data_nef_c15442_2jug save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 PRO middle . false 3 A 3 LEU middle . . 4 A 4 GLY middle . false 5 A 5 SER middle . . 6 A 6 SER middle . . 7 A 7 ALA middle . . 8 A 8 GLY middle . false 9 A 9 ALA middle . . 10 A 10 LEU middle . . 11 A 11 LEU middle . . 12 A 12 ALA middle . . 13 A 13 HIS middle . . 14 A 14 ALA middle . . 15 A 15 ALA middle . . 16 A 16 SER middle . . 17 A 17 LEU middle . . 18 A 18 GLY middle . false 19 A 19 VAL middle . . 20 A 20 ARG middle . . 21 A 21 LEU middle . . 22 A 22 TRP middle . . 23 A 23 VAL middle . . 24 A 24 GLU middle . . 25 A 25 GLY middle . false 26 A 26 GLU middle . . 27 A 27 ARG middle . . 28 A 28 LEU middle . . 29 A 29 ARG middle . . 30 A 30 PHE middle . . 31 A 31 GLN middle . . 32 A 32 ALA middle . . 33 A 33 PRO middle . false 34 A 34 PRO middle . false 35 A 35 GLY middle . false 36 A 36 VAL middle . . 37 A 37 MET middle . . 38 A 38 THR middle . . 39 A 39 PRO middle . false 40 A 40 GLU middle . . 41 A 41 LEU middle . . 42 A 42 GLN middle . . 43 A 43 SER middle . . 44 A 44 ARG middle . . 45 A 45 LEU middle . . 46 A 46 GLY middle . false 47 A 47 GLY middle . false 48 A 48 ALA middle . . 49 A 49 ARG middle . . 50 A 50 HIS middle . . 51 A 51 GLU middle . . 52 A 52 LEU middle . . 53 A 53 ILE middle . . 54 A 54 ALA middle . . 55 A 55 LEU middle . . 56 A 56 LEU middle . . 57 A 57 ARG middle . . 58 A 58 GLN middle . . 59 A 59 LEU middle . . 60 A 60 GLN middle . . 61 A 61 PRO middle . false 62 A 62 SER middle . . 63 A 63 SER middle . . 64 A 64 GLN middle . . 65 A 65 GLY middle . false 66 A 66 GLY middle . false 67 A 67 SER middle . . 68 A 68 LEU middle . . 69 A 69 LEU middle . . 70 A 70 ALA middle . . 71 A 71 PRO middle . false 72 A 72 VAL middle . . 73 A 73 ALA middle . . 74 A 74 ARG middle . . 75 A 75 ASN middle . . 76 A 76 GLY middle . false 77 A 77 ARG middle . . 78 A 78 LEU end . . 79 B 1 GLY start . false 80 B 2 PRO middle . false 81 B 3 LEU middle . . 82 B 4 GLY middle . false 83 B 5 SER middle . . 84 B 6 SER middle . . 85 B 7 ALA middle . . 86 B 8 GLY middle . false 87 B 9 ALA middle . . 88 B 10 LEU middle . . 89 B 11 LEU middle . . 90 B 12 ALA middle . . 91 B 13 HIS middle . . 92 B 14 ALA middle . . 93 B 15 ALA middle . . 94 B 16 SER middle . . 95 B 17 LEU middle . . 96 B 18 GLY middle . false 97 B 19 VAL middle . . 98 B 20 ARG middle . . 99 B 21 LEU middle . . 100 B 22 TRP middle . . 101 B 23 VAL middle . . 102 B 24 GLU middle . . 103 B 25 GLY middle . false 104 B 26 GLU middle . . 105 B 27 ARG middle . . 106 B 28 LEU middle . . 107 B 29 ARG middle . . 108 B 30 PHE middle . . 109 B 31 GLN middle . . 110 B 32 ALA middle . . 111 B 33 PRO middle . false 112 B 34 PRO middle . false 113 B 35 GLY middle . false 114 B 36 VAL middle . . 115 B 37 MET middle . . 116 B 38 THR middle . . 117 B 39 PRO middle . false 118 B 40 GLU middle . . 119 B 41 LEU middle . . 120 B 42 GLN middle . . 121 B 43 SER middle . . 122 B 44 ARG middle . . 123 B 45 LEU middle . . 124 B 46 GLY middle . false 125 B 47 GLY middle . false 126 B 48 ALA middle . . 127 B 49 ARG middle . . 128 B 50 HIS middle . . 129 B 51 GLU middle . . 130 B 52 LEU middle . . 131 B 53 ILE middle . . 132 B 54 ALA middle . . 133 B 55 LEU middle . . 134 B 56 LEU middle . . 135 B 57 ARG middle . . 136 B 58 GLN middle . . 137 B 59 LEU middle . . 138 B 60 GLN middle . . 139 B 61 PRO middle . false 140 B 62 SER middle . . 141 B 63 SER middle . . 142 B 64 GLN middle . . 143 B 65 GLY middle . false 144 B 66 GLY middle . false 145 B 67 SER middle . . 146 B 68 LEU middle . . 147 B 69 LEU middle . . 148 B 70 ALA middle . . 149 B 71 PRO middle . false 150 B 72 VAL middle . . 151 B 73 ALA middle . . 152 B 74 ARG middle . . 153 B 75 ASN middle . . 154 B 76 GLY middle . false 155 B 77 ARG middle . . 156 B 78 LEU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HA2 H 1 4.007 0.003 A 1 GLY HA3 H 1 4.007 0.003 A 1 GLY CA C 13 43.271 0.025 A 2 PRO HA H 1 4.487 0.004 A 2 PRO HBx H 1 1.967 0.002 A 2 PRO HBy H 1 2.317 0.004 A 2 PRO HDx H 1 3.574 0.007 A 2 PRO HDy H 1 3.614 0.003 A 2 PRO C C 13 177.032 0.000 A 2 PRO CA C 13 62.966 0.046 A 2 PRO CB C 13 32.054 0.019 A 2 PRO CD C 13 49.476 0.049 A 3 LEU H H 1 8.537 0.004 A 3 LEU HA H 1 4.345 0.006 A 3 LEU HBx H 1 1.631 0.000 A 3 LEU HBy H 1 1.674 0.000 A 3 LEU C C 13 177.845 0.000 A 3 LEU CA C 13 55.315 0.024 A 3 LEU CB C 13 42.051 0.044 A 3 LEU N N 15 122.077 0.046 A 4 GLY H H 1 8.410 0.004 A 4 GLY HA2 H 1 4.022 0.011 A 4 GLY HA3 H 1 4.022 0.011 A 4 GLY C C 13 173.489 0.000 A 4 GLY CA C 13 45.274 0.039 A 4 GLY N N 15 109.303 0.054 A 5 SER H H 1 7.905 0.002 A 5 SER CA C 13 59.604 0.000 A 5 SER CB C 13 64.749 0.000 A 5 SER N N 15 120.771 0.034 A 6 SER HA H 1 4.491 0.005 A 6 SER HBx H 1 4.001 0.003 A 6 SER HBy H 1 4.114 0.003 A 6 SER C C 13 175.906 0.000 A 6 SER CA C 13 59.099 0.044 A 6 SER CB C 13 63.569 0.070 A 7 ALA H H 1 8.724 0.003 A 7 ALA HA H 1 4.065 0.007 A 7 ALA HB% H 1 1.407 0.007 A 7 ALA C C 13 178.906 0.000 A 7 ALA CA C 13 54.960 0.074 A 7 ALA CB C 13 18.195 0.074 A 7 ALA N N 15 125.266 0.053 A 8 GLY H H 1 8.461 0.005 A 8 GLY HAx H 1 3.558 0.007 A 8 GLY HAy H 1 3.800 0.015 A 8 GLY C C 13 175.729 0.000 A 8 GLY CA C 13 46.975 0.063 A 8 GLY N N 15 123.886 0.035 A 9 ALA H H 1 7.803 0.005 A 9 ALA HA H 1 4.217 0.009 A 9 ALA HB% H 1 1.507 0.012 A 9 ALA C C 13 180.730 0.000 A 9 ALA CA C 13 54.628 0.033 A 9 ALA CB C 13 17.915 0.032 A 9 ALA N N 15 123.383 0.002 A 10 LEU H H 1 7.945 0.007 A 10 LEU HA H 1 4.184 0.010 A 10 LEU HB2 H 1 1.743 0.011 A 10 LEU HDx% H 1 0.814 0.004 A 10 LEU HDy% H 1 0.857 0.009 A 10 LEU HG H 1 1.555 0.005 A 10 LEU C C 13 178.268 0.000 A 10 LEU CA C 13 57.601 0.037 A 10 LEU CB C 13 41.402 0.039 A 10 LEU CDy C 13 25.699 0.042 A 10 LEU CDx C 13 23.488 0.072 A 10 LEU CG C 13 26.856 0.010 A 10 LEU N N 15 120.981 0.039 A 11 LEU H H 1 8.340 0.007 A 11 LEU HA H 1 3.904 0.008 A 11 LEU HB2 H 1 1.690 0.007 A 11 LEU HDx% H 1 0.998 0.011 A 11 LEU HDy% H 1 0.964 0.004 A 11 LEU HG H 1 1.714 0.008 A 11 LEU C C 13 178.220 0.000 A 11 LEU CA C 13 58.178 0.055 A 11 LEU CB C 13 41.764 0.069 A 11 LEU CDy C 13 25.221 0.071 A 11 LEU CDx C 13 24.992 0.040 A 11 LEU CG C 13 26.614 0.028 A 11 LEU N N 15 119.472 0.033 A 12 ALA H H 1 7.926 0.005 A 12 ALA HA H 1 4.097 0.011 A 12 ALA HB% H 1 1.538 0.008 A 12 ALA C C 13 180.221 0.000 A 12 ALA CA C 13 54.857 0.046 A 12 ALA CB C 13 18.142 0.079 A 12 ALA N N 15 118.581 0.038 A 13 HIS H H 1 8.364 0.009 A 13 HIS HA H 1 4.430 0.006 A 13 HIS HBx H 1 3.274 0.004 A 13 HIS HBy H 1 3.305 0.000 A 13 HIS HD2 H 1 7.836 0.007 A 13 HIS HE1 H 1 6.589 0.004 A 13 HIS C C 13 178.060 0.000 A 13 HIS CA C 13 59.077 0.031 A 13 HIS CB C 13 30.477 0.043 A 13 HIS CD2 C 13 119.106 0.039 A 13 HIS CE1 C 13 139.102 0.043 A 13 HIS N N 15 119.394 0.029 A 14 ALA H H 1 8.827 0.003 A 14 ALA HA H 1 3.751 0.009 A 14 ALA HB% H 1 1.415 0.006 A 14 ALA C C 13 179.442 0.000 A 14 ALA CA C 13 55.394 0.041 A 14 ALA CB C 13 16.709 0.053 A 14 ALA N N 15 120.813 0.042 A 15 ALA H H 1 8.660 0.006 A 15 ALA HA H 1 4.480 0.008 A 15 ALA HB% H 1 1.545 0.012 A 15 ALA C C 13 181.893 0.000 A 15 ALA CA C 13 54.887 0.053 A 15 ALA CB C 13 17.967 0.058 A 15 ALA N N 15 119.541 0.046 A 16 SER H H 1 8.168 0.010 A 16 SER HA H 1 4.294 0.004 A 16 SER HB2 H 1 4.118 0.009 A 16 SER HB3 H 1 4.118 0.009 A 16 SER C C 13 175.317 0.000 A 16 SER CA C 13 61.297 0.035 A 16 SER CB C 13 62.651 0.040 A 16 SER N N 15 115.696 0.034 A 17 LEU H H 1 7.326 0.009 A 17 LEU HA H 1 4.360 0.009 A 17 LEU HBx H 1 1.625 0.011 A 17 LEU HBy H 1 1.764 0.009 A 17 LEU HDx% H 1 0.636 0.006 A 17 LEU HDy% H 1 0.809 0.004 A 17 LEU HG H 1 1.546 0.012 A 17 LEU C C 13 177.146 0.000 A 17 LEU CA C 13 54.633 0.051 A 17 LEU CB C 13 42.993 0.038 A 17 LEU CDx C 13 21.996 0.060 A 17 LEU CDy C 13 25.528 0.053 A 17 LEU CG C 13 25.851 0.050 A 17 LEU N N 15 120.649 0.035 A 18 GLY H H 1 7.882 0.005 A 18 GLY HAx H 1 3.716 0.007 A 18 GLY HAy H 1 4.308 0.006 A 18 GLY C C 13 174.325 0.000 A 18 GLY CA C 13 44.806 0.038 A 18 GLY N N 15 104.666 0.053 A 19 VAL H H 1 7.848 0.006 A 19 VAL HA H 1 4.251 0.006 A 19 VAL HB H 1 1.905 0.010 A 19 VAL HGx% H 1 0.862 0.008 A 19 VAL HGy% H 1 0.876 0.009 A 19 VAL C C 13 174.822 0.000 A 19 VAL CA C 13 62.642 0.047 A 19 VAL CB C 13 31.623 0.047 A 19 VAL CG1 C 13 22.408 0.000 A 19 VAL N N 15 120.510 0.035 A 20 ARG H H 1 8.874 0.007 A 20 ARG HA H 1 5.073 0.005 A 20 ARG HB2 H 1 2.022 0.013 A 20 ARG HBx H 1 2.022 0.013 A 20 ARG HBy H 1 2.115 0.008 A 20 ARG HD2 H 1 3.235 0.007 A 20 ARG HD3 H 1 3.235 0.007 A 20 ARG HGx H 1 1.798 0.004 A 20 ARG HGy H 1 1.895 0.003 A 20 ARG C C 13 175.723 0.000 A 20 ARG CA C 13 55.009 0.043 A 20 ARG CB C 13 32.266 0.071 A 20 ARG CD C 13 43.260 0.051 A 20 ARG CG C 13 27.698 0.011 A 20 ARG N N 15 127.604 0.052 A 21 LEU H H 1 8.071 0.007 A 21 LEU HA H 1 5.589 0.005 A 21 LEU HBx H 1 1.518 0.017 A 21 LEU HBy H 1 1.605 0.011 A 21 LEU HDx% H 1 0.873 0.011 A 21 LEU HDy% H 1 0.855 0.006 A 21 LEU HG H 1 1.690 0.012 A 21 LEU C C 13 174.763 0.000 A 21 LEU CA C 13 54.033 0.043 A 21 LEU CB C 13 46.813 0.071 A 21 LEU CDx C 13 25.936 0.037 A 21 LEU CDy C 13 26.177 0.000 A 21 LEU CG C 13 27.245 0.025 A 21 LEU N N 15 122.913 0.026 A 22 TRP H H 1 8.604 0.007 A 22 TRP HA H 1 4.907 0.007 A 22 TRP HBx H 1 3.261 0.018 A 22 TRP HBy H 1 3.428 0.015 A 22 TRP HD1 H 1 6.982 0.012 A 22 TRP HE1 H 1 10.659 0.006 A 22 TRP HE3 H 1 7.094 0.008 A 22 TRP HH2 H 1 6.910 0.014 A 22 TRP HZ2 H 1 7.273 0.009 A 22 TRP HZ3 H 1 6.745 0.009 A 22 TRP C C 13 172.038 0.000 A 22 TRP CA C 13 57.170 0.032 A 22 TRP CB C 13 30.724 0.046 A 22 TRP CD1 C 13 127.411 0.026 A 22 TRP CE3 C 13 122.043 0.018 A 22 TRP CH2 C 13 123.415 0.063 A 22 TRP CZ2 C 13 113.945 0.033 A 22 TRP CZ3 C 13 120.642 0.048 A 22 TRP N N 15 117.809 0.043 A 22 TRP NE1 N 15 130.137 0.018 A 23 VAL H H 1 8.551 0.006 A 23 VAL HA H 1 4.733 0.014 A 23 VAL HB H 1 1.933 0.007 A 23 VAL HGx% H 1 0.868 0.006 A 23 VAL HGy% H 1 0.955 0.015 A 23 VAL C C 13 175.637 0.000 A 23 VAL CA C 13 60.285 0.045 A 23 VAL CB C 13 33.640 0.043 A 23 VAL CGx C 13 21.826 0.053 A 23 VAL CGy C 13 23.284 0.049 A 23 VAL N N 15 117.672 0.041 A 24 GLU H H 1 8.644 0.005 A 24 GLU HA H 1 4.683 0.011 A 24 GLU HBx H 1 1.866 0.011 A 24 GLU HBy H 1 1.967 0.004 A 24 GLU HGx H 1 2.287 0.028 A 24 GLU HGy H 1 2.332 0.012 A 24 GLU C C 13 176.363 0.000 A 24 GLU CA C 13 54.828 0.052 A 24 GLU CB C 13 32.058 0.054 A 24 GLU CG C 13 36.278 0.022 A 24 GLU N N 15 127.936 0.037 A 25 GLY H H 1 9.191 0.007 A 25 GLY HAx H 1 3.743 0.012 A 25 GLY HAy H 1 4.010 0.007 A 25 GLY C C 13 173.988 0.000 A 25 GLY CA C 13 47.433 0.072 A 25 GLY N N 15 117.493 0.052 A 26 GLU H H 1 8.810 0.003 A 26 GLU HA H 1 4.247 0.011 A 26 GLU HB2 H 1 2.320 0.004 A 26 GLU HB3 H 1 1.919 0.008 A 26 GLU HGx H 1 2.212 0.003 A 26 GLU HGy H 1 2.308 0.007 A 26 GLU C C 13 175.076 0.000 A 26 GLU CA C 13 55.383 0.051 A 26 GLU CB C 13 29.469 0.026 A 26 GLU CG C 13 35.940 0.023 A 26 GLU N N 15 123.051 0.044 A 27 ARG H H 1 7.987 0.007 A 27 ARG HA H 1 4.568 0.014 A 27 ARG HBx H 1 1.739 0.012 A 27 ARG HBy H 1 1.881 0.012 A 27 ARG HD2 H 1 3.191 0.011 A 27 ARG HD3 H 1 3.191 0.011 A 27 ARG HG2 H 1 1.619 0.009 A 27 ARG HG3 H 1 1.619 0.009 A 27 ARG C C 13 174.296 0.000 A 27 ARG CA C 13 54.464 0.043 A 27 ARG CB C 13 32.220 0.037 A 27 ARG CD C 13 43.318 0.058 A 27 ARG CG C 13 26.879 0.059 A 27 ARG N N 15 118.290 0.041 A 28 LEU H H 1 8.427 0.011 A 28 LEU HA H 1 4.493 0.013 A 28 LEU HBx H 1 1.280 0.008 A 28 LEU HBy H 1 1.715 0.014 A 28 LEU HD1% H 1 0.815 0.009 A 28 LEU HDy% H 1 0.806 0.006 A 28 LEU HG H 1 1.435 0.010 A 28 LEU C C 13 175.196 0.000 A 28 LEU CA C 13 54.063 0.056 A 28 LEU CB C 13 42.929 0.056 A 28 LEU CDx C 13 24.378 0.054 A 28 LEU CDy C 13 26.594 0.066 A 28 LEU CG C 13 26.913 0.076 A 28 LEU N N 15 123.289 0.040 A 29 ARG H H 1 8.720 0.013 A 29 ARG HA H 1 4.348 0.018 A 29 ARG HBx H 1 -0.464 0.012 A 29 ARG HBy H 1 0.257 0.008 A 29 ARG HDx H 1 2.857 0.015 A 29 ARG HDy H 1 2.884 0.014 A 29 ARG HGx H 1 0.965 0.009 A 29 ARG HGy H 1 1.096 0.012 A 29 ARG C C 13 173.463 0.000 A 29 ARG CA C 13 52.785 0.031 A 29 ARG CB C 13 30.689 0.035 A 29 ARG CD C 13 42.059 0.048 A 29 ARG CG C 13 26.553 0.052 A 29 ARG N N 15 125.863 0.042 A 30 PHE H H 1 7.409 0.013 A 30 PHE HA H 1 5.855 0.009 A 30 PHE HB2 H 1 2.793 0.006 A 30 PHE HB3 H 1 2.793 0.006 A 30 PHE HDx H 1 6.749 0.006 A 30 PHE HDy H 1 6.749 0.006 A 30 PHE HEx H 1 7.229 0.011 A 30 PHE HEy H 1 7.229 0.011 A 30 PHE HZ H 1 7.277 0.010 A 30 PHE C C 13 174.776 0.000 A 30 PHE CA C 13 54.717 0.028 A 30 PHE CB C 13 43.039 0.038 A 30 PHE CDx C 13 131.607 0.029 A 30 PHE CDy C 13 131.607 0.029 A 30 PHE CEx C 13 130.923 0.057 A 30 PHE CEy C 13 130.923 0.057 A 30 PHE CZ C 13 129.732 0.043 A 30 PHE N N 15 111.555 0.042 A 31 GLN H H 1 8.977 0.011 A 31 GLN HA H 1 4.730 0.012 A 31 GLN HB2 H 1 2.275 0.007 A 31 GLN HB3 H 1 2.275 0.007 A 31 GLN HE21 H 1 6.862 0.002 A 31 GLN HE22 H 1 7.538 0.013 A 31 GLN HGx H 1 2.526 0.022 A 31 GLN HGy H 1 2.542 0.016 A 31 GLN C C 13 173.792 0.000 A 31 GLN CA C 13 55.322 0.068 A 31 GLN CB C 13 32.518 0.038 A 31 GLN CG C 13 33.954 0.035 A 31 GLN N N 15 119.317 0.029 A 31 GLN NE2 N 15 110.997 0.039 A 32 ALA H H 1 9.130 0.010 A 32 ALA HA H 1 5.220 0.009 A 32 ALA HB% H 1 1.493 0.008 A 32 ALA CA C 13 49.238 0.032 A 32 ALA CB C 13 21.764 0.048 A 32 ALA N N 15 127.586 0.031 A 33 PRO HA H 1 4.887 0.004 A 33 PRO HBx H 1 1.913 0.006 A 33 PRO HBy H 1 2.634 0.003 A 33 PRO HDx H 1 3.251 0.007 A 33 PRO HDy H 1 3.988 0.018 A 33 PRO HGx H 1 2.172 0.007 A 33 PRO HGy H 1 2.288 0.011 A 33 PRO CA C 13 61.218 0.055 A 33 PRO CB C 13 30.194 0.058 A 33 PRO CD C 13 50.558 0.047 A 33 PRO CG C 13 27.493 0.038 A 34 PRO HA H 1 4.392 0.012 A 34 PRO HBx H 1 1.972 0.010 A 34 PRO HBy H 1 2.391 0.013 A 34 PRO HDx H 1 3.703 0.012 A 34 PRO HDy H 1 3.946 0.006 A 34 PRO HGx H 1 2.107 0.018 A 34 PRO HGy H 1 2.221 0.012 A 34 PRO C C 13 177.788 0.000 A 34 PRO CA C 13 64.008 0.048 A 34 PRO CB C 13 31.572 0.033 A 34 PRO CD C 13 50.254 0.034 A 34 PRO CG C 13 27.616 0.056 A 35 GLY H H 1 8.727 0.005 A 35 GLY HAx H 1 3.782 0.005 A 35 GLY HAy H 1 4.233 0.011 A 35 GLY C C 13 174.788 0.000 A 35 GLY CA C 13 45.571 0.047 A 35 GLY N N 15 111.271 0.056 A 36 VAL H H 1 7.438 0.007 A 36 VAL HA H 1 3.941 0.009 A 36 VAL HB H 1 1.986 0.009 A 36 VAL HGx% H 1 0.891 0.010 A 36 VAL HGy% H 1 0.992 0.008 A 36 VAL C C 13 176.161 0.000 A 36 VAL CA C 13 64.469 0.054 A 36 VAL CB C 13 32.542 0.076 A 36 VAL CGx C 13 21.640 0.040 A 36 VAL CGy C 13 23.011 0.046 A 36 VAL N N 15 118.654 0.052 A 37 MET H H 1 8.654 0.008 A 37 MET HA H 1 4.642 0.012 A 37 MET HBx H 1 1.645 0.011 A 37 MET HBy H 1 2.183 0.008 A 37 MET HE% H 1 1.273 0.011 A 37 MET HGx H 1 2.255 0.015 A 37 MET HGy H 1 2.519 0.008 A 37 MET C C 13 175.301 0.000 A 37 MET CA C 13 53.653 0.044 A 37 MET CB C 13 28.790 0.063 A 37 MET CE C 13 14.754 0.057 A 37 MET CG C 13 31.091 0.072 A 37 MET N N 15 118.359 0.028 A 38 THR H H 1 7.334 0.008 A 38 THR HA H 1 4.755 0.018 A 38 THR HB H 1 4.755 0.014 A 38 THR HG2% H 1 1.381 0.015 A 38 THR CA C 13 58.679 0.041 A 38 THR CB C 13 69.173 0.061 A 38 THR CG2 C 13 22.053 0.055 A 38 THR N N 15 117.290 0.049 A 39 PRO HA H 1 4.293 0.010 A 39 PRO HBx H 1 1.960 0.006 A 39 PRO HBy H 1 2.423 0.004 A 39 PRO HD2 H 1 3.934 0.008 A 39 PRO HD3 H 1 3.934 0.008 A 39 PRO HGx H 1 2.051 0.007 A 39 PRO HGy H 1 2.260 0.007 A 39 PRO C C 13 179.535 0.000 A 39 PRO CA C 13 65.355 0.047 A 39 PRO CB C 13 31.449 0.040 A 39 PRO CD C 13 50.146 0.020 A 39 PRO CG C 13 27.904 0.073 A 40 GLU H H 1 8.474 0.006 A 40 GLU HA H 1 4.063 0.004 A 40 GLU HBx H 1 1.923 0.010 A 40 GLU HBy H 1 2.130 0.006 A 40 GLU HG2 H 1 2.299 0.006 A 40 GLU HG3 H 1 2.299 0.006 A 40 GLU C C 13 178.645 0.000 A 40 GLU CA C 13 59.734 0.042 A 40 GLU CB C 13 28.940 0.056 A 40 GLU CG C 13 36.276 0.051 A 40 GLU N N 15 117.060 0.039 A 41 LEU H H 1 7.849 0.006 A 41 LEU HA H 1 4.102 0.007 A 41 LEU HBx H 1 1.625 0.009 A 41 LEU HBy H 1 1.976 0.008 A 41 LEU HDx% H 1 0.940 0.018 A 41 LEU HDy% H 1 0.961 0.010 A 41 LEU HG H 1 1.485 0.010 A 41 LEU C C 13 178.513 0.000 A 41 LEU CA C 13 57.705 0.051 A 41 LEU CB C 13 40.851 0.060 A 41 LEU CDy C 13 25.903 0.048 A 41 LEU CDx C 13 22.639 0.045 A 41 LEU CG C 13 27.058 0.056 A 41 LEU N N 15 122.347 0.046 A 42 GLN H H 1 8.632 0.005 A 42 GLN HA H 1 3.638 0.009 A 42 GLN HB2 H 1 2.078 0.006 A 42 GLN HB3 H 1 2.078 0.006 A 42 GLN HE21 H 1 6.810 0.009 A 42 GLN HE22 H 1 7.274 0.012 A 42 GLN HGx H 1 2.218 0.013 A 42 GLN HGy H 1 2.247 0.009 A 42 GLN C C 13 179.460 0.000 A 42 GLN CA C 13 60.027 0.032 A 42 GLN CB C 13 28.332 0.059 A 42 GLN CG C 13 34.113 0.043 A 42 GLN N N 15 119.091 0.046 A 42 GLN NE2 N 15 110.053 0.035 A 43 SER H H 1 8.260 0.009 A 43 SER HA H 1 4.291 0.011 A 43 SER