data_nef_c16731_2kuc save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code TargetDB NYSGXRC-11211c stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -2 MET start . . 2 A -1 SER middle . . 3 A 0 LEU middle . . 4 A 1 ALA middle . . 5 A 2 GLN middle . . 6 A 3 ALA middle . . 7 A 4 ASP middle . . 8 A 5 GLY middle . false 9 A 6 ILE middle . . 10 A 7 ALA middle . . 11 A 8 PHE middle . . 12 A 9 ARG middle . . 13 A 10 GLU middle . . 14 A 11 LEU middle . . 15 A 12 SER middle . . 16 A 13 PHE middle . . 17 A 14 PRO middle . false 18 A 15 GLU middle . . 19 A 16 ALA middle . . 20 A 17 LEU middle . . 21 A 18 LYS middle . . 22 A 19 ARG middle . . 23 A 20 ALA middle . . 24 A 21 GLU middle . . 25 A 22 VAL middle . . 26 A 23 GLU middle . . 27 A 24 ASP middle . . 28 A 25 LYS middle . . 29 A 26 LEU middle . . 30 A 27 LEU middle . . 31 A 28 PHE middle . . 32 A 29 VAL middle . . 33 A 30 ASP middle . . 34 A 31 CYS middle . . 35 A 32 PHE middle . . 36 A 33 THR middle . . 37 A 34 THR middle . . 38 A 35 TRP middle . . 39 A 36 CYS middle . . 40 A 37 GLY middle . false 41 A 38 PRO middle . false 42 A 39 CYS middle . . 43 A 40 LYS middle . . 44 A 41 ARG middle . . 45 A 42 LEU middle . . 46 A 43 SER middle . . 47 A 44 LYS middle . . 48 A 45 VAL middle . . 49 A 46 VAL middle . . 50 A 47 PHE middle . . 51 A 48 LYS middle . . 52 A 49 ASP middle . . 53 A 50 SER middle . . 54 A 51 LEU middle . . 55 A 52 VAL middle . . 56 A 53 ALA middle . . 57 A 54 ASP middle . . 58 A 55 TYR middle . . 59 A 56 PHE middle . . 60 A 57 ASN middle . . 61 A 58 ARG middle . . 62 A 59 HIS middle . . 63 A 60 PHE middle . . 64 A 61 VAL middle . . 65 A 62 ASN middle . . 66 A 63 LEU middle . . 67 A 64 LYS middle . . 68 A 65 MET middle . . 69 A 66 ASP middle . . 70 A 67 MET middle . . 71 A 68 GLU middle . . 72 A 69 LYS middle . . 73 A 70 GLY middle . false 74 A 71 GLU middle . . 75 A 72 GLY middle . false 76 A 73 VAL middle . . 77 A 74 GLU middle . . 78 A 75 LEU middle . . 79 A 76 ARG middle . . 80 A 77 LYS middle . . 81 A 78 LYS middle . . 82 A 79 TYR middle . . 83 A 80 GLY middle . false 84 A 81 VAL middle . . 85 A 82 HIS middle . . 86 A 83 ALA middle . . 87 A 84 TYR middle . . 88 A 85 PRO middle . false 89 A 86 THR middle . . 90 A 87 LEU middle . . 91 A 88 LEU middle . . 92 A 89 PHE middle . . 93 A 90 ILE middle . . 94 A 91 ASN middle . . 95 A 92 SER middle . . 96 A 93 SER middle . . 97 A 94 GLY middle . false 98 A 95 GLU middle . . 99 A 96 VAL middle . . 100 A 97 VAL middle . . 101 A 98 TYR middle . . 102 A 99 ARG middle . . 103 A 100 LEU middle . . 104 A 101 VAL middle . . 105 A 102 GLY middle . false 106 A 103 ALA middle . . 107 A 104 GLU middle . . 108 A 105 ASP middle . . 109 A 106 ALA middle . . 110 A 107 PRO middle . false 111 A 108 GLU middle . . 112 A 109 LEU middle . . 113 A 110 LEU middle . . 114 A 111 LYS middle . . 115 A 112 LYS middle . . 116 A 113 VAL middle . . 117 A 114 LYS middle . . 118 A 115 LEU middle . . 119 A 116 GLY middle . false 120 A 117 VAL middle . . 121 A 118 GLU middle . . 122 A 119 SER middle . . 123 A 120 GLU middle . . 124 A 121 GLY middle . false 125 A 122 HIS middle . . 126 A 123 HIS middle . . 127 A 124 HIS middle . . 128 A 125 HIS middle . . 129 A 126 HIS middle . . 130 A 127 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 ALA H H 1 8.385 0.003 A 1 ALA HA H 1 4.344 0.003 A 1 ALA HB% H 1 1.416 0.000 A 1 ALA C C 13 177.695 0.023 A 1 ALA CA C 13 52.678 0.112 A 1 ALA CB C 13 19.280 0.130 A 1 ALA N N 15 124.999 0.017 A 2 GLN H H 1 8.306 0.005 A 2 GLN HA H 1 4.363 0.004 A 2 GLN HBy H 1 2.151 0.000 A 2 GLN HBx H 1 2.038 0.000 A 2 GLN HE21 H 1 7.623 0.008 A 2 GLN HE22 H 1 6.897 0.009 A 2 GLN HG2 H 1 2.407 0.000 A 2 GLN HG3 H 1 2.407 0.000 A 2 GLN C C 13 175.696 0.022 A 2 GLN CA C 13 55.814 0.080 A 2 GLN CB C 13 29.739 0.122 A 2 GLN CG C 13 33.851 0.000 A 2 GLN N N 15 119.832 0.042 A 2 GLN NE2 N 15 112.715 0.024 A 3 ALA H H 1 8.361 0.006 A 3 ALA HA H 1 4.400 0.004 A 3 ALA HB% H 1 1.438 0.008 A 3 ALA C C 13 177.119 0.009 A 3 ALA CA C 13 52.607 0.098 A 3 ALA CB C 13 19.719 0.123 A 3 ALA N N 15 125.721 0.028 A 4 ASP H H 1 8.377 0.004 A 4 ASP HA H 1 4.723 0.005 A 4 ASP HBy H 1 2.737 0.011 A 4 ASP HBx H 1 2.669 0.006 A 4 ASP C C 13 176.179 0.009 A 4 ASP CA C 13 54.059 0.107 A 4 ASP CB C 13 41.577 0.099 A 4 ASP N N 15 120.364 0.036 A 5 GLY H H 1 8.160 0.006 A 5 GLY HAx H 1 3.899 0.011 A 5 GLY HAy H 1 4.323 0.004 A 5 GLY C C 13 174.427 0.017 A 5 GLY CA C 13 45.490 0.055 A 5 GLY N N 15 107.100 0.033 A 6 ILE H H 1 7.604 0.002 A 6 ILE HA H 1 3.604 0.009 A 6 ILE HB H 1 1.056 0.005 A 6 ILE HD1% H 1 -0.370 0.004 A 6 ILE HG1y H 1 1.743 0.011 A 6 ILE HG1x H 1 0.528 0.017 A 6 ILE HG2% H 1 -0.220 0.005 A 6 ILE C C 13 175.344 0.010 A 6 ILE CA C 13 63.729 0.078 A 6 ILE CB C 13 38.692 0.084 A 6 ILE CD1 C 13 13.828 0.015 A 6 ILE CG1 C 13 29.264 0.045 A 6 ILE CG2 C 13 15.445 0.009 A 6 ILE N N 15 123.515 0.020 A 7 ALA H H 1 9.646 0.006 A 7 ALA HA H 1 4.547 0.008 A 7 ALA HB% H 1 1.289 0.006 A 7 ALA C C 13 176.343 0.014 A 7 ALA CA C 13 50.321 0.127 A 7 ALA CB C 13 16.933 0.070 A 7 ALA N N 15 133.985 0.022 A 8 PHE H H 1 8.231 0.007 A 8 PHE HA H 1 4.440 0.009 A 8 PHE HBy H 1 3.225 0.012 A 8 PHE HBx H 1 2.866 0.012 A 8 PHE HDx H 1 7.061 0.013 A 8 PHE HDy H 1 7.061 0.013 A 8 PHE HEx H 1 7.232 0.015 A 8 PHE HEy H 1 7.232 0.015 A 8 PHE HZ H 1 7.367 0.006 A 8 PHE C C 13 176.946 0.012 A 8 PHE CA C 13 59.767 0.068 A 8 PHE CB C 13 39.486 0.101 A 8 PHE CDx C 13 132.742 0.067 A 8 PHE CDy C 13 132.742 0.067 A 8 PHE CEx C 13 131.631 0.104 A 8 PHE CEy C 13 131.631 0.104 A 8 PHE CZ C 13 129.209 0.054 A 8 PHE N N 15 124.487 0.035 A 9 ARG H H 1 9.165 0.004 A 9 ARG HA H 1 4.624 0.005 A 9 ARG HBy H 1 1.813 0.010 A 9 ARG HBx H 1 1.788 0.007 A 9 ARG HDy H 1 3.416 0.006 A 9 ARG HDx H 1 2.957 0.016 A 9 ARG HGy H 1 2.019 0.016 A 9 ARG HGx H 1 1.966 0.019 A 9 ARG C C 13 176.417 0.000 A 9 ARG CA C 13 55.251 0.146 A 9 ARG CB C 13 32.130 0.128 A 9 ARG CD C 13 43.880 0.017 A 9 ARG CG C 13 26.929 0.002 A 9 ARG N N 15 122.011 0.020 A 10 GLU HA H 1 4.629 0.005 A 10 GLU HBy H 1 2.129 0.008 A 10 GLU HBx H 1 1.958 0.002 A 10 GLU HGy H 1 2.314 0.017 A 10 GLU HGx H 1 2.272 0.025 A 10 GLU C C 13 174.930 0.012 A 10 GLU CA C 13 55.280 0.105 A 10 GLU CB C 13 28.005 0.127 A 10 GLU CG C 13 36.131 0.002 A 11 LEU H H 1 7.136 0.004 A 11 LEU HA H 1 4.832 0.007 A 11 LEU HBy H 1 1.708 0.004 A 11 LEU HBx H 1 1.382 0.010 A 11 LEU HDx% H 1 0.969 0.015 A 11 LEU HDy% H 1 0.757 0.011 A 11 LEU C C 13 176.076 0.014 A 11 LEU CA C 13 52.873 0.115 A 11 LEU CB C 13 48.003 0.089 A 11 LEU CDx C 13 23.267 0.000 A 11 LEU CDy C 13 26.408 0.033 A 11 LEU N N 15 123.656 0.031 A 12 SER H H 1 8.412 0.007 A 12 SER HA H 1 4.801 0.011 A 12 SER HBy H 1 4.486 0.005 A 12 SER HBx H 1 4.094 0.009 A 12 SER C C 13 174.541 0.013 A 12 SER CA C 13 57.387 0.118 A 12 SER CB C 13 64.663 0.044 A 12 SER N N 15 116.109 0.029 A 13 PHE H H 1 10.640 0.004 A 13 PHE HA H 1 4.282 0.007 A 13 PHE HBy H 1 3.437 0.008 A 13 PHE HBx H 1 2.917 0.009 A 13 PHE HDx H 1 7.012 0.009 A 13 PHE HDy H 1 7.012 0.009 A 13 PHE HEx H 1 7.230 0.011 A 13 PHE HEy H 1 7.230 0.011 A 13 PHE HZ H 1 7.465 0.006 A 13 PHE C C 13 173.972 0.000 A 13 PHE CA C 13 64.060 0.027 A 13 PHE CB C 13 37.049 0.040 A 13 PHE CDx C 13 131.843 0.070 A 13 PHE CDy C 13 131.843 0.070 A 13 PHE CEx C 13 131.199 0.020 A 13 PHE CEy C 13 131.199 0.020 A 13 PHE CZ C 13 129.984 0.055 A 13 PHE N N 15 123.518 0.027 A 14 PRO HA H 1 4.152 0.007 A 14 PRO HBy H 1 2.413 0.003 A 14 PRO HBx H 1 1.900 0.006 A 14 PRO HDy H 1 4.288 0.003 A 14 PRO HDx H 1 4.126 0.011 A 14 PRO HGy H 1 2.262 0.003 A 14 PRO HGx H 1 2.160 0.009 A 14 PRO C C 13 180.985 0.004 A 14 PRO CA C 13 66.069 0.022 A 14 PRO CB C 13 31.167 0.063 A 14 PRO CD C 13 50.168 0.024 A 14 PRO CG C 13 28.819 0.019 A 15 GLU H H 1 7.194 0.006 A 15 GLU HA H 1 4.082 0.009 A 15 GLU HBy H 1 2.304 0.009 A 15 GLU HBx H 1 2.076 0.008 A 15 GLU HG2 H 1 2.394 0.007 A 15 GLU HG3 H 1 2.394 0.007 A 15 GLU C C 13 179.315 0.010 A 15 GLU CA C 13 58.836 0.090 A 15 GLU CB C 13 30.709 0.087 A 15 GLU CG C 13 37.101 0.077 A 15 GLU N N 15 116.417 0.036 A 16 ALA H H 1 8.858 0.008 A 16 ALA HA H 1 3.898 0.007 A 16 ALA HB% H 1 1.423 0.014 A 16 ALA C C 13 179.088 0.005 A 16 ALA CA C 13 55.424 0.037 A 16 ALA CB C 13 19.611 0.048 A 16 ALA N N 15 125.566 0.024 A 17 LEU H H 1 8.159 0.004 A 17 LEU HA H 1 3.815 0.017 A 17 LEU HBy H 1 1.512 0.005 A 17 LEU HBx H 1 1.409 0.015 A 17 LEU HDx% H 1 0.687 0.009 A 17 LEU HDy% H 1 0.678 0.011 A 17 LEU C C 13 179.542 0.018 A 17 LEU CA C 13 58.036 0.039 A 17 LEU CB C 13 41.739 0.085 A 17 LEU CDy C 13 25.554 0.014 A 17 LEU CDx C 13 24.203 0.041 A 17 LEU N N 15 118.951 0.017 A 18 LYS H H 1 7.276 0.006 A 18 LYS HA H 1 4.260 0.006 A 18 LYS HBy H 1 2.013 0.011 A 18 LYS HBx H 1 1.950 0.001 A 18 LYS HDy H 1 1.795 0.003 A 18 LYS HDx H 1 1.755 0.001 A 18 LYS HE2 H 1 2.946 0.003 A 18 LYS HE3 H 1 2.946 0.003 A 18 LYS HG2 H 1 1.569 0.003 A 18 LYS HG3 H 1 1.569 0.003 A 18 LYS C C 13 179.409 0.005 A 18 LYS CA C 13 58.428 0.070 A 18 LYS CB C 13 31.604 0.134 A 18 LYS CD C 13 28.441 0.001 A 18 LYS CE C 13 41.789 0.000 A 18 LYS CG C 13 24.742 0.000 A 18 LYS N N 15 117.891 0.038 A 19 ARG H H 1 8.018 0.006 A 19 ARG HA H 1 4.078 0.007 A 19 ARG HBy H 1 2.132 0.004 A 19 ARG HBx H 1 1.970 0.013 A 19 ARG HDy H 1 3.276 0.007 A 19 ARG HDx H 1 3.128 0.006 A 19 ARG HGy H 1 1.986 0.006 A 19 ARG HGx H 1 1.755 0.011 A 19 ARG C C 13 177.861 0.017 A 19 ARG CA C 13 56.953 0.076 A 19 ARG CB C 13 28.295 0.023 A 19 ARG CD C 13 41.397 0.018 A 19 ARG CG C 13 24.648 0.015 A 19 ARG N N 15 117.812 0.026 A 20 ALA H H 1 8.351 0.007 A 20 ALA HA H 1 3.873 0.011 A 20 ALA HB% H 1 1.576 0.009 A 20 ALA C C 13 179.295 0.018 A 20 ALA CA C 13 56.226 0.076 A 20 ALA CB C 13 16.811 0.061 A 20 ALA N N 15 123.068 0.031 A 21 GLU H H 1 7.639 0.005 A 21 GLU HA H 1 4.160 0.006 A 21 GLU HB2 H 1 2.541 0.006 A 21 GLU HB3 H 1 2.541 0.006 A 21 GLU HGy H 1 2.340 0.007 A 21 GLU HGx H 1 2.216 0.025 A 21 GLU C C 13 179.649 0.026 A 21 GLU CA C 13 59.522 0.086 A 21 GLU CB C 13 30.292 0.150 A 21 GLU CG C 13 36.025 0.006 A 21 GLU N N 15 117.192 0.028 A 22 VAL H H 1 8.296 0.006 A 22 VAL HA H 1 3.823 0.004 A 22 VAL HB H 1 2.148 0.008 A 22 VAL HGx% H 1 1.166 0.010 A 22 VAL HGy% H 1 1.044 0.017 A 22 VAL C C 13 178.299 0.015 A 22 VAL CA C 13 65.935 0.072 A 22 VAL CB C 13 32.703 0.083 A 22 VAL CGy C 13 22.225 0.031 A 22 VAL CGx C 13 21.158 0.000 A 22 VAL N N 15 118.728 0.025 A 23 GLU H H 1 8.680 0.005 A 23 GLU HA H 1 4.148 0.021 A 23 GLU HBy H 1 2.294 0.004 A 23 GLU HBx H 1 2.107 0.012 A 23 GLU HG2 H 1 2.292 0.004 A 23 GLU HG3 H 1 2.292 0.004 A 23 GLU C C 13 175.460 0.020 A 23 GLU CA C 13 56.919 0.081 A 23 GLU CB C 13 29.905 0.082 A 23 GLU CG C 13 37.200 0.024 A 23 GLU N N 15 116.920 0.034 A 24 ASP H H 1 7.817 0.007 A 24 ASP HA H 1 4.484 0.008 A 24 ASP HBy H 1 3.305 0.007 A 24 ASP HBx H 1 2.492 0.004 A 24 ASP C C 13 174.404 0.011 A 24 ASP CA C 13 54.941 0.110 A 24 ASP CB C 13 39.233 0.084 A 24 ASP N N 15 120.252 0.021 A 25 LYS H H 1 8.441 0.009 A 25 LYS HA H 1 4.802 0.008 A 25 LYS HBy H 1 2.452 0.011 A 25 LYS HBx H 1 1.204 0.009 A 25 LYS HDy H 1 1.417 0.007 A 25 LYS HDx H 1 1.092 0.003 A 25 LYS HE2 H 1 2.818 0.005 A 25 LYS HE3 H 1 2.818 0.005 A 25 LYS HGy H 1 1.386 0.014 A 25 LYS HGx H 1 1.182 0.010 A 25 LYS C C 13 176.515 0.016 A 25 LYS CA C 13 55.358 0.076 A 25 LYS CB C 13 40.195 0.080 A 25 LYS CD C 13 29.632 0.030 A 25 LYS CE C 13 42.280 0.000 A 25 LYS CG C 13 26.270 0.021 A 25 LYS N N 15 118.504 0.031 A 26 LEU H H 1 8.242 0.007 A 26 LEU HA H 1 4.700 0.008 A 26 LEU HBy H 1 2.126 0.016 A 26 LEU HBx H 1 1.447 0.009 A 26 LEU HDx% H 1 1.026 0.009 A 26 LEU HDy% H 1 0.940 0.008 A 26 LEU HG H 1 1.977 0.015 A 26 LEU C C 13 175.942 0.011 A 26 LEU CA C 13 54.610 0.092 A 26 LEU CB C 13 43.219 0.086 A 26 LEU CDy C 13 26.930 0.021 A 26 LEU CDx C 13 23.338 0.000 A 26 LEU CG C 13 27.330 0.032 A 26 LEU N N 15 117.140 0.021 A 27 LEU H H 1 9.309 0.003 A 27 LEU HA H 1 4.965 0.007 A 27 LEU HBy H 1 1.844 0.008 A 27 LEU HBx H 1 1.058 0.009 A 27 LEU HDx% H 1 0.765 0.008 A 27 LEU HDy% H 1 0.496 0.008 A 27 LEU HG H 1 1.324 0.009 A 27 LEU C C 13 175.109 0.013 A 27 LEU CA C 13 54.070 0.043 A 27 LEU CB C 13 44.159 0.057 A 27 LEU CDx C 13 25.587 0.023 A 27 LEU CDy C 13 28.027 0.020 A 27 LEU CG C 13 27.481 0.000 A 27 LEU N N 15 121.968 0.019 A 28 PHE H H 1 9.153 0.005 A 28 PHE HA H 1 5.216 0.012 A 28 PHE HBy H 1 3.254 0.010 A 28 PHE HBx H 1 2.458 0.007 A 28 PHE HDx H 1 7.073 0.011 A 28 PHE HDy H 1 7.073 0.011 A 28 PHE HEx H 1 6.860 0.010 A 28 PHE HEy H 1 6.860 0.010 A 28 PHE HZ H 1 7.149 0.007 A 28 PHE C C 13 173.174 0.009 A 28 PHE CA C 13 54.102 0.104 A 28 PHE CB C 13 39.468 0.046 A 28 PHE CDx C 13 133.964 0.049 A 28 PHE CDy C 13 133.964 0.049 A 28 PHE CEx C 13 129.362 0.021 A 28 PHE CEy C 13 129.362 0.021 A 28 PHE CZ C 13 127.971 0.051 A 28 PHE N N 15 128.227 0.025 A 29 VAL H H 1 8.674 0.005 A 29 VAL HA H 1 4.434 0.009 A 29 VAL HB H 1 1.676 0.009 A 29 VAL HGx% H 1 0.664 0.013 A 29 VAL HGy% H 1 0.740 0.013 A 29 VAL C C 13 174.139 0.013 A 29 VAL CA C 13 59.777 0.045 A 29 VAL CB C 13 34.075 0.027 A 29 VAL CGy C 13 23.264 0.000 A 29 VAL CGx C 13 21.875 0.031 A 29 VAL N N 15 126.405 0.035 A 30 ASP H H 1 8.231 0.011 A 30 ASP HA H 1 4.685 0.010 A 30 ASP HB2 H 1 2.661 0.024 A 30 ASP HB3 H 1 2.661 0.024 A 30 ASP C C 13 175.065 0.016 A 30 ASP CA C 13 52.890 0.112 A 30 ASP CB C 13 41.033 0.006 A 30 ASP N N 15 126.084 0.117 A 31 CYS H H 1 8.520 0.018 A 31 CYS HA H 1 5.014 0.007 A 31 CYS HBy H 1 3.739 0.005 A 31 CYS HBx H 1 2.896 0.012 A 31 CYS C C 13 174.134 0.014 A 31 CYS CA C 13 59.117 0.061 A 31 CYS CB C 13 28.066 0.094 A 31 CYS N N 15 125.416 0.088 A 32 PHE H H 1 8.317 0.011 A 32 PHE HA H 1 5.471 0.006 A 32 PHE HB2 H 1 3.006 0.006 A 32 PHE HB3 H 1 3.006 0.006 A 32 PHE HDx H 1 6.846 0.013 A 32 PHE HDy H 1 6.846 0.013 A 32 PHE HEx H 1 6.922 0.013 A 32 PHE HEy H 1 6.922 0.013 A 32 PHE HZ H 1 7.222 0.009 A 32 PHE C C 13 172.874 0.035 A 32 PHE CA C 13 54.844 0.101 A 32 PHE CB C 13 44.343 0.065 A 32 PHE CDx C 13 132.200 0.028 A 32 PHE CDy C 13 132.200 0.028 A 32 PHE CEx C 13 130.964 0.032 A 32 PHE CEy C 13 130.964 0.032 A 32 PHE CZ C 13 130.063 0.014 A 32 PHE N N 15 122.848 0.039 A 33 THR H H 1 6.718 0.004 A 33 THR HA H 1 4.154 0.004 A 33 THR HB H 1 3.285 0.009 A 33 THR HG2% H 1 -0.098 0.004 A 33 THR C C 13 176.508 0.011 A 33 THR CA C 13 58.641 0.083 A 33 THR CB C 13 72.555 0.158 A 33 THR CG2 C 13 21.187 0.011 A 33 THR N N 15 105.351 0.037 A 34 THR H H 1 9.677 0.011 A 34 THR HA H 1 4.015 0.007 A 34 THR HB H 1 4.391 0.004 A 34 THR HG2% H 1 1.439 0.005 A 34 THR C C 13 174.988 0.016 A 34 THR CA C 13 64.350 0.070 A 34 THR CB C 13 69.323 0.122 A 34 THR CG2 C 13 22.107 0.012 A 34 THR N N 15 113.346 0.038 A 35 TRP H H 1 6.590 0.004 A 35 TRP HA H 1 4.753 0.003 A 35 TRP HBy H 1 3.654 0.005 A 35 TRP HBx H 1 3.168 0.006 A 35 TRP HD1 H 1 7.337 0.013 A 35 TRP HE1 H 1 11.759 0.000 A 35 TRP HE3 H 1 7.437 0.017 A 35 TRP HH2 H 1 7.335 0.021 A 35 TRP HZ2 H 1 7.620 0.004 A 35 TRP HZ3 H 1 7.507 0.006 A 35 TRP C C 13 176.280 0.018 A 35 TRP CA C 13 53.764 0.102 A 35 TRP CB C 13 29.940 0.094 A 35 TRP CD1 C 13 129.234 0.033 A 35 TRP CE3 C 13 121.818 0.128 A 35 TRP CH2 C 13 122.198 0.070 A 35 TRP CZ2 C 13 115.067 0.038 A 35 TRP CZ3 C 13 125.418 0.085 A 35 TRP N N 15 114.396 0.038 A 35 TRP NE1 N 15 135.063 0.000 A 36 CYS H H 1 6.156 0.004 A 36 CYS HA H 1 4.405 0.010 A 36 CYS HBy H 1 2.239 0.009 A 36 CYS HBx H 1 1.716 0.013 A 36 CYS C C 13 176.286 0.000 A 36 CYS CA C 13 59.640 0.064 A 36 CYS CB C 13 27.178 0.030 A 36 CYS N N 15 124.159 0.137 A 37 GLY HAx H 1 3.957 0.004 A 37 GLY HAy H 1 4.299 0.004 A 37 GLY CA C 13 48.980 0.040 A 38 PRO HA H 1 4.313 0.013 A 38 PRO HBy H 1 2.447 0.008 A 38 PRO HBx H 1 1.853 0.003 A 38 PRO HDy H 1 4.776 0.009 A 38 PRO HDx H 1 3.734 0.008 A 38 PRO HGy H 1 2.317 0.005 A 38 PRO HGx H 1 2.056 0.004 A 38 PRO C C 13 178.519 0.000 A 38 PRO CA C 13 65.958 0.053 A 38 PRO CB C 13 32.665 0.020 A 38 PRO CD C 13 51.671 0.027 A 38 PRO CG C 13 28.025 0.029 A 39 CYS H H 1 8.052 0.021 A 39 CYS HA H 1 4.018 0.009 A 39 CYS HBy H 1 3.381 0.026 A 39 CYS HBx H 1 3.151 0.015 A 39 CYS C C 13 177.068 0.028 A 39 CYS CA C 13 64.369 0.066 A 39 CYS CB C 13 28.234 0.139 A 39 CYS N N 15 116.649 0.188 A 40 LYS H H 1 7.718 0.005 A 40 LYS HA H 1 4.050 0.006 A 40 LYS HBy H 1 2.027 0.001 A 40 LYS HBx H 1 1.876 0.002 A 40 LYS HD2 H 1 1.675 0.003 A 40 LYS HD3 H 1 1.675 0.003 A 40 LYS HE2 H 1 2.963 0.004 A 40 LYS HE3 H 1 2.963 0.004 A 40 LYS HGy H 1 1.559 0.012 A 40 LYS HGx H 1 1.398 0.005 A 40 LYS C C 13 178.441 0.014 A 40 LYS CA C 13 59.188 0.142 A 40 LYS CB C 13 32.120 0.121 A 40 LYS CD C 13 29.589 0.000 A 40 LYS CE C 13 41.984 0.000 A 40 LYS CG C 13 25.477 0.004 A 40 LYS N N 15 120.987 0.044 A 41 ARG H H 1 7.570 0.009 A 41 ARG HA H 1 4.074 0.008 A 41 ARG HBy H 1 1.917 0.013 A 41 ARG HBx H 1 1.831 0.001 A 41 ARG HDy H 1 3.222 0.014 A 41 ARG HDx H 1 3.150 0.017 A 41 ARG HGy H 1 1.665 0.013 A 41 ARG HGx H 1 1.527 0.011 A 41 ARG C C 13 179.407 0.016 A 41 ARG CA C 13 59.412 0.084 A 41 ARG CB C 13 29.656 0.109 A 41 ARG CD C 13 43.331 0.026 A 41 ARG CG C 13 27.843 0.003 A 41 ARG N N 15 119.616 0.031 A 42 LEU H H 1 7.678 0.011 A 42 LEU HA H 1 3.684 0.007 A 42 LEU HBy H 1 1.586 0.006 A 42 LEU HBx H 1 0.638 0.011 A 42 LEU HDx% H 1 0.903 0.013 A 42 LEU HDy% H 1 0.807 0.007 A 42 LEU HG H 1 1.342 0.006 A 42 LEU C C 13 177.090 0.015 A 42 LEU CA C 13 58.137 0.131 A 42 LEU CB C 13 40.934 0.060 A 42 LEU CDy C 13 26.516 0.036 A 42 LEU CDx C 13 24.568 0.044 A 42 LEU CG C 13 26.433 0.000 A 42 LEU N N 15 118.941 0.119 A 43 SER H H 1 7.574 0.006 A 43 SER HA H 1 4.100 0.009 A 43 SER HBy H 1 3.870 0.004 A 43 SER HBx H 1 3.782 0.006 A 43 SER C C 13 176.295 0.013 A 43 SER CA C 13 61.632 0.125 A 43 SER CB C 13 63.156 0.076 A 43 SER N N 15 110.296 0.021 A 44 LYS H H 1 8.296 0.008 A 44 LYS HA H 1 4.255 0.005 A 44 LYS HB2 H 1 1.883 0.007 A 44 LYS HB3 H 1 1.883 0.007 A 44 LYS HD2 H 1 1.639 0.012 A 44 LYS HD3 H 1 1.639 0.012 A 44 LYS HE2 H 1 2.961 0.000 A 44 LYS HE3 H 1 2.961 0.000 A 44 LYS HGy H 1 1.585 0.020 A 44 LYS HGx H 1 1.436 0.016 A 44 LYS C C 13 176.860 0.013 A 44 LYS CA C 13 57.776 0.103 A 44 LYS CB C 13 33.740 0.148 A 44 LYS CD C 13 28.913 0.000 A 44 LYS CE C 13 41.883 0.000 A 44 LYS CG C 13 25.521 0.004 A 44 LYS N N 15 116.121 0.030 A 45 VAL H H 1 7.742 0.004 A 45 VAL HA H 1 4.205 0.005 A 45 VAL HB H 1 2.318 0.010 A 45 VAL HG1% H 1 0.973 0.011 A 45 VAL HG2% H 1 0.973 0.011 A 45 VAL C C 13 177.969 0.015 A 45 VAL CA C 13 64.502 0.095 A 45 VAL CB C 13 34.039 0.054 A 45 VAL CGy C 13 21.667 0.000 A 45 VAL CGx C 13 21.042 0.000 A 45 VAL N N 15 115.752 0.040 A 46 VAL H H 1 7.555 0.006 A 46 VAL HA H 1 3.699 0.009 A 46 VAL HB H 1 2.156 0.011 A 46 VAL HGx% H 1 1.199 0.011 A 46 VAL HGy% H 1 1.048 0.009 A 46 VAL C C 13 178.106 0.023 A 46 VAL CA C 13 68.247 0.041 A 46 VAL CB C 13 31.822 0.101 A 46 VAL CGy C 13 22.152 0.054 A 46 VAL CGx C 13 21.912 0.051 A 46 VAL N N 15 122.587 0.029 A 47 PHE H H 1 8.994 0.006 A 47 PHE HA H 1 4.596 0.006 A 47 PHE HB2 H 1 3.461 0.008 A 47 PHE HB3 H 1 3.461 0.008 A 47 PHE HDx H 1 7.066 0.012 A 47 PHE HDy H 1 7.066 0.012 A 47 PHE HEx H 1 7.263 0.017 A 47 PHE HEy H 1 7.263 0.017 A 47 PHE HZ H 1 6.841 0.013 A 47 PHE C C 13 174.983 0.017 A 47 PHE CA C 13 54.665 0.079 A 47 PHE CB C 13 36.836 0.087 A 47 PHE CDx C 13 129.797 0.043 A 47 PHE CDy C 13 129.797 0.043 A 47 PHE CEx C 13 131.144 0.048 A 47 PHE CEy C 13 131.144 0.048 A 47 PHE CZ C 13 129.614 0.054 A 47 PHE N N 15 113.970 0.039 A 48 LYS H H 1 6.851 0.006 A 48 LYS HA H 1 4.359 0.006 A 48 LYS HBy H 1 2.084 0.009 A 48 LYS HBx H 1 1.694 0.006 A 48 LYS HDy H 1 1.693 0.003 A 48 LYS HDx H 1 1.661 0.000 A 48 LYS HEy H 1 3.124 0.000 A 48 LYS HEx H 1 2.949 0.000 A 48 LYS HGy H 1 1.503 0.017 A 48 LYS HGx H 1 1.303 0.006 A 48 LYS C C 13 176.551 0.016 A 48 LYS CA C 13 54.809 0.098 A 48 LYS CB C 13 32.346 0.072 A 48 LYS CD C 13 28.482 0.000 A 48 LYS CE C 13 42.230 0.002 A 48 LYS CG C 13 25.133 0.000 A 48 LYS N N 15 112.051 0.031 A 49 ASP H H 1 7.582 0.008 A 49 ASP HA H 1 4.523 0.009 A 49 ASP HBy H 1 3.010 0.012 A 49 ASP HBx H 1 2.800 0.006 A 49 ASP C C 13 177.432 0.013 A 49 ASP CA C 13 55.187 0.074 A 49 ASP CB C 13 44.140 0.071 A 49 ASP N N 15 123.420 0.032 A 50 SER H H 1 8.901 0.007 A 50 SER HA H 1 4.111 0.007 A 50 SER HBy H 1 3.996 0.010 A 50 SER HBx H 1 3.955 0.000 A 50 SER C C 13 176.265 0.000 A 50 SER CA C 13 62.330 0.068 A 50 SER CB C 13 63.247 0.214 A 50 SER N N 15 122.231 0.030 A 51 LEU H H 1 8.084 0.004 A 51 LEU HA H 1 4.318 0.007 A 51 LEU HBy H 1 2.041 0.008 A 51 LEU HBx H 1 1.463 0.006 A 51 LEU HDx% H 1 1.002 0.014 A 51 LEU HDy% H 1 0.928 0.002 A 51 LEU HG H 1 1.785 0.010 A 51 LEU C C 13 180.801 0.021 A 51 LEU CA C 13 58.180 0.109 A 51 LEU CB C 13 41.319 0.099 A 51 LEU CDy C 13 25.235 0.110 A 51 LEU CDx C 13 23.484 0.000 A 51 LEU CG C 13 27.706 0.000 A 51 LEU N N 15 122.932 0.026 A 52 VAL H H 1 8.262 0.010 A 52 VAL HA H 1 3.769 0.010 A 52 VAL HB H 1 2.436 0.011 A 52 VAL HGx% H 1 1.192 0.009 A 52 VAL HGy% H 1 0.724 0.013 A 52 VAL C C 13 177.493 0.019 A 52 VAL CA C 13 66.750 0.034 A 52 VAL CB C 13 32.671 0.070 A 52 VAL CGy C 13 24.740 0.065 A 52 VAL CGx C 13 22.323 0.033 A 52 VAL N N 15 122.016 0.076 A 53 ALA H H 1 8.932 0.007 A 53 ALA HA H 1 3.759 0.010 A 53 ALA HB% H 1 1.245 0.011 A 53 ALA C C 13 178.718 0.011 A 53 ALA CA C 13 55.892 0.100 A 53 ALA CB C 13 17.749 0.055 A 53 ALA N N 15 120.623 0.021 A 54 ASP H H 1 8.019 0.005 A 54 ASP HA H 1 4.356 0.008 A 54 ASP HBy H 1 2.953 0.010 A 54 ASP HBx H 1 2.694 0.013 A 54 ASP C C 13 178.131 0.013 A 54 ASP CA C 13 57.790 0.083 A 54 ASP CB C 13 42.172 0.038 A 54 ASP N N 15 115.211 0.021 A 55 TYR H H 1 7.682 0.009 A 55 TYR HA H 1 4.105 0.006 A 55 TYR HBy H 1 3.364 0.011 A 55 TYR HBx H 1 3.244 0.004 A 55 TYR HDx H 1 6.894 0.007 A 55 TYR HDy H 1 6.894 0.007 A 55 TYR HEx H 1 6.338 0.009 A 55 TYR HEy H 1 6.338 0.009 A 55 TYR C C 13 178.703 0.014 A 55 TYR CA C 13 62.804 0.036 A 55 TYR CB C 13 39.495 0.089 A 55 TYR CDx C 13 132.893 0.034 A 55 TYR CDy C 13 132.893 0.034 A 55 TYR CEx C 13 118.258 0.048 A 55 TYR CEy C 13 118.258 0.048 A 55 TYR N N 15 118.139 0.029 A 56 PHE H H 1 9.313 0.008 A 56 PHE HA H 1 4.288 0.006 A 56 PHE HBy H 1 3.147 0.012 A 56 PHE HBx H 1 3.056 0.004 A 56 PHE HDx H 1 7.650 0.009 A 56 PHE HDy H 1 7.650 0.009 A 56 PHE HEx H 1 6.090 0.007 A 56 PHE HEy H 1 6.090 0.007 A 56 PHE HZ H 1 6.947 0.012 A 56 PHE C C 13 179.415 0.017 A 56 PHE CA C 13 61.049 0.032 A 56 PHE CB C 13 38.436 0.082 A 56 PHE CDx C 13 133.593 0.032 A 56 PHE CDy C 13 133.593 0.032 A 56 PHE CEx C 13 130.186 0.048 A 56 PHE CEy C 13 130.186 0.048 A 56 PHE CZ C 13 128.183 0.074 A 56 PHE N N 15 120.031 0.048 A 57 ASN H H 1 8.985 0.009 A 57 ASN HA H 1 4.565 0.011 A 57 ASN HBy H 1 3.035 0.007 A 57 ASN HBx H 1 2.760 0.015 A 57 ASN HD21 H 1 7.435 0.004 A 57 ASN HD22 H 1 6.695 0.004 A 57 ASN C C 13 178.251 0.014 A 57 ASN CA C 13 55.265 0.073 A 57 ASN CB C 13 37.301 0.130 A 57 ASN N N 15 116.596 0.078 A 57 ASN ND2 N 15 108.449 0.033 A 58 ARG H H 1 7.378 0.007 A 58 ARG HA H 1 4.112 0.009 A 58 ARG HBy H 1 1.547 0.006 A 58 ARG HBx H 1 1.260 0.012 A 58 ARG HDy H 1 2.967 0.014 A 58 ARG HDx H 1 2.930 0.019 A 58 ARG HGy H 1 1.311 0.013 A 58 ARG HGx H 1 0.979 0.019 A 58 ARG C C 13 177.673 0.016 A 58 ARG CA C 13 58.137 0.099 A 58 ARG CB C 13 30.936 0.068 A 58 ARG CD C 13 43.094 0.031 A 58 ARG CG C 13 27.766 0.011 A 58 ARG N N 15 118.818 0.082 A 59 HIS H H 1 7.043 0.008 A 59 HIS HA H 1 4.242 0.004 A 59 HIS HBx H 1 1.171 0.009 A 59 HIS HBy H 1 1.985 0.008 A 59 HIS HD2 H 1 5.837 0.015 A 59 HIS HE1 H 1 7.722 0.007 A 59 HIS C C 13 174.825 0.035 A 59 HIS CA C 13 58.538 0.114 A 59 HIS CB C 13 29.961 0.114 A 59 HIS CD2 C 13 122.359 0.026 A 59 HIS CE1 C 13 137.129 0.062 A 59 HIS N N 15 112.785 0.090 A 60 PHE H H 1 7.717 0.008 A 60 PHE HA H 1 6.048 0.006 A 60 PHE HBy H 1 3.467 0.012 A 60 PHE HBx H 1 3.274 0.010 A 60 PHE HDx H 1 7.268 0.010 A 60 PHE HDy H 1 7.268 0.010 A 60 PHE HEx H 1 6.709 0.008 A 60 PHE HEy H 1 6.709 0.008 A 60 PHE HZ H 1 6.401 0.028 A 60 PHE C C 13 177.496 0.014 A 60 PHE CA C 13 54.881 0.072 A 60 PHE CB C 13 41.690 0.086 A 60 PHE CDx C 13 133.033 0.055 A 60 PHE CDy C 13 133.033 0.055 A 60 PHE CEx C 13 129.671 0.015 A 60 PHE CEy C 13 129.671 0.015 A 60 PHE CZ C 13 130.003 0.054 A 60 PHE N N 15 115.172 0.052 A 61 VAL H H 1 8.744 0.005 A 61 VAL HA H 1 3.892 0.009 A 61 VAL HB H 1 2.020 0.008 A 61 VAL HGx% H 1 0.789 0.010 A 61 VAL HGy% H 1 0.786 0.011 A 61 VAL C C 13 174.101 0.033 A 61 VAL CA C 13 63.256 0.061 A 61 VAL CB C 13 32.373 0.122 A 61 VAL CGy C 13 20.427 0.123 A 61 VAL CGx C 13 20.238 0.066 A 61 VAL N N 15 123.124 0.020 A 62 ASN H H 1 7.896 0.008 A 62 ASN HA H 1 5.538 0.006 A 62 ASN HBy H 1 2.677 0.012 A 62 ASN HBx H 1 2.032 0.011 A 62 ASN HD21 H 1 6.676 0.008 A 62 ASN HD22 H 1 6.216 0.010 A 62 ASN C C 13 172.909 0.015 A 62 ASN CA C 13 55.518 0.065 A 62 ASN CB C 13 41.019 0.086 A 62 ASN N N 15 126.183 0.039 A 62 ASN ND2 N 15 111.040 0.053 A 63 LEU H H 1 9.809 0.008 A 63 LEU HA H 1 5.106 0.010 A 63 LEU HBy H 1 1.905 0.006 A 63 LEU HBx H 1 1.409 0.009 A 63 LEU HDx% H 1 1.108 0.008 A 63 LEU HDy% H 1 0.956 0.009 A 63 LEU HG H 1 1.738 0.006 A 63 LEU C C 13 173.938 0.025 A 63 LEU CA C 13 53.992 0.036 A 63 LEU CB C 13 48.614 0.044 A 63 LEU CDx C 13 24.712 0.012 A 63 LEU CDy C 13 25.698 0.038 A 63 LEU CG C 13 27.728 0.054 A 63 LEU N N 15 127.866 0.070 A 64 LYS H H 1 8.840 0.009 A 64 LYS HA H 1 4.825 0.006 A 64 LYS HB2 H 1 1.235 0.007 A 64 LYS HB3 H 1 1.235 0.007 A 64 LYS HDy H 1 0.851 0.012 A 64 LYS HDx H 1 0.840 0.018 A 64 LYS HE2 H 1 2.266 0.003 A 64 LYS HE3 H 1 2.266 0.003 A 64 LYS HG2 H 1 0.909 0.013 A 64 LYS HG3 H 1 0.909 