1.0 . 4.85 272 252 A 68 VAL H A 16 LEU HBy 1.0 . 4.85 273 253 A 67 GLU H A 66 PHE HD% 1.0 . 3.61 274 254 A 66 PHE H A 66 PHE HD% 1.0 . 3.54 275 255 A 66 PHE H A 17 ARG HA 1.0 . 4.76 276 256 A 66 PHE H A 18 GLN HBy 1.0 . 3.91 277 257 A 65 GLU H A 81 VAL HA 1.0 . 4.59 278 258 A 65 GLU H A 81 VAL HGx% 1.0 . 4.20 279 259 A 64 VAL H A 20 GLY H 1.0 . 3.72 280 260 A 64 VAL H A 21 THR HA 1.0 . 3.84 281 261 A 63 VAL H A 64 VAL H 1.0 . 4.62 282 262 A 62 GLU H A 22 VAL HB 1.0 . 3.16 283 263 A 62 GLU H A 21 THR HG2% 1.0 . 4.27 284 264 A 62 GLU H A 22 VAL HGy% 1.0 . 3.72 285 265 A 62 GLU H A 22 VAL HGx% 1.0 . 4.59 286 266 A 62 GLU H A 21 THR HA 1.0 . 5.03 287 267 A 61 GLY H A 22 VAL HGx% 1.0 . 3.92 288 268 A 61 GLY H A 21 THR HG2% 1.0 . 4.28 289 269 A 60 GLU H A 59 ARG HDx 1.0 . 5.50 290 270 A 60 GLU H A 59 ARG HDy 1.0 . 5.50 291 271 A 60 GLU H A 60 GLU HGy 1.0 . 4.24 292 272 A 59 ARG H A 58 LEU HA 1.0 . 3.14 293 273 A 59 ARG H A 58 LEU HBy 1.0 . 4.43 294 274 A 55 PHE HA A 56 ARG H 1.0 . 3.43 295 275 A 50 ILE H A 48 THR HA 1.0 . 4.89 296 276 A 50 ILE H A 50 ILE HG1x 1.0 . 3.89 297 276 A 50 ILE H A 50 ILE HG1y 1.0 . 3.89 298 277 A 49 ASN H A 48 THR HB 1.0 . 4.01 299 278 A 50 ILE HB A 49 ASN H 1.0 . 4.88 300 279 A 49 ASN H A 50 ILE HG1x 1.0 . 4.74 301 279 A 49 ASN H A 50 ILE HG1y 1.0 . 4.74 302 280 A 49 ASN H A 48 THR HG2% 1.0 . 4.95 303 281 A 49 ASN H A 50 ILE HG2% 1.0 . 5.50 304 282 A 49 ASN H A 81 VAL HGy% 1.0 . 5.50 305 283 A 45 VAL H A 34 ILE H 1.0 . 4.86 306 284 A 45 VAL H A 44 PHE HD% 1.0 . 4.12 307 285 A 45 VAL H A 33 PHE HA 1.0 . 4.06 308 286 A 44 PHE H A 43 LEU HG 1.0 . 4.80 309 287 A 44 PHE H A 44 PHE HD% 1.0 . 4.67 310 288 A 44 PHE H A 44 PHE HE% 1.0 . 4.67 311 289 A 43 LEU H A 35 THR HA 1.0 . 4.37 312 290 A 43 LEU H A 36 PRO HDy 1.0 . 4.25 313 291 A 43 LEU H A 36 PRO HDx 1.0 . 4.44 314 292 A 43 LEU H A 43 LEU HG 1.0 . 4.04 315 293 A 43 LEU H A 34 ILE HB 1.0 . 4.47 316 294 A 43 LEU H A 34 ILE HG2% 1.0 . 4.80 317 295 A 42 ASP H A 36 PRO HDx 1.0 . 5.50 318 296 A 36 PRO HA A 37 GLY H 1.0 . 2.84 319 297 A 34 ILE H A 43 LEU HDx% 1.0 . 5.41 320 298 A 34 ILE H A 43 LEU HDy% 1.0 . 5.41 321 299 A 45 VAL HB A 34 ILE H 1.0 . 4.45 322 300 A 34 ILE H A 42 ASP HBx 1.0 . 4.56 323 300 A 42 ASP HBy A 34 ILE H 1.0 . 4.56 324 301 A 34 ILE H A 33 PHE HBx 1.0 . 4.39 325 302 A 34 ILE H A 43 LEU HA 1.0 . 4.91 326 303 A 34 ILE H A 42 ASP HA 1.0 . 4.69 327 304 A 25 PHE HE% A 33 PHE H 1.0 . 3.89 328 305 A 33 PHE H A 25 PHE HD% 1.0 . 3.90 329 306 A 25 PHE HA A 33 PHE H 1.0 . 4.09 330 307 A 45 VAL HGx% A 33 PHE H 1.0 . 3.94 331 308 A 45 VAL HB A 33 PHE H 1.0 . 5.50 332 309 A 45 VAL H A 32 GLY H 1.0 . 4.26 333 310 A 32 GLY H A 31 PHE HD% 1.0 . 4.41 334 311 A 32 GLY H A 25 PHE HD% 1.0 . 5.00 335 312 A 45 VAL HGx% A 32 GLY H 1.0 . 3.51 336 313 A 31 PHE H A 29 LYS H 1.0 . 4.06 337 314 A 31 PHE H A 29 LYS HA 1.0 . 4.77 338 315 A 31 PHE H A 29 LYS HBy 1.0 . 4.35 339 316 A 31 PHE H A 29 LYS HBx 1.0 . 4.35 340 317 A 30 GLY H A 29 LYS HBx 1.0 . 4.49 341 318 A 30 GLY H A 27 ALA HB% 1.0 . 4.41 342 319 A 29 LYS H A 30 GLY HAy 1.0 . 5.36 343 320 A 29 LYS H A 27 ALA HB% 1.0 . 4.75 344 321 A 28 THR H A 27 ALA HB% 1.0 . 4.31 345 322 A 26 ASN H A 25 PHE HD% 1.0 . 3.68 346 323 A 31 PHE H A 26 ASN H 1.0 . 4.39 347 324 A 26 ASN H A 32 GLY HAy 1.0 . 4.34 348 325 A 26 ASN H A 32 GLY HAx 1.0 . 4.34 349 326 A 25 PHE H A 32 GLY HAy 1.0 . 5.50 350 327 A 25 PHE H A 32 GLY HAx 1.0 . 5.50 351 328 A 22 VAL HGx% A 25 PHE H 1.0 . 4.37 352 329 A 24 TRP H A 23 LYS H 1.0 . 3.09 353 330 A 24 TRP H A 24 TRP HD1 1.0 . 4.59 354 331 A 24 TRP H A 25 PHE HD% 1.0 . 5.21 355 332 A 24 TRP H A 22 VAL HA 1.0 . 3.96 356 333 A 24 TRP H A 23 LYS HBx 1.0 . 3.79 357 333 A 24 TRP H A 23 LYS HBy 1.0 . 3.79 358 334 A 24 TRP H A 23 LYS HGx 1.0 . 3.73 359 334 A 24 TRP H A 23 LYS HGy 1.0 . 3.73 360 335 A 22 VAL H A 63 VAL HA 1.0 . 4.26 361 336 A 22 VAL H A 61 GLY HAx 1.0 . 4.25 362 337 A 22 VAL H A 62 GLU HA 1.0 . 4.96 363 338 A 22 VAL H A 62 GLU HBy 1.0 . 5.09 364 339 A 22 VAL H A 23 LYS HBx 1.0 . 4.86 365 339 A 22 VAL H A 23 LYS HBy 1.0 . 4.86 366 340 A 22 VAL H A 62 GLU HBx 1.0 . 5.09 367 341 A 35 THR H A 21 THR H 1.0 . 3.57 368 342 A 21 THR H A 35 THR HA 1.0 . 5.50 369 343 A 21 THR H A 34 ILE HA 1.0 . 4.33 370 344 A 35 THR HG2% A 21 THR H 1.0 . 4.62 371 345 A 21 THR H A 64 VAL HGy% 1.0 . 4.50 372 346 A 34 ILE HG2% A 21 THR H 1.0 . 4.25 373 347 A 20 GLY H A 66 PHE HE% 1.0 . 3.84 374 348 A 20 GLY H A 19 GLN HA 1.0 . 2.87 375 349 A 63 VAL HA A 20 GLY H 1.0 . 4.21 376 350 A 34 ILE HA A 20 GLY H 1.0 . 5.50 377 351 A 64 VAL HA A 20 GLY H 1.0 . 5.19 378 352 A 20 GLY H A 19 GLN HBx 1.0 . 3.91 379 352 A 20 GLY H A 19 GLN HBy 1.0 . 3.91 380 353 A 64 VAL HGy% A 20 GLY H 1.0 . 4.06 381 354 A 34 ILE HG2% A 20 GLY H 1.0 . 4.81 382 355 A 34 ILE HD1% A 20 GLY H 1.0 . 5.28 383 356 A 19 GLN H A 66 PHE HE% 1.0 . 