data_nef_c16746_2kut 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 MET start . . 2 A 2 ASP middle . . 3 A 3 LEU middle . . 4 A 4 PRO middle . false 5 A 5 ILE middle . . 6 A 6 THR middle . . 7 A 7 LEU middle . . 8 A 8 SER middle . . 9 A 9 LYS middle . . 10 A 10 GLU middle . . 11 A 11 THR middle . . 12 A 12 PRO middle . false 13 A 13 PHE middle . . 14 A 14 GLU middle . . 15 A 15 GLY middle . false 16 A 16 GLU middle . . 17 A 17 GLU middle . . 18 A 18 ILE middle . . 19 A 19 THR middle . . 20 A 20 VAL middle . . 21 A 21 SER middle . . 22 A 22 ALA middle . . 23 A 23 ARG middle . . 24 A 24 VAL middle . . 25 A 25 THR middle . . 26 A 26 ASN middle . . 27 A 27 ARG middle . . 28 A 28 GLY middle . false 29 A 29 ALA middle . . 30 A 30 ALA middle . . 31 A 31 GLU middle . . 32 A 32 ALA middle . . 33 A 33 HIS middle . . 34 A 34 ASN middle . . 35 A 35 VAL middle . . 36 A 36 PRO middle . false 37 A 37 VAL middle . . 38 A 38 ALA middle . . 39 A 39 VAL middle . . 40 A 40 TYR middle . . 41 A 41 LEU middle . . 42 A 42 GLY middle . false 43 A 43 ASN middle . . 44 A 44 PRO middle . false 45 A 45 ALA middle . . 46 A 46 GLN middle . . 47 A 47 GLY middle . false 48 A 48 GLY middle . false 49 A 49 VAL middle . . 50 A 50 GLU middle . . 51 A 51 ILE middle . . 52 A 52 GLY middle . false 53 A 53 ARG middle . . 54 A 54 ASP middle . . 55 A 55 THR middle . . 56 A 56 ILE middle . . 57 A 57 SER middle . . 58 A 58 ARG middle . . 59 A 59 ILE middle . . 60 A 60 PRO middle . false 61 A 61 VAL middle . . 62 A 62 GLY middle . false 63 A 63 GLY middle . false 64 A 64 THR middle . . 65 A 65 GLY middle . false 66 A 66 LEU middle . . 67 A 67 ALA middle . . 68 A 68 ARG middle . . 69 A 69 VAL middle . . 70 A 70 GLN middle . . 71 A 71 TRP middle . . 72 A 72 LYS middle . . 73 A 73 ALA middle . . 74 A 74 THR middle . . 75 A 75 ARG middle . . 76 A 76 LYS middle . . 77 A 77 LEU middle . . 78 A 78 ALA middle . . 79 A 79 GLY middle . false 80 A 80 ARG middle . . 81 A 81 ALA middle . . 82 A 82 ALA middle . . 83 A 83 ASN middle . . 84 A 84 PRO middle . false 85 A 85 GLY middle . false 86 A 86 VAL middle . . 87 A 87 PRO middle . false 88 A 88 VAL middle . . 89 A 89 TYR middle . . 90 A 90 ALA middle . . 91 A 91 VAL middle . . 92 A 92 VAL middle . . 93 A 93 ASP middle . . 94 A 94 PRO middle . false 95 A 95 ASP middle . . 96 A 96 ASN middle . . 97 A 97 ARG middle . . 98 A 98 VAL middle . . 99 A 99 ALA middle . . 100 A 100 GLU middle . . 101 A 101 SER middle . . 102 A 102 ASP middle . . 103 A 103 LYS middle . . 104 A 104 ALA middle . . 105 A 105 ASN middle . . 106 A 106 ASN middle . . 107 A 107 VAL middle . . 108 A 108 PHE middle . . 109 A 109 SER middle . . 110 A 110 ARG middle . . 111 A 111 ILE middle . . 112 A 112 VAL middle . . 113 A 113 LYS middle . . 114 A 114 VAL middle . . 115 A 115 LEU middle . . 116 A 116 GLU middle . . 117 A 117 HIS middle . . 118 A 118 HIS middle . . 119 A 119 HIS middle . . 120 A 120 HIS middle . . 121 A 121 HIS middle . . 122 A 122 HIS 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 MET HA H 1 4.395 0.000 A 1 MET HBx H 1 1.978 0.000 A 1 MET HBy H 1 1.978 0.000 A 1 MET CA C 13 55.678 0.000 A 1 MET CB C 13 33.206 0.011 A 2 ASP H H 1 8.456 0.002 A 2 ASP HA H 1 4.527 0.005 A 2 ASP HBx H 1 2.534 0.006 A 2 ASP HBy H 1 2.534 0.006 A 2 ASP C C 13 175.546 0.012 A 2 ASP CA C 13 53.953 0.016 A 2 ASP CB C 13 40.878 0.084 A 2 ASP N N 15 120.722 0.011 A 3 LEU H H 1 7.836 0.001 A 3 LEU HA H 1 4.554 0.004 A 3 LEU HBy H 1 1.564 0.001 A 3 LEU HBx H 1 1.481 0.005 A 3 LEU HD2% H 1 0.927 0.006 A 3 LEU HG H 1 0.946 0.003 A 3 LEU CA C 13 53.213 0.089 A 3 LEU CB C 13 42.478 0.093 A 3 LEU CDy C 13 23.405 0.058 A 3 LEU CG C 13 25.459 0.129 A 3 LEU N N 15 122.798 0.015 A 4 PRO HA H 1 4.124 0.005 A 4 PRO HBy H 1 1.796 0.006 A 4 PRO HBx H 1 1.514 0.006 A 4 PRO HDy H 1 3.712 0.003 A 4 PRO HDx H 1 3.659 0.000 A 4 PRO HGx H 1 1.778 0.004 A 4 PRO HGy H 1 1.778 0.004 A 4 PRO C C 13 176.336 0.007 A 4 PRO CA C 13 64.689 0.097 A 4 PRO CB C 13 32.169 0.064 A 4 PRO CD C 13 50.486 0.000 A 4 PRO CG C 13 27.733 0.125 A 5 ILE H H 1 7.002 0.006 A 5 ILE HA H 1 5.129 0.004 A 5 ILE HB H 1 1.380 0.008 A 5 ILE HD1% H 1 0.611 0.009 A 5 ILE HG1x H 1 0.711 0.000 A 5 ILE HG1y H 1 0.711 0.000 A 5 ILE HG2% H 1 0.580 0.007 A 5 ILE C C 13 175.398 0.022 A 5 ILE CA C 13 59.496 0.054 A 5 ILE CB C 13 40.280 0.083 A 5 ILE CD1 C 13 13.810 0.098 A 5 ILE CG1 C 13 27.686 0.117 A 5 ILE CG2 C 13 17.212 0.039 A 5 ILE N N 15 115.821 0.032 A 6 THR H H 1 9.008 0.004 A 6 THR HA H 1 4.483 0.003 A 6 THR HB H 1 4.133 0.007 A 6 THR HG2% H 1 1.093 0.008 A 6 THR C C 13 172.271 0.029 A 6 THR CA C 13 60.046 0.116 A 6 THR CB C 13 71.711 0.063 A 6 THR CG2 C 13 22.156 0.000 A 6 THR N N 15 119.016 0.028 A 7 LEU H H 1 8.604 0.004 A 7 LEU HA H 1 5.275 0.007 A 7 LEU HBx H 1 1.555 0.007 A 7 LEU HBy H 1 1.555 0.007 A 7 LEU HD2% H 1 0.880 0.007 A 7 LEU HG H 1 0.986 0.005 A 7 LEU C C 13 178.251 0.006 A 7 LEU CA C 13 52.988 0.096 A 7 LEU CB C 13 46.107 0.105 A 7 LEU CDy C 13 24.642 0.112 A 7 LEU CG C 13 26.661 0.078 A 7 LEU N N 15 120.925 0.034 A 8 SER H H 1 8.496 0.002 A 8 SER HA H 1 4.147 0.005 A 8 SER C C 13 174.157 0.000 A 8 SER CA C 13 60.793 0.000 A 8 SER CB C 13 61.836 0.000 A 8 SER N N 15 115.577 0.048 A 9 LYS HA H 1 4.408 0.000 A 9 LYS HBx H 1 1.613 0.015 A 9 LYS HBy H 1 1.613 0.015 A 9 LYS C C 13 174.309 0.026 A 9 LYS CA C 13 55.708 0.025 A 9 LYS CB C 13 35.333 0.045 A 9 LYS CD C 13 29.189 0.000 A 9 LYS CE C 13 42.057 0.000 A 9 LYS CG C 13 24.491 0.000 A 10 GLU H H 1 8.316 0.001 A 10 GLU HA H 1 4.099 0.006 A 10 GLU HBx H 1 2.064 0.010 A 10 GLU HBy H 1 2.064 0.010 A 10 GLU HGx H 1 2.369 0.011 A 10 GLU HGy H 1 2.369 0.011 A 10 GLU C C 13 176.429 0.011 A 10 GLU CA C 13 58.805 0.048 A 10 GLU CB C 13 30.603 0.040 A 10 GLU CG C 13 36.635 0.119 A 10 GLU N N 15 121.668 0.020 A 11 THR H H 1 7.759 0.006 A 11 THR HA H 1 5.101 0.013 A 11 THR HB H 1 4.044 0.004 A 11 THR HG2% H 1 1.070 0.004 A 11 THR C C 13 172.904 0.000 A 11 THR CA C 13 56.026 0.160 A 11 THR CB C 13 69.905 0.032 A 11 THR CG2 C 13 21.019 0.030 A 11 THR N N 15 106.357 0.022 A 12 PRO HA H 1 4.243 0.004 A 12 PRO HBx H 1 1.788 0.006 A 12 PRO HBy H 1 1.788 0.006 A 12 PRO HDx H 1 3.318 0.000 A 12 PRO HDy H 1 3.318 0.000 A 12 PRO HGx H 1 1.683 0.000 A 12 PRO HGy H 1 1.683 0.000 A 12 PRO C C 13 175.192 0.022 A 12 PRO CA C 13 61.719 0.054 A 12 PRO CB C 13 32.950 0.064 A 12 PRO CG C 13 27.272 0.038 A 13 PHE H H 1 8.676 0.003 A 13 PHE HA H 1 4.758 0.002 A 13 PHE HBx H 1 2.702 0.012 A 13 PHE HBy H 1 2.702 0.012 A 13 PHE HDx H 1 6.884 0.000 A 13 PHE HDy H 1 6.884 0.000 A 13 PHE C C 13 176.308 0.009 A 13 PHE CA C 13 57.016 0.062 A 13 PHE CB C 13 41.013 0.051 A 13 PHE N N 15 116.962 0.027 A 14 GLU H H 1 8.281 0.003 A 14 GLU HA H 1 3.421 0.007 A 14 GLU HBx H 1 1.963 0.012 A 14 GLU HBy H 1 1.963 0.012 A 14 GLU HGy H 1 2.351 0.003 A 14 GLU HGx H 1 2.112 0.003 A 14 GLU C C 13 176.732 0.023 A 14 GLU CA C 13 58.029 0.103 A 14 GLU CB C 13 29.915 0.017 A 14 GLU CG C 13 35.879 0.087 A 14 GLU N N 15 119.828 0.018 A 15 GLY H H 1 9.115 0.009 A 15 GLY HAy H 1 4.305 0.003 A 15 GLY HAx H 1 3.410 0.006 A 15 GLY C C 13 173.643 0.000 A 15 GLY CA C 13 45.130 0.102 A 15 GLY N N 15 116.248 0.011 A 16 GLU H H 1 8.155 0.003 A 16 GLU HA H 1 4.043 0.005 A 16 GLU HBy H 1 1.914 0.006 A 16 GLU HBx H 1 1.544 0.008 A 16 GLU HGx H 1 2.074 0.000 A 16 GLU HGy H 1 2.074 0.000 A 16 GLU C C 13 174.898 0.012 A 16 GLU CA C 13 56.817 0.075 A 16 GLU CB C 13 31.056 0.141 A 16 GLU CG C 13 37.185 0.138 A 16 GLU N N 15 123.082 0.026 A 17 GLU H H 1 8.528 0.002 A 17 GLU HA H 1 4.728 0.006 A 17 GLU HBx H 1 1.871 0.000 A 17 GLU HBy H 1 1.871 0.000 A 17 GLU HGx H 1 1.978 0.005 A 17 GLU HGy H 1 1.978 0.005 A 17 GLU C C 13 176.151 0.017 A 17 GLU CA C 13 56.084 0.007 A 17 GLU CB C 13 30.187 0.000 A 17 GLU CG C 13 37.055 0.015 A 17 GLU N N 15 125.445 0.050 A 18 ILE H H 1 9.114 0.005 A 18 ILE HA H 1 4.713 0.001 A 18 ILE HB H 1 2.168 0.003 A 18 ILE HD1% H 1 1.108 0.005 A 18 ILE HG2% H 1 0.889 0.006 A 18 ILE C C 13 173.964 0.028 A 18 ILE CA C 13 59.004 0.030 A 18 ILE CB C 13 42.199 0.065 A 18 ILE CD1 C 13 16.080 0.049 A 18 ILE CG1 C 13 25.583 0.000 A 18 ILE CG2 C 13 18.981 0.018 A 18 ILE N N 15 122.248 0.057 A 19 THR H H 1 8.742 0.007 A 19 THR HA H 1 4.900 0.006 A 19 THR HB H 1 3.740 0.005 A 19 THR HG2% H 1 1.065 0.006 A 19 THR C C 13 174.859 0.025 A 19 THR CA C 13 62.223 0.120 A 19 THR CB C 13 70.753 0.042 A 19 THR CG2 C 13 22.255 0.024 A 19 THR N N 15 116.908 0.054 A 20 VAL H H 1 9.623 0.004 A 20 VAL HA H 1 4.426 0.008 A 20 VAL HB H 1 1.979 0.006 A 20 VAL HGx% H 1 0.627 0.000 A 20 VAL HGy% H 1 0.835 0.000 A 20 VAL C C 13 174.216 0.027 A 20 VAL CA C 13 61.926 0.044 A 20 VAL CB C 13 32.722 0.062 A 20 VAL CGy C 13 20.948 0.000 A 20 VAL N N 15 132.209 0.019 A 21 SER H H 1 9.036 0.002 A 21 SER HA H 1 5.726 0.006 A 21 SER HBy H 1 3.712 0.008 A 21 SER HBx H 1 3.463 0.004 A 21 SER C C 13 172.510 0.023 A 21 SER CA C 13 56.748 0.063 A 21 SER CB C 13 64.623 0.146 A 21 SER N N 15 121.835 0.025 A 22 ALA H H 1 9.244 0.003 A 22 ALA HA H 1 5.240 0.006 A 22 ALA HB% H 1 0.965 0.004 A 22 ALA C C 13 174.882 0.021 A 22 ALA CA C 13 49.794 0.087 A 22 ALA CB C 13 21.224 0.049 A 22 ALA N N 15 126.466 0.009 A 23 ARG H H 1 8.539 0.004 A 23 ARG HA H 1 4.835 0.008 A 23 ARG HBx H 1 1.541 0.008 A 23 ARG HBy H 1 1.541 0.008 A 23 ARG HDx H 1 3.055 0.007 A 23 ARG HDy H 1 3.055 0.007 A 23 ARG HGx H 1 1.501 0.004 A 23 ARG HGy H 1 1.501 0.004 A 23 ARG C C 13 174.878 0.000 A 23 ARG CA C 13 55.376 0.109 A 23 ARG CB C 13 31.843 0.067 A 23 ARG CD C 13 43.418 0.162 A 23 ARG CG C 13 27.906 0.003 A 23 ARG N N 15 124.056 0.038 A 24 VAL H H 1 8.729 0.002 A 24 VAL HA H 1 4.169 0.009 A 24 VAL HB H 1 1.654 0.009 A 24 VAL HG1% H 1 0.766 0.009 A 24 VAL C C 13 174.921 0.018 A 24 VAL CA C 13 61.409 0.093 A 24 VAL CB C 13 34.661 0.066 A 24 VAL CGx C 13 21.441 0.010 A 24 VAL N N 15 125.144 0.019 A 25 THR H H 1 8.722 0.002 A 25 THR HA H 1 4.861 0.006 A 25 THR HB H 1 3.846 0.005 A 25 THR HG2% H 1 0.983 0.008 A 25 THR C C 13 173.913 0.026 A 25 THR CA C 13 61.689 0.135 A 25 THR CB C 13 70.261 0.044 A 25 THR CG2 C 13 21.375 0.088 A 25 THR N N 15 123.567 0.017 A 26 ASN H H 1 8.413 0.003 A 26 ASN HA H 1 4.806 0.010 A 26 ASN HBy H 1 3.246 0.004 A 26 ASN HBx H 1 2.267 0.005 A 26 ASN CA C 13 52.134 0.100 A 26 ASN CB C 13 38.362 0.078 A 26 ASN N N 15 122.641 0.014 A 27 ARG H H 1 8.957 0.005 A 27 ARG HA H 1 4.583 0.011 A 27 ARG HBy H 1 2.088 0.003 A 27 ARG HBx H 1 1.623 0.011 A 27 ARG HDx H 1 3.183 0.005 A 27 ARG HDy H 1 3.183 0.005 A 27 ARG HGx H 1 1.556 0.003 A 27 ARG HGy H 1 1.556 0.003 A 27 ARG C C 13 176.684 0.008 A 27 ARG CA C 13 55.282 0.030 A 27 ARG CB C 13 29.653 0.036 A 27 ARG CD C 13 43.414 0.130 A 27 ARG CG C 13 28.063 0.089 A 27 ARG N N 15 127.783 0.015 A 28 GLY H H 1 8.245 0.004 A 28 GLY HAy H 1 4.396 0.008 A 28 GLY HAx H 1 3.917 0.003 A 28 GLY C C 13 172.669 0.041 A 28 GLY CA C 13 44.471 0.088 A 28 GLY N N 15 108.723 0.016 A 29 ALA H H 1 8.233 0.002 A 29 ALA HA H 1 4.350 0.006 A 29 ALA HB% H 1 1.374 0.005 A 29 ALA C C 13 176.425 0.009 A 29 ALA CA C 13 52.172 0.029 A 29 ALA CB C 13 19.681 0.063 A 29 ALA N N 15 118.796 0.025 A 30 ALA H H 1 7.609 0.004 A 30 ALA HA H 1 4.545 0.005 A 30 ALA HB% H 1 1.340 0.006 A 30 ALA C C 13 176.634 0.018 A 30 ALA CA C 13 50.037 0.090 A 30 ALA CB C 13 22.330 0.046 A 30 ALA N N 15 119.918 0.023 A 31 GLU H H 1 8.703 0.004 A 31 GLU HA H 1 3.683 0.008 A 31 GLU HBx H 1 1.874 0.000 A 31 GLU HBy H 1 1.874 0.000 A 31 GLU HGy H 1 2.076 0.000 A 31 GLU HGx H 1 1.824 0.002 A 31 GLU C C 13 174.210 0.019 A 31 GLU CA C 13 57.967 0.087 A 31 GLU CB C 13 30.529 0.005 A 31 GLU CG C 13 37.059 0.108 A 31 GLU N N 15 122.339 0.026 A 32 ALA H H 1 7.947 0.005 A 32 ALA HA H 1 4.573 0.004 A 32 ALA HB% H 1 1.149 0.005 A 32 ALA C C 13 176.282 0.016 A 32 ALA CA C 13 50.697 0.083 A 32 ALA CB C 13 20.810 0.066 A 32 ALA N N 15 128.462 0.010 A 33 HIS H H 1 8.664 0.002 A 33 HIS HA H 1 5.210 0.009 A 33 HIS HBx H 1 3.014 0.004 A 33 HIS HBy H 1 3.014 0.004 A 33 HIS HD2 H 1 7.014 0.002 A 33 HIS C C 13 173.957 0.022 A 33 HIS CA C 13 54.179 0.023 A 33 HIS CB C 13 33.274 0.062 A 33 HIS CD2 C 13 118.995 0.021 A 33 HIS N N 15 118.883 0.026 A 34 ASN H H 1 8.781 0.002 A 34 ASN HA H 1 4.102 0.008 A 34 ASN HBy H 1 2.852 0.003 A 34 ASN HBx H 1 2.548 0.006 A 34 ASN C C 13 174.020 0.007 A 34 ASN CA C 13 54.181 0.125 A 34 ASN CB C 13 37.006 0.092 A 34 ASN N N 15 121.329 0.014 A 35 VAL H H 1 8.523 0.003 A 35 VAL HA H 1 4.173 0.010 A 35 VAL HB H 1 1.948 0.004 A 35 VAL HGx% H 1 0.815 0.001 A 35 VAL HGy% H 1 0.704 0.000 A 35 VAL C C 13 173.461 0.000 A 35 VAL CA C 13 60.685 0.100 A 35 VAL CB C 13 34.192 0.099 A 35 VAL N N 15 122.549 0.033 A 36 PRO HA H 1 5.147 0.006 A 36 PRO HBy H 1 2.282 0.008 A 36 PRO HBx H 1 1.780 0.005 A 36 PRO HDx H 1 3.716 0.000 A 36 PRO HDy H 1 3.716 0.000 A 36 PRO HGy H 1 2.281 0.000 A 36 PRO HGx H 1 1.997 0.000 A 36 PRO C C 13 176.661 0.016 A 36 PRO CA C 13 61.858 0.054 A 36 PRO CB C 13 32.496 0.097 A 36 PRO CD C 13 51.228 0.103 A 36 PRO CG C 13 28.251 0.107 A 37 VAL H H 1 8.852 0.004 A 37 VAL HA H 1 4.691 0.006 A 37 VAL HB H 1 1.637 0.007 A 37 VAL HG1% H 1 0.549 0.000 A 37 VAL HG2% H 1 0.864 0.004 A 37 VAL C C 13 174.333 0.014 A 37 VAL CA C 13 61.360 0.064 A 37 VAL CB C 13 35.734 0.041 A 37 VAL CGx C 13 20.416 0.000 A 37 VAL CGy C 13 22.398 0.026 A 37 VAL N N 15 122.152 0.017 A 38 ALA H H 1 8.612 0.007 A 38 ALA HA H 1 5.056 0.006 A 38 ALA HB% H 1 1.167 0.006 A 38 ALA C C 13 174.776 0.056 A 38 ALA CA C 13 49.969 0.081 A 38 ALA CB C 13 23.309 0.055 A 38 ALA N N 15 126.460 0.059 A 39 VAL H H 1 8.361 0.005 A 39 VAL HA H 1 5.086 0.005 A 39 VAL HB H 1 1.430 0.004 A 39 VAL HGx% H 1 0.607 0.006 A 39 VAL HGy% H 1 0.565 0.007 A 39 VAL C C 13 174.511 0.041 A 39 VAL CA C 13 60.415 0.086 A 39 VAL CB C 13 33.885 0.051 A 39 VAL CGx C 13 21.457 0.089 A 39 VAL N N 15 120.755 0.014 A 40 TYR H H 1 9.776 0.003 A 40 TYR HA H 1 5.060 0.008 A 40 TYR HBx H 1 2.655 0.009 A 40 TYR HBy H 1 2.655 0.009 A 40 TYR HDx H 1 6.590 0.004 A 40 TYR HDy H 1 6.590 0.004 A 40 TYR HEx H 1 6.664 0.001 A 40 TYR HEy H 1 6.664 0.001 A 40 TYR C C 13 174.046 0.021 A 40 TYR CA C 13 56.875 0.085 A 40 TYR CB C 13 43.327 0.084 A 40 TYR CDx C 13 132.380 0.048 A 40 TYR CEx C 13 119.266 0.001 A 40 TYR N N 15 125.777 0.035 A 41 LEU H H 1 8.925 0.006 A 41 LEU HA H 1 4.702 0.006 A 41 LEU HBy H 1 1.909 0.009 A 41 LEU HBx H 1 1.195 0.004 A 41 LEU HD2% H 1 0.918 0.005 A 41 LEU HG H 1 0.974 0.008 A 41 LEU C C 13 176.529 0.000 A 41 LEU CA C 13 54.067 0.133 A 41 LEU CB C 13 42.609 0.105 A 41 LEU CDy C 13 24.905 0.082 A 41 LEU CG C 13 26.110 0.115 A 41 LEU N N 15 122.250 