0.013 A 64 LYS C C 13 175.566 0.020 A 64 LYS CA C 13 54.830 0.063 A 64 LYS CB C 13 34.536 0.057 A 64 LYS CD C 13 29.096 0.022 A 64 LYS CE C 13 41.490 0.019 A 64 LYS CG C 13 24.290 0.000 A 64 LYS N N 15 123.413 0.070 A 65 MET H H 1 9.035 0.006 A 65 MET HA H 1 4.800 0.005 A 65 MET HBy H 1 1.798 0.005 A 65 MET HBx H 1 1.497 0.009 A 65 MET HE% H 1 2.102 0.007 A 65 MET HGy H 1 2.231 0.012 A 65 MET HGx H 1 2.225 0.015 A 65 MET C C 13 171.544 0.017 A 65 MET CA C 13 53.991 0.110 A 65 MET CB C 13 35.748 0.040 A 65 MET CE C 13 16.723 0.009 A 65 MET CG C 13 32.627 0.000 A 65 MET N N 15 122.908 0.018 A 66 ASP H H 1 8.032 0.005 A 66 ASP HA H 1 3.162 0.010 A 66 ASP HBy H 1 2.636 0.011 A 66 ASP HBx H 1 2.063 0.007 A 66 ASP C C 13 178.487 0.023 A 66 ASP CA C 13 52.176 0.117 A 66 ASP CB C 13 40.544 0.091 A 66 ASP N N 15 128.419 0.020 A 67 MET H H 1 8.251 0.007 A 67 MET HA H 1 4.159 0.007 A 67 MET HBx H 1 1.573 0.009 A 67 MET HBy H 1 2.079 0.007 A 67 MET HE% H 1 2.036 0.005 A 67 MET HG2 H 1 2.651 0.008 A 67 MET HG3 H 1 2.651 0.008 A 67 MET C C 13 175.626 0.010 A 67 MET CA C 13 55.158 0.105 A 67 MET CB C 13 34.347 0.076 A 67 MET CE C 13 19.952 0.027 A 67 MET CG C 13 34.359 0.039 A 67 MET N N 15 123.380 0.026 A 68 GLU H H 1 8.690 0.005 A 68 GLU HA H 1 4.324 0.004 A 68 GLU HBy H 1 2.302 0.008 A 68 GLU HBx H 1 1.821 0.007 A 68 GLU HGy H 1 2.171 0.007 A 68 GLU HGx H 1 2.064 0.015 A 68 GLU C C 13 176.044 0.026 A 68 GLU CA C 13 54.905 0.071 A 68 GLU CB C 13 31.039 0.143 A 68 GLU CG C 13 37.168 0.018 A 68 GLU N N 15 114.225 0.018 A 69 LYS H H 1 7.398 0.004 A 69 LYS HA H 1 4.709 0.008 A 69 LYS HBy H 1 1.840 0.008 A 69 LYS HBx H 1 1.566 0.013 A 69 LYS HD2 H 1 1.702 0.000 A 69 LYS HD3 H 1 1.702 0.000 A 69 LYS HEy H 1 3.051 0.011 A 69 LYS HEx H 1 3.027 0.008 A 69 LYS HG2 H 1 1.308 0.008 A 69 LYS HG3 H 1 1.308 0.008 A 69 LYS C C 13 175.929 0.000 A 69 LYS CA C 13 55.073 0.106 A 69 LYS CB C 13 37.161 0.067 A 69 LYS CD C 13 29.309 0.000 A 69 LYS CE C 13 41.810 0.000 A 69 LYS CG C 13 24.741 0.000 A 69 LYS N N 15 119.808 0.044 A 70 GLY HAy H 1 4.050 0.005 A 70 GLY HAx H 1 3.854 0.005 A 70 GLY CA C 13 46.696 0.048 A 71 GLU HA H 1 4.260 0.005 A 71 GLU HBy H 1 2.258 0.007 A 71 GLU HBx H 1 2.085 0.007 A 71 GLU HG2 H 1 2.412 0.009 A 71 GLU HG3 H 1 2.412 0.009 A 71 GLU C C 13 177.615 0.021 A 71 GLU CA C 13 58.519 0.088 A 71 GLU CB C 13 30.141 0.123 A 71 GLU CG C 13 36.792 0.010 A 72 GLY H H 1 8.659 0.005 A 72 GLY HAy H 1 4.576 0.008 A 72 GLY HAx H 1 3.588 0.007 A 72 GLY C C 13 174.812 0.017 A 72 GLY CA C 13 47.547 0.044 A 72 GLY N N 15 108.995 0.024 A 73 VAL H H 1 6.949 0.005 A 73 VAL HA H 1 3.637 0.007 A 73 VAL HB H 1 2.036 0.005 A 73 VAL HGx% H 1 0.952 0.010 A 73 VAL HGy% H 1 0.829 0.007 A 73 VAL C C 13 178.737 0.016 A 73 VAL CA C 13 65.957 0.054 A 73 VAL CB C 13 32.037 0.145 A 73 VAL CGx C 13 20.958 0.000 A 73 VAL CGy C 13 21.716 0.027 A 73 VAL N N 15 119.449 0.020 A 74 GLU H H 1 7.283 0.007 A 74 GLU HA H 1 4.158 0.007 A 74 GLU HBy H 1 2.119 0.014 A 74 GLU HBx H 1 1.970 0.000 A 74 GLU HG2 H 1 2.327 0.001 A 74 GLU HG3 H 1 2.327 0.001 A 74 GLU C C 13 179.909 0.017 A 74 GLU CA C 13 58.535 0.077 A 74 GLU CB C 13 29.185 0.080 A 74 GLU CG C 13 36.507 0.000 A 74 GLU N N 15 117.749 0.035 A 75 LEU H H 1 7.875 0.006 A 75 LEU HA H 1 3.909 0.011 A 75 LEU HBy H 1 1.678 0.007 A 75 LEU HBx H 1 1.264 0.009 A 75 LEU HDx% H 1 0.377 0.012 A 75 LEU HDy% H 1 0.317 0.012 A 75 LEU HG H 1 1.579 0.011 A 75 LEU C C 13 178.392 0.013 A 75 LEU CA C 13 58.501 0.058 A 75 LEU CB C 13 42.110 0.035 A 75 LEU CDy C 13 25.523 0.015 A 75 LEU CDx C 13 23.208 0.010 A 75 LEU CG C 13 27.703 0.052 A 75 LEU N N 15 121.792 0.020 A 76 ARG H H 1 8.534 0.005 A 76 ARG HA H 1 3.723 0.007 A 76 ARG HBy H 1 2.481 0.013 A 76 ARG HBx H 1 2.159 0.013 A 76 ARG HDy H 1 3.361 0.010 A 76 ARG HDx H 1 3.354 0.011 A 76 ARG HGy H 1 1.912 0.012 A 76 ARG HGx H 1 1.713 0.021 A 76 ARG C C 13 178.879 0.015 A 76 ARG CA C 13 59.988 0.122 A 76 ARG CB C 13 29.930 0.051 A 76 ARG CD C 13 43.939 0.013 A 76 ARG CG C 13 27.159 0.001 A 76 ARG N N 15 120.117 0.017 A 77 LYS H H 1 7.023 0.006 A 77 LYS HA H 1 4.145 0.006 A 77 LYS HB2 H 1 1.940 0.010 A 77 LYS HB3 H 1 1.940 0.010 A 77 LYS HD2 H 1 1.721 0.012 A 77 LYS HD3 H 1 1.721 0.012 A 77 LYS HE2 H 1 2.962 0.000 A 77 LYS HE3 H 1 2.962 0.000 A 77 LYS HGx H 1 1.471 0.013 A 77 LYS HGy H 1 1.651 0.003 A 77 LYS C C 13 179.160 0.031 A 77 LYS CA C 13 58.716 0.102 A 77 LYS CB C 13 33.031 0.121 A 77 LYS CD C 13 29.582 0.000 A 77 LYS CE C 13 41.981 0.000 A 77 LYS CG C 13 25.150 0.005 A 77 LYS N N 15 116.311 0.027 A 78 LYS H H 1 8.203 0.003 A 78 LYS HA H 1 3.863 0.011 A 78 LYS HBy H 1 1.713 0.010 A 78 LYS HBx H 1 1.375 0.011 A 78 LYS HDy H 1 1.433 0.004 A 78 LYS HDx H 1 1.284 0.010 A 78 LYS HEy H 1 2.879 0.014 A 78 LYS HEx H 1 2.837 0.017 A 78 LYS HGy H 1 0.949 0.008 A 78 LYS HGx H 1 0.494 0.007 A 78 LYS C C 13 178.299 0.015 A 78 LYS CA C 13 59.252 0.114 A 78 LYS CB C 13 33.143 0.095 A 78 LYS CD C 13 29.089 0.030 A 78 LYS CE C 13 41.853 0.055 A 78 LYS CG C 13 24.343 0.038 A 78 LYS N N 15 121.125 0.024 A 79 TYR H H 1 8.120 0.002 A 79 TYR HA H 1 4.811 0.013 A 79 TYR HBy H 1 3.253 0.007 A 79 TYR HBx H 1 2.454 0.006 A 79 TYR HDx H 1 7.009 0.009 A 79 TYR HDy H 1 7.009 0.009 A 79 TYR HEx H 1 6.745 0.007 A 79 TYR HEy H 1 6.745 0.007 A 79 TYR C C 13 175.799 0.012 A 79 TYR CA C 13 57.938 0.086 A 79 TYR CB C 13 38.372 0.072 A 79 TYR CDx C 13 132.579 0.074 A 79 TYR CDy C 13 132.579 0.074 A 79 TYR CEx C 13 117.869 0.022 A 79 TYR CEy C 13 117.869 0.022 A 79 TYR N N 15 111.991 0.016 A 80 GLY H H 1 7.449 0.006 A 80 GLY HAy H 1 3.877 0.010 A 80 GLY HAx H 1 3.748 0.010 A 80 GLY C C 13 174.744 0.018 A 80 GLY CA C 13 48.191 0.118 A 80 GLY N N 15 111.908 0.021 A 81 VAL H H 1 8.128 0.005 A 81 VAL HA H 1 3.967 0.002 A 81 VAL HB H 1 2.125 0.005 A 81 VAL HGx% H 1 0.973 0.011 A 81 VAL HGy% H 1 0.971 0.012 A 81 VAL C C 13 174.664 0.000 A 81 VAL CA C 13 62.791 0.082 A 81 VAL CB C 13 31.454 0.103 A 81 VAL CGy C 13 21.631 0.027 A 81 VAL CGx C 13 21.345 0.000 A 81 VAL N N 15 120.679 0.026 A 82 HIS HA H 1 4.766 0.013 A 82 HIS HBy H 1 3.169 0.014 A 82 HIS HBx H 1 2.947 0.008 A 82 HIS HD2 H 1 6.898 0.006 A 82 HIS HE1 H 1 7.783 0.008 A 82 HIS C C 13 173.540 0.000 A 82 HIS CA C 13 55.168 0.108 A 82 HIS CB C 13 32.083 0.153 A 82 HIS CD2 C 13 120.205 0.004 A 82 HIS CE1 C 13 138.517 0.036 A 83 ALA H H 1 7.161 0.005 A 83 ALA HA H 1 4.116 0.007 A 83 ALA HB% H 1 1.090 0.006 A 83 ALA C C 13 173.964 0.017 A 83 ALA CA C 13 50.438 0.068 A 83 ALA CB C 13 22.347 0.130 A 83 ALA N N 15 122.250 0.025 A 84 TYR H H 1 8.222 0.007 A 84 TYR HA H 1 4.921 0.013 A 84 TYR HBy H 1 2.809 0.011 A 84 TYR HBx H 1 2.798 0.014 A 84 TYR HDx H 1 6.767 0.007 A 84 TYR HDy H 1 6.767 0.007 A 84 TYR HEx H 1 6.546 0.010 A 84 TYR HEy H 1 6.546 0.010 A 84 TYR C C 13 173.690 0.000 A 84 TYR CA C 13 53.813 0.123 A 84 TYR CB C 13 40.661 0.045 A 84 TYR CDx C 13 133.173 0.066 A 84 TYR CDy C 13 133.173 0.066 A 84 TYR CEx C 13 118.408 0.040 A 84 TYR CEy C 13 118.408 0.040 A 84 TYR N N 15 117.525 0.049 A 85 PRO HA H 1 4.830 0.029 A 85 PRO HBy H 1 3.092 0.011 A 85 PRO HBx H 1 2.004 0.009 A 85 PRO HD2 H 1 3.567 0.008 A 85 PRO HD3 H 1 3.567 0.008 A 85 PRO HGy H 1 1.839 0.011 A 85 PRO HGx H 1 1.830 0.011 A 85 PRO C C 13 177.076 0.016 A 85 PRO CA C 13 63.338 0.038 A 85 PRO CB C 13 35.256 0.042 A 85 PRO CD C 13 50.522 0.012 A 85 PRO CG C 13 25.641 0.020 A 86 THR H H 1 8.148 0.007 A 86 THR HA H 1 5.091 0.006 A 86 THR HB H 1 3.965 0.008 A 86 THR HG1 H 1 5.490 0.003 A 86 THR HG2% H 1 1.161 0.009 A 86 THR C C 13 171.154 0.015 A 86 THR CA C 13 64.034 0.087 A 86 THR CB C 13 72.464 0.145 A 86 THR CG2 C 13 21.871 0.028 A 86 THR N N 15 117.211 0.027 A 87 LEU H H 1 9.709 0.009 A 87 LEU HA H 1 5.236 0.006 A 87 LEU HBx H 1 1.967 0.010 A 87 LEU HBy H 1 2.316 0.017 A 87 LEU HDx% H 1 1.366 0.006 A 87 LEU HDy% H 1 1.242 0.010 A 87 LEU HG H 1 2.271 0.010 A 87 LEU C C 13 174.818 0.011 A 87 LEU CA C 13 54.736 0.112 A 87 LEU CB C 13 42.153 0.117 A 87 LEU CDy C 13 25.968 0.045 A 87 LEU CDx C 13 25.428 0.017 A 87 LEU CG C 13 29.411 0.015 A 87 LEU N N 15 129.694 0.048 A 88 LEU H H 1 8.537 0.005 A 88 LEU HA H 1 4.853 0.008 A 88 LEU HBy H 1 1.582 0.013 A 88 LEU HBx H 1 1.106 0.008 A 88 LEU HDx% H 1 0.722 0.012 A 88 LEU HDy% H 1 0.463 0.011 A 88 LEU HG H 1 1.591 0.008 A 88 LEU C C 13 174.755 0.016 A 88 LEU CA C 13 53.320 0.057 A 88 LEU CB C 13 45.940 0.092 A 88 LEU CDx C 13 23.706 0.026 A 88 LEU CDy C 13 25.975 0.026 A 88 LEU CG C 13 26.449 0.000 A 88 LEU N N 15 121.600 0.025 A 89 PHE H H 1 8.324 0.007 A 89 PHE HA H 1 5.457 0.005 A 89 PHE HBy H 1 3.102 0.010 A 89 PHE HBx H 1 2.555 0.006 A 89 PHE HDx H 1 6.687 0.010 A 89 PHE HDy H 1 6.687 0.010 A 89 PHE HEx H 1 6.479 0.013 A 89 PHE HEy H 1 6.479 0.013 A 89 PHE HZ H 1 6.855 0.013 A 89 PHE C C 13 175.309 0.016 A 89 PHE CA C 13 57.059 0.058 A 89 PHE CB C 13 39.722 0.059 A 89 PHE CDx C 13 132.464 0.047 A 89 PHE CDy C 13 132.464 0.047 A 89 PHE CEx C 13 131.098 0.052 A 89 PHE CEy C 13 131.098 0.052 A 89 PHE CZ C 13 130.542 0.000 A 89 PHE N N 15 119.311 0.030 A 90 ILE H H 1 9.843 0.005 A 90 ILE HA H 1 4.992 0.013 A 90 ILE HB H 1 1.586 0.010 A 90 ILE HD1% H 1 0.486 0.012 A 90 ILE HG1y H 1 1.395 0.006 A 90 ILE HG1x H 1 0.585 0.012 A 90 ILE HG2% H 1 1.133 0.010 A 90 ILE C C 13 174.831 0.012 A 90 ILE CA C 13 60.207 0.054 A 90 ILE CB C 13 42.949 0.079 A 90 ILE CD1 C 13 13.665 0.017 A 90 ILE CG1 C 13 28.555 0.013 A 90 ILE CG2 C 13 17.480 0.016 A 90 ILE N N 15 127.697 0.022 A 91 ASN H H 1 8.813 0.009 A 91 ASN HA H 1 5.131 0.008 A 91 ASN HBy H 1 3.622 0.009 A 91 ASN HBx H 1 2.741 0.004 A 91 ASN HD21 H 1 7.709 0.007 A 91 ASN HD22 H 1 7.546 0.004 A 91 ASN C C 13 177.278 0.010 A 91 ASN CA C 13 51.481 0.046 A 91 ASN CB C 13 39.160 0.099 A 91 ASN N N 15 122.908 0.028 A 91 ASN ND2 N 15 112.781 0.029 A 92 SER H H 1 8.888 0.006 A 92 SER HA H 1 4.060 0.006 A 92 SER HBy H 1 4.220 0.014 A 92 SER HBx H 1 3.887 0.003 A 92 SER C C 13 175.026 0.020 A 92 SER CA C 13 61.527 0.065 A 92 SER CB C 13 62.856 0.098 A 92 SER N N 15 112.183 0.016 A 93 SER H H 1 7.736 0.005 A 93 SER HA H 1 4.680 0.011 A 93 SER HBy H 1 4.076 0.000 A 93 SER HBx H 1 3.992 0.007 A 93 SER C C 13 174.999 0.012 A 93 SER CA C 13 58.962 0.111 A 93 SER CB C 13 63.580 0.121 A 93 SER N N 15 116.126 0.024 A 94 GLY H H 1 8.817 0.005 A 94 GLY HAy H 1 4.474 0.005 A 94 GLY HAx H 1 3.590 0.009 A 94 GLY C C 13 175.020 0.023 A 94 GLY CA C 13 45.187 0.051 A 94 GLY N N 15 109.165 0.016 A 95 GLU H H 1 7.985 0.006 A 95 GLU HA H 1 4.637 0.004 A 95 GLU HB2 H 1 2.034 0.009 A 95 GLU HB3 H 1 2.034 0.009 A 95 GLU HG2 H 1 2.246 0.006 A 95 GLU HG3 H 1 2.246 0.006 A 95 GLU C C 13 175.608 0.008 A 95 GLU CA C 13 55.172 0.107 A 95 GLU CB C 13 30.581 0.103 A 95 GLU CG C 13 35.934 0.000 A 95 GLU N N 15 122.595 0.030 A 96 VAL H H 1 9.009 0.007 A 96 VAL HA H 1 4.031 0.009 A 96 VAL HB H 1 2.190 0.018 A 96 VAL HGx% H 1 0.987 0.015 A 96 VAL HGy% H 1 0.934 0.010 A 96 VAL C C 13 176.820 0.014 A 96 VAL CA C 13 63.829 0.113 A 96 VAL CB C 13 32.229 0.071 A 96 VAL CGy C 13 24.219 0.003 A 96 VAL CGx C 13 22.802 0.047 A 96 VAL N N 15 123.361 0.032 A 97 VAL H H 1 9.559 0.005 A 97 VAL HA H 1 4.261 0.004 A 97 VAL HB H 1 2.052 0.008 A 97 VAL HGx% H 1 1.041 0.007 A 97 VAL HGy% H 1 1.041 0.007 A 97 VAL C C 13 175.816 0.014 A 97 VAL CA C 13 63.184 0.099 A 97 VAL CB C 13 33.196 0.094 A 97 VAL CGy C 13 21.379 0.000 A 97 VAL CGx C 13 21.170 0.000 A 97 VAL N N 15 128.926 0.042 A 98 TYR H H 1 7.989 0.004 A 98 TYR HA H 1 4.838 0.010 A 98 TYR HBy H 1 3.244 0.010 A 98 TYR HBx H 1 2.258 0.006 A 98 TYR HDx H 1 6.691 0.012 A 98 TYR HDy H 1 6.691 0.012 A 98 TYR HEx H 1 6.709 0.007 A 98 TYR HEy H 1 6.709 0.007 A 98 TYR C C 13 171.407 0.019 A 98 TYR CA C 13 58.075 0.100 A 98 TYR CB C 13 41.286 0.088 A 98 TYR CDx C 13 132.429 0.049 A 98 TYR CDy C 13 132.429 0.049 A 98 TYR CEx C 13 119.531 0.064 A 98 TYR CEy C 13 119.531 0.064 A 98 TYR N N 15 119.655 0.027 A 99 ARG H H 1 7.027 0.010 A 99 ARG HA H 1 5.302 0.008 A 99 ARG HB2 H 1 1.628 0.011 A 99 ARG HB3 H 1 1.628 0.011 A 99 ARG HDy H 1 3.261 0.009 A 99 ARG HDx H 1 3.140 0.006 A 99 ARG HG2 H 1 1.354 0.007 A 99 ARG HG3 H 1 1.354 0.007 A 99 ARG C C 13 172.324 0.018 A 99 ARG CA C 13 54.086 0.092 A 99 ARG CB C 13 35.015 0.038 A 99 ARG CD C 13 43.744 0.044 A 99 ARG CG C 13 26.515 0.000 A 99 ARG N N 15 125.987 0.029 A 100 LEU H H 1 8.884 0.005 A 100 LEU HA H 1 4.671 0.007 A 100 LEU HBy H 1 1.932 0.008 A 100 LEU HBx H 1 1.700 0.010 A 100 LEU HDx% H 1 1.112 0.018 A 100 LEU HDy% H 1 1.152 0.011 A 100 LEU HG H 1 1.722 0.020 A 100 LEU C C 13 174.434 0.020 A 100 LEU CA C 13 54.134 0.063 A 100 LEU CB C 13 45.870 0.068 A 100 LEU CDy C 13 26.115 0.064 A 100 LEU CDx C 13 25.301 0.014 A 100 LEU CG C 13 27.682 0.001 A 100 LEU N N 15 125.913 0.031 A 101 VAL H H 1 8.611 0.008 A 101 VAL HA H 1 4.764 0.008 A 101 VAL HB H 1 1.961 0.007 A 101 VAL HGx% H 1 0.976 0.010 A 101 VAL HGy% H 1 0.796 0.011 A 101 VAL C C 13 176.438 0.016 A 101 VAL CA C 13 61.544 0.071 A 101 VAL CB C 13 33.330 0.094 A 101 VAL CGx C 13 20.893 0.000 A 101 VAL CGy C 13 21.086 0.026 A 101 VAL N N 15 126.194 0.029 A 102 GLY H H 1 8.247 0.004 A 102 GLY HAy H 1 4.533 0.009 A 102 GLY HAx H 1 3.593 0.007 A 102 GLY C C 13 171.628 0.019 A 102 GLY CA C 13 43.621 0.063 A 102 GLY N N 15 114.816 0.022 A 103 ALA H H 1 8.269 0.007 A 103 ALA HA H 1 4.347 0.006 A 103 ALA HB% H 1 1.300 0.006 A 103 ALA C C 13 176.362 0.013 A 103 ALA CA C 13 51.795 0.080 A 103 ALA CB C 13 20.284 0.050 A 103 ALA N N 15 120.356 0.033 A 104 GLU H H 1 7.329 0.006 A 104 GLU HA H 1 4.538 0.006 A 104 GLU HBy H 1 2.222 0.009 A 104 GLU HBx H 1 1.595 0.012 A 104 GLU HG2 H 1 2.231 0.000 A 104 GLU HG3 H 1 2.231 0.000 A 104 GLU C C 13 175.040 0.012 A 104 GLU CA C 13 54.914 0.084 A 104 GLU CB C 13 33.286 0.143 A 104 GLU CG C 13 35.975 0.000 A 104 GLU N N 15 120.152 0.029 A 105 ASP H H 1 8.554 0.007 A 105 ASP HA H 1 4.634 0.004 A 105 ASP HBy H 1 2.853 0.011 A 105 ASP HBx H 1 2.777 0.004 A 105 ASP C C 13 176.394 0.017 A 105 ASP CA C 13 54.107 0.055 A 105 ASP CB C 13 42.041 0.083 A 105 ASP N N 15 118.174 0.029 A 106 ALA H H 1 9.016 0.005 A 106 ALA HA H 1 4.103 0.009 A 106 ALA HB% H 1 1.632 0.007 A 106 ALA C C 13 174.735 0.000 A 106 ALA CA C 13 57.407 0.099 A 106 ALA CB C 13 16.979 0.092 A 106 ALA N N 15 120.985 0.021 A 107 PRO HA H 1 4.287 0.009 A 107 PRO HBy H 1 2.323 0.009 A 107 PRO HBx H 1 1.936 0.003 A 107 PRO HDy H 1 3.887 0.008 A 107 PRO HDx H 1 3.751 0.014 A 107 PRO HGy H 1 2.205 0.007 A 107 PRO HGx H 1 2.033 0.005 A 107 PRO C C 13 180.460 0.017 A 107 PRO CA C 13 66.077 0.033 A 107 PRO CB C 13 30.845 0.096 A 107 PRO CD C 13 49.800 0.010 A 107 PRO CG C 13 28.569 0.057 A 108 GLU H H 1 7.445 0.004 A 108 GLU HA H 1 4.116 0.006 A 108 GLU HBy H 1 2.208 0.003 A 108 GLU HBx H 1 2.042 0.009 A 108 GLU HG2 H 1 2.433 0.005 A 108 GLU HG3 H 1 2.433 0.005 A 108 GLU C C 13 178.177 0.015 A 108 GLU CA C 13 58.952 0.103 A 108 GLU CB C 13 30.123 0.133 A 108 GLU CG C 13 36.563 0.000 A 108 GLU N N 15 118.216 0.034 A 109 LEU H H 1 8.689 0.006 A 109 LEU HA H 1 3.856 0.007 A 109 LEU HBx H 1 1.616 0.025 A 109 LEU HBy H 1 1.905 0.013 A 109 LEU HDx% H 1 1.075 0.010 A 109 LEU HDy% H 1 0.958 0.009 A 109 LEU HG H 1 1.583 0.014 A 109 LEU C C 13 178.311 0.005 A 109 LEU CA C 13 59.264 0.098 A 109 LEU CB C 13 42.015 0.111 A 109 LEU CDx C 13 26.060 0.020 A 109 LEU CDy C 13 26.503 0.027 A 109 LEU CG C 13 27.523 0.000 A 109 LEU N N 15 120.924 0.023 A 110 LEU H H 1 8.125 0.005 A 110 LEU HA H 1 3.821 0.015 A 110 LEU HBy H 1 1.630 0.010 A 110 LEU HBx H 1 1.532 0.014 A 110 LEU HDx% H 1 0.789 0.007 A 110 LEU HDy% H 1 0.685 0.013 A 110 LEU HG H 1 1.638 0.001 A 110 LEU C C 13 177.806 0.016 A 110 LEU CA C 13 57.976 0.059 A 110 LEU CB C 13 41.895 0.083 A 110 LEU CDy C 13 25.064 0.035 A 110 LEU CDx C 13 24.009 0.028 A 110 LEU CG C 13 27.653 0.006 A 110 LEU N N 15 116.606 0.048 A 111 LYS H H 1 7.427 0.006 A 111 LYS HA H 1 3.812 0.005 A 111 LYS HB2 H 1 1.888 0.010 A 111 LYS HB3 H 1 1.888 0.010 A 111 LYS HD2 H 1 1.725 0.000 A 111 LYS HD3 H 1 1.725 0.000 A 111 LYS HE2 H 1 2.944 0.000 A 111 LYS HE3 H 1 2.944 0.000 A 111 LYS HGy H 1 1.549 0.011 A 111 LYS HGx H 1 1.319 0.007 A 111 LYS C C 13 179.380 0.019 A 111 LYS CA C 13 59.762 0.087 A 111 LYS CB C 13 32.855 0.080 A 111 LYS CD C 13 29.485 0.000 A 111 LYS CE C 13 41.941 0.000 A 111 LYS CG C 13 24.794 0.001 A 111 LYS N N 15 117.297 0.059 A 112 LYS H H 1 8.093 0.004 A 112 LYS HA H 1 3.895 0.006 A 112 LYS HBy H 1 2.240 0.008 A 112 LYS HBx H 1 2.001 0.019 A 112 LYS HDy H 1 1.751 0.018 A 112 LYS HDx H 1 1.657 0.015 A 112 LYS HE2 H 1 3.061 0.006 A 112 LYS HE3 H 1 3.061 0.006 A 112 LYS HGx H 1 1.444 0.003 A 112 LYS HGy H 1 1.861 0.014 A 112 LYS C C 13 179.584 0.014 A 112 LYS CA C 13 60.387 0.047 A 112 LYS CB C 13 32.876 0.048 A 112 LYS CD C 13 30.152 0.052 A 112 LYS CE C 13 42.181 0.000 A 112 LYS CG C 13 27.470 0.007 A 112 LYS N N 15 117.689 0.031 A 113 VAL H H 1 8.547 0.005 A 113 VAL HA H 1 3.233 0.007 A 113 VAL HB H 1 1.992 0.006 A 113 VAL HGx% H 1 1.196 0.008 A 113 VAL HGy% H 1 0.496 0.008 A 113 VAL C C 13 176.883 0.015 A 113 VAL CA C 13 66.867 0.049 A 113 VAL CB C 13 32.181 0.044 A 113 VAL CGy C 13 24.507 0.024 A 113 VAL CGx C 13 21.301 0.102 A 113 VAL N N 15 120.145 0.034 A 114 LYS H H 1 8.054 0.007 A 114 LYS HA H 1 3.641 0.007 A 114 LYS HB2 H 1 1.542 0.004 A 114 LYS HB3 H 1 1.542 0.004 A 114 LYS HDy H 1 1.388 0.007 A 114 LYS HDx H 1 1.384 0.012 A 114 LYS HEy H 1 2.705 0.006 A 114 LYS HEx H 1 2.521 0.002 A 114 LYS HGy H 1 1.135 0.006 A 114 LYS HGx H 1 0.953 0.010 A 114 LYS C C 13 179.148 0.012 A 114 LYS CA C 13 60.484 0.057 A 114 LYS CB C 13 32.494 0.085 A 114 LYS CD C 13 29.565 0.010 A 114 LYS CE C 13 41.518 0.034 A 114 LYS CG C 13 25.778 0.038 A 114 LYS N N 15 117.933 0.028 A 115 LEU H H 1 7.209 0.007 A 115 LEU HA H 1 3.986 0.008 A 115 LEU HBy H 1 1.654 0.007 A 115 LEU HBx H 1 1.476 0.008 A 115 LEU HDx% H 1 0.867 0.008 A 115 LEU HDy% H 1 0.858 0.003 A 115 LEU HG H 1 1.651 0.000 A 115 LEU C C 13 179.553 0.000 A 115 LEU CA C 13 57.315 0.083 A 115 LEU CB C 13 42.186 0.076 A 115 LEU CDy C 13 24.817 0.008 A 115 LEU CDx C 13 23.711 0.007 A 115 LEU CG C 13 27.020 0.000 A 115 LEU N N 15 116.238 0.030 A 116 GLY H H 1 7.736 0.006 A 116 GLY HAx H 1 1.941 0.009 A 116 GLY HAy H 1 3.341 0.005 A 116 GLY C C 13 175.588 0.014 A 116 GLY CA C 13 45.493 0.060 A 116 GLY N N 15 107.078 0.029 A 117 VAL H H 1 7.857 0.006 A 117 VAL HA H 1 4.225 0.004 A 117 VAL HB H 1 2.213 0.008 A 117 VAL HGx% H 1 0.714 0.006 A 117 VAL HGy% H 1 0.487 0.011 A 117 VAL C C 13 177.171 0.008 A 117 VAL CA C 13 62.282 0.046 A 117 VAL CB C 13 32.190 0.078 A 117 VAL CGx C 13 19.302 0.013 A 117 VAL CGy C 13 20.882 0.017 A 117 VAL N N 15 111.254 0.022 A 118 GLU H H 1 7.670 0.006 A 118 GLU HA H 1 4.232 0.008 A 118 GLU HBy H 1 2.059 0.003 A 118 GLU HBx H 1 1.974 0.008 A 118 GLU HGx H 1 2.060 0.003 A 118 GLU HGy H 1 2.379 0.004 A 118 GLU C C 13 177.462 0.025 A 118 GLU CA C 13 57.609 0.061 A 118 GLU CB C 13 29.359 0.135 A 118 GLU CG C 13 36.906 0.013 A 118 GLU N N 15 120.973 0.020 A 119 SER H H 1 7.970 0.003 A 119 SER HA H 1 4.401 0.004 A 119 SER HBy H 1 3.925 0.009 A 119 SER HBx H 1 3.902 0.011 A 119 SER C C 13 174.903 0.017 A 119 SER CA C 13 59.231 0.110 A 119 SER CB C 13 63.799 0.168 A 119 SER N N 15 115.373 0.066 A 120 GLU H H 1 8.248 0.005 A 120 GLU HA H 1 4.301 0.006 A 120 GLU HBy H 1 2.156 0.003 A 120 GLU HBx H 1 1.969 0.000 A 120 GLU HG2 H 1 2.339 0.000 A 120 GLU HG3 H 1 2.339 0.000 A 120 GLU C C 13 177.117 0.010 A 120 GLU CA C 13 56.991 0.100 A 120 GLU CB C 13 30.152 0.171 A 120 GLU CG C 13 36.164 0.000 A 120 GLU N N 15 121.683 0.036 A 121 GLY H H 1 8.277 0.003 A 121 GLY HA2 H 1 3.919 0.000 A 121 GLY HA3 H 1 3.919 0.000 A 121 GLY C C 13 174.246 0.000 A 121 GLY CA C 13 45.578 0.082 A 121 GLY N N 15 108.637 0.038 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _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 3 ALA H A 3 ALA HB% 1.0 1.8 7.5 2 2 A 4 ASP H A 4 ASP HBy 1.0 1.8 7.0 3 3 A 4 ASP H A 4 ASP HBx 1.0 1.8 7.0 4 4 A 6 ILE HA A 6 ILE HD1% 1.0 1.8 7.5 5 5 A 6 ILE HA A 6 ILE HG1y 1.0 1.8 4.0 6 6 A 6 ILE HA A 6 ILE HG1x 1.0 1.8 5.0 7 7 A 6 ILE HA A 6 ILE HG2% 1.0 1.8 5.5 8 8 A 6 ILE HD1% A 6 ILE HB 1.0 1.8 7.5 9 9 A 6 ILE HD1% A 6 ILE HG1y 1.0 1.8 7.5 10 10 A 6 ILE HD1% A 6 ILE HG1x 1.0 1.8 7.5 11 11 A 6 ILE HD1% A 6 ILE HG2% 1.0 1.8 8.0 12 12 A 6 ILE HB A 6 ILE H 1.0 1.8 3.5 13 13 A 6 ILE HD1% A 6 ILE H 1.0 1.8 7.5 14 14 A 6 ILE HG1y A 6 ILE H 1.0 1.8 5.0 15 15 A 6 ILE HG1x A 6 ILE H 1.0 1.8 3.5 16 16 A 6 ILE HG2% A 6 ILE H 1.0 1.8 7.5 17 17 A 7 ALA H A 7 ALA HB% 1.0 1.8 5.0 18 18 A 8 PHE HA A 8 PHE HD% 1.0 1.8 5.0 19 19 A 8 PHE HA A 8 PHE HE% 1.0 1.8 7.5 20 20 A 8 PHE HD% A 8 PHE HBy 1.0 1.8 5.0 21 21 A 8 PHE HE% A 8 PHE HBy 1.0 1.8 7.5 22 22 A 8 PHE HD% A 8 PHE HBx 1.0 1.8 5.5 23 23 A 8 PHE HE% A 8 PHE HBx 1.0 1.8 7.5 24 24 A 8 PHE HBy A 8 PHE H 1.0 1.8 4.0 25 25 A 8 PHE HBx A 8 PHE H 1.0 1.8 3.5 26 26 A 8 PHE HD% A 8 PHE H 1.0 1.8 5.0 27 27 A 8 PHE HE% A 8 PHE H 1.0 1.8 7.5 28 28 A 9 ARG HA A 9 ARG HDy 1.0 1.8 5.5 29 29 A 9 ARG HA A 9 ARG HDx 1.0 1.8 5.5 30 30 A 9 ARG HDx A 9 ARG HBx 1.0 1.8 3.5 31 30 A 9 ARG HDx A 9 ARG HBy 1.0 1.8 3.5 32 31 A 9 ARG HDy A 9 ARG HGy 1.0 1.8 3.0 33 32 A 9 ARG HDx A 9 ARG HGx 1.0 1.8 3.5 34 32 A 9 ARG HDx A 9 ARG HGy 1.0 1.8 3.5 35 33 A 9 ARG HBy A 9 ARG H 1.0 1.8 4.0 36 34 A 9 ARG H A 9 ARG HBx 1.0 1.8 4.0 37 35 A 9 ARG HDy A 9 ARG H 1.0 1.8 7.0 38 36 A 9 ARG HDx A 9 ARG H 1.0 1.8 7.0 39 37 A 9 ARG HGy A 9 ARG H 1.0 1.8 4.0 40 38 A 9 ARG H A 9 ARG HGx 1.0 1.8 4.0 41 39 A 11 LEU HA A 11 LEU HDx% 1.0 1.8 5.0 42 39 A 11 LEU HA A 11 LEU HDy% 1.0 1.8 5.0 43 40 A 11 LEU HA A 11 LEU HDy% 1.0 1.8 7.5 44 40 A 11 LEU HA A 11 LEU HDx% 1.0 1.8 7.5 45 41 A 11 LEU HBy A 11 LEU HDx% 1.0 1.8 7.5 46 41 A 11 LEU HDy% A 11 LEU HBy 1.0 1.8 7.5 47 42 A 11 LEU HDy% A 11 LEU HBy 1.0 1.8 7.5 48 42 A 11 LEU HBy A 11 LEU HDx% 1.0 1.8 7.5 49 43 A 11 LEU HBx A 11 LEU HDx% 1.0 1.8 7.5 50 43 A 11 LEU HDy% A 11 LEU HBx 1.0 1.8 7.5 51 44 A 11 LEU HDy% A 11 LEU HBx 1.0 1.8 5.5 52 44 A 11 LEU HBx A 11 LEU HDx% 1.0 1.8 5.5 53 45 A 11 LEU HBy A 11 LEU H 1.0 1.8 4.0 54 46 A 11 LEU HBx A 11 LEU H 1.0 1.8 3.5 55 47 A 11 LEU H A 11 LEU HDx% 1.0 1.8 7.5 56 47 A 11 LEU HDy% A 11 LEU H 1.0 1.8 7.5 57 48 A 11 LEU HDy% A 11 LEU H 1.0 1.8 7.5 58 48 A 11 LEU H A 11 LEU HDx% 1.0 1.8 7.5 59 49 A 12 SER H A 12 SER HA 1.0 1.8 3.0 60 50 A 12 SER H A 12 SER HBy 1.0 1.8 4.0 61 51 A 12 SER H A 12 SER HBx 1.0 1.8 4.0 62 52 A 13 PHE HA A 13 PHE HD% 1.0 1.8 5.5 63 53 A 13 PHE HA A 13 PHE HE% 1.0 1.8 7.5 64 54 A 13 PHE HD% A 13 PHE HBy 1.0 1.8 5.5 65 55 A 13 PHE HD% A 13 PHE HBx 1.0 1.8 5.5 66 56 A 13 PHE HE% A 13 PHE HBx 1.0 1.8 7.5 67 57 A 13 PHE HBy A 13 PHE H 1.0 1.8 4.0 68 58 A 13 PHE HBx A 13 PHE H 1.0 1.8 4.0 69 59 A 13 PHE HD% A 13 PHE H 1.0 1.8 7.5 70 60 A 14 PRO HA A 14 PRO HGx 1.0 1.8 4.0 71 61 A 14 PRO HBy A 14 PRO HDy 1.0 1.8 5.0 72 62 A 14 PRO HBy A 14 PRO HDx 1.0 1.8 5.0 73 63 A 14 PRO HDy A 14 PRO HBx 1.0 1.8 5.0 74 64 A 14 PRO HDx A 14 PRO HBx 1.0 1.8 5.0 75 65 A 14 PRO HDy A 14 PRO HGy 1.0 1.8 3.5 76 66 A 14 PRO HGx A 14 PRO HDy 1.0 1.8 4.0 77 67 A 14 PRO HDx A 14 PRO HGy 1.0 1.8 4.0 78 68 A 14 PRO HGx A 14 PRO HDx 1.0 1.8 4.0 79 69 A 15 GLU H A 15 GLU HBy 1.0 1.8 3.0 80 70 A 15 GLU H A 15 GLU HBx 1.0 1.8 3.5 81 71 A 15 GLU H A 15 GLU HG2 1.0 1.8 3.5 82 71 A 15 GLU H A 15 GLU HG3 1.0 1.8 3.5 83 72 A 16 ALA H A 16 ALA HA 1.0 1.8 4.0 84 73 A 16 ALA H A 16 ALA HB% 1.0 1.8 5.0 85 74 A 17 LEU HA A 17 LEU HDy% 1.0 1.8 5.5 86 74 A 17 LEU HA A 17 LEU HDx% 1.0 1.8 5.5 87 75 A 17 LEU H A 17 LEU HBy 1.0 1.8 4.0 88 76 A 17 LEU H A 17 LEU HBx 1.0 1.8 4.0 89 77 A 17 LEU H A 17 LEU HDy% 1.0 1.8 5.5 90 77 A 17 LEU H A 17 LEU HDx% 1.0 1.8 5.5 91 78 A 17 LEU H A 17 LEU HDy% 1.0 1.8 5.5 92 78 A 17 LEU H A 17 LEU HDx% 1.0 1.8 5.5 93 79 A 18 LYS H A 18 LYS HBy 1.0 1.8 3.0 94 80 A 18 LYS H A 18 LYS HBx 1.0 1.8 3.0 95 81 A 18 LYS H A 18 LYS HDy 1.0 1.8 5.5 96 82 A 18 LYS H A 18 LYS HDx 1.0 1.8 5.5 97 83 A 18 LYS H A 18 LYS HG2 1.0 1.8 5.0 98 83 A 18 LYS H A 18 LYS HG3 1.0 1.8 5.0 99 84 A 19 ARG HA A 19 ARG HDy 1.0 1.8 4.0 100 85 A 19 ARG HA A 19 ARG HDx 1.0 1.8 3.5 101 86 A 19 ARG HA A 19 ARG HGy 1.0 1.8 5.0 102 87 A 19 ARG HA A 19 ARG HGx 1.0 1.8 5.0 103 88 A 19 ARG HDy A 19 ARG HBx 1.0 1.8 4.0 104 89 A 19 ARG HDx A 19 ARG HBx 1.0 1.8 4.0 105 90 A 19 ARG HDx A 19 ARG HBx 1.0 1.8 3.5 106 90 A 19 ARG HDx A 19 ARG HBy 1.0 1.8 3.5 107 91 A 19 ARG HDy A 19 ARG HGy 1.0 1.8 3.5 108 92 A 19 ARG HDy A 19 ARG HGx 1.0 1.8 4.0 109 93 A 19 ARG HDx A 19 ARG HGy 1.0 1.8 5.0 110 94 A 19 ARG HDx A 19 ARG HGx 1.0 1.8 3.5 111 95 A 19 ARG HBy A 19 ARG H 1.0 1.8 3.0 112 96 A 19 ARG H A 19 ARG HBx 1.0 1.8 3.5 113 97 A 19 ARG HDy A 19 ARG H 1.0 1.8 7.0 114 98 A 19 ARG HDx A 19 ARG H 1.0 1.8 7.0 115 99 A 19 ARG HGx A 19 ARG H 1.0 1.8 4.0 116 100 A 20 ALA H A 20 ALA HB% 1.0 1.8 5.0 117 101 A 21 GLU H A 21 GLU HB2 1.0 1.8 3.5 118 101 A 21 GLU H A 21 GLU HB3 1.0 1.8 3.5 119 102 A 21 GLU H A 21 GLU HGy 1.0 1.8 5.0 120 103 A 21 GLU H A 21 GLU HGx 1.0 1.8 5.0 121 104 A 22 VAL HA A 22 VAL HGx% 1.0 1.8 5.0 122 105 A 22 VAL HA A 22 VAL HGy% 1.0 1.8 5.0 123 106 A 22 VAL H A 22 VAL HB 1.0 1.8 4.0 124 107 A 22 VAL HGx% A 22 VAL H 1.0 1.8 5.5 125 108 A 22 VAL HGy% A 22 VAL H 1.0 1.8 5.0 126 109 A 23 GLU HA A 23 GLU HG2 1.0 1.8 3.5 127 109 A 23 GLU HA A 23 GLU HG3 1.0 1.8 3.5 128 110 A 23 GLU H A 23 GLU HBy 1.0 1.8 3.5 129 111 A 23 GLU H A 23 GLU HBx 1.0 1.8 4.0 130 112 A 24 ASP H A 24 ASP HBy 1.0 1.8 4.0 131 113 A 24 ASP H A 24 ASP HBx 1.0 1.8 5.0 132 114 A 25 LYS HA A 25 LYS HDy 1.0 1.8 7.0 133 115 A 25 LYS HA A 25 LYS HDx 1.0 1.8 7.0 134 116 A 25 LYS HA A 25 LYS HGy 1.0 1.8 5.0 135 117 A 25 LYS HA A 25 LYS HGx 1.0 