data_nef_c16361_2kkc 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 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 GLY start . false 2 A 0 PRO middle . false 3 A 1 HIS middle . . 4 A 2 MET middle . . 5 A 3 SER middle . . 6 A 4 LEU middle . . 7 A 5 THR middle . . 8 A 6 VAL middle . . 9 A 7 LYS middle . . 10 A 8 ALA middle . . 11 A 9 TYR middle . . 12 A 10 LEU middle . . 13 A 11 LEU middle . . 14 A 12 GLY middle . false 15 A 13 LYS middle . . 16 A 14 GLU middle . . 17 A 15 GLU middle . . 18 A 16 ALA middle . . 19 A 17 ALA middle . . 20 A 18 ARG middle . . 21 A 19 GLU middle . . 22 A 20 ILE middle . . 23 A 21 ARG middle . . 24 A 22 ARG middle . . 25 A 23 PHE middle . . 26 A 24 SER middle . . 27 A 25 PHE middle . . 28 A 26 CYS middle . . 29 A 27 PHE middle . . 30 A 28 SER middle . . 31 A 29 PRO middle . false 32 A 30 GLU middle . . 33 A 31 PRO middle . false 34 A 32 GLU middle . . 35 A 33 ALA middle . . 36 A 34 GLU middle . . 37 A 35 ALA middle . . 38 A 36 ALA middle . . 39 A 37 ALA middle . . 40 A 38 GLY middle . false 41 A 39 PRO middle . false 42 A 40 GLY middle . false 43 A 41 PRO middle . false 44 A 42 CYS middle . . 45 A 43 GLU middle . . 46 A 44 ARG middle . . 47 A 45 LEU middle . . 48 A 46 LEU middle . . 49 A 47 SER middle . . 50 A 48 ARG middle . . 51 A 49 VAL middle . . 52 A 50 ALA middle . . 53 A 51 VAL middle . . 54 A 52 LEU middle . . 55 A 53 PHE middle . . 56 A 54 PRO middle . false 57 A 55 ALA middle . . 58 A 56 LEU middle . . 59 A 57 ARG middle . . 60 A 58 PRO middle . false 61 A 59 GLY middle . false 62 A 60 GLY middle . false 63 A 61 PHE middle . . 64 A 62 GLN middle . . 65 A 63 ALA middle . . 66 A 64 HIS middle . . 67 A 65 TYR middle . . 68 A 66 ARG middle . . 69 A 67 ALA middle . . 70 A 68 GLU middle . . 71 A 69 ARG middle . . 72 A 70 GLY middle . false 73 A 71 ASP middle . . 74 A 72 LEU middle . . 75 A 73 VAL middle . . 76 A 74 ALA middle . . 77 A 75 PHE middle . . 78 A 76 SER middle . . 79 A 77 SER middle . . 80 A 78 ASP middle . . 81 A 79 GLU middle . . 82 A 80 GLU middle . . 83 A 81 LEU middle . . 84 A 82 THR middle . . 85 A 83 MET middle . . 86 A 84 ALA middle . . 87 A 85 MET middle . . 88 A 86 SER middle . . 89 A 87 TYR middle . . 90 A 88 VAL middle . . 91 A 89 LYS middle . . 92 A 90 ASP middle . . 93 A 91 ASP middle . . 94 A 92 ILE middle . . 95 A 93 PHE middle . . 96 A 94 ARG middle . . 97 A 95 ILE middle . . 98 A 96 TYR middle . . 99 A 97 ILE middle . . 100 A 98 LYS middle . . 101 A 99 GLU middle . . 102 A 100 LYS 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 HIS HA H 1 4.636 0.002 A 1 HIS HB2 H 1 3.054 0.013 A 1 HIS HB3 H 1 2.996 0.001 A 1 HIS HD2 H 1 6.945 0.003 A 1 HIS HE1 H 1 7.843 0.005 A 1 HIS CA C 13 56.072 0.064 A 1 HIS CB C 13 30.832 0.042 A 1 HIS CD2 C 13 120.027 0.000 A 1 HIS CE1 C 13 138.310 0.000 A 2 MET H H 1 8.433 0.000 A 2 MET HA H 1 4.524 0.003 A 2 MET HB2 H 1 1.998 0.013 A 2 MET HB3 H 1 1.899 0.007 A 2 MET HE% H 1 2.034 0.000 A 2 MET HG2 H 1 2.467 0.009 A 2 MET HG3 H 1 2.418 0.006 A 2 MET CA C 13 55.497 0.103 A 2 MET CB C 13 33.638 0.001 A 2 MET CE C 13 17.196 0.000 A 2 MET CG C 13 32.027 0.001 A 2 MET N N 15 121.346 0.000 A 3 SER H H 1 8.348 0.000 A 3 SER HA H 1 5.076 0.021 A 3 SER HB2 H 1 3.785 0.006 A 3 SER HB3 H 1 3.723 0.005 A 3 SER CA C 13 57.619 0.012 A 3 SER CB C 13 64.310 0.003 A 3 SER N N 15 117.682 0.000 A 4 LEU H H 1 8.844 0.000 A 4 LEU HA H 1 4.859 0.000 A 4 LEU HBx H 1 1.747 0.000 A 4 LEU HBy H 1 1.747 0.000 A 4 LEU HD1% H 1 0.851 0.000 A 4 LEU HD2% H 1 0.876 0.000 A 4 LEU HG H 1 1.738 0.000 A 4 LEU CA C 13 54.012 0.000 A 4 LEU CB C 13 45.262 0.000 A 4 LEU CD1 C 13 25.731 0.000 A 4 LEU CD2 C 13 25.136 0.000 A 4 LEU CG C 13 27.133 0.000 A 4 LEU N N 15 123.957 0.000 A 5 THR H H 1 8.368 0.000 A 5 THR HA H 1 4.449 0.009 A 5 THR HB H 1 4.140 0.004 A 5 THR HG2% H 1 1.041 0.013 A 5 THR CA C 13 63.468 0.069 A 5 THR CB C 13 69.441 0.000 A 5 THR CG2 C 13 21.388 0.060 A 5 THR N N 15 119.222 0.000 A 6 VAL H H 1 9.216 0.000 A 6 VAL HA H 1 4.874 0.000 A 6 VAL HB H 1 0.323 0.000 A 6 VAL HG1% H 1 0.697 0.000 A 6 VAL HG2% H 1 0.507 0.000 A 6 VAL CA C 13 60.113 0.000 A 6 VAL CB C 13 31.668 0.000 A 6 VAL CG1 C 13 22.512 0.000 A 6 VAL CG2 C 13 22.243 0.000 A 6 VAL N N 15 128.934 0.000 A 7 LYS H H 1 8.405 0.000 A 7 LYS HA H 1 4.670 0.014 A 7 LYS HB2 H 1 1.560 0.013 A 7 LYS HB3 H 1 1.298 0.008 A 7 LYS HDx H 1 1.660 0.009 A 7 LYS HDy H 1 1.660 0.009 A 7 LYS HEx H 1 2.701 0.000 A 7 LYS HEy H 1 2.701 0.000 A 7 LYS HG2 H 1 0.972 0.019 A 7 LYS HG3 H 1 0.845 0.003 A 7 LYS CA C 13 55.116 0.094 A 7 LYS CB C 13 35.688 0.040 A 7 LYS CD C 13 30.473 0.000 A 7 LYS CE C 13 42.267 0.000 A 7 LYS CG C 13 26.251 0.006 A 7 LYS N N 15 127.218 0.000 A 8 ALA H H 1 9.119 0.000 A 8 ALA HA H 1 5.172 0.005 A 8 ALA HB% H 1 1.340 0.009 A 8 ALA CA C 13 49.628 0.033 A 8 ALA CB C 13 21.375 0.000 A 8 ALA N N 15 127.063 0.000 A 9 TYR H H 1 8.986 0.000 A 9 TYR HA H 1 4.890 0.011 A 9 TYR HB2 H 1 3.008 0.019 A 9 TYR HB3 H 1 2.587 0.022 A 9 TYR HDx H 1 6.782 0.003 A 9 TYR HDy H 1 6.782 0.003 A 9 TYR HEx H 1 6.530 0.007 A 9 TYR HEy H 1 6.530 0.007 A 9 TYR CA C 13 56.052 0.021 A 9 TYR CB C 13 40.179 0.056 A 9 TYR CDx C 13 134.414 0.000 A 9 TYR CDy C 13 134.414 0.000 A 9 TYR CEx C 13 117.494 0.000 A 9 TYR CEy C 13 117.494 0.000 A 9 TYR N N 15 121.895 0.000 A 10 LEU HA H 1 4.483 0.017 A 10 LEU HB2 H 1 1.807 0.000 A 10 LEU HB3 H 1 0.518 0.002 A 10 LEU HD1% H 1 0.642 0.000 A 10 LEU HD2% H 1 0.527 0.000 A 10 LEU HG H 1 1.253 0.012 A 10 LEU CA C 13 54.435 0.028 A 10 LEU CB C 13 42.468 0.000 A 10 LEU CD1 C 13 25.767 0.000 A 10 LEU CD2 C 13 23.375 0.000 A 10 LEU CG C 13 27.482 0.066 A 11 LEU H H 1 8.939 0.000 A 11 LEU HA H 1 4.721 0.009 A 11 LEU HB2 H 1 1.914 0.012 A 11 LEU HB3 H 1 1.450 0.011 A 11 LEU HD1% H 1 0.753 0.000 A 11 LEU HD2% H 1 0.805 0.000 A 11 LEU HG H 1 1.770 0.000 A 11 LEU CA C 13 54.846 0.086 A 11 LEU CB C 13 42.770 0.031 A 11 LEU CD1 C 13 25.730 0.000 A 11 LEU CD2 C 13 22.561 0.000 A 11 LEU CG C 13 27.156 0.000 A 11 LEU N N 15 128.206 0.000 A 12 GLY H H 1 8.580 0.000 A 12 GLY HA2 H 1 4.458 0.000 A 12 GLY HA3 H 1 3.832 0.000 A 12 GLY CA C 13 44.355 0.011 A 12 GLY N N 15 109.838 0.000 A 13 LYS HA H 1 4.211 0.000 A 13 LYS HB2 H 1 1.876 0.018 A 13 LYS HB3 H 1 1.834 0.014 A 13 LYS HDx H 1 1.723 0.000 A 13 LYS HDy H 1 1.723 0.000 A 13 LYS HEx H 1 3.021 0.000 A 13 LYS HEy H 1 3.021 0.000 A 13 LYS HG2 H 1 1.534 0.012 A 13 LYS HG3 H 1 1.474 0.007 A 13 LYS CA C 13 57.704 0.000 A 13 LYS CB C 13 32.710 0.030 A 13 LYS CD C 13 29.138 0.000 A 13 LYS CE C 13 42.113 0.000 A 13 LYS CG C 13 25.087 0.000 A 14 GLU H H 1 8.702 0.000 A 14 GLU HA H 1 4.255 0.000 A 14 GLU HB2 H 1 2.210 0.000 A 14 GLU HB3 H 1 2.068 0.000 A 14 GLU HGx H 1 2.255 0.000 A 14 GLU HGy H 1 2.255 0.000 A 14 GLU CA C 13 56.472 0.000 A 14 GLU CB C 13 28.542 0.009 A 14 GLU CG C 13 36.584 0.000 A 14 GLU N N 15 119.065 0.000 A 15 GLU H H 1 8.320 0.000 A 15 GLU HA H 1 3.813 0.008 A 15 GLU HBx H 1 2.094 0.000 A 15 GLU HBy H 1 2.094 0.000 A 15 GLU HG2 H 1 2.224 0.007 A 15 GLU HG3 H 1 2.034 0.003 A 15 GLU CA C 13 58.051 0.097 A 15 GLU CB C 13 28.029 0.000 A 15 GLU CG C 13 36.875 0.003 A 15 GLU N N 15 115.210 0.000 A 16 ALA H H 1 7.699 0.000 A 16 ALA HA H 1 4.414 0.018 A 16 ALA HB% H 1 1.396 0.009 A 16 ALA CA C 13 51.703 0.021 A 16 ALA CB C 13 19.591 0.000 A 16 ALA N N 15 121.268 0.000 A 17 ALA H H 1 8.694 0.000 A 17 ALA HA H 1 4.488 0.017 A 17 ALA HB% H 1 1.501 0.009 A 17 ALA CA C 13 52.598 0.054 A 17 ALA CB C 13 18.924 0.000 A 17 ALA N N 15 123.960 0.000 A 18 ARG H H 1 9.130 0.000 A 18 ARG HA H 1 4.470 0.013 A 18 ARG HB2 H 1 1.939 0.001 A 18 ARG HB3 H 1 1.747 0.004 A 18 ARG HD2 H 1 3.248 0.006 A 18 ARG HD3 H 1 3.110 0.007 A 18 ARG HG2 H 1 1.731 0.000 A 18 ARG HG3 H 1 1.670 0.004 A 18 ARG CA C 13 56.954 0.141 A 18 ARG CB C 13 31.926 0.000 A 18 ARG CD C 13 44.031 0.000 A 18 ARG CG C 13 26.849 0.000 A 18 ARG N N 15 122.743 0.000 A 19 GLU H H 1 7.664 0.000 A 19 GLU HA H 1 4.640 0.000 A 19 GLU HB2 H 1 2.181 0.001 A 19 GLU HB3 H 1 2.121 0.002 A 19 GLU HG2 H 1 2.349 0.000 A 19 GLU HG3 H 1 2.314 0.000 A 19 GLU CA C 13 56.163 0.000 A 19 GLU CB C 13 34.329 0.000 A 19 GLU N N 15 117.631 0.000 A 20 ILE H H 1 8.974 0.000 A 20 ILE HA H 1 5.226 0.005 A 20 ILE HB H 1 1.543 0.011 A 20 ILE HD1% H 1 0.798 0.010 A 20 ILE HG12 H 1 1.427 0.028 A 20 ILE HG13 H 1 0.735 0.017 A 20 ILE HG2% H 1 0.348 0.000 A 20 ILE CA C 13 60.217 0.122 A 20 ILE CB C 13 41.485 0.000 A 20 ILE CD1 C 13 14.421 0.000 A 20 ILE CG1 C 13 27.611 0.018 A 20 ILE CG2 C 13 17.292 0.000 A 20 ILE N N 15 124.885 0.000 A 21 ARG HA H 1 4.777 0.000 A 21 ARG HB2 H 1 1.581 0.000 A 21 ARG HB3 H 1 1.665 0.000 A 21 ARG HG2 H 1 1.309 0.014 A 21 ARG HG3 H 1 1.246 0.004 A 21 ARG CA C 13 55.512 0.000 A 21 ARG CB C 13 30.544 0.008 A 21 ARG CG C 13 26.058 0.007 A 22 ARG H H 1 8.615 0.000 A 22 ARG HA H 1 5.730 0.018 A 22 ARG HB2 H 1 1.718 0.029 A 22 ARG HB3 H 1 1.654 0.009 A 22 ARG HDx H 1 3.138 0.000 A 22 ARG HDy H 1 3.138 0.000 A 22 ARG HG2 H 1 1.508 0.035 A 22 ARG HG3 H 1 1.440 0.012 A 22 ARG CA C 13 54.171 0.042 A 22 ARG CB C 13 33.703 0.017 A 22 ARG CD C 13 43.768 0.000 A 22 ARG CG C 13 27.758 0.005 A 22 ARG N N 15 121.542 0.000 A 23 PHE H H 1 8.973 0.000 A 23 PHE HA H 1 5.032 0.003 A 23 PHE HB2 H 1 3.218 0.005 A 23 PHE HB3 H 1 3.181 0.009 A 23 PHE HDx H 1 6.979 0.002 A 23 PHE HDy H 1 6.979 0.002 A 23 PHE HEx H 1 6.831 0.009 A 23 PHE HEy H 1 6.831 0.009 A 23 PHE CA C 13 56.274 0.016 A 23 PHE CB C 13 39.805 0.041 A 23 PHE CDx C 13 133.804 0.000 A 23 PHE CDy C 13 133.804 0.000 A 23 PHE CEx C 13 129.438 0.000 A 23 PHE CEy C 13 129.438 0.000 A 23 PHE N N 15 119.096 0.000 A 24 SER H H 1 8.906 0.000 A 24 SER HA H 1 5.165 0.002 A 24 SER HB2 H 1 3.897 0.009 A 24 SER HB3 H 1 3.874 0.012 A 24 SER CA C 13 57.920 0.000 A 24 SER CB C 13 64.320 0.000 A 24 SER N N 15 116.320 0.000 A 25 PHE H H 1 9.072 0.000 A 25 PHE HA H 1 4.924 0.007 A 25 PHE HB2 H 1 2.980 0.012 A 25 PHE HB3 H 1 2.671 0.001 A 25 PHE HDx H 1 6.893 0.006 A 25 PHE HDy H 1 6.893 0.006 A 25 PHE HEx H 1 6.931 0.000 A 25 PHE HEy H 1 6.931 0.000 A 25 PHE CA C 13 57.781 0.043 A 25 PHE CB C 13 44.680 0.039 A 25 PHE CDx C 13 131.598 0.000 A 25 PHE CDy C 13 131.598 0.000 A 25 PHE N N 15 125.720 0.000 A 26 CYS H H 1 7.954 0.000 A 26 CYS HA H 1 4.934 0.009 A 26 CYS HB2 H 1 2.702 0.005 A 26 CYS HB3 H 1 2.595 0.006 A 26 CYS CA C 13 57.071 0.016 A 26 CYS CB C 13 28.095 0.001 A 26 CYS N N 15 126.406 0.000 A 27 PHE H H 1 8.783 0.000 A 27 PHE HA H 1 4.242 0.003 A 27 PHE HB2 H 1 3.068 0.009 A 27 PHE HB3 H 1 2.919 0.003 A 27 PHE HDx H 1 7.174 0.004 A 27 PHE HDy H 1 7.174 0.004 A 27 PHE HEx H 1 7.181 0.002 A 27 PHE HEy H 1 7.181 0.002 A 27 PHE CA C 13 59.090 0.000 A 27 PHE CB C 13 40.370 0.036 A 27 PHE CDx C 13 132.021 0.000 A 27 PHE CDy C 13 132.021 0.000 A 27 PHE CEx C 13 131.141 0.000 A 27 PHE CEy C 13 131.141 0.000 A 27 PHE N N 15 125.974 0.000 A 28 SER H H 1 7.981 0.000 A 28 SER HA H 1 4.729 0.011 A 28 SER HB2 H 1 3.756 0.006 A 28 SER HB3 H 1 3.625 0.006 A 28 SER CA C 13 55.257 0.061 A 28 SER CB C 13 63.663 0.004 A 28 SER N N 15 116.284 0.000 A 29 PRO HA H 1 4.361 0.000 A 29 PRO HB2 H 1 2.180 0.000 A 29 PRO HB3 H 1 1.944 0.000 A 29 PRO HD2 H 1 3.649 0.000 A 29 PRO HD3 H 1 3.413 0.000 A 29 PRO HG2 H 1 1.926 0.000 A 29 PRO HG3 H 1 1.861 0.000 A 29 PRO CA C 13 63.086 0.000 A 29 PRO CB C 13 32.166 0.000 A 29 PRO CD C 13 50.543 0.007 A 29 PRO CG C 13 27.043 0.000 A 30 GLU H H 1 8.287 0.000 A 30 GLU HA H 1 4.525 0.007 A 30 GLU HB2 H 1 2.035 0.006 A 30 GLU HB3 H 1 1.834 0.007 A 30 GLU HGx H 1 2.245 0.006 A 30 GLU HGy H 1 2.245 0.006 A 30 GLU CA C 13 54.372 0.043 A 30 GLU CB C 13 29.615 0.003 A 30 GLU CG C 13 36.098 0.000 A 30 GLU N N 15 121.266 0.000 A 31 PRO HA H 1 4.361 0.017 A 31 PRO HB2 H 1 2.293 0.008 A 31 PRO HB3 H 1 1.935 0.009 A 31 PRO HD2 H 1 3.770 0.007 A 31 PRO HD3 H 1 3.705 0.005 A 31 PRO HG2 H 1 2.059 0.009 A 31 PRO HG3 H 1 2.005 0.006 A 31 PRO CA C 13 63.732 0.135 A 31 PRO CB C 13 32.086 0.004 A 31 PRO CD C 13 50.632 0.001 A 31 PRO CG C 13 27.487 0.000 A 32 GLU H H 1 8.576 0.000 A 32 GLU HA H 1 4.244 0.000 A 32 GLU HB2 H 1 2.105 0.008 A 32 GLU HB3 H 1 1.971 0.000 A 32 GLU HG2 H 1 2.302 0.008 A 32 GLU HG3 H 1 2.260 0.005 A 32 GLU CA C 13 56.923 0.000 A 32 GLU CB C 13 29.961 0.003 A 32 GLU CG C 13 36.442 0.003 A 32 GLU N N 15 120.055 0.000 A 33 ALA H H 1 8.232 0.000 A 33 ALA HA H 1 4.267 0.000 A 33 ALA HB% H 1 1.422 0.009 A 33 ALA CA C 13 53.224 0.000 A 33 ALA CB C 13 19.308 0.000 A 33 ALA N N 15 123.908 0.000 A 34 GLU H H 1 8.308 0.000 A 34 GLU HA H 1 4.219 0.007 A 34 GLU HB2 H 1 2.107 0.009 A 34 GLU HB3 H 1 1.986 0.010 A 34 GLU HG2 H 1 2.302 0.004 A 34 GLU HG3 H 1 2.260 0.005 A 34 GLU CA C 13 57.077 0.044 A 34 GLU CB C 13 29.819 0.008 A 34 GLU CG C 13 36.442 0.003 A 34 GLU N N 15 118.453 0.000 A 35 ALA H H 1 8.085 0.000 A 35 ALA HA H 1 4.300 0.000 A 35 ALA HB% H 1 1.413 0.000 A 35 ALA CA C 13 52.766 0.000 A 35 ALA CB C 13 19.253 0.000 A 35 ALA N N 15 123.420 0.000 A 36 ALA H H 1 8.107 0.000 A 36 ALA HA H 1 4.312 0.000 A 36 ALA HB% H 1 1.423 0.000 A 36 ALA CA C 13 52.504 0.000 A 36 ALA CB C 13 19.229 0.000 A 36 ALA N N 15 122.445 0.000 A 37 ALA H H 1 8.171 0.000 A 37 ALA HA H 1 4.382 0.000 A 37 ALA HB% H 1 1.437 0.014 A 37 ALA CA C 13 52.489 0.000 A 37 ALA CB C 13 19.276 0.000 A 37 ALA N N 15 122.707 0.000 A 38 GLY H H 1 8.090 0.000 A 38 GLY HA2 H 1 4.184 0.000 A 38 GLY HA3 H 1 4.114 0.000 A 38 GLY CA C 13 44.683 0.004 A 38 GLY N N 15 108.449 0.000 A 39 PRO HA H 1 4.511 0.000 A 39 PRO HB2 H 1 2.286 0.011 A 39 PRO HB3 H 1 1.932 0.008 A 39 PRO HDx H 1 3.644 0.000 A 39 PRO HDy H 1 3.644 0.000 A 39 PRO HG2 H 1 2.064 0.008 A 39 PRO HG3 H 1 2.005 0.010 A 39 PRO CA C 13 62.996 0.092 A 39 PRO CB C 13 32.558 0.000 A 39 PRO CD C 13 49.807 0.000 A 39 PRO CG C 13 27.351 0.005 A 40 GLY H H 1 8.907 0.000 A 40 GLY HA2 H 1 4.404 0.000 A 40 GLY HA3 H 1 4.367 0.000 A 40 GLY CA C 13 44.831 0.006 A 40 GLY N N 15 110.881 0.000 A 41 PRO HA H 1 4.271 0.011 A 41 PRO HB2 H 1 2.314 0.002 A 41 PRO HB3 H 1 1.956 0.000 A 41 PRO HD2 H 1 3.927 0.005 A 41 PRO HD3 H 1 3.643 0.013 A 41 PRO HG2 H 1 2.102 0.010 A 41 PRO HG3 H 1 2.069 0.012 A 41 PRO CA C 13 65.817 0.090 A 41 PRO CB C 13 31.963 0.006 A 41 PRO CD C 13 49.332 0.002 A 41 PRO CG C 13 27.777 0.004 A 42 CYS H H 1 9.233 0.000 A 42 CYS HA H 1 4.125 0.003 A 42 CYS HB2 H 1 3.165 0.002 A 42 CYS HB3 H 1 2.576 0.008 A 42 CYS CA C 13 63.917 0.111 A 42 CYS CB C 13 25.745 0.001 A 42 CYS N N 15 118.785 0.000 A 43 GLU H H 1 8.950 0.000 A 43 GLU HA H 1 4.037 0.000 A 43 GLU HB2 H 1 2.184 0.003 A 43 GLU HB3 H 1 2.036 0.003 A 43 GLU HG2 H 1 2.437 0.010 A 43 GLU HG3 H 1 2.401 0.023 A 43 GLU CA C 13 59.833 0.000 A 43 GLU CB C 13 29.420 0.000 A 43 GLU CG C 13 36.308 0.003 A 43 GLU N N 15 120.987 0.000 A 44 ARG H H 1 8.574 0.000 A 44 ARG HA H 1 4.163 0.000 A 44 ARG HB2 H 1 2.197 0.000 A 44 ARG HB3 H 1 2.131 0.014 A 44 ARG HDx H 1 3.313 0.000 A 44 ARG HDy H 1 3.313 0.000 A 44 ARG HGx H 1 1.683 0.011 A 44 ARG HGy H 1 1.683 0.011 A 44 ARG CA C 13 60.390 0.000 A 44 ARG CB C 13 30.680 0.043 A 44 ARG CD C 13 43.932 0.000 A 44 ARG CG C 13 29.300 0.000 A 44 ARG N N 15 118.522 0.000 A 45 LEU H H 1 8.775 0.000 A 45 LEU HA H 1 3.741 0.005 A 45 LEU HB2 H 1 2.088 0.008 A 45 LEU HB3 H 1 1.259 0.010 A 45 LEU HD1% H 1 0.997 0.000 A 45 LEU HD2% H 1 0.457 0.000 A 45 LEU HG H 1 1.393 0.008 A 45 LEU CA C 13 58.789 0.014 A 45 LEU CB C 13 41.253 0.004 A 45 LEU CD1 C 13 26.739 0.000 A 45 LEU CD2 C 13 23.435 0.000 A 45 LEU CG C 13 27.306 0.000 A 45 LEU N N 15 123.412 0.000 A 46 LEU H H 1 8.841 0.000 A 46 LEU HA H 1 4.116 0.000 A 46 LEU HB2 H 1 2.049 0.002 A 46 LEU HB3 H 1 1.536 0.000 A 46 LEU HD1% H 1 0.824 0.000 A 46 LEU HD2% H 1 0.782 0.000 A 46 LEU HG H 1 2.172 0.013 A 46 LEU CA C 13 58.205 0.000 A 46 LEU CB C 13 40.194 0.080 A 46 LEU CD1 C 13 25.803 0.000 A 46 LEU CD2 C 13 21.922 0.000 A 46 LEU CG C 13 26.938 0.000 A 46 LEU N N 15 117.754 0.000 A 47 SER H H 1 8.465 0.000 A 47 SER HA H 1 4.354 0.021 A 47 SER HB2 H 1 4.127 0.005 A 47 SER HB3 H 1 4.040 0.005 A 47 SER CA C 13 62.004 0.018 A 47 SER CB C 13 62.684 0.000 A 47 SER N N 15 116.879 0.000 A 48 ARG H H 1 7.731 0.000 A 48 ARG HA H 1 4.019 0.015 A 48 ARG HB2 H 1 1.976 0.005 A 48 ARG HB3 H 1 1.742 0.034 A 48 ARG HDx H 1 3.183 0.000 A 48 ARG HDy H 1 3.183 0.000 A 48 ARG HG2 H 1 1.593 0.006 A 48 ARG HG3 H 1 1.192 0.017 A 48 ARG CA C 13 57.495 0.063 A 48 ARG CB C 13 28.638 0.009 A 48 ARG CD C 13 42.143 0.000 A 48 ARG CG C 13 26.024 0.002 A 48 ARG N N 15 122.464 0.000 A 49 VAL H H 1 8.030 0.000 A 49 VAL HA H 1 3.234 0.000 A 49 VAL HB H 1 2.310 0.000 A 49 VAL HG1% H 1 1.063 0.000 A 49 VAL HG2% H 1 0.539 0.000 A 49 VAL CA C 13 67.046 0.000 A 49 VAL CB C 13 31.285 0.000 A 49 VAL CG1 C 13 23.965 0.000 A 49 VAL CG2 C 13 22.556 0.000 A 49 VAL N N 15 118.178 0.000 A 50 ALA H H 1 7.528 0.000 A 50 ALA HA H 1 3.869 0.000 A 50 ALA HB% H 1 1.590 0.000 A 50 ALA CA C 13 54.858 0.000 A 50 ALA CB C 13 17.952 0.000 A 50 ALA N N 15 118.493 0.000 A 51 VAL H H 1 7.202 0.000 A 51 VAL HA H 1 3.784 0.000 A 51 VAL HB H 1 2.106 0.000 A 51 VAL HG1% H 1 1.068 0.000 A 51 VAL HG2% H 1 0.918 0.000 A 51 VAL CA C 13 64.607 0.000 A 51 VAL CB C 13 32.097 0.000 A 51 VAL CG1 C 13 22.333 0.000 A 51 VAL CG2 C 13 21.266 0.000 A 51 VAL N N 15 114.134 0.000 A 52 LEU H H 1 7.557 0.000 A 52 LEU HA H 1 3.887 0.014 A 52 LEU HB2 H 1 1.340 0.018 A 52 LEU HB3 H 1 0.805 0.014 A 52 LEU HD1% H 1 0.604 0.006 A 52 LEU HD2% H 1 0.239 0.010 A 52 LEU HG H 1 1.303 0.000 A 52 LEU CA C 13 56.099 0.090 A 52 LEU CB C 13 42.930 0.003 A 52 LEU CD1 C 13 23.132 0.014 A 52 LEU CD2 C 13 26.074 0.000 A 52 LEU CG C 13 26.369 0.000 A 52 LEU N N 15 119.807 0.000 A 53 PHE H H 1 7.346 0.000 A 53 PHE HA H 1 4.958 0.000 A 53 PHE HBx H 1 2.807 0.000 A 53 PHE HBy H 1 2.807 0.000 A 53 PHE HDx H 1 7.328 0.000 A 53 PHE HDy H 1 7.328 0.000 A 53 PHE HEx H 1 6.864 0.005 A 53 PHE HEy H 1 6.864 0.005 A 53 PHE HZ H 1 6.979 0.000 A 53 PHE CA C 13 54.563 0.000 A 53 PHE CB C 13 38.923 0.017 A 53 PHE CDx C 13 133.085 0.000 A 53 PHE CDy C 13 133.085 0.000 A 53 PHE CEx C 13 130.035 0.000 A 53 PHE CEy C 13 130.035 0.000 A 53 PHE CZ C 13 128.612 0.000 A 53 PHE N N 15 115.924 0.000 A 54 PRO HA H 1 4.481 0.021 A 54 PRO HB2 H 1 2.368 0.005 A 54 PRO HB3 H 1 1.982 0.003 A 54 PRO HDx H 1 3.758 0.000 A 54 PRO HDy H 1 3.758 0.000 A 54 PRO HGx H 1 1.984 0.000 A 54 PRO HGy H 1 1.984 0.000 A 54 PRO CA C 13 64.418 0.000 A 54 PRO CB C 13 32.027 0.021 A 54 PRO CD C 13 50.914 0.000 A 54 PRO CG C 13 27.152 0.000 A 55 ALA H H 1 8.281 0.000 A 55 ALA HA H 1 4.272 0.000 A 55 ALA HB% H 1 1.348 0.000 A 55 ALA CA C 13 53.140 0.000 A 55 ALA N N 15 118.268 0.000 A 56 LEU H H 1 7.940 0.000 A 56 LEU HA H 1 4.399 0.009 A 56 LEU HB2 H 1 1.782 0.003 A 56 LEU HB3 H 1 1.175 0.016 A 56 LEU HD1% H 1 -0.019 0.000 A 56 LEU HD2% H 1 0.549 0.000 A 56 LEU HG H 1 1.529 0.010 A 56 LEU CA C 13 54.394 0.028 A 56 LEU CB C 13 42.239 0.018 A 56 LEU CD1 C 13 25.913 0.000 A 56 LEU CD2 C 13 22.154 0.000 A 56 LEU CG C 13 26.437 0.000 A 56 LEU N N 15 117.493 0.000 A 57 ARG H H 1 8.677 0.000 A 57 ARG HA H 1 4.876 0.000 A 57 ARG HB2 H 1 1.869 0.005 A 57 ARG HB3 H 1 1.773 0.003 A 57 ARG HD2 H 1 3.304 0.002 A 57 ARG HD3 H 1 3.269 0.001 A 57 ARG HG2 H 1 1.765 0.000 A 57 ARG HG3 H 1 1.722 0.000 A 57 ARG CA C 13 53.049 0.000 A 57 ARG CB C 13 30.888 0.002 A 57 ARG CD C 13 43.257 0.002 A 57 ARG CG C 13 26.988 0.005 A 57 ARG N N 15 121.192 0.000 A 58 PRO HA H 1 4.396 0.000 A 58 PRO HB2 H 1 2.351 0.012 A 58 PRO HB3 H 1 1.933 0.002 A 58 PRO HD2 H 1 3.996 0.008 A 58 PRO HD3 H 1 3.675 0.003 A 58 PRO HG2 H 1 2.213 0.008 A 58 PRO HG3 H 1 2.022 0.013 A 58 PRO CA C 13 64.142 0.000 A 58 PRO CB C 13 31.508 0.043 A 58 PRO CD C 13 50.811 0.042 A 58 PRO CG C 13 28.047 0.004 A 59 GLY H H 1 8.731 0.000 A 59 GLY HA2 H 1 4.099 0.000 A 59 GLY HA3 H 1 3.701 0.000 A 59 GLY CA C 13 45.764 0.001 A 59 GLY N N 15 113.419 0.000 A 60 GLY H H 1 8.608 0.000 A 60 GLY HA2 H 1 4.510 0.000 A 60 GLY HA3 H 1 3.701 0.000 A 60 GLY CA C 13 45.765 0.000 A 60 GLY N N 15 107.562 0.000 A 61 PHE H H 1 7.178 0.000 A 61 PHE HA H 1 5.360 0.003 A 61 PHE HB2 H 1 3.012 0.000 A 61 PHE HB3 H 1 2.764 0.000 A 61 PHE HDx H 1 6.901 0.001 A 61 PHE HDy H 1 6.901 0.001 A 61 PHE HEx H 1 7.089 0.006 A 61 PHE HEy H 1 7.089 0.006 A 61 PHE HZ H 1 7.489 0.000 A 61 PHE CA C 13 55.610 0.039 A 61 PHE CB C 13 41.012 0.027 A 61 PHE CDx C 13 133.021 0.000 A 61 PHE CDy C 13 133.021 0.000 A 61 PHE CEx C 13 130.857 0.000 A 61 PHE CEy C 13 130.857 0.000 A 61 PHE CZ C 13 129.887 0.000 A 61 PHE N N 15 114.628 0.000 A 62 GLN H H 1 9.270 0.000 A 62 GLN HA H 1 4.434 0.014 A 62 GLN HB2 H 1 1.905 0.011 A 62 GLN HB3 H 1 1.805 0.006 A 62 GLN HE21 H 1 7.574 0.000 A 62 GLN HE22 H 1 6.738 0.000 A 62 GLN HG2 H 1 1.985 0.007 A 62 GLN HG3 H 1 1.625 0.006 A 62 GLN CA C 13 54.006 0.098 A 62 GLN CB C 13 33.370 0.001 A 62 GLN CG C 13 34.368 0.001 A 62 GLN N N 15 120.154 0.000 A 62 GLN NE2 N 15 116.063 0.000 A 63 ALA H H 1 9.521 0.000 A 63 ALA HA H 1 4.888 0.000 A 63 ALA HB% H 1 0.877 0.000 A 63 ALA CA C 13 51.272 0.000 A 63 ALA CB C 13 21.478 0.000 A 63 ALA N N 15 130.708 0.000 A 64 HIS H H 1 8.307 0.000 A 64 HIS HA H 1 5.902 0.009 A 64 HIS HB2 H 1 3.073 0.000 A 64 HIS HB3 H 1 2.948 0.000 A 64 HIS HD2 H 1 6.540 0.000 A 64 HIS CA C 13 55.127 0.061 A 64 HIS CB C 13 34.037 0.000 A 64 HIS N N 15 115.808 0.000 A 65 TYR H H 1 9.527 0.000 A 65 TYR HA H 1 5.628 0.005 A 65 TYR HB2 H 1 3.641 0.002 A 65 TYR HB3 H 1 2.950 0.010 A 65 TYR HDx H 1 7.046 0.002 A 65 TYR HDy H 1 7.046 0.002 A 65 TYR HEx H 1 6.655 0.006 A 65 TYR HEy H 1 6.655 0.006 A 65 TYR CA C 13 55.308 0.047 A 65 TYR CB C 13 41.277 0.058 A 65 TYR CDx C 13 134.321 0.000 A 65 TYR CDy C 13 134.321 0.000 A 65 TYR CEx C 13 117.660 0.000 A 65 TYR CEy C 13 117.660 0.000 A 65 TYR N N 15 120.377 0.000 A 66 ARG H H 1 9.421 0.000 A 66 ARG HA H 1 4.684 0.004 A 66 ARG HB2 H 1 1.675 0.013 A 66 ARG HB3 H 1 