4.64 384 357 A 19 GLN H A 19 GLN HBx 1.0 . 3.75 385 357 A 19 GLN H A 19 GLN HBy 1.0 . 3.75 386 358 A 18 GLN H A 65 GLU HA 1.0 . 4.82 387 359 A 18 GLN H A 17 ARG HDx 1.0 . 4.91 388 359 A 18 GLN H A 17 ARG HDy 1.0 . 4.91 389 360 A 17 ARG H A 17 ARG HDx 1.0 . 4.26 390 360 A 17 ARG H A 17 ARG HDy 1.0 . 4.26 391 361 A 17 ARG H A 15 GLN HGx 1.0 . 4.33 392 361 A 17 ARG H A 15 GLN HGy 1.0 . 4.33 393 362 A 46 HIS H A 46 HIS HBx 1.0 . 3.72 394 362 A 46 HIS H A 46 HIS HBy 1.0 . 3.72 395 363 A 46 HIS H A 45 VAL HA 1.0 . 3.44 396 364 A 31 PHE H A 31 PHE HD% 1.0 . 3.93 397 365 A 45 VAL HB A 46 HIS H 1.0 . 4.66 398 366 A 76 SER H A 76 SER HBx 1.0 . 3.84 399 367 A 77 LYS H A 76 SER HBx 1.0 . 3.78 400 368 A 59 ARG H A 58 LEU HBx 1.0 . 4.43 401 369 A 24 TRP H A 23 LYS HDx 1.0 . 4.90 402 369 A 24 TRP H A 23 LYS HDy 1.0 . 4.90 403 370 A 22 VAL H A 23 LYS H 1.0 . 4.74 404 371 A 23 LYS H A 22 VAL HA 1.0 . 3.54 405 372 A 23 LYS H A 23 LYS HBx 1.0 . 3.92 406 372 A 23 LYS H A 23 LYS HBy 1.0 . 3.92 407 373 A 23 LYS H A 23 LYS HGx 1.0 . 5.50 408 373 A 23 LYS H A 23 LYS HGy 1.0 . 5.50 409 374 A 23 LYS H A 23 LYS HDx 1.0 . 5.50 410 374 A 23 LYS H A 23 LYS HDy 1.0 . 5.50 411 375 A 22 VAL HGx% A 23 LYS H 1.0 . 4.18 412 376 A 73 ASP H A 72 PRO HA 1.0 . 3.51 413 377 A 24 TRP HE1 A 23 LYS HDx 1.0 . 4.84 414 377 A 23 LYS HDy A 24 TRP HE1 1.0 . 4.84 415 378 A 69 GLU H A 79 VAL HGy% 1.0 . 3.78 416 379 A 25 PHE H A 25 PHE HD% 1.0 . 4.33 417 380 A 50 ILE H A 50 ILE HD1% 1.0 . 3.83 418 381 A 66 PHE H A 66 PHE HE% 1.0 . 4.59 419 382 A 79 VAL HGy% A 80 ASN HD2y 1.0 . 4.59 420 383 A 79 VAL HGy% A 80 ASN HD2x 1.0 . 4.59 421 384 A 49 ASN HA A 49 ASN HD2y 1.0 . 4.23 422 385 A 49 ASN HA A 49 ASN HD2x 1.0 . 4.23 423 386 A 82 THR HG2% A 82 THR HA 1.0 . 3.35 424 387 A 59 ARG HA A 59 ARG HGx 1.0 . 3.97 425 387 A 59 ARG HGy A 59 ARG HA 1.0 . 3.97 426 388 A 34 ILE HG2% A 34 ILE HG1x 1.0 . 3.96 427 389 A 34 ILE HB A 34 ILE HD1% 1.0 . 3.73 428 390 A 45 VAL HGx% A 34 ILE HD1% 1.0 . 4.18 429 391 A 34 ILE HG2% A 34 ILE HA 1.0 . 3.97 430 392 A 22 VAL HGx% A 25 PHE HBx 1.0 . 4.64 431 393 A 22 VAL HGy% A 22 VAL HA 1.0 . 3.76 432 394 A 22 VAL HGx% A 22 VAL HA 1.0 . 3.72 433 395 A 21 THR HG2% A 21 THR HA 1.0 . 3.47 434 396 A 18 GLN HA A 18 GLN HGx 1.0 . 4.00 435 396 A 18 GLN HGy A 18 GLN HA 1.0 . 4.00 436 397 A 28 THR HA A 28 THR HG2% 1.0 . 3.77 437 398 A 34 ILE HG2% A 34 ILE HD1% 1.0 . 2.44 438 399 A 50 ILE HG2% A 50 ILE HA 1.0 . 4.07 439 400 A 50 ILE HB A 50 ILE HD1% 1.0 . 3.75 440 401 A 50 ILE HA A 50 ILE HD1% 1.0 . 4.70 441 402 A 50 ILE HG2% A 50 ILE HD1% 1.0 . 3.67 442 403 A 62 GLU HA A 62 GLU HGx 1.0 . 3.91 443 403 A 62 GLU HGy A 62 GLU HA 1.0 . 3.91 444 404 A 75 ARG HA A 75 ARG HGx 1.0 . 4.02 445 405 A 75 ARG HA A 75 ARG HGy 1.0 . 4.02 446 406 A 64 VAL HGx% A 64 VAL HA 1.0 . 3.77 447 407 A 53 GLU HA A 53 GLU HGx 1.0 . 4.11 448 407 A 53 GLU HA A 53 GLU HGy 1.0 . 4.11 449 408 A 80 ASN HA A 49 ASN HBy 1.0 . 4.72 450 409 A 79 VAL HGy% A 50 ILE HD1% 1.0 . 5.13 451 410 A 79 VAL HGy% A 69 GLU HBx 1.0 . 4.26 452 411 A 45 VAL HB A 78 ALA HB% 1.0 . 4.42 453 412 A 76 SER HA A 75 ARG HBy 1.0 . 4.92 454 413 A 50 ILE HG2% A 50 ILE HG1x 1.0 . 3.88 455 413 A 50 ILE HG2% A 50 ILE HG1y 1.0 . 3.88 456 414 A 79 VAL HB A 50 ILE HG1x 1.0 . 4.86 457 414 A 79 VAL HB A 50 ILE HG1y 1.0 . 4.86 458 415 A 79 VAL HGx% A 69 GLU HBx 1.0 . 5.06 459 416 A 79 VAL HGx% A 69 GLU HBy 1.0 . 5.06 460 417 A 66 PHE HA A 66 PHE HD% 1.0 . 4.01 461 418 A 65 GLU HBx A 64 VAL HA 1.0 . 4.32 462 419 A 64 VAL HB A 81 VAL HGx% 1.0 . 3.89 463 420 A 81 VAL HB A 64 VAL HB 1.0 . 4.49 464 421 A 81 VAL HGx% A 64 VAL HGx% 1.0 . 3.36 465 422 A 34 ILE HG2% A 64 VAL HGy% 1.0 . 4.12 466 423 A 78 ALA HB% A 68 VAL HGx% 1.0 . 4.93 467 424 A 63 VAL HA A 63 VAL HGx% 1.0 . 4.19 468 425 A 63 VAL HA A 63 VAL HGy% 1.0 . 4.19 469 426 A 68 VAL HA A 68 VAL HGx% 1.0 . 3.97 470 427 A 61 GLY HAy A 62 GLU HA 1.0 . 4.54 471 428 A 22 VAL HGy% A 62 GLU HBy 1.0 . 4.12 472 429 A 22 VAL HGy% A 62 GLU HBx 1.0 . 4.12 473 430 A 21 THR HB A 61 GLY HAx 1.0 . 3.31 474 431 A 62 GLU HA A 61 GLY HAx 1.0 . 4.84 475 432 A 21 THR HG2% A 61 GLY HAx 1.0 . 4.31 476 433 A 60 GLU HA A 22 VAL HGx% 1.0 . 3.75 477 434 A 60 GLU HA A 22 VAL HB 1.0 . 4.67 478 435 A 80 ASN HA A 50 ILE HA 1.0 . 3.99 479 436 A 34 ILE HD1% A 45 VAL HGy% 1.0 . 3.88 480 437 A 41 GLU HA A 41 GLU HGx 1.0 . 4.02 481 437 A 41 GLU HGy A 41 GLU HA 1.0 . 4.02 482 438 A 35 THR HA A 36 PRO HA 1.0 . 4.84 483 439 A 35 THR HA A 36 PRO HDy 1.0 . 3.63 484 440 A 35 THR HG2% A 35 THR HA 1.0 . 4.23 485 441 A 34 ILE HB A 43 LEU HBx 1.0 . 4.87 486 442 A 34 ILE HG2% A 34 ILE HG1y 1.0 . 3.96 487 443 A 34 ILE HG2% A 20 GLY HAx 1.0 . 4.22 488 444 A 34 ILE HG2% A 20 GLY HAy 1.0 . 4.22 489 445 A 34 ILE HD1% A 34 ILE HA 1.0 . 4.23 490 446 A 42 ASP HBy A 33 PHE HBy 1.0 . 4.52 491 446 A 33 PHE HBy A 42 ASP HBx 1.0 . 4.52 492 447 A 29 LYS HA A 30 GLY HAy 1.0 . 