0.033 A 42 GLY H H 1 8.618 0.002 A 42 GLY HAy H 1 4.295 0.005 A 42 GLY HAx H 1 3.510 0.002 A 42 GLY C C 13 170.094 0.053 A 42 GLY CA C 13 43.657 0.065 A 42 GLY N N 15 114.930 0.025 A 43 ASN H H 1 8.003 0.004 A 43 ASN C C 13 176.630 0.000 A 43 ASN CA C 13 50.024 0.000 A 43 ASN CB C 13 38.756 0.000 A 43 ASN N N 15 116.432 0.125 A 44 PRO HA H 1 3.470 0.005 A 44 PRO HBy H 1 1.354 0.005 A 44 PRO HBx H 1 0.618 0.010 A 44 PRO HDy H 1 2.994 0.002 A 44 PRO HDx H 1 2.793 0.000 A 44 PRO HGy H 1 1.289 0.002 A 44 PRO HGx H 1 0.738 0.008 A 44 PRO C C 13 176.852 0.008 A 44 PRO CA C 13 64.239 0.051 A 44 PRO CB C 13 30.701 0.097 A 44 PRO CD C 13 50.173 0.000 A 44 PRO CG C 13 26.304 0.147 A 45 ALA H H 1 7.480 0.007 A 45 ALA HA H 1 4.165 0.007 A 45 ALA HB% H 1 1.228 0.005 A 45 ALA C C 13 177.673 0.018 A 45 ALA CA C 13 52.903 0.101 A 45 ALA CB C 13 19.066 0.042 A 45 ALA N N 15 118.399 0.021 A 46 GLN H H 1 7.551 0.005 A 46 GLN HA H 1 4.532 0.004 A 46 GLN HBy H 1 2.243 0.005 A 46 GLN HBx H 1 1.567 0.003 A 46 GLN HGx H 1 2.112 0.009 A 46 GLN HGy H 1 2.112 0.009 A 46 GLN C C 13 175.957 0.010 A 46 GLN CA C 13 53.858 0.005 A 46 GLN CB C 13 29.733 0.048 A 46 GLN CG C 13 33.665 0.085 A 46 GLN N N 15 117.538 0.011 A 47 GLY H H 1 8.051 0.003 A 47 GLY HAy H 1 4.097 0.004 A 47 GLY HAx H 1 3.648 0.004 A 47 GLY C C 13 174.952 0.012 A 47 GLY CA C 13 45.815 0.105 A 47 GLY N N 15 108.624 0.017 A 48 GLY H H 1 7.878 0.003 A 48 GLY HAy H 1 4.112 0.005 A 48 GLY HAx H 1 2.862 0.004 A 48 GLY C C 13 172.465 0.037 A 48 GLY CA C 13 45.461 0.074 A 48 GLY N N 15 108.777 0.016 A 49 VAL H H 1 8.185 0.002 A 49 VAL HA H 1 4.427 0.005 A 49 VAL HB H 1 2.046 0.005 A 49 VAL HG1% H 1 0.990 0.004 A 49 VAL HG2% H 1 1.051 0.008 A 49 VAL C C 13 175.162 0.038 A 49 VAL CA C 13 60.619 0.096 A 49 VAL CB C 13 35.139 0.054 A 49 VAL CGy C 13 21.077 0.014 A 49 VAL CGx C 13 20.645 0.065 A 49 VAL N N 15 119.724 0.020 A 50 GLU H H 1 8.915 0.002 A 50 GLU HA H 1 3.594 0.005 A 50 GLU HBx H 1 1.757 0.005 A 50 GLU HBy H 1 1.757 0.005 A 50 GLU HGx H 1 1.607 0.002 A 50 GLU HGy H 1 1.607 0.002 A 50 GLU C C 13 176.904 0.020 A 50 GLU CA C 13 57.879 0.057 A 50 GLU CB C 13 30.254 0.069 A 50 GLU CG C 13 37.322 0.101 A 50 GLU N N 15 128.036 0.041 A 51 ILE H H 1 9.578 0.005 A 51 ILE HA H 1 4.157 0.006 A 51 ILE HB H 1 1.513 0.007 A 51 ILE HD1% H 1 -0.074 0.011 A 51 ILE HG1y H 1 1.255 0.006 A 51 ILE HG1x H 1 0.765 0.001 A 51 ILE HG2% H 1 0.885 0.004 A 51 ILE C C 13 176.788 0.018 A 51 ILE CA C 13 62.587 0.067 A 51 ILE CB C 13 39.670 0.087 A 51 ILE CD1 C 13 12.519 0.084 A 51 ILE CG1 C 13 27.713 0.055 A 51 ILE CG2 C 13 18.694 0.105 A 51 ILE N N 15 127.526 0.034 A 52 GLY H H 1 7.408 0.002 A 52 GLY HAx H 1 4.119 0.008 A 52 GLY HAy H 1 4.119 0.008 A 52 GLY C C 13 169.697 0.032 A 52 GLY CA C 13 45.403 0.036 A 52 GLY N N 15 106.118 0.027 A 53 ARG H H 1 8.431 0.003 A 53 ARG HA H 1 5.330 0.008 A 53 ARG HBy H 1 1.848 0.005 A 53 ARG HBx H 1 1.613 0.005 A 53 ARG HDx H 1 2.885 0.000 A 53 ARG HDy H 1 2.885 0.000 A 53 ARG HGx H 1 1.490 0.002 A 53 ARG HGy H 1 1.490 0.002 A 53 ARG C C 13 174.274 0.016 A 53 ARG CA C 13 54.843 0.019 A 53 ARG CB C 13 35.012 0.140 A 53 ARG CD C 13 44.182 0.016 A 53 ARG CG C 13 26.311 0.071 A 53 ARG N N 15 116.170 0.009 A 54 ASP H H 1 8.797 0.004 A 54 ASP HA H 1 5.046 0.004 A 54 ASP HBy H 1 2.809 0.006 A 54 ASP HBx H 1 2.209 0.006 A 54 ASP C C 13 174.548 0.036 A 54 ASP CA C 13 52.702 0.094 A 54 ASP CB C 13 45.923 0.087 A 54 ASP N N 15 120.164 0.023 A 55 THR H H 1 8.217 0.004 A 55 THR HA H 1 4.831 0.005 A 55 THR HB H 1 3.794 0.005 A 55 THR HG2% H 1 0.738 0.007 A 55 THR C C 13 173.555 0.010 A 55 THR CA C 13 61.662 0.123 A 55 THR CB C 13 70.229 0.049 A 55 THR CG2 C 13 21.326 0.070 A 55 THR N N 15 118.211 0.051 A 56 ILE H H 1 9.094 0.004 A 56 ILE HA H 1 4.094 0.005 A 56 ILE HB H 1 1.630 0.007 A 56 ILE HD1% H 1 0.655 0.008 A 56 ILE HG1x H 1 0.808 0.006 A 56 ILE HG1y H 1 0.808 0.006 A 56 ILE HG2% H 1 0.775 0.002 A 56 ILE C C 13 177.172 0.005 A 56 ILE CA C 13 60.919 0.035 A 56 ILE CB C 13 39.187 0.063 A 56 ILE CD1 C 13 15.133 0.096 A 56 ILE CG1 C 13 26.754 0.201 A 56 ILE CG2 C 13 18.378 0.041 A 56 ILE N N 15 129.513 0.024 A 57 SER H H 1 9.005 0.002 A 57 SER HA H 1 4.761 0.001 A 57 SER C C 13 176.286 0.002 A 57 SER CA C 13 62.858 0.004 A 57 SER N N 15 124.580 0.027 A 58 ARG H H 1 7.857 0.003 A 58 ARG HA H 1 5.193 0.005 A 58 ARG HBx H 1 1.679 0.007 A 58 ARG HBy H 1 1.679 0.007 A 58 ARG HDx H 1 3.118 0.004 A 58 ARG HDy H 1 3.118 0.004 A 58 ARG HGx H 1 1.270 0.009 A 58 ARG HGy H 1 1.270 0.009 A 58 ARG C C 13 174.848 0.016 A 58 ARG CA C 13 55.371 0.134 A 58 ARG CB C 13 34.000 0.077 A 58 ARG CD C 13 43.601 0.154 A 58 ARG CG C 13 27.186 0.065 A 58 ARG N N 15 118.910 0.032 A 59 ILE H H 1 8.665 0.003 A 59 ILE HA H 1 4.528 0.002 A 59 ILE HB H 1 1.622 0.003 A 59 ILE HD1% H 1 0.676 0.010 A 59 ILE HG2% H 1 0.873 0.006 A 59 ILE C C 13 174.030 0.000 A 59 ILE CA C 13 58.969 0.000 A 59 ILE CB C 13 40.969 0.027 A 59 ILE CD1 C 13 13.596 0.033 A 59 ILE CG2 C 13 19.149 0.000 A 59 ILE N N 15 121.045 0.016 A 60 PRO HA H 1 4.408 0.006 A 60 PRO HBy H 1 2.396 0.003 A 60 PRO HBx H 1 1.819 0.008 A 60 PRO HDx H 1 3.657 0.003 A 60 PRO HDy H 1 3.657 0.003 A 60 PRO HGx H 1 1.970 0.001 A 60 PRO HGy H 1 1.970 0.001 A 60 PRO C C 13 176.726 0.012 A 60 PRO CA C 13 62.730 0.077 A 60 PRO CB C 13 33.129 0.019 A 60 PRO CD C 13 52.231 0.103 A 60 PRO CG C 13 27.456 0.113 A 61 VAL H H 1 8.835 0.001 A 61 VAL HA H 1 3.305 0.005 A 61 VAL HB H 1 1.781 0.006 A 61 VAL HG1% H 1 0.840 0.004 A 61 VAL HG2% H 1 0.692 0.003 A 61 VAL C C 13 178.217 0.004 A 61 VAL CA C 13 66.045 0.067 A 61 VAL CB C 13 31.443 0.041 A 61 VAL CGx C 13 20.709 0.067 A 61 VAL CGy C 13 21.724 0.113 A 61 VAL N N 15 123.362 0.014 A 62 GLY H H 1 8.849 0.001 A 62 GLY HAy H 1 4.127 0.005 A 62 GLY HAx H 1 3.748 0.012 A 62 GLY C C 13 174.245 0.004 A 62 GLY CA C 13 45.841 0.106 A 62 GLY N N 15 117.654 0.017 A 63 GLY H H 1 8.292 0.003 A 63 GLY HAy H 1 4.520 0.004 A 63 GLY HAx H 1 3.484 0.005 A 63 GLY C C 13 171.831 0.015 A 63 GLY CA C 13 44.075 0.082 A 63 GLY N N 15 108.309 0.012 A 64 THR H H 1 8.204 0.002 A 64 THR HA H 1 5.347 0.005 A 64 THR HB H 1 3.824 0.005 A 64 THR HG2% H 1 1.034 0.007 A 64 THR C C 13 174.457 0.022 A 64 THR CA C 13 60.738 0.085 A 64 THR CB C 13 72.613 0.049 A 64 THR CG2 C 13 21.760 0.042 A 64 THR N N 15 110.211 0.012 A 65 GLY H H 1 9.121 0.002 A 65 GLY HAy H 1 4.648 0.005 A 65 GLY HAx H 1 3.412 0.004 A 65 GLY C C 13 170.712 0.011 A 65 GLY CA C 13 44.194 0.076 A 65 GLY N N 15 111.346 0.014 A 66 LEU H H 1 8.431 0.002 A 66 LEU HA H 1 5.158 0.007 A 66 LEU HBx H 1 1.387 0.009 A 66 LEU HBy H 1 1.387 0.009 A 66 LEU HD1% H 1 0.762 0.003 A 66 LEU HD2% H 1 0.713 0.003 A 66 LEU C C 13 174.995 0.000 A 66 LEU CA C 13 54.026 0.095 A 66 LEU CB C 13 45.470 0.088 A 66 LEU CDx C 13 24.857 0.045 A 66 LEU CDy C 13 24.908 0.030 A 66 LEU CG C 13 27.135 0.000 A 66 LEU N N 15 121.388 0.023 A 67 ALA H H 1 8.920 0.003 A 67 ALA HA H 1 4.775 0.005 A 67 ALA HB% H 1 1.240 0.009 A 67 ALA C C 13 176.123 0.015 A 67 ALA CA C 13 49.669 0.100 A 67 ALA CB C 13 21.281 0.044 A 67 ALA N N 15 128.272 0.010 A 68 ARG H H 1 9.679 0.003 A 68 ARG HA H 1 5.270 0.004 A 68 ARG HBx H 1 1.505 0.005 A 68 ARG HBy H 1 1.505 0.005 A 68 ARG HDx H 1 3.032 0.002 A 68 ARG HDy H 1 3.032 0.002 A 68 ARG HGx H 1 1.448 0.008 A 68 ARG HGy H 1 1.448 0.008 A 68 ARG C C 13 175.060 0.022 A 68 ARG CA C 13 55.298 0.023 A 68 ARG CB C 13 33.867 0.021 A 68 ARG CD C 13 43.972 0.129 A 68 ARG CG C 13 27.551 0.081 A 68 ARG N N 15 121.688 0.015 A 69 VAL H H 1 8.866 0.004 A 69 VAL HA H 1 4.400 0.011 A 69 VAL HB H 1 1.787 0.004 A 69 VAL HG1% H 1 0.546 0.000 A 69 VAL HG2% H 1 0.647 0.000 A 69 VAL C C 13 174.178 0.022 A 69 VAL CA C 13 59.983 0.091 A 69 VAL CB C 13 36.431 0.097 A 69 VAL CGx C 13 20.453 0.080 A 69 VAL N N 15 118.657 0.023 A 70 GLN H H 1 8.594 0.007 A 70 GLN HA H 1 5.016 0.007 A 70 GLN HBx H 1 2.013 0.005 A 70 GLN HBy H 1 2.013 0.005 A 70 GLN HGy H 1 2.405 0.002 A 70 GLN HGx H 1 2.245 0.012 A 70 GLN C C 13 175.391 0.022 A 70 GLN CA C 13 54.889 0.084 A 70 GLN CB C 13 31.250 0.053 A 70 GLN CG C 13 34.919 0.086 A 70 GLN N N 15 123.558 0.028 A 71 TRP H H 1 9.246 0.002 A 71 TRP HA H 1 4.977 0.010 A 71 TRP HBy H 1 3.010 0.017 A 71 TRP HBx H 1 2.650 0.010 A 71 TRP HD1 H 1 7.393 0.001 A 71 TRP HE1 H 1 9.951 0.008 A 71 TRP HE3 H 1 7.190 0.000 A 71 TRP HH2 H 1 7.044 0.000 A 71 TRP HZ2 H 1 7.623 0.005 A 71 TRP C C 13 173.726 0.025 A 71 TRP CA C 13 55.426 0.156 A 71 TRP CB C 13 32.843 0.071 A 71 TRP CD1 C 13 127.846 0.005 A 71 TRP CE3 C 13 120.134 0.071 A 71 TRP CH2 C 13 123.400 0.001 A 71 TRP CZ2 C 13 114.268 0.020 A 71 TRP N N 15 123.611 0.015 A 71 TRP NE1 N 15 130.205 0.000 A 72 LYS H H 1 8.073 0.007 A 72 LYS HA H 1 3.988 0.005 A 72 LYS HBx H 1 1.475 0.004 A 72 LYS HBy H 1 1.475 0.004 A 72 LYS HEx H 1 2.973 0.009 A 72 LYS HEy H 1 2.973 0.009 A 72 LYS HGx H 1 1.129 0.014 A 72 LYS HGy H 1 1.129 0.014 A 72 LYS C C 13 172.777 0.022 A 72 LYS CA C 13 55.385 0.027 A 72 LYS CB C 13 31.119 0.076 A 72 LYS CD C 13 29.435 0.000 A 72 LYS CE C 13 42.162 0.069 A 72 LYS CG C 13 25.101 0.141 A 72 LYS N N 15 130.342 0.012 A 73 ALA H H 1 7.765 0.004 A 73 ALA HA H 1 0.870 0.001 A 73 ALA HB% H 1 0.868 0.009 A 73 ALA C C 13 176.469 0.007 A 73 ALA CA C 13 52.237 0.027 A 73 ALA CB C 13 18.972 0.089 A 73 ALA N N 15 128.556 0.025 A 74 THR H H 1 6.477 0.007 A 74 THR HA H 1 4.671 0.013 A 74 THR HB H 1 4.083 0.005 A 74 THR HG2% H 1 1.324 0.010 A 74 THR C C 13 170.738 0.046 A 74 THR CA C 13 59.198 0.078 A 74 THR CB C 13 69.827 0.070 A 74 THR CG2 C 13 19.435 0.029 A 74 THR N N 15 115.196 0.013 A 75 ARG H H 1 8.912 0.002 A 75 ARG HA H 1 4.553 0.000 A 75 ARG HBx H 1 1.807 0.000 A 75 ARG HBy H 1 1.807 0.000 A 75 ARG HDx H 1 3.100 0.000 A 75 ARG HDy H 1 3.100 0.000 A 75 ARG C C 13 176.481 0.007 A 75 ARG CA C 13 55.712 0.028 A 75 ARG CB C 13 31.624 0.048 A 75 ARG CD C 13 43.799 0.000 A 75 ARG CG C 13 27.723 0.000 A 75 ARG N N 15 122.372 0.023 A 76 LYS H H 1 8.379 0.002 A 76 LYS HA H 1 4.306 0.005 A 76 LYS HBx H 1 1.742 0.005 A 76 LYS HBy H 1 1.742 0.005 A 76 LYS HDx H 1 1.638 0.002 A 76 LYS HDy H 1 1.638 0.002 A 76 LYS HEx H 1 2.944 0.005 A 76 LYS HEy H 1 2.944 0.005 A 76 LYS HGx H 1 1.371 0.014 A 76 LYS HGy H 1 1.371 0.014 A 76 LYS C C 13 175.152 0.018 A 76 LYS CA C 13 56.896 0.045 A 76 LYS CB C 13 33.100 0.083 A 76 LYS CD C 13 29.431 0.111 A 76 LYS CE C 13 42.379 0.000 A 76 LYS CG C 13 25.043 0.136 A 76 LYS N N 15 122.442 0.024 A 77 LEU H H 1 8.158 0.005 A 77 LEU HA H 1 4.458 0.004 A 77 LEU HBx H 1 1.631 0.002 A 77 LEU HBy H 1 1.631 0.002 A 77 LEU HD1% H 1 0.955 0.013 A 77 LEU HD2% H 1 0.916 0.001 A 77 LEU HG H 1 1.656 0.000 A 77 LEU C C 13 176.529 0.006 A 77 LEU CA C 13 54.824 0.074 A 77 LEU CB C 13 43.482 0.089 A 77 LEU CDx C 13 25.050 0.128 A 77 LEU CG C 13 27.767 0.145 A 77 LEU N N 15 123.724 0.044 A 78 ALA H H 1 8.584 0.004 A 78 ALA HA H 1 4.208 0.010 A 78 ALA HB% H 1 1.409 0.003 A 78 ALA C C 13 178.187 0.006 A 78 ALA CA C 13 53.186 0.027 A 78 ALA CB C 13 18.538 0.049 A 78 ALA N N 15 126.136 0.019 A 79 GLY H H 1 8.475 0.002 A 79 GLY HAy H 1 4.087 0.005 A 79 GLY HAx H 1 3.811 0.005 A 79 GLY C C 13 174.086 0.028 A 79 GLY CA C 13 45.663 0.088 A 79 GLY N N 15 107.518 0.015 A 80 ARG H H 1 8.025 0.003 A 80 ARG HA H 1 4.518 0.007 A 80 ARG HBx H 1 1.908 0.000 A 80 ARG HBy H 1 1.908 0.000 A 80 ARG HDx H 1 3.218 0.004 A 80 ARG HDy H 1 3.218 0.004 A 80 ARG HGx H 1 1.637 0.002 A 80 ARG HGy H 1 1.637 0.002 A 80 ARG C C 13 175.641 0.018 A 80 ARG CA C 13 55.466 0.136 A 80 ARG CB C 13 31.893 0.018 A 80 ARG CD C 13 43.593 0.153 A 80 ARG CG C 13 27.246 0.115 A 80 ARG N N 15 119.987 0.009 A 81 ALA H H 1 8.434 0.004 A 81 ALA HA H 1 4.339 0.003 A 81 ALA HB% H 1 1.399 0.000 A 81 ALA C C 13 177.223 0.001 A 81 ALA CA C 13 52.517 0.031 A 81 ALA CB C 13 19.310 0.057 A 81 ALA N N 15 125.014 0.014 A 82 ALA H H 1 8.352 0.001 A 82 ALA HA H 1 4.342 0.001 A 82 ALA HB% H 1 1.376 0.003 A 82 ALA C C 13 177.021 0.025 A 82 ALA CA C 13 52.496 0.068 A 82 ALA CB C 13 19.147 0.064 A 82 ALA N N 15 123.082 0.011 A 83 ASN H H 1 8.222 0.002 A 83 ASN HA H 1 4.968 0.006 A 83 ASN HBy H 1 2.864 0.001 A 83 ASN HBx H 1 2.771 0.002 A 83 ASN C C 13 173.528 0.000 A 83 ASN CA C 13 52.639 0.129 A 83 ASN CB C 13 39.748 0.060 A 83 ASN N N 15 119.524 0.027 A 84 PRO HA H 1 4.453 0.007 A 84 PRO HBy H 1 2.291 0.013 A 84 PRO HBx H 1 1.940 0.004 A 84 PRO HDx H 1 3.783 0.014 A 84 PRO HDy H 1 3.783 0.014 A 84 PRO HGx H 1 2.016 0.001 A 84 PRO HGy H 1 2.016 0.001 A 84 PRO C C 13 176.152 0.003 A 84 PRO CA C 13 64.294 0.031 A 84 PRO CB C 13 32.333 0.103 A 84 PRO CD C 13 50.873 0.155 A 84 PRO CG C 13 27.554 0.120 A 85 GLY H H 1 7.803 0.005 A 85 GLY HAy H 1 4.343 0.008 A 85 GLY HAx H 1 3.707 0.006 A 85 GLY C C 13 172.765 0.029 A 85 GLY CA C 13 44.720 0.065 A 85 GLY N N 15 105.617 0.016 A 86 VAL H H 1 9.117 0.004 A 86 VAL HA H 1 4.805 0.014 A 86 VAL HB H 1 2.176 0.004 A 86 VAL HG1% H 1 1.085 0.001 A 86 VAL HG2% H 1 1.221 0.003 A 86 VAL C C 13 173.336 0.000 A 86 VAL CA C 13 58.761 0.099 A 86 VAL CB C 13 34.601 0.083 A 86 VAL CGy C 13 22.217 0.000 A 86 VAL CGx C 13 20.506 0.071 A 86 VAL N N 15 121.205 0.034 A 87 PRO HA H 1 4.883 0.008 A 87 PRO HBy H 1 2.139 0.002 A 87 PRO HBx H 1 1.954 0.008 A 87 PRO HDx H 1 3.631 0.000 A 87 PRO HDy H 1 3.631 0.000 A 87 PRO HGy H 1 2.359 0.004 A 87 PRO HGx H 1 2.105 0.000 A 87 PRO CA C 13 62.031 0.032 A 87 PRO CB C 13 32.170 0.081 A 87 PRO CD C 13 51.026 0.000 A 87 PRO CG C 13 28.152 0.043 A 88 VAL H H 1 8.767 0.005 A 88 VAL C C 13 174.736 0.018 A 88 VAL CB C 13 33.722 0.054 A 88 VAL N N 15 125.297 0.052 A 89 TYR H H 1 9.002 0.003 A 89 TYR HA H 1 5.179 0.008 A 89 TYR HBy H 1 2.930 0.007 A 89 TYR HBx H 1 2.427 0.003 A 89 TYR HDx H 1 6.679 0.001 A 89 TYR HDy H 1 6.679 0.001 A 89 TYR HEx H 1 6.554 0.001 A 89 TYR HEy H 1 6.554 0.001 A 89 TYR C C 13 174.705 0.010 A 89 TYR CA C 13 55.859 0.108 A 89 TYR CB C 13 43.557 0.061 A 89 TYR CDx C 13 132.895 0.037 A 89 TYR CEx C 13 117.465 0.002 A 89 TYR N N 15 124.711 0.016 A 90 ALA H H 1 9.208 0.002 A 90 ALA HA H 1 5.513 0.005 A 90 ALA HB% H 1 0.851 0.010 A 90 ALA C C 13 175.005 0.048 A 90 ALA CA C 13 50.466 0.081 A 90 ALA CB C 13 21.965 0.008 A 90 ALA N N 15 122.324 0.008 A 91 VAL H H 1 9.150 0.005 A 91 VAL HA H 1 4.852 0.004 A 91 VAL HB H 1 2.053 0.012 A 91 VAL HG1% H 1 0.839 0.001 A 91 VAL HG2% H 1 0.894 0.012 A 91 VAL C C 13 175.081 0.000 A 91 VAL CA C 13 60.751 0.082 A 91 VAL CB C 13 36.284 0.090 A 91 VAL CGx C 13 21.742 0.000 A 91 VAL N N 15 119.545 0.021 A 92 VAL H H 1 8.800 0.005 A 92 VAL HA H 1 4.037 0.004 A 92 VAL HB H 1 2.019 0.005 A 92 VAL HG1% H 1 0.913 0.002 A 92 VAL HG2% H 1 1.036 0.003 