1.487 0.016 A 66 ARG HD2 H 1 3.002 0.001 A 66 ARG HD3 H 1 2.852 0.008 A 66 ARG HG2 H 1 1.354 0.003 A 66 ARG HG3 H 1 1.166 0.010 A 66 ARG CA C 13 55.526 0.085 A 66 ARG CB C 13 31.592 0.063 A 66 ARG CD C 13 43.380 0.004 A 66 ARG CG C 13 27.691 0.011 A 66 ARG N N 15 121.220 0.000 A 67 ALA H H 1 8.520 0.000 A 67 ALA HA H 1 4.151 0.000 A 67 ALA HB% H 1 1.314 0.000 A 67 ALA CA C 13 50.603 0.000 A 67 ALA CB C 13 19.526 0.000 A 67 ALA N N 15 129.646 0.000 A 68 GLU HA H 1 4.344 0.000 A 68 GLU HBx H 1 2.264 0.000 A 68 GLU HBy H 1 2.264 0.000 A 68 GLU HG2 H 1 2.431 0.000 A 68 GLU HG3 H 1 2.395 0.000 A 68 GLU CA C 13 63.946 0.000 A 68 GLU CB C 13 31.469 0.000 A 68 GLU CG C 13 36.381 0.007 A 69 ARG H H 1 8.587 0.000 A 69 ARG HA H 1 4.218 0.000 A 69 ARG HB2 H 1 1.998 0.000 A 69 ARG HB3 H 1 1.935 0.003 A 69 ARG HD2 H 1 3.250 0.002 A 69 ARG HD3 H 1 3.220 0.007 A 69 ARG HGx H 1 1.638 0.000 A 69 ARG HGy H 1 1.638 0.000 A 69 ARG CA C 13 56.785 0.000 A 69 ARG CB C 13 29.257 0.000 A 69 ARG CD C 13 43.331 0.006 A 69 ARG CG C 13 27.765 0.000 A 69 ARG N N 15 119.649 0.000 A 70 GLY H H 1 8.035 0.000 A 70 GLY HA2 H 1 4.248 0.000 A 70 GLY HA3 H 1 3.452 0.000 A 70 GLY CA C 13 45.218 0.000 A 70 GLY N N 15 106.764 0.000 A 71 ASP H H 1 8.089 0.000 A 71 ASP HA H 1 4.322 0.000 A 71 ASP HB2 H 1 2.466 0.014 A 71 ASP HB3 H 1 2.348 0.008 A 71 ASP CA C 13 53.716 0.000 A 71 ASP CB C 13 40.782 0.002 A 71 ASP N N 15 119.563 0.000 A 72 LEU H H 1 8.283 0.000 A 72 LEU HA H 1 4.494 0.032 A 72 LEU HB2 H 1 1.510 0.003 A 72 LEU HB3 H 1 0.777 0.011 A 72 LEU HD1% H 1 0.257 0.000 A 72 LEU HD2% H 1 0.046 0.000 A 72 LEU HG H 1 1.329 0.005 A 72 LEU CA C 13 54.411 0.016 A 72 LEU CB C 13 42.153 0.001 A 72 LEU CD1 C 13 25.187 0.000 A 72 LEU CD2 C 13 23.441 0.000 A 72 LEU CG C 13 26.421 0.000 A 72 LEU N N 15 120.244 0.000 A 73 VAL H H 1 9.109 0.000 A 73 VAL HA H 1 4.081 0.014 A 73 VAL HB H 1 0.797 0.000 A 73 VAL HG1% H 1 0.953 0.012 A 73 VAL HG2% H 1 0.575 0.010 A 73 VAL CA C 13 61.524 0.112 A 73 VAL CB C 13 33.322 0.000 A 73 VAL CG1 C 13 21.605 0.000 A 73 VAL CG2 C 13 21.314 0.000 A 73 VAL N N 15 126.563 0.000 A 74 ALA H H 1 8.671 0.000 A 74 ALA HA H 1 4.453 0.000 A 74 ALA HB% H 1 1.124 0.000 A 74 ALA CA C 13 52.311 0.000 A 74 ALA CB C 13 18.823 0.000 A 74 ALA N N 15 130.232 0.000 A 75 PHE H H 1 7.911 0.000 A 75 PHE HA H 1 5.214 0.015 A 75 PHE HB2 H 1 3.170 0.015 A 75 PHE HB3 H 1 3.104 0.014 A 75 PHE HDx H 1 7.313 0.002 A 75 PHE HDy H 1 7.313 0.002 A 75 PHE HEx H 1 7.211 0.001 A 75 PHE HEy H 1 7.211 0.001 A 75 PHE HZ H 1 6.999 0.000 A 75 PHE CA C 13 56.473 0.061 A 75 PHE CB C 13 43.268 0.026 A 75 PHE CDx C 13 132.651 0.000 A 75 PHE CDy C 13 132.651 0.000 A 75 PHE CEx C 13 130.462 0.000 A 75 PHE CEy C 13 130.462 0.000 A 75 PHE CZ C 13 128.664 0.000 A 75 PHE N N 15 114.034 0.000 A 76 SER HA H 1 4.407 0.013 A 76 SER HBx H 1 3.863 0.003 A 76 SER HBy H 1 3.863 0.003 A 76 SER CA C 13 58.122 0.038 A 76 SER CB C 13 64.342 0.000 A 77 SER H H 1 7.953 0.000 A 77 SER HA H 1 5.147 0.015 A 77 SER HB2 H 1 4.433 0.005 A 77 SER HB3 H 1 4.023 0.003 A 77 SER CA C 13 56.219 0.090 A 77 SER CB C 13 68.069 0.000 A 77 SER N N 15 116.284 0.000 A 78 ASP H H 1 9.351 0.000 A 78 ASP HA H 1 4.515 0.000 A 78 ASP HB2 H 1 2.886 0.008 A 78 ASP HB3 H 1 2.733 0.015 A 78 ASP CA C 13 58.953 0.051 A 78 ASP CB C 13 40.543 0.004 A 78 ASP N N 15 123.186 0.000 A 79 GLU H H 1 9.232 0.000 A 79 GLU HA H 1 4.163 0.018 A 79 GLU HB2 H 1 2.204 0.000 A 79 GLU HB3 H 1 2.051 0.000 A 79 GLU HG2 H 1 2.448 0.011 A 79 GLU HG3 H 1 2.395 0.005 A 79 GLU CA C 13 60.390 0.069 A 79 GLU CB C 13 29.350 0.001 A 79 GLU CG C 13 36.721 0.000 A 79 GLU N N 15 121.421 0.000 A 80 GLU H H 1 7.791 0.000 A 80 GLU HA H 1 4.302 0.008 A 80 GLU HB2 H 1 2.470 0.006 A 80 GLU HB3 H 1 2.424 0.004 A 80 GLU HG2 H 1 2.565 0.003 A 80 GLU HG3 H 1 2.497 0.042 A 80 GLU CA C 13 58.751 0.013 A 80 GLU CB C 13 32.559 0.003 A 80 GLU CG C 13 37.710 0.000 A 80 GLU N N 15 119.154 0.000 A 81 LEU H H 1 8.477 0.000 A 81 LEU HA H 1 3.650 0.011 A 81 LEU HB2 H 1 2.201 0.016 A 81 LEU HB3 H 1 1.500 0.001 A 81 LEU HD1% H 1 0.869 0.000 A 81 LEU HD2% H 1 0.540 0.000 A 81 LEU HG H 1 1.412 0.003 A 81 LEU CA C 13 57.595 0.033 A 81 LEU CB C 13 41.414 0.012 A 81 LEU CD1 C 13 25.995 0.000 A 81 LEU CD2 C 13 23.783 0.000 A 81 LEU CG C 13 27.026 0.000 A 81 LEU N N 15 121.499 0.000 A 82 THR H H 1 8.377 0.000 A 82 THR HA H 1 3.675 0.000 A 82 THR HB H 1 4.293 0.000 A 82 THR HG2% H 1 1.220 0.000 A 82 THR CA C 13 67.319 0.000 A 82 THR CB C 13 68.498 0.000 A 82 THR CG2 C 13 21.726 0.000 A 82 THR N N 15 115.349 0.000 A 83 MET H H 1 7.385 0.000 A 83 MET HA H 1 4.164 0.026 A 83 MET HB2 H 1 2.717 0.000 A 83 MET HB3 H 1 2.267 0.021 A 83 MET HE% H 1 2.182 0.000 A 83 MET HGx H 1 2.724 0.000 A 83 MET HGy H 1 2.724 0.000 A 83 MET CA C 13 58.409 0.134 A 83 MET CB C 13 31.793 0.000 A 83 MET CE C 13 17.089 0.000 A 83 MET CG C 13 32.120 0.000 A 83 MET N N 15 121.062 0.000 A 84 ALA H H 1 7.902 0.000 A 84 ALA HA H 1 3.139 0.000 A 84 ALA HB% H 1 0.773 0.000 A 84 ALA CA C 13 55.066 0.000 A 84 ALA CB C 13 18.348 0.000 A 84 ALA N N 15 123.467 0.000 A 85 MET H H 1 7.721 0.000 A 85 MET HA H 1 3.729 0.004 A 85 MET HB2 H 1 2.030 0.000 A 85 MET HB3 H 1 1.633 0.009 A 85 MET HE% H 1 1.096 0.000 A 85 MET HGx H 1 2.035 0.000 A 85 MET HGy H 1 2.035 0.000 A 85 MET CA C 13 56.883 0.016 A 85 MET CB C 13 32.296 0.000 A 85 MET CE C 13 16.693 0.000 A 85 MET CG C 13 32.167 0.000 A 85 MET N N 15 114.257 0.000 A 86 SER H H 1 7.575 0.000 A 86 SER HA H 1 4.172 0.000 A 86 SER HB2 H 1 3.751 0.014 A 86 SER HB3 H 1 3.716 0.013 A 86 SER CA C 13 60.970 0.000 A 86 SER CB C 13 62.848 0.003 A 86 SER N N 15 115.893 0.000 A 87 TYR H H 1 7.329 0.000 A 87 TYR HA H 1 4.564 0.011 A 87 TYR HB2 H 1 3.601 0.000 A 87 TYR HB3 H 1 2.977 0.007 A 87 TYR HDx H 1 7.250 0.002 A 87 TYR HDy H 1 7.250 0.002 A 87 TYR HEx H 1 6.847 0.004 A 87 TYR HEy H 1 6.847 0.004 A 87 TYR CA C 13 58.353 0.085 A 87 TYR CB C 13 38.575 0.017 A 87 TYR CDx C 13 133.628 0.000 A 87 TYR CDy C 13 133.628 0.000 A 87 TYR CEx C 13 118.233 0.000 A 87 TYR CEy C 13 118.233 0.000 A 87 TYR N N 15 118.512 0.000 A 88 VAL H H 1 7.273 0.000 A 88 VAL HA H 1 4.086 0.000 A 88 VAL HB H 1 2.128 0.000 A 88 VAL HG1% H 1 1.095 0.000 A 88 VAL HG2% H 1 0.970 0.000 A 88 VAL CA C 13 64.128 0.000 A 88 VAL CB C 13 32.114 0.000 A 88 VAL CG1 C 13 23.293 0.000 A 88 VAL CG2 C 13 21.078 0.000 A 88 VAL N N 15 121.968 0.000 A 89 LYS HA H 1 4.699 0.036 A 89 LYS HB2 H 1 1.957 0.007 A 89 LYS HB3 H 1 1.812 0.015 A 89 LYS HDx H 1 1.763 0.040 A 89 LYS HDy H 1 1.763 0.040 A 89 LYS HEx H 1 3.082 0.005 A 89 LYS HEy H 1 3.082 0.005 A 89 LYS HG2 H 1 1.564 0.029 A 89 LYS HG3 H 1 1.492 0.018 A 89 LYS CA C 13 55.589 0.016 A 89 LYS CB C 13 34.596 0.033 A 89 LYS CD C 13 28.904 0.239 A 89 LYS CE C 13 42.345 0.000 A 89 LYS CG C 13 24.620 0.001 A 90 ASP H H 1 8.535 0.000 A 90 ASP HA H 1 4.578 0.002 A 90 ASP HB2 H 1 2.955 0.008 A 90 ASP HB3 H 1 2.787 0.007 A 90 ASP CA C 13 54.197 0.117 A 90 ASP CB C 13 40.226 0.004 A 90 ASP N N 15 121.828 0.000 A 91 ASP H H 1 8.354 0.000 A 91 ASP HA H 1 4.231 0.000 A 91 ASP HB2 H 1 3.016 0.002 A 91 ASP HB3 H 1 2.979 0.027 A 91 ASP CA C 13 55.745 0.000 A 91 ASP CB C 13 39.988 0.003 A 91 ASP N N 15 112.334 0.000 A 92 ILE H H 1 7.701 0.000 A 92 ILE HA H 1 4.902 0.001 A 92 ILE HB H 1 1.937 0.000 A 92 ILE HD1% H 1 0.877 0.008 A 92 ILE HG12 H 1 1.655 0.010 A 92 ILE HG13 H 1 0.944 0.006 A 92 ILE HG2% H 1 0.783 0.000 A 92 ILE CA C 13 60.042 0.017 A 92 ILE CB C 13 40.254 0.000 A 92 ILE CD1 C 13 13.540 0.000 A 92 ILE CG1 C 13 27.361 0.067 A 92 ILE CG2 C 13 17.894 0.000 A 92 ILE N N 15 118.676 0.000 A 93 PHE H H 1 9.203 0.000 A 93 PHE HA H 1 5.326 0.017 A 93 PHE HB2 H 1 3.070 0.000 A 93 PHE HB3 H 1 2.883 0.000 A 93 PHE HDx H 1 7.049 0.001 A 93 PHE HDy H 1 7.049 0.001 A 93 PHE HEx H 1 6.810 0.004 A 93 PHE HEy H 1 6.810 0.004 A 93 PHE HZ H 1 6.264 0.000 A 93 PHE CA C 13 53.501 0.011 A 93 PHE CB C 13 40.693 0.000 A 93 PHE CDx C 13 130.149 0.000 A 93 PHE CDy C 13 130.149 0.000 A 93 PHE CEx C 13 131.033 0.000 A 93 PHE CEy C 13 131.033 0.000 A 93 PHE CZ C 13 128.755 0.000 A 93 PHE N N 15 128.722 0.000 A 94 ARG H H 1 8.564 0.000 A 94 ARG HA H 1 5.243 0.009 A 94 ARG HB2 H 1 1.973 0.006 A 94 ARG HB3 H 1 1.650 0.017 A 94 ARG HD2 H 1 3.452 0.007 A 94 ARG HD3 H 1 3.395 0.015 A 94 ARG CA C 13 55.297 0.077 A 94 ARG CB C 13 30.842 0.013 A 94 ARG CD C 13 43.167 0.003 A 94 ARG N N 15 128.659 0.000 A 95 ILE H H 1 8.524 0.000 A 95 ILE HA H 1 5.357 0.006 A 95 ILE HB H 1 1.742 0.000 A 95 ILE HD1% H 1 0.801 0.013 A 95 ILE HG1x H 1 1.353 0.000 A 95 ILE HG1y H 1 1.353 0.000 A 95 ILE HG2% H 1 0.373 0.009 A 95 ILE CA C 13 58.439 0.031 A 95 ILE CB C 13 42.421 0.000 A 95 ILE CD1 C 13 15.119 0.000 A 95 ILE CG1 C 13 25.836 0.000 A 95 ILE CG2 C 13 18.018 0.000 A 95 ILE N N 15 114.673 0.000 A 96 TYR H H 1 9.184 0.000 A 96 TYR HA H 1 5.289 0.003 A 96 TYR HB2 H 1 2.703 0.000 A 96 TYR HB3 H 1 2.551 0.000 A 96 TYR HDx H 1 6.755 0.003 A 96 TYR HDy H 1 6.755 0.003 A 96 TYR HEx H 1 6.195 0.003 A 96 TYR HEy H 1 6.195 0.003 A 96 TYR CA C 13 56.997 0.036 A 96 TYR CB C 13 40.868 0.023 A 96 TYR CDx C 13 132.929 0.000 A 96 TYR CDy C 13 132.929 0.000 A 96 TYR CEx C 13 117.973 0.000 A 96 TYR CEy C 13 117.973 0.000 A 96 TYR N N 15 121.300 0.000 A 97 ILE H H 1 9.917 0.000 A 97 ILE HA H 1 4.951 0.000 A 97 ILE HB H 1 1.736 0.000 A 97 ILE HD1% H 1 0.524 0.000 A 97 ILE HG1x H 1 1.118 0.000 A 97 ILE HG1y H 1 1.118 0.000 A 97 ILE HG2% H 1 0.547 0.000 A 97 ILE CA C 13 59.649 0.000 A 97 ILE CB C 13 39.017 0.000 A 97 ILE CD1 C 13 13.062 0.000 A 97 ILE CG1 C 13 27.395 0.000 A 97 ILE CG2 C 13 19.687 0.000 A 97 ILE N N 15 128.092 0.000 A 98 LYS H H 1 8.661 0.000 A 98 LYS HA H 1 4.951 0.004 A 98 LYS HB2 H 1 2.028 0.005 A 98 LYS HB3 H 1 1.658 0.000 A 98 LYS HD2 H 1 1.588 0.006 A 98 LYS HD3 H 1 1.516 0.004 A 98 LYS HE2 H 1 2.784 0.008 A 98 LYS HE3 H 1 2.484 0.004 A 98 LYS HG2 H 1 1.479 0.012 A 98 LYS HG3 H 1 1.232 0.010 A 98 LYS CA C 13 54.575 0.088 A 98 LYS CB C 13 36.510 0.006 A 98 LYS CD C 13 29.454 0.009 A 98 LYS CE C 13 41.701 0.000 A 98 LYS CG C 13 25.776 0.002 A 98 LYS N N 15 123.710 0.000 A 99 GLU H H 1 9.164 0.000 A 99 GLU HA H 1 4.375 0.009 A 99 GLU HB2 H 1 2.204 0.003 A 99 GLU HB3 H 1 1.975 0.004 A 99 GLU HGx H 1 2.279 0.000 A 99 GLU HGy H 1 2.279 0.000 A 99 GLU CA C 13 57.766 0.077 A 99 GLU CB C 13 31.097 0.001 A 99 GLU CG C 13 38.021 0.000 A 99 GLU N N 15 124.588 0.000 A 100 LYS H H 1 7.834 0.000 A 100 LYS HA H 1 4.151 0.017 A 100 LYS HB2 H 1 1.788 0.008 A 100 LYS HB3 H 1 1.514 0.008 A 100 LYS HDx H 1 1.587 0.007 A 100 LYS HDy H 1 1.587 0.007 A 100 LYS HEx H 1 2.825 0.000 A 100 LYS HEy H 1 2.825 0.000 A 100 LYS HG2 H 1 1.265 0.010 A 100 LYS HG3 H 1 1.185 0.009 A 100 LYS CA C 13 58.111 0.038 A 100 LYS CB C 13 34.034 0.034 A 100 LYS CD C 13 29.503 0.000 A 100 LYS CE C 13 41.949 0.000 A 100 LYS CG C 13 25.316 0.001 A 100 LYS N N 15 128.282 0.000 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 62 GLN H A 63 ALA H 1.0 . 4.50 2 2 A 63 ALA H A 62 GLN HE22 1.0 . 3.84 3 3 A 63 ALA H A 75 PHE HE% 1.0 . 5.25 4 4 A 63 ALA H A 62 GLN HA 1.0 . 2.75 5 5 A 63 ALA H A 62 GLN HB3 1.0 . 3.69 6 6 A 63 ALA H A 62 GLN HB2 1.0 . 4.64 7 7 A 63 ALA H A 74 ALA HB% 1.0 . 4.68 8 8 A 63 ALA H A 63 ALA HB% 1.0 . 3.07 9 9 A 63 ALA H A 97 ILE HD1% 1.0 . 4.54 10 10 A 73 VAL H A 74 ALA H 1.0 . 4.44 11 11 A 74 ALA H A 64 HIS HD2 1.0 . 4.25 12 12 A 74 ALA H A 64 HIS HA 1.0 . 4.47 13 13 A 74 ALA H A 73 VAL HA 1.0 . 2.67 14 14 A 74 ALA H A 64 HIS HB3 1.0 . 4.30 15 15 A 74 ALA H A 72 LEU HB3 1.0 . 5.11 16 16 A 74 ALA HB% A 74 ALA H 1.0 . 2.87 17 17 A 67 ALA H A 67 ALA HB% 1.0 . 3.11 18 18 A 7 LYS H A 93 PHE H 1.0 . 3.53 19 19 A 6 VAL H A 22 ARG HA 1.0 . 4.65 20 20 A 6 VAL H A 24 SER HA 1.0 . 4.47 21 21 A 6 VAL H A 5 THR HA 1.0 . 2.84 22 22 A 6 VAL H A 5 THR HB 1.0 . 3.96 23 23 A 6 VAL H A 5 THR HG2% 1.0 . 3.38 24 24 A 6 VAL H A 6 VAL HG1% 1.0 . 4.26 25 25 A 6 VAL H A 6 VAL HG2% 1.0 . 4.26 26 26 A 6 VAL H A 6 VAL HB 1.0 . 3.51 27 27 A 93 PHE H A 92 ILE H 1.0 . 4.42 28 28 A 93 PHE H A 93 PHE HD% 1.0 . 4.50 29 29 A 93 PHE HD% A 94 ARG H 1.0 . 3.59 30 30 A 94 ARG H A 93 PHE HE% 1.0 . 4.93 31 31 A 94 ARG H A 93 PHE HA 1.0 . 2.81 32 32 A 93 PHE H A 6 VAL HA 1.0 . 3.08 33 33 A 93 PHE H A 92 ILE HA 1.0 . 3.26 34 34 A 94 ARG H A 94 ARG HD3 1.0 . 4.87 35 35 A 93 PHE H A 93 PHE HB3 1.0 . 3.29 36 36 A 94 ARG H A 93 PHE HB3 1.0 . 4.59 37 37 A 93 PHE H A 93 PHE HB2 1.0 . 3.35 38 38 A 94 ARG H A 93 PHE HB2 1.0 . 4.59 39 39 A 94 ARG H A 94 ARG HB2 1.0 . 3.68 40 40 A 93 PHE H A 92 ILE HB 1.0 . 4.41 41 41 A 94 ARG H A 94 ARG HB3 1.0 . 3.68 42 42 A 94 ARG H A 92 ILE HG2% 1.0 . 4.05 43 43 A 62 GLN H A 100 LYS H 1.0 . 4.25 44 44 A 100 LYS H A 60 GLY H 1.0 . 5.50 45 45 A 100 LYS H A 61 PHE H 1.0 . 4.42 46 46 A 100 LYS H A 61 PHE HD% 1.0 . 5.33 47 47 A 100 LYS H A 61 PHE HA 1.0 . 2.83 48 48 A 100 LYS H A 99 GLU HA 1.0 . 2.53 49 49 A 100 LYS H A 60 GLY HA3 1.0 . 4.44 50 50 A 100 LYS H A 61 PHE HB3 1.0 . 3.96 51 51 A 100 LYS H A 61 PHE HB2 1.0 . 4.17 52 52 A 100 LYS H A 100 LYS HB2 1.0 . 3.22 53 53 A 10 LEU HG A 11 LEU H 1.0 . 4.43 54 54 A 11 LEU H A 98 LYS HG2 1.0 . 4.65 55 55 A 100 LYS H A 100 LYS HG3 1.0 . 3.29 56 56 A 11 LEU H A 97 ILE H 1.0 . 4.95 57 57 A 97 ILE H A 9 TYR H 1.0 . 3.86 58 58 A 97 ILE H A 98 LYS H 1.0 . 4.52 59 59 A 97 ILE H A 96 TYR HD% 1.0 . 4.81 60 60 A 97 ILE H A 96 TYR HA 1.0 . 3.13 61 61 A 11 LEU H A 98 LYS HA 1.0 . 4.07 62 62 A 97 ILE H A 10 LEU HA 1.0 . 3.83 63 63 A 11 LEU H A 10 LEU HA 1.0 . 3.09 64 64 A 97 ILE H A 9 TYR HB2 1.0 . 4.12 65 65 A 97 ILE H A 96 TYR HB3 1.0 . 4.12 66 66 A 97 ILE H A 9 TYR HB3 1.0 . 5.11 67 67 A 97 ILE H A 96 TYR HB2 1.0 . 5.41 68 68 A 97 ILE H A 97 ILE HB 1.0 . 3.32 69 69 A 11 LEU H A 11 LEU HG 1.0 . 3.16 70 70 A 11 LEU H A 98 LYS HG3 1.0 . 4.58 71 71 A 97 ILE HD1% A 97 ILE H 1.0 . 3.45 72 72 A 7 LYS H A 94 ARG HA 1.0 . 3.79 73 73 A 7 LYS H A 6 VAL HA 1.0 . 3.11 74 74 A 7 LYS H A 93 PHE HB3 1.0 . 4.29 75 75 A 7 LYS H A 93 PHE HB2 1.0 . 5.50 76 76 A 7 LYS H A 7 LYS HB2 1.0 . 3.76 77 77 A 7 LYS H A 7 LYS HB3 1.0 . 3.80 78 78 A 7 LYS H A 92 ILE HG2% 1.0 . 3.68 79 79 A 7 LYS H A 6 VAL HG2% 1.0 . 4.50 80 80 A 8 ALA H A 53 PHE HE% 1.0 . 4.75 81 81 A 8 ALA H A 7 LYS HA 1.0 . 3.36 82 82 A 73 VAL H A 67 ALA H 1.0 . 5.00 83 83 A 73 VAL H A 64 HIS HA 1.0 . 4.68 84 84 A 73 VAL H A 72 LEU HA 1.0 . 2.93 85 85 A 73 VAL H A 64 HIS HB3 1.0 . 3.81 86 86 A 73 VAL H A 72 LEU HB3 1.0 . 3.77 87 87 A 73 VAL H A 73 VAL HG2% 1.0 . 4.07 88 88 A 25 PHE HD% A 26 CYS H 1.0 . 4.77 89 89 A 73 VAL H A 65 TYR HE% 1.0 . 5.26 90 90 A 26 CYS H A 25 PHE HB3 1.0 . 3.93 91 91 A 27 PHE H A 28 SER H 1.0 . 2.66 92 92 A 27 PHE H A 27 PHE HD% 1.0 . 4.32 93 93 A 27 PHE H A 27 PHE HB2 1.0 . 3.65 94 94 A 27 PHE H A 27 PHE HB3 1.0 . 3.65 95 95 A 25 PHE HD% A 25 PHE H 1.0 . 4.45 96 96 A 5 THR HA A 25 PHE H 1.0 . 3.66 97 97 A 25 PHE HB3 A 25 PHE H 1.0 . 3.53 98 98 A 25 PHE H A 4 LEU HBx 1.0 . 4.49 99 98 A 25 PHE H A 4 LEU HBy 1.0 . 4.49 100 99 A 5 THR HG2% A 25 PHE H 1.0 . 4.89 101 100 A 20 ILE H A 53 PHE HZ 1.0 . 5.45 102 101 A 53 PHE HE% A 20 ILE H 1.0 . 4.59 103 102 A 20 ILE H A 20 ILE HD1% 1.0 . 4.41 104 103 A 98 LYS H A 99 GLU H 1.0 . 4.64 105 104 A 100 LYS H A 99 GLU H 1.0 . 4.69 106 105 A 61 PHE HB2 A 99 GLU H 1.0 . 4.65 107 106 A 99 GLU H A 98 LYS HB3 1.0 . 3.41 108 107 A 98 LYS HG2 A 99 GLU H 1.0 . 3.97 109 108 A 25 PHE H A 4 LEU H 1.0 . 3.32 110 109 A 32 GLU H A 33 ALA H 1.0 . 4.59 111 110 A 27 PHE HD% A 4 LEU H 1.0 . 5.50 112 111 A 25 PHE HD% A 4 LEU H 1.0 . 4.54 113 112 A 5 THR HA A 4 LEU H 1.0 . 4.99 114 113 A 25 PHE HB3 A 4 LEU H 1.0 . 4.36 115 114 A 33 ALA H A 32 GLU HG2 1.0 . 5.50 116 115 A 33 ALA H A 32 GLU HG3 1.0 . 5.50 117 116 A 4 LEU H A 4 LEU HBx 1.0 . 3.96 118 116 A 4 LEU HBy A 4 LEU H 1.0 . 3.96 119 117 A 17 ALA H A 17 ALA HB% 1.0 . 2.93 120 118 A 33 ALA H A 33 ALA HB% 1.0 . 3.57 121 119 A 42 CYS H A 45 LEU H 1.0 . 4.91 122 120 A 98 LYS H A 64 HIS H 1.0 . 4.60 123 121 A 82 THR H A 84 ALA H 1.0 . 4.33 124 122 A 84 ALA H A 85 MET H 1.0 . 3.20 125 123 A 84 ALA H A 83 MET H 1.0 . 4.03 126 124 A 84 ALA H A 87 TYR HD% 1.0 . 4.66 127 125 A 84 ALA H A 87 TYR HE% 1.0 . 4.61 128 126 A 65 TYR HE% A 84 ALA H 1.0 . 5.50 129 127 A 61 PHE HA A 98 LYS H 1.0 . 5.41 130 128 A 84 ALA H A 81 LEU HA 1.0 . 3.44 131 129 A 84 ALA H A 83 MET HB2 1.0 . 3.77 132 130 A 98 LYS H A 98 LYS HB2 1.0 . 3.53 133 131 A 45 LEU H A 44 ARG HGx 1.0 . 4.73 134 131 A 45 LEU H A 44 ARG HGy 1.0 . 4.73 135 132 A 98 LYS H A 98 LYS HB3 1.0 . 4.17 136 133 A 98 LYS HG2 A 98 LYS H 1.0 . 4.72 137 134 A 84 ALA H A 82 THR HG2% 1.0 . 4.25 138 135 A 98 LYS H A 97 ILE HG2% 1.0 . 2.94 139 136 A 45 LEU H A 44 ARG H 1.0 . 2.89 140 137 A 45 LEU H A 25 PHE HE% 1.0 . 4.20 141 138 A 78 ASP H A 77 SER HB2 1.0 . 4.52 142 139 A 45 LEU H A 42 CYS HA 1.0 . 3.92 143 140 A 78 ASP H A 77 SER HB3 1.0 . 4.52 144 141 A 45 LEU H A 45 LEU HB3 1.0 . 2.94 145 142 A 45 LEU H A 45 LEU HD2% 1.0 . 4.39 146 143 A 18 ARG H A 19 GLU H 1.0 . 3.78 147 144 A 36 ALA HA A 37 ALA H 1.0 . 3.26 148 145 A 48 ARG H A 51 VAL H 1.0 . 5.16 149 146 A 48 ARG H A 23 PHE HE% 1.0 . 5.35 150 147 A 48 ARG H A 47 SER HB3 1.0 . 3.29 151 148 A 48 ARG H A 45 LEU HA 1.0 . 3.56 152 149 A 48 ARG H A 48 ARG HDx 1.0 . 3.77 153 149 A 48 ARG H A 48 ARG HDy 1.0 . 3.77 154 150 A 35 ALA HB% A 36 ALA H 1.0 . 3.38 155 151 A 36 ALA H A 36 ALA HB% 1.0 . 3.58 156 152 A 86 SER H A 88 VAL H 1.0 . 4.53 157 153 A 9 TYR H A 9 TYR HD% 1.0 . 3.41 158 154 A 88 VAL H A 85 MET HA 1.0 . 3.48 159 155 A 9 TYR H A 9 TYR HB2 1.0 . 3.31 160 156 A 88 VAL H A 87 TYR HB2 1.0 . 3.66 161 157 A 9 TYR H A 9 TYR HB3 1.0 . 3.94 162 158 A 88 VAL H A 88 VAL HB 1.0 . 2.90 163 159 A 9 TYR H A 97 ILE HB 1.0 . 4.49 164 160 A 9 TYR H A 95 ILE HG1x 1.0 . 4.61 165 160 A 9 TYR H A 95 ILE HG1y 1.0 . 4.61 166 161 A 9 TYR H A 97 ILE HG1x 1.0 . 3.42 167 161 A 9 TYR H A 97 ILE HG1y 1.0 . 3.42 168 162 A 97 ILE HD1% A 9 TYR H 1.0 . 4.09 169 163 A 79 GLU H A 81 LEU H 1.0 . 4.24 170 164 A 81 LEU H A 77 SER H 1.0 . 4.66 171 165 A 83 MET H A 81 LEU H 1.0 . 4.01 172 166 A 81 LEU H A 78 ASP HA 1.0 . 3.60 173 167 A 81 LEU H A 81 LEU HB2 1.0 . 3.04 174 168 A 81 LEU H A 81 LEU HD1% 1.0 . 4.05 175 169 A 81 LEU H A 81 LEU HD2% 1.0 . 4.05 176 170 A 97 ILE H A 96 TYR H 1.0 . 4.36 177 171 A 96 TYR H A 65 TYR H 1.0 . 4.91 178 172 A 73 VAL H A 66 ARG H 1.0 . 5.29 179 173 A 9 TYR H A 96 TYR H 1.0 . 5.29 180 174 A 67 ALA H A 66 ARG H 1.0 . 4.78 181 175 A 64 HIS H A 96 TYR H 1.0 . 3.58 182 176 A 75 PHE HE% A 96 TYR H 1.0 . 4.67 183 177 A 66 ARG H A 65 TYR HD% 1.0 . 4.67 184 178 A 96 TYR HD% A 66 ARG H 1.0 . 3.87 185 179 A 96 TYR HD% A 96 TYR H 1.0 . 3.91 186 180 A 66 ARG H A 96 TYR HE% 1.0 . 4.01 187 181 A 96 TYR H A 65 TYR HA 1.0 . 3.57 188 182 A 66 ARG H A 95 ILE HA 1.0 . 4.61 189 183 A 14 GLU HA A 16 ALA H 1.0 . 5.00 190 184 A 29 PRO HD3 A 30 GLU H 1.0 . 4.02 191 185 A 66 ARG H A 65 TYR HB2 1.0 . 3.34 192 186 A 30 GLU H A 29 PRO HD2 1.0 . 3.12 193 187 A 79 GLU H A 78 ASP HB2 1.0 . 4.18 194 188 A 96 TYR HB2 A 96 TYR H 1.0 . 3.61 195 189 A 79 GLU H A 79 GLU HB3 1.0 . 3.02 196 190 A 79 GLU H A 79 GLU HB2 1.0 . 4.04 197 191 A 16 ALA H A 15 GLU HBx 1.0 . 3.98 198 191 A 16 ALA H A 15 GLU HBy 1.0 . 3.98 199 192 A 57 ARG H A 56 LEU HB2 1.0 . 3.89 200 193 A 57 ARG H A 57 ARG HB2 1.0 . 3.88 201 194 A 66 ARG H A 66 ARG HB2 1.0 . 3.71 202 195 A 66 ARG H A 66 ARG HB3 1.0 . 3.71 203 196 A 57 ARG H A 56 LEU HB3 1.0 . 3.89 204 197 A 96 TYR H A 97 ILE HG1x 1.0 . 5.10 205 197 A 97 ILE HG1y A 96 TYR H 1.0 . 5.10 206 198 A 66 ARG H A 84 ALA HB% 1.0 . 5.50 207 199 A 42 CYS H A 43 GLU H 1.0 . 3.04 208 200 A 44 ARG H A 43 GLU H 1.0 . 3.10 209 201 A 82 THR H A 83 MET H 1.0 . 3.10 210 202 A 43 GLU H A 40 GLY HA2 1.0 . 4.80 211 203 A 83 MET H A 80 GLU HA 1.0 . 4.27 212 204 A 83 MET H A 83 MET HA 1.0 . 2.92 213 205 A 83 MET H A 84 ALA HA 1.0 . 5.06 214 206 A 83 MET H A 83 MET HB2 1.0 . 3.51 215 207 A 43 GLU H A 46 LEU HB2 1.0 . 5.35 216 208 A 83 MET H A 81 LEU HB2 1.0 . 5.06 217 209 A 83 MET H A 84 ALA HB% 1.0 . 4.08 218 210 A 73 VAL H A 65 TYR H 1.0 . 2.81 219 211 A 65 TYR H A 75 PHE H 1.0 . 4.53 220 212 A 65 TYR H A 75 PHE HD% 1.0 . 4.02 221 213 A 65 TYR H A 65 TYR HD% 1.0 . 3.84 222 214 A 65 TYR HE% A 65 TYR H 1.0 . 4.56 223 215 A 72 LEU HA A 65 TYR H 1.0 . 4.74 224 216 A 72 LEU HB3 A 65 TYR H 1.0 . 4.93 225 217 A 65 TYR H A 73 VAL HB 1.0 . 4.86 226 218 A 65 TYR H A 73 VAL HG2% 1.0 . 4.56 227 219 A 73 VAL H A 72 LEU H 1.0 . 4.55 228 220 A 62 GLN H A 98 LYS H 1.0 . 3.39 229 221 A 62 GLN H A 61 PHE HD% 1.0 . 3.88 230 222 A 72 LEU H A 71 ASP HA 1.0 . 2.72 231 223 A 62 GLN H A 100 LYS HA 1.0 . 5.19 232 224 A 72 LEU HB3 A 72 LEU H 1.0 . 3.76 233 225 A 72 LEU H A 72 LEU HD2% 1.0 . 4.03 234 226 A 52 LEU H A 53 PHE H 1.0 . 2.88 235 227 A 32 GLU H A 31 PRO HD2 1.0 . 3.67 236 228 A 52 LEU H A 49 VAL HA 1.0 . 3.67 237 229 A 52 LEU H A 51 VAL HB 1.0 . 4.35 238 230 A 52 LEU H A 50 ALA HB% 1.0 . 4.37 239 231 A 52 LEU H A 51 VAL HG1% 1.0 . 4.22 240 232 A 52 LEU H A 52 LEU HB3 1.0 . 4.14 241 233 A 52 LEU H A 52 LEU HD1% 1.0 . 4.12 242 234 A 67 ALA H A 71 ASP H 1.0 . 3.99 243 235 A 72 LEU H A 71 ASP H 1.0 . 4.65 244 236 A 67 ALA HB% A 71 ASP H 1.0 . 4.46 245 237 A 6 VAL H A 5 THR H 1.0 . 4.93 246 238 A 93 PHE H A 5 THR H 1.0 . 5.35 247 239 A 79 GLU H A 80 GLU H 1.0 . 3.71 248 240 A 4 LEU H A 5 THR H 1.0 . 4.61 249 241 A 81 LEU H A 80 GLU H 1.0 . 3.86 250 242 A 83 MET H A 80 GLU H 1.0 . 5.30 251 243 A 5 THR HB A 5 THR H 1.0 . 3.52 252 244 A 80 GLU H A 75 PHE HB2 1.0 . 5.03 253 245 A 14 GLU H A 14 GLU HB2 1.0 . 3.00 254 246 A 14 GLU H A 14 GLU HGx 1.0 . 3.20 255 246 A 14 GLU H A 14 GLU HGy 1.0 . 3.20 256 247 A 79 GLU HB3 A 80 GLU H 1.0 . 4.10 257 248 A 14 GLU H A 14 GLU HB3 1.0 . 3.80 258 249 A 79 GLU HB2 A 80 GLU H 1.0 . 4.32 259 250 A 14 GLU H A 13 LYS HB2 1.0 . 4.65 260 251 A 14 GLU H A 13 LYS HB3 1.0 . 4.65 261 252 A 81 LEU HB2 A 80 GLU H 1.0 . 4.67 262 253 A 6 VAL H A 23 PHE H 1.0 . 