4.59 493 448 A 29 LYS HA A 29 LYS HDx 1.0 . 3.95 494 448 A 29 LYS HA A 29 LYS HDy 1.0 . 3.95 495 449 A 25 PHE HA A 32 GLY HAy 1.0 . 4.31 496 450 A 22 VAL HGx% A 25 PHE HA 1.0 . 4.62 497 451 A 25 PHE HA A 24 TRP HA 1.0 . 4.77 498 452 A 22 VAL HGx% A 25 PHE HBy 1.0 . 4.64 499 453 A 22 VAL HB A 23 LYS HA 1.0 . 4.39 500 454 A 63 VAL HA A 21 THR HA 1.0 . 3.59 501 455 A 21 THR HB A 22 VAL HA 1.0 . 4.73 502 456 A 21 THR HB A 63 VAL HA 1.0 . 5.07 503 457 A 21 THR HG2% A 22 VAL HGy% 1.0 . 4.59 504 458 A 21 THR HG2% A 63 VAL HB 1.0 . 4.57 505 459 A 21 THR HG2% A 61 GLY HAy 1.0 . 4.06 506 460 A 79 VAL HGy% A 69 GLU HBy 1.0 . 4.26 507 461 A 16 LEU HA A 17 ARG HGx 1.0 . 4.29 508 461 A 16 LEU HA A 17 ARG HGy 1.0 . 4.29 509 462 A 16 LEU HA A 16 LEU HDy% 1.0 . 4.43 510 463 A 18 GLN H A 16 LEU HBx 1.0 . 4.97 511 463 A 16 LEU HBy A 18 GLN H 1.0 . 4.97 512 464 A 15 GLN HA A 15 GLN HGx 1.0 . 3.99 513 464 A 15 GLN HA A 15 GLN HGy 1.0 . 3.99 514 465 A 81 VAL HGy% A 64 VAL HGy% 1.0 . 3.91 515 466 A 66 PHE HBx A 81 VAL HGy% 1.0 . 4.42 516 467 A 81 VAL HGy% A 66 PHE HBy 1.0 . 4.47 517 468 A 81 VAL HGy% A 66 PHE HA 1.0 . 4.47 518 469 A 81 VAL HB A 50 ILE HD1% 1.0 . 4.44 519 470 A 80 ASN HA A 49 ASN HBx 1.0 . 4.72 520 471 A 80 ASN HA A 79 VAL HB 1.0 . 4.71 521 472 A 81 VAL HB A 80 ASN HA 1.0 . 5.47 522 473 A 81 VAL HA A 80 ASN HBy 1.0 . 5.36 523 474 A 81 VAL HA A 80 ASN HBx 1.0 . 5.36 524 475 A 60 GLU HBx A 59 ARG HA 1.0 . 5.22 525 476 A 45 VAL HB A 34 ILE HD1% 1.0 . 4.76 526 477 A 45 VAL HGx% A 34 ILE HG2% 1.0 . 4.75 527 478 A 34 ILE HB A 43 LEU HBy 1.0 . 4.87 528 479 A 44 PHE HA A 33 PHE HA 1.0 . 4.43 529 480 A 45 VAL HGx% A 33 PHE HA 1.0 . 4.33 530 481 A 25 PHE HA A 32 GLY HAx 1.0 . 4.31 531 482 A 17 ARG HA A 17 ARG HGx 1.0 . 3.86 532 482 A 17 ARG HA A 17 ARG HGy 1.0 . 3.86 533 483 A 16 LEU HA A 16 LEU HDx% 1.0 . 4.43 534 484 A 21 THR HA A 61 GLY HAx 1.0 . 4.97 535 485 A 64 VAL HGy% A 21 THR HA 1.0 . 4.33 536 486 A 22 VAL HGy% A 21 THR HA 1.0 . 4.71 537 487 A 21 THR HG2% A 63 VAL HA 1.0 . 4.45 538 488 A 22 VAL HGx% A 60 GLU HBx 1.0 . 5.01 539 489 A 22 VAL HGx% A 24 TRP H 1.0 . 5.07 540 490 A 22 VAL HGx% A 25 PHE HE% 1.0 . 5.49 541 491 A 22 VAL HGx% A 60 GLU H 1.0 . 4.71 542 492 A 42 ASP HBy A 33 PHE HBx 1.0 . 4.52 543 492 A 33 PHE HBx A 42 ASP HBx 1.0 . 4.52 544 493 A 81 VAL HGx% A 34 ILE HG1x 1.0 . 5.50 545 494 A 64 VAL HB A 81 VAL HA 1.0 . 4.72 546 495 A 81 VAL HA A 50 ILE HG1x 1.0 . 4.25 547 495 A 81 VAL HA A 50 ILE HG1y 1.0 . 4.25 548 496 A 29 LYS HDy A 29 LYS HBx 1.0 . 3.38 549 496 A 29 LYS HBx A 29 LYS HDx 1.0 . 3.38 550 497 A 29 LYS HDy A 29 LYS HBy 1.0 . 3.38 551 497 A 29 LYS HBy A 29 LYS HDx 1.0 . 3.38 552 498 A 16 LEU HBy A 16 LEU HDy% 1.0 . 4.16 553 498 A 16 LEU HBx A 16 LEU HDy% 1.0 . 4.16 554 499 A 81 VAL HGy% A 50 ILE HG1x 1.0 . 3.99 555 499 A 81 VAL HGy% A 50 ILE HG1y 1.0 . 3.99 556 500 A 81 VAL HGx% A 64 VAL HGy% 1.0 . 3.54 557 501 A 81 VAL HGx% A 50 ILE HG1x 1.0 . 4.36 558 501 A 81 VAL HGx% A 50 ILE HG1y 1.0 . 4.36 559 502 A 81 VAL HA A 81 VAL HGx% 1.0 . 4.18 560 503 A 14 GLU HA A 14 GLU HGx 1.0 . 3.91 561 503 A 14 GLU HA A 14 GLU HGy 1.0 . 3.91 562 504 A 81 VAL HGx% A 34 ILE HG1y 1.0 . 5.50 563 505 A 22 VAL HGx% A 23 LYS HA 1.0 . 5.50 564 506 A 79 VAL HGx% A 50 ILE HG1x 1.0 . 4.71 565 506 A 79 VAL HGx% A 50 ILE HG1y 1.0 . 4.71 566 507 A 49 ASN HA A 50 ILE HG1x 1.0 . 5.39 567 507 A 49 ASN HA A 50 ILE HG1y 1.0 . 5.39 568 508 A 17 ARG HA A 17 ARG HDx 1.0 . 4.37 569 508 A 17 ARG HA A 17 ARG HDy 1.0 . 4.37 570 509 A 58 LEU HA A 58 LEU HDx% 1.0 . 4.52 571 510 A 58 LEU HA A 58 LEU HDy% 1.0 . 4.52 572 511 A 55 PHE HA A 56 ARG HA 1.0 . 4.52 573 512 A 55 PHE HA A 56 ARG HDx 1.0 . 5.50 574 513 A 16 LEU HBy A 16 LEU HDx% 1.0 . 4.16 575 513 A 16 LEU HDx% A 16 LEU HBx 1.0 . 4.16 576 514 A 42 ASP HA A 36 PRO HDy 1.0 . 4.62 577 515 A 42 ASP HA A 36 PRO HDx 1.0 . 4.77 578 516 A 78 ALA HB% A 68 VAL HGy% 1.0 . 4.93 579 517 A 68 VAL HA A 68 VAL HGy% 1.0 . 3.97 580 518 A 23 LYS HA A 23 LYS HDx 1.0 . 4.36 581 518 A 23 LYS HDy A 23 LYS HA 1.0 . 4.36 582 519 A 23 LYS HA A 23 LYS HGx 1.0 . 3.45 583 519 A 23 LYS HGy A 23 LYS HA 1.0 . 3.45 584 520 A 23 LYS HEy A 23 LYS HGx 1.0 . 4.18 585 520 A 23 LYS HEx A 23 LYS HGx 1.0 . 4.18 586 520 A 23 LYS HGy A 23 LYS HEx 1.0 . 4.18 587 520 A 23 LYS HGy A 23 LYS HEy 1.0 . 4.18 588 521 A 25 PHE HD% A 27 ALA HA 1.0 . 4.12 589 522 A 81 VAL HB A 50 ILE HA 1.0 . 4.74 590 523 A 34 ILE HD1% A 81 VAL HGx% 1.0 . 3.33 591 524 A 21 THR HA A 63 VAL HGx% 1.0 . 5.27 592 525 A 21 THR HA A 63 VAL HGy% 1.0 . 5.27 593 526 A 55 PHE HA A 56 ARG HDy 1.0 . 5.50 594 527 A 19 GLN HA A 19 GLN HGx 1.0 . 3.76 595 528 A 19 GLN HA A 19 GLN HGy 1.0 . 3.76 596 529 A 24 TRP HD1 A 23 LYS HDx 1.0 . 3.63 597 529 A 24 TRP HD1 A 23 LYS HDy 1.0 . 3.63 598 530 A 25 PHE HD% A 27 ALA HB% 1.0 . 4.14 599 531 A 22 VAL HGx% A 25 PHE HD% 1.0 . 