data_nef_c16380_2kl2 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 1zko stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ALA middle . . 3 A 3 HIS middle . . 4 A 4 ILE middle . . 5 A 5 PHE middle . . 6 A 6 VAL middle . . 7 A 7 TYR middle . . 8 A 8 GLY middle . false 9 A 9 THR middle . . 10 A 10 LEU middle . . 11 A 11 LYS middle . . 12 A 12 ARG middle . . 13 A 13 GLY middle . false 14 A 14 GLN middle . . 15 A 15 PRO middle . false 16 A 16 ASN middle . . 17 A 17 HIS middle . . 18 A 18 LYS middle . . 19 A 19 VAL middle . . 20 A 20 MET middle . . 21 A 21 LEU middle . . 22 A 22 ASP middle . . 23 A 23 HIS middle . . 24 A 24 SER middle . . 25 A 25 HIS middle . . 26 A 26 GLY middle . false 27 A 27 LEU middle . . 28 A 28 ALA middle . . 29 A 29 ALA middle . . 30 A 30 PHE middle . . 31 A 31 ARG middle . . 32 A 32 GLY middle . false 33 A 33 ARG middle . . 34 A 34 GLY middle . false 35 A 35 CYS middle . . 36 A 36 THR middle . . 37 A 37 VAL middle . . 38 A 38 GLU middle . . 39 A 39 SER middle . . 40 A 40 PHE middle . . 41 A 41 PRO middle . false 42 A 42 LEU middle . . 43 A 43 VAL middle . . 44 A 44 ILE middle . . 45 A 45 ALA middle . . 46 A 46 GLY middle . false 47 A 47 GLU middle . . 48 A 48 HIS middle . . 49 A 49 ASN middle . . 50 A 50 ILE middle . . 51 A 51 PRO middle . false 52 A 52 TRP middle . . 53 A 53 LEU middle . . 54 A 54 LEU middle . . 55 A 55 TYR middle . . 56 A 56 LEU middle . . 57 A 57 PRO middle . false 58 A 58 GLY middle . false 59 A 59 LYS middle . . 60 A 60 GLY middle . false 61 A 61 HIS middle . . 62 A 62 CYS middle . . 63 A 63 VAL middle . . 64 A 64 THR middle . . 65 A 65 GLY middle . false 66 A 66 GLU middle . . 67 A 67 ILE middle . . 68 A 68 TYR middle . . 69 A 69 GLU middle . . 70 A 70 VAL middle . . 71 A 71 ASP middle . . 72 A 72 GLU middle . . 73 A 73 GLN middle . . 74 A 74 MET middle . . 75 A 75 LEU middle . . 76 A 76 ARG middle . . 77 A 77 PHE middle . . 78 A 78 LEU middle . . 79 A 79 ASP middle . . 80 A 80 ASP middle . . 81 A 81 PHE middle . . 82 A 82 GLU middle . . 83 A 83 ASP middle . . 84 A 84 CYS middle . . 85 A 85 PRO middle . true 86 A 86 SER middle . . 87 A 87 MET middle . . 88 A 88 TYR middle . . 89 A 89 GLN middle . . 90 A 90 ARG middle . . 91 A 91 THR middle . . 92 A 92 ALA middle . . 93 A 93 LEU middle . . 94 A 94 GLN middle . . 95 A 95 VAL middle . . 96 A 96 GLN middle . . 97 A 97 VAL middle . . 98 A 98 LEU middle . . 99 A 99 GLU middle . . 100 A 100 TRP middle . . 101 A 101 GLU middle . . 102 A 102 GLY middle . false 103 A 103 ASP middle . . 104 A 104 GLY middle . false 105 A 105 ASP middle . . 106 A 106 PRO middle . false 107 A 107 GLY middle . false 108 A 108 ASP middle . . 109 A 109 SER middle . . 110 A 110 VAL middle . . 111 A 111 GLN middle . . 112 A 112 CYS middle . . 113 A 113 PHE middle . . 114 A 114 VAL middle . . 115 A 115 TYR middle . . 116 A 116 THR middle . . 117 A 117 THR middle . . 118 A 118 ALA middle . . 119 A 119 THR middle . . 120 A 120 TYR middle . . 121 A 121 ALA middle . . 122 A 122 PRO middle . false 123 A 123 GLU middle . . 124 A 124 TRP middle . . 125 A 125 LEU middle . . 126 A 126 PHE middle . . 127 A 127 LEU middle . . 128 A 128 PRO middle . false 129 A 129 TYR middle . . 130 A 130 HIS middle . . 131 A 131 GLU middle . . 132 A 132 SER middle . . 133 A 133 TYR middle . . 134 A 134 ASP middle . . 135 A 135 SER middle . . 136 A 136 GLU middle . . 137 A 137 GLY middle . false 138 A 138 PRO middle . false 139 A 139 HIS middle . . 140 A 140 GLY middle . false 141 A 141 LEU middle . . 142 A 142 ARG middle . . 143 A 143 TYR middle . . 144 A 144 ASN middle . . 145 A 145 PRO middle . false 146 A 146 ARG middle . . 147 A 147 GLU middle . . 148 A 148 ASN middle . . 149 A 149 ARG 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 2 ALA HA H 1 4.182 0.008 A 2 ALA HB% H 1 1.579 0.008 A 2 ALA CA C 13 51.510 0.2 A 2 ALA CB C 13 20.090 0.2 A 3 HIS H H 1 9.173 0.008 A 3 HIS HA H 1 5.839 0.008 A 3 HIS HBy H 1 3.156 0.008 A 3 HIS HBx H 1 3.117 0.008 A 3 HIS HD2 H 1 6.608 0.008 A 3 HIS CA C 13 56.960 0.2 A 3 HIS CB C 13 32.820 0.2 A 3 HIS CD2 C 13 118.907 0.2 A 3 HIS N N 15 118.801 0.15 A 4 ILE H H 1 9.494 0.008 A 4 ILE HA H 1 5.508 0.008 A 4 ILE HB H 1 1.735 0.008 A 4 ILE HD1% H 1 0.654 0.008 A 4 ILE HG1y H 1 1.498 0.008 A 4 ILE HG1x H 1 1.122 0.008 A 4 ILE HG2% H 1 0.914 0.008 A 4 ILE CA C 13 58.300 0.2 A 4 ILE CB C 13 41.930 0.2 A 4 ILE CD1 C 13 14.665 0.2 A 4 ILE CG1 C 13 27.365 0.2 A 4 ILE CG2 C 13 17.815 0.2 A 4 ILE N N 15 118.202 0.15 A 5 PHE H H 1 8.815 0.008 A 5 PHE HA H 1 5.789 0.008 A 5 PHE HBx H 1 2.876 0.008 A 5 PHE HBy H 1 3.062 0.008 A 5 PHE HDx H 1 6.947 0.008 A 5 PHE HDy H 1 6.947 0.008 A 5 PHE HEx H 1 7.404 0.008 A 5 PHE HEy H 1 7.404 0.008 A 5 PHE HZ H 1 6.774 0.008 A 5 PHE CA C 13 55.153 0.2 A 5 PHE CB C 13 40.740 0.2 A 5 PHE CDx C 13 132.173 0.2 A 5 PHE CEx C 13 129.614 0.2 A 5 PHE CZ C 13 129.672 0.2 A 5 PHE N N 15 126.107 0.15 A 6 VAL H H 1 9.078 0.008 A 6 VAL HA H 1 4.357 0.008 A 6 VAL HB H 1 2.171 0.008 A 6 VAL HGx% H 1 0.812 0.008 A 6 VAL HGy% H 1 0.690 0.008 A 6 VAL CA C 13 59.157 0.2 A 6 VAL CB C 13 33.473 0.2 A 6 VAL CGx C 13 19.985 0.2 A 6 VAL CGy C 13 22.295 0.2 A 6 VAL N N 15 118.658 0.15 A 7 TYR H H 1 6.878 0.008 A 7 TYR HA H 1 4.170 0.008 A 7 TYR HBy H 1 2.406 0.008 A 7 TYR HBx H 1 2.363 0.008 A 7 TYR CB C 13 36.608 0.2 A 7 TYR N N 15 116.860 0.15 A 8 GLY HAy H 1 4.195 0.008 A 8 GLY HAx H 1 2.933 0.008 A 8 GLY CA C 13 46.169 0.2 A 9 THR H H 1 7.618 0.008 A 9 THR HA H 1 3.831 0.008 A 9 THR HB H 1 3.704 0.008 A 9 THR HG2% H 1 0.500 0.008 A 9 THR CA C 13 64.570 0.2 A 9 THR CB C 13 68.494 0.2 A 9 THR CG2 C 13 20.690 0.2 A 9 THR N N 15 115.934 0.15 A 10 LEU H H 1 7.561 0.008 A 10 LEU HA H 1 3.673 0.008 A 10 LEU HBy H 1 1.559 0.008 A 10 LEU HBx H 1 1.276 0.008 A 10 LEU HDx% H 1 0.553 0.008 A 10 LEU HDy% H 1 0.249 0.008 A 10 LEU HG H 1 1.216 0.008 A 10 LEU CA C 13 55.950 0.2 A 10 LEU CB C 13 41.610 0.2 A 10 LEU CDy C 13 24.943 0.2 A 10 LEU CDx C 13 22.756 0.2 A 10 LEU CG C 13 27.302 0.2 A 10 LEU N N 15 120.151 0.15 A 11 LYS H H 1 6.738 0.008 A 11 LYS HA H 1 4.007 0.008 A 11 LYS HBx H 1 1.513 0.008 A 11 LYS HBy H 1 1.622 0.008 A 11 LYS HGy H 1 1.252 0.008 A 11 LYS CA C 13 57.390 0.2 A 11 LYS CB C 13 34.322 0.2 A 11 LYS CG C 13 26.058 0.2 A 11 LYS N N 15 116.295 0.15 A 12 ARG H H 1 9.432 0.008 A 12 ARG HA H 1 2.029 0.008 A 12 ARG HBx H 1 1.295 0.008 A 12 ARG HBy H 1 1.642 0.008 A 12 ARG HDx H 1 2.396 0.008 A 12 ARG HDy H 1 2.516 0.008 A 12 ARG HGy H 1 1.598 0.008 A 12 ARG HGx H 1 1.092 0.008 A 12 ARG CA C 13 58.420 0.2 A 12 ARG CB C 13 29.190 0.2 A 12 ARG CD C 13 43.288 0.2 A 12 ARG CG C 13 26.924 0.2 A 12 ARG N N 15 120.863 0.15 A 13 GLY H H 1 8.048 0.008 A 13 GLY HAy H 1 3.990 0.008 A 13 GLY HAx H 1 3.538 0.008 A 13 GLY CA C 13 45.490 0.2 A 13 GLY N N 15 111.120 0.15 A 14 GLN H H 1 7.904 0.008 A 14 GLN HA H 1 4.682 0.008 A 14 GLN HBx H 1 2.155 0.008 A 14 GLN HBy H 1 2.315 0.008 A 14 GLN HE2x H 1 7.243 0.008 A 14 GLN HE2y H 1 7.767 0.008 A 14 GLN HGx H 1 1.987 0.008 A 14 GLN HGy H 1 2.311 0.008 A 14 GLN CA C 13 53.440 0.2 A 14 GLN CB C 13 27.115 0.2 A 14 GLN CG C 13 34.047 0.2 A 14 GLN N N 15 117.811 0.15 A 14 GLN NE2 N 15 115.458 0.15 A 15 PRO HA H 1 4.342 0.008 A 15 PRO HBx H 1 1.576 0.008 A 15 PRO HBy H 1 2.702 0.008 A 15 PRO HDx H 1 3.431 0.008 A 15 PRO HDy H 1 4.207 0.008 A 15 PRO HGy H 1 2.251 0.008 A 15 PRO HGx H 1 2.109 0.008 A 15 PRO CA C 13 66.870 0.2 A 15 PRO CB C 13 34.060 0.2 A 15 PRO CD C 13 51.952 0.2 A 15 PRO CG C 13 27.977 0.2 A 16 ASN H H 1 8.287 0.008 A 16 ASN HA H 1 5.356 0.008 A 16 ASN HBx H 1 2.038 0.008 A 16 ASN HBy H 1 2.870 0.008 A 16 ASN HD2x H 1 6.721 0.008 A 16 ASN HD2y H 1 7.820 0.008 A 16 ASN CA C 13 52.230 0.2 A 16 ASN CB C 13 39.030 0.2 A 16 ASN N N 15 110.638 0.15 A 16 ASN ND2 N 15 110.714 0.15 A 17 HIS H H 1 7.819 0.008 A 17 HIS HA H 1 3.815 0.008 A 17 HIS HBy H 1 3.495 0.008 A 17 HIS HBx H 1 3.008 0.008 A 17 HIS HD2 H 1 7.026 0.008 A 17 HIS CA C 13 60.140 0.2 A 17 HIS CB C 13 27.680 0.2 A 17 HIS CD2 C 13 124.294 0.2 A 17 HIS N N 15 121.058 0.15 A 18 LYS H H 1 8.326 0.008 A 18 LYS HA H 1 3.695 0.008 A 18 LYS HBx H 1 1.776 0.008 A 18 LYS HDx H 1 1.620 0.008 A 18 LYS HEx H 1 2.960 0.008 A 18 LYS HGy H 1 1.305 0.008 A 18 LYS HGx H 1 1.274 0.008 A 18 LYS CA C 13 58.890 0.2 A 18 LYS CB C 13 31.070 0.2 A 18 LYS CD C 13 29.484 0.2 A 18 LYS CE C 13 42.080 0.2 A 18 LYS CG C 13 24.305 0.2 A 18 LYS N N 15 112.812 0.15 A 19 VAL H H 1 7.373 0.008 A 19 VAL HA H 1 3.816 0.008 A 19 VAL HB H 1 1.789 0.008 A 19 VAL HGx% H 1 0.528 0.008 A 19 VAL HGy% H 1 0.430 0.008 A 19 VAL CA C 13 64.960 0.2 A 19 VAL CB C 13 30.960 0.2 A 19 VAL CGy C 13 20.892 0.2 A 19 VAL CGx C 13 20.187 0.2 A 19 VAL N N 15 117.691 0.15 A 20 MET H H 1 7.329 0.008 A 20 MET HA H 1 3.951 0.008 A 20 MET HBx H 1 1.397 0.008 A 20 MET HBy H 1 1.496 0.008 A 20 MET HE% H 1 0.938 0.008 A 20 MET HGy H 1 2.036 0.008 A 20 MET HGx H 1 1.984 0.008 A 20 MET CA C 13 55.560 0.2 A 20 MET CB C 13 31.460 0.2 A 20 MET CE C 13 15.480 0.2 A 20 MET CG C 13 32.430 0.2 A 20 MET N N 15 114.870 0.15 A 21 LEU H H 1 6.718 0.008 A 21 LEU HA H 1 4.091 0.008 A 21 LEU HBy H 1 1.509 0.008 A 21 LEU HBx H 1 1.432 0.008 A 21 LEU HDx% H 1 0.801 0.008 A 21 LEU HDy% H 1 0.734 0.008 A 21 LEU HG H 1 1.168 0.008 A 21 LEU CA C 13 54.140 0.2 A 21 LEU CB C 13 42.310 0.2 A 21 LEU CDy C 13 25.391 0.2 A 21 LEU CDx C 13 22.099 0.2 A 21 LEU CG C 13 26.357 0.2 A 21 LEU N N 15 116.021 0.15 A 22 ASP H H 1 6.399 0.008 A 22 ASP HA H 1 4.288 0.008 A 22 ASP HBx H 1 2.200 0.008 A 22 ASP CA C 13 52.776 0.2 A 22 ASP CB C 13 40.180 0.2 A 22 ASP N N 15 117.972 0.15 A 23 HIS H H 1 8.601 0.008 A 23 HIS HA H 1 4.848 0.008 A 23 HIS HBy H 1 3.207 0.008 A 23 HIS HBx H 1 3.109 0.008 A 23 HIS HD2 H 1 7.298 0.008 A 23 HIS CA C 13 55.800 0.2 A 23 HIS CB C 13 27.860 0.2 A 23 HIS CD2 C 13 119.640 0.2 A 23 HIS N N 15 123.395 0.15 A 24 SER H H 1 8.526 0.008 A 24 SER HA H 1 4.105 0.008 A 24 SER HBx H 1 3.637 0.008 A 24 SER CA C 13 60.870 0.2 A 24 SER CB C 13 62.510 0.2 A 24 SER N N 15 117.035 0.15 A 25 HIS H H 1 7.450 0.008 A 25 HIS HA H 1 4.494 0.008 A 25 HIS HBy H 1 2.650 0.008 A 25 HIS HBx H 1 2.429 0.008 A 25 HIS HD2 H 1 6.805 0.008 A 25 HIS CA C 13 53.900 0.2 A 25 HIS CB C 13 28.320 0.2 A 25 HIS CD2 C 13 119.623 0.2 A 25 HIS N N 15 117.560 0.15 A 26 GLY H H 1 6.926 0.008 A 26 GLY HAx H 1 3.587 0.008 A 26 GLY HAy H 1 4.362 0.008 A 26 GLY CA C 13 43.730 0.2 A 26 GLY N N 15 103.120 0.15 A 27 LEU H H 1 8.579 0.008 A 27 LEU HA H 1 4.327 0.008 A 27 LEU HBx H 1 1.364 0.008 A 27 LEU HDx% H 1 0.754 0.008 A 27 LEU HDy% H 1 0.615 0.008 A 27 LEU HG H 1 1.406 0.008 A 27 LEU CA C 13 54.520 0.2 A 27 LEU CB C 13 44.250 0.2 A 27 LEU CDy C 13 24.398 0.2 A 27 LEU CDx C 13 24.036 0.2 A 27 LEU CG C 13 26.917 0.2 A 27 LEU N N 15 121.940 0.15 A 28 ALA H H 1 7.776 0.008 A 28 ALA HA H 1 5.231 0.008 A 28 ALA HB% H 1 1.292 0.008 A 28 ALA CA C 13 50.990 0.2 A 28 ALA CB C 13 22.580 0.2 A 28 ALA N N 15 123.020 0.15 A 29 ALA H H 1 9.231 0.008 A 29 ALA HA H 1 4.857 0.008 A 29 ALA HB% H 1 1.311 0.008 A 29 ALA CA C 13 50.661 0.2 A 29 ALA CB C 13 21.140 0.2 A 29 ALA N N 15 125.760 0.15 A 30 PHE H H 1 9.083 0.008 A 30 PHE HA H 1 3.397 0.008 A 30 PHE HBy H 1 2.994 0.008 A 30 PHE HBx H 1 2.681 0.008 A 30 PHE HDx H 1 6.601 0.008 A 30 PHE HDy H 1 6.601 0.008 A 30 PHE HEx H 1 6.884 0.008 A 30 PHE HEy H 1 6.884 0.008 A 30 PHE CA C 13 59.895 0.2 A 30 PHE CB C 13 38.810 0.2 A 30 PHE CDx C 13 130.984 0.2 A 30 PHE CEx C 13 130.970 0.2 A 30 PHE N N 15 126.590 0.15 A 31 ARG H H 1 8.102 0.008 A 31 ARG HA H 1 3.941 0.008 A 31 ARG HBx H 1 -0.063 0.008 A 31 ARG HBy H 1 0.442 0.008 A 31 ARG HDx H 1 2.646 0.008 A 31 ARG HDy H 1 2.999 0.008 A 31 ARG HE H 1 7.120 0.008 A 31 ARG HGx H 1 1.325 0.008 A 31 ARG CA C 13 53.120 0.2 A 31 ARG CB C 13 31.665 0.2 A 31 ARG CD C 13 42.284 0.2 A 31 ARG CG C 13 27.076 0.2 A 31 ARG N N 15 125.007 0.15 A 31 ARG NE N 15 85.237 0.15 A 32 GLY H H 1 5.465 0.008 A 32 GLY HAx H 1 3.264 0.008 A 32 GLY HAy H 1 4.670 0.008 A 32 GLY CA C 13 45.150 0.2 A 32 GLY N N 15 101.400 0.15 A 33 ARG H H 1 8.345 0.008 A 