3.00 263 254 A 92 ILE H A 91 ASP H 1.0 . 4.07 264 255 A 42 CYS H A 78 ASP HA 1.0 . 3.47 265 256 A 42 CYS H A 41 PRO HD2 1.0 . 4.06 266 257 A 42 CYS H A 41 PRO HD3 1.0 . 4.06 267 258 A 42 CYS H A 42 CYS HB2 1.0 . 4.13 268 259 A 42 CYS H A 41 PRO HG2 1.0 . 3.05 269 260 A 92 ILE H A 92 ILE HG13 1.0 . 3.00 270 261 A 42 CYS H A 44 ARG H 1.0 . 4.44 271 262 A 47 SER H A 50 ALA H 1.0 . 5.01 272 263 A 34 GLU H A 35 ALA H 1.0 . 2.85 273 264 A 48 ARG H A 50 ALA H 1.0 . 4.19 274 265 A 86 SER H A 87 TYR H 1.0 . 4.13 275 266 A 51 VAL H A 50 ALA H 1.0 . 3.12 276 267 A 92 ILE H A 90 ASP HA 1.0 . 4.33 277 268 A 44 ARG H A 44 ARG HA 1.0 . 2.91 278 269 A 87 TYR H A 86 SER HA 1.0 . 3.55 279 270 A 50 ALA H A 46 LEU HA 1.0 . 4.69 280 271 A 44 ARG H A 44 ARG HDx 1.0 . 4.74 281 271 A 44 ARG H A 44 ARG HDy 1.0 . 4.74 282 272 A 49 VAL HA A 50 ALA H 1.0 . 3.54 283 273 A 87 TYR HB2 A 87 TYR H 1.0 . 3.52 284 274 A 50 ALA H A 49 VAL HB 1.0 . 3.97 285 275 A 51 VAL HB A 50 ALA H 1.0 . 5.35 286 276 A 34 GLU H A 34 GLU HB2 1.0 . 2.76 287 277 A 44 ARG H A 44 ARG HGx 1.0 . 3.79 288 277 A 44 ARG HGy A 44 ARG H 1.0 . 3.79 289 278 A 33 ALA HB% A 34 GLU H 1.0 . 3.13 290 279 A 44 ARG H A 45 LEU HB3 1.0 . 4.79 291 280 A 50 ALA H A 49 VAL HG1% 1.0 . 3.86 292 281 A 46 LEU H A 49 VAL H 1.0 . 5.25 293 282 A 48 ARG H A 49 VAL H 1.0 . 3.90 294 283 A 50 ALA H A 49 VAL H 1.0 . 3.23 295 284 A 51 VAL H A 49 VAL H 1.0 . 4.59 296 285 A 23 PHE HE% A 49 VAL H 1.0 . 4.49 297 286 A 55 ALA H A 54 PRO HDx 1.0 . 3.43 298 286 A 54 PRO HDy A 55 ALA H 1.0 . 3.43 299 287 A 45 LEU HA A 49 VAL H 1.0 . 4.44 300 288 A 55 ALA H A 53 PHE HBx 1.0 . 3.72 301 288 A 55 ALA H A 53 PHE HBy 1.0 . 3.72 302 289 A 49 VAL H A 48 ARG HB3 1.0 . 3.82 303 290 A 55 ALA H A 55 ALA HB% 1.0 . 3.58 304 291 A 4 LEU H A 3 SER H 1.0 . 4.69 305 292 A 48 ARG H A 46 LEU H 1.0 . 4.83 306 293 A 75 PHE HE% A 46 LEU H 1.0 . 5.18 307 294 A 3 SER H A 2 MET HB2 1.0 . 4.63 308 295 A 19 GLU H A 18 ARG HB2 1.0 . 3.75 309 296 A 46 LEU HB2 A 46 LEU H 1.0 . 3.49 310 297 A 17 ALA HB% A 19 GLU H 1.0 . 4.62 311 298 A 45 LEU HB3 A 46 LEU H 1.0 . 3.91 312 299 A 10 LEU HG A 19 GLU H 1.0 . 4.41 313 300 A 19 GLU H A 10 LEU HB3 1.0 . 3.01 314 301 A 46 LEU H A 45 LEU HD2% 1.0 . 4.12 315 302 A 55 ALA H A 56 LEU H 1.0 . 4.49 316 303 A 56 LEU H A 56 LEU HG 1.0 . 4.60 317 304 A 47 SER H A 46 LEU H 1.0 . 2.92 318 305 A 47 SER H A 49 VAL H 1.0 . 4.36 319 306 A 48 ARG H A 47 SER H 1.0 . 3.80 320 307 A 47 SER H A 47 SER HB2 1.0 . 2.85 321 308 A 47 SER H A 48 ARG HDx 1.0 . 4.52 322 308 A 48 ARG HDy A 47 SER H 1.0 . 4.52 323 309 A 47 SER H A 46 LEU HB3 1.0 . 4.42 324 310 A 46 LEU HB2 A 47 SER H 1.0 . 3.20 325 311 A 47 SER H A 49 VAL HG2% 1.0 . 5.04 326 312 A 47 SER H A 46 LEU HD1% 1.0 . 5.39 327 313 A 47 SER H A 46 LEU HD2% 1.0 . 5.39 328 314 A 77 SER H A 80 GLU H 1.0 . 4.08 329 315 A 23 PHE HA A 24 SER H 1.0 . 3.55 330 316 A 77 SER H A 76 SER HA 1.0 . 3.47 331 317 A 28 SER H A 27 PHE HA 1.0 . 3.48 332 318 A 24 SER H A 23 PHE HB3 1.0 . 4.62 333 319 A 63 ALA H A 62 GLN HE21 1.0 . 3.90 334 320 A 62 GLN HE22 A 75 PHE H 1.0 . 3.64 335 321 A 75 PHE H A 62 GLN HE21 1.0 . 3.85 336 322 A 53 PHE HE% A 53 PHE H 1.0 . 5.31 337 323 A 53 PHE H A 54 PRO HA 1.0 . 4.84 338 324 A 86 SER H A 86 SER HB2 1.0 . 3.68 339 325 A 86 SER H A 86 SER HB3 1.0 . 3.68 340 326 A 53 PHE H A 49 VAL HA 1.0 . 4.20 341 327 A 86 SER H A 84 ALA HA 1.0 . 4.21 342 328 A 86 SER H A 87 TYR HB2 1.0 . 4.82 343 329 A 53 PHE H A 53 PHE HBx 1.0 . 4.11 344 329 A 53 PHE H A 53 PHE HBy 1.0 . 4.11 345 330 A 53 PHE H A 54 PRO HGx 1.0 . 5.19 346 330 A 53 PHE H A 54 PRO HGy 1.0 . 5.19 347 331 A 62 GLN HE22 A 62 GLN HB2 1.0 . 5.16 348 332 A 62 GLN HE21 A 62 GLN HG3 1.0 . 3.16 349 333 A 53 PHE H A 52 LEU HB2 1.0 . 4.04 350 334 A 62 GLN HE22 A 74 ALA HB% 1.0 . 3.36 351 335 A 74 ALA HB% A 62 GLN HE21 1.0 . 4.29 352 336 A 63 ALA HB% A 62 GLN HE21 1.0 . 4.37 353 337 A 86 SER H A 84 ALA HB% 1.0 . 5.41 354 338 A 53 PHE H A 52 LEU HB3 1.0 . 3.92 355 339 A 97 ILE HD1% A 64 HIS H 1.0 . 3.99 356 340 A 53 PHE H A 49 VAL HG1% 1.0 . 4.36 357 341 A 53 PHE H A 52 LEU HD1% 1.0 . 4.60 358 342 A 96 TYR HB3 A 64 HIS H 1.0 . 4.70 359 343 A 64 HIS H A 95 ILE HB 1.0 . 4.72 360 344 A 74 ALA HB% A 64 HIS H 1.0 . 5.50 361 345 A 64 HIS H A 97 ILE HG1x 1.0 . 5.50 362 345 A 64 HIS H A 97 ILE HG1y 1.0 . 5.50 363 346 A 82 THR H A 80 GLU H 1.0 . 4.32 364 347 A 82 THR H A 78 ASP HA 1.0 . 4.25 365 348 A 82 THR H A 82 THR HA 1.0 . 2.89 366 349 A 82 THR H A 81 LEU HB3 1.0 . 4.13 367 350 A 82 THR H A 81 LEU HB2 1.0 . 3.19 368 351 A 82 THR H A 82 THR HG2% 1.0 . 3.30 369 352 A 82 THR H A 81 LEU HD1% 1.0 . 4.69 370 353 A 82 THR H A 81 LEU HD2% 1.0 . 4.69 371 354 A 14 GLU H A 15 GLU H 1.0 . 4.00 372 355 A 16 ALA H A 15 GLU H 1.0 . 3.05 373 356 A 15 GLU H A 15 GLU HBx 1.0 . 3.55 374 356 A 15 GLU HBy A 15 GLU H 1.0 . 3.55 375 357 A 15 GLU H A 11 LEU HB3 1.0 . 4.07 376 358 A 62 GLN H A 61 PHE H 1.0 . 4.51 377 359 A 96 TYR H A 95 ILE H 1.0 . 4.52 378 360 A 9 TYR H A 95 ILE H 1.0 . 4.14 379 361 A 9 TYR HD% A 95 ILE H 1.0 . 3.67 380 362 A 95 ILE H A 9 TYR HE% 1.0 . 4.47 381 363 A 61 PHE H A 61 PHE HB3 1.0 . 3.57 382 364 A 61 PHE H A 100 LYS HEx 1.0 . 4.02 383 364 A 61 PHE H A 100 LYS HEy 1.0 . 4.02 384 365 A 95 ILE H A 94 ARG HB2 1.0 . 4.36 385 366 A 61 PHE H A 100 LYS HB2 1.0 . 4.65 386 367 A 95 ILE H A 94 ARG HB3 1.0 . 4.36 387 368 A 95 ILE H A 95 ILE HG1x 1.0 . 3.48 388 368 A 95 ILE HG1y A 95 ILE H 1.0 . 3.48 389 369 A 95 ILE H A 95 ILE HG2% 1.0 . 3.40 390 370 A 85 MET H A 83 MET H 1.0 . 4.64 391 371 A 85 MET H A 87 TYR H 1.0 . 5.05 392 372 A 85 MET H A 83 MET HA 1.0 . 4.61 393 373 A 85 MET H A 85 MET HGx 1.0 . 4.32 394 373 A 85 MET H A 85 MET HGy 1.0 . 4.32 395 374 A 74 ALA H A 75 PHE H 1.0 . 4.44 396 375 A 51 VAL H A 52 LEU H 1.0 . 3.37 397 376 A 75 PHE H A 75 PHE HD% 1.0 . 4.00 398 377 A 51 VAL H A 48 ARG HA 1.0 . 3.37 399 378 A 75 PHE H A 75 PHE HB2 1.0 . 4.07 400 379 A 51 VAL H A 52 LEU HG 1.0 . 4.19 401 380 A 91 ASP H A 90 ASP H 1.0 . 4.62 402 381 A 91 ASP H A 90 ASP HA 1.0 . 3.25 403 382 A 91 ASP H A 90 ASP HB2 1.0 . 3.00 404 383 A 91 ASP H A 90 ASP HB3 1.0 . 3.00 405 384 A 39 PRO HB3 A 40 GLY H 1.0 . 3.32 406 385 A 18 ARG H A 12 GLY H 1.0 . 4.52 407 386 A 11 LEU H A 12 GLY H 1.0 . 4.53 408 387 A 16 ALA H A 12 GLY H 1.0 . 4.16 409 388 A 12 GLY H A 11 LEU HB2 1.0 . 4.59 410 389 A 18 ARG HB2 A 12 GLY H 1.0 . 4.73 411 390 A 11 LEU HB3 A 12 GLY H 1.0 . 3.64 412 391 A 37 ALA HA A 38 GLY H 1.0 . 2.74 413 392 A 38 GLY H A 38 GLY HA3 1.0 . 2.95 414 393 A 38 GLY H A 39 PRO HDx 1.0 . 3.13 415 393 A 38 GLY H A 39 PRO HDy 1.0 . 3.13 416 394 A 36 ALA HB% A 38 GLY H 1.0 . 5.07 417 395 A 38 GLY H A 37 ALA HB% 1.0 . 5.25 418 396 A 60 GLY H A 61 PHE H 1.0 . 3.35 419 397 A 60 GLY H A 61 PHE HD% 1.0 . 3.35 420 398 A 60 GLY H A 59 GLY HA2 1.0 . 3.31 421 399 A 60 GLY H A 57 ARG HB2 1.0 . 3.60 422 400 A 67 ALA H A 70 GLY H 1.0 . 3.99 423 401 A 70 GLY H A 70 GLY HA2 1.0 . 2.82 424 402 A 67 ALA HB% A 70 GLY H 1.0 . 3.91 425 403 A 2 MET H A 2 MET HG2 1.0 . 4.67 426 404 A 2 MET H A 2 MET HG3 1.0 . 4.67 427 405 A 3 SER H A 4 LEU HG 1.0 . 4.92 428 406 A 3 SER H A 2 MET HB3 1.0 . 4.63 429 407 A 5 THR HG2% A 4 LEU H 1.0 . 5.50 430 408 A 24 SER HA A 5 THR H 1.0 . 5.20 431 409 A 25 PHE H A 5 THR H 1.0 . 4.97 432 410 A 6 VAL H A 25 PHE HB3 1.0 . 5.44 433 411 A 6 VAL H A 23 PHE HE% 1.0 . 5.50 434 412 A 7 LYS H A 6 VAL HB 1.0 . 4.73 435 413 A 7 LYS H A 6 VAL HG1% 1.0 . 4.50 436 414 A 7 LYS H A 94 ARG H 1.0 . 4.94 437 415 A 8 ALA H A 9 TYR HA 1.0 . 5.24 438 416 A 7 LYS H A 8 ALA H 1.0 . 4.69 439 417 A 9 TYR H A 8 ALA H 1.0 . 4.67 440 418 A 11 LEU H A 18 ARG H 1.0 . 4.94 441 419 A 12 GLY H A 13 LYS HA 1.0 . 5.50 442 420 A 15 GLU H A 12 GLY H 1.0 . 4.82 443 421 A 26 CYS H A 25 PHE H 1.0 . 4.71 444 422 A 26 CYS H A 25 PHE HB2 1.0 . 5.23 445 423 A 26 CYS H A 27 PHE H 1.0 . 4.82 446 424 A 27 PHE H A 4 LEU HD1% 1.0 . 5.50 447 425 A 27 PHE H A 4 LEU HD2% 1.0 . 5.50 448 426 A 27 PHE H A 4 LEU HG 1.0 . 5.47 449 427 A 25 PHE HD% A 27 PHE H 1.0 . 5.31 450 428 A 32 GLU H A 32 GLU HB2 1.0 . 3.83 451 429 A 32 GLU H A 31 PRO HD3 1.0 . 3.91 452 430 A 33 ALA H A 32 GLU HB2 1.0 . 4.38 453 431 A 33 ALA H A 32 GLU HB3 1.0 . 4.38 454 432 A 35 ALA H A 34 GLU HB2 1.0 . 2.98 455 433 A 35 ALA H A 34 GLU HB3 1.0 . 3.54 456 434 A 36 ALA H A 32 GLU HB3 1.0 . 4.24 457 435 A 36 ALA H A 32 GLU HB2 1.0 . 4.24 458 436 A 42 CYS H A 41 PRO HB2 1.0 . 3.45 459 437 A 43 GLU H A 43 GLU HG2 1.0 . 4.73 460 438 A 44 ARG H A 41 PRO HA 1.0 . 3.71 461 439 A 45 LEU H A 46 LEU H 1.0 . 5.18 462 440 A 46 LEU H A 45 LEU HD1% 1.0 . 4.12 463 441 A 46 LEU H A 46 LEU HG 1.0 . 4.15 464 442 A 46 LEU H A 45 LEU HB2 1.0 . 4.03 465 443 A 48 ARG H A 52 LEU HD1% 1.0 . 4.71 466 444 A 48 ARG H A 48 ARG HG2 1.0 . 2.90 467 445 A 48 ARG H A 48 ARG HB2 1.0 . 2.83 468 446 A 48 ARG H A 47 SER HB2 1.0 . 3.35 469 447 A 49 VAL H A 48 ARG HG2 1.0 . 3.86 470 448 A 52 LEU HD1% A 49 VAL H 1.0 . 4.03 471 449 A 52 LEU HD1% A 50 ALA H 1.0 . 4.87 472 450 A 51 VAL H A 51 VAL HG2% 1.0 . 3.94 473 451 A 52 LEU H A 53 PHE HBx 1.0 . 5.01 474 451 A 52 LEU H A 53 PHE HBy 1.0 . 5.01 475 452 A 53 PHE H A 49 VAL HB 1.0 . 5.50 476 453 A 53 PHE H A 54 PRO HDx 1.0 . 5.04 477 453 A 53 PHE H A 54 PRO HDy 1.0 . 5.04 478 454 A 53 PHE H A 55 ALA H 1.0 . 5.45 479 455 A 56 LEU H A 56 LEU HD2% 1.0 . 4.96 480 456 A 56 LEU H A 53 PHE HBx 1.0 . 4.31 481 456 A 53 PHE HBy A 56 LEU H 1.0 . 4.31 482 457 A 57 ARG H A 58 PRO HD3 1.0 . 5.17 483 458 A 57 ARG H A 58 PRO HD2 1.0 . 5.24 484 459 A 60 GLY HA3 A 57 ARG H 1.0 . 5.50 485 460 A 60 GLY H A 59 GLY H 1.0 . 5.20 486 461 A 60 GLY H A 100 LYS HG3 1.0 . 5.50 487 462 A 60 GLY H A 50 ALA HB% 1.0 . 5.22 488 463 A 60 GLY H A 100 LYS HEx 1.0 . 5.50 489 463 A 60 GLY H A 100 LYS HEy 1.0 . 5.50 490 464 A 60 GLY H A 61 PHE HB3 1.0 . 4.30 491 465 A 60 GLY H A 61 PHE HA 1.0 . 5.18 492 466 A 61 PHE H A 100 LYS HG3 1.0 . 4.69 493 467 A 61 PHE H A 59 GLY HA2 1.0 . 4.85 494 468 A 61 PHE H A 99 GLU HA 1.0 . 5.02 495 469 A 63 ALA H A 64 HIS H 1.0 . 4.53 496 470 A 63 ALA H A 75 PHE H 1.0 . 4.72 497 471 A 64 HIS H A 95 ILE HG2% 1.0 . 5.19 498 472 A 96 TYR HB2 A 64 HIS H 1.0 . 3.68 499 473 A 73 VAL HA A 65 TYR H 1.0 . 4.72 500 474 A 64 HIS H A 65 TYR H 1.0 . 4.87 501 475 A 66 ARG H A 67 ALA HA 1.0 . 5.45 502 476 A 72 LEU HA A 66 ARG H 1.0 . 5.20 503 477 A 67 ALA H A 65 TYR HE% 1.0 . 5.15 504 478 A 73 VAL H A 64 HIS HB2 1.0 . 5.17 505 479 A 74 ALA H A 73 VAL HB 1.0 . 4.49 506 480 A 74 ALA H A 73 VAL HG1% 1.0 . 4.29 507 481 A 74 ALA H A 65 TYR H 1.0 . 5.01 508 482 A 73 VAL HA A 75 PHE H 1.0 . 5.50 509 483 A 73 VAL H A 75 PHE H 1.0 . 5.50 510 484 A 77 SER H A 75 PHE HB2 1.0 . 4.76 511 485 A 78 ASP H A 77 SER H 1.0 . 4.81 512 486 A 52 LEU H A 49 VAL H 1.0 . 4.82 513 487 A 55 ALA H A 53 PHE HD% 1.0 . 5.50 514 488 A 56 LEU H A 56 LEU HD1% 1.0 . 4.96 515 489 A 63 ALA H A 98 LYS H 1.0 . 5.17 516 490 A 67 ALA H A 66 ARG HA 1.0 . 3.17 517 491 A 73 VAL H A 67 ALA HB% 1.0 . 5.33 518 492 A 73 VAL H A 72 LEU HG 1.0 . 5.50 519 493 A 73 VAL H A 65 TYR HD% 1.0 . 5.18 520 494 A 65 TYR HD% A 75 PHE H 1.0 . 5.18 521 495 A 77 SER H A 76 SER HBx 1.0 . 4.13 522 495 A 77 SER H A 76 SER HBy 1.0 . 4.13 523 496 A 77 SER H A 75 PHE HD% 1.0 . 4.34 524 497 A 79 GLU H A 78 ASP HB3 1.0 . 4.18 525 498 A 80 GLU H A 77 SER HB2 1.0 . 4.77 526 499 A 82 THR HG2% A 81 LEU H 1.0 . 4.34 527 500 A 81 LEU H A 77 SER HA 1.0 . 5.50 528 501 A 82 THR H A 81 LEU H 1.0 . 3.93 529 502 A 84 ALA H A 85 MET HGx 1.0 . 4.82 530 502 A 84 ALA H A 85 MET HGy 1.0 . 4.82 531 503 A 85 MET H A 86 SER H 1.0 . 4.65 532 504 A 88 VAL H A 87 TYR HB3 1.0 . 4.27 533 505 A 91 ASP H A 92 ILE HG13 1.0 . 4.36 534 506 A 92 ILE H A 92 ILE HG2% 1.0 . 4.92 535 507 A 92 ILE H A 93 PHE HA 1.0 . 5.14 536 508 A 93 PHE H A 94 ARG H 1.0 . 4.32 537 509 A 94 ARG H A 95 ILE HG2% 1.0 . 4.24 538 510 A 94 ARG H A 95 ILE HG1x 1.0 . 5.49 539 510 A 94 ARG H A 95 ILE HG1y 1.0 . 5.49 540 511 A 9 TYR HB2 A 95 ILE H 1.0 . 5.30 541 512 A 96 TYR HE% A 95 ILE H 1.0 . 5.50 542 513 A 97 ILE HD1% A 96 TYR H 1.0 . 4.94 543 514 A 96 TYR H A 63 ALA HA 1.0 . 4.94 544 515 A 96 TYR H A 65 TYR HB2 1.0 . 5.50 545 516 A 64 HIS HA A 96 TYR H 1.0 . 5.08 546 517 A 97 ILE H A 8 ALA HB% 1.0 . 5.20 547 518 A 97 ILE H A 95 ILE HG1x 1.0 . 5.50 548 518 A 97 ILE H A 95 ILE HG1y 1.0 . 5.50 549 519 A 97 ILE H A 98 LYS HG3 1.0 . 5.08 550 520 A 97 ILE H A 64 HIS H 1.0 . 5.07 551 521 A 98 LYS H A 97 ILE HG1x 1.0 . 4.94 552 521 A 98 LYS H A 97 ILE HG1y 1.0 . 4.94 553 522 A 17 ALA H A 18 ARG H 1.0 . 5.19 554 523 A 61 PHE HB3 A 99 GLU H 1.0 . 5.50 555 524 A 7 LYS H A 7 LYS HG3 1.0 . 4.24 556 525 A 7 LYS H A 7 LYS HG2 1.0 . 4.24 557 526 A 7 LYS HB2 A 8 ALA H 1.0 . 5.05 558 527 A 52 LEU H A 51 VAL HG2% 1.0 . 4.22 559 528 A 55 ALA HB% A 56 LEU H 1.0 . 4.83 560 529 A 75 PHE HE% A 75 PHE H 1.0 . 4.16 561 530 A 84 ALA H A 80 GLU HA 1.0 . 4.58 562 531 A 87 TYR HD% A 86 SER H 1.0 . 3.44 563 532 A 16 ALA H A 14 GLU HB2 1.0 . 4.43 564 533 A 93 PHE HE% A 85 MET H 1.0 . 4.85 565 534 A 86 SER H A 83 MET HGx 1.0 . 4.87 566 534 A 86 SER H A 83 MET HGy 1.0 . 4.87 567 535 A 45 LEU H A 81 LEU HG 1.0 . 5.50 568 536 A 47 SER H A 49 VAL HB 1.0 . 5.28 569 537 A 62 GLN HB2 A 62 GLN HE21 1.0 . 3.80 570 538 A 62 GLN HB3 A 62 GLN HE21 1.0 . 3.54 571 539 A 62 GLN H A 99 GLU HA 1.0 . 3.81 572 540 A 63 ALA H A 61 PHE HE% 1.0 . 4.67 573 541 A 62 GLN HE22 A 62 GLN HA 1.0 . 3.93 574 542 A 62 GLN HE22 A 74 ALA HA 1.0 . 4.21 575 543 A 62 GLN HA A 62 GLN HE21 1.0 . 4.37 576 544 A 62 GLN HE21 A 74 ALA HA 1.0 . 4.54 577 545 A 64 HIS H A 62 GLN HE21 1.0 . 5.50 578 546 A 96 TYR HD% A 64 HIS H 1.0 . 5.50 579 547 A 65 TYR H A 73 VAL HG1% 1.0 . 4.56 580 548 A 69 ARG H A 69 ARG HB3 1.0 . 3.67 581 549 A 69 ARG H A 69 ARG HB2 1.0 . 3.67 582 550 A 69 ARG H A 69 ARG HGx 1.0 . 3.15 583 550 A 69 ARG H A 69 ARG HGy 1.0 . 3.15 584 551 A 80 GLU H A 80 GLU HG2 1.0 . 5.13 585 552 A 80 GLU H A 77 SER HB3 1.0 . 4.77 586 553 A 82 THR H A 79 GLU H 1.0 . 5.21 587 554 A 80 GLU H A 77 SER HA 1.0 . 4.66 588 555 A 81 LEU H A 80 GLU HB2 1.0 . 5.46 589 556 A 81 LEU H A 80 GLU HB3 1.0 . 5.46 590 557 A 6 VAL H A 23 PHE HD% 1.0 . 4.93 591 558 A 22 ARG H A 22 ARG HG2 1.0 . 5.25 592 559 A 22 ARG H A 22 ARG HG3 1.0 . 5.25 593 560 A 7 LYS H A 7 LYS HDx 1.0 . 4.97 594 560 A 7 LYS H A 7 LYS HDy 1.0 . 4.97 595 561 A 34 GLU H A 34 GLU HB3 1.0 . 3.77 596 562 A 19 GLU H A 19 GLU HG2 1.0 . 5.50 597 563 A 19 GLU H A 19 GLU HG3 1.0 . 5.50 598 564 A 6 VAL HB A 23 PHE H 1.0 . 5.00 599 565 A 6 VAL H A 25 PHE H 1.0 . 4.25 600 566 A 19 GLU H A 11 LEU HA 1.0 . 5.50 601 567 A 5 THR HA A 23 PHE H 1.0 . 5.50 602 568 A 7 LYS H A 23 PHE H 1.0 . 5.50 603 569 A 62 GLN HE22 A 62 GLN HB3 1.0 . 3.91 604 570 A 81 LEU H A 79 GLU HA 1.0 . 4.46 605 571 A 5 THR HB A 92 ILE HA 1.0 . 4.02 606 572 A 82 THR H A 82 THR HB 1.0 . 3.60 607 573 A 83 MET H A 82 THR HB 1.0 . 4.06 608 574 A 81 LEU HB2 A 82 THR HA 1.0 . 4.62 609 575 A 82 THR HG2% A 82 THR HA 1.0 . 3.36 610 576 A 49 VAL HA A 52 LEU HB3 1.0 . 4.12 611 577 A 49 VAL HA A 53 PHE HD% 1.0 . 5.04 612 578 A 49 VAL HA A 52 LEU HB2 1.0 . 3.73 613 579 A 49 VAL HA A 49 VAL HG1% 1.0 . 3.47 614 580 A 49 VAL HA A 52 LEU HD1% 1.0 . 4.33 615 581 A 42 CYS HA A 41 PRO HA 1.0 . 4.94 616 582 A 50 ALA HB% A 51 VAL HA 1.0 . 4.35 617 583 A 54 PRO HA A 55 ALA HA 1.0 . 5.01 618 584 A 88 VAL HA A 88 VAL HG1% 1.0 . 3.32 619 585 A 88 VAL HA A 88 VAL HG2% 1.0 . 3.32 620 586 A 68 GLU HA A 68 GLU HBx 1.0 . 2.87 621 586 A 68 GLU HA A 68 GLU HBy 1.0 . 2.87 622 587 A 42 CYS HA A 41 PRO HG2 1.0 . 4.65 623 588 A 42 CYS HA A 41 PRO HB2 1.0 . 4.16 624 589 A 42 CYS HA A 45 LEU HB3 1.0 . 4.36 625 590 A 40 GLY H A 39 PRO HA 1.0 . 2.86 626 591 A 39 PRO HA A 40 GLY HA3 1.0 . 4.80 627 592 A 40 GLY HA2 A 39 PRO HA 1.0 . 5.27 628 593 A 47 SER HB3 A 47 SER H 1.0 . 3.73 629 594 A 50 ALA H A 47 SER HA 1.0 . 4.21 630 595 A 73 VAL HA A 72 LEU HB3 1.0 . 4.67 631 596 A 73 VAL HA A 73 VAL HG2% 1.0 . 3.54 632 597 A 82 THR H A 79 GLU HA 1.0 . 4.03 633 598 A 79 GLU HA A 82 THR HB 1.0 . 3.79 634 599 A 47 SER HB3 A 44 ARG HA 1.0 . 4.17 635 600 A 44 ARG HA A 44 ARG HDx 1.0 . 4.14 636 600 A 44 ARG HA A 44 ARG HDy 1.0 . 4.14 637 601 A 44 ARG HA A 44 ARG HGx 1.0 . 3.52 638 601 A 44 ARG HGy A 44 ARG HA 1.0 . 3.52 639 602 A 46 LEU H A 43 GLU HA 1.0 . 4.33 640 603 A 92 ILE HA A 92 ILE HD1% 1.0 . 3.92 641 604 A 6 VAL HA A 6 VAL HG2% 1.0 . 3.88 642 605 A 98 LYS H A 97 ILE HA 1.0 . 3.38 643 606 A 46 LEU HB2 A 43 GLU HA 1.0 . 4.05 644 607 A 97 ILE HD1% A 97 ILE HA 1.0 . 4.01 645 608 A 78 ASP HA A 42 CYS HB2 1.0 . 4.62 646 609 A 78 ASP HA A 81 LEU HB3 1.0 . 4.40 647 610 A 78 ASP HA A 81 LEU HB2 1.0 . 4.17 648 611 A 25 PHE HE% A 45 LEU HA 1.0 . 4.69 649 612 A 78 ASP HA A 42 CYS HB3 1.0 . 4.62 650 613 A 83 MET HB2 A 80 GLU HA 1.0 . 3.98 651 614 A 45 LEU HA A 48 ARG HB2 1.0 . 4.35 652 615 A 45 LEU HA A 45 LEU HG 1.0 . 3.87 653 616 A 45 LEU HA A 45 LEU HD1% 1.0 . 4.14 654 617 A 96 TYR H A 95 ILE HA 1.0 . 3.29 655 618 A 86 SER H A 83 MET HA 1.0 . 4.21 656 619 A 87 TYR HD% A 87 TYR HA 1.0 . 3.39 657 620 A 96 TYR HD% A 95 ILE HA 1.0 . 4.06 658 621 A 83 MET HA A 86 SER HB2 1.0 . 4.69 659 622 A 83 MET HA A 86 SER HB3 1.0 . 4.69 660 623 A 95 ILE HA A 95 ILE HD1% 1.0 . 4.23 661 624 A 46 LEU HA A 49 VAL H 1.0 . 4.19 662 625 A 46 LEU HA A 61 PHE HZ 1.0 . 4.24 663 626 A 99 GLU HA A 100 LYS HA 1.0 . 4.45 664 627 A 46 LEU HA A 46 LEU HG 1.0 . 3.80 665 628 A 11 LEU HB3 A 15 GLU HA 1.0 . 3.91 666 629 A 46 LEU HA A 45 LEU HG 1.0 . 5.19 667 630 A 100 LYS HA A 100 LYS HG2 1.0 . 3.53 668 631 A 15 GLU HA A 11 LEU HD1% 1.0 . 4.71 669 632 A 46 LEU HA A 49 VAL HG1% 1.0 . 4.18 670 633 A 24 SER HA A 25 PHE H 1.0 . 3.21 671 634 A 24 SER HA A 4 LEU H 1.0 . 4.57 672 635 A 24 SER HA A 5 THR HA 1.0 . 3.50 673 636 A 99 GLU HA A 61 PHE HB3 1.0 . 3.89 674 637 A 99 GLU HA A 61 PHE HB2 1.0 . 4.00 675 638 A 99 GLU HA A 99 GLU HGx 1.0 . 3.33 676 638 A 99 GLU HA A 99 GLU HGy 1.0 . 3.33 677 639 A 4 LEU H A 3 SER HA 1.0 . 3.04 678 640 A 3 SER HA A 26 CYS HA 1.0 . 3.54 679 641 A 48 ARG HA A 48 ARG HDx 1.0 . 3.26 680 641 A 48 ARG HDy A 48 ARG HA 1.0 . 3.26 681 642 A 51 VAL HB A 48 ARG HA 1.0 . 4.33 682 643 A 4 LEU HG A 3 SER HA 1.0 . 4.14 683 644 A 48 ARG HA A 48 ARG HG2 1.0 . 3.96 684 645 A 48 ARG HA A 48 ARG HG3 1.0 . 4.13 685 646 A 48 ARG HA A 51 VAL HG2% 1.0 . 4.74 686 647 A 81 LEU HA A 84 ALA HB% 1.0 . 3.56 687 648 A 81 LEU HA A 81 LEU HD2% 1.0 . 3.97 688 649 A 9 TYR H A 96 TYR HA 1.0 . 4.11 689 650 A 33 ALA H A 32 GLU HA 1.0 . 3.55 690 651 A 96 TYR HA A 9 TYR HD% 1.0 . 4.71 691 652 A 69 ARG HA A 69 ARG HD2 1.0 . 5.50 692 653 A 69 ARG HA A 69 ARG HD3 1.0 . 5.50 693 654 A 96 TYR HA A 9 TYR HB2 1.0 . 4.00 694 655 A 96 TYR HA A 11 LEU HG 1.0 . 5.25 695 656 A 96 TYR HA A 95 ILE HB 1.0 . 5.50 696 657 A 69 ARG HA A 69 ARG HGx 1.0 . 3.58 697 657 A 69 ARG HGy A 69 ARG HA 1.0 . 3.58 698 658 A 14 GLU HA A 15 GLU HA 1.0 . 5.20 699 659 A 23 PHE HA A 23 PHE HD% 1.0 . 4.28 700 660 A 52 LEU HA A 54 PRO HDx 1.0 . 4.00 701 660 A 54 PRO HDy A 52 LEU HA 1.0 . 4.00 702 661 A 9 TYR HA A 20 ILE HA 1.0 . 4.02 703 662 A 52 LEU HD1% A 52 LEU HA 1.0 . 4.03 704 663 A 62 GLN H A 61 PHE HA 1.0 . 3.33 705 664 A 61 PHE HA A 99 GLU HA 1.0 . 3.34 706 665 A 2 MET HA A 2 MET HG3 1.0 . 3.82 707 666 A 61 PHE HA A 100 LYS HG3 1.0 . 4.09 708 667 A 91 ASP HA A 4 LEU HD1% 1.0 . 4.68 709 668 A 91 ASP HA A 4 LEU HD2% 1.0 . 4.68 710 669 A 66 ARG H A 65 TYR HA 1.0 . 3.46 711 670 A 7 LYS HA A 23 PHE H 1.0 . 4.85 712 671 A 94 ARG HA A 95 ILE H 1.0 . 3.36 713 672 A 3 SER H A 2 MET HA 1.0 . 3.30 714 673 A 96 TYR HD% A 65 TYR HA 1.0 . 4.06 715 674 A 65 TYR HA A 95 ILE HA 1.0 . 4.19 716 675 A 92 ILE HG2% A 94 ARG HA 1.0 . 4.27 717 676 A 65 TYR HA A 84 ALA HB% 1.0 . 5.20 718 677 A 64 HIS HA A 75 PHE H 1.0 . 4.14 719 678 A 84 ALA HA A 87 TYR H 1.0 . 4.26 720 679 A 53 PHE H A 50 ALA HA 1.0 . 4.13 721 680 A 61 PHE HE% A 50 ALA HA 1.0 . 4.40 722 681 A 87 TYR HB2 A 84 ALA HA 1.0 . 4.27 723 682 A 98 LYS HA A 99 GLU H 1.0 . 3.13 724 683 A 98 LYS HA A 98 LYS HG3 1.0 . 3.51 725 684 A 98 LYS HG2 A 98 LYS HA 1.0 . 4.04 726 685 A 49 VAL HG1% A 50 ALA HA 1.0 . 3.84 727 686 A 57 ARG H A 56 LEU HA 1.0 . 3.43 728 687 A 53 PHE HD% A 53 PHE HA 1.0 . 4.79 729 688 A 53 PHE HA A 54 PRO HDx 1.0 . 3.66 730 688 A 54 PRO HDy A 53 PHE HA 1.0 . 3.66 731 689 A 98 LYS HA A 99 GLU HGx 1.0 . 4.38 732 689 A 98 LYS HA A 99 GLU HGy 1.0 . 4.38 733 690 A 30 GLU HA A 30 GLU HGx 1.0 . 3.27 734 690 A 30 GLU HA A 30 GLU HGy 1.0 . 3.27 735 691 A 72 LEU HA A 72 LEU HG 1.0 . 4.17 736 692 A 56 LEU HA A 56 LEU HD2% 1.0 . 4.57 737 693 A 98 LYS HA A 97 ILE HG2% 1.0 . 4.42 738 694 A 10 LEU HA A 10 LEU HD2% 1.0 . 4.13 739 695 A 22 ARG HA A 8 ALA H 1.0 . 4.03 740 696 A 22 ARG HA A 23 PHE H 1.0 . 3.42 741 697 A 5 THR H A 4 LEU HA 1.0 . 3.17 742 698 A 22 ARG HA A 7 LYS HA 1.0 . 3.71 743 699 A 62 GLN HA A 62 GLN HG3 1.0 . 3.80 744 700 A 62 GLN HA A 63 ALA HB% 1.0 . 4.13 745 701 A 93 PHE HD% A 93 PHE HA 1.0 . 3.76 746 702 A 93 PHE HA A 88 VAL HG1% 1.0 . 3.77 747 703 A 55 ALA HA A 54 PRO HGx 1.0 . 4.23 748 703 A 54 PRO HGy A 55 ALA HA 1.0 . 4.23 749 704 A 34 GLU HB3 A 35 ALA HA 1.0 . 5.50 750 705 A 18 ARG H A 17 ALA HA 1.0 . 3.28 751 706 A 12 GLY H A 17 ALA HA 1.0 . 5.45 752 707 A 19 GLU H A 17 ALA HA 1.0 . 4.43 753 708 A 18 ARG HB2 A 17 ALA HA 1.0 . 4.55 754 709 A 63 ALA H A 74 ALA HA 1.0 . 4.90 755 710 A 65 TYR H A 74 ALA HA 1.0 . 5.15 756 711 A 75 PHE H A 74 ALA HA 1.0 . 3.23 757 712 A 64 HIS HD2 A 74 ALA HA 1.0 . 4.38 758 713 A 64 HIS HA A 74 ALA HA 1.0 . 3.43 759 714 A 58 PRO HD3 A 57 ARG HA 1.0 . 3.37 760 715 A 58 PRO HD2 A 57 ARG HA 1.0 . 3.35 761 716 A 29 PRO HD3 A 28 SER HA 1.0 . 3.25 762 717 A 29 PRO HD2 A 28 SER HA 1.0 . 3.36 763 718 A 31 PRO HD2 A 30 GLU HA 1.0 . 3.02 764 719 A 31 PRO HD3 A 40 GLY HA3 1.0 . 4.69 765 720 A 40 GLY HA2 A 31 PRO HD3 1.0 . 4.73 766 721 A 31 PRO HD2 A 40 GLY HA3 1.0 . 4.44 767 722 A 40 GLY HA2 A 31 PRO HD2 1.0 . 4.45 768 723 A 58 PRO HD3 A 57 ARG HB3 1.0 . 