1.8 5.0 136 118 A 25 LYS HBy A 25 LYS HE2 1.0 1.8 7.0 137 118 A 25 LYS HBy A 25 LYS HE3 1.0 1.8 7.0 138 119 A 25 LYS HDy A 25 LYS HBx 1.0 1.8 5.0 139 120 A 25 LYS HBx A 25 LYS HE2 1.0 1.8 7.0 140 120 A 25 LYS HE3 A 25 LYS HBx 1.0 1.8 7.0 141 121 A 25 LYS HGy A 25 LYS HE2 1.0 1.8 5.0 142 121 A 25 LYS HGy A 25 LYS HE3 1.0 1.8 5.0 143 122 A 25 LYS HGx A 25 LYS HE2 1.0 1.8 5.0 144 122 A 25 LYS HGx A 25 LYS HE3 1.0 1.8 5.0 145 123 A 25 LYS HBy A 25 LYS H 1.0 1.8 4.0 146 124 A 25 LYS HBx A 25 LYS H 1.0 1.8 4.0 147 125 A 25 LYS HGy A 25 LYS H 1.0 1.8 5.0 148 126 A 25 LYS HGx A 25 LYS H 1.0 1.8 5.0 149 127 A 26 LEU HA A 26 LEU HDy% 1.0 1.8 7.5 150 127 A 26 LEU HA A 26 LEU HDx% 1.0 1.8 7.5 151 128 A 26 LEU HBy A 26 LEU HDy% 1.0 1.8 5.5 152 128 A 26 LEU HBy A 26 LEU HDx% 1.0 1.8 5.5 153 129 A 26 LEU HBx A 26 LEU HDy% 1.0 1.8 5.5 154 129 A 26 LEU HBx A 26 LEU HDx% 1.0 1.8 5.5 155 130 A 26 LEU HG A 26 LEU HDy% 1.0 1.8 5.0 156 130 A 26 LEU HG A 26 LEU HDx% 1.0 1.8 5.0 157 131 A 26 LEU HBy A 26 LEU H 1.0 1.8 4.0 158 132 A 26 LEU HBx A 26 LEU H 1.0 1.8 5.0 159 133 A 26 LEU H A 26 LEU HDx% 1.0 1.8 7.5 160 133 A 26 LEU H A 26 LEU HDy% 1.0 1.8 7.5 161 134 A 26 LEU H A 26 LEU HDy% 1.0 1.8 7.5 162 134 A 26 LEU H A 26 LEU HDx% 1.0 1.8 7.5 163 135 A 26 LEU HG A 26 LEU H 1.0 1.8 5.0 164 136 A 27 LEU HA A 27 LEU HDx% 1.0 1.8 5.5 165 136 A 27 LEU HA A 27 LEU HDy% 1.0 1.8 5.5 166 137 A 27 LEU HA A 27 LEU HDy% 1.0 1.8 7.5 167 137 A 27 LEU HA A 27 LEU HDx% 1.0 1.8 7.5 168 138 A 27 LEU HA A 27 LEU HG 1.0 1.8 7.0 169 139 A 27 LEU HBy A 27 LEU HDx% 1.0 1.8 7.5 170 139 A 27 LEU HDy% A 27 LEU HBy 1.0 1.8 7.5 171 140 A 27 LEU HDy% A 27 LEU HBy 1.0 1.8 7.5 172 140 A 27 LEU HBy A 27 LEU HDx% 1.0 1.8 7.5 173 141 A 27 LEU HBx A 27 LEU HDx% 1.0 1.8 5.5 174 141 A 27 LEU HDy% A 27 LEU HBx 1.0 1.8 5.5 175 142 A 27 LEU HDy% A 27 LEU HBx 1.0 1.8 7.5 176 142 A 27 LEU HBx A 27 LEU HDx% 1.0 1.8 7.5 177 143 A 27 LEU HBy A 27 LEU H 1.0 1.8 4.0 178 144 A 27 LEU HBx A 27 LEU H 1.0 1.8 4.0 179 145 A 27 LEU H A 27 LEU HDx% 1.0 1.8 7.5 180 145 A 27 LEU HDy% A 27 LEU H 1.0 1.8 7.5 181 146 A 27 LEU HDy% A 27 LEU H 1.0 1.8 7.5 182 146 A 27 LEU H A 27 LEU HDx% 1.0 1.8 7.5 183 147 A 27 LEU HG A 27 LEU H 1.0 1.8 5.0 184 148 A 28 PHE HA A 28 PHE HD% 1.0 1.8 5.5 185 149 A 28 PHE HD% A 28 PHE HBy 1.0 1.8 7.5 186 150 A 28 PHE HBy A 28 PHE HE% 1.0 1.8 7.5 187 151 A 28 PHE HD% A 28 PHE HBx 1.0 1.8 5.5 188 152 A 28 PHE HBy A 28 PHE H 1.0 1.8 5.0 189 153 A 28 PHE HBx A 28 PHE H 1.0 1.8 4.0 190 154 A 28 PHE HD% A 28 PHE H 1.0 1.8 7.5 191 155 A 29 VAL HA A 29 VAL HGx% 1.0 1.8 5.5 192 156 A 29 VAL H A 29 VAL HB 1.0 1.8 4.0 193 157 A 29 VAL HGx% A 29 VAL H 1.0 1.8 5.5 194 158 A 29 VAL H A 29 VAL HGy% 1.0 1.8 7.5 195 159 A 30 ASP H A 30 ASP HB2 1.0 1.8 3.5 196 159 A 30 ASP H A 30 ASP HB3 1.0 1.8 3.5 197 160 A 31 CYS H A 31 CYS HBy 1.0 1.8 4.0 198 161 A 31 CYS H A 31 CYS HBx 1.0 1.8 5.0 199 162 A 32 PHE HA A 32 PHE HD% 1.0 1.8 5.5 200 163 A 32 PHE HD% A 32 PHE HB2 1.0 1.8 5.0 201 163 A 32 PHE HD% A 32 PHE HB3 1.0 1.8 5.0 202 164 A 32 PHE H A 32 PHE HB2 1.0 1.8 5.0 203 164 A 32 PHE HB3 A 32 PHE H 1.0 1.8 5.0 204 165 A 32 PHE HD% A 32 PHE H 1.0 1.8 5.5 205 166 A 33 THR HA A 33 THR HG2% 1.0 1.8 7.5 206 167 A 33 THR H A 33 THR HB 1.0 1.8 5.0 207 168 A 33 THR HG2% A 33 THR H 1.0 1.8 7.5 208 169 A 34 THR HA A 34 THR HG2% 1.0 1.8 5.0 209 170 A 34 THR H A 34 THR HB 1.0 1.8 7.0 210 171 A 34 THR HG2% A 34 THR H 1.0 1.8 7.5 211 172 A 35 TRP HA A 35 TRP HD1 1.0 1.8 5.0 212 173 A 35 TRP HA A 35 TRP HE3 1.0 1.8 7.0 213 174 A 35 TRP HD1 A 35 TRP HBy 1.0 1.8 4.0 214 175 A 35 TRP HE3 A 35 TRP HBy 1.0 1.8 7.0 215 176 A 35 TRP HD1 A 35 TRP HBx 1.0 1.8 5.0 216 177 A 35 TRP HE3 A 35 TRP HBx 1.0 1.8 7.0 217 178 A 35 TRP HBy A 35 TRP H 1.0 1.8 5.0 218 179 A 35 TRP HBx A 35 TRP H 1.0 1.8 7.0 219 180 A 35 TRP HD1 A 35 TRP H 1.0 1.8 5.0 220 181 A 36 CYS H A 36 CYS HBy 1.0 1.8 7.0 221 182 A 36 CYS H A 36 CYS HBx 1.0 1.8 5.0 222 183 A 38 PRO HA A 38 PRO HGy 1.0 1.8 5.0 223 184 A 38 PRO HA A 38 PRO HGx 1.0 1.8 4.0 224 185 A 38 PRO HBy A 38 PRO HDy 1.0 1.8 4.0 225 186 A 38 PRO HBy A 38 PRO HDx 1.0 1.8 7.0 226 187 A 38 PRO HDy A 38 PRO HBx 1.0 1.8 5.0 227 188 A 38 PRO HDx A 38 PRO HBx 1.0 1.8 7.0 228 189 A 38 PRO HGy A 38 PRO HDy 1.0 1.8 5.0 229 190 A 38 PRO HGx A 38 PRO HDy 1.0 1.8 4.0 230 191 A 38 PRO HGy A 38 PRO HDx 1.0 1.8 5.0 231 192 A 38 PRO HGx A 38 PRO HDx 1.0 1.8 5.0 232 193 A 39 CYS H A 39 CYS HBy 1.0 1.8 7.0 233 194 A 39 CYS H A 39 CYS HBx 1.0 1.8 5.0 234 195 A 40 LYS H A 40 LYS HBy 1.0 1.8 3.5 235 196 A 40 LYS H A 40 LYS HBx 1.0 1.8 4.0 236 197 A 40 LYS H A 40 LYS HD2 1.0 1.8 5.0 237 197 A 40 LYS H A 40 LYS HD3 1.0 1.8 5.0 238 198 A 40 LYS H A 40 LYS HE2 1.0 1.8 7.0 239 198 A 40 LYS H A 40 LYS HE3 1.0 1.8 7.0 240 199 A 40 LYS H A 40 LYS HGy 1.0 1.8 5.0 241 200 A 40 LYS H A 40 LYS HGx 1.0 1.8 5.0 242 201 A 41 ARG HA A 41 ARG HDy 1.0 1.8 5.0 243 202 A 41 ARG HA A 41 ARG HDx 1.0 1.8 5.0 244 203 A 41 ARG HBx A 41 ARG HDy 1.0 1.8 3.5 245 204 A 41 ARG HBx A 41 ARG HDx 1.0 1.8 3.5 246 205 A 41 ARG HGy A 41 ARG HDy 1.0 1.8 3.5 247 206 A 41 ARG HGy A 41 ARG HDx 1.0 1.8 3.5 248 207 A 41 ARG H A 41 ARG HBy 1.0 1.8 3.5 249 208 A 41 ARG HBx A 41 ARG H 1.0 1.8 3.5 250 209 A 41 ARG H A 41 ARG HGx 1.0 1.8 5.0 251 210 A 42 LEU HA A 42 LEU HDx% 1.0 1.8 7.5 252 210 A 42 LEU HA A 42 LEU HDy% 1.0 1.8 7.5 253 211 A 42 LEU HA A 42 LEU HDy% 1.0 1.8 5.5 254 211 A 42 LEU HA A 42 LEU HDx% 1.0 1.8 5.5 255 212 A 42 LEU HBy A 42 LEU HDx% 1.0 1.8 5.0 256 212 A 42 LEU HDy% A 42 LEU HBy 1.0 1.8 5.0 257 213 A 42 LEU HDy% A 42 LEU HBy 1.0 1.8 5.5 258 213 A 42 LEU HBy A 42 LEU HDx% 1.0 1.8 5.5 259 214 A 42 LEU HBx A 42 LEU HDx% 1.0 1.8 5.5 260 214 A 42 LEU HDy% A 42 LEU HBx 1.0 1.8 5.5 261 215 A 42 LEU HDy% A 42 LEU HBx 1.0 1.8 7.5 262 215 A 42 LEU HBx A 42 LEU HDx% 1.0 1.8 7.5 263 216 A 42 LEU HG A 42 LEU HDx% 1.0 1.8 4.0 264 216 A 42 LEU HDy% A 42 LEU HG 1.0 1.8 4.0 265 217 A 42 LEU HBy A 42 LEU H 1.0 1.8 4.0 266 218 A 42 LEU HBx A 42 LEU H 1.0 1.8 5.0 267 219 A 42 LEU H A 42 LEU HDx% 1.0 1.8 7.5 268 219 A 42 LEU HDy% A 42 LEU H 1.0 1.8 7.5 269 220 A 42 LEU HDy% A 42 LEU H 1.0 1.8 7.5 270 220 A 42 LEU H A 42 LEU HDx% 1.0 1.8 7.5 271 221 A 42 LEU HG A 42 LEU H 1.0 1.8 5.0 272 222 A 43 SER H A 43 SER HBy 1.0 1.8 3.5 273 223 A 43 SER H A 43 SER HBx 1.0 1.8 4.0 274 224 A 44 LYS H A 44 LYS HB2 1.0 1.8 3.0 275 224 A 44 LYS H A 44 LYS HB3 1.0 1.8 3.0 276 225 A 44 LYS H A 44 LYS HD2 1.0 1.8 5.0 277 225 A 44 LYS H A 44 LYS HD3 1.0 1.8 5.0 278 226 A 44 LYS H A 44 LYS HGy 1.0 1.8 5.0 279 227 A 44 LYS H A 44 LYS HGx 1.0 1.8 5.0 280 228 A 45 VAL HA A 45 VAL HG1% 1.0 1.8 3.5 281 228 A 45 VAL HA A 45 VAL HG2% 1.0 1.8 3.5 282 229 A 45 VAL H A 45 VAL HB 1.0 1.8 3.5 283 230 A 45 VAL H A 45 VAL HG1% 1.0 1.8 4.0 284 230 A 45 VAL HG2% A 45 VAL H 1.0 1.8 4.0 285 231 A 46 VAL HA A 46 VAL HGx% 1.0 1.8 5.0 286 232 A 46 VAL HA A 46 VAL HGy% 1.0 1.8 5.0 287 233 A 46 VAL H A 46 VAL HB 1.0 1.8 4.0 288 234 A 46 VAL HGx% A 46 VAL H 1.0 1.8 5.0 289 235 A 46 VAL HGy% A 46 VAL H 1.0 1.8 5.5 290 236 A 47 PHE HA A 47 PHE HD% 1.0 1.8 5.0 291 237 A 47 PHE HA A 47 PHE HE% 1.0 1.8 7.5 292 238 A 47 PHE HD% A 47 PHE HB2 1.0 1.8 5.5 293 238 A 47 PHE HD% A 47 PHE HB3 1.0 1.8 5.5 294 239 A 47 PHE HE% A 47 PHE HB2 1.0 1.8 7.5 295 239 A 47 PHE HE% A 47 PHE HB3 1.0 1.8 7.5 296 240 A 47 PHE H A 47 PHE HB2 1.0 1.8 3.5 297 240 A 47 PHE HB3 A 47 PHE H 1.0 1.8 3.5 298 241 A 47 PHE HD% A 47 PHE H 1.0 1.8 5.5 299 242 A 47 PHE HE% A 47 PHE H 1.0 1.8 7.5 300 243 A 48 LYS HA A 48 LYS HGy 1.0 1.8 4.0 301 244 A 48 LYS HA A 48 LYS HGx 1.0 1.8 4.0 302 245 A 48 LYS H A 48 LYS HBy 1.0 1.8 3.5 303 246 A 48 LYS H A 48 LYS HBx 1.0 1.8 4.0 304 247 A 48 LYS HGy A 48 LYS H 1.0 1.8 5.0 305 248 A 48 LYS HGx A 48 LYS H 1.0 1.8 5.0 306 249 A 49 ASP H A 49 ASP HBy 1.0 1.8 3.5 307 250 A 49 ASP H A 49 ASP HBx 1.0 1.8 3.5 308 251 A 50 SER H A 50 SER HBy 1.0 1.8 4.0 309 252 A 51 LEU HA A 51 LEU HDx% 1.0 1.8 5.5 310 252 A 51 LEU HA A 51 LEU HDy% 1.0 1.8 5.5 311 253 A 51 LEU HBx A 51 LEU HDx% 1.0 1.8 5.5 312 253 A 51 LEU HDy% A 51 LEU HBx 1.0 1.8 5.5 313 254 A 51 LEU H A 51 LEU HBy 1.0 1.8 3.5 314 255 A 51 LEU HBx A 51 LEU H 1.0 1.8 3.5 315 256 A 51 LEU H A 51 LEU HDx% 1.0 1.8 7.5 316 256 A 51 LEU HDy% A 51 LEU H 1.0 1.8 7.5 317 257 A 51 LEU HDy% A 51 LEU H 1.0 1.8 7.5 318 257 A 51 LEU H A 51 LEU HDx% 1.0 1.8 7.5 319 258 A 51 LEU H A 51 LEU HG 1.0 1.8 5.0 320 259 A 52 VAL HA A 52 VAL HGx% 1.0 1.8 5.0 321 260 A 52 VAL HA A 52 VAL HGy% 1.0 1.8 5.0 322 261 A 52 VAL H A 52 VAL HB 1.0 1.8 3.5 323 262 A 52 VAL HGx% A 52 VAL H 1.0 1.8 5.0 324 263 A 52 VAL HGy% A 52 VAL H 1.0 1.8 7.5 325 264 A 53 ALA H A 53 ALA HB% 1.0 1.8 5.0 326 265 A 54 ASP H A 54 ASP HBy 1.0 1.8 3.5 327 266 A 54 ASP H A 54 ASP HBx 1.0 1.8 4.0 328 267 A 55 TYR HA A 55 TYR HD% 1.0 1.8 5.5 329 268 A 55 TYR HA A 55 TYR HE% 1.0 1.8 7.5 330 269 A 55 TYR HD% A 55 TYR HBy 1.0 1.8 5.0 331 270 A 55 TYR HE% A 55 TYR HBy 1.0 1.8 7.5 332 271 A 55 TYR HD% A 55 TYR HBx 1.0 1.8 5.0 333 272 A 55 TYR HE% A 55 TYR HBx 1.0 1.8 7.5 334 273 A 55 TYR HBy A 55 TYR H 1.0 1.8 3.5 335 274 A 55 TYR HBx A 55 TYR H 1.0 1.8 3.5 336 275 A 55 TYR HD% A 55 TYR H 1.0 1.8 5.5 337 276 A 56 PHE HA A 56 PHE HD% 1.0 1.8 7.5 338 277 A 56 PHE HA A 56 PHE HE% 1.0 1.8 7.5 339 278 A 56 PHE HD% A 56 PHE HBy 1.0 1.8 5.0 340 279 A 56 PHE HE% A 56 PHE HBy 1.0 1.8 7.5 341 280 A 56 PHE HD% A 56 PHE HBx 1.0 1.8 5.5 342 281 A 56 PHE HE% A 56 PHE HBx 1.0 1.8 7.5 343 282 A 56 PHE HD% A 56 PHE HZ 1.0 1.8 7.5 344 283 A 56 PHE HBy A 56 PHE H 1.0 1.8 4.0 345 284 A 56 PHE HBx A 56 PHE H 1.0 1.8 3.5 346 285 A 56 PHE HD% A 56 PHE H 1.0 1.8 5.0 347 286 A 56 PHE HE% A 56 PHE H 1.0 1.8 7.5 348 287 A 57 ASN HA A 57 ASN HD21 1.0 1.8 7.0 349 288 A 57 ASN HA A 57 ASN HD22 1.0 1.8 7.0 350 289 A 57 ASN HD21 A 57 ASN HBy 1.0 1.8 5.0 351 290 A 57 ASN HD22 A 57 ASN HBy 1.0 1.8 4.0 352 291 A 57 ASN HD21 A 57 ASN HBx 1.0 1.8 5.0 353 292 A 57 ASN HD22 A 57 ASN HBx 1.0 1.8 4.0 354 293 A 57 ASN HBy A 57 ASN H 1.0 1.8 4.0 355 294 A 57 ASN HBx A 57 ASN H 1.0 1.8 3.5 356 295 A 57 ASN HD21 A 57 ASN H 1.0 1.8 5.0 357 296 A 57 ASN HD22 A 57 ASN H 1.0 1.8 7.0 358 297 A 58 ARG HA A 58 ARG HDy 1.0 1.8 5.0 359 298 A 58 ARG HA A 58 ARG HDx 1.0 1.8 5.0 360 299 A 58 ARG HA A 58 ARG HGy 1.0 1.8 4.0 361 300 A 58 ARG HA A 58 ARG HGx 1.0 1.8 4.0 362 301 A 58 ARG HBy A 58 ARG HDy 1.0 1.8 4.0 363 302 A 58 ARG HBy A 58 ARG HDx 1.0 1.8 4.0 364 303 A 58 ARG HBy A 58 ARG HDy 1.0 1.8 4.0 365 303 A 58 ARG HBy A 58 ARG HDx 1.0 1.8 4.0 366 304 A 58 ARG HBx A 58 ARG HDy 1.0 1.8 4.0 367 304 A 58 ARG HDx A 58 ARG HBx 1.0 1.8 4.0 368 305 A 58 ARG HGy A 58 ARG HDy 1.0 1.8 3.5 369 306 A 58 ARG HGx A 58 ARG HDy 1.0 1.8 3.5 370 307 A 58 ARG HGy A 58 ARG HDx 1.0 1.8 3.5 371 308 A 58 ARG HGx A 58 ARG HDx 1.0 1.8 3.5 372 309 A 58 ARG HBy A 58 ARG H 1.0 1.8 4.0 373 310 A 58 ARG HBx A 58 ARG H 1.0 1.8 4.0 374 311 A 58 ARG HGy A 58 ARG H 1.0 1.8 7.0 375 312 A 58 ARG HGx A 58 ARG H 1.0 1.8 5.0 376 313 A 59 HIS HA A 59 HIS HD2 1.0 1.8 7.0 377 314 A 59 HIS HD2 A 59 HIS HBx 1.0 1.8 4.0 378 315 A 59 HIS HD2 A 59 HIS HBy 1.0 1.8 5.0 379 316 A 59 HIS HBx A 59 HIS H 1.0 1.8 4.0 380 317 A 59 HIS HBy A 59 HIS H 1.0 1.8 4.0 381 318 A 59 HIS HD2 A 59 HIS H 1.0 1.8 7.0 382 319 A 60 PHE HA A 60 PHE HD% 1.0 1.8 5.5 383 320 A 60 PHE HD% A 60 PHE HBy 1.0 1.8 5.5 384 321 A 60 PHE HD% A 60 PHE HBx 1.0 1.8 7.5 385 322 A 60 PHE HBy A 60 PHE H 1.0 1.8 5.0 386 323 A 60 PHE HBx A 60 PHE H 1.0 1.8 4.0 387 324 A 60 PHE HD% A 60 PHE H 1.0 1.8 7.5 388 325 A 61 VAL HA A 61 VAL HGx% 1.0 1.8 3.5 389 325 A 61 VAL HA A 61 VAL HGy% 1.0 1.8 3.5 390 326 A 61 VAL H A 61 VAL HB 1.0 1.8 4.0 391 327 A 61 VAL H A 61 VAL HGx% 1.0 1.8 5.0 392 327 A 61 VAL HGy% A 61 VAL H 1.0 1.8 5.0 393 328 A 62 ASN HBy A 62 ASN HD21 1.0 1.8 7.0 394 329 A 62 ASN HBy A 62 ASN HD22 1.0 1.8 5.0 395 330 A 62 ASN HD21 A 62 ASN HBx 1.0 1.8 5.0 396 331 A 62 ASN HD22 A 62 ASN HBx 1.0 1.8 5.0 397 332 A 62 ASN HBy A 62 ASN H 1.0 1.8 4.0 398 333 A 62 ASN HBx A 62 ASN H 1.0 1.8 4.0 399 334 A 62 ASN HD21 A 62 ASN H 1.0 1.8 7.0 400 335 A 62 ASN HD22 A 62 ASN H 1.0 1.8 5.0 401 336 A 63 LEU HA A 63 LEU HDx% 1.0 1.8 5.5 402 336 A 63 LEU HA A 63 LEU HDy% 1.0 1.8 5.5 403 337 A 63 LEU HA A 63 LEU HDy% 1.0 1.8 7.5 404 337 A 63 LEU HA A 63 LEU HDx% 1.0 1.8 7.5 405 338 A 63 LEU HA A 63 LEU HG 1.0 1.8 5.0 406 339 A 63 LEU HBy A 63 LEU HDx% 1.0 1.8 7.5 407 339 A 63 LEU HDy% A 63 LEU HBy 1.0 1.8 7.5 408 340 A 63 LEU HDy% A 63 LEU HBy 1.0 1.8 5.5 409 340 A 63 LEU HBy A 63 LEU HDx% 1.0 1.8 5.5 410 341 A 63 LEU HBx A 63 LEU HDx% 1.0 1.8 7.5 411 341 A 63 LEU HDy% A 63 LEU HBx 1.0 1.8 7.5 412 342 A 63 LEU HDy% A 63 LEU HBx 1.0 1.8 5.5 413 342 A 63 LEU HBx A 63 LEU HDx% 1.0 1.8 5.5 414 343 A 63 LEU HBy A 63 LEU H 1.0 1.8 4.0 415 344 A 63 LEU HBx A 63 LEU H 1.0 1.8 3.5 416 345 A 63 LEU H A 63 LEU HDx% 1.0 1.8 7.5 417 345 A 63 LEU HDy% A 63 LEU H 1.0 1.8 7.5 418 346 A 63 LEU HDy% A 63 LEU H 1.0 1.8 7.5 419 346 A 63 LEU H A 63 LEU HDx% 1.0 1.8 7.5 420 347 A 64 LYS HA A 64 LYS HDy 1.0 1.8 7.0 421 347 A 64 LYS HA A 64 LYS HDx 1.0 1.8 7.0 422 348 A 64 LYS HB2 A 64 LYS HDy 1.0 1.8 4.0 423 348 A 64 LYS HB3 A 64 LYS HDy 1.0 1.8 4.0 424 348 A 64 LYS HDx A 64 LYS HB2 1.0 1.8 4.0 425 348 A 64 LYS HDx A 64 LYS HB3 1.0 1.8 4.0 426 349 A 64 LYS HB3 A 64 LYS HE2 1.0 1.8 4.0 427 349 A 64 LYS HB2 A 64 LYS HE2 1.0 1.8 4.0 428 349 A 64 LYS HE3 A 64 LYS HB2 1.0 1.8 4.0 429 349 A 64 LYS HB3 A 64 LYS HE3 1.0 1.8 4.0 430 350 A 64 LYS HE2 A 64 LYS HG2 1.0 1.8 3.0 431 350 A 64 LYS HE3 A 64 LYS HG2 1.0 1.8 3.0 432 350 A 64 LYS HG3 A 64 LYS HE2 1.0 1.8 3.0 433 350 A 64 LYS HE3 A 64 LYS HG3 1.0 1.8 3.0 434 351 A 64 LYS H A 64 LYS HB2 1.0 1.8 4.0 435 351 A 64 LYS HB3 A 64 LYS H 1.0 1.8 4.0 436 352 A 64 LYS H A 64 LYS HG2 1.0 1.8 5.0 437 352 A 64 LYS HG3 A 64 LYS H 1.0 1.8 5.0 438 353 A 65 MET HA A 65 MET HE% 1.0 1.8 5.5 439 354 A 65 MET HA A 65 MET HGy 1.0 1.8 4.0 440 354 A 65 MET HA A 65 MET HGx 1.0 1.8 4.0 441 355 A 65 MET HE% A 65 MET HBy 1.0 1.8 5.5 442 356 A 65 MET HE% A 65 MET HBx 1.0 1.8 5.5 443 357 A 65 MET HBy A 65 MET H 1.0 1.8 5.0 444 358 A 65 MET HBx A 65 MET H 1.0 1.8 5.0 445 359 A 65 MET H A 65 MET HGy 1.0 1.8 5.0 446 359 A 65 MET HGx A 65 MET H 1.0 1.8 5.0 447 360 A 66 ASP H A 66 ASP HA 1.0 1.8 5.0 448 361 A 66 ASP H A 66 ASP HBy 1.0 1.8 3.5 449 362 A 66 ASP H A 66 ASP HBx 1.0 1.8 3.5 450 363 A 67 MET HA A 67 MET HE% 1.0 1.8 5.5 451 364 A 67 MET HA A 67 MET HG2 1.0 1.8 5.0 452 364 A 67 MET HA A 67 MET HG3 1.0 1.8 5.0 453 365 A 67 MET HE% A 67 MET HBx 1.0 1.8 5.5 454 366 A 67 MET HE% A 67 MET HG2 1.0 1.8 5.5 455 366 A 67 MET HE% A 67 MET HG3 1.0 1.8 5.5 456 367 A 67 MET HBx A 67 MET H 1.0 1.8 4.0 457 368 A 67 MET H A 67 MET HBy 1.0 1.8 4.0 458 369 A 68 GLU HA A 68 GLU HGy 1.0 1.8 4.0 459 370 A 68 GLU HA A 68 GLU HGx 1.0 1.8 4.0 460 371 A 68 GLU H A 68 GLU HBy 1.0 1.8 4.0 461 372 A 68 GLU H A 68 GLU HBx 1.0 1.8 4.0 462 373 A 68 GLU HGy A 68 GLU H 1.0 1.8 5.0 463 374 A 68 GLU HGx A 68 GLU H 1.0 1.8 5.0 464 375 A 69 LYS HBy A 69 LYS HEx 1.0 1.8 7.0 465 376 A 69 LYS HBx A 69 LYS HEx 1.0 1.8 7.0 466 376 A 69 LYS HBx A 69 LYS HEy 1.0 1.8 7.0 467 377 A 69 LYS HBy A 69 LYS H 1.0 1.8 4.0 468 378 A 69 LYS HBx A 69 LYS H 1.0 1.8 4.0 469 379 A 69 LYS H A 69 LYS HG2 1.0 1.8 4.0 470 379 A 69 LYS H A 69 LYS HG3 1.0 1.8 4.0 471 380 A 73 VAL HA A 73 VAL HGx% 1.0 1.8 5.0 472 381 A 73 VAL HA A 73 VAL HGy% 1.0 1.8 5.0 473 382 A 73 VAL H A 73 VAL HB 1.0 1.8 4.0 474 383 A 73 VAL HGx% A 73 VAL H 1.0 1.8 5.0 475 384 A 73 VAL HGy% A 73 VAL H 1.0 1.8 5.5 476 385 A 74 GLU H A 74 GLU HBx 1.0 1.8 4.0 477 386 A 74 GLU H A 74 GLU HG2 1.0 1.8 5.0 478 386 A 74 GLU H A 74 GLU HG3 1.0 1.8 5.0 479 387 A 75 LEU HA A 75 LEU HDy% 1.0 1.8 7.5 480 387 A 75 LEU HA A 75 LEU HDx% 1.0 1.8 7.5 481 388 A 75 LEU HA A 75 LEU HDy% 1.0 1.8 5.5 482 388 A 75 LEU HA A 75 LEU HDx% 1.0 1.8 5.5 483 389 A 75 LEU HBy A 75 LEU HDy% 1.0 1.8 5.5 484 389 A 75 LEU HBy A 75 LEU HDx% 1.0 1.8 5.5 485 390 A 75 LEU HBy A 75 LEU HDy% 1.0 1.8 5.5 486 390 A 75 LEU HBy A 75 LEU HDx% 1.0 1.8 5.5 487 391 A 75 LEU HBx A 75 LEU HDy% 1.0 1.8 5.5 488 391 A 75 LEU HBx A 75 LEU HDx% 1.0 1.8 5.5 489 392 A 75 LEU HBx A 75 LEU HDy% 1.0 1.8 5.5 490 392 A 75 LEU HBx A 75 LEU HDx% 1.0 1.8 5.5 491 393 A 75 LEU HG A 75 LEU HDy% 1.0 1.8 5.5 492 393 A 75 LEU HG A 75 LEU HDx% 1.0 1.8 5.5 493 394 A 75 LEU HG A 75 LEU HDy% 1.0 1.8 5.0 494 394 A 75 LEU HG A 75 LEU HDx% 1.0 1.8 5.0 495 395 A 75 LEU HBy A 75 LEU H 1.0 1.8 3.5 496 396 A 75 LEU HBx A 75 LEU H 1.0 1.8 4.0 497 397 A 75 LEU H A 75 LEU HDy% 1.0 1.8 7.5 498 397 A 75 LEU H A 75 LEU HDx% 1.0 1.8 7.5 499 398 A 75 LEU H A 75 LEU HDy% 1.0 1.8 7.5 500 398 A 75 LEU H A 75 LEU HDx% 1.0 1.8 7.5 501 399 A 75 LEU HG A 75 LEU H 1.0 1.8 3.5 502 400 A 76 ARG HA A 76 ARG HDy 1.0 1.8 5.0 503 400 A 76 ARG HA A 76 ARG HDx 1.0 1.8 5.0 504 401 A 76 ARG HA A 76 ARG HGy 1.0 1.8 3.5 505 402 A 76 ARG HA A 76 ARG HGx 1.0 1.8 4.0 506 403 A 76 ARG HDx A 76 ARG HBy 1.0 1.8 5.0 507 403 A 76 ARG HBy A 76 ARG HDy 1.0 1.8 5.0 508 404 A 76 ARG HDx A 76 ARG HBx 1.0 1.8 4.0 509 404 A 76 ARG HBx A 76 ARG HDy 1.0 1.8 4.0 510 405 A 76 ARG H A 76 ARG HBy 1.0 1.8 3.0 511 406 A 76 ARG H A 76 ARG HBx 1.0 1.8 3.5 512 407 A 76 ARG H A 76 ARG HDy 1.0 1.8 7.0 513 408 A 76 ARG HGy A 76 ARG H 1.0 1.8 5.0 514 409 A 76 ARG HGx A 76 ARG H 1.0 1.8 5.0 515 410 A 77 LYS H A 77 LYS HB2 1.0 1.8 3.0 516 410 A 77 LYS H A 77 LYS HB3 1.0 1.8 3.0 517 411 A 77 LYS H A 77 LYS HD2 1.0 1.8 5.0 518 411 A 77 LYS H A 77 LYS HD3 1.0 1.8 5.0 519 412 A 77 LYS H A 77 LYS HGx 1.0 1.8 5.0 520 413 A 77 LYS H A 77 LYS HGy 1.0 1.8 5.0 521 414 A 78 LYS HA A 78 LYS HDy 1.0 1.8 5.0 522 415 A 78 LYS HA A 78 LYS HDx 1.0 1.8 5.0 523 416 A 78 LYS HA A 78 LYS HGx 1.0 1.8 4.0 524 417 A 78 LYS HDy A 78 LYS HGx 1.0 1.8 3.5 525 418 A 78 LYS HDx A 78 LYS HGx 1.0 1.8 3.5 526 419 A 78 LYS HGx A 78 LYS HEy 1.0 1.8 5.0 527 420 A 78 LYS HGx A 78 LYS HEx 1.0 1.8 5.0 528 421 A 78 LYS HGx A 78 LYS HEx 1.0 1.8 5.0 529 421 A 78 LYS HGx A 78 LYS HEy 1.0 1.8 5.0 530 422 A 78 LYS H A 78 LYS HBy 1.0 1.8 3.0 531 423 A 78 LYS H A 78 LYS HBx 1.0 1.8 3.5 532 424 A 78 LYS H A 78 LYS HGy 1.0 1.8 5.0 533 425 A 78 LYS HGx A 78 LYS H 1.0 1.8 7.0 534 426 A 79 TYR HA A 79 TYR HD% 1.0 1.8 4.0 535 427 A 79 TYR HA A 79 TYR HE% 1.0 1.8 5.5 536 428 A 79 TYR HD% A 79 TYR HBy 1.0 1.8 4.0 537 429 A 79 TYR HE% A 79 TYR HBy 1.0 1.8 7.5 538 430 A 79 TYR HD% A 79 TYR HBx 1.0 1.8 5.5 539 431 A 79 TYR HE% A 79 TYR HBx 1.0 1.8 7.5 540 432 A 79 TYR HBy A 79 TYR H 1.0 1.8 4.0 541 433 A 79 TYR HBx A 79 TYR H 1.0 1.8 4.0 542 434 A 79 TYR HD% A 79 TYR H 1.0 1.8 5.5 543 435 A 79 TYR HE% A 79 TYR H 1.0 1.8 7.5 544 436 A 81 VAL H A 81 VAL HB 1.0 1.8 3.5 545 437 A 81 VAL H A 81 VAL HGx% 1.0 1.8 4.0 546 437 A 81 VAL H A 81 VAL HGy% 1.0 1.8 4.0 547 438 A 82 HIS HA A 82 HIS HD2 1.0 1.8 5.0 548 439 A 82 HIS HD2 A 82 HIS HBy 1.0 1.8 7.0 549 440 A 82 HIS HD2 A 82 HIS HBx 1.0 1.8 7.0 550 441 A 83 ALA H A 83 ALA HB% 1.0 1.8 5.5 551 442 A 84 TYR HA A 84 TYR HD% 1.0 1.8 5.5 552 443 A 84 TYR HA A 84 TYR HE% 1.0 1.8 7.5 553 444 A 84 TYR HD% A 84 TYR HBx 1.0 1.8 5.0 554 444 A 84 TYR HD% A 84 TYR HBy 1.0 1.8 5.0 555 445 A 84 TYR HE% A 84 TYR HBx 1.0 1.8 5.5 556 445 A 84 TYR HE% A 84 TYR HBy 1.0 1.8 5.5 557 446 A 84 TYR HBy A 84 TYR H 1.0 1.8 4.0 558 447 A 84 TYR H A 84 TYR HBx 1.0 1.8 4.0 559 448 A 84 TYR HD% A 84 TYR H 1.0 1.8 5.5 560 449 A 84 TYR HE% A 84 TYR H 1.0 1.8 7.5 561 450 A 85 PRO HA A 85 PRO HD2 1.0 1.8 7.0 562 450 A 85 PRO HA A 85 PRO HD3 1.0 1.8 7.0 563 451 A 85 PRO HA A 85 PRO HGx 1.0 1.8 7.0 564 452 A 85 PRO HA A 85 PRO HGx 1.0 1.8 7.0 565 452 A 85 PRO HA A 85 PRO HGy 1.0 1.8 7.0 566 453 A 85 PRO HBy A 85 PRO HD2 1.0 1.8 5.0 567 453 A 85 PRO HD3 A 85 PRO HBy 1.0 1.8 5.0 568 454 A 85 PRO HBx A 85 PRO HD2 1.0 1.8 5.0 569 454 A 85 PRO HD3 A 85 PRO HBx 1.0 1.8 5.0 570 455 A 85 PRO HD3 A 85 PRO HGx 1.0 1.8 3.5 571 455 A 85 PRO HD2 A 85 PRO HGx 1.0 1.8 3.5 572 455 A 85 PRO HGy A 85 PRO HD2 1.0 1.8 3.5 573 455 A 85 PRO HD3 A 85 PRO HGy 1.0 1.8 3.5 574 456 A 86 THR HA A 86 THR HG2% 1.0 1.8 5.5 575 457 A 86 THR H A 86 THR HB 1.0 1.8 4.0 576 458 A 86 THR H A 86 THR HG1 1.0 1.8 5.0 577 459 A 87 LEU HA A 87 LEU HDx% 1.0 1.8 7.5 578 459 A 87 LEU HA A 87 LEU HDy% 1.0 1.8 7.5 579 460 A 87 LEU HA A 87 LEU HDy% 1.0 1.8 7.5 580 460 A 87 LEU HA A 87 LEU HDx% 1.0 1.8 7.5 581 461 A 87 LEU HA A 87 LEU HG 1.0 1.8 5.0 582 462 A 87 LEU HBx A 87 LEU HDx% 1.0 1.8 7.5 583 462 A 87 LEU HDy% A 87 LEU HBx 1.0 1.8 7.5 584 463 A 87 LEU HDy% A 87 LEU HBx 1.0 1.8 7.5 585 463 A 87 LEU HBx A 87 LEU HDx% 1.0 1.8 7.5 586 464 A 87 LEU HBy A 87 LEU HDx% 1.0 1.8 7.5 587 464 A 87 LEU HDy% A 87 LEU HBy 1.0 1.8 7.5 588 465 A 87 LEU HDy% A 87 LEU HBy 1.0 1.8 7.5 589 465 A 87 LEU HBy A 87 LEU HDx% 1.0 1.8 7.5 590 466 A 87 LEU HG A 87 LEU HDx% 1.0 1.8 5.5 591 466 A 87 LEU HDy% A 87 LEU HG 1.0 1.8 5.5 592 467 A 87 LEU HDy% A 87 LEU HG 1.0 1.8 5.5 593 467 A 87 LEU HG A 87 LEU HDx% 1.0 1.8 5.5 594 468 A 87 LEU HBx A 87 LEU H 1.0 1.8 4.0 595 469 A 87 LEU HBy A 87 LEU H 1.0 1.8 4.0 596 470 A 87 LEU H A 87 LEU HDx% 1.0 1.8 5.5 597 470 A 87 LEU HDy% A 87 LEU H 1.0 1.8 5.5 598 471 A 87 LEU HDy% A 87 LEU H 1.0 1.8 7.5 599 471 A 87 LEU H A 87 LEU HDx% 1.0 1.8 7.5 600 472 A 88 LEU HA A 88 LEU HDx% 1.0 1.8 7.5 601 472 A 88 LEU HA A 88 LEU HDy% 1.0 1.8 7.5 602 473 A 88 LEU HA A 88 LEU HDy% 1.0 1.8 5.5 603 473 A 88 LEU HA A 88 LEU HDx% 1.0 1.8 5.5 604 474 A 88 LEU HBy A 88 LEU HDx% 1.0 1.8 7.5 605 474 A 88 LEU HDy% A 88 LEU HBy 1.0 1.8 7.5 606 475 A 88 LEU HDy% A 88 LEU HBy 1.0 1.8 7.5 607 475 A 88 LEU HBy A 88 LEU HDx% 1.0 1.8 7.5 608 476 A 88 LEU HBx A 88 LEU HDx% 1.0 1.8 5.0 609 476 A 88 LEU HDy% A 88 LEU HBx 1.0 1.8 5.0 610 477 A 88 LEU HDy% A 88 LEU HBx 1.0 1.8 7.5 611 477 A 88 LEU HBx A 88 LEU HDx% 1.0 1.8 7.5 612 478 A 88 LEU HBy A 88 LEU H 1.0 1.8 3.5 613 479 A 88 LEU HBx A 88 LEU H 1.0 1.8 4.0 614 480 A 88 LEU H A 88 LEU HDx% 1.0 1.8 7.5 615 480 A 88 LEU HDy% A 88 LEU H 1.0 1.8 7.5 616 481 A 88 LEU HDy% A 88 LEU H 1.0 1.8 7.5 617 481 A 88 LEU H A 88 LEU HDx% 1.0 1.8 7.5 618 482 A 89 PHE HA A 89 PHE HD% 1.0 1.8 7.5 619 483 A 89 PHE HD% A 89 PHE HBy 1.0 1.8 5.5 620 484 A 89 PHE HD% A 89 PHE HBx 1.0 1.8 5.5 621 485 A 89 PHE HBy A 89 PHE H 1.0 1.8 4.0 622 486 A 89 PHE HD% A 89 PHE H 1.0 1.8 5.5 623 487 A 89 PHE H A 89 PHE HE% 1.0 1.8 7.5 624 488 A 90 ILE HA A 90 ILE HD1% 1.0 1.8 7.5 625 489 A 90 ILE HA A 90 ILE HG1y 1.0 1.8 5.0 626 490 A 90 ILE HA A 90 ILE HG1x 1.0 1.8 5.0 627 491 A 90 ILE HA A 90 ILE HG2% 1.0 1.8 5.5 628 492 A 90 ILE HD1% A 90 ILE HB 1.0 1.8 5.0 629 493 A 90 ILE HD1% A 90 ILE HG1x 1.0 1.8 5.5 630 494 A 90 ILE HD1% A 90 ILE HG2% 1.0 1.8 7.0 631 495 A 90 ILE HB A 90 ILE H 1.0 1.8 3.5 632 496 A 90 ILE HD1% A 90 ILE H 1.0 1.8 7.5 633 497 A 90 ILE HG1y A 90 ILE H 1.0 1.8 5.0 634 498 A 90 ILE HG2% A 90 ILE H 1.0 1.8 7.5 635 499 A 91 ASN HA A 91 ASN HD21 1.0 1.8 7.0 636 500 A 91 ASN HD21 A 91 ASN HBy 1.0 1.8 5.0 637 501 A 91 ASN HBy A 91 ASN HD22 1.0 1.8 5.0 638 502 A 91 ASN HD21 A 91 ASN HBx 1.0 1.8 4.0 639 503 A 91 ASN HD22 A 91 ASN HBx 1.0 1.8 5.0 640 504 A 91 ASN HBy A 91 ASN H 1.0 1.8 5.0 641 505 A 91 ASN HBx A 91 ASN H 1.0 1.8 5.0 642 506 A 91 ASN HD21 A 91 ASN H 1.0 1.8 7.0 643 507 A 91 ASN HD22 A 91 ASN H 1.0 1.8 7.0 644 508 A 92 SER H A 92 SER HBy 1.0 1.8 4.0 645 509 A 92 SER H A 92 SER HBx 1.0 1.8 4.0 646 510 A 93 SER H A 93 SER HBx 1.0 1.8 4.0 647 511 A 95 GLU H A 95 GLU HB2 1.0 1.8 4.0 648 511 A 95 GLU H A 95 GLU HB3 1.0 1.8 4.0 649 512 A 95 GLU H A 95 GLU HG2 1.0 1.8 5.0 650 512 A 95 GLU H A 95 GLU HG3 1.0 1.8 5.0 651 513 A 96 VAL HA A 96 VAL HGx% 1.0 1.8 5.0 652 514 A 96 VAL HA A 96 VAL HGy% 1.0 1.8 5.5 653 515 A 96 VAL H A 96 VAL HB 1.0 1.8 4.0 654 516 A 96 VAL H A 96 VAL HGx% 1.0 1.8 5.0 655 517 A 96 VAL H A 96 VAL HGy% 1.0 1.8 5.5 656 518 A 97 VAL HA A 97 VAL HGx% 1.0 1.8 3.5 657 518 A 97 VAL HA A 97 VAL HGy% 1.0 1.8 3.5 658 519 A 97 VAL H A 97 VAL HB 1.0 1.8 4.0 659 520 A 97 VAL H A 97 VAL HGx% 1.0 1.8 4.0 660 520 A 97 VAL HGy% A 97 VAL H 1.0 1.8 4.0 661 521 A 98 TYR HA A 98 TYR HD% 1.0 1.8 5.5 662 522 A 98 TYR HA A 98 TYR HE% 1.0 1.8 7.5 663 523 A 98 TYR HD% A 98 TYR HBy 1.0 1.8 7.5 664 524 A 98 TYR HE% A 98 TYR HBy 1.0 1.8 5.5 665 525 A 98 TYR HD% A 98 TYR HBx 1.0 1.8 7.5 666 526 A 98 TYR HE% A 98 TYR HBx 1.0 1.8 5.0 667 527 A 98 TYR HBy A 98 TYR H 1.0 1.8 5.0 668 528 A 98 TYR HBx A 98 TYR H 1.0 1.8 5.0 669 529 A 98 TYR HD% A 98 TYR H 1.0 1.8 7.5 670 530 A 99 ARG HA A 99 ARG HDy 1.0 1.8 7.0 671 531 A 99 ARG HA A 99 ARG HDx 1.0 1.8 7.0 672 532 A 99 ARG HA A 99 ARG HG2 1.0 1.8 4.0 673 532 A 99 ARG HA A 99 ARG HG3 1.0 1.8 4.0 674 533 A 99 ARG HDy A 99 ARG HB2 1.0 1.8 4.0 675 533 A 99 ARG HDy A 99 ARG HB3 1.0 1.8 4.0 676 534 A 99 ARG HDx A 99 ARG HB2 1.0 1.8 3.5 677 534 A 99 ARG HDx A 99 ARG HB3 1.0 1.8 3.5 678 535 A 99 ARG HDy A 99 ARG HG2 1.0 1.8 3.5 679 535 A 99 ARG HDy A 99 ARG HG3 1.0 1.8 3.5 680 536 A 99 ARG HDx A 99 ARG HG2 1.0 1.8 3.5 681 536 A 99 ARG HDx A 99 ARG HG3 1.0 1.8 3.5 682 537 A 99 ARG H A 99 ARG HB2 1.0 1.8 4.0 683 537 A 99 ARG HB3 A 99 ARG H 1.0 1.8 4.0 684 538 A 99 ARG H A 99 ARG HG2 1.0 1.8 5.0 685 538 A 99 ARG HG3 A 99 ARG H 1.0 1.8 5.0 686 539 A 100 LEU HA A 100 LEU HDy% 1.0 1.8 5.0 687 539 A 100 LEU HA A 100 LEU HDx% 1.0 1.8 5.0 688 540 A 100 LEU HBy A 100 LEU HDx% 1.0 1.8 5.0 689 540 A 100 LEU HBy A 100 LEU HDy% 1.0 1.8 5.0 690 541 A 100 LEU HBx A 100 LEU HDx% 1.0 1.8 5.0 691 541 A 100 LEU HDy% A 100 LEU HBx 1.0 1.8 5.0 692 542 A 100 LEU HBy A 100 LEU H 1.0 1.8 4.0 693 543 A 100 LEU HBx A 100 LEU H 1.0 1.8 3.5 694 544 A 100 LEU HDy% A 100 LEU H 1.0 1.8 7.5 695 544 A 100 LEU H A 100 LEU HDx% 1.0 1.8 7.5 696 545 A 100 LEU HDy% A 100 LEU H 1.0 1.8 7.5 697 545 A 100 LEU H A 100 LEU HDx% 1.0 1.8 7.5 698 546 A 101 VAL HA A 101 