HB2 H 1 4.029 0.008 A 43 SER HB3 H 1 4.029 0.008 A 43 SER C C 13 177.756 0.000 A 43 SER CA C 13 61.196 0.051 A 43 SER CB C 13 62.591 0.053 A 43 SER N N 15 114.301 0.037 A 44 ARG H H 1 8.034 0.008 A 44 ARG HA H 1 4.118 0.008 A 44 ARG HB2 H 1 1.967 0.007 A 44 ARG HB3 H 1 1.967 0.007 A 44 ARG HDx H 1 3.123 0.018 A 44 ARG HDy H 1 3.147 0.019 A 44 ARG HGx H 1 1.697 0.013 A 44 ARG HGy H 1 1.952 0.005 A 44 ARG C C 13 179.381 0.000 A 44 ARG CA C 13 59.003 0.075 A 44 ARG CB C 13 30.332 0.037 A 44 ARG CD C 13 43.365 0.024 A 44 ARG CG C 13 27.199 0.058 A 44 ARG N N 15 123.148 0.033 A 45 LEU H H 1 8.429 0.011 A 45 LEU HA H 1 3.864 0.011 A 45 LEU HB2 H 1 1.731 0.011 A 45 LEU HB3 H 1 1.731 0.011 A 45 LEU HDx% H 1 0.404 0.006 A 45 LEU HDy% H 1 0.626 0.007 A 45 LEU HG H 1 1.776 0.015 A 45 LEU C C 13 178.405 0.000 A 45 LEU CA C 13 57.752 0.040 A 45 LEU CB C 13 41.507 0.053 A 45 LEU CDy C 13 25.802 0.037 A 45 LEU CDx C 13 22.797 0.041 A 45 LEU CG C 13 26.335 0.051 A 45 LEU N N 15 118.344 0.033 A 46 GLY H H 1 8.197 0.003 A 46 GLY HA2 H 1 3.787 0.005 A 46 GLY HAx H 1 3.787 0.005 A 46 GLY HAy H 1 3.992 0.007 A 46 GLY C C 13 177.842 0.000 A 46 GLY CA C 13 46.958 0.044 A 46 GLY N N 15 122.888 0.031 A 47 GLY H H 1 8.222 0.011 A 47 GLY HA2 H 1 4.028 0.022 A 47 GLY HA3 H 1 4.028 0.022 A 47 GLY C C 13 174.558 0.000 A 47 GLY CA C 13 46.394 0.018 A 47 GLY N N 15 108.504 0.032 A 48 ALA H H 1 7.320 0.012 A 48 ALA HA H 1 4.947 0.005 A 48 ALA HB% H 1 1.401 0.011 A 48 ALA C C 13 177.822 0.000 A 48 ALA CA C 13 50.590 0.033 A 48 ALA CB C 13 18.793 0.029 A 48 ALA N N 15 121.588 0.040 A 49 ARG H H 1 7.214 0.009 A 49 ARG HA H 1 3.885 0.008 A 49 ARG HBx H 1 1.933 0.013 A 49 ARG HBy H 1 1.964 0.008 A 49 ARG HD2 H 1 3.309 0.010 A 49 ARG HD3 H 1 3.309 0.010 A 49 ARG HGx H 1 1.339 0.009 A 49 ARG HGy H 1 1.607 0.011 A 49 ARG C C 13 176.708 0.000 A 49 ARG CA C 13 60.563 0.050 A 49 ARG CB C 13 30.208 0.071 A 49 ARG CD C 13 43.303 0.026 A 49 ARG CG C 13 26.142 0.047 A 49 ARG N N 15 119.114 0.031 A 50 HIS H H 1 8.544 0.007 A 50 HIS HA H 1 4.317 0.012 A 50 HIS HB2 H 1 3.195 0.010 A 50 HIS HB3 H 1 3.195 0.010 A 50 HIS HD2 H 1 8.071 0.009 A 50 HIS HE1 H 1 7.225 0.009 A 50 HIS C C 13 178.416 0.000 A 50 HIS CA C 13 60.034 0.032 A 50 HIS CB C 13 29.013 0.026 A 50 HIS CD2 C 13 119.765 0.038 A 50 HIS CE1 C 13 138.017 0.051 A 50 HIS N N 15 116.856 0.049 A 51 GLU H H 1 8.244 0.011 A 51 GLU HA H 1 4.152 0.009 A 51 GLU HB2 H 1 2.167 0.003 A 51 GLU HB3 H 1 2.167 0.003 A 51 GLU HGx H 1 2.337 0.019 A 51 GLU HGy H 1 2.427 0.015 A 51 GLU CA C 13 59.451 0.039 A 51 GLU CB C 13 29.561 0.037 A 51 GLU CG C 13 37.110 0.035 A 51 GLU N N 15 120.357 0.044 A 52 LEU H H 1 8.651 0.010 A 52 LEU HA H 1 4.049 0.015 A 52 LEU HBx H 1 1.212 0.010 A 52 LEU HBy H 1 1.999 0.009 A 52 LEU HDx% H 1 0.862 0.012 A 52 LEU HDy% H 1 0.873 0.008 A 52 LEU HG H 1 1.806 0.010 A 52 LEU C C 13 178.500 0.000 A 52 LEU CA C 13 58.008 0.034 A 52 LEU CB C 13 42.131 0.044 A 52 LEU CDx C 13 23.639 0.056 A 52 LEU CDy C 13 26.736 0.036 A 52 LEU CG C 13 26.783 0.035 A 52 LEU N N 15 119.605 0.049 A 53 ILE H H 1 8.545 0.007 A 53 ILE HA H 1 3.508 0.012 A 53 ILE HB H 1 1.874 0.010 A 53 ILE HD1% H 1 0.801 0.008 A 53 ILE HG1x H 1 0.806 0.009 A 53 ILE HG1y H 1 1.889 0.007 A 53 ILE HG2% H 1 0.892 0.007 A 53 ILE C C 13 177.093 0.000 A 53 ILE CA C 13 66.058 0.028 A 53 ILE CB C 13 38.061 0.040 A 53 ILE CD1 C 13 13.628 0.041 A 53 ILE CG1 C 13 30.526 0.033 A 53 ILE CG2 C 13 16.465 0.059 A 53 ILE N N 15 118.982 0.046 A 54 ALA H H 1 7.357 0.010 A 54 ALA HA H 1 4.063 0.005 A 54 ALA HB% H 1 1.504 0.015 A 54 ALA C C 13 180.368 0.000 A 54 ALA CA C 13 54.963 0.073 A 54 ALA CB C 13 17.926 0.054 A 54 ALA N N 15 119.142 0.028 A 55 LEU H H 1 7.717 0.010 A 55 LEU HA H 1 4.144 0.015 A 55 LEU HB2 H 1 1.752 0.007 A 55 LEU HBx H 1 1.752 0.007 A 55 LEU HBy H 1 1.825 0.010 A 55 LEU HDx% H 1 0.855 0.011 A 55 LEU HDy% H 1 0.900 0.011 A 55 LEU C C 13 178.816 0.000 A 55 LEU CA C 13 57.781 0.055 A 55 LEU CB C 13 42.237 0.047 A 55 LEU CDx C 13 23.452 0.000 A 55 LEU CDy C 13 24.546 0.048 A 55 LEU N N 15 118.062 0.041 A 56 LEU H H 1 8.675 0.012 A 56 LEU HA H 1 4.031 0.010 A 56 LEU HBx H 1 1.542 0.008 A 56 LEU HBy H 1 1.906 0.013 A 56 LEU HDx% H 1 0.996 0.014 A 56 LEU HDy% H 1 0.716 0.010 A 56 LEU HG H 1 1.870 0.012 A 56 LEU C C 13 180.755 0.000 A 56 LEU CA C 13 58.111 0.067 A 56 LEU CB C 13 41.494 0.070 A 56 LEU CDy C 13 26.340 0.038 A 56 LEU CDx C 13 23.864 0.058 A 56 LEU CG C 13 27.753 0.045 A 56 LEU N N 15 118.376 0.032 A 57 ARG H H 1 8.335 0.008 A 57 ARG HA H 1 4.107 0.012 A 57 ARG HB2 H 1 1.956 0.016 A 57 ARG HB3 H 1 1.955 0.017 A 57 ARG HD2 H 1 3.181 0.006 A 57 ARG HD3 H 1 3.181 0.006 A 57 ARG HG2 H 1 1.764 0.000 A 57 ARG HGx H 1 1.764 0.000 A 57 ARG HGy H 1 1.970 0.004 A 57 ARG C C 13 178.148 0.000 A 57 ARG CA C 13 59.094 0.050 A 57 ARG CB C 13 30.288 0.031 A 57 ARG CD C 13 43.584 0.021 A 57 ARG CG C 13 28.161 0.035 A 57 ARG N N 15 117.858 0.033 A 58 GLN H H 1 7.661 0.009 A 58 GLN HA H 1 4.323 0.006 A 58 GLN HBx H 1 2.381 0.014 A 58 GLN HBy H 1 2.550 0.012 A 58 GLN HE21 H 1 6.760 0.007 A 58 GLN HE22 H 1 7.184 0.010 A 58 GLN HGx H 1 2.514 0.014 A 58 GLN HGy H 1 2.673 0.010 A 58 GLN C C 13 176.214 0.000 A 58 GLN CA C 13 56.428 0.038 A 58 GLN CB C 13 29.077 0.031 A 58 GLN CG C 13 34.176 0.033 A 58 GLN N N 15 116.341 0.043 A 58 GLN NE2 N 15 108.822 0.030 A 59 LEU H H 1 7.631 0.004 A 59 LEU HA H 1 4.045 0.008 A 59 LEU HD1% H 1 0.937 0.016 A 59 LEU C C 13 176.906 0.000 A 59 LEU CA C 13 54.213 0.086 A 59 LEU CB C 13 41.280 0.041 A 59 LEU CD1 C 13 25.979 0.065 A 59 LEU N N 15 118.795 0.035 A 60 GLN H H 1 7.534 0.013 A 60 GLN HA H 1 4.700 0.011 A 60 GLN HBx H 1 1.986 0.012 A 60 GLN HBy H 1 2.163 0.012 A 60 GLN HE21 H 1 6.977 0.012 A 60 GLN HE22 H 1 7.577 0.006 A 60 GLN HG2 H 1 2.476 0.007 A 60 GLN HG3 H 1 2.476 0.007 A 60 GLN CA C 13 53.279 0.048 A 60 GLN CB C 13 29.218 0.042 A 60 GLN CG C 13 33.290 0.034 A 60 GLN N N 15 116.771 0.025 A 60 GLN NE2 N 15 111.087 0.030 A 61 PRO HDx H 1 3.563 0.007 A 61 PRO HDy H 1 3.573 0.016 A 61 PRO HGx H 1 1.594 0.004 A 61 PRO HGy H 1 1.840 0.005 A 61 PRO CD C 13 50.075 0.051 A 61 PRO CG C 13 26.914 0.001 A 62 SER H H 1 8.567 0.000 A 62 SER HA H 1 4.414 0.004 A 62 SER HBx H 1 3.719 0.004 A 62 SER HBy H 1 3.815 0.010 A 62 SER CA C 13 57.515 0.057 A 62 SER CB C 13 63.765 0.033 A 63 SER HA H 1 4.469 0.026 A 63 SER HB2 H 1 3.936 0.005 A 63 SER HB3 H 1 3.936 0.005 A 63 SER CA C 13 58.694 0.075 A 63 SER CB C 13 63.466 0.007 A 64 GLN H H 1 8.287 0.020 A 64 GLN HA H 1 4.406 0.008 A 64 GLN HBx H 1 1.988 0.011 A 64 GLN HBy H 1 2.184 0.012 A 64 GLN HE21 H 1 6.838 0.002 A 64 GLN HE22 H 1 7.498 0.002 A 64 GLN HG2 H 1 2.375 0.007 A 64 GLN HG3 H 1 2.375 0.007 A 64 GLN C C 13 176.355 0.000 A 64 GLN CA C 13 55.850 0.061 A 64 GLN CB C 13 29.308 0.044 A 64 GLN CG C 13 33.705 0.027 A 64 GLN N N 15 120.666 0.047 A 64 GLN NE2 N 15 111.747 0.032 A 65 GLY H H 1 8.277 0.014 A 65 GLY HAx H 1 3.996 0.010 A 65 GLY HAy H 1 4.074 0.000 A 65 GLY C C 13 174.438 0.000 A 65 GLY CA C 13 45.182 0.000 A 65 GLY N N 15 108.814 0.031 A 66 GLY H H 1 8.265 0.004 A 66 GLY HAx H 1 3.973 0.014 A 66 GLY HAy H 1 4.077 0.005 A 66 GLY C C 13 174.056 0.000 A 66 GLY CA C 13 45.131 0.048 A 66 GLY N N 15 107.825 0.037 A 67 SER H H 1 8.253 0.004 A 67 SER HA H 1 4.534 0.005 A 67 SER HBx H 1 3.609 0.022 A 67 SER HBy H 1 3.765 0.004 A 67 SER C C 13 174.132 0.000 A 67 SER CA C 13 57.922 0.050 A 67 SER CB C 13 64.084 0.037 A 67 SER N N 15 115.544 0.051 A 68 LEU H H 1 8.342 0.004 A 68 LEU HA H 1 4.390 0.021 A 68 LEU HB2 H 1 1.619 0.007 A 68 LEU HB3 H 1 1.619 0.007 A 68 LEU HDx% H 1 0.868 0.013 A 68 LEU HDy% H 1 0.898 0.005 A 68 LEU HG H 1 1.898 0.000 A 68 LEU C C 13 177.083 0.000 A 68 LEU CA C 13 55.077 0.022 A 68 LEU CB C 13 42.279 0.046 A 68 LEU CDx C 13 23.613 0.030 A 68 LEU CDy C 13 24.743 0.014 A 68 LEU CG C 13 27.137 0.022 A 68 LEU N N 15 123.250 0.041 A 69 LEU H H 1 8.172 0.006 A 69 LEU HA H 1 4.402 0.004 A 69 LEU HB2 H 1 1.574 0.032 A 69 LEU HB3 H 1 1.597 0.010 A 69 LEU HDx% H 1 0.847 0.016 A 69 LEU HDy% H 1 0.865 0.002 A 69 LEU HG H 1 1.601 0.000 A 69 LEU C C 13 176.310 0.000 A 69 LEU CA C 13 54.705 0.069 A 69 LEU CB C 13 42.239 0.037 A 69 LEU CDx C 13 23.849 0.009 A 69 LEU CDy C 13 24.820 0.006 A 69 LEU CG C 13 27.126 0.056 A 69 LEU N N 15 122.236 0.045 A 70 ALA H H 1 8.155 0.006 A 70 ALA HA H 1 4.608 0.005 A 70 ALA HB% H 1 1.376 0.009 A 70 ALA CA C 13 50.200 0.035 A 70 ALA CB C 13 18.330 0.037 A 70 ALA N N 15 125.565 0.033 A 71 PRO HA H 1 4.475 0.009 A 71 PRO HBx H 1 1.941 0.010 A 71 PRO HBy H 1 2.293 0.007 A 71 PRO HDx H 1 3.662 0.011 A 71 PRO HDy H 1 3.721 0.030 A 71 PRO C C 13 176.832 0.000 A 71 PRO CA C 13 62.926 0.067 A 71 PRO CB C 13 31.828 0.068 A 71 PRO CD C 13 50.235 0.054 A 72 VAL H H 1 8.091 0.005 A 72 VAL HA H 1 4.114 0.005 A 72 VAL HB H 1 2.069 0.018 A 72 VAL HGx% H 1 0.974 0.010 A 72 VAL HGy% H 1 0.972 0.012 A 72 VAL C C 13 175.809 0.000 A 72 VAL CA C 13 61.931 0.042 A 72 VAL CB C 13 32.780 0.045 A 72 VAL CGx C 13 20.689 0.049 A 72 VAL CGy C 13 20.779 0.012 A 72 VAL N N 15 119.209 0.052 A 73 ALA H H 1 8.328 0.006 A 73 ALA HA H 1 4.390 0.006 A 73 ALA HB% H 1 1.418 0.003 A 73 ALA C C 13 177.514 0.000 A 73 ALA CA C 13 52.105 0.045 A 73 ALA CB C 13 19.269 0.067 A 73 ALA N N 15 127.159 0.078 A 74 ARG H H 1 8.391 0.003 A 74 ARG HA H 1 4.394 0.006 A 74 ARG HBx H 1 1.784 0.020 A 74 ARG HBy H 1 1.925 0.007 A 74 ARG HD2 H 1 3.222 0.013 A 74 ARG HD3 H 1 3.222 0.013 A 74 ARG HG2 H 1 1.671 0.000 A 74 ARG HG3 H 1 1.671 0.000 A 74 ARG C C 13 175.100 0.000 A 74 ARG CA C 13 55.775 0.041 A 74 ARG CB C 13 31.071 0.072 A 74 ARG CD C 13 43.250 0.000 A 74 ARG N N 15 120.088 0.043 A 75 ASN H H 1 8.052 0.009 A 75 ASN HA H 1 4.528 0.011 A 75 ASN HB2 H 1 2.809 0.020 A 75 ASN HB3 H 1 2.809 0.020 A 75 ASN HD21 H 1 6.939 0.004 A 75 ASN HD22 H 1 7.614 0.003 A 75 ASN C C 13 176.356 0.000 A 75 ASN CA C 13 54.601 0.023 A 75 ASN CB C 13 40.780 0.021 A 75 ASN CG C 13 177.100 0.008 A 75 ASN N N 15 124.928 0.037 A 75 ASN ND2 N 15 112.400 0.032 A 76 GLY H H 1 8.191 0.014 A 76 GLY HAx H 1 3.749 0.012 A 76 GLY HAy H 1 3.939 0.000 A 76 GLY C C 13 173.445 0.000 A 76 GLY CA C 13 45.375 0.047 A 76 GLY N N 15 113.019 0.044 A 77 ARG H H 1 8.130 0.005 A 77 ARG HA H 1 4.552 0.004 A 77 ARG HB2 H 1 1.835 0.008 A 77 ARG HB3 H 1 1.835 0.008 A 77 ARG HD2 H 1 3.200 0.006 A 77 ARG HD3 H 1 3.200 0.006 A 77 ARG HG2 H 1 1.624 0.009 A 77 ARG HG3 H 1 1.624 0.009 A 77 ARG C C 13 175.109 0.000 A 77 ARG CA C 13 55.590 0.038 A 77 ARG CB C 13 31.213 0.046 A 77 ARG N N 15 120.343 0.040 A 78 LEU H H 1 8.057 0.004 A 78 LEU HA H 1 4.282 0.016 A 78 LEU HB2 H 1 1.600 0.009 A 78 LEU HB3 H 1 1.600 0.009 A 78 LEU HD1% H 1 0.885 0.012 A 78 LEU HD2% H 1 0.885 0.012 A 78 LEU CA C 13 56.439 0.057 A 78 LEU CB C 13 43.715 0.049 A 78 LEU CDx C 13 23.634 0.037 A 78 LEU CDy C 13 25.401 0.017 A 78 LEU CG C 13 27.416 0.000 A 78 LEU N N 15 128.622 0.037 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 29 ARG HGy A 29 ARG HBx 1.0 1.8 3.6 2 1 A 29 ARG HGx A 29 ARG HBx 1.0 1.8 3.6 3 1 A 29 ARG HBy A 29 ARG HGy 1.0 1.8 3.6 4 1 A 29 ARG HGx A 29 ARG HBy 1.0 1.8 3.6 5 2 A 29 ARG HBy A 29 ARG H 1.0 1.9 4.1 6 2 A 29 ARG HBx A 29 ARG H 1.0 1.9 4.1 7 3 A 29 ARG HBx A 29 ARG HA 1.0 1.8 4.0 8 3 A 29 ARG HBy A 29 ARG HA 1.0 1.8 4.0 9 4 A 22 TRP HZ2 A 22 TRP HH2 1.0 1.7 3.1 10 5 A 22 TRP HZ2 A 22 TRP HE1 1.0 1.8 3.8 11 6 A 22 TRP HH2 A 22 TRP HZ3 1.0 1.5 2.7 12 7 A 22 TRP HZ3 A 22 TRP HE3 1.0 1.7 3.3 13 8 A 22 TRP HE3 A 22 TRP H 1.0 1.9 4.1 14 9 A 22 TRP HE3 A 22 TRP HBx 1.0 1.8 4.0 15 9 A 22 TRP HE3 A 22 TRP HBy 1.0 1.8 4.0 16 10 A 22 TRP HE3 A 22 TRP HA 1.0 2.0 6.0 17 11 A 22 TRP HE1 A 22 TRP HD1 1.0 1.7 3.3 18 12 A 13 HIS HE1 A 13 HIS H 1.0 1.9 6.0 19 13 A 13 HIS HE1 A 13 HIS HBy 1.0 1.9 4.5 20 13 A 13 HIS HE1 A 13 HIS HBx 1.0 1.9 4.5 21 14 A 30 PHE HA A 30 PHE H 1.0 1.9 4.3 22 15 A 30 PHE HB3 A 30 PHE HA 1.0 1.6 2.8 23 15 A 30 PHE HB2 A 30 PHE HA 1.0 1.6 2.8 24 16 A 21 LEU HA A 21 LEU H 1.0 1.8 4.2 25 17 A 20 ARG HA A 20 ARG HBx 1.0 1.8 3.4 26 17 A 20 ARG HA A 20 ARG HBy 1.0 1.8 3.4 27 18 A 48 ALA HA A 48 ALA H 1.0 1.7 3.1 28 19 A 22 TRP HBy A 22 TRP HA 1.0 1.6 3.0 29 19 A 22 TRP HBx A 22 TRP HA 1.0 1.6 3.0 30 20 A 22 TRP HA A 22 TRP HD1 1.0 2.0 5.8 31 21 A 19 VAL HA A 19 VAL H 1.0 1.8 3.6 32 22 A 33 PRO HA A 33 PRO HDx 1.0 2.0 5.4 33 23 A 33 PRO HA A 33 PRO HBx 1.0 1.7 3.1 34 23 A 33 PRO HA A 33 PRO HBy 1.0 1.7 3.1 35 24 A 33 PRO HA A 33 PRO HDy 1.0 0.0 6.0 36 25 A 33 PRO HA A 33 PRO HGx 1.0 1.8 3.8 37 25 A 33 PRO HA A 33 PRO HGy 1.0 1.8 3.8 38 26 A 34 PRO HA A 34 PRO HDy 1.0 1.9 4.3 39 27 A 34 PRO HA A 34 PRO HBx 1.0 1.7 3.1 40 27 A 34 PRO HA A 34 PRO HBy 1.0 1.7 3.1 41 28 A 34 PRO HA A 34 PRO HGx 1.0 1.9 4.5 42 28 A 34 PRO HA A 34 PRO HGy 1.0 1.9 4.5 43 29 A 50 HIS HA A 50 HIS HB2 1.0 1.6 2.8 44 29 A 50 HIS HA A 50 HIS HB3 1.0 1.6 2.8 45 30 A 50 HIS HA A 50 HIS H 1.0 1.7 3.5 46 31 A 50 HIS HB3 A 50 HIS HE1 1.0 2.0 5.2 47 31 A 50 HIS HB2 A 50 HIS HE1 1.0 2.0 5.2 48 32 A 50 HIS HB2 A 50 HIS H 1.0 1.9 3.7 49 32 A 50 HIS HB3 A 50 HIS H 1.0 1.9 3.7 50 33 A 22 TRP HBy A 22 TRP HD1 1.0 1.8 3.6 51 33 A 22 TRP HBx A 22 TRP HD1 1.0 1.8 3.6 52 34 A 26 GLU HA A 26 GLU H 1.0 1.9 4.3 53 35 A 26 GLU HA A 26 GLU HGx 1.0 1.7 3.3 54 35 A 26 GLU HA A 26 GLU HGy 1.0 1.7 3.3 55 36 A 26 GLU HA A 26 GLU HB3 1.0 1.8 3.4 56 36 A 26 GLU HA A 26 GLU HB2 1.0 1.8 3.4 57 37 A 11 LEU HA A 11 LEU HBy 1.0 1.6 2.8 58 37 A 11 LEU HA A 11 LEU HB2 1.0 1.6 2.8 59 38 A 45 LEU HA A 45 LEU H 1.0 1.8 3.4 60 39 A 45 LEU HA A 45 LEU HB2 1.0 1.6 2.8 61 39 A 45 LEU HA A 45 LEU HB3 1.0 1.6 2.8 62 40 A 36 VAL HA A 36 VAL H 1.0 1.8 3.4 63 41 A 36 VAL HA A 36 VAL HB 1.0 1.8 3.4 64 42 A 21 LEU HA A 21 LEU HG 1.0 1.8 3.4 65 43 A 21 LEU HA A 21 LEU HBx 1.0 1.5 2.7 66 43 A 21 LEU HA A 21 LEU HBy 1.0 1.5 2.7 67 44 A 21 LEU H A 21 LEU HBy 1.0 1.8 3.6 68 44 A 21 LEU H A 21 LEU HBx 1.0 1.8 3.6 69 45 A 29 ARG HBy A 29 ARG HDx 1.0 2.0 4.6 70 45 A 29 ARG HBy A 29 ARG HDy 1.0 2.0 4.6 71 45 A 29 ARG HBx A 29 ARG HDx 1.0 2.0 4.6 72 45 A 29 ARG HBx A 29 ARG HDy 1.0 2.0 4.6 73 46 A 29 ARG HGx A 29 ARG HDx 1.0 1.7 3.5 74 46 A 29 ARG HGy A 29 ARG HDy 1.0 1.7 3.5 75 46 A 29 ARG HGy A 29 ARG HDx 1.0 1.7 3.5 76 46 A 29 ARG HGx A 29 ARG HDy 1.0 1.7 3.5 77 47 A 29 ARG HA A 29 ARG HDy 1.0 1.9 5.1 78 48 A 29 ARG HA A 29 ARG HDx 1.0 1.8 3.4 79 49 A 29 ARG HGy A 29 ARG HDy 1.0 1.7 3.1 80 49 A 29 ARG HGx A 29 ARG HDy 1.0 1.7 3.1 81 50 A 29 ARG HGx A 29 ARG HDx 1.0 1.7 3.3 82 50 A 29 ARG HGy A 29 ARG HDx 1.0 1.7 3.3 83 51 A 29 ARG HBy A 29 ARG HDy 1.0 1.9 4.3 84 51 A 29 ARG HBx A 29 ARG HDy 1.0 1.9 4.3 85 52 A 29 ARG HBy A 29 ARG HDx 1.0 2.0 4.8 86 52 A 29 ARG HBx A 29 ARG HDx 1.0 2.0 4.8 87 53 A 29 ARG H A 29 ARG HDy 1.0 2.0 5.0 88 54 A 29 ARG H A 29 ARG HDx 1.0 2.0 4.8 89 55 A 29 ARG HA A 29 ARG HDy 1.0 1.9 4.3 90 55 A 29 ARG HA A 29 ARG HDx 1.0 1.9 4.3 91 56 A 29 ARG H A 29 ARG HA 1.0 2.0 5.4 92 57 A 22 TRP HZ3 A 22 TRP H 1.0 1.9 6.0 93 58 A 22 TRP HZ3 A 22 TRP HBy 1.0 2.0 5.8 94 59 A 29 ARG HGx A 29 ARG HA 1.0 1.9 4.1 95 59 A 29 ARG HGy A 29 ARG HA 1.0 1.9 4.1 96 60 A 29 ARG HGy A 29 ARG H 1.0 1.9 4.5 97 60 A 29 ARG HGx A 29 ARG H 1.0 1.9 4.5 98 61 A 33 PRO HDx A 33 PRO HDy 1.0 1.3 2.2 99 62 A 33 PRO HDx A 33 PRO HGy 1.0 1.6 3.0 100 62 A 33 PRO HDx A 33 PRO HGx 1.0 1.6 3.0 101 63 A 33 PRO HBy A 33 PRO HDy 1.0 2.0 4.6 102 63 A 33 PRO HBx A 33 PRO HDy 1.0 2.0 4.6 103 64 A 33 PRO HDx A 33 PRO HBy 1.0 2.0 5.0 104 64 A 33 PRO HDx A 33 PRO HBx 1.0 2.0 5.0 105 65 A 33 PRO HBx A 33 PRO HGy 1.0 1.6 2.8 106 65 A 33 PRO HBy A 33 PRO HGy 1.0 1.6 2.8 107 65 A 33 PRO HBx A 33 PRO HGx 1.0 1.6 2.8 108 65 A 33 PRO HBy A 33 PRO HGx 1.0 1.6 2.8 109 66 A 33 PRO HDy A 33 PRO HGx 1.0 1.5 2.5 110 66 A 33 PRO HDy A 33 PRO HGy 1.0 1.5 2.5 111 67 A 34 PRO HDy A 34 PRO HGx 1.0 1.6 3.0 112 67 A 34 PRO HDy A 34 PRO HGy 1.0 1.6 3.0 113 68 A 34 PRO HDy A 34 PRO HBx 1.0 1.7 3.1 114 68 A 34 PRO HDy A 34 PRO HBy 1.0 1.7 3.1 115 69 A 34 PRO HGy A 34 PRO HDx 1.0 1.6 2.6 116 69 A 34 PRO HGx A 34 PRO HDx 1.0 1.6 2.6 117 70 A 37 MET HA A 37 MET HBy 1.0 1.7 3.3 118 70 A 37 MET HA A 37 MET HBx 1.0 1.7 3.3 119 71 A 37 MET HA A 37 MET HGx 1.0 1.9 4.5 120 71 A 37 MET HA A 37 MET HGy 1.0 1.9 4.5 121 72 A 37 MET HA A 37 MET H 1.0 1.8 3.8 122 73 A 38 THR HB A 38 THR H 1.0 2.0 6.0 123 74 A 38 THR H A 38 THR HA 1.0 1.9 5.3 124 75 A 39 PRO HA A 39 PRO HGx 1.0 1.6 3.0 125 75 A 39 PRO HGy A 39 PRO HA 1.0 1.6 3.0 126 76 A 39 PRO HA A 39 PRO HBx 1.0 1.6 3.0 127 76 A 39 PRO HA A 39 PRO HBy 1.0 1.6 3.0 128 77 A 39 PRO HA A 39 PRO HD2 1.0 2.0 5.0 129 77 A 39 PRO HA A 39 PRO HD3 1.0 2.0 5.0 130 78 A 43 SER H A 43 SER HB3 1.0 1.6 2.8 131 78 A 43 SER HB2 A 43 SER H 1.0 1.6 2.8 132 79 A 43 SER H A 43 SER HA 1.0 