3.97 769 724 A 9 TYR H A 8 ALA HA 1.0 . 3.41 770 725 A 95 ILE H A 8 ALA HA 1.0 . 4.17 771 726 A 95 ILE HD1% A 8 ALA HA 1.0 . 3.69 772 727 A 97 ILE HD1% A 8 ALA HA 1.0 . 5.08 773 728 A 40 GLY HA3 A 41 PRO HD2 1.0 . 3.62 774 729 A 40 GLY HA3 A 41 PRO HD3 1.0 . 3.62 775 730 A 5 THR H A 4 LEU HBx 1.0 . 3.97 776 730 A 4 LEU HBy A 5 THR H 1.0 . 3.97 777 731 A 38 GLY HA2 A 39 PRO HDx 1.0 . 3.48 778 731 A 39 PRO HDy A 38 GLY HA2 1.0 . 3.48 779 732 A 38 GLY HA3 A 39 PRO HDx 1.0 . 3.09 780 732 A 38 GLY HA3 A 39 PRO HDy 1.0 . 3.09 781 733 A 38 GLY HA3 A 39 PRO HG3 1.0 . 5.33 782 734 A 18 ARG HD2 A 12 GLY HA2 1.0 . 4.91 783 735 A 18 ARG HD2 A 12 GLY HA3 1.0 . 4.91 784 736 A 18 ARG HB3 A 18 ARG HD3 1.0 . 4.10 785 737 A 44 ARG HDy A 44 ARG HB3 1.0 . 3.95 786 737 A 44 ARG HB3 A 44 ARG HDx 1.0 . 3.95 787 738 A 7 LYS HB3 A 22 ARG HDx 1.0 . 5.22 788 738 A 7 LYS HB3 A 22 ARG HDy 1.0 . 5.22 789 739 A 66 ARG HD2 A 66 ARG HB2 1.0 . 4.18 790 740 A 66 ARG HB2 A 66 ARG HD3 1.0 . 4.18 791 741 A 66 ARG HB3 A 66 ARG HD2 1.0 . 4.18 792 742 A 66 ARG HB3 A 66 ARG HD3 1.0 . 4.18 793 743 A 94 ARG HD2 A 94 ARG HB2 1.0 . 3.96 794 744 A 94 ARG HB2 A 94 ARG HD3 1.0 . 3.96 795 745 A 94 ARG HB3 A 94 ARG HD2 1.0 . 3.96 796 746 A 94 ARG HB3 A 94 ARG HD3 1.0 . 3.96 797 747 A 52 LEU H A 52 LEU HB2 1.0 . 4.10 798 748 A 11 LEU HB2 A 11 LEU HD1% 1.0 . 3.98 799 749 A 52 LEU HD1% A 52 LEU HB2 1.0 . 4.22 800 750 A 96 TYR H A 95 ILE HB 1.0 . 3.88 801 751 A 13 LYS HEx A 14 GLU HGx 1.0 . 4.19 802 751 A 13 LYS HEy A 14 GLU HGx 1.0 . 4.19 803 751 A 14 GLU HGy A 13 LYS HEx 1.0 . 4.19 804 751 A 14 GLU HGy A 13 LYS HEy 1.0 . 4.19 805 752 A 13 LYS HEy A 13 LYS HB2 1.0 . 4.73 806 752 A 13 LYS HB2 A 13 LYS HEx 1.0 . 4.73 807 753 A 7 LYS HB2 A 7 LYS HEx 1.0 . 4.04 808 753 A 7 LYS HB2 A 7 LYS HEy 1.0 . 4.04 809 754 A 13 LYS HEx A 13 LYS HG3 1.0 . 3.33 810 754 A 13 LYS HEy A 13 LYS HG3 1.0 . 3.33 811 755 A 92 ILE HG2% A 7 LYS HEx 1.0 . 4.87 812 755 A 92 ILE HG2% A 7 LYS HEy 1.0 . 4.87 813 756 A 72 LEU HB2 A 72 LEU HD1% 1.0 . 4.04 814 757 A 100 LYS HB2 A 100 LYS HEx 1.0 . 3.78 815 757 A 100 LYS HB2 A 100 LYS HEy 1.0 . 3.78 816 758 A 98 LYS HB2 A 98 LYS HE2 1.0 . 4.88 817 759 A 98 LYS HG2 A 98 LYS HE3 1.0 . 4.16 818 760 A 66 ARG H A 65 TYR HB3 1.0 . 4.40 819 761 A 62 GLN H A 61 PHE HB3 1.0 . 4.38 820 762 A 62 GLN H A 61 PHE HB2 1.0 . 4.31 821 763 A 72 LEU H A 71 ASP HB2 1.0 . 4.26 822 764 A 72 LEU H A 71 ASP HB3 1.0 . 4.26 823 765 A 92 ILE H A 92 ILE HB 1.0 . 3.68 824 766 A 99 GLU H A 99 GLU HGx 1.0 . 3.58 825 766 A 99 GLU H A 99 GLU HGy 1.0 . 3.58 826 767 A 99 GLU HGy A 10 LEU HD2% 1.0 . 5.50 827 767 A 10 LEU HD2% A 99 GLU HGx 1.0 . 5.50 828 768 A 99 GLU HGy A 56 LEU HD2% 1.0 . 5.22 829 768 A 56 LEU HD2% A 99 GLU HGx 1.0 . 5.22 830 769 A 100 LYS H A 99 GLU HGx 1.0 . 4.63 831 769 A 100 LYS H A 99 GLU HGy 1.0 . 4.63 832 770 A 14 GLU HB3 A 14 GLU HGx 1.0 . 2.86 833 770 A 14 GLU HGy A 14 GLU HB3 1.0 . 2.86 834 771 A 30 GLU H A 30 GLU HGx 1.0 . 3.10 835 771 A 30 GLU H A 30 GLU HGy 1.0 . 3.10 836 772 A 30 GLU HGy A 30 GLU HB3 1.0 . 2.99 837 772 A 30 GLU HB3 A 30 GLU HGx 1.0 . 2.99 838 773 A 69 ARG HGy A 68 GLU HG2 1.0 . 5.08 839 773 A 68 GLU HG2 A 69 ARG HGx 1.0 . 5.08 840 774 A 69 ARG HGy A 68 GLU HG3 1.0 . 5.08 841 774 A 68 GLU HG3 A 69 ARG HGx 1.0 . 5.08 842 775 A 31 PRO HD2 A 30 GLU HGx 1.0 . 4.06 843 775 A 31 PRO HD2 A 30 GLU HGy 1.0 . 4.06 844 776 A 63 ALA H A 62 GLN HG3 1.0 . 4.94 845 777 A 62 GLN HA A 62 GLN HG2 1.0 . 3.42 846 778 A 10 LEU HB2 A 19 GLU HB2 1.0 . 4.27 847 779 A 10 LEU HB2 A 19 GLU HB3 1.0 . 4.27 848 780 A 74 ALA HB% A 62 GLN HG2 1.0 . 4.31 849 781 A 74 ALA HB% A 62 GLN HG3 1.0 . 3.58 850 782 A 100 LYS H A 100 LYS HB3 1.0 . 3.80 851 783 A 100 LYS HG2 A 100 LYS HB3 1.0 . 2.87 852 784 A 100 LYS HB2 A 100 LYS HG3 1.0 . 2.85 853 785 A 62 GLN H A 62 GLN HB3 1.0 . 3.90 854 786 A 62 GLN H A 62 GLN HB2 1.0 . 3.14 855 787 A 40 GLY H A 39 PRO HB2 1.0 . 4.27 856 788 A 30 GLU H A 29 PRO HB3 1.0 . 4.63 857 789 A 51 VAL HB A 50 ALA HB% 1.0 . 3.96 858 790 A 81 LEU HB2 A 41 PRO HB2 1.0 . 4.40 859 791 A 84 ALA H A 83 MET HB3 1.0 . 3.83 860 792 A 83 MET H A 83 MET HB3 1.0 . 3.45 861 793 A 80 GLU HA A 83 MET HB3 1.0 . 3.82 862 794 A 83 MET HA A 83 MET HGx 1.0 . 2.85 863 794 A 83 MET HA A 83 MET HGy 1.0 . 2.85 864 795 A 83 MET HB2 A 83 MET HA 1.0 . 2.74 865 796 A 58 PRO HB2 A 59 GLY HA3 1.0 . 4.94 866 797 A 49 VAL HB A 49 VAL H 1.0 . 3.85 867 798 A 49 VAL HB A 61 PHE HZ 1.0 . 3.61 868 799 A 46 LEU HA A 49 VAL HB 1.0 . 3.75 869 800 A 57 ARG H A 57 ARG HB3 1.0 . 3.90 870 801 A 57 ARG HB2 A 58 PRO HD3 1.0 . 4.95 871 802 A 58 PRO HD2 A 57 ARG HB3 1.0 . 2.40 872 803 A 60 GLY HA3 A 57 ARG HB2 1.0 . 4.02 873 804 A 52 LEU HB3 A 21 ARG HB3 1.0 . 4.17 874 805 A 52 LEU HB3 A 21 ARG HB2 1.0 . 4.17 875 806 A 32 GLU H A 32 GLU HB3 1.0 . 3.83 876 807 A 31 PRO HD2 A 30 GLU HB2 1.0 . 3.92 877 808 A 60 GLY HA2 A 100 LYS HDx 1.0 . 4.36 878 808 A 60 GLY HA2 A 100 LYS HDy 1.0 . 4.36 879 809 A 98 LYS HB2 A 98 LYS HD2 1.0 . 3.91 880 810 A 62 GLN HG2 A 100 LYS HDx 1.0 . 3.85 881 810 A 62 GLN HG2 A 100 LYS HDy 1.0 . 3.85 882 811 A 98 LYS HB2 A 98 LYS HD3 1.0 . 4.15 883 812 A 11 LEU HB2 A 98 LYS HD3 1.0 . 4.49 884 813 A 100 LYS HG3 A 100 LYS HDx 1.0 . 2.78 885 813 A 100 LYS HG3 A 100 LYS HDy 1.0 . 2.78 886 814 A 13 LYS HDy A 14 GLU HGx 1.0 . 3.64 887 814 A 13 LYS HDx A 14 GLU HGx 1.0 . 3.64 888 814 A 14 GLU HGy A 13 LYS HDx 1.0 . 3.64 889 814 A 14 GLU HGy A 13 LYS HDy 1.0 . 3.64 890 815 A 48 ARG H A 48 ARG HB3 1.0 . 3.74 891 816 A 89 LYS HA A 89 LYS HDx 1.0 . 4.11 892 816 A 89 LYS HA A 89 LYS HDy 1.0 . 4.11 893 817 A 48 ARG HB3 A 48 ARG HDx 1.0 . 3.88 894 817 A 48 ARG HDy A 48 ARG HB3 1.0 . 3.88 895 818 A 14 GLU HA A 14 GLU HB3 1.0 . 2.55 896 819 A 48 ARG HA A 48 ARG HB2 1.0 . 3.02 897 820 A 40 GLY HA2 A 31 PRO HG3 1.0 . 4.63 898 821 A 97 ILE H A 97 ILE HG1x 1.0 . 3.50 899 821 A 97 ILE H A 97 ILE HG1y 1.0 . 3.50 900 822 A 78 ASP HA A 41 PRO HG2 1.0 . 3.33 901 823 A 10 LEU HG A 10 LEU HA 1.0 . 3.89 902 824 A 40 GLY HA2 A 31 PRO HG2 1.0 . 4.63 903 825 A 38 GLY HA3 A 39 PRO HG2 1.0 . 5.33 904 826 A 4 LEU H A 4 LEU HG 1.0 . 4.04 905 827 A 53 PHE HA A 54 PRO HGx 1.0 . 4.28 906 827 A 54 PRO HGy A 53 PHE HA 1.0 . 4.28 907 828 A 97 ILE HA A 97 ILE HG1x 1.0 . 3.44 908 828 A 97 ILE HG1y A 97 ILE HA 1.0 . 3.44 909 829 A 92 ILE HA A 92 ILE HG13 1.0 . 3.17 910 830 A 92 ILE HA A 92 ILE HG12 1.0 . 3.26 911 831 A 41 PRO HG2 A 81 LEU HG 1.0 . 4.39 912 832 A 10 LEU HG A 18 ARG HB2 1.0 . 4.88 913 833 A 45 LEU H A 45 LEU HD1% 1.0 . 4.39 914 834 A 57 ARG H A 57 ARG HG3 1.0 . 4.70 915 835 A 57 ARG HA A 57 ARG HG2 1.0 . 4.08 916 836 A 18 ARG HA A 18 ARG HG2 1.0 . 3.61 917 837 A 18 ARG HA A 18 ARG HG3 1.0 . 3.61 918 838 A 46 LEU HA A 45 LEU HD1% 1.0 . 4.59 919 839 A 81 LEU HA A 81 LEU HG 1.0 . 3.77 920 840 A 45 LEU HB2 A 45 LEU HD1% 1.0 . 4.18 921 841 A 41 PRO HB2 A 81 LEU HG 1.0 . 2.70 922 842 A 45 LEU HB3 A 45 LEU HD1% 1.0 . 4.21 923 843 A 75 PHE HZ A 45 LEU HD1% 1.0 . 4.48 924 844 A 72 LEU H A 72 LEU HG 1.0 . 4.40 925 845 A 23 PHE HE% A 52 LEU HD1% 1.0 . 4.42 926 846 A 8 ALA HA A 95 ILE HG1x 1.0 . 2.80 927 846 A 95 ILE HG1y A 8 ALA HA 1.0 . 2.80 928 847 A 52 LEU HD1% A 23 PHE HB3 1.0 . 4.13 929 848 A 46 LEU HB3 A 46 LEU HD1% 1.0 . 4.09 930 849 A 41 PRO HB2 A 81 LEU HD1% 1.0 . 4.29 931 850 A 46 LEU HB2 A 46 LEU HD1% 1.0 . 3.24 932 851 A 81 LEU HB2 A 81 LEU HD1% 1.0 . 3.52 933 852 A 42 CYS H A 42 CYS HB3 1.0 . 4.13 934 853 A 11 LEU H A 11 LEU HD1% 1.0 . 4.02 935 854 A 46 LEU H A 46 LEU HD1% 1.0 . 4.05 936 855 A 53 PHE HD% A 10 LEU HD1% 1.0 . 4.45 937 856 A 27 PHE HD% A 4 LEU HD1% 1.0 . 4.31 938 857 A 61 PHE HE% A 46 LEU HD1% 1.0 . 4.71 939 858 A 10 LEU HA A 10 LEU HD1% 1.0 . 4.13 940 859 A 4 LEU HD1% A 27 PHE HB3 1.0 . 5.39 941 860 A 96 TYR HB3 A 11 LEU HD1% 1.0 . 4.44 942 861 A 99 GLU HGy A 10 LEU HD1% 1.0 . 5.50 943 861 A 10 LEU HD1% A 99 GLU HGx 1.0 . 5.50 944 862 A 97 ILE HD1% A 95 ILE HG1x 1.0 . 3.84 945 862 A 97 ILE HD1% A 95 ILE HG1y 1.0 . 3.84 946 863 A 100 LYS H A 100 LYS HG2 1.0 . 4.07 947 864 A 61 PHE HA A 100 LYS HG2 1.0 . 3.70 948 865 A 4 LEU HD2% A 27 PHE HB3 1.0 . 5.39 949 866 A 100 LYS HG3 A 100 LYS HEx 1.0 . 3.36 950 866 A 100 LYS HG3 A 100 LYS HEy 1.0 . 3.36 951 867 A 62 GLN HB2 A 100 LYS HG2 1.0 . 3.84 952 868 A 72 LEU H A 72 LEU HD1% 1.0 . 4.03 953 869 A 72 LEU HA A 72 LEU HD1% 1.0 . 4.46 954 870 A 13 LYS HG2 A 13 LYS HEx 1.0 . 3.33 955 870 A 13 LYS HEy A 13 LYS HG2 1.0 . 3.33 956 871 A 64 HIS HB2 A 72 LEU HD1% 1.0 . 4.89 957 872 A 96 TYR HB3 A 72 LEU HD1% 1.0 . 3.80 958 873 A 13 LYS HDy A 13 LYS HG3 1.0 . 2.97 959 873 A 13 LYS HDx A 13 LYS HG3 1.0 . 2.97 960 874 A 72 LEU HB3 A 72 LEU HD1% 1.0 . 3.53 961 875 A 89 LYS HA A 89 LYS HG2 1.0 . 3.88 962 876 A 89 LYS HA A 89 LYS HG3 1.0 . 3.88 963 877 A 49 VAL H A 49 VAL HG2% 1.0 . 2.76 964 878 A 50 ALA H A 49 VAL HG2% 1.0 . 3.94 965 879 A 23 PHE HE% A 49 VAL HG2% 1.0 . 3.53 966 880 A 53 PHE HE% A 49 VAL HG2% 1.0 . 3.96 967 881 A 46 LEU HA A 49 VAL HG2% 1.0 . 3.66 968 882 A 49 VAL HA A 49 VAL HG2% 1.0 . 3.04 969 883 A 49 VAL HG2% A 48 ARG HG2 1.0 . 4.72 970 884 A 49 VAL HG2% A 8 ALA HB% 1.0 . 4.61 971 885 A 49 VAL HG2% A 45 LEU HG 1.0 . 5.24 972 886 A 49 VAL HG2% A 95 ILE HD1% 1.0 . 4.43 973 887 A 53 PHE HD% A 10 LEU HD2% 1.0 . 4.45 974 888 A 75 PHE HE% A 81 LEU HD2% 1.0 . 4.31 975 889 A 49 VAL HG2% A 48 ARG HB2 1.0 . 3.74 976 890 A 96 TYR HD% A 72 LEU HD2% 1.0 . 4.94 977 891 A 72 LEU HA A 72 LEU HD2% 1.0 . 4.46 978 892 A 46 LEU HA A 45 LEU HD2% 1.0 . 4.59 979 893 A 45 LEU HA A 45 LEU HD2% 1.0 . 4.14 980 894 A 64 HIS HB3 A 72 LEU HD2% 1.0 . 5.04 981 895 A 64 HIS HB2 A 72 LEU HD2% 1.0 . 4.89 982 896 A 96 TYR HB3 A 72 LEU HD2% 1.0 . 3.80 983 897 A 45 LEU HB2 A 45 LEU HD2% 1.0 . 4.18 984 898 A 41 PRO HB2 A 81 LEU HD2% 1.0 . 4.29 985 899 A 72 LEU HB3 A 72 LEU HD2% 1.0 . 3.53 986 900 A 45 LEU HB3 A 45 LEU HD2% 1.0 . 4.21 987 901 A 72 LEU HB2 A 72 LEU HD2% 1.0 . 4.04 988 902 A 90 ASP H A 88 VAL HG1% 1.0 . 5.04 989 903 A 52 LEU H A 52 LEU HD2% 1.0 . 3.96 990 904 A 88 VAL H A 88 VAL HG1% 1.0 . 3.87 991 905 A 23 PHE HD% A 52 LEU HD2% 1.0 . 4.29 992 906 A 52 LEU HA A 52 LEU HD2% 1.0 . 2.40 993 907 A 23 PHE HB3 A 52 LEU HD2% 1.0 . 3.87 994 908 A 52 LEU HB3 A 52 LEU HD2% 1.0 . 3.16 995 909 A 11 LEU H A 11 LEU HD2% 1.0 . 4.02 996 910 A 49 VAL HG1% A 49 VAL H 1.0 . 4.29 997 911 A 49 VAL HG1% A 61 PHE HZ 1.0 . 4.67 998 912 A 49 VAL HG1% A 53 PHE HD% 1.0 . 3.71 999 913 A 49 VAL HG1% A 61 PHE HE% 1.0 . 4.04 1000 914 A 93 PHE HD% A 6 VAL HG1% 1.0 . 3.89 1001 915 A 23 PHE HE% A 6 VAL HG1% 1.0 . 3.83 1002 916 A 6 VAL HA A 6 VAL HG1% 1.0 . 3.88 1003 917 A 11 LEU HA A 11 LEU HD2% 1.0 . 4.00 1004 918 A 15 GLU HA A 11 LEU HD2% 1.0 . 4.71 1005 919 A 96 TYR HB3 A 11 LEU HD2% 1.0 . 4.44 1006 920 A 11 LEU HB2 A 11 LEU HD2% 1.0 . 3.98 1007 921 A 11 LEU HB3 A 11 LEU HD2% 1.0 . 3.85 1008 922 A 51 VAL H A 51 VAL HG1% 1.0 . 3.94 1009 923 A 93 PHE HD% A 6 VAL HG2% 1.0 . 3.89 1010 924 A 53 PHE HE% A 49 VAL HG1% 1.0 . 3.60 1011 925 A 61 PHE HD% A 56 LEU HD2% 1.0 . 5.06 1012 926 A 23 PHE HE% A 6 VAL HG2% 1.0 . 3.83 1013 927 A 48 ARG HA A 51 VAL HG1% 1.0 . 4.74 1014 928 A 52 LEU HA A 51 VAL HG1% 1.0 . 3.90 1015 929 A 51 VAL HA A 51 VAL HG1% 1.0 . 3.26 1016 930 A 49 VAL HG1% A 53 PHE HBx 1.0 . 3.55 1017 930 A 49 VAL HG1% A 53 PHE HBy 1.0 . 3.55 1018 931 A 49 VAL HG1% A 97 ILE HG1x 1.0 . 3.16 1019 931 A 97 ILE HG1y A 49 VAL HG1% 1.0 . 3.16 1020 932 A 46 LEU H A 46 LEU HD2% 1.0 . 4.05 1021 933 A 75 PHE HE% A 46 LEU HD2% 1.0 . 4.09 1022 934 A 61 PHE HE% A 46 LEU HD2% 1.0 . 4.71 1023 935 A 46 LEU HB3 A 46 LEU HD2% 1.0 . 4.09 1024 936 A 46 LEU HB2 A 46 LEU HD2% 1.0 . 3.24 1025 937 A 73 VAL H A 73 VAL HG1% 1.0 . 4.07 1026 938 A 63 ALA HB% A 64 HIS H 1.0 . 3.69 1027 939 A 83 MET H A 82 THR HG2% 1.0 . 3.25 1028 940 A 63 ALA HB% A 75 PHE HD% 1.0 . 3.78 1029 941 A 75 PHE HE% A 63 ALA HB% 1.0 . 3.03 1030 942 A 63 ALA HB% A 61 PHE HE% 1.0 . 3.02 1031 943 A 63 ALA HB% A 75 PHE HZ 1.0 . 4.07 1032 944 A 63 ALA HB% A 61 PHE HD% 1.0 . 4.17 1033 945 A 82 THR HG2% A 79 GLU HA 1.0 . 2.64 1034 946 A 63 ALA HB% A 95 ILE HB 1.0 . 3.40 1035 947 A 63 ALA HB% A 97 ILE HD1% 1.0 . 3.22 1036 948 A 8 ALA H A 8 ALA HB% 1.0 . 3.60 1037 949 A 9 TYR H A 8 ALA HB% 1.0 . 3.65 1038 950 A 5 THR HG2% A 23 PHE H 1.0 . 4.17 1039 951 A 5 THR HG2% A 5 THR H 1.0 . 3.81 1040 952 A 53 PHE HZ A 8 ALA HB% 1.0 . 3.63 1041 953 A 53 PHE HE% A 8 ALA HB% 1.0 . 3.34 1042 954 A 5 THR HA A 5 THR HG2% 1.0 . 2.62 1043 955 A 73 VAL HA A 73 VAL HG1% 1.0 . 3.54 1044 956 A 51 VAL HA A 51 VAL HG2% 1.0 . 3.26 1045 957 A 50 ALA HB% A 51 VAL HG2% 1.0 . 4.89 1046 958 A 8 ALA HB% A 97 ILE HG1x 1.0 . 3.68 1047 958 A 97 ILE HG1y A 8 ALA HB% 1.0 . 3.68 1048 959 A 8 ALA HB% A 95 ILE HD1% 1.0 . 4.03 1049 960 A 49 VAL HG1% A 8 ALA HB% 1.0 . 3.67 1050 961 A 88 VAL H A 88 VAL HG2% 1.0 . 3.87 1051 962 A 93 PHE HA A 88 VAL HG2% 1.0 . 3.77 1052 963 A 97 ILE H A 97 ILE HG2% 1.0 . 4.19 1053 964 A 62 GLN H A 97 ILE HG2% 1.0 . 4.41 1054 965 A 17 ALA H A 16 ALA HB% 1.0 . 4.42 1055 966 A 16 ALA H A 16 ALA HB% 1.0 . 3.14 1056 967 A 61 PHE HD% A 97 ILE HG2% 1.0 . 3.48 1057 968 A 61 PHE HA A 97 ILE HG2% 1.0 . 5.16 1058 969 A 97 ILE HG2% A 97 ILE HA 1.0 . 3.27 1059 970 A 10 LEU HA A 97 ILE HG2% 1.0 . 3.99 1060 971 A 99 GLU HA A 97 ILE HG2% 1.0 . 4.67 1061 972 A 15 GLU HA A 16 ALA HB% 1.0 . 4.69 1062 973 A 61 PHE HB3 A 97 ILE HG2% 1.0 . 4.35 1063 974 A 61 PHE HB2 A 97 ILE HG2% 1.0 . 3.44 1064 975 A 97 ILE HG2% A 56 LEU HG 1.0 . 5.50 1065 976 A 98 LYS HG3 A 97 ILE HG2% 1.0 . 5.50 1066 977 A 97 ILE HG2% A 97 ILE HG1x 1.0 . 3.24 1067 977 A 97 ILE HG2% A 97 ILE HG1y 1.0 . 3.24 1068 978 A 63 ALA HB% A 97 ILE HG2% 1.0 . 4.05 1069 979 A 97 ILE HG2% A 95 ILE HD1% 1.0 . 5.11 1070 980 A 37 ALA H A 36 ALA HB% 1.0 . 3.98 1071 981 A 37 ALA H A 37 ALA HB% 1.0 . 4.14 1072 982 A 35 ALA HB% A 35 ALA H 1.0 . 3.72 1073 983 A 17 ALA HB% A 18 ARG H 1.0 . 3.72 1074 984 A 74 ALA HB% A 75 PHE H 1.0 . 3.57 1075 985 A 17 ALA HB% A 9 TYR HD% 1.0 . 3.29 1076 986 A 74 ALA HB% A 64 HIS HD2 1.0 . 3.91 1077 987 A 74 ALA HB% A 64 HIS HA 1.0 . 3.99 1078 988 A 74 ALA HB% A 73 VAL HA 1.0 . 4.03 1079 989 A 9 TYR HB2 A 17 ALA HB% 1.0 . 5.50 1080 990 A 9 TYR HB3 A 17 ALA HB% 1.0 . 3.88 1081 991 A 84 ALA H A 84 ALA HB% 1.0 . 3.24 1082 992 A 65 TYR HD% A 84 ALA HB% 1.0 . 4.23 1083 993 A 93 PHE HD% A 84 ALA HB% 1.0 . 4.80 1084 994 A 93 PHE HE% A 84 ALA HB% 1.0 . 4.00 1085 995 A 65 TYR HE% A 84 ALA HB% 1.0 . 4.63 1086 996 A 84 ALA HB% A 93 PHE HZ 1.0 . 2.66 1087 997 A 65 TYR HB2 A 84 ALA HB% 1.0 . 4.40 1088 998 A 96 TYR H A 95 ILE HG2% 1.0 . 4.01 1089 999 A 85 MET H A 84 ALA HB% 1.0 . 4.39 1090 1000 A 75 PHE HD% A 95 ILE HG2% 1.0 . 4.69 1091 1001 A 75 PHE HE% A 95 ILE HG2% 1.0 . 3.77 1092 1002 A 95 ILE HG2% A 75 PHE HZ 1.0 . 4.20 1093 1003 A 93 PHE HE% A 95 ILE HG2% 1.0 . 4.01 1094 1004 A 95 ILE HA A 95 ILE HG2% 1.0 . 3.37 1095 1005 A 84 ALA HB% A 65 TYR HB3 1.0 . 4.10 1096 1006 A 95 ILE HG2% A 95 ILE HG1x 1.0 . 3.57 1097 1006 A 95 ILE HG1y A 95 ILE HG2% 1.0 . 3.57 1098 1007 A 93 PHE H A 92 ILE HG2% 1.0 . 3.48 1099 1008 A 50 ALA HB% A 50 ALA H 1.0 . 2.82 1100 1009 A 51 VAL H A 50 ALA HB% 1.0 . 3.26 1101 1010 A 50 ALA HB% A 61 PHE HE% 1.0 . 4.10 1102 1011 A 92 ILE HA A 92 ILE HG2% 1.0 . 3.26 1103 1012 A 50 ALA HB% A 47 SER HA 1.0 . 3.63 1104 1013 A 50 ALA HB% A 58 PRO HA 1.0 . 3.76 1105 1014 A 5 THR HB A 92 ILE HG2% 1.0 . 4.11 1106 1015 A 50 ALA HB% A 59 GLY HA2 1.0 . 4.19 1107 1016 A 50 ALA HB% A 48 ARG HA 1.0 . 4.68 1108 1017 A 50 ALA HB% A 58 PRO HB2 1.0 . 4.84 1109 1018 A 92 ILE HG2% A 7 LYS HDx 1.0 . 3.44 1110 1018 A 92 ILE HG2% A 7 LYS HDy 1.0 . 3.44 1111 1019 A 50 ALA HB% A 51 VAL HG1% 1.0 . 4.89 1112 1020 A 95 ILE HG2% A 95 ILE HD1% 1.0 . 2.90 1113 1021 A 50 ALA HB% A 49 VAL HG1% 1.0 . 4.41 1114 1022 A 8 ALA H A 20 ILE HG2% 1.0 . 4.40 1115 1023 A 20 ILE H A 20 ILE HG2% 1.0 . 4.03 1116 1024 A 27 PHE HD% A 2 MET HE% 1.0 . 4.37 1117 1025 A 2 MET HE% A 27 PHE HE% 1.0 . 4.89 1118 1026 A 20 ILE HA A 20 ILE HG2% 1.0 . 3.74 1119 1027 A 9 TYR HA A 20 ILE HG2% 1.0 . 4.40 1120 1028 A 2 MET HA A 2 MET HE% 1.0 . 4.45 1121 1029 A 83 MET HA A 83 MET HE% 1.0 . 4.19 1122 1030 A 20 ILE HG2% A 7 LYS HEx 1.0 . 3.96 1123 1030 A 7 LYS HEy A 20 ILE HG2% 1.0 . 3.96 1124 1031 A 83 MET HB2 A 83 MET HE% 1.0 . 2.70 1125 1032 A 20 ILE HG2% A 20 ILE HG12 1.0 . 3.77 1126 1033 A 2 MET HE% A 4 LEU HD1% 1.0 . 4.32 1127 1034 A 2 MET HE% A 4 LEU HD2% 1.0 . 4.32 1128 1035 A 93 PHE HD% A 85 MET HE% 1.0 . 4.17 1129 1036 A 25 PHE HE% A 85 MET HE% 1.0 . 4.24 1130 1037 A 93 PHE HE% A 85 MET HE% 1.0 . 4.59 1131 1038 A 85 MET HA A 85 MET HE% 1.0 . 4.20 1132 1039 A 93 PHE HB3 A 85 MET HE% 1.0 . 4.50 1133 1040 A 93 PHE HB2 A 85 MET HE% 1.0 . 4.16 1134 1041 A 85 MET HE% A 85 MET HGx 1.0 . 4.05 1135 1041 A 85 MET HGy A 85 MET HE% 1.0 . 4.05 1136 1042 A 95 ILE H A 95 ILE HD1% 1.0 . 4.13 1137 1043 A 95 ILE HD1% A 75 PHE HZ 1.0 . 3.85 1138 1044 A 95 ILE HB A 95 ILE HD1% 1.0 . 3.42 1139 1045 A 95 ILE HD1% A 45 LEU HD1% 1.0 . 3.45 1140 1046 A 95 ILE HD1% A 45 LEU HD2% 1.0 . 3.45 1141 1047 A 9 TYR H A 95 ILE HD1% 1.0 . 5.00 1142 1048 A 20 ILE HD1% A 20 ILE HG2% 1.0 . 3.01 1143 1049 A 20 ILE HD1% A 7 LYS HEx 1.0 . 4.93 1144 1049 A 20 ILE HD1% A 7 LYS HEy 1.0 . 4.93 1145 1050 A 93 PHE H A 92 ILE HD1% 1.0 . 5.42 1146 1051 A 92 ILE H A 92 ILE HD1% 1.0 . 4.47 1147 1052 A 92 ILE HD1% A 90 ASP HB2 1.0 . 4.74 1148 1053 A 92 ILE HB A 92 ILE HD1% 1.0 . 3.22 1149 1054 A 97 ILE HD1% A 61 PHE HD% 1.0 . 4.22 1150 1055 A 97 ILE HD1% A 63 ALA HA 1.0 . 4.01 1151 1056 A 97 ILE HD1% A 95 ILE HB 1.0 . 3.75 1152 1057 A 97 ILE HD1% A 97 ILE HB 1.0 . 4.25 1153 1058 A 97 ILE HD1% A 8 ALA HB% 1.0 . 3.76 1154 1059 A 97 ILE HD1% A 49 VAL HG2% 1.0 . 3.47 1155 1060 A 97 ILE HD1% A 95 ILE HD1% 1.0 . 3.27 1156 1061 A 2 MET HA A 2 MET HG2 1.0 . 3.82 1157 1062 A 62 GLN HB3 A 63 ALA HB% 1.0 . 5.50 1158 1063 A 51 VAL HA A 54 PRO HB3 1.0 . 4.85 1159 1064 A 4 LEU HG A 85 MET HE% 1.0 . 4.95 1160 1065 A 4 LEU HBy A 4 LEU HD1% 1.0 . 3.21 1161 1065 A 4 LEU HD1% A 4 LEU HBx 1.0 . 3.21 1162 1066 A 4 LEU HBx A 4 LEU HD2% 1.0 . 3.21 1163 1066 A 4 LEU HBy A 4 LEU HD2% 1.0 . 3.21 1164 1067 A 4 LEU HBx A 91 ASP HB2 1.0 . 5.48 1165 1067 A 4 LEU HBy A 91 ASP HB2 1.0 . 5.48 1166 1068 A 91 ASP HB3 A 4 LEU HBx 1.0 . 5.48 1167 1068 A 4 LEU HBy A 91 ASP HB3 1.0 . 5.48 1168 1069 A 93 PHE HB2 A 4 LEU HBx 1.0 . 5.12 1169 1069 A 93 PHE HB2 A 4 LEU HBy 1.0 . 5.12 1170 1070 A 5 THR HA A 4 LEU HA 1.0 . 4.53 1171 1071 A 3 SER HA A 4 LEU HBx 1.0 . 5.50 1172 1071 A 4 LEU HBy A 3 SER HA 1.0 . 5.50 1173 1072 A 93 PHE HD% A 4 LEU HBx 1.0 . 5.50 1174 1072 A 93 PHE HD% A 4 LEU HBy 1.0 . 5.50 1175 1073 A 27 PHE HD% A 4 LEU HBx 1.0 . 5.04 1176 1073 A 27 PHE HD% A 4 LEU HBy 1.0 . 5.04 1177 1074 A 5 THR HA A 6 VAL HB 1.0 . 5.02 1178 1075 A 5 THR HB A 92 ILE HG12 1.0 . 4.01 1179 1076 A 5 THR HB A 22 ARG HB2 1.0 . 5.50 1180 1077 A 5 THR HB A 7 LYS HDx 1.0 . 5.40 1181 1077 A 5 THR HB A 7 LYS HDy 1.0 . 5.40 1182 1078 A 5 THR HB A 22 ARG HB3 1.0 . 5.50 1183 1079 A 5 THR HB A 92 ILE HG13 1.0 . 5.50 1184 1080 A 97 ILE HB A 49 VAL HG1% 1.0 . 4.57 1185 1081 A 6 VAL HB A 23 PHE HE% 1.0 . 4.92 1186 1082 A 94 ARG H A 7 LYS HB2 1.0 . 5.25 1187 1083 A 95 ILE HB A 8 ALA HA 1.0 . 4.79 1188 1084 A 95 ILE HG2% A 8 ALA HA 1.0 . 4.82 1189 1085 A 8 ALA HB% A 20 ILE HG2% 1.0 . 5.40 1190 1086 A 95 ILE HG2% A 8 ALA HB% 1.0 . 5.50 1191 1087 A 7 LYS HA A 8 ALA HB% 1.0 . 4.53 1192 1088 A 9 TYR HA A 8 ALA HA 1.0 . 5.11 1193 1089 A 95 ILE H A 8 ALA HB% 1.0 . 5.08 1194 1090 A 97 ILE HD1% A 9 TYR HB2 1.0 . 5.50 1195 1091 A 9 TYR HB3 A 11 LEU HG 1.0 . 5.50 1196 1092 A 96 TYR HA A 9 TYR HB3 1.0 . 4.74 1197 1093 A 18 ARG H A 10 LEU HB2 1.0 . 5.50 1198 1094 A 18 ARG H A 10 LEU HB3 1.0 . 5.29 1199 1095 A 11 LEU HB3 A 11 LEU HD1% 1.0 . 3.85 1200 1096 A 11 LEU HA A 11 LEU HD1% 1.0 . 4.00 1201 1097 A 10 LEU HA A 11 LEU HB2 1.0 . 5.50 1202 1098 A 18 ARG H A 11 LEU HA 1.0 . 4.33 1203 1099 A 11 LEU HB3 A 12 GLY HA2 1.0 . 5.50 1204 1100 A 12 GLY HA2 A 18 ARG HG2 1.0 . 5.50 1205 1101 A 18 ARG HG3 A 12 GLY HA2 1.0 . 5.50 1206 1102 A 12 GLY HA3 A 18 ARG HG2 1.0 . 5.50 1207 1103 A 18 ARG HG3 A 12 GLY HA3 1.0 . 5.50 1208 1104 A 11 LEU HB3 A 12 GLY HA3 1.0 . 5.50 1209 1105 A 12 GLY HA2 A 18 ARG HD3 1.0 . 4.91 1210 1106 A 13 LYS HDy A 13 LYS HB2 1.0 . 3.29 1211 1106 A 13 LYS HB2 A 13 LYS HDx 1.0 . 3.29 1212 1107 A 13 LYS HA A 13 LYS HDx 1.0 . 4.22 1213 1107 A 13 LYS HA A 13 LYS HDy 1.0 . 4.22 1214 1108 A 14 GLU HGy A 13 LYS HG2 1.0 . 5.09 1215 1108 A 13 LYS HG2 A 14 GLU HGx 1.0 . 5.09 1216 1109 A 14 GLU HGy A 13 LYS HG3 1.0 . 5.09 1217 1109 A 13 LYS HG3 A 14 GLU HGx 1.0 . 5.09 1218 1110 A 14 GLU HB2 A 13 LYS HDx 1.0 . 4.90 1219 1110 A 14 GLU HB2 A 13 LYS HDy 1.0 . 4.90 1220 1111 A 13 LYS HEy A 13 LYS HB3 1.0 . 4.73 1221 1111 A 13 LYS HB3 A 13 LYS HEx 1.0 . 4.73 1222 1112 A 13 LYS HDy A 13 LYS HB3 1.0 . 3.29 1223 1112 A 13 LYS HB3 A 13 LYS HDx 1.0 . 3.29 1224 1113 A 14 GLU HA A 14 GLU HGx 1.0 . 2.89 1225 1113 A 14 GLU HA A 14 GLU HGy 1.0 . 2.89 1226 1114 A 14 GLU HB2 A 14 GLU HGx 1.0 . 2.40 1227 1114 A 14 GLU HB2 A 14 GLU HGy 1.0 . 2.40 1228 1115 A 14 GLU HB2 A 15 GLU HA 1.0 . 5.50 1229 1116 A 14 GLU HB3 A 15 GLU H 1.0 . 4.98 1230 1117 A 15 GLU HBy A 15 GLU HG2 1.0 . 2.88 1231 1117 A 15 GLU HG2 A 15 GLU HBx 1.0 . 2.88 1232 1118 A 15 GLU HBx A 15 GLU HG3 1.0 . 2.88 1233 1118 A 15 GLU HBy A 15 GLU HG3 1.0 . 2.88 1234 1119 A 15 GLU HA A 16 ALA HA 1.0 . 5.03 1235 1120 A 14 GLU HA A 15 GLU HBx 1.0 . 4.60 1236 1120 A 14 GLU HA A 15 GLU HBy 1.0 . 4.60 1237 1121 A 16 ALA H A 14 GLU HGx 1.0 . 5.50 1238 1121 A 16 ALA H A 14 GLU HGy 1.0 . 5.50 1239 1122 A 17 ALA HB% A 16 ALA HA 1.0 . 4.19 1240 1123 A 17 ALA HB% A 18 ARG HA 1.0 . 4.57 1241 1124 A 11 LEU HG A 98 LYS HG3 1.0 . 4.13 1242 1125 A 17 ALA HB% A 18 ARG HB2 1.0 . 5.39 1243 1126 A 18 ARG HA A 18 ARG HD3 1.0 . 4.93 1244 1127 A 18 ARG HA A 18 ARG HD2 1.0 . 4.93 1245 1128 A 12 GLY HA3 A 18 ARG HD3 1.0 . 