33 ARG HA H 1 5.158 0.008 A 33 ARG HBx H 1 1.747 0.008 A 33 ARG HBy H 1 2.061 0.008 A 33 ARG HDx H 1 3.326 0.008 A 33 ARG HE H 1 7.441 0.008 A 33 ARG HGx H 1 1.912 0.008 A 33 ARG CA C 13 54.924 0.2 A 33 ARG CB C 13 34.180 0.2 A 33 ARG CD C 13 43.390 0.2 A 33 ARG CG C 13 28.869 0.2 A 33 ARG N N 15 116.822 0.15 A 33 ARG NE N 15 84.274 0.15 A 34 GLY H H 1 8.549 0.008 A 34 GLY HAy H 1 5.154 0.008 A 34 GLY HAx H 1 3.752 0.008 A 34 GLY CA C 13 45.620 0.2 A 34 GLY N N 15 107.400 0.15 A 35 CYS H H 1 8.803 0.008 A 35 CYS HA H 1 5.893 0.008 A 35 CYS HBy H 1 2.720 0.008 A 35 CYS HBx H 1 1.831 0.008 A 35 CYS CA C 13 55.420 0.2 A 35 CYS CB C 13 30.960 0.2 A 35 CYS N N 15 117.781 0.15 A 36 THR H H 1 9.033 0.008 A 36 THR HA H 1 3.835 0.008 A 36 THR HB H 1 4.889 0.008 A 36 THR HG2% H 1 1.038 0.008 A 36 THR CA C 13 64.160 0.2 A 36 THR CB C 13 68.200 0.2 A 36 THR CG2 C 13 23.169 0.2 A 36 THR N N 15 117.973 0.15 A 37 VAL H H 1 7.545 0.008 A 37 VAL HA H 1 3.709 0.008 A 37 VAL HB H 1 1.820 0.008 A 37 VAL HGx% H 1 0.804 0.008 A 37 VAL HGy% H 1 0.804 0.008 A 37 VAL CA C 13 65.740 0.2 A 37 VAL CB C 13 32.410 0.2 A 37 VAL CGy C 13 23.083 0.2 A 37 VAL CGx C 13 20.959 0.2 A 37 VAL N N 15 121.706 0.15 A 38 GLU H H 1 8.540 0.008 A 38 GLU HA H 1 4.264 0.008 A 38 GLU HBx H 1 1.651 0.008 A 38 GLU HBy H 1 1.807 0.008 A 38 GLU HGy H 1 2.066 0.008 A 38 GLU HGx H 1 1.980 0.008 A 38 GLU CA C 13 54.260 0.2 A 38 GLU CB C 13 30.770 0.2 A 38 GLU CG C 13 36.505 0.2 A 38 GLU N N 15 119.219 0.15 A 39 SER H H 1 8.692 0.008 A 39 SER HA H 1 4.035 0.008 A 39 SER HBy H 1 3.087 0.008 A 39 SER HBx H 1 2.854 0.008 A 39 SER CA C 13 57.370 0.2 A 39 SER CB C 13 63.760 0.2 A 39 SER N N 15 118.941 0.15 A 40 PHE H H 1 8.302 0.008 A 40 PHE HA H 1 4.986 0.008 A 40 PHE HBy H 1 3.111 0.008 A 40 PHE HBx H 1 2.317 0.008 A 40 PHE HDx H 1 7.168 0.008 A 40 PHE HDy H 1 7.168 0.008 A 40 PHE HEx H 1 6.957 0.008 A 40 PHE HEy H 1 6.957 0.008 A 40 PHE HZ H 1 7.176 0.008 A 40 PHE CA C 13 57.320 0.2 A 40 PHE CB C 13 44.292 0.2 A 40 PHE CDx C 13 131.612 0.2 A 40 PHE CEx C 13 130.583 0.2 A 40 PHE CZ C 13 129.126 0.2 A 40 PHE N N 15 119.300 0.15 A 41 PRO HA H 1 3.828 0.008 A 41 PRO HBx H 1 0.667 0.008 A 41 PRO HBy H 1 1.278 0.008 A 41 PRO HDy H 1 4.034 0.008 A 41 PRO HDx H 1 3.786 0.008 A 41 PRO HGy H 1 1.540 0.008 A 41 PRO HGx H 1 0.894 0.008 A 41 PRO CA C 13 62.270 0.2 A 41 PRO CB C 13 30.790 0.2 A 41 PRO CD C 13 50.635 0.2 A 41 PRO CG C 13 28.428 0.2 A 42 LEU H H 1 7.964 0.008 A 42 LEU HA H 1 5.352 0.008 A 42 LEU HBx H 1 1.185 0.008 A 42 LEU HBy H 1 2.540 0.008 A 42 LEU HDx% H 1 0.775 0.008 A 42 LEU HDy% H 1 0.707 0.008 A 42 LEU CA C 13 53.830 0.2 A 42 LEU CB C 13 42.380 0.2 A 42 LEU CDy C 13 25.569 0.2 A 42 LEU CDx C 13 25.459 0.2 A 42 LEU N N 15 129.948 0.15 A 43 VAL H H 1 8.607 0.008 A 43 VAL HA H 1 5.296 0.008 A 43 VAL HB H 1 2.136 0.008 A 43 VAL HGx% H 1 0.815 0.008 A 43 VAL HGy% H 1 1.110 0.008 A 43 VAL CA C 13 58.040 0.2 A 43 VAL CB C 13 35.220 0.2 A 43 VAL CGx C 13 19.012 0.2 A 43 VAL CGy C 13 21.491 0.2 A 43 VAL N N 15 117.190 0.15 A 44 ILE H H 1 9.056 0.008 A 44 ILE HA H 1 4.426 0.008 A 44 ILE HB H 1 1.378 0.008 A 44 ILE HD1% H 1 0.051 0.008 A 44 ILE HG1y H 1 1.171 0.008 A 44 ILE HG1x H 1 0.375 0.008 A 44 ILE HG2% H 1 0.493 0.008 A 44 ILE CA C 13 61.156 0.2 A 44 ILE CB C 13 38.544 0.2 A 44 ILE CD1 C 13 12.219 0.2 A 44 ILE CG1 C 13 27.385 0.2 A 44 ILE CG2 C 13 17.747 0.2 A 44 ILE N N 15 122.963 0.15 A 45 ALA H H 1 8.701 0.008 A 45 ALA HA H 1 4.626 0.008 A 45 ALA HB% H 1 -0.318 0.008 A 45 ALA CA C 13 51.430 0.2 A 45 ALA CB C 13 21.670 0.2 A 45 ALA N N 15 126.347 0.15 A 46 GLY H H 1 8.486 0.008 A 46 GLY HAy H 1 4.587 0.008 A 46 GLY HAx H 1 4.084 0.008 A 46 GLY CA C 13 44.500 0.2 A 46 GLY N N 15 108.262 0.15 A 47 GLU H H 1 8.938 0.008 A 47 GLU HA H 1 4.003 0.008 A 47 GLU HBy H 1 1.810 0.008 A 47 GLU HBx H 1 1.740 0.008 A 47 GLU CA C 13 58.820 0.2 A 47 GLU CB C 13 29.500 0.2 A 47 GLU N N 15 118.010 0.15 A 48 HIS H H 1 8.742 0.008 A 48 HIS HA H 1 4.704 0.008 A 48 HIS HBx H 1 3.008 0.008 A 48 HIS HBy H 1 3.370 0.008 A 48 HIS HD2 H 1 7.213 0.008 A 48 HIS CA C 13 55.130 0.2 A 48 HIS CB C 13 29.110 0.2 A 48 HIS CD2 C 13 120.211 0.2 A 48 HIS N N 15 115.306 0.15 A 49 ASN H H 1 7.810 0.008 A 49 ASN HA H 1 3.878 0.008 A 49 ASN HBx H 1 2.188 0.008 A 49 ASN HBy H 1 3.193 0.008 A 49 ASN HD2y H 1 7.835 0.008 A 49 ASN HD2x H 1 6.871 0.008 A 49 ASN CA C 13 53.876 0.2 A 49 ASN CB C 13 36.030 0.2 A 49 ASN N N 15 114.919 0.15 A 49 ASN ND2 N 15 113.084 0.15 A 50 ILE H H 1 7.046 0.008 A 50 ILE HA H 1 4.022 0.008 A 50 ILE HB H 1 1.471 0.008 A 50 ILE HD1% H 1 0.878 0.008 A 50 ILE HG1y H 1 1.585 0.008 A 50 ILE HG1x H 1 1.006 0.008 A 50 ILE HG2% H 1 -0.217 0.008 A 50 ILE CA C 13 59.430 0.2 A 50 ILE CB C 13 41.326 0.2 A 50 ILE CD1 C 13 13.726 0.2 A 50 ILE CG1 C 13 30.358 0.2 A 50 ILE CG2 C 13 16.275 0.2 A 50 ILE N N 15 120.995 0.15 A 51 PRO HA H 1 5.194 0.008 A 51 PRO HBx H 1 1.261 0.008 A 51 PRO CA C 13 60.560 0.2 A 51 PRO CB C 13 31.841 0.2 A 52 TRP H H 1 9.564 0.008 A 52 TRP HA H 1 4.805 0.008 A 52 TRP HBy H 1 2.993 0.008 A 52 TRP HD1 H 1 6.728 0.008 A 52 TRP HE1 H 1 8.617 0.008 A 52 TRP HE3 H 1 6.974 0.008 A 52 TRP HH2 H 1 7.016 0.008 A 52 TRP HZ2 H 1 7.366 0.008 A 52 TRP HZ3 H 1 6.225 0.008 A 52 TRP CA C 13 56.550 0.2 A 52 TRP CB C 13 32.300 0.2 A 52 TRP CD1 C 13 130.410 0.2 A 52 TRP CE3 C 13 120.588 0.2 A 52 TRP CH2 C 13 123.117 0.2 A 52 TRP CZ2 C 13 113.681 0.2 A 52 TRP CZ3 C 13 120.777 0.2 A 52 TRP N N 15 123.070 0.15 A 52 TRP NE1 N 15 129.382 0.15 A 53 LEU H H 1 7.227 0.008 A 53 LEU HA H 1 4.863 0.008 A 53 LEU HBy H 1 1.728 0.008 A 53 LEU HBx H 1 0.164 0.008 A 53 LEU HDx% H 1 0.179 0.008 A 53 LEU HDy% H 1 0.495 0.008 A 53 LEU HG H 1 0.973 0.008 A 53 LEU CA C 13 53.790 0.2 A 53 LEU CB C 13 42.250 0.2 A 53 LEU CDx C 13 25.436 0.2 A 53 LEU CDy C 13 27.117 0.2 A 53 LEU CG C 13 27.052 0.2 A 53 LEU N N 15 124.700 0.15 A 54 LEU H H 1 9.021 0.008 A 54 LEU HA H 1 4.618 0.008 A 54 LEU HBy H 1 1.476 0.008 A 54 LEU HBx H 1 0.782 0.008 A 54 LEU HDx% H 1 0.253 0.008 A 54 LEU HDy% H 1 0.500 0.008 A 54 LEU HG H 1 1.622 0.008 A 54 LEU CA C 13 54.030 0.2 A 54 LEU CB C 13 40.360 0.2 A 54 LEU CDy C 13 24.698 0.2 A 54 LEU CDx C 13 22.839 0.2 A 54 LEU CG C 13 26.535 0.2 A 54 LEU N N 15 126.893 0.15 A 55 TYR H H 1 8.884 0.008 A 55 TYR HA H 1 4.562 0.008 A 55 TYR HBx H 1 2.764 0.008 A 55 TYR HBy H 1 3.303 0.008 A 55 TYR HDx H 1 7.128 0.008 A 55 TYR HDy H 1 7.128 0.008 A 55 TYR HEx H 1 6.862 0.008 A 55 TYR HEy H 1 6.862 0.008 A 55 TYR CA C 13 58.420 0.2 A 55 TYR CB C 13 36.180 0.2 A 55 TYR CDx C 13 133.152 0.2 A 55 TYR CEx C 13 117.976 0.2 A 55 TYR N N 15 123.430 0.15 A 56 LEU H H 1 8.192 0.008 A 56 LEU HA H 1 4.530 0.008 A 56 LEU HBy H 1 1.368 0.008 A 56 LEU HBx H 1 0.974 0.008 A 56 LEU HDx% H 1 0.708 0.008 A 56 LEU HDy% H 1 0.803 0.008 A 56 LEU CA C 13 51.720 0.2 A 56 LEU CB C 13 43.260 0.2 A 56 LEU CDy C 13 25.367 0.2 A 56 LEU CDx C 13 25.270 0.2 A 56 LEU N N 15 130.832 0.15 A 57 PRO HA H 1 3.779 0.008 A 57 PRO HBy H 1 1.730 0.008 A 57 PRO HBx H 1 1.566 0.008 A 57 PRO HDx H 1 2.527 0.008 A 57 PRO HDy H 1 3.353 0.008 A 57 PRO HGx H 1 1.618 0.008 A 57 PRO HGy H 1 1.844 0.008 A 57 PRO CA C 13 62.240 0.2 A 57 PRO CB C 13 31.130 0.2 A 57 PRO CD C 13 49.606 0.2 A 57 PRO CG C 13 27.418 0.2 A 58 GLY H H 1 8.908 0.008 A 58 GLY HAy H 1 4.027 0.008 A 58 GLY HAx H 1 3.433 0.008 A 58 GLY CA C 13 44.860 0.2 A 58 GLY N N 15 112.351 0.15 A 59 LYS H H 1 7.214 0.008 A 59 LYS HA H 1 4.386 0.008 A 59 LYS HBy H 1 1.550 0.008 A 59 LYS HBx H 1 1.515 0.008 A 59 LYS HDx H 1 1.481 0.008 A 59 LYS HDy H 1 1.575 0.008 A 59 LYS HEy H 1 2.895 0.008 A 59 LYS HEx H 1 2.837 0.008 A 59 LYS HGx H 1 1.144 0.008 A 59 LYS HGy H 1 1.251 0.008 A 59 LYS CA C 13 53.760 0.2 A 59 LYS CB C 13 34.590 0.2 A 59 LYS CD C 13 28.483 0.2 A 59 LYS CE C 13 42.284 0.2 A 59 LYS CG C 13 24.985 0.2 A 59 LYS N N 15 121.458 0.15 A 60 GLY H H 1 8.312 0.008 A 60 GLY HAy H 1 3.379 0.008 A 60 GLY HAx H 1 3.229 0.008 A 60 GLY CA C 13 45.350 0.2 A 60 GLY N N 15 103.990 0.15 A 61 HIS H H 1 7.880 0.008 A 61 HIS HA H 1 4.868 0.008 A 61 HIS HBx H 1 2.694 0.008 A 61 HIS HBy H 1 3.270 0.008 A 61 HIS HD2 H 1 6.873 0.008 A 61 HIS CA C 13 53.920 0.2 A 61 HIS CB C 13 33.020 0.2 A 61 HIS CD2 C 13 120.370 0.2 A 61 HIS N N 15 121.221 0.15 A 62 CYS H H 1 8.760 0.008 A 62 CYS HA H 1 4.248 0.008 A 62 CYS HBx H 1 2.564 0.008 A 62 CYS HBy H 1 3.328 0.008 A 62 CYS CA C 13 61.730 0.2 A 62 CYS CB C 13 26.560 0.2 A 62 CYS N N 15 121.842 0.15 A 63 VAL H H 1 8.109 0.008 A 63 VAL HA H 1 4.869 0.008 A 63 VAL HB H 1 1.974 0.008 A 63 VAL HGx% H 1 1.123 0.008 A 63 VAL HGy% H 1 1.229 0.008 A 63 VAL CA C 13 62.210 0.2 A 63 VAL CB C 13 34.780 0.2 A 63 VAL CGy C 13 22.336 0.2 A 63 VAL CGx C 13 22.267 0.2 A 63 VAL N N 15 127.029 0.15 A 64 THR H H 1 8.453 0.008 A 64 THR HA H 1 5.349 0.008 A 64 THR HB H 1 4.465 0.008 A 64 THR HG2% H 1 1.358 0.008 A 64 THR CA C 13 61.100 0.2 A 64 THR CB C 13 70.790 0.2 A 64 THR CG2 C 13 22.252 0.2 A 64 THR N N 15 116.830 0.15 A 65 GLY H H 1 8.663 0.008 A 65 GLY HAy H 1 4.085 0.008 A 65 GLY HAx H 1 3.480 0.008 A 65 GLY CA C 13 46.570 0.2 A 65 GLY N N 15 107.680 0.15 A 66 GLU H H 1 8.574 0.008 A 66 GLU HA H 1 5.150 0.008 A 66 GLU HBx H 1 2.337 0.008 A 66 GLU HBy H 1 2.397 0.008 A 66 GLU CA C 13 54.450 0.2 A 66 GLU CB C 13 37.328 0.2 A 66 GLU N N 15 120.921 0.15 A 67 ILE H H 1 8.623 0.008 A 67 ILE HA H 1 5.149 0.008 A 67 ILE HB H 1 1.044 0.008 A 67 ILE HD1% H 1 0.702 0.008 A 67 ILE HG1y H 1 1.537 0.008 A 67 ILE HG1x H 1 1.027 0.008 A 67 ILE HG2% H 1 0.817 0.008 A 67 ILE CA C 13 60.180 0.2 A 67 ILE CB C 13 40.210 0.2 A 67 ILE CD1 C 13 14.735 0.2 A 67 ILE CG1 C 13 28.425 0.2 A 67 ILE CG2 C 13 17.906 0.2 A 67 ILE N N 15 121.340 0.15 A 68 TYR H H 1 9.196 0.008 A 68 TYR HA H 1 5.001 0.008 A 68 TYR HBy H 1 2.557 0.008 A 68 TYR HBx H 1 2.439 0.008 A 68 TYR HDx H 1 6.768 0.008 A 68 TYR HDy H 1 6.768 0.008 A 68 TYR HEx H 1 6.983 0.008 A 68 TYR HEy H 1 6.983 0.008 A 68 TYR CA C 13 56.270 0.2 A 68 TYR CB C 13 41.480 0.2 A 68 TYR CDx C 13 132.098 0.2 A 68 TYR CEx C 13 118.458 0.2 A 68 TYR N N 15 123.650 0.15 A 69 GLU H H 1 9.302 0.008 A 69 GLU HA H 1 5.066 0.008 A 69 GLU HBy H 1 1.929 0.008 A 69 GLU HBx H 1 1.849 0.008 A 69 GLU HGx H 1 1.926 0.008 A 69 GLU HGy H 1 2.038 0.008 A 69 GLU CA C 13 55.180 0.2 A 69 GLU CB C 13 31.420 0.2 A 69 GLU CG C 13 35.953 0.2 A 69 GLU N N 15 124.090 0.15 A 70 VAL H H 1 8.908 0.008 A 70 VAL HA H 1 5.556 0.008 A 70 VAL HB H 1 2.314 0.008 A 70 VAL HGx% H 1 0.858 0.008 A 70 VAL HGy% H 1 0.724 0.008 A 70 VAL CA C 13 57.780 0.2 A 70 VAL CB C 13 35.400 0.2 A 70 VAL CGy C 13 22.114 0.2 A 70 VAL CGx C 13 19.284 0.2 A 70 VAL N N 15 119.540 0.15 A 71 ASP H H 1 7.939 0.008 A 71 ASP HA H 1 4.909 0.008 A 71 ASP HBx H 1 2.708 0.008 A 71 ASP HBy H 1 3.266 0.008 A 71 ASP CA C 13 51.240 0.2 A 71 ASP CB C 13 42.210 0.2 A 71 ASP N N 15 120.720 0.15 A 72 GLU H H 1 8.364 0.008 A 72 GLU HA H 1 3.869 0.008 A 72 GLU HBx H 1 1.984 0.008 A 72 GLU HGx H 1 2.294 0.008 A 72 GLU CA C 13 59.775 0.2 A 72 GLU CB C 13 29.140 0.2 A 72 GLU CG C 13 36.654 0.2 A 72 GLU N N 15 117.910 0.15 A 73 GLN H H 1 7.960 0.008 A 73 GLN HA H 1 3.899 0.008 A 73 GLN HBx H 1 2.082 0.008 A 73 GLN HE2y H 1 7.363 0.008 A 73 GLN HE2x H 1 6.656 0.008 A 73 GLN HGx H 1 2.396 0.008 A 73 GLN CA C 13 59.570 0.2 A 73 GLN CB C 13 27.810 0.2 A 73 GLN CG C 13 33.354 0.2 A 73 GLN N N 15 119.617 0.15 A 73 GLN NE2 N 15 111.729 0.15 A 74 MET H H 1 8.489 0.008 A 74 MET HA H 1 4.766 0.008 A 74 MET HBy H 1 2.251 0.008 A 74 MET HBx H 1 2.061 0.008 A 74 MET HE% H 1 1.691 0.008 A 74 MET HGx H 1 2.550 0.008 A 74 MET CA C 13 56.790 0.2 A 74 MET CB C 13 31.900 0.2 A 74 MET CE C 13 17.774 0.2 A 74 MET CG C 13 32.505 0.2 A 74 MET N N 15 121.800 0.15 A 75 LEU H H 1 8.162 0.008 A 75 LEU HA H 1 3.897 0.008 A 75 LEU HBx H 1 1.438 0.008 A 75 LEU HBy H 1 1.542 0.008 A 75 LEU HDx% H 1 0.492 0.008 A 75 LEU HDy% H 1 0.546 0.008 A 75 LEU HG H 1 0.724 0.008 A 75 LEU CA C 13 58.230 0.2 A 75 LEU CB C 13 42.160 0.2 A 75 LEU CDy C 13 24.936 0.2 A 75 LEU CDx C 13 24.517 0.2 A 75 LEU CG C 13 19.262 0.2 A 75 LEU N N 15 