VAL HGx% 1.0 1.8 5.5 699 547 A 101 VAL HA A 101 VAL HGy% 1.0 1.8 5.5 700 548 A 101 VAL H A 101 VAL HB 1.0 0.8 4.0 701 549 A 101 VAL HGx% A 101 VAL H 1.0 1.8 7.5 702 550 A 101 VAL HGy% A 101 VAL H 1.0 1.8 5.5 703 551 A 103 ALA H A 103 ALA HB% 1.0 1.8 5.0 704 552 A 104 GLU H A 104 GLU HBy 1.0 1.8 4.0 705 553 A 104 GLU H A 104 GLU HBx 1.0 1.8 4.0 706 554 A 105 ASP H A 105 ASP HBy 1.0 1.8 3.5 707 555 A 105 ASP H A 105 ASP HBx 1.0 1.8 4.0 708 556 A 106 ALA H A 106 ALA HB% 1.0 1.8 5.0 709 557 A 107 PRO HA A 107 PRO HDy 1.0 1.8 7.0 710 558 A 107 PRO HA A 107 PRO HDx 1.0 1.8 5.0 711 559 A 107 PRO HDy A 107 PRO HBx 1.0 1.8 5.0 712 560 A 107 PRO HDx A 107 PRO HBx 1.0 1.8 5.0 713 561 A 107 PRO HDy A 107 PRO HGy 1.0 1.8 4.0 714 562 A 107 PRO HDy A 107 PRO HGx 1.0 1.8 4.0 715 563 A 107 PRO HDx A 107 PRO HGy 1.0 1.8 4.0 716 564 A 107 PRO HDx A 107 PRO HGx 1.0 1.8 4.0 717 565 A 108 GLU H A 108 GLU HBy 1.0 1.8 3.0 718 566 A 108 GLU H A 108 GLU HBx 1.0 1.8 3.5 719 567 A 108 GLU H A 108 GLU HG2 1.0 1.8 4.0 720 567 A 108 GLU H A 108 GLU HG3 1.0 1.8 4.0 721 568 A 109 LEU HA A 109 LEU HDx% 1.0 1.8 7.5 722 568 A 109 LEU HA A 109 LEU HDy% 1.0 1.8 7.5 723 569 A 109 LEU HA A 109 LEU HDy% 1.0 1.8 5.0 724 569 A 109 LEU HA A 109 LEU HDx% 1.0 1.8 5.0 725 570 A 109 LEU HBx A 109 LEU HDx% 1.0 1.8 5.5 726 570 A 109 LEU HDy% A 109 LEU HBx 1.0 1.8 5.5 727 571 A 109 LEU HBy A 109 LEU HDx% 1.0 1.8 5.0 728 571 A 109 LEU HDy% A 109 LEU HBy 1.0 1.8 5.0 729 572 A 109 LEU HBx A 109 LEU H 1.0 1.8 3.5 730 573 A 109 LEU HBy A 109 LEU H 1.0 1.8 3.0 731 574 A 109 LEU H A 109 LEU HDx% 1.0 1.8 7.5 732 574 A 109 LEU HDy% A 109 LEU H 1.0 1.8 7.5 733 575 A 109 LEU HDy% A 109 LEU H 1.0 1.8 7.5 734 575 A 109 LEU H A 109 LEU HDx% 1.0 1.8 7.5 735 576 A 110 LEU H A 110 LEU HBx 1.0 1.8 4.0 736 577 A 110 LEU H A 110 LEU HDx% 1.0 1.8 7.5 737 577 A 110 LEU H A 110 LEU HDy% 1.0 1.8 7.5 738 578 A 110 LEU H A 110 LEU HDy% 1.0 1.8 7.5 739 578 A 110 LEU H A 110 LEU HDx% 1.0 1.8 7.5 740 579 A 111 LYS HA A 111 LYS HGx 1.0 1.8 4.0 741 580 A 111 LYS H A 111 LYS HB2 1.0 1.8 3.0 742 580 A 111 LYS H A 111 LYS HB3 1.0 1.8 3.0 743 581 A 111 LYS H A 111 LYS HGy 1.0 1.8 5.0 744 582 A 111 LYS HGx A 111 LYS H 1.0 1.8 5.0 745 583 A 112 LYS HA A 112 LYS HDx 1.0 1.8 5.0 746 584 A 112 LYS HA A 112 LYS HE2 1.0 1.8 5.0 747 584 A 112 LYS HA A 112 LYS HE3 1.0 1.8 5.0 748 585 A 112 LYS HA A 112 LYS HGx 1.0 1.8 3.5 749 586 A 112 LYS H A 112 LYS HBy 1.0 1.8 4.0 750 587 A 112 LYS H A 112 LYS HBx 1.0 1.8 4.0 751 588 A 112 LYS H A 112 LYS HE2 1.0 1.8 7.0 752 588 A 112 LYS HE3 A 112 LYS H 1.0 1.8 7.0 753 589 A 112 LYS HGx A 112 LYS H 1.0 1.8 5.0 754 590 A 113 VAL HA A 113 VAL HGx% 1.0 1.8 5.0 755 591 A 113 VAL HA A 113 VAL HGy% 1.0 1.8 5.5 756 592 A 113 VAL H A 113 VAL HB 1.0 1.8 3.0 757 593 A 113 VAL HGx% A 113 VAL H 1.0 1.8 5.0 758 594 A 113 VAL HGy% A 113 VAL H 1.0 1.8 7.5 759 595 A 114 LYS HA A 114 LYS HDy 1.0 1.8 4.0 760 595 A 114 LYS HA A 114 LYS HDx 1.0 1.8 4.0 761 596 A 114 LYS HA A 114 LYS HGy 1.0 1.8 4.0 762 597 A 114 LYS HA A 114 LYS HGx 1.0 1.8 4.0 763 598 A 114 LYS HEy A 114 LYS HB2 1.0 1.8 4.0 764 598 A 114 LYS HB3 A 114 LYS HEy 1.0 1.8 4.0 765 599 A 114 LYS HEx A 114 LYS HB2 1.0 1.8 4.0 766 599 A 114 LYS HB3 A 114 LYS HEx 1.0 1.8 4.0 767 600 A 114 LYS HGy A 114 LYS HEy 1.0 1.8 4.0 768 601 A 114 LYS HGx A 114 LYS HEy 1.0 1.8 4.0 769 602 A 114 LYS HGy A 114 LYS HEx 1.0 1.8 4.0 770 603 A 114 LYS HGx A 114 LYS HEx 1.0 1.8 4.0 771 604 A 114 LYS HGy A 114 LYS H 1.0 1.8 5.0 772 605 A 114 LYS HGx A 114 LYS H 1.0 1.8 5.0 773 606 A 115 LEU HA A 115 LEU HDy% 1.0 1.8 5.0 774 606 A 115 LEU HA A 115 LEU HDx% 1.0 1.8 5.0 775 607 A 115 LEU HA A 115 LEU HDy% 1.0 1.8 5.5 776 607 A 115 LEU HA A 115 LEU HDx% 1.0 1.8 5.5 777 608 A 115 LEU HBx A 115 LEU HDy% 1.0 1.8 4.0 778 608 A 115 LEU HBx A 115 LEU HDx% 1.0 1.8 4.0 779 609 A 115 LEU H A 115 LEU HBy 1.0 1.8 4.0 780 610 A 115 LEU HBx A 115 LEU H 1.0 1.8 4.0 781 611 A 115 LEU H A 115 LEU HDy% 1.0 1.8 7.5 782 611 A 115 LEU H A 115 LEU HDx% 1.0 1.8 7.5 783 612 A 117 VAL HA A 117 VAL HGx% 1.0 1.8 5.0 784 613 A 117 VAL HA A 117 VAL HGy% 1.0 1.8 5.5 785 614 A 117 VAL H A 117 VAL HB 1.0 1.8 4.0 786 615 A 117 VAL HGx% A 117 VAL H 1.0 1.8 5.5 787 616 A 117 VAL HGy% A 117 VAL H 1.0 1.8 5.0 788 617 A 118 GLU HA A 118 GLU HGx 1.0 1.8 3.5 789 618 A 118 GLU H A 118 GLU HBy 1.0 1.8 3.5 790 619 A 118 GLU H A 118 GLU HGy 1.0 1.8 5.0 791 620 A 119 SER H A 119 SER HBy 1.0 1.8 4.0 792 620 A 119 SER H A 119 SER HBx 1.0 1.8 4.0 793 621 A 120 GLU H A 120 GLU HBx 1.0 1.8 7.0 794 622 A 3 ALA H A 2 GLN HA 1.0 1.8 7.0 795 623 A 4 ASP H A 3 ALA HA 1.0 1.8 5.0 796 624 A 3 ALA HB% A 4 ASP H 1.0 1.8 7.5 797 625 A 4 ASP HA A 5 GLY H 1.0 1.8 4.0 798 626 A 4 ASP HBy A 5 GLY H 1.0 1.8 7.0 799 627 A 4 ASP HBx A 5 GLY H 1.0 1.8 7.0 800 628 A 6 ILE H A 5 GLY HAx 1.0 1.8 3.0 801 629 A 6 ILE HG1x A 5 GLY HAx 1.0 1.8 7.0 802 630 A 6 ILE H A 5 GLY HAy 1.0 1.8 3.5 803 631 A 6 ILE HG1x A 5 GLY HAy 1.0 1.8 7.0 804 632 A 6 ILE H A 5 GLY H 1.0 1.8 7.0 805 633 A 6 ILE HA A 7 ALA H 1.0 1.8 3.0 806 634 A 6 ILE HA A 7 ALA HA 1.0 1.8 7.0 807 635 A 6 ILE HA A 7 ALA HB% 1.0 1.8 7.5 808 636 A 6 ILE HB A 7 ALA H 1.0 1.8 7.0 809 637 A 6 ILE HD1% A 7 ALA H 1.0 1.8 7.5 810 638 A 6 ILE HG1y A 7 ALA H 1.0 1.8 7.0 811 639 A 6 ILE HG1x A 7 ALA H 1.0 1.8 7.0 812 640 A 6 ILE HG2% A 7 ALA H 1.0 1.8 5.5 813 641 A 6 ILE HG2% A 7 ALA HA 1.0 1.8 7.5 814 642 A 6 ILE HG2% A 7 ALA HB% 1.0 1.8 8.0 815 643 A 6 ILE H A 7 ALA H 1.0 1.8 7.0 816 644 A 8 PHE H A 7 ALA HA 1.0 1.8 3.0 817 645 A 8 PHE HD% A 7 ALA HA 1.0 1.8 7.5 818 646 A 7 ALA HB% A 8 PHE H 1.0 1.8 5.5 819 647 A 7 ALA H A 8 PHE H 1.0 1.8 7.0 820 648 A 8 PHE HA A 9 ARG H 1.0 1.8 3.0 821 649 A 8 PHE HBy A 9 ARG H 1.0 1.8 5.0 822 650 A 8 PHE HBx A 9 ARG H 1.0 1.8 5.0 823 651 A 8 PHE HD% A 9 ARG H 1.0 1.8 7.5 824 652 A 8 PHE H A 9 ARG H 1.0 1.8 7.0 825 653 A 11 LEU H A 10 GLU HA 1.0 1.8 3.0 826 654 A 11 LEU HDy% A 10 GLU HA 1.0 1.8 7.5 827 654 A 10 GLU HA A 11 LEU HDx% 1.0 1.8 7.5 828 655 A 11 LEU H A 10 GLU HBy 1.0 1.8 5.0 829 656 A 11 LEU H A 10 GLU HBx 1.0 1.8 5.0 830 657 A 11 LEU H A 10 GLU HGy 1.0 1.8 5.0 831 657 A 11 LEU H A 10 GLU HGx 1.0 1.8 5.0 832 658 A 11 LEU HA A 12 SER H 1.0 1.8 3.0 833 659 A 11 LEU HBy A 12 SER H 1.0 1.8 4.0 834 660 A 11 LEU HBx A 12 SER H 1.0 1.8 4.0 835 661 A 12 SER H A 11 LEU HDx% 1.0 1.8 5.5 836 661 A 11 LEU HDy% A 12 SER H 1.0 1.8 5.5 837 662 A 11 LEU HDy% A 12 SER H 1.0 1.8 7.5 838 662 A 12 SER H A 11 LEU HDx% 1.0 1.8 7.5 839 663 A 11 LEU H A 12 SER H 1.0 1.8 5.0 840 664 A 12 SER HA A 13 PHE H 1.0 1.8 3.5 841 665 A 12 SER HBy A 13 PHE H 1.0 1.8 4.0 842 666 A 12 SER HBx A 13 PHE H 1.0 1.8 3.5 843 667 A 12 SER H A 13 PHE H 1.0 1.8 7.0 844 668 A 13 PHE HBy A 14 PRO HDy 1.0 1.8 4.0 845 669 A 13 PHE HBy A 14 PRO HDx 1.0 1.8 4.0 846 670 A 13 PHE HBy A 14 PRO HGy 1.0 1.8 7.0 847 671 A 13 PHE HBy A 14 PRO HGx 1.0 1.8 7.0 848 672 A 13 PHE HBx A 14 PRO HDy 1.0 1.8 5.0 849 673 A 13 PHE HBx A 14 PRO HDx 1.0 1.8 5.0 850 674 A 13 PHE HBx A 14 PRO HGy 1.0 1.8 7.0 851 675 A 13 PHE HBx A 14 PRO HGx 1.0 1.8 7.0 852 676 A 13 PHE HD% A 14 PRO HA 1.0 1.8 7.5 853 677 A 13 PHE HD% A 14 PRO HDy 1.0 1.8 7.5 854 678 A 13 PHE HD% A 14 PRO HDx 1.0 1.8 7.5 855 679 A 13 PHE HD% A 14 PRO HGy 1.0 1.8 7.5 856 680 A 13 PHE HD% A 14 PRO HGx 1.0 1.8 7.5 857 681 A 13 PHE HE% A 14 PRO HA 1.0 1.8 7.5 858 682 A 13 PHE H A 14 PRO HGy 1.0 1.8 7.0 859 683 A 14 PRO HA A 15 GLU H 1.0 1.8 3.5 860 684 A 14 PRO HBy A 15 GLU H 1.0 1.8 4.0 861 685 A 16 ALA H A 15 GLU HA 1.0 1.8 5.0 862 686 A 15 GLU HBy A 16 ALA H 1.0 1.8 3.5 863 687 A 15 GLU HBy A 16 ALA HA 1.0 1.8 7.0 864 688 A 15 GLU HBy A 16 ALA HB% 1.0 1.8 7.5 865 689 A 15 GLU HBx A 16 ALA H 1.0 1.8 4.0 866 690 A 15 GLU HBx A 16 ALA HA 1.0 1.8 4.0 867 691 A 15 GLU HBx A 16 ALA HB% 1.0 1.8 7.5 868 692 A 16 ALA H A 15 GLU HG2 1.0 1.8 5.0 869 692 A 15 GLU HG3 A 16 ALA H 1.0 1.8 5.0 870 693 A 15 GLU H A 16 ALA H 1.0 1.8 3.5 871 694 A 16 ALA HA A 17 LEU H 1.0 1.8 5.0 872 695 A 16 ALA H A 17 LEU H 1.0 1.8 3.5 873 696 A 17 LEU HA A 18 LYS H 1.0 1.8 5.0 874 697 A 17 LEU HBy A 18 LYS H 1.0 1.8 3.5 875 698 A 17 LEU HBx A 18 LYS H 1.0 1.8 3.5 876 699 A 18 LYS H A 17 LEU HDx% 1.0 1.8 7.0 877 699 A 18 LYS H A 17 LEU HDy% 1.0 1.8 7.0 878 700 A 17 LEU H A 18 LYS H 1.0 1.8 3.5 879 701 A 17 LEU H A 18 LYS HBx 1.0 1.8 5.0 880 702 A 19 ARG H A 18 LYS HA 1.0 1.8 5.0 881 703 A 19 ARG H A 18 LYS HG2 1.0 1.8 3.5 882 703 A 18 LYS HG3 A 19 ARG H 1.0 1.8 3.5 883 704 A 18 LYS H A 19 ARG H 1.0 1.8 3.5 884 705 A 19 ARG HA A 20 ALA H 1.0 1.8 5.0 885 706 A 19 ARG HBy A 20 ALA H 1.0 1.8 4.0 886 707 A 20 ALA H A 19 ARG HBx 1.0 1.8 4.0 887 708 A 19 ARG HGx A 20 ALA H 1.0 1.8 5.0 888 709 A 19 ARG H A 20 ALA H 1.0 1.8 3.5 889 710 A 21 GLU H A 20 ALA HA 1.0 1.8 4.0 890 711 A 20 ALA HB% A 21 GLU H 1.0 1.8 5.5 891 712 A 20 ALA H A 21 GLU H 1.0 1.8 3.5 892 713 A 22 VAL H A 21 GLU HA 1.0 1.8 4.0 893 714 A 22 VAL H A 21 GLU HB2 1.0 1.8 3.5 894 714 A 21 GLU HB3 A 22 VAL H 1.0 1.8 3.5 895 715 A 22 VAL HA A 21 GLU HB2 1.0 1.8 7.0 896 715 A 21 GLU HB3 A 22 VAL HA 1.0 1.8 7.0 897 716 A 21 GLU HGy A 22 VAL H 1.0 1.8 5.0 898 717 A 21 GLU HGx A 22 VAL H 1.0 1.8 5.0 899 718 A 21 GLU H A 22 VAL H 1.0 1.8 4.0 900 719 A 21 GLU H A 22 VAL HGx% 1.0 1.8 7.5 901 720 A 21 GLU H A 22 VAL HGy% 1.0 1.8 7.5 902 721 A 22 VAL HA A 23 GLU H 1.0 1.8 4.0 903 722 A 22 VAL HB A 23 GLU H 1.0 1.8 5.0 904 723 A 22 VAL HGx% A 23 GLU H 1.0 1.8 7.5 905 724 A 22 VAL HGx% A 23 GLU HG2 1.0 1.8 7.5 906 724 A 22 VAL HGx% A 23 GLU HG3 1.0 1.8 7.5 907 725 A 22 VAL HGy% A 23 GLU H 1.0 1.8 7.5 908 726 A 22 VAL H A 23 GLU H 1.0 1.8 4.0 909 727 A 23 GLU HA A 24 ASP H 1.0 1.8 4.0 910 728 A 23 GLU HBy A 24 ASP H 1.0 1.8 5.0 911 729 A 23 GLU HBx A 24 ASP H 1.0 1.8 7.0 912 730 A 23 GLU H A 24 ASP H 1.0 1.8 3.5 913 731 A 23 GLU H A 24 ASP HA 1.0 1.8 5.0 914 732 A 25 LYS H A 24 ASP HA 1.0 1.8 3.0 915 733 A 24 ASP HBy A 25 LYS H 1.0 1.8 5.0 916 734 A 24 ASP HBx A 25 LYS H 1.0 1.8 7.0 917 735 A 24 ASP H A 25 LYS H 1.0 1.8 5.0 918 736 A 25 LYS HA A 26 LEU H 1.0 1.8 3.5 919 737 A 25 LYS HBx A 26 LEU H 1.0 1.8 5.0 920 738 A 25 LYS HGy A 26 LEU H 1.0 1.8 5.0 921 739 A 26 LEU HA A 27 LEU H 1.0 1.8 3.5 922 740 A 26 LEU HA A 27 LEU HBy 1.0 1.8 7.0 923 741 A 26 LEU HA A 27 LEU HBx 1.0 1.8 7.0 924 742 A 26 LEU HBy A 27 LEU H 1.0 1.8 5.0 925 743 A 26 LEU HBx A 27 LEU H 1.0 1.8 4.0 926 744 A 27 LEU H A 26 LEU HDx% 1.0 1.8 7.5 927 744 A 26 LEU HDy% A 27 LEU H 1.0 1.8 7.5 928 745 A 26 LEU HG A 27 LEU H 1.0 1.8 5.0 929 746 A 27 LEU HA A 28 PHE H 1.0 1.8 3.5 930 747 A 27 LEU HBy A 28 PHE H 1.0 1.8 7.0 931 748 A 27 LEU HBx A 28 PHE H 1.0 1.8 7.0 932 749 A 28 PHE H A 27 LEU HDx% 1.0 1.8 5.5 933 749 A 27 LEU HDy% A 28 PHE H 1.0 1.8 5.5 934 750 A 27 LEU HDy% A 28 PHE H 1.0 1.8 7.5 935 750 A 28 PHE H A 27 LEU HDx% 1.0 1.8 7.5 936 751 A 27 LEU HDy% A 28 PHE HA 1.0 1.8 7.5 937 751 A 28 PHE HA A 27 LEU HDx% 1.0 1.8 7.5 938 752 A 27 LEU HG A 28 PHE H 1.0 1.8 7.0 939 753 A 28 PHE HA A 29 VAL H 1.0 1.8 3.0 940 754 A 28 PHE HBy A 29 VAL H 1.0 1.8 5.0 941 755 A 28 PHE HBx A 29 VAL H 1.0 1.8 7.0 942 756 A 28 PHE HD% A 29 VAL H 1.0 1.8 5.5 943 757 A 28 PHE HE% A 29 VAL H 1.0 1.8 7.5 944 758 A 28 PHE H A 29 VAL H 1.0 1.8 7.0 945 759 A 29 VAL HA A 30 ASP H 1.0 1.8 3.5 946 760 A 29 VAL HB A 30 ASP H 1.0 1.8 7.0 947 761 A 29 VAL HGx% A 30 ASP H 1.0 1.8 7.5 948 762 A 29 VAL HGx% A 30 ASP HA 1.0 1.8 7.5 949 763 A 29 VAL HGy% A 30 ASP H 1.0 1.8 7.5 950 764 A 29 VAL HGy% A 30 ASP HA 1.0 1.8 7.5 951 765 A 29 VAL H A 30 ASP H 1.0 1.8 7.0 952 766 A 31 CYS H A 30 ASP HA 1.0 1.8 3.5 953 767 A 31 CYS H A 30 ASP HB2 1.0 1.8 5.0 954 767 A 30 ASP HB3 A 31 CYS H 1.0 1.8 5.0 955 768 A 32 PHE H A 31 CYS HA 1.0 1.8 3.5 956 769 A 32 PHE HD% A 31 CYS HA 1.0 1.8 7.5 957 770 A 31 CYS HBy A 32 PHE H 1.0 1.8 5.0 958 771 A 31 CYS HBx A 32 PHE H 1.0 1.8 5.0 959 772 A 32 PHE HA A 33 THR H 1.0 1.8 3.5 960 773 A 33 THR H A 32 PHE HB2 1.0 1.8 3.5 961 773 A 32 PHE HB3 A 33 THR H 1.0 1.8 3.5 962 774 A 32 PHE HD% A 33 THR HA 1.0 1.8 7.5 963 775 A 33 THR HA A 34 THR H 1.0 1.8 4.0 964 776 A 33 THR HB A 34 THR H 1.0 1.8 5.0 965 777 A 33 THR HG2% A 34 THR H 1.0 1.8 7.5 966 778 A 34 THR HA A 35 TRP H 1.0 1.8 5.0 967 779 A 34 THR HB A 35 TRP H 1.0 1.8 7.0 968 780 A 34 THR HG2% A 35 TRP H 1.0 1.8 7.5 969 781 A 34 THR H A 35 TRP H 1.0 1.8 7.0 970 782 A 35 TRP HE3 A 36 CYS HA 1.0 1.8 7.0 971 783 A 35 TRP H A 36 CYS H 1.0 1.8 5.0 972 784 A 36 CYS HBy A 37 GLY HAx 1.0 1.8 7.0 973 785 A 38 PRO HDy A 37 GLY HAx 1.0 1.8 4.0 974 786 A 38 PRO HDx A 37 GLY HAx 1.0 1.8 5.0 975 787 A 38 PRO HGx A 37 GLY HAx 1.0 1.8 7.0 976 788 A 38 PRO HDy A 37 GLY HAy 1.0 1.8 5.0 977 789 A 38 PRO HDx A 37 GLY HAy 1.0 1.8 7.0 978 790 A 38 PRO HGx A 37 GLY HAy 1.0 1.8 7.0 979 791 A 38 PRO HA A 39 CYS H 1.0 1.8 7.0 980 792 A 40 LYS H A 39 CYS HA 1.0 1.8 4.0 981 793 A 39 CYS HBy A 40 LYS H 1.0 1.8 5.0 982 794 A 39 CYS HBx A 40 LYS H 1.0 1.8 7.0 983 795 A 39 CYS H A 40 LYS H 1.0 1.8 7.0 984 796 A 41 ARG H A 40 LYS HA 1.0 1.8 4.0 985 797 A 40 LYS HBy A 41 ARG H 1.0 1.8 4.0 986 798 A 40 LYS HGy A 41 ARG H 1.0 1.8 5.0 987 799 A 40 LYS HGx A 41 ARG H 1.0 1.8 7.0 988 800 A 41 ARG HA A 42 LEU H 1.0 1.8 4.0 989 801 A 41 ARG HBy A 42 LEU H 1.0 1.8 5.0 990 802 A 41 ARG HBx A 42 LEU H 1.0 1.8 4.0 991 803 A 41 ARG H A 42 LEU H 1.0 1.8 3.5 992 804 A 42 LEU HA A 43 SER H 1.0 1.8 5.0 993 805 A 42 LEU HBy A 43 SER H 1.0 1.8 4.0 994 806 A 42 LEU HBx A 43 SER H 1.0 1.8 5.0 995 807 A 43 SER H A 42 LEU HDx% 1.0 1.8 7.5 996 807 A 42 LEU HDy% A 43 SER H 1.0 1.8 7.5 997 808 A 42 LEU HDy% A 43 SER H 1.0 1.8 7.5 998 808 A 43 SER H A 42 LEU HDx% 1.0 1.8 7.5 999 809 A 42 LEU HG A 43 SER H 1.0 1.8 7.0 1000 810 A 44 LYS H A 43 SER HA 1.0 1.8 4.0 1001 811 A 43 SER HBy A 44 LYS H 1.0 1.8 5.0 1002 812 A 43 SER HBx A 44 LYS H 1.0 1.8 5.0 1003 813 A 43 SER H A 44 LYS H 1.0 1.8 4.0 1004 814 A 43 SER H A 44 LYS HB2 1.0 1.8 5.0 1005 814 A 43 SER H A 44 LYS HB3 1.0 1.8 5.0 1006 815 A 45 VAL H A 44 LYS HB2 1.0 1.8 4.0 1007 815 A 44 LYS HB3 A 45 VAL H 1.0 1.8 4.0 1008 816 A 45 VAL H A 44 LYS HD2 1.0 1.8 5.0 1009 816 A 44 LYS HD3 A 45 VAL H 1.0 1.8 5.0 1010 817 A 44 LYS HGy A 45 VAL H 1.0 1.8 5.0 1011 818 A 44 LYS H A 45 VAL H 1.0 1.8 3.5 1012 819 A 44 LYS H A 45 VAL HG1% 1.0 1.8 7.0 1013 819 A 44 LYS H A 45 VAL HG2% 1.0 1.8 7.0 1014 820 A 45 VAL HA A 46 VAL H 1.0 1.8 5.0 1015 821 A 45 VAL HB A 46 VAL H 1.0 1.8 3.5 1016 822 A 45 VAL HB A 46 VAL HA 1.0 1.8 7.0 1017 823 A 45 VAL HB A 46 VAL HGx% 1.0 1.8 7.5 1018 824 A 46 VAL H A 45 VAL HG1% 1.0 1.8 5.0 1019 824 A 45 VAL HG2% A 46 VAL H 1.0 1.8 5.0 1020 825 A 45 VAL H A 46 VAL H 1.0 1.8 3.5 1021 826 A 45 VAL H A 46 VAL HGx% 1.0 1.8 7.5 1022 827 A 46 VAL HA A 47 PHE H 1.0 1.8 4.0 1023 828 A 46 VAL HA A 47 PHE HD% 1.0 1.8 7.5 1024 829 A 46 VAL HB A 47 PHE H 1.0 1.8 4.0 1025 830 A 46 VAL HGx% A 47 PHE H 1.0 1.8 7.5 1026 831 A 46 VAL HGy% A 47 PHE H 1.0 1.8 7.5 1027 832 A 46 VAL HGy% A 47 PHE HD% 1.0 1.8 8.0 1028 833 A 46 VAL HGy% A 47 PHE HE% 1.0 1.8 8.0 1029 834 A 46 VAL H A 47 PHE H 1.0 1.8 4.0 1030 835 A 47 PHE HA A 48 LYS H 1.0 1.8 5.0 1031 836 A 48 LYS H A 47 PHE HB2 1.0 1.8 5.0 1032 836 A 47 PHE HB3 A 48 LYS H 1.0 1.8 5.0 1033 837 A 47 PHE HD% A 48 LYS HA 1.0 1.8 7.5 1034 838 A 47 PHE H A 48 LYS H 1.0 1.8 4.0 1035 839 A 47 PHE H A 48 LYS HBy 1.0 1.8 7.0 1036 840 A 48 LYS HA A 49 ASP H 1.0 1.8 3.5 1037 841 A 48 LYS HBy A 49 ASP H 1.0 1.8 4.0 1038 842 A 48 LYS HBx A 49 ASP H 1.0 1.8 5.0 1039 843 A 48 LYS HGx A 49 ASP H 1.0 1.8 7.0 1040 844 A 48 LYS H A 49 ASP H 1.0 1.8 3.0 1041 845 A 48 LYS H A 49 ASP HA 1.0 1.8 5.0 1042 846 A 48 LYS H A 49 ASP HBy 1.0 1.8 7.0 1043 847 A 48 LYS H A 49 ASP HBx 1.0 1.8 7.0 1044 848 A 50 SER H A 49 ASP HA 1.0 1.8 3.5 1045 849 A 49 ASP HBy A 50 SER H 1.0 1.8 7.0 1046 850 A 49 ASP HBx A 50 SER H 1.0 1.8 7.0 1047 851 A 49 ASP H A 50 SER H 1.0 1.8 7.0 1048 852 A 51 LEU H A 50 SER HA 1.0 1.8 5.0 1049 853 A 50 SER HBy A 51 LEU H 1.0 1.8 5.0 1050 854 A 50 SER H A 51 LEU H 1.0 1.8 5.0 1051 855 A 51 LEU HA A 52 VAL H 1.0 1.8 5.0 1052 856 A 51 LEU HBy A 52 VAL H 1.0 1.8 5.0 1053 857 A 51 LEU HBy A 52 VAL HA 1.0 1.8 5.5 1054 858 A 51 LEU HBx A 52 VAL H 1.0 1.8 4.0 1055 859 A 52 VAL H A 51 LEU HDx% 1.0 1.8 7.5 1056 859 A 51 LEU HDy% A 52 VAL H 1.0 1.8 7.5 1057 860 A 51 LEU HDy% A 52 VAL H 1.0 1.8 7.5 1058 860 A 52 VAL H A 51 LEU HDx% 1.0 1.8 7.5 1059 861 A 51 LEU HG A 52 VAL H 1.0 1.8 7.0 1060 862 A 51 LEU H A 52 VAL H 1.0 1.8 3.0 1061 863 A 51 LEU H A 52 VAL HA 1.0 1.8 7.0 1062 864 A 51 LEU H A 52 VAL HGx% 1.0 1.8 7.5 1063 865 A 51 LEU H A 52 VAL HGy% 1.0 1.8 7.5 1064 866 A 52 VAL HB A 53 ALA H 1.0 1.8 3.5 1065 867 A 52 VAL HB A 53 ALA HB% 1.0 1.8 5.5 1066 868 A 52 VAL HGy% A 53 ALA H 1.0 1.8 7.5 1067 869 A 52 VAL HGy% A 53 ALA HA 1.0 1.8 7.5 1068 870 A 52 VAL H A 53 ALA H 1.0 1.8 3.5 1069 871 A 54 ASP H A 53 ALA HA 1.0 1.8 5.0 1070 872 A 53 ALA HB% A 54 ASP H 1.0 1.8 5.5 1071 873 A 53 ALA HB% A 54 ASP HA 1.0 1.8 7.5 1072 874 A 53 ALA H A 54 ASP H 1.0 1.8 4.0 1073 875 A 53 ALA H A 54 ASP HBy 1.0 1.8 7.0 1074 876 A 55 TYR H A 54 ASP HA 1.0 1.8 5.0 1075 877 A 54 ASP HBy A 55 TYR H 1.0 1.8 4.0 1076 878 A 54 ASP HBx A 55 TYR H 1.0 1.8 4.0 1077 879 A 54 ASP HBx A 55 TYR HA 1.0 1.8 5.0 1078 880 A 54 ASP H A 55 TYR H 1.0 1.8 3.5 1079 881 A 55 TYR HA A 56 PHE H 1.0 1.8 7.0 1080 882 A 55 TYR HBy A 56 PHE H 1.0 1.8 5.0 1081 883 A 55 TYR HBy A 56 PHE HD% 1.0 1.8 7.5 1082 884 A 55 TYR HBx A 56 PHE H 1.0 1.8 4.0 1083 885 A 55 TYR HBx A 56 PHE HD% 1.0 1.8 5.5 1084 886 A 55 TYR HBx A 56 PHE HE% 1.0 1.8 7.5 1085 887 A 55 TYR HD% A 56 PHE H 1.0 1.8 7.5 1086 888 A 55 TYR HD% A 56 PHE HA 1.0 1.8 7.5 1087 889 A 55 TYR HD% A 56 PHE HD% 1.0 1.8 7.0 1088 890 A 55 TYR HD% A 56 PHE HE% 1.0 1.8 8.0 1089 891 A 55 TYR HE% A 56 PHE HA 1.0 1.8 7.5 1090 892 A 55 TYR HE% A 56 PHE HD% 1.0 1.8 8.0 1091 893 A 55 TYR H A 56 PHE H 1.0 1.8 3.5 1092 894 A 56 PHE HA A 57 ASN H 1.0 1.8 5.0 1093 895 A 56 PHE HBy A 57 ASN H 1.0 1.8 4.0 1094 896 A 56 PHE HD% A 57 ASN H 1.0 1.8 7.5 1095 897 A 56 PHE H A 57 ASN H 1.0 1.8 4.0 1096 898 A 57 ASN HA A 58 ARG H 1.0 1.8 5.0 1097 899 A 57 ASN HBy A 58 ARG H 1.0 1.8 5.0 1098 900 A 57 ASN HBx A 58 ARG H 1.0 1.8 5.0 1099 901 A 57 ASN HBx A 58 ARG HGx 1.0 1.8 7.0 1100 902 A 57 ASN H A 58 ARG H 1.0 1.8 3.5 1101 903 A 58 ARG HA A 59 HIS H 1.0 1.8 5.0 1102 904 A 58 ARG HBy A 59 HIS H 1.0 1.8 5.0 1103 905 A 58 ARG HBy A 59 HIS HD2 1.0 1.8 7.0 1104 906 A 58 ARG HBx A 59 HIS H 1.0 1.8 4.0 1105 907 A 58 ARG HBx A 59 HIS HD2 1.0 1.8 5.0 1106 908 A 58 ARG HBx A 59 HIS HE1 1.0 1.8 7.0 1107 909 A 59 HIS HD2 A 58 ARG HDy 1.0 1.8 7.0 1108 909 A 58 ARG HDx A 59 HIS HD2 1.0 1.8 7.0 1109 910 A 58 ARG HGy A 59 HIS H 1.0 1.8 7.0 1110 911 A 58 ARG H A 59 HIS H 1.0 1.8 3.5 1111 912 A 59 HIS HA A 60 PHE H 1.0 1.8 4.0 1112 913 A 59 HIS HA A 60 PHE HD% 1.0 1.8 7.5 1113 914 A 59 HIS HBx A 60 PHE H 1.0 1.8 4.0 1114 915 A 59 HIS HBx A 60 PHE HD% 1.0 1.8 7.5 1115 916 A 59 HIS HBy A 60 PHE H 1.0 1.8 5.0 1116 917 A 59 HIS HBy A 60 PHE HA 1.0 1.8 7.0 1117 918 A 59 HIS HBy A 60 PHE HD% 1.0 1.8 7.5 1118 919 A 59 HIS H A 60 PHE H 1.0 1.8 3.5 1119 920 A 59 HIS H A 60 PHE HD% 1.0 1.8 7.5 1120 921 A 60 PHE HA A 61 VAL H 1.0 1.8 3.5 1121 922 A 60 PHE HA A 61 VAL HA 1.0 1.8 7.0 1122 923 A 60 PHE HA A 61 VAL HGx% 1.0 1.8 7.0 1123 923 A 60 PHE HA A 61 VAL HGy% 1.0 1.8 7.0 1124 924 A 60 PHE HBy A 61 VAL H 1.0 1.8 4.0 1125 925 A 60 PHE HBy A 61 VAL HGx% 1.0 1.8 7.0 1126 925 A 60 PHE HBy A 61 VAL HGy% 1.0 1.8 7.0 1127 926 A 60 PHE HBx A 61 VAL H 1.0 1.8 5.0 1128 927 A 60 PHE HBx A 61 VAL HGx% 1.0 1.8 7.0 1129 927 A 60 PHE HBx A 61 VAL HGy% 1.0 1.8 7.0 1130 928 A 60 PHE HD% A 61 VAL H 1.0 1.8 7.5 1131 929 A 60 PHE H A 61 VAL H 1.0 1.8 7.0 1132 930 A 61 VAL HA A 62 ASN H 1.0 1.8 3.0 1133 931 A 62 ASN H A 61 VAL HGx% 1.0 1.8 5.0 1134 931 A 61 VAL HGy% A 62 ASN H 1.0 1.8 5.0 1135 932 A 62 ASN HA A 61 VAL HGx% 1.0 1.8 7.0 1136 932 A 61 VAL HGy% A 62 ASN HA 1.0 1.8 7.0 1137 933 A 61 VAL H A 62 ASN H 1.0 1.8 7.0 1138 934 A 63 LEU H A 62 ASN HA 1.0 1.8 3.0 1139 935 A 63 LEU HBy A 62 ASN HA 1.0 1.8 7.0 1140 936 A 63 LEU HBx A 62 ASN HA 1.0 1.8 7.0 1141 937 A 62 ASN HBy A 63 LEU H 1.0 1.8 5.0 1142 938 A 62 ASN HBy A 63 LEU HA 1.0 1.8 7.0 1143 939 A 62 ASN HBx A 63 LEU H 1.0 1.8 7.0 1144 940 A 62 ASN HBx A 63 LEU HA 1.0 1.8 7.0 1145 941 A 62 ASN H A 63 LEU H 1.0 1.8 7.0 1146 942 A 63 LEU HA A 64 LYS H 1.0 1.8 3.0 1147 943 A 63 LEU HBy A 64 LYS H 1.0 1.8 5.0 1148 944 A 63 LEU HBx A 64 LYS H 1.0 1.8 5.0 1149 945 A 64 LYS H A 63 LEU HDx% 1.0 1.8 5.5 1150 945 A 63 LEU HDy% A 64 LYS H 1.0 1.8 5.5 1151 946 A 63 LEU HG A 64 LYS H 1.0 1.8 4.0 1152 947 A 63 LEU H A 64 LYS H 1.0 1.8 7.0 1153 948 A 65 MET H A 64 LYS HB2 1.0 1.8 5.0 1154 948 A 64 LYS HB3 A 65 MET H 1.0 1.8 5.0 1155 949 A 65 MET HA A 66 ASP H 1.0 1.8 3.0 1156 950 A 65 MET HBy A 66 ASP H 1.0 1.8 5.0 1157 951 A 65 MET HBx A 66 ASP H 1.0 1.8 5.0 1158 952 A 66 ASP H A 65 MET HGy 1.0 1.8 5.0 1159 952 A 65 MET HGx A 66 ASP H 1.0 1.8 5.0 1160 953 A 65 MET H A 66 ASP H 1.0 1.8 7.0 1161 954 A 66 ASP HA A 67 MET H 1.0 1.8 3.5 1162 955 A 66 ASP HA A 67 MET HA 1.0 1.8 7.0 1163 956 A 66 ASP HBy A 67 MET H 1.0 1.8 5.0 1164 957 A 66 ASP HBx A 67 MET H 1.0 1.8 4.0 1165 958 A 66 ASP HBx A 67 MET HBx 1.0 1.8 5.0 1166 959 A 67 MET HA A 68 GLU H 1.0 1.8 5.0 1167 960 A 67 MET HBx A 68 GLU H 1.0 1.8 5.0 1168 961 A 68 GLU H A 67 MET HG2 1.0 1.8 7.0 1169 961 A 67 MET HG3 A 68 GLU H 1.0 1.8 7.0 1170 962 A 67 MET H A 68 GLU H 1.0 1.8 4.0 1171 963 A 68 GLU HA A 69 LYS H 1.0 1.8 4.0 1172 964 A 68 GLU HBx A 69 LYS H 1.0 1.8 5.0 1173 965 A 68 GLU HGy A 69 LYS H 1.0 1.8 5.0 1174 966 A 68 GLU HGx A 69 LYS H 1.0 1.8 5.0 1175 967 A 68 GLU H A 69 LYS H 1.0 1.8 4.0 1176 968 A 68 GLU H A 69 LYS HA 1.0 1.8 7.0 1177 969 A 68 GLU H A 69 LYS HG2 1.0 1.8 7.0 1178 969 A 68 GLU H A 69 LYS HG3 1.0 1.8 7.0 1179 970 A 69 LYS HA A 70 GLY HAy 1.0 1.8 7.0 1180 971 A 69 LYS HA A 70 GLY HAx 1.0 1.8 7.0 1181 972 A 69 LYS HBy A 70 GLY HAy 1.0 1.8 7.0 1182 973 A 69 LYS HBy A 70 GLY HAx 1.0 1.8 7.0 1183 974 A 69 LYS HBx A 70 GLY HAx 1.0 1.8 7.0 1184 975 A 70 GLY HAy A 69 LYS HG2 1.0 1.8 7.0 1185 975 A 69 LYS HG3 A 70 GLY HAy 1.0 1.8 7.0 1186 976 A 70 GLY HAx A 69 LYS HG2 1.0 1.8 7.0 1187 976 A 69 LYS HG3 A 70 GLY HAx 1.0 1.8 7.0 1188 977 A 70 GLY HAy A 71 GLU HBx 1.0 1.8 7.0 1189 978 A 70 GLY HAy A 71 GLU HG2 1.0 1.8 7.0 1190 978 A 70 GLY HAy A 71 GLU HG3 1.0 1.8 7.0 1191 979 A 70 GLY HAx A 71 GLU HBy 1.0 1.8 7.0 1192 980 A 70 GLY HAx A 71 GLU HBx 1.0 1.8 7.0 1193 981 A 70 GLY HAx A 71 GLU HG2 1.0 1.8 7.0 1194 981 A 70 GLY HAx A 71 GLU HG3 1.0 1.8 7.0 1195 982 A 71 GLU HA A 72 GLY H 1.0 1.8 5.0 1196 983 A 71 GLU HBy A 72 GLY H 1.0 1.8 5.0 1197 984 A 71 GLU HBy A 72 GLY HAy 1.0 1.8 5.0 1198 985 A 71 GLU HBx A 72 GLY H 1.0 1.8 5.0 1199 986 A 72 GLY H A 71 GLU HG2 1.0 1.8 5.0 1200 986 A 71 GLU HG3 A 72 GLY H 1.0 1.8 5.0 1201 987 A 73 VAL H A 72 GLY HAy 1.0 1.8 3.5 1202 988 A 73 VAL H A 72 GLY HAx 1.0 1.8 5.0 1203 989 A 73 VAL H A 72 GLY H 1.0 1.8 3.5 1204 990 A 73 VAL HGx% A 72 GLY H 1.0 1.8 7.5 1205 991 A 73 VAL HGy% A 72 GLY H 1.0 1.8 7.5 1206 992 A 73 VAL HA A 74 GLU H 1.0 1.8 5.0 1207 993 A 73 VAL HGx% A 74 GLU H 1.0 1.8 7.5 1208 994 A 73 VAL HGy% A 74 GLU H 1.0 1.8 7.5 1209 995 A 73 VAL H A 74 GLU H 1.0 1.8 3.5 1210 996 A 73 VAL H A 74 GLU HA 1.0 1.8 7.0 1211 997 A 75 LEU H A 74 GLU HA 1.0 1.8 5.0 1212 998 A 74 GLU HBx A 75 LEU H 1.0 1.8 3.5 1213 999 A 74 GLU HBx A 75 LEU HDy% 1.0 1.8 5.5 1214 999 A 74 GLU HBx A 75 LEU HDx% 1.0 1.8 5.5 1215 1000 A 74 GLU HBx A 75 LEU HDx% 1.0 1.8 7.0 1216 1000 A 74 GLU HBx A 75 LEU HDy% 1.0 1.8 7.0 1217 1001 A 75 LEU H A 74 GLU HG2 1.0 1.8 5.0 1218 1001 A 74 GLU HG3 A 75 LEU H 1.0 1.8 5.0 1219 1002 A 74 GLU H A 75 LEU H 1.0 1.8 3.5 1220 1003 A 74 GLU H A 75 LEU HBx 1.0 1.8 7.0 1221 1004 A 75 LEU H A 76 ARG H 1.0 1.8 3.5 1222 1005 A 76 ARG HA A 77 LYS H 1.0 1.8 5.0 1223 1006 A 77 LYS H A 76 ARG HBy 1.0 1.8 4.0 1224 1007 A 77 LYS H A 76 ARG HBx 1.0 1.8 5.0 1225 1008 A 77 LYS H A 76 ARG HDy 1.0 1.8 7.0 1226 1009 A 76 ARG H A 77 LYS H 1.0 1.8 4.0 1227 1010 A 78 LYS H A 77 LYS HA 1.0 1.8 4.0 1228 1011 A 78 LYS H A 77 LYS HB2 1.0 1.8 3.5 1229 1011 A 77 LYS HB3 A 78 LYS H 1.0 1.8 3.5 1230 1012 A 77 LYS H A 78 LYS H 1.0 1.8 3.5 1231 1013 A 77 LYS H A 78 LYS HA 1.0 1.8 5.0 1232 1014 A 78 LYS HA A 79 TYR H 1.0 1.8 4.0 1233 1015 A 78 LYS HA A 79 TYR HD% 1.0 1.8 7.5 1234 1016 A 78 LYS HBy A 79 TYR H 1.0 1.8 4.0 1235 1017 A 78 LYS HBy A 79 TYR HD% 1.0 1.8 5.5 1236 1018 A 78 LYS HBy A 79 TYR HE% 1.0 1.8 7.5 1237 1019 A 78 LYS HBx A 79 TYR H 1.0 1.8 4.0 1238 1020 A 78 LYS HBx A 79 TYR HD% 1.0 1.8 7.5 1239 1021 A 78 LYS HBx A 79 TYR HE% 1.0 1.8 7.5 1240 1022 A 78 LYS HDy A 79 TYR HD% 1.0 1.8 7.5 1241 1023 A 78 LYS HDy A 79 TYR HE% 1.0 1.8 7.5 1242 1024 A 78 LYS HDx A 79 TYR HD% 1.0 1.8 5.5 1243 1025 A 78 LYS HDx A 79 TYR HE% 1.0 1.8 7.5 1244 1026 A 78 LYS HEy A 79 TYR HD% 1.0 1.8 7.5 1245 1027 A 78 LYS HEy A 79 TYR HE% 1.0 1.8 7.5 1246 1028 A 79 TYR HD% A 78 LYS HEx 1.0 1.8 7.5 1247 1029 A 79 TYR HE% A 78 LYS HEx 1.0 1.8 7.5 1248 1030 A 79 TYR HE% A 78 LYS HEx 1.0 1.8 7.5 1249 1030 A 78 LYS HEy A 79 TYR HE% 1.0 1.8 7.5 1250 1031 A 78 LYS HGy A 79 TYR H 1.0 1.8 5.5 1251 1032 A 78 LYS HGx A 79 TYR H 1.0 1.8 5.5 1252 1033 A 78 LYS HGx A 79 TYR HD% 1.0 1.8 5.0 1253 1034 A 78 LYS HGx A 79 TYR HE% 1.0 1.8 5.0 1254 1035 A 79 TYR HA A 80 GLY H 1.0 1.8 5.0 1255 1036 A 79 TYR HBy A 80 GLY H 1.0 1.8 7.0 1256 1037 A 79 TYR HBx A 80 GLY H 1.0 1.8 5.0 1257 1038 A 79 TYR HD% A 80 GLY H 1.0 1.8 7.5 1258 1039 A 79 TYR H A 80 GLY H 1.0 1.8 3.5 1259 1040 A 81 VAL H A 80 GLY HAy 1.0 1.8 3.5 1260 1041 A 81 VAL H A 80 GLY HAx 1.0 1.8 3.5 1261 1042 A 81 VAL H A 80 GLY H 1.0 1.8 3.5 1262 1043 A 80 GLY H A 81 VAL HGx% 1.0 1.8 7.0 1263 1043 A 81 