4.91 1246 1129 A 5 THR H A 4 LEU HG 1.0 . 5.50 1247 1130 A 18 ARG H A 18 ARG HG2 1.0 . 4.78 1248 1131 A 18 ARG H A 18 ARG HG3 1.0 . 4.78 1249 1132 A 10 LEU HB3 A 19 GLU HB2 1.0 . 4.97 1250 1133 A 10 LEU HB3 A 19 GLU HB3 1.0 . 4.97 1251 1134 A 53 PHE HE% A 19 GLU HB2 1.0 . 5.12 1252 1135 A 53 PHE HE% A 19 GLU HB3 1.0 . 5.12 1253 1136 A 52 LEU HD1% A 23 PHE HA 1.0 . 5.23 1254 1137 A 24 SER H A 23 PHE HB2 1.0 . 5.15 1255 1138 A 24 SER HA A 4 LEU HBx 1.0 . 5.50 1256 1138 A 24 SER HA A 4 LEU HBy 1.0 . 5.50 1257 1139 A 46 LEU HG A 76 SER HBx 1.0 . 5.50 1258 1139 A 46 LEU HG A 76 SER HBy 1.0 . 5.50 1259 1140 A 5 THR HG2% A 24 SER HB2 1.0 . 5.50 1260 1141 A 5 THR HG2% A 24 SER HB3 1.0 . 5.50 1261 1142 A 24 SER HA A 25 PHE HB3 1.0 . 5.00 1262 1143 A 24 SER HA A 25 PHE HB2 1.0 . 5.24 1263 1144 A 25 PHE HD% A 25 PHE HA 1.0 . 3.91 1264 1145 A 3 SER HA A 26 CYS HB2 1.0 . 5.50 1265 1146 A 27 PHE HB2 A 4 LEU HD1% 1.0 . 5.39 1266 1147 A 27 PHE HB2 A 4 LEU HD2% 1.0 . 5.39 1267 1148 A 25 PHE HE% A 27 PHE HA 1.0 . 4.76 1268 1149 A 30 GLU H A 29 PRO HB2 1.0 . 4.63 1269 1150 A 30 GLU HGy A 30 GLU HB2 1.0 . 2.99 1270 1150 A 30 GLU HB2 A 30 GLU HGx 1.0 . 2.99 1271 1151 A 29 PRO HA A 30 GLU HGx 1.0 . 4.31 1272 1151 A 30 GLU HGy A 29 PRO HA 1.0 . 4.31 1273 1152 A 31 PRO HD3 A 30 GLU HGx 1.0 . 4.18 1274 1152 A 31 PRO HD3 A 30 GLU HGy 1.0 . 4.18 1275 1153 A 32 GLU H A 31 PRO HG2 1.0 . 5.15 1276 1154 A 32 GLU H A 31 PRO HG3 1.0 . 5.15 1277 1155 A 30 GLU H A 31 PRO HD2 1.0 . 4.82 1278 1156 A 40 GLY H A 39 PRO HG3 1.0 . 4.89 1279 1157 A 40 GLY H A 39 PRO HG2 1.0 . 4.89 1280 1158 A 33 ALA HB% A 32 GLU HA 1.0 . 4.50 1281 1159 A 33 ALA HB% A 34 GLU HA 1.0 . 4.81 1282 1160 A 34 GLU HA A 34 GLU HG2 1.0 . 3.55 1283 1161 A 34 GLU HA A 34 GLU HG3 1.0 . 3.55 1284 1162 A 35 ALA HB% A 32 GLU HB3 1.0 . 5.08 1285 1163 A 36 ALA HB% A 32 GLU HB3 1.0 . 5.31 1286 1164 A 35 ALA HB% A 32 GLU HB2 1.0 . 5.08 1287 1165 A 36 ALA HB% A 32 GLU HB2 1.0 . 5.31 1288 1166 A 37 ALA HB% A 38 GLY HA2 1.0 . 4.96 1289 1167 A 38 GLY HA3 A 37 ALA HB% 1.0 . 5.38 1290 1168 A 38 GLY HA3 A 39 PRO HA 1.0 . 4.48 1291 1169 A 39 PRO HB3 A 38 GLY HA3 1.0 . 5.04 1292 1170 A 40 GLY HA3 A 41 PRO HG3 1.0 . 5.50 1293 1171 A 41 PRO HG2 A 40 GLY HA3 1.0 . 5.50 1294 1172 A 41 PRO HA A 44 ARG HGx 1.0 . 5.01 1295 1172 A 44 ARG HGy A 41 PRO HA 1.0 . 5.01 1296 1173 A 43 GLU H A 41 PRO HA 1.0 . 5.07 1297 1174 A 45 LEU H A 41 PRO HA 1.0 . 4.85 1298 1175 A 42 CYS HA A 81 LEU HG 1.0 . 4.73 1299 1176 A 43 GLU HA A 43 GLU HG2 1.0 . 4.24 1300 1177 A 43 GLU HA A 43 GLU HG3 1.0 . 4.24 1301 1178 A 42 CYS H A 43 GLU HA 1.0 . 5.50 1302 1179 A 44 ARG HDy A 44 ARG HB2 1.0 . 3.95 1303 1179 A 44 ARG HB2 A 44 ARG HDx 1.0 . 3.95 1304 1180 A 45 LEU HA A 95 ILE HD1% 1.0 . 5.50 1305 1181 A 45 LEU HB3 A 44 ARG HB2 1.0 . 5.50 1306 1182 A 45 LEU HB3 A 46 LEU HG 1.0 . 5.50 1307 1183 A 45 LEU HB3 A 44 ARG HB3 1.0 . 5.50 1308 1184 A 42 CYS HA A 45 LEU HB2 1.0 . 4.93 1309 1185 A 25 PHE HE% A 45 LEU HB2 1.0 . 5.36 1310 1186 A 25 PHE HE% A 45 LEU HB3 1.0 . 5.47 1311 1187 A 46 LEU HB3 A 43 GLU HA 1.0 . 4.85 1312 1188 A 46 LEU HG A 43 GLU HA 1.0 . 5.44 1313 1189 A 47 SER H A 46 LEU HG 1.0 . 5.50 1314 1190 A 49 VAL HB A 47 SER HA 1.0 . 5.50 1315 1191 A 47 SER HB3 A 48 ARG HG2 1.0 . 4.96 1316 1192 A 47 SER HB3 A 48 ARG HB3 1.0 . 5.50 1317 1193 A 46 LEU H A 47 SER HB2 1.0 . 5.33 1318 1194 A 52 LEU HD1% A 48 ARG HG2 1.0 . 4.99 1319 1195 A 52 LEU HD1% A 48 ARG HG3 1.0 . 4.64 1320 1196 A 52 LEU HD1% A 48 ARG HDx 1.0 . 4.64 1321 1196 A 48 ARG HDy A 52 LEU HD1% 1.0 . 4.64 1322 1197 A 48 ARG HA A 52 LEU HG 1.0 . 4.78 1323 1198 A 52 LEU HG A 48 ARG HDx 1.0 . 5.05 1324 1198 A 48 ARG HDy A 52 LEU HG 1.0 . 5.05 1325 1199 A 50 ALA H A 48 ARG HA 1.0 . 4.93 1326 1200 A 52 LEU H A 48 ARG HA 1.0 . 5.30 1327 1201 A 23 PHE HE% A 48 ARG HG2 1.0 . 4.86 1328 1202 A 23 PHE HE% A 48 ARG HDx 1.0 . 5.26 1329 1202 A 23 PHE HE% A 48 ARG HDy 1.0 . 5.26 1330 1203 A 53 PHE HE% A 49 VAL HA 1.0 . 4.77 1331 1204 A 48 ARG H A 49 VAL HG2% 1.0 . 4.45 1332 1205 A 51 VAL H A 49 VAL HA 1.0 . 5.01 1333 1206 A 50 ALA HA A 58 PRO HA 1.0 . 4.53 1334 1207 A 50 ALA HB% A 49 VAL HB 1.0 . 4.21 1335 1208 A 50 ALA HB% A 49 VAL H 1.0 . 4.63 1336 1209 A 51 VAL HB A 52 LEU HG 1.0 . 5.34 1337 1210 A 52 LEU HG A 51 VAL HA 1.0 . 5.38 1338 1211 A 51 VAL HB A 48 ARG HDx 1.0 . 5.42 1339 1211 A 48 ARG HDy A 51 VAL HB 1.0 . 5.42 1340 1212 A 52 LEU HA A 51 VAL HG2% 1.0 . 3.90 1341 1213 A 51 VAL H A 51 VAL HB 1.0 . 3.29 1342 1214 A 53 PHE H A 51 VAL HA 1.0 . 4.61 1343 1215 A 49 VAL HG2% A 52 LEU HB2 1.0 . 5.50 1344 1216 A 52 LEU HG A 52 LEU HA 1.0 . 3.43 1345 1217 A 52 LEU HB2 A 52 LEU HG 1.0 . 2.87 1346 1218 A 51 VAL HB A 52 LEU HD2% 1.0 . 5.50 1347 1219 A 51 VAL H A 52 LEU HA 1.0 . 5.31 1348 1220 A 51 VAL H A 52 LEU HB2 1.0 . 5.15 1349 1221 A 52 LEU H A 52 LEU HG 1.0 . 4.48 1350 1222 A 53 PHE H A 52 LEU HD2% 1.0 . 5.26 1351 1223 A 53 PHE HD% A 52 LEU HD2% 1.0 . 5.50 1352 1224 A 52 LEU HD1% A 53 PHE HD% 1.0 . 5.40 1353 1225 A 56 LEU HG A 53 PHE HBx 1.0 . 4.85 1354 1225 A 53 PHE HBy A 56 LEU HG 1.0 . 4.85 1355 1226 A 55 ALA HB% A 54 PRO HA 1.0 . 5.11 1356 1227 A 55 ALA HB% A 54 PRO HGx 1.0 . 4.67 1357 1227 A 55 ALA HB% A 54 PRO HGy 1.0 . 4.67 1358 1228 A 55 ALA HA A 54 PRO HB2 1.0 . 4.80 1359 1229 A 56 LEU HA A 56 LEU HD1% 1.0 . 4.57 1360 1230 A 10 LEU HB2 A 53 PHE HBx 1.0 . 5.21 1361 1230 A 53 PHE HBy A 10 LEU HB2 1.0 . 5.21 1362 1231 A 61 PHE HB2 A 56 LEU HG 1.0 . 5.50 1363 1232 A 57 ARG HA A 57 ARG HG3 1.0 . 4.08 1364 1233 A 57 ARG HA A 57 ARG HD2 1.0 . 5.29 1365 1234 A 57 ARG HA A 57 ARG HD3 1.0 . 5.29 1366 1235 A 57 ARG HB2 A 56 LEU HA 1.0 . 5.50 1367 1236 A 57 ARG HB2 A 58 PRO HA 1.0 . 5.50 1368 1237 A 99 GLU HA A 57 ARG HB2 1.0 . 5.50 1369 1238 A 57 ARG HB3 A 58 PRO HA 1.0 . 5.00 1370 1239 A 57 ARG H A 57 ARG HG2 1.0 . 4.70 1371 1240 A 57 ARG H A 57 ARG HD2 1.0 . 5.50 1372 1241 A 57 ARG H A 57 ARG HD3 1.0 . 5.50 1373 1242 A 97 ILE H A 11 LEU HG 1.0 . 5.50 1374 1243 A 50 ALA HB% A 58 PRO HD3 1.0 . 5.50 1375 1244 A 31 PRO HD2 A 30 GLU HB3 1.0 . 3.92 1376 1245 A 57 ARG HB2 A 58 PRO HD2 1.0 . 4.30 1377 1246 A 60 GLY HA3 A 100 LYS HB3 1.0 . 5.50 1378 1247 A 59 GLY HA3 A 58 PRO HA 1.0 . 5.50 1379 1248 A 99 GLU HA A 60 GLY HA3 1.0 . 5.50 1380 1249 A 59 GLY HA2 A 58 PRO HA 1.0 . 4.90 1381 1250 A 100 LYS HB2 A 60 GLY HA2 1.0 . 5.01 1382 1251 A 100 LYS HB3 A 60 GLY HA2 1.0 . 5.05 1383 1252 A 62 GLN HB2 A 61 PHE HA 1.0 . 5.29 1384 1253 A 61 PHE HA A 100 LYS HB2 1.0 . 5.45 1385 1254 A 61 PHE HA A 62 GLN HG2 1.0 . 5.50 1386 1255 A 61 PHE HA A 99 GLU HGx 1.0 . 5.33 1387 1255 A 61 PHE HA A 99 GLU HGy 1.0 . 5.33 1388 1256 A 63 ALA H A 62 GLN HG2 1.0 . 4.76 1389 1257 A 62 GLN H A 62 GLN HG2 1.0 . 4.69 1390 1258 A 62 GLN H A 62 GLN HG3 1.0 . 5.20 1391 1259 A 62 GLN HA A 61 PHE HD% 1.0 . 4.78 1392 1260 A 63 ALA HB% A 64 HIS HA 1.0 . 5.13 1393 1261 A 64 HIS HA A 73 VAL HB 1.0 . 5.50 1394 1262 A 64 HIS HB3 A 72 LEU HB2 1.0 . 5.50 1395 1263 A 64 HIS HB3 A 96 TYR HB2 1.0 . 4.89 1396 1264 A 64 HIS HB3 A 96 TYR HB3 1.0 . 5.24 1397 1265 A 96 TYR HB3 A 64 HIS HB2 1.0 . 5.11 1398 1266 A 96 TYR HB2 A 64 HIS HB2 1.0 . 4.94 1399 1267 A 64 HIS HB3 A 65 TYR H 1.0 . 4.84 1400 1268 A 65 TYR HA A 95 ILE HG2% 1.0 . 4.78 1401 1269 A 65 TYR HB2 A 95 ILE HG2% 1.0 . 5.32 1402 1270 A 65 TYR HA A 95 ILE HB 1.0 . 5.09 1403 1271 A 96 TYR HE% A 65 TYR HA 1.0 . 4.82 1404 1272 A 65 TYR HD% A 65 TYR HA 1.0 . 4.47 1405 1273 A 67 ALA H A 66 ARG HG2 1.0 . 5.50 1406 1274 A 66 ARG H A 66 ARG HD3 1.0 . 5.25 1407 1275 A 66 ARG H A 66 ARG HD2 1.0 . 5.25 1408 1276 A 67 ALA H A 66 ARG HG3 1.0 . 5.50 1409 1277 A 65 TYR HE% A 67 ALA HA 1.0 . 4.49 1410 1278 A 67 ALA HB% A 70 GLY HA2 1.0 . 5.50 1411 1279 A 70 GLY HA2 A 66 ARG HD3 1.0 . 4.77 1412 1280 A 70 GLY HA3 A 66 ARG HD2 1.0 . 5.50 1413 1281 A 70 GLY HA2 A 66 ARG HD2 1.0 . 4.77 1414 1282 A 71 ASP HA A 72 LEU HB2 1.0 . 4.91 1415 1283 A 71 ASP HA A 72 LEU HG 1.0 . 5.50 1416 1284 A 64 HIS HB3 A 72 LEU HD1% 1.0 . 5.04 1417 1285 A 73 VAL H A 72 LEU HB2 1.0 . 5.00 1418 1286 A 74 ALA H A 72 LEU HA 1.0 . 5.50 1419 1287 A 98 LYS H A 10 LEU HA 1.0 . 5.50 1420 1288 A 67 ALA H A 72 LEU HA 1.0 . 4.71 1421 1289 A 73 VAL HA A 72 LEU HA 1.0 . 4.98 1422 1290 A 73 VAL HA A 74 ALA HA 1.0 . 5.35 1423 1291 A 72 LEU HA A 73 VAL HB 1.0 . 5.45 1424 1292 A 73 VAL HB A 74 ALA HA 1.0 . 5.50 1425 1293 A 74 ALA H A 73 VAL HG2% 1.0 . 4.29 1426 1294 A 74 ALA HB% A 64 HIS HB3 1.0 . 4.75 1427 1295 A 64 HIS HB3 A 74 ALA HA 1.0 . 4.53 1428 1296 A 64 HIS HB2 A 74 ALA HA 1.0 . 4.65 1429 1297 A 74 ALA HB% A 73 VAL H 1.0 . 5.50 1430 1298 A 77 SER HA A 42 CYS HB3 1.0 . 4.96 1431 1299 A 41 PRO HG2 A 78 ASP HB2 1.0 . 5.50 1432 1300 A 41 PRO HG2 A 78 ASP HB3 1.0 . 5.50 1433 1301 A 42 CYS HA A 78 ASP HA 1.0 . 5.25 1434 1302 A 80 GLU H A 79 GLU HG3 1.0 . 5.01 1435 1303 A 80 GLU H A 79 GLU HG2 1.0 . 5.01 1436 1304 A 80 GLU HA A 79 GLU HA 1.0 . 4.91 1437 1305 A 81 LEU HA A 81 LEU HD1% 1.0 . 3.97 1438 1306 A 81 LEU HB2 A 81 LEU HD2% 1.0 . 3.52 1439 1307 A 81 LEU H A 81 LEU HG 1.0 . 5.00 1440 1308 A 83 MET H A 81 LEU HA 1.0 . 4.70 1441 1309 A 81 LEU HB3 A 82 THR HB 1.0 . 5.29 1442 1310 A 83 MET HB2 A 82 THR HB 1.0 . 5.50 1443 1311 A 82 THR HG2% A 83 MET HGx 1.0 . 5.42 1444 1311 A 82 THR HG2% A 83 MET HGy 1.0 . 5.42 1445 1312 A 82 THR HA A 85 MET HGx 1.0 . 4.80 1446 1312 A 82 THR HA A 85 MET HGy 1.0 . 4.80 1447 1313 A 84 ALA HB% A 83 MET HB3 1.0 . 5.14 1448 1314 A 82 THR HG2% A 83 MET HB3 1.0 . 5.19 1449 1315 A 84 ALA HA A 83 MET HB3 1.0 . 4.68 1450 1316 A 84 ALA HA A 83 MET HGx 1.0 . 5.35 1451 1316 A 84 ALA HA A 83 MET HGy 1.0 . 5.35 1452 1317 A 82 THR H A 83 MET HB3 1.0 . 5.50 1453 1318 A 83 MET HB2 A 84 ALA HA 1.0 . 5.50 1454 1319 A 65 TYR HB2 A 84 ALA HA 1.0 . 4.89 1455 1320 A 65 TYR HE% A 84 ALA HA 1.0 . 4.66 1456 1321 A 65 TYR HD% A 84 ALA HA 1.0 . 4.98 1457 1322 A 84 ALA HB% A 87 TYR H 1.0 . 5.37 1458 1323 A 85 MET HA A 84 ALA HB% 1.0 . 4.95 1459 1324 A 85 MET HA A 88 VAL HB 1.0 . 4.52 1460 1325 A 86 SER HA A 87 TYR HA 1.0 . 4.88 1461 1326 A 87 TYR HE% A 87 TYR HA 1.0 . 5.02 1462 1327 A 42 CYS HA A 81 LEU HB2 1.0 . 5.20 1463 1328 A 90 ASP H A 88 VAL HG2% 1.0 . 5.04 1464 1329 A 44 ARG H A 42 CYS HA 1.0 . 5.50 1465 1330 A 90 ASP H A 88 VAL HA 1.0 . 5.50 1466 1331 A 93 PHE H A 88 VAL HG1% 1.0 . 5.31 1467 1332 A 93 PHE H A 88 VAL HG2% 1.0 . 5.31 1468 1333 A 9 TYR HB2 A 11 LEU HD1% 1.0 . 5.50 1469 1334 A 9 TYR HB2 A 11 LEU HD2% 1.0 . 5.50 1470 1335 A 91 ASP HA A 4 LEU HBx 1.0 . 4.97 1471 1335 A 4 LEU HBy A 91 ASP HA 1.0 . 4.97 1472 1336 A 92 ILE HG2% A 92 ILE HG13 1.0 . 3.77 1473 1337 A 92 ILE HG2% A 92 ILE HG12 1.0 . 3.35 1474 1338 A 92 ILE HG2% A 92 ILE HD1% 1.0 . 2.45 1475 1339 A 92 ILE HD1% A 7 LYS HEx 1.0 . 5.03 1476 1339 A 92 ILE HD1% A 7 LYS HEy 1.0 . 5.03 1477 1340 A 92 ILE HD1% A 90 ASP HB3 1.0 . 4.74 1478 1341 A 6 VAL HA A 93 PHE HB3 1.0 . 4.48 1479 1342 A 93 PHE H A 92 ILE HG12 1.0 . 4.91 1480 1343 A 5 THR H A 92 ILE HG12 1.0 . 5.50 1481 1344 A 91 ASP H A 92 ILE HG12 1.0 . 5.50 1482 1345 A 91 ASP H A 92 ILE HD1% 1.0 . 4.71 1483 1346 A 92 ILE H A 92 ILE HG12 1.0 . 4.67 1484 1347 A 93 PHE H A 92 ILE HG13 1.0 . 5.42 1485 1348 A 93 PHE HA A 92 ILE HB 1.0 . 5.13 1486 1349 A 92 ILE HG2% A 94 ARG HD2 1.0 . 5.50 1487 1350 A 92 ILE HG2% A 94 ARG HD3 1.0 . 5.50 1488 1351 A 94 ARG HA A 7 LYS HB3 1.0 . 5.04 1489 1352 A 94 ARG HA A 95 ILE HG1x 1.0 . 5.28 1490 1352 A 94 ARG HA A 95 ILE HG1y 1.0 . 5.28 1491 1353 A 94 ARG HA A 94 ARG HD2 1.0 . 5.50 1492 1354 A 94 ARG HA A 94 ARG HD3 1.0 . 5.50 1493 1355 A 93 PHE HA A 94 ARG HA 1.0 . 4.89 1494 1356 A 94 ARG H A 94 ARG HD2 1.0 . 4.87 1495 1357 A 95 ILE HA A 65 TYR HB3 1.0 . 5.04 1496 1358 A 94 ARG HA A 95 ILE HA 1.0 . 4.76 1497 1359 A 94 ARG HA A 95 ILE HG2% 1.0 . 4.59 1498 1360 A 95 ILE HG2% A 93 PHE HZ 1.0 . 4.47 1499 1361 A 93 PHE HE% A 95 ILE HB 1.0 . 5.50 1500 1362 A 96 TYR HB2 A 95 ILE HA 1.0 . 4.84 1501 1363 A 96 TYR H A 95 ILE HD1% 1.0 . 4.77 1502 1364 A 64 HIS H A 95 ILE HA 1.0 . 5.50 1503 1365 A 75 PHE HE% A 95 ILE HB 1.0 . 4.72 1504 1366 A 95 ILE HB A 75 PHE HZ 1.0 . 4.78 1505 1367 A 97 ILE HD1% A 96 TYR HA 1.0 . 4.61 1506 1368 A 96 TYR HA A 97 ILE HG1x 1.0 . 4.65 1507 1368 A 96 TYR HA A 97 ILE HG1y 1.0 . 4.65 1508 1369 A 96 TYR HA A 95 ILE HG1x 1.0 . 5.50 1509 1369 A 96 TYR HA A 95 ILE HG1y 1.0 . 5.50 1510 1370 A 96 TYR HA A 98 LYS HG3 1.0 . 5.50 1511 1371 A 97 ILE HG2% A 99 GLU HGx 1.0 . 5.50 1512 1371 A 97 ILE HG2% A 99 GLU HGy 1.0 . 5.50 1513 1372 A 97 ILE HD1% A 49 VAL HB 1.0 . 4.75 1514 1373 A 97 ILE HD1% A 61 PHE HB2 1.0 . 5.37 1515 1374 A 63 ALA HB% A 97 ILE HG1x 1.0 . 4.48 1516 1374 A 63 ALA HB% A 97 ILE HG1y 1.0 . 4.48 1517 1375 A 95 ILE HD1% A 97 ILE HG1x 1.0 . 4.52 1518 1375 A 97 ILE HG1y A 95 ILE HD1% 1.0 . 4.52 1519 1376 A 97 ILE HA A 95 ILE HD1% 1.0 . 5.50 1520 1377 A 63 ALA HB% A 97 ILE HA 1.0 . 4.49 1521 1378 A 10 LEU HG A 97 ILE HG2% 1.0 . 5.50 1522 1379 A 98 LYS HB3 A 97 ILE HA 1.0 . 5.50 1523 1380 A 96 TYR HA A 97 ILE HB 1.0 . 5.24 1524 1381 A 96 TYR HA A 97 ILE HA 1.0 . 5.06 1525 1382 A 97 ILE HD1% A 10 LEU HA 1.0 . 5.36 1526 1383 A 98 LYS H A 97 ILE HB 1.0 . 5.06 1527 1384 A 97 ILE HD1% A 61 PHE HE% 1.0 . 4.44 1528 1385 A 98 LYS HG2 A 98 LYS HE2 1.0 . 4.16 1529 1386 A 11 LEU HB3 A 98 LYS HE2 1.0 . 4.39 1530 1387 A 11 LEU HB3 A 98 LYS HE3 1.0 . 4.39 1531 1388 A 98 LYS HG3 A 98 LYS HD2 1.0 . 2.74 1532 1389 A 100 LYS HB3 A 100 LYS HDx 1.0 . 2.76 1533 1389 A 100 LYS HB3 A 100 LYS HDy 1.0 . 2.76 1534 1390 A 98 LYS HB3 A 98 LYS HD3 1.0 . 2.60 1535 1391 A 98 LYS HB3 A 98 LYS HD2 1.0 . 3.68 1536 1392 A 98 LYS HB2 A 98 LYS HE3 1.0 . 4.88 1537 1393 A 98 LYS HA A 98 LYS HD2 1.0 . 4.87 1538 1394 A 98 LYS HA A 98 LYS HD3 1.0 . 4.70 1539 1395 A 98 LYS HG3 A 99 GLU H 1.0 . 5.10 1540 1396 A 98 LYS H A 98 LYS HD2 1.0 . 5.50 1541 1397 A 99 GLU HGy A 56 LEU HD1% 1.0 . 5.22 1542 1397 A 56 LEU HD1% A 99 GLU HGx 1.0 . 5.22 1543 1398 A 99 GLU HA A 56 LEU HG 1.0 . 5.50 1544 1399 A 99 GLU HA A 56 LEU HB3 1.0 . 5.50 1545 1400 A 99 GLU HGy A 56 LEU HB3 1.0 . 5.21 1546 1400 A 56 LEU HB3 A 99 GLU HGx 1.0 . 5.21 1547 1401 A 98 LYS HG2 A 99 GLU HGx 1.0 . 5.50 1548 1401 A 98 LYS HG2 A 99 GLU HGy 1.0 . 5.50 1549 1402 A 56 LEU HG A 99 GLU HGx 1.0 . 5.03 1550 1402 A 56 LEU HG A 99 GLU HGy 1.0 . 5.03 1551 1403 A 98 LYS HD3 A 99 GLU HGx 1.0 . 5.50 1552 1403 A 99 GLU HGy A 98 LYS HD3 1.0 . 5.50 1553 1404 A 99 GLU HGy A 56 LEU HB2 1.0 . 5.21 1554 1404 A 56 LEU HB2 A 99 GLU HGx 1.0 . 5.21 1555 1405 A 61 PHE HB2 A 99 GLU HGx 1.0 . 5.39 1556 1405 A 61 PHE HB2 A 99 GLU HGy 1.0 . 5.39 1557 1406 A 61 PHE HB3 A 99 GLU HGx 1.0 . 5.50 1558 1406 A 61 PHE HB3 A 99 GLU HGy 1.0 . 5.50 1559 1407 A 99 GLU HA A 98 LYS HA 1.0 . 4.45 1560 1408 A 100 LYS HG2 A 100 LYS HEx 1.0 . 3.55 1561 1408 A 100 LYS HEy A 100 LYS HG2 1.0 . 3.55 1562 1409 A 82 THR HG2% A 83 MET HA 1.0 . 3.70 1563 1410 A 100 LYS HG3 A 100 LYS HA 1.0 . 4.02 1564 1411 A 100 LYS HA A 100 LYS HDx 1.0 . 4.09 1565 1411 A 100 LYS HA A 100 LYS HDy 1.0 . 4.09 1566 1412 A 100 LYS HB2 A 100 LYS HDx 1.0 . 3.24 1567 1412 A 100 LYS HB2 A 100 LYS HDy 1.0 . 3.24 1568 1413 A 100 LYS HB3 A 100 LYS HEx 1.0 . 3.72 1569 1413 A 100 LYS HEy A 100 LYS HB3 1.0 . 3.72 1570 1414 A 100 LYS HA A 100 LYS HEx 1.0 . 5.12 1571 1414 A 100 LYS HA A 100 LYS HEy 1.0 . 5.12 1572 1415 A 99 GLU HA A 100 LYS HG3 1.0 . 4.83 1573 1416 A 99 GLU HA A 100 LYS HG2 1.0 . 5.24 1574 1417 A 61 PHE HA A 100 LYS HDx 1.0 . 4.83 1575 1417 A 61 PHE HA A 100 LYS HDy 1.0 . 4.83 1576 1418 A 61 PHE HA A 100 LYS HEx 1.0 . 4.72 1577 1418 A 61 PHE HA A 100 LYS HEy 1.0 . 4.72 1578 1419 A 60 GLY HA3 A 100 LYS HDx 1.0 . 5.50 1579 1419 A 60 GLY HA3 A 100 LYS HDy 1.0 . 5.50 1580 1420 A 60 GLY HA3 A 100 LYS HEx 1.0 . 4.74 1581 1420 A 60 GLY HA3 A 100 LYS HEy 1.0 . 4.74 1582 1421 A 62 GLN H A 100 LYS HG3 1.0 . 5.02 1583 1422 A 62 GLN H A 100 LYS HG2 1.0 . 4.94 1584 1423 A 62 GLN H A 100 LYS HDx 1.0 . 5.50 1585 1423 A 62 GLN H A 100 LYS HDy 1.0 . 5.50 1586 1424 A 100 LYS H A 100 LYS HDx 1.0 . 4.64 1587 1424 A 100 LYS H A 100 LYS HDy 1.0 . 4.64 1588 1425 A 26 CYS HA A 3 SER HB3 1.0 . 5.50 1589 1426 A 26 CYS HA A 3 SER HB2 1.0 . 5.50 1590 1427 A 25 PHE H A 3 SER HA 1.0 . 4.74 1591 1428 A 6 VAL H A 4 LEU HBx 1.0 . 5.50 1592 1428 A 6 VAL H A 4 LEU HBy 1.0 . 5.50 1593 1429 A 93 PHE H A 4 LEU HBx 1.0 . 5.50 1594 1429 A 93 PHE H A 4 LEU HBy 1.0 . 5.50 1595 1430 A 9 TYR HB3 A 18 ARG H 1.0 . 5.50 1596 1431 A 10 LEU HA A 97 ILE HB 1.0 . 3.65 1597 1432 A 24 SER HA A 23 PHE HA 1.0 . 4.62 1598 1433 A 41 PRO HA A 40 GLY HA3 1.0 . 4.55 1599 1434 A 50 ALA HA A 53 PHE HBx 1.0 . 4.64 1600 1434 A 53 PHE HBy A 50 ALA HA 1.0 . 4.64 1601 1435 A 54 PRO HA A 53 PHE HA 1.0 . 4.85 1602 1436 A 75 PHE HE% A 64 HIS HA 1.0 . 4.71 1603 1437 A 62 GLN H A 98 LYS HB3 1.0 . 5.26 1604 1438 A 18 ARG HB3 A 19 GLU HA 1.0 . 5.06 1605 1439 A 25 PHE HB3 A 3 SER HA 1.0 . 5.21 1606 1440 A 3 SER HA A 26 CYS HB3 1.0 . 5.50 1607 1441 A 3 SER HA A 2 MET HA 1.0 . 4.78 1608 1442 A 27 PHE HD% A 4 LEU HD2% 1.0 . 4.31 1609 1443 A 5 THR HB A 92 ILE HD1% 1.0 . 4.43 1610 1444 A 24 SER HA A 5 THR HG2% 1.0 . 4.51 1611 1445 A 13 LYS HDy A 13 LYS HG2 1.0 . 2.97 1612 1445 A 13 LYS HG2 A 13 LYS HDx 1.0 . 2.97 1613 1446 A 89 LYS HEy A 89 LYS HG3 1.0 . 3.78 1614 1446 A 89 LYS HEx A 89 LYS HG3 1.0 . 3.78 1615 1447 A 89 LYS HG2 A 89 LYS HEx 1.0 . 3.78 1616 1447 A 89 LYS HEy A 89 LYS HG2 1.0 . 3.78 1617 1448 A 9 TYR HB2 A 8 ALA HA 1.0 . 5.07 1618 1449 A 53 PHE HE% A 8 ALA HA 1.0 . 4.82 1619 1450 A 8 ALA H A 22 ARG HDx 1.0 . 5.50 1620 1450 A 8 ALA H A 22 ARG HDy 1.0 . 5.50 1621 1451 A 22 ARG HA A 5 THR HG2% 1.0 . 4.92 1622 1452 A 22 ARG HA A 23 PHE HD% 1.0 . 5.04 1623 1453 A 29 PRO HD2 A 28 SER HB2 1.0 . 4.72 1624 1454 A 29 PRO HD2 A 28 SER HB3 1.0 . 4.72 1625 1455 A 39 PRO HB2 A 42 CYS HB2 1.0 . 5.50 1626 1456 A 39 PRO HB2 A 42 CYS HB3 1.0 . 5.50 1627 1457 A 43 GLU H A 43 GLU HG3 1.0 . 4.73 1628 1458 A 41 PRO HA A 44 ARG HDx 1.0 . 5.10 1629 1458 A 44 ARG HDy A 41 PRO HA 1.0 . 5.10 1630 1459 A 46 LEU HB3 A 47 SER HA 1.0 . 5.29 1631 1460 A 49 VAL HA A 50 ALA HA 1.0 . 5.34 1632 1461 A 49 VAL HA A 52 LEU HA 1.0 . 5.50 1633 1462 A 52 LEU HD1% A 49 VAL HG2% 1.0 . 4.71 1634 1463 A 52 LEU HD1% A 51 VAL HG1% 1.0 . 5.24 1635 1464 A 52 LEU HD1% A 51 VAL HG2% 1.0 . 5.24 1636 1465 A 57 ARG HB2 A 56 LEU HG 1.0 . 5.50 1637 1466 A 61 PHE HA A 100 LYS HB3 1.0 . 5.15 1638 1467 A 70 GLY HA3 A 66 ARG HD3 1.0 . 5.50 1639 1468 A 77 SER HA A 42 CYS HB2 1.0 . 4.96 1640 1469 A 98 LYS HG3 A 97 ILE HA 1.0 . 5.09 1641 1470 A 98 LYS HA A 11 LEU HB2 1.0 . 3.91 1642 1471 A 98 LYS HB2 A 11 LEU HB2 1.0 . 5.25 1643 1472 A 62 GLN HB3 A 98 LYS HB2 1.0 . 5.20 1644 1473 A 99 GLU HA A 56 LEU HB2 1.0 . 5.50 1645 1474 A 99 GLU HA A 100 LYS HB2 1.0 . 5.50 1646 1475 A 100 LYS HA A 99 GLU HGx 1.0 . 5.50 1647 1475 A 100 LYS HA A 99 GLU HGy 1.0 . 5.50 1648 1476 A 100 LYS HG2 A 62 GLN HG2 1.0 . 5.31 1649 1477 A 61 PHE H A 100 LYS HDx 1.0 . 5.03 1650 1477 A 61 PHE H A 100 LYS HDy 1.0 . 5.03 1651 1478 A 98 LYS H A 98 LYS HD3 1.0 . 5.50 1652 1479 A 62 GLN H A 100 LYS HB2 1.0 . 5.50 1653 1480 A 16 ALA HA A 15 GLU HBx 1.0 . 4.49 1654 1480 A 15 GLU HBy A 16 ALA HA 1.0 . 4.49 1655 1481 A 96 TYR HD% A 72 LEU HD1% 1.0 . 4.94 1656 1482 A 23 PHE H A 6 VAL HG2% 1.0 . 4.95 1657 1483 A 23 PHE H A 6 VAL HG1% 1.0 . 4.95 1658 1484 A 75 PHE HE% A 95 ILE HD1% 1.0 . 4.53 1659 1485 A 47 SER H A 43 GLU HA 1.0 . 4.59 1660 1486 A 62 GLN H A 97 ILE HA 1.0 . 5.23 1661 1487 A 96 TYR H A 97 ILE HA 1.0 . 5.29 1662 1488 A 65 TYR HD% A 67 ALA HA 1.0 . 5.11 1663 1489 A 68 GLU HG2 A 68 GLU HBx 1.0 . 2.99 1664 1489 A 68 GLU HBy A 68 GLU HG2 1.0 . 2.99 1665 1490 A 68 GLU HBx A 68 GLU HG3 1.0 . 2.99 1666 1490 A 68 GLU HBy A 68 GLU HG3 1.0 . 2.99 1667 1491 A 70 GLY H A 69 ARG HGx 1.0 . 5.30 1668 1491 A 70 GLY H A 69 ARG HGy 1.0 . 5.30 1669 1492 A 71 ASP H A 69 ARG HGx 1.0 . 5.50 1670 1492 A 71 ASP H A 69 ARG HGy 1.0 . 5.50 1671 1493 A 80 GLU H A 80 GLU HG3 1.0 . 5.13 1672 1494 A 65 TYR HE% A 73 VAL HG2% 1.0 . 5.00 1673 1495 A 75 PHE HD% A 74 ALA HA 1.0 . 4.75 1674 1496 A 75 PHE HA A 80 GLU HB2 1.0 . 5.50 1675 1497 A 75 PHE HA A 80 GLU HB3 1.0 . 5.50 1676 1498 A 80 GLU HA A 75 PHE HB2 1.0 . 4.90 1677 1499 A 45 LEU H A 45 LEU HG 1.0 . 4.83 1678 1500 A 23 PHE HE% A 45 LEU HA 1.0 . 4.42 1679 1501 A 75 PHE HD% A 76 SER HA 1.0 . 4.98 1680 1502 A 47 SER H A 44 ARG HA 1.0 . 4.02 1681 1503 A 3 SER H A 2 MET HE% 1.0 . 4.57 1682 1504 A 2 MET H A 2 MET HE% 1.0 . 4.86 1683 1505 A 83 MET HE% A 83 MET HGx 1.0 . 3.40 1684 1505 A 83 MET HGy A 83 MET HE% 1.0 . 3.40 1685 1506 A 87 TYR HE% A 83 MET HE% 1.0 . 5.10 1686 1507 A 83 MET H A 83 MET HE% 1.0 . 4.47 1687 1508 A 85 MET H A 85 MET HE% 1.0 . 4.76 1688 1509 A 85 MET H A 82 THR HA 1.0 . 4.52 1689 1510 A 5 THR HA A 24 SER HB2 1.0 . 5.50 1690 1511 A 5 THR HA A 24 SER HB3 1.0 . 5.50 1691 1512 A 22 ARG HA A 8 ALA HB% 1.0 . 4.57 1692 1513 A 22 ARG HDy A 22 ARG HB2 1.0 . 3.85 1693 1513 A 22 ARG HB2 A 22 ARG HDx 1.0 . 3.85 1694 1514 A 22 ARG HDy A 22 ARG HB3 1.0 . 3.85 1695 1514 A 22 ARG HB3 A 22 ARG HDx 1.0 . 3.85 1696 1515 A 18 ARG HB3 A 18 ARG HD2 1.0 . 4.10 1697 1516 A 20 ILE HD1% A 17 ALA HB% 1.0 . 3.38 1698 1517 A 20 ILE HD1% A 20 ILE HB 1.0 . 3.61 1699 1518 A 20 ILE HG2% A 20 ILE HG13 1.0 . 3.77 1700 1519 A 20 ILE HD1% A 20 ILE HA 1.0 . 3.94 1701 1520 A 49 VAL HA A 52 LEU HG 1.0 . 4.95 1702 1521 A 22 ARG HA A 22 ARG HDx 1.0 . 5.08 1703 1521 A 22 ARG HA A 22 ARG HDy 1.0 . 5.08 1704 1522 A 92 ILE HG2% A 22 ARG HDx 1.0 . 4.86 1705 1522 A 92 ILE HG2% A 22 ARG HDy 1.0 . 4.86 1706 1523 A 5 THR HG2% A 22 ARG HDx 1.0 . 4.31 1707 1523 A 5 THR HG2% A 22 ARG HDy 1.0 . 4.31 1708 1524 A 4 LEU H A 26 CYS HA 1.0 . 4.17 1709 1525 A 52 LEU HB3 A 52 LEU HD1% 1.0 . 3.78 1710 1526 A 61 PHE HD% A 56 LEU HD1% 1.0 . 5.06 1711 1527 A 78 ASP HA A 81 LEU HG 1.0 . 4.67 1712 1528 A 83 MET H A 79 GLU HA 1.0 . 4.98 1713 1529 A 82 THR H A 81 LEU HG 1.0 . 5.31 1714 1530 A 31 PRO HD3 A 30 GLU HA 1.0 . 2.83 1715 1531 A 20 ILE HD1% A 9 TYR HD% 1.0 . 