A 92 VAL C C 13 175.377 0.007 A 92 VAL CA C 13 62.808 0.042 A 92 VAL CB C 13 32.532 0.015 A 92 VAL CGx C 13 21.371 0.000 A 92 VAL CGy C 13 22.741 0.064 A 92 VAL N N 15 128.280 0.023 A 93 ASP H H 1 9.386 0.003 A 93 ASP HA H 1 4.431 0.004 A 93 ASP HBx H 1 2.309 0.002 A 93 ASP HBy H 1 2.309 0.002 A 93 ASP C C 13 174.034 0.000 A 93 ASP CA C 13 54.597 0.129 A 93 ASP CB C 13 40.103 0.013 A 93 ASP N N 15 124.661 0.018 A 94 PRO HA H 1 4.068 0.005 A 94 PRO HBx H 1 2.045 0.002 A 94 PRO HBy H 1 2.045 0.002 A 94 PRO HDx H 1 3.689 0.007 A 94 PRO HDy H 1 3.689 0.007 A 94 PRO HGx H 1 1.820 0.000 A 94 PRO HGy H 1 1.820 0.000 A 94 PRO C C 13 177.815 0.016 A 94 PRO CA C 13 64.383 0.028 A 94 PRO CB C 13 32.728 0.016 A 94 PRO CD C 13 50.676 0.093 A 94 PRO CG C 13 27.250 0.144 A 95 ASP H H 1 9.083 0.003 A 95 ASP HA H 1 4.620 0.005 A 95 ASP HBy H 1 2.830 0.004 A 95 ASP HBx H 1 2.521 0.004 A 95 ASP C C 13 175.812 0.015 A 95 ASP CA C 13 55.147 0.094 A 95 ASP CB C 13 40.644 0.055 A 95 ASP N N 15 117.828 0.018 A 96 ASN H H 1 7.673 0.002 A 96 ASN HA H 1 4.743 0.005 A 96 ASN HBy H 1 2.839 0.000 A 96 ASN HBx H 1 2.639 0.004 A 96 ASN C C 13 174.908 0.021 A 96 ASN CA C 13 53.238 0.088 A 96 ASN CB C 13 39.120 0.039 A 96 ASN N N 15 118.123 0.016 A 97 ARG H H 1 8.568 0.002 A 97 ARG HA H 1 4.314 0.006 A 97 ARG HBx H 1 1.794 0.012 A 97 ARG HBy H 1 1.794 0.012 A 97 ARG HDx H 1 3.147 0.006 A 97 ARG HDy H 1 3.147 0.006 A 97 ARG HGx H 1 1.588 0.007 A 97 ARG HGy H 1 1.588 0.007 A 97 ARG C C 13 176.643 0.023 A 97 ARG CA C 13 56.428 0.023 A 97 ARG CB C 13 30.648 0.160 A 97 ARG CD C 13 43.334 0.138 A 97 ARG CG C 13 27.134 0.088 A 97 ARG N N 15 122.031 0.033 A 98 VAL H H 1 8.471 0.005 A 98 VAL HA H 1 4.125 0.010 A 98 VAL HB H 1 2.121 0.005 A 98 VAL HGx% H 1 0.916 0.006 A 98 VAL C C 13 176.091 0.012 A 98 VAL CA C 13 62.229 0.077 A 98 VAL CB C 13 32.880 0.054 A 98 VAL CGx C 13 21.107 0.043 A 98 VAL N N 15 121.577 0.015 A 99 ALA H H 1 8.428 0.003 A 99 ALA HA H 1 4.220 0.008 A 99 ALA HB% H 1 1.394 0.007 A 99 ALA C C 13 178.243 0.003 A 99 ALA CA C 13 53.202 0.025 A 99 ALA CB C 13 19.076 0.040 A 99 ALA N N 15 127.296 0.009 A 100 GLU H H 1 8.424 0.002 A 100 GLU HA H 1 4.180 0.006 A 100 GLU HBx H 1 2.027 0.005 A 100 GLU HBy H 1 2.027 0.005 A 100 GLU HGx H 1 2.254 0.004 A 100 GLU HGy H 1 2.254 0.004 A 100 GLU C C 13 177.030 0.009 A 100 GLU CA C 13 57.583 0.080 A 100 GLU CB C 13 29.747 0.019 A 100 GLU CG C 13 36.466 0.110 A 100 GLU N N 15 118.952 0.007 A 101 SER H H 1 8.101 0.001 A 101 SER HA H 1 4.323 0.004 A 101 SER HBx H 1 3.880 0.006 A 101 SER HBy H 1 3.880 0.006 A 101 SER C C 13 174.579 0.015 A 101 SER CA C 13 59.192 0.043 A 101 SER CB C 13 63.746 0.143 A 101 SER N N 15 114.979 0.019 A 102 ASP H H 1 8.273 0.001 A 102 ASP HA H 1 4.632 0.000 A 102 ASP HBx H 1 2.698 0.008 A 102 ASP HBy H 1 2.698 0.008 A 102 ASP C C 13 176.656 0.007 A 102 ASP CA C 13 54.607 0.020 A 102 ASP CB C 13 41.125 0.041 A 102 ASP N N 15 121.865 0.007 A 103 LYS H H 1 8.083 0.001 A 103 LYS HA H 1 4.170 0.004 A 103 LYS HBx H 1 1.814 0.003 A 103 LYS HBy H 1 1.814 0.003 A 103 LYS HDx H 1 1.643 0.000 A 103 LYS HDy H 1 1.643 0.000 A 103 LYS HEx H 1 2.976 0.003 A 103 LYS HEy H 1 2.976 0.003 A 103 LYS C C 13 176.847 0.028 A 103 LYS CA C 13 57.335 0.034 A 103 LYS CB C 13 32.635 0.069 A 103 LYS CD C 13 29.178 0.109 A 103 LYS CE C 13 42.451 0.105 A 103 LYS CG C 13 24.665 0.000 A 103 LYS N N 15 121.435 0.014 A 104 ALA H H 1 8.134 0.003 A 104 ALA HA H 1 4.259 0.006 A 104 ALA HB% H 1 1.397 0.006 A 104 ALA C C 13 177.917 0.011 A 104 ALA CA C 13 53.307 0.029 A 104 ALA CB C 13 19.214 0.057 A 104 ALA N N 15 122.202 0.023 A 105 ASN H H 1 8.127 0.002 A 105 ASN HA H 1 4.765 0.000 A 105 ASN HBx H 1 2.817 0.000 A 105 ASN HBy H 1 2.817 0.000 A 105 ASN C C 13 174.886 0.023 A 105 ASN CA C 13 53.675 0.057 A 105 ASN CB C 13 39.022 0.048 A 105 ASN N N 15 115.572 0.031 A 106 ASN H H 1 8.182 0.002 A 106 ASN HA H 1 4.756 0.000 A 106 ASN HBx H 1 2.972 0.015 A 106 ASN HBy H 1 2.972 0.015 A 106 ASN C C 13 172.809 0.024 A 106 ASN CA C 13 53.403 0.047 A 106 ASN CB C 13 39.496 0.103 A 106 ASN N N 15 117.533 0.014 A 107 VAL H H 1 7.350 0.002 A 107 VAL HA H 1 4.870 0.006 A 107 VAL HB H 1 1.938 0.005 A 107 VAL HGx% H 1 0.956 0.009 A 107 VAL HGy% H 1 0.926 0.001 A 107 VAL C C 13 174.586 0.015 A 107 VAL CA C 13 61.492 0.122 A 107 VAL CB C 13 34.142 0.068 A 107 VAL CGx C 13 21.094 0.000 A 107 VAL N N 15 118.118 0.013 A 108 PHE H H 1 8.812 0.003 A 108 PHE HA H 1 5.021 0.008 A 108 PHE HBy H 1 3.289 0.009 A 108 PHE HBx H 1 2.792 0.007 A 108 PHE HDx H 1 7.031 0.003 A 108 PHE HDy H 1 7.031 0.003 A 108 PHE HEx H 1 7.179 0.000 A 108 PHE HEy H 1 7.179 0.000 A 108 PHE C C 13 173.909 0.018 A 108 PHE CA C 13 55.143 0.137 A 108 PHE CB C 13 41.452 0.047 A 108 PHE CDx C 13 132.083 0.002 A 108 PHE N N 15 125.689 0.012 A 109 SER H H 1 8.429 0.003 A 109 SER HA H 1 5.175 0.006 A 109 SER HBy H 1 2.756 0.001 A 109 SER HBx H 1 2.416 0.002 A 109 SER C C 13 173.578 0.005 A 109 SER CA C 13 57.410 0.030 A 109 SER CB C 13 66.328 0.036 A 109 SER N N 15 112.832 0.031 A 110 ARG H H 1 8.672 0.003 A 110 ARG HA H 1 4.496 0.000 A 110 ARG HBx H 1 1.606 0.003 A 110 ARG HBy H 1 1.606 0.003 A 110 ARG HDx H 1 2.731 0.006 A 110 ARG HDy H 1 2.731 0.006 A 110 ARG HGx H 1 1.435 0.004 A 110 ARG HGy H 1 1.435 0.004 A 110 ARG C C 13 173.419 0.019 A 110 ARG CA C 13 55.294 0.026 A 110 ARG CB C 13 34.120 0.105 A 110 ARG CD C 13 43.845 0.103 A 110 ARG CG C 13 26.380 0.091 A 110 ARG N N 15 118.360 0.030 A 111 ILE H H 1 8.567 0.003 A 111 ILE HA H 1 4.471 0.005 A 111 ILE HB H 1 1.802 0.010 A 111 ILE HD1% H 1 0.653 0.004 A 111 ILE HG1x H 1 1.161 0.011 A 111 ILE HG1y H 1 1.161 0.011 A 111 ILE HG2% H 1 0.642 0.003 A 111 ILE C C 13 176.395 0.019 A 111 ILE CA C 13 59.879 0.052 A 111 ILE CB C 13 37.158 0.096 A 111 ILE CD1 C 13 11.089 0.065 A 111 ILE CG1 C 13 27.467 0.106 A 111 ILE CG2 C 13 17.845 0.049 A 111 ILE N N 15 123.678 0.018 A 112 VAL H H 1 9.363 0.006 A 112 VAL HA H 1 4.383 0.008 A 112 VAL HB H 1 2.153 0.008 A 112 VAL HGx% H 1 0.949 0.004 A 112 VAL HGy% H 1 0.913 0.001 A 112 VAL C C 13 174.357 0.018 A 112 VAL CA C 13 61.456 0.094 A 112 VAL CB C 13 34.173 0.059 A 112 VAL CGx C 13 21.258 0.008 A 112 VAL CGy C 13 21.672 0.000 A 112 VAL N N 15 130.703 0.038 A 113 LYS H H 1 8.954 0.003 A 113 LYS HA H 1 4.501 0.063 A 113 LYS HBx H 1 1.724 0.007 A 113 LYS HBy H 1 1.724 0.007 A 113 LYS HDx H 1 1.602 0.000 A 113 LYS HDy H 1 1.602 0.000 A 113 LYS HEx H 1 2.892 0.000 A 113 LYS HEy H 1 2.892 0.000 A 113 LYS C C 13 173.258 0.021 A 113 LYS CA C 13 55.933 0.017 A 113 LYS CB C 13 32.594 0.032 A 113 LYS CD C 13 29.498 0.172 A 113 LYS CE C 13 42.318 0.117 A 113 LYS CG C 13 24.846 0.000 A 113 LYS N N 15 130.174 0.066 A 114 VAL H H 1 7.681 0.003 A 114 VAL HA H 1 4.397 0.007 A 114 VAL HB H 1 1.742 0.009 A 114 VAL HGx% H 1 0.507 0.000 A 114 VAL HGy% H 1 0.872 0.000 A 114 VAL C C 13 176.638 0.002 A 114 VAL CA C 13 60.926 0.094 A 114 VAL CB C 13 32.903 0.007 A 114 VAL N N 15 123.586 0.021 A 115 LEU H H 1 8.866 0.003 A 115 LEU HA H 1 4.320 0.006 A 115 LEU HBy H 1 1.310 0.001 A 115 LEU HBx H 1 1.138 0.000 A 115 LEU HD1% H 1 0.511 0.000 A 115 LEU HD2% H 1 0.645 0.005 A 115 LEU HG H 1 0.516 0.005 A 115 LEU C C 13 176.645 0.005 A 115 LEU CA C 13 54.327 0.100 A 115 LEU CB C 13 43.194 0.075 A 115 LEU CDy C 13 22.203 0.094 A 115 LEU CG C 13 25.629 0.000 A 115 LEU N N 15 128.263 0.022 A 116 GLU H H 1 8.482 0.001 A 116 GLU N N 15 120.220 0.010 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 ASP HA A 3 LEU H 1.0 1.8 3.47 2 2 A 3 LEU H A 2 ASP H 1.0 1.8 4.80 3 3 A 3 LEU H A 2 ASP HBx 1.0 1.8 4.81 4 3 A 3 LEU H A 2 ASP HBy 1.0 1.8 4.81 5 4 A 3 LEU HA A 3 LEU HG 1.0 1.8 3.78 6 5 A 3 LEU HA A 3 LEU HD11 1.0 1.8 3.29 7 5 A 3 LEU HA A 3 LEU HD2% 1.0 1.8 3.29 8 6 A 3 LEU HA A 4 PRO HDx 1.0 1.8 3.51 9 7 A 3 LEU HA A 4 PRO HDy 1.0 1.8 3.71 10 8 A 3 LEU HA A 4 PRO HGx 1.0 1.8 4.59 11 8 A 3 LEU HA A 4 PRO HGy 1.0 1.8 4.59 12 9 A 3 LEU HG A 4 PRO HDx 1.0 1.8 4.96 13 10 A 3 LEU HG A 4 PRO HDy 1.0 1.8 4.41 14 11 A 3 LEU HG A 5 ILE H 1.0 1.8 5.96 15 12 A 3 LEU H A 3 LEU HBy 1.0 1.8 3.26 16 12 A 3 LEU H A 3 LEU HBx 1.0 1.8 3.26 17 13 A 3 LEU H A 3 LEU HD11 1.0 1.8 4.58 18 13 A 3 LEU H A 3 LEU HD2% 1.0 1.8 4.58 19 14 A 3 LEU H A 4 PRO HDx 1.0 1.8 5.30 20 15 A 3 LEU H A 4 PRO HDy 1.0 1.8 5.78 21 16 A 5 ILE H A 3 LEU HBy 1.0 1.8 3.30 22 16 A 5 ILE H A 3 LEU HBx 1.0 1.8 3.30 23 17 A 3 LEU HBx A 4 PRO HDx 1.0 1.8 4.22 24 18 A 3 LEU HBy A 4 PRO HDx 1.0 1.8 5.22 25 19 A 3 LEU HD11 A 4 PRO HDx 1.0 1.8 4.53 26 19 A 3 LEU HD2% A 4 PRO HDx 1.0 1.8 4.53 27 20 A 3 LEU HD2% A 4 PRO HDy 1.0 1.8 4.49 28 20 A 4 PRO HDy A 3 LEU HD11 1.0 1.8 4.49 29 21 A 3 LEU HD2% A 4 PRO HGx 1.0 1.8 5.57 30 21 A 4 PRO HGy A 3 LEU HD11 1.0 1.8 5.57 31 21 A 3 LEU HD2% A 4 PRO HGy 1.0 1.8 5.57 32 21 A 3 LEU HD11 A 4 PRO HGx 1.0 1.8 5.57 33 22 A 5 ILE H A 3 LEU HD11 1.0 1.8 5.92 34 22 A 3 LEU HD2% A 5 ILE H 1.0 1.8 5.92 35 23 A 4 PRO HA A 23 ARG HBx 1.0 1.8 3.91 36 23 A 4 PRO HA A 23 ARG HBy 1.0 1.8 3.91 37 24 A 4 PRO HA A 23 ARG HDx 1.0 1.8 4.22 38 24 A 4 PRO HA A 23 ARG HDy 1.0 1.8 4.22 39 25 A 4 PRO HBy A 108 PHE HBx 1.0 1.8 4.35 40 25 A 4 PRO HBy A 108 PHE HBy 1.0 1.8 4.35 41 26 A 4 PRO HBy A 108 PHE HD% 1.0 1.8 4.26 42 27 A 4 PRO HBy A 109 SER H 1.0 1.8 5.34 43 28 A 5 ILE H A 4 PRO HDx 1.0 1.8 4.10 44 29 A 5 ILE HD1% A 4 PRO HDx 1.0 1.8 5.93 45 30 A 108 PHE HBy A 4 PRO HDx 1.0 1.8 5.30 46 30 A 4 PRO HDx A 108 PHE HBx 1.0 1.8 5.30 47 31 A 108 PHE HD% A 4 PRO HDx 1.0 1.8 5.12 48 32 A 109 SER H A 4 PRO HDx 1.0 1.8 6.00 49 32 A 109 SER H A 4 PRO HDy 1.0 1.8 6.00 50 33 A 5 ILE H A 4 PRO HDy 1.0 1.8 4.73 51 34 A 5 ILE H A 4 PRO HGx 1.0 1.8 3.77 52 34 A 4 PRO HGy A 5 ILE H 1.0 1.8 3.77 53 35 A 4 PRO HGy A 108 PHE HBx 1.0 1.8 4.57 54 35 A 4 PRO HGx A 108 PHE HBx 1.0 1.8 4.57 55 35 A 108 PHE HBy A 4 PRO HGx 1.0 1.8 4.57 56 35 A 4 PRO HGy A 108 PHE HBy 1.0 1.8 4.57 57 36 A 5 ILE HD1% A 5 ILE HA 1.0 1.8 4.18 58 37 A 5 ILE HA A 5 ILE HG2% 1.0 1.8 3.67 59 38 A 5 ILE HA A 6 THR H 1.0 1.8 3.03 60 39 A 5 ILE HA A 23 ARG HGx 1.0 1.8 4.26 61 39 A 5 ILE HA A 23 ARG HGy 1.0 1.8 4.26 62 40 A 5 ILE HB A 109 SER HA 1.0 1.8 5.03 63 41 A 5 ILE H A 5 ILE HB 1.0 1.8 4.07 64 42 A 5 ILE H A 5 ILE HD1% 1.0 1.8 3.94 65 43 A 5 ILE H A 5 ILE HG2% 1.0 1.8 4.19 66 44 A 5 ILE H A 6 THR H 1.0 1.8 4.66 67 45 A 5 ILE H A 23 ARG HGx 1.0 1.8 5.50 68 45 A 5 ILE H A 23 ARG HGy 1.0 1.8 5.50 69 46 A 5 ILE H A 110 ARG HDx 1.0 1.8 4.92 70 46 A 5 ILE H A 110 ARG HDy 1.0 1.8 4.92 71 47 A 5 ILE HD1% A 6 THR H 1.0 1.8 5.11 72 48 A 5 ILE HD1% A 89 TYR HA 1.0 1.8 4.42 73 49 A 5 ILE HD1% A 90 ALA HA 1.0 1.8 5.45 74 50 A 5 ILE HD1% A 90 ALA H 1.0 1.8 4.30 75 51 A 5 ILE HD1% A 108 PHE HBx 1.0 1.8 4.01 76 52 A 116 GLU H A 115 LEU HBy 1.0 1.8 3.62 77 52 A 115 LEU HBx A 116 GLU H 1.0 1.8 3.62 78 53 A 108 PHE HBy A 5 ILE HD1% 1.0 1.8 4.01 79 54 A 108 PHE HD% A 5 ILE HD1% 1.0 1.8 4.63 80 55 A 5 ILE HD1% A 109 SER HA 1.0 1.8 4.27 81 56 A 109 SER H A 5 ILE HD1% 1.0 1.8 4.51 82 57 A 22 ALA HA A 5 ILE HG1x 1.0 1.8 4.46 83 57 A 5 ILE HG1y A 22 ALA HA 1.0 1.8 4.46 84 58 A 5 ILE HG2% A 6 THR HA 1.0 1.8 4.27 85 59 A 5 ILE HG2% A 6 THR H 1.0 1.8 3.64 86 60 A 5 ILE HG2% A 7 LEU H 1.0 1.8 4.64 87 61 A 5 ILE HG2% A 7 LEU HD11 1.0 1.8 3.83 88 61 A 5 ILE HG2% A 7 LEU HD2% 1.0 1.8 3.83 89 62 A 5 ILE HG2% A 21 SER HBx 1.0 1.8 5.81 90 62 A 5 ILE HG2% A 21 SER HBy 1.0 1.8 5.81 91 63 A 5 ILE HG2% A 110 ARG HDx 1.0 1.8 4.00 92 63 A 5 ILE HG2% A 110 ARG HDy 1.0 1.8 4.00 93 64 A 6 THR HA A 6 THR HG2% 1.0 1.8 3.22 94 65 A 6 THR HA A 7 LEU H 1.0 1.8 3.16 95 66 A 6 THR HA A 7 LEU HBx 1.0 1.8 5.46 96 66 A 6 THR HA A 7 LEU HBy 1.0 1.8 5.46 97 67 A 6 THR HA A 110 ARG HDx 1.0 1.8 5.32 98 67 A 110 ARG HDy A 6 THR HA 1.0 1.8 5.32 99 68 A 7 LEU H A 6 THR HB 1.0 1.8 4.28 100 69 A 6 THR HB A 7 LEU HBx 1.0 1.8 5.93 101 69 A 7 LEU HBy A 6 THR HB 1.0 1.8 5.93 102 70 A 6 THR H A 6 THR HG2% 1.0 1.8 4.23 103 71 A 6 THR H A 7 LEU H 1.0 1.8 4.59 104 72 A 6 THR H A 21 SER HA 1.0 1.8 5.45 105 73 A 6 THR H A 21 SER HBx 1.0 1.8 5.01 106 74 A 6 THR H A 21 SER HBy 1.0 1.8 5.81 107 75 A 6 THR H A 22 ALA HA 1.0 1.8 4.63 108 76 A 6 THR H A 23 ARG HGx 1.0 1.8 5.37 109 76 A 6 THR H A 23 ARG HGy 1.0 1.8 5.37 110 77 A 7 LEU H A 6 THR HG2% 1.0 1.8 4.66 111 78 A 7 LEU HA A 7 LEU HD11 1.0 1.8 3.39 112 78 A 7 LEU HD2% A 7 LEU HA 1.0 1.8 3.39 113 79 A 7 LEU HA A 8 SER H 1.0 1.8 3.22 114 80 A 7 LEU HA A 18 ILE HD1% 1.0 1.8 5.50 115 81 A 7 LEU HA A 20 VAL HA 1.0 1.8 3.96 116 82 A 7 LEU HA A 21 SER H 1.0 1.8 4.10 117 83 A 20 VAL HA A 7 LEU HG 1.0 1.8 5.59 118 84 A 7 LEU HG A 110 ARG HDx 1.0 1.8 4.73 119 84 A 110 ARG HDy A 7 LEU HG 1.0 1.8 4.73 120 85 A 7 LEU H A 7 LEU HG 1.0 1.8 4.72 121 86 A 7 LEU H A 7 LEU HBx 1.0 1.8 3.27 122 86 A 7 LEU H A 7 LEU HBy 1.0 1.8 3.27 123 87 A 7 LEU H A 7 LEU HD11 1.0 1.8 3.92 124 87 A 7 LEU H A 7 LEU HD2% 1.0 1.8 3.92 125 88 A 8 SER H A 7 LEU HBx 1.0 1.8 3.63 126 88 A 7 LEU HBy A 8 SER H 1.0 1.8 3.63 127 89 A 18 ILE HD1% A 7 LEU HBx 1.0 1.8 3.76 128 89 A 7 LEU HBy A 18 ILE HD1% 1.0 1.8 3.76 129 90 A 20 VAL HA A 7 LEU HBx 1.0 1.8 5.65 130 90 A 7 LEU HBy A 20 VAL HA 1.0 1.8 5.65 131 91 A 21 SER H A 7 LEU HBx 1.0 1.8 5.67 132 91 A 7 LEU HBy A 21 SER H 1.0 1.8 5.67 133 92 A 8 SER H A 7 LEU HD11 1.0 1.8 4.89 134 92 A 7 LEU HD2% A 8 SER H 1.0 1.8 4.89 135 93 A 18 ILE HB A 7 LEU HD11 1.0 1.8 4.66 136 93 A 7 LEU HD2% A 18 ILE HB 1.0 1.8 4.66 137 94 A 20 VAL HA A 7 LEU HD11 1.0 1.8 3.47 138 94 A 7 LEU HD2% A 20 VAL HA 1.0 1.8 3.47 139 95 A 7 LEU HD2% A 20 VAL HGy% 1.0 1.8 3.94 140 95 A 7 LEU HD11 A 20 VAL HGy% 1.0 1.8 3.94 141 95 A 20 VAL HGx% A 7 LEU HD11 1.0 1.8 3.94 142 95 A 7 LEU HD2% A 20 VAL HGx% 1.0 1.8 3.94 143 96 A 21 SER H A 7 LEU HD11 1.0 1.8 4.38 144 96 A 7 LEU HD2% A 21 SER H 1.0 1.8 4.38 145 97 A 7 LEU HD11 A 110 ARG HDx 1.0 1.8 5.06 146 97 A 7 LEU HD2% A 110 ARG HDx 1.0 1.8 5.06 147 97 A 110 ARG HDy A 7 LEU HD11 1.0 1.8 5.06 148 97 A 110 ARG HDy A 7 LEU HD2% 1.0 1.8 5.06 149 98 A 8 SER HA A 19 THR HB 1.0 1.8 5.15 150 99 A 8 SER HA A 19 THR H 1.0 1.8 5.96 151 100 A 8 SER H A 18 ILE HA 1.0 1.8 5.39 152 101 A 8 SER H A 18 ILE HB 1.0 1.8 4.42 153 102 A 8 SER H A 18 ILE HD1% 1.0 1.8 5.13 154 103 A 8 SER H A 19 THR HB 1.0 1.8 4.22 155 104 A 8 SER H A 19 THR H 1.0 1.8 3.99 156 105 A 8 SER H A 20 VAL HA 1.0 1.8 4.79 157 106 A 8 SER H A 21 SER H 1.0 1.8 5.97 158 107 A 9 LYS HA A 10 GLU H 1.0 1.8 3.06 159 108 A 9 LYS HA A 11 THR H 1.0 1.8 4.68 160 109 A 10 GLU H A 9 LYS HBx 1.0 1.8 4.37 161 109 A 10 GLU H A 9 LYS HBy 1.0 1.8 4.37 162 110 A 11 THR H A 9 LYS HBx 1.0 1.8 5.02 163 110 A 11 THR H A 9 LYS HBy 1.0 1.8 5.02 164 111 A 18 ILE HA A 9 LYS HBx 1.0 1.8 5.39 165 111 A 18 ILE HA A 