1.6 3.0 133 80 A 49 ARG H A 49 ARG HD2 1.0 2.0 6.0 134 80 A 49 ARG HD3 A 49 ARG H 1.0 2.0 6.0 135 81 A 52 LEU HA A 52 LEU HBx 1.0 1.7 3.5 136 81 A 52 LEU HA A 52 LEU HBy 1.0 1.7 3.5 137 82 A 52 LEU HA A 52 LEU H 1.0 1.6 3.0 138 83 A 53 ILE H A 53 ILE HA 1.0 1.7 3.5 139 84 A 10 LEU H A 10 LEU HA 1.0 1.8 3.4 140 85 A 10 LEU HA A 10 LEU HBy 1.0 1.5 2.3 141 85 A 10 LEU HA A 10 LEU HB2 1.0 1.5 2.3 142 86 A 57 ARG HA A 57 ARG H 1.0 1.7 3.1 143 87 A 37 MET HBy A 37 MET H 1.0 1.6 3.0 144 87 A 37 MET HBx A 37 MET H 1.0 1.6 3.0 145 88 A 64 GLN HE22 A 64 GLN HBy 1.0 2.0 5.2 146 88 A 64 GLN HBx A 64 GLN HE22 1.0 2.0 5.2 147 89 A 60 GLN HA A 60 GLN HBx 1.0 1.8 3.6 148 89 A 60 GLN HBy A 60 GLN HA 1.0 1.8 3.6 149 90 A 64 GLN HE22 A 64 GLN HG2 1.0 2.0 6.0 150 90 A 64 GLN HE22 A 64 GLN HG3 1.0 2.0 6.0 151 91 A 64 GLN HG2 A 64 GLN HE21 1.0 2.0 5.6 152 91 A 64 GLN HG3 A 64 GLN HE21 1.0 2.0 5.6 153 92 A 60 GLN HBx A 60 GLN HE22 1.0 2.0 6.0 154 92 A 60 GLN HBy A 60 GLN HE22 1.0 2.0 6.0 155 93 A 51 GLU H A 51 GLU HB2 1.0 1.8 3.8 156 93 A 51 GLU HB3 A 51 GLU H 1.0 1.8 3.8 157 94 A 64 GLN HG2 A 64 GLN HA 1.0 1.9 4.1 158 94 A 64 GLN HG3 A 64 GLN HA 1.0 1.9 4.1 159 95 A 64 GLN HBx A 64 GLN HA 1.0 1.7 3.5 160 95 A 64 GLN HBy A 64 GLN HA 1.0 1.7 3.5 161 96 A 67 SER HA A 67 SER HBy 1.0 1.8 3.6 162 96 A 67 SER HA A 67 SER HBx 1.0 1.8 3.6 163 97 A 41 LEU H A 41 LEU HBx 1.0 1.7 3.5 164 97 A 41 LEU H A 41 LEU HBy 1.0 1.7 3.5 165 98 A 41 LEU HBy A 41 LEU HG 1.0 1.7 3.3 166 98 A 41 LEU HBx A 41 LEU HG 1.0 1.7 3.3 167 99 A 52 LEU HBy A 52 LEU HG 1.0 1.7 3.1 168 99 A 52 LEU HBx A 52 LEU HG 1.0 1.7 3.1 169 100 A 52 LEU HBy A 52 LEU H 1.0 1.7 3.1 170 100 A 52 LEU HBx A 52 LEU H 1.0 1.7 3.1 171 101 A 42 GLN HA A 42 GLN HGx 1.0 1.7 3.1 172 101 A 42 GLN HA A 42 GLN HGy 1.0 1.7 3.1 173 102 A 42 GLN HA A 42 GLN HB3 1.0 1.6 2.8 174 102 A 42 GLN HA A 42 GLN HB2 1.0 1.6 2.8 175 103 A 42 GLN HA A 42 GLN HE22 1.0 2.0 5.8 176 104 A 42 GLN HA A 42 GLN H 1.0 1.8 3.6 177 105 A 42 GLN HB3 A 42 GLN HE22 1.0 2.0 5.8 178 105 A 42 GLN HB2 A 42 GLN HE22 1.0 2.0 5.8 179 106 A 42 GLN HB3 A 42 GLN HE21 1.0 2.0 6.0 180 106 A 42 GLN HB2 A 42 GLN HE21 1.0 2.0 6.0 181 107 A 42 GLN HB3 A 42 GLN H 1.0 1.6 3.0 182 107 A 42 GLN HB2 A 42 GLN H 1.0 1.6 3.0 183 108 A 42 GLN HGx A 42 GLN HE21 1.0 1.9 4.5 184 108 A 42 GLN HGy A 42 GLN HE21 1.0 1.9 4.5 185 109 A 42 GLN HGx A 42 GLN HE22 1.0 2.0 5.2 186 109 A 42 GLN HGy A 42 GLN HE22 1.0 2.0 5.2 187 110 A 42 GLN HGy A 42 GLN H 1.0 2.0 6.0 188 110 A 42 GLN HGx A 42 GLN H 1.0 2.0 6.0 189 111 A 14 ALA HA A 14 ALA H 1.0 1.7 3.5 190 112 A 58 GLN HA A 58 GLN HE21 1.0 2.0 6.0 191 113 A 22 TRP HH2 A 22 TRP HBy 1.0 2.0 6.0 192 113 A 22 TRP HH2 A 22 TRP HBx 1.0 2.0 6.0 193 114 A 17 LEU HG A 17 LEU H 1.0 1.7 3.3 194 115 A 8 GLY HAy A 8 GLY H 1.0 1.8 3.6 195 116 A 8 GLY H A 8 GLY HAx 1.0 1.9 4.5 196 117 A 8 GLY HAy A 8 GLY HAx 1.0 1.5 2.5 197 118 A 54 ALA H A 54 ALA HA 1.0 1.7 3.3 198 119 A 55 LEU HA A 55 LEU H 1.0 1.7 3.1 199 120 A 12 ALA HA A 12 ALA H 1.0 1.8 3.4 200 121 A 28 LEU HA A 28 LEU H 1.0 1.8 3.6 201 122 A 28 LEU HA A 28 LEU HBy 1.0 1.7 3.3 202 122 A 28 LEU HA A 28 LEU HBx 1.0 1.7 3.3 203 123 A 13 HIS H A 13 HIS HA 1.0 1.7 3.5 204 124 A 13 HIS HA A 13 HIS HD2 1.0 1.9 6.0 205 125 A 41 LEU H A 41 LEU HA 1.0 1.8 3.8 206 126 A 40 GLU HA A 40 GLU H 1.0 1.9 4.3 207 127 A 51 GLU H A 51 GLU HA 1.0 1.8 3.4 208 128 A 49 ARG H A 49 ARG HA 1.0 1.7 3.3 209 129 A 13 HIS H A 13 HIS HBx 1.0 1.7 3.1 210 129 A 13 HIS H A 13 HIS HBy 1.0 1.7 3.1 211 130 A 13 HIS HBy A 13 HIS HA 1.0 1.7 2.9 212 130 A 13 HIS HBx A 13 HIS HA 1.0 1.7 2.9 213 131 A 16 SER H A 16 SER HB3 1.0 1.7 2.9 214 131 A 16 SER HB2 A 16 SER H 1.0 1.7 2.9 215 132 A 17 LEU HA A 17 LEU HBx 1.0 1.8 3.4 216 132 A 17 LEU HA A 17 LEU HBy 1.0 1.8 3.4 217 133 A 17 LEU HBy A 17 LEU H 1.0 1.7 3.5 218 133 A 17 LEU HBx A 17 LEU H 1.0 1.7 3.5 219 134 A 40 GLU HA A 40 GLU HG2 1.0 1.8 3.4 220 134 A 40 GLU HA A 40 GLU HG3 1.0 1.8 3.4 221 135 A 40 GLU HA A 40 GLU HBy 1.0 1.6 2.8 222 135 A 40 GLU HA A 40 GLU HBx 1.0 1.6 2.8 223 136 A 41 LEU HBy A 41 LEU HA 1.0 1.6 2.8 224 136 A 41 LEU HBx A 41 LEU HA 1.0 1.6 2.8 225 137 A 41 LEU HG A 41 LEU HA 1.0 1.5 2.5 226 138 A 44 ARG HA A 44 ARG HB2 1.0 1.5 2.5 227 138 A 44 ARG HB3 A 44 ARG HA 1.0 1.5 2.5 228 139 A 49 ARG HD3 A 49 ARG HA 1.0 2.0 6.0 229 139 A 49 ARG HD2 A 49 ARG HA 1.0 2.0 6.0 230 140 A 49 ARG HA A 49 ARG HBx 1.0 1.5 2.7 231 140 A 49 ARG HA A 49 ARG HBy 1.0 1.5 2.7 232 141 A 49 ARG HA A 49 ARG HGy 1.0 1.8 4.2 233 141 A 49 ARG HA A 49 ARG HGx 1.0 1.8 4.2 234 142 A 53 ILE HA A 53 ILE HB 1.0 1.8 4.0 235 143 A 53 ILE H A 53 ILE HB 1.0 1.7 2.9 236 144 A 51 GLU HA A 51 GLU HGx 1.0 1.7 3.3 237 144 A 51 GLU HA A 51 GLU HGy 1.0 1.7 3.3 238 145 A 51 GLU HB3 A 51 GLU HA 1.0 1.6 2.8 239 145 A 51 GLU HB2 A 51 GLU HA 1.0 1.6 2.8 240 146 A 10 LEU H A 10 LEU HB2 1.0 1.6 2.8 241 146 A 10 LEU H A 10 LEU HBy 1.0 1.6 2.8 242 147 A 58 GLN H A 58 GLN HBx 1.0 1.7 3.3 243 147 A 58 GLN HBy A 58 GLN H 1.0 1.7 3.3 244 148 A 58 GLN HE21 A 58 GLN HBx 1.0 2.0 6.0 245 148 A 58 GLN HE21 A 58 GLN HBy 1.0 2.0 6.0 246 149 A 58 GLN HBx A 58 GLN HE22 1.0 1.9 6.0 247 149 A 58 GLN HBy A 58 GLN HE22 1.0 1.9 6.0 248 150 A 75 ASN HA A 75 ASN HB2 1.0 1.8 3.6 249 150 A 75 ASN HB3 A 75 ASN HA 1.0 1.8 3.6 250 151 A 75 ASN HB3 A 75 ASN H 1.0 2.0 4.6 251 151 A 75 ASN HB2 A 75 ASN H 1.0 2.0 4.6 252 152 A 70 ALA H A 70 ALA HA 1.0 1.9 4.3 253 153 A 41 LEU H A 41 LEU HG 1.0 2.0 6.0 254 154 A 17 LEU HA A 17 LEU HG 1.0 1.8 4.0 255 155 A 19 VAL H A 19 VAL HB 1.0 1.7 3.1 256 156 A 19 VAL HA A 19 VAL HB 1.0 1.8 3.6 257 157 A 20 ARG HA A 20 ARG H 1.0 2.0 5.2 258 158 A 21 LEU H A 21 LEU HG 1.0 0.0 6.0 259 159 A 44 ARG HA A 44 ARG HGy 1.0 1.6 3.0 260 159 A 44 ARG HA A 44 ARG HGx 1.0 1.6 3.0 261 160 A 56 LEU HA A 56 LEU HBy 1.0 1.6 3.0 262 160 A 56 LEU HBx A 56 LEU HA 1.0 1.6 3.0 263 161 A 23 VAL HA A 23 VAL HB 1.0 1.7 3.3 264 162 A 23 VAL HB A 23 VAL H 1.0 1.7 3.3 265 163 A 24 GLU HA A 24 GLU H 1.0 1.9 4.5 266 164 A 24 GLU HA A 24 GLU HGx 1.0 1.8 3.8 267 164 A 24 GLU HA A 24 GLU HGy 1.0 1.8 3.8 268 165 A 24 GLU H A 24 GLU HGy 1.0 2.0 6.0 269 165 A 24 GLU H A 24 GLU HGx 1.0 2.0 6.0 270 166 A 24 GLU H A 24 GLU HBx 1.0 1.7 3.3 271 166 A 24 GLU H A 24 GLU HBy 1.0 1.7 3.3 272 167 A 24 GLU HA A 24 GLU HBy 1.0 1.7 3.3 273 167 A 24 GLU HA A 24 GLU HBx 1.0 1.7 3.3 274 168 A 26 GLU H A 26 GLU HB2 1.0 1.9 4.7 275 168 A 26 GLU H A 26 GLU HB3 1.0 1.9 4.7 276 169 A 26 GLU H A 26 GLU HGy 1.0 2.0 5.6 277 169 A 26 GLU H A 26 GLU HGx 1.0 2.0 5.6 278 170 A 27 ARG HA A 27 ARG H 1.0 1.8 3.8 279 171 A 27 ARG HA A 27 ARG HD2 1.0 1.9 3.9 280 171 A 27 ARG HA A 27 ARG HD3 1.0 1.9 3.9 281 172 A 27 ARG HA A 27 ARG HBy 1.0 1.8 3.6 282 172 A 27 ARG HA A 27 ARG HBx 1.0 1.8 3.6 283 173 A 27 ARG H A 27 ARG HBx 1.0 1.9 3.9 284 173 A 27 ARG H A 27 ARG HBy 1.0 1.9 3.9 285 174 A 27 ARG HD3 A 27 ARG HBy 1.0 1.9 4.3 286 174 A 27 ARG HD2 A 27 ARG HBy 1.0 1.9 4.3 287 174 A 27 ARG HD2 A 27 ARG HBx 1.0 1.9 4.3 288 174 A 27 ARG HD3 A 27 ARG HBx 1.0 1.9 4.3 289 175 A 27 ARG H A 27 ARG HG3 1.0 1.9 4.3 290 175 A 27 ARG H A 27 ARG HG2 1.0 1.9 4.3 291 176 A 28 LEU H A 28 LEU HBx 1.0 1.8 3.6 292 176 A 28 LEU H A 28 LEU HBy 1.0 1.8 3.6 293 177 A 28 LEU H A 28 LEU HG 1.0 2.0 6.0 294 178 A 28 LEU HA A 28 LEU HG 1.0 1.9 3.9 295 179 A 53 ILE H A 53 ILE HG1y 1.0 1.8 3.4 296 180 A 53 ILE H A 53 ILE HG1x 1.0 2.0 4.8 297 181 A 53 ILE HA A 53 ILE HG1y 1.0 1.8 4.0 298 182 A 53 ILE HG1x A 53 ILE HG1y 1.0 1.5 2.3 299 183 A 49 ARG HBx A 49 ARG HGx 1.0 1.7 3.1 300 183 A 49 ARG HBy A 49 ARG HGy 1.0 1.7 3.1 301 183 A 49 ARG HBy A 49 ARG HGx 1.0 1.7 3.1 302 183 A 49 ARG HBx A 49 ARG HGy 1.0 1.7 3.1 303 184 A 57 ARG HA A 57 ARG HGx 1.0 1.7 3.3 304 184 A 57 ARG HA A 57 ARG HGy 1.0 1.7 3.3 305 185 A 57 ARG HGy A 57 ARG HD3 1.0 1.7 3.1 306 185 A 57 ARG HGx A 57 ARG HD2 1.0 1.7 3.1 307 185 A 57 ARG HGx A 57 ARG HD3 1.0 1.7 3.1 308 185 A 57 ARG HGy A 57 ARG HD2 1.0 1.7 3.1 309 186 A 57 ARG H A 57 ARG HGx 1.0 1.9 4.9 310 186 A 57 ARG H A 57 ARG HGy 1.0 1.9 4.9 311 187 A 20 ARG H A 20 ARG HGx 1.0 1.9 4.5 312 187 A 20 ARG H A 20 ARG HGy 1.0 1.9 4.5 313 188 A 20 ARG HA A 20 ARG HGy 1.0 1.9 4.3 314 188 A 20 ARG HA A 20 ARG HGx 1.0 1.9 4.3 315 189 A 20 ARG HGy A 20 ARG HD3 1.0 1.7 3.3 316 189 A 20 ARG HGx A 20 ARG HD2 1.0 1.7 3.3 317 189 A 20 ARG HGy A 20 ARG HD2 1.0 1.7 3.3 318 189 A 20 ARG HGx A 20 ARG HD3 1.0 1.7 3.3 319 190 A 44 ARG HGy A 44 ARG H 1.0 1.7 3.3 320 190 A 44 ARG HGx A 44 ARG H 1.0 1.7 3.3 321 191 A 44 ARG HGx A 44 ARG HDy 1.0 1.6 3.0 322 191 A 44 ARG HGy A 44 ARG HDy 1.0 1.6 3.0 323 191 A 44 ARG HGx A 44 ARG HDx 1.0 1.6 3.0 324 191 A 44 ARG HGy A 44 ARG HDx 1.0 1.6 3.0 325 192 A 72 VAL HB A 72 VAL H 1.0 1.9 4.1 326 193 A 72 VAL HB A 72 VAL HA 1.0 1.8 4.0 327 194 A 37 MET HBx A 37 MET HGx 1.0 1.8 3.6 328 194 A 37 MET HBx A 37 MET HGy 1.0 1.8 3.6 329 194 A 37 MET HBy A 37 MET HGy 1.0 1.8 3.6 330 194 A 37 MET HBy A 37 MET HGx 1.0 1.8 3.6 331 195 A 37 MET HGy A 37 MET H 1.0 2.0 6.0 332 195 A 37 MET HGx A 37 MET H 1.0 2.0 6.0 333 196 A 58 GLN HE21 A 58 GLN HGy 1.0 1.9 4.3 334 196 A 58 GLN HE21 A 58 GLN HGx 1.0 1.9 4.3 335 197 A 58 GLN H A 58 GLN HGy 1.0 1.8 3.8 336 197 A 58 GLN H A 58 GLN HGx 1.0 1.8 3.8 337 198 A 58 GLN HE22 A 58 GLN HGy 1.0 2.0 6.0 338 198 A 58 GLN HE22 A 58 GLN HGx 1.0 2.0 6.0 339 199 A 58 GLN HA A 58 GLN HGx 1.0 1.9 4.3 340 199 A 58 GLN HA A 58 GLN HGy 1.0 1.9 4.3 341 200 A 20 ARG HBy A 20 ARG H 1.0 1.8 3.6 342 200 A 20 ARG HBx A 20 ARG H 1.0 1.8 3.6 343 201 A 20 ARG HBy A 20 ARG HD3 1.0 1.8 3.4 344 201 A 20 ARG HBy A 20 ARG HD2 1.0 1.8 3.4 345 201 A 20 ARG HBx A 20 ARG HD3 1.0 1.8 3.4 346 201 A 20 ARG HBx A 20 ARG HD2 1.0 1.8 3.4 347 202 A 20 ARG H A 20 ARG HD3 1.0 2.0 6.0 348 202 A 20 ARG H A 20 ARG HD2 1.0 2.0 6.0 349 203 A 20 ARG HA A 20 ARG HD2 1.0 1.9 6.0 350 203 A 20 ARG HA A 20 ARG HD3 1.0 1.9 6.0 351 204 A 2 PRO HDx A 2 PRO HBy 1.0 1.8 3.8 352 204 A 2 PRO HDx A 2 PRO HBx 1.0 1.8 3.8 353 205 A 2 PRO HBx A 2 PRO HDy 1.0 1.8 3.8 354 205 A 2 PRO HBy A 2 PRO HDy 1.0 1.8 3.8 355 206 A 66 GLY HAy A 66 GLY H 1.0 2.0 6.0 356 207 A 66 GLY H A 66 GLY HAx 1.0 2.0 5.0 357 208 A 62 SER HA A 62 SER HBx 1.0 1.9 3.9 358 208 A 62 SER HBy A 62 SER HA 1.0 1.9 3.9 359 209 A 6 SER HA A 6 SER HBx 1.0 1.7 3.1 360 209 A 6 SER HBy A 6 SER HA 1.0 1.7 3.1 361 210 A 11 LEU HA A 11 LEU H 1.0 1.7 3.3 362 211 A 11 LEU HA A 11 LEU HG 1.0 1.9 4.3 363 212 A 11 LEU H A 11 LEU HG 1.0 2.0 4.8 364 213 A 45 LEU H A 45 LEU HG 1.0 1.7 3.1 365 214 A 56 LEU HA A 56 LEU HG 1.0 1.9 4.1 366 215 A 56 LEU H A 56 LEU HG 1.0 1.8 3.6 367 216 A 56 LEU HBx A 56 LEU HG 1.0 1.6 2.6 368 216 A 56 LEU HBy A 56 LEU HG 1.0 1.6 2.6 369 217 A 56 LEU HBx A 56 LEU H 1.0 1.7 3.3 370 217 A 56 LEU HBy A 56 LEU H 1.0 1.7 3.3 371 218 A 55 LEU HA A 55 LEU HBy 1.0 1.4 2.4 372 218 A 55 LEU HA A 55 LEU HBx 1.0 1.4 2.4 373 219 A 45 LEU HA A 45 LEU HG 1.0 1.8 3.6 374 220 A 18 GLY HAx A 18 GLY H 1.0 1.6 3.0 375 221 A 18 GLY H A 18 GLY HAy 1.0 1.7 3.5 376 222 A 18 GLY HAx A 18 GLY HAy 1.0 1.4 2.2 377 223 A 31 GLN H A 31 GLN HB2 1.0 1.7 3.3 378 223 A 31 GLN HB3 A 31 GLN H 1.0 1.7 3.3 379 224 A 31 GLN HB3 A 31 GLN HA 1.0 1.7 3.3 380 224 A 31 GLN HB2 A 31 GLN HA 1.0 1.7 3.3 381 225 A 31 GLN HB2 A 31 GLN HGy 1.0 1.7 3.1 382 225 A 31 GLN HB3 A 31 GLN HGy 1.0 1.7 3.1 383 225 A 31 GLN HB2 A 31 GLN HGx 1.0 1.7 3.1 384 225 A 31 GLN HB3 A 31 GLN HGx 1.0 1.7 3.1 385 226 A 31 GLN HGy A 31 GLN HE22 1.0 2.0 5.6 386 226 A 31 GLN HGx A 31 GLN HE22 1.0 2.0 5.6 387 227 A 31 GLN H A 31 GLN HGy 1.0 2.0 6.0 388 227 A 31 GLN H A 31 GLN HGx 1.0 2.0 6.0 389 228 A 31 GLN HA A 31 GLN HGx 1.0 1.9 4.3 390 228 A 31 GLN HA A 31 GLN HGy 1.0 1.9 4.3 391 229 A 17 LEU HA A 17 LEU H 1.0 1.8 3.4 392 230 A 45 LEU H A 45 LEU HB3 1.0 1.8 3.8 393 230 A 45 LEU H A 45 LEU HB2 1.0 1.8 3.8 394 231 A 13 HIS HE1 A 13 HIS HD2 1.0 1.9 6.0 395 232 A 22 TRP HZ2 A 22 TRP HZ3 1.0 2.0 6.0 396 233 A 57 ARG H A 57 ARG HB3 1.0 1.6 2.6 397 233 A 57 ARG H A 57 ARG HB2 1.0 1.6 2.6 398 234 A 44 ARG HB3 A 44 ARG H 1.0 1.7 3.3 399 234 A 44 ARG HB2 A 44 ARG H 1.0 1.7 3.3 400 235 A 49 ARG HD3 A 49 ARG HBy 1.0 1.6 3.0 401 235 A 49 ARG HD3 A 49 ARG HBx 1.0 1.6 3.0 402 235 A 49 ARG HD2 A 49 ARG HBx 1.0 1.6 3.0 403 235 A 49 ARG HD2 A 49 ARG HBy 1.0 1.6 3.0 404 236 A 49 ARG HD3 A 49 ARG HGy 1.0 1.6 2.8 405 236 A 49 ARG HD2 A 49 ARG HGx 1.0 1.6 2.8 406 236 A 49 ARG HD3 A 49 ARG HGx 1.0 1.6 2.8 407 236 A 49 ARG HD2 A 49 ARG HGy 1.0 1.6 2.8 408 237 A 57 ARG HD3 A 57 ARG HB2 1.0 1.6 2.8 409 237 A 57 ARG HD2 A 57 ARG HB2 1.0 1.6 2.8 410 237 A 57 ARG HD2 A 57 ARG HB3 1.0 1.6 2.8 411 237 A 57 ARG HD3 A 57 ARG HB3 1.0 1.6 2.8 412 238 A 49 ARG H A 49 ARG HGy 1.0 1.7 3.1 413 238 A 49 ARG H A 49 ARG HGx 1.0 1.7 3.1 414 239 A 50 HIS H A 50 HIS HE1 1.0 1.9 6.0 415 240 A 52 LEU H A 52 LEU HG 1.0 1.8 3.4 416 241 A 52 LEU HA A 52 LEU HG 1.0 1.8 3.8 417 242 A 58 GLN HA A 58 GLN H 1.0 1.7 3.3 418 243 A 58 GLN HA A 58 GLN HBy 1.0 1.7 2.9 419 243 A 58 GLN HA A 58 GLN HBx 1.0 1.7 2.9 420 244 A 76 GLY HAy A 76 GLY H 1.0 2.0 6.0 421 245 A 76 GLY H A 76 GLY HAx 1.0 2.0 6.0 422 246 A 46 GLY HAy A 46 GLY H 1.0 2.0 5.0 423 247 A 46 GLY H A 46 GLY HAx 1.0 1.9 4.7 424 248 A 4 GLY H A 4 GLY HA3 1.0 2.0 6.0 425 248 A 4 GLY HA2 A 4 GLY H 1.0 2.0 6.0 426 249 A 69 LEU HA A 69 LEU H 1.0 1.8 3.6 427 250 A 77 ARG HA A 77 ARG HD2 1.0 0.7 6.0 428 250 A 77 ARG HA A 77 ARG HD3 1.0 0.7 6.0 429 251 A 77 ARG HA A 77 ARG H 1.0 1.9 4.1 430 252 A 75 ASN HA A 75 ASN H 1.0 2.0 5.8 431 253 A 77 ARG HA A 77 ARG HB3 1.0 2.0 4.8 432 253 A 77 ARG HA A 77 ARG HB2 1.0 2.0 4.8 433 254 A 77 ARG HA A 77 ARG HG2 1.0 2.0 5.4 434 254 A 77 ARG HA A 77 ARG HG3 1.0 2.0 5.4 435 255 A 73 ALA HA A 73 ALA H 1.0 2.0 5.6 436 256 A 63 SER HA A 63 SER HB2 1.0 1.9 4.3 437 256 A 63 SER HB3 A 63 SER HA 1.0 1.9 4.3 438 257 A 27 ARG HA A 27 ARG HG2 1.0 2.0 4.8 439 257 A 27 ARG HA A 27 ARG HG3 1.0 2.0 4.8 440 258 A 27 ARG HD3 A 27 ARG HG3 1.0 1.8 3.6 441 258 A 27 ARG HD3 A 27 ARG HG2 1.0 1.8 3.6 442 258 A 27 ARG HD2 A 27 ARG HG2 1.0 1.8 3.6 443 258 A 27 ARG HD2 A 27 ARG HG3 1.0 1.8 3.6 444 259 A 49 ARG H A 49 ARG HBx 1.0 1.9 4.5 445 259 A 49 ARG H A 49 ARG HBy 1.0 1.9 4.5 446 260 A 47 GLY HA3 A 47 GLY H 1.0 1.9 4.7 447 261 A 47 GLY H A 47 GLY HA2 1.0 1.8 3.8 448 262 A 61 PRO HDy A 61 PRO HGx 1.0 1.9 4.5 449 262 A 61 PRO HDy A 61 PRO HGy 1.0 1.9 4.5 450 263 A 60 GLN HA A 60 GLN HE21 1.0 1.8 6.0 451 264 A 24 GLU HGy A 24 GLU HBy 1.0 1.8 3.6 452 264 A 24 GLU HGy A 24 GLU HBx 1.0 1.8 3.6 453 264 A 24 GLU HGx A 24 GLU HBx 1.0 1.8 3.6 454 264 A 24 GLU HGx A 24 GLU HBy 1.0 1.8 3.6 455 265 A 40 GLU H A 40 GLU HG3 1.0 1.9 6.0 456 265 A 40 GLU H A 40 GLU HG2 1.0 1.9 6.0 457 266 A 60 GLN HA A 60 GLN HG3 1.0 1.9 4.5 458 266 A 60 GLN HA A 60 GLN HG2 1.0 1.9 4.5 459 267 A 60 GLN HBx A 60 GLN HG2 1.0 1.9 4.1 460 267 A 60 GLN HBy A 60 GLN HG3 1.0 1.9 4.1 461 267 A 60 GLN HBx A 60 GLN HG3 1.0 1.9 4.1 462 267 A 60 GLN HBy A 60 GLN HG2 1.0 1.9 4.1 463 268 A 60 GLN HE22 A 60 GLN HG2 1.0 2.0 6.0 464 268 A 60 GLN HE22 A 60 GLN HG3 1.0 2.0 6.0 465 269 A 60 GLN HE21 A 60 GLN HG2 1.0 1.9 4.3 466 269 A 60 GLN HE21 A 60 GLN HG3 1.0 1.9 4.3 467 270 A 57 ARG HA A 57 ARG HD3 1.0 1.9 5.1 468 270 A 57 ARG HA A 57 ARG HD2 1.0 1.9 5.1 469 271 A 44 ARG HA A 44 ARG HDy 1.0 2.0 5.0 470 272 A 44 ARG H A 44 ARG HDy 1.0 1.9 6.0 471 273 A 44 ARG H A 44 ARG HDx 1.0 1.9 6.0 472 274 A 27 ARG H A 27 ARG HD2 1.0 2.0 6.0 473 274 A 27 ARG H A 27 ARG HD3 1.0 2.0 6.0 474 275 A 57 ARG H A 57 ARG HD3 1.0 1.9 6.0 475 275 A 57 ARG H A 57 ARG HD2 1.0 1.9 6.0 476 276 A 44 ARG HB2 A 44 ARG HDy 1.0 1.8 3.6 477 276 A 44 ARG HB3 A 44 ARG HDy 1.0 1.8 3.6 478 277 A 44 ARG HGy A 44 ARG HDy 1.0 1.9 4.1 479 277 A 44 ARG HGx A 44 ARG HDy 1.0 1.9 4.1 480 278 A 55 LEU H A 55 LEU HBy 1.0 1.9 3.9 481 278 A 55 LEU H A 55 LEU HBx 1.0 1.9 3.9 482 279 A 78 LEU H A 78 LEU HB3 1.0 2.0 5.0 483 279 A 78 LEU HB2 A 78 LEU H 1.0 2.0 5.0 484 280 A 78 LEU HB2 A 78 LEU HA 1.0 1.9 4.3 485 280 A 78 LEU HB3 A 78 LEU HA 1.0 1.9 4.3 486 281 A 16 SER HB3 A 16 SER HA 1.0 1.7 3.3 487 281 A 16 SER HB2 A 16 SER HA 1.0 1.7 3.3 488 282 A 16 SER H A 16 SER HA 1.0 1.9 3.9 489 283 A 9 ALA HA A 9 ALA H 1.0 1.9 4.5 490 284 A 10 LEU H A 10 LEU HG 1.0 1.9 6.0 491 285 A 10 LEU HA A 10 LEU HG 1.0 2.0 5.4 492 286 A 11 LEU HBy A 11 LEU H 1.0 1.8 4.0 493 286 A 11 LEU HB2 A 11 LEU H 1.0 1.8 4.0 494 287 A 15 ALA HA A 15 ALA H 1.0 1.9 4.5 495 288 A 20 ARG HGy A 20 ARG HD3 1.0 1.7 3.5 496 288 A 20 ARG HGx A 20 ARG HD2 1.0 1.7 3.5 497 288 A 20 ARG HGy A 20 ARG HD2 1.0 1.7 3.5 498 288 A 20 ARG HGx A 20 ARG HD3 1.0 1.7 3.5 499 289 A 22 TRP HH2 A 22 TRP HE1 1.0 1.3 6.0 500 290 A 28 LEU HBy A 28 LEU HG 1.0 1.8 4.2 501 290 A 28 LEU HBx A 28 LEU HG 1.0 1.8 4.2 502 291 A 31 GLN H A 31 GLN HA 1.0 1.9 6.0 503 292 A 31 GLN