VAL HGy% A 80 GLY H 1.0 1.8 7.0 1264 1044 A 82 HIS HE1 A 81 VAL HGx% 1.0 1.8 7.0 1265 1044 A 81 VAL HGy% A 82 HIS HE1 1.0 1.8 7.0 1266 1045 A 82 HIS HA A 83 ALA H 1.0 1.8 5.0 1267 1046 A 82 HIS HBy A 83 ALA H 1.0 1.8 7.0 1268 1047 A 82 HIS HBx A 83 ALA H 1.0 1.8 7.0 1269 1048 A 84 TYR H A 83 ALA HA 1.0 1.8 3.0 1270 1049 A 84 TYR HD% A 83 ALA HA 1.0 1.8 7.5 1271 1050 A 84 TYR HE% A 83 ALA HA 1.0 1.8 7.5 1272 1051 A 83 ALA HB% A 84 TYR H 1.0 1.8 5.0 1273 1052 A 83 ALA H A 84 TYR H 1.0 1.8 7.0 1274 1053 A 83 ALA H A 84 TYR HE% 1.0 1.8 7.5 1275 1054 A 84 TYR HA A 85 PRO HBy 1.0 1.8 7.0 1276 1055 A 85 PRO HA A 84 TYR HBx 1.0 1.8 4.0 1277 1055 A 84 TYR HBy A 85 PRO HA 1.0 1.8 4.0 1278 1056 A 84 TYR HD% A 85 PRO HA 1.0 1.8 7.5 1279 1057 A 85 PRO HA A 86 THR H 1.0 1.8 3.5 1280 1058 A 85 PRO HBy A 86 THR H 1.0 1.8 5.0 1281 1059 A 86 THR HA A 87 LEU H 1.0 1.8 3.0 1282 1060 A 86 THR HA A 87 LEU HBx 1.0 1.8 7.0 1283 1061 A 86 THR HA A 87 LEU HDx% 1.0 1.8 7.5 1284 1061 A 86 THR HA A 87 LEU HDy% 1.0 1.8 7.5 1285 1062 A 86 THR HA A 87 LEU HDy% 1.0 1.8 7.5 1286 1062 A 86 THR HA A 87 LEU HDx% 1.0 1.8 7.5 1287 1063 A 86 THR HB A 87 LEU H 1.0 1.8 7.0 1288 1064 A 86 THR HG1 A 87 LEU H 1.0 1.8 7.0 1289 1065 A 87 LEU HA A 88 LEU H 1.0 1.8 3.0 1290 1066 A 87 LEU HA A 88 LEU HBy 1.0 1.8 5.0 1291 1067 A 87 LEU HBx A 88 LEU H 1.0 1.8 5.0 1292 1068 A 87 LEU HBy A 88 LEU H 1.0 1.8 5.0 1293 1069 A 87 LEU HDy% A 88 LEU H 1.0 1.8 7.5 1294 1069 A 88 LEU H A 87 LEU HDx% 1.0 1.8 7.5 1295 1070 A 87 LEU H A 88 LEU H 1.0 1.8 7.0 1296 1071 A 88 LEU HA A 89 PHE HBy 1.0 1.8 7.0 1297 1072 A 88 LEU HA A 89 PHE HD% 1.0 1.8 7.5 1298 1073 A 88 LEU HBy A 89 PHE H 1.0 1.8 5.0 1299 1074 A 89 PHE H A 88 LEU HDx% 1.0 1.8 7.5 1300 1074 A 88 LEU HDy% A 89 PHE H 1.0 1.8 7.5 1301 1075 A 88 LEU HDy% A 89 PHE H 1.0 1.8 7.5 1302 1075 A 89 PHE H A 88 LEU HDx% 1.0 1.8 7.5 1303 1076 A 88 LEU H A 89 PHE H 1.0 1.8 5.0 1304 1077 A 89 PHE HA A 90 ILE H 1.0 1.8 3.0 1305 1078 A 89 PHE HA A 90 ILE HB 1.0 1.8 7.0 1306 1079 A 89 PHE HA A 90 ILE HD1% 1.0 1.8 7.5 1307 1080 A 89 PHE HA A 90 ILE HG1x 1.0 1.8 7.0 1308 1081 A 89 PHE HBy A 90 ILE H 1.0 1.8 7.0 1309 1082 A 89 PHE HBx A 90 ILE H 1.0 1.8 5.0 1310 1083 A 89 PHE HD% A 90 ILE H 1.0 1.8 7.5 1311 1084 A 89 PHE H A 90 ILE H 1.0 1.8 7.0 1312 1085 A 90 ILE HA A 91 ASN H 1.0 1.8 3.0 1313 1086 A 90 ILE HB A 91 ASN H 1.0 1.8 7.0 1314 1087 A 90 ILE HD1% A 91 ASN H 1.0 1.8 7.5 1315 1088 A 90 ILE HG1y A 91 ASN H 1.0 1.8 7.0 1316 1089 A 90 ILE HG2% A 91 ASN H 1.0 1.8 5.0 1317 1090 A 90 ILE H A 91 ASN H 1.0 1.8 7.0 1318 1091 A 91 ASN HA A 92 SER H 1.0 1.8 3.5 1319 1092 A 91 ASN HBy A 92 SER H 1.0 1.8 3.5 1320 1093 A 91 ASN HBx A 92 SER H 1.0 1.8 4.0 1321 1094 A 91 ASN HD21 A 92 SER H 1.0 1.8 7.0 1322 1095 A 91 ASN HD22 A 92 SER H 1.0 1.8 7.0 1323 1096 A 93 SER H A 92 SER HA 1.0 1.8 4.0 1324 1097 A 92 SER H A 93 SER H 1.0 1.8 4.0 1325 1098 A 93 SER HA A 94 GLY H 1.0 1.8 5.0 1326 1099 A 93 SER HBx A 94 GLY H 1.0 1.8 5.0 1327 1100 A 93 SER H A 94 GLY H 1.0 1.8 3.0 1328 1101 A 93 SER H A 94 GLY HAy 1.0 1.8 5.0 1329 1102 A 95 GLU H A 94 GLY HAy 1.0 1.8 5.0 1330 1103 A 95 GLU H A 94 GLY HAx 1.0 1.8 5.0 1331 1104 A 95 GLU H A 94 GLY H 1.0 1.8 5.0 1332 1105 A 94 GLY H A 95 GLU HB2 1.0 1.8 7.0 1333 1105 A 95 GLU HB3 A 94 GLY H 1.0 1.8 7.0 1334 1106 A 94 GLY H A 95 GLU HG2 1.0 1.8 7.0 1335 1106 A 95 GLU HG3 A 94 GLY H 1.0 1.8 7.0 1336 1107 A 96 VAL H A 95 GLU HA 1.0 1.8 3.0 1337 1108 A 96 VAL H A 95 GLU HB2 1.0 1.8 4.0 1338 1108 A 95 GLU HB3 A 96 VAL H 1.0 1.8 4.0 1339 1109 A 95 GLU H A 96 VAL H 1.0 1.8 7.0 1340 1110 A 96 VAL HA A 97 VAL H 1.0 1.8 3.5 1341 1111 A 97 VAL H A 96 VAL HGy% 1.0 1.8 5.5 1342 1112 A 96 VAL H A 97 VAL H 1.0 1.8 7.0 1343 1113 A 97 VAL HA A 98 TYR H 1.0 1.8 5.0 1344 1114 A 97 VAL HB A 98 TYR H 1.0 1.8 4.0 1345 1115 A 98 TYR H A 97 VAL HGx% 1.0 1.8 5.0 1346 1115 A 97 VAL HGy% A 98 TYR H 1.0 1.8 5.0 1347 1116 A 98 TYR HBy A 97 VAL HGx% 1.0 1.8 7.0 1348 1116 A 97 VAL HGy% A 98 TYR HBy 1.0 1.8 7.0 1349 1117 A 98 TYR HBx A 97 VAL HGx% 1.0 1.8 7.0 1350 1117 A 97 VAL HGy% A 98 TYR HBx 1.0 1.8 7.0 1351 1118 A 97 VAL H A 98 TYR H 1.0 1.8 3.5 1352 1119 A 98 TYR HA A 99 ARG H 1.0 1.8 3.0 1353 1120 A 98 TYR HA A 99 ARG HB2 1.0 1.8 7.0 1354 1120 A 98 TYR HA A 99 ARG HB3 1.0 1.8 7.0 1355 1121 A 98 TYR HBy A 99 ARG H 1.0 1.8 7.0 1356 1122 A 98 TYR HBx A 99 ARG H 1.0 1.8 5.0 1357 1123 A 98 TYR HD% A 99 ARG H 1.0 1.8 7.5 1358 1124 A 98 TYR HD% A 99 ARG HA 1.0 1.8 7.5 1359 1125 A 98 TYR HE% A 99 ARG HA 1.0 1.8 7.5 1360 1126 A 98 TYR H A 99 ARG H 1.0 1.8 5.0 1361 1127 A 99 ARG HA A 100 LEU H 1.0 1.8 3.0 1362 1128 A 100 LEU H A 99 ARG HB2 1.0 1.8 4.0 1363 1128 A 99 ARG HB3 A 100 LEU H 1.0 1.8 4.0 1364 1129 A 100 LEU H A 99 ARG HG2 1.0 1.8 4.0 1365 1129 A 99 ARG HG3 A 100 LEU H 1.0 1.8 4.0 1366 1130 A 99 ARG H A 100 LEU H 1.0 1.8 7.0 1367 1131 A 100 LEU HA A 101 VAL H 1.0 1.8 3.0 1368 1132 A 101 VAL H A 100 LEU HDx% 1.0 1.8 5.0 1369 1132 A 100 LEU HDy% A 101 VAL H 1.0 1.8 5.0 1370 1133 A 101 VAL HA A 102 GLY H 1.0 1.8 3.0 1371 1134 A 101 VAL HB A 102 GLY H 1.0 1.8 5.0 1372 1135 A 101 VAL HGx% A 102 GLY H 1.0 1.8 5.5 1373 1136 A 101 VAL HGx% A 102 GLY HAy 1.0 1.8 7.5 1374 1137 A 101 VAL HGx% A 102 GLY HAx 1.0 1.8 7.5 1375 1138 A 101 VAL HGy% A 102 GLY H 1.0 1.8 7.5 1376 1139 A 101 VAL H A 102 GLY H 1.0 1.8 7.0 1377 1140 A 103 ALA H A 102 GLY HAy 1.0 1.8 3.5 1378 1141 A 103 ALA HB% A 102 GLY HAy 1.0 1.8 7.5 1379 1142 A 103 ALA H A 102 GLY HAx 1.0 1.8 3.0 1380 1143 A 102 GLY HAx A 103 ALA HA 1.0 1.8 7.0 1381 1144 A 103 ALA HB% A 102 GLY HAx 1.0 1.8 7.5 1382 1145 A 104 GLU H A 103 ALA HA 1.0 1.8 3.5 1383 1146 A 103 ALA HB% A 104 GLU H 1.0 1.8 7.5 1384 1147 A 103 ALA H A 104 GLU H 1.0 1.8 7.0 1385 1148 A 105 ASP H A 104 GLU HA 1.0 1.8 3.0 1386 1149 A 104 GLU HBy A 105 ASP H 1.0 1.8 5.0 1387 1150 A 104 GLU HBx A 105 ASP H 1.0 1.8 3.5 1388 1151 A 104 GLU H A 105 ASP H 1.0 1.8 7.0 1389 1152 A 106 ALA H A 105 ASP HA 1.0 1.8 3.5 1390 1153 A 106 ALA HB% A 105 ASP HA 1.0 1.8 7.5 1391 1154 A 105 ASP HBx A 106 ALA H 1.0 1.8 4.0 1392 1155 A 105 ASP H A 106 ALA H 1.0 1.8 7.0 1393 1156 A 106 ALA HB% A 107 PRO HA 1.0 1.8 5.5 1394 1157 A 106 ALA HB% A 107 PRO HDy 1.0 1.8 5.0 1395 1158 A 106 ALA HB% A 107 PRO HDx 1.0 1.8 5.5 1396 1159 A 106 ALA H A 107 PRO HDy 1.0 1.8 4.0 1397 1160 A 106 ALA H A 107 PRO HDx 1.0 1.8 4.0 1398 1161 A 106 ALA H A 107 PRO HGy 1.0 1.8 7.0 1399 1162 A 107 PRO HA A 108 GLU H 1.0 1.8 5.0 1400 1163 A 108 GLU H A 107 PRO HBy 1.0 1.8 3.5 1401 1164 A 107 PRO HBx A 108 GLU H 1.0 1.8 4.0 1402 1165 A 107 PRO HDy A 108 GLU H 1.0 1.8 4.0 1403 1166 A 107 PRO HDx A 108 GLU H 1.0 1.8 4.0 1404 1167 A 109 LEU H A 108 GLU HA 1.0 1.8 4.0 1405 1168 A 108 GLU HBy A 109 LEU H 1.0 1.8 4.0 1406 1169 A 108 GLU HBx A 109 LEU H 1.0 1.8 4.0 1407 1170 A 109 LEU H A 108 GLU HG2 1.0 1.8 7.0 1408 1170 A 108 GLU HG3 A 109 LEU H 1.0 1.8 7.0 1409 1171 A 108 GLU H A 109 LEU H 1.0 1.8 3.5 1410 1172 A 109 LEU HA A 110 LEU H 1.0 1.8 4.0 1411 1173 A 109 LEU HBx A 110 LEU H 1.0 1.8 3.5 1412 1174 A 109 LEU HBy A 110 LEU H 1.0 1.8 3.0 1413 1175 A 110 LEU H A 109 LEU HDx% 1.0 1.8 7.5 1414 1175 A 109 LEU HDy% A 110 LEU H 1.0 1.8 7.5 1415 1176 A 109 LEU HDy% A 110 LEU H 1.0 1.8 7.5 1416 1176 A 110 LEU H A 109 LEU HDx% 1.0 1.8 7.5 1417 1177 A 109 LEU H A 110 LEU H 1.0 1.8 4.0 1418 1178 A 111 LYS H A 110 LEU HA 1.0 1.8 4.0 1419 1179 A 111 LYS H A 110 LEU HBy 1.0 1.8 5.0 1420 1180 A 110 LEU HDy% A 111 LYS H 1.0 1.8 7.5 1421 1180 A 111 LYS H A 110 LEU HDx% 1.0 1.8 7.5 1422 1181 A 110 LEU H A 111 LYS H 1.0 1.8 3.0 1423 1182 A 112 LYS H A 111 LYS HB2 1.0 1.8 3.0 1424 1182 A 111 LYS HB3 A 112 LYS H 1.0 1.8 3.0 1425 1183 A 111 LYS H A 112 LYS H 1.0 1.8 4.0 1426 1184 A 112 LYS H A 113 VAL H 1.0 1.8 3.0 1427 1185 A 113 VAL HA A 114 LYS H 1.0 1.8 5.0 1428 1186 A 113 VAL HGy% A 114 LYS H 1.0 1.8 7.5 1429 1187 A 113 VAL HGy% A 114 LYS HA 1.0 1.8 7.5 1430 1188 A 113 VAL H A 114 LYS H 1.0 1.8 3.5 1431 1189 A 114 LYS HA A 115 LEU H 1.0 1.8 5.0 1432 1190 A 114 LYS H A 115 LEU H 1.0 1.8 3.5 1433 1191 A 115 LEU HA A 116 GLY H 1.0 1.8 5.0 1434 1192 A 115 LEU HBy A 116 GLY H 1.0 1.8 4.0 1435 1193 A 115 LEU HBx A 116 GLY H 1.0 1.8 4.0 1436 1194 A 116 GLY H A 115 LEU HDx% 1.0 1.8 7.0 1437 1194 A 116 GLY H A 115 LEU HDy% 1.0 1.8 7.0 1438 1195 A 115 LEU H A 116 GLY H 1.0 1.8 3.5 1439 1196 A 117 VAL H A 116 GLY HAx 1.0 1.8 4.0 1440 1197 A 117 VAL HGx% A 116 GLY HAx 1.0 1.8 7.5 1441 1198 A 117 VAL H A 116 GLY HAy 1.0 1.8 5.0 1442 1199 A 117 VAL HGx% A 116 GLY HAy 1.0 1.8 7.5 1443 1200 A 117 VAL H A 116 GLY H 1.0 1.8 3.0 1444 1201 A 117 VAL HGx% A 116 GLY H 1.0 1.8 7.5 1445 1202 A 117 VAL HGy% A 116 GLY H 1.0 1.8 7.5 1446 1203 A 117 VAL HB A 118 GLU H 1.0 1.8 5.0 1447 1204 A 117 VAL HGx% A 118 GLU H 1.0 1.8 7.5 1448 1205 A 117 VAL HGy% A 118 GLU H 1.0 1.8 5.5 1449 1206 A 117 VAL HGy% A 118 GLU HBx 1.0 1.8 7.5 1450 1207 A 117 VAL HGy% A 118 GLU HGx 1.0 1.8 7.5 1451 1208 A 117 VAL HGy% A 118 GLU HGy 1.0 1.8 7.5 1452 1209 A 117 VAL H A 118 GLU H 1.0 1.8 3.0 1453 1210 A 117 VAL H A 118 GLU HGx 1.0 1.8 7.0 1454 1211 A 117 VAL H A 118 GLU HGy 1.0 1.8 7.0 1455 1212 A 118 GLU HA A 119 SER H 1.0 1.8 4.0 1456 1213 A 118 GLU HBy A 119 SER H 1.0 1.8 7.0 1457 1214 A 119 SER H A 118 GLU HGy 1.0 1.8 7.0 1458 1215 A 119 SER H A 118 GLU HGy 1.0 1.8 7.0 1459 1215 A 119 SER H A 118 GLU HGx 1.0 1.8 7.0 1460 1216 A 120 GLU H A 119 SER HA 1.0 1.8 5.0 1461 1217 A 120 GLU HA A 121 GLY H 1.0 1.8 7.0 1462 1218 A 4 ASP HBx A 2 GLN HE21 1.0 1.8 7.0 1463 1219 A 4 ASP HBx A 2 GLN HE22 1.0 1.8 7.0 1464 1220 A 3 ALA HB% A 5 GLY H 1.0 1.8 7.5 1465 1221 A 7 ALA HB% A 5 GLY HAy 1.0 1.8 7.5 1466 1222 A 6 ILE HA A 8 PHE HD% 1.0 1.8 7.5 1467 1223 A 6 ILE HA A 8 PHE HE% 1.0 1.8 7.5 1468 1224 A 6 ILE HD1% A 8 PHE HE% 1.0 1.8 8.0 1469 1225 A 6 ILE HG1y A 8 PHE HE% 1.0 1.8 7.0 1470 1226 A 6 ILE HG2% A 8 PHE H 1.0 1.8 7.5 1471 1227 A 6 ILE HG2% A 8 PHE HA 1.0 1.8 7.5 1472 1228 A 9 ARG HDy A 11 LEU HDy% 1.0 1.8 7.5 1473 1228 A 9 ARG HDy A 11 LEU HDx% 1.0 1.8 7.5 1474 1229 A 9 ARG HDx A 11 LEU HDy% 1.0 1.8 7.5 1475 1229 A 9 ARG HDx A 11 LEU HDx% 1.0 1.8 7.5 1476 1230 A 9 ARG H A 11 LEU HDx% 1.0 1.8 7.5 1477 1230 A 9 ARG H A 11 LEU HDy% 1.0 1.8 7.5 1478 1231 A 9 ARG H A 11 LEU HDy% 1.0 1.8 7.5 1479 1231 A 9 ARG H A 11 LEU HDx% 1.0 1.8 7.5 1480 1232 A 11 LEU HA A 15 GLU HBy 1.0 1.8 5.0 1481 1233 A 11 LEU HA A 15 GLU HBx 1.0 1.8 7.0 1482 1234 A 11 LEU HBy A 15 GLU HBy 1.0 1.8 5.0 1483 1235 A 11 LEU HBy A 15 GLU HBx 1.0 1.8 5.0 1484 1236 A 11 LEU HBx A 15 GLU HBy 1.0 1.8 7.0 1485 1237 A 11 LEU HBx A 15 GLU HBx 1.0 1.8 5.0 1486 1238 A 11 LEU HDy% A 15 GLU HG2 1.0 1.8 7.5 1487 1238 A 11 LEU HDx% A 15 GLU HG2 1.0 1.8 7.5 1488 1238 A 15 GLU HG3 A 11 LEU HDx% 1.0 1.8 7.5 1489 1238 A 11 LEU HDy% A 15 GLU HG3 1.0 1.8 7.5 1490 1239 A 11 LEU HDy% A 15 GLU HBy 1.0 1.8 7.5 1491 1239 A 15 GLU HBy A 11 LEU HDx% 1.0 1.8 7.5 1492 1240 A 11 LEU HDy% A 15 GLU HG2 1.0 1.8 7.5 1493 1240 A 11 LEU HDx% A 15 GLU HG2 1.0 1.8 7.5 1494 1240 A 11 LEU HDy% A 15 GLU HG3 1.0 1.8 7.5 1495 1240 A 15 GLU HG3 A 11 LEU HDx% 1.0 1.8 7.5 1496 1241 A 11 LEU HBy A 16 ALA H 1.0 1.8 5.0 1497 1242 A 11 LEU HBy A 16 ALA HB% 1.0 1.8 5.5 1498 1243 A 11 LEU HBx A 16 ALA HB% 1.0 1.8 5.5 1499 1244 A 11 LEU HDy% A 16 ALA HA 1.0 1.8 5.5 1500 1244 A 16 ALA HA A 11 LEU HDx% 1.0 1.8 5.5 1501 1245 A 12 SER HBy A 14 PRO HGy 1.0 1.8 7.0 1502 1246 A 12 SER HBy A 14 PRO HGx 1.0 1.8 7.0 1503 1247 A 12 SER HA A 15 GLU H 1.0 1.8 5.0 1504 1248 A 12 SER HA A 15 GLU HG2 1.0 1.8 7.0 1505 1248 A 12 SER HA A 15 GLU HG3 1.0 1.8 7.0 1506 1249 A 12 SER HBy A 15 GLU H 1.0 1.8 7.0 1507 1250 A 12 SER HBy A 15 GLU HBy 1.0 1.8 7.0 1508 1251 A 12 SER HBy A 15 GLU HG2 1.0 1.8 7.0 1509 1251 A 12 SER HBy A 15 GLU HG3 1.0 1.8 7.0 1510 1252 A 12 SER HBx A 15 GLU HBy 1.0 1.8 5.0 1511 1253 A 12 SER HBx A 15 GLU HG2 1.0 1.8 7.0 1512 1253 A 12 SER HBx A 15 GLU HG3 1.0 1.8 7.0 1513 1254 A 12 SER H A 15 GLU H 1.0 1.8 7.0 1514 1255 A 12 SER H A 15 GLU HBy 1.0 1.8 5.0 1515 1256 A 12 SER H A 15 GLU HBx 1.0 1.8 5.0 1516 1257 A 12 SER H A 15 GLU HG2 1.0 1.8 4.0 1517 1257 A 12 SER H A 15 GLU HG3 1.0 1.8 4.0 1518 1258 A 12 SER H A 16 ALA H 1.0 1.8 7.0 1519 1259 A 13 PHE HA A 15 GLU H 1.0 1.8 5.0 1520 1260 A 13 PHE H A 15 GLU H 1.0 1.8 7.0 1521 1261 A 13 PHE HA A 16 ALA H 1.0 1.8 5.0 1522 1262 A 13 PHE HA A 16 ALA HB% 1.0 1.8 5.5 1523 1263 A 13 PHE HBx A 16 ALA HB% 1.0 1.8 7.5 1524 1264 A 13 PHE HD% A 16 ALA HB% 1.0 1.8 8.0 1525 1265 A 13 PHE H A 16 ALA HB% 1.0 1.8 7.5 1526 1266 A 13 PHE HA A 17 LEU H 1.0 1.8 5.0 1527 1267 A 13 PHE HD% A 17 LEU HDy% 1.0 1.8 8.0 1528 1267 A 13 PHE HD% A 17 LEU HDx% 1.0 1.8 8.0 1529 1268 A 13 PHE HE% A 17 LEU HDy% 1.0 1.8 8.0 1530 1268 A 13 PHE HE% A 17 LEU HDx% 1.0 1.8 8.0 1531 1269 A 13 PHE HE% A 17 LEU HDy% 1.0 1.8 8.0 1532 1269 A 13 PHE HE% A 17 LEU HDx% 1.0 1.8 8.0 1533 1270 A 17 LEU HDy% A 13 PHE HZ 1.0 1.8 7.5 1534 1270 A 13 PHE HZ A 17 LEU HDx% 1.0 1.8 7.5 1535 1271 A 17 LEU HDy% A 13 PHE HZ 1.0 1.8 7.5 1536 1271 A 13 PHE HZ A 17 LEU HDx% 1.0 1.8 7.5 1537 1272 A 13 PHE HZ A 17 LEU HDx% 1.0 1.8 7.0 1538 1272 A 17 LEU HDy% A 13 PHE HZ 1.0 1.8 7.0 1539 1273 A 14 PRO HA A 17 LEU H 1.0 1.8 4.0 1540 1274 A 14 PRO HA A 17 LEU HBy 1.0 1.8 5.5 1541 1275 A 14 PRO HA A 17 LEU HBx 1.0 1.8 5.5 1542 1276 A 14 PRO HA A 17 LEU HDy% 1.0 1.8 5.5 1543 1276 A 14 PRO HA A 17 LEU HDx% 1.0 1.8 5.5 1544 1277 A 14 PRO HBx A 17 LEU HDx% 1.0 1.8 7.0 1545 1277 A 14 PRO HBx A 17 LEU HDy% 1.0 1.8 7.0 1546 1278 A 15 GLU H A 17 LEU H 1.0 1.8 5.0 1547 1279 A 16 ALA H A 18 LYS H 1.0 1.8 7.0 1548 1280 A 16 ALA HA A 19 ARG H 1.0 1.8 4.0 1549 1281 A 16 ALA HA A 19 ARG HBx 1.0 1.8 5.0 1550 1282 A 16 ALA HA A 19 ARG HGy 1.0 1.8 5.5 1551 1283 A 16 ALA HA A 19 ARG HGx 1.0 1.8 5.5 1552 1284 A 16 ALA H A 19 ARG H 1.0 1.8 7.0 1553 1285 A 16 ALA HB% A 20 ALA H 1.0 1.8 7.5 1554 1286 A 17 LEU H A 19 ARG HBx 1.0 1.8 7.0 1555 1287 A 17 LEU HA A 20 ALA H 1.0 1.8 4.0 1556 1288 A 18 LYS H A 20 ALA H 1.0 1.8 7.0 1557 1289 A 21 GLU H A 18 LYS HA 1.0 1.8 4.0 1558 1290 A 18 LYS HA A 21 GLU HB2 1.0 1.8 4.0 1559 1290 A 21 GLU HB3 A 18 LYS HA 1.0 1.8 4.0 1560 1291 A 18 LYS HBx A 21 GLU H 1.0 1.8 7.0 1561 1292 A 18 LYS H A 21 GLU H 1.0 1.8 5.0 1562 1293 A 22 VAL H A 18 LYS HA 1.0 1.8 5.0 1563 1294 A 22 VAL HGy% A 18 LYS HE2 1.0 1.8 7.5 1564 1294 A 22 VAL HGy% A 18 LYS HE3 1.0 1.8 7.5 1565 1295 A 22 VAL H A 18 LYS HG2 1.0 1.8 5.0 1566 1295 A 18 LYS HG3 A 22 VAL H 1.0 1.8 5.0 1567 1296 A 19 ARG H A 21 GLU H 1.0 1.8 5.0 1568 1297 A 19 ARG HA A 22 VAL H 1.0 1.8 4.0 1569 1298 A 19 ARG HDy A 22 VAL HGy% 1.0 1.8 7.5 1570 1299 A 19 ARG HDx A 22 VAL HGx% 1.0 1.8 7.5 1571 1300 A 19 ARG HDx A 22 VAL HGy% 1.0 1.8 7.5 1572 1301 A 19 ARG HA A 23 GLU H 1.0 1.8 5.0 1573 1302 A 20 ALA H A 22 VAL HGy% 1.0 1.8 7.5 1574 1303 A 24 ASP H A 20 ALA HA 1.0 1.8 5.0 1575 1304 A 25 LYS H A 20 ALA HA 1.0 1.8 4.0 1576 1305 A 25 LYS HBx A 20 ALA HA 1.0 1.8 7.0 1577 1306 A 20 ALA HB% A 25 LYS H 1.0 1.8 7.5 1578 1307 A 23 GLU H A 21 GLU HA 1.0 1.8 5.5 1579 1308 A 23 GLU H A 21 GLU HB2 1.0 1.8 5.0 1580 1308 A 21 GLU HB3 A 23 GLU H 1.0 1.8 5.0 1581 1309 A 21 GLU H A 23 GLU H 1.0 1.8 7.0 1582 1310 A 25 LYS H A 21 GLU HA 1.0 1.8 7.0 1583 1311 A 22 VAL HA A 24 ASP H 1.0 1.8 5.0 1584 1312 A 22 VAL HGx% A 24 ASP H 1.0 1.8 7.5 1585 1313 A 22 VAL HGy% A 24 ASP H 1.0 1.8 7.5 1586 1314 A 22 VAL H A 24 ASP H 1.0 1.8 5.0 1587 1315 A 28 PHE HD% A 30 ASP HA 1.0 1.8 7.5 1588 1316 A 28 PHE HE% A 30 ASP H 1.0 1.8 7.5 1589 1317 A 28 PHE HE% A 30 ASP HA 1.0 1.8 7.5 1590 1318 A 28 PHE HE% A 30 ASP HB2 1.0 1.8 7.5 1591 1318 A 28 PHE HE% A 30 ASP HB3 1.0 1.8 7.5 1592 1319 A 30 ASP HA A 28 PHE HZ 1.0 1.8 5.0 1593 1320 A 28 PHE HZ A 30 ASP HB2 1.0 1.8 7.0 1594 1320 A 30 ASP HB3 A 28 PHE HZ 1.0 1.8 7.0 1595 1321 A 29 VAL HGy% A 31 CYS H 1.0 1.8 7.5 1596 1322 A 29 VAL HGy% A 31 CYS HA 1.0 1.8 7.5 1597 1323 A 34 THR HB A 32 PHE HE% 1.0 1.8 7.5 1598 1324 A 34 THR HG2% A 32 PHE HE% 1.0 1.8 8.0 1599 1325 A 34 THR HG2% A 32 PHE HZ 1.0 1.8 7.5 1600 1326 A 33 THR HA A 35 TRP H 1.0 1.8 7.0 1601 1327 A 33 THR HB A 35 TRP H 1.0 1.8 5.0 1602 1328 A 33 THR HG2% A 35 TRP HD1 1.0 1.8 7.5 1603 1329 A 33 THR HG2% A 35 TRP HZ2 1.0 1.8 7.5 1604 1330 A 33 THR HG2% A 35 TRP HZ3 1.0 1.8 7.5 1605 1331 A 40 LYS HBy A 37 GLY HAx 1.0 1.8 7.0 1606 1332 A 40 LYS HBx A 37 GLY HAx 1.0 1.8 7.0 1607 1333 A 40 LYS HBx A 37 GLY HAy 1.0 1.8 7.0 1608 1334 A 38 PRO HA A 41 ARG H 1.0 1.8 5.0 1609 1335 A 38 PRO HA A 41 ARG HBx 1.0 1.8 5.0 1610 1336 A 38 PRO HA A 41 ARG HDy 1.0 1.8 7.0 1611 1337 A 38 PRO HA A 41 ARG HDx 1.0 1.8 7.0 1612 1338 A 38 PRO HA A 41 ARG HDy 1.0 1.8 7.0 1613 1338 A 38 PRO HA A 41 ARG HDx 1.0 1.8 7.0 1614 1339 A 42 LEU HBy A 39 CYS HA 1.0 1.8 5.0 1615 1340 A 42 LEU HBx A 39 CYS HA 1.0 1.8 7.0 1616 1341 A 39 CYS HA A 42 LEU HDx% 1.0 1.8 7.5 1617 1341 A 42 LEU HDy% A 39 CYS HA 1.0 1.8 7.5 1618 1342 A 43 SER H A 40 LYS HA 1.0 1.8 3.5 1619 1343 A 44 LYS H A 40 LYS HA 1.0 1.8 5.0 1620 1344 A 44 LYS HB3 A 41 ARG HDx 1.0 1.8 7.0 1621 1344 A 41 ARG HDx A 44 LYS HB2 1.0 1.8 7.0 1622 1345 A 41 ARG HA A 46 VAL H 1.0 1.8 7.0 1623 1346 A 42 LEU HA A 46 VAL HB 1.0 1.8 5.5 1624 1347 A 42 LEU HA A 46 VAL HGx% 1.0 1.8 5.5 1625 1348 A 42 LEU HA A 46 VAL HGy% 1.0 1.8 7.5 1626 1349 A 42 LEU HBx A 46 VAL HB 1.0 1.8 7.0 1627 1350 A 42 LEU HDy% A 46 VAL H 1.0 1.8 7.5 1628 1350 A 46 VAL H A 42 LEU HDx% 1.0 1.8 7.5 1629 1351 A 42 LEU HDy% A 46 VAL HA 1.0 1.8 7.5 1630 1351 A 46 VAL HA A 42 LEU HDx% 1.0 1.8 7.5 1631 1352 A 42 LEU H A 46 VAL HGx% 1.0 1.8 7.5 1632 1353 A 42 LEU HA A 47 PHE HD% 1.0 1.8 7.5 1633 1354 A 42 LEU HA A 47 PHE HE% 1.0 1.8 7.5 1634 1355 A 42 LEU HBy A 47 PHE HE% 1.0 1.8 7.5 1635 1356 A 42 LEU HBx A 47 PHE HE% 1.0 1.8 7.5 1636 1357 A 42 LEU HDy% A 47 PHE H 1.0 1.8 7.5 1637 1357 A 47 PHE H A 42 LEU HDx% 1.0 1.8 7.5 1638 1358 A 42 LEU HDy% A 47 PHE HD% 1.0 1.8 8.0 1639 1358 A 47 PHE HD% A 42 LEU HDx% 1.0 1.8 8.0 1640 1359 A 42 LEU HDy% A 47 PHE HE% 1.0 1.8 8.0 1641 1359 A 47 PHE HE% A 42 LEU HDx% 1.0 1.8 8.0 1642 1360 A 47 PHE H A 43 SER HA 1.0 1.8 5.0 1643 1361 A 43 SER HA A 47 PHE HB2 1.0 1.8 4.0 1644 1361 A 47 PHE HB3 A 43 SER HA 1.0 1.8 4.0 1645 1362 A 47 PHE HD% A 43 SER HA 1.0 1.8 5.5 1646 1363 A 47 PHE HE% A 43 SER HA 1.0 1.8 7.5 1647 1364 A 43 SER HBy A 47 PHE HD% 1.0 1.8 7.5 1648 1365 A 43 SER HBy A 47 PHE HE% 1.0 1.8 7.5 1649 1366 A 43 SER HBx A 47 PHE HD% 1.0 1.8 7.5 1650 1367 A 43 SER HBx A 47 PHE HE% 1.0 1.8 7.5 1651 1368 A 46 VAL H A 44 LYS HB2 1.0 1.8 7.0 1652 1368 A 44 LYS HB3 A 46 VAL H 1.0 1.8 7.0 1653 1369 A 44 LYS H A 46 VAL H 1.0 1.8 7.0 1654 1370 A 45 VAL HA A 47 PHE H 1.0 1.8 7.0 1655 1371 A 45 VAL HB A 47 PHE H 1.0 1.8 7.0 1656 1372 A 47 PHE H A 45 VAL HG1% 1.0 1.8 7.0 1657 1372 A 45 VAL HG2% A 47 PHE H 1.0 1.8 7.0 1658 1373 A 45 VAL H A 47 PHE H 1.0 1.8 5.0 1659 1374 A 45 VAL HA A 48 LYS H 1.0 1.8 7.0 1660 1375 A 45 VAL HA A 48 LYS HBy 1.0 1.8 5.0 1661 1376 A 48 LYS H A 45 VAL HG1% 1.0 1.8 7.0 1662 1376 A 45 VAL HG2% A 48 LYS H 1.0 1.8 7.0 1663 1377 A 46 VAL HA A 48 LYS H 1.0 1.8 5.0 1664 1378 A 46 VAL HGx% A 48 LYS H 1.0 1.8 7.5 1665 1379 A 46 VAL HGy% A 48 LYS H 1.0 1.8 7.5 1666 1380 A 46 VAL H A 48 LYS H 1.0 1.8 7.0 1667 1381 A 46 VAL HA A 49 ASP HBy 1.0 1.8 7.0 1668 1382 A 47 PHE H A 49 ASP H 1.0 1.8 5.0 1669 1383 A 47 PHE HD% A 52 VAL HGy% 1.0 1.8 8.0 1670 1384 A 47 PHE H A 52 VAL HGy% 1.0 1.8 7.5 1671 1385 A 51 LEU H A 49 ASP HA 1.0 1.8 7.0 1672 1386 A 49 ASP HBy A 51 LEU H 1.0 1.8 7.0 1673 1387 A 49 ASP HBx A 51 LEU HDx% 1.0 1.8 7.5 1674 1387 A 49 ASP HBx A 51 LEU HDy% 1.0 1.8 7.5 1675 1388 A 49 ASP HBy A 52 VAL H 1.0 1.8 5.0 1676 1389 A 49 ASP HBy A 52 VAL HB 1.0 1.8 5.0 1677 1390 A 49 ASP HBy A 52 VAL HGx% 1.0 1.8 5.5 1678 1391 A 49 ASP HBy A 52 VAL HGy% 1.0 1.8 7.5 1679 1392 A 49 ASP HBx A 52 VAL H 1.0 1.8 5.0 1680 1393 A 49 ASP HBx A 52 VAL HB 1.0 1.8 5.0 1681 1394 A 49 ASP HBx A 52 VAL HGx% 1.0 1.8 7.5 1682 1395 A 49 ASP HBx A 52 VAL HGy% 1.0 1.8 7.5 1683 1396 A 49 ASP H A 52 VAL H 1.0 1.8 7.0 1684 1397 A 49 ASP H A 52 VAL HGy% 1.0 1.8 7.5 1685 1398 A 49 ASP HBy A 53 ALA H 1.0 1.8 5.5 1686 1399 A 52 VAL H A 50 SER HA 1.0 1.8 7.0 1687 1400 A 52 VAL HGx% A 50 SER HA 1.0 1.8 7.5 1688 1401 A 53 ALA H A 50 SER HA 1.0 1.8 5.0 1689 1402 A 53 ALA HB% A 50 SER HA 1.0 1.8 5.5 1690 1403 A 54 ASP H A 50 SER HA 1.0 1.8 5.0 1691 1404 A 51 LEU HA A 53 ALA H 1.0 1.8 7.0 1692 1405 A 51 LEU HDy% A 54 ASP H 1.0 1.8 7.5 1693 1405 A 54 ASP H A 51 LEU HDx% 1.0 1.8 7.5 1694 1406 A 52 VAL HGy% A 54 ASP H 1.0 1.8 7.5 1695 1407 A 52 VAL HA A 55 TYR H 1.0 1.8 5.0 1696 1408 A 52 VAL HA A 55 TYR HBy 1.0 1.8 7.0 1697 1409 A 52 VAL HA A 55 TYR HBx 1.0 1.8 5.0 1698 1410 A 52 VAL HA A 55 TYR HD% 1.0 1.8 7.5 1699 1411 A 52 VAL HA A 56 PHE HD% 1.0 1.8 7.5 1700 1412 A 52 VAL HA A 56 PHE HE% 1.0 1.8 7.5 1701 1413 A 52 VAL HGx% A 56 PHE HD% 1.0 1.8 8.0 1702 1414 A 52 VAL HGy% A 56 PHE HBy 1.0 1.8 7.5 1703 1415 A 52 VAL HGy% A 56 PHE HD% 1.0 1.8 8.0 1704 1416 A 52 VAL HGy% A 56 PHE HE% 1.0 1.8 8.0 1705 1417 A 53 ALA HB% A 55 TYR H 1.0 1.8 7.5 1706 1418 A 56 PHE H A 53 ALA HA 1.0 1.8 5.0 1707 1419 A 56 PHE HBy A 53 ALA HA 1.0 1.8 5.0 1708 1420 A 56 PHE HBx A 53 ALA HA 1.0 1.8 7.0 1709 1421 A 56 PHE HD% A 53 ALA HA 1.0 1.8 7.5 1710 1422 A 53 ALA HB% A 56 PHE HBy 1.0 1.8 7.5 1711 1423 A 53 ALA H A 56 PHE HD% 1.0 1.8 7.5 1712 1424 A 57 ASN H A 53 ALA HA 1.0 1.8 7.0 1713 1425 A 53 ALA HB% A 57 ASN H 1.0 1.8 7.5 1714 1426 A 53 ALA HB% A 57 ASN HBx 1.0 1.8 7.5 1715 1427 A 53 ALA HB% A 57 ASN HD21 1.0 1.8 7.5 1716 1428 A 53 ALA HB% A 57 ASN HD22 1.0 1.8 7.5 1717 1429 A 54 ASP H A 56 PHE H 1.0 1.8 7.0 1718 1430 A 57 ASN H A 54 ASP HA 1.0 1.8 5.0 1719 1431 A 57 ASN HBy A 54 ASP HA 1.0 1.8 5.0 1720 1432 A 57 ASN HBx A 54 ASP HA 1.0 1.8 5.0 1721 1433 A 57 ASN HD21 A 54 ASP HA 1.0 1.8 7.0 1722 1434 A 57 ASN HD22 A 54 ASP HA 1.0 1.8 7.0 1723 1435 A 58 ARG H A 54 ASP HA 1.0 1.8 7.0 1724 1436 A 55 TYR HA A 57 ASN H 1.0 1.8 7.0 1725 1437 A 55 TYR H A 57 ASN H 1.0 1.8 7.0 1726 1438 A 55 TYR HA A 58 ARG HBy 1.0 1.8 5.0 1727 1439 A 55 TYR HA A 59 HIS HD2 1.0 1.8 4.0 1728 1440 A 55 TYR HA A 59 HIS HE1 1.0 1.8 7.0 1729 1441 A 55 TYR HD% A 59 HIS HD2 1.0 1.8 7.5 1730 1442 A 55 TYR HD% A 59 HIS HE1 1.0 1.8 7.5 1731 1443 A 55 TYR HE% A 59 HIS HBx 1.0 1.8 7.5 1732 1444 A 55 TYR HE% A 59 HIS HBy 1.0 1.8 7.5 1733 1445 A 55 TYR HE% A 59 HIS HD2 1.0 1.8 7.5 1734 1446 A 55 TYR HE% A 60 PHE HE% 1.0 1.8 7.0 1735 1447 A 56 PHE HA A 58 ARG H 1.0 1.8 5.0 1736 1448 A 56 PHE HA A 59 HIS HBx 1.0 1.8 7.0 1737 1449 A 56 PHE HA A 59 HIS HBy 1.0 1.8 7.0 1738 1450 A 56 PHE H A 59 HIS H 1.0 1.8 7.0 1739 1451 A 56 PHE HA A 60 PHE HA 1.0 1.8 7.0 1740 1452 A 56 PHE HA A 60 PHE HBx 1.0 1.8 7.0 1741 1453 A 56 PHE HA A 60 PHE HD% 1.0 1.8 5.5 1742 1454 A 56 PHE HBy A 60 PHE HD% 1.0 1.8 7.5 1743 1455 A 56 PHE HBx A 60 PHE HD% 1.0 1.8 7.5 1744 1456 A 56 PHE HD% A 60 PHE HD% 1.0 1.8 8.0 1745 1457 A 56 PHE HE% A 60 PHE HD% 1.0 1.8 8.0 1746 1458 A 56 PHE H A 60 PHE HD% 1.0 1.8 7.5 1747 1459 A 57 ASN H A 59 HIS H 1.0 1.8 7.0 1748 1460 A 57 ASN HA A 60 PHE H 1.0 1.8 7.0 1749 1461 A 57 ASN HA A 62 ASN HD21 1.0 1.8 5.0 1750 1462 A 57 ASN HA A 62 ASN HD22 1.0 1.8 4.0 1751 1463 A 57 ASN H A 62 ASN HD21 1.0 1.8 7.0 1752 1464 A 58 ARG H A 60 PHE H 1.0 1.8 5.0 1753 1465 A 60 PHE H A 62 ASN HD21 1.0 1.8 7.0 1754 1466 A 60 PHE H A 62 ASN HD22 1.0 1.8 7.0 1755 1467 A 63 LEU HBy A 61 VAL HGx% 1.0 1.8 5.0 1756 1467 A 61 VAL HGy% A 63 LEU HBy 1.0 1.8 5.0 1757 1468 A 63 LEU HBx A 61 VAL HGx% 1.0 1.8 5.0 1758 1468 A 61 VAL HGy% A 63 LEU HBx 1.0 1.8 5.0 1759 1469 A 65 MET HE% A 63 LEU HDx% 1.0 1.8 8.0 1760 1469 A 63 LEU HDy% A 65 MET HE% 1.0 1.8 8.0 1761 1470 A 63 LEU HDy% A 65 MET HBy 1.0 1.8 7.5 1762 1470 A 65 MET HBy A 63 LEU HDx% 1.0 1.8 7.5 1763 1471 A 63 LEU HDy% A 65 MET HBx 1.0 1.8 7.5 1764 1471 A 65 MET HBx A 63 LEU HDx% 1.0 1.8 7.5 1765 1472 A 63 LEU HDy% A 65 MET HE% 1.0 1.8 8.0 1766 1472 A 65 MET HE% A 63 LEU HDx% 1.0 1.8 8.0 1767 1473 A 66 ASP HA A 68 GLU H 1.0 1.8 7.0 1768 1474 A 66 ASP HBy A 69 LYS H 1.0 1.8 5.5 1769 1475 A 66 ASP HBy A 69 LYS HBy 1.0 1.8 5.0 1770 1476 A 66 ASP HBy A 69 LYS HBx 1.0 1.8 5.0 1771 1477 A 67 MET H A 69 LYS H 1.0 1.8 7.0 1772 1478 A 67 MET HA A 72 GLY H 1.0 1.8 5.5 1773 1479 A 67 MET HA A 72 GLY HAy 1.0 1.8 4.0 1774 1480 A 67 MET HA A 72 GLY HAx 1.0 1.8 4.0 1775 1481 A 67 MET HE% A 72 GLY HAx 1.0 1.8 7.5 1776 1482 A 68 GLU HA A 73 VAL HGx% 1.0 1.8 5.5 1777 1483 A 69 LYS HBx A 72 GLY H 1.0 1.8 7.0 1778 1484 A 69 LYS H A 72 GLY H 1.0 1.8 7.0 1779 1485 A 69 LYS H A 72 GLY HAy 1.0 1.8 7.0 1780 1486 A 69 LYS H A 72 GLY HAx 1.0 1.8 5.0 1781 1487 A 73 VAL HGx% A 69 LYS HA 1.0 1.8 5.5 1782 1488 A 69 LYS H A 73 VAL HGx% 1.0 1.8 7.5 1783 1489 A 70 GLY HAy A 72 GLY H 1.0 1.8 7.0 1784 1490 A 70 GLY HAx A 72 GLY H 1.0 1.8 7.0 1785 1491 A 73 VAL HGx% A 70 GLY HAy 1.0 1.8 7.5 1786 1492 A 73 VAL HGx% A 70 GLY HAx 1.0 1.8 7.5 1787 1493 A 73 VAL H A 71 GLU HA 1.0 1.8 5.0 1788 1494 A 74 GLU H A 71 GLU HBy 1.0 1.8 5.5 1789 1495 A 75 LEU H A 71 GLU HA 1.0 1.8 7.0 1790 1496 A 75 LEU HDy% A 71 GLU HG2 1.0 1.8 7.5 1791 1496 A 71 GLU HG3 A 75 LEU HDx% 1.0 1.8 7.5 1792 1496 A 71 GLU HG3 A 75 LEU HDy% 1.0 1.8 7.5 1793 1496 A 71 GLU HG2 A 75 LEU HDx% 1.0 1.8 7.5 1794 1497 A 71 GLU HG2 A 75 LEU HDx% 1.0 1.8 7.5 1795 1497 A 71 GLU HG3 A 75 LEU HDy% 1.0 1.8 7.5 1796 1497 A 71 GLU HG3 A 75 LEU HDx% 1.0 1.8 7.5 1797 1497 A 75 LEU HDy% A 71 GLU HG2 1.0 1.8 7.5 1798 1498 A 74 GLU H A 72 GLY H 1.0 1.8 7.0 1799 1499 A 75 LEU H A 72 GLY HAy 1.0 1.8 5.0 1800 1500 A 75 LEU HBy A 72 GLY HAy 1.0 1.8 5.0 1801 1501 A 75 LEU HBx A 72 GLY HAy 1.0 1.8 7.0 1802 1502 A 72 GLY HAy A 75 LEU HDy% 1.0 1.8 7.5 1803 1502 A 72 GLY HAy A 75 LEU HDx% 1.0 1.8 7.5 1804 1503 A 75 LEU H A 72 GLY HAx 1.0 1.8 7.0 1805 