120.230 0.15 A 76 ARG H H 1 7.824 0.008 A 76 ARG HA H 1 3.952 0.008 A 76 ARG HBy H 1 1.912 0.008 A 76 ARG HBx H 1 1.885 0.008 A 76 ARG HDx H 1 3.156 0.008 A 76 ARG HDy H 1 3.188 0.008 A 76 ARG HE H 1 7.408 0.008 A 76 ARG HGx H 1 1.626 0.008 A 76 ARG HGy H 1 1.767 0.008 A 76 ARG CA C 13 59.270 0.2 A 76 ARG CB C 13 29.930 0.2 A 76 ARG CD C 13 43.499 0.2 A 76 ARG CG C 13 27.852 0.2 A 76 ARG N N 15 116.540 0.15 A 76 ARG NE N 15 85.111 0.15 A 77 PHE H H 1 8.137 0.008 A 77 PHE HA H 1 4.085 0.008 A 77 PHE HBx H 1 3.265 0.008 A 77 PHE HBy H 1 3.310 0.008 A 77 PHE HDx H 1 6.919 0.008 A 77 PHE HDy H 1 6.919 0.008 A 77 PHE HEx H 1 6.598 0.008 A 77 PHE HEy H 1 6.598 0.008 A 77 PHE CA C 13 61.980 0.2 A 77 PHE CB C 13 38.530 0.2 A 77 PHE CDx C 13 131.757 0.2 A 77 PHE CEx C 13 130.268 0.2 A 77 PHE N N 15 120.650 0.15 A 78 LEU H H 1 9.071 0.008 A 78 LEU HA H 1 3.629 0.008 A 78 LEU HBy H 1 2.147 0.008 A 78 LEU HBx H 1 1.179 0.008 A 78 LEU HDx% H 1 0.665 0.008 A 78 LEU HDy% H 1 0.477 0.008 A 78 LEU HG H 1 1.829 0.008 A 78 LEU CA C 13 57.730 0.2 A 78 LEU CB C 13 41.420 0.2 A 78 LEU CDy C 13 26.627 0.2 A 78 LEU CDx C 13 22.293 0.2 A 78 LEU CG C 13 26.837 0.2 A 78 LEU N N 15 122.360 0.15 A 79 ASP H H 1 8.506 0.008 A 79 ASP HA H 1 4.320 0.008 A 79 ASP HBy H 1 2.845 0.008 A 79 ASP HBx H 1 2.577 0.008 A 79 ASP CA C 13 57.190 0.2 A 79 ASP CB C 13 39.420 0.2 A 79 ASP N N 15 120.070 0.15 A 80 ASP H H 1 7.154 0.008 A 80 ASP HA H 1 4.501 0.008 A 80 ASP HBy H 1 2.596 0.008 A 80 ASP HBx H 1 2.515 0.008 A 80 ASP CA C 13 56.700 0.2 A 80 ASP CB C 13 40.660 0.2 A 80 ASP N N 15 118.890 0.15 A 81 PHE H H 1 8.791 0.008 A 81 PHE HA H 1 3.659 0.008 A 81 PHE HBx H 1 2.280 0.008 A 81 PHE HBy H 1 2.580 0.008 A 81 PHE HDx H 1 6.841 0.008 A 81 PHE HDy H 1 6.841 0.008 A 81 PHE CA C 13 61.640 0.2 A 81 PHE CB C 13 40.210 0.2 A 81 PHE CDx C 13 131.487 0.2 A 81 PHE N N 15 125.745 0.15 A 82 GLU H H 1 8.209 0.008 A 82 GLU HA H 1 3.956 0.008 A 82 GLU HBx H 1 1.683 0.008 A 82 GLU HGy H 1 1.304 0.008 A 82 GLU CA C 13 55.060 0.2 A 82 GLU CB C 13 28.910 0.2 A 82 GLU CG C 13 29.093 0.2 A 82 GLU N N 15 115.707 0.15 A 83 ASP H H 1 7.615 0.008 A 83 ASP HA H 1 4.236 0.008 A 83 ASP HBx H 1 2.256 0.008 A 83 ASP HBy H 1 3.192 0.008 A 83 ASP CA C 13 54.370 0.2 A 83 ASP CB C 13 39.400 0.2 A 83 ASP N N 15 116.517 0.15 A 84 CYS H H 1 8.361 0.008 A 84 CYS HA H 1 5.522 0.008 A 84 CYS HBx H 1 2.651 0.008 A 84 CYS HBy H 1 3.050 0.008 A 84 CYS CA C 13 56.617 0.2 A 84 CYS CB C 13 27.651 0.2 A 84 CYS N N 15 119.420 0.15 A 85 PRO HA H 1 5.704 0.008 A 85 PRO HBy H 1 2.408 0.008 A 85 PRO HBx H 1 2.173 0.008 A 85 PRO HDx H 1 3.479 0.008 A 85 PRO HDy H 1 3.519 0.008 A 85 PRO HGy H 1 1.968 0.008 A 85 PRO HGx H 1 1.658 0.008 A 85 PRO CA C 13 64.355 0.2 A 85 PRO CB C 13 33.190 0.2 A 85 PRO CD C 13 49.372 0.2 A 85 PRO CG C 13 24.186 0.2 A 86 SER H H 1 8.389 0.008 A 86 SER HA H 1 4.175 0.008 A 86 SER HBx H 1 3.828 0.008 A 86 SER CA C 13 62.130 0.2 A 86 SER CB C 13 63.080 0.2 A 86 SER N N 15 122.195 0.15 A 87 MET H H 1 8.576 0.008 A 87 MET HA H 1 4.475 0.008 A 87 MET HBx H 1 2.393 0.008 A 87 MET HBy H 1 2.586 0.008 A 87 MET HE% H 1 2.091 0.008 A 87 MET HGy H 1 2.841 0.008 A 87 MET CA C 13 57.520 0.2 A 87 MET CB C 13 33.210 0.2 A 87 MET CE C 13 17.734 0.2 A 87 MET CG C 13 32.972 0.2 A 87 MET N N 15 121.299 0.15 A 88 TYR H H 1 6.778 0.008 A 88 TYR HA H 1 5.023 0.008 A 88 TYR HBx H 1 2.671 0.008 A 88 TYR HBy H 1 3.212 0.008 A 88 TYR HDx H 1 7.250 0.008 A 88 TYR HDy H 1 7.250 0.008 A 88 TYR HEx H 1 6.495 0.008 A 88 TYR HEy H 1 6.495 0.008 A 88 TYR CA C 13 56.300 0.2 A 88 TYR CB C 13 42.530 0.2 A 88 TYR CDx C 13 133.576 0.2 A 88 TYR CEx C 13 117.690 0.2 A 88 TYR N N 15 113.420 0.15 A 89 GLN H H 1 9.567 0.008 A 89 GLN HA H 1 4.857 0.008 A 89 GLN HBx H 1 1.867 0.008 A 89 GLN HBy H 1 2.014 0.008 A 89 GLN HE2y H 1 7.250 0.008 A 89 GLN HE2x H 1 6.362 0.008 A 89 GLN HGy H 1 2.415 0.008 A 89 GLN HGx H 1 2.366 0.008 A 89 GLN CA C 13 55.870 0.2 A 89 GLN CB C 13 30.430 0.2 A 89 GLN CG C 13 35.078 0.2 A 89 GLN N N 15 115.440 0.15 A 89 GLN NE2 N 15 112.016 0.15 A 90 ARG H H 1 8.772 0.008 A 90 ARG HA H 1 4.499 0.008 A 90 ARG HBx H 1 1.396 0.008 A 90 ARG HBy H 1 1.659 0.008 A 90 ARG HDy H 1 2.564 0.008 A 90 ARG HDx H 1 2.123 0.008 A 90 ARG HE H 1 9.717 0.008 A 90 ARG HGx H 1 0.633 0.008 A 90 ARG HGy H 1 1.169 0.008 A 90 ARG CA C 13 56.620 0.2 A 90 ARG CB C 13 29.020 0.2 A 90 ARG CD C 13 41.536 0.2 A 90 ARG CG C 13 26.454 0.2 A 90 ARG N N 15 123.860 0.15 A 90 ARG NE N 15 81.159 0.15 A 91 THR H H 1 9.217 0.008 A 91 THR HA H 1 4.518 0.008 A 91 THR HB H 1 3.909 0.008 A 91 THR HG2% H 1 0.840 0.008 A 91 THR CA C 13 60.570 0.2 A 91 THR CB C 13 71.050 0.2 A 91 THR CG2 C 13 21.232 0.2 A 91 THR N N 15 125.064 0.15 A 92 ALA H H 1 8.655 0.008 A 92 ALA HA H 1 5.041 0.008 A 92 ALA HB% H 1 1.045 0.008 A 92 ALA CA C 13 51.320 0.2 A 92 ALA CB C 13 19.480 0.2 A 92 ALA N N 15 126.963 0.15 A 93 LEU H H 1 9.005 0.008 A 93 LEU HA H 1 4.720 0.008 A 93 LEU HBx H 1 1.448 0.008 A 93 LEU HBy H 1 1.600 0.008 A 93 LEU HDx% H 1 0.831 0.008 A 93 LEU HDy% H 1 1.119 0.008 A 93 LEU HG H 1 0.416 0.008 A 93 LEU CA C 13 53.750 0.2 A 93 LEU CB C 13 45.340 0.2 A 93 LEU CDy C 13 25.119 0.2 A 93 LEU CDx C 13 23.348 0.2 A 93 LEU CG C 13 24.897 0.2 A 93 LEU N N 15 122.440 0.15 A 94 GLN H H 1 8.360 0.008 A 94 GLN HA H 1 4.229 0.008 A 94 GLN HBx H 1 1.831 0.008 A 94 GLN HE2y H 1 7.303 0.008 A 94 GLN HE2x H 1 6.599 0.008 A 94 GLN HGx H 1 2.214 0.008 A 94 GLN CA C 13 56.040 0.2 A 94 GLN CB C 13 28.780 0.2 A 94 GLN CG C 13 33.296 0.2 A 94 GLN N N 15 119.357 0.15 A 94 GLN NE2 N 15 109.450 0.15 A 95 VAL H H 1 8.612 0.008 A 95 VAL HA H 1 4.013 0.008 A 95 VAL HB H 1 1.812 0.008 A 95 VAL HGx% H 1 0.301 0.008 A 95 VAL HGy% H 1 0.115 0.008 A 95 VAL CA C 13 61.440 0.2 A 95 VAL CB C 13 35.110 0.2 A 95 VAL CGy C 13 21.270 0.2 A 95 VAL CGx C 13 21.212 0.2 A 95 VAL N N 15 126.928 0.15 A 96 GLN H H 1 9.222 0.008 A 96 GLN HA H 1 4.279 0.008 A 96 GLN HBy H 1 2.186 0.008 A 96 GLN HBx H 1 1.821 0.008 A 96 GLN HE2y H 1 7.304 0.008 A 96 GLN HE2x H 1 6.625 0.008 A 96 GLN HGy H 1 2.282 0.008 A 96 GLN HGx H 1 1.990 0.008 A 96 GLN CA C 13 55.150 0.2 A 96 GLN CB C 13 29.100 0.2 A 96 GLN CG C 13 33.368 0.2 A 96 GLN N N 15 128.360 0.15 A 96 GLN NE2 N 15 110.915 0.15 A 97 VAL H H 1 8.233 0.008 A 97 VAL HA H 1 3.674 0.008 A 97 VAL HB H 1 1.929 0.008 A 97 VAL HGx% H 1 0.901 0.008 A 97 VAL HGy% H 1 0.569 0.008 A 97 VAL CA C 13 64.040 0.2 A 97 VAL CB C 13 31.920 0.2 A 97 VAL CGy C 13 22.891 0.2 A 97 VAL CGx C 13 22.051 0.2 A 97 VAL N N 15 128.120 0.15 A 98 LEU H H 1 8.880 0.008 A 98 LEU HA H 1 4.472 0.008 A 98 LEU HBy H 1 1.505 0.008 A 98 LEU HBx H 1 1.384 0.008 A 98 LEU HDy% H 1 0.782 0.008 A 98 LEU HG H 1 1.741 0.008 A 98 LEU CA C 13 55.641 0.2 A 98 LEU CB C 13 42.510 0.2 A 98 LEU CDy C 13 22.136 0.2 A 98 LEU CG C 13 34.310 0.2 A 98 LEU N N 15 128.877 0.15 A 99 GLU H H 1 7.682 0.008 A 99 GLU HA H 1 4.403 0.008 A 99 GLU HBy H 1 2.034 0.008 A 99 GLU HBx H 1 1.945 0.008 A 99 GLU HGy H 1 2.256 0.008 A 99 GLU HGx H 1 2.163 0.008 A 99 GLU CA C 13 56.310 0.2 A 99 GLU CB C 13 32.790 0.2 A 99 GLU CG C 13 35.741 0.2 A 99 GLU N N 15 118.210 0.15 A 100 TRP H H 1 8.883 0.008 A 100 TRP HA H 1 5.205 0.008 A 100 TRP HBy H 1 3.013 0.008 A 100 TRP HBx H 1 2.849 0.008 A 100 TRP HD1 H 1 6.902 0.008 A 100 TRP HE1 H 1 9.157 0.008 A 100 TRP HE3 H 1 7.291 0.008 A 100 TRP HH2 H 1 6.428 0.008 A 100 TRP HZ2 H 1 7.371 0.008 A 100 TRP HZ3 H 1 6.396 0.008 A 100 TRP CA C 13 55.982 0.2 A 100 TRP CB C 13 32.430 0.2 A 100 TRP CD1 C 13 127.532 0.2 A 100 TRP CE3 C 13 120.938 0.2 A 100 TRP CH2 C 13 122.645 0.2 A 100 TRP CZ2 C 13 114.552 0.2 A 100 TRP CZ3 C 13 120.483 0.2 A 100 TRP N N 15 126.421 0.15 A 100 TRP NE1 N 15 128.299 0.15 A 101 GLU H H 1 8.116 0.008 A 101 GLU HA H 1 4.462 0.008 A 101 GLU HBy H 1 1.762 0.008 A 101 GLU HBx H 1 1.469 0.008 A 101 GLU HGy H 1 1.970 0.008 A 101 GLU CA C 13 55.050 0.2 A 101 GLU CB C 13 30.950 0.2 A 101 GLU CG C 13 35.825 0.2 A 101 GLU N N 15 128.535 0.15 A 102 GLY H H 1 7.614 0.008 A 102 GLY HAx H 1 3.853 0.008 A 102 GLY HAy H 1 3.905 0.008 A 102 GLY CA C 13 44.440 0.2 A 102 GLY N N 15 108.953 0.15 A 103 ASP H H 1 8.261 0.008 A 103 ASP HA H 1 4.641 0.008 A 103 ASP HBx H 1 2.630 0.008 A 103 ASP HBy H 1 2.680 0.008 A 103 ASP CA C 13 54.530 0.2 A 103 ASP CB C 13 41.690 0.2 A 103 ASP N N 15 118.730 0.15 A 104 GLY H H 1 8.526 0.008 A 104 GLY HAx H 1 3.719 0.008 A 104 GLY HAy H 1 3.892 0.008 A 104 GLY CA C 13 45.960 0.2 A 104 GLY N N 15 109.230 0.15 A 105 ASP H H 1 7.806 0.008 A 105 ASP HA H 1 3.381 0.008 A 105 ASP HBy H 1 2.472 0.008 A 105 ASP HBx H 1 2.388 0.008 A 105 ASP CA C 13 51.020 0.2 A 105 ASP CB C 13 41.406 0.2 A 105 ASP N N 15 119.739 0.15 A 106 PRO HA H 1 4.065 0.008 A 106 PRO HBy H 1 1.444 0.008 A 106 PRO HBx H 1 1.191 0.008 A 106 PRO HDy H 1 2.591 0.008 A 106 PRO HDx H 1 1.821 0.008 A 106 PRO HGy H 1 1.097 0.008 A 106 PRO HGx H 1 0.366 0.008 A 106 PRO CA C 13 62.970 0.2 A 106 PRO CB C 13 31.660 0.2 A 106 PRO CD C 13 49.081 0.2 A 106 PRO CG C 13 25.711 0.2 A 107 GLY H H 1 7.863 0.008 A 107 GLY HAx H 1 3.401 0.008 A 107 GLY HAy H 1 4.103 0.008 A 107 GLY CA C 13 44.170 0.2 A 107 GLY N N 15 109.610 0.15 A 108 ASP H H 1 8.171 0.008 A 108 ASP HA H 1 4.283 0.008 A 108 ASP HBx H 1 2.579 0.008 A 108 ASP CA C 13 56.430 0.2 A 108 ASP CB C 13 41.490 0.2 A 108 ASP N N 15 119.264 0.15 A 109 SER H H 1 7.560 0.008 A 109 SER HA H 1 5.188 0.008 A 109 SER HBy H 1 3.587 0.008 A 109 SER HBx H 1 3.404 0.008 A 109 SER CA C 13 56.740 0.2 A 109 SER CB C 13 65.780 0.2 A 109 SER N N 15 110.810 0.15 A 110 VAL H H 1 8.932 0.008 A 110 VAL HA H 1 4.262 0.008 A 110 VAL HB H 1 1.525 0.008 A 110 VAL HGx% H 1 0.441 0.008 A 110 VAL HGy% H 1 0.532 0.008 A 110 VAL CA C 13 59.470 0.2 A 110 VAL CB C 13 35.400 0.2 A 110 VAL CGx C 13 20.241 0.2 A 110 VAL CGy C 13 20.656 0.2 A 110 VAL N N 15 118.530 0.15 A 111 GLN H H 1 8.468 0.008 A 111 GLN HA H 1 4.422 0.008 A 111 GLN HBx H 1 1.807 0.008 A 111 GLN HBy H 1 1.841 0.008 A 111 GLN HE2y H 1 7.363 0.008 A 111 GLN HE2x H 1 6.680 0.008 A 111 GLN HGx H 1 1.873 0.008 A 111 GLN HGy H 1 1.904 0.008 A 111 GLN CA C 13 55.960 0.2 A 111 GLN CB C 13 29.470 0.2 A 111 GLN CG C 13 34.336 0.2 A 111 GLN N N 15 127.378 0.15 A 111 GLN NE2 N 15 111.192 0.15 A 112 CYS H H 1 8.785 0.008 A 112 CYS HA H 1 4.782 0.008 A 112 CYS HBx H 1 2.348 0.008 A 112 CYS HBy H 1 2.633 0.008 A 112 CYS CA C 13 57.100 0.2 A 112 CYS CB C 13 33.700 0.2 A 112 CYS N N 15 122.300 0.15 A 113 PHE H H 1 8.838 0.008 A 113 PHE HA H 1 5.154 0.008 A 113 PHE HBy H 1 2.792 0.008 A 113 PHE HBx H 1 2.567 0.008 A 113 PHE HDx H 1 7.034 0.008 A 113 PHE HDy H 1 7.034 0.008 A 113 PHE HEx H 1 7.394 0.008 A 113 PHE HEy H 1 7.394 0.008 A 113 PHE CA C 13 58.650 0.2 A 113 PHE CB C 13 40.210 0.2 A 113 PHE CDx C 13 130.530 0.2 A 113 PHE CEx C 13 132.554 0.2 A 113 PHE N N 15 118.974 0.15 A 114 VAL H H 1 9.079 0.008 A 114 VAL HA H 1 4.472 0.008 A 114 VAL HB H 1 1.858 0.008 A 114 VAL HGx% H 1 1.119 0.008 A 114 VAL HGy% H 1 1.065 0.008 A 114 VAL CA C 13 60.650 0.2 A 114 VAL CB C 13 35.970 0.2 A 114 VAL CGy C 13 23.349 0.2 A 114 VAL CGx C 13 22.052 0.2 A 114 VAL N N 15 121.660 0.15 A 115 TYR H H 1 9.672 0.008 A 115 TYR HA H 1 4.988 0.008 A 115 TYR HBx H 1 2.325 0.008 A 115 TYR HBy H 1 2.399 0.008 A 115 TYR HDx H 1 6.807 0.008 A 115 TYR HDy H 1 6.807 0.008 A 115 TYR HEx H 1 6.622 0.008 A 115 TYR HEy H 1 6.622 0.008 A 115 TYR CA C 13 59.240 0.2 A 115 TYR CB C 13 36.925 0.2 A 115 TYR CDx C 13 132.481 0.2 A 115 TYR CEx C 13 116.851 0.2 A 115 TYR N N 15 127.830 0.15 A 116 THR H H 1 9.061 0.008 A 116 THR HA H 1 5.435 0.008 A 116 THR HB H 1 4.293 0.008 A 116 THR HG2% H 1 0.962 0.008 A 116 THR CA C 13 60.130 0.2 A 116 THR CB C 13 71.910 0.2 A 116 THR CG2 C 13 22.070 0.2 A 116 THR N N 15 119.130 0.15 A 117 THR H H 1 8.707 0.008 A 117 THR HA H 1 5.561 0.008 A 117 THR HB H 1 4.447 0.008 A 117 THR HG2% H 1 1.467 0.008 A 117 THR CA C 13 60.160 0.2 A 117 THR CB C 13 70.170 0.2 A 117 THR CG2 C 13 22.576 0.2 A 117 THR N N 15 111.190 0.15 A 118 ALA H H 1 9.257 0.008 A 118 ALA HA H 1 5.033 0.008 A 118 ALA HB% H 1 1.519 