HB3 A 31 GLN HE22 1.0 0.7 6.0 504 292 A 31 GLN HB2 A 31 GLN HE22 1.0 0.7 6.0 505 293 A 32 ALA H A 32 ALA HA 1.0 2.0 6.0 506 294 A 33 PRO HBx A 33 PRO HGy 1.0 1.8 4.0 507 294 A 33 PRO HBy A 33 PRO HGy 1.0 1.8 4.0 508 294 A 33 PRO HBx A 33 PRO HGx 1.0 1.8 4.0 509 294 A 33 PRO HBy A 33 PRO HGx 1.0 1.8 4.0 510 295 A 34 PRO HDy A 34 PRO HDx 1.0 1.6 2.6 511 296 A 34 PRO HBx A 34 PRO HDx 1.0 2.0 5.6 512 296 A 34 PRO HBy A 34 PRO HDx 1.0 2.0 5.6 513 297 A 35 GLY HAy A 35 GLY HAx 1.0 1.6 2.8 514 298 A 36 VAL H A 36 VAL HB 1.0 2.0 4.8 515 299 A 37 MET HBx A 37 MET HGx 1.0 1.9 4.1 516 299 A 37 MET HBx A 37 MET HGy 1.0 1.9 4.1 517 299 A 37 MET HBy A 37 MET HGy 1.0 1.9 4.1 518 299 A 37 MET HBy A 37 MET HGx 1.0 1.9 4.1 519 300 A 40 GLU HG3 A 40 GLU HBy 1.0 1.6 2.8 520 300 A 40 GLU HG3 A 40 GLU HBx 1.0 1.6 2.8 521 300 A 40 GLU HG2 A 40 GLU HBx 1.0 1.6 2.8 522 300 A 40 GLU HG2 A 40 GLU HBy 1.0 1.6 2.8 523 301 A 40 GLU H A 40 GLU HBx 1.0 2.0 5.0 524 301 A 40 GLU H A 40 GLU HBy 1.0 2.0 5.0 525 302 A 44 ARG HA A 44 ARG H 1.0 1.9 4.3 526 303 A 43 SER HB3 A 43 SER HA 1.0 1.7 3.3 527 303 A 43 SER HB2 A 43 SER HA 1.0 1.7 3.3 528 304 A 44 ARG HA A 44 ARG HDx 1.0 1.9 5.3 529 304 A 44 ARG HA A 44 ARG HDy 1.0 1.9 5.3 530 305 A 10 LEU HB2 A 10 LEU HG 1.0 1.7 3.5 531 305 A 10 LEU HBy A 10 LEU HG 1.0 1.7 3.5 532 306 A 46 GLY HAy A 46 GLY HAx 1.0 1.7 3.1 533 307 A 47 GLY HA3 A 47 GLY HA2 1.0 1.7 2.9 534 308 A 49 ARG HD3 A 49 ARG HBy 1.0 1.9 4.3 535 308 A 49 ARG HD3 A 49 ARG HBx 1.0 1.9 4.3 536 308 A 49 ARG HD2 A 49 ARG HBx 1.0 1.9 4.3 537 308 A 49 ARG HD2 A 49 ARG HBy 1.0 1.9 4.3 538 309 A 49 ARG HBx A 49 ARG HGx 1.0 1.9 4.1 539 309 A 49 ARG HBy A 49 ARG HGy 1.0 1.9 4.1 540 309 A 49 ARG HBy A 49 ARG HGx 1.0 1.9 4.1 541 309 A 49 ARG HBx A 49 ARG HGy 1.0 1.9 4.1 542 310 A 64 GLN HBy A 64 GLN HG3 1.0 1.7 3.3 543 310 A 64 GLN HBy A 64 GLN HG2 1.0 1.7 3.3 544 310 A 64 GLN HBx A 64 GLN HG2 1.0 1.7 3.3 545 310 A 64 GLN HBx A 64 GLN HG3 1.0 1.7 3.3 546 311 A 51 GLU H A 51 GLU HGy 1.0 2.0 6.0 547 311 A 51 GLU H A 51 GLU HGx 1.0 2.0 6.0 548 312 A 51 GLU HB2 A 51 GLU HGy 1.0 1.9 4.1 549 312 A 51 GLU HB2 A 51 GLU HGx 1.0 1.9 4.1 550 312 A 51 GLU HB3 A 51 GLU HGy 1.0 1.9 4.1 551 312 A 51 GLU HB3 A 51 GLU HGx 1.0 1.9 4.1 552 313 A 53 ILE HA A 53 ILE HG1x 1.0 1.9 4.7 553 314 A 56 LEU HA A 56 LEU H 1.0 1.9 4.1 554 315 A 60 GLN HBy A 60 GLN H 1.0 2.0 5.4 555 315 A 60 GLN HBx A 60 GLN H 1.0 2.0 5.4 556 316 A 74 ARG HA A 74 ARG HD3 1.0 1.8 6.0 557 316 A 74 ARG HA A 74 ARG HD2 1.0 1.8 6.0 558 317 A 71 PRO HBx A 71 PRO HDy 1.0 2.0 6.0 559 317 A 71 PRO HBy A 71 PRO HDy 1.0 2.0 6.0 560 317 A 71 PRO HDx A 71 PRO HBy 1.0 2.0 6.0 561 317 A 71 PRO HBx A 71 PRO HDx 1.0 2.0 6.0 562 318 A 68 LEU HA A 68 LEU HB3 1.0 1.8 3.8 563 318 A 68 LEU HA A 68 LEU HB2 1.0 1.8 3.8 564 319 A 69 LEU H A 69 LEU HB2 1.0 2.0 5.2 565 319 A 69 LEU H A 69 LEU HB3 1.0 2.0 5.2 566 320 A 71 PRO HDy A 71 PRO HA 1.0 2.0 6.0 567 321 A 71 PRO HBx A 71 PRO HA 1.0 1.8 3.4 568 321 A 71 PRO HBy A 71 PRO HA 1.0 1.8 3.4 569 322 A 74 ARG HA A 74 ARG HBy 1.0 1.9 4.3 570 322 A 74 ARG HA A 74 ARG HBx 1.0 1.9 4.3 571 323 A 74 ARG HD3 A 74 ARG HBx 1.0 2.0 5.8 572 323 A 74 ARG HD3 A 74 ARG HBy 1.0 2.0 5.8 573 323 A 74 ARG HD2 A 74 ARG HBx 1.0 2.0 5.8 574 323 A 74 ARG HD2 A 74 ARG HBy 1.0 2.0 5.8 575 324 A 22 TRP HE3 A 21 LEU HA 1.0 1.8 4.0 576 325 A 22 TRP HE3 A 21 LEU H 1.0 2.0 5.6 577 326 A 22 TRP HE3 A 21 LEU HBx 1.0 2.0 6.0 578 326 A 22 TRP HE3 A 21 LEU HBy 1.0 2.0 6.0 579 327 A 22 TRP HZ3 A 21 LEU HA 1.0 2.0 5.6 580 328 A 50 HIS HE1 A 49 ARG HGx 1.0 1.9 6.0 581 329 A 20 ARG HA A 19 VAL HB 1.0 0.0 6.0 582 330 A 48 ALA HA A 47 GLY HA3 1.0 1.9 4.9 583 331 A 22 TRP HA A 21 LEU HA 1.0 2.0 6.0 584 332 A 32 ALA HA A 31 GLN HB3 1.0 0.0 6.0 585 333 A 50 HIS HA A 49 ARG HGx 1.0 2.0 5.0 586 333 A 50 HIS HA A 49 ARG HGy 1.0 2.0 5.0 587 334 A 9 ALA HA A 8 GLY HAy 1.0 1.9 4.9 588 335 A 9 ALA HA A 8 GLY HAx 1.0 2.0 5.6 589 336 A 21 LEU HG A 20 ARG H 1.0 2.0 5.0 590 337 A 29 ARG HGy A 28 LEU HA 1.0 2.0 6.0 591 337 A 29 ARG HGx A 28 LEU HA 1.0 2.0 6.0 592 338 A 32 ALA HA A 33 PRO HDx 1.0 1.8 3.6 593 339 A 33 PRO HA A 34 PRO HGx 1.0 2.0 6.0 594 339 A 33 PRO HA A 34 PRO HGy 1.0 2.0 6.0 595 340 A 32 ALA HA A 33 PRO HGx 1.0 2.0 6.0 596 340 A 32 ALA HA A 33 PRO HGy 1.0 2.0 6.0 597 341 A 33 PRO HBx A 34 PRO HDx 1.0 1.8 3.6 598 341 A 33 PRO HBy A 34 PRO HDx 1.0 1.8 3.6 599 342 A 33 PRO HA A 34 PRO HDy 1.0 1.6 3.0 600 343 A 33 PRO HA A 34 PRO HDx 1.0 1.6 2.8 601 344 A 37 MET HBy A 38 THR HA 1.0 0.0 6.0 602 345 A 38 THR HA A 39 PRO HGx 1.0 2.0 6.0 603 345 A 38 THR HA A 39 PRO HGy 1.0 2.0 6.0 604 346 A 38 THR HB A 39 PRO HGy 1.0 2.0 6.0 605 346 A 38 THR HB A 39 PRO HGx 1.0 2.0 6.0 606 347 A 38 THR HB A 39 PRO HBy 1.0 2.0 6.0 607 347 A 38 THR HB A 39 PRO HBx 1.0 2.0 6.0 608 348 A 38 THR H A 39 PRO HD2 1.0 1.9 6.0 609 348 A 38 THR H A 39 PRO HD3 1.0 1.9 6.0 610 349 A 38 THR HB A 39 PRO HA 1.0 2.0 6.0 611 350 A 43 SER HB3 A 42 GLN H 1.0 1.9 6.0 612 350 A 43 SER HB2 A 42 GLN H 1.0 1.9 6.0 613 351 A 43 SER HB3 A 42 GLN HGy 1.0 1.9 5.1 614 351 A 43 SER HB2 A 42 GLN HGy 1.0 1.9 5.1 615 352 A 16 SER HA A 15 ALA H 1.0 2.0 6.0 616 353 A 45 LEU HA A 44 ARG HA 1.0 2.0 5.4 617 354 A 52 LEU HA A 51 GLU HGy 1.0 1.9 4.9 618 355 A 53 ILE HA A 52 LEU HA 1.0 2.0 4.8 619 356 A 52 LEU HBy A 51 GLU H 1.0 2.0 6.0 620 356 A 52 LEU HBx A 51 GLU H 1.0 2.0 6.0 621 357 A 41 LEU HG A 42 GLN HA 1.0 1.9 5.3 622 358 A 41 LEU H A 42 GLN HA 1.0 1.9 6.0 623 359 A 41 LEU HBy A 42 GLN HGy 1.0 0.0 6.0 624 359 A 41 LEU HBx A 42 GLN HGx 1.0 0.0 6.0 625 360 A 13 HIS H A 14 ALA HA 1.0 1.8 6.0 626 361 A 29 ARG HBx A 30 PHE HA 1.0 2.0 6.0 627 361 A 29 ARG HBy A 30 PHE HA 1.0 2.0 6.0 628 362 A 30 PHE HA A 31 GLN HB2 1.0 2.0 6.0 629 362 A 30 PHE HA A 31 GLN HB3 1.0 2.0 6.0 630 363 A 54 ALA H A 55 LEU HA 1.0 1.8 6.0 631 364 A 14 ALA HA A 15 ALA HA 1.0 2.0 6.0 632 365 A 13 HIS HBx A 12 ALA H 1.0 2.0 6.0 633 365 A 13 HIS HBy A 12 ALA H 1.0 2.0 6.0 634 366 A 16 SER HB3 A 15 ALA H 1.0 1.9 6.0 635 366 A 16 SER HB2 A 15 ALA H 1.0 1.9 6.0 636 367 A 13 HIS HBx A 14 ALA HA 1.0 2.0 6.0 637 368 A 41 LEU HA A 40 GLU HG3 1.0 2.0 5.2 638 368 A 41 LEU HA A 40 GLU HG2 1.0 2.0 5.2 639 369 A 52 LEU HBy A 53 ILE HB 1.0 2.0 6.0 640 369 A 52 LEU HBx A 53 ILE HB 1.0 2.0 6.0 641 370 A 50 HIS HB2 A 51 GLU HA 1.0 2.0 5.4 642 371 A 57 ARG HA A 58 GLN HBx 1.0 2.0 6.0 643 371 A 57 ARG HA A 58 GLN HBy 1.0 2.0 6.0 644 372 A 17 LEU HG A 16 SER H 1.0 2.0 6.0 645 373 A 19 VAL HA A 18 GLY HAy 1.0 2.0 6.0 646 374 A 24 GLU HA A 25 GLY HAx 1.0 1.9 6.0 647 375 A 21 LEU HA A 20 ARG HA 1.0 1.8 6.0 648 376 A 20 ARG HA A 21 LEU HBy 1.0 1.9 6.0 649 376 A 20 ARG HA A 21 LEU HBx 1.0 1.9 6.0 650 377 A 20 ARG HA A 21 LEU HG 1.0 1.9 6.0 651 378 A 22 TRP HA A 23 VAL HB 1.0 2.0 6.0 652 379 A 24 GLU HGx A 25 GLY HAx 1.0 2.0 5.6 653 379 A 24 GLU HGy A 25 GLY HAx 1.0 2.0 5.6 654 380 A 24 GLU HGx A 25 GLY HAy 1.0 2.0 5.2 655 380 A 24 GLU HGy A 25 GLY HAy 1.0 2.0 5.2 656 381 A 26 GLU HGx A 27 ARG HA 1.0 2.0 6.0 657 381 A 26 GLU HGy A 27 ARG HA 1.0 2.0 6.0 658 382 A 52 LEU HA A 53 ILE HG1y 1.0 2.0 6.0 659 383 A 56 LEU H A 57 ARG HGx 1.0 1.9 6.0 660 383 A 56 LEU H A 57 ARG HGy 1.0 1.9 6.0 661 384 A 72 VAL HB A 71 PRO HA 1.0 2.0 6.0 662 385 A 57 ARG H A 58 GLN HGy 1.0 1.9 6.0 663 385 A 57 ARG H A 58 GLN HGx 1.0 1.9 6.0 664 386 A 57 ARG HA A 58 GLN HGy 1.0 2.0 5.4 665 386 A 57 ARG HA A 58 GLN HGx 1.0 2.0 5.4 666 387 A 58 GLN HGx A 57 ARG HB2 1.0 0.0 6.0 667 387 A 58 GLN HGx A 57 ARG HB3 1.0 0.0 6.0 668 388 A 20 ARG HBy A 19 VAL HA 1.0 2.0 6.0 669 388 A 20 ARG HBx A 19 VAL HA 1.0 2.0 6.0 670 389 A 2 PRO HDy A 1 GLY HA2 1.0 1.7 3.3 671 389 A 2 PRO HDy A 1 GLY HA3 1.0 1.7 3.3 672 390 A 53 ILE HA A 54 ALA HA 1.0 1.9 6.0 673 391 A 55 LEU H A 56 LEU HG 1.0 2.0 6.0 674 392 A 17 LEU H A 18 GLY HAx 1.0 2.0 6.0 675 393 A 17 LEU H A 18 GLY HAy 1.0 1.9 6.0 676 394 A 70 ALA HA A 71 PRO HDy 1.0 1.6 2.8 677 395 A 57 ARG H A 58 GLN HA 1.0 1.9 6.0 678 396 A 58 GLN HA A 57 ARG HB3 1.0 0.0 6.0 679 397 A 75 ASN HB3 A 76 GLY HAy 1.0 1.8 6.0 680 398 A 45 LEU H A 46 GLY HAy 1.0 1.1 6.0 681 399 A 34 PRO HBx A 35 GLY HAy 1.0 2.0 6.0 682 400 A 34 PRO HBx A 35 GLY HAx 1.0 1.9 6.0 683 401 A 70 ALA H A 71 PRO HDx 1.0 1.4 6.0 684 402 A 70 ALA H A 71 PRO HDy 1.0 1.8 6.0 685 403 A 61 PRO HDy A 60 GLN H 1.0 1.6 6.0 686 404 A 60 GLN HA A 61 PRO HDy 1.0 1.9 3.9 687 405 A 61 PRO HDy A 60 GLN HG3 1.0 1.8 6.0 688 405 A 61 PRO HDy A 60 GLN HG2 1.0 1.8 6.0 689 406 A 57 ARG H A 58 GLN HBx 1.0 1.3 6.0 690 406 A 57 ARG H A 58 GLN HBy 1.0 1.3 6.0 691 407 A 64 GLN HG3 A 63 SER HB2 1.0 2.0 6.0 692 407 A 64 GLN HG2 A 63 SER HB2 1.0 2.0 6.0 693 407 A 64 GLN HG2 A 63 SER HB3 1.0 2.0 6.0 694 408 A 54 ALA H A 55 LEU HBy 1.0 1.6 6.0 695 408 A 54 ALA H A 55 LEU HBx 1.0 1.6 6.0 696 409 A 17 LEU HBy A 16 SER H 1.0 1.0 6.0 697 409 A 17 LEU HBx A 16 SER H 1.0 1.0 6.0 698 410 A 43 SER HA A 42 GLN HB3 1.0 2.0 6.0 699 411 A 43 SER HA A 42 GLN HGy 1.0 2.0 6.0 700 412 A 32 ALA HA A 33 PRO HA 1.0 1.1 6.0 701 413 A 33 PRO HA A 34 PRO HBx 1.0 1.6 6.0 702 413 A 33 PRO HA A 34 PRO HBy 1.0 1.6 6.0 703 414 A 36 VAL HB A 37 MET HA 1.0 2.0 5.6 704 415 A 41 LEU HG A 42 GLN HB3 1.0 1.7 6.0 705 415 A 41 LEU HG A 42 GLN HB2 1.0 1.7 6.0 706 416 A 43 SER HB3 A 42 GLN HB3 1.0 1.9 5.5 707 416 A 43 SER HB2 A 42 GLN HB3 1.0 1.9 5.5 708 417 A 45 LEU HA A 44 ARG H 1.0 1.6 6.0 709 418 A 45 LEU HA A 44 ARG HB3 1.0 2.0 5.8 710 418 A 45 LEU HA A 44 ARG HB2 1.0 2.0 5.8 711 419 A 44 ARG H A 45 LEU HG 1.0 1.7 6.0 712 420 A 50 HIS HB2 A 49 ARG HBx 1.0 2.0 6.0 713 420 A 50 HIS HB3 A 49 ARG HBx 1.0 2.0 6.0 714 421 A 50 HIS HB3 A 51 GLU HB2 1.0 1.0 6.0 715 421 A 50 HIS HB2 A 51 GLU HB3 1.0 1.0 6.0 716 421 A 50 HIS HB2 A 51 GLU HB2 1.0 1.0 6.0 717 422 A 51 GLU H A 52 LEU HG 1.0 1.8 6.0 718 423 A 53 ILE H A 54 ALA HA 1.0 2.0 6.0 719 424 A 54 ALA HA A 55 LEU HBy 1.0 2.0 5.4 720 424 A 54 ALA HA A 55 LEU HBx 1.0 2.0 5.4 721 425 A 57 ARG HA A 56 LEU H 1.0 1.7 6.0 722 426 A 72 VAL HA A 71 PRO HBx 1.0 2.0 5.8 723 427 A 30 PHE HB3 A 31 GLN H 1.0 1.9 4.7 724 427 A 30 PHE HB2 A 31 GLN H 1.0 1.9 4.7 725 428 A 22 TRP HD1 A 23 VAL H 1.0 1.9 4.5 726 429 A 13 HIS HE1 A 14 ALA H 1.0 2.0 5.8 727 430 A 13 HIS HE1 A 14 ALA HA 1.0 2.0 5.2 728 431 A 50 HIS HE1 A 51 GLU HGy 1.0 2.0 6.0 729 431 A 50 HIS HE1 A 51 GLU HGx 1.0 2.0 6.0 730 432 A 30 PHE HA A 31 GLN H 1.0 1.6 2.8 731 433 A 22 TRP H A 21 LEU HA 1.0 1.6 2.8 732 434 A 21 LEU H A 20 ARG HA 1.0 1.7 3.5 733 435 A 48 ALA HA A 49 ARG HBx 1.0 2.0 6.0 734 435 A 48 ALA HA A 49 ARG HBy 1.0 2.0 6.0 735 436 A 48 ALA HA A 49 ARG HA 1.0 2.0 5.4 736 437 A 22 TRP HA A 23 VAL H 1.0 1.5 2.7 737 438 A 32 ALA HA A 33 PRO HBy 1.0 1.9 6.0 738 438 A 32 ALA HA A 33 PRO HBx 1.0 1.9 6.0 739 439 A 32 ALA HA A 33 PRO HDy 1.0 1.4 2.4 740 440 A 19 VAL HA A 20 ARG H 1.0 1.5 2.7 741 441 A 34 PRO HA A 35 GLY H 1.0 2.0 4.8 742 442 A 50 HIS HA A 51 GLU H 1.0 1.9 4.5 743 443 A 50 HIS HB3 A 51 GLU H 1.0 1.8 3.8 744 443 A 50 HIS HB2 A 51 GLU H 1.0 1.8 3.8 745 444 A 50 HIS HB3 A 51 GLU HA 1.0 2.0 6.0 746 444 A 50 HIS HB2 A 51 GLU HA 1.0 2.0 6.0 747 445 A 22 TRP HBy A 23 VAL H 1.0 1.8 3.8 748 445 A 22 TRP HBx A 23 VAL H 1.0 1.8 3.8 749 446 A 22 TRP HBy A 23 VAL HB 1.0 1.9 6.0 750 446 A 22 TRP HBx A 23 VAL HB 1.0 1.9 6.0 751 447 A 26 GLU HA A 27 ARG H 1.0 1.8 4.0 752 448 A 10 LEU H A 9 ALA HA 1.0 0.0 6.0 753 449 A 11 LEU HA A 12 ALA H 1.0 1.9 4.3 754 450 A 45 LEU HA A 46 GLY H 1.0 2.0 4.6 755 451 A 36 VAL HA A 37 MET H 1.0 1.9 4.7 756 452 A 22 TRP HZ3 A 21 LEU HG 1.0 2.0 6.0 757 453 A 22 TRP H A 21 LEU HBx 1.0 1.9 4.9 758 453 A 22 TRP H A 21 LEU HBy 1.0 1.9 4.9 759 454 A 29 ARG HA A 30 PHE H 1.0 1.9 4.5 760 455 A 33 PRO HA A 34 PRO HA 1.0 1.9 4.9 761 456 A 33 PRO HDx A 34 PRO HDy 1.0 1.7 6.0 762 457 A 33 PRO HBx A 34 PRO HDy 1.0 2.0 5.0 763 457 A 33 PRO HBy A 34 PRO HDy 1.0 2.0 5.0 764 458 A 39 PRO HD3 A 40 GLU H 1.0 1.9 4.7 765 458 A 39 PRO HD2 A 40 GLU H 1.0 1.9 4.7 766 459 A 16 SER H A 15 ALA HA 1.0 1.9 4.7 767 460 A 29 ARG HBy A 28 LEU HA 1.0 1.9 6.0 768 460 A 29 ARG HBx A 28 LEU HA 1.0 1.9 6.0 769 461 A 37 MET HA A 38 THR H 1.0 1.7 3.1 770 462 A 38 THR HA A 39 PRO HD2 1.0 1.7 3.1 771 462 A 38 THR HA A 39 PRO HD3 1.0 1.7 3.1 772 463 A 39 PRO HGy A 40 GLU H 1.0 1.9 6.0 773 463 A 39 PRO HGx A 40 GLU H 1.0 1.9 6.0 774 464 A 39 PRO HBy A 40 GLU H 1.0 2.0 5.0 775 464 A 39 PRO HBx A 40 GLU H 1.0 2.0 5.0 776 465 A 39 PRO HA A 40 GLU H 1.0 2.0 5.2 777 466 A 43 SER HB2 A 44 ARG H 1.0 1.8 3.6 778 466 A 43 SER HB3 A 44 ARG H 1.0 1.8 3.6 779 467 A 43 SER HB2 A 44 ARG HDx 1.0 1.8 6.0 780 467 A 43 SER HB3 A 44 ARG HDx 1.0 1.8 6.0 781 467 A 43 SER HB3 A 44 ARG HDy 1.0 1.8 6.0 782 468 A 43 SER HB2 A 44 ARG HB2 1.0 2.0 4.8 783 468 A 43 SER HB3 A 44 ARG HB3 1.0 2.0 4.8 784 468 A 43 SER HB3 A 44 ARG HB2 1.0 2.0 4.8 785 469 A 43 SER HB2 A 44 ARG HGy 1.0 2.0 5.6 786 469 A 43 SER HB2 A 44 ARG HGx 1.0 2.0 5.6 787 469 A 43 SER HB3 A 44 ARG HGy 1.0 2.0 5.6 788 469 A 43 SER HB3 A 44 ARG HGx 1.0 2.0 5.6 789 470 A 48 ALA HA A 49 ARG H 1.0 1.7 3.3 790 471 A 57 ARG H A 56 LEU HA 1.0 1.9 4.3 791 472 A 53 ILE HA A 54 ALA H 1.0 1.9 4.9 792 473 A 10 LEU HA A 11 LEU H 1.0 1.8 3.8 793 474 A 57 ARG HA A 58 GLN H 1.0 1.8 3.8 794 475 A 64 GLN HBy A 65 GLY H 1.0 1.8 3.8 795 475 A 64 GLN HBx A 65 GLY H 1.0 1.8 3.8 796 476 A 64 GLN HA A 65 GLY H 1.0 1.9 4.5 797 477 A 75 ASN H A 74 ARG HA 1.0 1.9 4.3 798 478 A 67 SER HA A 68 LEU H 1.0 1.9 4.1 799 479 A 67 SER HA A 68 LEU HB3 1.0 2.0 6.0 800 479 A 67 SER HA A 68 LEU HB2 1.0 2.0 6.0 801 480 A 67 SER HBy A 68 LEU HB3 1.0 2.0 6.0 802 480 A 67 SER HBx A 68 LEU HB3 1.0 2.0 6.0 803 480 A 67 SER HBx A 68 LEU HB2 1.0 2.0 6.0 804 480 A 67 SER HBy A 68 LEU HB2 1.0 2.0 6.0 805 481 A 67 SER HBy A 68 LEU H 1.0 1.9 6.0 806 481 A 67 SER HBx A 68 LEU H 1.0 1.9 6.0 807 482 A 69 LEU H A 68 LEU HB2 1.0 1.9 3.9 808 482 A 69 LEU H A 68 LEU HB3 1.0 1.9 3.9 809 483 A 41 LEU HBx A 42 GLN HA 1.0 1.9 6.0 810 483 A 41 LEU HBy A 42 GLN HA 1.0 1.9 6.0 811 484 A 41 LEU HBx A 42 GLN H 1.0 1.8 3.8 812 484 A 41 LEU HBy A 42 GLN H 1.0 1.8 3.8 813 485 A 53 ILE HA A 52 LEU HBy 1.0 2.0 5.2 814 485 A 53 ILE HA A 52 LEU HBx 1.0 2.0 5.2 815 486 A 43 SER HA A 42 GLN HA 1.0 2.0 5.8 816 487 A 43 SER HB3 A 42 GLN HA 1.0 1.9 6.0 817 487 A 43 SER HB2 A 42 GLN HA 1.0 1.9 6.0 818 488 A 43 SER H A 42 GLN HA 1.0 1.9 4.3 819 489 A 43 SER H A 42 GLN HB2 1.0 1.8 3.4 820 489 A 43 SER H A 42 GLN HB3 1.0 1.8 3.4 821 490 A 43 SER HA A 42 GLN HGx 1.0 1.9 4.7 822 490 A 43 SER HA A 42 GLN HGy 1.0 1.9 4.7 823 491 A 43 SER HB2 A 42 GLN HGx 1.0 1.9 6.0 824 491 A 43 SER HB3 A 42 GLN HGy 1.0 1.9 6.0 825 491 A 43 SER HB2 A 42 GLN HGy 1.0 1.9 6.0 826 492 A 43 SER H A 42 GLN HGx 1.0 2.0 5.6 827 492 A 43 SER H A 42 GLN HGy 1.0 2.0 5.6 828 493 A 14 ALA HA A 15 ALA H 1.0 1.9 4.7 829 494 A 30 PHE HA A 31 GLN HA 1.0 1.9 6.0 830 495 A 30 PHE HA A 31 GLN HGy 1.0 1.4 6.0 831 495 A 30 PHE HA A 31 GLN HGx 1.0 1.4 6.0 832 496 A 9 ALA H A 8 GLY HAx 1.0 2.0 5.6 833 497 A 9 ALA H A 8 GLY HAy 1.0 2.0 4.6 834 498 A 54 ALA HA A 55 LEU H 1.0 1.9 4.3 835 499 A 55 LEU HA A 56 LEU H 1.0 1.9 4.1 836 500 A 11 LEU HB2 A 12 ALA H 1.0 1.8 3.6 837 500 A 11 LEU HBy A 12 ALA H 1.0 1.8 3.6 838 501 A 13 HIS H A 12 ALA HA 1.0 1.9 4.3 839 502 A 29 ARG H A 28 LEU HA 1.0 1.5 2.5 840 503 A 14 ALA H A 13 HIS HA 1.0 1.9 4.5 841 504 A 42 GLN H A 41 LEU HA 1.0 1.9 3.9 842 505 A 41 LEU H A 40 GLU HA 1.0 2.0 5.0 843 506 A 52 LEU H A 51 GLU HA 1.0 1.9 4.3 844 507 A 50 HIS H A 49 ARG HA 1.0 0.0 6.0 845 508 A 13 HIS HBx A 14 ALA H 1.0 1.8 4.2 846 508 A 13 HIS HBy A 14 ALA H 1.0 1.8 4.2 847 509 A 13 HIS HBy A 14 ALA HA 1.0 1.9 6.0 848 509 A 13 HIS HBx A 14 ALA HA 1.0 1.9 6.0 849 510 A 17 LEU H A 16 SER HB2 1.0 1.9 4.1 850 510 A 17 LEU H A 16 SER HB3 1.0 1.9 4.1 851 511 A 54 ALA HA A 53 ILE HB 1.0 2.0 5.6 852 512 A 54 ALA H A 53 ILE HB 1.0 1.7 3.3 853 513 A 57 ARG H A 56 LEU HBx 1.0 1.9 4.9 854 513 A 57 ARG H A 56 LEU HBy 1.0 1.9 4.9 855 514 A 75 ASN HB2 A 76 GLY H 1.0 1.9 4.5 856 514 A 75 ASN HB3 A 76 GLY H 1.0 1.9 4.5 857 515 A 70 ALA HA A 71 PRO HDx 1.0 1.5 2.5 858 515 A 70 ALA HA A 71 PRO HDy 1.0 1.5 2.5 859 516 A 19 VAL HB A 20 ARG H 1.0 2.0 5.2 860 517 A 26 GLU H A 25 GLY HAx 1.0 2.0 5.4 861 518 A 22 TRP HBx A 21 LEU HA 1.0 1.9 6.0 862 518 A 22 TRP HBy A 21 LEU HA 1.0 1.9 6.0 863 519 A 22 TRP HA A 21 LEU HBx 1.0 2.0 5.6 864 519 A 22 TRP HA A 21 LEU HBy 1.0 2.0 5.6 865 520 A 22 TRP HE3 A 21 LEU HG 1.0 1.9 6.0 866 521 A 23 VAL HA A 24 GLU H 1.0 1.6 3.0 867 522 A 26 GLU HA A 25 GLY HAx 1.0 2.0 5.8 868 523 A 26 GLU HGy A 27 ARG H 1.0 1.9 5.3 869 524 A 28 LEU H A 27 ARG HA 1.0 1.5 2.7 870 525 A 28 LEU HBx A 27 ARG HA 1.0 2.0 6.0 871 525 A 28 LEU HBy A 27 ARG HA 1.0 2.0 6.0 872 526 A 28 LEU H A 27 ARG HBy 1.0 2.0 5.2 873 526 A 28 LEU H A 27 ARG HBx 1.0 2.0 5.2 874 527 