9 LYS HBy 1.0 1.8 5.39 166 112 A 18 ILE HB A 9 LYS HBx 1.0 1.8 4.32 167 112 A 18 ILE HB A 9 LYS HBy 1.0 1.8 4.32 168 113 A 18 ILE HG2% A 9 LYS HBx 1.0 1.8 3.52 169 113 A 9 LYS HBy A 18 ILE HG2% 1.0 1.8 3.52 170 114 A 19 THR H A 9 LYS HBx 1.0 1.8 5.65 171 114 A 19 THR H A 9 LYS HBy 1.0 1.8 5.65 172 115 A 10 GLU HA A 10 GLU HGx 1.0 1.8 4.08 173 115 A 10 GLU HA A 10 GLU HGy 1.0 1.8 4.08 174 116 A 10 GLU H A 10 GLU HBx 1.0 1.8 3.07 175 116 A 10 GLU H A 10 GLU HBy 1.0 1.8 3.07 176 117 A 10 GLU H A 10 GLU HGx 1.0 1.8 4.13 177 117 A 10 GLU H A 10 GLU HGy 1.0 1.8 4.13 178 118 A 10 GLU H A 11 THR HA 1.0 1.8 5.54 179 119 A 10 GLU H A 11 THR H 1.0 1.8 3.41 180 120 A 11 THR H A 10 GLU HBx 1.0 1.8 3.81 181 120 A 11 THR H A 10 GLU HBy 1.0 1.8 3.81 182 121 A 11 THR HG2% A 10 GLU HGx 1.0 1.8 4.16 183 121 A 10 GLU HGy A 11 THR HG2% 1.0 1.8 4.16 184 122 A 11 THR HA A 11 THR HG2% 1.0 1.8 3.44 185 123 A 11 THR HA A 12 PRO HDx 1.0 1.8 3.95 186 123 A 11 THR HA A 12 PRO HDy 1.0 1.8 3.95 187 124 A 11 THR H A 11 THR HG2% 1.0 1.8 3.90 188 125 A 11 THR H A 12 PRO HDx 1.0 1.8 4.66 189 125 A 11 THR H A 12 PRO HDy 1.0 1.8 4.66 190 126 A 12 PRO HA A 13 PHE H 1.0 1.8 3.19 191 127 A 12 PRO HA A 13 PHE HBx 1.0 1.8 5.06 192 127 A 12 PRO HA A 13 PHE HBy 1.0 1.8 5.06 193 128 A 12 PRO HA A 114 VAL HB 1.0 1.8 5.36 194 129 A 12 PRO HA A 114 VAL HGy% 1.0 1.8 4.22 195 129 A 12 PRO HA A 114 VAL HGx% 1.0 1.8 4.22 196 130 A 13 PHE H A 12 PRO HBx 1.0 1.8 4.07 197 130 A 13 PHE H A 12 PRO HBy 1.0 1.8 4.07 198 131 A 114 VAL HA A 12 PRO HBx 1.0 1.8 4.38 199 131 A 12 PRO HBy A 114 VAL HA 1.0 1.8 4.38 200 132 A 13 PHE HA A 14 GLU H 1.0 1.8 3.19 201 133 A 13 PHE HA A 14 GLU HBx 1.0 1.8 4.60 202 133 A 13 PHE HA A 14 GLU HBy 1.0 1.8 4.60 203 134 A 13 PHE HA A 115 LEU H 1.0 1.8 5.05 204 135 A 13 PHE H A 13 PHE HBx 1.0 1.8 3.35 205 135 A 13 PHE H A 13 PHE HBy 1.0 1.8 3.35 206 136 A 13 PHE H A 13 PHE HD% 1.0 1.8 4.48 207 137 A 13 PHE H A 14 GLU H 1.0 1.8 4.43 208 138 A 13 PHE H A 114 VAL HB 1.0 1.8 5.34 209 139 A 13 PHE H A 114 VAL HGy% 1.0 1.8 4.56 210 139 A 13 PHE H A 114 VAL HGx% 1.0 1.8 4.56 211 140 A 14 GLU H A 13 PHE HBx 1.0 1.8 4.09 212 140 A 13 PHE HBy A 14 GLU H 1.0 1.8 4.09 213 141 A 16 GLU H A 13 PHE HBx 1.0 1.8 5.13 214 141 A 13 PHE HBy A 16 GLU H 1.0 1.8 5.13 215 142 A 13 PHE HBy A 16 GLU HBx 1.0 1.8 4.43 216 142 A 13 PHE HBx A 16 GLU HBx 1.0 1.8 4.43 217 142 A 16 GLU HBy A 13 PHE HBx 1.0 1.8 4.43 218 142 A 13 PHE HBy A 16 GLU HBy 1.0 1.8 4.43 219 143 A 14 GLU HA A 15 GLY H 1.0 1.8 3.21 220 144 A 16 GLU H A 14 GLU HA 1.0 1.8 4.17 221 145 A 14 GLU HA A 114 VAL HGy% 1.0 1.8 3.97 222 145 A 114 VAL HGx% A 14 GLU HA 1.0 1.8 3.97 223 146 A 14 GLU H A 14 GLU HBx 1.0 1.8 3.26 224 146 A 14 GLU H A 14 GLU HBy 1.0 1.8 3.26 225 147 A 14 GLU H A 14 GLU HGy 1.0 1.8 4.17 226 147 A 14 GLU H A 14 GLU HGx 1.0 1.8 4.17 227 148 A 14 GLU H A 15 GLY H 1.0 1.8 4.98 228 149 A 14 GLU H A 114 VAL HGy% 1.0 1.8 4.16 229 149 A 114 VAL HGx% A 14 GLU H 1.0 1.8 4.16 230 150 A 14 GLU H A 115 LEU H 1.0 1.8 5.72 231 151 A 15 GLY H A 14 GLU HBx 1.0 1.8 4.97 232 151 A 14 GLU HBy A 15 GLY H 1.0 1.8 4.97 233 152 A 14 GLU HGx A 114 VAL HGy% 1.0 1.8 4.88 234 152 A 14 GLU HGy A 114 VAL HGy% 1.0 1.8 4.88 235 152 A 114 VAL HGx% A 14 GLU HGy 1.0 1.8 4.88 236 152 A 114 VAL HGx% A 14 GLU HGx 1.0 1.8 4.88 237 153 A 16 GLU H A 15 GLY H 1.0 1.8 3.65 238 154 A 15 GLY H A 73 ALA H 1.0 1.8 5.01 239 155 A 15 GLY H A 73 ALA HB% 1.0 1.8 4.07 240 156 A 15 GLY H A 114 VAL HGy% 1.0 1.8 5.54 241 156 A 114 VAL HGx% A 15 GLY H 1.0 1.8 5.54 242 157 A 15 GLY HAx A 72 LYS HGx 1.0 1.8 5.17 243 157 A 15 GLY HAx A 72 LYS HGy 1.0 1.8 5.17 244 158 A 73 ALA H A 15 GLY HAx 1.0 1.8 5.56 245 159 A 16 GLU HA A 17 GLU H 1.0 1.8 2.89 246 160 A 16 GLU HA A 17 GLU HGx 1.0 1.8 5.62 247 160 A 16 GLU HA A 17 GLU HGy 1.0 1.8 5.62 248 161 A 16 GLU H A 16 GLU HBx 1.0 1.8 3.29 249 161 A 16 GLU H A 16 GLU HBy 1.0 1.8 3.29 250 162 A 16 GLU H A 17 GLU H 1.0 1.8 4.75 251 163 A 16 GLU H A 73 ALA H 1.0 1.8 4.94 252 164 A 17 GLU H A 16 GLU HBx 1.0 1.8 4.57 253 165 A 16 GLU HBy A 17 GLU H 1.0 1.8 5.07 254 166 A 17 GLU HA A 17 GLU HGx 1.0 1.8 3.94 255 166 A 17 GLU HGy A 17 GLU HA 1.0 1.8 3.94 256 167 A 17 GLU HA A 18 ILE H 1.0 1.8 3.18 257 168 A 17 GLU HA A 72 LYS HA 1.0 1.8 3.46 258 169 A 73 ALA H A 17 GLU HA 1.0 1.8 3.85 259 170 A 17 GLU H A 17 GLU HBx 1.0 1.8 3.11 260 170 A 17 GLU H A 17 GLU HBy 1.0 1.8 3.11 261 171 A 17 GLU H A 17 GLU HGx 1.0 1.8 4.17 262 171 A 17 GLU H A 17 GLU HGy 1.0 1.8 4.17 263 172 A 17 GLU H A 18 ILE H 1.0 1.8 4.49 264 173 A 73 ALA H A 17 GLU H 1.0 1.8 5.60 265 174 A 18 ILE H A 17 GLU HGx 1.0 1.8 3.81 266 174 A 17 GLU HGy A 18 ILE H 1.0 1.8 3.81 267 175 A 71 TRP H A 17 GLU HGx 1.0 1.8 3.57 268 175 A 17 GLU HGy A 71 TRP H 1.0 1.8 3.57 269 176 A 72 LYS HA A 17 GLU HGx 1.0 1.8 4.36 270 176 A 17 GLU HGy A 72 LYS HA 1.0 1.8 4.36 271 177 A 72 LYS H A 17 GLU HGx 1.0 1.8 4.07 272 177 A 17 GLU HGy A 72 LYS H 1.0 1.8 4.07 273 178 A 18 ILE HD1% A 18 ILE HA 1.0 1.8 4.06 274 179 A 18 ILE HA A 18 ILE HG2% 1.0 1.8 3.44 275 180 A 19 THR H A 18 ILE HA 1.0 1.8 3.42 276 181 A 18 ILE HD1% A 18 ILE HB 1.0 1.8 3.49 277 182 A 18 ILE HB A 19 THR HA 1.0 1.8 4.77 278 183 A 18 ILE HB A 19 THR H 1.0 1.8 3.58 279 184 A 18 ILE HB A 71 TRP H 1.0 1.8 5.67 280 185 A 18 ILE HD1% A 18 ILE H 1.0 1.8 4.29 281 186 A 18 ILE HG2% A 18 ILE H 1.0 1.8 3.95 282 187 A 19 THR H A 18 ILE H 1.0 1.8 5.09 283 188 A 18 ILE H A 72 LYS HA 1.0 1.8 4.06 284 189 A 73 ALA H A 18 ILE H 1.0 1.8 4.63 285 190 A 18 ILE HD1% A 19 THR H 1.0 1.8 4.66 286 191 A 18 ILE HD1% A 20 VAL HA 1.0 1.8 5.54 287 192 A 18 ILE HD1% A 71 TRP H 1.0 1.8 5.30 288 193 A 18 ILE HD1% A 71 TRP HBx 1.0 1.8 4.69 289 194 A 18 ILE HD1% A 71 TRP HBy 1.0 1.8 5.25 290 195 A 18 ILE HD1% A 71 TRP HE3 1.0 1.8 3.64 291 196 A 19 THR H A 18 ILE HG2% 1.0 1.8 4.01 292 197 A 18 ILE HG2% A 71 TRP H 1.0 1.8 5.59 293 198 A 19 THR HA A 19 THR HG2% 1.0 1.8 3.35 294 199 A 19 THR HA A 20 VAL H 1.0 1.8 3.32 295 200 A 19 THR HA A 69 VAL H 1.0 1.8 4.70 296 201 A 19 THR HB A 20 VAL H 1.0 1.8 5.02 297 202 A 19 THR HB A 19 THR H 1.0 1.8 3.81 298 203 A 19 THR HG2% A 20 VAL H 1.0 1.8 3.60 299 204 A 21 SER H A 19 THR HG2% 1.0 1.8 6.00 300 205 A 19 THR HG2% A 68 ARG HA 1.0 1.8 4.38 301 206 A 19 THR HG2% A 68 ARG HDx 1.0 1.8 3.68 302 206 A 19 THR HG2% A 68 ARG HDy 1.0 1.8 3.68 303 207 A 19 THR HG2% A 69 VAL H 1.0 1.8 3.99 304 208 A 20 VAL HA A 20 VAL HGx% 1.0 1.8 3.58 305 209 A 20 VAL HA A 20 VAL HGy% 1.0 1.8 3.58 306 210 A 20 VAL HA A 21 SER H 1.0 1.8 3.08 307 211 A 21 SER H A 20 VAL HB 1.0 1.8 4.74 308 212 A 20 VAL HB A 39 VAL HGy% 1.0 1.8 3.59 309 212 A 20 VAL HB A 39 VAL HGx% 1.0 1.8 3.59 310 213 A 69 VAL H A 20 VAL HB 1.0 1.8 4.28 311 214 A 20 VAL H A 20 VAL HB 1.0 1.8 3.68 312 215 A 20 VAL H A 20 VAL HGy% 1.0 1.8 3.72 313 215 A 20 VAL HGx% A 20 VAL H 1.0 1.8 3.72 314 216 A 20 VAL H A 69 VAL H 1.0 1.8 3.81 315 217 A 20 VAL H A 69 VAL HG1% 1.0 1.8 4.28 316 217 A 20 VAL H A 69 VAL HG2% 1.0 1.8 4.28 317 218 A 20 VAL H A 70 GLN H 1.0 1.8 5.25 318 219 A 71 TRP H A 20 VAL H 1.0 1.8 4.74 319 220 A 71 TRP H A 20 VAL HGy% 1.0 1.8 5.82 320 220 A 20 VAL HGx% A 71 TRP H 1.0 1.8 5.82 321 221 A 71 TRP HBx A 20 VAL HGy% 1.0 1.8 4.36 322 221 A 20 VAL HGx% A 71 TRP HBx 1.0 1.8 4.36 323 222 A 71 TRP HBy A 20 VAL HGy% 1.0 1.8 3.79 324 222 A 20 VAL HGx% A 71 TRP HBy 1.0 1.8 3.79 325 223 A 71 TRP HE3 A 20 VAL HGy% 1.0 1.8 4.09 326 223 A 20 VAL HGx% A 71 TRP HE3 1.0 1.8 4.09 327 224 A 21 SER HA A 22 ALA H 1.0 1.8 3.05 328 225 A 21 SER HA A 22 ALA HB% 1.0 1.8 4.45 329 226 A 21 SER HA A 66 LEU HD1% 1.0 1.8 6.25 330 227 A 21 SER HA A 66 LEU HD2% 1.0 1.8 5.75 331 228 A 21 SER HA A 67 ALA H 1.0 1.8 4.83 332 229 A 21 SER HA A 68 ARG HA 1.0 1.8 3.88 333 230 A 21 SER HA A 68 ARG HGx 1.0 1.8 6.00 334 230 A 21 SER HA A 68 ARG HGy 1.0 1.8 6.00 335 231 A 21 SER HA A 69 VAL H 1.0 1.8 4.26 336 232 A 21 SER H A 21 SER HBx 1.0 1.8 5.16 337 233 A 21 SER HBy A 21 SER H 1.0 1.8 5.16 338 234 A 22 ALA H A 21 SER HBx 1.0 1.8 4.44 339 235 A 66 LEU HD1% A 21 SER HBx 1.0 1.8 4.95 340 236 A 21 SER HBx A 66 LEU HD2% 1.0 1.8 4.95 341 237 A 21 SER HBy A 22 ALA H 1.0 1.8 4.44 342 238 A 21 SER HBy A 66 LEU HD1% 1.0 1.8 4.95 343 239 A 21 SER HBy A 66 LEU HD2% 1.0 1.8 4.95 344 240 A 22 ALA HA A 23 ARG H 1.0 1.8 3.16 345 241 A 22 ALA HA A 23 ARG HGx 1.0 1.8 4.08 346 241 A 23 ARG HGy A 22 ALA HA 1.0 1.8 4.08 347 242 A 22 ALA H A 22 ALA HB% 1.0 1.8 3.39 348 243 A 22 ALA H A 23 ARG H 1.0 1.8 4.84 349 244 A 22 ALA H A 66 LEU HD2% 1.0 1.8 4.12 350 244 A 22 ALA H A 66 LEU HD1% 1.0 1.8 4.12 351 245 A 22 ALA H A 67 ALA H 1.0 1.8 3.69 352 246 A 22 ALA H A 67 ALA HB% 1.0 1.8 4.07 353 247 A 68 ARG HA A 22 ALA H 1.0 1.8 5.34 354 248 A 22 ALA HB% A 23 ARG H 1.0 1.8 3.90 355 249 A 22 ALA HB% A 67 ALA H 1.0 1.8 4.73 356 250 A 23 ARG HA A 24 VAL H 1.0 1.8 3.08 357 251 A 23 ARG HA A 64 THR HB 1.0 1.8 4.88 358 252 A 66 LEU HD1% A 23 ARG HA 1.0 1.8 4.83 359 253 A 23 ARG HA A 66 LEU HD2% 1.0 1.8 3.83 360 254 A 23 ARG H A 23 ARG HBx 1.0 1.8 3.42 361 254 A 23 ARG HBy A 23 ARG H 1.0 1.8 3.42 362 255 A 23 ARG H A 23 ARG HDx 1.0 1.8 5.09 363 255 A 23 ARG HDy A 23 ARG H 1.0 1.8 5.09 364 256 A 23 ARG H A 23 ARG HGx 1.0 1.8 3.94 365 256 A 23 ARG HGy A 23 ARG H 1.0 1.8 3.94 366 257 A 108 PHE HD% A 23 ARG H 1.0 1.8 5.16 367 258 A 23 ARG HBx A 23 ARG HDx 1.0 1.8 4.21 368 258 A 23 ARG HBy A 23 ARG HDx 1.0 1.8 4.21 369 258 A 23 ARG HDy A 23 ARG HBx 1.0 1.8 4.21 370 258 A 23 ARG HBy A 23 ARG HDy 1.0 1.8 4.21 371 259 A 64 THR HG2% A 23 ARG HBx 1.0 1.8 4.40 372 259 A 23 ARG HBy A 64 THR HG2% 1.0 1.8 4.40 373 260 A 23 ARG HBx A 66 LEU HD2% 1.0 1.8 4.46 374 260 A 23 ARG HBy A 66 LEU HD2% 1.0 1.8 4.46 375 260 A 66 LEU HD1% A 23 ARG HBx 1.0 1.8 4.46 376 260 A 23 ARG HBy A 66 LEU HD1% 1.0 1.8 4.46 377 261 A 23 ARG HBy A 108 PHE HBx 1.0 1.8 6.29 378 261 A 23 ARG HBx A 108 PHE HBx 1.0 1.8 6.29 379 261 A 108 PHE HBy A 23 ARG HBx 1.0 1.8 6.29 380 261 A 23 ARG HBy A 108 PHE HBy 1.0 1.8 6.29 381 262 A 108 PHE HD% A 23 ARG HBx 1.0 1.8 5.96 382 262 A 23 ARG HBy A 108 PHE HD% 1.0 1.8 5.96 383 263 A 64 THR HB A 23 ARG HDx 1.0 1.8 5.55 384 263 A 23 ARG HDy A 64 THR HB 1.0 1.8 5.55 385 264 A 23 ARG HDy A 66 LEU HD1% 1.0 1.8 5.87 386 264 A 66 LEU HD1% A 23 ARG HDx 1.0 1.8 5.87 387 265 A 23 ARG HDx A 66 LEU HD2% 1.0 1.8 4.87 388 265 A 23 ARG HDy A 66 LEU HD2% 1.0 1.8 4.87 389 266 A 64 THR HB A 23 ARG HGx 1.0 1.8 5.00 390 266 A 23 ARG HGy A 64 THR HB 1.0 1.8 5.00 391 267 A 24 VAL HA A 24 VAL HG1% 1.0 1.8 3.14 392 267 A 24 VAL HA A 24 VAL HG21 1.0 1.8 3.14 393 268 A 24 VAL HA A 25 THR HB 1.0 1.8 5.03 394 269 A 24 VAL HA A 25 THR H 1.0 1.8 2.97 395 270 A 25 THR H A 24 VAL HB 1.0 1.8 4.49 396 271 A 24 VAL HB A 65 GLY H 1.0 1.8 4.23 397 272 A 24 VAL H A 24 VAL HB 1.0 1.8 3.92 398 273 A 24 VAL H A 24 VAL HG1% 1.0 1.8 3.48 399 273 A 24 VAL H A 24 VAL HG21 1.0 1.8 3.48 400 274 A 24 VAL H A 56 ILE HD1% 1.0 1.8 5.57 401 275 A 24 VAL H A 64 THR HG2% 1.0 1.8 5.16 402 276 A 24 VAL H A 65 GLY H 1.0 1.8 3.85 403 277 A 24 VAL H A 66 LEU HA 1.0 1.8 4.32 404 278 A 66 LEU HD1% A 24 VAL H 1.0 1.8 5.82 405 279 A 24 VAL H A 66 LEU HD2% 1.0 1.8 5.02 406 280 A 25 THR H A 24 VAL HG1% 1.0 1.8 3.48 407 280 A 24 VAL HG21 A 25 THR H 1.0 1.8 3.48 408 281 A 24 VAL HG1% A 65 GLY HAy 1.0 1.8 3.85 409 281 A 65 GLY HAx A 24 VAL HG1% 1.0 1.8 3.85 410 281 A 24 VAL HG21 A 65 GLY HAx 1.0 1.8 3.85 411 281 A 24 VAL HG21 A 65 GLY HAy 1.0 1.8 3.85 412 282 A 66 LEU H A 24 VAL HG1% 1.0 1.8 4.98 413 282 A 24 VAL HG21 A 66 LEU H 1.0 1.8 4.98 414 283 A 25 THR HA A 25 THR HG2% 1.0 1.8 3.28 415 284 A 25 THR HA A 26 ASN H 1.0 1.8 3.12 416 285 A 25 THR HA A 64 THR HA 1.0 1.8 3.78 417 286 A 65 GLY H A 25 THR HA 1.0 1.8 4.15 418 287 A 25 THR HB A 26 ASN HA 1.0 1.8 5.34 419 288 A 25 THR HB A 26 ASN H 1.0 1.8 4.35 420 289 A 25 THR HB A 27 ARG HGx 1.0 1.8 4.37 421 289 A 25 THR HB A 27 ARG HGy 1.0 1.8 4.37 422 290 A 25 THR HB A 25 THR H 1.0 1.8 3.42 423 291 A 25 THR H A 25 THR HG2% 1.0 1.8 3.98 424 292 A 25 THR H A 26 ASN H 1.0 1.8 4.51 425 293 A 25 THR HG2% A 26 ASN H 1.0 1.8 3.41 426 294 A 25 THR HG2% A 27 ARG HDx 1.0 1.8 3.65 427 294 A 25 THR HG2% A 27 ARG HDy 1.0 1.8 3.65 428 295 A 25 THR HG2% A 27 ARG HGx 1.0 1.8 2.97 429 295 A 25 THR HG2% A 27 ARG HGy 1.0 1.8 2.97 430 296 A 26 ASN HA A 27 ARG H 1.0 1.8 3.36 431 297 A 26 ASN H A 26 ASN HBx 1.0 1.8 3.67 432 298 A 26 ASN H A 26 ASN HBy 1.0 1.8 3.67 433 299 A 26 ASN H A 59 ILE HG2% 1.0 1.8 3.93 434 300 A 26 ASN H A 64 THR HA 1.0 1.8 4.02 435 301 A 64 THR HG2% A 26 ASN H 1.0 1.8 3.96 436 302 A 65 GLY H A 26 ASN H 1.0 1.8 5.26 437 303 A 32 ALA H A 26 ASN HBx 1.0 1.8 4.80 438 303 A 26 ASN HBy A 32 ALA H 1.0 1.8 4.80 439 304 A 32 ALA HB% A 26 ASN HBx 1.0 1.8 4.46 440 304 A 26 ASN HBy A 32 ALA HB% 1.0 1.8 4.46 441 305 A 59 ILE HB A 26 ASN HBx 1.0 1.8 4.17 442 305 A 26 ASN HBy A 59 ILE HB 1.0 1.8 4.17 443 306 A 59 ILE HD1% A 26 ASN HBx 1.0 1.8 4.91 444 306 A 26 ASN HBy A 59 ILE HD1% 1.0 1.8 4.91 445 307 A 62 GLY H A 26 ASN HBx 1.0 1.8 4.45 446 307 A 26 ASN HBy A 62 GLY H 1.0 1.8 4.45 447 308 A 63 GLY H A 26 ASN HBx 1.0 1.8 4.45 448 308 A 26 ASN HBy A 63 GLY H 1.0 1.8 4.45 449 309 A 59 ILE HG2% A 26 ASN HBx 1.0 1.8 3.97 450 310 A 59 ILE HG2% A 26 ASN HBy 1.0 1.8 3.97 451 311 A 62 GLY H A 27 ARG HA 1.0 1.8 4.91 452 312 A 27 ARG H A 28 GLY H 1.0 1.8 4.39 453 313 A 28 GLY H A 27 ARG HBy 1.0 1.8 4.19 454 313 A 28 GLY H A 27 ARG HBx 1.0 1.8 4.19 455 314 A 29 ALA H A 28 GLY HAy 1.0 1.8 3.10 456 314 A 28 GLY HAx A 29 ALA H 1.0 1.8 3.10 457 315 A 29 ALA HB% A 28 GLY HAy 1.0 1.8 4.56 458 315 A 28 GLY HAx A 29 ALA HB% 1.0 1.8 4.56 459 316 A 30 ALA H A 28 GLY HAy 1.0 1.8 3.87 460 316 A 28 GLY HAx A 30 ALA H 1.0 1.8 3.87 461 317 A 30 ALA H A 29 ALA HA 1.0 1.8 3.52 462 318 A 29 ALA HA A 61 VAL HG2% 1.0 1.8 5.03 463 318 A 29 ALA HA A 61 VAL HG1% 1.0 1.8 5.03 464 319 A 29 ALA H A 29 ALA HB% 1.0 1.8 3.14 465 320 A 29 ALA H A 30 ALA H 1.0 1.8 4.71 466 321 A 29 ALA H A 30 ALA HB% 1.0 1.8 4.81 467 322 A 29 ALA HB% A 30 ALA H 1.0 1.8 3.73 468 323 A 30 ALA HA A 31 GLU H 1.0 1.8 3.28 469 324 A 30 ALA HA A 61 VAL HG2% 1.0 1.8 3.73 470 324 A 61 VAL HG1% A 30 ALA HA 1.0 1.8 3.73 471 325 A 30 ALA H A 30 ALA HB% 1.0 1.8 2.93 472 326 A 30 ALA H A 31 GLU H 1.0 1.8 4.86 473 327 A 30 ALA H A 61 VAL HG2% 1.0 1.8 3.73 474 327 A 30 ALA H A 61 VAL HG1% 1.0 1.8 3.73 475 328 A 30 ALA HB% A 31 GLU HA 1.0 1.8 4.55 476 329 A 30 ALA HB% A 31 GLU H 1.0 1.8 3.53 477 330 A 31 GLU HA A 31 GLU HGy 1.0 1.8 3.52 478 330 A 31 GLU HA A 31 GLU HGx 1.0 1.8 3.52 479 331 A 32 ALA H A 31 GLU HA 1.0 1.8 3.15 480 332 A 32 ALA HB% A 31 GLU HA 1.0 1.8 4.05 481 333 A 31 GLU HA A 60 PRO HA 1.0 1.8 3.92 482 334 A 31 GLU HA A 60 PRO HBy 1.0 1.8 5.46 