0.008 A 118 ALA CA C 13 51.550 0.2 A 118 ALA CB C 13 20.050 0.2 A 118 ALA N N 15 132.010 0.15 A 119 THR H H 1 8.628 0.008 A 119 THR HA H 1 4.143 0.008 A 119 THR HB H 1 4.259 0.008 A 119 THR HG2% H 1 0.925 0.008 A 119 THR CA C 13 60.090 0.2 A 119 THR CB C 13 68.056 0.2 A 119 THR CG2 C 13 21.676 0.2 A 119 THR N N 15 114.350 0.15 A 120 TYR H H 1 6.281 0.008 A 120 TYR HA H 1 3.594 0.008 A 120 TYR HBx H 1 2.539 0.008 A 120 TYR HBy H 1 2.595 0.008 A 120 TYR HDx H 1 6.804 0.008 A 120 TYR HDy H 1 6.804 0.008 A 120 TYR CA C 13 53.530 0.2 A 120 TYR CB C 13 40.072 0.2 A 120 TYR CDx C 13 134.234 0.2 A 120 TYR N N 15 117.205 0.15 A 121 ALA HA H 1 5.030 0.008 A 121 ALA CA C 13 51.536 0.2 A 122 PRO HA H 1 4.059 0.008 A 122 PRO HBx H 1 1.889 0.008 A 122 PRO HBy H 1 2.303 0.008 A 122 PRO HDx H 1 3.614 0.008 A 122 PRO HGx H 1 1.918 0.008 A 122 PRO HGy H 1 2.048 0.008 A 122 PRO CA C 13 65.435 0.2 A 122 PRO CB C 13 31.680 0.2 A 122 PRO CD C 13 50.046 0.2 A 122 PRO CG C 13 27.724 0.2 A 123 GLU H H 1 9.336 0.008 A 123 GLU HA H 1 4.169 0.008 A 123 GLU HBx H 1 2.173 0.008 A 123 GLU HGy H 1 2.409 0.008 A 123 GLU HGx H 1 2.364 0.008 A 123 GLU CA C 13 59.100 0.2 A 123 GLU CB C 13 27.940 0.2 A 123 GLU CG C 13 36.531 0.2 A 123 GLU N N 15 115.528 0.15 A 124 TRP H H 1 8.560 0.008 A 124 TRP HA H 1 4.671 0.008 A 124 TRP HBy H 1 3.274 0.008 A 124 TRP HBx H 1 3.122 0.008 A 124 TRP HD1 H 1 6.880 0.008 A 124 TRP HE1 H 1 10.086 0.008 A 124 TRP HE3 H 1 6.787 0.008 A 124 TRP HH2 H 1 6.086 0.008 A 124 TRP HZ2 H 1 7.161 0.008 A 124 TRP HZ3 H 1 5.041 0.008 A 124 TRP CA C 13 57.370 0.2 A 124 TRP CB C 13 28.310 0.2 A 124 TRP CD1 C 13 123.067 0.2 A 124 TRP CE3 C 13 118.867 0.2 A 124 TRP CH2 C 13 124.518 0.2 A 124 TRP CZ2 C 13 113.653 0.2 A 124 TRP CZ3 C 13 120.731 0.2 A 124 TRP N N 15 123.431 0.15 A 124 TRP NE1 N 15 127.449 0.15 A 125 LEU H H 1 7.378 0.008 A 125 LEU HA H 1 4.065 0.008 A 125 LEU HBy H 1 1.391 0.008 A 125 LEU HBx H 1 1.180 0.008 A 125 LEU HDx% H 1 0.850 0.008 A 125 LEU HDy% H 1 0.556 0.008 A 125 LEU HG H 1 1.524 0.008 A 125 LEU CA C 13 56.060 0.2 A 125 LEU CB C 13 41.220 0.2 A 125 LEU CDy C 13 25.160 0.2 A 125 LEU CDx C 13 23.573 0.2 A 125 LEU CG C 13 27.264 0.2 A 125 LEU N N 15 113.660 0.15 A 126 PHE H H 1 7.415 0.008 A 126 PHE HA H 1 4.640 0.008 A 126 PHE HBy H 1 3.515 0.008 A 126 PHE HBx H 1 2.850 0.008 A 126 PHE HDx H 1 7.255 0.008 A 126 PHE HDy H 1 7.255 0.008 A 126 PHE HEx H 1 7.305 0.008 A 126 PHE HEy H 1 7.305 0.008 A 126 PHE CA C 13 56.940 0.2 A 126 PHE CB C 13 38.670 0.2 A 126 PHE CDx C 13 131.319 0.2 A 126 PHE CEx C 13 131.314 0.2 A 126 PHE N N 15 116.360 0.15 A 127 LEU H H 1 7.168 0.008 A 127 LEU HA H 1 4.529 0.008 A 127 LEU HBx H 1 1.645 0.008 A 127 LEU HBy H 1 1.992 0.008 A 127 LEU HDx% H 1 0.881 0.008 A 127 LEU HDy% H 1 1.027 0.008 A 127 LEU HG H 1 1.871 0.008 A 127 LEU CA C 13 53.580 0.2 A 127 LEU CB C 13 40.832 0.2 A 127 LEU CDy C 13 26.056 0.2 A 127 LEU CDx C 13 21.934 0.2 A 127 LEU CG C 13 27.448 0.2 A 127 LEU N N 15 122.990 0.15 A 128 PRO HA H 1 3.986 0.008 A 128 PRO HBy H 1 2.111 0.008 A 128 PRO HBx H 1 1.561 0.008 A 128 PRO HDy H 1 3.804 0.008 A 128 PRO HDx H 1 3.628 0.008 A 128 PRO HGx H 1 1.951 0.008 A 128 PRO HGy H 1 2.138 0.008 A 128 PRO CA C 13 63.140 0.2 A 128 PRO CB C 13 31.993 0.2 A 128 PRO CD C 13 49.794 0.2 A 128 PRO CG C 13 28.174 0.2 A 129 TYR H H 1 8.070 0.008 A 129 TYR HA H 1 5.529 0.008 A 129 TYR HBy H 1 3.629 0.008 A 129 TYR HBx H 1 3.012 0.008 A 129 TYR HDx H 1 6.845 0.008 A 129 TYR HDy H 1 6.845 0.008 A 129 TYR HEx H 1 6.647 0.008 A 129 TYR HEy H 1 6.647 0.008 A 129 TYR CA C 13 52.486 0.2 A 129 TYR CB C 13 36.760 0.2 A 129 TYR CDx C 13 131.724 0.2 A 129 TYR CEx C 13 118.946 0.2 A 129 TYR N N 15 120.100 0.15 A 130 HIS H H 1 9.193 0.008 A 130 HIS HA H 1 4.733 0.008 A 130 HIS HBx H 1 2.706 0.008 A 130 HIS HBy H 1 3.374 0.008 A 130 HIS HD2 H 1 7.563 0.008 A 130 HIS CA C 13 55.920 0.2 A 130 HIS CB C 13 32.908 0.2 A 130 HIS CD2 C 13 120.441 0.2 A 130 HIS N N 15 121.985 0.15 A 131 GLU H H 1 9.093 0.008 A 131 GLU HA H 1 4.277 0.008 A 131 GLU HBy H 1 2.011 0.008 A 131 GLU HBx H 1 1.852 0.008 A 131 GLU HGx H 1 2.102 0.008 A 131 GLU CA C 13 58.110 0.2 A 131 GLU CB C 13 30.700 0.2 A 131 GLU CG C 13 36.762 0.2 A 131 GLU N N 15 122.150 0.15 A 132 SER H H 1 7.621 0.008 A 132 SER HA H 1 4.686 0.008 A 132 SER HBy H 1 3.844 0.008 A 132 SER HBx H 1 3.652 0.008 A 132 SER CA C 13 56.340 0.2 A 132 SER CB C 13 65.050 0.2 A 132 SER N N 15 108.030 0.15 A 133 TYR H H 1 8.667 0.008 A 133 TYR HA H 1 4.564 0.008 A 133 TYR HBx H 1 2.736 0.008 A 133 TYR HBy H 1 3.308 0.008 A 133 TYR HDx H 1 6.529 0.008 A 133 TYR HDy H 1 6.529 0.008 A 133 TYR CA C 13 57.910 0.2 A 133 TYR CB C 13 40.720 0.2 A 133 TYR CDx C 13 132.026 0.2 A 133 TYR N N 15 121.977 0.15 A 134 ASP H H 1 7.303 0.008 A 134 ASP HA H 1 3.944 0.008 A 134 ASP HBx H 1 2.314 0.008 A 134 ASP HBy H 1 2.406 0.008 A 134 ASP CA C 13 52.540 0.2 A 134 ASP CB C 13 42.900 0.2 A 134 ASP N N 15 127.820 0.15 A 135 SER H H 1 9.392 0.008 A 135 SER HA H 1 3.945 0.008 A 135 SER HBx H 1 3.971 0.008 A 135 SER HBy H 1 4.370 0.008 A 135 SER CA C 13 61.770 0.2 A 135 SER CB C 13 63.561 0.2 A 135 SER N N 15 127.670 0.15 A 136 GLU H H 1 7.546 0.008 A 136 GLU HA H 1 4.233 0.008 A 136 GLU HBy H 1 2.299 0.008 A 136 GLU HBx H 1 1.602 0.008 A 136 GLU HGy H 1 2.289 0.008 A 136 GLU HGx H 1 2.076 0.008 A 136 GLU CA C 13 54.796 0.2 A 136 GLU CB C 13 28.420 0.2 A 136 GLU CG C 13 35.955 0.2 A 136 GLU N N 15 113.107 0.15 A 137 GLY H H 1 7.241 0.008 A 137 GLY HAy H 1 3.994 0.008 A 137 GLY HAx H 1 3.503 0.008 A 137 GLY CA C 13 44.880 0.2 A 137 GLY N N 15 104.690 0.15 A 138 PRO HA H 1 4.211 0.008 A 138 PRO HBy H 1 2.183 0.008 A 138 PRO HBx H 1 1.974 0.008 A 138 PRO HDx H 1 3.525 0.008 A 138 PRO HDy H 1 3.580 0.008 A 138 PRO HGy H 1 1.975 0.008 A 138 PRO HGx H 1 1.924 0.008 A 138 PRO CA C 13 64.830 0.2 A 138 PRO CB C 13 31.180 0.2 A 138 PRO CD C 13 50.390 0.2 A 138 PRO CG C 13 27.145 0.2 A 139 HIS H H 1 6.414 0.008 A 139 HIS HA H 1 4.299 0.008 A 139 HIS HBx H 1 3.167 0.008 A 139 HIS HD2 H 1 7.124 0.008 A 139 HIS CA C 13 55.080 0.2 A 139 HIS CB C 13 30.260 0.2 A 139 HIS CD2 C 13 118.287 0.2 A 139 HIS N N 15 116.498 0.15 A 140 GLY H H 1 7.082 0.008 A 140 GLY HAy H 1 3.919 0.008 A 140 GLY HAx H 1 3.721 0.008 A 140 GLY CA C 13 46.590 0.2 A 140 GLY N N 15 108.485 0.15 A 141 LEU HA H 1 4.451 0.008 A 141 LEU HBy H 1 2.049 0.008 A 141 LEU HBx H 1 0.765 0.008 A 141 LEU HDx% H 1 0.779 0.008 A 141 LEU HG H 1 1.615 0.008 A 141 LEU CA C 13 53.024 0.2 A 141 LEU CB C 13 39.500 0.2 A 141 LEU CDx C 13 26.528 0.2 A 141 LEU CG C 13 25.690 0.2 A 142 ARG H H 1 7.472 0.008 A 142 ARG HA H 1 4.724 0.008 A 142 ARG HBx H 1 1.605 0.008 A 142 ARG HDx H 1 3.141 0.008 A 142 ARG HE H 1 7.900 0.008 A 142 ARG HGx H 1 1.540 0.008 A 142 ARG CA C 13 55.940 0.2 A 142 ARG CB C 13 31.070 0.2 A 142 ARG CD C 13 43.520 0.2 A 142 ARG CG C 13 27.661 0.2 A 142 ARG N N 15 121.987 0.15 A 142 ARG NE N 15 86.566 0.15 A 143 TYR H H 1 8.487 0.008 A 143 TYR HA H 1 4.474 0.008 A 143 TYR HBy H 1 3.382 0.008 A 143 TYR HBx H 1 2.761 0.008 A 143 TYR HDx H 1 6.992 0.008 A 143 TYR HDy H 1 6.992 0.008 A 143 TYR HEx H 1 6.722 0.008 A 143 TYR HEy H 1 6.722 0.008 A 143 TYR CA C 13 59.015 0.2 A 143 TYR CB C 13 38.720 0.2 A 143 TYR CDx C 13 133.126 0.2 A 143 TYR CEx C 13 117.859 0.2 A 143 TYR N N 15 127.896 0.15 A 144 ASN H H 1 7.805 0.008 A 144 ASN HA H 1 4.892 0.008 A 144 ASN HBy H 1 2.651 0.008 A 144 ASN HBx H 1 2.361 0.008 A 144 ASN HD2y H 1 7.441 0.008 A 144 ASN HD2x H 1 6.720 0.008 A 144 ASN CA C 13 50.120 0.2 A 144 ASN CB C 13 39.360 0.2 A 144 ASN N N 15 125.629 0.15 A 144 ASN ND2 N 15 111.468 0.15 A 145 PRO HA H 1 3.975 0.008 A 145 PRO HBx H 1 1.881 0.008 A 145 PRO HBy H 1 2.136 0.008 A 145 PRO HDy H 1 3.580 0.008 A 145 PRO HDx H 1 3.271 0.008 A 145 PRO HGx H 1 1.878 0.008 A 145 PRO CA C 13 63.140 0.2 A 145 PRO CB C 13 32.386 0.2 A 145 PRO CD C 13 50.438 0.2 A 145 PRO CG C 13 27.000 0.2 A 146 ARG H H 1 8.055 0.008 A 146 ARG HA H 1 3.918 0.008 A 146 ARG HBx H 1 1.574 0.008 A 146 ARG HBy H 1 1.665 0.008 A 146 ARG HDy H 1 3.025 0.008 A 146 ARG HDx H 1 3.001 0.008 A 146 ARG HE H 1 6.942 0.008 A 146 ARG HGx H 1 1.383 0.008 A 146 ARG HGy H 1 1.477 0.008 A 146 ARG CA C 13 56.740 0.2 A 146 ARG CB C 13 30.430 0.2 A 146 ARG CD C 13 43.459 0.2 A 146 ARG CG C 13 27.162 0.2 A 146 ARG N N 15 120.069 0.15 A 146 ARG NE N 15 84.986 0.15 A 147 GLU H H 1 8.440 0.008 A 147 GLU HA H 1 4.167 0.008 A 147 GLU HBx H 1 1.856 0.008 A 147 GLU HBy H 1 1.953 0.008 A 147 GLU HGy H 1 2.178 0.008 A 147 GLU CA C 13 56.710 0.2 A 147 GLU CB C 13 30.150 0.2 A 147 GLU CG C 13 36.190 0.2 A 147 GLU N N 15 120.760 0.15 A 148 ASN H H 1 8.363 0.008 A 148 ASN HA H 1 4.652 0.008 A 148 ASN HBy H 1 2.779 0.008 A 148 ASN HBx H 1 2.634 0.008 A 148 ASN HD2y H 1 7.556 0.008 A 148 ASN HD2x H 1 6.816 0.008 A 148 ASN CA C 13 53.240 0.2 A 148 ASN CB C 13 38.840 0.2 A 148 ASN N N 15 120.210 0.15 A 148 ASN ND2 N 15 112.833 0.15 A 149 ARG H H 1 7.755 0.008 A 149 ARG HA H 1 4.088 0.008 A 149 ARG HBy H 1 1.753 0.008 A 149 ARG HBx H 1 1.606 0.008 A 149 ARG HDy H 1 2.997 0.008 A 149 ARG HDx H 1 2.662 0.008 A 149 ARG CA C 13 57.440 0.2 A 149 ARG CB C 13 31.554 0.2 A 149 ARG CD C 13 43.542 0.2 A 149 ARG N N 15 126.220 0.15 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 11 LYS HBy A 65 GLY HAx 1.0 . 4.81 2 2 A 65 GLY HAx A 11 LYS HGy 1.0 . 5.45 3 3 A 5 PHE HZ A 65 GLY HAy 1.0 . 4.71 4 4 A 65 GLY HAx A 5 PHE HE% 1.0 . 5.42 5 5 A 65 GLY HAx A 66 GLU HBy 1.0 . 5.26 6 6 A 8 GLY HAx A 9 THR HG2% 1.0 . 5.50 7 7 A 9 THR HG2% A 8 GLY HAy 1.0 . 5.50 8 8 A 8 GLY HAx A 133 TYR HBy 1.0 . 5.12 9 9 A 103 ASP HA A 104 GLY HAx 1.0 . 4.77 10 10 A 103 ASP HA A 104 GLY HAy 1.0 . 4.82 11 11 A 104 GLY HAy A 105 ASP HBx 1.0 . 5.31 12 12 A 8 GLY HAy A 133 TYR HBx 1.0 . 4.82 13 13 A 8 GLY HAy A 133 TYR HD% 1.0 . 4.69 14 14 A 104 GLY HAy A 103 ASP HBy 1.0 . 5.05 15 15 A 104 GLY HAy A 100 TRP HZ2 1.0 . 5.38 16 16 A 104 GLY HAy A 105 ASP HBy 1.0 . 5.36 17 17 A 8 GLY HAy A 7 TYR H 1.0 . 5.34 18 18 A 34 GLY HAx A 67 ILE HD1% 1.0 . 4.72 19 19 A 34 GLY HAx A 65 GLY H 1.0 . 5.25 20 20 A 34 GLY HAx A 98 LEU HBy 1.0 . 3.75 21 21 A 34 GLY HAx A 98 LEU HDy% 1.0 . 4.40 22 22 A 5 PHE HZ A 34 GLY HAy 1.0 . 4.80 23 23 A 98 LEU HBy A 34 GLY HAy 1.0 . 4.19 24 24 A 98 LEU HDy% A 34 GLY HAy 1.0 . 4.67 25 25 A 34 GLY HAy A 5 PHE HD% 1.0 . 4.94 26 26 A 34 GLY HAy A 95 VAL HGy% 1.0 . 5.50 27 27 A 34 GLY HAy A 97 VAL HGx% 1.0 . 5.50 28 28 A 95 VAL HGy% A 93 LEU HBy 1.0 . 5.22 29 29 A 13 GLY HAy A 14 GLN HE2y 1.0 . 5.42 30 30 A 60 GLY HAx A 129 TYR HE% 1.0 . 5.22 31 31 A 60 GLY HAx A 59 LYS HBx 1.0 . 5.09 32 31 A 60 GLY HAx A 59 LYS HBy 1.0 . 5.09 33 32 A 41 PRO HA A 60 GLY HAy 1.0 . 4.61 34 33 A 93 LEU HBy A 93 LEU HDx% 1.0 . 4.14 35 34 A 93 LEU HBx A 114 VAL HB 1.0 . 4.87 36 35 A 93 LEU HDx% A 93 LEU HBx 1.0 . 4.21 37 36 A 95 VAL HGy% A 93 LEU HBx 1.0 . 5.14 38 37 A 30 PHE HE% A 32 GLY HAy 1.0 . 4.05 39 38 A 32 GLY HAy A 33 ARG H 1.0 . 3.43 40 39 A 32 GLY HAy A 101 GLU H 1.0 . 4.53 41 40 A 32 GLY HAy A 100 TRP HA 1.0 . 4.05 42 41 A 32 GLY HAy A 101 GLU HBy 1.0 . 4.94 43 42 A 32 GLY HAy A 100 TRP H 1.0 . 5.21 44 43 A 32 GLY HAy A 100 TRP HE3 1.0 . 5.50 45 44 A 58 GLY HAx A 59 LYS HBx 1.0 . 5.34 46 44 A 59 LYS HBy A 58 GLY HAx 1.0 . 5.34 47 45 A 58 GLY HAx A 39 SER HBx 1.0 . 4.67 48 46 A 58 GLY HAx A 39 SER H 1.0 . 4.97 49 47 A 137 GLY HAx A 139 HIS HD2 1.0 . 5.50 50 48 A 137 GLY HAx A 138 PRO HGy 1.0 . 4.68 51 49 A 137 GLY HAx A 139 HIS H 1.0 . 5.37 52 50 A 138 PRO HGy A 137 GLY HAy 1.0 . 5.20 53 51 A 57 PRO HA A 58 GLY HAy 1.0 . 4.92 54 52 A 39 SER H A 58 GLY HAy 1.0 . 4.43 55 53 A 58 GLY HAy A 59 LYS HBx 1.0 . 5.18 56 53 A 59 LYS HBy A 58 GLY HAy 1.0 . 5.18 57 54 A 31 ARG HDy A 102 GLY HAx 1.0 . 5.50 58 55 A 46 GLY HAx A 124 TRP HZ2 1.0 . 4.96 59 56 A 46 GLY HAx A 48 HIS H 1.0 . 4.82 60 57 A 31 ARG HDx A 102 GLY HAx 1.0 . 4.75 61 58 A 103 ASP H A 102 GLY HAx 1.0 . 3.18 62 59 A 103 ASP H A 102 GLY HAy 1.0 . 3.09 63 60 A 103 ASP HBx A 102 GLY HAy 1.0 . 4.47 64 61 A 100 TRP HD1 A 102 GLY HAy 1.0 . 5.37 65 62 A 40 PHE HBy A 41 PRO HDy 1.0 . 