A 28 LEU H A 27 ARG HG2 1.0 1.9 3.7 875 527 A 28 LEU H A 27 ARG HG3 1.0 1.9 3.7 876 528 A 29 ARG H A 28 LEU HBy 1.0 2.0 6.0 877 528 A 29 ARG H A 28 LEU HBx 1.0 2.0 6.0 878 529 A 29 ARG H A 28 LEU HG 1.0 1.9 4.7 879 530 A 54 ALA H A 53 ILE HG1y 1.0 1.9 6.0 880 531 A 53 ILE HG1x A 54 ALA H 1.0 2.0 6.0 881 532 A 50 HIS H A 49 ARG HGx 1.0 1.9 4.1 882 532 A 50 HIS H A 49 ARG HGy 1.0 1.9 4.1 883 533 A 41 LEU HG A 42 GLN H 1.0 2.0 5.2 884 534 A 58 GLN H A 57 ARG HGy 1.0 2.0 5.8 885 534 A 58 GLN H A 57 ARG HGx 1.0 2.0 5.8 886 535 A 21 LEU H A 20 ARG HGy 1.0 2.0 6.0 887 535 A 21 LEU H A 20 ARG HGx 1.0 2.0 6.0 888 536 A 45 LEU H A 44 ARG HGx 1.0 2.0 5.4 889 536 A 45 LEU H A 44 ARG HGy 1.0 2.0 5.4 890 537 A 72 VAL HB A 73 ALA H 1.0 2.0 6.0 891 538 A 37 MET HGx A 38 THR H 1.0 2.0 5.0 892 538 A 37 MET HGy A 38 THR H 1.0 2.0 5.0 893 539 A 21 LEU H A 20 ARG HBx 1.0 2.0 5.4 894 539 A 21 LEU H A 20 ARG HBy 1.0 2.0 5.4 895 540 A 21 LEU H A 20 ARG HD2 1.0 2.0 6.0 896 540 A 21 LEU H A 20 ARG HD3 1.0 2.0 6.0 897 541 A 2 PRO HDx A 1 GLY HA3 1.0 1.7 2.9 898 541 A 2 PRO HDx A 1 GLY HA2 1.0 1.7 2.9 899 541 A 2 PRO HDy A 1 GLY HA2 1.0 1.7 2.9 900 541 A 2 PRO HDy A 1 GLY HA3 1.0 1.7 2.9 901 542 A 2 PRO HBy A 1 GLY HA2 1.0 1.9 6.0 902 542 A 2 PRO HBx A 1 GLY HA2 1.0 1.9 6.0 903 542 A 2 PRO HBx A 1 GLY HA3 1.0 1.9 6.0 904 542 A 2 PRO HBy A 1 GLY HA3 1.0 1.9 6.0 905 543 A 6 SER HBx A 7 ALA H 1.0 1.9 6.0 906 543 A 6 SER HBy A 7 ALA H 1.0 1.9 6.0 907 544 A 64 GLN HE22 A 63 SER HB3 1.0 1.5 6.0 908 544 A 64 GLN HE22 A 63 SER HB2 1.0 1.5 6.0 909 545 A 12 ALA H A 11 LEU HG 1.0 2.0 5.6 910 546 A 57 ARG H A 56 LEU HG 1.0 1.9 4.7 911 547 A 32 ALA HA A 31 GLN HB2 1.0 2.0 6.0 912 547 A 32 ALA HA A 31 GLN HB3 1.0 2.0 6.0 913 548 A 32 ALA H A 31 GLN HGx 1.0 1.9 5.7 914 548 A 32 ALA H A 31 GLN HGy 1.0 1.9 5.7 915 549 A 32 ALA HA A 31 GLN HGx 1.0 1.9 6.0 916 549 A 32 ALA HA A 31 GLN HGy 1.0 1.9 6.0 917 550 A 17 LEU HA A 18 GLY H 1.0 1.8 3.8 918 551 A 17 LEU HA A 18 GLY HAy 1.0 2.0 5.4 919 552 A 45 LEU HB3 A 46 GLY H 1.0 1.9 4.1 920 552 A 45 LEU HB2 A 46 GLY H 1.0 1.9 4.1 921 553 A 58 GLN H A 57 ARG HB2 1.0 1.9 3.9 922 553 A 58 GLN H A 57 ARG HB3 1.0 1.9 3.9 923 554 A 49 ARG HD3 A 50 HIS HD2 1.0 2.0 6.0 924 555 A 50 HIS HA A 49 ARG HD3 1.0 2.0 6.0 925 556 A 50 HIS HE1 A 51 GLU HA 1.0 1.7 6.0 926 557 A 50 HIS HE1 A 51 GLU H 1.0 1.6 6.0 927 558 A 76 GLY HAy A 77 ARG HG3 1.0 1.5 6.0 928 558 A 76 GLY HAy A 77 ARG HG2 1.0 1.5 6.0 929 559 A 73 ALA HA A 74 ARG HBy 1.0 1.7 6.0 930 559 A 73 ALA HA A 74 ARG HBx 1.0 1.7 6.0 931 560 A 64 GLN HBy A 63 SER HB2 1.0 0.0 6.0 932 560 A 64 GLN HBx A 63 SER HB2 1.0 0.0 6.0 933 560 A 64 GLN HBy A 63 SER HB3 1.0 0.0 6.0 934 560 A 64 GLN HBx A 63 SER HB3 1.0 0.0 6.0 935 561 A 45 LEU HG A 46 GLY H 1.0 1.8 6.0 936 562 A 48 ALA HA A 47 GLY HA2 1.0 1.8 6.0 937 563 A 48 ALA H A 47 GLY HA3 1.0 2.0 6.0 938 564 A 48 ALA H A 47 GLY HA2 1.0 2.0 5.4 939 565 A 4 GLY H A 3 LEU HA 1.0 2.0 6.0 940 566 A 26 GLU HB2 A 27 ARG H 1.0 1.8 6.0 941 566 A 26 GLU HB3 A 27 ARG H 1.0 1.8 6.0 942 567 A 41 LEU H A 40 GLU HG3 1.0 2.0 6.0 943 567 A 41 LEU H A 40 GLU HG2 1.0 2.0 6.0 944 568 A 45 LEU H A 44 ARG HDy 1.0 2.0 6.0 945 569 A 58 GLN H A 57 ARG HD2 1.0 2.0 5.2 946 569 A 58 GLN H A 57 ARG HD3 1.0 2.0 5.2 947 570 A 28 LEU HBy A 27 ARG HD2 1.0 1.8 3.8 948 570 A 28 LEU HBx A 27 ARG HD3 1.0 1.8 3.8 949 570 A 28 LEU HBy A 27 ARG HD3 1.0 1.8 3.8 950 571 A 28 LEU H A 27 ARG HD2 1.0 2.0 5.2 951 571 A 28 LEU H A 27 ARG HD3 1.0 2.0 5.2 952 572 A 56 LEU H A 55 LEU HBx 1.0 1.9 4.7 953 572 A 56 LEU H A 55 LEU HBy 1.0 1.9 4.7 954 573 A 43 SER HA A 44 ARG HGy 1.0 2.0 6.0 955 573 A 43 SER HA A 44 ARG HGx 1.0 2.0 6.0 956 574 A 17 LEU H A 16 SER HA 1.0 2.0 5.6 957 575 A 41 LEU HBx A 42 GLN HGx 1.0 1.6 6.0 958 575 A 41 LEU HBy A 42 GLN HGy 1.0 1.6 6.0 959 575 A 41 LEU HBy A 42 GLN HGx 1.0 1.6 6.0 960 576 A 10 LEU HB2 A 9 ALA HA 1.0 1.7 6.0 961 576 A 10 LEU HBy A 9 ALA HA 1.0 1.7 6.0 962 577 A 10 LEU HB2 A 11 LEU H 1.0 1.8 4.0 963 577 A 10 LEU HBy A 11 LEU H 1.0 1.8 4.0 964 578 A 11 LEU H A 10 LEU HG 1.0 2.0 5.8 965 579 A 11 LEU HA A 10 LEU HG 1.0 2.0 5.6 966 580 A 13 HIS HBx A 12 ALA HA 1.0 1.6 6.0 967 580 A 13 HIS HBy A 12 ALA HA 1.0 1.6 6.0 968 581 A 16 SER HB3 A 15 ALA HA 1.0 0.3 6.0 969 581 A 16 SER HB2 A 15 ALA HA 1.0 0.3 6.0 970 582 A 33 PRO HGx A 34 PRO HDy 1.0 1.7 6.0 971 582 A 33 PRO HGy A 34 PRO HDy 1.0 1.7 6.0 972 583 A 30 PHE HB3 A 31 GLN HB2 1.0 1.1 6.0 973 583 A 30 PHE HB2 A 31 GLN HB2 1.0 1.1 6.0 974 583 A 30 PHE HB2 A 31 GLN HB3 1.0 1.1 6.0 975 583 A 30 PHE HB3 A 31 GLN HB3 1.0 1.1 6.0 976 584 A 32 ALA H A 31 GLN HA 1.0 2.0 6.0 977 585 A 32 ALA H A 31 GLN HB3 1.0 1.7 6.0 978 585 A 32 ALA H A 31 GLN HB2 1.0 1.7 6.0 979 586 A 72 VAL HB A 71 PRO HDy 1.0 0.0 6.0 980 587 A 36 VAL H A 35 GLY HAy 1.0 1.9 5.5 981 588 A 36 VAL H A 35 GLY HAx 1.0 2.0 5.8 982 589 A 60 GLN HBx A 61 PRO HDy 1.0 2.0 6.0 983 589 A 60 GLN HBy A 61 PRO HDy 1.0 2.0 6.0 984 590 A 43 SER HB2 A 42 GLN HB2 1.0 2.0 6.0 985 590 A 43 SER HB3 A 42 GLN HB3 1.0 2.0 6.0 986 590 A 43 SER HB2 A 42 GLN HB3 1.0 2.0 6.0 987 591 A 41 LEU H A 40 GLU HBx 1.0 1.9 5.1 988 591 A 41 LEU H A 40 GLU HBy 1.0 1.9 5.1 989 592 A 43 SER HA A 44 ARG H 1.0 2.0 5.6 990 593 A 45 LEU H A 44 ARG HA 1.0 2.0 4.8 991 594 A 50 HIS H A 49 ARG HD3 1.0 1.3 6.0 992 595 A 52 LEU H A 51 GLU HGx 1.0 2.0 6.0 993 595 A 52 LEU H A 51 GLU HGy 1.0 2.0 6.0 994 596 A 57 ARG HGy A 58 GLN HGy 1.0 1.7 6.0 995 596 A 57 ARG HGx A 58 GLN HGy 1.0 1.7 6.0 996 596 A 57 ARG HGy A 58 GLN HGx 1.0 1.7 6.0 997 596 A 57 ARG HGx A 58 GLN HGx 1.0 1.7 6.0 998 597 A 72 VAL H A 71 PRO HA 1.0 1.9 3.9 999 598 A 2 PRO HA A 3 LEU H 1.0 2.0 6.0 1000 599 A 72 VAL H A 71 PRO HBy 1.0 2.0 6.0 1001 599 A 72 VAL H A 71 PRO HBx 1.0 2.0 6.0 1002 600 A 75 ASN HA A 74 ARG HBx 1.0 2.0 6.0 1003 600 A 75 ASN HA A 74 ARG HBy 1.0 2.0 6.0 1004 601 A 75 ASN H A 74 ARG HBx 1.0 1.9 6.0 1005 601 A 75 ASN H A 74 ARG HBy 1.0 1.9 6.0 1006 602 A 22 TRP HD1 A 24 GLU HGy 1.0 2.0 5.8 1007 602 A 22 TRP HD1 A 24 GLU HGx 1.0 2.0 5.8 1008 603 A 22 TRP HD1 A 24 GLU HBy 1.0 2.0 4.6 1009 603 A 22 TRP HD1 A 24 GLU HBx 1.0 2.0 4.6 1010 604 A 22 TRP HE3 A 31 GLN H 1.0 1.9 6.0 1011 605 A 22 TRP HH2 A 31 GLN H 1.0 1.9 6.0 1012 606 A 22 TRP HZ3 A 31 GLN HGy 1.0 1.9 6.0 1013 606 A 22 TRP HZ3 A 31 GLN HGx 1.0 1.9 6.0 1014 607 A 22 TRP HZ3 A 31 GLN HB2 1.0 1.9 4.1 1015 607 A 22 TRP HZ3 A 31 GLN HB3 1.0 1.9 4.1 1016 608 A 22 TRP HZ3 A 30 PHE HA 1.0 2.0 5.8 1017 609 A 22 TRP HZ3 A 31 GLN H 1.0 2.0 5.0 1018 610 A 22 TRP HZ2 A 31 GLN HB3 1.0 1.9 6.0 1019 610 A 22 TRP HZ2 A 31 GLN HB2 1.0 1.9 6.0 1020 611 A 22 TRP HZ2 A 29 ARG HDy 1.0 1.9 6.0 1021 612 A 29 ARG HGy A 22 TRP HZ2 1.0 2.0 6.0 1022 612 A 29 ARG HGx A 22 TRP HZ2 1.0 2.0 6.0 1023 613 A 30 PHE HZ A 37 MET HGx 1.0 2.0 6.0 1024 613 A 30 PHE HZ A 37 MET HGy 1.0 2.0 6.0 1025 614 A 30 PHE HA A 21 LEU HA 1.0 1.8 4.0 1026 615 A 21 LEU HA A 31 GLN H 1.0 2.0 5.8 1027 616 A 30 PHE HB3 A 21 LEU HA 1.0 2.0 6.0 1028 616 A 30 PHE HB2 A 21 LEU HA 1.0 2.0 6.0 1029 617 A 48 ALA HA A 51 GLU HGy 1.0 1.8 6.0 1030 617 A 48 ALA HA A 51 GLU HGx 1.0 1.8 6.0 1031 618 A 48 ALA HA A 52 LEU H 1.0 1.9 6.0 1032 619 A 48 ALA HA A 51 GLU H 1.0 2.0 6.0 1033 620 A 22 TRP HA A 56 LEU HBy 1.0 2.0 5.0 1034 620 A 22 TRP HA A 56 LEU HBx 1.0 2.0 5.0 1035 621 A 32 ALA HA A 19 VAL HA 1.0 1.9 3.9 1036 622 A 34 PRO HA A 36 VAL H 1.0 2.0 6.0 1037 623 A 50 HIS HA A 54 ALA H 1.0 2.0 5.2 1038 624 A 50 HIS HA A 53 ILE HB 1.0 1.8 3.8 1039 625 A 22 TRP HBy A 24 GLU HA 1.0 1.9 6.0 1040 625 A 22 TRP HBx A 24 GLU HA 1.0 1.9 6.0 1041 626 A 22 TRP HBy A 56 LEU HBy 1.0 2.0 6.0 1042 626 A 22 TRP HBx A 56 LEU HBx 1.0 2.0 6.0 1043 626 A 22 TRP HBy A 56 LEU HBx 1.0 2.0 6.0 1044 627 A 9 ALA HA A 11 LEU H 1.0 2.0 5.8 1045 628 A 13 HIS H A 11 LEU HA 1.0 0.0 6.0 1046 629 A 11 LEU HA A 14 ALA H 1.0 2.0 5.6 1047 630 A 11 LEU HA A 15 ALA H 1.0 2.0 5.6 1048 631 A 48 ALA H A 45 LEU HA 1.0 1.9 6.0 1049 632 A 22 TRP HZ3 A 31 GLN HA 1.0 1.7 6.0 1050 633 A 30 PHE HB3 A 22 TRP HZ3 1.0 1.8 6.0 1051 633 A 30 PHE HB2 A 22 TRP HZ3 1.0 1.8 6.0 1052 634 A 55 LEU HA A 58 GLN HBx 1.0 1.9 4.7 1053 634 A 55 LEU HA A 58 GLN HBy 1.0 1.9 4.7 1054 635 A 29 ARG HBy A 24 GLU HBy 1.0 1.8 6.0 1055 635 A 29 ARG HBx A 24 GLU HBx 1.0 1.8 6.0 1056 635 A 29 ARG HBx A 24 GLU HBy 1.0 1.8 6.0 1057 636 A 33 PRO HDx A 36 VAL H 1.0 0.9 6.0 1058 637 A 33 PRO HBy A 36 VAL H 1.0 1.8 6.0 1059 637 A 33 PRO HBx A 36 VAL H 1.0 1.8 6.0 1060 638 A 33 PRO HGy A 36 VAL H 1.0 0.0 6.0 1061 638 A 33 PRO HGx A 36 VAL H 1.0 0.0 6.0 1062 639 A 19 VAL H A 15 ALA HA 1.0 1.9 4.3 1063 640 A 17 LEU H A 15 ALA HA 1.0 2.0 6.0 1064 641 A 58 GLN HE22 A 15 ALA HA 1.0 2.0 6.0 1065 642 A 38 THR HB A 40 GLU HG3 1.0 1.9 6.0 1066 642 A 38 THR HB A 40 GLU HG2 1.0 1.9 6.0 1067 643 A 38 THR HB A 40 GLU H 1.0 1.9 6.0 1068 644 A 39 PRO HBx A 42 GLN H 1.0 2.0 6.0 1069 644 A 39 PRO HBy A 42 GLN H 1.0 2.0 6.0 1070 645 A 39 PRO HA A 42 GLN HA 1.0 1.7 6.0 1071 646 A 41 LEU H A 39 PRO HA 1.0 1.9 6.0 1072 647 A 39 PRO HA A 43 SER H 1.0 2.0 6.0 1073 648 A 39 PRO HA A 42 GLN H 1.0 2.0 5.2 1074 649 A 45 LEU H A 43 SER HB2 1.0 0.0 6.0 1075 649 A 45 LEU H A 43 SER HB3 1.0 0.0 6.0 1076 650 A 52 LEU HA A 54 ALA H 1.0 2.0 6.0 1077 651 A 53 ILE HA A 55 LEU H 1.0 1.9 6.0 1078 652 A 53 ILE HA A 57 ARG H 1.0 2.0 6.0 1079 653 A 10 LEU HA A 14 ALA H 1.0 1.9 5.5 1080 654 A 13 HIS HE1 A 10 LEU HA 1.0 1.9 6.0 1081 655 A 13 HIS HBx A 10 LEU HA 1.0 1.9 4.1 1082 655 A 13 HIS HBy A 10 LEU HA 1.0 1.9 4.1 1083 656 A 13 HIS HBx A 9 ALA HA 1.0 1.8 6.0 1084 656 A 13 HIS HBy A 9 ALA HA 1.0 1.8 6.0 1085 657 A 57 ARG HA A 60 GLN HE22 1.0 1.7 6.0 1086 658 A 52 LEU HBy A 54 ALA H 1.0 1.7 6.0 1087 658 A 52 LEU HBx A 54 ALA H 1.0 1.7 6.0 1088 659 A 45 LEU HB3 A 42 GLN HA 1.0 2.0 4.4 1089 659 A 45 LEU HB2 A 42 GLN HA 1.0 2.0 4.4 1090 660 A 42 GLN HA A 44 ARG H 1.0 1.9 6.0 1091 661 A 45 LEU H A 42 GLN HA 1.0 1.9 5.3 1092 662 A 42 GLN HB2 A 44 ARG H 1.0 1.2 6.0 1093 662 A 42 GLN HB3 A 44 ARG H 1.0 1.2 6.0 1094 663 A 58 GLN HE21 A 15 ALA HA 1.0 1.9 4.3 1095 664 A 17 LEU H A 14 ALA HA 1.0 1.9 5.3 1096 665 A 14 ALA HA A 16 SER H 1.0 2.0 6.0 1097 666 A 14 ALA HA A 18 GLY H 1.0 2.0 6.0 1098 667 A 22 TRP HD1 A 29 ARG HDx 1.0 1.8 6.0 1099 667 A 22 TRP HD1 A 29 ARG HDy 1.0 1.8 6.0 1100 668 A 29 ARG HBy A 22 TRP HD1 1.0 1.9 6.0 1101 668 A 29 ARG HBx A 22 TRP HD1 1.0 1.9 6.0 1102 669 A 22 TRP HH2 A 30 PHE HA 1.0 1.8 6.0 1103 670 A 22 TRP HH2 A 31 GLN HA 1.0 1.5 6.0 1104 671 A 30 PHE HB2 A 22 TRP HH2 1.0 1.8 6.0 1105 671 A 30 PHE HB3 A 22 TRP HH2 1.0 1.8 6.0 1106 672 A 29 ARG HBx A 22 TRP HH2 1.0 1.9 6.0 1107 672 A 29 ARG HBy A 22 TRP HH2 1.0 1.9 6.0 1108 673 A 22 TRP HE3 A 31 GLN HGy 1.0 1.0 6.0 1109 673 A 22 TRP HE3 A 31 GLN HGx 1.0 1.0 6.0 1110 674 A 29 ARG HA A 22 TRP HZ2 1.0 1.0 6.0 1111 675 A 13 HIS H A 11 LEU HB2 1.0 0.0 6.0 1112 675 A 13 HIS H A 11 LEU HBy 1.0 0.0 6.0 1113 676 A 12 ALA HA A 15 ALA H 1.0 2.0 5.0 1114 677 A 12 ALA HA A 16 SER H 1.0 1.9 6.0 1115 678 A 13 HIS HA A 16 SER H 1.0 2.0 5.6 1116 679 A 13 HIS HA A 15 ALA H 1.0 2.0 5.0 1117 680 A 14 ALA H A 12 ALA HA 1.0 2.0 6.0 1118 681 A 54 ALA HA A 56 LEU H 1.0 2.0 5.6 1119 682 A 57 ARG H A 54 ALA HA 1.0 1.8 3.6 1120 683 A 41 LEU HA A 44 ARG H 1.0 2.0 5.2 1121 684 A 45 LEU H A 41 LEU HA 1.0 1.9 6.0 1122 685 A 43 SER H A 41 LEU HA 1.0 1.9 6.0 1123 686 A 41 LEU HA A 44 ARG HDy 1.0 2.0 5.8 1124 686 A 41 LEU HA A 44 ARG HDx 1.0 2.0 5.8 1125 687 A 43 SER H A 40 GLU HA 1.0 1.9 4.9 1126 688 A 40 GLU HA A 44 ARG H 1.0 2.0 6.0 1127 689 A 42 GLN H A 40 GLU HA 1.0 0.0 6.0 1128 690 A 58 GLN H A 56 LEU HA 1.0 1.9 4.1 1129 691 A 55 LEU H A 51 GLU HA 1.0 2.0 6.0 1130 692 A 54 ALA H A 51 GLU HA 1.0 1.9 4.9 1131 693 A 50 HIS HA A 52 LEU H 1.0 2.0 6.0 1132 694 A 51 GLU H A 49 ARG HA 1.0 2.0 6.0 1133 695 A 52 LEU H A 49 ARG HA 1.0 2.0 4.8 1134 696 A 17 LEU H A 13 HIS HA 1.0 2.0 6.0 1135 697 A 14 ALA HA A 19 VAL HB 1.0 2.0 4.6 1136 698 A 17 LEU HBy A 14 ALA HA 1.0 1.9 4.5 1137 698 A 17 LEU HBx A 14 ALA HA 1.0 1.9 4.5 1138 699 A 19 VAL H A 17 LEU HBy 1.0 2.0 5.4 1139 699 A 19 VAL H A 17 LEU HBx 1.0 2.0 5.4 1140 700 A 41 LEU HA A 44 ARG HGx 1.0 1.8 3.4 1141 700 A 41 LEU HA A 44 ARG HGy 1.0 1.8 3.4 1142 701 A 52 LEU HBy A 49 ARG HA 1.0 1.9 4.5 1143 701 A 52 LEU HBx A 49 ARG HA 1.0 1.9 4.5 1144 702 A 55 LEU H A 53 ILE HB 1.0 1.7 6.0 1145 703 A 70 ALA HA A 72 VAL HB 1.0 2.0 6.0 1146 704 A 19 VAL H A 17 LEU HG 1.0 1.9 6.0 1147 705 A 32 ALA HA A 19 VAL HB 1.0 1.7 6.0 1148 706 A 33 PRO HBx A 18 GLY HAy 1.0 1.9 6.0 1149 706 A 33 PRO HBy A 18 GLY HAy 1.0 1.9 6.0 1150 707 A 27 ARG H A 25 GLY HAx 1.0 1.7 6.0 1151 708 A 27 ARG H A 25 GLY HAy 1.0 1.8 6.0 1152 709 A 21 LEU HA A 56 LEU HBy 1.0 1.9 6.0 1153 709 A 21 LEU HA A 56 LEU HBx 1.0 1.9 6.0 1154 710 A 30 PHE HA A 21 LEU HBx 1.0 1.9 6.0 1155 710 A 30 PHE HA A 21 LEU HBy 1.0 1.9 6.0 1156 711 A 30 PHE HB2 A 21 LEU HBx 1.0 1.5 6.0 1157 711 A 30 PHE HB3 A 21 LEU HBy 1.0 1.5 6.0 1158 711 A 30 PHE HB2 A 21 LEU HBy 1.0 1.5 6.0 1159 712 A 28 LEU HA A 23 VAL HB 1.0 1.6 6.0 1160 713 A 37 MET H A 35 GLY HAy 1.0 1.7 6.0 1161 714 A 37 MET H A 35 GLY HAx 1.0 1.9 6.0 1162 715 A 40 GLU HG3 A 44 ARG HDy 1.0 2.0 6.0 1163 715 A 40 GLU HG2 A 44 ARG HDy 1.0 2.0 6.0 1164 715 A 40 GLU HG3 A 44 ARG HDx 1.0 2.0 6.0 1165 715 A 40 GLU HG2 A 44 ARG HDx 1.0 2.0 6.0 1166 716 A 29 ARG HGy A 24 GLU HGy 1.0 2.0 6.0 1167 716 A 29 ARG HGy A 24 GLU HGx 1.0 2.0 6.0 1168 716 A 29 ARG HGx A 24 GLU HGy 1.0 2.0 6.0 1169 716 A 29 ARG HGx A 24 GLU HGx 1.0 2.0 6.0 1170 717 A 29 ARG HDx A 24 GLU HBy 1.0 1.9 5.1 1171 717 A 29 ARG HDy A 24 GLU HBx 1.0 1.9 5.1 1172 717 A 29 ARG HDy A 24 GLU HBy 1.0 1.9 5.1 1173 718 A 29 ARG HDx A 27 ARG HBx 1.0 2.0 6.0 1174 718 A 29 ARG HDx A 27 ARG HBy 1.0 2.0 6.0 1175 719 A 51 GLU H A 49 ARG HGx 1.0 1.2 6.0 1176 719 A 51 GLU H A 49 ARG HGy 1.0 1.2 6.0 1177 720 A 22 TRP HZ3 A 20 ARG HGy 1.0 1.9 6.0 1178 720 A 22 TRP HZ3 A 20 ARG HGx 1.0 1.9 6.0 1179 721 A 22 TRP HE3 A 20 ARG HGy 1.0 1.9 6.0 1180 721 A 22 TRP HE3 A 20 ARG HGx 1.0 1.9 6.0 1181 722 A 20 ARG HGx A 31 GLN HGy 1.0 1.9 6.0 1182 722 A 20 ARG HGy A 31 GLN HGy 1.0 1.9 6.0 1183 722 A 20 ARG HGx A 31 GLN HGx 1.0 1.9 6.0 1184 722 A 20 ARG HGy A 31 GLN HGx 1.0 1.9 6.0 1185 723 A 22 TRP HZ3 A 20 ARG HBy 1.0 2.0 5.0 1186 723 A 22 TRP HZ3 A 20 ARG HBx 1.0 2.0 5.0 1187 724 A 22 TRP HE3 A 20 ARG HBx 1.0 1.9 4.5 1188 724 A 22 TRP HE3 A 20 ARG HBy 1.0 1.9 4.5 1189 725 A 30 PHE HA A 20 ARG HBy 1.0 1.6 6.0 1190 725 A 30 PHE HA A 20 ARG HBx 1.0 1.6 6.0 1191 726 A 20 ARG HBy A 31 GLN HA 1.0 1.6 6.0 1192 726 A 20 ARG HBx A 31 GLN HA 1.0 1.6 6.0 1193 727 A 22 TRP HZ3 A 20 ARG HD3 1.0 1.9 6.0 1194 727 A 22 TRP HZ3 A 20 ARG HD2 1.0 1.9 6.0 1195 728 A 22 TRP HE3 A 20 ARG HD2 1.0 1.9 6.0 1196 728 A 22 TRP HE3 A 20 ARG HD3 1.0 1.9 6.0 1197 729 A 64 GLN HE21 A 62 SER HBx 1.0 2.0 6.0 1198 729 A 64 GLN HE21 A 62 SER HBy 1.0 2.0 6.0 1199 730 A 64 GLN HE22 A 62 SER HBx 1.0 1.6 6.0 1200 730 A 64 GLN HE22 A 62 SER HBy 1.0 1.6 6.0 1201 731 A 8 GLY H A 6 SER HBx 1.0 2.0 6.0 1202 731 A 8 GLY H A 6 SER HBy 1.0 2.0 6.0 1203 732 A 9 ALA H A 6 SER HBx 1.0 1.9 6.0 1204 732 A 9 ALA H A 6 SER HBy 1.0 1.9 6.0 1205 733 A 54 ALA HA A 57 ARG HD3 1.0 2.0 5.2 1206 733 A 54 ALA HA A 57 ARG HD2 1.0 2.0 5.2 1207 734 A 54 ALA HA A 57 ARG HB3 1.0 1.8 3.6 1208 734 A 54 ALA HA A 57 ARG HB2 1.0 1.8 3.6 1209 735 A 58 GLN H A 56 LEU HBx 1.0 2.0 5.4 1210 735 A 58 GLN H A 56 LEU HBy 1.0 2.0 5.4 1211 736 A 55 LEU HA A 58 GLN HGy 1.0 2.0 5.8 1212 736 A 55 LEU HA A 58 GLN HGx 1.0 2.0 5.8 1213 737 A 58 GLN HE22 A 18 GLY HAx 1.0 2.0 6.0 1214 738 A 58 GLN HE22 A 18 GLY HAy 1.0 1.8 6.0 1215 739 A 58 GLN HE21 A 18 GLY HAx 1.0 2.0 6.0 1216 740 A 20 ARG HD3 A 18 GLY HAx 1.0 2.0 6.0 1217 740 A 20 ARG HD2 A 18 GLY HAx 1.0 2.0 6.0 1218 741 A 33 PRO HGx A 18 GLY HAy 1.0 2.0 5.4 1219 741 A 33 PRO HGy A 18 GLY HAy 1.0 2.0 5.4 1220 742 A 33 PRO HDy A 31 GLN HB2 1.0 1.9 6.0 1221 742 A 33 PRO HDy A 31 GLN HB3 1.0 1.9 6.0 1222 743 A 33 PRO HDy A 31 GLN HGx 1.0 2.0 5.8 1223 743 A 33 PRO HDy A 31 GLN HGy 1.0 2.0 5.8 1224 744 A 56 LEU HBx A 58 GLN HGy 1.0 1.7 6.0 1225 744 A 56 LEU HBy A 58 GLN HGx 1.0 1.7 6.0 1226 744 A 56 LEU HBx A 58 GLN HGx 1.0 1.7 6.0 1227 744 A 56 LEU HBy A 58 GLN HGy 1.0 1.7 6.0 1228 745 A 17 LEU HA A 14 ALA HA 1.0 1.3 6.0 1229 746 A 30 PHE HB3 A 27 ARG HG2 1.0 1.8 6.0 1230 746 A 30 PHE HB2 A 27 ARG HG2 1.0 1.8 6.0 1231 746 A 30 PHE HB3 A 27 ARG HG3 1.0 1.8 6.0 1232 746 A 30 PHE HB2 A 27 ARG HG3 1.0 1.8 6.0 1233 747 A 17 LEU HG A 14 ALA HA 1.0 2.0 5.4 1234 748 A 37 MET HGx A 39 PRO HA 1.0 1.3 6.0 1235 748 A 37 MET HGy A 39 PRO HA 1.0 1.3 6.0 1236 749 A 60 GLN HG3 A 62 SER H 1.0 0.7 6.0 1237 749 A 60 GLN HG2 A 62 SER H 1.0 0.7 6.0 1238 750 A 18 GLY H A 16 SER HA 1.0 2.0 6.0 1239 751 A 10 LEU H A 7 ALA