483 334 A 31 GLU HA A 60 PRO HBx 1.0 1.8 5.46 484 335 A 31 GLU HA A 61 VAL H 1.0 1.8 4.17 485 336 A 31 GLU HA A 61 VAL HG2% 1.0 1.8 4.34 486 336 A 61 VAL HG1% A 31 GLU HA 1.0 1.8 4.34 487 337 A 31 GLU H A 31 GLU HGy 1.0 1.8 3.46 488 337 A 31 GLU H A 31 GLU HGx 1.0 1.8 3.46 489 338 A 32 ALA H A 31 GLU H 1.0 1.8 4.83 490 339 A 31 GLU H A 61 VAL HG2% 1.0 1.8 4.04 491 339 A 61 VAL HG1% A 31 GLU H 1.0 1.8 4.04 492 340 A 32 ALA HB% A 31 GLU HBx 1.0 1.8 4.81 493 340 A 32 ALA HB% A 31 GLU HBy 1.0 1.8 4.81 494 341 A 32 ALA H A 31 GLU HGy 1.0 1.8 4.18 495 341 A 32 ALA H A 31 GLU HGx 1.0 1.8 4.18 496 342 A 32 ALA H A 31 GLU HGy 1.0 1.8 4.82 497 342 A 32 ALA H A 31 GLU HGx 1.0 1.8 4.82 498 343 A 32 ALA HA A 33 HIS H 1.0 1.8 2.90 499 344 A 32 ALA H A 32 ALA HB% 1.0 1.8 3.36 500 345 A 32 ALA H A 33 HIS HA 1.0 1.8 5.75 501 346 A 32 ALA H A 33 HIS H 1.0 1.8 4.84 502 347 A 32 ALA H A 35 VAL HGy% 1.0 1.8 5.20 503 348 A 32 ALA H A 59 ILE HB 1.0 1.8 4.90 504 349 A 32 ALA H A 59 ILE H 1.0 1.8 5.17 505 350 A 32 ALA H A 59 ILE HD1% 1.0 1.8 5.98 506 351 A 32 ALA H A 61 VAL H 1.0 1.8 5.54 507 352 A 32 ALA HB% A 33 HIS H 1.0 1.8 3.43 508 353 A 32 ALA HB% A 59 ILE HB 1.0 1.8 3.34 509 354 A 33 HIS HA A 33 HIS HD2 1.0 1.8 4.77 510 355 A 33 HIS HA A 34 ASN HA 1.0 1.8 4.82 511 356 A 33 HIS HA A 34 ASN H 1.0 1.8 3.01 512 357 A 33 HIS HA A 35 VAL H 1.0 1.8 4.51 513 358 A 33 HIS H A 33 HIS HD2 1.0 1.8 5.89 514 359 A 33 HIS HD2 A 33 HIS HBx 1.0 1.8 3.86 515 359 A 33 HIS HD2 A 33 HIS HBy 1.0 1.8 3.86 516 360 A 33 HIS HD2 A 58 ARG HA 1.0 1.8 4.46 517 361 A 34 ASN HA A 35 VAL H 1.0 1.8 3.22 518 362 A 34 ASN HA A 55 THR HG2% 1.0 1.8 3.65 519 363 A 34 ASN H A 35 VAL HB 1.0 1.8 5.38 520 364 A 34 ASN H A 35 VAL H 1.0 1.8 3.69 521 365 A 34 ASN H A 55 THR HG2% 1.0 1.8 4.81 522 366 A 55 THR HG2% A 34 ASN HBx 1.0 1.8 3.77 523 366 A 55 THR HG2% A 34 ASN HBy 1.0 1.8 3.77 524 367 A 35 VAL H A 34 ASN HBx 1.0 1.8 4.87 525 368 A 35 VAL H A 34 ASN HBy 1.0 1.8 4.87 526 369 A 35 VAL HA A 35 VAL HGx% 1.0 1.8 3.19 527 370 A 35 VAL HB A 56 ILE HB 1.0 1.8 3.79 528 371 A 35 VAL HB A 56 ILE H 1.0 1.8 4.72 529 372 A 56 ILE HD1% A 35 VAL HB 1.0 1.8 4.99 530 373 A 35 VAL HB A 56 ILE HG2% 1.0 1.8 4.83 531 374 A 35 VAL H A 35 VAL HB 1.0 1.8 3.40 532 375 A 35 VAL H A 55 THR HG2% 1.0 1.8 3.53 533 376 A 35 VAL H A 56 ILE HB 1.0 1.8 4.21 534 377 A 35 VAL H A 56 ILE H 1.0 1.8 3.74 535 378 A 36 PRO HA A 37 VAL H 1.0 1.8 3.10 536 379 A 36 PRO HA A 55 THR HA 1.0 1.8 3.69 537 380 A 56 ILE H A 36 PRO HA 1.0 1.8 4.23 538 381 A 36 PRO HA A 56 ILE HG1x 1.0 1.8 4.48 539 381 A 36 PRO HA A 56 ILE HG1y 1.0 1.8 4.48 540 382 A 37 VAL H A 36 PRO HBy 1.0 1.8 4.02 541 382 A 37 VAL H A 36 PRO HBx 1.0 1.8 4.02 542 383 A 56 ILE H A 36 PRO HBy 1.0 1.8 6.00 543 383 A 56 ILE H A 36 PRO HBx 1.0 1.8 6.00 544 384 A 93 ASP HA A 36 PRO HGy 1.0 1.8 4.66 545 384 A 36 PRO HGx A 93 ASP HA 1.0 1.8 4.66 546 385 A 37 VAL HA A 37 VAL HG1% 1.0 1.8 3.51 547 386 A 37 VAL HA A 37 VAL HG2% 1.0 1.8 3.51 548 387 A 37 VAL HA A 38 ALA H 1.0 1.8 3.16 549 388 A 37 VAL HA A 38 ALA HB% 1.0 1.8 4.32 550 389 A 37 VAL HA A 92 VAL HA 1.0 1.8 3.98 551 390 A 37 VAL HA A 93 ASP H 1.0 1.8 4.12 552 391 A 38 ALA H A 37 VAL HB 1.0 1.8 3.96 553 392 A 37 VAL HB A 54 ASP H 1.0 1.8 5.46 554 393 A 67 ALA HB% A 37 VAL HB 1.0 1.8 3.94 555 394 A 37 VAL H A 37 VAL HB 1.0 1.8 3.49 556 395 A 37 VAL H A 37 VAL HG2% 1.0 1.8 3.49 557 395 A 37 VAL H A 37 VAL HG1% 1.0 1.8 3.49 558 396 A 37 VAL H A 37 VAL HG1% 1.0 1.8 4.22 559 397 A 37 VAL H A 37 VAL HG2% 1.0 1.8 4.22 560 398 A 37 VAL H A 55 THR HA 1.0 1.8 4.38 561 399 A 37 VAL H A 55 THR H 1.0 1.8 5.60 562 400 A 56 ILE H A 37 VAL H 1.0 1.8 5.64 563 401 A 67 ALA HB% A 37 VAL H 1.0 1.8 5.03 564 402 A 37 VAL H A 93 ASP H 1.0 1.8 5.83 565 403 A 38 ALA HA A 37 VAL HG2% 1.0 1.8 3.93 566 403 A 37 VAL HG1% A 38 ALA HA 1.0 1.8 3.93 567 404 A 38 ALA H A 37 VAL HG2% 1.0 1.8 3.42 568 404 A 38 ALA H A 37 VAL HG1% 1.0 1.8 3.42 569 405 A 38 ALA HB% A 37 VAL HG2% 1.0 1.8 4.23 570 405 A 38 ALA HB% A 37 VAL HG1% 1.0 1.8 4.23 571 406 A 40 TYR HD% A 37 VAL HG2% 1.0 1.8 5.92 572 406 A 37 VAL HG1% A 40 TYR HD% 1.0 1.8 5.92 573 407 A 90 ALA HA A 37 VAL HG2% 1.0 1.8 4.47 574 407 A 90 ALA HA A 37 VAL HG1% 1.0 1.8 4.47 575 408 A 91 VAL H A 37 VAL HG2% 1.0 1.8 3.68 576 408 A 37 VAL HG1% A 91 VAL H 1.0 1.8 3.68 577 409 A 92 VAL HA A 37 VAL HG2% 1.0 1.8 3.61 578 409 A 92 VAL HA A 37 VAL HG1% 1.0 1.8 3.61 579 410 A 37 VAL HG2% A 92 VAL HG2% 1.0 1.8 4.36 580 410 A 37 VAL HG1% A 92 VAL HG2% 1.0 1.8 4.36 581 410 A 92 VAL HG1% A 37 VAL HG2% 1.0 1.8 4.36 582 410 A 37 VAL HG1% A 92 VAL HG1% 1.0 1.8 4.36 583 411 A 93 ASP H A 37 VAL HG2% 1.0 1.8 4.03 584 411 A 93 ASP H A 37 VAL HG1% 1.0 1.8 4.03 585 412 A 37 VAL HG1% A 39 VAL H 1.0 1.8 5.48 586 413 A 39 VAL H A 37 VAL HG2% 1.0 1.8 5.98 587 414 A 38 ALA HA A 39 VAL H 1.0 1.8 3.04 588 415 A 38 ALA HA A 50 GLU HGx 1.0 1.8 4.95 589 415 A 38 ALA HA A 50 GLU HGy 1.0 1.8 4.95 590 416 A 38 ALA HA A 53 ARG HA 1.0 1.8 4.28 591 417 A 38 ALA HA A 53 ARG HBx 1.0 1.8 4.51 592 418 A 38 ALA HA A 53 ARG HBy 1.0 1.8 4.51 593 419 A 38 ALA HA A 53 ARG HGx 1.0 1.8 5.22 594 419 A 38 ALA HA A 53 ARG HGy 1.0 1.8 5.22 595 420 A 54 ASP H A 38 ALA HA 1.0 1.8 5.64 596 421 A 38 ALA H A 38 ALA HB% 1.0 1.8 3.52 597 422 A 90 ALA HA A 38 ALA H 1.0 1.8 5.82 598 423 A 38 ALA H A 91 VAL HB 1.0 1.8 4.81 599 424 A 38 ALA H A 91 VAL H 1.0 1.8 4.05 600 425 A 38 ALA H A 91 VAL HG1% 1.0 1.8 4.81 601 425 A 38 ALA H A 91 VAL HG2% 1.0 1.8 4.81 602 426 A 38 ALA H A 92 VAL HA 1.0 1.8 4.34 603 427 A 38 ALA H A 93 ASP H 1.0 1.8 4.89 604 428 A 38 ALA HB% A 39 VAL H 1.0 1.8 3.64 605 429 A 38 ALA HB% A 40 TYR HE% 1.0 1.8 4.02 606 430 A 38 ALA HB% A 50 GLU HGx 1.0 1.8 4.25 607 430 A 38 ALA HB% A 50 GLU HGy 1.0 1.8 4.25 608 431 A 38 ALA HB% A 91 VAL HB 1.0 1.8 3.88 609 432 A 38 ALA HB% A 91 VAL H 1.0 1.8 4.54 610 433 A 39 VAL HA A 40 TYR H 1.0 1.8 3.47 611 434 A 40 TYR HD% A 39 VAL HA 1.0 1.8 3.94 612 435 A 40 TYR HE% A 39 VAL HA 1.0 1.8 4.62 613 436 A 90 ALA HA A 39 VAL HA 1.0 1.8 3.83 614 437 A 39 VAL HA A 90 ALA HB% 1.0 1.8 3.82 615 438 A 91 VAL H A 39 VAL HA 1.0 1.8 4.17 616 439 A 39 VAL HB A 52 GLY H 1.0 1.8 4.67 617 440 A 39 VAL HB A 69 VAL HG1% 1.0 1.8 3.75 618 440 A 69 VAL HG2% A 39 VAL HB 1.0 1.8 3.75 619 441 A 90 ALA HA A 39 VAL HB 1.0 1.8 5.63 620 442 A 39 VAL H A 39 VAL HB 1.0 1.8 3.38 621 443 A 39 VAL H A 39 VAL HGy% 1.0 1.8 3.45 622 443 A 39 VAL HGx% A 39 VAL H 1.0 1.8 3.45 623 444 A 39 VAL HGx% A 39 VAL H 1.0 1.8 4.04 624 445 A 39 VAL H A 39 VAL HGy% 1.0 1.8 4.04 625 446 A 39 VAL H A 40 TYR H 1.0 1.8 5.09 626 447 A 39 VAL H A 52 GLY H 1.0 1.8 3.90 627 448 A 39 VAL H A 53 ARG HA 1.0 1.8 4.47 628 449 A 39 VAL H A 53 ARG HBx 1.0 1.8 4.78 629 450 A 39 VAL H A 53 ARG HBy 1.0 1.8 5.78 630 451 A 39 VAL H A 69 VAL HG1% 1.0 1.8 4.88 631 451 A 69 VAL HG2% A 39 VAL H 1.0 1.8 4.88 632 452 A 40 TYR H A 39 VAL HGy% 1.0 1.8 3.67 633 452 A 39 VAL HGx% A 40 TYR H 1.0 1.8 3.67 634 453 A 51 ILE HD1% A 39 VAL HGy% 1.0 1.8 3.56 635 453 A 39 VAL HGx% A 51 ILE HD1% 1.0 1.8 3.56 636 454 A 52 GLY H A 39 VAL HGy% 1.0 1.8 4.48 637 454 A 39 VAL HGx% A 52 GLY H 1.0 1.8 4.48 638 455 A 69 VAL HB A 39 VAL HGy% 1.0 1.8 4.10 639 455 A 39 VAL HGx% A 69 VAL HB 1.0 1.8 4.10 640 456 A 91 VAL H A 39 VAL HGy% 1.0 1.8 4.37 641 456 A 39 VAL HGx% A 91 VAL H 1.0 1.8 4.37 642 457 A 53 ARG HA A 39 VAL HGy% 1.0 1.8 5.79 643 457 A 39 VAL HGx% A 53 ARG HA 1.0 1.8 5.79 644 458 A 40 TYR HA A 41 LEU H 1.0 1.8 3.40 645 459 A 40 TYR HA A 50 GLU HA 1.0 1.8 3.83 646 460 A 40 TYR HA A 51 ILE H 1.0 1.8 4.09 647 461 A 51 ILE HD1% A 40 TYR HA 1.0 1.8 4.38 648 462 A 52 GLY H A 40 TYR HA 1.0 1.8 5.34 649 463 A 40 TYR H A 40 TYR HBx 1.0 1.8 4.05 650 463 A 40 TYR H A 40 TYR HBy 1.0 1.8 4.05 651 464 A 40 TYR HD% A 40 TYR H 1.0 1.8 4.15 652 465 A 40 TYR HE% A 40 TYR H 1.0 1.8 4.66 653 466 A 40 TYR H A 51 ILE HD1% 1.0 1.8 5.24 654 467 A 40 TYR H A 89 TYR H 1.0 1.8 4.74 655 468 A 40 TYR H A 89 TYR HBx 1.0 1.8 4.61 656 468 A 40 TYR H A 89 TYR HBy 1.0 1.8 4.61 657 469 A 90 ALA HA A 40 TYR H 1.0 1.8 4.42 658 470 A 91 VAL H A 40 TYR H 1.0 1.8 4.90 659 471 A 41 LEU H A 40 TYR HBx 1.0 1.8 3.94 660 471 A 41 LEU H A 40 TYR HBy 1.0 1.8 3.94 661 472 A 40 TYR HBy A 89 TYR HBx 1.0 1.8 5.87 662 472 A 89 TYR HBy A 40 TYR HBx 1.0 1.8 5.87 663 472 A 40 TYR HBy A 89 TYR HBy 1.0 1.8 5.87 664 472 A 40 TYR HBx A 89 TYR HBx 1.0 1.8 5.87 665 473 A 40 TYR HD% A 41 LEU H 1.0 1.8 4.53 666 474 A 40 TYR HD% A 44 PRO HA 1.0 1.8 5.27 667 475 A 40 TYR HD% A 44 PRO HBy 1.0 1.8 5.62 668 475 A 40 TYR HD% A 44 PRO HBx 1.0 1.8 5.62 669 476 A 40 TYR HD% A 49 VAL HA 1.0 1.8 5.82 670 477 A 40 TYR HD% A 50 GLU HA 1.0 1.8 4.25 671 478 A 90 ALA HA A 40 TYR HD% 1.0 1.8 4.88 672 479 A 40 TYR HD% A 91 VAL HG1% 1.0 1.8 5.93 673 479 A 40 TYR HD% A 91 VAL HG2% 1.0 1.8 5.93 674 480 A 40 TYR HE% A 44 PRO HDx 1.0 1.8 5.21 675 480 A 40 TYR HE% A 44 PRO HDy 1.0 1.8 5.21 676 481 A 40 TYR HE% A 89 TYR HBx 1.0 1.8 4.19 677 482 A 40 TYR HE% A 89 TYR HBy 1.0 1.8 4.19 678 483 A 91 VAL HB A 40 TYR HE% 1.0 1.8 4.29 679 484 A 91 VAL H A 40 TYR HE% 1.0 1.8 4.21 680 485 A 40 TYR HE% A 91 VAL HG1% 1.0 1.8 3.25 681 485 A 91 VAL HG2% A 40 TYR HE% 1.0 1.8 3.25 682 486 A 41 LEU HA A 41 LEU HD11 1.0 1.8 3.38 683 486 A 41 LEU HA A 41 LEU HD2% 1.0 1.8 3.38 684 487 A 41 LEU HA A 42 GLY H 1.0 1.8 3.21 685 488 A 51 ILE HD1% A 41 LEU HA 1.0 1.8 4.55 686 489 A 42 GLY H A 41 LEU HG 1.0 1.8 4.07 687 490 A 41 LEU HG A 42 GLY HAy 1.0 1.8 5.13 688 490 A 41 LEU HG A 42 GLY HAx 1.0 1.8 5.13 689 491 A 41 LEU HG A 87 PRO HGy 1.0 1.8 4.60 690 491 A 41 LEU HG A 87 PRO HGx 1.0 1.8 4.60 691 492 A 41 LEU H A 41 LEU HBx 1.0 1.8 3.80 692 493 A 41 LEU H A 41 LEU HBy 1.0 1.8 3.80 693 494 A 41 LEU H A 41 LEU HD11 1.0 1.8 4.02 694 494 A 41 LEU H A 41 LEU HD2% 1.0 1.8 4.02 695 495 A 41 LEU H A 42 GLY H 1.0 1.8 4.58 696 496 A 41 LEU H A 49 VAL H 1.0 1.8 4.37 697 497 A 41 LEU H A 49 VAL HG2% 1.0 1.8 4.59 698 497 A 41 LEU H A 49 VAL HG1% 1.0 1.8 4.59 699 498 A 41 LEU H A 50 GLU HA 1.0 1.8 5.43 700 499 A 41 LEU H A 51 ILE H 1.0 1.8 5.61 701 500 A 51 ILE HD1% A 41 LEU H 1.0 1.8 4.71 702 501 A 42 GLY H A 41 LEU HBx 1.0 1.8 4.59 703 502 A 51 ILE HD1% A 41 LEU HBx 1.0 1.8 4.79 704 503 A 51 ILE HD1% A 41 LEU HBy 1.0 1.8 4.79 705 504 A 42 GLY H A 41 LEU HD11 1.0 1.8 4.93 706 504 A 41 LEU HD2% A 42 GLY H 1.0 1.8 4.93 707 505 A 71 TRP HE1 A 41 LEU HD11 1.0 1.8 5.03 708 505 A 41 LEU HD2% A 71 TRP HE1 1.0 1.8 5.03 709 506 A 71 TRP HE3 A 41 LEU HD11 1.0 1.8 3.63 710 506 A 71 TRP HE3 A 41 LEU HD2% 1.0 1.8 3.63 711 507 A 71 TRP HH2 A 41 LEU HD11 1.0 1.8 3.29 712 507 A 41 LEU HD2% A 71 TRP HH2 1.0 1.8 3.29 713 508 A 71 TRP HZ2 A 41 LEU HD11 1.0 1.8 3.71 714 508 A 41 LEU HD2% A 71 TRP HZ2 1.0 1.8 3.71 715 509 A 74 THR H A 41 LEU HD11 1.0 1.8 5.89 716 509 A 41 LEU HD2% A 74 THR H 1.0 1.8 5.89 717 510 A 41 LEU HD11 A 87 PRO HGy 1.0 1.8 4.63 718 510 A 41 LEU HD2% A 87 PRO HGy 1.0 1.8 4.63 719 510 A 87 PRO HGx A 41 LEU HD11 1.0 1.8 4.63 720 510 A 41 LEU HD2% A 87 PRO HGx 1.0 1.8 4.63 721 511 A 42 GLY H A 43 ASN H 1.0 1.8 4.60 722 512 A 42 GLY H A 87 PRO HBx 1.0 1.8 5.49 723 512 A 42 GLY H A 87 PRO HBy 1.0 1.8 5.49 724 513 A 42 GLY H A 87 PRO HGy 1.0 1.8 4.31 725 513 A 42 GLY H A 87 PRO HGx 1.0 1.8 4.31 726 514 A 42 GLY H A 89 TYR HD% 1.0 1.8 4.62 727 515 A 42 GLY HAx A 87 PRO HBx 1.0 1.8 5.57 728 515 A 42 GLY HAy A 87 PRO HBx 1.0 1.8 5.57 729 515 A 87 PRO HBy A 42 GLY HAy 1.0 1.8 5.57 730 515 A 42 GLY HAx A 87 PRO HBy 1.0 1.8 5.57 731 516 A 42 GLY HAx A 87 PRO HGy 1.0 1.8 4.25 732 516 A 42 GLY HAy A 87 PRO HGy 1.0 1.8 4.25 733 516 A 87 PRO HGx A 42 GLY HAy 1.0 1.8 4.25 734 516 A 42 GLY HAx A 87 PRO HGx 1.0 1.8 4.25 735 517 A 89 TYR HE% A 42 GLY HAy 1.0 1.8 5.33 736 517 A 42 GLY HAx A 89 TYR HE% 1.0 1.8 5.33 737 518 A 43 ASN H A 46 GLN H 1.0 1.8 4.49 738 519 A 43 ASN H A 46 GLN HBx 1.0 1.8 4.70 739 519 A 43 ASN H A 46 GLN HBy 1.0 1.8 4.70 740 520 A 44 PRO HA A 46 GLN H 1.0 1.8 4.56 741 521 A 44 PRO HA A 48 GLY H 1.0 1.8 4.40 742 522 A 44 PRO HA A 48 GLY HAx 1.0 1.8 4.17 743 523 A 44 PRO HA A 48 GLY HAy 1.0 1.8 4.67 744 524 A 48 GLY H A 44 PRO HBy 1.0 1.8 5.14 745 524 A 44 PRO HBx A 48 GLY H 1.0 1.8 5.14 746 525 A 45 ALA H A 44 PRO HDx 1.0 1.8 3.73 747 525 A 44 PRO HDy A 45 ALA H 1.0 1.8 3.73 748 526 A 45 ALA H A 44 PRO HDx 1.0 1.8 4.25 749 527 A 44 PRO HDy A 45 ALA H 1.0 1.8 4.25 750 528 A 45 ALA H A 44 PRO HGy 1.0 1.8 4.29 751 528 A 45 ALA H A 44 PRO HGx 1.0 1.8 4.29 752 529 A 45 ALA H A 45 ALA HB% 1.0 1.8 2.88 753 530 A 45 ALA H A 46 GLN HA 1.0 1.8 5.39 754 531 A 45 ALA H A 46 GLN HBx 1.0 1.8 4.74 755 531 A 46 GLN HBy A 45 ALA H 1.0 1.8 4.74 756 532 A 45 ALA H A 47 GLY H 1.0 1.8 4.97 757 533 A 46 GLN H A 45 ALA HB% 1.0 1.8 3.53 758 534 A 45 ALA HB% A 47 GLY H 1.0 1.8 5.21 759 535 A 46 GLN H A 46 GLN HBx 1.0 1.8 3.76 760 536 A 46 GLN H A 46 GLN HBy 1.0 1.8 4.26 761 537 A 46 GLN H A 47 GLY H 1.0 1.8 3.66 762 538 A 46 GLN H A 47 GLY HAy 1.0 1.8 5.07 763 538 A 46 GLN H A 47 GLY HAx 1.0 1.8 5.07 764 539 A 46 GLN H A 48 GLY H 1.0 1.8 5.13 765 540 A 49 VAL H A 48 GLY H 1.0 1.8 4.70 766 541 A 49 VAL H A 48 GLY HAy 1.0 1.8 3.07 767 541 A 49 VAL H A 48 GLY HAx 1.0 1.8 3.07 768 542 A 48 GLY HAy A 49 VAL HG2% 1.0 1.8 4.53 769 542 A 49 VAL HG1% A 48 GLY HAy 1.0 1.8 4.53 770 542 A 49 VAL HG1% A 48 GLY HAx 1.0 1.8 4.53 771 542 A 48 GLY HAx A 49 VAL HG2% 1.0 1.8 4.53 772 543 A 50 GLU H A 48 GLY HAy 1.0 1.8 5.81 773 543 A 48 GLY HAx A 50 GLU H 1.0 1.8 5.81 774 544 A 49 VAL HA A 49 VAL HG1% 1.0 1.8 3.46 775 545 A 49 VAL HA A 49 VAL HG2% 1.0 1.8 3.46 776 546 A 49 VAL HA A 50 GLU H 1.0 1.8 2.91 777 547 A 50 GLU H A 49 VAL HB 1.0 1.8 4.39 778 548 A 49 VAL H A 49 VAL HB 1.0 1.8 3.52 779 549 A 49 VAL H A 49 VAL HG2% 1.0 1.8 3.49 780 549 A 49 VAL H A 49 VAL HG1% 1.0 1.8 3.49 781 550 A 49 VAL H A 50 GLU H 1.0 1.8 5.09 782 551 A 49 VAL HG1% A 50 GLU H 1.0 1.8 4.95 783 552 A 50 GLU H A 49 VAL HG2% 1.0 1.8 4.95 784 553 A 50 GLU HA A 50 GLU HGx 1.0 1.8 4.13 785 553 A 50 GLU HGy A 50 GLU HA 1.0 1.8 4.13 786 554 A 50 GLU HA A 51 ILE HG1y 1.0 1.8 4.66 787 554 A 50 GLU HA A 51 ILE HG1x 1.0 1.8 4.66 788 555 A 50 GLU HA A 51 ILE HG2% 1.0 1.8 5.89 789 556 A 52 GLY H A 50 GLU HA 1.0 1.8 4.14 790 557 A 50 GLU H A 50 GLU HBx 1.0 1.8 3.06 791 557 A 50 GLU H A 50 GLU HBy 1.0 1.8 3.06 792 558 A 50 GLU H A 50 GLU HGx 1.0 1.8 4.62 793 558 A 50 GLU HGy A 50 GLU H 1.0 1.8 4.62 794 559 A 50 GLU H A 51 ILE HA 1.0 1.8 6.00 795 560 A 51 ILE H A 50 GLU H 1.0 1.8 5.67 796 561 A 51 ILE H A 50 GLU HGx 1.0 1.8 4.45 797 561 A 50 GLU HGy A 51 ILE H 1.0 1.8 4.45 798 562 A 52 GLY H A 50 GLU HGx 1.0 1.8 3.30 799 562 A 50 GLU HGy A 52 GLY H 1.0 1.8 3.30 800 563 A 51 ILE HD1% A 51 ILE HA 1.0 1.8 4.32 801 564 