4.74 66 63 A 40 PHE HBy A 41 PRO HDx 1.0 . 4.60 67 64 A 41 PRO HDx A 40 PHE HBx 1.0 . 5.06 68 65 A 27 LEU HBx A 71 ASP HA 1.0 . 5.23 69 66 A 27 LEU HBx A 27 LEU H 1.0 . 3.03 70 67 A 27 LEU HBx A 71 ASP H 1.0 . 3.63 71 68 A 27 LEU HBx A 28 ALA H 1.0 . 4.01 72 69 A 27 LEU HBx A 70 VAL HA 1.0 . 4.43 73 70 A 27 LEU HBx A 71 ASP HBy 1.0 . 4.17 74 71 A 27 LEU HBx A 71 ASP HBx 1.0 . 3.68 75 72 A 27 LEU HBx A 74 MET HE% 1.0 . 5.50 76 73 A 27 LEU HBx A 27 LEU HDy% 1.0 . 3.52 77 74 A 27 LEU HBx A 28 ALA HA 1.0 . 4.92 78 75 A 107 GLY HAy A 109 SER H 1.0 . 4.85 79 76 A 40 PHE HBx A 56 LEU H 1.0 . 5.31 80 77 A 40 PHE HBx A 39 SER HA 1.0 . 4.74 81 78 A 26 GLY HAx A 74 MET HBy 1.0 . 4.59 82 79 A 27 LEU HBx A 26 GLY HAy 1.0 . 4.77 83 80 A 27 LEU H A 26 GLY HAy 1.0 . 3.44 84 81 A 26 GLY HAy A 73 GLN HGx 1.0 . 4.44 85 82 A 26 GLY HAx A 74 MET HA 1.0 . 5.16 86 83 A 26 GLY HAx A 73 GLN HBx 1.0 . 3.64 87 84 A 26 GLY HAy A 74 MET HA 1.0 . 5.33 88 85 A 26 GLY HAy A 73 GLN H 1.0 . 5.27 89 86 A 26 GLY HAy A 73 GLN HBx 1.0 . 3.62 90 87 A 76 ARG H A 76 ARG HDy 1.0 . 5.46 91 88 A 76 ARG HDy A 76 ARG HA 1.0 . 4.95 92 89 A 76 ARG HBx A 76 ARG HDx 1.0 . 3.62 93 90 A 142 ARG HA A 142 ARG HDx 1.0 . 3.58 94 91 A 142 ARG HDx A 142 ARG HGx 1.0 . 2.71 95 92 A 146 ARG HE A 149 ARG HDy 1.0 . 4.60 96 93 A 149 ARG HDy A 146 ARG HA 1.0 . 3.71 97 94 A 149 ARG HDy A 149 ARG HBy 1.0 . 3.49 98 95 A 149 ARG HDy A 149 ARG HBx 1.0 . 3.37 99 96 A 149 ARG HDy A 146 ARG HGy 1.0 . 3.18 100 97 A 30 PHE HE% A 33 ARG HDx 1.0 . 4.75 101 98 A 33 ARG HDx A 33 ARG HA 1.0 . 4.43 102 99 A 33 ARG HDx A 33 ARG HBy 1.0 . 3.38 103 100 A 33 ARG HDx A 33 ARG HBx 1.0 . 2.95 104 101 A 33 ARG HDx A 98 LEU HBx 1.0 . 5.13 105 102 A 33 ARG H A 33 ARG HDx 1.0 . 5.25 106 103 A 146 ARG H A 146 ARG HDy 1.0 . 4.66 107 103 A 146 ARG H A 146 ARG HDx 1.0 . 4.66 108 104 A 146 ARG HBy A 146 ARG HDy 1.0 . 3.36 109 104 A 146 ARG HDx A 146 ARG HBy 1.0 . 3.36 110 105 A 146 ARG HBx A 146 ARG HDy 1.0 . 3.28 111 105 A 146 ARG HDx A 146 ARG HBx 1.0 . 3.28 112 106 A 12 ARG HBx A 12 ARG HDy 1.0 . 4.15 113 107 A 12 ARG HA A 12 ARG HDx 1.0 . 5.50 114 108 A 12 ARG HBx A 12 ARG HDx 1.0 . 4.23 115 109 A 56 LEU H A 56 LEU HBy 1.0 . 3.92 116 110 A 56 LEU HBy A 59 LYS H 1.0 . 5.36 117 111 A 56 LEU HBy A 40 PHE HA 1.0 . 5.03 118 112 A 41 PRO HDy A 56 LEU HBy 1.0 . 4.42 119 113 A 41 PRO HDx A 56 LEU HBy 1.0 . 4.20 120 114 A 56 LEU HBy A 56 LEU HDx% 1.0 . 3.96 121 115 A 56 LEU HBy A 125 LEU HDy% 1.0 . 5.50 122 116 A 56 LEU H A 56 LEU HBx 1.0 . 3.67 123 117 A 40 PHE HA A 56 LEU HBx 1.0 . 4.89 124 118 A 41 PRO HDy A 56 LEU HBx 1.0 . 4.22 125 119 A 41 PRO HDx A 56 LEU HBx 1.0 . 4.09 126 120 A 56 LEU HBx A 54 LEU HDx% 1.0 . 5.50 127 121 A 137 GLY HAy A 134 ASP HBy 1.0 . 5.22 128 122 A 137 GLY HAy A 134 ASP HBx 1.0 . 4.81 129 123 A 134 ASP HBy A 133 TYR HA 1.0 . 5.06 130 124 A 88 TYR HBy A 115 TYR HD% 1.0 . 4.22 131 125 A 88 TYR HBy A 115 TYR HBy 1.0 . 4.48 132 126 A 88 TYR HBy A 82 GLU HBx 1.0 . 5.08 133 127 A 82 GLU HBx A 88 TYR HBx 1.0 . 4.61 134 128 A 34 GLY HAx A 98 LEU HBx 1.0 . 4.80 135 129 A 33 ARG HBy A 98 LEU HBx 1.0 . 4.97 136 130 A 98 LEU HDy% A 98 LEU HBx 1.0 . 3.56 137 131 A 42 LEU HBx A 53 LEU HDy% 1.0 . 4.67 138 132 A 42 LEU HBx A 130 HIS H 1.0 . 5.31 139 133 A 98 LEU HBy A 33 ARG H 1.0 . 5.30 140 134 A 21 LEU H A 21 LEU HBy 1.0 . 4.11 141 135 A 21 LEU HBy A 18 LYS HA 1.0 . 4.13 142 136 A 42 LEU HBx A 53 LEU HA 1.0 . 5.50 143 137 A 42 LEU HBx A 43 VAL H 1.0 . 5.02 144 138 A 71 ASP HBy A 73 GLN H 1.0 . 3.96 145 139 A 71 ASP HBy A 72 GLU HGx 1.0 . 5.36 146 140 A 31 ARG HDy A 31 ARG HA 1.0 . 3.46 147 141 A 59 LYS HGy A 59 LYS HEy 1.0 . 4.08 148 142 A 59 LYS HEy A 59 LYS HGx 1.0 . 4.04 149 143 A 59 LYS HEy A 56 LEU HDy% 1.0 . 4.79 150 144 A 59 LYS HEy A 59 LYS HA 1.0 . 5.22 151 145 A 59 LYS HA A 59 LYS HEx 1.0 . 5.20 152 146 A 59 LYS HGy A 59 LYS HEx 1.0 . 4.14 153 147 A 59 LYS HGx A 59 LYS HEx 1.0 . 4.03 154 148 A 56 LEU HDy% A 59 LYS HEx 1.0 . 4.66 155 149 A 56 LEU HDx% A 59 LYS HEx 1.0 . 5.33 156 150 A 101 GLU H A 31 ARG HDx 1.0 . 5.34 157 151 A 31 ARG HDx A 31 ARG HA 1.0 . 3.65 158 152 A 53 LEU HBy A 116 THR HB 1.0 . 5.09 159 153 A 53 LEU HBy A 54 LEU H 1.0 . 4.98 160 154 A 74 MET H A 75 LEU HBy 1.0 . 5.09 161 155 A 75 LEU HBy A 75 LEU H 1.0 . 3.38 162 156 A 75 LEU HBx A 75 LEU HDx% 1.0 . 3.74 163 157 A 42 LEU HDy% A 53 LEU HBx 1.0 . 5.50 164 158 A 71 ASP HBy A 72 GLU HA 1.0 . 5.14 165 159 A 18 LYS HEx A 18 LYS HGy 1.0 . 3.61 166 159 A 18 LYS HGx A 18 LYS HEx 1.0 . 3.61 167 160 A 18 LYS HEx A 18 LYS HBx 1.0 . 4.55 168 161 A 4 ILE H A 4 ILE HB 1.0 . 4.13 169 162 A 4 ILE HB A 5 PHE H 1.0 . 3.44 170 163 A 4 ILE HB A 113 PHE HBx 1.0 . 5.29 171 164 A 18 LYS HEx A 16 ASN HA 1.0 . 5.10 172 165 A 18 LYS HEx A 19 VAL H 1.0 . 5.43 173 166 A 103 ASP HBy A 103 ASP H 1.0 . 3.22 174 167 A 104 GLY HAx A 103 ASP HBy 1.0 . 4.42 175 168 A 6 VAL HB A 10 LEU HBy 1.0 . 4.62 176 169 A 108 ASP H A 108 ASP HBx 1.0 . 2.94 177 170 A 109 SER H A 108 ASP HBx 1.0 . 3.47 178 171 A 108 ASP HBx A 109 SER HBy 1.0 . 4.65 179 172 A 29 ALA H A 68 TYR HBx 1.0 . 4.19 180 173 A 105 ASP HBx A 104 GLY H 1.0 . 5.38 181 174 A 90 ARG HDx A 91 THR HA 1.0 . 5.48 182 175 A 10 LEU HBx A 20 MET HE% 1.0 . 5.50 183 176 A 10 LEU HBx A 6 VAL HGx% 1.0 . 5.50 184 177 A 90 ARG HDy A 92 ALA H 1.0 . 4.61 185 178 A 108 ASP HBx A 109 SER HA 1.0 . 4.77 186 179 A 90 ARG HDy A 113 PHE HD% 1.0 . 5.49 187 180 A 68 TYR HBx A 28 ALA HB% 1.0 . 5.22 188 181 A 78 LEU HBy A 78 LEU HDy% 1.0 . 4.05 189 182 A 78 LEU HBx A 79 ASP HBx 1.0 . 5.43 190 183 A 105 ASP HBy A 106 PRO HDx 1.0 . 5.50 191 184 A 105 ASP HBy A 100 TRP HD1 1.0 . 4.78 192 185 A 105 ASP HBx A 106 PRO HDx 1.0 . 5.36 193 186 A 78 LEU HBy A 77 PHE H 1.0 . 5.09 194 187 A 48 HIS HBy A 50 ILE HB 1.0 . 4.87 195 188 A 125 LEU HBy A 126 PHE HD% 1.0 . 5.50 196 189 A 54 LEU HDx% A 125 LEU HBx 1.0 . 5.50 197 190 A 126 PHE HD% A 125 LEU HBx 1.0 . 5.19 198 191 A 133 TYR HBy A 42 LEU HDx% 1.0 . 4.95 199 192 A 5 PHE HBy A 112 CYS HBx 1.0 . 5.23 200 193 A 5 PHE HBx A 93 LEU HDy% 1.0 . 3.98 201 194 A 133 TYR HBx A 132 SER HA 1.0 . 4.42 202 195 A 8 GLY HAx A 133 TYR HBx 1.0 . 4.87 203 196 A 133 TYR HBx A 42 LEU HDx% 1.0 . 4.39 204 197 A 133 TYR HBx A 51 PRO HBx 1.0 . 5.38 205 198 A 127 LEU HBy A 128 PRO HDy 1.0 . 5.02 206 199 A 127 LEU HBy A 128 PRO HDx 1.0 . 4.61 207 200 A 128 PRO HDy A 127 LEU HBx 1.0 . 4.55 208 201 A 128 PRO HDx A 127 LEU HBx 1.0 . 4.32 209 202 A 79 ASP H A 80 ASP HBx 1.0 . 5.24 210 203 A 80 ASP HBx A 77 PHE HA 1.0 . 3.98 211 204 A 80 ASP HBx A 80 ASP H 1.0 . 3.18 212 205 A 127 LEU HBy A 129 TYR HD% 1.0 . 5.50 213 206 A 56 LEU H A 54 LEU HBy 1.0 . 5.23 214 207 A 22 ASP HBx A 24 SER HBx 1.0 . 5.29 215 208 A 54 LEU HBy A 41 PRO HBy 1.0 . 4.44 216 209 A 41 PRO HDx A 54 LEU HBy 1.0 . 4.53 217 210 A 54 LEU HBy A 55 TYR H 1.0 . 4.94 218 211 A 67 ILE HD1% A 67 ILE HB 1.0 . 3.84 219 212 A 5 PHE HD% A 67 ILE HB 1.0 . 5.27 220 213 A 54 LEU HBx A 120 TYR HD% 1.0 . 5.38 221 214 A 41 PRO HBy A 54 LEU HBx 1.0 . 4.89 222 215 A 54 LEU HDx% A 54 LEU HBx 1.0 . 3.94 223 216 A 4 ILE HA A 113 PHE HBy 1.0 . 5.05 224 217 A 90 ARG HDx A 113 PHE HBy 1.0 . 4.94 225 218 A 78 LEU HA A 81 PHE HBy 1.0 . 3.43 226 219 A 113 PHE HBx A 90 ARG HGx 1.0 . 4.45 227 220 A 22 ASP HBx A 25 HIS HD2 1.0 . 4.79 228 221 A 22 ASP HBx A 19 VAL HA 1.0 . 4.37 229 222 A 21 LEU H A 22 ASP HBx 1.0 . 5.15 230 223 A 67 ILE HB A 31 ARG HBx 1.0 . 5.38 231 224 A 54 LEU HDy% A 120 TYR HBy 1.0 . 4.26 232 225 A 67 ILE HB A 32 GLY HAx 1.0 . 5.24 233 226 A 120 TYR HBy A 124 TRP HBy 1.0 . 5.44 234 227 A 120 TYR HBy A 117 THR HG2% 1.0 . 4.70 235 228 A 124 TRP HBy A 120 TYR HBx 1.0 . 5.24 236 229 A 83 ASP HBy A 86 SER HBx 1.0 . 5.07 237 230 A 83 ASP HBy A 88 TYR H 1.0 . 4.99 238 231 A 44 ILE HD1% A 141 LEU HBx 1.0 . 5.50 239 232 A 141 LEU HBx A 44 ILE HG2% 1.0 . 4.40 240 233 A 83 ASP HBy A 83 ASP H 1.0 . 4.20 241 234 A 83 ASP HBy A 87 MET HBx 1.0 . 3.21 242 235 A 79 ASP HBx A 78 LEU H 1.0 . 5.13 243 236 A 79 ASP HBx A 80 ASP H 1.0 . 4.16 244 237 A 83 ASP HBx A 84 CYS H 1.0 . 5.09 245 238 A 83 ASP H A 83 ASP HBx 1.0 . 4.07 246 239 A 83 ASP HBx A 87 MET H 1.0 . 4.67 247 240 A 83 ASP HBx A 87 MET HGy 1.0 . 4.79 248 241 A 143 TYR HD% A 144 ASN HBx 1.0 . 5.39 249 242 A 144 ASN HBx A 145 PRO HDy 1.0 . 5.03 250 243 A 144 ASN HBx A 144 ASN H 1.0 . 3.80 251 244 A 144 ASN HBx A 144 ASN HD2y 1.0 . 3.88 252 245 A 144 ASN HBx A 48 HIS HA 1.0 . 3.93 253 246 A 144 ASN HBx A 143 TYR HA 1.0 . 5.31 254 247 A 48 HIS HBy A 144 ASN HBx 1.0 . 5.32 255 248 A 86 SER HBx A 83 ASP HBx 1.0 . 5.36 256 249 A 49 ASN HD2x A 141 LEU HBy 1.0 . 5.35 257 250 A 142 ARG HA A 141 LEU HBy 1.0 . 4.64 258 251 A 147 GLU HBx A 148 ASN HBx 1.0 . 5.24 259 252 A 9 THR HB A 16 ASN HBx 1.0 . 4.28 260 253 A 16 ASN HBx A 10 LEU HDy% 1.0 . 4.56 261 254 A 15 PRO HGx A 143 TYR HBy 1.0 . 4.99 262 255 A 29 ALA HA A 30 PHE HBy 1.0 . 5.08 263 256 A 30 PHE HBy A 31 ARG H 1.0 . 4.97 264 257 A 9 THR HB A 16 ASN HBy 1.0 . 4.35 265 258 A 15 PRO HGx A 143 TYR HBx 1.0 . 4.83 266 259 A 126 PHE HBy A 127 LEU HDy% 1.0 . 5.50 267 260 A 148 ASN HBy A 148 ASN HD2y 1.0 . 4.08 268 261 A 9 THR HG2% A 143 TYR HBx 1.0 . 5.46 269 262 A 126 PHE HBy A 126 PHE H 1.0 . 3.68 270 263 A 74 MET HA A 77 PHE HBy 1.0 . 4.60 271 264 A 77 PHE HBy A 25 HIS HBx 1.0 . 5.17 272 265 A 77 PHE H A 77 PHE HBy 1.0 . 3.74 273 266 A 78 LEU H A 77 PHE HBx 1.0 . 4.15 274 267 A 76 ARG HBx A 77 PHE HBx 1.0 . 5.47 275 268 A 44 ILE HB A 45 ALA H 1.0 . 5.17 276 269 A 11 LYS HGy A 66 GLU HBx 1.0 . 5.45 277 270 A 41 PRO HA A 129 TYR HBx 1.0 . 5.29 278 271 A 88 TYR HD% A 115 TYR HBx 1.0 . 4.94 279 272 A 129 TYR HBy A 130 HIS HA 1.0 . 4.51 280 273 A 129 TYR HBx A 130 HIS HA 1.0 . 4.85 281 274 A 115 TYR HBy A 116 THR H 1.0 . 5.38 282 275 A 131 GLU HGx A 132 SER H 1.0 . 5.19 283 276 A 131 GLU HGx A 61 HIS HBx 1.0 . 4.40 284 277 A 123 GLU HGy A 124 TRP HE1 1.0 . 5.50 285 278 A 123 GLU HGy A 124 TRP HD1 1.0 . 3.95 286 279 A 115 TYR HBy A 88 TYR HD% 1.0 . 4.82 287 280 A 72 GLU HGx A 72 GLU H 1.0 . 3.35 288 281 A 72 GLU HGx A 76 ARG HE 1.0 . 5.34 289 282 A 72 GLU HGx A 72 GLU HA 1.0 . 3.29 290 283 A 88 TYR HBy A 115 TYR HBx 1.0 . 4.36 291 284 A 72 GLU HGx A 72 GLU HBx 1.0 . 2.67 292 285 A 72 GLU HGx A 76 ARG HGy 1.0 . 4.98 293 286 A 38 GLU HA A 38 GLU HGy 1.0 . 3.66 294 287 A 123 GLU HGy A 123 GLU H 1.0 . 3.85 295 288 A 123 GLU HGy A 124 TRP H 1.0 . 4.39 296 289 A 123 GLU HGy A 123 GLU HBx 1.0 . 2.87 297 290 A 123 GLU HGy A 122 PRO HA 1.0 . 5.19 298 291 A 123 GLU HBx A 123 GLU HGx 1.0 . 2.92 299 292 A 38 GLU HGy A 58 GLY H 1.0 . 4.36 300 293 A 58 GLY HAx A 38 GLU HGy 1.0 . 5.50 301 294 A 57 PRO HA A 38 GLU HGy 1.0 . 4.54 302 295 A 38 GLU HGy A 40 PHE HZ 1.0 . 4.99 303 296 A 38 GLU H A 38 GLU HGx 1.0 . 4.03 304 297 A 57 PRO HA A 38 GLU HGx 1.0 . 4.77 305 298 A 38 GLU HGx A 37 VAL HGx% 1.0 . 4.47 306 298 A 38 GLU HGx A 37 VAL HGy% 1.0 . 4.47 307 299 A 38 GLU HGx A 40 PHE HE% 1.0 . 5.34 308 300 A 55 TYR HBy A 117 THR H 1.0 . 4.91 309 301 A 116 THR HB A 55 TYR HBy 1.0 . 4.37 310 302 A 49 ASN HBy A 49 ASN HD2y 1.0 . 3.72 311 303 A 55 TYR HBx A 91 THR HG2% 1.0 . 5.50 312 304 A 56 LEU H A 55 TYR HBx 1.0 . 5.16 313 305 A 49 ASN HD2y A 49 ASN HBx 1.0 . 3.96 314 306 A 142 ARG HA A 49 ASN HBx 1.0 . 3.82 315 307 A 49 ASN HBx A 141 LEU HDx% 1.0 . 4.54 316 308 A 147 GLU HBy A 147 GLU HGy 1.0 . 2.67 317 309 A 147 GLU HBx A 147 GLU HGy 1.0 . 2.98 318 310 A 147 GLU HGy A 147 GLU H 1.0 . 3.84 319 311 A 114 VAL HB A 113 PHE HA 1.0 . 5.00 320 312 A 136 GLU HA A 136 GLU HGx 1.0 . 3.79 321 313 A 3 HIS HD2 A 69 GLU HGy 1.0 . 5.26 322 314 A 69 GLU HGy A 70 VAL H 1.0 . 4.36 323 315 A 70 VAL HA A 69 GLU HGy 1.0 . 5.39 324 316 A 93 LEU HDx% A 114 VAL HB 1.0 . 5.50 325 317 A 114 VAL HB A 53 LEU HDx% 1.0 . 5.41 326 318 A 114 VAL HB A 115 TYR H 1.0 . 5.09 327 319 A 114 VAL HB A 114 VAL H 1.0 . 3.64 328 320 A 136 GLU H A 136 GLU HGy 1.0 . 4.25 329 321 A 136 GLU HA A 136 GLU HGy 1.0 . 3.93 330 322 A 136 GLU HGx A 136 GLU H 1.0 . 3.96 331 323 A 136 GLU HGx A 135 SER HBx 1.0 . 5.14 332 324 A 69 GLU HGy A 69 GLU H 1.0 . 4.93 333 325 A 69 GLU HGy A 29 ALA HB% 1.0 . 