3.67 600 532 A 25 PHE HA A 25 PHE HD% 1.0 . 4.02 601 533 A 24 TRP HD1 A 23 LYS HGx 1.0 . 3.55 602 533 A 24 TRP HD1 A 23 LYS HGy 1.0 . 3.55 603 534 A 64 VAL HGy% A 66 PHE HE% 1.0 . 4.14 604 535 A 15 GLN H A 14 GLU HBx 1.0 . 4.14 605 535 A 15 GLN H A 14 GLU HBy 1.0 . 4.14 606 536 A 15 GLN H A 15 GLN HBx 1.0 . 3.60 607 536 A 15 GLN H A 15 GLN HBy 1.0 . 3.60 608 537 A 15 GLN H A 15 GLN HE2x 1.0 . 4.55 609 537 A 15 GLN H A 15 GLN HE2y 1.0 . 4.55 610 538 A 16 LEU H A 15 GLN HBx 1.0 . 3.96 611 538 A 16 LEU H A 15 GLN HBy 1.0 . 3.96 612 539 A 16 LEU H A 16 LEU HDy% 1.0 . 4.10 613 539 A 16 LEU H A 16 LEU HDx% 1.0 . 4.10 614 540 A 16 LEU HA A 16 LEU HDy% 1.0 . 3.75 615 540 A 16 LEU HA A 16 LEU HDx% 1.0 . 3.75 616 541 A 16 LEU HBy A 68 VAL HGy% 1.0 . 4.61 617 541 A 68 VAL HGx% A 16 LEU HBx 1.0 . 4.61 618 541 A 16 LEU HBy A 68 VAL HGx% 1.0 . 4.61 619 541 A 16 LEU HBx A 68 VAL HGy% 1.0 . 4.61 620 542 A 16 LEU HG A 68 VAL HGy% 1.0 . 5.16 621 542 A 68 VAL HGx% A 16 LEU HG 1.0 . 5.16 622 543 A 17 ARG H A 16 LEU HDy% 1.0 . 4.25 623 543 A 17 ARG H A 16 LEU HDx% 1.0 . 4.25 624 544 A 16 LEU HDx% A 68 VAL HGy% 1.0 . 3.45 625 544 A 16 LEU HDy% A 68 VAL HGy% 1.0 . 3.45 626 544 A 68 VAL HGx% A 16 LEU HDy% 1.0 . 3.45 627 544 A 16 LEU HDx% A 68 VAL HGx% 1.0 . 3.45 628 545 A 17 ARG H A 17 ARG HBx 1.0 . 2.91 629 545 A 17 ARG H A 17 ARG HBy 1.0 . 2.91 630 546 A 17 ARG HBx A 17 ARG HDx 1.0 . 3.62 631 546 A 17 ARG HBy A 17 ARG HDx 1.0 . 3.62 632 546 A 17 ARG HDy A 17 ARG HBx 1.0 . 3.62 633 546 A 17 ARG HDy A 17 ARG HBy 1.0 . 3.62 634 547 A 17 ARG HBy A 65 GLU HGx 1.0 . 4.26 635 547 A 17 ARG HBx A 65 GLU HGx 1.0 . 4.26 636 547 A 65 GLU HGy A 17 ARG HBx 1.0 . 4.26 637 547 A 17 ARG HBy A 65 GLU HGy 1.0 . 4.26 638 548 A 18 GLN H A 65 GLU HGx 1.0 . 4.13 639 548 A 18 GLN H A 65 GLU HGy 1.0 . 4.13 640 549 A 18 GLN HGx A 36 PRO HBx 1.0 . 4.67 641 549 A 18 GLN HGy A 36 PRO HBx 1.0 . 4.67 642 549 A 36 PRO HBy A 18 GLN HGx 1.0 . 4.67 643 549 A 18 GLN HGy A 36 PRO HBy 1.0 . 4.67 644 550 A 19 GLN H A 19 GLN HGy 1.0 . 4.50 645 550 A 19 GLN H A 19 GLN HGx 1.0 . 4.50 646 551 A 19 GLN H A 20 GLY HAx 1.0 . 5.01 647 551 A 19 GLN H A 20 GLY HAy 1.0 . 5.01 648 552 A 19 GLN HA A 63 VAL HGy% 1.0 . 4.75 649 552 A 19 GLN HA A 63 VAL HGx% 1.0 . 4.75 650 553 A 20 GLY H A 19 GLN HGy 1.0 . 4.12 651 553 A 20 GLY H A 19 GLN HGx 1.0 . 4.12 652 554 A 20 GLY H A 63 VAL HGy% 1.0 . 4.06 653 554 A 20 GLY H A 63 VAL HGx% 1.0 . 4.06 654 555 A 21 THR H A 20 GLY HAx 1.0 . 2.80 655 555 A 21 THR H A 20 GLY HAy 1.0 . 2.80 656 556 A 21 THR HA A 20 GLY HAx 1.0 . 4.55 657 556 A 21 THR HA A 20 GLY HAy 1.0 . 4.55 658 557 A 21 THR H A 63 VAL HGy% 1.0 . 4.95 659 557 A 21 THR H A 63 VAL HGx% 1.0 . 4.95 660 558 A 21 THR HA A 63 VAL HGy% 1.0 . 4.55 661 558 A 21 THR HA A 63 VAL HGx% 1.0 . 4.55 662 559 A 21 THR HG2% A 63 VAL HGy% 1.0 . 3.41 663 559 A 21 THR HG2% A 63 VAL HGx% 1.0 . 3.41 664 560 A 22 VAL H A 62 GLU HBx 1.0 . 4.44 665 560 A 22 VAL H A 62 GLU HBy 1.0 . 4.44 666 561 A 22 VAL HB A 62 GLU HBx 1.0 . 4.04 667 561 A 22 VAL HB A 62 GLU HBy 1.0 . 4.04 668 562 A 22 VAL HGx% A 25 PHE HBx 1.0 . 3.98 669 562 A 22 VAL HGx% A 25 PHE HBy 1.0 . 3.98 670 563 A 24 TRP H A 24 TRP HBx 1.0 . 3.67 671 563 A 24 TRP H A 24 TRP HBy 1.0 . 3.67 672 564 A 25 PHE H A 24 TRP HBx 1.0 . 3.82 673 564 A 25 PHE H A 24 TRP HBy 1.0 . 3.82 674 565 A 25 PHE HA A 32 GLY HAy 1.0 . 3.71 675 565 A 25 PHE HA A 32 GLY HAx 1.0 . 3.71 676 566 A 26 ASN H A 25 PHE HBx 1.0 . 3.74 677 566 A 26 ASN H A 25 PHE HBy 1.0 . 3.74 678 567 A 26 ASN H A 26 ASN HBy 1.0 . 3.36 679 567 A 26 ASN H A 26 ASN HBx 1.0 . 3.36 680 568 A 26 ASN H A 32 GLY HAy 1.0 . 3.74 681 568 A 26 ASN H A 32 GLY HAx 1.0 . 3.74 682 569 A 31 PHE H A 26 ASN HBy 1.0 . 4.11 683 569 A 31 PHE H A 26 ASN HBx 1.0 . 4.11 684 570 A 29 LYS H A 29 LYS HBy 1.0 . 3.33 685 570 A 29 LYS H A 29 LYS HBx 1.0 . 3.33 686 571 A 29 LYS H A 29 LYS HGy 1.0 . 3.18 687 571 A 29 LYS H A 29 LYS HGx 1.0 . 3.18 688 572 A 29 LYS HA A 29 LYS HGy 1.0 . 3.69 689 572 A 29 LYS HA A 29 LYS HGx 1.0 . 3.69 690 573 A 29 LYS HBy A 29 LYS HDx 1.0 . 2.95 691 573 A 29 LYS HBx A 29 LYS HDx 1.0 . 2.95 692 573 A 29 LYS HDy A 29 LYS HBy 1.0 . 2.95 693 573 A 29 LYS HDy A 29 LYS HBx 1.0 . 2.95 694 574 A 30 GLY H A 29 LYS HBy 1.0 . 3.67 695 574 A 30 GLY H A 29 LYS HBx 1.0 . 3.67 696 575 A 31 PHE H A 29 LYS HBy 1.0 . 3.70 697 575 A 31 PHE H A 29 LYS HBx 1.0 . 3.70 698 576 A 31 PHE HD% A 29 LYS HBy 1.0 . 4.17 699 576 A 31 PHE HD% A 29 LYS HBx 1.0 . 4.17 700 577 A 30 GLY H A 29 LYS HGy 1.0 . 4.49 701 577 A 30 GLY H A 29 LYS HGx 1.0 . 4.49 702 578 A 31 PHE HBx A 32 GLY HAy 1.0 . 4.43 703 578 A 31 PHE HBy A 32 GLY HAy 1.0 . 4.43 704 578 A 32 GLY HAx A 31 PHE HBx 1.0 . 4.43 705 578 A 31 PHE HBy A 32 GLY HAx 1.0 . 4.43 706 579 A 33 PHE H A 33 PHE HBy 1.0 . 3.53 707 579 A 33 PHE H A 33 PHE HBx 1.0 . 3.53 708 580 A 34 ILE H A 33 PHE HBy 1.0 . 