1504 A 75 LEU HBy A 72 GLY HAx 1.0 1.8 5.0 1806 1505 A 75 LEU HBx A 72 GLY HAx 1.0 1.8 7.0 1807 1506 A 72 GLY HAx A 75 LEU HDy% 1.0 1.8 7.5 1808 1506 A 72 GLY HAx A 75 LEU HDx% 1.0 1.8 7.5 1809 1507 A 75 LEU HBy A 72 GLY H 1.0 1.8 7.0 1810 1508 A 72 GLY H A 75 LEU HDy% 1.0 1.8 7.5 1811 1508 A 72 GLY H A 75 LEU HDx% 1.0 1.8 7.5 1812 1509 A 73 VAL HGy% A 75 LEU H 1.0 1.8 7.5 1813 1510 A 73 VAL H A 75 LEU H 1.0 1.8 7.0 1814 1511 A 73 VAL HA A 76 ARG H 1.0 1.8 4.0 1815 1512 A 73 VAL HA A 76 ARG HBy 1.0 1.8 4.0 1816 1513 A 73 VAL HA A 76 ARG HBx 1.0 1.8 5.0 1817 1514 A 73 VAL HA A 76 ARG HDy 1.0 1.8 7.0 1818 1514 A 73 VAL HA A 76 ARG HDx 1.0 1.8 7.0 1819 1515 A 73 VAL HGx% A 76 ARG H 1.0 1.8 7.5 1820 1516 A 73 VAL HA A 77 LYS HD2 1.0 1.8 7.0 1821 1516 A 73 VAL HA A 77 LYS HD3 1.0 1.8 7.0 1822 1517 A 73 VAL HGy% A 77 LYS H 1.0 1.8 7.5 1823 1518 A 76 ARG H A 74 GLU HA 1.0 1.8 5.0 1824 1519 A 74 GLU H A 76 ARG H 1.0 1.8 7.0 1825 1520 A 75 LEU HA A 77 LYS H 1.0 1.8 7.0 1826 1521 A 75 LEU H A 77 LYS H 1.0 1.8 5.0 1827 1522 A 75 LEU HA A 78 LYS HBx 1.0 1.8 3.5 1828 1523 A 78 LYS H A 75 LEU HDy% 1.0 1.8 7.5 1829 1523 A 78 LYS H A 75 LEU HDx% 1.0 1.8 7.5 1830 1524 A 78 LYS HBy A 75 LEU HDy% 1.0 1.8 7.5 1831 1524 A 78 LYS HBy A 75 LEU HDx% 1.0 1.8 7.5 1832 1525 A 78 LYS HBx A 75 LEU HDy% 1.0 1.8 7.5 1833 1525 A 78 LYS HBx A 75 LEU HDx% 1.0 1.8 7.5 1834 1526 A 78 LYS HDy A 75 LEU HDy% 1.0 1.8 7.5 1835 1526 A 78 LYS HDy A 75 LEU HDx% 1.0 1.8 7.5 1836 1527 A 78 LYS HDx A 75 LEU HDy% 1.0 1.8 7.5 1837 1527 A 78 LYS HDx A 75 LEU HDx% 1.0 1.8 7.5 1838 1528 A 75 LEU H A 78 LYS H 1.0 1.8 7.0 1839 1529 A 75 LEU HA A 79 TYR HD% 1.0 1.8 7.5 1840 1530 A 75 LEU HA A 79 TYR HE% 1.0 1.8 7.5 1841 1531 A 75 LEU HBy A 79 TYR HD% 1.0 1.8 7.5 1842 1532 A 75 LEU HBy A 79 TYR HE% 1.0 1.8 7.5 1843 1533 A 75 LEU HBx A 79 TYR HD% 1.0 1.8 7.5 1844 1534 A 75 LEU HBx A 79 TYR HE% 1.0 1.8 5.5 1845 1535 A 79 TYR HE% A 75 LEU HDy% 1.0 1.8 8.0 1846 1535 A 79 TYR HE% A 75 LEU HDx% 1.0 1.8 8.0 1847 1536 A 79 TYR HD% A 75 LEU HDy% 1.0 1.8 8.0 1848 1536 A 79 TYR HD% A 75 LEU HDx% 1.0 1.8 8.0 1849 1537 A 79 TYR HE% A 75 LEU HDy% 1.0 1.8 8.0 1850 1537 A 79 TYR HE% A 75 LEU HDx% 1.0 1.8 8.0 1851 1538 A 79 TYR HD% A 75 LEU HDx% 1.0 1.8 7.5 1852 1538 A 79 TYR HD% A 75 LEU HDy% 1.0 1.8 7.5 1853 1539 A 75 LEU HG A 79 TYR HE% 1.0 1.8 7.5 1854 1540 A 78 LYS H A 76 ARG HBy 1.0 1.8 5.5 1855 1541 A 76 ARG H A 78 LYS H 1.0 1.8 5.0 1856 1542 A 76 ARG HA A 79 TYR H 1.0 1.8 5.0 1857 1543 A 79 TYR HD% A 76 ARG HBy 1.0 1.8 7.5 1858 1544 A 76 ARG HA A 81 VAL HGx% 1.0 1.8 5.0 1859 1544 A 76 ARG HA A 81 VAL HGy% 1.0 1.8 5.0 1860 1545 A 81 VAL H A 76 ARG HBx 1.0 1.8 7.0 1861 1545 A 81 VAL H A 76 ARG HBy 1.0 1.8 7.0 1862 1546 A 81 VAL H A 76 ARG HDy 1.0 1.8 7.0 1863 1547 A 76 ARG HGy A 81 VAL H 1.0 1.8 5.0 1864 1548 A 76 ARG HGx A 81 VAL H 1.0 1.8 5.0 1865 1549 A 79 TYR H A 77 LYS HA 1.0 1.8 7.0 1866 1550 A 77 LYS HA A 80 GLY H 1.0 1.8 5.0 1867 1551 A 81 VAL H A 77 LYS HA 1.0 1.8 7.0 1868 1552 A 78 LYS HBy A 80 GLY H 1.0 1.8 7.0 1869 1553 A 78 LYS H A 80 GLY H 1.0 1.8 7.0 1870 1554 A 79 TYR HBy A 81 VAL HGx% 1.0 1.8 7.0 1871 1554 A 79 TYR HBy A 81 VAL HGy% 1.0 1.8 7.0 1872 1555 A 82 HIS HD2 A 80 GLY HAy 1.0 1.8 7.0 1873 1556 A 80 GLY HAy A 82 HIS HE1 1.0 1.8 7.0 1874 1557 A 82 HIS HD2 A 80 GLY HAx 1.0 1.8 7.0 1875 1558 A 80 GLY HAx A 82 HIS HE1 1.0 1.8 7.0 1876 1559 A 83 ALA H A 81 VAL HA 1.0 1.8 5.0 1877 1560 A 83 ALA H A 81 VAL HGx% 1.0 1.8 5.0 1878 1560 A 81 VAL HGy% A 83 ALA H 1.0 1.8 5.0 1879 1561 A 81 VAL HGy% A 84 TYR HD% 1.0 1.8 8.0 1880 1562 A 83 ALA H A 86 THR HG1 1.0 1.8 5.5 1881 1563 A 85 PRO HBy A 87 LEU HDx% 1.0 1.8 7.5 1882 1563 A 85 PRO HBy A 87 LEU HDy% 1.0 1.8 7.5 1883 1564 A 85 PRO HBx A 87 LEU HDx% 1.0 1.8 7.5 1884 1564 A 85 PRO HBx A 87 LEU HDy% 1.0 1.8 7.5 1885 1565 A 87 LEU HBx A 89 PHE HE% 1.0 1.8 7.5 1886 1566 A 87 LEU HBy A 89 PHE HE% 1.0 1.8 7.5 1887 1567 A 89 PHE HE% A 87 LEU HDx% 1.0 1.8 8.0 1888 1567 A 87 LEU HDy% A 89 PHE HE% 1.0 1.8 8.0 1889 1568 A 87 LEU HDy% A 89 PHE HE% 1.0 1.8 8.0 1890 1568 A 89 PHE HE% A 87 LEU HDx% 1.0 1.8 8.0 1891 1569 A 87 LEU HG A 89 PHE HE% 1.0 1.8 7.5 1892 1570 A 88 LEU HA A 90 ILE HD1% 1.0 1.8 7.5 1893 1571 A 88 LEU HBx A 90 ILE HG1x 1.0 1.8 7.0 1894 1572 A 88 LEU HDy% A 90 ILE HD1% 1.0 1.8 8.0 1895 1572 A 90 ILE HD1% A 88 LEU HDx% 1.0 1.8 8.0 1896 1573 A 88 LEU HDy% A 90 ILE HG2% 1.0 1.8 8.0 1897 1573 A 90 ILE HG2% A 88 LEU HDx% 1.0 1.8 8.0 1898 1574 A 90 ILE HG2% A 93 SER H 1.0 1.8 7.5 1899 1575 A 90 ILE HD1% A 94 GLY HAx 1.0 1.8 7.5 1900 1576 A 90 ILE HG2% A 94 GLY H 1.0 1.8 5.5 1901 1577 A 90 ILE HG2% A 94 GLY HAy 1.0 1.8 5.5 1902 1578 A 90 ILE HG2% A 94 GLY HAx 1.0 1.8 5.5 1903 1579 A 90 ILE HA A 95 GLU H 1.0 1.8 7.0 1904 1580 A 90 ILE HG2% A 95 GLU H 1.0 1.8 7.5 1905 1581 A 91 ASN HA A 93 SER H 1.0 1.8 7.0 1906 1582 A 91 ASN HBy A 93 SER H 1.0 1.8 4.0 1907 1583 A 91 ASN HBy A 93 SER HA 1.0 1.8 7.0 1908 1584 A 91 ASN HBx A 93 SER H 1.0 1.8 7.0 1909 1585 A 91 ASN HBx A 93 SER HA 1.0 1.8 7.0 1910 1586 A 91 ASN H A 93 SER H 1.0 1.8 7.0 1911 1587 A 91 ASN HBy A 95 GLU HB2 1.0 1.8 7.0 1912 1587 A 91 ASN HBy A 95 GLU HB3 1.0 1.8 7.0 1913 1588 A 91 ASN HBx A 95 GLU HB2 1.0 1.8 7.0 1914 1588 A 91 ASN HBx A 95 GLU HB3 1.0 1.8 7.0 1915 1589 A 91 ASN HD21 A 95 GLU H 1.0 1.8 7.0 1916 1590 A 91 ASN HD21 A 95 GLU HB2 1.0 1.8 5.0 1917 1590 A 91 ASN HD21 A 95 GLU HB3 1.0 1.8 5.0 1918 1591 A 91 ASN HD21 A 95 GLU HG2 1.0 1.8 7.0 1919 1591 A 91 ASN HD21 A 95 GLU HG3 1.0 1.8 7.0 1920 1592 A 91 ASN HD22 A 95 GLU H 1.0 1.8 7.0 1921 1593 A 91 ASN HD22 A 95 GLU HB2 1.0 1.8 5.5 1922 1593 A 91 ASN HD22 A 95 GLU HB3 1.0 1.8 5.5 1923 1594 A 91 ASN HD22 A 95 GLU HG2 1.0 1.8 5.0 1924 1594 A 91 ASN HD22 A 95 GLU HG3 1.0 1.8 5.0 1925 1595 A 91 ASN H A 95 GLU H 1.0 1.8 5.0 1926 1596 A 91 ASN H A 96 VAL HA 1.0 1.8 5.0 1927 1597 A 92 SER HA A 94 GLY H 1.0 1.8 4.0 1928 1598 A 93 SER HBx A 95 GLU H 1.0 1.8 7.0 1929 1599 A 93 SER H A 95 GLU H 1.0 1.8 7.0 1930 1600 A 96 VAL HA A 98 TYR H 1.0 1.8 5.0 1931 1601 A 98 TYR H A 96 VAL HGy% 1.0 1.8 5.5 1932 1602 A 99 ARG HDy A 96 VAL HGx% 1.0 1.8 7.0 1933 1603 A 99 ARG HDx A 96 VAL HGx% 1.0 1.8 5.5 1934 1604 A 99 ARG H A 96 VAL HGy% 1.0 1.8 7.5 1935 1605 A 99 ARG HA A 96 VAL HGy% 1.0 1.8 7.5 1936 1606 A 99 ARG HDy A 96 VAL HGy% 1.0 1.8 7.5 1937 1607 A 99 ARG HDx A 96 VAL HGy% 1.0 1.8 7.5 1938 1608 A 99 ARG HA A 96 VAL HGx% 1.0 1.8 7.0 1939 1608 A 99 ARG HA A 96 VAL HGy% 1.0 1.8 7.0 1940 1609 A 96 VAL HGx% A 99 ARG HB2 1.0 1.8 5.0 1941 1609 A 96 VAL HGy% A 99 ARG HB2 1.0 1.8 5.0 1942 1609 A 99 ARG HB3 A 96 VAL HGx% 1.0 1.8 5.0 1943 1609 A 99 ARG HB3 A 96 VAL HGy% 1.0 1.8 5.0 1944 1610 A 98 TYR HD% A 100 LEU H 1.0 1.8 7.5 1945 1611 A 98 TYR HE% A 100 LEU HA 1.0 1.8 7.5 1946 1612 A 98 TYR HE% A 100 LEU HBx 1.0 1.8 5.5 1947 1613 A 98 TYR HE% A 100 LEU HDy% 1.0 1.8 8.0 1948 1613 A 98 TYR HE% A 100 LEU HDx% 1.0 1.8 8.0 1949 1614 A 98 TYR HE% A 100 LEU HDy% 1.0 1.8 7.0 1950 1614 A 98 TYR HE% A 100 LEU HDx% 1.0 1.8 7.0 1951 1615 A 98 TYR HE% A 100 LEU HG 1.0 1.8 7.5 1952 1616 A 100 LEU HDy% A 102 GLY H 1.0 1.8 7.5 1953 1616 A 102 GLY H A 100 LEU HDx% 1.0 1.8 7.5 1954 1617 A 100 LEU HDy% A 102 GLY HAy 1.0 1.8 7.5 1955 1617 A 102 GLY HAy A 100 LEU HDx% 1.0 1.8 7.5 1956 1618 A 100 LEU HDy% A 102 GLY HAx 1.0 1.8 7.5 1957 1618 A 102 GLY HAx A 100 LEU HDx% 1.0 1.8 7.5 1958 1619 A 102 GLY H A 100 LEU HG 1.0 1.8 7.0 1959 1620 A 100 LEU HDy% A 103 ALA HA 1.0 1.8 7.5 1960 1620 A 103 ALA HA A 100 LEU HDx% 1.0 1.8 7.5 1961 1621 A 101 VAL HGx% A 103 ALA H 1.0 1.8 7.5 1962 1622 A 104 GLU HBy A 108 GLU H 1.0 1.8 5.0 1963 1623 A 104 GLU HBy A 109 LEU HA 1.0 1.8 5.0 1964 1624 A 104 GLU HBx A 109 LEU HA 1.0 1.8 5.5 1965 1625 A 104 GLU H A 109 LEU HDx% 1.0 1.8 7.5 1966 1625 A 104 GLU H A 109 LEU HDy% 1.0 1.8 7.5 1967 1626 A 104 GLU H A 109 LEU HDy% 1.0 1.8 7.5 1968 1626 A 104 GLU H A 109 LEU HDx% 1.0 1.8 7.5 1969 1627 A 107 PRO HDy A 105 ASP HA 1.0 1.8 5.0 1970 1628 A 107 PRO HDx A 105 ASP HA 1.0 1.8 7.0 1971 1629 A 105 ASP HBx A 107 PRO HDy 1.0 1.8 4.0 1972 1630 A 105 ASP HBx A 107 PRO HDx 1.0 1.8 5.0 1973 1631 A 105 ASP HBy A 108 GLU H 1.0 1.8 7.0 1974 1632 A 105 ASP HBx A 108 GLU H 1.0 1.8 7.0 1975 1633 A 105 ASP H A 108 GLU H 1.0 1.8 7.0 1976 1634 A 105 ASP H A 108 GLU HBx 1.0 1.8 7.0 1977 1635 A 106 ALA HA A 109 LEU HDx% 1.0 1.8 7.5 1978 1635 A 109 LEU HDy% A 106 ALA HA 1.0 1.8 7.5 1979 1636 A 110 LEU H A 106 ALA HA 1.0 1.8 5.0 1980 1637 A 107 PRO HA A 109 LEU H 1.0 1.8 7.0 1981 1638 A 107 PRO HA A 110 LEU H 1.0 1.8 5.0 1982 1639 A 107 PRO HA A 110 LEU HDx% 1.0 1.8 7.5 1983 1639 A 107 PRO HA A 110 LEU HDy% 1.0 1.8 7.5 1984 1640 A 107 PRO HA A 110 LEU HDy% 1.0 1.8 7.5 1985 1640 A 107 PRO HA A 110 LEU HDx% 1.0 1.8 7.5 1986 1641 A 107 PRO HBx A 110 LEU H 1.0 1.8 7.0 1987 1642 A 107 PRO HA A 111 LYS H 1.0 1.8 7.0 1988 1643 A 108 GLU HBy A 110 LEU H 1.0 1.8 7.0 1989 1644 A 111 LYS H A 108 GLU HA 1.0 1.8 4.0 1990 1645 A 109 LEU H A 111 LYS H 1.0 1.8 7.0 1991 1646 A 109 LEU HA A 113 VAL H 1.0 1.8 5.0 1992 1647 A 113 VAL H A 109 LEU HDx% 1.0 1.8 7.5 1993 1647 A 109 LEU HDy% A 113 VAL H 1.0 1.8 7.5 1994 1648 A 113 VAL HA A 110 LEU HA 1.0 1.8 7.0 1995 1649 A 113 VAL HB A 110 LEU HA 1.0 1.8 5.0 1996 1650 A 113 VAL HGx% A 110 LEU HA 1.0 1.8 5.5 1997 1651 A 113 VAL HGy% A 110 LEU HA 1.0 1.8 5.5 1998 1652 A 113 VAL H A 110 LEU HDx% 1.0 1.8 7.5 1999 1652 A 110 LEU HDy% A 113 VAL H 1.0 1.8 7.5 2000 1653 A 110 LEU H A 113 VAL HGx% 1.0 1.8 7.5 2001 1654 A 114 LYS HEy A 110 LEU HDx% 1.0 1.8 7.5 2002 1654 A 110 LEU HDy% A 114 LYS HEy 1.0 1.8 7.5 2003 1655 A 114 LYS HEx A 110 LEU HDx% 1.0 1.8 7.5 2004 1655 A 110 LEU HDy% A 114 LYS HEx 1.0 1.8 7.5 2005 1656 A 110 LEU HDy% A 114 LYS HEy 1.0 1.8 7.5 2006 1656 A 114 LYS HEy A 110 LEU HDx% 1.0 1.8 7.5 2007 1657 A 110 LEU HDy% A 114 LYS HEx 1.0 1.8 7.5 2008 1657 A 114 LYS HEx A 110 LEU HDx% 1.0 1.8 7.5 2009 1658 A 111 LYS H A 113 VAL H 1.0 1.8 7.0 2010 1659 A 111 LYS HA A 114 LYS HB2 1.0 1.8 4.0 2011 1659 A 111 LYS HA A 114 LYS HB3 1.0 1.8 4.0 2012 1660 A 112 LYS HA A 115 LEU HDy% 1.0 1.8 7.5 2013 1660 A 112 LYS HA A 115 LEU HDx% 1.0 1.8 7.5 2014 1661 A 112 LYS H A 115 LEU H 1.0 1.8 5.0 2015 1662 A 113 VAL H A 115 LEU H 1.0 1.8 7.0 2016 1663 A 113 VAL HA A 116 GLY H 1.0 1.8 4.0 2017 1664 A 113 VAL H A 116 GLY H 1.0 1.8 7.0 2018 1665 A 113 VAL HA A 117 VAL H 1.0 1.8 7.0 2019 1666 A 113 VAL HA A 117 VAL HGy% 1.0 1.8 7.5 2020 1667 A 114 LYS H A 116 GLY H 1.0 1.8 5.0 2021 1668 A 114 LYS HA A 117 VAL H 1.0 1.8 7.0 2022 1669 A 114 LYS HA A 117 VAL HGy% 1.0 1.8 7.5 2023 1670 A 114 LYS H A 117 VAL HGy% 1.0 1.8 7.5 2024 1671 A 114 LYS HA A 118 GLU H 1.0 1.8 5.0 2025 1672 A 115 LEU HA A 117 VAL H 1.0 1.8 7.0 2026 1673 A 115 LEU H A 117 VAL H 1.0 1.8 7.0 2027 1674 A 48 LYS HBy A 5 GLY HAx 1.0 1.8 7.0 2028 1675 A 48 LYS HBx A 5 GLY HAx 1.0 1.8 7.0 2029 1676 A 48 LYS HGx A 5 GLY HAx 1.0 1.8 7.0 2030 1677 A 48 LYS HA A 5 GLY HAy 1.0 1.8 5.0 2031 1678 A 48 LYS HGx A 5 GLY HAy 1.0 1.8 7.0 2032 1679 A 48 LYS HBy A 5 GLY H 1.0 1.8 7.0 2033 1680 A 53 ALA HB% A 5 GLY HAx 1.0 1.8 5.5 2034 1681 A 53 ALA HB% A 5 GLY HAy 1.0 1.8 5.5 2035 1682 A 53 ALA HB% A 5 GLY H 1.0 1.8 7.5 2036 1683 A 6 ILE HG2% A 28 PHE HD% 1.0 1.8 8.0 2037 1684 A 6 ILE HG2% A 28 PHE HE% 1.0 1.8 8.0 2038 1685 A 6 ILE HB A 47 PHE HD% 1.0 1.8 7.5 2039 1686 A 6 ILE HB A 47 PHE HE% 1.0 1.8 7.5 2040 1687 A 6 ILE HB A 47 PHE HZ 1.0 1.8 7.0 2041 1688 A 6 ILE HD1% A 47 PHE H 1.0 1.8 7.5 2042 1689 A 6 ILE HD1% A 47 PHE HA 1.0 1.8 7.5 2043 1690 A 6 ILE HD1% A 47 PHE HB2 1.0 1.8 7.5 2044 1690 A 6 ILE HD1% A 47 PHE HB3 1.0 1.8 7.5 2045 1691 A 6 ILE HD1% A 47 PHE HD% 1.0 1.8 8.0 2046 1692 A 6 ILE HD1% A 47 PHE HE% 1.0 1.8 8.0 2047 1693 A 6 ILE HD1% A 47 PHE HZ 1.0 1.8 7.5 2048 1694 A 6 ILE HG1y A 47 PHE HE% 1.0 1.8 7.5 2049 1695 A 6 ILE HG1x A 47 PHE HD% 1.0 1.8 7.5 2050 1696 A 6 ILE HG1x A 47 PHE HE% 1.0 1.8 7.5 2051 1697 A 6 ILE HG2% A 47 PHE HE% 1.0 1.8 8.0 2052 1698 A 6 ILE HG2% A 47 PHE HZ 1.0 1.8 7.5 2053 1699 A 6 ILE H A 47 PHE HB2 1.0 1.8 5.0 2054 1699 A 6 ILE H A 47 PHE HB3 1.0 1.8 5.0 2055 1700 A 6 ILE H A 47 PHE HE% 1.0 1.8 7.5 2056 1701 A 6 ILE HD1% A 52 VAL HGy% 1.0 1.8 8.0 2057 1702 A 6 ILE HA A 53 ALA HB% 1.0 1.8 7.5 2058 1703 A 6 ILE HD1% A 53 ALA HA 1.0 1.8 7.5 2059 1704 A 6 ILE HD1% A 53 ALA HB% 1.0 1.8 8.0 2060 1705 A 6 ILE HG1y A 53 ALA HA 1.0 1.8 5.0 2061 1706 A 6 ILE HG1x A 53 ALA HA 1.0 1.8 5.0 2062 1707 A 6 ILE HG1x A 53 ALA HB% 1.0 1.8 7.5 2063 1708 A 6 ILE HG2% A 53 ALA HA 1.0 1.8 7.5 2064 1709 A 6 ILE HG2% A 53 ALA HB% 1.0 1.8 8.0 2065 1710 A 6 ILE H A 53 ALA HA 1.0 1.8 5.5 2066 1711 A 6 ILE H A 53 ALA HB% 1.0 1.8 5.5 2067 1712 A 6 ILE HA A 56 PHE HD% 1.0 1.8 7.5 2068 1713 A 6 ILE HD1% A 56 PHE H 1.0 1.8 7.5 2069 1714 A 6 ILE HD1% A 56 PHE HBy 1.0 1.8 7.5 2070 1715 A 6 ILE HD1% A 56 PHE HBx 1.0 1.8 7.5 2071 1716 A 6 ILE HD1% A 56 PHE HD% 1.0 1.8 8.0 2072 1717 A 6 ILE HD1% A 56 PHE HE% 1.0 1.8 8.0 2073 1718 A 6 ILE HG1y A 56 PHE HBy 1.0 1.8 7.0 2074 1719 A 6 ILE HG1y A 56 PHE HD% 1.0 1.8 7.5 2075 1720 A 6 ILE HG1x A 56 PHE HD% 1.0 1.8 7.5 2076 1721 A 6 ILE HG2% A 56 PHE HBy 1.0 1.8 7.5 2077 1722 A 6 ILE HG2% A 56 PHE HBx 1.0 1.8 7.5 2078 1723 A 6 ILE HG2% A 56 PHE HD% 1.0 1.8 8.0 2079 1724 A 6 ILE HA A 57 ASN HD21 1.0 1.8 7.0 2080 1725 A 6 ILE HA A 57 ASN HD22 1.0 1.8 7.0 2081 1726 A 6 ILE HG2% A 57 ASN H 1.0 1.8 7.5 2082 1727 A 6 ILE HG2% A 57 ASN HA 1.0 1.8 7.5 2083 1728 A 6 ILE HG2% A 57 ASN HD21 1.0 1.8 7.5 2084 1729 A 6 ILE HG2% A 57 ASN HD22 1.0 1.8 7.5 2085 1730 A 6 ILE HG2% A 62 ASN H 1.0 1.8 7.5 2086 1731 A 6 ILE HG2% A 62 ASN HA 1.0 1.8 7.5 2087 1732 A 6 ILE HG2% A 62 ASN HBy 1.0 1.8 7.5 2088 1733 A 6 ILE HG2% A 62 ASN HBx 1.0 1.8 7.5 2089 1734 A 6 ILE HG2% A 62 ASN HD21 1.0 1.8 7.5 2090 1735 A 6 ILE HG2% A 62 ASN HD22 1.0 1.8 7.5 2091 1736 A 7 ALA H A 57 ASN HD21 1.0 1.8 5.5 2092 1737 A 7 ALA H A 57 ASN HD22 1.0 1.8 5.5 2093 1738 A 8 PHE HE% A 29 VAL HGx% 1.0 1.8 8.0 2094 1739 A 8 PHE HD% A 30 ASP H 1.0 1.8 7.5 2095 1740 A 8 PHE HE% A 30 ASP H 1.0 1.8 7.5 2096 1741 A 8 PHE HE% A 30 ASP HA 1.0 1.8 7.5 2097 1742 A 8 PHE HE% A 30 ASP HB2 1.0 1.8 7.5 2098 1742 A 8 PHE HE% A 30 ASP HB3 1.0 1.8 7.5 2099 1743 A 8 PHE HZ A 30 ASP HB2 1.0 1.8 7.0 2100 1743 A 30 ASP HB3 A 8 PHE HZ 1.0 1.8 7.0 2101 1744 A 8 PHE HZ A 42 LEU HDx% 1.0 1.8 7.5 2102 1744 A 42 LEU HDy% A 8 PHE HZ 1.0 1.8 7.5 2103 1745 A 42 LEU HDy% A 8 PHE HZ 1.0 1.8 7.5 2104 1745 A 8 PHE HZ A 42 LEU HDx% 1.0 1.8 7.5 2105 1746 A 8 PHE HA A 62 ASN H 1.0 1.8 5.0 2106 1747 A 8 PHE HA A 62 ASN HA 1.0 1.8 7.0 2107 1748 A 8 PHE HA A 62 ASN HBy 1.0 1.8 4.0 2108 1749 A 8 PHE HA A 62 ASN HBx 1.0 1.8 5.5 2109 1750 A 8 PHE HD% A 62 ASN HBy 1.0 1.8 7.5 2110 1751 A 8 PHE HD% A 62 ASN HBx 1.0 1.8 7.5 2111 1752 A 8 PHE HD% A 62 ASN HD21 1.0 1.8 7.5 2112 1753 A 8 PHE HD% A 62 ASN HD22 1.0 1.8 7.5 2113 1754 A 8 PHE HE% A 62 ASN HA 1.0 1.8 7.5 2114 1755 A 8 PHE H A 62 ASN HBy 1.0 1.8 7.0 2115 1756 A 8 PHE H A 62 ASN HBx 1.0 1.8 7.0 2116 1757 A 8 PHE HBy A 63 LEU HA 1.0 1.8 7.0 2117 1758 A 8 PHE HBx A 63 LEU HA 1.0 1.8 7.0 2118 1759 A 8 PHE HD% A 63 LEU H 1.0 1.8 5.5 2119 1760 A 8 PHE HD% A 63 LEU HA 1.0 1.8 5.5 2120 1761 A 8 PHE HD% A 63 LEU HBy 1.0 1.8 7.5 2121 1762 A 8 PHE HD% A 63 LEU HBx 1.0 1.8 7.5 2122 1763 A 8 PHE HD% A 63 LEU HDy% 1.0 1.8 8.0 2123 1763 A 8 PHE HD% A 63 LEU HDx% 1.0 1.8 8.0 2124 1764 A 8 PHE HD% A 63 LEU HG 1.0 1.8 7.5 2125 1765 A 8 PHE HE% A 63 LEU H 1.0 1.8 7.5 2126 1766 A 8 PHE HE% A 63 LEU HA 1.0 1.8 7.5 2127 1767 A 8 PHE HE% A 63 LEU HDy% 1.0 1.8 8.0 2128 1767 A 8 PHE HE% A 63 LEU HDx% 1.0 1.8 8.0 2129 1768 A 8 PHE HA A 64 LYS H 1.0 1.8 7.0 2130 1769 A 8 PHE HBy A 64 LYS H 1.0 1.8 7.0 2131 1770 A 8 PHE HBx A 64 LYS H 1.0 1.8 7.0 2132 1771 A 8 PHE HBx A 64 LYS HG2 1.0 1.8 7.0 2133 1771 A 8 PHE HBx A 64 LYS HG3 1.0 1.8 7.0 2134 1772 A 8 PHE HD% A 64 LYS H 1.0 1.8 7.5 2135 1773 A 8 PHE HD% A 64 LYS HA 1.0 1.8 7.5 2136 1774 A 8 PHE HD% A 64 LYS HDy 1.0 1.8 7.5 2137 1774 A 8 PHE HD% A 64 LYS HDx 1.0 1.8 7.5 2138 1775 A 8 PHE HE% A 64 LYS HA 1.0 1.8 7.5 2139 1776 A 8 PHE HE% A 87 LEU HDx% 1.0 1.8 8.0 2140 1776 A 8 PHE HE% A 87 LEU HDy% 1.0 1.8 8.0 2141 1777 A 8 PHE HZ A 87 LEU HDx% 1.0 1.8 7.5 2142 1777 A 87 LEU HDy% A 8 PHE HZ 1.0 1.8 7.5 2143 1778 A 87 LEU HDy% A 8 PHE HZ 1.0 1.8 7.5 2144 1778 A 8 PHE HZ A 87 LEU HDx% 1.0 1.8 7.5 2145 1779 A 9 ARG HDy A 61 VAL HGx% 1.0 1.8 5.0 2146 1779 A 9 ARG HDy A 61 VAL HGy% 1.0 1.8 5.0 2147 1780 A 9 ARG HDx A 61 VAL HGx% 1.0 1.8 5.0 2148 1780 A 9 ARG HDx A 61 VAL HGy% 1.0 1.8 5.0 2149 1781 A 9 ARG H A 62 ASN H 1.0 1.8 7.0 2150 1782 A 9 ARG H A 62 ASN HBx 1.0 1.8 7.0 2151 1783 A 9 ARG H A 63 LEU HA 1.0 1.8 5.0 2152 1784 A 9 ARG H A 63 LEU HBx 1.0 1.8 7.0 2153 1785 A 9 ARG H A 63 LEU HDx% 1.0 1.8 7.5 2154 1785 A 9 ARG H A 63 LEU HDy% 1.0 1.8 7.5 2155 1786 A 11 LEU HDy% A 19 ARG HGy 1.0 1.8 7.5 2156 1786 A 19 ARG HGy A 11 LEU HDx% 1.0 1.8 7.5 2157 1787 A 11 LEU HDy% A 19 ARG HGx 1.0 1.8 7.5 2158 1787 A 19 ARG HGx A 11 LEU HDx% 1.0 1.8 7.5 2159 1788 A 11 LEU HBy A 63 LEU HDx% 1.0 1.8 7.5 2160 1788 A 11 LEU HBy A 63 LEU HDy% 1.0 1.8 7.5 2161 1789 A 11 LEU HBx A 63 LEU HDx% 1.0 1.8 7.5 2162 1789 A 11 LEU HBx A 63 LEU HDy% 1.0 1.8 7.5 2163 1790 A 11 LEU HDy% A 63 LEU HA 1.0 1.8 7.5 2164 1790 A 63 LEU HA A 11 LEU HDx% 1.0 1.8 7.5 2165 1791 A 11 LEU H A 63 LEU HDx% 1.0 1.8 7.5 2166 1791 A 11 LEU H A 63 LEU HDy% 1.0 1.8 7.5 2167 1792 A 11 LEU H A 64 LYS H 1.0 1.8 7.0 2168 1793 A 12 SER HA A 65 MET HE% 1.0 1.8 7.5 2169 1794 A 12 SER HBy A 65 MET HE% 1.0 1.8 7.5 2170 1795 A 12 SER HBx A 65 MET HE% 1.0 1.8 7.5 2171 1796 A 13 PHE HA A 27 LEU HDx% 1.0 1.8 7.5 2172 1796 A 13 PHE HA A 27 LEU HDy% 1.0 1.8 7.5 2173 1797 A 13 PHE HA A 27 LEU HDy% 1.0 1.8 7.5 2174 1797 A 13 PHE HA A 27 LEU HDx% 1.0 1.8 7.5 2175 1798 A 13 PHE HD% A 27 LEU HDy% 1.0 1.8 8.0 2176 1798 A 13 PHE HD% A 27 LEU HDx% 1.0 1.8 8.0 2177 1799 A 13 PHE HE% A 27 LEU HDy% 1.0 1.8 8.0 2178 1799 A 13 PHE HE% A 27 LEU HDx% 1.0 1.8 8.0 2179 1800 A 27 LEU HDy% A 13 PHE HZ 1.0 1.8 7.5 2180 1800 A 13 PHE HZ A 27 LEU HDx% 1.0 1.8 7.5 2181 1801 A 13 PHE HD% A 29 VAL HGx% 1.0 1.8 8.0 2182 1802 A 13 PHE HE% A 29 VAL HGx% 1.0 1.8 8.0 2183 1803 A 13 PHE HA A 63 LEU HDx% 1.0 1.8 7.5 2184 1803 A 13 PHE HA A 63 LEU HDy% 1.0 1.8 7.5 2185 1804 A 13 PHE HBy A 63 LEU HDy% 1.0 1.8 7.5 2186 1804 A 13 PHE HBy A 63 LEU HDx% 1.0 1.8 7.5 2187 1805 A 13 PHE HBx A 63 LEU HDy% 1.0 1.8 7.5 2188 1805 A 13 PHE HBx A 63 LEU HDx% 1.0 1.8 7.5 2189 1806 A 13 PHE HD% A 63 LEU HDy% 1.0 1.8 8.0 2190 1806 A 13 PHE HD% A 63 LEU HDx% 1.0 1.8 8.0 2191 1807 A 13 PHE HE% A 63 LEU HDy% 1.0 1.8 8.0 2192 1807 A 13 PHE HE% A 63 LEU HDx% 1.0 1.8 8.0 2193 1808 A 13 PHE H A 63 LEU HDx% 1.0 1.8 7.5 2194 1808 A 13 PHE H A 63 LEU HDy% 1.0 1.8 7.5 2195 1809 A 13 PHE H A 63 LEU HDy% 1.0 1.8 7.5 2196 1809 A 13 PHE H A 63 LEU HDx% 1.0 1.8 7.5 2197 1810 A 13 PHE HA A 65 MET HE% 1.0 1.8 7.5 2198 1811 A 13 PHE HBy A 65 MET HE% 1.0 1.8 7.5 2199 1812 A 13 PHE HBx A 65 MET HE% 1.0 1.8 5.5 2200 1813 A 13 PHE HD% A 65 MET HE% 1.0 1.8 8.0 2201 1814 A 13 PHE HE% A 65 MET HE% 1.0 1.8 8.0 2202 1815 A 13 PHE H A 65 MET HE% 1.0 1.8 7.5 2203 1816 A 13 PHE H A 71 GLU HG2 1.0 1.8 7.0 2204 1816 A 13 PHE H A 71 GLU HG3 1.0 1.8 7.0 2205 1817 A 13 PHE HA A 75 LEU HDy% 1.0 1.8 7.5 2206 1817 A 13 PHE HA A 75 LEU HDx% 1.0 1.8 7.5 2207 1818 A 13 PHE HBy A 75 LEU HDy% 1.0 1.8 7.5 2208 1818 A 13 PHE HBy A 75 LEU HDx% 1.0 1.8 7.5 2209 1819 A 13 PHE HBx A 75 LEU HDy% 1.0 1.8 7.5 2210 1819 A 13 PHE HBx A 75 LEU HDx% 1.0 1.8 7.5 2211 1820 A 13 PHE HBx A 75 LEU HDy% 1.0 1.8 7.5 2212 1820 A 13 PHE HBx A 75 LEU HDx% 1.0 1.8 7.5 2213 1821 A 13 PHE HD% A 75 LEU HDy% 1.0 1.8 8.0 2214 1821 A 13 PHE HD% A 75 LEU HDx% 1.0 1.8 8.0 2215 1822 A 13 PHE HD% A 75 LEU HG 1.0 1.8 7.5 2216 1823 A 13 PHE HE% A 75 LEU HDy% 1.0 1.8 8.0 2217 1823 A 13 PHE HE% A 75 LEU HDx% 1.0 1.8 8.0 2218 1824 A 13 PHE HE% A 75 LEU HDy% 1.0 1.8 8.0 2219 1824 A 13 PHE HE% A 75 LEU HDx% 1.0 1.8 8.0 2220 1825 A 13 PHE H A 75 LEU HDy% 1.0 1.8 7.5 2221 1825 A 13 PHE H A 75 LEU HDx% 1.0 1.8 7.5 2222 1826 A 13 PHE HE% A 78 LYS HEx 1.0 1.8 7.5 2223 1827 A 79 TYR HE% A 13 PHE HZ 1.0 1.8 7.5 2224 1828 A 13 PHE HD% A 90 ILE HD1% 1.0 1.8 8.0 2225 1829 A 13 PHE HE% A 90 ILE HD1% 1.0 1.8 8.0 2226 1830 A 13 PHE HE% A 90 ILE HG2% 1.0 1.8 8.0 2227 1831 A 90 ILE HD1% A 13 PHE HZ 1.0 1.8 7.5 2228 1832 A 90 ILE HG2% A 13 PHE HZ 1.0 1.8 7.5 2229 1833 A 13 PHE HE% A 94 GLY HAy 1.0 1.8 7.5 2230 1834 A 13 PHE HE% A 94 GLY HAx 1.0 1.8 7.5 2231 1835 A 94 GLY HAy A 13 PHE HZ 1.0 1.8 7.0 2232 1836 A 94 GLY HAx A 13 PHE HZ 1.0 1.8 7.0 2233 1837 A 14 PRO HDx A 75 LEU HDy% 1.0 1.8 7.5 2234 1837 A 14 PRO HDx A 75 LEU HDx% 1.0 1.8 7.5 2235 1838 A 16 ALA HA A 27 LEU HDx% 1.0 1.8 5.0 2236 1838 A 16 ALA HA A 27 LEU HDy% 1.0 1.8 5.0 2237 1839 A 16 ALA HB% A 27 LEU HDx% 1.0 1.8 7.0 2238 1839 A 16 ALA HB% A 27 LEU HDy% 1.0 1.8 7.0 2239 1840 A 16 ALA HB% A 27 LEU HDy% 1.0 1.8 8.0 2240 1840 A 16 ALA HB% A 27 LEU HDx% 1.0 1.8 8.0 2241 1841 A 16 ALA H A 27 LEU HDx% 1.0 1.8 7.5 2242 1841 A 16 ALA H A 27 LEU HDy% 1.0 1.8 7.5 2243 1842 A 16 ALA HA A 63 LEU HDy% 1.0 1.8 7.5 2244 1842 A 16 ALA HA A 63 LEU HDx% 1.0 1.8 7.5 2245 1843 A 16 ALA HB% A 63 LEU HDx% 1.0 1.8 8.0 2246 1843 A 16 ALA HB% A 63 LEU HDy% 1.0 1.8 8.0 2247 1844 A 16 ALA HB% A 63 LEU HDy% 1.0 1.8 8.0 2248 1844 A 16 ALA HB% A 63 LEU HDx% 1.0 1.8 8.0 2249 1845 A 16 ALA HB% A 63 LEU HG 1.0 1.8 5.5 2250 1846 A 16 ALA H A 63 LEU HDx% 1.0 1.8 7.5 2251 1846 A 16 ALA H A 63 LEU HDy% 1.0 1.8 7.5 2252 1847 A 16 ALA H A 63 LEU HDy% 1.0 1.8 7.5 2253 1847 A 16 ALA H A 63 LEU HDx% 1.0 1.8 7.5 2254 1848 A 17 LEU HA A 27 LEU HBy 1.0 1.8 7.0 2255 1849 A 17 LEU HA A 27 LEU HBx 1.0 1.8 7.0 2256 1850 A 17 LEU HA A 27 LEU HDy% 1.0 1.8 7.5 2257 1850 A 17 LEU HA A 27 LEU HDx% 1.0 1.8 7.5 2258 1851 A 17 LEU H A 27 LEU HDy% 1.0 1.8 7.5 2259 1851 A 17 LEU H A 27 LEU HDx% 1.0 1.8 7.5 2260 1852 A 90 ILE HG2% A 17 LEU HDy% 1.0 1.8 7.0 2261 1852 A 90 ILE HG2% A 17 LEU HDx% 1.0 1.8 7.0 2262 1853 A 92 SER H A 17 LEU HDy% 1.0 1.8 7.5 2263 1853 A 92 SER H A 17 LEU HDx% 1.0 1.8 7.5 2264 1854 A 93 SER H A 17 LEU HDx% 1.0 1.8 7.0 2265 1854 A 93 SER H A 17 LEU HDy% 1.0 1.8 7.0 2266 1855 A 93 SER HA A 17 LEU HDx% 1.0 1.8 7.0 2267 1855 A 17 LEU HDy% A 93 SER HA 1.0 1.8 7.0 2268 1856 A 17 LEU HDy% A 94 GLY H 1.0 1.8 5.5 2269 1856 A 94 GLY H A 17 LEU HDx% 1.0 1.8 5.5 2270 1857 A 17 LEU HDy% A 94 GLY HAy 1.0 1.8 7.5 2271 1857 A 94 GLY HAy A 17 LEU HDx% 1.0 1.8 7.5 2272 1858 A 17 LEU HDy% A 94 GLY HAx 1.0 1.8 7.5 2273 1858 A 94 GLY HAx A 17 LEU HDx% 1.0 1.8 7.5 2274 1859 A 94 GLY HAy A 17 LEU HDx% 1.0 1.8 5.0 2275 1859 A 17 LEU HDy% A 94 GLY HAy 1.0 1.8 5.0 2276 1860 A 94 GLY HAx A 17 LEU HDx% 1.0 1.8 5.0 2277 1860 A 17 LEU HDy% A 94 GLY HAx 1.0 1.8 5.0 2278 1861 A 95 GLU H A 17 LEU HDx% 1.0 1.8 7.0 2279 1861 A 95 GLU H A 17 LEU HDy% 1.0 1.8 7.0 2280 1862 A 19 ARG H A 27 LEU HDx% 1.0 1.8 7.5 2281 1862 A 19 ARG H A 27 LEU HDy% 1.0 1.8 7.5 2282 1863 A 19 ARG HDy A 61 VAL HGx% 1.0 1.8 7.0 2283 1863 A 19 ARG HDy A 61 VAL HGy% 1.0 1.8 7.0 2284 1864 A 19 ARG HDx A 61 VAL HGx% 1.0 1.8 7.0 2285 1864 A 19 ARG HDx A 61 VAL HGy% 1.0 1.8 7.0 2286 1865 A 19 ARG HGx A 61 VAL HGx% 1.0 1.8 5.0 2287 1865 A 19 ARG HGx A 61 VAL HGy% 1.0 1.8 5.0 2288 1866 A 20 ALA HB% A 26 LEU HA 1.0 1.8 7.5 2289 1867 A 20 ALA HA A 27 LEU HDx% 1.0 1.8 5.5 2290 1867 A 27 LEU HDy% A 20 ALA HA 1.0 1.8 5.5 2291 1868 A 20 ALA HB% A 27 LEU H 1.0 1.8 7.5 2292 1869 A 20 ALA HB% A 27 LEU HA 1.0 1.8 7.5 2293 1870 A 20 ALA HB% A 27 LEU HDx% 1.0 1.8 8.0 2294 1870 A 20 ALA HB% A 27 LEU HDy% 1.0 1.8 8.0 2295 1871 A 20 ALA HB% A 27 LEU HDy% 1.0 1.8 8.0 2296 1871 A 20 ALA HB% A 27 LEU HDx% 1.0 1.8 8.0 2297 1872 A 20 ALA H A 27 LEU HDx% 1.0 1.8 5.5 2298 1872 A 20 ALA H A 27 LEU HDy% 1.0 1.8 5.5 2299 1873 A 20 ALA HB% A 28 PHE H 1.0 1.8 7.5 2300 1874 A 20 ALA HA A 61 VAL HGx% 1.0 1.8 4.0 2301 1874 A 61 VAL HGy% A 20 ALA HA 1.0 1.8 4.0 2302 1875 A 20 ALA HB% A 61 VAL HGx% 1.0 1.8 7.5 2303 1875 A 20 ALA HB% A 61 VAL HGy% 1.0 1.8 7.5 2304 1876 A 20 ALA HB% A 91 ASN HA 1.0 1.8 7.5 2305 1877 A 20 ALA HB% A 92 SER H 1.0 1.8 7.5 2306 1878 A 20 ALA HB% A 92 SER HBy 1.0 1.8 7.5 2307 1879 A 20 ALA HB% A 92 SER HBx 1.0 1.8 7.5 2308 1880 A 21 GLU H A 27 LEU HDx% 1.0 1.8 7.5 2309 1880 A 21 GLU H A 27 LEU HDy% 1.0 1.8 7.5 2310 1881 A 92 SER HBy A 21 GLU HB2 1.0 1.8 7.0 2311 1881 A 21 GLU HB3 A 92 SER HBy 1.0 1.8 7.0 2312 1882 A 92 SER HBx A 21 GLU HB2 1.0 1.8 7.0 2313 1882 A 21 GLU HB3 A 92 SER HBx 1.0 1.8 7.0 2314 1883 A 23 GLU HG2 A 61 VAL HGx% 1.0 1.8 7.0 2315 1883 A 23 GLU HG3 A 61 VAL HGx% 1.0 1.8 7.0 2316 1883 A 61 VAL HGy% A 23 GLU HG2 1.0 1.8 7.0 2317 1883 A 23 GLU HG3 A 61 VAL HGy% 1.0 1.8 7.0 2318 1884 A 23 GLU H A 61 VAL HGy% 1.0 1.8 7.5 2319 1885 A 25 LYS HA A 60 PHE HA 1.0 1.8 7.0 2320 1886 A 25 LYS HBx A 60 PHE HA 1.0 1.8 5.0 2321 1887 A 25 LYS HDy A 60 PHE HA 1.0 1.8 7.0 2322 1888 A 25 LYS HDx A 60 PHE HA 1.0 1.8 7.0 2323 1889 A 25 LYS HBy A 61 VAL HGx% 1.0 1.8 7.0 2324 1889 A 25 LYS HBy A 61 VAL HGy% 1.0 1.8 7.0 2325 1890 A 25 LYS HBx A 61 VAL HGx% 1.0 1.8 7.0 2326 1890 A 25 LYS HBx A 61 VAL HGy% 1.0 1.8 7.0 2327 1891 A 25 LYS HDy A 61 VAL HGx% 1.0 1.8 7.0 2328 1891 A 25 LYS HDy A 61 VAL HGy% 1.0 1.8 7.0 2329 1892 A 25 LYS H A 61 VAL HGy% 1.0 1.8 7.5 2330 1893 A 26 LEU HBy A 60 PHE HA 1.0 1.8 7.0 2331 1894 A 26 LEU HBy A 60 PHE HD% 1.0 1.8 7.5 2332 1895 A 26 LEU HBx A 60 PHE HD% 1.0 1.8 7.5 2333 1896 A 26 LEU HDy% A 60 PHE HD% 1.0 1.8 8.0 2334 1896 A 60 PHE HD% A 26 LEU HDx% 1.0 1.8 8.0 2335 1897 A 26 LEU HDy% A 60 PHE HE% 1.0 1.8 8.0 2336 1897 A 60 PHE HE% A 26 LEU HDx% 1.0 1.8 8.0 2337 1898 A 26 LEU HDy% A 60 PHE HZ 1.0 1.8 7.5 2338 1898 A 60 PHE HZ A 26 LEU HDx% 1.0 1.8 7.5 