HA 1.0 2.0 5.8 1240 752 A 11 LEU HB2 A 8 GLY HAy 1.0 0.5 6.0 1241 752 A 11 LEU HBy A 8 GLY HAy 1.0 0.5 6.0 1242 753 A 10 LEU H A 8 GLY HAx 1.0 1.5 6.0 1243 754 A 10 LEU H A 8 GLY HAy 1.0 0.4 6.0 1244 755 A 8 GLY HAx A 11 LEU H 1.0 1.7 6.0 1245 756 A 13 HIS HBx A 10 LEU HB2 1.0 1.6 6.0 1246 756 A 13 HIS HBy A 10 LEU HBy 1.0 1.6 6.0 1247 756 A 13 HIS HBy A 10 LEU HB2 1.0 1.6 6.0 1248 757 A 10 LEU HBy A 14 ALA H 1.0 0.2 6.0 1249 757 A 10 LEU HB2 A 14 ALA H 1.0 0.2 6.0 1250 758 A 12 ALA HA A 15 ALA HA 1.0 0.0 6.0 1251 759 A 58 GLN HBy A 15 ALA HA 1.0 1.9 6.0 1252 759 A 58 GLN HBx A 15 ALA HA 1.0 1.9 6.0 1253 760 A 19 VAL HB A 15 ALA HA 1.0 2.0 6.0 1254 761 A 58 GLN HE21 A 18 GLY HAy 1.0 0.2 6.0 1255 762 A 58 GLN HGy A 18 GLY HAx 1.0 0.8 6.0 1256 762 A 58 GLN HGx A 18 GLY HAx 1.0 0.8 6.0 1257 763 A 30 PHE HZ A 19 VAL HB 1.0 0.0 6.0 1258 764 A 20 ARG HD3 A 31 GLN HA 1.0 1.0 6.0 1259 764 A 20 ARG HD2 A 31 GLN HA 1.0 1.0 6.0 1260 765 A 20 ARG HGy A 31 GLN HB2 1.0 1.6 6.0 1261 765 A 20 ARG HGx A 31 GLN HB3 1.0 1.6 6.0 1262 765 A 20 ARG HGy A 31 GLN HB3 1.0 1.6 6.0 1263 766 A 33 PRO HA A 36 VAL H 1.0 0.4 6.0 1264 767 A 41 LEU H A 37 MET HA 1.0 0.3 6.0 1265 768 A 37 MET HA A 39 PRO HD2 1.0 1.4 6.0 1266 768 A 37 MET HA A 39 PRO HD3 1.0 1.4 6.0 1267 769 A 40 GLU HG2 A 44 ARG HGx 1.0 1.5 6.0 1268 769 A 40 GLU HG3 A 44 ARG HGx 1.0 1.5 6.0 1269 769 A 40 GLU HG3 A 44 ARG HGy 1.0 1.5 6.0 1270 769 A 40 GLU HG2 A 44 ARG HGy 1.0 1.5 6.0 1271 770 A 45 LEU HA A 41 LEU HG 1.0 1.1 6.0 1272 771 A 42 GLN HB2 A 44 ARG HGy 1.0 1.1 6.0 1273 771 A 42 GLN HB3 A 44 ARG HGx 1.0 1.1 6.0 1274 771 A 42 GLN HB3 A 44 ARG HGy 1.0 1.1 6.0 1275 772 A 45 LEU H A 43 SER HA 1.0 1.2 6.0 1276 773 A 45 LEU HB2 A 47 GLY H 1.0 2.0 6.0 1277 773 A 45 LEU HB3 A 47 GLY H 1.0 2.0 6.0 1278 774 A 51 GLU HGx A 55 LEU HBx 1.0 1.7 6.0 1279 774 A 51 GLU HGy A 55 LEU HBy 1.0 1.7 6.0 1280 774 A 51 GLU HGy A 55 LEU HBx 1.0 1.7 6.0 1281 775 A 52 LEU HA A 55 LEU H 1.0 2.0 5.6 1282 776 A 53 ILE HA A 56 LEU H 1.0 2.0 5.6 1283 777 A 57 ARG HA A 60 GLN HG2 1.0 2.0 5.8 1284 777 A 57 ARG HA A 60 GLN HG3 1.0 2.0 5.8 1285 778 A 75 ASN H A 72 VAL HA 1.0 2.0 6.0 1286 779 A 22 TRP HE3 A 30 PHE HA 1.0 2.0 6.0 1287 780 A 22 TRP H A 30 PHE HA 1.0 2.0 6.0 1288 781 A 30 PHE HA A 21 LEU HG 1.0 1.9 4.5 1289 782 A 30 PHE HA A 21 LEU HBx 1.0 2.0 6.0 1290 782 A 30 PHE HA A 21 LEU HBy 1.0 2.0 6.0 1291 783 A 32 ALA HA A 20 ARG H 1.0 2.0 5.4 1292 784 A 36 VAL HA A 38 THR HB 1.0 0.0 6.0 1293 785 A 29 ARG HBx A 22 TRP HZ2 1.0 1.9 5.3 1294 785 A 29 ARG HBy A 22 TRP HZ2 1.0 1.9 5.3 1295 786 A 29 ARG HBy A 22 TRP HD1 1.0 1.9 6.0 1296 786 A 29 ARG HBx A 22 TRP HD1 1.0 1.9 6.0 1297 787 A 29 ARG HBy A 22 TRP HE1 1.0 1.9 6.0 1298 787 A 29 ARG HBx A 22 TRP HE1 1.0 1.9 6.0 1299 788 A 29 ARG HBy A 24 GLU HBy 1.0 2.0 6.0 1300 788 A 29 ARG HBx A 24 GLU HBx 1.0 2.0 6.0 1301 788 A 29 ARG HBx A 24 GLU HBy 1.0 2.0 6.0 1302 789 A 29 ARG HGx A 24 GLU HBx 1.0 2.0 5.2 1303 789 A 29 ARG HGy A 24 GLU HBy 1.0 2.0 5.2 1304 789 A 29 ARG HGx A 24 GLU HBy 1.0 2.0 5.2 1305 790 A 29 ARG HGy A 24 GLU HGx 1.0 2.0 6.0 1306 790 A 29 ARG HGx A 24 GLU HGy 1.0 2.0 6.0 1307 790 A 29 ARG HGx A 24 GLU HGx 1.0 2.0 6.0 1308 791 A 29 ARG HGy A 23 VAL HA 1.0 1.8 6.0 1309 791 A 29 ARG HGx A 23 VAL HA 1.0 1.8 6.0 1310 792 A 29 ARG HGy A 22 TRP HD1 1.0 1.8 6.0 1311 792 A 29 ARG HGx A 22 TRP HD1 1.0 1.8 6.0 1312 793 A 29 ARG HGy A 22 TRP HE1 1.0 2.0 6.0 1313 793 A 29 ARG HGx A 22 TRP HE1 1.0 2.0 6.0 1314 794 A 29 ARG HDx A 24 GLU HGx 1.0 1.7 6.0 1315 795 A 29 ARG HDy A 24 GLU HGy 1.0 1.9 6.0 1316 795 A 29 ARG HDy A 24 GLU HGx 1.0 1.9 6.0 1317 796 A 29 ARG HDy A 24 GLU HBx 1.0 1.9 4.1 1318 796 A 29 ARG HDy A 24 GLU HBy 1.0 1.9 4.1 1319 797 A 29 ARG HDx A 24 GLU HBx 1.0 2.0 6.0 1320 797 A 29 ARG HDx A 24 GLU HBy 1.0 2.0 6.0 1321 798 A 29 ARG HDy A 27 ARG HG2 1.0 1.9 6.0 1322 798 A 29 ARG HDy A 27 ARG HG3 1.0 1.9 6.0 1323 799 A 29 ARG HDx A 27 ARG HG2 1.0 2.0 5.0 1324 799 A 29 ARG HDx A 27 ARG HG3 1.0 2.0 5.0 1325 800 A 29 ARG HDx A 23 VAL HA 1.0 2.0 5.4 1326 801 A 29 ARG HDy A 23 VAL HA 1.0 2.0 6.0 1327 802 A 22 TRP HZ2 A 29 ARG HDx 1.0 2.0 6.0 1328 803 A 22 TRP HD1 A 29 ARG HDy 1.0 2.0 6.0 1329 804 A 22 TRP HE1 A 29 ARG HDy 1.0 1.9 6.0 1330 805 A 22 TRP HE1 A 29 ARG HDx 1.0 1.9 6.0 1331 806 A 17 LEU HBy A 14 ALA HA 1.0 2.0 5.6 1332 806 A 17 LEU HBx A 14 ALA HA 1.0 2.0 5.6 1333 807 A 29 ARG HBx A 22 TRP HZ3 1.0 1.7 6.0 1334 807 A 29 ARG HBy A 22 TRP HZ3 1.0 1.7 6.0 1335 808 A 29 ARG HGy A 24 GLU HGx 1.0 2.0 6.0 1336 808 A 29 ARG HGx A 24 GLU HGy 1.0 2.0 6.0 1337 808 A 29 ARG HGx A 24 GLU HGx 1.0 2.0 6.0 1338 809 A 29 ARG HDx A 27 ARG HA 1.0 0.0 6.0 1339 810 A 29 ARG HDy A 27 ARG HA 1.0 0.0 6.0 1340 811 A 19 VAL HA A 33 PRO HDx 1.0 2.0 5.4 1341 812 A 19 VAL HA A 33 PRO HDy 1.0 1.9 4.7 1342 813 A 19 VAL H A 33 PRO HDy 1.0 1.9 6.0 1343 814 A 19 VAL H A 33 PRO HDx 1.0 1.8 6.0 1344 815 A 33 PRO HDy A 20 ARG H 1.0 1.9 6.0 1345 816 A 33 PRO HDx A 20 ARG H 1.0 2.0 5.8 1346 817 A 19 VAL H A 33 PRO HGy 1.0 1.8 6.0 1347 817 A 19 VAL H A 33 PRO HGx 1.0 1.8 6.0 1348 818 A 22 TRP HA A 56 LEU HA 1.0 1.8 6.0 1349 819 A 53 ILE HA A 50 HIS HA 1.0 1.4 6.0 1350 820 A 37 MET HA A 41 LEU HBx 1.0 2.0 5.4 1351 820 A 37 MET HA A 41 LEU HBy 1.0 2.0 5.4 1352 821 A 38 THR H A 41 LEU HBx 1.0 1.9 4.7 1353 821 A 38 THR H A 41 LEU HBy 1.0 1.9 4.7 1354 822 A 39 PRO HA A 42 GLN HB2 1.0 1.8 3.6 1355 822 A 39 PRO HA A 42 GLN HB3 1.0 1.8 3.6 1356 823 A 22 TRP HH2 A 31 GLN HGy 1.0 2.0 6.0 1357 823 A 22 TRP HH2 A 31 GLN HGx 1.0 2.0 6.0 1358 824 A 23 VAL HA A 28 LEU HA 1.0 1.9 4.1 1359 825 A 38 THR H A 41 LEU HA 1.0 1.7 6.0 1360 826 A 11 LEU HB2 A 8 GLY HAx 1.0 1.9 3.9 1361 826 A 11 LEU HBy A 8 GLY HAx 1.0 1.9 3.9 1362 827 A 13 HIS HBx A 10 LEU HB2 1.0 2.0 6.0 1363 827 A 13 HIS HBy A 10 LEU HB2 1.0 2.0 6.0 1364 828 A 38 THR HB A 40 GLU HA 1.0 1.6 6.0 1365 829 A 50 HIS HB2 A 53 ILE HB 1.0 1.9 6.0 1366 829 A 50 HIS HB3 A 53 ILE HB 1.0 1.9 6.0 1367 830 A 51 GLU H A 53 ILE HB 1.0 2.0 6.0 1368 831 A 10 LEU HB2 A 7 ALA HA 1.0 1.8 3.6 1369 831 A 10 LEU HBy A 7 ALA HA 1.0 1.8 3.6 1370 832 A 58 GLN HBx A 56 LEU HBy 1.0 0.0 6.0 1371 832 A 58 GLN HBy A 56 LEU HBx 1.0 0.0 6.0 1372 832 A 58 GLN HBy A 56 LEU HBy 1.0 0.0 6.0 1373 833 A 20 ARG HA A 58 GLN HBx 1.0 2.0 6.0 1374 833 A 20 ARG HA A 58 GLN HBy 1.0 2.0 6.0 1375 834 A 22 TRP HE1 A 24 GLU HGy 1.0 2.0 6.0 1376 834 A 22 TRP HE1 A 24 GLU HGx 1.0 2.0 6.0 1377 835 A 22 TRP HE1 A 24 GLU HBy 1.0 2.0 5.4 1378 835 A 22 TRP HE1 A 24 GLU HBx 1.0 2.0 5.4 1379 836 A 30 PHE HB3 A 21 LEU HG 1.0 2.0 6.0 1380 836 A 30 PHE HB2 A 21 LEU HG 1.0 2.0 6.0 1381 837 A 22 TRP HD1 A 24 GLU HA 1.0 1.9 6.0 1382 838 A 24 GLU H A 27 ARG HBx 1.0 1.9 6.0 1383 838 A 24 GLU H A 27 ARG HBy 1.0 1.9 6.0 1384 839 A 28 LEU HBy A 23 VAL HB 1.0 1.9 4.3 1385 839 A 28 LEU HBx A 23 VAL HB 1.0 1.9 4.3 1386 840 A 50 HIS HA A 53 ILE HG1y 1.0 1.9 6.0 1387 841 A 37 MET HA A 41 LEU HG 1.0 1.2 6.0 1388 842 A 20 ARG HGx A 18 GLY HAx 1.0 2.0 5.4 1389 842 A 20 ARG HGy A 18 GLY HAx 1.0 2.0 5.4 1390 843 A 58 GLN HGy A 15 ALA HA 1.0 2.0 6.0 1391 843 A 58 GLN HGx A 15 ALA HA 1.0 2.0 6.0 1392 844 A 64 GLN HBy A 66 GLY HAy 1.0 2.0 5.8 1393 844 A 64 GLN HBx A 66 GLY HAy 1.0 2.0 5.8 1394 845 A 8 GLY HAx A 11 LEU HG 1.0 2.0 6.0 1395 846 A 53 ILE HA A 56 LEU HBx 1.0 1.9 4.5 1396 846 A 53 ILE HA A 56 LEU HBy 1.0 1.9 4.5 1397 847 A 22 TRP HH2 A 31 GLN HB3 1.0 1.9 4.1 1398 847 A 22 TRP HH2 A 31 GLN HB2 1.0 1.9 4.1 1399 848 A 22 TRP HE3 A 31 GLN HB3 1.0 2.0 6.0 1400 849 A 20 ARG HD2 A 31 GLN HB2 1.0 2.0 5.8 1401 849 A 20 ARG HD3 A 31 GLN HB3 1.0 2.0 5.8 1402 849 A 20 ARG HD2 A 31 GLN HB3 1.0 2.0 5.8 1403 850 A 20 ARG HA A 58 GLN HGy 1.0 1.8 6.0 1404 850 A 20 ARG HA A 58 GLN HGx 1.0 1.8 6.0 1405 851 A 45 LEU HB3 A 42 GLN HE22 1.0 2.0 6.0 1406 851 A 45 LEU HB2 A 42 GLN HE22 1.0 2.0 6.0 1407 852 A 48 ALA HA A 50 HIS HD2 1.0 0.4 6.0 1408 853 A 48 ALA HA A 51 GLU HB2 1.0 1.8 6.0 1409 853 A 48 ALA HA A 51 GLU HB3 1.0 1.8 6.0 1410 854 A 30 PHE HZ A 37 MET HBy 1.0 2.0 6.0 1411 854 A 30 PHE HZ A 37 MET HBx 1.0 2.0 6.0 1412 855 A 48 ALA H A 52 LEU HG 1.0 2.0 6.0 1413 856 A 75 ASN HB2 A 77 ARG HA 1.0 2.0 6.0 1414 856 A 75 ASN HB3 A 77 ARG HA 1.0 2.0 6.0 1415 857 A 24 GLU H A 27 ARG HG2 1.0 1.6 6.0 1416 857 A 24 GLU H A 27 ARG HG3 1.0 1.6 6.0 1417 858 A 64 GLN HBy A 66 GLY HAx 1.0 1.9 6.0 1418 858 A 64 GLN HBx A 66 GLY HAx 1.0 1.9 6.0 1419 859 A 40 GLU HG3 A 44 ARG HDx 1.0 2.0 6.0 1420 859 A 40 GLU HG2 A 44 ARG HDx 1.0 2.0 6.0 1421 860 A 40 GLU HG3 A 44 ARG HDy 1.0 2.0 6.0 1422 860 A 40 GLU HG2 A 44 ARG HDy 1.0 2.0 6.0 1423 861 A 24 GLU H A 27 ARG HD2 1.0 1.6 6.0 1424 861 A 24 GLU H A 27 ARG HD3 1.0 1.6 6.0 1425 862 A 30 PHE HB2 A 21 LEU HBx 1.0 2.0 6.0 1426 862 A 30 PHE HB3 A 21 LEU HBy 1.0 2.0 6.0 1427 862 A 30 PHE HB2 A 21 LEU HBy 1.0 2.0 6.0 1428 863 A 13 HIS HBx A 16 SER HB2 1.0 0.1 6.0 1429 863 A 13 HIS HBx A 16 SER HB3 1.0 0.1 6.0 1430 864 A 8 GLY HAx A 12 ALA HA 1.0 2.0 6.0 1431 865 A 13 HIS HBx A 17 LEU HBy 1.0 0.3 6.0 1432 865 A 13 HIS HBx A 17 LEU HBx 1.0 0.3 6.0 1433 866 A 33 PRO HGx A 18 GLY HAx 1.0 2.0 5.2 1434 866 A 33 PRO HGy A 18 GLY HAx 1.0 2.0 5.2 1435 867 A 29 ARG HGy A 23 VAL HA 1.0 1.5 6.0 1436 867 A 29 ARG HGx A 23 VAL HA 1.0 1.5 6.0 1437 868 A 32 ALA HA A 19 VAL H 1.0 1.0 6.0 1438 869 A 33 PRO HDx A 36 VAL HA 1.0 0.0 6.0 1439 870 A 32 ALA HA A 36 VAL HB 1.0 0.9 6.0 1440 871 A 13 HIS HE1 A 41 LEU HA 1.0 0.2 6.0 1441 872 A 13 HIS HE1 A 41 LEU HG 1.0 1.6 6.0 1442 873 A 42 GLN HA A 45 LEU HG 1.0 1.9 6.0 1443 874 A 48 ALA HA A 52 LEU HG 1.0 1.6 6.0 1444 875 A 53 ILE HA A 56 LEU HG 1.0 1.9 6.0 1445 876 A 56 LEU HBx A 60 GLN HG2 1.0 2.0 6.0 1446 876 A 56 LEU HBy A 60 GLN HG3 1.0 2.0 6.0 1447 876 A 56 LEU HBx A 60 GLN HG3 1.0 2.0 6.0 1448 877 A 73 ALA HA A 71 PRO HBy 1.0 1.9 6.0 1449 877 A 73 ALA HA A 71 PRO HBx 1.0 1.9 6.0 1450 878 A 22 TRP HE1 A 22 TRP H 1.0 2.0 6.0 1451 879 A 22 TRP HE1 A 22 TRP HD1 1.0 1.7 3.3 1452 880 A 22 TRP HZ2 A 22 TRP HE1 1.0 1.8 3.8 1453 881 A 18 GLY H A 18 GLY HAy 1.0 1.8 3.8 1454 882 A 18 GLY HAx A 18 GLY H 1.0 1.6 3.0 1455 883 A 17 LEU HA A 17 LEU H 1.0 1.8 3.4 1456 884 A 17 LEU HBy A 17 LEU H 1.0 1.7 3.1 1457 884 A 17 LEU HBx A 17 LEU H 1.0 1.7 3.1 1458 885 A 17 LEU HG A 17 LEU H 1.0 1.6 2.8 1459 886 A 16 SER H A 16 SER HA 1.0 1.7 3.5 1460 887 A 16 SER H A 16 SER HB3 1.0 1.7 3.1 1461 887 A 16 SER HB2 A 16 SER H 1.0 1.7 3.1 1462 888 A 14 ALA HA A 14 ALA H 1.0 1.9 3.9 1463 889 A 13 HIS HE1 A 13 HIS H 1.0 1.9 6.0 1464 890 A 13 HIS H A 13 HIS HA 1.0 1.8 3.8 1465 891 A 13 HIS H A 13 HIS HBx 1.0 1.6 2.8 1466 891 A 13 HIS H A 13 HIS HBy 1.0 1.6 2.8 1467 892 A 31 GLN H A 31 GLN HA 1.0 1.9 3.9 1468 893 A 31 GLN H A 31 GLN HGy 1.0 2.0 5.6 1469 893 A 31 GLN H A 31 GLN HGx 1.0 2.0 5.6 1470 894 A 31 GLN H A 31 GLN HB2 1.0 1.8 3.6 1471 894 A 31 GLN HB3 A 31 GLN H 1.0 1.8 3.6 1472 895 A 26 GLU HA A 26 GLU H 1.0 1.9 3.9 1473 896 A 26 GLU H A 26 GLU HB2 1.0 1.8 3.8 1474 896 A 26 GLU H A 26 GLU HB3 1.0 1.8 3.8 1475 897 A 3 LEU HA A 3 LEU H 1.0 2.0 5.8 1476 898 A 32 ALA H A 32 ALA HA 1.0 2.0 4.8 1477 899 A 20 ARG H A 20 ARG HD3 1.0 2.0 6.0 1478 899 A 20 ARG H A 20 ARG HD2 1.0 2.0 6.0 1479 900 A 20 ARG HA A 20 ARG H 1.0 1.9 4.1 1480 901 A 24 GLU H A 24 GLU HGy 1.0 2.0 6.0 1481 901 A 24 GLU H A 24 GLU HGx 1.0 2.0 6.0 1482 902 A 4 GLY H A 4 GLY HA3 1.0 2.0 5.2 1483 902 A 4 GLY HA2 A 4 GLY H 1.0 2.0 5.2 1484 903 A 78 LEU H A 78 LEU HA 1.0 1.9 4.9 1485 904 A 9 ALA HA A 9 ALA H 1.0 1.8 3.8 1486 905 A 8 GLY HAy A 8 GLY H 1.0 1.7 3.3 1487 906 A 8 GLY H A 8 GLY HAx 1.0 1.9 4.1 1488 907 A 28 LEU H A 28 LEU HBx 1.0 1.7 2.9 1489 907 A 28 LEU H A 28 LEU HBy 1.0 1.7 2.9 1490 908 A 58 GLN HA A 58 GLN H 1.0 1.8 3.8 1491 909 A 58 GLN H A 58 GLN HBx 1.0 1.7 3.3 1492 909 A 58 GLN HBy A 58 GLN H 1.0 1.7 3.3 1493 910 A 57 ARG H A 57 ARG HD3 1.0 2.0 6.0 1494 910 A 57 ARG H A 57 ARG HD2 1.0 2.0 6.0 1495 911 A 57 ARG HA A 57 ARG H 1.0 1.7 3.3 1496 912 A 57 ARG H A 57 ARG HGx 1.0 1.9 4.5 1497 912 A 57 ARG H A 57 ARG HGy 1.0 1.9 4.5 1498 913 A 57 ARG H A 57 ARG HB3 1.0 1.6 2.6 1499 913 A 57 ARG H A 57 ARG HB2 1.0 1.6 2.6 1500 914 A 11 LEU HA A 11 LEU H 1.0 1.8 3.6 1501 915 A 10 LEU H A 10 LEU HA 1.0 1.7 3.5 1502 916 A 10 LEU H A 10 LEU HB2 1.0 1.6 2.8 1503 916 A 10 LEU H A 10 LEU HBy 1.0 1.6 2.8 1504 917 A 12 ALA HA A 12 ALA H 1.0 1.8 3.6 1505 918 A 72 VAL H A 72 VAL HA 1.0 2.0 4.6 1506 919 A 72 VAL HB A 72 VAL H 1.0 1.9 4.1 1507 920 A 19 VAL H A 19 VAL HB 1.0 1.7 3.3 1508 921 A 44 ARG HA A 44 ARG H 1.0 1.6 3.0 1509 922 A 44 ARG H A 44 ARG HDy 1.0 1.9 6.0 1510 922 A 44 ARG H A 44 ARG HDx 1.0 1.9 6.0 1511 923 A 44 ARG HGy A 44 ARG H 1.0 1.6 2.8 1512 923 A 44 ARG HGx A 44 ARG H 1.0 1.6 2.8 1513 924 A 45 LEU HA A 45 LEU H 1.0 1.8 3.8 1514 925 A 45 LEU H A 45 LEU HB3 1.0 1.7 2.9 1515 925 A 45 LEU H A 45 LEU HB2 1.0 1.7 2.9 1516 926 A 46 GLY HAy A 46 GLY H 1.0 1.8 3.6 1517 927 A 46 GLY H A 46 GLY HAx 1.0 1.7 3.1 1518 928 A 43 SER H A 43 SER HA 1.0 1.8 3.6 1519 929 A 43 SER H A 43 SER HB3 1.0 1.6 3.0 1520 929 A 43 SER HB2 A 43 SER H 1.0 1.6 3.0 1521 930 A 15 ALA HA A 15 ALA H 1.0 1.8 3.8 1522 931 A 42 GLN HA A 42 GLN H 1.0 1.8 3.8 1523 932 A 42 GLN HGy A 42 GLN H 1.0 1.9 4.7 1524 932 A 42 GLN HGx A 42 GLN H 1.0 1.9 4.7 1525 933 A 42 GLN HB3 A 42 GLN H 1.0 1.6 2.8 1526 933 A 42 GLN HB2 A 42 GLN H 1.0 1.6 2.8 1527 934 A 53 ILE H A 53 ILE HB 1.0 1.5 2.7 1528 935 A 53 ILE H A 53 ILE HA 1.0 1.8 4.0 1529 936 A 54 ALA H A 54 ALA HA 1.0 1.7 3.3 1530 937 A 49 ARG H A 49 ARG HA 1.0 1.8 3.4 1531 938 A 49 ARG H A 49 ARG HD2 1.0 2.0 6.0 1532 938 A 49 ARG HD3 A 49 ARG H 1.0 2.0 6.0 1533 939 A 49 ARG H A 49 ARG HBx 1.0 1.7 3.1 1534 939 A 49 ARG H A 49 ARG HBy 1.0 1.7 3.1 1535 940 A 49 ARG H A 49 ARG HGy 1.0 1.8 3.4 1536 940 A 49 ARG H A 49 ARG HGx 1.0 1.8 3.4 1537 941 A 50 HIS HA A 50 HIS H 1.0 1.9 4.1 1538 942 A 50 HIS HB2 A 50 HIS H 1.0 1.8 3.6 1539 942 A 50 HIS HB3 A 50 HIS H 1.0 1.8 3.6 1540 943 A 51 GLU H A 51 GLU HA 1.0 1.8 3.8 1541 944 A 51 GLU H A 51 GLU HGy 1.0 2.0 4.8 1542 944 A 51 GLU H A 51 GLU HGx 1.0 2.0 4.8 1543 945 A 51 GLU H A 51 GLU HB2 1.0 1.7 3.3 1544 945 A 51 GLU HB3 A 51 GLU H 1.0 1.7 3.3 1545 946 A 58 GLN HA A 58 GLN HE21 1.0 1.9 6.0 1546 947 A 58 GLN HE21 A 58 GLN HE22 1.0 1.5 2.3 1547 948 A 58 GLN HE21 A 58 GLN HGy 1.0 1.9 4.5 1548 948 A 58 GLN HE21 A 58 GLN HGx 1.0 1.9 4.5 1549 949 A 58 GLN HE22 A 58 GLN HGy 1.0 2.0 6.0 1550 949 A 58 GLN HE22 A 58 GLN HGx 1.0 2.0 6.0 1551 950 A 58 GLN HE21 A 58 GLN HBx 1.0 1.9 5.3 1552 950 A 58 GLN HE21 A 58 GLN HBy 1.0 1.9 5.3 1553 951 A 58 GLN HBx A 58 GLN HE22 1.0 2.0 5.8 1554 951 A 58 GLN HBy A 58 GLN HE22 1.0 2.0 5.8 1555 952 A 42 GLN HGx A 42 GLN HE22 1.0 1.9 5.1 1556 952 A 42 GLN HGy A 42 GLN HE22 1.0 1.9 5.1 1557 953 A 42 GLN HGx A 42 GLN HE21 1.0 1.9 4.1 1558 953 A 42 GLN HGy A 42 GLN HE21 1.0 1.9 4.1 1559 954 A 42 GLN HB3 A 42 GLN HE22 1.0 2.0 6.0 1560 954 A 42 GLN HB2 A 42 GLN HE22 1.0 2.0 6.0 1561 955 A 42 GLN HB3 A 42 GLN HE21 1.0 2.0 5.4 1562 955 A 42 GLN HB2 A 42 GLN HE21 1.0 2.0 5.4 1563 956 A 42 GLN HE22 A 42 GLN HE21 1.0 1.3 2.2 1564 957 A 27 ARG HA A 27 ARG H 1.0 1.8 3.8 1565 958 A 27 ARG H A 27 ARG HD2 1.0 2.0 6.0 1566 958 A 27 ARG H A 27 ARG HD3 1.0 2.0 6.0 1567 959 A 47 GLY H A 47 GLY HA2 1.0 1.5 2.7 1568 960 A 41 LEU H A 41 LEU HA 1.0 1.8 3.6 1569 961 A 41 LEU H A 41 LEU HBx 1.0 1.6 3.0 1570 961 A 41 LEU H A 41 LEU HBy 1.0 1.6 3.0 1571 962 A 40 GLU HA A 40 GLU H 1.0 1.8 3.6 1572 963 A 40 GLU H A 40 GLU HG3 1.0 2.0 5.4 1573 963 A 40 GLU H A 40 GLU HG2 1.0 2.0 5.4 1574 964 A 40 GLU H A 40 GLU HBx 1.0 1.8 3.4 1575 964 A 40 GLU H A 40 GLU HBy 1.0 1.8 3.4 1576 965 A 36 VAL HA A 36 VAL H 1.0 1.7 3.5 1577 966 A 36 VAL H A 36 VAL HB 1.0 1.8 3.8 1578 967 A 55 LEU HA A 55 LEU H 1.0 1.7 3.1 1579 968 A 55 LEU H A 55 LEU HBy 1.0 1.7 2.9 1580 968 A 55 LEU H A 55 LEU HBx 1.0 1.7 2.9 1581 969 A 56 LEU HA A 56 LEU H 1.0 1.8 3.6 1582 970 A 37 MET HBy A 37 MET H 1.0 1.6 2.8 1583 970 A 37 MET HBx A 37 MET H 1.0 1.6 2.8 1584 971 A 56 LEU HBx A 56 LEU H 1.0 1.4 2.2 1585 971 A 56 LEU HBy A 56 LEU H 1.0 1.4 2.2 1586 972 A 22 TRP HE1 A 22 TRP HZ3 1.0 0.0 6.0 1587 973 A 22 TRP HE1 A 22 TRP HBy 1.0 1.9 6.0 1588 973 A 22 TRP HE1 A 22 TRP HBx 1.0 1.9 6.0 1589 974 A 22 TRP HE3 A 22 TRP H 1.0 1.9 4.3 1590 975 A 23 VAL HA A 23 VAL H 1.0 1.7 3.3 1591 976 A 23 VAL HB A 23 VAL H 1.0 1.7 3.5 1592 977 A 59 LEU H A 59 LEU HA 1.0 1.9 4.5 1593 978 A 7 ALA HA A 7 ALA H 1.0 2.0 4.8 1594 979 A 69 LEU HA A 69 LEU H 1.0 1.7 3.3 1595 980 A 68 LEU HB3 A 68 LEU H 1.0 1.8 3.8 1596 980 A 68 LEU HB2 A 68 LEU H 1.0 1.8 3.8 1597 981 A 75 ASN HA A 75 ASN H 1.0 2.0 5.4 1598 982 A 75 ASN HB3 A 75 ASN H 1.0 1.9 5.7 1599 982 A 75 ASN HB2 A 75 ASN H 1.0 1.9 5.7 1600 983 A 73 ALA HA A 73 ALA H 1.0 2.0 5.2 1601 984 A 76 GLY HAy A 76 GLY H 1.0 1.9 4.9 