4.93 334 326 A 101 GLU H A 101 GLU HGy 1.0 . 3.56 335 327 A 30 PHE HE% A 101 GLU HGy 1.0 . 4.17 336 328 A 101 GLU HGy A 30 PHE HD% 1.0 . 4.33 337 329 A 100 TRP HA A 101 GLU HGy 1.0 . 4.73 338 330 A 101 GLU HGy A 101 GLU HA 1.0 . 3.38 339 331 A 31 ARG HA A 101 GLU HGy 1.0 . 4.35 340 332 A 32 GLY HAy A 101 GLU HGy 1.0 . 4.50 341 333 A 101 GLU HBy A 101 GLU HGy 1.0 . 2.63 342 334 A 69 GLU H A 69 GLU HGx 1.0 . 4.98 343 335 A 69 GLU HGx A 31 ARG HGx 1.0 . 4.71 344 336 A 99 GLU H A 99 GLU HGy 1.0 . 4.70 345 337 A 100 TRP H A 99 GLU HGy 1.0 . 4.32 346 338 A 99 GLU HGy A 99 GLU HA 1.0 . 3.81 347 339 A 33 ARG H A 99 GLU HGy 1.0 . 4.98 348 340 A 99 GLU HA A 99 GLU HGx 1.0 . 3.88 349 341 A 99 GLU H A 99 GLU HGx 1.0 . 4.98 350 342 A 69 GLU HGy A 31 ARG HE 1.0 . 5.50 351 343 A 100 TRP HZ3 A 110 VAL HB 1.0 . 5.20 352 344 A 74 MET H A 70 VAL HB 1.0 . 4.89 353 345 A 75 LEU H A 70 VAL HB 1.0 . 4.81 354 346 A 70 VAL HB A 74 MET HGx 1.0 . 4.07 355 347 A 28 ALA HB% A 70 VAL HB 1.0 . 5.50 356 348 A 110 VAL HB A 110 VAL H 1.0 . 3.98 357 349 A 110 VAL HB A 106 PRO HBx 1.0 . 4.29 358 350 A 109 SER HA A 110 VAL HB 1.0 . 5.50 359 351 A 110 VAL HB A 106 PRO HGy 1.0 . 4.72 360 352 A 127 LEU HBx A 43 VAL HB 1.0 . 4.49 361 353 A 95 VAL HB A 96 GLN H 1.0 . 4.58 362 354 A 95 VAL HB A 110 VAL HGx% 1.0 . 4.04 363 355 A 90 ARG H A 89 GLN HGy 1.0 . 5.41 364 356 A 89 GLN HE2y A 89 GLN HGy 1.0 . 3.92 365 357 A 89 GLN HA A 89 GLN HGy 1.0 . 4.13 366 358 A 85 PRO HBx A 89 GLN HGy 1.0 . 5.18 367 359 A 85 PRO HA A 89 GLN HGy 1.0 . 4.84 368 360 A 85 PRO HA A 89 GLN HGx 1.0 . 4.98 369 361 A 89 GLN H A 89 GLN HGx 1.0 . 5.06 370 362 A 90 ARG H A 89 GLN HGx 1.0 . 5.31 371 363 A 62 CYS HA A 63 VAL HB 1.0 . 4.60 372 364 A 5 PHE HZ A 63 VAL HB 1.0 . 5.41 373 365 A 118 ALA H A 89 GLN HGy 1.0 . 5.50 374 366 A 42 LEU HDx% A 63 VAL HB 1.0 . 5.50 375 367 A 41 PRO HDx A 59 LYS HBx 1.0 . 5.42 376 367 A 59 LYS HBy A 41 PRO HDx 1.0 . 5.42 377 368 A 59 LYS H A 59 LYS HBx 1.0 . 3.72 378 368 A 59 LYS HBy A 59 LYS H 1.0 . 3.72 379 369 A 40 PHE HA A 59 LYS HBx 1.0 . 5.12 380 369 A 59 LYS HBy A 40 PHE HA 1.0 . 5.12 381 370 A 60 GLY H A 59 LYS HBx 1.0 . 4.04 382 370 A 59 LYS HBy A 60 GLY H 1.0 . 4.04 383 371 A 129 TYR HE% A 59 LYS HBx 1.0 . 5.50 384 371 A 129 TYR HE% A 59 LYS HBy 1.0 . 5.50 385 372 A 41 PRO HDy A 59 LYS HBx 1.0 . 4.41 386 372 A 59 LYS HBy A 41 PRO HDy 1.0 . 4.41 387 373 A 59 LYS HEx A 59 LYS HBx 1.0 . 5.10 388 373 A 59 LYS HBy A 59 LYS HEx 1.0 . 5.10 389 374 A 143 TYR HD% A 15 PRO HBy 1.0 . 4.07 390 375 A 15 PRO HBy A 16 ASN HD2x 1.0 . 4.92 391 376 A 98 LEU HDy% A 33 ARG HBy 1.0 . 5.23 392 377 A 111 GLN HA A 111 GLN HGy 1.0 . 3.57 393 378 A 92 ALA HB% A 111 GLN HGy 1.0 . 3.92 394 379 A 94 GLN HA A 111 GLN HGx 1.0 . 4.56 395 380 A 112 CYS H A 111 GLN HGx 1.0 . 4.03 396 381 A 92 ALA HA A 111 GLN HGx 1.0 . 5.19 397 382 A 111 GLN HA A 111 GLN HGx 1.0 . 3.58 398 383 A 93 LEU H A 111 GLN HGx 1.0 . 4.55 399 384 A 11 LYS HBy A 12 ARG H 1.0 . 4.65 400 385 A 12 ARG H A 11 LYS HBx 1.0 . 5.00 401 386 A 33 ARG HBy A 99 GLU H 1.0 . 5.34 402 387 A 14 GLN H A 14 GLN HGy 1.0 . 4.97 403 388 A 14 GLN HGy A 9 THR HA 1.0 . 5.49 404 389 A 16 ASN HD2x A 14 GLN HGx 1.0 . 5.50 405 390 A 16 ASN HBy A 14 GLN HGx 1.0 . 5.28 406 391 A 5 PHE HBx A 112 CYS HBy 1.0 . 3.95 407 392 A 4 ILE HA A 112 CYS HBy 1.0 . 4.14 408 393 A 14 GLN H A 14 GLN HGx 1.0 . 4.57 409 394 A 9 THR HA A 14 GLN HGx 1.0 . 5.26 410 395 A 110 VAL HGx% A 112 CYS HBy 1.0 . 5.50 411 396 A 112 CYS HBy A 113 PHE H 1.0 . 3.58 412 397 A 112 CYS HBx A 5 PHE HBx 1.0 . 3.94 413 398 A 112 CYS HBx A 112 CYS H 1.0 . 3.62 414 399 A 112 CYS HBx A 4 ILE HA 1.0 . 4.61 415 400 A 6 VAL HB A 68 TYR HD% 1.0 . 5.40 416 401 A 6 VAL HB A 10 LEU HBx 1.0 . 5.43 417 402 A 6 VAL HB A 10 LEU HDx% 1.0 . 4.95 418 403 A 6 VAL HB A 68 TYR HE% 1.0 . 5.35 419 404 A 84 CYS HA A 85 PRO HBy 1.0 . 4.77 420 405 A 73 GLN HGx A 73 GLN HE2y 1.0 . 3.54 421 406 A 26 GLY HAx A 73 GLN HGx 1.0 . 4.26 422 407 A 87 MET HBx A 87 MET HE% 1.0 . 2.95 423 408 A 109 SER HA A 96 GLN HGy 1.0 . 5.10 424 409 A 96 GLN HGy A 96 GLN HA 1.0 . 3.65 425 410 A 96 GLN HGy A 97 VAL HA 1.0 . 5.12 426 411 A 96 GLN HGy A 97 VAL H 1.0 . 3.93 427 412 A 96 GLN HGy A 96 GLN HE2y 1.0 . 4.05 428 413 A 96 GLN HGy A 37 VAL HGx% 1.0 . 4.08 429 413 A 37 VAL HGy% A 96 GLN HGy 1.0 . 4.08 430 414 A 109 SER HA A 94 GLN HGx 1.0 . 5.13 431 415 A 85 PRO HBx A 84 CYS HA 1.0 . 5.41 432 416 A 109 SER HA A 96 GLN HGx 1.0 . 5.33 433 417 A 109 SER HBy A 96 GLN HGx 1.0 . 5.49 434 418 A 96 GLN HGx A 98 LEU HA 1.0 . 5.50 435 419 A 97 VAL H A 96 GLN HGx 1.0 . 3.97 436 420 A 96 GLN HA A 96 GLN HGx 1.0 . 3.82 437 421 A 96 GLN HGx A 96 GLN HBx 1.0 . 2.90 438 422 A 98 LEU HDy% A 96 GLN HGx 1.0 . 3.86 439 423 A 61 HIS HBy A 131 GLU HA 1.0 . 4.13 440 424 A 61 HIS HBy A 131 GLU HBx 1.0 . 5.04 441 425 A 110 VAL H A 94 GLN HGx 1.0 . 4.67 442 426 A 94 GLN HGx A 95 VAL H 1.0 . 3.78 443 427 A 94 GLN HGx A 94 GLN HE2y 1.0 . 3.48 444 428 A 94 GLN HA A 94 GLN HGx 1.0 . 3.42 445 429 A 109 SER HBy A 94 GLN HGx 1.0 . 4.16 446 430 A 94 GLN HGx A 109 SER HBx 1.0 . 3.55 447 431 A 94 GLN HGx A 37 VAL HGx% 1.0 . 3.40 448 431 A 37 VAL HGy% A 94 GLN HGx 1.0 . 3.40 449 432 A 96 GLN HGx A 98 LEU H 1.0 . 5.40 450 433 A 131 GLU HGx A 61 HIS HBy 1.0 . 4.12 451 434 A 87 MET HBx A 87 MET HGy 1.0 . 2.94 452 435 A 88 TYR H A 87 MET HGy 1.0 . 5.00 453 436 A 88 TYR H A 87 MET HBy 1.0 . 4.43 454 437 A 83 ASP HBy A 87 MET HBy 1.0 . 4.04 455 438 A 4 ILE H A 3 HIS HBy 1.0 . 4.39 456 439 A 3 HIS HBy A 110 VAL HGy% 1.0 . 5.50 457 440 A 110 VAL HGx% A 3 HIS HBy 1.0 . 5.50 458 441 A 110 VAL HGy% A 3 HIS HBx 1.0 . 5.50 459 442 A 87 MET H A 87 MET HGy 1.0 . 4.29 460 443 A 87 MET HGy A 87 MET HA 1.0 . 3.67 461 444 A 86 SER HBx A 87 MET HGy 1.0 . 5.23 462 445 A 83 ASP HBy A 87 MET HGy 1.0 . 3.84 463 446 A 87 MET HGy A 88 TYR HE% 1.0 . 5.50 464 447 A 87 MET HGy A 52 TRP HZ3 1.0 . 4.43 465 448 A 87 MET H A 87 MET HBy 1.0 . 4.07 466 449 A 88 TYR HD% A 87 MET HBy 1.0 . 5.32 467 450 A 87 MET HBy A 88 TYR HE% 1.0 . 5.19 468 451 A 87 MET HBy A 52 TRP HZ3 1.0 . 4.35 469 452 A 87 MET HGy A 87 MET HBy 1.0 . 2.56 470 453 A 33 ARG HDx A 99 GLU HBy 1.0 . 4.83 471 454 A 99 GLU HGx A 99 GLU HBy 1.0 . 2.94 472 455 A 33 ARG HDx A 99 GLU HBx 1.0 . 5.08 473 456 A 33 ARG H A 99 GLU HBx 1.0 . 4.27 474 457 A 130 HIS HBy A 131 GLU H 1.0 . 4.30 475 458 A 99 GLU HBx A 33 ARG HE 1.0 . 5.44 476 459 A 28 ALA HA A 74 MET HGx 1.0 . 5.37 477 460 A 38 GLU HA A 37 VAL HB 1.0 . 4.81 478 461 A 26 GLY HAx A 74 MET HGx 1.0 . 5.36 479 462 A 20 MET H A 20 MET HGy 1.0 . 3.77 480 463 A 20 MET HGy A 20 MET HA 1.0 . 4.12 481 464 A 10 LEU HBx A 20 MET HGy 1.0 . 4.04 482 465 A 20 MET HGy A 17 HIS HA 1.0 . 5.11 483 466 A 10 LEU HDy% A 20 MET HGx 1.0 . 4.54 484 467 A 18 LYS HA A 20 MET HGx 1.0 . 5.50 485 468 A 28 ALA HB% A 20 MET HGx 1.0 . 4.58 486 469 A 20 MET HE% A 20 MET HGx 1.0 . 4.47 487 470 A 17 HIS HA A 20 MET HGx 1.0 . 5.06 488 471 A 146 ARG H A 145 PRO HBx 1.0 . 4.12 489 472 A 38 GLU H A 37 VAL HB 1.0 . 3.61 490 473 A 43 VAL HGx% A 52 TRP HBy 1.0 . 4.02 491 474 A 144 ASN H A 145 PRO HBy 1.0 . 5.34 492 475 A 116 THR HB A 55 TYR HBx 1.0 . 3.93 493 476 A 116 THR HB A 53 LEU H 1.0 . 5.48 494 477 A 109 SER HA A 97 VAL HB 1.0 . 4.50 495 478 A 97 VAL HB A 108 ASP HA 1.0 . 3.80 496 479 A 127 LEU HA A 128 PRO HBx 1.0 . 5.20 497 480 A 128 PRO HBx A 129 TYR H 1.0 . 4.20 498 481 A 123 GLU H A 122 PRO HBy 1.0 . 4.21 499 482 A 71 ASP H A 74 MET HBy 1.0 . 4.51 500 483 A 26 GLY HAx A 74 MET HBx 1.0 . 4.68 501 484 A 74 MET HBx A 70 VAL HGx% 1.0 . 5.50 502 485 A 70 VAL HA A 74 MET HBx 1.0 . 5.15 503 486 A 51 PRO HBx A 44 ILE HA 1.0 . 5.39 504 487 A 42 LEU HDy% A 51 PRO HBx 1.0 . 4.68 505 488 A 51 PRO HBx A 44 ILE HG1x 1.0 . 4.05 506 489 A 31 ARG HBy A 32 GLY H 1.0 . 4.99 507 490 A 110 VAL HGy% A 106 PRO HBy 1.0 . 4.13 508 491 A 106 PRO HBx A 110 VAL HGy% 1.0 . 4.43 509 492 A 31 ARG HBy A 67 ILE HG2% 1.0 . 4.65 510 493 A 31 ARG HBx A 100 TRP HH2 1.0 . 5.22 511 494 A 31 ARG HE A 69 GLU HBy 1.0 . 5.19 512 495 A 3 HIS HD2 A 69 GLU HBy 1.0 . 5.00 513 496 A 70 VAL H A 69 GLU HBx 1.0 . 5.21 514 497 A 31 ARG HE A 69 GLU HBx 1.0 . 5.33 515 498 A 149 ARG HBy A 149 ARG H 1.0 . 4.06 516 499 A 20 MET H A 20 MET HBy 1.0 . 3.97 517 500 A 21 LEU H A 20 MET HBy 1.0 . 5.34 518 501 A 55 TYR HD% A 91 THR HB 1.0 . 5.37 519 502 A 92 ALA HA A 91 THR HB 1.0 . 5.11 520 503 A 93 LEU HBx A 91 THR HB 1.0 . 4.68 521 504 A 91 THR HB A 91 THR H 1.0 . 3.75 522 505 A 114 VAL HB A 91 THR HB 1.0 . 4.66 523 506 A 10 LEU HDy% A 19 VAL HB 1.0 . 4.08 524 507 A 100 TRP HA A 101 GLU HBy 1.0 . 4.96 525 508 A 58 GLY H A 57 PRO HBy 1.0 . 4.46 526 509 A 58 GLY H A 57 PRO HBx 1.0 . 4.59 527 510 A 38 GLU HGx A 57 PRO HBx 1.0 . 4.59 528 511 A 65 GLY H A 64 THR HB 1.0 . 3.33 529 512 A 64 THR HB A 64 THR H 1.0 . 3.87 530 513 A 98 LEU HDy% A 64 THR HB 1.0 . 4.90 531 514 A 96 GLN H A 35 CYS HBy 1.0 . 5.12 532 515 A 35 CYS HBy A 36 THR H 1.0 . 3.43 533 516 A 35 CYS HBy A 35 CYS H 1.0 . 3.95 534 517 A 65 GLY H A 35 CYS HBy 1.0 . 4.74 535 518 A 35 CYS HBy A 64 THR HA 1.0 . 3.51 536 519 A 34 GLY HAx A 35 CYS HBy 1.0 . 5.50 537 520 A 64 THR HB A 35 CYS HBy 1.0 . 4.67 538 521 A 35 CYS HBy A 62 CYS HBy 1.0 . 4.33 539 522 A 130 HIS HA A 131 GLU HBx 1.0 . 4.07 540 523 A 58 GLY H A 38 GLU HBy 1.0 . 5.34 541 524 A 101 GLU H A 101 GLU HBy 1.0 . 3.70 542 525 A 101 GLU HBy A 31 ARG HA 1.0 . 4.32 543 526 A 30 PHE HD% A 101 GLU HBx 1.0 . 5.20 544 527 A 101 GLU HBx A 102 GLY H 1.0 . 4.35 545 528 A 35 CYS HBy A 95 VAL HGx% 1.0 . 5.50 546 529 A 61 HIS HBy A 131 GLU HBy 1.0 . 5.16 547 530 A 131 GLU HBx A 131 GLU H 1.0 . 3.81 548 531 A 39 SER H A 38 GLU HBx 1.0 . 3.86 549 532 A 38 GLU HBx A 37 VAL HGx% 1.0 . 5.33 550 532 A 37 VAL HGy% A 38 GLU HBx 1.0 . 5.33 551 533 A 58 GLY H A 38 GLU HBx 1.0 . 5.14 552 534 A 129 TYR HD% A 41 PRO HBx 1.0 . 5.00 553 535 A 60 GLY HAx A 41 PRO HBx 1.0 . 5.30 554 536 A 54 LEU HDx% A 41 PRO HBx 1.0 . 4.58 555 537 A 129 TYR HE% A 41 PRO HBx 1.0 . 5.00 556 538 A 5 PHE HZ A 64 THR HB 1.0 . 5.08 557 539 A 132 SER HA A 131 GLU HBy 1.0 . 4.96 558 540 A 89 GLN HE2y A 89 GLN HBy 1.0 . 5.39 559 541 A 146 ARG HBy A 147 GLU H 1.0 . 4.26 560 542 A 146 ARG H A 146 ARG HBy 1.0 . 3.64 561 543 A 146 ARG HBx A 146 ARG HGx 1.0 . 2.97 562 544 A 139 HIS HBx A 142 ARG HE 1.0 . 4.78 563 545 A 50 ILE H A 50 ILE HG1y 1.0 . 4.14 564 546 A 48 HIS HA A 50 ILE HG1x 1.0 . 5.32 565 547 A 147 GLU HBy A 147 GLU H 1.0 . 3.54 566 548 A 48 HIS HBy A 50 ILE HG1x 1.0 . 4.87 567 549 A 50 ILE HG1x A 48 HIS HBx 1.0 . 4.72 568 550 A 147 GLU HBx A 147 GLU H 1.0 . 3.46 569 551 A 47 GLU HBx A 48 HIS HD2 1.0 . 5.38 570 552 A 47 GLU HBx A 47 GLU H 1.0 . 3.58 571 553 A 48 HIS HA A 47 GLU HBx 1.0 . 4.63 572 554 A 96 GLN HBx A 96 GLN HE2x 1.0 . 4.76 573 555 A 112 CYS H A 111 GLN HBx 1.0 . 3.92 574 555 A 112 CYS H A 111 GLN HBy 1.0 . 3.92 575 556 A 111 GLN HE2y A 111 GLN HBx 1.0 . 4.68 576 556 A 111 GLN HBy A 111 GLN HE2y 1.0 . 4.68 577 557 A 92 ALA HB% A 111 GLN HBx 1.0 . 5.26 578 557 A 92 ALA HB% A 111 GLN HBy 1.0 . 5.26 579 558 A 111 GLN H A 111 GLN HBx 1.0 . 3.26 580 558 A 111 GLN HBy A 111 GLN H 1.0 . 3.26 581 559 A 48 HIS H A 47 GLU HBx 1.0 . 4.47 582 560 A 18 LYS HDx A 21 LEU HDx% 1.0 . 5.50 583 561 A 18 LYS HDx A 18 LYS H 1.0 . 4.25 584 562 A 19 VAL H A 18 LYS HDx 1.0 . 4.85 585 563 A 18 LYS HA A 18 LYS HDx 1.0 . 4.76 586 564 A 16 ASN HA A 18 LYS HDx 1.0 . 5.31 587 565 A 48 HIS H A 48 HIS HBy 1.0 . 3.89 588 566 A 48 HIS HBy A 50 ILE HG1y 1.0 . 4.41 589 567 A 48 HIS HBy A 49 ASN H 1.0 . 4.71 590 568 A 48 HIS HBx A 50 ILE HG2% 1.0 . 5.50 591 569 A 96 GLN HBx A 95 VAL HGx% 1.0 . 5.50 592 570 A 11 LYS H A 12 ARG HBy 1.0 . 5.10 593 571 A 50 ILE HG1y A 48 HIS HBx 1.0 . 4.96 594 572 A 97 VAL H A 96 GLN HBy 1.0 . 4.78 595 573 A 35 CYS HBy A 96 GLN HBy 1.0 . 4.62 596 574 A 96 GLN HBy A 37 VAL HGx% 1.0 . 4.09 597 574 A 37 VAL HGy% A 96 GLN HBy 1.0 . 4.09 598 575 A 71 ASP HBy A 72 GLU HBx 1.0 . 4.82 599 576 A 72 GLU H A 72 GLU HBx 1.0 . 2.99 600 577 A 73 GLN H A 72 GLU HBx 1.0 . 3.37 601 578 A 71 ASP HA A 72 GLU HBx 1.0 . 4.65 602 579 A 97 VAL H A 96 GLN HBx 1.0 . 