3.66 709 580 A 34 ILE H A 33 PHE HBx 1.0 . 3.66 710 581 A 33 PHE HBx A 42 ASP HBx 1.0 . 3.91 711 581 A 33 PHE HBy A 42 ASP HBx 1.0 . 3.91 712 581 A 42 ASP HBy A 33 PHE HBy 1.0 . 3.91 713 581 A 42 ASP HBy A 33 PHE HBx 1.0 . 3.91 714 582 A 43 LEU H A 33 PHE HBy 1.0 . 4.56 715 582 A 43 LEU H A 33 PHE HBx 1.0 . 4.56 716 583 A 34 ILE H A 34 ILE HG1x 1.0 . 3.79 717 583 A 34 ILE H A 34 ILE HG1y 1.0 . 3.79 718 584 A 34 ILE H A 43 LEU HDy% 1.0 . 4.61 719 584 A 34 ILE H A 43 LEU HDx% 1.0 . 4.61 720 585 A 34 ILE HB A 43 LEU HBx 1.0 . 4.26 721 585 A 34 ILE HB A 43 LEU HBy 1.0 . 4.26 722 586 A 34 ILE HG2% A 34 ILE HG1x 1.0 . 3.38 723 586 A 34 ILE HG2% A 34 ILE HG1y 1.0 . 3.38 724 587 A 34 ILE HG2% A 43 LEU HDy% 1.0 . 4.85 725 587 A 34 ILE HG2% A 43 LEU HDx% 1.0 . 4.85 726 588 A 35 THR H A 34 ILE HG1x 1.0 . 5.28 727 588 A 35 THR H A 34 ILE HG1y 1.0 . 5.28 728 589 A 34 ILE HG1x A 43 LEU HDy% 1.0 . 4.42 729 589 A 34 ILE HG1y A 43 LEU HDy% 1.0 . 4.42 730 589 A 43 LEU HDx% A 34 ILE HG1x 1.0 . 4.42 731 589 A 34 ILE HG1y A 43 LEU HDx% 1.0 . 4.42 732 590 A 45 VAL HGx% A 34 ILE HG1x 1.0 . 4.37 733 590 A 45 VAL HGx% A 34 ILE HG1y 1.0 . 4.37 734 591 A 78 ALA HB% A 34 ILE HG1x 1.0 . 4.25 735 591 A 78 ALA HB% A 34 ILE HG1y 1.0 . 4.25 736 592 A 81 VAL HGx% A 34 ILE HG1x 1.0 . 4.75 737 592 A 81 VAL HGx% A 34 ILE HG1y 1.0 . 4.75 738 593 A 37 GLY H A 36 PRO HBx 1.0 . 3.70 739 593 A 37 GLY H A 36 PRO HBy 1.0 . 3.70 740 594 A 37 GLY H A 36 PRO HGx 1.0 . 4.89 741 594 A 37 GLY H A 36 PRO HGy 1.0 . 4.89 742 595 A 36 PRO HGx A 43 LEU HDy% 1.0 . 4.89 743 595 A 36 PRO HGy A 43 LEU HDy% 1.0 . 4.89 744 595 A 43 LEU HDx% A 36 PRO HGx 1.0 . 4.89 745 595 A 43 LEU HDx% A 36 PRO HGy 1.0 . 4.89 746 596 A 36 PRO HDx A 43 LEU HDy% 1.0 . 4.14 747 596 A 36 PRO HDx A 43 LEU HDx% 1.0 . 4.14 748 597 A 40 GLY H A 39 GLY HAx 1.0 . 3.13 749 597 A 40 GLY H A 39 GLY HAy 1.0 . 3.13 750 598 A 39 GLY HAy A 40 GLY HAy 1.0 . 4.42 751 598 A 39 GLY HAx A 40 GLY HAy 1.0 . 4.42 752 598 A 40 GLY HAx A 39 GLY HAx 1.0 . 4.42 753 598 A 39 GLY HAy A 40 GLY HAx 1.0 . 4.42 754 599 A 41 GLU H A 40 GLY HAy 1.0 . 2.77 755 599 A 41 GLU H A 40 GLY HAx 1.0 . 2.77 756 600 A 41 GLU H A 41 GLU HBx 1.0 . 3.00 757 600 A 41 GLU H A 41 GLU HBy 1.0 . 3.00 758 601 A 42 ASP H A 41 GLU HBx 1.0 . 3.35 759 601 A 42 ASP H A 41 GLU HBy 1.0 . 3.35 760 602 A 43 LEU H A 43 LEU HBx 1.0 . 3.16 761 602 A 43 LEU H A 43 LEU HBy 1.0 . 3.16 762 603 A 43 LEU H A 43 LEU HDy% 1.0 . 3.94 763 603 A 43 LEU H A 43 LEU HDx% 1.0 . 3.94 764 604 A 44 PHE H A 43 LEU HBx 1.0 . 3.79 765 604 A 44 PHE H A 43 LEU HBy 1.0 . 3.79 766 605 A 44 PHE H A 43 LEU HDy% 1.0 . 4.58 767 605 A 44 PHE H A 43 LEU HDx% 1.0 . 4.58 768 606 A 44 PHE H A 44 PHE HBx 1.0 . 3.11 769 606 A 44 PHE H A 44 PHE HBy 1.0 . 3.11 770 607 A 45 VAL H A 44 PHE HBx 1.0 . 3.73 771 607 A 45 VAL H A 44 PHE HBy 1.0 . 3.73 772 608 A 49 ASN H A 49 ASN HBy 1.0 . 3.20 773 608 A 49 ASN H A 49 ASN HBx 1.0 . 3.20 774 609 A 49 ASN HBx A 50 ILE HG1x 1.0 . 4.80 775 609 A 49 ASN HBy A 50 ILE HG1x 1.0 . 4.80 776 609 A 50 ILE HG1y A 49 ASN HBy 1.0 . 4.80 777 609 A 50 ILE HG1y A 49 ASN HBx 1.0 . 4.80 778 610 A 79 VAL HGx% A 49 ASN HBy 1.0 . 4.34 779 610 A 79 VAL HGx% A 49 ASN HBx 1.0 . 4.34 780 611 A 80 ASN H A 49 ASN HBy 1.0 . 3.55 781 611 A 80 ASN H A 49 ASN HBx 1.0 . 3.55 782 612 A 80 ASN HA A 49 ASN HBy 1.0 . 4.02 783 612 A 80 ASN HA A 49 ASN HBx 1.0 . 4.02 784 613 A 81 VAL H A 49 ASN HBy 1.0 . 5.20 785 613 A 81 VAL H A 49 ASN HBx 1.0 . 5.20 786 614 A 79 VAL HGx% A 49 ASN HD2x 1.0 . 4.53 787 614 A 79 VAL HGx% A 49 ASN HD2y 1.0 . 4.53 788 615 A 50 ILE HG2% A 56 ARG HDy 1.0 . 4.60 789 615 A 50 ILE HG2% A 56 ARG HDx 1.0 . 4.60 790 616 A 55 PHE HA A 56 ARG HDy 1.0 . 4.77 791 616 A 55 PHE HA A 56 ARG HDx 1.0 . 4.77 792 617 A 56 ARG HA A 56 ARG HGx 1.0 . 3.54 793 617 A 56 ARG HA A 56 ARG HGy 1.0 . 3.54 794 618 A 56 ARG HA A 56 ARG HDy 1.0 . 5.31 795 618 A 56 ARG HA A 56 ARG HDx 1.0 . 5.31 796 619 A 58 LEU HA A 58 LEU HDy% 1.0 . 3.45 797 619 A 58 LEU HA A 58 LEU HDx% 1.0 . 3.45 798 620 A 59 ARG H A 58 LEU HBx 1.0 . 3.66 799 620 A 59 ARG H A 58 LEU HBy 1.0 . 3.66 800 621 A 59 ARG H A 58 LEU HDy% 1.0 . 3.99 801 621 A 59 ARG H A 58 LEU HDx% 1.0 . 3.99 802 622 A 59 ARG H A 59 ARG HBy 1.0 . 3.34 803 622 A 59 ARG H A 59 ARG HBx 1.0 . 3.34 804 623 A 59 ARG HBx A 59 ARG HGx 1.0 . 2.42 805 623 A 59 ARG HGy A 59 ARG HBy 1.0 . 2.42 806 623 A 59 ARG HGy A 59 ARG HBx 1.0 . 2.42 807 623 A 59 ARG HBy A 59 ARG HGx 1.0 . 2.42 808 624 A 60 GLU H A 59 ARG HBy 1.0 . 3.43 809 624 A 60 GLU H A 59 ARG HBx 1.0 . 3.43 810 625 A 60 GLU HBx A 59 ARG HBy 1.0 . 5.07 811 625 A 60 GLU HBx A 59 ARG HBx 1.0 . 5.07 812 626 A 59 ARG HBy A 60 GLU HGy 1.0 . 4.76 813 626 A 59 ARG HBx A 60 GLU HGy 1.0 . 4.76 814 626 A 60 GLU HGx A 59 ARG HBy 1.0 . 4.76 815 626 A 59 ARG HBx A 60 GLU HGx 1.0 . 4.76 816 627 A 60 GLU H A 60 GLU HGy 1.0 . 