A 51 ILE HG2% A 51 ILE HA 1.0 1.8 3.08 802 565 A 51 ILE HA A 71 TRP HD1 1.0 1.8 5.56 803 566 A 51 ILE HD1% A 51 ILE HB 1.0 1.8 3.48 804 567 A 52 GLY H A 51 ILE HB 1.0 1.8 4.34 805 568 A 71 TRP HD1 A 51 ILE HB 1.0 1.8 5.07 806 569 A 51 ILE H A 51 ILE HB 1.0 1.8 4.19 807 570 A 51 ILE HD1% A 51 ILE H 1.0 1.8 4.46 808 571 A 51 ILE H A 51 ILE HG1y 1.0 1.8 4.34 809 571 A 51 ILE H A 51 ILE HG1x 1.0 1.8 4.34 810 572 A 51 ILE H A 51 ILE HG2% 1.0 1.8 4.19 811 573 A 52 GLY H A 51 ILE H 1.0 1.8 3.37 812 574 A 52 GLY H A 51 ILE HD1% 1.0 1.8 4.97 813 575 A 71 TRP HBx A 51 ILE HD1% 1.0 1.8 4.38 814 576 A 71 TRP HBy A 51 ILE HD1% 1.0 1.8 4.67 815 577 A 51 ILE HD1% A 71 TRP HD1 1.0 1.8 4.17 816 578 A 51 ILE HD1% A 71 TRP HE1 1.0 1.8 4.44 817 579 A 52 GLY H A 51 ILE HG1y 1.0 1.8 4.08 818 579 A 52 GLY H A 51 ILE HG1x 1.0 1.8 4.08 819 580 A 51 ILE HG1y A 52 GLY HAx 1.0 1.8 5.12 820 580 A 51 ILE HG1x A 52 GLY HAx 1.0 1.8 5.12 821 580 A 52 GLY HAy A 51 ILE HG1y 1.0 1.8 5.12 822 580 A 51 ILE HG1x A 52 GLY HAy 1.0 1.8 5.12 823 581 A 51 ILE HD1% A 51 ILE HG2% 1.0 1.8 3.07 824 582 A 52 GLY H A 51 ILE HG2% 1.0 1.8 4.29 825 583 A 71 TRP HBx A 51 ILE HG2% 1.0 1.8 3.98 826 584 A 51 ILE HG2% A 71 TRP HD1 1.0 1.8 3.41 827 585 A 71 TRP HE1 A 51 ILE HG2% 1.0 1.8 3.68 828 586 A 72 LYS H A 51 ILE HG2% 1.0 1.8 5.71 829 587 A 52 GLY H A 53 ARG H 1.0 1.8 4.45 830 588 A 52 GLY H A 69 VAL HG1% 1.0 1.8 4.63 831 588 A 69 VAL HG2% A 52 GLY H 1.0 1.8 4.63 832 589 A 53 ARG H A 52 GLY HAx 1.0 1.8 2.94 833 589 A 52 GLY HAy A 53 ARG H 1.0 1.8 2.94 834 590 A 53 ARG HA A 53 ARG HGx 1.0 1.8 4.18 835 590 A 53 ARG HA A 53 ARG HGy 1.0 1.8 4.18 836 591 A 54 ASP H A 53 ARG HA 1.0 1.8 3.06 837 592 A 53 ARG HA A 69 VAL HB 1.0 1.8 6.00 838 593 A 53 ARG HA A 69 VAL HG1% 1.0 1.8 4.01 839 593 A 69 VAL HG2% A 53 ARG HA 1.0 1.8 4.01 840 594 A 53 ARG H A 53 ARG HBx 1.0 1.8 3.56 841 594 A 53 ARG H A 53 ARG HBy 1.0 1.8 3.56 842 595 A 53 ARG H A 53 ARG HGx 1.0 1.8 4.21 843 595 A 53 ARG HGy A 53 ARG H 1.0 1.8 4.21 844 596 A 53 ARG H A 54 ASP HA 1.0 1.8 4.96 845 597 A 54 ASP H A 53 ARG H 1.0 1.8 4.34 846 598 A 54 ASP H A 53 ARG HBx 1.0 1.8 3.65 847 598 A 54 ASP H A 53 ARG HBy 1.0 1.8 3.65 848 599 A 54 ASP HA A 53 ARG HGx 1.0 1.8 4.25 849 599 A 53 ARG HGy A 54 ASP HA 1.0 1.8 4.25 850 600 A 55 THR H A 53 ARG HGx 1.0 1.8 4.93 851 600 A 55 THR H A 53 ARG HGy 1.0 1.8 4.93 852 601 A 55 THR H A 54 ASP HA 1.0 1.8 2.88 853 602 A 55 THR HG2% A 54 ASP HA 1.0 1.8 5.58 854 603 A 54 ASP H A 54 ASP HBx 1.0 1.8 3.99 855 604 A 54 ASP H A 54 ASP HBy 1.0 1.8 3.99 856 605 A 54 ASP H A 55 THR H 1.0 1.8 4.35 857 606 A 67 ALA HB% A 54 ASP H 1.0 1.8 4.37 858 607 A 55 THR H A 54 ASP HBx 1.0 1.8 4.11 859 607 A 55 THR H A 54 ASP HBy 1.0 1.8 4.11 860 608 A 54 ASP HBy A 69 VAL HG1% 1.0 1.8 3.85 861 608 A 54 ASP HBx A 69 VAL HG1% 1.0 1.8 3.85 862 608 A 69 VAL HG2% A 54 ASP HBx 1.0 1.8 3.85 863 608 A 69 VAL HG2% A 54 ASP HBy 1.0 1.8 3.85 864 609 A 67 ALA HB% A 54 ASP HBx 1.0 1.8 4.68 865 610 A 68 ARG H A 54 ASP HBx 1.0 1.8 4.54 866 611 A 67 ALA HB% A 54 ASP HBy 1.0 1.8 4.18 867 612 A 54 ASP HBy A 68 ARG H 1.0 1.8 4.04 868 613 A 55 THR HG2% A 55 THR HA 1.0 1.8 3.33 869 614 A 56 ILE H A 55 THR HA 1.0 1.8 3.30 870 615 A 56 ILE H A 55 THR HB 1.0 1.8 4.96 871 616 A 55 THR H A 55 THR HB 1.0 1.8 3.29 872 617 A 55 THR HG2% A 55 THR H 1.0 1.8 3.95 873 618 A 56 ILE H A 55 THR H 1.0 1.8 4.78 874 619 A 55 THR HG2% A 56 ILE H 1.0 1.8 3.39 875 620 A 56 ILE HD1% A 56 ILE HA 1.0 1.8 4.27 876 621 A 56 ILE HG2% A 56 ILE HA 1.0 1.8 3.37 877 622 A 56 ILE HA A 57 SER H 1.0 1.8 2.93 878 623 A 56 ILE HD1% A 56 ILE HB 1.0 1.8 3.34 879 624 A 56 ILE HB A 57 SER H 1.0 1.8 4.11 880 625 A 59 ILE HD1% A 56 ILE HB 1.0 1.8 3.33 881 626 A 56 ILE HB A 56 ILE H 1.0 1.8 3.39 882 627 A 56 ILE HD1% A 56 ILE H 1.0 1.8 4.23 883 628 A 56 ILE H A 56 ILE HG1x 1.0 1.8 4.71 884 628 A 56 ILE H A 56 ILE HG1y 1.0 1.8 4.71 885 629 A 65 GLY H A 56 ILE HD1% 1.0 1.8 5.15 886 630 A 56 ILE HD1% A 65 GLY HAy 1.0 1.8 4.17 887 630 A 56 ILE HD1% A 65 GLY HAx 1.0 1.8 4.17 888 631 A 56 ILE HD1% A 66 LEU HA 1.0 1.8 4.28 889 632 A 56 ILE HD1% A 66 LEU H 1.0 1.8 4.47 890 633 A 56 ILE HD1% A 67 ALA HA 1.0 1.8 4.61 891 634 A 67 ALA H A 56 ILE HD1% 1.0 1.8 4.22 892 635 A 67 ALA HB% A 56 ILE HD1% 1.0 1.8 3.38 893 636 A 56 ILE HG2% A 57 SER H 1.0 1.8 3.59 894 637 A 58 ARG HA A 56 ILE HG2% 1.0 1.8 4.32 895 638 A 56 ILE HG2% A 58 ARG H 1.0 1.8 3.29 896 639 A 59 ILE H A 56 ILE HG2% 1.0 1.8 4.41 897 640 A 56 ILE HG2% A 65 GLY HAy 1.0 1.8 3.28 898 640 A 65 GLY HAx A 56 ILE HG2% 1.0 1.8 3.28 899 641 A 65 GLY HAx A 56 ILE HG2% 1.0 1.8 3.80 900 642 A 56 ILE HG2% A 65 GLY HAy 1.0 1.8 3.80 901 643 A 66 LEU H A 56 ILE HG2% 1.0 1.8 3.91 902 644 A 57 SER H A 58 ARG H 1.0 1.8 3.65 903 645 A 58 ARG HA A 58 ARG HGx 1.0 1.8 4.08 904 645 A 58 ARG HA A 58 ARG HGy 1.0 1.8 4.08 905 646 A 59 ILE H A 58 ARG HA 1.0 1.8 2.98 906 647 A 59 ILE HD1% A 58 ARG HA 1.0 1.8 5.07 907 648 A 58 ARG H A 58 ARG HBx 1.0 1.8 3.35 908 648 A 58 ARG H A 58 ARG HBy 1.0 1.8 3.35 909 649 A 58 ARG H A 58 ARG HDx 1.0 1.8 5.36 910 649 A 58 ARG H A 58 ARG HDy 1.0 1.8 5.36 911 650 A 58 ARG H A 58 ARG HGx 1.0 1.8 4.37 912 650 A 58 ARG H A 58 ARG HGy 1.0 1.8 4.37 913 651 A 59 ILE H A 58 ARG H 1.0 1.8 4.26 914 652 A 58 ARG HBx A 58 ARG HDx 1.0 1.8 3.90 915 652 A 58 ARG HBy A 58 ARG HDx 1.0 1.8 3.90 916 652 A 58 ARG HDy A 58 ARG HBx 1.0 1.8 3.90 917 652 A 58 ARG HBy A 58 ARG HDy 1.0 1.8 3.90 918 653 A 59 ILE H A 58 ARG HBx 1.0 1.8 3.75 919 653 A 59 ILE H A 58 ARG HBy 1.0 1.8 3.75 920 654 A 59 ILE HA A 58 ARG HGx 1.0 1.8 4.22 921 654 A 58 ARG HGy A 59 ILE HA 1.0 1.8 4.22 922 655 A 59 ILE H A 58 ARG HGx 1.0 1.8 4.01 923 655 A 59 ILE H A 58 ARG HGy 1.0 1.8 4.01 924 656 A 59 ILE HD1% A 59 ILE HA 1.0 1.8 4.00 925 657 A 59 ILE HG2% A 59 ILE HA 1.0 1.8 3.42 926 658 A 59 ILE HA A 60 PRO HDx 1.0 1.8 3.38 927 658 A 59 ILE HA A 60 PRO HDy 1.0 1.8 3.38 928 659 A 59 ILE HB A 59 ILE HD1% 1.0 1.8 3.64 929 660 A 59 ILE HB A 60 PRO HDx 1.0 1.8 5.17 930 660 A 59 ILE HB A 60 PRO HDy 1.0 1.8 5.17 931 661 A 59 ILE HB A 59 ILE H 1.0 1.8 4.01 932 662 A 59 ILE HD1% A 59 ILE H 1.0 1.8 4.24 933 663 A 59 ILE H A 60 PRO HDx 1.0 1.8 4.39 934 663 A 59 ILE H A 60 PRO HDy 1.0 1.8 4.39 935 664 A 59 ILE HD1% A 60 PRO HDx 1.0 1.8 4.80 936 664 A 59 ILE HD1% A 60 PRO HDy 1.0 1.8 4.80 937 665 A 65 GLY H A 59 ILE HD1% 1.0 1.8 5.73 938 666 A 59 ILE HD1% A 65 GLY HAy 1.0 1.8 3.93 939 666 A 65 GLY HAx A 59 ILE HD1% 1.0 1.8 3.93 940 667 A 66 LEU H A 59 ILE HD1% 1.0 1.8 5.36 941 668 A 59 ILE HG2% A 60 PRO HDx 1.0 1.8 3.57 942 668 A 59 ILE HG2% A 60 PRO HDy 1.0 1.8 3.57 943 669 A 59 ILE HG2% A 63 GLY H 1.0 1.8 4.32 944 670 A 64 THR HA A 59 ILE HG2% 1.0 1.8 3.96 945 671 A 59 ILE HG2% A 64 THR H 1.0 1.8 4.11 946 672 A 60 PRO HA A 61 VAL H 1.0 1.8 3.05 947 673 A 61 VAL H A 60 PRO HBy 1.0 1.8 3.58 948 673 A 60 PRO HBx A 61 VAL H 1.0 1.8 3.58 949 674 A 63 GLY H A 60 PRO HBy 1.0 1.8 5.50 950 674 A 63 GLY H A 60 PRO HBx 1.0 1.8 5.50 951 675 A 61 VAL H A 60 PRO HGx 1.0 1.8 4.73 952 675 A 61 VAL H A 60 PRO HGy 1.0 1.8 4.73 953 676 A 63 GLY H A 60 PRO HGx 1.0 1.8 4.63 954 676 A 63 GLY H A 60 PRO HGy 1.0 1.8 4.63 955 677 A 63 GLY HAx A 60 PRO HGx 1.0 1.8 5.53 956 677 A 60 PRO HGy A 63 GLY HAx 1.0 1.8 5.53 957 678 A 63 GLY HAy A 60 PRO HGx 1.0 1.8 4.23 958 678 A 60 PRO HGy A 63 GLY HAy 1.0 1.8 4.23 959 679 A 64 THR H A 60 PRO HGx 1.0 1.8 5.57 960 679 A 64 THR H A 60 PRO HGy 1.0 1.8 5.57 961 680 A 61 VAL HG1% A 61 VAL HA 1.0 1.8 3.24 962 681 A 61 VAL HA A 61 VAL HG2% 1.0 1.8 3.24 963 682 A 62 GLY H A 61 VAL HA 1.0 1.8 2.97 964 683 A 61 VAL HA A 62 GLY HAx 1.0 1.8 4.51 965 684 A 61 VAL HA A 62 GLY HAy 1.0 1.8 4.51 966 685 A 63 GLY H A 61 VAL HA 1.0 1.8 3.68 967 686 A 62 GLY H A 61 VAL HB 1.0 1.8 4.49 968 687 A 63 GLY H A 61 VAL HB 1.0 1.8 6.00 969 688 A 61 VAL H A 61 VAL HB 1.0 1.8 3.18 970 689 A 61 VAL H A 61 VAL HG2% 1.0 1.8 2.99 971 689 A 61 VAL HG1% A 61 VAL H 1.0 1.8 2.99 972 690 A 61 VAL HG1% A 62 GLY HAy 1.0 1.8 4.85 973 690 A 62 GLY HAx A 61 VAL HG2% 1.0 1.8 4.85 974 690 A 61 VAL HG1% A 62 GLY HAx 1.0 1.8 4.85 975 690 A 61 VAL HG2% A 62 GLY HAy 1.0 1.8 4.85 976 691 A 63 GLY H A 61 VAL HG2% 1.0 1.8 5.34 977 691 A 63 GLY H A 61 VAL HG1% 1.0 1.8 5.34 978 692 A 62 GLY H A 61 VAL HG1% 1.0 1.8 4.09 979 693 A 62 GLY H A 61 VAL HG2% 1.0 1.8 4.09 980 694 A 62 GLY H A 63 GLY H 1.0 1.8 3.46 981 695 A 64 THR H A 63 GLY HAx 1.0 1.8 3.25 982 696 A 64 THR H A 63 GLY HAy 1.0 1.8 3.19 983 697 A 64 THR HG2% A 64 THR HA 1.0 1.8 3.49 984 698 A 65 GLY H A 64 THR HA 1.0 1.8 3.24 985 699 A 64 THR HB A 65 GLY H 1.0 1.8 3.89 986 700 A 64 THR HB A 64 THR H 1.0 1.8 4.22 987 701 A 64 THR HG2% A 64 THR H 1.0 1.8 3.99 988 702 A 65 GLY H A 64 THR H 1.0 1.8 4.78 989 703 A 64 THR HG2% A 65 GLY H 1.0 1.8 4.07 990 704 A 65 GLY H A 66 LEU H 1.0 1.8 4.77 991 705 A 65 GLY H A 66 LEU HD2% 1.0 1.8 5.80 992 705 A 66 LEU HD1% A 65 GLY H 1.0 1.8 5.80 993 706 A 66 LEU H A 65 GLY HAy 1.0 1.8 2.97 994 706 A 65 GLY HAx A 66 LEU H 1.0 1.8 2.97 995 707 A 65 GLY HAx A 66 LEU H 1.0 1.8 3.44 996 708 A 66 LEU H A 65 GLY HAy 1.0 1.8 3.44 997 709 A 66 LEU HD1% A 66 LEU HA 1.0 1.8 4.06 998 710 A 66 LEU HA A 66 LEU HD2% 1.0 1.8 3.56 999 711 A 67 ALA H A 66 LEU HA 1.0 1.8 3.04 1000 712 A 66 LEU H A 66 LEU HBx 1.0 1.8 3.14 1001 712 A 66 LEU H A 66 LEU HBy 1.0 1.8 3.14 1002 713 A 66 LEU H A 66 LEU HD2% 1.0 1.8 4.36 1003 713 A 66 LEU HD1% A 66 LEU H 1.0 1.8 4.36 1004 714 A 67 ALA H A 66 LEU H 1.0 1.8 4.49 1005 715 A 66 LEU HD1% A 66 LEU HBy 1.0 1.8 2.93 1006 715 A 66 LEU HD1% A 66 LEU HBx 1.0 1.8 2.93 1007 716 A 66 LEU HBy A 66 LEU HD2% 1.0 1.8 2.93 1008 716 A 66 LEU HBx A 66 LEU HD2% 1.0 1.8 2.93 1009 717 A 67 ALA H A 66 LEU HBx 1.0 1.8 4.83 1010 717 A 67 ALA H A 66 LEU HBy 1.0 1.8 4.83 1011 718 A 67 ALA H A 66 LEU HD2% 1.0 1.8 3.63 1012 718 A 67 ALA H A 66 LEU HD1% 1.0 1.8 3.63 1013 719 A 68 ARG H A 67 ALA HA 1.0 1.8 3.05 1014 720 A 67 ALA H A 67 ALA HB% 1.0 1.8 3.30 1015 721 A 67 ALA H A 68 ARG H 1.0 1.8 4.77 1016 722 A 67 ALA HB% A 68 ARG H 1.0 1.8 3.62 1017 723 A 68 ARG HA A 68 ARG HDx 1.0 1.8 4.28 1018 723 A 68 ARG HA A 68 ARG HDy 1.0 1.8 4.28 1019 724 A 68 ARG HA A 68 ARG HGx 1.0 1.8 3.79 1020 724 A 68 ARG HA A 68 ARG HGy 1.0 1.8 3.79 1021 725 A 68 ARG HA A 69 VAL HB 1.0 1.8 6.00 1022 726 A 69 VAL H A 68 ARG HA 1.0 1.8 3.03 1023 727 A 68 ARG HA A 69 VAL HG1% 1.0 1.8 4.41 1024 727 A 68 ARG HA A 69 VAL HG2% 1.0 1.8 4.41 1025 728 A 68 ARG H A 68 ARG HDx 1.0 1.8 5.12 1026 728 A 68 ARG HDy A 68 ARG H 1.0 1.8 5.12 1027 729 A 68 ARG H A 68 ARG HGx 1.0 1.8 4.32 1028 729 A 68 ARG HGy A 68 ARG H 1.0 1.8 4.32 1029 730 A 69 VAL H A 68 ARG H 1.0 1.8 4.45 1030 731 A 68 ARG HBx A 68 ARG HDx 1.0 1.8 3.35 1031 731 A 68 ARG HBy A 68 ARG HDx 1.0 1.8 3.35 1032 731 A 68 ARG HDy A 68 ARG HBx 1.0 1.8 3.35 1033 731 A 68 ARG HDy A 68 ARG HBy 1.0 1.8 3.35 1034 732 A 69 VAL H A 68 ARG HDx 1.0 1.8 5.35 1035 732 A 69 VAL H A 68 ARG HDy 1.0 1.8 5.35 1036 733 A 69 VAL H A 68 ARG HGx 1.0 1.8 3.99 1037 733 A 69 VAL H A 68 ARG HGy 1.0 1.8 3.99 1038 734 A 70 GLN H A 68 ARG HGx 1.0 1.8 5.40 1039 734 A 70 GLN H A 68 ARG HGy 1.0 1.8 5.40 1040 735 A 70 GLN H A 69 VAL HA 1.0 1.8 2.95 1041 736 A 69 VAL H A 69 VAL HB 1.0 1.8 3.96 1042 737 A 69 VAL H A 69 VAL HG1% 1.0 1.8 3.38 1043 737 A 69 VAL H A 69 VAL HG2% 1.0 1.8 3.38 1044 738 A 69 VAL H A 70 GLN H 1.0 1.8 4.65 1045 739 A 70 GLN H A 69 VAL HG1% 1.0 1.8 4.01 1046 739 A 69 VAL HG2% A 70 GLN H 1.0 1.8 4.01 1047 740 A 71 TRP H A 70 GLN HA 1.0 1.8 3.08 1048 741 A 70 GLN H A 70 GLN HBx 1.0 1.8 3.19 1049 741 A 70 GLN H A 70 GLN HBy 1.0 1.8 3.19 1050 742 A 70 GLN H A 70 GLN HGx 1.0 1.8 3.43 1051 742 A 70 GLN H A 70 GLN HGy 1.0 1.8 3.43 1052 743 A 70 GLN H A 70 GLN HGx 1.0 1.8 4.07 1053 744 A 70 GLN H A 70 GLN HGy 1.0 1.8 4.07 1054 745 A 71 TRP H A 70 GLN H 1.0 1.8 4.91 1055 746 A 71 TRP H A 70 GLN HGx 1.0 1.8 4.66 1056 746 A 71 TRP H A 70 GLN HGy 1.0 1.8 4.66 1057 747 A 71 TRP HD1 A 71 TRP HA 1.0 1.8 3.49 1058 748 A 71 TRP HE1 A 71 TRP HA 1.0 1.8 5.41 1059 749 A 72 LYS H A 71 TRP HA 1.0 1.8 3.07 1060 750 A 71 TRP H A 71 TRP HBx 1.0 1.8 4.04 1061 751 A 71 TRP H A 71 TRP HBy 1.0 1.8 3.89 1062 752 A 71 TRP H A 72 LYS H 1.0 1.8 4.67 1063 753 A 72 LYS H A 71 TRP HBx 1.0 1.8 4.57 1064 754 A 71 TRP HBy A 71 TRP HE3 1.0 1.8 4.07 1065 755 A 72 LYS H A 71 TRP HBy 1.0 1.8 4.93 1066 756 A 72 LYS H A 71 TRP HD1 1.0 1.8 3.60 1067 757 A 71 TRP HE1 A 74 THR H 1.0 1.8 5.63 1068 758 A 71 TRP HE1 A 74 THR HG2% 1.0 1.8 3.89 1069 759 A 71 TRP HH2 A 73 ALA HA 1.0 1.8 4.74 1070 760 A 71 TRP HH2 A 74 THR H 1.0 1.8 4.35 1071 761 A 71 TRP HH2 A 86 VAL HG2% 1.0 1.8 3.94 1072 761 A 71 TRP HH2 A 86 VAL HG1% 1.0 1.8 3.94 1073 762 A 71 TRP HH2 A 86 VAL HG1% 1.0 1.8 4.88 1074 763 A 71 TRP HH2 A 86 VAL HG2% 1.0 1.8 4.88 1075 764 A 71 TRP HZ2 A 73 ALA HA 1.0 1.8 4.59 1076 765 A 71 TRP HZ2 A 74 THR H 1.0 1.8 3.76 1077 766 A 71 TRP HZ2 A 74 THR HG2% 1.0 1.8 3.67 1078 767 A 73 ALA H A 72 LYS HA 1.0 1.8 3.04 1079 768 A 72 LYS H A 72 LYS HBx 1.0 1.8 3.39 1080 768 A 72 LYS H A 72 LYS HBy 1.0 1.8 3.39 1081 769 A 72 LYS H A 72 LYS HGx 1.0 1.8 4.51 1082 769 A 72 LYS HGy A 72 LYS H 1.0 1.8 4.51 1083 770 A 72 LYS H A 73 ALA HA 1.0 1.8 6.00 1084 771 A 73 ALA H A 72 LYS H 1.0 1.8 4.59 1085 772 A 73 ALA H A 72 LYS HBx 1.0 1.8 4.16 1086 772 A 73 ALA H A 72 LYS HBy 1.0 1.8 4.16 1087 773 A 73 ALA H A 72 LYS HGx 1.0 1.8 4.37 1088 773 A 73 ALA H A 72 LYS HGy 1.0 1.8 4.37 1089 774 A 73 ALA H A 73 ALA HB% 1.0 1.8 3.55 1090 775 A 73 ALA H A 74 THR H 1.0 1.8 4.82 1091 776 A 73 ALA HB% A 74 THR H 1.0 1.8 3.51 1092 777 A 74 THR HA A 75 ARG H 1.0 1.8 3.56 1093 778 A 75 ARG H A 74 THR HB 1.0 1.8 4.53 1094 779 A 74 THR H A 74 THR HG2% 1.0 1.8 3.73 1095 780 A 74 THR H A 75 ARG H 1.0 1.8 4.89 1096 781 A 74 THR HG2% A 75 ARG H 1.0 1.8 4.49 1097 782 A 75 ARG H A 76 LYS H 1.0 1.8 4.65 1098 783 A 75 ARG H A 76 LYS HBx 1.0 1.8 5.23 1099 783 A 75 ARG H A 76 LYS HBy 1.0 1.8 5.23 1100 784 A 76 LYS HA A 76 LYS HGx 1.0 1.8 3.92 1101 784 A 76 LYS HA A 76 LYS HGy 1.0 1.8 3.92 1102 785 A 76 LYS HA A 77 LEU H 1.0 1.8 3.11 1103 786 A 76 LYS H A 76 LYS HBx 1.0 1.8 3.27 1104 786 A 76 LYS H A 76 LYS HBy 1.0 1.8 3.27 1105 787 A 76 LYS H A 76 LYS HEx 1.0 1.8 6.23 1106 787 A 76 LYS H A 76 LYS HEy 1.0 1.8 6.23 1107 788 A 76 LYS H A 76 LYS HGx 1.0 1.8 4.71 1108 788 A 76 LYS H A 76 LYS HGy 1.0 1.8 4.71 1109 789 A 76 LYS HBy A 76 LYS HEx 1.0 1.8 4.15 1110 789 A 76 LYS HBx A 76 LYS HEx 1.0 1.8 4.15 1111 789 A 76 LYS HEy A 76 LYS HBx 1.0 1.8 4.15 1112 789 A 76 LYS HBy A 76 LYS HEy 1.0 1.8 4.15 1113 790 A 76 LYS HDx A 76 LYS HEx 1.0 1.8 2.82 1114 790 A 76 LYS HEy A 76 LYS HDx 1.0 1.8 2.82 1115 790 A 76 LYS HEy A 76 LYS HDy 1.0 1.8 2.82 1116 790 A 76 