2339 1899 A 26 LEU HG A 60 PHE HD% 1.0 1.8 7.5 2340 1900 A 26 LEU H A 60 PHE HA 1.0 1.8 7.0 2341 1901 A 26 LEU H A 60 PHE HD% 1.0 1.8 7.5 2342 1902 A 26 LEU HDy% A 89 PHE HBy 1.0 1.8 7.5 2343 1902 A 89 PHE HBy A 26 LEU HDx% 1.0 1.8 7.5 2344 1903 A 26 LEU HDy% A 89 PHE HBx 1.0 1.8 7.5 2345 1903 A 89 PHE HBx A 26 LEU HDx% 1.0 1.8 7.5 2346 1904 A 26 LEU HDy% A 89 PHE HD% 1.0 1.8 8.0 2347 1904 A 89 PHE HD% A 26 LEU HDx% 1.0 1.8 8.0 2348 1905 A 26 LEU HBy A 90 ILE H 1.0 1.8 7.0 2349 1906 A 26 LEU HA A 91 ASN HA 1.0 1.8 5.0 2350 1907 A 26 LEU HBy A 91 ASN HA 1.0 1.8 7.0 2351 1908 A 26 LEU HBx A 91 ASN HA 1.0 1.8 7.0 2352 1909 A 91 ASN HA A 26 LEU HDx% 1.0 1.8 5.5 2353 1909 A 26 LEU HDy% A 91 ASN HA 1.0 1.8 5.5 2354 1910 A 91 ASN HBy A 26 LEU HDx% 1.0 1.8 7.5 2355 1910 A 26 LEU HDy% A 91 ASN HBy 1.0 1.8 7.5 2356 1911 A 91 ASN HBx A 26 LEU HDx% 1.0 1.8 7.5 2357 1911 A 26 LEU HDy% A 91 ASN HBx 1.0 1.8 7.5 2358 1912 A 26 LEU HDy% A 91 ASN HA 1.0 1.8 5.5 2359 1912 A 91 ASN HA A 26 LEU HDx% 1.0 1.8 5.5 2360 1913 A 26 LEU HG A 91 ASN HA 1.0 1.8 7.0 2361 1914 A 92 SER H A 26 LEU HDx% 1.0 1.8 7.5 2362 1914 A 26 LEU HDy% A 92 SER H 1.0 1.8 7.5 2363 1915 A 26 LEU HDy% A 92 SER H 1.0 1.8 7.5 2364 1915 A 92 SER H A 26 LEU HDx% 1.0 1.8 7.5 2365 1916 A 26 LEU HDy% A 92 SER HBx 1.0 1.8 7.5 2366 1916 A 92 SER HBx A 26 LEU HDx% 1.0 1.8 7.5 2367 1917 A 26 LEU HDy% A 117 VAL HGx% 1.0 1.8 8.0 2368 1917 A 117 VAL HGx% A 26 LEU HDx% 1.0 1.8 8.0 2369 1918 A 27 LEU HA A 60 PHE HBy 1.0 1.8 7.0 2370 1919 A 27 LEU HA A 61 VAL H 1.0 1.8 4.0 2371 1920 A 27 LEU HA A 61 VAL HB 1.0 1.8 5.0 2372 1921 A 27 LEU HA A 61 VAL HGx% 1.0 1.8 7.0 2373 1921 A 27 LEU HA A 61 VAL HGy% 1.0 1.8 7.0 2374 1922 A 61 VAL HB A 27 LEU HDx% 1.0 1.8 5.5 2375 1922 A 27 LEU HDy% A 61 VAL HB 1.0 1.8 5.5 2376 1923 A 27 LEU HDy% A 61 VAL HB 1.0 1.8 7.5 2377 1923 A 61 VAL HB A 27 LEU HDx% 1.0 1.8 7.5 2378 1924 A 27 LEU HDy% A 63 LEU HBy 1.0 1.8 7.5 2379 1924 A 63 LEU HBy A 27 LEU HDx% 1.0 1.8 7.5 2380 1925 A 27 LEU HDy% A 63 LEU HBx 1.0 1.8 7.5 2381 1925 A 63 LEU HBx A 27 LEU HDx% 1.0 1.8 7.5 2382 1926 A 27 LEU HDx% A 63 LEU HDx% 1.0 1.8 8.0 2383 1926 A 27 LEU HDy% A 63 LEU HDx% 1.0 1.8 8.0 2384 1926 A 27 LEU HDy% A 63 LEU HDy% 1.0 1.8 8.0 2385 1926 A 63 LEU HDy% A 27 LEU HDx% 1.0 1.8 8.0 2386 1927 A 27 LEU HBx A 89 PHE HA 1.0 1.8 6.0 2387 1928 A 27 LEU H A 89 PHE HA 1.0 1.8 7.0 2388 1929 A 27 LEU HBy A 90 ILE H 1.0 1.8 5.0 2389 1930 A 27 LEU HBy A 90 ILE HD1% 1.0 1.8 7.5 2390 1931 A 27 LEU HBy A 90 ILE HG2% 1.0 1.8 7.5 2391 1932 A 27 LEU HBx A 90 ILE H 1.0 1.8 4.0 2392 1933 A 27 LEU H A 90 ILE H 1.0 1.8 5.0 2393 1934 A 27 LEU H A 90 ILE HB 1.0 1.8 5.5 2394 1935 A 27 LEU H A 91 ASN HA 1.0 1.8 7.0 2395 1936 A 27 LEU HDy% A 94 GLY HAy 1.0 1.8 7.5 2396 1936 A 94 GLY HAy A 27 LEU HDx% 1.0 1.8 7.5 2397 1937 A 28 PHE HBx A 56 PHE HE% 1.0 1.8 7.5 2398 1938 A 28 PHE HD% A 56 PHE HD% 1.0 1.8 8.0 2399 1939 A 28 PHE HD% A 56 PHE HE% 1.0 1.8 8.0 2400 1940 A 28 PHE H A 60 PHE HBx 1.0 1.8 7.0 2401 1941 A 28 PHE H A 60 PHE HD% 1.0 1.8 7.5 2402 1942 A 28 PHE HBy A 61 VAL H 1.0 1.8 5.0 2403 1943 A 28 PHE HBy A 61 VAL HGx% 1.0 1.8 7.0 2404 1943 A 28 PHE HBy A 61 VAL HGy% 1.0 1.8 7.0 2405 1944 A 28 PHE H A 61 VAL H 1.0 1.8 5.0 2406 1945 A 28 PHE H A 61 VAL HB 1.0 1.8 5.0 2407 1946 A 28 PHE HBy A 62 ASN HA 1.0 1.8 7.0 2408 1947 A 28 PHE HBx A 62 ASN HA 1.0 1.8 5.0 2409 1948 A 28 PHE HBx A 62 ASN HD22 1.0 1.8 7.0 2410 1949 A 28 PHE HD% A 62 ASN HA 1.0 1.8 5.5 2411 1950 A 28 PHE HE% A 62 ASN HA 1.0 1.8 7.5 2412 1951 A 28 PHE H A 62 ASN HA 1.0 1.8 5.0 2413 1952 A 28 PHE HBy A 63 LEU H 1.0 1.8 7.0 2414 1953 A 28 PHE HBx A 63 LEU H 1.0 1.8 5.0 2415 1954 A 28 PHE H A 63 LEU H 1.0 1.8 7.0 2416 1955 A 28 PHE H A 63 LEU HBx 1.0 1.8 7.0 2417 1956 A 28 PHE HD% A 87 LEU HA 1.0 1.8 7.5 2418 1957 A 28 PHE HD% A 87 LEU HBx 1.0 1.8 7.5 2419 1958 A 28 PHE HD% A 87 LEU HBy 1.0 1.8 7.5 2420 1959 A 28 PHE HE% A 87 LEU H 1.0 1.8 7.5 2421 1960 A 28 PHE HE% A 87 LEU HA 1.0 1.8 5.5 2422 1961 A 28 PHE HE% A 87 LEU HBx 1.0 1.8 7.5 2423 1962 A 28 PHE HE% A 87 LEU HBy 1.0 1.8 7.5 2424 1963 A 28 PHE HE% A 87 LEU HDx% 1.0 1.8 8.0 2425 1963 A 28 PHE HE% A 87 LEU HDy% 1.0 1.8 8.0 2426 1964 A 28 PHE HE% A 87 LEU HDy% 1.0 1.8 8.0 2427 1964 A 28 PHE HE% A 87 LEU HDx% 1.0 1.8 8.0 2428 1965 A 28 PHE HE% A 87 LEU HG 1.0 1.8 5.5 2429 1966 A 28 PHE HZ A 87 LEU HDx% 1.0 1.8 7.5 2430 1966 A 87 LEU HDy% A 28 PHE HZ 1.0 1.8 7.5 2431 1967 A 87 LEU HDy% A 28 PHE HZ 1.0 1.8 7.5 2432 1967 A 28 PHE HZ A 87 LEU HDx% 1.0 1.8 7.5 2433 1968 A 87 LEU HG A 28 PHE HZ 1.0 1.8 5.0 2434 1969 A 28 PHE HD% A 88 LEU H 1.0 1.8 7.5 2435 1970 A 28 PHE HE% A 88 LEU H 1.0 1.8 7.5 2436 1971 A 28 PHE HA A 89 PHE HA 1.0 1.8 5.0 2437 1972 A 28 PHE HBx A 89 PHE HE% 1.0 1.8 7.5 2438 1973 A 28 PHE HD% A 89 PHE HA 1.0 1.8 7.5 2439 1974 A 28 PHE HD% A 89 PHE HE% 1.0 1.8 8.0 2440 1975 A 28 PHE HE% A 89 PHE HE% 1.0 1.8 8.0 2441 1976 A 28 PHE HA A 90 ILE H 1.0 1.8 5.0 2442 1977 A 29 VAL HA A 63 LEU H 1.0 1.8 5.0 2443 1978 A 29 VAL HA A 63 LEU HA 1.0 1.8 7.0 2444 1979 A 29 VAL HA A 63 LEU HBy 1.0 1.8 5.0 2445 1980 A 29 VAL HA A 63 LEU HBx 1.0 1.8 7.0 2446 1981 A 29 VAL HGx% A 63 LEU H 1.0 1.8 7.5 2447 1982 A 29 VAL HGx% A 63 LEU HBy 1.0 1.8 5.5 2448 1983 A 29 VAL HGy% A 65 MET H 1.0 1.8 7.5 2449 1984 A 29 VAL HGy% A 65 MET HBy 1.0 1.8 7.5 2450 1985 A 29 VAL HGy% A 65 MET HBx 1.0 1.8 7.5 2451 1986 A 29 VAL HGy% A 65 MET HE% 1.0 1.8 8.0 2452 1987 A 29 VAL HB A 87 LEU HA 1.0 1.8 5.5 2453 1988 A 29 VAL HGx% A 87 LEU HA 1.0 1.8 7.5 2454 1989 A 29 VAL H A 87 LEU HDy% 1.0 1.8 7.5 2455 1989 A 29 VAL H A 87 LEU HDx% 1.0 1.8 7.5 2456 1990 A 29 VAL HB A 88 LEU H 1.0 1.8 5.0 2457 1991 A 29 VAL HB A 88 LEU HA 1.0 1.8 7.0 2458 1992 A 29 VAL HB A 88 LEU HDx% 1.0 1.8 7.5 2459 1992 A 29 VAL HB A 88 LEU HDy% 1.0 1.8 7.5 2460 1993 A 29 VAL HB A 88 LEU HDy% 1.0 1.8 5.0 2461 1993 A 29 VAL HB A 88 LEU HDx% 1.0 1.8 5.0 2462 1994 A 29 VAL H A 88 LEU H 1.0 1.8 4.0 2463 1995 A 29 VAL H A 88 LEU HBy 1.0 1.8 5.0 2464 1996 A 29 VAL H A 88 LEU HDx% 1.0 1.8 7.5 2465 1996 A 29 VAL H A 88 LEU HDy% 1.0 1.8 7.5 2466 1997 A 29 VAL HGx% A 89 PHE HA 1.0 1.8 7.5 2467 1998 A 29 VAL H A 89 PHE H 1.0 1.8 7.0 2468 1999 A 29 VAL H A 89 PHE HA 1.0 1.8 5.0 2469 2000 A 29 VAL H A 90 ILE H 1.0 1.8 7.0 2470 2001 A 47 PHE HE% A 30 ASP HB2 1.0 1.8 7.5 2471 2001 A 30 ASP HB3 A 47 PHE HE% 1.0 1.8 7.5 2472 2002 A 30 ASP H A 63 LEU H 1.0 1.8 7.0 2473 2003 A 30 ASP H A 63 LEU HBy 1.0 1.8 7.0 2474 2004 A 30 ASP H A 63 LEU HDy% 1.0 1.8 7.5 2475 2004 A 30 ASP H A 63 LEU HDx% 1.0 1.8 7.5 2476 2005 A 30 ASP HB3 A 64 LYS HB2 1.0 1.8 5.0 2477 2005 A 30 ASP HB2 A 64 LYS HB2 1.0 1.8 5.0 2478 2005 A 64 LYS HB3 A 30 ASP HB2 1.0 1.8 5.0 2479 2005 A 30 ASP HB3 A 64 LYS HB3 1.0 1.8 5.0 2480 2006 A 30 ASP H A 64 LYS HA 1.0 1.8 4.0 2481 2007 A 65 MET H A 30 ASP HB2 1.0 1.8 5.0 2482 2007 A 30 ASP HB3 A 65 MET H 1.0 1.8 5.0 2483 2008 A 30 ASP H A 65 MET H 1.0 1.8 5.0 2484 2009 A 87 LEU HA A 30 ASP HA 1.0 1.8 5.0 2485 2010 A 87 LEU HBx A 30 ASP HA 1.0 1.8 7.0 2486 2011 A 30 ASP HA A 87 LEU HDx% 1.0 1.8 7.5 2487 2011 A 87 LEU HDy% A 30 ASP HA 1.0 1.8 7.5 2488 2012 A 87 LEU HDy% A 30 ASP HA 1.0 1.8 7.5 2489 2012 A 30 ASP HA A 87 LEU HDx% 1.0 1.8 7.5 2490 2013 A 87 LEU HG A 30 ASP HA 1.0 1.8 7.0 2491 2014 A 87 LEU HA A 30 ASP HB2 1.0 1.8 7.0 2492 2014 A 30 ASP HB3 A 87 LEU HA 1.0 1.8 7.0 2493 2015 A 30 ASP H A 87 LEU HDx% 1.0 1.8 7.5 2494 2015 A 30 ASP H A 87 LEU HDy% 1.0 1.8 7.5 2495 2016 A 30 ASP H A 87 LEU HDy% 1.0 1.8 7.5 2496 2016 A 30 ASP H A 87 LEU HDx% 1.0 1.8 7.5 2497 2017 A 88 LEU H A 30 ASP HA 1.0 1.8 7.0 2498 2018 A 65 MET HBy A 31 CYS HA 1.0 0.8 6.0 2499 2019 A 65 MET HBx A 31 CYS HA 1.0 1.8 7.0 2500 2020 A 67 MET HE% A 31 CYS HA 1.0 1.8 7.5 2501 2021 A 31 CYS HA A 67 MET HG2 1.0 1.8 7.0 2502 2021 A 67 MET HG3 A 31 CYS HA 1.0 1.8 7.0 2503 2022 A 31 CYS HBy A 67 MET HE% 1.0 1.8 5.5 2504 2023 A 31 CYS HBx A 67 MET HE% 1.0 1.8 7.5 2505 2024 A 31 CYS HBx A 67 MET HG2 1.0 1.8 5.0 2506 2024 A 31 CYS HBx A 67 MET HG3 1.0 1.8 5.0 2507 2025 A 31 CYS HBy A 81 VAL HGx% 1.0 1.8 7.0 2508 2025 A 31 CYS HBy A 81 VAL HGy% 1.0 1.8 7.0 2509 2026 A 31 CYS HBx A 81 VAL HGx% 1.0 1.8 7.0 2510 2026 A 31 CYS HBx A 81 VAL HGy% 1.0 1.8 7.0 2511 2027 A 86 THR HB A 31 CYS HA 1.0 1.8 7.0 2512 2028 A 31 CYS HBy A 86 THR H 1.0 1.8 5.0 2513 2029 A 31 CYS HBy A 86 THR HB 1.0 1.8 4.0 2514 2030 A 31 CYS HBy A 86 THR HG2% 1.0 1.8 7.5 2515 2031 A 31 CYS HBx A 86 THR H 1.0 1.8 5.0 2516 2032 A 31 CYS HBx A 86 THR HB 1.0 1.8 5.0 2517 2033 A 31 CYS HBx A 86 THR HG2% 1.0 1.8 7.5 2518 2034 A 31 CYS H A 86 THR H 1.0 1.8 5.0 2519 2035 A 31 CYS H A 86 THR HB 1.0 1.8 7.0 2520 2036 A 31 CYS H A 86 THR HG2% 1.0 1.8 7.5 2521 2037 A 31 CYS H A 87 LEU HA 1.0 1.8 7.0 2522 2038 A 31 CYS H A 87 LEU HDy% 1.0 1.8 7.5 2523 2038 A 31 CYS H A 87 LEU HDx% 1.0 1.8 7.5 2524 2039 A 32 PHE HA A 39 CYS HBy 1.0 1.8 7.0 2525 2040 A 32 PHE HA A 39 CYS HBx 1.0 1.8 7.0 2526 2041 A 39 CYS HBy A 32 PHE HB2 1.0 1.8 5.0 2527 2041 A 32 PHE HB3 A 39 CYS HBy 1.0 1.8 5.0 2528 2042 A 39 CYS HBx A 32 PHE HB2 1.0 1.8 5.0 2529 2042 A 32 PHE HB3 A 39 CYS HBx 1.0 1.8 5.0 2530 2043 A 32 PHE HD% A 39 CYS HBy 1.0 1.8 7.5 2531 2044 A 32 PHE HD% A 39 CYS HBx 1.0 1.8 7.5 2532 2045 A 32 PHE HD% A 64 LYS HE2 1.0 1.8 7.5 2533 2045 A 32 PHE HD% A 64 LYS HE3 1.0 1.8 7.5 2534 2046 A 32 PHE HE% A 64 LYS HB2 1.0 1.8 5.5 2535 2046 A 64 LYS HB3 A 32 PHE HE% 1.0 1.8 5.5 2536 2047 A 32 PHE HE% A 64 LYS HDy 1.0 1.8 7.5 2537 2047 A 64 LYS HDx A 32 PHE HE% 1.0 1.8 7.5 2538 2048 A 32 PHE HE% A 64 LYS HE2 1.0 1.8 5.5 2539 2048 A 64 LYS HE3 A 32 PHE HE% 1.0 1.8 5.5 2540 2049 A 32 PHE HE% A 64 LYS HG2 1.0 1.8 7.5 2541 2049 A 64 LYS HG3 A 32 PHE HE% 1.0 1.8 7.5 2542 2050 A 32 PHE HD% A 65 MET H 1.0 1.8 5.5 2543 2051 A 65 MET H A 32 PHE HE% 1.0 1.8 5.5 2544 2052 A 65 MET HA A 32 PHE HE% 1.0 1.8 7.5 2545 2053 A 66 ASP H A 32 PHE HE% 1.0 1.8 7.5 2546 2054 A 66 ASP HA A 32 PHE HE% 1.0 1.8 7.5 2547 2055 A 66 ASP HBy A 32 PHE HE% 1.0 1.8 7.5 2548 2056 A 66 ASP HBx A 32 PHE HE% 1.0 1.8 7.5 2549 2057 A 66 ASP H A 32 PHE HZ 1.0 1.8 7.0 2550 2058 A 66 ASP HA A 32 PHE HZ 1.0 1.8 7.0 2551 2059 A 66 ASP HBy A 32 PHE HZ 1.0 1.8 7.0 2552 2060 A 66 ASP HBx A 32 PHE HZ 1.0 1.8 7.0 2553 2061 A 32 PHE HA A 84 TYR HBx 1.0 1.8 7.0 2554 2061 A 32 PHE HA A 84 TYR HBy 1.0 1.8 7.0 2555 2062 A 32 PHE HA A 84 TYR HD% 1.0 1.8 7.5 2556 2063 A 32 PHE HA A 85 PRO HA 1.0 1.8 7.0 2557 2064 A 33 THR HG2% A 67 MET HBx 1.0 1.8 7.5 2558 2065 A 33 THR HG2% A 67 MET HG2 1.0 1.8 7.5 2559 2065 A 33 THR HG2% A 67 MET HG3 1.0 1.8 7.5 2560 2066 A 33 THR HG2% A 68 GLU H 1.0 1.8 7.5 2561 2067 A 33 THR HG2% A 68 GLU HBy 1.0 1.8 7.5 2562 2068 A 33 THR HG2% A 68 GLU HGy 1.0 1.8 7.5 2563 2069 A 33 THR HG2% A 68 GLU HGx 1.0 1.8 7.5 2564 2070 A 33 THR HG2% A 84 TYR HD% 1.0 1.8 8.0 2565 2071 A 33 THR HG2% A 84 TYR HE% 1.0 1.8 8.0 2566 2072 A 84 TYR HE% A 35 TRP HZ2 1.0 1.8 5.5 2567 2073 A 84 TYR HD% A 35 TRP HZ3 1.0 1.8 7.5 2568 2074 A 84 TYR HE% A 35 TRP HZ3 1.0 1.8 7.5 2569 2075 A 38 PRO HA A 85 PRO HD2 1.0 1.8 7.0 2570 2075 A 38 PRO HA A 85 PRO HD3 1.0 1.8 7.0 2571 2076 A 38 PRO HBy A 85 PRO HD2 1.0 1.8 5.0 2572 2076 A 38 PRO HBy A 85 PRO HD3 1.0 1.8 5.0 2573 2077 A 38 PRO HGy A 85 PRO HD2 1.0 1.8 7.0 2574 2077 A 38 PRO HGy A 85 PRO HD3 1.0 1.8 7.0 2575 2078 A 38 PRO HBy A 102 GLY HAy 1.0 1.8 7.0 2576 2079 A 38 PRO HBy A 103 ALA HB% 1.0 1.8 7.5 2577 2080 A 85 PRO HBy A 39 CYS HA 1.0 1.8 7.0 2578 2081 A 85 PRO HBx A 39 CYS HA 1.0 1.8 7.0 2579 2082 A 39 CYS HA A 85 PRO HGx 1.0 1.8 5.0 2580 2082 A 85 PRO HGy A 39 CYS HA 1.0 1.8 5.0 2581 2083 A 85 PRO HBy A 42 LEU HDx% 1.0 1.8 7.5 2582 2083 A 42 LEU HDy% A 85 PRO HBy 1.0 1.8 7.5 2583 2084 A 85 PRO HBx A 42 LEU HDx% 1.0 1.8 7.5 2584 2084 A 42 LEU HDy% A 85 PRO HBx 1.0 1.8 7.5 2585 2085 A 42 LEU HDy% A 85 PRO HD2 1.0 1.8 7.5 2586 2085 A 42 LEU HDx% A 85 PRO HD2 1.0 1.8 7.5 2587 2085 A 85 PRO HD3 A 42 LEU HDx% 1.0 1.8 7.5 2588 2085 A 42 LEU HDy% A 85 PRO HD3 1.0 1.8 7.5 2589 2086 A 42 LEU HDy% A 85 PRO HGx 1.0 1.8 7.5 2590 2086 A 42 LEU HDx% A 85 PRO HGx 1.0 1.8 7.5 2591 2086 A 85 PRO HGy A 42 LEU HDx% 1.0 1.8 7.5 2592 2086 A 42 LEU HDy% A 85 PRO HGy 1.0 1.8 7.5 2593 2087 A 42 LEU HA A 103 ALA HB% 1.0 1.8 7.5 2594 2088 A 103 ALA HA A 42 LEU HDx% 1.0 1.8 5.5 2595 2088 A 42 LEU HDy% A 103 ALA HA 1.0 1.8 5.5 2596 2089 A 42 LEU HDy% A 103 ALA HB% 1.0 1.8 8.0 2597 2089 A 103 ALA HB% A 42 LEU HDx% 1.0 1.8 8.0 2598 2090 A 42 LEU HDy% A 104 GLU H 1.0 1.8 7.5 2599 2090 A 104 GLU H A 42 LEU HDx% 1.0 1.8 7.5 2600 2091 A 106 ALA H A 45 VAL HG1% 1.0 1.8 7.0 2601 2091 A 45 VAL HG2% A 106 ALA H 1.0 1.8 7.0 2602 2092 A 46 VAL HGy% A 105 ASP HA 1.0 1.8 7.5 2603 2093 A 46 VAL HA A 106 ALA HB% 1.0 1.8 7.5 2604 2094 A 46 VAL HGx% A 106 ALA H 1.0 1.8 5.5 2605 2095 A 46 VAL HGy% A 106 ALA H 1.0 1.8 7.5 2606 2096 A 46 VAL HGy% A 106 ALA HB% 1.0 1.8 8.0 2607 2097 A 47 PHE HD% A 53 ALA HA 1.0 1.8 7.5 2608 2098 A 47 PHE HE% A 64 LYS HB2 1.0 1.8 7.5 2609 2098 A 47 PHE HE% A 64 LYS HB3 1.0 1.8 7.5 2610 2099 A 47 PHE HE% A 64 LYS HE2 1.0 1.8 7.5 2611 2099 A 47 PHE HE% A 64 LYS HE3 1.0 1.8 7.5 2612 2100 A 47 PHE HE% A 87 LEU HDy% 1.0 1.8 8.0 2613 2100 A 47 PHE HE% A 87 LEU HDx% 1.0 1.8 8.0 2614 2101 A 47 PHE HE% A 109 LEU HDy% 1.0 1.8 8.0 2615 2101 A 47 PHE HE% A 109 LEU HDx% 1.0 1.8 8.0 2616 2102 A 106 ALA HB% A 49 ASP HA 1.0 1.8 7.5 2617 2103 A 49 ASP HBy A 106 ALA HB% 1.0 1.8 7.5 2618 2104 A 49 ASP HBx A 106 ALA HB% 1.0 1.8 7.0 2619 2105 A 52 VAL HB A 106 ALA HB% 1.0 1.8 7.5 2620 2106 A 52 VAL HGy% A 106 ALA HA 1.0 1.8 7.5 2621 2107 A 52 VAL HGy% A 107 PRO HA 1.0 1.8 7.5 2622 2108 A 52 VAL HGx% A 109 LEU H 1.0 1.8 7.5 2623 2109 A 55 TYR HBy A 110 LEU HDy% 1.0 1.8 7.5 2624 2109 A 55 TYR HBy A 110 LEU HDx% 1.0 1.8 7.5 2625 2110 A 55 TYR HBx A 110 LEU HDy% 1.0 1.8 7.5 2626 2110 A 55 TYR HBx A 110 LEU HDx% 1.0 1.8 7.5 2627 2111 A 55 TYR HD% A 110 LEU HDx% 1.0 1.8 8.0 2628 2111 A 55 TYR HD% A 110 LEU HDy% 1.0 1.8 8.0 2629 2112 A 55 TYR HD% A 110 LEU HDy% 1.0 1.8 8.0 2630 2112 A 55 TYR HD% A 110 LEU HDx% 1.0 1.8 8.0 2631 2113 A 55 TYR HE% A 110 LEU HDx% 1.0 1.8 8.0 2632 2113 A 55 TYR HE% A 110 LEU HDy% 1.0 1.8 8.0 2633 2114 A 55 TYR H A 110 LEU HDx% 1.0 1.8 7.5 2634 2114 A 55 TYR H A 110 LEU HDy% 1.0 1.8 7.5 2635 2115 A 55 TYR H A 110 LEU HDy% 1.0 1.8 7.5 2636 2115 A 55 TYR H A 110 LEU HDx% 1.0 1.8 7.5 2637 2116 A 55 TYR HD% A 113 VAL HGy% 1.0 1.8 8.0 2638 2117 A 55 TYR HE% A 113 VAL HGy% 1.0 1.8 8.0 2639 2118 A 55 TYR HD% A 114 LYS HEy 1.0 1.8 7.5 2640 2119 A 55 TYR HE% A 114 LYS HA 1.0 1.8 7.5 2641 2120 A 55 TYR HE% A 114 LYS HB2 1.0 1.8 7.5 2642 2120 A 55 TYR HE% A 114 LYS HB3 1.0 1.8 7.5 2643 2121 A 55 TYR HE% A 114 LYS HDy 1.0 1.8 7.5 2644 2121 A 55 TYR HE% A 114 LYS HDx 1.0 1.8 7.5 2645 2122 A 55 TYR HE% A 114 LYS HEy 1.0 1.8 7.5 2646 2123 A 55 TYR HE% A 114 LYS HEx 1.0 1.8 7.5 2647 2124 A 55 TYR HE% A 114 LYS HGy 1.0 1.8 7.5 2648 2125 A 55 TYR HE% A 114 LYS HGx 1.0 1.8 7.5 2649 2126 A 55 TYR HE% A 117 VAL HGx% 1.0 1.8 8.0 2650 2127 A 55 TYR HE% A 117 VAL HGy% 1.0 1.8 8.0 2651 2128 A 56 PHE HBx A 62 ASN HD22 1.0 1.8 7.0 2652 2129 A 56 PHE HE% A 87 LEU HDy% 1.0 1.8 8.0 2653 2129 A 56 PHE HE% A 87 LEU HDx% 1.0 1.8 8.0 2654 2130 A 56 PHE HD% A 89 PHE HE% 1.0 1.8 8.0 2655 2131 A 56 PHE HE% A 89 PHE HE% 1.0 1.8 8.0 2656 2132 A 56 PHE HZ A 89 PHE HE% 1.0 1.8 7.5 2657 2133 A 56 PHE HE% A 109 LEU HDx% 1.0 1.8 8.0 2658 2133 A 56 PHE HE% A 109 LEU HDy% 1.0 1.8 8.0 2659 2134 A 56 PHE HE% A 109 LEU HDy% 1.0 1.8 8.0 2660 2134 A 56 PHE HE% A 109 LEU HDx% 1.0 1.8 8.0 2661 2135 A 56 PHE HZ A 109 LEU HBy 1.0 1.8 7.0 2662 2136 A 56 PHE HZ A 109 LEU HDx% 1.0 1.8 7.5 2663 2136 A 56 PHE HZ A 109 LEU HDy% 1.0 1.8 7.5 2664 2137 A 56 PHE HZ A 109 LEU HDy% 1.0 1.8 7.5 2665 2137 A 56 PHE HZ A 109 LEU HDx% 1.0 1.8 7.5 2666 2138 A 56 PHE HD% A 110 LEU HDx% 1.0 1.8 8.0 2667 2138 A 56 PHE HD% A 110 LEU HDy% 1.0 1.8 8.0 2668 2139 A 56 PHE HD% A 110 LEU HDy% 1.0 1.8 8.0 2669 2139 A 56 PHE HD% A 110 LEU HDx% 1.0 1.8 8.0 2670 2140 A 56 PHE HE% A 110 LEU HA 1.0 1.8 7.5 2671 2141 A 56 PHE HE% A 110 LEU HDx% 1.0 1.8 8.0 2672 2141 A 56 PHE HE% A 110 LEU HDy% 1.0 1.8 8.0 2673 2142 A 56 PHE HE% A 110 LEU HDy% 1.0 1.8 8.0 2674 2142 A 56 PHE HE% A 110 LEU HDx% 1.0 1.8 8.0 2675 2143 A 56 PHE HE% A 110 LEU HG 1.0 1.8 7.5 2676 2144 A 56 PHE H A 110 LEU HDx% 1.0 1.8 7.5 2677 2144 A 56 PHE H A 110 LEU HDy% 1.0 1.8 7.5 2678 2145 A 56 PHE HZ A 110 LEU HA 1.0 1.8 7.0 2679 2146 A 56 PHE HZ A 110 LEU HDx% 1.0 1.8 7.5 2680 2146 A 56 PHE HZ A 110 LEU HDy% 1.0 1.8 7.5 2681 2147 A 56 PHE HD% A 113 VAL HGx% 1.0 1.8 8.0 2682 2148 A 56 PHE HD% A 113 VAL HGy% 1.0 1.8 8.0 2683 2149 A 56 PHE HE% A 113 VAL HB 1.0 1.8 7.5 2684 2150 A 56 PHE HE% A 113 VAL HGx% 1.0 1.8 8.0 2685 2151 A 56 PHE HE% A 113 VAL HGy% 1.0 1.8 8.0 2686 2152 A 56 PHE HZ A 113 VAL HB 1.0 1.8 7.0 2687 2153 A 56 PHE HZ A 113 VAL HGx% 1.0 1.8 5.5 2688 2154 A 56 PHE HZ A 113 VAL HGy% 1.0 1.8 5.5 2689 2155 A 60 PHE HBy A 89 PHE HE% 1.0 1.8 7.5 2690 2156 A 60 PHE HBx A 89 PHE HE% 1.0 1.8 7.5 2691 2157 A 60 PHE HD% A 89 PHE HE% 1.0 1.8 8.0 2692 2158 A 89 PHE HE% A 60 PHE HE% 1.0 1.8 8.0 2693 2159 A 113 VAL HGx% A 60 PHE HE% 1.0 1.8 8.0 2694 2160 A 117 VAL HGx% A 60 PHE HE% 1.0 1.8 8.0 2695 2161 A 117 VAL HGy% A 60 PHE HE% 1.0 1.8 8.0 2696 2162 A 117 VAL HGx% A 60 PHE HZ 1.0 1.8 7.5 2697 2163 A 65 MET HE% A 71 GLU HG2 1.0 1.8 5.5 2698 2163 A 65 MET HE% A 71 GLU HG3 1.0 1.8 5.5 2699 2164 A 65 MET HE% A 72 GLY HAy 1.0 1.8 7.5 2700 2165 A 65 MET HBy A 75 LEU HDy% 1.0 1.8 7.5 2701 2165 A 65 MET HBy A 75 LEU HDx% 1.0 1.8 7.5 2702 2166 A 65 MET HBx A 75 LEU HDy% 1.0 1.8 7.5 2703 2166 A 65 MET HBx A 75 LEU HDx% 1.0 1.8 7.5 2704 2167 A 65 MET HE% A 75 LEU HDy% 1.0 1.8 8.0 2705 2167 A 65 MET HE% A 75 LEU HDx% 1.0 1.8 8.0 2706 2168 A 65 MET HGx A 75 LEU HDy% 1.0 1.8 5.5 2707 2168 A 65 MET HGy A 75 LEU HDx% 1.0 1.8 5.5 2708 2168 A 65 MET HGx A 75 LEU HDx% 1.0 1.8 5.5 2709 2168 A 75 LEU HDy% A 65 MET HGy 1.0 1.8 5.5 2710 2169 A 65 MET HGx A 75 LEU HDy% 1.0 1.8 7.5 2711 2169 A 65 MET HGy A 75 LEU HDx% 1.0 1.8 7.5 2712 2169 A 65 MET HGx A 75 LEU HDx% 1.0 1.8 7.5 2713 2169 A 75 LEU HDy% A 65 MET HGy 1.0 1.8 7.5 2714 2170 A 67 MET HE% A 75 LEU HA 1.0 1.8 7.5 2715 2171 A 67 MET HE% A 75 LEU HBy 1.0 1.8 5.5 2716 2172 A 67 MET HE% A 75 LEU HDy% 1.0 1.8 8.0 2717 2172 A 67 MET HE% A 75 LEU HDx% 1.0 1.8 8.0 2718 2173 A 67 MET HA A 76 ARG HBx 1.0 1.8 7.0 2719 2174 A 67 MET HA A 76 ARG HDy 1.0 1.8 7.0 2720 2174 A 67 MET HA A 76 ARG HDx 1.0 1.8 7.0 2721 2175 A 67 MET HBy A 76 ARG HDy 1.0 1.8 7.0 2722 2175 A 67 MET HBy A 76 ARG HDx 1.0 1.8 7.0 2723 2176 A 67 MET HE% A 76 ARG HBx 1.0 1.8 7.5 2724 2177 A 67 MET HE% A 76 ARG HDy 1.0 1.8 7.5 2725 2177 A 67 MET HE% A 76 ARG HDx 1.0 1.8 7.5 2726 2178 A 67 MET HG3 A 76 ARG HDy 1.0 1.8 7.0 2727 2178 A 76 ARG HDx A 67 MET HG2 1.0 1.8 7.0 2728 2178 A 67 MET HG3 A 76 ARG HDx 1.0 1.8 7.0 2729 2178 A 67 MET HG2 A 76 ARG HDy 1.0 1.8 7.0 2730 2179 A 67 MET HE% A 79 TYR HD% 1.0 1.8 8.0 2731 2180 A 67 MET HE% A 81 VAL HGx% 1.0 1.8 7.5 2732 2180 A 67 MET HE% A 81 VAL HGy% 1.0 1.8 7.5 2733 2181 A 67 MET HG3 A 81 VAL HGx% 1.0 1.8 7.0 2734 2181 A 67 MET HG2 A 81 VAL HGx% 1.0 1.8 7.0 2735 2181 A 81 VAL HGy% A 67 MET HG2 1.0 1.8 7.0 2736 2181 A 67 MET HG3 A 81 VAL HGy% 1.0 1.8 7.0 2737 2182 A 67 MET HE% A 82 HIS HA 1.0 1.8 7.5 2738 2183 A 67 MET HE% A 84 TYR HD% 1.0 1.8 8.0 2739 2184 A 67 MET HE% A 84 TYR HE% 1.0 1.8 8.0 2740 2185 A 67 MET HE% A 86 THR HB 1.0 1.8 7.5 2741 2186 A 86 THR HB A 67 MET HG2 1.0 1.8 7.0 2742 2186 A 67 MET HG3 A 86 THR HB 1.0 1.8 7.0 2743 2187 A 67 MET HE% A 88 LEU HDy% 1.0 1.8 8.0 2744 2187 A 67 MET HE% A 88 LEU HDx% 1.0 1.8 8.0 2745 2188 A 88 LEU HDy% A 75 LEU HDx% 1.0 1.8 8.0 2746 2188 A 75 LEU HDy% A 88 LEU HDx% 1.0 1.8 8.0 2747 2188 A 88 LEU HDy% A 75 LEU HDy% 1.0 1.8 8.0 2748 2188 A 75 LEU HDx% A 88 LEU HDx% 1.0 1.8 8.0 2749 2189 A 79 TYR HD% A 86 THR HG2% 1.0 1.8 8.0 2750 2190 A 79 TYR HA A 88 LEU HDx% 1.0 1.8 7.5 2751 2190 A 79 TYR HA A 88 LEU HDy% 1.0 1.8 7.5 2752 2191 A 79 TYR HA A 88 LEU HDy% 1.0 1.8 7.5 2753 2191 A 79 TYR HA A 88 LEU HDx% 1.0 1.8 7.5 2754 2192 A 79 TYR HBy A 88 LEU HDx% 1.0 1.8 7.5 2755 2192 A 79 TYR HBy A 88 LEU HDy% 1.0 1.8 7.5 2756 2193 A 79 TYR HBy A 88 LEU HDy% 1.0 1.8 7.5 2757 2193 A 79 TYR HBy A 88 LEU HDx% 1.0 1.8 7.5 2758 2194 A 79 TYR HBx A 88 LEU HDx% 1.0 1.8 7.5 2759 2194 A 79 TYR HBx A 88 LEU HDy% 1.0 1.8 7.5 2760 2195 A 79 TYR HBx A 88 LEU HDy% 1.0 1.8 7.5 2761 2195 A 79 TYR HBx A 88 LEU HDx% 1.0 1.8 7.5 2762 2196 A 79 TYR HD% A 88 LEU HDx% 1.0 1.8 8.0 2763 2196 A 79 TYR HD% A 88 LEU HDy% 1.0 1.8 8.0 2764 2197 A 79 TYR HE% A 88 LEU HBy 1.0 1.8 7.5 2765 2198 A 79 TYR HE% A 88 LEU HDx% 1.0 1.8 8.0 2766 2198 A 79 TYR HE% A 88 LEU HDy% 1.0 1.8 8.0 2767 2199 A 79 TYR HE% A 88 LEU HDy% 1.0 1.8 8.0 2768 2199 A 79 TYR HE% A 88 LEU HDx% 1.0 1.8 8.0 2769 2200 A 79 TYR HD% A 89 PHE H 1.0 1.8 7.5 2770 2201 A 79 TYR HD% A 89 PHE HD% 1.0 1.8 8.0 2771 2202 A 79 TYR HE% A 90 ILE HD1% 1.0 1.8 8.0 2772 2203 A 79 TYR HE% A 90 ILE HG2% 1.0 1.8 8.0 2773 2204 A 79 TYR HE% A 95 GLU HA 1.0 1.8 7.5 2774 2205 A 79 TYR HA A 96 VAL HGx% 1.0 1.8 5.5 2775 2206 A 79 TYR HD% A 96 VAL H 1.0 1.8 7.5 2776 2207 A 79 TYR HD% A 96 VAL HGx% 1.0 1.8 7.0 2777 2208 A 79 TYR HD% A 96 VAL HGy% 1.0 1.8 8.0 2778 2209 A 79 TYR HE% A 96 VAL H 1.0 1.8 7.5 2779 2210 A 79 TYR HE% A 96 VAL HGx% 1.0 1.8 7.0 2780 2211 A 79 TYR HE% A 96 VAL HGy% 1.0 1.8 8.0 2781 2212 A 79 TYR HA A 99 ARG HB2 1.0 1.8 5.5 2782 2212 A 79 TYR HA A 99 ARG HB3 1.0 1.8 5.5 2783 2213 A 79 TYR HD% A 99 ARG HB2 1.0 1.8 7.5 2784 2213 A 79 TYR HD% A 99 ARG HB3 1.0 1.8 7.5 2785 2214 A 79 TYR HBx A 101 VAL HGy% 1.0 1.8 7.5 2786 2215 A 101 VAL HGx% A 83 ALA HA 1.0 1.8 7.5 2787 2216 A 83 ALA H A 101 VAL HGx% 1.0 1.8 7.5 2788 2217 A 84 TYR H A 101 VAL HGx% 1.0 1.8 7.5 2789 2218 A 102 GLY HAy A 85 PRO HD2 1.0 1.8 7.0 2790 2218 A 85 PRO HD3 A 102 GLY HAy 1.0 1.8 7.0 2791 2219 A 102 GLY HAy A 85 PRO HGx 1.0 1.8 7.0 2792 2219 A 85 PRO HGy A 102 GLY HAy 1.0 1.8 7.0 2793 2220 A 102 GLY HAx A 85 PRO HGx 1.0 1.8 5.0 2794 2220 A 85 PRO HGy A 102 GLY HAx 1.0 1.8 5.0 2795 2221 A 85 PRO HBy A 103 ALA HB% 1.0 1.8 7.5 2796 2222 A 85 PRO HBx A 103 ALA HB% 1.0 1.8 7.5 2797 2223 A 103 ALA HB% A 85 PRO HD2 1.0 1.8 7.5 2798 2223 A 85 PRO HD3 A 103 ALA HB% 1.0 1.8 7.5 2799 2224 A 86 THR HG2% A 99 ARG HA 1.0 1.8 7.5 2800 2225 A 86 THR HG2% A 99 ARG HB2 1.0 1.8 7.5 2801 2225 A 86 THR HG2% A 99 ARG HB3 1.0 1.8 7.5 2802 2226 A 86 THR HG2% A 99 ARG HDy 1.0 1.8 7.5 2803 2227 A 86 THR HG2% A 99 ARG HDx 1.0 1.8 7.5 2804 2228 A 86 THR HA A 100 LEU H 1.0 1.8 7.0 2805 2229 A 86 THR HA A 101 VAL HA 1.0 1.8 3.0 2806 2230 A 86 THR HA A 101 VAL HGx% 1.0 1.8 7.5 2807 2231 A 86 THR HA A 101 VAL HGy% 1.0 1.8 5.5 2808 2232 A 86 THR HB A 101 VAL HA 1.0 1.8 7.0 2809 2233 A 86 THR HB A 101 VAL HGy% 1.0 1.8 7.0 2810 2234 A 86 THR HG2% A 101 VAL HA 1.0 1.8 7.5 2811 2235 A 86 THR HA A 102 GLY H 1.0 1.8 5.0 2812 2236 A 87 LEU HBx A 100 LEU HBy 1.0 1.8 4.0 2813 2237 A 87 LEU HBx A 100 LEU HBx 1.0 1.8 5.0 2814 2238 A 87 LEU H A 100 LEU H 1.0 1.8 5.0 2815 2239 A 87 LEU H A 100 LEU HBx 1.0 1.8 7.0 2816 2240 A 87 LEU H A 101 VAL HA 1.0 1.8 5.0 2817 2241 A 87 LEU H A 101 VAL HGx% 1.0 1.8 7.5 2818 2242 A 102 GLY H A 87 LEU HDx% 1.0 1.8 7.5 2819 2242 A 87 LEU HDy% A 102 GLY H 1.0 1.8 7.5 2820 2243 A 87 LEU H A 102 GLY H 1.0 1.8 7.0 2821 2244 A 87 LEU H A 109 LEU HDx% 1.0 1.8 7.5 2822 2244 A 87 LEU H A 109 LEU HDy% 1.0 1.8 7.5 2823 2245 A 88 LEU HA A 96 VAL HGx% 1.0 1.8 6.0 2824 2246 A 88 LEU HDx% A 96 VAL HGx% 1.0 1.8 8.0 2825 2246 A 88 LEU HDy% A 96 VAL HGx% 1.0 1.8 8.0 2826 2247 A 88 LEU HA A 99 ARG HA 1.0 1.8 4.0 2827 2248 A 99 ARG HA A 88 LEU HDx% 1.0 1.8 7.5 2828 2248 A 88 LEU HDy% A 99 ARG HA 1.0 1.8 7.5 2829 2249 A 88 LEU HDy% A 99 ARG HA 1.0 1.8 7.5 2830 2249 A 99 ARG HA A 88 LEU HDx% 1.0 1.8 7.5 2831 2250 A 88 LEU HDx% A 99 ARG HB2 1.0 1.8 5.5 2832 2250 A 88 LEU HDy% A 99 ARG HB2 1.0 1.8 5.5 2833 2250 A 88 LEU HDy% A 99 ARG HB3 1.0 1.8 5.5 2834 2250 A 99 ARG HB3 A 88 LEU HDx% 1.0 1.8 5.5 2835 2251 A 88 LEU HDy% A 99 ARG HDy 1.0 1.8 7.5 2836 2251 A 99 ARG HDy A 88 LEU HDx% 1.0 1.8 7.5 2837 2252 A 88 LEU HDy% A 99 ARG HDx 1.0 1.8 7.5 2838 2252 A 99 ARG HDx A 88 LEU HDx% 1.0 1.8 7.5 2839 2253 A 88 LEU HDy% A 100 LEU H 1.0 1.8 7.5 2840 2253 A 100 LEU H A 88 LEU HDx% 1.0 1.8 7.5 2841 2254 A 88 LEU H A 109 LEU HDx% 1.0 1.8 7.5 2842 2254 A 88 LEU H A 109 LEU HDy% 1.0 1.8 7.5 2843 2255 A 89 PHE H A 96 VAL HGy% 1.0 1.8 7.5 2844 2256 A 89 PHE HBy A 98 TYR H 1.0 1.8 4.0 2845 2257 A 89 PHE HBy A 98 TYR HBy 1.0 1.8 7.0 2846 2258 A 89 PHE HBy A 98 TYR HE% 1.0 1.8 7.5 2847 2259 A 89 PHE HBx A 98 TYR H 1.0 1.8 5.0 2848 2260 A 89 PHE HBx A 98 TYR HBy 1.0 1.8 7.0 2849 2261 A 89 PHE H A 98 TYR H 1.0 1.8 5.0 2850 2262 A 89 PHE HE% A 99 ARG HA 1.0 1.8 7.5 2851 2263 A 89 PHE H A 99 ARG HA 1.0 1.8 5.0 2852 2264 A 89 PHE HE% A 100 LEU HBy 1.0 1.8 7.5 2853 2265 A 89 PHE HE% A 100 LEU HBx 1.0 1.8 7.5 2854 2266 A 89 PHE HE% A 109 LEU HDy% 1.0 1.8 8.0 2855 2266 A 89 PHE HE% A 109 LEU HDx% 1.0 1.8 8.0 2856 2267 A 89 PHE HE% A 113 VAL HA 1.0 1.8 7.5 2857 2268 A 89 PHE HE% A 113 VAL HGx% 1.0 1.8 8.0 2858 2269 A 89 PHE HE% A 113 VAL HGy% 1.0 1.8 8.0 2859 2270 A 89 PHE HBy A 117 VAL HGx% 1.0 1.8 7.5 2860 2271 A 89 PHE HBy A 117 VAL HGy% 1.0 1.8 7.5 2861 2272 A 89 PHE HBx A 117 VAL HGx% 1.0 1.8 7.5 2862 2273 A 89 PHE HD% A 117 VAL HGx% 1.0 1.8 8.0 2863 2274 A 89 PHE HD% A 117 VAL HGy% 1.0 1.8 8.0 2864 2275 A 89 PHE HE% A 117 VAL HGy% 1.0 1.8 8.0 2865 2276 A 90 ILE HA A 96 VAL HA 1.0 1.8 4.0 2866 2277 A 90 ILE HA A 96 VAL HGx% 1.0 1.8 7.5 2867 2278 A 90 ILE HA A 96 VAL HGy% 1.0 1.8 7.5 2868 2279 A 90 ILE HD1% A 96 VAL HA 1.0 1.8 7.5 2869 2280 A 90 ILE