1602 985 A 76 GLY H A 76 GLY HAx 1.0 2.0 5.4 1603 986 A 77 ARG H A 77 ARG HB3 1.0 2.0 6.0 1604 986 A 77 ARG H A 77 ARG HB2 1.0 2.0 6.0 1605 987 A 29 ARG H A 29 ARG HDy 1.0 1.9 5.1 1606 987 A 29 ARG H A 29 ARG HDx 1.0 1.9 5.1 1607 988 A 29 ARG HGy A 29 ARG H 1.0 1.9 4.5 1608 988 A 29 ARG HGx A 29 ARG H 1.0 1.9 4.5 1609 989 A 29 ARG HBy A 29 ARG H 1.0 1.8 3.8 1610 989 A 29 ARG HBx A 29 ARG H 1.0 1.8 3.8 1611 990 A 25 GLY HAy A 25 GLY H 1.0 2.0 6.0 1612 991 A 25 GLY HAx A 25 GLY H 1.0 2.0 6.0 1613 992 A 52 LEU HA A 52 LEU H 1.0 1.7 3.1 1614 993 A 52 LEU HBy A 52 LEU H 1.0 1.6 2.8 1615 993 A 52 LEU HBx A 52 LEU H 1.0 1.6 2.8 1616 994 A 26 GLU H A 26 GLU HGy 1.0 2.0 5.6 1617 994 A 26 GLU H A 26 GLU HGx 1.0 2.0 5.6 1618 995 A 37 MET HA A 37 MET H 1.0 1.7 3.3 1619 996 A 19 VAL HA A 19 VAL H 1.0 1.7 3.1 1620 997 A 20 ARG HBy A 20 ARG H 1.0 1.5 2.7 1621 997 A 20 ARG HBx A 20 ARG H 1.0 1.5 2.7 1622 998 A 21 LEU HA A 21 LEU H 1.0 1.9 4.7 1623 999 A 22 TRP HZ3 A 22 TRP H 1.0 1.8 6.0 1624 1000 A 22 TRP H A 22 TRP HA 1.0 2.0 4.6 1625 1001 A 28 LEU H A 28 LEU HG 1.0 2.0 5.4 1626 1002 A 29 ARG H A 29 ARG HA 1.0 1.9 4.1 1627 1003 A 30 PHE HB3 A 30 PHE H 1.0 2.0 5.8 1628 1003 A 30 PHE HB2 A 30 PHE H 1.0 2.0 5.8 1629 1004 A 30 PHE HA A 30 PHE H 1.0 2.0 5.6 1630 1005 A 75 ASN HB2 A 75 ASN HD22 1.0 1.7 6.0 1631 1005 A 75 ASN HB3 A 75 ASN HD22 1.0 1.7 6.0 1632 1006 A 60 GLN HE21 A 60 GLN HG2 1.0 1.9 4.1 1633 1006 A 60 GLN HE21 A 60 GLN HG3 1.0 1.9 4.1 1634 1007 A 60 GLN HBx A 60 GLN HE21 1.0 2.0 5.0 1635 1007 A 60 GLN HBy A 60 GLN HE21 1.0 2.0 5.0 1636 1008 A 60 GLN HE22 A 60 GLN HG2 1.0 2.0 6.0 1637 1008 A 60 GLN HE22 A 60 GLN HG3 1.0 2.0 6.0 1638 1009 A 60 GLN HBx A 60 GLN HE22 1.0 2.0 6.0 1639 1009 A 60 GLN HBy A 60 GLN HE22 1.0 2.0 6.0 1640 1010 A 64 GLN HE22 A 64 GLN HG2 1.0 1.8 6.0 1641 1010 A 64 GLN HE22 A 64 GLN HG3 1.0 1.8 6.0 1642 1011 A 64 GLN HG2 A 64 GLN HE21 1.0 1.9 6.0 1643 1011 A 64 GLN HG3 A 64 GLN HE21 1.0 1.9 6.0 1644 1012 A 64 GLN HE22 A 64 GLN HE21 1.0 1.4 2.2 1645 1013 A 58 GLN HE21 A 58 GLN H 1.0 1.9 6.0 1646 1014 A 58 GLN H A 58 GLN HGy 1.0 1.9 4.5 1647 1014 A 58 GLN H A 58 GLN HGx 1.0 1.9 4.5 1648 1015 A 60 GLN HA A 60 GLN H 1.0 1.9 4.9 1649 1016 A 60 GLN HBy A 60 GLN H 1.0 1.8 4.0 1650 1016 A 60 GLN HBx A 60 GLN H 1.0 1.8 4.0 1651 1017 A 60 GLN HG3 A 60 GLN H 1.0 2.0 6.0 1652 1017 A 60 GLN HG2 A 60 GLN H 1.0 2.0 6.0 1653 1018 A 35 GLY HAy A 35 GLY H 1.0 1.9 6.0 1654 1019 A 35 GLY HAx A 35 GLY H 1.0 2.0 6.0 1655 1020 A 20 ARG H A 20 ARG HGx 1.0 2.0 5.0 1656 1020 A 20 ARG H A 20 ARG HGy 1.0 2.0 5.0 1657 1021 A 24 GLU HA A 24 GLU H 1.0 0.0 6.0 1658 1022 A 24 GLU H A 24 GLU HBx 1.0 1.7 3.1 1659 1022 A 24 GLU H A 24 GLU HBy 1.0 1.7 3.1 1660 1023 A 37 MET HGy A 37 MET H 1.0 2.0 6.0 1661 1023 A 37 MET HGx A 37 MET H 1.0 2.0 6.0 1662 1024 A 38 THR HB A 38 THR H 1.0 2.0 4.4 1663 1025 A 47 GLY HA3 A 47 GLY H 1.0 0.0 6.0 1664 1026 A 48 ALA HA A 48 ALA H 1.0 1.9 3.9 1665 1027 A 11 LEU HBy A 11 LEU H 1.0 1.6 2.8 1666 1027 A 11 LEU HB2 A 11 LEU H 1.0 1.6 2.8 1667 1028 A 64 GLN HA A 64 GLN H 1.0 1.9 4.5 1668 1029 A 67 SER HA A 67 SER H 1.0 2.0 6.0 1669 1030 A 67 SER HBy A 67 SER H 1.0 2.0 6.0 1670 1030 A 67 SER HBx A 67 SER H 1.0 2.0 6.0 1671 1031 A 68 LEU HA A 68 LEU H 1.0 1.9 4.3 1672 1032 A 69 LEU H A 69 LEU HB2 1.0 1.8 3.4 1673 1032 A 69 LEU H A 69 LEU HB3 1.0 1.8 3.4 1674 1033 A 70 ALA H A 70 ALA HA 1.0 1.9 4.3 1675 1034 A 77 ARG HA A 77 ARG H 1.0 1.9 6.0 1676 1035 A 28 LEU HA A 28 LEU H 1.0 1.8 3.8 1677 1036 A 31 GLN HGy A 31 GLN HE22 1.0 2.0 6.0 1678 1036 A 31 GLN HGx A 31 GLN HE22 1.0 2.0 6.0 1679 1037 A 31 GLN HB3 A 31 GLN HE22 1.0 1.7 6.0 1680 1037 A 31 GLN HB2 A 31 GLN HE22 1.0 1.7 6.0 1681 1038 A 31 GLN HGy A 31 GLN HE21 1.0 2.0 6.0 1682 1038 A 31 GLN HGx A 31 GLN HE21 1.0 2.0 6.0 1683 1039 A 31 GLN HB3 A 31 GLN HE21 1.0 1.8 6.0 1684 1039 A 31 GLN HB2 A 31 GLN HE21 1.0 1.8 6.0 1685 1040 A 31 GLN HE22 A 31 GLN HE21 1.0 1.5 2.5 1686 1041 A 60 GLN HE22 A 60 GLN HE21 1.0 1.4 2.4 1687 1042 A 41 LEU H A 41 LEU HG 1.0 1.9 6.0 1688 1043 A 64 GLN HE22 A 64 GLN H 1.0 1.5 6.0 1689 1044 A 75 ASN HD22 A 75 ASN HD21 1.0 1.7 3.3 1690 1045 A 17 LEU HBy A 18 GLY H 1.0 1.9 4.1 1691 1045 A 17 LEU HBx A 18 GLY H 1.0 1.9 4.1 1692 1046 A 17 LEU HG A 18 GLY H 1.0 2.0 5.4 1693 1047 A 17 LEU H A 18 GLY H 1.0 1.7 3.3 1694 1048 A 17 LEU H A 16 SER H 1.0 1.8 3.6 1695 1049 A 17 LEU H A 16 SER HB2 1.0 1.9 4.3 1696 1049 A 17 LEU H A 16 SER HB3 1.0 1.9 4.3 1697 1050 A 13 HIS H A 14 ALA H 1.0 1.8 3.6 1698 1051 A 13 HIS HE1 A 14 ALA H 1.0 2.0 6.0 1699 1052 A 14 ALA H A 13 HIS HA 1.0 1.9 4.7 1700 1053 A 13 HIS HBx A 14 ALA H 1.0 1.9 3.7 1701 1053 A 13 HIS HBy A 14 ALA H 1.0 1.9 3.7 1702 1054 A 30 PHE HA A 31 GLN H 1.0 1.6 2.8 1703 1055 A 30 PHE HB3 A 31 GLN H 1.0 2.0 4.4 1704 1055 A 30 PHE HB2 A 31 GLN H 1.0 2.0 4.4 1705 1056 A 30 PHE HZ A 31 GLN H 1.0 1.9 6.0 1706 1057 A 26 GLU H A 25 GLY HAx 1.0 2.0 5.0 1707 1058 A 26 GLU H A 25 GLY HAy 1.0 1.7 3.3 1708 1059 A 2 PRO HA A 3 LEU H 1.0 1.9 4.9 1709 1060 A 32 ALA H A 31 GLN HA 1.0 1.6 3.0 1710 1061 A 32 ALA H A 31 GLN HGx 1.0 2.0 5.6 1711 1061 A 32 ALA H A 31 GLN HGy 1.0 2.0 5.6 1712 1062 A 32 ALA H A 31 GLN HB3 1.0 2.0 6.0 1713 1062 A 32 ALA H A 31 GLN HB2 1.0 2.0 6.0 1714 1063 A 19 VAL HA A 20 ARG H 1.0 1.7 2.9 1715 1064 A 19 VAL H A 20 ARG H 1.0 1.9 6.0 1716 1065 A 23 VAL HB A 24 GLU H 1.0 1.9 4.7 1717 1066 A 4 GLY H A 3 LEU HA 1.0 2.0 5.2 1718 1067 A 77 ARG HA A 78 LEU H 1.0 1.8 3.8 1719 1068 A 77 ARG HB3 A 78 LEU H 1.0 1.9 4.5 1720 1068 A 77 ARG HB2 A 78 LEU H 1.0 1.9 4.5 1721 1069 A 77 ARG HG2 A 78 LEU H 1.0 1.8 4.0 1722 1069 A 77 ARG HG3 A 78 LEU H 1.0 1.8 4.0 1723 1070 A 70 ALA H A 69 LEU HB3 1.0 2.0 4.8 1724 1070 A 70 ALA H A 69 LEU HB2 1.0 2.0 4.8 1725 1071 A 70 ALA H A 69 LEU HA 1.0 1.7 3.5 1726 1072 A 9 ALA H A 8 GLY HAy 1.0 1.8 4.0 1727 1073 A 9 ALA H A 8 GLY HAx 1.0 2.0 5.2 1728 1074 A 9 ALA H A 8 GLY H 1.0 1.8 3.8 1729 1075 A 8 GLY H A 7 ALA H 1.0 1.9 4.9 1730 1076 A 8 GLY H A 7 ALA HA 1.0 1.9 4.5 1731 1077 A 28 LEU H A 27 ARG HBy 1.0 1.9 4.7 1732 1077 A 28 LEU H A 27 ARG HBx 1.0 1.9 4.7 1733 1078 A 28 LEU H A 27 ARG HD2 1.0 1.9 4.7 1734 1078 A 28 LEU H A 27 ARG HD3 1.0 1.9 4.7 1735 1079 A 28 LEU H A 27 ARG HA 1.0 1.6 2.8 1736 1080 A 28 LEU H A 27 ARG H 1.0 2.0 5.6 1737 1081 A 29 ARG H A 28 LEU H 1.0 2.0 5.4 1738 1082 A 66 GLY HAx A 67 SER H 1.0 1.9 4.3 1739 1083 A 57 ARG HA A 58 GLN H 1.0 1.8 3.8 1740 1084 A 58 GLN H A 57 ARG HD2 1.0 2.0 5.2 1741 1084 A 58 GLN H A 57 ARG HD3 1.0 2.0 5.2 1742 1085 A 58 GLN H A 57 ARG HB2 1.0 1.7 3.5 1743 1085 A 58 GLN H A 57 ARG HB3 1.0 1.7 3.5 1744 1086 A 58 GLN H A 57 ARG HGy 1.0 2.0 5.0 1745 1086 A 58 GLN H A 57 ARG HGx 1.0 2.0 5.0 1746 1087 A 57 ARG H A 56 LEU H 1.0 1.7 3.5 1747 1088 A 57 ARG H A 56 LEU HBx 1.0 1.9 4.5 1748 1088 A 57 ARG H A 56 LEU HBy 1.0 1.9 4.5 1749 1089 A 10 LEU HB2 A 11 LEU H 1.0 1.6 2.8 1750 1089 A 10 LEU HBy A 11 LEU H 1.0 1.6 2.8 1751 1090 A 11 LEU HB2 A 12 ALA H 1.0 1.8 3.4 1752 1090 A 11 LEU HBy A 12 ALA H 1.0 1.8 3.4 1753 1091 A 11 LEU HA A 12 ALA H 1.0 1.9 4.3 1754 1092 A 72 VAL H A 71 PRO HA 1.0 1.8 3.4 1755 1093 A 72 VAL H A 71 PRO HBy 1.0 1.9 4.3 1756 1093 A 72 VAL H A 71 PRO HBx 1.0 1.9 4.3 1757 1094 A 19 VAL H A 18 GLY HAx 1.0 1.8 3.8 1758 1095 A 19 VAL H A 18 GLY HAy 1.0 2.0 4.8 1759 1096 A 43 SER H A 44 ARG H 1.0 1.7 3.1 1760 1097 A 43 SER HA A 44 ARG H 1.0 1.9 4.5 1761 1098 A 45 LEU H A 44 ARG H 1.0 1.7 3.3 1762 1099 A 45 LEU H A 44 ARG HA 1.0 1.8 4.0 1763 1100 A 45 LEU H A 44 ARG HB3 1.0 1.7 3.1 1764 1100 A 45 LEU H A 44 ARG HB2 1.0 1.7 3.1 1765 1101 A 45 LEU HB3 A 46 GLY H 1.0 1.7 3.3 1766 1101 A 45 LEU HB2 A 46 GLY H 1.0 1.7 3.3 1767 1102 A 43 SER H A 42 GLN HA 1.0 2.0 5.0 1768 1103 A 43 SER H A 42 GLN HGx 1.0 2.0 4.6 1769 1103 A 43 SER H A 42 GLN HGy 1.0 2.0 4.6 1770 1104 A 43 SER H A 42 GLN HB2 1.0 1.7 3.3 1771 1104 A 43 SER H A 42 GLN HB3 1.0 1.7 3.3 1772 1105 A 41 LEU H A 42 GLN H 1.0 1.8 3.4 1773 1106 A 14 ALA HA A 15 ALA H 1.0 1.9 4.3 1774 1107 A 53 ILE H A 52 LEU HBy 1.0 1.9 4.1 1775 1107 A 53 ILE H A 52 LEU HBx 1.0 1.9 4.1 1776 1108 A 53 ILE H A 52 LEU HA 1.0 1.9 4.3 1777 1109 A 53 ILE H A 54 ALA H 1.0 1.8 3.6 1778 1110 A 53 ILE HA A 54 ALA H 1.0 1.9 5.1 1779 1111 A 54 ALA H A 53 ILE HB 1.0 1.6 3.0 1780 1112 A 48 ALA HA A 49 ARG H 1.0 1.8 4.0 1781 1113 A 50 HIS H A 49 ARG HBy 1.0 1.9 4.5 1782 1113 A 50 HIS H A 49 ARG HBx 1.0 1.9 4.5 1783 1114 A 50 HIS H A 49 ARG HGx 1.0 1.8 4.0 1784 1114 A 50 HIS H A 49 ARG HGy 1.0 1.8 4.0 1785 1115 A 50 HIS H A 51 GLU H 1.0 1.6 3.0 1786 1116 A 50 HIS HB3 A 51 GLU H 1.0 1.9 4.1 1787 1116 A 50 HIS HB2 A 51 GLU H 1.0 1.9 4.1 1788 1117 A 50 HIS HA A 51 GLU H 1.0 1.9 4.5 1789 1118 A 34 PRO HA A 35 GLY H 1.0 1.9 4.9 1790 1119 A 26 GLU H A 27 ARG H 1.0 1.7 3.3 1791 1120 A 26 GLU HA A 27 ARG H 1.0 1.9 4.3 1792 1121 A 26 GLU HB2 A 27 ARG H 1.0 1.9 3.9 1793 1121 A 26 GLU HB3 A 27 ARG H 1.0 1.9 3.9 1794 1122 A 41 LEU H A 40 GLU H 1.0 1.8 3.8 1795 1123 A 41 LEU H A 40 GLU HG3 1.0 2.0 5.0 1796 1123 A 41 LEU H A 40 GLU HG2 1.0 2.0 5.0 1797 1124 A 39 PRO HA A 40 GLU H 1.0 2.0 5.0 1798 1125 A 37 MET HA A 38 THR H 1.0 0.0 6.0 1799 1126 A 37 MET HGy A 38 THR H 1.0 2.0 6.0 1800 1127 A 37 MET HBy A 38 THR H 1.0 1.9 4.3 1801 1127 A 37 MET HBx A 38 THR H 1.0 1.9 4.3 1802 1128 A 37 MET H A 38 THR H 1.0 1.9 4.3 1803 1129 A 36 VAL H A 35 GLY HAy 1.0 1.9 4.5 1804 1130 A 36 VAL H A 35 GLY HAx 1.0 1.9 4.1 1805 1131 A 54 ALA H A 55 LEU H 1.0 1.8 3.6 1806 1132 A 22 TRP H A 21 LEU HA 1.0 1.7 3.1 1807 1133 A 22 TRP H A 21 LEU HBx 1.0 1.9 3.9 1808 1133 A 22 TRP H A 21 LEU HBy 1.0 1.9 3.9 1809 1134 A 22 TRP HD1 A 23 VAL H 1.0 2.0 5.0 1810 1135 A 22 TRP HA A 23 VAL H 1.0 1.7 3.1 1811 1136 A 22 TRP HBy A 23 VAL H 1.0 1.8 3.8 1812 1136 A 22 TRP HBx A 23 VAL H 1.0 1.8 3.8 1813 1137 A 58 GLN HGy A 59 LEU H 1.0 1.8 4.0 1814 1137 A 58 GLN HGx A 59 LEU H 1.0 1.8 4.0 1815 1138 A 58 GLN HA A 59 LEU H 1.0 2.0 5.2 1816 1139 A 66 GLY H A 65 GLY HAy 1.0 1.8 3.6 1817 1140 A 67 SER HBy A 68 LEU H 1.0 2.0 5.8 1818 1140 A 67 SER HBx A 68 LEU H 1.0 2.0 5.8 1819 1141 A 67 SER HA A 68 LEU H 1.0 1.8 3.6 1820 1142 A 73 ALA HA A 74 ARG H 1.0 2.0 5.0 1821 1143 A 75 ASN H A 74 ARG HA 1.0 2.0 4.4 1822 1144 A 75 ASN H A 74 ARG HBx 1.0 2.0 6.0 1823 1144 A 75 ASN H A 74 ARG HBy 1.0 2.0 6.0 1824 1145 A 72 VAL HA A 73 ALA H 1.0 1.8 3.8 1825 1146 A 75 ASN HB2 A 76 GLY H 1.0 2.0 5.2 1826 1146 A 75 ASN HB3 A 76 GLY H 1.0 2.0 5.2 1827 1147 A 76 GLY HAy A 77 ARG H 1.0 2.0 4.6 1828 1148 A 29 ARG H A 28 LEU HA 1.0 1.6 2.6 1829 1149 A 52 LEU H A 51 GLU HB2 1.0 1.8 3.4 1830 1149 A 52 LEU H A 51 GLU HB3 1.0 1.8 3.4 1831 1150 A 45 LEU HA A 46 GLY H 1.0 1.8 3.6 1832 1151 A 29 ARG H A 28 LEU HBy 1.0 2.0 5.2 1833 1151 A 29 ARG H A 28 LEU HBx 1.0 2.0 5.2 1834 1152 A 23 VAL HA A 24 GLU H 1.0 1.5 2.5 1835 1153 A 54 ALA HA A 55 LEU H 1.0 1.8 3.8 1836 1154 A 13 HIS H A 12 ALA HA 1.0 1.9 4.5 1837 1155 A 21 LEU H A 20 ARG HA 1.0 1.7 3.3 1838 1156 A 21 LEU H A 20 ARG HD2 1.0 1.7 6.0 1839 1156 A 21 LEU H A 20 ARG HD3 1.0 1.7 6.0 1840 1157 A 29 ARG HBx A 30 PHE H 1.0 2.0 6.0 1841 1157 A 29 ARG HBy A 30 PHE H 1.0 2.0 6.0 1842 1158 A 29 ARG HA A 30 PHE H 1.0 1.8 4.0 1843 1159 A 58 GLN HBx A 59 LEU H 1.0 1.9 4.3 1844 1159 A 58 GLN HBy A 59 LEU H 1.0 1.9 4.3 1845 1160 A 41 LEU H A 40 GLU HBx 1.0 1.8 3.6 1846 1160 A 41 LEU H A 40 GLU HBy 1.0 1.8 3.6 1847 1161 A 30 PHE H A 31 GLN H 1.0 2.0 6.0 1848 1162 A 36 VAL H A 37 MET H 1.0 1.6 2.8 1849 1163 A 36 VAL HA A 37 MET H 1.0 1.8 3.6 1850 1164 A 36 VAL HB A 37 MET H 1.0 1.9 4.1 1851 1165 A 39 PRO HD3 A 40 GLU H 1.0 1.8 3.8 1852 1165 A 39 PRO HD2 A 40 GLU H 1.0 1.8 3.8 1853 1166 A 39 PRO HBy A 40 GLU H 1.0 1.8 3.6 1854 1166 A 39 PRO HBx A 40 GLU H 1.0 1.8 3.6 1855 1167 A 42 GLN H A 41 LEU HA 1.0 1.9 3.9 1856 1168 A 45 LEU H A 44 ARG HDx 1.0 2.0 5.4 1857 1168 A 45 LEU H A 44 ARG HDy 1.0 2.0 5.4 1858 1169 A 46 GLY HAx A 47 GLY H 1.0 1.9 4.1 1859 1169 A 46 GLY HAy A 47 GLY H 1.0 1.9 4.1 1860 1170 A 48 ALA H A 47 GLY H 1.0 1.8 3.4 1861 1171 A 48 ALA H A 47 GLY HA3 1.0 1.9 4.1 1862 1172 A 48 ALA H A 47 GLY HA2 1.0 1.8 3.4 1863 1173 A 50 HIS H A 49 ARG HA 1.0 2.0 6.0 1864 1174 A 50 HIS HE1 A 51 GLU H 1.0 1.9 3.9 1865 1175 A 64 GLN HA A 65 GLY H 1.0 2.0 6.0 1866 1176 A 72 VAL H A 71 PRO HDy 1.0 1.9 6.0 1867 1176 A 72 VAL H A 71 PRO HDx 1.0 1.9 6.0 1868 1177 A 72 VAL HB A 73 ALA H 1.0 2.0 6.0 1869 1178 A 16 SER H A 15 ALA HA 1.0 1.9 4.3 1870 1179 A 55 LEU HA A 56 LEU H 1.0 1.9 4.5 1871 1180 A 56 LEU H A 55 LEU HBx 1.0 1.7 3.1 1872 1180 A 56 LEU H A 55 LEU HBy 1.0 1.7 3.1 1873 1181 A 66 GLY H A 65 GLY HAx 1.0 2.0 6.0 1874 1182 A 66 GLY HAy A 67 SER H 1.0 1.9 6.0 1875 1183 A 6 SER HA A 7 ALA H 1.0 2.0 5.2 1876 1184 A 29 ARG H A 28 LEU HG 1.0 2.0 6.0 1877 1185 A 32 ALA H A 31 GLN H 1.0 1.9 6.0 1878 1186 A 41 LEU HBx A 42 GLN H 1.0 2.0 5.2 1879 1186 A 41 LEU HBy A 42 GLN H 1.0 2.0 5.2 1880 1187 A 48 ALA H A 49 ARG H 1.0 1.9 4.9 1881 1188 A 58 GLN HE21 A 59 LEU H 1.0 1.8 6.0 1882 1189 A 19 VAL HB A 18 GLY H 1.0 2.0 6.0 1883 1190 A 21 LEU H A 20 ARG H 1.0 2.0 6.0 1884 1191 A 10 LEU HB2 A 9 ALA H 1.0 2.0 6.0 1885 1191 A 10 LEU HBy A 9 ALA H 1.0 2.0 6.0 1886 1192 A 57 ARG H A 58 GLN H 1.0 1.8 3.4 1887 1193 A 57 ARG H A 58 GLN HGy 1.0 1.9 6.0 1888 1193 A 57 ARG H A 58 GLN HGx 1.0 1.9 6.0 1889 1194 A 57 ARG H A 58 GLN HBx 1.0 1.9 6.0 1890 1194 A 57 ARG H A 58 GLN HBy 1.0 1.9 6.0 1891 1195 A 12 ALA H A 11 LEU H 1.0 1.6 3.0 1892 1196 A 10 LEU H A 11 LEU H 1.0 1.8 3.4 1893 1197 A 13 HIS H A 12 ALA H 1.0 1.7 3.1 1894 1198 A 45 LEU H A 46 GLY H 1.0 1.8 3.4 1895 1199 A 43 SER H A 44 ARG HGy 1.0 2.0 6.0 1896 1199 A 43 SER H A 44 ARG HGx 1.0 2.0 6.0 1897 1200 A 50 HIS H A 49 ARG H 1.0 1.9 4.5 1898 1201 A 52 LEU H A 51 GLU H 1.0 1.6 3.0 1899 1202 A 52 LEU HBy A 51 GLU H 1.0 1.9 6.0 1900 1202 A 52 LEU HBx A 51 GLU H 1.0 1.9 6.0 1901 1203 A 48 ALA HA A 47 GLY H 1.0 1.8 6.0 1902 1204 A 41 LEU H A 42 GLN HA 1.0 1.9 6.0 1903 1205 A 36 VAL H A 37 MET HBy 1.0 2.0 6.0 1904 1205 A 36 VAL H A 37 MET HBx 1.0 2.0 6.0 1905 1206 A 55 LEU H A 56 LEU H 1.0 1.8 3.4 1906 1207 A 60 GLN HA A 59 LEU H 1.0 1.8 6.0 1907 1208 A 14 ALA H A 15 ALA H 1.0 1.6 3.0 1908 1209 A 16 SER H A 15 ALA H 1.0 1.6 2.6 1909 1210 A 22 TRP HE3 A 21 LEU H 1.0 2.0 6.0 1910 1211 A 22 TRP H A 21 LEU H 1.0 1.9 5.7 1911 1212 A 24 GLU H A 25 GLY H 1.0 1.8 6.0 1912 1213 A 29 ARG H A 30 PHE H 1.0 1.9 6.0 1913 1214 A 32 ALA H A 33 PRO HDy 1.0 1.8 6.0 1914 1215 A 38 THR H A 39 PRO HA 1.0 2.0 6.0 1915 1216 A 43 SER H A 42 GLN H 1.0 1.8 3.4 1916 1217 A 45 LEU HA A 44 ARG H 1.0 2.0 6.0 1917 1218 A 48 ALA H A 49 ARG HGy 1.0 2.0 6.0 1918 1218 A 48 ALA H A 49 ARG HGx 1.0 2.0 6.0 1919 1219 A 50 HIS HA A 49 ARG H 1.0 1.7 6.0 1920 1220 A 50 HIS H A 51 GLU HA 1.0 1.9 6.0 1921 1221 A 72 VAL H A 73 ALA H 1.0 2.0 6.0 1922 1222 A 10 LEU H A 9 ALA H 1.0 1.6 3.0 1923 1223 A 57 ARG H A 58 GLN HA 1.0 1.9 6.0 1924 1224 A 54 ALA H A 55 LEU HBy 1.0 1.9 6.0 1925 1224 A 54 ALA H A 55 LEU HBx 1.0 1.9 6.0 1926 1225 A 22 TRP HE1 A 29 ARG HDx 1.0 2.0 6.0 1927 1225 A 22 TRP HE1 A 29 ARG HDy 1.0 2.0 6.0 1928 1226 A 22 TRP HE1 A 24 GLU HGy 1.0 2.0 5.6 1929 1226 A 22 TRP HE1 A 24 GLU HGx 1.0 2.0 5.6 1930 1227 A 22 TRP HE1 A 24 GLU HBy 1.0 2.0 4.8 1931 1227 A 22 TRP HE1 A 24 GLU HBx 1.0 2.0 4.8 1932 1228 A 29 ARG HGy A 22 TRP HE1 1.0 2.0 5.6 1933 1228 A 29 ARG HGx A 22 TRP HE1 1.0 2.0 5.6 1934 1229 A 29 ARG HBy A 22 TRP HE1 1.0 2.0 6.0 1935 1229 A 29 ARG HBx A 22 TRP HE1 1.0 2.0 6.0 1936 1230 A 14 ALA H A 19 VAL HB 1.0 1.9 6.0 1937 1231 A 20 ARG H A 31 GLN HB2 1.0 2.0 5.8 1938 1231 A 20 ARG H A 31 GLN HB3 1.0 2.0 5.8 1939 1232 A 32 ALA HA A 20 ARG H 1.0 2.0 5.8 1940 1233 A 29 ARG HGy A 24 GLU H 1.0 1.8 6.0 1941 1233 A 29 ARG HGx A 24 GLU H 1.0 1.8 6.0 1942 1234 A 13 HIS HBx A 10 LEU H 1.0 1.8 6.0 1943 1234 A 13 HIS HBy A 10 LEU H 1.0 1.8 6.0 1944 1235 A 19 VAL H A 33 PRO HDy 1.0 2.0 6.0 1945 1236 A 48 ALA H A 46 GLY H 1.0 1.8 6.0 1946 1237 A 53 ILE H A 55 LEU H 1.0 1.9 6.0 1947 1238 A 38 THR H A 41 LEU HA 1.0 1.9 6.0 1948 1239 A 41 LEU H A 38 THR H 1.0 2.0 6.0 1949 1240 A 52 LEU H A 54 ALA H 1.0 2.0 5.8 1950 1241 A 57 ARG H A 55 LEU H 1.0 2.0 6.0 1951 1242 A 22 TRP H A 30 PHE HA 1.0 1.9 6.0 1952 1243 A 22 TRP H A 28 LEU HA 1.0 1.8 6.0 1953 1244 A 29 ARG HBy A 22 TRP H 1.0 1.9 6.0 1954 1244 A 29 ARG HBx A 22 TRP H 1.0 1.9 6.0 1955 1245 A 56 LEU HBy A 23 VAL H 1.0 0.0 6.0 1956 1245 A 56 LEU HBx A 23 VAL H 1.0 0.0 6.0 1957 1246 A 52 LEU H A 55 LEU HBy 1.0 0.0 6.0 1958 1246 A 52 LEU H A 55 LEU HBx 1.0 0.0 6.0 1959 1247 A 29 ARG HDx A 24 GLU H 1.0 1.9 6.0 1960 1247 A 29 ARG HDy A 24 GLU H 1.0 1.9 6.0 1961 1248 A 12 ALA H A 15 ALA H 1.0 2.0 5.2 1962 1249 A 13 HIS H A 15 ALA H 1.0 2.0 6.0 1963 1250 A 58 GLN HE22 A 18 GLY H 1.0 1.9 6.0 1964 1251 A 19 VAL H A 58 