5.11 603 580 A 96 GLN HBx A 37 VAL HA 1.0 . 4.70 604 581 A 90 ARG HBy A 90 ARG HE 1.0 . 5.03 605 582 A 82 GLU HBx A 88 TYR H 1.0 . 5.23 606 583 A 90 ARG HE A 90 ARG HBx 1.0 . 4.79 607 584 A 88 TYR HD% A 82 GLU HGy 1.0 . 5.28 608 585 A 32 GLY HAx A 33 ARG HGx 1.0 . 5.50 609 586 A 96 GLN HBx A 37 VAL H 1.0 . 4.78 610 587 A 30 PHE HE% A 33 ARG HGx 1.0 . 4.73 611 588 A 95 VAL H A 94 GLN HBx 1.0 . 4.62 612 589 A 136 GLU H A 136 GLU HBy 1.0 . 4.10 613 590 A 59 LYS H A 59 LYS HDy 1.0 . 5.07 614 591 A 59 LYS HA A 59 LYS HDy 1.0 . 3.79 615 592 A 67 ILE HG1y A 68 TYR H 1.0 . 5.24 616 593 A 59 LYS HA A 59 LYS HDx 1.0 . 3.86 617 594 A 60 GLY H A 59 LYS HDx 1.0 . 5.28 618 595 A 95 VAL HGx% A 36 THR HB 1.0 . 5.50 619 596 A 54 LEU HDy% A 124 TRP HBx 1.0 . 5.50 620 597 A 77 PHE HBx A 25 HIS HBy 1.0 . 5.37 621 598 A 25 HIS HBx A 77 PHE HD% 1.0 . 4.18 622 599 A 25 HIS HBx A 77 PHE HBx 1.0 . 4.47 623 600 A 60 GLY H A 59 LYS HDy 1.0 . 5.10 624 601 A 67 ILE HG1y A 67 ILE HA 1.0 . 4.08 625 602 A 54 LEU HDx% A 41 PRO HGy 1.0 . 4.65 626 603 A 67 ILE HG1y A 5 PHE HA 1.0 . 5.13 627 604 A 68 TYR H A 67 ILE HG1x 1.0 . 5.31 628 605 A 67 ILE HG1x A 67 ILE H 1.0 . 4.51 629 606 A 67 ILE HG2% A 67 ILE HG1x 1.0 . 4.18 630 607 A 95 VAL HGx% A 67 ILE HG1x 1.0 . 4.90 631 608 A 5 PHE HD% A 67 ILE HG1x 1.0 . 4.37 632 609 A 41 PRO HGx A 43 VAL HGy% 1.0 . 5.50 633 610 A 54 LEU HDx% A 41 PRO HGx 1.0 . 5.50 634 611 A 120 TYR HBx A 124 TRP HBx 1.0 . 5.48 635 612 A 127 LEU HDy% A 128 PRO HGy 1.0 . 5.32 636 613 A 129 TYR H A 128 PRO HGy 1.0 . 5.50 637 614 A 127 LEU HDy% A 128 PRO HGx 1.0 . 5.50 638 615 A 119 THR HB A 120 TYR H 1.0 . 5.37 639 616 A 27 LEU HDy% A 23 HIS HBx 1.0 . 5.50 640 617 A 127 LEU HA A 128 PRO HGy 1.0 . 4.66 641 618 A 129 TYR H A 128 PRO HGx 1.0 . 5.38 642 619 A 127 LEU HA A 128 PRO HGx 1.0 . 4.83 643 620 A 143 TYR HD% A 15 PRO HGy 1.0 . 4.81 644 621 A 15 PRO HGy A 14 GLN HA 1.0 . 4.72 645 622 A 15 PRO HGx A 16 ASN HD2x 1.0 . 5.50 646 623 A 73 GLN HBx A 74 MET H 1.0 . 3.56 647 624 A 77 PHE H A 76 ARG HGy 1.0 . 4.77 648 625 A 76 ARG HA A 76 ARG HGy 1.0 . 3.76 649 626 A 77 PHE H A 76 ARG HGx 1.0 . 5.07 650 627 A 76 ARG HA A 76 ARG HGx 1.0 . 3.68 651 628 A 76 ARG H A 76 ARG HGx 1.0 . 3.95 652 629 A 10 LEU HA A 17 HIS HBy 1.0 . 4.86 653 630 A 18 LYS HA A 17 HIS HBx 1.0 . 4.95 654 631 A 123 GLU H A 122 PRO HGy 1.0 . 3.98 655 632 A 123 GLU H A 122 PRO HGx 1.0 . 4.37 656 633 A 76 ARG HGy A 76 ARG HBy 1.0 . 2.85 657 634 A 142 ARG HGx A 141 LEU HA 1.0 . 5.45 658 635 A 142 ARG HGx A 142 ARG H 1.0 . 3.69 659 636 A 84 CYS HBy A 115 TYR HE% 1.0 . 5.50 660 637 A 89 GLN HA A 84 CYS HBy 1.0 . 4.57 661 638 A 85 PRO HA A 84 CYS HBy 1.0 . 3.69 662 639 A 85 PRO HA A 84 CYS HBx 1.0 . 4.06 663 640 A 84 CYS HBx A 79 ASP HA 1.0 . 4.51 664 641 A 90 ARG H A 84 CYS HBx 1.0 . 5.27 665 642 A 88 TYR H A 84 CYS HBx 1.0 . 4.71 666 643 A 142 ARG HA A 142 ARG HGx 1.0 . 3.58 667 644 A 124 TRP HA A 127 LEU HG 1.0 . 3.50 668 645 A 127 LEU HA A 127 LEU HG 1.0 . 4.04 669 646 A 56 LEU HA A 57 PRO HGx 1.0 . 4.78 670 647 A 4 ILE H A 4 ILE HG1y 1.0 . 4.16 671 648 A 4 ILE HG1y A 68 TYR HBy 1.0 . 4.19 672 649 A 68 TYR HBx A 4 ILE HG1y 1.0 . 5.21 673 650 A 44 ILE H A 44 ILE HG1y 1.0 . 4.43 674 651 A 68 TYR H A 4 ILE HG1x 1.0 . 4.80 675 652 A 4 ILE HG1x A 3 HIS HA 1.0 . 5.07 676 653 A 40 PHE HE% A 57 PRO HGx 1.0 . 4.46 677 654 A 57 PRO HGx A 55 TYR HE% 1.0 . 4.88 678 655 A 125 LEU HA A 125 LEU HG 1.0 . 3.79 679 656 A 54 LEU HDx% A 125 LEU HG 1.0 . 5.30 680 657 A 146 ARG HGy A 147 GLU H 1.0 . 5.06 681 658 A 16 ASN HBx A 10 LEU HG 1.0 . 5.22 682 659 A 10 LEU HG A 10 LEU H 1.0 . 4.01 683 660 A 10 LEU HA A 10 LEU HG 1.0 . 4.18 684 661 A 10 LEU HG A 6 VAL HGy% 1.0 . 5.19 685 662 A 44 ILE HG1y A 51 PRO HA 1.0 . 5.06 686 663 A 44 ILE HG1y A 43 VAL HA 1.0 . 5.15 687 664 A 68 TYR HBy A 4 ILE HG1x 1.0 . 4.07 688 665 A 44 ILE HG2% A 44 ILE HG1x 1.0 . 3.94 689 666 A 133 TYR HD% A 44 ILE HG1x 1.0 . 4.88 690 667 A 14 GLN HBy A 15 PRO HDy 1.0 . 5.43 691 668 A 14 GLN HBy A 15 PRO HDx 1.0 . 5.18 692 669 A 138 PRO HGy A 139 HIS H 1.0 . 5.04 693 670 A 139 HIS H A 138 PRO HGx 1.0 . 5.17 694 671 A 146 ARG HGy A 149 ARG HA 1.0 . 4.01 695 672 A 147 GLU H A 146 ARG HGx 1.0 . 5.50 696 673 A 40 PHE HBy A 53 LEU HG 1.0 . 4.15 697 674 A 40 PHE HBx A 53 LEU HG 1.0 . 4.20 698 675 A 54 LEU H A 53 LEU HG 1.0 . 4.51 699 676 A 42 LEU HDy% A 53 LEU HG 1.0 . 5.38 700 677 A 53 LEU HDy% A 40 PHE H 1.0 . 5.44 701 678 A 53 LEU HDy% A 55 TYR HA 1.0 . 5.50 702 679 A 53 LEU HDy% A 43 VAL H 1.0 . 5.42 703 680 A 53 LEU HDy% A 42 LEU HA 1.0 . 3.87 704 681 A 53 LEU HDy% A 53 LEU HA 1.0 . 3.26 705 682 A 41 PRO HDx A 53 LEU HDy% 1.0 . 5.50 706 683 A 40 PHE HBy A 53 LEU HDy% 1.0 . 3.64 707 684 A 53 LEU HDy% A 42 LEU HBy 1.0 . 4.48 708 685 A 40 PHE HBx A 53 LEU HDy% 1.0 . 3.46 709 686 A 53 LEU HDy% A 63 VAL HB 1.0 . 4.30 710 687 A 53 LEU HDy% A 53 LEU HBy 1.0 . 4.05 711 688 A 53 LEU HDy% A 63 VAL HGy% 1.0 . 3.41 712 689 A 15 PRO HDy A 14 GLN HBx 1.0 . 5.49 713 690 A 9 THR HA A 14 GLN HBx 1.0 . 4.41 714 691 A 16 ASN HD2x A 14 GLN HBx 1.0 . 5.50 715 692 A 15 PRO HDx A 14 GLN HBx 1.0 . 5.24 716 693 A 143 TYR HE% A 145 PRO HGx 1.0 . 5.09 717 694 A 27 LEU HA A 27 LEU HG 1.0 . 4.16 718 695 A 69 GLU H A 31 ARG HGx 1.0 . 4.47 719 696 A 31 ARG H A 31 ARG HGx 1.0 . 5.19 720 697 A 53 LEU HA A 53 LEU HG 1.0 . 3.99 721 698 A 53 LEU HG A 40 PHE HD% 1.0 . 5.08 722 699 A 62 CYS HBx A 63 VAL HA 1.0 . 5.24 723 700 A 36 THR H A 62 CYS HBy 1.0 . 4.73 724 701 A 62 CYS HBy A 62 CYS H 1.0 . 3.84 725 702 A 62 CYS HBy A 63 VAL HA 1.0 . 5.16 726 703 A 62 CYS HBy A 35 CYS HBx 1.0 . 5.32 727 704 A 131 GLU HGx A 62 CYS HBx 1.0 . 4.75 728 705 A 62 CYS HBx A 63 VAL H 1.0 . 4.53 729 706 A 120 TYR HD% A 54 LEU HG 1.0 . 5.50 730 707 A 55 TYR H A 54 LEU HG 1.0 . 5.46 731 708 A 113 PHE HA A 90 ARG HGy 1.0 . 5.44 732 709 A 79 ASP H A 78 LEU HDx% 1.0 . 5.17 733 710 A 77 PHE HBy A 78 LEU HDx% 1.0 . 5.50 734 711 A 78 LEU H A 78 LEU HDx% 1.0 . 3.94 735 712 A 115 TYR HD% A 78 LEU HDx% 1.0 . 5.50 736 713 A 78 LEU HA A 78 LEU HDx% 1.0 . 4.42 737 714 A 78 LEU HBy A 78 LEU HDx% 1.0 . 3.42 738 715 A 15 PRO HA A 17 HIS H 1.0 . 5.19 739 716 A 54 LEU H A 54 LEU HG 1.0 . 3.57 740 717 A 113 PHE HD% A 90 ARG HGy 1.0 . 4.33 741 718 A 113 PHE HBx A 90 ARG HGy 1.0 . 3.99 742 719 A 91 THR H A 90 ARG HGy 1.0 . 5.15 743 720 A 141 LEU HDx% A 44 ILE H 1.0 . 5.50 744 721 A 49 ASN HD2x A 141 LEU HDx% 1.0 . 5.50 745 722 A 141 LEU HDx% A 49 ASN HA 1.0 . 5.50 746 723 A 142 ARG HA A 141 LEU HDx% 1.0 . 4.43 747 724 A 141 LEU HDx% A 141 LEU HA 1.0 . 4.21 748 725 A 141 LEU HDx% A 139 HIS HA 1.0 . 5.50 749 726 A 141 LEU HDx% A 139 HIS HBx 1.0 . 4.00 750 727 A 141 LEU HBy A 141 LEU HDx% 1.0 . 3.40 751 728 A 74 MET HGx A 78 LEU HDx% 1.0 . 4.11 752 729 A 78 LEU HBx A 78 LEU HDx% 1.0 . 3.44 753 730 A 113 PHE HD% A 90 ARG HGx 1.0 . 4.94 754 731 A 113 PHE HBy A 90 ARG HGx 1.0 . 4.62 755 732 A 20 MET H A 21 LEU HG 1.0 . 4.80 756 733 A 113 PHE HBy A 90 ARG HGy 1.0 . 5.15 757 734 A 44 ILE HB A 141 LEU HDx% 1.0 . 3.86 758 735 A 11 LYS HGy A 11 LYS H 1.0 . 4.81 759 736 A 45 ALA H A 127 LEU HDx% 1.0 . 5.40 760 737 A 44 ILE H A 127 LEU HDx% 1.0 . 4.97 761 738 A 127 LEU HDx% A 46 GLY H 1.0 . 4.83 762 739 A 126 PHE H A 127 LEU HDx% 1.0 . 5.50 763 740 A 43 VAL HA A 127 LEU HDx% 1.0 . 5.26 764 741 A 124 TRP HA A 127 LEU HDx% 1.0 . 3.22 765 742 A 128 PRO HDx A 127 LEU HDx% 1.0 . 5.06 766 743 A 124 TRP HBy A 127 LEU HDx% 1.0 . 4.43 767 744 A 124 TRP HBx A 127 LEU HDx% 1.0 . 4.03 768 745 A 43 VAL HB A 127 LEU HDx% 1.0 . 3.55 769 746 A 127 LEU HBy A 127 LEU HDx% 1.0 . 3.44 770 747 A 127 LEU HBx A 127 LEU HDx% 1.0 . 3.60 771 748 A 109 SER HBy A 95 VAL H 1.0 . 5.27 772 749 A 109 SER HBy A 96 GLN HA 1.0 . 3.88 773 750 A 109 SER HBy A 97 VAL H 1.0 . 4.78 774 751 A 96 GLN HA A 109 SER HBx 1.0 . 4.07 775 752 A 96 GLN H A 37 VAL HA 1.0 . 5.15 776 753 A 109 SER HBy A 96 GLN HBx 1.0 . 4.57 777 754 A 139 HIS HBx A 141 LEU HG 1.0 . 4.26 778 755 A 100 TRP HZ3 A 106 PRO HGx 1.0 . 4.83 779 756 A 97 VAL HGx% A 106 PRO HGx 1.0 . 5.30 780 757 A 110 VAL HGy% A 106 PRO HGx 1.0 . 4.09 781 758 A 100 TRP HE3 A 106 PRO HGx 1.0 . 5.50 782 759 A 106 PRO HGx A 105 ASP HA 1.0 . 4.84 783 760 A 18 LYS HA A 21 LEU HDx% 1.0 . 3.22 784 761 A 130 HIS H A 42 LEU HDx% 1.0 . 4.71 785 762 A 42 LEU HDx% A 133 TYR H 1.0 . 4.18 786 763 A 42 LEU HDx% A 132 SER H 1.0 . 4.38 787 764 A 42 LEU HDx% A 42 LEU HA 1.0 . 4.33 788 765 A 42 LEU HDx% A 63 VAL HA 1.0 . 4.84 789 766 A 42 LEU HDx% A 132 SER HA 1.0 . 3.39 790 767 A 133 TYR HA A 42 LEU HDx% 1.0 . 5.34 791 768 A 42 LEU HDx% A 130 HIS HBy 1.0 . 3.82 792 769 A 42 LEU HDx% A 130 HIS HBx 1.0 . 3.25 793 770 A 42 LEU HDx% A 42 LEU HBy 1.0 . 3.49 794 771 A 42 LEU HDx% A 63 VAL HGx% 1.0 . 3.20 795 772 A 42 LEU HDx% A 42 LEU H 1.0 . 5.06 796 773 A 42 LEU HDx% A 131 GLU HA 1.0 . 5.50 797 774 A 42 LEU HDy% A 51 PRO HA 1.0 . 4.43 798 775 A 122 PRO HA A 125 LEU HG 1.0 . 4.54 799 776 A 122 PRO HA A 125 LEU H 1.0 . 4.60 800 777 A 125 LEU HBy A 122 PRO HA 1.0 . 5.29 801 778 A 21 LEU HDx% A 18 LYS H 1.0 . 4.87 802 779 A 20 MET H A 21 LEU HDx% 1.0 . 5.50 803 780 A 21 LEU H A 21 LEU HDx% 1.0 . 3.88 804 781 A 21 LEU HDx% A 21 LEU HA 1.0 . 4.11 805 782 A 18 LYS HBx A 21 LEU HDx% 1.0 . 3.88 806 783 A 21 LEU HBy A 21 LEU HDx% 1.0 . 2.53 807 784 A 56 LEU HBy A 56 LEU HDy% 1.0 . 2.68 808 785 A 56 LEU HBx A 56 LEU HDy% 1.0 . 3.07 809 786 A 42 LEU HDy% A 52 TRP H 1.0 . 3.82 810 787 A 54 LEU H A 42 LEU HDy% 1.0 . 5.32 811 788 A 43 VAL H A 42 LEU HDy% 1.0 . 3.40 812 789 A 56 LEU H A 56 LEU HDx% 1.0 . 5.15 813 790 A 42 LEU HDy% A 42 LEU H 1.0 . 5.50 814 791 A 59 LYS H A 56 LEU HDx% 1.0 . 4.51 815 792 A 42 LEU HDy% A 42 LEU HA 1.0 . 3.29 816 793 A 53 LEU HA A 42 LEU HDy% 1.0 . 3.82 817 794 A 56 LEU HDx% A 56 LEU HA 1.0 . 3.50 818 795 A 41 PRO HDy A 56 LEU HDx% 1.0 . 5.15 819 796 A 57 PRO HA A 56 LEU HDx% 1.0 . 5.29 820 797 A 56 LEU HDx% A 57 PRO HDy 1.0 . 4.41 821 798 A 133 TYR HBx A 42 LEU HDy% 1.0 . 4.60 822 799 A 42 LEU HDy% A 42 LEU HBy 1.0 . 3.93 823 800 A 56 LEU HDx% A 56 LEU HBx 1.0 . 3.21 824 801 A 53 LEU HDy% A 42 LEU HDy% 1.0 . 3.22 825 802 A 53 LEU HDx% A 55 TYR HA 1.0 . 5.49 826 803 A 116 THR HB A 53 LEU HDx% 1.0 . 4.36 827 804 A 53 LEU HDx% A 63 VAL HB 1.0 . 5.13 828 805 A 117 THR H A 53 LEU HDx% 1.0 . 5.37 829 806 A 53 LEU HDx% A 40 PHE HD% 1.0 . 3.99 830 807 A 40 PHE HE% A 53 LEU HDx% 1.0 . 4.50 831 808 A 53 LEU HA A 53 LEU HDx% 1.0 . 4.22 832 809 A 40 PHE HBy A 53 LEU HDx% 1.0 . 4.10 833 810 A 40 PHE HBx A 53 LEU HDx% 1.0 . 3.97 834 811 A 53 LEU HBy A 53 LEU HDx% 1.0 . 3.47 835 812 A 117 THR HG2% A 53 LEU HDx% 1.0 . 5.50 836 813 A 53 LEU HDx% A 116 THR HG2% 1.0 . 3.08 837 814 A 42 LEU HDy% A 53 LEU HDx% 1.0 . 5.12 838 815 A 56 LEU H A 56 LEU HDy% 1.0 . 5.07 839 816 A 56 LEU HDy% A 56 LEU HA 1.0 . 3.26 840 817 A 56 LEU HDy% A 57 PRO HDy 1.0 . 4.41 841 818 A 125 LEU HDy% A 56 LEU HDy% 1.0 . 3.24 842 819 A 54 LEU HDx% A 56 LEU HDy% 1.0 . 4.81 843 820 A 133 TYR H A 132 SER HBy 1.0 . 4.31 844 821 A 64 THR H A 132 SER HBy 1.0 . 4.80 845 822 A 132 SER HA A 132 SER HBy 1.0 . 3.01 846 823 A 132 SER HA A 132 SER HBx 1.0 . 3.02 847 824 A 64 THR H A 132 SER HBx 1.0 . 4.98 848 825 A 125 LEU H A 125 LEU HDx% 1.0 . 3.88 849 826 A 122 PRO HA A 125 LEU HDx% 1.0 . 3.50 850 827 A 93 LEU HDx% A 5 PHE HBx 1.0 . 5.50 851 828 A 122 PRO HBy A 125 LEU HDx% 1.0 . 4.73 852 829 A 125 LEU HBy A 125 LEU HDx% 1.0 . 3.01 853 830 A 125 LEU HBx A 125 LEU HDx% 1.0 . 3.13 854 831 A 54 LEU HDx% A 125 LEU HDx% 1.0 . 4.40 855 832 A 93 LEU HDx% A 92 ALA HA 1.0 . 5.50 856 833 A 93 LEU HDx% A 93 LEU H 1.0 . 4.12 857 834 A 93 LEU HDx% A 94 GLN H 1.0 . 4.15 858 835 A 93 LEU HDx% A 36 THR HB 1.0 . 5.50 859 836 A 93 LEU HDx% A 36 THR HG2% 1.0 . 3.57 860 837 A 75 LEU HDx% A 79 ASP H 1.0 . 5.50 861 838 A 19 VAL HA A 18 LYS HGy 1.0 . 4.99 862 838 A 18 LYS HGx A 19 VAL HA 1.0 . 4.99 863 839 A 19 VAL HA A 19 VAL HGy% 1.0 . 3.62 864 840 A 21 LEU H A 19 VAL HA 1.0 . 4.66 865 841 A 19 VAL HA A 22 ASP H 1.0 . 4.54 866 842 A 19 VAL HA A 10 LEU HDy% 1.0 . 5.46 867 843 A 59 LYS HGy A 59 LYS HA 1.0 . 4.06 868 844 A 59 LYS HGy A 56 LEU HDy% 1.0 . 