3.81 1716 1532 A 87 TYR HD% A 84 ALA HA 1.0 . 3.42 1717 1533 A 65 TYR HD% A 75 PHE HD% 1.0 . 3.47 1718 1534 A 75 PHE HE% A 46 LEU HD1% 1.0 . 4.09 1719 1535 A 75 PHE HE% A 81 LEU HD1% 1.0 . 4.31 1720 1536 A 53 PHE HE% A 10 LEU HB3 1.0 . 4.34 1721 1537 A 9 TYR HE% A 94 ARG HB2 1.0 . 3.84 1722 1538 A 9 TYR HE% A 94 ARG HB3 1.0 . 3.84 1723 1539 A 20 ILE HD1% A 9 TYR HE% 1.0 . 3.58 1724 1540 A 94 ARG HA A 9 TYR HE% 1.0 . 4.04 1725 1541 A 9 TYR HD% A 8 ALA HA 1.0 . 4.23 1726 1542 A 9 TYR H A 9 TYR HE% 1.0 . 5.23 1727 1543 A 23 PHE H A 23 PHE HD% 1.0 . 4.41 1728 1544 A 52 LEU HD1% A 23 PHE HD% 1.0 . 4.11 1729 1545 A 27 PHE HD% A 27 PHE HA 1.0 . 4.23 1730 1546 A 52 LEU HB2 A 53 PHE HD% 1.0 . 4.42 1731 1547 A 53 PHE HE% A 97 ILE HG1x 1.0 . 4.49 1732 1547 A 53 PHE HE% A 97 ILE HG1y 1.0 . 4.49 1733 1548 A 53 PHE HE% A 52 LEU HB3 1.0 . 4.55 1734 1549 A 52 LEU HB3 A 53 PHE HD% 1.0 . 4.20 1735 1550 A 61 PHE HD% A 57 ARG HB2 1.0 . 5.50 1736 1551 A 62 GLN HB2 A 61 PHE HD% 1.0 . 5.50 1737 1552 A 97 ILE HG2% A 61 PHE HE% 1.0 . 5.34 1738 1553 A 61 PHE HD% A 99 GLU HA 1.0 . 4.75 1739 1554 A 61 PHE HD% A 61 PHE HA 1.0 . 4.25 1740 1555 A 61 PHE H A 61 PHE HD% 1.0 . 3.59 1741 1556 A 65 TYR HD% A 73 VAL HB 1.0 . 4.64 1742 1557 A 65 TYR HE% A 73 VAL HB 1.0 . 4.68 1743 1558 A 65 TYR HE% A 73 VAL HG1% 1.0 . 5.00 1744 1559 A 67 ALA HB% A 65 TYR HE% 1.0 . 4.21 1745 1560 A 65 TYR HE% A 75 PHE HB3 1.0 . 4.27 1746 1561 A 65 TYR HE% A 75 PHE HD% 1.0 . 4.34 1747 1562 A 64 HIS HA A 75 PHE HD% 1.0 . 4.14 1748 1563 A 67 ALA HB% A 87 TYR HE% 1.0 . 4.05 1749 1564 A 87 TYR HD% A 84 ALA HB% 1.0 . 4.41 1750 1565 A 87 TYR HE% A 83 MET HB3 1.0 . 4.60 1751 1566 A 87 TYR HE% A 83 MET HGx 1.0 . 4.76 1752 1566 A 87 TYR HE% A 83 MET HGy 1.0 . 4.76 1753 1567 A 87 TYR HE% A 84 ALA HA 1.0 . 3.93 1754 1568 A 87 TYR HE% A 67 ALA HA 1.0 . 4.00 1755 1569 A 87 TYR HD% A 67 ALA HA 1.0 . 4.13 1756 1570 A 96 TYR HE% A 11 LEU HD1% 1.0 . 4.95 1757 1571 A 96 TYR HE% A 11 LEU HD2% 1.0 . 4.95 1758 1572 A 96 TYR HE% A 94 ARG HB3 1.0 . 5.50 1759 1573 A 96 TYR HE% A 94 ARG HB2 1.0 . 5.50 1760 1574 A 96 TYR HD% A 96 TYR HA 1.0 . 4.51 1761 1575 A 96 TYR HD% A 9 TYR HB2 1.0 . 4.68 1762 1576 A 96 TYR HD% A 64 HIS HB2 1.0 . 4.97 1763 1577 A 75 PHE HD% A 75 PHE HZ 1.0 . 3.93 1764 1578 A 75 PHE HZ A 45 LEU HD2% 1.0 . 4.48 1765 1579 A 7 LYS HB3 A 9 TYR HE% 1.0 . 4.32 1766 1580 A 75 PHE HE% A 93 PHE HZ 1.0 . 4.78 1767 1581 A 75 PHE HE% A 65 TYR HD% 1.0 . 4.34 1768 1582 A 2 MET H A 27 PHE HB3 1.0 . 4.56 1769 1582 A 2 MET H A 27 PHE HB2 1.0 . 4.56 1770 1583 A 2 MET HA A 4 LEU HD2% 1.0 . 5.41 1771 1583 A 2 MET HA A 4 LEU HD1% 1.0 . 5.41 1772 1584 A 2 MET HE% A 2 MET HB3 1.0 . 2.68 1773 1584 A 2 MET HE% A 2 MET HB2 1.0 . 2.68 1774 1585 A 3 SER H A 2 MET HB3 1.0 . 3.86 1775 1585 A 3 SER H A 2 MET HB2 1.0 . 3.86 1776 1586 A 2 MET HB3 A 4 LEU HD2% 1.0 . 4.45 1777 1586 A 2 MET HB2 A 4 LEU HD2% 1.0 . 4.45 1778 1586 A 4 LEU HD1% A 2 MET HB3 1.0 . 4.45 1779 1586 A 4 LEU HD1% A 2 MET HB2 1.0 . 4.45 1780 1587 A 27 PHE H A 2 MET HB3 1.0 . 4.66 1781 1587 A 27 PHE H A 2 MET HB2 1.0 . 4.66 1782 1588 A 2 MET HB3 A 27 PHE HB3 1.0 . 4.93 1783 1588 A 2 MET HB2 A 27 PHE HB3 1.0 . 4.93 1784 1588 A 27 PHE HB2 A 2 MET HB3 1.0 . 4.93 1785 1588 A 27 PHE HB2 A 2 MET HB2 1.0 . 4.93 1786 1589 A 27 PHE HD% A 2 MET HB3 1.0 . 4.88 1787 1589 A 27 PHE HD% A 2 MET HB2 1.0 . 4.88 1788 1590 A 2 MET HE% A 2 MET HG3 1.0 . 3.57 1789 1590 A 2 MET HE% A 2 MET HG2 1.0 . 3.57 1790 1591 A 3 SER H A 2 MET HG3 1.0 . 4.46 1791 1591 A 3 SER H A 2 MET HG2 1.0 . 4.46 1792 1592 A 2 MET HG2 A 4 LEU HD2% 1.0 . 4.85 1793 1592 A 2 MET HG3 A 4 LEU HD2% 1.0 . 4.85 1794 1592 A 4 LEU HD1% A 2 MET HG3 1.0 . 4.85 1795 1592 A 4 LEU HD1% A 2 MET HG2 1.0 . 4.85 1796 1593 A 2 MET HE% A 4 LEU HD2% 1.0 . 3.77 1797 1593 A 2 MET HE% A 4 LEU HD1% 1.0 . 3.77 1798 1594 A 2 MET HE% A 27 PHE HB3 1.0 . 5.34 1799 1594 A 2 MET HE% A 27 PHE HB2 1.0 . 5.34 1800 1595 A 3 SER H A 4 LEU HD2% 1.0 . 4.51 1801 1595 A 3 SER H A 4 LEU HD1% 1.0 . 4.51 1802 1596 A 3 SER HA A 4 LEU HD2% 1.0 . 4.62 1803 1596 A 3 SER HA A 4 LEU HD1% 1.0 . 4.62 1804 1597 A 4 LEU H A 3 SER HB3 1.0 . 2.97 1805 1597 A 4 LEU H A 3 SER HB2 1.0 . 2.97 1806 1598 A 3 SER HB2 A 4 LEU HBx 1.0 . 5.34 1807 1598 A 3 SER HB3 A 4 LEU HBx 1.0 . 5.34 1808 1598 A 4 LEU HBy A 3 SER HB3 1.0 . 5.34 1809 1598 A 4 LEU HBy A 3 SER HB2 1.0 . 5.34 1810 1599 A 4 LEU HG A 3 SER HB3 1.0 . 5.34 1811 1599 A 4 LEU HG A 3 SER HB2 1.0 . 5.34 1812 1600 A 3 SER HB3 A 24 SER HB3 1.0 . 3.36 1813 1600 A 3 SER HB2 A 24 SER HB3 1.0 . 3.36 1814 1600 A 24 SER HB2 A 3 SER HB3 1.0 . 3.36 1815 1600 A 3 SER HB2 A 24 SER HB2 1.0 . 3.36 1816 1601 A 25 PHE H A 3 SER HB3 1.0 . 4.98 1817 1601 A 25 PHE H A 3 SER HB2 1.0 . 4.98 1818 1602 A 25 PHE HA A 3 SER HB3 1.0 . 5.34 1819 1602 A 25 PHE HA A 3 SER HB2 1.0 . 5.34 1820 1603 A 26 CYS HA A 3 SER HB3 1.0 . 4.65 1821 1603 A 26 CYS HA A 3 SER HB2 1.0 . 4.65 1822 1604 A 4 LEU H A 4 LEU HD2% 1.0 . 3.65 1823 1604 A 4 LEU H A 4 LEU HD1% 1.0 . 3.65 1824 1605 A 4 LEU HA A 4 LEU HD2% 1.0 . 3.73 1825 1605 A 4 LEU HA A 4 LEU HD1% 1.0 . 3.73 1826 1606 A 4 LEU HA A 91 ASP HB2 1.0 . 3.74 1827 1606 A 4 LEU HA A 91 ASP HB3 1.0 . 3.74 1828 1607 A 4 LEU HBx A 6 VAL HG2% 1.0 . 4.85 1829 1607 A 4 LEU HBy A 6 VAL HG2% 1.0 . 4.85 1830 1607 A 6 VAL HG1% A 4 LEU HBx 1.0 . 4.85 1831 1607 A 4 LEU HBy A 6 VAL HG1% 1.0 . 4.85 1832 1608 A 4 LEU HBx A 91 ASP HB2 1.0 . 4.79 1833 1608 A 4 LEU HBy A 91 ASP HB2 1.0 . 4.79 1834 1608 A 91 ASP HB3 A 4 LEU HBx 1.0 . 4.79 1835 1608 A 4 LEU HBy A 91 ASP HB3 1.0 . 4.79 1836 1609 A 25 PHE HE% A 4 LEU HD2% 1.0 . 5.09 1837 1609 A 25 PHE HE% A 4 LEU HD1% 1.0 . 5.09 1838 1610 A 27 PHE HA A 4 LEU HD2% 1.0 . 4.86 1839 1610 A 27 PHE HA A 4 LEU HD1% 1.0 . 4.86 1840 1611 A 4 LEU HD1% A 27 PHE HB3 1.0 . 3.16 1841 1611 A 4 LEU HD2% A 27 PHE HB3 1.0 . 3.16 1842 1611 A 27 PHE HB2 A 4 LEU HD2% 1.0 . 3.16 1843 1611 A 27 PHE HB2 A 4 LEU HD1% 1.0 . 3.16 1844 1612 A 27 PHE HD% A 4 LEU HD2% 1.0 . 3.68 1845 1612 A 27 PHE HD% A 4 LEU HD1% 1.0 . 3.68 1846 1613 A 27 PHE HE% A 4 LEU HD2% 1.0 . 4.22 1847 1613 A 27 PHE HE% A 4 LEU HD1% 1.0 . 4.22 1848 1614 A 85 MET HA A 4 LEU HD2% 1.0 . 5.44 1849 1614 A 85 MET HA A 4 LEU HD1% 1.0 . 5.44 1850 1615 A 4 LEU HD1% A 85 MET HB2 1.0 . 4.85 1851 1615 A 4 LEU HD2% A 85 MET HB2 1.0 . 4.85 1852 1615 A 85 MET HB3 A 4 LEU HD2% 1.0 . 4.85 1853 1615 A 4 LEU HD1% A 85 MET HB3 1.0 . 4.85 1854 1616 A 85 MET HE% A 4 LEU HD2% 1.0 . 2.94 1855 1616 A 85 MET HE% A 4 LEU HD1% 1.0 . 2.94 1856 1617 A 91 ASP HA A 4 LEU HD2% 1.0 . 3.97 1857 1617 A 91 ASP HA A 4 LEU HD1% 1.0 . 3.97 1858 1618 A 4 LEU HD1% A 91 ASP HB2 1.0 . 4.27 1859 1618 A 4 LEU HD2% A 91 ASP HB2 1.0 . 4.27 1860 1618 A 91 ASP HB3 A 4 LEU HD2% 1.0 . 4.27 1861 1618 A 4 LEU HD1% A 91 ASP HB3 1.0 . 4.27 1862 1619 A 5 THR H A 6 VAL HG2% 1.0 . 5.35 1863 1619 A 5 THR H A 6 VAL HG1% 1.0 . 5.35 1864 1620 A 5 THR H A 91 ASP HB2 1.0 . 3.76 1865 1620 A 5 THR H A 91 ASP HB3 1.0 . 3.76 1866 1621 A 5 THR HA A 6 VAL HG2% 1.0 . 3.66 1867 1621 A 5 THR HA A 6 VAL HG1% 1.0 . 3.66 1868 1622 A 5 THR HB A 22 ARG HB2 1.0 . 4.62 1869 1622 A 5 THR HB A 22 ARG HB3 1.0 . 4.62 1870 1623 A 5 THR HG2% A 6 VAL HG2% 1.0 . 5.10 1871 1623 A 5 THR HG2% A 6 VAL HG1% 1.0 . 5.10 1872 1624 A 5 THR HG2% A 22 ARG HB2 1.0 . 2.98 1873 1624 A 5 THR HG2% A 22 ARG HB3 1.0 . 2.98 1874 1625 A 5 THR HG2% A 22 ARG HG2 1.0 . 3.50 1875 1625 A 5 THR HG2% A 22 ARG HG3 1.0 . 3.50 1876 1626 A 6 VAL H A 6 VAL HG2% 1.0 . 3.10 1877 1626 A 6 VAL H A 6 VAL HG1% 1.0 . 3.10 1878 1627 A 6 VAL H A 22 ARG HB2 1.0 . 3.90 1879 1627 A 6 VAL H A 22 ARG HB3 1.0 . 3.90 1880 1628 A 7 LYS H A 6 VAL HG2% 1.0 . 3.39 1881 1628 A 7 LYS H A 6 VAL HG1% 1.0 . 3.39 1882 1629 A 8 ALA HA A 6 VAL HG2% 1.0 . 4.84 1883 1629 A 8 ALA HA A 6 VAL HG1% 1.0 . 4.84 1884 1630 A 23 PHE H A 6 VAL HG2% 1.0 . 4.36 1885 1630 A 23 PHE H A 6 VAL HG1% 1.0 . 4.36 1886 1631 A 23 PHE HD% A 6 VAL HG2% 1.0 . 4.77 1887 1631 A 23 PHE HD% A 6 VAL HG1% 1.0 . 4.77 1888 1632 A 23 PHE HE% A 6 VAL HG2% 1.0 . 2.70 1889 1632 A 23 PHE HE% A 6 VAL HG1% 1.0 . 2.70 1890 1633 A 24 SER HA A 6 VAL HG2% 1.0 . 4.96 1891 1633 A 24 SER HA A 6 VAL HG1% 1.0 . 4.96 1892 1634 A 25 PHE H A 6 VAL HG2% 1.0 . 4.55 1893 1634 A 25 PHE H A 6 VAL HG1% 1.0 . 4.55 1894 1635 A 25 PHE HA A 6 VAL HG2% 1.0 . 4.97 1895 1635 A 25 PHE HA A 6 VAL HG1% 1.0 . 4.97 1896 1636 A 25 PHE HB2 A 6 VAL HG2% 1.0 . 3.50 1897 1636 A 25 PHE HB2 A 6 VAL HG1% 1.0 . 3.50 1898 1637 A 25 PHE HB3 A 6 VAL HG2% 1.0 . 3.63 1899 1637 A 25 PHE HB3 A 6 VAL HG1% 1.0 . 3.63 1900 1638 A 6 VAL HG2% A 45 LEU HD2% 1.0 . 3.65 1901 1638 A 6 VAL HG1% A 45 LEU HD2% 1.0 . 3.65 1902 1638 A 45 LEU HD1% A 6 VAL HG2% 1.0 . 3.65 1903 1638 A 6 VAL HG1% A 45 LEU HD1% 1.0 . 3.65 1904 1639 A 85 MET HE% A 6 VAL HG2% 1.0 . 5.44 1905 1639 A 85 MET HE% A 6 VAL HG1% 1.0 . 5.44 1906 1640 A 93 PHE H A 6 VAL HG2% 1.0 . 4.61 1907 1640 A 93 PHE H A 6 VAL HG1% 1.0 . 4.61 1908 1641 A 93 PHE HB2 A 6 VAL HG2% 1.0 . 4.70 1909 1641 A 93 PHE HB2 A 6 VAL HG1% 1.0 . 4.70 1910 1642 A 93 PHE HB3 A 6 VAL HG2% 1.0 . 4.52 1911 1642 A 93 PHE HB3 A 6 VAL HG1% 1.0 . 4.52 1912 1643 A 94 ARG H A 6 VAL HG2% 1.0 . 5.13 1913 1643 A 94 ARG H A 6 VAL HG1% 1.0 . 5.13 1914 1644 A 94 ARG HA A 6 VAL HG2% 1.0 . 5.10 1915 1644 A 94 ARG HA A 6 VAL HG1% 1.0 . 5.10 1916 1645 A 95 ILE H A 6 VAL HG2% 1.0 . 5.44 1917 1645 A 95 ILE H A 6 VAL HG1% 1.0 . 5.44 1918 1646 A 6 VAL HG2% A 95 ILE HG1x 1.0 . 3.62 1919 1646 A 6 VAL HG1% A 95 ILE HG1x 1.0 . 3.62 1920 1646 A 95 ILE HG1y A 6 VAL HG2% 1.0 . 3.62 1921 1646 A 95 ILE HG1y A 6 VAL HG1% 1.0 . 3.62 1922 1647 A 95 ILE HD1% A 6 VAL HG2% 1.0 . 3.34 1923 1647 A 95 ILE HD1% A 6 VAL HG1% 1.0 . 3.34 1924 1648 A 7 LYS H A 7 LYS HG3 1.0 . 3.41 1925 1648 A 7 LYS H A 7 LYS HG2 1.0 . 3.41 1926 1649 A 7 LYS H A 22 ARG HB2 1.0 . 5.34 1927 1649 A 7 LYS H A 22 ARG HB3 1.0 . 5.34 1928 1650 A 7 LYS H A 94 ARG HB2 1.0 . 5.34 1929 1650 A 7 LYS H A 94 ARG HB3 1.0 . 5.34 1930 1651 A 7 LYS HA A 7 LYS HG3 1.0 . 3.71 1931 1651 A 7 LYS HA A 7 LYS HG2 1.0 . 3.71 1932 1652 A 7 LYS HB3 A 94 ARG HB2 1.0 . 5.34 1933 1652 A 7 LYS HB3 A 94 ARG HB3 1.0 . 5.34 1934 1653 A 7 LYS HG2 A 22 ARG HDx 1.0 . 3.99 1935 1653 A 7 LYS HG3 A 22 ARG HDx 1.0 . 3.99 1936 1653 A 22 ARG HDy A 7 LYS HG3 1.0 . 3.99 1937 1653 A 22 ARG HDy A 7 LYS HG2 1.0 . 3.99 1938 1654 A 9 TYR HB3 A 11 LEU HD2% 1.0 . 3.63 1939 1654 A 9 TYR HB3 A 11 LEU HD1% 1.0 . 3.63 1940 1655 A 9 TYR HE% A 94 ARG HB2 1.0 . 3.34 1941 1655 A 9 TYR HE% A 94 ARG HB3 1.0 . 3.34 1942 1656 A 9 TYR HE% A 94 ARG HD3 1.0 . 4.45 1943 1656 A 9 TYR HE% A 94 ARG HD2 1.0 . 4.45 1944 1657 A 10 LEU HA A 10 LEU HD2% 1.0 . 3.14 1945 1657 A 10 LEU HA A 10 LEU HD1% 1.0 . 3.14 1946 1658 A 10 LEU HB2 A 10 LEU HD2% 1.0 . 2.84 1947 1658 A 10 LEU HB2 A 10 LEU HD1% 1.0 . 2.84 1948 1659 A 10 LEU HB3 A 10 LEU HD2% 1.0 . 2.93 1949 1659 A 10 LEU HB3 A 10 LEU HD1% 1.0 . 2.93 1950 1660 A 10 LEU HB3 A 18 ARG HD3 1.0 . 5.34 1951 1660 A 10 LEU HB3 A 18 ARG HD2 1.0 . 5.34 1952 1661 A 10 LEU HB3 A 19 GLU HB2 1.0 . 4.36 1953 1661 A 10 LEU HB3 A 19 GLU HB3 1.0 . 4.36 1954 1662 A 11 LEU H A 10 LEU HD2% 1.0 . 3.16 1955 1662 A 11 LEU H A 10 LEU HD1% 1.0 . 3.16 1956 1663 A 11 LEU HG A 10 LEU HD2% 1.0 . 5.44 1957 1663 A 11 LEU HG A 10 LEU HD1% 1.0 . 5.44 1958 1664 A 10 LEU HD2% A 11 LEU HD2% 1.0 . 3.88 1959 1664 A 11 LEU HD1% A 10 LEU HD2% 1.0 . 3.88 1960 1664 A 11 LEU HD1% A 10 LEU HD1% 1.0 . 3.88 1961 1664 A 10 LEU HD1% A 11 LEU HD2% 1.0 . 3.88 1962 1665 A 18 ARG H A 10 LEU HD2% 1.0 . 4.70 1963 1665 A 18 ARG H A 10 LEU HD1% 1.0 . 4.70 1964 1666 A 18 ARG HB2 A 10 LEU HD2% 1.0 . 4.85 1965 1666 A 18 ARG HB2 A 10 LEU HD1% 1.0 . 4.85 1966 1667 A 18 ARG HB3 A 10 LEU HD2% 1.0 . 3.49 1967 1667 A 18 ARG HB3 A 10 LEU HD1% 1.0 . 3.49 1968 1668 A 10 LEU HD2% A 18 ARG HG2 1.0 . 4.87 1969 1668 A 10 LEU HD1% A 18 ARG HG2 1.0 . 4.87 1970 1668 A 18 ARG HG3 A 10 LEU HD2% 1.0 . 4.87 1971 1668 A 10 LEU HD1% A 18 ARG HG3 1.0 . 4.87 1972 1669 A 10 LEU HD1% A 18 ARG HD3 1.0 . 4.01 1973 1669 A 10 LEU HD2% A 18 ARG HD3 1.0 . 4.01 1974 1669 A 18 ARG HD2 A 10 LEU HD2% 1.0 . 4.01 1975 1669 A 10 LEU HD1% A 18 ARG HD2 1.0 . 4.01 1976 1670 A 10 LEU HD2% A 19 GLU HB2 1.0 . 3.65 1977 1670 A 10 LEU HD1% A 19 GLU HB2 1.0 . 3.65 1978 1670 A 19 GLU HB3 A 10 LEU HD2% 1.0 . 3.65 1979 1670 A 10 LEU HD1% A 19 GLU HB3 1.0 . 3.65 1980 1671 A 10 LEU HD2% A 19 GLU HG3 1.0 . 5.27 1981 1671 A 10 LEU HD1% A 19 GLU HG3 1.0 . 5.27 1982 1671 A 19 GLU HG2 A 10 LEU HD2% 1.0 . 5.27 1983 1671 A 10 LEU HD1% A 19 GLU HG2 1.0 . 5.27 1984 1672 A 10 LEU HD2% A 53 PHE HBx 1.0 . 4.20 1985 1672 A 10 LEU HD1% A 53 PHE HBx 1.0 . 4.20 1986 1672 A 53 PHE HBy A 10 LEU HD2% 1.0 . 4.20 1987 1672 A 53 PHE HBy A 10 LEU HD1% 1.0 . 4.20 1988 1673 A 53 PHE HD% A 10 LEU HD2% 1.0 . 3.72 1989 1673 A 53 PHE HD% A 10 LEU HD1% 1.0 . 3.72 1990 1674 A 53 PHE HE% A 10 LEU HD2% 1.0 . 4.52 1991 1674 A 53 PHE HE% A 10 LEU HD1% 1.0 . 4.52 1992 1675 A 10 LEU HD2% A 56 LEU HB2 1.0 . 4.07 1993 1675 A 10 LEU HD1% A 56 LEU HB2 1.0 . 4.07 1994 1675 A 56 LEU HB3 A 10 LEU HD2% 1.0 . 4.07 1995 1675 A 10 LEU HD1% A 56 LEU HB3 1.0 . 4.07 1996 1676 A 56 LEU HG A 10 LEU HD2% 1.0 . 4.58 1997 1676 A 56 LEU HG A 10 LEU HD1% 1.0 . 4.58 1998 1677 A 10 LEU HD1% A 56 LEU HD2% 1.0 . 3.46 1999 1677 A 10 LEU HD2% A 56 LEU HD2% 1.0 . 3.46 2000 1677 A 56 LEU HD1% A 10 LEU HD2% 1.0 . 3.46 2001 1677 A 10 LEU HD1% A 56 LEU HD1% 1.0 . 3.46 2002 1678 A 97 ILE HB A 10 LEU HD2% 1.0 . 3.94 2003 1678 A 97 ILE HB A 10 LEU HD1% 1.0 . 3.94 2004 1679 A 98 LYS HA A 10 LEU HD2% 1.0 . 3.86 2005 1679 A 98 LYS HA A 10 LEU HD1% 1.0 . 3.86 2006 1680 A 99 GLU H A 10 LEU HD2% 1.0 . 4.27 2007 1680 A 99 GLU H A 10 LEU HD1% 1.0 . 4.27 2008 1681 A 10 LEU HD1% A 99 GLU HGx 1.0 . 4.11 2009 1681 A 10 LEU HD2% A 99 GLU HGx 1.0 . 4.11 2010 1681 A 99 GLU HGy A 10 LEU HD2% 1.0 . 4.11 2011 1681 A 99 GLU HGy A 10 LEU HD1% 1.0 . 4.11 2012 1682 A 11 LEU HA A 11 LEU HD2% 1.0 . 2.98 2013 1682 A 11 LEU HA A 11 LEU HD1% 1.0 . 2.98 2014 1683 A 11 LEU HA A 12 GLY HA2 1.0 . 4.36 2015 1683 A 11 LEU HA A 12 GLY HA3 1.0 . 4.36 2016 1684 A 11 LEU HB2 A 12 GLY HA2 1.0 . 5.33 2017 1684 A 11 LEU HB2 A 12 GLY HA3 1.0 . 5.33 2018 1685 A 11 LEU HB3 A 11 LEU HD2% 1.0 . 2.98 2019 1685 A 11 LEU HB3 A 11 LEU HD1% 1.0 . 2.98 2020 1686 A 11 LEU HB3 A 12 GLY HA2 1.0 . 4.68 2021 1686 A 11 LEU HB3 A 12 GLY HA3 1.0 . 4.68 2022 1687 A 11 LEU HB3 A 98 LYS HE3 1.0 . 3.73 2023 1687 A 11 LEU HB3 A 98 LYS HE2 1.0 . 3.73 2024 1688 A 12 GLY H A 11 LEU HD2% 1.0 . 4.06 2025 1688 A 12 GLY H A 11 LEU HD1% 1.0 . 4.06 2026 1689 A 15 GLU H A 11 LEU HD2% 1.0 . 5.40 2027 1689 A 15 GLU H A 11 LEU HD1% 1.0 . 5.40 2028 1690 A 15 GLU HA A 11 LEU HD2% 1.0 . 3.24 2029 1690 A 15 GLU HA A 11 LEU HD1% 1.0 . 3.24 2030 1691 A 11 LEU HD2% A 15 GLU HBx 1.0 . 3.46 2031 1691 A 11 LEU HD1% A 15 GLU HBx 1.0 . 3.46 2032 1691 A 15 GLU HBy A 11 LEU HD2% 1.0 . 3.46 2033 1691 A 15 GLU HBy A 11 LEU HD1% 1.0 . 3.46 2034 1692 A 11 LEU HD2% A 15 GLU HG3 1.0 . 4.58 2035 1692 A 11 LEU HD1% A 15 GLU HG3 1.0 . 4.58 2036 1692 A 15 GLU HG2 A 11 LEU HD2% 1.0 . 4.58 2037 1692 A 11 LEU HD1% A 15 GLU HG2 1.0 . 4.58 2038 1693 A 16 ALA H A 11 LEU HD2% 1.0 . 4.67 2039 1693 A 16 ALA H A 11 LEU HD1% 1.0 . 4.67 2040 1694 A 16 ALA HA A 11 LEU HD2% 1.0 . 4.19 2041 1694 A 16 ALA HA A 11 LEU HD1% 1.0 . 4.19 2042 1695 A 17 ALA H A 11 LEU HD2% 1.0 . 4.22 2043 1695 A 17 ALA H A 11 LEU HD1% 1.0 . 4.22 2044 1696 A 17 ALA HA A 11 LEU HD2% 1.0 . 3.35 2045 1696 A 17 ALA HA A 11 LEU HD1% 1.0 . 3.35 2046 1697 A 18 ARG H A 11 LEU HD2% 1.0 . 4.28 2047 1697 A 18 ARG H A 11 LEU HD1% 1.0 . 4.28 2048 1698 A 11 LEU HD1% A 72 LEU HD2% 1.0 . 3.87 2049 1698 A 72 LEU HD1% A 11 LEU HD2% 1.0 . 3.87 2050 1698 A 11 LEU HD1% A 72 LEU HD1% 1.0 . 3.87 2051 1698 A 11 LEU HD2% A 72 LEU HD2% 1.0 . 3.87 2052 1699 A 96 TYR H A 11 LEU HD2% 1.0 . 5.39 2053 1699 A 96 TYR H A 11 LEU HD1% 1.0 . 5.39 2054 1700 A 96 TYR HA A 11 LEU HD2% 1.0 . 4.20 2055 1700 A 96 TYR HA A 11 LEU HD1% 1.0 . 4.20 2056 1701 A 96 TYR HB2 A 11 LEU HD2% 1.0 . 3.79 2057 1701 A 96 TYR HB2 A 11 LEU HD1% 1.0 . 3.79 2058 1702 A 96 TYR HB3 A 11 LEU HD2% 1.0 . 3.49 2059 1702 A 96 TYR HB3 A 11 LEU HD1% 1.0 . 3.49 2060 1703 A 96 TYR HD% A 11 LEU HD2% 1.0 . 2.53 2061 1703 A 96 TYR HD% A 11 LEU HD1% 1.0 . 2.53 2062 1704 A 96 TYR HE% A 11 LEU HD2% 1.0 . 4.32 2063 1704 A 96 TYR HE% A 11 LEU HD1% 1.0 . 4.32 2064 1705 A 97 ILE H A 11 LEU HD2% 1.0 . 4.26 2065 1705 A 97 ILE H A 11 LEU HD1% 1.0 . 4.26 2066 1706 A 97 ILE HA A 11 LEU HD2% 1.0 . 5.44 2067 1706 A 97 ILE HA A 11 LEU HD1% 1.0 . 5.44 2068 1707 A 98 LYS HA A 11 LEU HD2% 1.0 . 4.38 2069 1707 A 98 LYS HA A 11 LEU HD1% 1.0 . 4.38 2070 1708 A 98 LYS HB2 A 11 LEU HD2% 1.0 . 4.01 2071 1708 A 98 LYS HB2 A 11 LEU HD1% 1.0 . 4.01 2072 1709 A 98 LYS HG2 A 11 LEU HD2% 1.0 . 3.40 2073 1709 A 98 LYS HG2 A 11 LEU HD1% 1.0 . 3.40 2074 1710 A 98 LYS HG3 A 11 LEU HD2% 1.0 . 3.88 2075 1710 A 98 LYS HG3 A 11 LEU HD1% 1.0 . 3.88 2076 1711 A 98 LYS HD2 A 11 LEU HD2% 1.0 . 4.68 2077 1711 A 98 LYS HD2 A 11 LEU HD1% 1.0 . 4.68 2078 1712 A 11 LEU HD1% A 98 LYS HE3 1.0 . 3.71 2079 1712 A 11 LEU HD2% A 98 LYS HE3 1.0 . 3.71 2080 1712 A 98 LYS HE2 A 11 LEU HD2% 1.0 . 3.71 2081 1712 A 11 LEU HD1% A 98 LYS HE2 1.0 . 3.71 2082 1713 A 99 GLU H A 11 LEU HD2% 1.0 . 5.44 2083 1713 A 99 GLU H A 11 LEU HD1% 1.0 . 5.44 2084 1714 A 12 GLY H A 18 ARG HG2 1.0 . 4.99 2085 1714 A 12 GLY H A 18 ARG HG3 1.0 . 4.99 2086 1715 A 12 GLY H A 18 ARG HD3 1.0 . 5.34 2087 1715 A 12 GLY H A 18 ARG HD2 1.0 . 5.34 2088 1716 A 13 LYS HA A 12 GLY HA2 1.0 . 4.72 2089 1716 A 13 LYS HA A 12 GLY HA3 1.0 . 4.72 2090 1717 A 12 GLY HA3 A 13 LYS HB2 1.0 . 4.74 2091 1717 A 12 GLY HA2 A 13 LYS HB2 1.0 . 4.74 2092 1717 A 13 LYS HB3 A 12 GLY HA2 1.0 . 4.74 2093 1717 A 12 GLY HA3 A 13 LYS HB3 1.0 . 4.74 2094 1718 A 12 GLY HA2 A 18 ARG HG2 1.0 . 4.31 2095 1718 A 12 GLY HA3 A 18 ARG HG2 1.0 . 4.31 2096 1718 A 18 ARG HG3 A 12 GLY HA2 1.0 . 4.31 2097 1718 A 18 ARG HG3 A 12 GLY HA3 1.0 . 4.31 2098 1719 A 12 GLY HA3 A 18 ARG HD3 1.0 . 3.52 2099 1719 A 12 GLY HA2 A 18 ARG HD3 1.0 . 3.52 2100 1719 A 18 ARG HD2 A 12 GLY HA2 1.0 . 3.52 2101 1719 A 18 ARG HD2 A 12 GLY HA3 1.0 . 3.52 2102 1720 A 13 LYS HA A 13 LYS HG3 1.0 . 2.77 2103 1720 A 13 LYS HA A 13 LYS HG2 1.0 . 2.77 2104 1721 A 13 LYS HB2 A 13 LYS HDx 1.0 . 2.77 2105 1721 A 13 LYS HB3 A 13 LYS HDx 1.0 . 2.77 2106 1721 A 13 LYS HDy A 13 LYS HB2 1.0 . 2.77 2107 1721 A 13 LYS HDy A 13 LYS HB3 1.0 . 2.77 2108 1722 A 13 LYS HB2 A 13 LYS HEx 1.0 . 4.01 2109 1722 A 13 LYS HB3 A 13 LYS HEx 1.0 . 4.01 2110 1722 A 13 LYS HEy A 13 LYS HB2 1.0 . 4.01 2111 1722 A 13 LYS HEy A 13 LYS HB3 1.0 . 4.01 2112 1723 A 14 GLU H A 13 LYS HB2 1.0 . 4.08 2113 1723 A 14 GLU H A 13 LYS HB3 1.0 . 4.08 2114 1724 A 13 LYS HEx A 13 LYS HG3 1.0 . 2.86 2115 1724 A 13 LYS HEy A 13 LYS HG3 1.0 . 2.86 2116 1724 A 13 LYS HG2 A 13 LYS HEx 1.0 . 2.86 2117 1724 A 13 LYS HEy A 13 LYS HG2 1.0 . 2.86 2118 1725 A 13 LYS HG2 A 14 GLU HGx 1.0 . 4.42 2119 1725 A 14 GLU HGy A 13 LYS HG3 1.0 . 4.42 2120 1725 A 14 GLU HGy A 13 LYS HG2 1.0 . 4.42 2121 1725 A 13 LYS HG3 A 14 GLU HGx 1.0 . 4.42 2122 1726 A 15 GLU H A 15 GLU HG3 1.0 . 3.50 2123 1726 A 15 GLU H A 15 GLU HG2 1.0 . 3.50 2124 1727 A 15 GLU HA A 15 GLU HG3 1.0 . 2.62 2125 1727 A 15 GLU HA A 15 GLU HG2 1.0 . 2.62 2126 1728 A 16 ALA H A 15 GLU HG3 1.0 . 5.34 2127 1728 A 16 ALA H A 15 GLU HG2 1.0 . 5.34 2128 1729 A 18 ARG H A 18 ARG HG2 1.0 . 4.08 2129 1729 A 18 ARG H A 18 ARG HG3 1.0 . 4.08 2130 1730 A 18 ARG H A 18 ARG HD3 1.0 . 5.34 2131 1730 A 18 ARG H A 18 ARG HD2 1.0 . 5.34 2132 1731 A 18 ARG HA A 18 ARG HG2 1.0 . 3.11 2133 1731 A 18 ARG HA A 18 ARG HG3 1.0 . 3.11 2134 1732 A 18 ARG HA A 18 ARG HD3 1.0 . 4.21 2135 1732 A 18 ARG HA A 18 ARG HD2 1.0 . 4.21 2136 1733 A 18 ARG HA A 19 GLU HB2 1.0 . 5.30 2137 1733 A 18 ARG HA A 19 GLU HB3 1.0 . 5.30 2138 1734 A 18 ARG HB2 A 18 ARG HD3 1.0 . 3.38 2139 1734 A 18 ARG HB2 A 18 ARG HD2 1.0 . 3.38 2140 1735 A 18 ARG HB3 A 18 ARG HD3 1.0 . 3.46 2141 1735 A 18 ARG HB3 A 18 ARG HD2 1.0 . 3.46 2142 1736 A 18 ARG HB3 A 19 GLU HB2 1.0 . 3.62 2143 1736 A 18 ARG HB3 A 19 GLU HB3 1.0 . 3.62 2144 1737 A 18 ARG HD3 A 18 ARG HG2 1.0 . 2.18 2145 1737 A 18 ARG HD2 A 18 ARG HG2 1.0 . 2.18 2146 1737 A 18 ARG HG3 A 18 ARG HD3 1.0 . 2.18 2147 1737 A 18 ARG HD2 A 18 ARG HG3 1.0 . 2.18 2148 1738 A 19 GLU H A 18 ARG HG2 1.0 . 4.89 2149 1738 A 19 GLU H A 18 ARG HG3 1.0 . 4.89 2150 1739 A 18 ARG HD3 A 19 GLU HB2 1.0 . 5.18 2151 1739 A 18 ARG HD2 A 19 GLU HB2 1.0 . 5.18 2152 1739 A 19 GLU HB3 A 18 ARG HD3 1.0 . 5.18 2153 1739 A 18 ARG HD2 A 19 GLU HB3 1.0 . 5.18 2154 1740 A 19 GLU H A 19 GLU HG3 1.0 . 4.82 2155 1740 A 19 GLU H A 19 GLU HG2 1.0 . 4.82 2156 1741 A 19 GLU HA A 19 GLU HG3 1.0 . 3.68 2157 1741 A 19 GLU HA A 19 GLU HG2 1.0 . 3.68 2158 1742 A 53 PHE HE% A 19 GLU HB2 1.0 . 4.49 2159 1742 A 53 PHE HE% A 19 GLU HB3 1.0 . 4.49 2160 1743 A 20 ILE HG2% A 20 ILE HG13 1.0 . 3.17 2161 1743 A 20 ILE HG2% A 20 ILE HG12 1.0 . 3.17 2162 1744 A 52 LEU HD1% A 21 ARG HB2 1.0 . 4.43 2163 1744 A 52 LEU HD1% A 21 ARG HB3 1.0 . 4.43 2164 1745 A 52 LEU HD2% A 21 ARG HB2 1.0 . 4.14 2165 1745 A 52 LEU HD2% A 21 ARG HB3 1.0 . 4.14 2166 1746 A 52 LEU HD2% A 21 ARG HG2 1.0 . 3.32 2167 1746 A 52 LEU HD2% A 21 ARG HG3 1.0 . 3.32 2168 1747 A 22 ARG H A 22 ARG HB2 1.0 . 3.31 2169 1747 A 22 ARG H A 22 ARG HB3 1.0 . 3.31 2170 1748 A 22 ARG H A 22 ARG HG2 1.0 . 4.63 2171 1748 A 22 ARG H A 22 ARG HG3 1.0 . 4.63 2172 1749 A 22 ARG HA A 22 ARG HG2 1.0 . 3.67 2173 1749 A 22 ARG HA A 22 ARG HG3 1.0 . 3.67 2174 1750 A 22 ARG HB2 A 22 ARG HDx 1.0 . 3.30 2175 1750 A 22 ARG HB3 A 22 ARG HDx 1.0 . 3.30 2176 1750 A 22 ARG HDy A 22 ARG HB2 1.0 . 3.30 2177 1750 A 22 ARG HDy A 22 ARG HB3 1.0 . 3.30 2178 1751 A 23 PHE H A 22 ARG HB2 1.0 . 4.08 2179 1751 A 23 PHE H A 22 ARG HB3 1.0 . 4.08 2180 1752 A 23 PHE HA A 24 SER HB3 1.0 . 4.76 2181 1752 A 23 PHE HA A 24 SER HB2 1.0 . 4.76 2182 1753 A 23 PHE HB2 A 24 SER HB3 1.0 . 