GLN HE21 1.0 2.0 6.0 1965 1252 A 32 ALA HA A 19 VAL H 1.0 1.0 6.0 1966 1253 A 19 VAL H A 33 PRO HDx 1.0 1.8 6.0 1967 1254 A 30 PHE HA A 20 ARG H 1.0 1.6 6.0 1968 1255 A 20 ARG H A 31 GLN HGy 1.0 1.7 6.0 1969 1255 A 20 ARG H A 31 GLN HGx 1.0 1.7 6.0 1970 1256 A 30 PHE HB3 A 22 TRP H 1.0 1.5 6.0 1971 1256 A 30 PHE HB2 A 22 TRP H 1.0 1.5 6.0 1972 1257 A 28 LEU HA A 23 VAL H 1.0 1.8 6.0 1973 1258 A 28 LEU HA A 24 GLU H 1.0 1.9 4.1 1974 1259 A 26 GLU HA A 24 GLU H 1.0 1.9 6.0 1975 1260 A 10 LEU H A 8 GLY H 1.0 1.9 6.0 1976 1261 A 9 ALA H A 11 LEU H 1.0 1.9 6.0 1977 1262 A 52 LEU H A 55 LEU H 1.0 2.0 6.0 1978 1263 A 17 LEU HG A 14 ALA H 1.0 1.9 6.0 1979 1264 A 20 ARG H A 31 GLN HA 1.0 1.4 6.0 1980 1265 A 22 TRP H A 30 PHE H 1.0 0.0 6.0 1981 1266 A 45 LEU H A 43 SER H 1.0 1.9 6.0 1982 1267 A 51 GLU H A 53 ILE HB 1.0 1.8 6.0 1983 1268 A 54 ALA H A 56 LEU H 1.0 1.9 6.0 1984 1269 A 58 GLN H A 60 GLN H 1.0 2.0 6.0 1985 1270 A 16 SER H A 18 GLY H 1.0 1.9 6.0 1986 1271 A 17 LEU H A 14 ALA HA 1.0 2.0 5.2 1987 1272 A 14 ALA H A 16 SER H 1.0 1.9 6.0 1988 1273 A 13 HIS HA A 16 SER H 1.0 1.9 3.9 1989 1274 A 14 ALA HA A 16 SER H 1.0 2.0 6.0 1990 1275 A 14 ALA H A 12 ALA H 1.0 2.0 6.0 1991 1276 A 10 LEU HA A 14 ALA H 1.0 2.0 5.4 1992 1277 A 11 LEU HA A 14 ALA H 1.0 2.0 5.4 1993 1278 A 21 LEU HA A 31 GLN H 1.0 2.0 5.6 1994 1279 A 19 VAL HA A 31 GLN H 1.0 1.9 6.0 1995 1280 A 21 LEU HG A 31 GLN H 1.0 2.0 6.0 1996 1281 A 21 LEU HBx A 31 GLN H 1.0 2.0 5.2 1997 1281 A 21 LEU HBy A 31 GLN H 1.0 2.0 5.2 1998 1282 A 22 TRP HE3 A 31 GLN H 1.0 1.9 6.0 1999 1283 A 9 ALA H A 6 SER HA 1.0 2.0 6.0 2000 1284 A 58 GLN H A 56 LEU HBx 1.0 0.0 6.0 2001 1284 A 58 GLN H A 56 LEU HBy 1.0 0.0 6.0 2002 1285 A 58 GLN H A 56 LEU H 1.0 1.9 6.0 2003 1286 A 53 ILE HA A 57 ARG H 1.0 2.0 6.0 2004 1287 A 8 GLY HAx A 11 LEU H 1.0 2.0 5.4 2005 1288 A 10 LEU H A 6 SER HA 1.0 2.0 5.8 2006 1289 A 10 LEU H A 8 GLY HAy 1.0 2.0 6.0 2007 1290 A 10 LEU H A 8 GLY HAx 1.0 1.9 6.0 2008 1291 A 8 GLY HAx A 12 ALA H 1.0 2.0 6.0 2009 1292 A 19 VAL H A 15 ALA H 1.0 2.0 6.0 2010 1293 A 19 VAL H A 16 SER H 1.0 2.0 5.6 2011 1294 A 19 VAL H A 17 LEU H 1.0 2.0 6.0 2012 1295 A 19 VAL H A 15 ALA HA 1.0 2.0 5.0 2013 1296 A 19 VAL H A 17 LEU HBy 1.0 1.9 4.7 2014 1296 A 19 VAL H A 17 LEU HBx 1.0 1.9 4.7 2015 1297 A 42 GLN H A 44 ARG H 1.0 2.0 6.0 2016 1298 A 42 GLN HA A 44 ARG H 1.0 2.0 6.0 2017 1299 A 42 GLN HGy A 44 ARG H 1.0 2.0 6.0 2018 1300 A 45 LEU H A 43 SER HA 1.0 1.9 6.0 2019 1301 A 45 LEU H A 42 GLN HA 1.0 2.0 5.6 2020 1302 A 43 SER HA A 46 GLY H 1.0 2.0 5.0 2021 1303 A 44 ARG HGy A 46 GLY H 1.0 0.0 6.0 2022 1303 A 44 ARG HGx A 46 GLY H 1.0 0.0 6.0 2023 1304 A 41 LEU H A 43 SER H 1.0 2.0 6.0 2024 1305 A 38 THR HA A 42 GLN H 1.0 0.0 6.0 2025 1306 A 39 PRO HA A 42 GLN H 1.0 2.0 5.2 2026 1307 A 53 ILE H A 50 HIS HA 1.0 2.0 5.8 2027 1308 A 53 ILE H A 49 ARG HA 1.0 2.0 6.0 2028 1309 A 53 ILE H A 51 GLU H 1.0 2.0 5.8 2029 1310 A 54 ALA H A 51 GLU H 1.0 2.0 5.4 2030 1311 A 50 HIS HA A 54 ALA H 1.0 1.9 6.0 2031 1312 A 50 HIS HB3 A 54 ALA H 1.0 2.0 5.8 2032 1312 A 50 HIS HB2 A 54 ALA H 1.0 2.0 5.8 2033 1313 A 49 ARG H A 51 GLU H 1.0 2.0 6.0 2034 1314 A 48 ALA HA A 51 GLU H 1.0 1.9 6.0 2035 1315 A 58 GLN HE21 A 15 ALA HA 1.0 1.7 6.0 2036 1316 A 58 GLN HE22 A 15 ALA HA 1.0 1.9 6.0 2037 1317 A 19 VAL H A 58 GLN HE22 1.0 2.0 6.0 2038 1318 A 58 GLN HE21 A 56 LEU HBy 1.0 0.0 6.0 2039 1318 A 58 GLN HE21 A 56 LEU HBx 1.0 0.0 6.0 2040 1319 A 24 GLU H A 27 ARG H 1.0 1.9 4.7 2041 1320 A 27 ARG H A 25 GLY HAx 1.0 1.7 6.0 2042 1321 A 27 ARG H A 25 GLY HAy 1.0 1.8 6.0 2043 1322 A 43 SER HA A 47 GLY H 1.0 0.0 6.0 2044 1323 A 45 LEU HB2 A 47 GLY H 1.0 2.0 6.0 2045 1323 A 45 LEU HB3 A 47 GLY H 1.0 2.0 6.0 2046 1324 A 41 LEU H A 39 PRO HA 1.0 2.0 6.0 2047 1325 A 38 THR H A 40 GLU H 1.0 1.8 6.0 2048 1326 A 36 VAL HA A 38 THR H 1.0 1.9 5.5 2049 1327 A 36 VAL HB A 38 THR H 1.0 2.0 4.8 2050 1328 A 34 PRO HA A 36 VAL H 1.0 2.0 6.0 2051 1329 A 33 PRO HDx A 36 VAL H 1.0 0.9 6.0 2052 1330 A 53 ILE HA A 55 LEU H 1.0 1.9 6.0 2053 1331 A 52 LEU HBy A 55 LEU H 1.0 1.8 6.0 2054 1332 A 53 ILE HA A 56 LEU H 1.0 2.0 5.8 2055 1333 A 57 ARG HB2 A 59 LEU H 1.0 0.0 6.0 2056 1333 A 57 ARG HB3 A 59 LEU H 1.0 0.0 6.0 2057 1334 A 56 LEU HBy A 59 LEU H 1.0 2.0 5.0 2058 1334 A 56 LEU HBx A 59 LEU H 1.0 2.0 5.0 2059 1335 A 20 ARG HA A 59 LEU H 1.0 0.0 6.0 2060 1336 A 57 ARG H A 59 LEU H 1.0 1.8 6.0 2061 1337 A 29 ARG H A 27 ARG HBy 1.0 2.0 6.0 2062 1338 A 11 LEU HA A 15 ALA H 1.0 1.9 4.7 2063 1339 A 50 HIS HB3 A 52 LEU H 1.0 1.9 6.0 2064 1339 A 50 HIS HB2 A 52 LEU H 1.0 1.9 6.0 2065 1340 A 22 TRP HD1 A 24 GLU H 1.0 1.7 6.0 2066 1341 A 22 TRP HH2 A 31 GLN H 1.0 2.0 5.2 2067 1342 A 17 LEU H A 14 ALA H 1.0 1.7 6.0 2068 1343 A 17 LEU H A 15 ALA H 1.0 1.8 6.0 2069 1344 A 9 ALA H A 7 ALA HA 1.0 2.0 5.4 2070 1345 A 13 HIS HBx A 16 SER H 1.0 1.6 6.0 2071 1346 A 18 GLY H A 15 ALA H 1.0 1.7 6.0 2072 1347 A 18 GLY H A 15 ALA HA 1.0 1.9 5.5 2073 1348 A 57 ARG HA A 60 GLN HE21 1.0 2.0 6.0 2074 1349 A 57 ARG HA A 60 GLN HE22 1.0 2.0 6.0 2075 1350 A 58 GLN HE21 A 18 GLY H 1.0 1.5 6.0 2076 1351 A 58 GLN HE21 A 18 GLY HAy 1.0 2.0 6.0 2077 1352 A 58 GLN HE22 A 18 GLY HAy 1.0 2.0 6.0 2078 1353 A 54 ALA H A 57 ARG H 1.0 1.8 6.0 2079 1354 A 20 ARG HBy A 59 LEU H 1.0 0.0 6.0 2080 1355 A 20 ARG HBy A 31 GLN H 1.0 2.0 5.2 2081 1355 A 20 ARG HBx A 31 GLN H 1.0 2.0 5.2 2082 1356 A 34 PRO HGy A 36 VAL H 1.0 0.0 6.0 2083 1356 A 34 PRO HGx A 36 VAL H 1.0 0.0 6.0 2084 1357 A 37 MET H A 35 GLY HAx 1.0 2.0 6.0 2085 1358 A 37 MET H A 35 GLY HAy 1.0 1.8 6.0 2086 1359 A 33 PRO HDx A 37 MET H 1.0 2.0 5.8 2087 1360 A 38 THR H A 42 GLN H 1.0 0.0 6.0 2088 1361 A 48 ALA H A 45 LEU HB3 1.0 2.0 5.8 2089 1362 A 48 ALA HA A 50 HIS H 1.0 1.8 6.0 2090 1363 A 53 ILE H A 50 HIS HB2 1.0 1.8 6.0 2091 1363 A 53 ILE H A 50 HIS HB3 1.0 1.8 6.0 2092 1364 A 10 LEU H A 7 ALA HA 1.0 2.0 4.6 2093 1365 A 29 ARG H A 23 VAL HA 1.0 1.9 5.1 2094 1366 A 10 LEU HA A 12 ALA H 1.0 1.9 5.3 2095 1367 A 41 LEU H A 38 THR HA 1.0 2.0 5.0 2096 1368 A 19 VAL H A 17 LEU HG 1.0 0.0 6.0 2097 1369 A 8 GLY HAy A 12 ALA H 1.0 1.8 6.0 2098 1370 A 50 HIS HE1 A 52 LEU H 1.0 2.0 6.0 2099 1371 A 22 TRP HE1 A 24 GLU H 1.0 0.0 6.0 2100 1372 A 34 PRO HBy A 36 VAL H 1.0 1.9 6.0 2101 1372 A 34 PRO HBx A 36 VAL H 1.0 1.9 6.0 2102 1373 A 41 LEU H A 39 PRO HD2 1.0 1.8 6.0 2103 1374 A 39 PRO HD3 A 42 GLN H 1.0 1.9 6.0 2104 1374 A 39 PRO HD2 A 42 GLN H 1.0 1.9 6.0 2105 1375 A 37 MET HGy A 42 GLN H 1.0 1.7 6.0 2106 1376 A 39 PRO HBx A 42 GLN H 1.0 2.0 5.6 2107 1376 A 39 PRO HBy A 42 GLN H 1.0 2.0 5.6 2108 1377 A 45 LEU H A 42 GLN H 1.0 1.9 6.0 2109 1378 A 51 GLU H A 49 ARG HA 1.0 1.8 6.0 2110 1379 A 55 LEU H A 51 GLU HGy 1.0 1.5 6.0 2111 1380 A 56 LEU H A 59 LEU H 1.0 1.9 6.0 2112 1381 A 57 ARG HA A 59 LEU H 1.0 1.9 6.0 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 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 8 GLY O A 12 ALA N 1.0 0.0 3.3 2 2 A 12 ALA H A 8 GLY O 1.0 0.0 2.3 3 3 A 9 ALA O A 13 HIS N 1.0 0.0 3.3 4 4 A 13 HIS H A 9 ALA O 1.0 0.0 2.3 5 5 A 10 LEU O A 14 ALA N 1.0 0.0 3.3 6 6 A 14 ALA H A 10 LEU O 1.0 0.0 2.3 7 7 A 11 LEU O A 15 ALA N 1.0 0.0 3.3 8 8 A 15 ALA H A 11 LEU O 1.0 0.0 2.3 9 9 A 12 ALA O A 16 SER N 1.0 0.0 3.3 10 10 A 16 SER H A 12 ALA O 1.0 0.0 2.3 11 11 A 20 ARG O A 31 GLN N 1.0 0.0 3.3 12 12 A 31 GLN H A 20 ARG O 1.0 0.0 2.3 13 13 A 31 GLN O A 20 ARG N 1.0 0.0 3.3 14 14 A 20 ARG H A 31 GLN O 1.0 0.0 2.3 15 15 A 22 TRP O A 29 ARG N 1.0 0.0 3.3 16 16 A 29 ARG H A 22 TRP O 1.0 0.0 2.3 17 17 A 29 ARG O A 22 TRP N 1.0 0.0 3.3 18 18 A 22 TRP H A 29 ARG O 1.0 0.0 2.3 19 19 A 24 GLU O A 27 ARG N 1.0 0.0 3.3 20 20 A 27 ARG H A 24 GLU O 1.0 0.0 2.3 21 21 A 27 ARG O A 24 GLU N 1.0 0.0 3.3 22 22 A 24 GLU H A 27 ARG O 1.0 0.0 2.3 23 23 A 39 PRO O A 43 SER N 1.0 0.0 3.3 24 24 A 43 SER H A 39 PRO O 1.0 0.0 2.3 25 25 A 40 GLU O A 44 ARG N 1.0 0.0 3.3 26 26 A 44 ARG H A 40 GLU O 1.0 0.0 2.3 27 27 A 41 LEU O A 45 LEU N 1.0 0.0 3.3 28 28 A 45 LEU H A 41 LEU O 1.0 0.0 2.3 29 29 A 49 ARG O A 53 ILE N 1.0 0.0 3.3 30 30 A 53 ILE H A 49 ARG O 1.0 0.0 2.3 31 31 A 50 HIS O A 54 ALA N 1.0 0.0 3.3 32 32 A 54 ALA H A 50 HIS O 1.0 0.0 2.3 33 33 A 51 GLU O A 55 LEU N 1.0 0.0 3.3 34 34 A 55 LEU H A 51 GLU O 1.0 0.0 2.3 35 35 A 52 LEU O A 56 LEU N 1.0 0.0 3.3 36 36 A 56 LEU H A 52 LEU O 1.0 0.0 2.3 37 37 A 53 ILE O A 57 ARG N 1.0 0.0 3.3 38 38 A 57 ARG H A 53 ILE O 1.0 0.0 2.3 39 39 A 54 ALA O A 58 GLN N 1.0 0.0 3.3 40 40 A 58 GLN H A 54 ALA O 1.0 0.0 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 undefined _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 7 ALA C A 8 GLY N A 8 GLY CA A 8 GLY C 1.0 -80.0 -48.0 PHI 2 2 A 8 GLY C A 9 ALA N A 9 ALA CA A 9 ALA C 1.0 -73.0 -57.0 PHI 3 3 A 9 ALA C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -78.0 -54.0 PHI 4 4 A 10 LEU C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -77.0 -49.0 PHI 5 5 A 11 LEU C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -68.0 -56.0 PHI 6 6 A 12 ALA C A 13 HIS N A 13 HIS CA A 13 HIS C 1.0 -77.0 -53.0 PHI 7 7 A 13 HIS C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -83.0 -43.0 PHI 8 8 A 14 ALA C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -75.0 -55.0 PHI 9 9 A 15 ALA C A 16 SER N A 16 SER CA A 16 SER C 1.0 -83.0 -51.0 PHI 10 10 A 16 SER C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -104.0 -72.0 PHI 11 11 A 17 LEU C A 18 GLY N A 18 GLY CA A 18 GLY C 1.0 -22.0 342.0 PHI 12 12 A 18 GLY C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -126.0 -62.0 PHI 13 13 A 19 VAL C A 20 ARG N A 20 ARG CA A 20 ARG C 1.0 -130.0 -66.0 PHI 14 14 A 20 ARG C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -162.0 -102.0 PHI 15 15 A 21 LEU C A 22 TRP N A 22 TRP CA A 22 TRP C 1.0 -202.0 -90.0 PHI 16 16 A 22 TRP C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -151.0 -79.0 PHI 17 17 A 23 VAL C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -161.0 -81.0 PHI 18 18 A 24 GLU C A 25 GLY N A 25 GLY CA A 25 GLY C 1.0 -40.0 144.0 PHI 19 19 A 25 GLY C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -116.0 -84.0 PHI 20 20 A 26 GLU C A 27 ARG N A 27 ARG CA A 27 ARG C 1.0 -165.0 -57.0 PHI 21 21 A 27 ARG C A 28 LEU N A 28 LEU CA A 28 LEU C 1.0 -153.0 -65.0 PHI 22 22 A 28 LEU C A 29 ARG N A 29 ARG CA A 29 ARG C 1.0 -152.0 -80.0 PHI 23 23 A 29 ARG C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -158.0 -102.0 PHI 24 24 A 30 PHE C A 31 GLN N A 31 GLN CA A 31 GLN C 1.0 -153.0 -101.0 PHI 25 25 A 31 GLN C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -155.0 -79.0 PHI 26 26 A 32 ALA C A 33 PRO N A 33 PRO CA A 33 PRO C 1.0 -84.0 -52.0 PHI 27 27 A 33 PRO C A 34 PRO N A 34 PRO CA A 34 PRO C 1.0 -73.0 -53.0 PHI 28 28 A 34 PRO C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 55.0 111.0 PHI 29 29 A 35 GLY C A 36 VAL N A 36 VAL CA A 36 VAL C 1.0 -118.0 -36.0 PHI 30 30 A 36 VAL C A 37 MET N A 37 MET CA A 37 MET C 1.0 -127.0 -83.0 PHI 31 31 A 37 MET C A 38 THR N A 38 THR CA A 38 THR C 1.0 -149.0 -51.0 PHI 32 32 A 38 THR C A 39 PRO N A 39 PRO CA A 39 PRO C 1.0 -69.0 -43.0 PHI 33 33 A 39 PRO C A 40 GLU N A 40 GLU CA A 40 GLU C 1.0 -72.0 -56.0 PHI 34 34 A 40 GLU C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -81.0 -51.0 PHI 35 35 A 41 LEU C A 42 GLN N A 42 GLN CA A 42 GLN C 1.0 -69.0 -57.0 PHI 36 36 A 42 GLN C A 43 SER N A 43 SER CA A 43 SER C 1.0 -72.0 -58.0 PHI 37 37 A 43 SER C A 44 ARG N A 44 ARG CA A 44 ARG C 1.0 -77.0 -55.0 PHI 38 38 A 44 ARG C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -75.0 -53.0 PHI 39 39 A 45 LEU C A 46 GLY N A 46 GLY CA A 46 GLY C 1.0 86.0 104.0 PHI 40 40 A 46 GLY C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 68.0 116.0 PHI 41 41 A 47 GLY C A 48 ALA N A 48 ALA CA A 48 ALA C 1.0 -155.0 -39.0 PHI 42 42 A 48 ALA C A 49 ARG N A 49 ARG CA A 49 ARG C 1.0 -68.0 -54.0 PHI 43 43 A 49 ARG C A 50 HIS N A 50 HIS CA A 50 HIS C 1.0 -71.0 -55.0 PHI 44 44 A 50 HIS C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -74.0 -58.0 PHI 45 45 A 51 GLU C A 52 LEU N A 52 LEU CA A 52 LEU C 1.0 -80.0 -54.0 PHI 46 46 A 52 LEU C A 53 ILE N A 53 ILE CA A 53 ILE C 1.0 -73.0 -55.0 PHI 47 47 A 53 ILE C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -68.0 -52.0 PHI 48 48 A 54 ALA C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -71.0 -55.0 PHI 49 49 A 55 LEU C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -79.0 -51.0 PHI 50 50 A 56 LEU C A 57 ARG N A 57 ARG CA A 57 ARG C 1.0 -73.0 -51.0 PHI 51 51 A 57 ARG C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -95.0 -49.0 PHI 52 52 A 58 GLN C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 -117.0 -73.0 PHI 53 53 A 59 LEU C A 60 GLN N A 60 GLN CA A 60 GLN C 1.0 -156.0 -52.0 PHI 54 54 A 8 GLY N A 8 GLY CA A 8 GLY C A 9 ALA N 1.0 -59.0 -27.0 PSI 55 55 A 9 ALA N A 9 ALA CA A 9 ALA C A 10 LEU N 1.0 -48.0 -28.0 PSI 56 56 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 LEU N 1.0 -46.0 -34.0 PSI 57 57 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 ALA N 1.0 -55.0 -27.0 PSI 58 58 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 HIS N 1.0 -53.0 -29.0 PSI 59 59 A 13 HIS N A 13 HIS CA A 13 HIS C A 14 ALA N 1.0 -61.0 -29.0 PSI 60 60 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 ALA N 1.0 -49.0 -33.0 PSI 61 61 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 SER N 1.0 -49.0 -25.0 PSI 62 62 A 16 SER N A 16 SER CA A 16 SER C A 17 LEU N 1.0 -58.0 6.0 PSI 63 63 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 GLY N 1.0 -24.0 28.0 PSI 64 64 A 18 GLY N A 18 GLY CA A 18 GLY C A 19 VAL N 1.0 -199.0 213.0 PSI 65 65 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 ARG N 1.0 105.0 157.0 PSI 66 66 A 20 ARG N A 20 ARG CA A 20 ARG C A 21 LEU N 1.0 100.0 152.0 PSI 67 67 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 TRP N 1.0 125.0 185.0 PSI 68 68 A 22 TRP N A 22 TRP CA A 22 TRP C A 23 VAL N 1.0 118.0 194.0 PSI 69 69 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 GLU N 1.0 116.0 156.0 PSI 70 70 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 GLY N 1.0 87.0 151.0 PSI 71 71 A 25 GLY N A 25 GLY CA A 25 GLY C A 26 GLU N 1.0 -179.0 -39.0 PSI 72 72 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 ARG N 1.0 -31.0 25.0 PSI 73 73 A 27 ARG N A 27 ARG CA A 27 ARG C A 28 LEU N 1.0 85.0 193.0 PSI 74 74 A 28 LEU N A 28 LEU CA A 28 LEU C A 29 ARG N 1.0 104.0 156.0 PSI 75 75 A 29 ARG N A 29 ARG CA A 29 ARG C A 30 PHE N 1.0 126.0 186.0 PSI 76 76 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 GLN N 1.0 132.0 172.0 PSI 77 77 A 31 GLN N A 31 GLN CA A 31 GLN C A 32 ALA N 1.0 100.0 160.0 PSI 78 78 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 PRO N 1.0 106.0 156.0 PSI 79 79 A 33 PRO N A 33 PRO CA A 33 PRO C A 34 PRO N 1.0 119.0 163.0 PSI 80 80 A 34 PRO N A 34 PRO CA A 34 PRO C A 35 GLY N 1.0 124.0 172.0 PSI 81 81 A 35 GLY N A 35 GLY CA A 35 GLY C A 36 VAL N 1.0 -37.0 49.0 PSI 82 82 A 36 VAL N A 36 VAL CA A 36 VAL C A 37 MET N 1.0 -66.0 18.0 PSI 83 83 A 37 MET N A 37 MET CA A 37 MET C A 38 THR N 1.0 -13.0 17.0 PSI 84 84 A 38 THR N A 38 THR CA A 38 THR C A 39 PRO N 1.0 63.0 205.0 PSI 85 85 A 39 PRO N A 39 PRO CA A 39 PRO C A 40 GLU N 1.0 -55.0 -9.0 PSI 86 86 A 40 GLU N A 40 GLU CA A 40 GLU C A 41 LEU N 1.0 -53.0 -23.0 PSI 87 87 A 42 GLN N A 42 GLN CA A 42 GLN C A 43 SER N 1.0 -48.0 -28.0 PSI 88 88 A 43 SER N A 43 SER CA A 43 SER C A 44 ARG N 1.0 -50.0 -30.0 PSI 89 89 A 44 ARG N A 44 ARG CA A 44 ARG C A 45 LEU N 1.0 -51.0 -29.0 PSI 90 90 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLY N 1.0 -42.0 -26.0 PSI 91 91 A 46 GLY N A 46 GLY CA A 46 GLY C A 47 GLY N 1.0 -21.0 9.0 PSI 92 92 A 47 GLY N A 47 GLY CA A 47 GLY C A 48 ALA N 1.0 -46.0 36.0 PSI 93 93 A 48 ALA N A 48 ALA CA A 48 ALA C A 49 ARG N 1.0 152.0 184.0 PSI 94 94 A 49 ARG N A 49 ARG CA A 49 ARG C A 50 HIS N 1.0 -50.0 -22.0 PSI 95 95 A 50 HIS N A 50 HIS CA A 50 HIS C A 51 GLU N 1.0 -51.0 -31.0 PSI 96 96 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 LEU N 1.0 -55.0 -31.0 PSI 97 97 A 52 LEU N A 52 LEU CA A 52 LEU C A 53 ILE N 1.0 -51.0 -25.0 PSI 98 98 A 53 ILE N A 53 ILE CA A 53 ILE C A 54 ALA N 1.0 -53.0 -31.0 PSI 99 99 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 LEU N 1.0 -52.0 -26.0 PSI 100 100 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 LEU N 1.0 -56.0 -30.0 PSI 101 101 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 ARG N 1.0 -56.0 -24.0 PSI 102 102 A 57 ARG N A 57 ARG CA A 57 ARG C A 58 GLN N 1.0 -54.0 -10.0 PSI 103 103 A 58 GLN N A 58 GLN CA A 58 GLN C A 59 LEU N 1.0 -64.0 12.0 PSI 104 104 A 59 LEU N A 59 LEU CA A 59 LEU C A 60 GLN N 1.0 -31.0 27.0 PSI 105 105 A 60 GLN N A 60 GLN CA A 60 GLN C A 61 PRO N 1.0 61.0 197.0 PSI stop_ save_