3.53 817 627 A 60 GLU H A 60 GLU HGx 1.0 . 3.53 818 628 A 61 GLY H A 60 GLU HGy 1.0 . 4.64 819 628 A 61 GLY H A 60 GLU HGx 1.0 . 4.64 820 629 A 61 GLY HAy A 60 GLU HGy 1.0 . 5.34 821 629 A 61 GLY HAy A 60 GLU HGx 1.0 . 5.34 822 630 A 63 VAL H A 62 GLU HBx 1.0 . 3.86 823 630 A 63 VAL H A 62 GLU HBy 1.0 . 3.86 824 631 A 63 VAL H A 63 VAL HGy% 1.0 . 2.93 825 631 A 63 VAL H A 63 VAL HGx% 1.0 . 2.93 826 632 A 64 VAL H A 63 VAL HGy% 1.0 . 3.39 827 632 A 64 VAL H A 63 VAL HGx% 1.0 . 3.39 828 633 A 64 VAL HGx% A 63 VAL HGy% 1.0 . 4.61 829 633 A 64 VAL HGx% A 63 VAL HGx% 1.0 . 4.61 830 634 A 64 VAL HGy% A 63 VAL HGy% 1.0 . 4.39 831 634 A 64 VAL HGy% A 63 VAL HGx% 1.0 . 4.39 832 635 A 65 GLU H A 65 GLU HGx 1.0 . 4.72 833 635 A 65 GLU H A 65 GLU HGy 1.0 . 4.72 834 636 A 65 GLU HA A 65 GLU HGx 1.0 . 3.73 835 636 A 65 GLU HA A 65 GLU HGy 1.0 . 3.73 836 637 A 66 PHE H A 65 GLU HGx 1.0 . 3.61 837 637 A 66 PHE H A 65 GLU HGy 1.0 . 3.61 838 638 A 68 VAL H A 67 GLU HGy 1.0 . 4.14 839 638 A 68 VAL H A 67 GLU HGx 1.0 . 4.14 840 639 A 79 VAL H A 67 GLU HGy 1.0 . 5.04 841 639 A 79 VAL H A 67 GLU HGx 1.0 . 5.04 842 640 A 68 VAL H A 68 VAL HGy% 1.0 . 3.58 843 640 A 68 VAL H A 68 VAL HGx% 1.0 . 3.58 844 641 A 69 GLU H A 68 VAL HGy% 1.0 . 3.68 845 641 A 69 GLU H A 68 VAL HGx% 1.0 . 3.68 846 642 A 68 VAL HGx% A 69 GLU HBy 1.0 . 4.14 847 642 A 68 VAL HGy% A 69 GLU HBy 1.0 . 4.14 848 642 A 69 GLU HBx A 68 VAL HGy% 1.0 . 4.14 849 642 A 68 VAL HGx% A 69 GLU HBx 1.0 . 4.14 850 643 A 68 VAL HGy% A 76 SER HBx 1.0 . 3.65 851 643 A 68 VAL HGx% A 76 SER HBx 1.0 . 3.65 852 643 A 76 SER HBy A 68 VAL HGy% 1.0 . 3.65 853 643 A 68 VAL HGx% A 76 SER HBy 1.0 . 3.65 854 644 A 77 LYS H A 68 VAL HGy% 1.0 . 4.67 855 644 A 77 LYS H A 68 VAL HGx% 1.0 . 4.67 856 645 A 78 ALA H A 68 VAL HGy% 1.0 . 4.69 857 645 A 78 ALA H A 68 VAL HGx% 1.0 . 4.69 858 646 A 78 ALA HA A 68 VAL HGy% 1.0 . 4.92 859 646 A 78 ALA HA A 68 VAL HGx% 1.0 . 4.92 860 647 A 78 ALA HB% A 68 VAL HGy% 1.0 . 4.07 861 647 A 78 ALA HB% A 68 VAL HGx% 1.0 . 4.07 862 648 A 69 GLU H A 69 GLU HBy 1.0 . 3.19 863 648 A 69 GLU H A 69 GLU HBx 1.0 . 3.19 864 649 A 69 GLU H A 69 GLU HGx 1.0 . 4.74 865 649 A 69 GLU H A 69 GLU HGy 1.0 . 4.74 866 650 A 69 GLU H A 76 SER HBx 1.0 . 4.90 867 650 A 69 GLU H A 76 SER HBy 1.0 . 4.90 868 651 A 70 ALA H A 69 GLU HBy 1.0 . 3.78 869 651 A 70 ALA H A 69 GLU HBx 1.0 . 3.78 870 652 A 79 VAL H A 69 GLU HBy 1.0 . 4.85 871 652 A 79 VAL H A 69 GLU HBx 1.0 . 4.85 872 653 A 79 VAL HGx% A 69 GLU HBy 1.0 . 4.34 873 653 A 79 VAL HGx% A 69 GLU HBx 1.0 . 4.34 874 654 A 79 VAL HGy% A 69 GLU HBy 1.0 . 3.74 875 654 A 79 VAL HGy% A 69 GLU HBx 1.0 . 3.74 876 655 A 70 ALA HA A 69 GLU HGx 1.0 . 4.93 877 655 A 69 GLU HGy A 70 ALA HA 1.0 . 4.93 878 656 A 79 VAL HGy% A 69 GLU HGx 1.0 . 5.32 879 656 A 79 VAL HGy% A 69 GLU HGy 1.0 . 5.32 880 657 A 71 GLY H A 74 GLY HAx 1.0 . 5.13 881 657 A 71 GLY H A 74 GLY HAy 1.0 . 5.13 882 658 A 74 GLY H A 71 GLY HAx 1.0 . 4.54 883 658 A 74 GLY H A 71 GLY HAy 1.0 . 4.54 884 659 A 75 ARG H A 71 GLY HAx 1.0 . 5.11 885 659 A 75 ARG H A 71 GLY HAy 1.0 . 5.11 886 660 A 73 ASP H A 73 ASP HBy 1.0 . 3.68 887 660 A 73 ASP H A 73 ASP HBx 1.0 . 3.68 888 661 A 75 ARG H A 73 ASP HBy 1.0 . 4.12 889 661 A 75 ARG H A 73 ASP HBx 1.0 . 4.12 890 662 A 74 GLY H A 75 ARG HGy 1.0 . 4.64 891 662 A 74 GLY H A 75 ARG HGx 1.0 . 4.64 892 663 A 75 ARG H A 75 ARG HGy 1.0 . 3.60 893 663 A 75 ARG H A 75 ARG HGx 1.0 . 3.60 894 664 A 75 ARG H A 75 ARG HDx 1.0 . 4.72 895 664 A 75 ARG H A 75 ARG HDy 1.0 . 4.72 896 665 A 75 ARG HA A 75 ARG HGy 1.0 . 3.46 897 665 A 75 ARG HA A 75 ARG HGx 1.0 . 3.46 898 666 A 76 SER H A 75 ARG HGy 1.0 . 4.29 899 666 A 76 SER H A 75 ARG HGx 1.0 . 4.29 900 667 A 76 SER HA A 75 ARG HGy 1.0 . 4.58 901 667 A 76 SER HA A 75 ARG HGx 1.0 . 4.58 902 668 A 75 ARG HGx A 77 LYS HGx 1.0 . 4.53 903 668 A 75 ARG HGy A 77 LYS HGx 1.0 . 4.53 904 668 A 77 LYS HGy A 75 ARG HGy 1.0 . 4.53 905 668 A 75 ARG HGx A 77 LYS HGy 1.0 . 4.53 906 669 A 76 SER HA A 77 LYS HGx 1.0 . 5.34 907 669 A 76 SER HA A 77 LYS HGy 1.0 . 5.34 908 670 A 77 LYS H A 76 SER HBx 1.0 . 3.04 909 670 A 77 LYS H A 76 SER HBy 1.0 . 3.04 910 671 A 77 LYS H A 77 LYS HBx 1.0 . 3.65 911 671 A 77 LYS H A 77 LYS HBy 1.0 . 3.65 912 672 A 77 LYS H A 77 LYS HGx 1.0 . 3.57 913 672 A 77 LYS H A 77 LYS HGy 1.0 . 3.57 914 673 A 78 ALA H A 77 LYS HBx 1.0 . 3.53 915 673 A 78 ALA H A 77 LYS HBy 1.0 . 3.53 916 674 A 79 VAL HGx% A 77 LYS HBx 1.0 . 4.00 917 674 A 79 VAL HGx% A 77 LYS HBy 1.0 . 4.00 918 675 A 78 ALA H A 77 LYS HGx 1.0 . 4.38 919 675 A 78 ALA H A 77 LYS HGy 1.0 . 4.38 920 676 A 79 VAL HGy% A 80 ASN HD2y 1.0 . 3.99 921 676 A 79 VAL HGy% A 80 ASN HD2x 1.0 . 3.99 922 677 A 80 ASN H A 80 ASN HBx 1.0 . 3.68 923 677 A 80 ASN H A 80 ASN HBy 1.0 . 3.68 924 678 A 80 ASN HD2x A 80 ASN HBy 1.0 . 3.15 925 678 A 80 ASN HD2x A 80 ASN HBx 1.0 . 