5.34 2183 1753 A 23 PHE HB2 A 24 SER HB2 1.0 . 5.34 2184 1754 A 23 PHE HE% A 45 LEU HD2% 1.0 . 3.01 2185 1754 A 23 PHE HE% A 45 LEU HD1% 1.0 . 3.01 2186 1755 A 25 PHE H A 24 SER HB3 1.0 . 3.83 2187 1755 A 25 PHE H A 24 SER HB2 1.0 . 3.83 2188 1756 A 25 PHE HA A 26 CYS HB3 1.0 . 4.50 2189 1756 A 25 PHE HA A 26 CYS HB2 1.0 . 4.50 2190 1757 A 26 CYS H A 26 CYS HB3 1.0 . 3.64 2191 1757 A 26 CYS H A 26 CYS HB2 1.0 . 3.64 2192 1758 A 27 PHE H A 26 CYS HB3 1.0 . 3.35 2193 1758 A 27 PHE H A 26 CYS HB2 1.0 . 3.35 2194 1759 A 28 SER H A 26 CYS HB3 1.0 . 4.69 2195 1759 A 28 SER H A 26 CYS HB2 1.0 . 4.69 2196 1760 A 27 PHE H A 28 SER HB3 1.0 . 5.00 2197 1760 A 27 PHE H A 28 SER HB2 1.0 . 5.00 2198 1761 A 28 SER H A 28 SER HB3 1.0 . 3.44 2199 1761 A 28 SER H A 28 SER HB2 1.0 . 3.44 2200 1762 A 28 SER HA A 29 PRO HG2 1.0 . 4.43 2201 1762 A 28 SER HA A 29 PRO HG3 1.0 . 4.43 2202 1763 A 29 PRO HA A 28 SER HB3 1.0 . 4.68 2203 1763 A 29 PRO HA A 28 SER HB2 1.0 . 4.68 2204 1764 A 28 SER HB3 A 29 PRO HG2 1.0 . 4.56 2205 1764 A 28 SER HB2 A 29 PRO HG2 1.0 . 4.56 2206 1764 A 29 PRO HG3 A 28 SER HB3 1.0 . 4.56 2207 1764 A 28 SER HB2 A 29 PRO HG3 1.0 . 4.56 2208 1765 A 30 GLU H A 28 SER HB3 1.0 . 3.38 2209 1765 A 30 GLU H A 28 SER HB2 1.0 . 3.38 2210 1766 A 28 SER HB3 A 30 GLU HGx 1.0 . 5.34 2211 1766 A 28 SER HB2 A 30 GLU HGx 1.0 . 5.34 2212 1766 A 30 GLU HGy A 28 SER HB3 1.0 . 5.34 2213 1766 A 30 GLU HGy A 28 SER HB2 1.0 . 5.34 2214 1767 A 30 GLU H A 29 PRO HB3 1.0 . 3.86 2215 1767 A 30 GLU H A 29 PRO HB2 1.0 . 3.86 2216 1768 A 30 GLU H A 29 PRO HG2 1.0 . 4.69 2217 1768 A 30 GLU H A 29 PRO HG3 1.0 . 4.69 2218 1769 A 30 GLU H A 30 GLU HB2 1.0 . 2.84 2219 1769 A 30 GLU H A 30 GLU HB3 1.0 . 2.84 2220 1770 A 30 GLU HB3 A 30 GLU HGx 1.0 . 2.39 2221 1770 A 30 GLU HGy A 30 GLU HB2 1.0 . 2.39 2222 1770 A 30 GLU HGy A 30 GLU HB3 1.0 . 2.39 2223 1770 A 30 GLU HB2 A 30 GLU HGx 1.0 . 2.39 2224 1771 A 31 PRO HD2 A 30 GLU HB2 1.0 . 3.44 2225 1771 A 31 PRO HD2 A 30 GLU HB3 1.0 . 3.44 2226 1772 A 31 PRO HD3 A 30 GLU HB2 1.0 . 4.22 2227 1772 A 31 PRO HD3 A 30 GLU HB3 1.0 . 4.22 2228 1773 A 32 GLU H A 31 PRO HB2 1.0 . 4.08 2229 1773 A 32 GLU H A 31 PRO HB3 1.0 . 4.08 2230 1774 A 31 PRO HB3 A 44 ARG HGx 1.0 . 3.76 2231 1774 A 44 ARG HGy A 31 PRO HB2 1.0 . 3.76 2232 1774 A 44 ARG HGy A 31 PRO HB3 1.0 . 3.76 2233 1774 A 31 PRO HB2 A 44 ARG HGx 1.0 . 3.76 2234 1775 A 31 PRO HB3 A 44 ARG HDx 1.0 . 3.35 2235 1775 A 31 PRO HB2 A 44 ARG HDx 1.0 . 3.35 2236 1775 A 44 ARG HDy A 31 PRO HB2 1.0 . 3.35 2237 1775 A 44 ARG HDy A 31 PRO HB3 1.0 . 3.35 2238 1776 A 32 GLU H A 31 PRO HG3 1.0 . 4.46 2239 1776 A 32 GLU H A 31 PRO HG2 1.0 . 4.46 2240 1777 A 40 GLY HA3 A 31 PRO HG3 1.0 . 5.18 2241 1777 A 40 GLY HA3 A 31 PRO HG2 1.0 . 5.18 2242 1778 A 31 PRO HG3 A 44 ARG HGx 1.0 . 3.35 2243 1778 A 31 PRO HG2 A 44 ARG HGx 1.0 . 3.35 2244 1778 A 44 ARG HGy A 31 PRO HG3 1.0 . 3.35 2245 1778 A 44 ARG HGy A 31 PRO HG2 1.0 . 3.35 2246 1779 A 31 PRO HG2 A 44 ARG HDx 1.0 . 4.34 2247 1779 A 31 PRO HG3 A 44 ARG HDx 1.0 . 4.34 2248 1779 A 44 ARG HDy A 31 PRO HG3 1.0 . 4.34 2249 1779 A 44 ARG HDy A 31 PRO HG2 1.0 . 4.34 2250 1780 A 32 GLU H A 32 GLU HB2 1.0 . 3.05 2251 1780 A 32 GLU H A 32 GLU HB3 1.0 . 3.05 2252 1781 A 32 GLU H A 32 GLU HG3 1.0 . 4.58 2253 1781 A 32 GLU H A 32 GLU HG2 1.0 . 4.58 2254 1782 A 32 GLU HA A 32 GLU HG3 1.0 . 3.18 2255 1782 A 32 GLU HA A 32 GLU HG2 1.0 . 3.18 2256 1783 A 33 ALA H A 32 GLU HB2 1.0 . 3.85 2257 1783 A 33 ALA H A 32 GLU HB3 1.0 . 3.85 2258 1784 A 35 ALA HA A 32 GLU HB2 1.0 . 5.34 2259 1784 A 35 ALA HA A 32 GLU HB3 1.0 . 5.34 2260 1785 A 35 ALA HB% A 32 GLU HB2 1.0 . 4.28 2261 1785 A 35 ALA HB% A 32 GLU HB3 1.0 . 4.28 2262 1786 A 36 ALA H A 32 GLU HB2 1.0 . 3.68 2263 1786 A 36 ALA H A 32 GLU HB3 1.0 . 3.68 2264 1787 A 36 ALA HA A 32 GLU HB2 1.0 . 4.10 2265 1787 A 36 ALA HA A 32 GLU HB3 1.0 . 4.10 2266 1788 A 36 ALA HB% A 32 GLU HB2 1.0 . 4.68 2267 1788 A 36 ALA HB% A 32 GLU HB3 1.0 . 4.68 2268 1789 A 33 ALA H A 32 GLU HG3 1.0 . 4.76 2269 1789 A 33 ALA H A 32 GLU HG2 1.0 . 4.76 2270 1790 A 35 ALA H A 32 GLU HG3 1.0 . 4.86 2271 1790 A 35 ALA H A 32 GLU HG2 1.0 . 4.86 2272 1791 A 35 ALA HA A 32 GLU HG3 1.0 . 5.34 2273 1791 A 35 ALA HA A 32 GLU HG2 1.0 . 5.34 2274 1792 A 35 ALA HB% A 32 GLU HG3 1.0 . 4.15 2275 1792 A 35 ALA HB% A 32 GLU HG2 1.0 . 4.15 2276 1793 A 36 ALA H A 32 GLU HG3 1.0 . 3.04 2277 1793 A 36 ALA H A 32 GLU HG2 1.0 . 3.04 2278 1794 A 36 ALA HA A 32 GLU HG3 1.0 . 5.34 2279 1794 A 36 ALA HA A 32 GLU HG2 1.0 . 5.34 2280 1795 A 36 ALA HB% A 32 GLU HG3 1.0 . 4.33 2281 1795 A 36 ALA HB% A 32 GLU HG2 1.0 . 4.33 2282 1796 A 33 ALA HB% A 34 GLU HG3 1.0 . 4.53 2283 1796 A 33 ALA HB% A 34 GLU HG2 1.0 . 4.53 2284 1797 A 34 GLU H A 34 GLU HG3 1.0 . 3.17 2285 1797 A 34 GLU H A 34 GLU HG2 1.0 . 3.17 2286 1798 A 34 GLU HA A 34 GLU HG3 1.0 . 2.73 2287 1798 A 34 GLU HA A 34 GLU HG2 1.0 . 2.73 2288 1799 A 38 GLY HA3 A 39 PRO HG3 1.0 . 4.45 2289 1799 A 38 GLY HA3 A 39 PRO HG2 1.0 . 4.45 2290 1800 A 39 PRO HA A 42 CYS HB3 1.0 . 4.99 2291 1800 A 39 PRO HA A 42 CYS HB2 1.0 . 4.99 2292 1801 A 39 PRO HB2 A 41 PRO HD3 1.0 . 4.93 2293 1801 A 39 PRO HB2 A 41 PRO HD2 1.0 . 4.93 2294 1802 A 39 PRO HB2 A 42 CYS HB3 1.0 . 4.70 2295 1802 A 39 PRO HB2 A 42 CYS HB2 1.0 . 4.70 2296 1803 A 40 GLY H A 39 PRO HG3 1.0 . 4.31 2297 1803 A 40 GLY H A 39 PRO HG2 1.0 . 4.31 2298 1804 A 40 GLY H A 41 PRO HD3 1.0 . 3.71 2299 1804 A 40 GLY H A 41 PRO HD2 1.0 . 3.71 2300 1805 A 41 PRO HA A 44 ARG HB2 1.0 . 3.85 2301 1805 A 41 PRO HA A 44 ARG HB3 1.0 . 3.85 2302 1806 A 41 PRO HA A 81 LEU HD2% 1.0 . 5.44 2303 1806 A 41 PRO HA A 81 LEU HD1% 1.0 . 5.44 2304 1807 A 41 PRO HB2 A 42 CYS HB3 1.0 . 5.34 2305 1807 A 41 PRO HB2 A 42 CYS HB2 1.0 . 5.34 2306 1808 A 41 PRO HB2 A 81 LEU HD2% 1.0 . 3.58 2307 1808 A 41 PRO HB2 A 81 LEU HD1% 1.0 . 3.58 2308 1809 A 41 PRO HG2 A 78 ASP HB2 1.0 . 4.83 2309 1809 A 41 PRO HG2 A 78 ASP HB3 1.0 . 4.83 2310 1810 A 41 PRO HG2 A 81 LEU HD2% 1.0 . 3.36 2311 1810 A 41 PRO HG2 A 81 LEU HD1% 1.0 . 3.36 2312 1811 A 42 CYS H A 41 PRO HD3 1.0 . 3.55 2313 1811 A 42 CYS H A 41 PRO HD2 1.0 . 3.55 2314 1812 A 78 ASP HA A 41 PRO HD3 1.0 . 4.75 2315 1812 A 78 ASP HA A 41 PRO HD2 1.0 . 4.75 2316 1813 A 42 CYS H A 42 CYS HB3 1.0 . 3.51 2317 1813 A 42 CYS H A 42 CYS HB2 1.0 . 3.51 2318 1814 A 42 CYS H A 78 ASP HB2 1.0 . 3.91 2319 1814 A 42 CYS H A 78 ASP HB3 1.0 . 3.91 2320 1815 A 42 CYS H A 81 LEU HD2% 1.0 . 3.15 2321 1815 A 42 CYS H A 81 LEU HD1% 1.0 . 3.15 2322 1816 A 42 CYS HA A 42 CYS HB3 1.0 . 2.31 2323 1816 A 42 CYS HA A 42 CYS HB2 1.0 . 2.31 2324 1817 A 42 CYS HA A 45 LEU HD2% 1.0 . 4.23 2325 1817 A 42 CYS HA A 45 LEU HD1% 1.0 . 4.23 2326 1818 A 42 CYS HA A 46 LEU HD2% 1.0 . 4.17 2327 1818 A 42 CYS HA A 46 LEU HD1% 1.0 . 4.17 2328 1819 A 42 CYS HA A 81 LEU HD2% 1.0 . 3.35 2329 1819 A 42 CYS HA A 81 LEU HD1% 1.0 . 3.35 2330 1820 A 43 GLU H A 42 CYS HB3 1.0 . 3.00 2331 1820 A 43 GLU H A 42 CYS HB2 1.0 . 3.00 2332 1821 A 42 CYS HB2 A 43 GLU HB2 1.0 . 4.68 2333 1821 A 42 CYS HB3 A 43 GLU HB2 1.0 . 4.68 2334 1821 A 43 GLU HB3 A 42 CYS HB3 1.0 . 4.68 2335 1821 A 42 CYS HB2 A 43 GLU HB3 1.0 . 4.68 2336 1822 A 46 LEU HG A 42 CYS HB3 1.0 . 5.34 2337 1822 A 46 LEU HG A 42 CYS HB2 1.0 . 5.34 2338 1823 A 42 CYS HB2 A 46 LEU HD2% 1.0 . 4.81 2339 1823 A 42 CYS HB3 A 46 LEU HD2% 1.0 . 4.81 2340 1823 A 46 LEU HD1% A 42 CYS HB3 1.0 . 4.81 2341 1823 A 42 CYS HB2 A 46 LEU HD1% 1.0 . 4.81 2342 1824 A 77 SER HA A 42 CYS HB3 1.0 . 4.31 2343 1824 A 77 SER HA A 42 CYS HB2 1.0 . 4.31 2344 1825 A 78 ASP HA A 42 CYS HB3 1.0 . 3.93 2345 1825 A 78 ASP HA A 42 CYS HB2 1.0 . 3.93 2346 1826 A 81 LEU HB2 A 42 CYS HB3 1.0 . 5.18 2347 1826 A 81 LEU HB2 A 42 CYS HB2 1.0 . 5.18 2348 1827 A 81 LEU HB3 A 42 CYS HB3 1.0 . 5.34 2349 1827 A 81 LEU HB3 A 42 CYS HB2 1.0 . 5.34 2350 1828 A 42 CYS HB2 A 81 LEU HD2% 1.0 . 3.64 2351 1828 A 81 LEU HD1% A 42 CYS HB3 1.0 . 3.64 2352 1828 A 42 CYS HB2 A 81 LEU HD1% 1.0 . 3.64 2353 1828 A 42 CYS HB3 A 81 LEU HD2% 1.0 . 3.64 2354 1829 A 43 GLU H A 43 GLU HB2 1.0 . 2.59 2355 1829 A 43 GLU H A 43 GLU HB3 1.0 . 2.59 2356 1830 A 43 GLU H A 43 GLU HG3 1.0 . 3.95 2357 1830 A 43 GLU H A 43 GLU HG2 1.0 . 3.95 2358 1831 A 43 GLU HA A 43 GLU HG3 1.0 . 3.61 2359 1831 A 43 GLU HA A 43 GLU HG2 1.0 . 3.61 2360 1832 A 43 GLU HA A 46 LEU HD2% 1.0 . 3.68 2361 1832 A 43 GLU HA A 46 LEU HD1% 1.0 . 3.68 2362 1833 A 44 ARG H A 43 GLU HG3 1.0 . 5.03 2363 1833 A 44 ARG H A 43 GLU HG2 1.0 . 5.03 2364 1834 A 44 ARG HA A 43 GLU HG3 1.0 . 3.59 2365 1834 A 44 ARG HA A 43 GLU HG2 1.0 . 3.59 2366 1835 A 44 ARG H A 44 ARG HB2 1.0 . 3.26 2367 1835 A 44 ARG H A 44 ARG HB3 1.0 . 3.26 2368 1836 A 44 ARG HB3 A 44 ARG HDx 1.0 . 3.38 2369 1836 A 44 ARG HB2 A 44 ARG HDx 1.0 . 3.38 2370 1836 A 44 ARG HDy A 44 ARG HB2 1.0 . 3.38 2371 1836 A 44 ARG HDy A 44 ARG HB3 1.0 . 3.38 2372 1837 A 45 LEU H A 44 ARG HB2 1.0 . 4.18 2373 1837 A 45 LEU H A 44 ARG HB3 1.0 . 4.18 2374 1838 A 45 LEU HA A 44 ARG HB2 1.0 . 4.49 2375 1838 A 45 LEU HA A 44 ARG HB3 1.0 . 4.49 2376 1839 A 45 LEU HB2 A 44 ARG HB2 1.0 . 4.72 2377 1839 A 45 LEU HB2 A 44 ARG HB3 1.0 . 4.72 2378 1840 A 45 LEU HB3 A 44 ARG HB2 1.0 . 4.82 2379 1840 A 45 LEU HB3 A 44 ARG HB3 1.0 . 4.82 2380 1841 A 45 LEU H A 45 LEU HD2% 1.0 . 3.86 2381 1841 A 45 LEU H A 45 LEU HD1% 1.0 . 3.86 2382 1842 A 45 LEU HA A 45 LEU HD2% 1.0 . 3.17 2383 1842 A 45 LEU HA A 45 LEU HD1% 1.0 . 3.17 2384 1843 A 45 LEU HA A 46 LEU HD2% 1.0 . 5.44 2385 1843 A 45 LEU HA A 46 LEU HD1% 1.0 . 5.44 2386 1844 A 45 LEU HB3 A 45 LEU HD2% 1.0 . 2.70 2387 1844 A 45 LEU HB3 A 45 LEU HD1% 1.0 . 2.70 2388 1845 A 45 LEU HB3 A 46 LEU HD2% 1.0 . 4.17 2389 1845 A 45 LEU HB3 A 46 LEU HD1% 1.0 . 4.17 2390 1846 A 45 LEU HG A 46 LEU HD2% 1.0 . 4.17 2391 1846 A 45 LEU HG A 46 LEU HD1% 1.0 . 4.17 2392 1847 A 46 LEU H A 45 LEU HD2% 1.0 . 3.58 2393 1847 A 46 LEU H A 45 LEU HD1% 1.0 . 3.58 2394 1848 A 46 LEU HA A 45 LEU HD2% 1.0 . 3.70 2395 1848 A 46 LEU HA A 45 LEU HD1% 1.0 . 3.70 2396 1849 A 45 LEU HD2% A 46 LEU HD2% 1.0 . 3.32 2397 1849 A 45 LEU HD1% A 46 LEU HD2% 1.0 . 3.32 2398 1849 A 46 LEU HD1% A 45 LEU HD2% 1.0 . 3.32 2399 1849 A 45 LEU HD1% A 46 LEU HD1% 1.0 . 3.32 2400 1850 A 48 ARG H A 45 LEU HD2% 1.0 . 4.45 2401 1850 A 48 ARG H A 45 LEU HD1% 1.0 . 4.45 2402 1851 A 48 ARG HB2 A 45 LEU HD2% 1.0 . 4.20 2403 1851 A 48 ARG HB2 A 45 LEU HD1% 1.0 . 4.20 2404 1852 A 61 PHE HE% A 45 LEU HD2% 1.0 . 5.13 2405 1852 A 61 PHE HE% A 45 LEU HD1% 1.0 . 5.13 2406 1853 A 75 PHE HE% A 45 LEU HD2% 1.0 . 2.79 2407 1853 A 75 PHE HE% A 45 LEU HD1% 1.0 . 2.79 2408 1854 A 75 PHE HZ A 45 LEU HD2% 1.0 . 3.52 2409 1854 A 75 PHE HZ A 45 LEU HD1% 1.0 . 3.52 2410 1855 A 45 LEU HD2% A 81 LEU HD2% 1.0 . 2.50 2411 1855 A 45 LEU HD1% A 81 LEU HD2% 1.0 . 2.50 2412 1855 A 81 LEU HD1% A 45 LEU HD2% 1.0 . 2.50 2413 1855 A 45 LEU HD1% A 81 LEU HD1% 1.0 . 2.50 2414 1856 A 93 PHE HE% A 45 LEU HD2% 1.0 . 4.51 2415 1856 A 93 PHE HE% A 45 LEU HD1% 1.0 . 4.51 2416 1857 A 95 ILE HG2% A 45 LEU HD2% 1.0 . 3.90 2417 1857 A 95 ILE HG2% A 45 LEU HD1% 1.0 . 3.90 2418 1858 A 95 ILE HD1% A 45 LEU HD2% 1.0 . 2.87 2419 1858 A 95 ILE HD1% A 45 LEU HD1% 1.0 . 2.87 2420 1859 A 46 LEU H A 46 LEU HD2% 1.0 . 3.37 2421 1859 A 46 LEU H A 46 LEU HD1% 1.0 . 3.37 2422 1860 A 46 LEU HA A 46 LEU HD2% 1.0 . 2.81 2423 1860 A 46 LEU HA A 46 LEU HD1% 1.0 . 2.81 2424 1861 A 47 SER H A 46 LEU HD2% 1.0 . 4.60 2425 1861 A 47 SER H A 46 LEU HD1% 1.0 . 4.60 2426 1862 A 49 VAL HB A 46 LEU HD2% 1.0 . 3.68 2427 1862 A 49 VAL HB A 46 LEU HD1% 1.0 . 3.68 2428 1863 A 49 VAL HG1% A 46 LEU HD2% 1.0 . 4.17 2429 1863 A 49 VAL HG1% A 46 LEU HD1% 1.0 . 4.17 2430 1864 A 49 VAL HG2% A 46 LEU HD2% 1.0 . 4.03 2431 1864 A 49 VAL HG2% A 46 LEU HD1% 1.0 . 4.03 2432 1865 A 50 ALA H A 46 LEU HD2% 1.0 . 5.44 2433 1865 A 50 ALA H A 46 LEU HD1% 1.0 . 5.44 2434 1866 A 61 PHE HE% A 46 LEU HD2% 1.0 . 3.33 2435 1866 A 61 PHE HE% A 46 LEU HD1% 1.0 . 3.33 2436 1867 A 61 PHE HZ A 46 LEU HD2% 1.0 . 3.02 2437 1867 A 61 PHE HZ A 46 LEU HD1% 1.0 . 3.02 2438 1868 A 62 GLN HE22 A 46 LEU HD2% 1.0 . 5.00 2439 1868 A 62 GLN HE22 A 46 LEU HD1% 1.0 . 5.00 2440 1869 A 63 ALA H A 46 LEU HD2% 1.0 . 4.31 2441 1869 A 63 ALA H A 46 LEU HD1% 1.0 . 4.31 2442 1870 A 63 ALA HB% A 46 LEU HD2% 1.0 . 2.47 2443 1870 A 63 ALA HB% A 46 LEU HD1% 1.0 . 2.47 2444 1871 A 75 PHE HD% A 46 LEU HD2% 1.0 . 4.43 2445 1871 A 75 PHE HD% A 46 LEU HD1% 1.0 . 4.43 2446 1872 A 75 PHE HE% A 46 LEU HD2% 1.0 . 3.44 2447 1872 A 75 PHE HE% A 46 LEU HD1% 1.0 . 3.44 2448 1873 A 75 PHE HZ A 46 LEU HD2% 1.0 . 4.22 2449 1873 A 75 PHE HZ A 46 LEU HD1% 1.0 . 4.22 2450 1874 A 76 SER HA A 46 LEU HD2% 1.0 . 3.32 2451 1874 A 76 SER HA A 46 LEU HD1% 1.0 . 3.32 2452 1875 A 46 LEU HD2% A 76 SER HBx 1.0 . 4.86 2453 1875 A 46 LEU HD1% A 76 SER HBx 1.0 . 4.86 2454 1875 A 76 SER HBy A 46 LEU HD2% 1.0 . 4.86 2455 1875 A 76 SER HBy A 46 LEU HD1% 1.0 . 4.86 2456 1876 A 97 ILE HG2% A 46 LEU HD2% 1.0 . 4.93 2457 1876 A 97 ILE HG2% A 46 LEU HD1% 1.0 . 4.93 2458 1877 A 97 ILE HD1% A 46 LEU HD2% 1.0 . 3.75 2459 1877 A 97 ILE HD1% A 46 LEU HD1% 1.0 . 3.75 2460 1878 A 47 SER HA A 51 VAL HG2% 1.0 . 4.90 2461 1878 A 47 SER HA A 51 VAL HG1% 1.0 . 4.90 2462 1879 A 47 SER HB2 A 51 VAL HG2% 1.0 . 5.44 2463 1879 A 47 SER HB2 A 51 VAL HG1% 1.0 . 5.44 2464 1880 A 47 SER HB3 A 51 VAL HG2% 1.0 . 4.96 2465 1880 A 47 SER HB3 A 51 VAL HG1% 1.0 . 4.96 2466 1881 A 48 ARG HA A 51 VAL HG2% 1.0 . 3.21 2467 1881 A 48 ARG HA A 51 VAL HG1% 1.0 . 3.21 2468 1882 A 48 ARG HG2 A 51 VAL HG2% 1.0 . 5.37 2469 1882 A 48 ARG HG2 A 51 VAL HG1% 1.0 . 5.37 2470 1883 A 48 ARG HDy A 51 VAL HG2% 1.0 . 3.77 2471 1883 A 51 VAL HG1% A 48 ARG HDx 1.0 . 3.77 2472 1883 A 48 ARG HDy A 51 VAL HG1% 1.0 . 3.77 2473 1883 A 48 ARG HDx A 51 VAL HG2% 1.0 . 3.77 2474 1884 A 50 ALA H A 51 VAL HG2% 1.0 . 4.81 2475 1884 A 50 ALA H A 51 VAL HG1% 1.0 . 4.81 2476 1885 A 50 ALA HA A 51 VAL HG2% 1.0 . 5.06 2477 1885 A 50 ALA HA A 51 VAL HG1% 1.0 . 5.06 2478 1886 A 50 ALA HA A 56 LEU HD2% 1.0 . 4.75 2479 1886 A 50 ALA HA A 56 LEU HD1% 1.0 . 4.75 2480 1887 A 50 ALA HB% A 51 VAL HG2% 1.0 . 3.58 2481 1887 A 50 ALA HB% A 51 VAL HG1% 1.0 . 3.58 2482 1888 A 50 ALA HB% A 56 LEU HD2% 1.0 . 5.44 2483 1888 A 50 ALA HB% A 56 LEU HD1% 1.0 . 5.44 2484 1889 A 50 ALA HB% A 58 PRO HG2 1.0 . 5.35 2485 1889 A 50 ALA HB% A 58 PRO HG3 1.0 . 5.35 2486 1890 A 51 VAL H A 51 VAL HG2% 1.0 . 2.85 2487 1890 A 51 VAL H A 51 VAL HG1% 1.0 . 2.85 2488 1891 A 51 VAL HA A 51 VAL HG2% 1.0 . 2.77 2489 1891 A 51 VAL HA A 51 VAL HG1% 1.0 . 2.77 2490 1892 A 52 LEU H A 51 VAL HG2% 1.0 . 3.20 2491 1892 A 52 LEU H A 51 VAL HG1% 1.0 . 3.20 2492 1893 A 52 LEU HA A 51 VAL HG2% 1.0 . 3.34 2493 1893 A 52 LEU HA A 51 VAL HG1% 1.0 . 3.34 2494 1894 A 52 LEU HB2 A 51 VAL HG2% 1.0 . 5.44 2495 1894 A 52 LEU HB2 A 51 VAL HG1% 1.0 . 5.44 2496 1895 A 52 LEU HD2% A 51 VAL HG2% 1.0 . 3.74 2497 1895 A 52 LEU HD2% A 51 VAL HG1% 1.0 . 3.74 2498 1896 A 53 PHE H A 51 VAL HG2% 1.0 . 4.47 2499 1896 A 53 PHE H A 51 VAL HG1% 1.0 . 4.47 2500 1897 A 54 PRO HB3 A 51 VAL HG2% 1.0 . 5.32 2501 1897 A 54 PRO HB3 A 51 VAL HG1% 1.0 . 5.32 2502 1898 A 51 VAL HG2% A 54 PRO HGx 1.0 . 5.44 2503 1898 A 51 VAL HG1% A 54 PRO HGx 1.0 . 5.44 2504 1898 A 54 PRO HGy A 51 VAL HG2% 1.0 . 5.44 2505 1898 A 54 PRO HGy A 51 VAL HG1% 1.0 . 5.44 2506 1899 A 53 PHE H A 56 LEU HD2% 1.0 . 5.24 2507 1899 A 53 PHE H A 56 LEU HD1% 1.0 . 5.24 2508 1900 A 53 PHE HBy A 56 LEU HB2 1.0 . 5.34 2509 1900 A 53 PHE HBx A 56 LEU HB2 1.0 . 5.34 2510 1900 A 56 LEU HB3 A 53 PHE HBx 1.0 . 5.34 2511 1900 A 53 PHE HBy A 56 LEU HB3 1.0 . 5.34 2512 1901 A 53 PHE HBx A 56 LEU HD2% 1.0 . 4.09 2513 1901 A 56 LEU HD1% A 53 PHE HBx 1.0 . 4.09 2514 1901 A 53 PHE HBy A 56 LEU HD1% 1.0 . 4.09 2515 1901 A 53 PHE HBy A 56 LEU HD2% 1.0 . 4.09 2516 1902 A 53 PHE HD% A 56 LEU HD2% 1.0 . 4.55 2517 1902 A 53 PHE HD% A 56 LEU HD1% 1.0 . 4.55 2518 1903 A 56 LEU H A 56 LEU HB2 1.0 . 3.48 2519 1903 A 56 LEU H A 56 LEU HB3 1.0 . 3.48 2520 1904 A 56 LEU HA A 56 LEU HD2% 1.0 . 3.61 2521 1904 A 56 LEU HA A 56 LEU HD1% 1.0 . 3.61 2522 1905 A 56 LEU HB2 A 56 LEU HD2% 1.0 . 2.64 2523 1905 A 56 LEU HD1% A 56 LEU HB2 1.0 . 2.64 2524 1905 A 56 LEU HB3 A 56 LEU HD1% 1.0 . 2.64 2525 1905 A 56 LEU HB3 A 56 LEU HD2% 1.0 . 2.64 2526 1906 A 57 ARG H A 56 LEU HB2 1.0 . 3.23 2527 1906 A 57 ARG H A 56 LEU HB3 1.0 . 3.23 2528 1907 A 99 GLU HA A 56 LEU HB2 1.0 . 4.83 2529 1907 A 99 GLU HA A 56 LEU HB3 1.0 . 4.83 2530 1908 A 56 LEU HB2 A 99 GLU HGx 1.0 . 4.52 2531 1908 A 56 LEU HB3 A 99 GLU HGx 1.0 . 4.52 2532 1908 A 99 GLU HGy A 56 LEU HB2 1.0 . 4.52 2533 1908 A 99 GLU HGy A 56 LEU HB3 1.0 . 4.52 2534 1909 A 57 ARG H A 56 LEU HD2% 1.0 . 3.31 2535 1909 A 57 ARG H A 56 LEU HD1% 1.0 . 3.31 2536 1910 A 56 LEU HD2% A 57 ARG HG2 1.0 . 4.54 2537 1910 A 56 LEU HD1% A 57 ARG HG2 1.0 . 4.54 2538 1910 A 57 ARG HG3 A 56 LEU HD2% 1.0 . 4.54 2539 1910 A 56 LEU HD1% A 57 ARG HG3 1.0 . 4.54 2540 1911 A 60 GLY H A 56 LEU HD2% 1.0 . 3.83 2541 1911 A 60 GLY H A 56 LEU HD1% 1.0 . 3.83 2542 1912 A 61 PHE H A 56 LEU HD2% 1.0 . 4.50 2543 1912 A 61 PHE H A 56 LEU HD1% 1.0 . 4.50 2544 1913 A 61 PHE HA A 56 LEU HD2% 1.0 . 3.90 2545 1913 A 61 PHE HA A 56 LEU HD1% 1.0 . 3.90 2546 1914 A 61 PHE HB2 A 56 LEU HD2% 1.0 . 3.91 2547 1914 A 61 PHE HB2 A 56 LEU HD1% 1.0 . 3.91 2548 1915 A 61 PHE HB3 A 56 LEU HD2% 1.0 . 3.55 2549 1915 A 61 PHE HB3 A 56 LEU HD1% 1.0 . 3.55 2550 1916 A 61 PHE HD% A 56 LEU HD2% 1.0 . 3.77 2551 1916 A 61 PHE HD% A 56 LEU HD1% 1.0 . 3.77 2552 1917 A 62 GLN H A 56 LEU HD2% 1.0 . 5.44 2553 1917 A 62 GLN H A 56 LEU HD1% 1.0 . 5.44 2554 1918 A 97 ILE HG2% A 56 LEU HD2% 1.0 . 3.63 2555 1918 A 97 ILE HG2% A 56 LEU HD1% 1.0 . 3.63 2556 1919 A 99 GLU H A 56 LEU HD2% 1.0 . 4.85 2557 1919 A 99 GLU H A 56 LEU HD1% 1.0 . 4.85 2558 1920 A 99 GLU HA A 56 LEU HD2% 1.0 . 3.40 2559 1920 A 99 GLU HA A 56 LEU HD1% 1.0 . 3.40 2560 1921 A 56 LEU HD1% A 99 GLU HB2 1.0 . 3.41 2561 1921 A 56 LEU HD2% A 99 GLU HB2 1.0 . 3.41 2562 1921 A 99 GLU HB3 A 56 LEU HD2% 1.0 . 3.41 2563 1921 A 56 LEU HD1% A 99 GLU HB3 1.0 . 3.41 2564 1922 A 56 LEU HD2% A 99 GLU HGx 1.0 . 4.31 2565 1922 A 99 GLU HGy A 56 LEU HD2% 1.0 . 4.31 2566 1922 A 99 GLU HGy A 56 LEU HD1% 1.0 . 4.31 2567 1922 A 56 LEU HD1% A 99 GLU HGx 1.0 . 4.31 2568 1923 A 100 LYS H A 56 LEU HD2% 1.0 . 3.88 2569 1923 A 100 LYS H A 56 LEU HD1% 1.0 . 3.88 2570 1924 A 57 ARG H A 57 ARG HG2 1.0 . 3.93 2571 1924 A 57 ARG H A 57 ARG HG3 1.0 . 3.93 2572 1925 A 57 ARG HA A 57 ARG HG2 1.0 . 3.45 2573 1925 A 57 ARG HA A 57 ARG HG3 1.0 . 3.45 2574 1926 A 57 ARG HA A 57 ARG HD3 1.0 . 4.57 2575 1926 A 57 ARG HA A 57 ARG HD2 1.0 . 4.57 2576 1927 A 57 ARG HA A 58 PRO HG2 1.0 . 4.57 2577 1927 A 57 ARG HA A 58 PRO HG3 1.0 . 4.57 2578 1928 A 57 ARG HB2 A 57 ARG HG2 1.0 . 2.53 2579 1928 A 57 ARG HB2 A 57 ARG HG3 1.0 . 2.53 2580 1929 A 57 ARG HB2 A 57 ARG HD3 1.0 . 2.39 2581 1929 A 57 ARG HB2 A 57 ARG HD2 1.0 . 2.39 2582 1930 A 57 ARG HB3 A 57 ARG HG2 1.0 . 2.55 2583 1930 A 57 ARG HB3 A 57 ARG HG3 1.0 . 2.55 2584 1931 A 57 ARG HB3 A 57 ARG HD3 1.0 . 3.51 2585 1931 A 57 ARG HB3 A 57 ARG HD2 1.0 . 3.51 2586 1932 A 58 PRO HD2 A 57 ARG HG2 1.0 . 3.92 2587 1932 A 58 PRO HD2 A 57 ARG HG3 1.0 . 3.92 2588 1933 A 58 PRO HD3 A 57 ARG HG2 1.0 . 4.63 2589 1933 A 58 PRO HD3 A 57 ARG HG3 1.0 . 4.63 2590 1934 A 60 GLY HA3 A 57 ARG HD3 1.0 . 4.70 2591 1934 A 60 GLY HA3 A 57 ARG HD2 1.0 . 4.70 2592 1935 A 61 PHE HA A 99 GLU HB2 1.0 . 5.34 2593 1935 A 61 PHE HA A 99 GLU HB3 1.0 . 5.34 2594 1936 A 64 HIS H A 72 LEU HD2% 1.0 . 5.44 2595 1936 A 64 HIS H A 72 LEU HD1% 1.0 . 5.44 2596 1937 A 64 HIS HB2 A 72 LEU HD2% 1.0 . 3.81 2597 1937 A 64 HIS HB2 A 72 LEU HD1% 1.0 . 3.81 2598 1938 A 64 HIS HB3 A 72 LEU HD2% 1.0 . 3.67 2599 1938 A 64 HIS HB3 A 72 LEU HD1% 1.0 . 3.67 2600 1939 A 65 TYR H A 72 LEU HD2% 1.0 . 4.59 2601 1939 A 65 TYR H A 72 LEU HD1% 1.0 . 4.59 2602 1940 A 65 TYR H A 73 VAL HG2% 1.0 . 4.01 2603 1940 A 65 TYR H A 73 VAL HG1% 1.0 . 4.01 2604 1941 A 65 TYR HA A 66 ARG HB2 1.0 . 4.79 2605 1941 A 65 TYR HA A 66 ARG HB3 1.0 . 4.79 2606 1942 A 65 TYR HB2 A 66 ARG HB2 1.0 . 5.34 2607 1942 A 65 TYR HB2 A 66 ARG HB3 1.0 . 5.34 2608 1943 A 65 TYR HB2 A 81 LEU HD2% 1.0 . 5.44 2609 1943 A 65 TYR HB2 A 81 LEU HD1% 1.0 . 5.44 2610 1944 A 65 TYR HE% A 73 VAL HG2% 1.0 . 3.85 2611 1944 A 65 TYR HE% A 73 VAL HG1% 1.0 . 3.85 2612 1945 A 66 ARG H A 66 ARG HB2 1.0 . 3.15 2613 1945 A 66 ARG H A 66 ARG HB3 1.0 . 3.15 2614 1946 A 66 ARG H A 66 ARG HG2 1.0 . 3.25 2615 1946 A 66 ARG H A 66 ARG HG3 1.0 . 3.25 2616 1947 A 66 ARG H A 66 ARG HD3 1.0 . 4.55 2617 1947 A 66 ARG H A 66 ARG HD2 1.0 . 4.55 2618 1948 A 66 ARG H A 72 LEU HD2% 1.0 . 4.17 2619 1948 A 66 ARG H A 72 LEU HD1% 1.0 . 4.17 2620 1949 A 66 ARG HB2 A 66 ARG HD3 1.0 . 3.28 2621 1949 A 66 ARG HD2 A 66 ARG HB2 1.0 . 3.28 2622 1949 A 66 ARG HB3 A 66 ARG HD2 1.0 . 3.28 2623 1949 A 66 ARG HB3 A 66 ARG HD3 1.0 . 3.28 2624 1950 A 67 ALA H A 66 ARG HB2 1.0 . 3.70 2625 1950 A 67 ALA H A 66 ARG HB3 1.0 . 3.70 2626 1951 A 70 GLY H A 66 ARG HB2 1.0 . 4.98 2627 1951 A 70 GLY H A 66 ARG HB3 1.0 . 4.98 2628 1952 A 70 GLY HA2 A 66 ARG HB2 1.0 . 4.70 2629 1952 A 70 GLY HA2 A 66 ARG HB3 1.0 . 4.70 2630 1953 A 70 GLY HA3 A 66 ARG HB2 1.0 . 5.07 2631 1953 A 70 GLY HA3 A 66 ARG HB3 1.0 . 5.07 2632 1954 A 71 ASP H A 66 ARG HB2 1.0 . 5.34 2633 1954 A 71 ASP H A 66 ARG HB3 1.0 . 5.34 2634 1955 A 66 ARG HB3 A 72 LEU HD2% 1.0 . 4.60 2635 1955 A 66 ARG HB2 A 72 LEU HD2% 1.0 . 4.60 2636 1955 A 72 LEU HD1% A 66 ARG HB2 1.0 . 4.60 2637 1955 A 72 LEU HD1% A 66 ARG HB3 1.0 . 4.60 2638 1956 A 96 TYR HE% A 66 ARG HB2 1.0 . 3.98 2639 1956 A 96 TYR HE% A 66 ARG HB3 1.0 . 3.98 2640 1957 A 67 ALA H A 66 ARG HG2 1.0 . 4.65 2641 1957 A 67 ALA H A 66 ARG HG3 1.0 . 4.65 2642 1958 A 70 GLY HA2 A 66 ARG HG2 1.0 . 5.23 2643 1958 A 70 GLY HA2 A 66 ARG HG3 1.0 . 5.23 2644 1959 A 66 ARG HG2 A 72 LEU HD2% 1.0 . 4.50 2645 1959 A 66 ARG HG3 A 72 LEU HD2% 1.0 . 