HD1% A 96 VAL HGx% 1.0 1.8 8.0 2870 2281 A 90 ILE HG1y A 96 VAL HA 1.0 1.8 5.0 2871 2282 A 90 ILE HG1x A 96 VAL HA 1.0 1.8 7.0 2872 2283 A 90 ILE HG2% A 96 VAL HA 1.0 1.8 7.5 2873 2284 A 90 ILE HA A 97 VAL H 1.0 1.8 5.0 2874 2285 A 90 ILE HG1y A 97 VAL H 1.0 1.8 7.0 2875 2286 A 90 ILE HA A 98 TYR H 1.0 1.8 7.0 2876 2287 A 91 ASN HA A 97 VAL HGx% 1.0 1.8 5.0 2877 2287 A 91 ASN HA A 97 VAL HGy% 1.0 1.8 5.0 2878 2288 A 91 ASN HBy A 97 VAL HGx% 1.0 1.8 5.0 2879 2288 A 91 ASN HBy A 97 VAL HGy% 1.0 1.8 5.0 2880 2289 A 91 ASN HBx A 97 VAL HGx% 1.0 1.8 5.0 2881 2289 A 91 ASN HBx A 97 VAL HGy% 1.0 1.8 5.0 2882 2290 A 91 ASN HD21 A 97 VAL HGx% 1.0 1.8 7.0 2883 2290 A 91 ASN HD21 A 97 VAL HGy% 1.0 1.8 7.0 2884 2291 A 91 ASN HD22 A 97 VAL HGx% 1.0 1.8 7.0 2885 2291 A 91 ASN HD22 A 97 VAL HGy% 1.0 1.8 7.0 2886 2292 A 91 ASN H A 97 VAL H 1.0 1.8 7.0 2887 2293 A 91 ASN H A 97 VAL HGx% 1.0 1.8 4.0 2888 2293 A 91 ASN H A 97 VAL HGy% 1.0 1.8 4.0 2889 2294 A 117 VAL H A 97 VAL HGx% 1.0 1.8 7.0 2890 2294 A 97 VAL HGy% A 117 VAL H 1.0 1.8 7.0 2891 2295 A 98 TYR HE% A 113 VAL H 1.0 1.8 7.5 2892 2296 A 98 TYR HE% A 113 VAL HA 1.0 1.8 5.5 2893 2297 A 98 TYR HE% A 113 VAL HB 1.0 1.8 7.5 2894 2298 A 98 TYR HE% A 113 VAL HGx% 1.0 1.8 8.0 2895 2299 A 98 TYR HD% A 116 GLY H 1.0 1.8 7.5 2896 2300 A 98 TYR HE% A 116 GLY HAy 1.0 1.8 5.5 2897 2301 A 98 TYR HD% A 117 VAL HA 1.0 1.8 7.5 2898 2302 A 98 TYR HD% A 117 VAL HB 1.0 1.8 7.5 2899 2303 A 98 TYR HE% A 117 VAL HA 1.0 1.8 7.5 2900 2304 A 98 TYR HE% A 117 VAL HGx% 1.0 1.8 8.0 2901 2305 A 98 TYR H A 117 VAL HGx% 1.0 1.8 7.5 2902 2306 A 98 TYR H A 117 VAL HGy% 1.0 1.8 7.5 2903 2307 A 100 LEU HDx% A 112 LYS HE2 1.0 1.8 7.5 2904 2307 A 100 LEU HDy% A 112 LYS HE3 1.0 1.8 7.5 2905 2307 A 112 LYS HE3 A 100 LEU HDx% 1.0 1.8 7.5 2906 2307 A 100 LEU HDy% A 112 LYS HE2 1.0 1.8 7.5 2907 2308 A 100 LEU HDy% A 112 LYS HA 1.0 1.8 7.5 2908 2308 A 112 LYS HA A 100 LEU HDx% 1.0 1.8 7.5 2909 2309 A 100 LEU HBx A 113 VAL HA 1.0 1.8 7.0 2910 2310 A 100 LEU HDy% A 113 VAL HA 1.0 1.8 7.5 2911 2310 A 113 VAL HA A 100 LEU HDx% 1.0 1.8 7.5 2912 2311 A 100 LEU HDy% A 115 LEU H 1.0 1.8 7.5 2913 2311 A 115 LEU H A 100 LEU HDx% 1.0 1.8 7.5 2914 2312 A 112 LYS HBx A 103 ALA HA 1.0 1.8 7.0 2915 2313 A 103 ALA HA A 112 LYS HGy 1.0 1.8 7.0 2916 2314 A 103 ALA HB% A 112 LYS HBy 1.0 1.8 7.5 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 113 VAL HA A 117 VAL HGy% 1.0 1.8 6.5 2 1 A 98 TYR HBx A 117 VAL HGy% 1.0 1.8 6.5 3 2 A 89 PHE HBy A 26 LEU HDx% 1.0 1.8 6.5 4 2 A 89 PHE HBy A 97 VAL HGx% 1.0 1.8 6.5 5 2 A 89 PHE HBy A 97 VAL HGy% 1.0 1.8 6.5 6 2 A 26 LEU HDy% A 89 PHE HBy 1.0 1.8 6.5 7 3 A 38 PRO HA A 85 PRO HGx 1.0 1.8 5.0 8 3 A 85 PRO HGy A 103 ALA HA 1.0 1.8 5.0 9 3 A 38 PRO HA A 85 PRO HGy 1.0 1.8 5.0 10 3 A 103 ALA HA A 85 PRO HGx 1.0 1.8 5.0 11 4 A 98 TYR HD% A 113 VAL HGy% 1.0 1.8 6.0 12 4 A 98 TYR HE% A 113 VAL HGy% 1.0 1.8 6.0 13 4 A 89 PHE HD% A 113 VAL HGy% 1.0 1.8 6.0 14 4 A 113 VAL HGy% A 60 PHE HE% 1.0 1.8 6.0 15 5 A 79 TYR HD% A 90 ILE HG2% 1.0 1.8 7.0 16 5 A 13 PHE HD% A 90 ILE HG2% 1.0 1.8 7.0 17 6 A 111 LYS HA A 114 LYS HEx 1.0 1.8 6.0 18 6 A 114 LYS HEx A 110 LEU HA 1.0 1.8 6.0 19 7 A 101 VAL H A 100 LEU HG 1.0 1.8 5.0 20 7 A 100 LEU HBx A 101 VAL H 1.0 1.8 5.0 21 8 A 81 VAL H A 76 ARG HBy 1.0 1.8 5.0 22 8 A 79 TYR HBy A 81 VAL H 1.0 1.8 5.0 23 9 A 89 PHE HBx A 97 VAL HGx% 1.0 1.8 6.5 24 9 A 89 PHE HBx A 26 LEU HDx% 1.0 1.8 6.5 25 9 A 89 PHE HBx A 97 VAL HGy% 1.0 1.8 6.5 26 9 A 26 LEU HDy% A 89 PHE HBx 1.0 1.8 6.5 27 10 A 87 LEU HG A 28 PHE HZ 1.0 1.8 6.0 28 10 A 87 LEU HBy A 28 PHE HZ 1.0 1.8 6.0 29 11 A 100 LEU HBy A 100 LEU HG 1.0 1.8 3.0 30 11 A 100 LEU HBy A 100 LEU HBx 1.0 1.8 3.0 31 12 A 109 LEU HDy% A 110 LEU HA 1.0 1.8 5.5 32 12 A 114 LYS HGy A 110 LEU HA 1.0 1.8 5.5 33 12 A 110 LEU HA A 109 LEU HDx% 1.0 1.8 5.5 34 13 A 112 LYS HBy A 103 ALA HA 1.0 1.8 5.0 35 13 A 104 GLU HBy A 103 ALA HA 1.0 1.8 5.0 36 14 A 98 TYR HD% A 99 ARG HB2 1.0 1.8 6.5 37 14 A 98 TYR HD% A 99 ARG HB3 1.0 1.8 6.5 38 14 A 88 LEU HBy A 98 TYR HD% 1.0 1.8 6.5 39 15 A 29 VAL HB A 63 LEU HDx% 1.0 1.8 5.5 40 15 A 29 VAL HB A 88 LEU HBx 1.0 1.8 5.5 41 15 A 29 VAL HB A 63 LEU HDy% 1.0 1.8 5.5 42 16 A 90 ILE HG1x A 27 LEU HDx% 1.0 1.8 5.5 43 16 A 63 LEU HBx A 27 LEU HDx% 1.0 1.8 5.5 44 16 A 27 LEU HDy% A 90 ILE HG1x 1.0 1.8 5.5 45 16 A 27 LEU HDy% A 63 LEU HBx 1.0 1.8 5.5 46 17 A 47 PHE HD% A 109 LEU HDx% 1.0 1.8 7.0 47 17 A 28 PHE HD% A 109 LEU HDy% 1.0 1.8 7.0 48 17 A 28 PHE HD% A 109 LEU HDx% 1.0 1.8 7.0 49 17 A 47 PHE HD% A 109 LEU HDy% 1.0 1.8 7.0 50 18 A 27 LEU HBy A 90 ILE HB 1.0 1.8 5.5 51 18 A 20 ALA HB% A 27 LEU HBy 1.0 1.8 5.5 52 19 A 98 TYR HE% A 116 GLY HAy 1.0 1.8 5.0 53 19 A 98 TYR HE% A 100 LEU HBy 1.0 1.8 5.0 54 20 A 98 TYR HE% A 99 ARG HB2 1.0 1.8 6.5 55 20 A 98 TYR HD% A 99 ARG HB2 1.0 1.8 6.5 56 20 A 98 TYR HE% A 99 ARG HB3 1.0 1.8 6.5 57 20 A 98 TYR HD% A 99 ARG HB3 1.0 1.8 6.5 58 21 A 28 PHE HE% A 87 LEU HG 1.0 1.8 5.5 59 21 A 28 PHE HE% A 87 LEU HBy 1.0 1.8 5.5 60 22 A 78 LYS HGx A 75 LEU HDx% 1.0 1.8 6.0 61 22 A 63 LEU HDx% A 75 LEU HDx% 1.0 1.8 6.0 62 22 A 63 LEU HDy% A 75 LEU HDx% 1.0 1.8 6.0 63 22 A 78 LYS HGx A 75 LEU HDy% 1.0 1.8 6.0 64 22 A 63 LEU HDy% A 75 LEU HDy% 1.0 1.8 6.0 65 22 A 75 LEU HDy% A 63 LEU HDx% 1.0 1.8 6.0 66 23 A 27 LEU HA A 61 VAL HA 1.0 1.8 6.0 67 23 A 27 LEU HA A 20 ALA HA 1.0 1.8 6.0 68 24 A 25 LYS HGy A 25 LYS HBy 1.0 1.8 3.5 69 24 A 25 LYS HBy A 25 LYS HBx 1.0 1.8 3.5 70 25 A 88 LEU HG A 88 LEU HDx% 1.0 1.8 5.5 71 25 A 88 LEU HDy% A 88 LEU HBy 1.0 1.8 5.5 72 25 A 88 LEU HBy A 88 LEU HDx% 1.0 1.8 5.5 73 25 A 88 LEU HDy% A 88 LEU HG 1.0 1.8 5.5 74 26 A 53 ALA HB% A 57 ASN HBy 1.0 1.8 6.5 75 26 A 53 ALA HB% A 54 ASP HBx 1.0 1.8 6.5 76 27 A 32 PHE HD% A 39 CYS HA 1.0 1.8 5.5 77 27 A 32 PHE HD% A 34 THR HA 1.0 1.8 5.5 78 28 A 47 PHE HD% A 109 LEU HDx% 1.0 1.8 7.0 79 28 A 28 PHE HD% A 109 LEU HDx% 1.0 1.8 7.0 80 28 A 47 PHE HD% A 109 LEU HDy% 1.0 1.8 7.0 81 28 A 28 PHE HD% A 109 LEU HDy% 1.0 1.8 7.0 82 29 A 73 VAL HGy% A 76 ARG HBy 1.0 1.8 6.5 83 29 A 81 VAL HGy% A 76 ARG HBy 1.0 1.8 6.5 84 29 A 76 ARG HBy A 81 VAL HGx% 1.0 1.8 6.5 85 30 A 117 VAL HGy% A 26 LEU HDx% 1.0 1.8 7.0 86 30 A 117 VAL HGy% A 97 VAL HGx% 1.0 1.8 7.0 87 30 A 97 VAL HGy% A 117 VAL HGy% 1.0 1.8 7.0 88 30 A 26 LEU HDy% A 117 VAL HGy% 1.0 1.8 7.0 89 31 A 6 ILE HD1% A 47 PHE HZ 1.0 1.8 7.0 90 31 A 6 ILE HD1% A 28 PHE HE% 1.0 1.8 7.0 91 32 A 100 LEU HA A 100 LEU HG 1.0 1.8 3.5 92 32 A 100 LEU HA A 100 LEU HBx 1.0 1.8 3.5 93 33 A 55 TYR HBx A 110 LEU HDx% 1.0 1.8 6.5 94 33 A 55 TYR HBx A 110 LEU HDy% 1.0 1.8 6.5 95 33 A 52 VAL HGx% A 55 TYR HBx 1.0 1.8 6.5 96 34 A 103 ALA HB% A 112 LYS HBx 1.0 1.8 6.5 97 34 A 85 PRO HBx A 103 ALA HB% 1.0 1.8 6.5 98 35 A 88 LEU HA A 88 LEU HG 1.0 1.8 3.5 99 35 A 88 LEU HA A 88 LEU HBy 1.0 1.8 3.5 100 36 A 53 ALA H A 53 ALA HA 1.0 1.8 3.5 101 36 A 52 VAL HA A 53 ALA H 1.0 1.8 3.5 102 37 A 25 LYS HGy A 26 LEU H 1.0 1.8 5.0 103 37 A 25 LYS HBx A 26 LEU H 1.0 1.8 5.0 104 38 A 20 ALA HB% A 27 LEU HDx% 1.0 1.8 6.0 105 38 A 90 ILE HB A 27 LEU HDx% 1.0 1.8 6.0 106 38 A 27 LEU HDy% A 90 ILE HB 1.0 1.8 6.0 107 38 A 20 ALA HB% A 27 LEU HDy% 1.0 1.8 6.0 108 39 A 90 ILE HB A 27 LEU HDx% 1.0 1.8 5.5 109 39 A 90 ILE HD1% A 90 ILE HB 1.0 1.8 5.5 110 39 A 27 LEU HDy% A 90 ILE HB 1.0 1.8 5.5 111 40 A 98 TYR HD% A 113 VAL HGx% 1.0 1.8 7.0 112 40 A 89 PHE HD% A 113 VAL HGx% 1.0 1.8 7.0 113 41 A 32 PHE HD% A 39 CYS HA 1.0 1.8 6.5 114 41 A 32 PHE HD% A 34 THR HA 1.0 1.8 6.5 115 42 A 14 PRO HDx A 15 GLU HG2 1.0 1.8 3.5 116 42 A 15 GLU HA A 15 GLU HG2 1.0 1.8 3.5 117 42 A 15 GLU HG3 A 15 GLU HA 1.0 1.8 3.5 118 42 A 14 PRO HDx A 15 GLU HG3 1.0 1.8 3.5 119 43 A 15 GLU H A 63 LEU HDy% 1.0 1.8 6.5 120 43 A 15 GLU H A 11 LEU HDx% 1.0 1.8 6.5 121 43 A 15 GLU H A 63 LEU HDx% 1.0 1.8 6.5 122 43 A 11 LEU HDy% A 15 GLU H 1.0 1.8 6.5 123 44 A 55 TYR HBy A 110 LEU HDx% 1.0 1.8 6.5 124 44 A 55 TYR HBy A 110 LEU HDy% 1.0 1.8 6.5 125 44 A 52 VAL HGx% A 55 TYR HBy 1.0 1.8 6.5 126 45 A 98 TYR HBx A 117 VAL HGx% 1.0 1.8 6.5 127 45 A 98 TYR HBx A 113 VAL HGy% 1.0 1.8 6.5 128 46 A 65 MET HA A 65 MET HE% 1.0 1.8 5.5 129 46 A 65 MET HA A 10 GLU HBx 1.0 1.8 5.5 130 47 A 118 GLU H A 118 GLU HGx 1.0 1.8 3.5 131 47 A 118 GLU H A 118 GLU HBy 1.0 1.8 3.5 132 48 A 87 LEU H A 100 LEU HDy% 1.0 1.8 5.5 133 48 A 87 LEU H A 100 LEU HDx% 1.0 1.8 5.5 134 48 A 86 THR HG2% A 87 LEU H 1.0 1.8 5.5 135 49 A 79 TYR HE% A 96 VAL HGy% 1.0 1.8 6.0 136 49 A 78 LYS HGx A 79 TYR HE% 1.0 1.8 6.0 137 50 A 27 LEU HBx A 90 ILE HB 1.0 1.8 5.5 138 50 A 20 ALA HB% A 27 LEU HBx 1.0 1.8 5.5 139 51 A 46 VAL HGy% A 109 LEU HG 1.0 1.8 5.5 140 51 A 46 VAL HGy% A 109 LEU HBx 1.0 1.8 5.5 141 51 A 42 LEU HBy A 46 VAL HGy% 1.0 1.8 5.5 142 52 A 52 VAL HGy% A 106 ALA HB% 1.0 1.8 5.5 143 52 A 46 VAL HGy% A 106 ALA HB% 1.0 1.8 5.5 144 53 A 98 TYR HE% A 116 GLY HAy 1.0 1.8 5.0 145 53 A 98 TYR HE% A 100 LEU HBy 1.0 1.8 5.0 146 54 A 98 TYR HBy A 117 VAL HGx% 1.0 1.8 6.5 147 54 A 98 TYR HBy A 113 VAL HGy% 1.0 1.8 6.5 148 55 A 63 LEU HDy% A 64 LYS HA 1.0 1.8 6.5 149 55 A 12 SER HA A 63 LEU HDx% 1.0 1.8 6.5 150 55 A 64 LYS HA A 63 LEU HDx% 1.0 1.8 6.5 151 55 A 12 SER HA A 63 LEU HDy% 1.0 1.8 6.5 152 55 A 11 LEU HA A 63 LEU HDx% 1.0 1.8 6.5 153 55 A 11 LEU HA A 63 LEU HDy% 1.0 1.8 6.5 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _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 17 LEU N A 13 PHE O 1.0 2.8 3.3 2 2 A 17 LEU H A 13 PHE O 1.0 1.8 2.3 3 3 A 18 LYS N A 14 PRO O 1.0 2.8 3.3 4 4 A 18 LYS H A 14 PRO O 1.0 1.8 2.3 5 5 A 19 ARG N A 15 GLU O 1.0 2.8 3.3 6 6 A 19 ARG H A 15 GLU O 1.0 1.8 2.3 7 7 A 20 ALA N A 16 ALA O 1.0 2.8 3.3 8 8 A 20 ALA H A 16 ALA O 1.0 1.8 2.3 9 9 A 21 GLU N A 17 LEU O 1.0 2.8 3.3 10 10 A 21 GLU H A 17 LEU O 1.0 1.8 2.3 11 11 A 22 VAL N A 18 LYS O 1.0 2.8 3.3 12 12 A 22 VAL H A 18 LYS O 1.0 1.8 2.3 13 13 A 23 GLU N A 19 ARG O 1.0 2.8 3.3 14 14 A 23 GLU H A 19 ARG O 1.0 1.8 2.3 15 15 A 24 ASP N A 20 ALA O 1.0 2.8 3.3 16 16 A 24 ASP H A 20 ALA O 1.0 1.8 2.3 17 17 A 55 TYR N A 51 LEU O 1.0 2.8 3.3 18 18 A 55 TYR H A 51 LEU O 1.0 1.8 2.3 19 19 A 56 PHE N A 52 VAL O 1.0 2.8 3.3 20 20 A 56 PHE H A 52 VAL O 1.0 1.8 2.3 21 21 A 57 ASN N A 53 ALA O 1.0 2.8 3.3 22 22 A 57 ASN H A 53 ALA O 1.0 1.8 2.3 23 23 A 58 ARG N A 54 ASP O 1.0 2.8 3.3 24 24 A 58 ARG H A 54 ASP O 1.0 1.8 2.3 25 25 A 59 HIS N A 55 TYR O 1.0 2.8 3.3 26 26 A 59 HIS H A 55 TYR O 1.0 1.8 2.3 27 27 A 76 ARG N A 72 GLY O 1.0 2.8 3.3 28 28 A 76 ARG H A 72 GLY O 1.0 1.8 2.3 29 29 A 77 LYS N A 73 VAL O 1.0 2.8 3.3 30 30 A 77 LYS H A 73 VAL O 1.0 1.8 2.3 31 31 A 78 LYS N A 74 GLU O 1.0 2.8 3.3 32 32 A 78 LYS H A 74 GLU O 1.0 1.8 2.3 33 33 A 79 TYR N A 75 LEU O 1.0 2.8 3.3 34 34 A 79 TYR H A 75 LEU O 1.0 1.8 2.3 35 35 A 112 LYS N A 108 GLU O 1.0 2.8 3.3 36 36 A 112 LYS H A 108 GLU O 1.0 1.8 2.3 37 37 A 113 VAL N A 109 LEU O 1.0 2.8 3.3 38 38 A 113 VAL H A 109 LEU O 1.0 1.8 2.3 39 39 A 114 LYS N A 110 LEU O 1.0 2.8 3.3 40 40 A 114 LYS H A 110 LEU O 1.0 1.8 2.3 41 41 A 115 LEU N A 111 LYS O 1.0 2.8 3.3 42 42 A 115 LEU H A 111 LYS O 1.0 1.8 2.3 43 43 A 64 LYS N A 9 ARG O 1.0 2.8 3.3 44 44 A 64 LYS H A 9 ARG O 1.0 1.8 2.3 45 45 A 27 LEU N A 90 ILE O 1.0 2.8 3.3 46 46 A 27 LEU H A 90 ILE O 1.0 1.8 2.3 47 47 A 90 ILE N A 27 LEU O 1.0 2.8 3.3 48 48 A 90 ILE H A 27 LEU O 1.0 1.8 2.3 49 49 A 29 VAL N A 88 LEU O 1.0 2.8 3.3 50 50 A 29 VAL H A 88 LEU O 1.0 1.8 2.3 51 51 A 88 LEU N A 29 VAL O 1.0 2.8 3.3 52 52 A 88 LEU H A 29 VAL O 1.0 1.8 2.3 53 53 A 33 THR N A 84 TYR O 1.0 2.8 3.3 54 54 A 33 THR H A 84 TYR O 1.0 1.8 2.3 55 55 A 65 MET N A 30 ASP O 1.0 2.8 3.3 56 56 A 65 MET H A 30 ASP O 1.0 1.8 2.3 57 57 A 30 ASP N A 63 LEU O 1.0 2.8 3.3 58 58 A 30 ASP H A 63 LEU O 1.0 1.8 2.3 59 59 A 63 LEU N A 28 PHE O 1.0 2.8 3.3 60 60 A 63 LEU H A 28 PHE O 1.0 1.8 2.3 61 61 A 28 PHE N A 61 VAL O 1.0 2.8 3.3 62 62 A 28 PHE H A 61 VAL O 1.0 1.8 2.3 63 63 A 61 VAL N A 26 LEU O 1.0 2.8 3.3 64 64 A 61 VAL H A 26 LEU O 1.0 1.8 2.3 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 5 GLY C A 6 ILE N A 6 ILE CA A 6 ILE C 1.0 -127.0 -31.0 PHI 2 2 A 6 ILE C A 7 ALA N A 7 ALA CA A 7 ALA C 1.0 -131.0 -79.0 PHI 3 3 A 8 PHE C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -128.0 -68.0 PHI 4 4 A 9 ARG C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -126.0 -82.0 PHI 5 5 A 10 GLU C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -149.0 -101.0 PHI 6 6 A 11 LEU C A 12 SER N A 12 SER CA A 12 SER C 1.0 -171.0 -31.0 PHI 7 7 A 12 SER C A 13 PHE N A 13 PHE CA A 13 PHE C 1.0 -65.0 -41.0 PHI 8 8 A 13 PHE C A 14 PRO N A 14 PRO CA A 14 PRO C 1.0 -69.0 -49.0 PHI 9 9 A 14 PRO C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -78.0 -58.0 PHI 10 10 A 15 GLU C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -72.0 -52.0 PHI 11 11 A 16 ALA C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -74.0 -54.0 PHI 12 12 A 17 LEU C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -72.0 -48.0 PHI 13 13 A 18 LYS C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -71.0 -59.0 PHI 14 14 A 19 ARG C A 20 ALA N A 20 ALA CA A 20 ALA C 1.0 -78.0 -46.0 PHI 15 15 A 20 ALA C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -76.0 -52.0 PHI 16 16 A 21 GLU C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -90.0 -50.0 PHI 17 17 A 22 VAL C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -108.0 -48.0 PHI 18 18 A 26 LEU C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -163.0 -71.0 PHI 19 19 A 27 LEU C A 28 PHE N A 28 PHE CA A 28 PHE C 1.0 -143.0 -91.0 PHI 20 20 A 28 PHE C A 29 VAL N A 29 VAL CA A 29 VAL C 1.0 -135.0 -91.0 PHI 21 21 A 29 VAL C A 30 ASP N A 30 ASP CA A 30 ASP C 1.0 -128.0 -80.0 PHI 22 22 A 30 ASP C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -122.0 -62.0 PHI 23 23 A 31 CYS C A 32 PHE N A 32 PHE CA A 32 PHE C 1.0 -159.0 -103.0 PHI 24 24 A 32 PHE C A 33 THR N A 33 THR CA A 33 THR C 1.0 -146.0 -102.0 PHI 25 25 A 33 THR C A 34 THR N A 34 THR CA A 34 THR C 1.0 -95.0 -43.0 PHI 26 26 A 37 GLY C A 38 PRO N A 38 PRO CA A 38 PRO C 1.0 -66.0 -50.0 PHI 27 27 A 38 PRO C A 39 CYS N A 39 CYS CA A 39 CYS C 1.0 -80.0 -48.0 PHI 28 28 A 39 CYS C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -79.0 -47.0 PHI 29 29 A 40 LYS C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -75.0 -55.0 PHI 30 30 A 41 ARG C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -80.0 -52.0 PHI 31 31 A 42 LEU C A 43 SER N A 43 SER CA A 43 SER C 1.0 -83.0 -43.0 PHI 32 32 A 43 SER C A 44 LYS N A 44 LYS CA A 44 LYS C 1.0 -95.0 -47.0 PHI 33 33 A 44 LYS C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -108.0 -48.0 PHI 34 34 A 45 VAL C A 46 VAL N A 46 VAL CA A 46 VAL C 1.0 -82.0 -46.0 PHI 35 35 A 46 VAL C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -118.0 -50.0 PHI 36 36 A 49 ASP C A 50 SER N A 50 SER CA A 50 SER C 1.0 -69.0 -49.0 PHI 37 37 A 50 SER C A 51 LEU N A 51 LEU CA A 51 LEU C 1.0 -70.0 -54.0 PHI 38 38 A 51 LEU C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -89.0 -49.0 PHI 39 39 A 52 VAL C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -71.0 -51.0 PHI 40 40 A 53 ALA C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -72.0 -56.0 PHI 41 41 A 54 ASP C A 55 TYR N A 55 TYR CA A 55 TYR C 1.0 -70.0 -54.0 PHI 42 42 A 55 TYR C A 56 PHE N A 56 PHE CA A 56 PHE C 1.0 -78.0 -50.0 PHI 43 43 A 56 PHE C A 57 ASN N A 57 ASN CA A 57 ASN C 1.0 -72.0 -56.0 PHI 44 44 A 57 ASN C A 58 ARG N A 58 ARG CA A 58 ARG C 1.0 -88.0 -52.0 PHI 45 45 A 58 ARG C A 59 HIS N A 59 HIS CA A 59 HIS C 1.0 -112.0 -60.0 PHI 46 46 A 60 PHE C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -152.0 -36.0 PHI 47 47 A 61 VAL C A 62 ASN N A 62 ASN CA A 62 ASN C 1.0 -165.0 -81.0 PHI 48 48 A 62 ASN C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -153.0 -97.0 PHI 49 49 A 63 LEU C A 64 LYS N A 64 LYS CA A 64 LYS C 1.0 -151.0 -87.0 PHI 50 50 A 64 LYS C A 65 MET N A 65 MET CA A 65 MET C 1.0 -172.0 -88.0 PHI 51 51 A 65 MET C A 66 ASP N A 66 ASP CA A 66 ASP C 1.0 -128.0 -68.0 PHI 52 52 A 66 ASP C A 67 MET N A 67 MET CA A 67 MET C 1.0 -139.0 -51.0 PHI 53 53 A 67 MET C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -188.0 -116.0 PHI 54 54 A 71 GLU C A 72 GLY N A 72 GLY CA A 72 GLY C 1.0 -80.0 -48.0 PHI 55 55 A 72 GLY C A 73 VAL N A 73 VAL CA A 73 VAL C 1.0 -67.0 -55.0 PHI 56 56 A 73 VAL C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -75.0 -55.0 PHI 57 57 A 74 GLU C A 75 LEU N A 75 LEU CA A 75 LEU C 1.0 -72.0 -56.0 PHI 58 58 A 75 LEU C A 76 ARG N A 76 ARG CA A 76 ARG C 1.0 -71.0 -55.0 PHI 59 59 A 76 ARG C A 77 LYS N A 77 LYS CA A 77 LYS C 1.0 -76.0 -56.0 PHI 60 60 A 77 LYS C A 78 LYS N A 78 LYS CA A 78 LYS C 1.0 -80.0 -48.0 PHI 61 61 A 78 LYS C A 79 TYR N A 79 TYR CA A 79 TYR C 1.0 -128.0 -80.0 PHI 62 62 A 81 VAL C A 82 HIS N A 82 HIS CA A 82 HIS C 1.0 -179.0 -63.0 PHI 63 63 A 83 ALA C A 84 TYR N A 84 TYR CA A 84 TYR C 1.0 -161.0 -93.0 PHI 64 64 A 84 TYR C A 85 PRO N A 85 PRO CA A 85 PRO C 1.0 -150.0 -66.0 PHI 65 65 A 85 PRO C A 86 THR N A 86 THR CA A 86 THR C 1.0 -152.0 -88.0 PHI 66 66 A 86 THR C A 87 LEU N A 87 LEU CA A 87 LEU C 1.0 -154.0 -70.0 PHI 67 67 A 87 LEU C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -175.0 -91.0 PHI 68 68 A 88 LEU C A 89 PHE N A 89 PHE CA A 89 PHE C 1.0 -144.0 -84.0 PHI 69 69 A 89 PHE C A 90 ILE N A 90 ILE CA A 90 ILE C 1.0 -151.0 -103.0 PHI 70 70 A 90 ILE C A 91 ASN N A 91 ASN CA A 91 ASN C 1.0 -111.0 -63.0 PHI 71 71 A 91 ASN C A 92 SER N A 92 SER CA A 92 SER C 1.0 -90.0 -38.0 PHI 72 72 A 92 SER C A 93 SER N A 93 SER CA A 93 SER C 1.0 -110.0 -58.0 PHI 73 73 A 97 VAL C A 98 TYR N A 98 TYR CA A 98 TYR C 1.0 -171.0 -127.0 PHI 74 74 A 98 TYR C A 99 ARG N A 99 ARG CA A 99 ARG C 1.0 -170.0 -86.0 PHI 75 75 A 99 ARG C A 100 LEU N A 100 LEU CA A 100 LEU C 1.0 -152.0 -84.0 PHI 76 76 A 100 LEU C A 101 VAL N A 101 VAL CA A 101 VAL C 1.0 -134.0 -86.0 PHI 77 77 A 102 GLY C A 103 ALA N A 103 ALA CA A 103 ALA C 1.0 -160.0 -52.0 PHI 78 78 A 103 ALA C A 104 GLU N A 104 GLU CA A 104 GLU C 1.0 -179.0 -79.0 PHI 79 79 A 105 ASP C A 106 ALA N A 106 ALA CA A 106 ALA C 1.0 -65.0 -37.0 PHI 80 80 A 106 ALA C A 107 PRO N A 107 PRO CA A 107 PRO C 1.0 -63.0 -51.0 PHI 81 81 A 107 PRO C A 108 GLU N A 108 GLU CA A 108 GLU C 1.0 -74.0 -58.0 PHI 82 82 A 108 GLU C A 109 LEU N A 109 LEU CA A 109 LEU C 1.0 -78.0 -42.0 PHI 83 83 A 109 LEU C A 110 LEU N A 110 LEU CA A 110 LEU C 1.0 -73.0 -49.0 PHI 84 84 A 110 LEU C A 111 LYS N A 111 LYS CA A 111 LYS C 1.0 -73.0 -49.0 PHI 85 85 A 111 LYS C A 112 LYS N A 112 LYS CA A 112 LYS C 1.0 -70.0 -58.0 PHI 86 86 A 112 LYS C A 113 VAL N A 113 VAL CA A 113 VAL C 1.0 -73.0 -57.0 PHI 87 87 A 113 VAL C A 114 LYS N A 114 LYS CA A 114 LYS C 1.0 -66.0 -54.0 PHI 88 88 A 114 LYS C A 115 LEU N A 115 LEU CA A 115 LEU C 1.0 -77.0 -61.0 PHI 89 89 A 115 LEU C A 116 GLY N A 116 GLY CA A 116 GLY C 1.0 -91.0 -47.0 PHI 90 90 A 116 GLY C A 117 VAL N A 117 VAL CA A 117 VAL C 1.0 -129.0 -45.0 PHI 91 91 A 6 ILE N A 6 ILE CA A 6 ILE C A 7 ALA N 1.0 115.0 147.0 PSI 92 92 A 7 ALA N A 7 ALA CA A 7 ALA C A 8 PHE N 1.0 81.0 121.0 PSI 93 93 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 GLU N 1.0 106.0 182.0 PSI 94 94 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 LEU N 1.0 95.0 163.0 PSI 95 95 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 SER N 1.0 139.0 167.0 PSI 96 96 A 12 SER N A 12 SER CA A 12 SER C A 13 PHE N 1.0 94.0 190.0 PSI 97 97 A 13 PHE N A 13 PHE CA A 13 PHE C A 14 PRO N 1.0 -63.0 -27.0 PSI 98 98 A 14 PRO N A 14 PRO CA A 14 PRO C A 15 GLU N 1.0 -53.0 -21.0 PSI 99 99 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 ALA N 1.0 -54.0 -22.0 PSI 100 100 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 LEU N 1.0 -61.0 -33.0 PSI 101 101 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 LYS N 1.0 -54.0 -26.0 PSI 102 102 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ARG N 1.0 -58.0 -30.0 PSI 103 103 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 ALA N 1.0 -53.0 -25.0 PSI 104 104 A 20 ALA N A 20 ALA CA A 20 ALA C A 21 GLU N 1.0 -67.0 -19.0 PSI 105 105 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 VAL N 1.0 -51.0 -31.0 PSI 106 106 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 GLU N 1.0 -55.0 -27.0 PSI 107 107 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 ASP N 1.0 -36.0 16.0 PSI 108 108 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 PHE N 1.0 102.0 154.0 PSI 109 109 A 28 PHE N A 28 PHE CA A 28 PHE C A 29 VAL N 1.0 102.0 150.0 PSI 110 110 A 29 VAL N A 29 VAL CA A 29 VAL C A 30 ASP N 1.0 103.0 147.0 PSI 111 111 A 30 ASP N A 30 ASP CA A 30 ASP C A 31 CYS N 1.0 89.0 137.0 PSI 112 112 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 PHE N 1.0 114.0 142.0 PSI 113 113 A 32 PHE N A 32 PHE CA A 32 PHE C A 33 THR N 1.0 139.0 183.0 PSI 114 114 A 33 THR N A 33 THR CA A 33 THR C A 34 THR N 1.0 141.0 173.0 PSI 115 115 A 34 THR N A 34 THR CA A 34 THR C A 35 TRP N 1.0 -65.0 15.0 PSI 116 116 A 38 PRO N A 38 PRO CA A 38 PRO C A 39 CYS N 1.0 -45.0 -25.0 PSI 117 117 A 39 CYS N A 39 CYS CA A 39 CYS C A 40 LYS N 1.0 -59.0 -19.0 PSI 118 118 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 ARG N 1.0 -65.0 -25.0 PSI 119 119 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 LEU N 1.0 -59.0 -23.0 PSI 120 120 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 SER N 1.0 -65.0 -21.0 PSI 121 121 A 43 SER N A 43 SER CA A 43 SER C A 44 LYS N 1.0 -55.0 -31.0 PSI 122 122 A 44 LYS N A 44 LYS CA A 44 LYS C A 45 VAL N 1.0 -68.0 -4.0 PSI 123 123 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 VAL N 1.0 -52.0 -20.0 PSI 124 124 A 46 VAL N A 46 VAL CA A 46 VAL C A 47 PHE N 1.0 -58.0 -22.0 PSI 125 125 A 47 PHE N A 47 PHE CA A 47 PHE C A 48 LYS N 1.0 -48.0 48.0 PSI 126 126 A 50 SER N A 50 SER CA A 50 SER C A 51 LEU N 1.0 -63.0 -19.0 PSI 127 127 A 51 LEU N A 51 LEU CA A 51 LEU C A 52 VAL N 1.0 -52.0 -36.0 PSI 128 128 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 ALA N 1.0 -61.0 -21.0 PSI 129 129 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 ASP N 1.0 -51.0 -35.0 PSI 130 130 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 TYR N 1.0 -51.0 -31.0 PSI 131 131 A 55 TYR N A 55 TYR CA A 55 TYR C A 56 PHE N 1.0 -59.0 -31.0 PSI 132 132 A 56 PHE N A 56 PHE CA A 56 PHE C A 57 ASN N 1.0 -59.0 -31.0 PSI 133 133 A 57 ASN N A 57 ASN CA A 57 ASN C A 58 ARG N 1.0 -51.0 -31.0 PSI 134 134 A 58 ARG N A 58 ARG CA A 58 ARG C A 59 HIS N 1.0 -53.0 -25.0 PSI 135 135 A 59 HIS N A 59 HIS CA A 59 HIS C A 60 PHE N 1.0 -41.0 -1.0 PSI 136 136 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 ASN N 1.0 111.0 143.0 PSI 137 137 A 62 ASN N A 62 ASN CA A 62 ASN C A 63 LEU N 1.0 96.0 164.0 PSI 138 138 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 LYS N 1.0 126.0 158.0 PSI 139 139 A 64 LYS N A 64 LYS CA A 64 LYS C A 65 MET N 1.0 118.0 150.0 PSI 140 140 A 65 MET N A 65 MET CA A 65 MET C A 66 ASP N 1.0 94.0 158.0 PSI 141 141 A 66 ASP N A 66 ASP CA A 66 ASP C A 67 MET N 1.0 95.0 155.0 PSI 142 142 A 67 MET N A 67 MET CA A 67 MET C A 68 GLU N 1.0 -64.0 4.0 PSI 143 143 A 69 LYS N A 69 LYS CA A 69 LYS C A 70 GLY N 1.0 112.0 180.0 PSI 144 144 A 72 GLY N A 72 GLY CA A 72 GLY C A 73 VAL N 1.0 -57.0 -33.0 PSI 145 145 A 73 VAL N A 73 VAL CA A 73 VAL C A 74 GLU N 1.0 -56.0 -20.0 PSI 146 146 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 LEU N 1.0 -64.0 -24.0 PSI 147 147 A 75 LEU N A 75 LEU CA A 75 LEU C A 76 ARG N 1.0 -60.0 -32.0 PSI 148 148 A 76 ARG N A 76 ARG CA A 76 ARG C A 77 LYS N 1.0 -55.0 -27.0 PSI 149 149 A 77 LYS N A 77 LYS CA A 77 LYS C A 78 LYS N 1.0 -54.0 -18.0 PSI 150 150 A 78 LYS N A 78 LYS CA A 78 LYS C A 79 TYR N 1.0 -49.0 -33.0 PSI 151 151 A 79 TYR N A 79 TYR CA A 79 TYR C A 80 GLY N 1.0 -28.0 36.0 PSI 152 152 A 86 THR N A 86 THR CA A 86 THR C A 87 LEU N 1.0 106.0 150.0 PSI 153 153 A 87 LEU N A 87 LEU CA A 87 LEU C A 88 LEU N 1.0 103.0 151.0 PSI 154 154 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 PHE N 1.0 121.0 181.0 PSI 155 155 A 89 PHE N A 89 PHE CA A 89 PHE C A 90 ILE N 1.0 107.0 143.0 PSI 156 156 A 90 ILE N A 90 ILE CA A 90 ILE C A 91 ASN N 1.0 117.0 165.0 PSI 157 157 A 91 ASN N A 91 ASN CA A 91 ASN C A 92 SER N 1.0 -198.0 -158.0 PSI 158 158 A 92 SER N A 92 SER CA A 92 SER C A 93 SER N 1.0 -44.0 16.0 PSI 159 159 A 93 SER N A 93 SER CA A 93 SER C A 94 GLY N 1.0 -56.0 28.0 PSI 160 160 A 98 TYR N A 98 TYR CA A 98 TYR C A 99 ARG N 1.0 123.0 171.0 PSI 161 161 A 99 ARG N A 99 ARG CA A 99 ARG C A 100 LEU N 1.0 115.0 155.0 PSI 162 162 A 100 LEU N A 100 LEU CA A 100 LEU C A 101 VAL N 1.0 108.0 136.0 PSI 163 163 A 101 VAL N A 101 VAL CA A 101 VAL C A 102 GLY N 1.0 102.0 146.0 PSI 164 164 A 103 ALA N A 103 ALA CA A 103 ALA C A 104 GLU N 1.0 115.0 163.0 PSI 165 165 A 104 GLU N A 104 GLU CA A 104 GLU C A 105 ASP N 1.0 136.0 184.0 PSI 166 166 A 106 ALA N A 106 ALA CA A 106 ALA C A 107 PRO N 1.0 -60.0 -40.0 PSI 167 167 A 107 PRO N A 107 PRO CA A 107 PRO C A 108 GLU N 1.0 -52.0 -24.0 PSI 168 168 A 108 GLU N A 108 GLU CA A 108 GLU C A 109 LEU N 1.0 -57.0 -21.0 PSI 169 169 A 109 LEU N A 109 LEU CA A 109 LEU C A 110 LEU N 1.0 -61.0 -33.0 PSI 170 170 A 110 LEU N A 110 LEU CA A 110 LEU C A 111 LYS N 1.0 -52.0 -32.0 PSI 171 171 A 111 LYS N A 111 LYS CA A 111 LYS C A 112 LYS N 1.0 -52.0 -36.0 PSI 172 172 A 112 LYS N A 112 LYS CA A 112 LYS C A 113 VAL N 1.0 -57.0 -25.0 PSI 173 173 A 113 VAL N A 113 VAL CA A 113 VAL C A 114 LYS N 1.0 -52.0 -36.0 PSI 174 174 A 114 LYS N A 114 LYS CA A 114 LYS C A 115 LEU N 1.0 -55.0 -35.0 PSI 175 175 A 115 LEU N A 115 LEU CA A 115 LEU C A 116 GLY N 1.0 -60.0 -8.0 PSI 176 176 A 116 GLY N A 116 GLY CA A 116 GLY C A 117 VAL N 1.0 -58.0 -10.0 PSI 177 177 A 117 VAL N A 117 VAL CA A 117 VAL C A 118 GLU N 1.0 -52.0 16.0 PSI stop_ save_