3.15 926 678 A 80 ASN HD2y A 80 ASN HBx 1.0 . 3.15 927 678 A 80 ASN HD2y A 80 ASN HBy 1.0 . 3.15 928 679 A 81 VAL HA A 80 ASN HBx 1.0 . 4.63 929 679 A 81 VAL HA A 80 ASN HBy 1.0 . 4.63 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 12 SER C A 13 GLY N A 13 GLY CA A 13 GLY C 1.0 56.0 124.0 PHI 2 2 A 13 GLY N A 13 GLY CA A 13 GLY C A 14 GLU N 1.0 -41.0 55.0 PSI 3 3 A 14 GLU C A 15 GLN N A 15 GLN CA A 15 GLN C 1.0 -132.0 -44.0 PHI 4 4 A 15 GLN N A 15 GLN CA A 15 GLN C A 16 LEU N 1.0 96.0 168.0 PSI 5 5 A 16 LEU C A 17 ARG N A 17 ARG CA A 17 ARG C 1.0 -125.0 -53.0 PHI 6 6 A 17 ARG N A 17 ARG CA A 17 ARG C A 18 GLN N 1.0 105.0 173.0 PSI 7 7 A 17 ARG C A 18 GLN N A 18 GLN CA A 18 GLN C 1.0 -153.0 -85.0 PHI 8 8 A 18 GLN N A 18 GLN CA A 18 GLN C A 19 GLN N 1.0 124.0 180.0 PSI 9 9 A 18 GLN C A 19 GLN N A 19 GLN CA A 19 GLN C 1.0 -171.0 -99.0 PHI 10 10 A 19 GLN N A 19 GLN CA A 19 GLN C A 20 GLY N 1.0 131.0 183.0 PSI 11 11 A 19 GLN C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 100.0 256.0 PHI 12 12 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 THR N 1.0 147.0 199.0 PSI 13 13 A 20 GLY C A 21 THR N A 21 THR CA A 21 THR C 1.0 -172.0 -56.0 PHI 14 14 A 21 THR N A 21 THR CA A 21 THR C A 22 VAL N 1.0 110.0 178.0 PSI 15 15 A 21 THR C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -87.0 -39.0 PHI 16 16 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 LYS N 1.0 -56.0 -4.0 PSI 17 17 A 22 VAL C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -104.0 -44.0 PHI 18 18 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 TRP N 1.0 -54.0 2.0 PSI 19 19 A 23 LYS C A 24 TRP N A 24 TRP CA A 24 TRP C 1.0 -142.0 -78.0 PHI 20 20 A 24 TRP N A 24 TRP CA A 24 TRP C A 25 PHE N 1.0 -19.0 33.0 PSI 21 21 A 24 TRP C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -167.0 -71.0 PHI 22 22 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 ASN N 1.0 96.0 144.0 PSI 23 23 A 25 PHE C A 26 ASN N A 26 ASN CA A 26 ASN C 1.0 -145.0 -69.0 PHI 24 24 A 26 ASN N A 26 ASN CA A 26 ASN C A 27 ALA N 1.0 60.0 156.0 PSI 25 25 A 26 ASN C A 27 ALA N A 27 ALA CA A 27 ALA C 1.0 -73.0 -49.0 PHI 26 26 A 27 ALA N A 27 ALA CA A 27 ALA C A 28 THR N 1.0 -57.0 3.0 PSI 27 27 A 27 ALA C A 28 THR N A 28 THR CA A 28 THR C 1.0 -93.0 -49.0 PHI 28 28 A 28 THR N A 28 THR CA A 28 THR C A 29 LYS N 1.0 -54.0 -14.0 PSI 29 29 A 28 THR C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -112.0 -68.0 PHI 30 30 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 GLY N 1.0 -35.0 25.0 PSI 31 31 A 29 LYS C A 30 GLY N A 30 GLY CA A 30 GLY C 1.0 46.0 86.0 PHI 32 32 A 30 GLY N A 30 GLY CA A 30 GLY C A 31 PHE N 1.0 13.0 65.0 PSI 33 33 A 30 GLY C A 31 PHE N A 31 PHE CA A 31 PHE C 1.0 -176.0 -84.0 PHI 34 34 A 31 PHE N A 31 PHE CA A 31 PHE C A 32 GLY N 1.0 103.0 199.0 PSI 35 35 A 31 PHE C A 32 GLY N A 32 GLY CA A 32 GLY C 1.0 -243.0 -87.0 PHI 36 36 A 32 GLY N A 32 GLY CA A 32 GLY C A 33 PHE N 1.0 131.0 215.0 PSI 37 37 A 32 GLY C A 33 PHE N A 33 PHE CA A 33 PHE C 1.0 -166.0 -102.0 PHI 38 38 A 33 PHE N A 33 PHE CA A 33 PHE C A 34 ILE N 1.0 132.0 168.0 PSI 39 39 A 33 PHE C A 34 ILE N A 34 ILE CA A 34 ILE C 1.0 -164.0 -112.0 PHI 40 40 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 THR N 1.0 113.0 153.0 PSI 41 41 A 34 ILE C A 35 THR N A 35 THR CA A 35 THR C 1.0 -134.0 -66.0 PHI 42 42 A 35 THR N A 35 THR CA A 35 THR C A 36 PRO N 1.0 75.0 151.0 PSI 43 43 A 36 PRO N A 36 PRO CA A 36 PRO C A 37 GLY N 1.0 112.0 164.0 PSI 44 44 A 36 PRO C A 37 GLY N A 37 GLY CA A 37 GLY C 1.0 37.0 121.0 PHI 45 45 A 37 GLY N A 37 GLY CA A 37 GLY C A 38 GLY N 1.0 -48.0 72.0 PSI 46 46 A 37 GLY C A 38 GLY N A 38 GLY CA A 38 GLY C 1.0 49.0 105.0 PHI 47 47 A 38 GLY N A 38 GLY CA A 38 GLY C A 39 GLY N 1.0 -35.0 37.0 PSI 48 48 A 40 GLY C A 41 GLU N A 41 GLU CA A 41 GLU C 1.0 -149.0 -33.0 PHI 49 49 A 41 GLU N A 41 GLU CA A 41 GLU C A 42 ASP N 1.0 78.0 202.0 PSI 50 50 A 41 GLU C A 42 ASP N A 42 ASP CA A 42 ASP C 1.0 -109.0 -41.0 PHI 51 51 A 42 ASP N A 42 ASP CA A 42 ASP C A 43 LEU N 1.0 109.0 153.0 PSI 52 52 A 42 ASP C A 43 LEU N A 43 LEU CA A 43 LEU C 1.0 -151.0 -71.0 PHI 53 53 A 43 LEU N A 43 LEU CA A 43 LEU C A 44 PHE N 1.0 114.0 170.0 PSI 54 54 A 43 LEU C A 44 PHE N A 44 PHE CA A 44 PHE C 1.0 -143.0 -87.0 PHI 55 55 A 44 PHE N A 44 PHE CA A 44 PHE C A 45 VAL N 1.0 105.0 149.0 PSI 56 56 A 44 PHE C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -151.0 -99.0 PHI 57 57 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 HIS N 1.0 120.0 148.0 PSI 58 58 A 45 VAL C A 46 HIS N A 46 HIS CA A 46 HIS C 1.0 -159.0 -79.0 PHI 59 59 A 46 HIS N A 46 HIS CA A 46 HIS C A 47 GLN N 1.0 112.0 152.0 PSI 60 60 A 46 HIS C A 47 GLN N A 47 GLN CA A 47 GLN C 1.0 -147.0 -43.0 PHI 61 61 A 47 GLN N A 47 GLN CA A 47 GLN C A 48 THR N 1.0 101.0 221.0 PSI 62 62 A 47 GLN C A 48 THR N A 48 THR CA A 48 THR C 1.0 -111.0 -31.0 PHI 63 63 A 48 THR N A 48 THR CA A 48 THR C A 49 ASN N 1.0 -50.0 -2.0 PSI 64 64 A 48 THR C A 49 ASN N A 49 ASN CA A 49 ASN C 1.0 -132.0 -68.0 PHI 65 65 A 49 ASN N A 49 ASN CA A 49 ASN C A 50 ILE N 1.0 -32.0 28.0 PSI 66 66 A 49 ASN C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -147.0 -39.0 PHI 67 67 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 ASN N 1.0 78.0 162.0 PSI 68 68 A 50 ILE C A 51 ASN N A 51 ASN CA A 51 ASN C 1.0 -153.0 -65.0 PHI 69 69 A 51 ASN N A 51 ASN CA A 51 ASN C A 52 SER N 1.0 87.0 183.0 PSI 70 70 A 51 ASN C A 52 SER N A 52 SER CA A 52 SER C 1.0 -158.0 -38.0 PHI 71 71 A 52 SER N A 52 SER CA A 52 SER C A 53 GLU N 1.0 96.0 176.0 PSI 72 72 A 52 SER C A 53 GLU N A 53 GLU CA A 53 GLU C 1.0 -124.0 -72.0 PHI 73 73 A 53 GLU N A 53 GLU CA A 53 GLU C A 54 GLY N 1.0 -39.0 25.0 PSI 74 74 A 54 GLY C A 55 PHE N A 55 PHE CA A 55 PHE C 1.0 -134.0 -58.0 PHI 75 75 A 55 PHE N A 55 PHE CA A 55 PHE C A 56 ARG N 1.0 50.0 186.0 PSI 76 76 A 55 PHE C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -153.0 -77.0 PHI 77 77 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 SER N 1.0 104.0 148.0 PSI 78 78 A 56 ARG C A 57 SER N A 57 SER CA A 57 SER C 1.0 -144.0 -60.0 PHI 79 79 A 57 SER N A 57 SER CA A 57 SER C A 58 LEU N 1.0 83.0 167.0 PSI 80 80 A 57 SER C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -131.0 -59.0 PHI 81 81 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 ARG N 1.0 116.0 160.0 PSI 82 82 A 58 LEU C A 59 ARG N A 59 ARG CA A 59 ARG C 1.0 -162.0 -82.0 PHI 83 83 A 59 ARG N A 59 ARG CA A 59 ARG C A 60 GLU N 1.0 126.0 174.0 PSI 84 84 A 59 ARG C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -71.0 -43.0 PHI 85 85 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 GLY N 1.0 113.0 157.0 PSI 86 86 A 60 GLU C A 61 GLY N A 61 GLY CA A 61 GLY C 1.0 74.0 114.0 PHI 87 87 A 61 GLY N A 61 GLY CA A 61 GLY C A 62 GLU N 1.0 -41.0 19.0 PSI 88 88 A 61 GLY C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -82.0 -58.0 PHI 89 89 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 VAL N 1.0 120.0 164.0 PSI 90 90 A 62 GLU C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -132.0 -56.0 PHI 91 91 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 VAL N 1.0 118.0 154.0 PSI 92 92 A 63 VAL C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -167.0 -111.0 PHI 93 93 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 GLU N 1.0 149.0 181.0 PSI 94 94 A 64 VAL C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -154.0 -114.0 PHI 95 95 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 PHE N 1.0 124.0 176.0 PSI 96 96 A 65 GLU C A 66 PHE N A 66 PHE CA A 66 PHE C 1.0 -175.0 -127.0 PHI 97 97 A 66 PHE N A 66 PHE CA A 66 PHE C A 67 GLU N 1.0 135.0 179.0 PSI 98 98 A 66 PHE C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -180.0 -88.0 PHI 99 99 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 VAL N 1.0 135.0 167.0 PSI 100 100 A 67 GLU C A 68 VAL N A 68 VAL CA A 68 VAL C 1.0 -165.0 -73.0 PHI 101 101 A 68 VAL N A 68 VAL CA A 68 VAL C A 69 GLU N 1.0 111.0 151.0 PSI 102 102 A 68 VAL C A 69 GLU N A 69 GLU CA A 69 GLU C 1.0 -163.0 -103.0 PHI 103 103 A 69 GLU N A 69 GLU CA A 69 GLU C A 70 ALA N 1.0 119.0 159.0 PSI 104 104 A 69 GLU C A 70 ALA N A 70 ALA CA A 70 ALA C 1.0 -124.0 -76.0 PHI 105 105 A 70 ALA N A 70 ALA CA A 70 ALA C A 71 GLY N 1.0 97.0 177.0 PSI 106 106 A 70 ALA C A 71 GLY N A 71 GLY CA A 71 GLY C 1.0 -132.0 -40.0 PHI 107 107 A 71 GLY N A 71 GLY CA A 71 GLY C A 72 PRO N 1.0 92.0 184.0 PSI 108 108 A 72 PRO N A 72 PRO CA A 72 PRO C A 73 ASP N 1.0 -49.0 -9.0 PSI 109 109 A 72 PRO C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 -98.0 -70.0 PHI 110 110 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 GLY N 1.0 -25.0 23.0 PSI 111 111 A 73 ASP C A 74 GLY N A 74 GLY CA A 74 GLY C 1.0 71.0 119.0 PHI 112 112 A 74 GLY N A 74 GLY CA A 74 GLY C A 75 ARG N 1.0 -21.0 15.0 PSI 113 113 A 74 GLY C A 75 ARG N A 75 ARG CA A 75 ARG C 1.0 -117.0 -53.0 PHI 114 114 A 75 ARG N A 75 ARG CA A 75 ARG C A 76 SER N 1.0 114.0 170.0 PSI 115 115 A 75 ARG C A 76 SER N A 76 SER CA A 76 SER C 1.0 -142.0 -62.0 PHI 116 116 A 76 SER N A 76 SER CA A 76 SER C A 77 LYS N 1.0 83.0 183.0 PSI 117 117 A 76 SER C A 77 LYS N A 77 LYS CA A 77 LYS C 1.0 -161.0 -101.0 PHI 118 118 A 77 LYS N A 77 LYS CA A 77 LYS C A 78 ALA N 1.0 133.0 169.0 PSI 119 119 A 77 LYS C A 78 ALA N A 78 ALA CA A 78 ALA C 1.0 -173.0 -53.0 PHI 120 120 A 78 ALA N A 78 ALA CA A 78 ALA C A 79 VAL N 1.0 107.0 175.0 PSI 121 121 A 78 ALA C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -170.0 -98.0 PHI 122 122 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 ASN N 1.0 133.0 177.0 PSI 123 123 A 80 ASN C A 81 VAL N A 81 VAL CA A 81 VAL C 1.0 -118.0 -42.0 PHI 124 124 A 81 VAL N A 81 VAL CA A 81 VAL C A 82 THR N 1.0 108.0 148.0 PSI stop_ save_