4.50 2646 1959 A 72 LEU HD1% A 66 ARG HG2 1.0 . 4.50 2647 1959 A 72 LEU HD1% A 66 ARG HG3 1.0 . 4.50 2648 1960 A 67 ALA H A 66 ARG HD3 1.0 . 4.66 2649 1960 A 67 ALA H A 66 ARG HD2 1.0 . 4.66 2650 1961 A 70 GLY H A 66 ARG HD3 1.0 . 4.51 2651 1961 A 70 GLY H A 66 ARG HD2 1.0 . 4.51 2652 1962 A 70 GLY HA3 A 66 ARG HD3 1.0 . 4.83 2653 1962 A 70 GLY HA3 A 66 ARG HD2 1.0 . 4.83 2654 1963 A 67 ALA H A 71 ASP HB2 1.0 . 5.34 2655 1963 A 67 ALA H A 71 ASP HB3 1.0 . 5.34 2656 1964 A 67 ALA H A 72 LEU HD2% 1.0 . 4.91 2657 1964 A 67 ALA H A 72 LEU HD1% 1.0 . 4.91 2658 1965 A 67 ALA H A 73 VAL HG2% 1.0 . 4.08 2659 1965 A 67 ALA H A 73 VAL HG1% 1.0 . 4.08 2660 1966 A 67 ALA HA A 68 GLU HG3 1.0 . 5.08 2661 1966 A 67 ALA HA A 68 GLU HG2 1.0 . 5.08 2662 1967 A 67 ALA HA A 73 VAL HG2% 1.0 . 5.21 2663 1967 A 67 ALA HA A 73 VAL HG1% 1.0 . 5.21 2664 1968 A 67 ALA HB% A 68 GLU HG3 1.0 . 5.14 2665 1968 A 67 ALA HB% A 68 GLU HG2 1.0 . 5.14 2666 1969 A 67 ALA HB% A 71 ASP HB2 1.0 . 5.34 2667 1969 A 67 ALA HB% A 71 ASP HB3 1.0 . 5.34 2668 1970 A 67 ALA HB% A 73 VAL HG2% 1.0 . 3.52 2669 1970 A 67 ALA HB% A 73 VAL HG1% 1.0 . 3.52 2670 1971 A 69 ARG H A 68 GLU HG3 1.0 . 5.34 2671 1971 A 69 ARG H A 68 GLU HG2 1.0 . 5.34 2672 1972 A 68 GLU HG2 A 69 ARG HGx 1.0 . 4.38 2673 1972 A 68 GLU HG3 A 69 ARG HGx 1.0 . 4.38 2674 1972 A 69 ARG HGy A 68 GLU HG3 1.0 . 4.38 2675 1972 A 69 ARG HGy A 68 GLU HG2 1.0 . 4.38 2676 1973 A 70 GLY H A 68 GLU HG3 1.0 . 4.78 2677 1973 A 70 GLY H A 68 GLU HG2 1.0 . 4.78 2678 1974 A 87 TYR HE% A 68 GLU HG3 1.0 . 4.90 2679 1974 A 87 TYR HE% A 68 GLU HG2 1.0 . 4.90 2680 1975 A 69 ARG H A 69 ARG HB2 1.0 . 3.12 2681 1975 A 69 ARG H A 69 ARG HB3 1.0 . 3.12 2682 1976 A 69 ARG HA A 69 ARG HD3 1.0 . 4.75 2683 1976 A 69 ARG HA A 69 ARG HD2 1.0 . 4.75 2684 1977 A 69 ARG HB3 A 69 ARG HD3 1.0 . 3.26 2685 1977 A 69 ARG HD2 A 69 ARG HB2 1.0 . 3.26 2686 1977 A 69 ARG HB3 A 69 ARG HD2 1.0 . 3.26 2687 1977 A 69 ARG HB2 A 69 ARG HD3 1.0 . 3.26 2688 1978 A 70 GLY H A 69 ARG HB2 1.0 . 4.17 2689 1978 A 70 GLY H A 69 ARG HB3 1.0 . 4.17 2690 1979 A 71 ASP H A 69 ARG HB2 1.0 . 4.37 2691 1979 A 71 ASP H A 69 ARG HB3 1.0 . 4.37 2692 1980 A 71 ASP H A 71 ASP HB2 1.0 . 3.63 2693 1980 A 71 ASP H A 71 ASP HB3 1.0 . 3.63 2694 1981 A 72 LEU H A 71 ASP HB2 1.0 . 3.73 2695 1981 A 72 LEU H A 71 ASP HB3 1.0 . 3.73 2696 1982 A 72 LEU HB2 A 71 ASP HB2 1.0 . 4.68 2697 1982 A 72 LEU HB2 A 71 ASP HB3 1.0 . 4.68 2698 1983 A 72 LEU HB3 A 71 ASP HB2 1.0 . 5.34 2699 1983 A 72 LEU HB3 A 71 ASP HB3 1.0 . 5.34 2700 1984 A 72 LEU HG A 71 ASP HB2 1.0 . 5.34 2701 1984 A 72 LEU HG A 71 ASP HB3 1.0 . 5.34 2702 1985 A 73 VAL H A 71 ASP HB2 1.0 . 5.34 2703 1985 A 73 VAL H A 71 ASP HB3 1.0 . 5.34 2704 1986 A 71 ASP HB3 A 73 VAL HG2% 1.0 . 4.32 2705 1986 A 71 ASP HB2 A 73 VAL HG2% 1.0 . 4.32 2706 1986 A 73 VAL HG1% A 71 ASP HB2 1.0 . 4.32 2707 1986 A 73 VAL HG1% A 71 ASP HB3 1.0 . 4.32 2708 1987 A 72 LEU HA A 72 LEU HD2% 1.0 . 3.36 2709 1987 A 72 LEU HA A 72 LEU HD1% 1.0 . 3.36 2710 1988 A 72 LEU HA A 73 VAL HG2% 1.0 . 4.56 2711 1988 A 72 LEU HA A 73 VAL HG1% 1.0 . 4.56 2712 1989 A 72 LEU HB3 A 72 LEU HD2% 1.0 . 2.94 2713 1989 A 72 LEU HB3 A 72 LEU HD1% 1.0 . 2.94 2714 1990 A 73 VAL H A 72 LEU HD2% 1.0 . 3.57 2715 1990 A 73 VAL H A 72 LEU HD1% 1.0 . 3.57 2716 1991 A 96 TYR H A 72 LEU HD2% 1.0 . 4.22 2717 1991 A 96 TYR H A 72 LEU HD1% 1.0 . 4.22 2718 1992 A 96 TYR HB2 A 72 LEU HD2% 1.0 . 3.99 2719 1992 A 96 TYR HB2 A 72 LEU HD1% 1.0 . 3.99 2720 1993 A 96 TYR HB3 A 72 LEU HD2% 1.0 . 3.03 2721 1993 A 96 TYR HB3 A 72 LEU HD1% 1.0 . 3.03 2722 1994 A 96 TYR HD% A 72 LEU HD2% 1.0 . 3.61 2723 1994 A 96 TYR HD% A 72 LEU HD1% 1.0 . 3.61 2724 1995 A 72 LEU HD2% A 98 LYS HE3 1.0 . 4.23 2725 1995 A 98 LYS HE2 A 72 LEU HD2% 1.0 . 4.23 2726 1995 A 98 LYS HE2 A 72 LEU HD1% 1.0 . 4.23 2727 1995 A 72 LEU HD1% A 98 LYS HE3 1.0 . 4.23 2728 1996 A 73 VAL H A 73 VAL HG2% 1.0 . 3.03 2729 1996 A 73 VAL H A 73 VAL HG1% 1.0 . 3.03 2730 1997 A 73 VAL HA A 73 VAL HG2% 1.0 . 3.09 2731 1997 A 73 VAL HA A 73 VAL HG1% 1.0 . 3.09 2732 1998 A 74 ALA H A 73 VAL HG2% 1.0 . 3.17 2733 1998 A 74 ALA H A 73 VAL HG1% 1.0 . 3.17 2734 1999 A 75 PHE HB2 A 73 VAL HG2% 1.0 . 5.05 2735 1999 A 75 PHE HB2 A 73 VAL HG1% 1.0 . 5.05 2736 2000 A 75 PHE H A 80 GLU HG3 1.0 . 5.34 2737 2000 A 75 PHE H A 80 GLU HG2 1.0 . 5.34 2738 2001 A 75 PHE HA A 80 GLU HG3 1.0 . 4.73 2739 2001 A 75 PHE HA A 80 GLU HG2 1.0 . 4.73 2740 2002 A 75 PHE HB2 A 80 GLU HG3 1.0 . 5.10 2741 2002 A 75 PHE HB2 A 80 GLU HG2 1.0 . 5.10 2742 2003 A 75 PHE HB3 A 80 GLU HG3 1.0 . 5.04 2743 2003 A 75 PHE HB3 A 80 GLU HG2 1.0 . 5.04 2744 2004 A 75 PHE HD% A 81 LEU HD2% 1.0 . 3.75 2745 2004 A 75 PHE HD% A 81 LEU HD1% 1.0 . 3.75 2746 2005 A 75 PHE HE% A 81 LEU HD2% 1.0 . 3.30 2747 2005 A 75 PHE HE% A 81 LEU HD1% 1.0 . 3.30 2748 2006 A 77 SER H A 77 SER HB3 1.0 . 3.21 2749 2006 A 77 SER H A 77 SER HB2 1.0 . 3.21 2750 2007 A 77 SER H A 80 GLU HB2 1.0 . 3.84 2751 2007 A 77 SER H A 80 GLU HB3 1.0 . 3.84 2752 2008 A 77 SER H A 81 LEU HD2% 1.0 . 3.25 2753 2008 A 77 SER H A 81 LEU HD1% 1.0 . 3.25 2754 2009 A 80 GLU H A 77 SER HB3 1.0 . 4.08 2755 2009 A 80 GLU H A 77 SER HB2 1.0 . 4.08 2756 2010 A 78 ASP HA A 81 LEU HD2% 1.0 . 4.13 2757 2010 A 78 ASP HA A 81 LEU HD1% 1.0 . 4.13 2758 2011 A 79 GLU H A 78 ASP HB2 1.0 . 3.64 2759 2011 A 79 GLU H A 78 ASP HB3 1.0 . 3.64 2760 2012 A 78 ASP HB3 A 81 LEU HD2% 1.0 . 4.90 2761 2012 A 78 ASP HB2 A 81 LEU HD2% 1.0 . 4.90 2762 2012 A 81 LEU HD1% A 78 ASP HB2 1.0 . 4.90 2763 2012 A 81 LEU HD1% A 78 ASP HB3 1.0 . 4.90 2764 2013 A 82 THR H A 78 ASP HB2 1.0 . 5.34 2765 2013 A 82 THR H A 78 ASP HB3 1.0 . 5.34 2766 2014 A 82 THR HB A 78 ASP HB2 1.0 . 5.34 2767 2014 A 82 THR HB A 78 ASP HB3 1.0 . 5.34 2768 2015 A 79 GLU H A 79 GLU HG3 1.0 . 3.22 2769 2015 A 79 GLU H A 79 GLU HG2 1.0 . 3.22 2770 2016 A 80 GLU H A 79 GLU HG3 1.0 . 4.38 2771 2016 A 80 GLU H A 79 GLU HG2 1.0 . 4.38 2772 2017 A 80 GLU HA A 79 GLU HG3 1.0 . 4.46 2773 2017 A 80 GLU HA A 79 GLU HG2 1.0 . 4.46 2774 2018 A 80 GLU H A 80 GLU HG3 1.0 . 4.32 2775 2018 A 80 GLU H A 80 GLU HG2 1.0 . 4.32 2776 2019 A 80 GLU H A 81 LEU HD2% 1.0 . 3.43 2777 2019 A 80 GLU H A 81 LEU HD1% 1.0 . 3.43 2778 2020 A 80 GLU HA A 80 GLU HG3 1.0 . 3.40 2779 2020 A 80 GLU HA A 80 GLU HG2 1.0 . 3.40 2780 2021 A 81 LEU H A 80 GLU HG3 1.0 . 5.20 2781 2021 A 81 LEU H A 80 GLU HG2 1.0 . 5.20 2782 2022 A 81 LEU H A 81 LEU HD2% 1.0 . 3.45 2783 2022 A 81 LEU H A 81 LEU HD1% 1.0 . 3.45 2784 2023 A 81 LEU HA A 81 LEU HD2% 1.0 . 3.13 2785 2023 A 81 LEU HA A 81 LEU HD1% 1.0 . 3.13 2786 2024 A 81 LEU HB2 A 81 LEU HD2% 1.0 . 3.07 2787 2024 A 81 LEU HB2 A 81 LEU HD1% 1.0 . 3.07 2788 2025 A 81 LEU HB3 A 81 LEU HD2% 1.0 . 3.08 2789 2025 A 81 LEU HB3 A 81 LEU HD1% 1.0 . 3.08 2790 2026 A 82 THR H A 81 LEU HD2% 1.0 . 3.89 2791 2026 A 82 THR H A 81 LEU HD1% 1.0 . 3.89 2792 2027 A 82 THR HA A 81 LEU HD2% 1.0 . 5.42 2793 2027 A 82 THR HA A 81 LEU HD1% 1.0 . 5.42 2794 2028 A 84 ALA H A 81 LEU HD2% 1.0 . 4.61 2795 2028 A 84 ALA H A 81 LEU HD1% 1.0 . 4.61 2796 2029 A 84 ALA HA A 81 LEU HD2% 1.0 . 5.44 2797 2029 A 84 ALA HA A 81 LEU HD1% 1.0 . 5.44 2798 2030 A 84 ALA HB% A 81 LEU HD2% 1.0 . 3.11 2799 2030 A 84 ALA HB% A 81 LEU HD1% 1.0 . 3.11 2800 2031 A 85 MET H A 81 LEU HD2% 1.0 . 5.18 2801 2031 A 85 MET H A 81 LEU HD1% 1.0 . 5.18 2802 2032 A 93 PHE HE% A 81 LEU HD2% 1.0 . 3.71 2803 2032 A 93 PHE HE% A 81 LEU HD1% 1.0 . 3.71 2804 2033 A 93 PHE HZ A 81 LEU HD2% 1.0 . 3.12 2805 2033 A 93 PHE HZ A 81 LEU HD1% 1.0 . 3.12 2806 2034 A 82 THR HA A 85 MET HB2 1.0 . 4.24 2807 2034 A 82 THR HA A 85 MET HB3 1.0 . 4.24 2808 2035 A 83 MET HA A 86 SER HB3 1.0 . 3.98 2809 2035 A 83 MET HA A 86 SER HB2 1.0 . 3.98 2810 2036 A 83 MET HGx A 86 SER HB3 1.0 . 4.93 2811 2036 A 83 MET HGy A 86 SER HB3 1.0 . 4.93 2812 2036 A 86 SER HB2 A 83 MET HGx 1.0 . 4.93 2813 2036 A 83 MET HGy A 86 SER HB2 1.0 . 4.93 2814 2037 A 85 MET H A 85 MET HB2 1.0 . 3.44 2815 2037 A 85 MET H A 85 MET HB3 1.0 . 3.44 2816 2038 A 85 MET H A 88 VAL HG2% 1.0 . 5.09 2817 2038 A 85 MET H A 88 VAL HG1% 1.0 . 5.09 2818 2039 A 85 MET HA A 88 VAL HG2% 1.0 . 3.14 2819 2039 A 85 MET HA A 88 VAL HG1% 1.0 . 3.14 2820 2040 A 85 MET HE% A 85 MET HB2 1.0 . 4.90 2821 2040 A 85 MET HE% A 85 MET HB3 1.0 . 4.90 2822 2041 A 85 MET HB2 A 88 VAL HG2% 1.0 . 5.28 2823 2041 A 85 MET HB3 A 88 VAL HG2% 1.0 . 5.28 2824 2041 A 88 VAL HG1% A 85 MET HB2 1.0 . 5.28 2825 2041 A 85 MET HB3 A 88 VAL HG1% 1.0 . 5.28 2826 2042 A 86 SER HA A 86 SER HB3 1.0 . 2.54 2827 2042 A 86 SER HA A 86 SER HB2 1.0 . 2.54 2828 2043 A 87 TYR H A 86 SER HB3 1.0 . 4.20 2829 2043 A 87 TYR H A 86 SER HB2 1.0 . 4.20 2830 2044 A 87 TYR HA A 86 SER HB3 1.0 . 4.44 2831 2044 A 87 TYR HA A 86 SER HB2 1.0 . 4.44 2832 2045 A 87 TYR HD% A 86 SER HB3 1.0 . 4.73 2833 2045 A 87 TYR HD% A 86 SER HB2 1.0 . 4.73 2834 2046 A 87 TYR HE% A 86 SER HB3 1.0 . 5.18 2835 2046 A 87 TYR HE% A 86 SER HB2 1.0 . 5.18 2836 2047 A 87 TYR H A 88 VAL HG2% 1.0 . 3.60 2837 2047 A 87 TYR H A 88 VAL HG1% 1.0 . 3.60 2838 2048 A 88 VAL H A 88 VAL HG2% 1.0 . 3.02 2839 2048 A 88 VAL H A 88 VAL HG1% 1.0 . 3.02 2840 2049 A 90 ASP H A 88 VAL HG2% 1.0 . 4.42 2841 2049 A 90 ASP H A 88 VAL HG1% 1.0 . 4.42 2842 2050 A 88 VAL HG1% A 90 ASP HB2 1.0 . 3.94 2843 2050 A 88 VAL HG2% A 90 ASP HB2 1.0 . 3.94 2844 2050 A 90 ASP HB3 A 88 VAL HG2% 1.0 . 3.94 2845 2050 A 88 VAL HG1% A 90 ASP HB3 1.0 . 3.94 2846 2051 A 91 ASP H A 88 VAL HG2% 1.0 . 4.16 2847 2051 A 91 ASP H A 88 VAL HG1% 1.0 . 4.16 2848 2052 A 91 ASP HA A 88 VAL HG2% 1.0 . 3.79 2849 2052 A 91 ASP HA A 88 VAL HG1% 1.0 . 3.79 2850 2053 A 88 VAL HG1% A 91 ASP HB2 1.0 . 5.28 2851 2053 A 88 VAL HG2% A 91 ASP HB2 1.0 . 5.28 2852 2053 A 91 ASP HB3 A 88 VAL HG2% 1.0 . 5.28 2853 2053 A 91 ASP HB3 A 88 VAL HG1% 1.0 . 5.28 2854 2054 A 92 ILE H A 88 VAL HG2% 1.0 . 4.21 2855 2054 A 92 ILE H A 88 VAL HG1% 1.0 . 4.21 2856 2055 A 92 ILE HB A 88 VAL HG2% 1.0 . 4.32 2857 2055 A 92 ILE HB A 88 VAL HG1% 1.0 . 4.32 2858 2056 A 93 PHE H A 88 VAL HG2% 1.0 . 4.63 2859 2056 A 93 PHE H A 88 VAL HG1% 1.0 . 4.63 2860 2057 A 93 PHE HA A 88 VAL HG2% 1.0 . 3.29 2861 2057 A 93 PHE HA A 88 VAL HG1% 1.0 . 3.29 2862 2058 A 93 PHE HB2 A 88 VAL HG2% 1.0 . 3.70 2863 2058 A 93 PHE HB2 A 88 VAL HG1% 1.0 . 3.70 2864 2059 A 93 PHE HB3 A 88 VAL HG2% 1.0 . 4.69 2865 2059 A 93 PHE HB3 A 88 VAL HG1% 1.0 . 4.69 2866 2060 A 93 PHE HD% A 88 VAL HG2% 1.0 . 3.66 2867 2060 A 93 PHE HD% A 88 VAL HG1% 1.0 . 3.66 2868 2061 A 94 ARG H A 88 VAL HG2% 1.0 . 4.51 2869 2061 A 94 ARG H A 88 VAL HG1% 1.0 . 4.51 2870 2062 A 89 LYS HA A 89 LYS HG3 1.0 . 3.26 2871 2062 A 89 LYS HA A 89 LYS HG2 1.0 . 3.26 2872 2063 A 89 LYS HB2 A 89 LYS HDx 1.0 . 3.16 2873 2063 A 89 LYS HB3 A 89 LYS HDx 1.0 . 3.16 2874 2063 A 89 LYS HDy A 89 LYS HB2 1.0 . 3.16 2875 2063 A 89 LYS HDy A 89 LYS HB3 1.0 . 3.16 2876 2064 A 91 ASP H A 90 ASP HB2 1.0 . 2.54 2877 2064 A 91 ASP H A 90 ASP HB3 1.0 . 2.54 2878 2065 A 91 ASP HA A 90 ASP HB2 1.0 . 5.30 2879 2065 A 91 ASP HA A 90 ASP HB3 1.0 . 5.30 2880 2066 A 92 ILE H A 90 ASP HB2 1.0 . 2.99 2881 2066 A 92 ILE H A 90 ASP HB3 1.0 . 2.99 2882 2067 A 92 ILE HD1% A 90 ASP HB2 1.0 . 4.06 2883 2067 A 92 ILE HD1% A 90 ASP HB3 1.0 . 4.06 2884 2068 A 92 ILE HG12 A 91 ASP HB2 1.0 . 5.34 2885 2068 A 92 ILE HG12 A 91 ASP HB3 1.0 . 5.34 2886 2069 A 92 ILE HG2% A 94 ARG HD3 1.0 . 4.75 2887 2069 A 92 ILE HG2% A 94 ARG HD2 1.0 . 4.75 2888 2070 A 93 PHE HA A 94 ARG HB2 1.0 . 5.03 2889 2070 A 93 PHE HA A 94 ARG HB3 1.0 . 5.03 2890 2071 A 94 ARG H A 94 ARG HB2 1.0 . 3.04 2891 2071 A 94 ARG H A 94 ARG HB3 1.0 . 3.04 2892 2072 A 94 ARG H A 94 ARG HD3 1.0 . 4.23 2893 2072 A 94 ARG H A 94 ARG HD2 1.0 . 4.23 2894 2073 A 94 ARG HA A 94 ARG HD3 1.0 . 4.70 2895 2073 A 94 ARG HA A 94 ARG HD2 1.0 . 4.70 2896 2074 A 95 ILE H A 94 ARG HB2 1.0 . 3.54 2897 2074 A 95 ILE H A 94 ARG HB3 1.0 . 3.54 2898 2075 A 96 TYR HE% A 94 ARG HB2 1.0 . 4.65 2899 2075 A 96 TYR HE% A 94 ARG HB3 1.0 . 4.65 2900 2076 A 95 ILE H A 94 ARG HD3 1.0 . 5.34 2901 2076 A 95 ILE H A 94 ARG HD2 1.0 . 5.34 2902 2077 A 98 LYS HA A 99 GLU HB2 1.0 . 5.15 2903 2077 A 98 LYS HA A 99 GLU HB3 1.0 . 5.15 2904 2078 A 98 LYS HB2 A 98 LYS HE3 1.0 . 4.26 2905 2078 A 98 LYS HB2 A 98 LYS HE2 1.0 . 4.26 2906 2079 A 98 LYS HB3 A 98 LYS HE3 1.0 . 5.23 2907 2079 A 98 LYS HB3 A 98 LYS HE2 1.0 . 5.23 2908 2080 A 99 GLU H A 99 GLU HB2 1.0 . 2.96 2909 2080 A 99 GLU H A 99 GLU HB3 1.0 . 2.96 2910 2081 A 99 GLU HB2 A 99 GLU HGx 1.0 . 2.41 2911 2081 A 99 GLU HB3 A 99 GLU HGx 1.0 . 2.41 2912 2081 A 99 GLU HGy A 99 GLU HB2 1.0 . 2.41 2913 2081 A 99 GLU HGy A 99 GLU HB3 1.0 . 2.41 2914 2082 A 100 LYS H A 99 GLU HB2 1.0 . 3.12 2915 2082 A 100 LYS H A 99 GLU HB3 1.0 . 3.12 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 2 MET C A 3 SER N A 3 SER CA A 3 SER C 1.0 -131.9 -74.0 PHI 2 2 A 3 SER N A 3 SER CA A 3 SER C A 4 LEU N 1.0 100.9 158.1 PSI 3 3 A 3 SER C A 4 LEU N A 4 LEU CA A 4 LEU C 1.0 -154.0 -87.2 PHI 4 4 A 4 LEU N A 4 LEU CA A 4 LEU C A 5 THR N 1.0 111.8 163.8 PSI 5 5 A 4 LEU C A 5 THR N A 5 THR CA A 5 THR C 1.0 -122.9 -68.1 PHI 6 6 A 5 THR N A 5 THR CA A 5 THR C A 6 VAL N 1.0 104.4 144.8 PSI 7 7 A 5 THR C A 6 VAL N A 6 VAL CA A 6 VAL C 1.0 -123.5 -82.3 PHI 8 8 A 6 VAL N A 6 VAL CA A 6 VAL C A 7 LYS N 1.0 105.5 147.9 PSI 9 9 A 6 VAL C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -150.8 -90.8 PHI 10 10 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 ALA N 1.0 104.3 162.1 PSI 11 11 A 7 LYS C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -135.6 -88.1 PHI 12 12 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 TYR N 1.0 114.0 154.2 PSI 13 13 A 8 ALA C A 9 TYR N A 9 TYR CA A 9 TYR C 1.0 -128.4 -88.0 PHI 14 14 A 9 TYR N A 9 TYR CA A 9 TYR C A 10 LEU N 1.0 106.9 152.0 PSI 15 15 A 9 TYR C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -131.9 -75.9 PHI 16 16 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 LEU N 1.0 96.6 151.3 PSI 17 17 A 12 GLY C A 13 LYS N A 13 LYS CA A 13 LYS C 1.0 -98.9 -45.4 PHI 18 18 A 13 LYS N A 13 LYS CA A 13 LYS C A 14 GLU N 1.0 -51.7 14.2 PSI 19 19 A 13 LYS C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -110.6 -60.3 PHI 20 20 A 14 GLU N A 14 GLU CA A 14 GLU C A 15 GLU N 1.0 -33.9 26.4 PSI 21 21 A 18 ARG C A 19 GLU N A 19 GLU CA A 19 GLU C 1.0 -171.3 -123.6 PHI 22 22 A 19 GLU N A 19 GLU CA A 19 GLU C A 20 ILE N 1.0 129.8 169.3 PSI 23 23 A 19 GLU C A 20 ILE N A 20 ILE CA A 20 ILE C 1.0 -150.0 -105.4 PHI 24 24 A 20 ILE N A 20 ILE CA A 20 ILE C A 21 ARG N 1.0 103.9 163.8 PSI 25 25 A 21 ARG C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -149.3 -106.1 PHI 26 26 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 PHE N 1.0 122.4 179.9 PSI 27 27 A 22 ARG C A 23 PHE N A 23 PHE CA A 23 PHE C 1.0 -171.5 -102.9 PHI 28 28 A 23 PHE N A 23 PHE CA A 23 PHE C A 24 SER N 1.0 120.2 170.6 PSI 29 29 A 23 PHE C A 24 SER N A 24 SER CA A 24 SER C 1.0 -126.5 -72.7 PHI 30 30 A 24 SER N A 24 SER CA A 24 SER C A 25 PHE N 1.0 106.3 153.2 PSI 31 31 A 24 SER C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -156.4 -78.8 PHI 32 32 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 CYS N 1.0 107.8 161.0 PSI 33 33 A 25 PHE C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -120.0 -75.3 PHI 34 34 A 26 CYS N A 26 CYS CA A 26 CYS C A 27 PHE N 1.0 95.8 144.0 PSI 35 35 A 27 PHE C A 28 SER N A 28 SER CA A 28 SER C 1.0 -136.1 -60.0 PHI 36 36 A 28 SER N A 28 SER CA A 28 SER C A 29 PRO N 1.0 126.1 170.1 PSI 37 37 A 41 PRO C A 42 CYS N A 42 CYS CA A 42 CYS C 1.0 -78.2 -51.8 PHI 38 38 A 42 CYS N A 42 CYS CA A 42 CYS C A 43 GLU N 1.0 -55.9 -24.3 PSI 39 39 A 42 CYS C A 43 GLU N A 43 GLU CA A 43 GLU C 1.0 -81.3 -45.7 PHI 40 40 A 43 GLU N A 43 GLU CA A 43 GLU C A 44 ARG N 1.0 -55.4 -26.0 PSI 41 41 A 43 GLU C A 44 ARG N A 44 ARG CA A 44 ARG C 1.0 -82.9 -46.4 PHI 42 42 A 44 ARG N A 44 ARG CA A 44 ARG C A 45 LEU N 1.0 -52.2 -25.9 PSI 43 43 A 44 ARG C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -81.0 -47.7 PHI 44 44 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 LEU N 1.0 -59.9 -27.0 PSI 45 45 A 45 LEU C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 -75.4 -47.7 PHI 46 46 A 46 LEU N A 46 LEU CA A 46 LEU C A 47 SER N 1.0 -53.2 -22.7 PSI 47 47 A 46 LEU C A 47 SER N A 47 SER CA A 47 SER C 1.0 -79.3 -46.9 PHI 48 48 A 47 SER N A 47 SER CA A 47 SER C A 48 ARG N 1.0 -54.9 -22.1 PSI 49 49 A 47 SER C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -82.3 -51.8 PHI 50 50 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 VAL N 1.0 -60.3 -24.0 PSI 51 51 A 48 ARG C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -79.7 -49.2 PHI 52 52 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 ALA N 1.0 -58.6 -33.5 PSI 53 53 A 49 VAL C A 50 ALA N A 50 ALA CA A 50 ALA C 1.0 -72.1 -44.8 PHI 54 54 A 50 ALA N A 50 ALA CA A 50 ALA C A 51 VAL N 1.0 -60.4 -17.7 PSI 55 55 A 50 ALA C A 51 VAL N A 51 VAL CA A 51 VAL C 1.0 -98.5 -52.1 PHI 56 56 A 51 VAL N A 51 VAL CA A 51 VAL C A 52 LEU N 1.0 -52.9 -18.7 PSI 57 57 A 51 VAL C A 52 LEU N A 52 LEU CA A 52 LEU C 1.0 -97.5 -52.4 PHI 58 58 A 52 LEU N A 52 LEU CA A 52 LEU C A 53 PHE N 1.0 -61.4 -9.4 PSI 59 59 A 54 PRO C A 55 ALA N A 55 ALA CA A 55 ALA C 1.0 -113.3 -56.2 PHI 60 60 A 55 ALA N A 55 ALA CA A 55 ALA C A 56 LEU N 1.0 -37.2 9.5 PSI 61 61 A 56 LEU C A 57 ARG N A 57 ARG CA A 57 ARG C 1.0 -130.1 -59.1 PHI 62 62 A 57 ARG N A 57 ARG CA A 57 ARG C A 58 PRO N 1.0 103.7 175.8 PSI 63 63 A 60 GLY C A 61 PHE N A 61 PHE CA A 61 PHE C 1.0 -148.7 -92.3 PHI 64 64 A 61 PHE N A 61 PHE CA A 61 PHE C A 62 GLN N 1.0 121.2 178.1 PSI 65 65 A 61 PHE C A 62 GLN N A 62 GLN CA A 62 GLN C 1.0 -164.9 -99.5 PHI 66 66 A 62 GLN N A 62 GLN CA A 62 GLN C A 63 ALA N 1.0 122.3 162.1 PSI 67 67 A 62 GLN C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -135.3 -60.8 PHI 68 68 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 HIS N 1.0 111.9 156.1 PSI 69 69 A 63 ALA C A 64 HIS N A 64 HIS CA A 64 HIS C 1.0 -145.8 -98.4 PHI 70 70 A 64 HIS N A 64 HIS CA A 64 HIS C A 65 TYR N 1.0 122.2 168.6 PSI 71 71 A 64 HIS C A 65 TYR N A 65 TYR CA A 65 TYR C 1.0 -155.0 -114.3 PHI 72 72 A 65 TYR N A 65 TYR CA A 65 TYR C A 66 ARG N 1.0 125.6 165.9 PSI 73 73 A 65 TYR C A 66 ARG N A 66 ARG CA A 66 ARG C 1.0 -136.2 -72.2 PHI 74 74 A 66 ARG N A 66 ARG CA A 66 ARG C A 67 ALA N 1.0 98.4 149.3 PSI 75 75 A 66 ARG C A 67 ALA N A 67 ALA CA A 67 ALA C 1.0 -141.6 -63.3 PHI 76 76 A 67 ALA N A 67 ALA CA A 67 ALA C A 68 GLU N 1.0 115.3 186.6 PSI 77 77 A 67 ALA C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -77.3 -40.6 PHI 78 78 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 ARG N 1.0 -56.3 -7.8 PSI 79 79 A 68 GLU C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -108.8 -64.6 PHI 80 80 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 GLY N 1.0 -26.8 25.0 PSI 81 81 A 71 ASP C A 72 LEU N A 72 LEU CA A 72 LEU C 1.0 -130.8 -55.8 PHI 82 82 A 72 LEU N A 72 LEU CA A 72 LEU C A 73 VAL N 1.0 102.9 167.5 PSI 83 83 A 72 LEU C A 73 VAL N A 73 VAL CA A 73 VAL C 1.0 -128.5 -75.8 PHI 84 84 A 73 VAL N A 73 VAL CA A 73 VAL C A 74 ALA N 1.0 101.1 139.1 PSI 85 85 A 74 ALA C A 75 PHE N A 75 PHE CA A 75 PHE C 1.0 -163.2 -89.4 PHI 86 86 A 75 PHE N A 75 PHE CA A 75 PHE C A 76 SER N 1.0 128.9 175.7 PSI 87 87 A 77 SER C A 78 ASP N A 78 ASP CA A 78 ASP C 1.0 -81.4 -45.1 PHI 88 88 A 78 ASP N A 78 ASP CA A 78 ASP C A 79 GLU N 1.0 -52.6 -15.4 PSI 89 89 A 78 ASP C A 79 GLU N A 79 GLU CA A 79 GLU C 1.0 -78.5 -48.9 PHI 90 90 A 79 GLU N A 79 GLU CA A 79 GLU C A 80 GLU N 1.0 -60.5 -23.5 PSI 91 91 A 79 GLU C A 80 GLU N A 80 GLU CA A 80 GLU C 1.0 -79.6 -47.2 PHI 92 92 A 80 GLU N A 80 GLU CA A 80 GLU C A 81 LEU N 1.0 -59.0 -28.4 PSI 93 93 A 80 GLU C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -79.1 -47.6 PHI 94 94 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 THR N 1.0 -62.1 -25.0 PSI 95 95 A 81 LEU C A 82 THR N A 82 THR CA A 82 THR C 1.0 -84.8 -45.9 PHI 96 96 A 82 THR N A 82 THR CA A 82 THR C A 83 MET N 1.0 -55.5 -24.2 PSI 97 97 A 82 THR C A 83 MET N A 83 MET CA A 83 MET C 1.0 -82.6 -49.0 PHI 98 98 A 83 MET N A 83 MET CA A 83 MET C A 84 ALA N 1.0 -56.7 -24.2 PSI 99 99 A 83 MET C A 84 ALA N A 84 ALA CA A 84 ALA C 1.0 -81.1 -45.9 PHI 100 100 A 84 ALA N A 84 ALA CA A 84 ALA C A 85 MET N 1.0 -61.8 -25.4 PSI 101 101 A 84 ALA C A 85 MET N A 85 MET CA A 85 MET C 1.0 -75.8 -44.1 PHI 102 102 A 85 MET N A 85 MET CA A 85 MET C A 86 SER N 1.0 -56.4 -22.5 PSI 103 103 A 85 MET C A 86 SER N A 86 SER CA A 86 SER C 1.0 -84.7 -57.7 PHI 104 104 A 86 SER N A 86 SER CA A 86 SER C A 87 TYR N 1.0 -53.4 -10.5 PSI 105 105 A 86 SER C A 87 TYR N A 87 TYR CA A 87 TYR C 1.0 -113.7 -64.9 PHI 106 106 A 87 TYR N A 87 TYR CA A 87 TYR C A 88 VAL N 1.0 -53.2 14.1 PSI 107 107 A 91 ASP C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 -136.3 -103.3 PHI 108 108 A 92 ILE N A 92 ILE CA A 92 ILE C A 93 PHE N 1.0 115.4 147.9 PSI 109 109 A 92 ILE C A 93 PHE N A 93 PHE CA A 93 PHE C 1.0 -142.4 -103.1 PHI 110 110 A 93 PHE N A 93 PHE CA A 93 PHE C A 94 ARG N 1.0 108.3 148.1 PSI 111 111 A 93 PHE C A 94 ARG N A 94 ARG CA A 94 ARG C 1.0 -137.4 -71.2 PHI 112 112 A 94 ARG N A 94 ARG CA A 94 ARG C A 95 ILE N 1.0 104.0 155.5 PSI 113 113 A 94 ARG C A 95 ILE N A 95 ILE CA A 95 ILE C 1.0 -152.4 -116.5 PHI 114 114 A 95 ILE N A 95 ILE CA A 95 ILE C A 96 TYR N 1.0 134.2 186.3 PSI 115 115 A 95 ILE C A 96 TYR N A 96 TYR CA A 96 TYR C 1.0 -143.1 -101.4 PHI 116 116 A 96 TYR N A 96 TYR CA A 96 TYR C A 97 ILE N 1.0 104.2 138.9 PSI 117 117 A 96 TYR C A 97 ILE N A 97 ILE CA A 97 ILE C 1.0 -130.0 -89.1 PHI 118 118 A 97 ILE N A 97 ILE CA A 97 ILE C A 98 LYS N 1.0 107.8 139.1 PSI 119 119 A 97 ILE C A 98 LYS N A 98 LYS CA A 98 LYS C 1.0 -153.0 -100.2 PHI 120 120 A 98 LYS N A 98 LYS CA A 98 LYS C A 99 GLU N 1.0 116.1 174.1 PSI 121 121 A 98 LYS C A 99 GLU N A 99 GLU CA A 99 GLU C 1.0 -93.8 -53.8 PHI 122 122 A 99 GLU N A 99 GLU CA A 99 GLU C A 100 LYS N 1.0 112.4 155.2 PSI stop_ save_