LYS HDy A 76 LYS HEx 1.0 1.8 2.82 1117 791 A 76 LYS HEx A 76 LYS HGx 1.0 1.8 3.26 1118 791 A 76 LYS HEy A 76 LYS HGx 1.0 1.8 3.26 1119 791 A 76 LYS HGy A 76 LYS HEx 1.0 1.8 3.26 1120 791 A 76 LYS HGy A 76 LYS HEy 1.0 1.8 3.26 1121 792 A 77 LEU HA A 76 LYS HGx 1.0 1.8 5.46 1122 792 A 76 LYS HGy A 77 LEU HA 1.0 1.8 5.46 1123 793 A 77 LEU H A 76 LYS HGx 1.0 1.8 4.11 1124 793 A 76 LYS HGy A 77 LEU H 1.0 1.8 4.11 1125 794 A 77 LEU HA A 77 LEU HD1% 1.0 1.8 4.37 1126 795 A 77 LEU HA A 77 LEU HD2% 1.0 1.8 4.37 1127 796 A 77 LEU HA A 78 ALA H 1.0 1.8 3.38 1128 797 A 77 LEU H A 77 LEU HBx 1.0 1.8 3.43 1129 797 A 77 LEU H A 77 LEU HBy 1.0 1.8 3.43 1130 798 A 77 LEU H A 77 LEU HD2% 1.0 1.8 4.09 1131 798 A 77 LEU H A 77 LEU HD1% 1.0 1.8 4.09 1132 799 A 77 LEU H A 78 ALA H 1.0 1.8 4.31 1133 800 A 78 ALA H A 77 LEU HD1% 1.0 1.8 5.67 1134 801 A 78 ALA H A 77 LEU HD2% 1.0 1.8 5.67 1135 802 A 78 ALA H A 78 ALA HB% 1.0 1.8 3.58 1136 803 A 78 ALA HB% A 79 GLY H 1.0 1.8 4.56 1137 804 A 79 GLY H A 80 ARG H 1.0 1.8 4.90 1138 805 A 80 ARG HA A 80 ARG HGx 1.0 1.8 3.69 1139 805 A 80 ARG HA A 80 ARG HGy 1.0 1.8 3.69 1140 806 A 80 ARG H A 80 ARG HGx 1.0 1.8 4.48 1141 806 A 80 ARG H A 80 ARG HGy 1.0 1.8 4.48 1142 807 A 80 ARG H A 81 ALA H 1.0 1.8 4.45 1143 808 A 80 ARG H A 81 ALA HB% 1.0 1.8 6.00 1144 809 A 80 ARG HDy A 80 ARG HGx 1.0 1.8 3.01 1145 809 A 80 ARG HDx A 80 ARG HGx 1.0 1.8 3.01 1146 809 A 80 ARG HGy A 80 ARG HDx 1.0 1.8 3.01 1147 809 A 80 ARG HGy A 80 ARG HDy 1.0 1.8 3.01 1148 810 A 81 ALA H A 80 ARG HGx 1.0 1.8 4.89 1149 810 A 80 ARG HGy A 81 ALA H 1.0 1.8 4.89 1150 811 A 81 ALA H A 81 ALA HB% 1.0 1.8 3.81 1151 812 A 82 ALA H A 82 ALA HB% 1.0 1.8 3.38 1152 813 A 82 ALA HB% A 83 ASN H 1.0 1.8 3.71 1153 814 A 83 ASN HA A 84 PRO HDx 1.0 1.8 3.22 1154 814 A 83 ASN HA A 84 PRO HDy 1.0 1.8 3.22 1155 815 A 83 ASN H A 83 ASN HBx 1.0 1.8 3.62 1156 815 A 83 ASN H A 83 ASN HBy 1.0 1.8 3.62 1157 816 A 83 ASN H A 84 PRO HDx 1.0 1.8 4.53 1158 816 A 83 ASN H A 84 PRO HDy 1.0 1.8 4.53 1159 817 A 83 ASN HBy A 84 PRO HDx 1.0 1.8 3.92 1160 817 A 83 ASN HBx A 84 PRO HDx 1.0 1.8 3.92 1161 817 A 84 PRO HDy A 83 ASN HBx 1.0 1.8 3.92 1162 817 A 84 PRO HDy A 83 ASN HBy 1.0 1.8 3.92 1163 818 A 84 PRO HDy A 83 ASN HBx 1.0 1.8 4.46 1164 818 A 83 ASN HBx A 84 PRO HDx 1.0 1.8 4.46 1165 819 A 84 PRO HDy A 83 ASN HBy 1.0 1.8 4.46 1166 819 A 83 ASN HBy A 84 PRO HDx 1.0 1.8 4.46 1167 820 A 85 GLY H A 84 PRO HGx 1.0 1.8 4.59 1168 820 A 84 PRO HGy A 85 GLY H 1.0 1.8 4.59 1169 821 A 85 GLY H A 86 VAL H 1.0 1.8 4.73 1170 822 A 86 VAL HB A 85 GLY HAy 1.0 1.8 5.90 1171 822 A 85 GLY HAx A 86 VAL HB 1.0 1.8 5.90 1172 823 A 85 GLY HAx A 86 VAL HG2% 1.0 1.8 4.33 1173 823 A 85 GLY HAy A 86 VAL HG2% 1.0 1.8 4.33 1174 823 A 86 VAL HG1% A 85 GLY HAy 1.0 1.8 4.33 1175 823 A 86 VAL HG1% A 85 GLY HAx 1.0 1.8 4.33 1176 824 A 86 VAL H A 86 VAL HB 1.0 1.8 3.92 1177 825 A 86 VAL H A 86 VAL HG2% 1.0 1.8 3.66 1178 825 A 86 VAL HG1% A 86 VAL H 1.0 1.8 3.66 1179 826 A 86 VAL H A 111 ILE HG2% 1.0 1.8 4.60 1180 827 A 86 VAL H A 112 VAL H 1.0 1.8 5.02 1181 828 A 86 VAL H A 112 VAL HGy% 1.0 1.8 4.86 1182 828 A 86 VAL H A 112 VAL HGx% 1.0 1.8 4.86 1183 829 A 112 VAL H A 86 VAL HG2% 1.0 1.8 5.07 1184 829 A 86 VAL HG1% A 112 VAL H 1.0 1.8 5.07 1185 830 A 114 VAL H A 86 VAL HG2% 1.0 1.8 4.94 1186 830 A 86 VAL HG1% A 114 VAL H 1.0 1.8 4.94 1187 831 A 87 PRO HA A 88 VAL H 1.0 1.8 3.37 1188 832 A 87 PRO HA A 111 ILE HA 1.0 1.8 3.95 1189 833 A 87 PRO HA A 111 ILE HD1% 1.0 1.8 4.00 1190 834 A 111 ILE HG2% A 87 PRO HA 1.0 1.8 5.18 1191 835 A 112 VAL H A 87 PRO HA 1.0 1.8 4.72 1192 836 A 88 VAL H A 87 PRO HBx 1.0 1.8 4.11 1193 836 A 87 PRO HBy A 88 VAL H 1.0 1.8 4.11 1194 837 A 89 TYR HE% A 87 PRO HBx 1.0 1.8 3.65 1195 837 A 87 PRO HBy A 89 TYR HE% 1.0 1.8 3.65 1196 838 A 111 ILE HD1% A 87 PRO HBx 1.0 1.8 3.82 1197 838 A 87 PRO HBy A 111 ILE HD1% 1.0 1.8 3.82 1198 839 A 87 PRO HBy A 89 TYR HE% 1.0 1.8 4.25 1199 840 A 89 TYR HE% A 87 PRO HDy 1.0 1.8 5.25 1200 841 A 88 VAL H A 111 ILE HA 1.0 1.8 4.27 1201 842 A 88 VAL H A 111 ILE HD1% 1.0 1.8 4.84 1202 843 A 112 VAL H A 88 VAL H 1.0 1.8 5.69 1203 844 A 89 TYR HA A 89 TYR HD% 1.0 1.8 4.55 1204 845 A 89 TYR HA A 90 ALA H 1.0 1.8 3.10 1205 846 A 89 TYR HA A 90 ALA HB% 1.0 1.8 4.16 1206 847 A 89 TYR HA A 107 VAL HGy% 1.0 1.8 4.57 1207 847 A 89 TYR HA A 107 VAL HGx% 1.0 1.8 4.57 1208 848 A 89 TYR H A 89 TYR HBx 1.0 1.8 3.66 1209 848 A 89 TYR H A 89 TYR HBy 1.0 1.8 3.66 1210 849 A 89 TYR H A 89 TYR HD% 1.0 1.8 4.56 1211 850 A 90 ALA H A 89 TYR HBx 1.0 1.8 3.99 1212 850 A 90 ALA H A 89 TYR HBy 1.0 1.8 3.99 1213 851 A 89 TYR HBx A 107 VAL HGy% 1.0 1.8 4.26 1214 851 A 89 TYR HBy A 107 VAL HGy% 1.0 1.8 4.26 1215 851 A 107 VAL HGx% A 89 TYR HBx 1.0 1.8 4.26 1216 851 A 89 TYR HBy A 107 VAL HGx% 1.0 1.8 4.26 1217 852 A 90 ALA H A 89 TYR HD% 1.0 1.8 5.20 1218 853 A 89 TYR HD% A 107 VAL HGy% 1.0 1.8 3.32 1219 853 A 89 TYR HD% A 107 VAL HGx% 1.0 1.8 3.32 1220 854 A 89 TYR HE% A 107 VAL HGy% 1.0 1.8 4.08 1221 854 A 89 TYR HE% A 107 VAL HGx% 1.0 1.8 4.08 1222 855 A 89 TYR HE% A 109 SER HBx 1.0 1.8 4.01 1223 856 A 89 TYR HE% A 109 SER HBy 1.0 1.8 5.01 1224 857 A 90 ALA HA A 91 VAL H 1.0 1.8 3.13 1225 858 A 90 ALA H A 90 ALA HB% 1.0 1.8 3.43 1226 859 A 90 ALA H A 108 PHE H 1.0 1.8 3.87 1227 860 A 91 VAL H A 90 ALA HB% 1.0 1.8 3.91 1228 861 A 90 ALA HB% A 108 PHE HBx 1.0 1.8 5.11 1229 862 A 108 PHE HBy A 90 ALA HB% 1.0 1.8 4.61 1230 863 A 108 PHE HD% A 90 ALA HB% 1.0 1.8 4.16 1231 864 A 91 VAL HA A 92 VAL H 1.0 1.8 3.24 1232 865 A 91 VAL H A 91 VAL HB 1.0 1.8 3.69 1233 866 A 91 VAL H A 91 VAL HG1% 1.0 1.8 3.46 1234 866 A 91 VAL H A 91 VAL HG2% 1.0 1.8 3.46 1235 867 A 92 VAL HA A 91 VAL H 1.0 1.8 5.14 1236 868 A 91 VAL H A 92 VAL H 1.0 1.8 4.55 1237 869 A 92 VAL H A 91 VAL HG1% 1.0 1.8 3.45 1238 869 A 91 VAL HG2% A 92 VAL H 1.0 1.8 3.45 1239 870 A 92 VAL HA A 92 VAL HG1% 1.0 1.8 3.50 1240 871 A 92 VAL HA A 92 VAL HG2% 1.0 1.8 3.50 1241 872 A 92 VAL HA A 93 ASP H 1.0 1.8 3.46 1242 873 A 93 ASP H A 92 VAL HB 1.0 1.8 4.61 1243 874 A 92 VAL HB A 106 ASN HBx 1.0 1.8 4.49 1244 874 A 92 VAL HB A 106 ASN HBy 1.0 1.8 4.49 1245 875 A 92 VAL H A 92 VAL HB 1.0 1.8 3.76 1246 876 A 92 VAL HG1% A 92 VAL H 1.0 1.8 3.81 1247 877 A 92 VAL H A 92 VAL HG2% 1.0 1.8 3.81 1248 878 A 92 VAL H A 106 ASN HBx 1.0 1.8 4.82 1249 878 A 92 VAL H A 106 ASN HBy 1.0 1.8 4.82 1250 879 A 93 ASP H A 92 VAL HG2% 1.0 1.8 3.87 1251 879 A 93 ASP H A 92 VAL HG1% 1.0 1.8 3.87 1252 880 A 92 VAL HG2% A 93 ASP HBx 1.0 1.8 4.77 1253 880 A 92 VAL HG1% A 93 ASP HBx 1.0 1.8 4.77 1254 880 A 93 ASP HBy A 92 VAL HG2% 1.0 1.8 4.77 1255 880 A 92 VAL HG1% A 93 ASP HBy 1.0 1.8 4.77 1256 881 A 106 ASN H A 92 VAL HG2% 1.0 1.8 5.35 1257 881 A 92 VAL HG1% A 106 ASN H 1.0 1.8 5.35 1258 882 A 93 ASP HA A 94 PRO HDx 1.0 1.8 3.56 1259 882 A 93 ASP HA A 94 PRO HDy 1.0 1.8 3.56 1260 883 A 93 ASP H A 93 ASP HBx 1.0 1.8 4.05 1261 883 A 93 ASP H A 93 ASP HBy 1.0 1.8 4.05 1262 884 A 93 ASP H A 94 PRO HDx 1.0 1.8 4.54 1263 884 A 93 ASP H A 94 PRO HDy 1.0 1.8 4.54 1264 885 A 94 PRO HA A 96 ASN H 1.0 1.8 4.48 1265 886 A 95 ASP H A 94 PRO HDx 1.0 1.8 5.02 1266 886 A 94 PRO HDy A 95 ASP H 1.0 1.8 5.02 1267 887 A 95 ASP H A 94 PRO HGx 1.0 1.8 4.70 1268 887 A 95 ASP H A 94 PRO HGy 1.0 1.8 4.70 1269 888 A 95 ASP H A 95 ASP HBx 1.0 1.8 3.74 1270 889 A 95 ASP H A 95 ASP HBy 1.0 1.8 4.74 1271 890 A 96 ASN H A 95 ASP H 1.0 1.8 3.29 1272 891 A 95 ASP H A 97 ARG H 1.0 1.8 4.94 1273 892 A 96 ASN HA A 97 ARG HA 1.0 1.8 5.27 1274 893 A 96 ASN HA A 97 ARG HBx 1.0 1.8 4.93 1275 893 A 96 ASN HA A 97 ARG HBy 1.0 1.8 4.93 1276 894 A 96 ASN HA A 97 ARG HGx 1.0 1.8 4.15 1277 894 A 96 ASN HA A 97 ARG HGy 1.0 1.8 4.15 1278 895 A 96 ASN HA A 98 VAL H 1.0 1.8 5.06 1279 896 A 96 ASN H A 96 ASN HBx 1.0 1.8 3.92 1280 897 A 96 ASN H A 96 ASN HBy 1.0 1.8 4.92 1281 898 A 96 ASN H A 97 ARG H 1.0 1.8 3.90 1282 899 A 96 ASN H A 97 ARG HGx 1.0 1.8 4.98 1283 899 A 96 ASN H A 97 ARG HGy 1.0 1.8 4.98 1284 900 A 97 ARG HA A 97 ARG HDx 1.0 1.8 4.19 1285 900 A 97 ARG HA A 97 ARG HDy 1.0 1.8 4.19 1286 901 A 97 ARG HA A 97 ARG HGx 1.0 1.8 3.83 1287 901 A 97 ARG HA A 97 ARG HGy 1.0 1.8 3.83 1288 902 A 97 ARG HA A 98 VAL HB 1.0 1.8 5.82 1289 903 A 97 ARG HA A 98 VAL H 1.0 1.8 3.74 1290 904 A 97 ARG H A 97 ARG HBx 1.0 1.8 4.14 1291 904 A 97 ARG H A 97 ARG HBy 1.0 1.8 4.14 1292 905 A 98 VAL H A 97 ARG HBx 1.0 1.8 3.95 1293 905 A 97 ARG HBy A 98 VAL H 1.0 1.8 3.95 1294 906 A 98 VAL H A 97 ARG HGx 1.0 1.8 4.57 1295 906 A 97 ARG HGy A 98 VAL H 1.0 1.8 4.57 1296 907 A 98 VAL HA A 98 VAL HGx% 1.0 1.8 3.31 1297 908 A 98 VAL HA A 99 ALA H 1.0 1.8 3.75 1298 909 A 98 VAL HB A 99 ALA H 1.0 1.8 4.14 1299 910 A 98 VAL H A 98 VAL HB 1.0 1.8 3.45 1300 911 A 98 VAL H A 98 VAL HGx% 1.0 1.8 3.93 1301 912 A 98 VAL HGx% A 99 ALA HA 1.0 1.8 4.99 1302 913 A 98 VAL HGx% A 99 ALA H 1.0 1.8 3.75 1303 914 A 98 VAL HGx% A 100 GLU H 1.0 1.8 5.47 1304 915 A 99 ALA HA A 100 GLU H 1.0 1.8 3.41 1305 916 A 99 ALA H A 99 ALA HB% 1.0 1.8 3.06 1306 917 A 99 ALA H A 102 ASP HBx 1.0 1.8 4.84 1307 917 A 99 ALA H A 102 ASP HBy 1.0 1.8 4.84 1308 918 A 99 ALA HB% A 100 GLU HA 1.0 1.8 4.65 1309 919 A 100 GLU H A 99 ALA HB% 1.0 1.8 3.68 1310 920 A 99 ALA HB% A 102 ASP HBx 1.0 1.8 4.24 1311 920 A 99 ALA HB% A 102 ASP HBy 1.0 1.8 4.24 1312 921 A 100 GLU HA A 100 GLU HGx 1.0 1.8 3.56 1313 921 A 100 GLU HA A 100 GLU HGy 1.0 1.8 3.56 1314 922 A 100 GLU H A 100 GLU HBx 1.0 1.8 3.35 1315 922 A 100 GLU H A 100 GLU HBy 1.0 1.8 3.35 1316 923 A 100 GLU H A 100 GLU HGx 1.0 1.8 4.18 1317 923 A 100 GLU H A 100 GLU HGy 1.0 1.8 4.18 1318 924 A 100 GLU H A 101 SER H 1.0 1.8 3.92 1319 925 A 101 SER H A 100 GLU HBx 1.0 1.8 4.28 1320 925 A 100 GLU HBy A 101 SER H 1.0 1.8 4.28 1321 926 A 101 SER H A 100 GLU HGx 1.0 1.8 4.66 1322 926 A 100 GLU HGy A 101 SER H 1.0 1.8 4.66 1323 927 A 101 SER H A 101 SER HBx 1.0 1.8 3.68 1324 927 A 101 SER H A 101 SER HBy 1.0 1.8 3.68 1325 928 A 102 ASP H A 101 SER HBx 1.0 1.8 4.10 1326 928 A 101 SER HBy A 102 ASP H 1.0 1.8 4.10 1327 929 A 102 ASP H A 102 ASP HBx 1.0 1.8 3.41 1328 929 A 102 ASP HBy A 102 ASP H 1.0 1.8 3.41 1329 930 A 103 LYS H A 102 ASP HBx 1.0 1.8 4.22 1330 930 A 102 ASP HBy A 103 LYS H 1.0 1.8 4.22 1331 931 A 104 ALA H A 102 ASP HBx 1.0 1.8 5.23 1332 931 A 102 ASP HBy A 104 ALA H 1.0 1.8 5.23 1333 932 A 106 ASN H A 103 LYS HA 1.0 1.8 5.83 1334 933 A 103 LYS H A 103 LYS HDx 1.0 1.8 5.45 1335 933 A 103 LYS H A 103 LYS HDy 1.0 1.8 5.45 1336 934 A 103 LYS H A 103 LYS HEx 1.0 1.8 5.52 1337 934 A 103 LYS H A 103 LYS HEy 1.0 1.8 5.52 1338 935 A 104 ALA H A 103 LYS HBx 1.0 1.8 3.98 1339 935 A 104 ALA H A 103 LYS HBy 1.0 1.8 3.98 1340 936 A 104 ALA H A 103 LYS HDx 1.0 1.8 5.71 1341 936 A 104 ALA H A 103 LYS HDy 1.0 1.8 5.71 1342 937 A 104 ALA H A 104 ALA HB% 1.0 1.8 3.08 1343 938 A 104 ALA HB% A 105 ASN H 1.0 1.8 4.09 1344 939 A 104 ALA HB% A 107 VAL H 1.0 1.8 5.75 1345 940 A 105 ASN H A 107 VAL H 1.0 1.8 5.09 1346 941 A 107 VAL H A 106 ASN HA 1.0 1.8 3.50 1347 942 A 106 ASN H A 107 VAL HB 1.0 1.8 5.41 1348 943 A 106 ASN H A 107 VAL H 1.0 1.8 3.79 1349 944 A 106 ASN H A 107 VAL HGy% 1.0 1.8 4.99 1350 944 A 107 VAL HGx% A 106 ASN H 1.0 1.8 4.99 1351 945 A 107 VAL HA A 107 VAL HGy% 1.0 1.8 3.06 1352 945 A 107 VAL HGx% A 107 VAL HA 1.0 1.8 3.06 1353 946 A 107 VAL HGx% A 107 VAL HA 1.0 1.8 3.65 1354 947 A 107 VAL HA A 107 VAL HGy% 1.0 1.8 3.65 1355 948 A 108 PHE H A 107 VAL HA 1.0 1.8 3.30 1356 949 A 108 PHE H A 107 VAL HB 1.0 1.8 4.87 1357 950 A 107 VAL H A 107 VAL HB 1.0 1.8 3.54 1358 951 A 107 VAL H A 107 VAL HGy% 1.0 1.8 3.50 1359 951 A 107 VAL HGx% A 107 VAL H 1.0 1.8 3.50 1360 952 A 108 PHE H A 107 VAL H 1.0 1.8 4.47 1361 953 A 108 PHE H A 107 VAL HGy% 1.0 1.8 3.59 1362 953 A 107 VAL HGx% A 108 PHE H 1.0 1.8 3.59 1363 954 A 109 SER H A 107 VAL HGy% 1.0 1.8 5.11 1364 954 A 109 SER H A 107 VAL HGx% 1.0 1.8 5.11 1365 955 A 108 PHE HD% A 108 PHE HA 1.0 1.8 3.95 1366 956 A 109 SER H A 108 PHE HA 1.0 1.8 3.07 1367 957 A 109 SER H A 108 PHE H 1.0 1.8 4.67 1368 958 A 109 SER H A 108 PHE HBx 1.0 1.8 3.97 1369 959 A 108 PHE HBy A 109 SER H 1.0 1.8 3.97 1370 960 A 108 PHE HD% A 109 SER H 1.0 1.8 5.19 1371 961 A 109 SER HA A 110 ARG H 1.0 1.8 3.15 1372 962 A 109 SER HBx A 110 ARG H 1.0 1.8 4.33 1373 963 A 109 SER HBy A 110 ARG H 1.0 1.8 5.33 1374 964 A 110 ARG HA A 111 ILE H 1.0 1.8 3.07 1375 965 A 110 ARG H A 110 ARG HBx 1.0 1.8 4.00 1376 965 A 110 ARG H A 110 ARG HBy 1.0 1.8 4.00 1377 966 A 110 ARG H A 110 ARG HGx 1.0 1.8 4.24 1378 966 A 110 ARG H A 110 ARG HGy 1.0 1.8 4.24 1379 967 A 111 ILE HA A 110 ARG HDx 1.0 1.8 5.94 1380 967 A 110 ARG HDy A 111 ILE HA 1.0 1.8 5.94 1381 968 A 110 ARG HDx A 112 VAL HGy% 1.0 1.8 4.01 1382 968 A 110 ARG HDy A 112 VAL HGy% 1.0 1.8 4.01 1383 968 A 112 VAL HGx% A 110 ARG HDx 1.0 1.8 4.01 1384 968 A 110 ARG HDy A 112 VAL HGx% 1.0 1.8 4.01 1385 969 A 112 VAL HGx% A 110 ARG HDx 1.0 1.8 4.97 1386 969 A 110 ARG HDy A 112 VAL HGx% 1.0 1.8 4.97 1387 970 A 110 ARG HDx A 112 VAL HGy% 1.0 1.8 4.97 1388 970 A 110 ARG HDy A 112 VAL HGy% 1.0 1.8 4.97 1389 971 A 111 ILE HB A 110 ARG HGx 1.0 1.8 5.27 1390 971 A 110 ARG HGy A 111 ILE HB 1.0 1.8 5.27 1391 972 A 111 ILE H A 110 ARG HGx 1.0 1.8 3.49 1392 972 A 111 ILE H A 110 ARG HGy 1.0 1.8 3.49 1393 973 A 111 ILE HD1% A 110 ARG HGx 1.0 1.8 4.89 1394 973 A 111 ILE HD1% A 110 ARG HGy 1.0 1.8 4.89 1395 974 A 111 ILE HA A 111 ILE HD1% 1.0 1.8 3.62 1396 975 A 111 ILE HG2% A 111 ILE HA 1.0 1.8 3.57 1397 976 A 112 VAL H A 111 ILE HA 1.0 1.8 3.47 1398 977 A 111 ILE HD1% A 111 ILE HB 1.0 1.8 3.91 1399 978 A 111 ILE H A 111 ILE HB 1.0 1.8 3.16 1400 979 A 111 ILE HD1% A 111 ILE H 1.0 1.8 4.39 1401 980 A 111 ILE H A 111 ILE HG1x 1.0 1.8 3.88 1402 980 A 111 ILE H A 111 ILE HG1y 1.0 1.8 3.88 1403 981 A 112 VAL H A 111 ILE H 1.0 1.8 4.94 1404 982 A 112 VAL H A 111 ILE HD1% 1.0 1.8 4.64 1405 983 A 112 VAL H A 111 ILE HG1x 1.0 1.8 5.69 1406 983 A 112 VAL H A 111 ILE HG1y 1.0 1.8 5.69 1407 984 A 111 ILE HG2% A 111 ILE HG1x 1.0 1.8 3.67 1408 984 A 111 ILE HG2% A 111 ILE HG1y 1.0 1.8 3.67 1409 985 A 111 ILE HG2% A 112 VAL H 1.0 1.8 4.05 1410 986 A 111 ILE HG2% A 113 LYS H 1.0 1.8 5.14 1411 987 A 111 ILE HG2% A 113 LYS HEx 1.0 1.8 5.15 1412 987 A 111 ILE HG2% A 113 LYS HEy 1.0 1.8 5.15 1413 988 A 112 VAL HGx% A 112 VAL HA 1.0 1.8 3.30 1414 989 A 112 VAL HA A 112 VAL HGy% 1.0 1.8 3.30 1415 990 A 113 LYS H A 112 VAL HA 1.0 1.8 3.37 1416 991 A 113 LYS H A 112 VAL HB 1.0 1.8 4.85 1417 992 A 112 VAL H A 112 VAL HB 1.0 1.8 4.00 1418 993 A 112 VAL H A 112 VAL HGy% 1.0 1.8 3.64 1419 993 A 112 VAL H A 112 VAL HGx% 1.0 1.8 3.64 1420 994 A 112 VAL H A 112 VAL HGx% 1.0 1.8 4.21 1421 995 A 112 VAL H A 112 VAL HGy% 1.0 1.8 4.21 1422 996 A 113 LYS H A 112 VAL HGy% 1.0 1.8 3.86 1423 996 A 112 VAL HGx% A 113 LYS H 1.0 1.8 3.86 1424 997 A 114 VAL H A 113 LYS HA 1.0 1.8 3.19 1425 998 A 113 LYS H A 113 LYS HBx 1.0 1.8 3.58 1426 998 A 113 LYS H A 113 LYS HBy 1.0 1.8 3.58 1427 999 A 113 LYS H A 113 LYS HDx 1.0 1.8 5.31 1428 999 A 113 LYS H A 113 LYS HDy 1.0 1.8 5.31 1429 1000 A 114 VAL H A 113 LYS H 1.0 1.8 4.83 1430 1001 A 113 LYS HBy A 113 LYS HEx 1.0 1.8 4.23 1431 1001 A 113 LYS HBx A 113 LYS HEx 1.0 1.8 4.23 1432 1001 A 113 LYS HEy A 113 LYS HBx 1.0 1.8 4.23 1433 1001 A 113 LYS HEy A 113 LYS HBy 1.0 1.8 4.23 1434 1002 A 114 VAL HA A 113 LYS HBx 1.0 1.8 4.68 1435 1002 A 114 VAL HA A 113 LYS HBy 1.0 1.8 4.68 1436 1003 A 114 VAL H A 113 LYS HBx 1.0 1.8 3.97 1437 1003 A 114 VAL H A 113 LYS HBy 1.0 1.8 3.97 1438 1004 A 114 VAL HA A 115 LEU H 1.0 1.8 3.29 1439 1005 A 114 VAL HB A 114 VAL H 1.0 1.8 3.98 1440 1006 A 114 VAL H A 114 VAL HGy% 1.0 1.8 3.48 1441 1006 A 114 VAL HGx% A 114 VAL H 1.0 1.8 3.48 1442 1007 A 114 VAL HGx% A 114 VAL H 1.0 1.8 4.44 1443 1008 A 114 VAL H A 114 VAL HGy% 1.0 1.8 4.44 1444 1009 A 115 LEU H A 114 VAL HGy% 1.0 1.8 4.49 1445 1009 A 114 VAL HGx% A 115 LEU H 1.0 1.8 4.49 1446 1010 A 115 LEU HA A 115 LEU HD1% 1.0 1.8 3.60 1447 1010 A 115 LEU HA A 115 LEU HD2% 1.0 1.8 3.60 1448 1011 A 116 GLU H A 115 LEU HA 1.0 1.8 3.42 1449 1012 A 115 LEU H A 115 LEU HG 1.0 1.8 5.13 1450 1013 A 115 LEU HBx A 115 LEU H 1.0 1.8 3.93 1451 1014 A 115 LEU H A 115 LEU HBy 1.0 1.8 4.93 1452 1015 A 115 LEU H A 115 LEU HD1% 1.0 1.8 5.07 1453 1015 A 115 LEU H A 115 LEU HD2% 1.0 1.8 5.07 1454 1016 A 115 LEU HBx A 116 GLU H 1.0 1.8 4.21 1455 1017 A 116 GLU H A 115 LEU HBy 1.0 1.8 5.21 1456 1018 A 116 GLU H A 115 LEU HD1% 1.0 1.8 4.13 1457 1018 A 116 GLU H A 115 LEU HD2% 1.0 1.8 4.13 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 ASP C A 3 LEU N A 3 LEU CA A 3 LEU C 1.0 -122.6 -39.4 PHI 2 2 A 3 LEU N A 3 LEU CA A 3 LEU C A 4 PRO N 1.0 114.0 169.0 PSI 3 3 A 4 PRO C A 5 ILE N A 5 ILE CA A 5 ILE C 1.0 -224.2 21.4 PHI 4 4 A 5 ILE N A 5 ILE CA A 5 ILE C A 6 THR N 1.0 117.8 194.6 PSI 5 5 A 5 ILE C A 6 THR N A 6 THR CA A 6 THR C 1.0 -188.0 -79.4 PHI 6 6 A 6 THR N A 6 THR CA A 6 THR C A 7 LEU N 1.0 124.0 201.4 PSI 7 7 A 6 THR C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -137.2 -70.4 PHI 8 8 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 SER N 1.0 147.4 182.6 PSI 9 9 A 8 SER C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -142.0 -57.4 PHI 10 10 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 GLU N 1.0 -43.1 46.9 PSI 11 11 A 9 LYS C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -109.0 -54.0 PHI 12 12 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 THR N 1.0 -58.2 13.8 PSI 13 13 A 10 GLU C A 11 THR N A 11 THR CA A 11 THR C 1.0 -171.7 -65.9 PHI 14 14 A 11 THR N A 11 THR CA A 11 THR C A 12 PRO N 1.0 82.2 212.2 PSI 15 15 A 13 PHE C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -65.2 -45.2 PHI 16 16 A 14 GLU N A 14 GLU CA A 14 GLU C A 15 GLY N 1.0 118.3 145.1 PSI 17 17 A 14 GLU C A 15 GLY N A 15 GLY CA A 15 GLY C 1.0 63.7 117.3 PHI 18 18 A 15 GLY N A 15 GLY CA A 15 GLY C A 16 GLU N 1.0 -36.0 16.0 PSI 19 19 A 15 GLY C A 16 GLU N A 16 GLU CA A 16 GLU C 1.0 -94.2 -54.2 PHI 20 20 A 16 GLU N A 16 GLU CA A 16 GLU C A 17 GLU N 1.0 125.4 157.0 PSI 21 21 A 16 GLU C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -133.0 -63.8 PHI 22 22 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 ILE N 1.0 107.7 145.7 PSI 23 23 A 17 GLU C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -168.5 -101.7 PHI 24 24 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 THR N 1.0 144.9 175.9 PSI 25 25 A 18 ILE C A 19 THR N A 19 THR CA A 19 THR C 1.0 -171.4 -64.2 PHI 26 26 A 19 THR N A 19 THR CA A 19 THR C A 20 VAL N 1.0 111.1 142.5 PSI 27 27 A 19 THR C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -138.0 -86.0 PHI 28 28 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 SER N 1.0 102.0 147.0 PSI 29 29 A 20 VAL C A 21 SER N A 21 SER CA A 21 SER C 1.0 -147.2 -98.0 PHI 30 30 A 21 SER N A 21 SER CA A 21 SER C A 22 ALA N 1.0 107.8 142.0 PSI 31 31 A 21 SER C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -165.9 -80.3 PHI 32 32 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 ARG N 1.0 94.3 167.3 PSI 33 33 A 22 ALA C A 23 ARG N A 23 ARG CA A 23 ARG C 1.0 -141.1 -68.9 PHI 34 34 A 23 ARG N A 23 ARG CA A 23 ARG C A 24 VAL N 1.0 114.3 140.5 PSI 35 35 A 23 ARG C A 24 VAL N A 24 VAL CA A 24 VAL C 1.0 -130.5 -82.7 PHI 36 36 A 24 VAL N A 24 VAL CA A 24 VAL C A 25 THR N 1.0 94.4 146.4 PSI 37 37 A 24 VAL C A 25 THR N A 25 THR CA A 25 THR C 1.0 -135.4 -88.4 PHI 38 38 A 25 THR N A 25 THR CA A 25 THR C A 26 ASN N 1.0 114.6 154.0 PSI 39 39 A 25 THR C A 26 ASN N A 26 ASN CA A 26 ASN C 1.0 -125.9 -59.1 PHI 40 40 A 26 ASN N A 26 ASN CA A 26 ASN C A 27 ARG N 1.0 82.9 157.5 PSI 41 41 A 26 ASN C A 27 ARG N A 27 ARG CA A 27 ARG C 1.0 -140.2 -48.4 PHI 42 42 A 27 ARG N A 27 ARG CA A 27 ARG C A 28 GLY N 1.0 77.1 206.1 PSI 43 43 A 29 ALA C A 30 ALA N A 30 ALA CA A 30 ALA C 1.0 -180.3 -46.7 PHI 44 44 A 30 ALA N A 30 ALA CA A 30 ALA C A 31 GLU N 1.0 116.6 171.2 PSI 45 45 A 30 ALA C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -140.0 -41.0 PHI 46 46 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 ALA N 1.0 106.9 147.3 PSI 47 47 A 31 GLU C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -143.3 -66.3 PHI 48 48 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 HIS N 1.0 108.9 152.9 PSI 49 49 A 32 ALA C A 33 HIS N A 33 HIS CA A 33 HIS C 1.0 -170.3 -62.1 PHI 50 50 A 33 HIS N A 33 HIS CA A 33 HIS C A 34 ASN N 1.0 110.1 177.7 PSI 51 51 A 34 ASN C A 35 VAL N A 35 VAL CA A 35 VAL C 1.0 -150.9 -57.1 PHI 52 52 A 35 VAL N A 35 VAL CA A 35 VAL C A 36 PRO N 1.0 86.7 158.7 PSI 53 53 A 36 PRO C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -173.9 -70.7 PHI 54 54 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 ALA N 1.0 132.5 169.9 PSI 55 55 A 37 VAL C A 38 ALA N A 38 ALA CA A 38 ALA C 1.0 -155.2 -93.0 PHI 56 56 A 38 ALA N A 38 ALA CA A 38 ALA C A 39 VAL N 1.0 118.2 160.4 PSI 57 57 A 38 ALA C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -155.2 -81.2 PHI 58 58 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 TYR N 1.0 115.4 151.6 PSI 59 59 A 39 VAL C A 40 TYR N A 40 TYR CA A 40 TYR C 1.0 -151.9 -101.5 PHI 60 60 A 40 TYR N A 40 TYR CA A 40 TYR C A 41 LEU N 1.0 125.4 174.0 PSI 61 61 A 40 TYR C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -140.4 -77.2 PHI 62 62 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 GLY N 1.0 106.8 143.4 PSI 63 63 A 41 LEU C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 -239.6 -31.8 PHI 64 64 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 ASN N 1.0 123.2 203.2 PSI 65 65 A 42 GLY C A 43 ASN N A 43 ASN CA A 43 ASN C 1.0 -221.4 24.6 PHI 66 66 A 43 ASN N A 43 ASN CA A 43 ASN C A 44 PRO N 1.0 48.1 217.5 PSI 67 67 A 44 PRO C A 45 ALA N A 45 ALA CA A 45 ALA C 1.0 -116.7 -45.3 PHI 68 68 A 45 ALA N A 45 ALA CA A 45 ALA C A 46 GLN N 1.0 -45.9 26.1 PSI 69 69 A 48 GLY C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -166.6 -63.6 PHI 70 70 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 GLU N 1.0 115.5 166.5 PSI 71 71 A 49 VAL C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -92.6 -59.2 PHI 72 72 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 ILE N 1.0 106.1 143.7 PSI 73 73 A 50 GLU C A 51 ILE N A 51 ILE CA A 51 ILE C 1.0 -109.0 -71.0 PHI 74 74 A 51 ILE N A 51 ILE CA A 51 ILE C A 52 GLY N 1.0 -58.0 -18.8 PSI 75 75 A 51 ILE C A 52 GLY N A 52 GLY CA A 52 GLY C 1.0 -225.7 -119.9 PHI 76 76 A 52 GLY N A 52 GLY CA A 52 GLY C A 53 ARG N 1.0 140.4 194.0 PSI 77 77 A 52 GLY C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 -170.4 -121.2 PHI 78 78 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 ASP N 1.0 139.8 168.6 PSI 79 79 A 53 ARG C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -177.2 -108.4 PHI 80 80 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 THR N 1.0 116.2 161.6 PSI 81 81 A 54 ASP C A 55 THR N A 55 THR CA A 55 THR C 1.0 -143.9 -77.7 PHI 82 82 A 55 THR N A 55 THR CA A 55 THR C A 56 ILE N 1.0 107.5 144.9 PSI 83 83 A 55 THR C A 56 ILE N A 56 ILE CA A 56 ILE C 1.0 -108.8 -50.6 PHI 84 84 A 56 ILE N A 56 ILE CA A 56 ILE C A 57 SER N 1.0 79.2 178.2 PSI 85 85 A 56 ILE C A 57 SER N A 57 SER CA A 57 SER C 1.0 -105.0 -51.6 PHI 86 86 A 57 SER N A 57 SER CA A 57 SER C A 58 ARG N 1.0 -48.8 -27.2 PSI 87 87 A 58 ARG C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -174.5 -69.9 PHI 88 88 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 PRO N 1.0 70.2 190.6 PSI 89 89 A 60 PRO C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -68.8 -43.4 PHI 90 90 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 GLY N 1.0 122.5 142.5 PSI 91 91 A 61 VAL C A 62 GLY N A 62 GLY CA A 62 GLY C 1.0 66.1 114.9 PHI 92 92 A 62 GLY N A 62 GLY CA A 62 GLY C A 63 GLY N 1.0 -42.5 17.9 PSI 93 93 A 62 GLY C A 63 GLY N A 63 GLY CA A 63 GLY C 1.0 -160.1 -38.9 PHI 94 94 A 63 GLY N A 63 GLY CA A 63 GLY C A 64 THR N 1.0 94.6 203.6 PSI 95 95 A 63 GLY C A 64 THR N A 64 THR CA A 64 THR C 1.0 -182.0 -95.0 PHI 96 96 A 64 THR N A 64 THR CA A 64 THR C A 65 GLY N 1.0 118.9 182.1 PSI 97 97 A 64 THR C A 65 GLY N A 65 GLY CA A 65 GLY C 1.0 -278.7 -42.5 PHI 98 98 A 65 GLY N A 65 GLY CA A 65 GLY C A 66 LEU N 1.0 128.6 212.4 PSI 99 99 A 65 GLY C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -156.3 -82.7 PHI 100 100 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 ALA N 1.0 110.0 159.0 PSI 101 101 A 66 LEU C A 67 ALA N A 67 ALA CA A 67 ALA C 1.0 -140.9 -102.3 PHI 102 102 A 67 ALA N A 67 ALA CA A 67 ALA C A 68 ARG N 1.0 104.7 155.1 PSI 103 103 A 67 ALA C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -157.9 -100.1 PHI 104 104 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 VAL N 1.0 112.0 179.2 PSI 105 105 A 68 ARG C A 69 VAL N A 69 VAL CA A 69 VAL C 1.0 -155.8 -103.8 PHI 106 106 A 69 VAL N A 69 VAL CA A 69 VAL C A 70 GLN N 1.0 123.3 180.7 PSI 107 107 A 69 VAL C A 70 GLN N A 70 GLN CA A 70 GLN C 1.0 -131.8 -67.0 PHI 108 108 A 70 GLN N A 70 GLN CA A 70 GLN C A 71 TRP N 1.0 116.1 158.5 PSI 109 109 A 70 GLN C A 71 TRP N A 71 TRP CA A 71 TRP C 1.0 -152.2 -93.6 PHI 110 110 A 71 TRP N A 71 TRP CA A 71 TRP C A 72 LYS N 1.0 110.3 142.9 PSI 111 111 A 71 TRP C A 72 LYS N A 72 LYS CA A 72 LYS C 1.0 -148.4 -72.8 PHI 112 112 A 72 LYS N A 72 LYS CA A 72 LYS C A 73 ALA N 1.0 103.7 123.7 PSI 113 113 A 72 LYS C A 73 ALA N A 73 ALA CA A 73 ALA C 1.0 -139.4 -73.0 PHI 114 114 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 THR N 1.0 97.0 148.6 PSI 115 115 A 73 ALA C A 74 THR N A 74 THR CA A 74 THR C 1.0 -184.2 -106.6 PHI 116 116 A 74 THR N A 74 THR CA A 74 THR C A 75 ARG N 1.0 123.1 200.3 PSI 117 117 A 75 ARG C A 76 LYS N A 76 LYS CA A 76 LYS C 1.0 -234.4 20.4 PHI 118 118 A 76 LYS N A 76 LYS CA A 76 LYS C A 77 LEU N 1.0 80.1 189.5 PSI 119 119 A 84 PRO C A 85 GLY N A 85 GLY CA A 85 GLY C 1.0 50.7 107.7 PHI 120 120 A 85 GLY N A 85 GLY CA A 85 GLY C A 86 VAL N 1.0 -56.1 77.9 PSI 121 121 A 85 GLY C A 86 VAL N A 86 VAL CA A 86 VAL C 1.0 -149.9 -76.5 PHI 122 122 A 86 VAL N A 86 VAL CA A 86 VAL C A 87 PRO N 1.0 67.4 176.0 PSI 123 123 A 87 PRO C A 88 VAL N A 88 VAL CA A 88 VAL C 1.0 -158.8 -66.0 PHI 124 124 A 88 VAL N A 88 VAL CA A 88 VAL C A 89 TYR N 1.0 104.5 159.1 PSI 125 125 A 88 VAL C A 89 TYR N A 89 TYR CA A 89 TYR C 1.0 -155.8 -108.4 PHI 126 126 A 89 TYR N A 89 TYR CA A 89 TYR C A 90 ALA N 1.0 125.7 180.5 PSI 127 127 A 89 TYR C A 90 ALA N A 90 ALA CA A 90 ALA C 1.0 -168.7 -90.9 PHI 128 128 A 90 ALA N A 90 ALA CA A 90 ALA C A 91 VAL N 1.0 121.9 168.9 PSI 129 129 A 90 ALA C A 91 VAL N A 91 VAL CA A 91 VAL C 1.0 -140.4 -120.4 PHI 130 130 A 91 VAL N A 91 VAL CA A 91 VAL C A 92 VAL N 1.0 117.5 157.3 PSI 131 131 A 91 VAL C A 92 VAL N A 92 VAL CA A 92 VAL C 1.0 -109.9 -47.1 PHI 132 132 A 92 VAL N A 92 VAL CA A 92 VAL C A 93 ASP N 1.0 108.1 156.3 PSI 133 133 A 92 VAL C A 93 ASP N A 93 ASP CA A 93 ASP C 1.0 -141.3 -21.3 PHI 134 134 A 93 ASP N A 93 ASP CA A 93 ASP C A 94 PRO N 1.0 84.2 178.2 PSI 135 135 A 94 PRO C A 95 ASP N A 95 ASP CA A 95 ASP C 1.0 -108.9 -48.9 PHI 136 136 A 95 ASP N A 95 ASP CA A 95 ASP C A 96 ASN N 1.0 -40.9 20.5 PSI 137 137 A 99 ALA C A 100 GLU N A 100 GLU CA A 100 GLU C 1.0 -98.9 -38.5 PHI 138 138 A 100 GLU N A 100 GLU CA A 100 GLU C A 101 SER N 1.0 -81.8 15.8 PSI 139 139 A 100 GLU C A 101 SER N A 101 SER CA A 101 SER C 1.0 -89.0 -47.8 PHI 140 140 A 101 SER N A 101 SER CA A 101 SER C A 102 ASP N 1.0 -67.6 -7.6 PSI 141 141 A 101 SER C A 102 ASP N A 102 ASP CA A 102 ASP C 1.0 -91.3 -49.9 PHI 142 142 A 102 ASP N A 102 ASP CA A 102 ASP C A 103 LYS N 1.0 -71.0 13.4 PSI 143 143 A 102 ASP C A 103 LYS N A 103 LYS CA A 103 LYS C 1.0 -92.5 -44.3 PHI 144 144 A 103 LYS N A 103 LYS CA A 103 LYS C A 104 ALA N 1.0 -81.1 13.1 PSI 145 145 A 103 LYS C A 104 ALA N A 104 ALA CA A 104 ALA C 1.0 -101.2 -45.0 PHI 146 146 A 104 ALA N A 104 ALA CA A 104 ALA C A 105 ASN N 1.0 -85.1 32.1 PSI 147 147 A 104 ALA C A 105 ASN N A 105 ASN CA A 105 ASN C 1.0 -131.4 -54.0 PHI 148 148 A 105 ASN N A 105 ASN CA A 105 ASN C A 106 ASN N 1.0 -62.3 37.7 PSI 149 149 A 106 ASN C A 107 VAL N A 107 VAL CA A 107 VAL C 1.0 -168.1 -83.5 PHI 150 150 A 107 VAL N A 107 VAL CA A 107 VAL C A 108 PHE N 1.0 106.2 172.4 PSI 151 151 A 107 VAL C A 108 PHE N A 108 PHE CA A 108 PHE C 1.0 -163.6 -88.2 PHI 152 152 A 108 PHE N A 108 PHE CA A 108 PHE C A 109 SER N 1.0 130.8 184.2 PSI 153 153 A 108 PHE C A 109 SER N A 109 SER CA A 109 SER C 1.0 -181.3 -72.3 PHI 154 154 A 109 SER N A 109 SER CA A 109 SER C A 110 ARG N 1.0 131.7 182.1 PSI 155 155 A 109 SER C A 110 ARG N A 110 ARG CA A 110 ARG C 1.0 -169.7 -116.9 PHI 156 156 A 110 ARG N A 110 ARG CA A 110 ARG C A 111 ILE N 1.0 124.2 168.0 PSI 157 157 A 110 ARG C A 111 ILE N A 111 ILE CA A 111 ILE C 1.0 -109.9 -82.7 PHI 158 158 A 111 ILE N A 111 ILE CA A 111 ILE C A 112 VAL N 1.0 88.7 146.5 PSI 159 159 A 111 ILE C A 112 VAL N A 112 VAL CA A 112 VAL C 1.0 -147.6 -75.8 PHI 160 160 A 112 VAL N A 112 VAL CA A 112 VAL C A 113 LYS N 1.0 103.2 143.0 PSI 161 161 A 112 VAL C A 113 LYS N A 113 LYS CA A 113 LYS C 1.0 -139.7 -83.7 PHI 162 162 A 113 LYS N A 113 LYS CA A 113 LYS C A 114 VAL N 1.0 103.5 160.1 PSI 163 163 A 113 LYS C A 114 VAL N A 114 VAL CA A 114 VAL C 1.0 -127.7 -91.1 PHI 164 164 A 114 VAL N A 114 VAL CA A 114 VAL C A 115 LEU N 1.0 94.9 135.5 PSI 165 165 A 114 VAL C A 115 LEU N A 115 LEU CA A 115 LEU C 1.0 -150.0 -40.6 PHI 166 166 A 115 LEU N A 115 LEU CA A 115 LEU C A 116 GLU N 1.0 117.0 179.2 PSI stop_ save_