4.69 869 845 A 129 TYR HE% A 59 LYS HGy 1.0 . 5.41 870 846 A 129 TYR HE% A 59 LYS HGx 1.0 . 5.50 871 847 A 10 LEU HDx% A 10 LEU H 1.0 . 4.39 872 848 A 10 LEU HDx% A 81 PHE HD% 1.0 . 5.06 873 849 A 10 LEU HDx% A 10 LEU HA 1.0 . 4.35 874 850 A 75 LEU HDx% A 78 LEU H 1.0 . 5.50 875 851 A 75 LEU H A 75 LEU HDx% 1.0 . 4.38 876 852 A 76 ARG H A 75 LEU HDx% 1.0 . 5.01 877 853 A 75 LEU HDx% A 113 PHE HD% 1.0 . 4.09 878 854 A 75 LEU HDx% A 75 LEU HA 1.0 . 3.30 879 855 A 75 LEU HDx% A 113 PHE HBy 1.0 . 5.41 880 856 A 75 LEU HDx% A 113 PHE HBx 1.0 . 4.09 881 857 A 75 LEU HDx% A 78 LEU HBy 1.0 . 4.11 882 858 A 75 LEU HBy A 75 LEU HDx% 1.0 . 3.68 883 859 A 75 LEU HDx% A 4 ILE HG2% 1.0 . 3.96 884 860 A 75 LEU HDx% A 78 LEU HDx% 1.0 . 3.41 885 861 A 93 LEU H A 93 LEU HG 1.0 . 4.18 886 862 A 94 GLN H A 93 LEU HG 1.0 . 4.48 887 863 A 40 PHE HE% A 93 LEU HG 1.0 . 3.57 888 864 A 114 VAL HB A 93 LEU HG 1.0 . 3.28 889 865 A 93 LEU HBx A 93 LEU HG 1.0 . 2.77 890 866 A 93 LEU HG A 114 VAL HGy% 1.0 . 3.03 891 867 A 56 LEU HDx% A 59 LYS HGy 1.0 . 5.32 892 868 A 75 LEU HDx% A 4 ILE HA 1.0 . 5.50 893 869 A 54 LEU HDx% A 55 TYR H 1.0 . 5.50 894 870 A 54 LEU HDx% A 125 LEU H 1.0 . 5.14 895 871 A 54 LEU HDx% A 125 LEU HA 1.0 . 4.03 896 872 A 54 LEU HDx% A 124 TRP HBy 1.0 . 4.37 897 873 A 54 LEU HDx% A 120 TYR HBy 1.0 . 4.78 898 874 A 54 LEU HDx% A 54 LEU HBy 1.0 . 3.23 899 875 A 54 LEU HDx% A 41 PRO HBy 1.0 . 3.61 900 876 A 54 LEU HDx% A 43 VAL HGy% 1.0 . 3.90 901 877 A 54 LEU HDx% A 43 VAL HGx% 1.0 . 3.27 902 878 A 54 LEU HDx% A 45 ALA HB% 1.0 . 5.50 903 879 A 9 THR HA A 14 GLN HBy 1.0 . 3.67 904 880 A 54 LEU HDx% A 54 LEU H 1.0 . 4.21 905 881 A 54 LEU HDx% A 43 VAL H 1.0 . 5.32 906 882 A 54 LEU HDx% A 124 TRP HZ3 1.0 . 5.50 907 883 A 54 LEU HDx% A 53 LEU HA 1.0 . 5.50 908 884 A 54 LEU HDx% A 54 LEU HA 1.0 . 4.35 909 885 A 41 PRO HDx A 54 LEU HDx% 1.0 . 5.48 910 886 A 54 LEU HDx% A 124 TRP HBx 1.0 . 4.18 911 887 A 54 LEU HDx% A 52 TRP HBy 1.0 . 4.67 912 888 A 54 LEU HDx% A 43 VAL HB 1.0 . 5.50 913 889 A 88 TYR H A 85 PRO HA 1.0 . 4.78 914 890 A 29 ALA H A 27 LEU HDx% 1.0 . 5.28 915 891 A 27 LEU H A 27 LEU HDx% 1.0 . 4.47 916 892 A 71 ASP H A 27 LEU HDx% 1.0 . 5.09 917 893 A 75 LEU H A 75 LEU HDy% 1.0 . 4.27 918 894 A 75 LEU HDy% A 113 PHE HE% 1.0 . 4.28 919 895 A 72 GLU HGx A 75 LEU HDy% 1.0 . 5.03 920 896 A 90 ARG HDx A 75 LEU HDy% 1.0 . 4.00 921 897 A 75 LEU HDy% A 2 ALA HB% 1.0 . 3.45 922 898 A 113 PHE HBy A 75 LEU HDy% 1.0 . 5.39 923 899 A 113 PHE HBx A 75 LEU HDy% 1.0 . 4.33 924 900 A 89 GLN HA A 85 PRO HA 1.0 . 4.21 925 901 A 89 GLN HE2y A 85 PRO HA 1.0 . 5.50 926 902 A 85 PRO HGy A 86 SER H 1.0 . 5.43 927 903 A 19 VAL HGy% A 18 LYS HGy 1.0 . 5.18 928 903 A 18 LYS HGx A 19 VAL HGy% 1.0 . 5.18 929 904 A 71 ASP HBy A 27 LEU HDx% 1.0 . 5.30 930 905 A 71 ASP HBx A 27 LEU HDx% 1.0 . 4.47 931 906 A 27 LEU HBx A 27 LEU HDx% 1.0 . 2.77 932 907 A 96 GLN H A 36 THR HA 1.0 . 4.10 933 908 A 37 VAL H A 36 THR HA 1.0 . 3.07 934 909 A 36 THR HA A 95 VAL HA 1.0 . 3.33 935 910 A 95 VAL HGx% A 36 THR HA 1.0 . 4.56 936 911 A 40 PHE HE% A 36 THR HA 1.0 . 5.32 937 912 A 19 VAL HGx% A 18 LYS HGy 1.0 . 4.89 938 912 A 18 LYS HGx A 19 VAL HGx% 1.0 . 4.89 939 913 A 97 VAL HA A 98 LEU H 1.0 . 3.06 940 914 A 96 GLN HA A 97 VAL HA 1.0 . 4.76 941 915 A 98 LEU HBy A 97 VAL HA 1.0 . 4.32 942 916 A 67 ILE HD1% A 97 VAL HA 1.0 . 4.35 943 917 A 97 VAL HA A 95 VAL HGx% 1.0 . 5.06 944 918 A 34 GLY HAx A 97 VAL HA 1.0 . 3.94 945 919 A 27 LEU HDy% A 29 ALA H 1.0 . 5.18 946 920 A 27 LEU H A 27 LEU HDy% 1.0 . 4.53 947 921 A 71 ASP H A 27 LEU HDy% 1.0 . 4.97 948 922 A 28 ALA H A 27 LEU HDy% 1.0 . 4.11 949 923 A 70 VAL HA A 27 LEU HDy% 1.0 . 4.95 950 924 A 27 LEU HDy% A 28 ALA HA 1.0 . 5.25 951 925 A 27 LEU HDy% A 23 HIS HA 1.0 . 4.51 952 926 A 27 LEU HDy% A 27 LEU HA 1.0 . 3.32 953 927 A 27 LEU HDy% A 23 HIS HBy 1.0 . 4.42 954 928 A 71 ASP HBx A 27 LEU HDy% 1.0 . 4.63 955 929 A 58 GLY H A 39 SER HBy 1.0 . 4.75 956 930 A 39 SER H A 39 SER HBy 1.0 . 3.60 957 931 A 39 SER HBy A 61 HIS H 1.0 . 4.59 958 932 A 59 LYS H A 39 SER HBy 1.0 . 4.79 959 933 A 40 PHE HA A 39 SER HBy 1.0 . 5.14 960 934 A 39 SER HBy A 61 HIS HA 1.0 . 4.22 961 935 A 62 CYS HA A 39 SER HBy 1.0 . 5.15 962 936 A 39 SER HBx A 58 GLY H 1.0 . 4.37 963 937 A 39 SER HBx A 39 SER H 1.0 . 3.46 964 938 A 39 SER HBx A 40 PHE H 1.0 . 3.86 965 939 A 39 SER HBx A 61 HIS HA 1.0 . 4.91 966 940 A 39 SER HBx A 58 GLY HAy 1.0 . 4.25 967 941 A 39 SER HBx A 38 GLU HA 1.0 . 5.10 968 942 A 136 GLU HGx A 135 SER HBy 1.0 . 5.20 969 943 A 135 SER HBy A 143 TYR H 1.0 . 5.33 970 944 A 135 SER HBx A 135 SER H 1.0 . 4.14 971 945 A 136 GLU H A 135 SER HBx 1.0 . 4.47 972 946 A 125 LEU HDy% A 124 TRP H 1.0 . 5.50 973 947 A 125 LEU HDy% A 125 LEU H 1.0 . 4.00 974 948 A 125 LEU HDy% A 120 TYR HD% 1.0 . 4.40 975 949 A 125 LEU HDy% A 125 LEU HA 1.0 . 2.98 976 950 A 125 LEU HDy% A 124 TRP HBy 1.0 . 5.35 977 951 A 125 LEU HDy% A 124 TRP HBx 1.0 . 5.50 978 952 A 125 LEU HDy% A 125 LEU HBy 1.0 . 3.46 979 953 A 125 LEU HDy% A 125 LEU HBx 1.0 . 3.26 980 954 A 125 LEU HDy% A 54 LEU HDx% 1.0 . 3.30 981 955 A 115 TYR H A 114 VAL HGx% 1.0 . 4.32 982 956 A 91 THR H A 114 VAL HGx% 1.0 . 5.50 983 957 A 93 LEU HDy% A 112 CYS H 1.0 . 3.82 984 958 A 93 LEU HDy% A 113 PHE HA 1.0 . 4.68 985 959 A 93 LEU HDy% A 92 ALA HA 1.0 . 5.45 986 960 A 93 LEU HDy% A 93 LEU HA 1.0 . 3.92 987 961 A 114 VAL HGx% A 114 VAL HA 1.0 . 3.48 988 962 A 93 LEU HDy% A 112 CYS HBy 1.0 . 4.32 989 963 A 112 CYS HBx A 93 LEU HDy% 1.0 . 4.11 990 964 A 93 LEU HBy A 93 LEU HDy% 1.0 . 4.07 991 965 A 93 LEU HBx A 93 LEU HDy% 1.0 . 3.33 992 966 A 93 LEU HDy% A 95 VAL HGx% 1.0 . 5.50 993 967 A 36 THR H A 36 THR HG2% 1.0 . 3.13 994 968 A 63 VAL H A 36 THR HG2% 1.0 . 3.96 995 969 A 37 VAL H A 36 THR HG2% 1.0 . 4.48 996 970 A 5 PHE HE% A 36 THR HG2% 1.0 . 5.05 997 971 A 36 THR HG2% A 35 CYS HA 1.0 . 4.54 998 972 A 36 THR HG2% A 95 VAL HA 1.0 . 4.73 999 973 A 36 THR HG2% A 36 THR HA 1.0 . 3.26 1000 974 A 35 CYS HBy A 36 THR HG2% 1.0 . 5.29 1001 975 A 40 PHE HBx A 36 THR HG2% 1.0 . 5.50 1002 976 A 63 VAL HB A 36 THR HG2% 1.0 . 3.57 1003 977 A 63 VAL HGy% A 36 THR HG2% 1.0 . 3.86 1004 978 A 36 THR HG2% A 93 LEU HG 1.0 . 3.63 1005 979 A 109 SER HA A 37 VAL HGx% 1.0 . 5.49 1006 979 A 109 SER HA A 37 VAL HGy% 1.0 . 5.49 1007 980 A 129 TYR H A 128 PRO HA 1.0 . 2.61 1008 981 A 129 TYR HD% A 128 PRO HA 1.0 . 5.09 1009 982 A 128 PRO HA A 129 TYR HA 1.0 . 4.71 1010 983 A 129 TYR HBx A 128 PRO HA 1.0 . 4.78 1011 984 A 143 TYR HE% A 145 PRO HA 1.0 . 3.98 1012 985 A 86 SER HBx A 87 MET HBy 1.0 . 5.22 1013 986 A 86 SER HBx A 87 MET HBx 1.0 . 4.71 1014 987 A 96 GLN H A 36 THR HG2% 1.0 . 5.45 1015 988 A 110 VAL H A 37 VAL HGx% 1.0 . 5.50 1016 988 A 37 VAL HGy% A 110 VAL H 1.0 . 5.50 1017 989 A 96 GLN HE2y A 37 VAL HGx% 1.0 . 5.30 1018 989 A 37 VAL HGy% A 96 GLN HE2y 1.0 . 5.30 1019 990 A 94 GLN HE2x A 37 VAL HGx% 1.0 . 5.50 1020 990 A 37 VAL HGy% A 94 GLN HE2x 1.0 . 5.50 1021 991 A 96 GLN HA A 37 VAL HGx% 1.0 . 4.06 1022 991 A 37 VAL HGy% A 96 GLN HA 1.0 . 4.06 1023 992 A 95 VAL HA A 37 VAL HGx% 1.0 . 3.71 1024 992 A 37 VAL HGy% A 95 VAL HA 1.0 . 3.71 1025 993 A 36 THR HA A 37 VAL HGx% 1.0 . 4.04 1026 993 A 37 VAL HGy% A 36 THR HA 1.0 . 4.04 1027 994 A 109 SER HBy A 37 VAL HGx% 1.0 . 4.04 1028 994 A 109 SER HBy A 37 VAL HGy% 1.0 . 4.04 1029 995 A 109 SER HBx A 37 VAL HGx% 1.0 . 4.18 1030 995 A 37 VAL HGy% A 109 SER HBx 1.0 . 4.18 1031 996 A 96 GLN H A 37 VAL HGx% 1.0 . 3.58 1032 996 A 37 VAL HGy% A 96 GLN H 1.0 . 3.58 1033 997 A 37 VAL H A 37 VAL HGx% 1.0 . 3.23 1034 997 A 37 VAL HGy% A 37 VAL H 1.0 . 3.23 1035 998 A 36 THR HB A 37 VAL HGx% 1.0 . 5.26 1036 998 A 37 VAL HGy% A 36 THR HB 1.0 . 5.26 1037 999 A 37 VAL HA A 37 VAL HGx% 1.0 . 3.00 1038 999 A 37 VAL HGy% A 37 VAL HA 1.0 . 3.00 1039 1000 A 96 GLN HBx A 37 VAL HGx% 1.0 . 2.67 1040 1000 A 37 VAL HGy% A 96 GLN HBx 1.0 . 2.67 1041 1001 A 95 VAL HGy% A 37 VAL HGx% 1.0 . 5.50 1042 1001 A 95 VAL HGy% A 37 VAL HGy% 1.0 . 5.50 1043 1002 A 105 ASP HA A 106 PRO HA 1.0 . 4.70 1044 1003 A 110 VAL HGy% A 106 PRO HA 1.0 . 4.89 1045 1004 A 97 VAL HGx% A 33 ARG H 1.0 . 4.90 1046 1005 A 97 VAL HGx% A 97 VAL H 1.0 . 4.20 1047 1006 A 97 VAL HGx% A 101 GLU H 1.0 . 5.45 1048 1007 A 97 VAL HGx% A 99 GLU H 1.0 . 3.55 1049 1008 A 97 VAL HGx% A 100 TRP HD1 1.0 . 5.50 1050 1009 A 97 VAL HGx% A 100 TRP HZ3 1.0 . 4.87 1051 1010 A 97 VAL HGx% A 100 TRP HA 1.0 . 4.00 1052 1011 A 97 VAL HGx% A 99 GLU HA 1.0 . 4.29 1053 1012 A 97 VAL HGx% A 108 ASP HA 1.0 . 4.71 1054 1013 A 97 VAL HGx% A 97 VAL HA 1.0 . 3.34 1055 1014 A 97 VAL HGx% A 100 TRP HBy 1.0 . 3.83 1056 1015 A 97 VAL HGx% A 100 TRP HBx 1.0 . 3.46 1057 1016 A 97 VAL HGx% A 106 PRO HDy 1.0 . 5.39 1058 1017 A 67 ILE HD1% A 97 VAL HGx% 1.0 . 3.97 1059 1018 A 54 LEU HDy% A 52 TRP H 1.0 . 5.50 1060 1019 A 54 LEU HDy% A 124 TRP HBy 1.0 . 5.23 1061 1020 A 54 LEU H A 54 LEU HDy% 1.0 . 3.92 1062 1021 A 55 TYR H A 54 LEU HDy% 1.0 . 4.31 1063 1022 A 54 LEU HDy% A 117 THR H 1.0 . 4.80 1064 1023 A 43 VAL H A 54 LEU HDy% 1.0 . 4.75 1065 1024 A 54 LEU HDy% A 120 TYR H 1.0 . 5.12 1066 1025 A 54 LEU HDy% A 54 LEU HA 1.0 . 3.32 1067 1026 A 54 LEU HDy% A 52 TRP HBy 1.0 . 3.34 1068 1027 A 54 LEU HDy% A 117 THR HG2% 1.0 . 3.25 1069 1028 A 54 LEU HDy% A 43 VAL HGy% 1.0 . 5.12 1070 1029 A 54 LEU HDy% A 45 ALA HB% 1.0 . 5.50 1071 1030 A 28 ALA HB% A 20 MET H 1.0 . 5.50 1072 1031 A 27 LEU H A 28 ALA HB% 1.0 . 5.50 1073 1032 A 120 TYR HD% A 54 LEU HDy% 1.0 . 3.33 1074 1033 A 54 LEU HDy% A 120 TYR HBx 1.0 . 3.62 1075 1034 A 54 LEU HBx A 54 LEU HDy% 1.0 . 3.03 1076 1035 A 10 LEU HDy% A 18 LYS H 1.0 . 5.17 1077 1036 A 10 LEU HDy% A 17 HIS H 1.0 . 4.72 1078 1037 A 10 LEU HDy% A 10 LEU H 1.0 . 4.61 1079 1038 A 19 VAL H A 10 LEU HDy% 1.0 . 4.31 1080 1039 A 10 LEU HDy% A 17 HIS HA 1.0 . 4.00 1081 1040 A 10 LEU HDy% A 16 ASN HBy 1.0 . 3.71 1082 1041 A 10 LEU HDy% A 17 HIS HD2 1.0 . 4.33 1083 1042 A 16 ASN HA A 10 LEU HDy% 1.0 . 5.00 1084 1043 A 10 LEU HDy% A 20 MET HA 1.0 . 5.48 1085 1044 A 10 LEU HDy% A 20 MET HGy 1.0 . 3.64 1086 1045 A 10 LEU HBy A 10 LEU HDy% 1.0 . 4.13 1087 1046 A 10 LEU HDy% A 19 VAL HGy% 1.0 . 3.24 1088 1047 A 117 THR HG2% A 89 GLN H 1.0 . 5.49 1089 1048 A 117 THR HG2% A 118 ALA H 1.0 . 4.81 1090 1049 A 54 LEU H A 117 THR HG2% 1.0 . 5.50 1091 1050 A 117 THR HG2% A 117 THR H 1.0 . 3.39 1092 1051 A 117 THR HG2% A 88 TYR HA 1.0 . 3.99 1093 1052 A 117 THR HG2% A 52 TRP HA 1.0 . 5.50 1094 1053 A 117 THR HG2% A 54 LEU HA 1.0 . 3.55 1095 1054 A 116 THR HB A 117 THR HG2% 1.0 . 4.98 1096 1055 A 117 THR HG2% A 120 TYR HA 1.0 . 4.54 1097 1056 A 117 THR HG2% A 52 TRP HBy 1.0 . 3.43 1098 1057 A 117 THR HG2% A 120 TYR HBx 1.0 . 3.81 1099 1058 A 54 LEU HBx A 117 THR HG2% 1.0 . 4.72 1100 1059 A 54 LEU HDx% A 117 THR HG2% 1.0 . 5.39 1101 1060 A 29 ALA H A 28 ALA HB% 1.0 . 3.62 1102 1061 A 71 ASP H A 28 ALA HB% 1.0 . 5.30 1103 1062 A 28 ALA H A 28 ALA HB% 1.0 . 3.33 1104 1063 A 28 ALA HB% A 68 TYR HE% 1.0 . 5.10 1105 1064 A 70 VAL HA A 28 ALA HB% 1.0 . 4.17 1106 1065 A 28 ALA HB% A 29 ALA HA 1.0 . 4.88 1107 1066 A 28 ALA HB% A 27 LEU HA 1.0 . 4.51 1108 1067 A 28 ALA HB% A 21 LEU HA 1.0 . 5.20 1109 1068 A 28 ALA HB% A 20 MET HA 1.0 . 4.10 1110 1069 A 28 ALA HB% A 74 MET HGx 1.0 . 3.66 1111 1070 A 74 MET HBy A 28 ALA HB% 1.0 . 4.08 1112 1071 A 28 ALA HB% A 70 VAL HGx% 1.0 . 3.33 1113 1072 A 41 PRO HA A 40 PHE H 1.0 . 5.44 1114 1073 A 41 PRO HA A 129 TYR HBy 1.0 . 4.41 1115 1074 A 131 GLU HGx A 63 VAL HA 1.0 . 4.69 1116 1075 A 85 PRO HA A 86 SER HA 1.0 . 5.18 1117 1076 A 41 PRO HA A 54 LEU HDx% 1.0 . 5.50 1118 1077 A 41 PRO HA A 129 TYR HD% 1.0 . 5.37 1119 1078 A 60 GLY HAx A 41 PRO HA 1.0 . 4.21 1120 1079 A 57 PRO HA A 58 GLY H 1.0 . 2.93 1121 1080 A 39 SER H A 57 PRO HA 1.0 . 4.79 1122 1081 A 57 PRO HA A 59 LYS H 1.0 . 3.66 1123 1082 A 57 PRO HA A 40 PHE HA 1.0 . 4.44 1124 1083 A 36 THR H A 64 THR HG2% 1.0 . 5.02 1125 1084 A 64 THR H A 64 THR HG2% 1.0 . 3.38 1126 1085 A 63 VAL H A 64 THR HG2% 1.0 . 5.50 1127 1086 A 64 THR HA A 64 THR HG2% 1.0 . 3.33 1128 1087 A 63 VAL HA A 64 THR HG2% 1.0 . 4.26 1129 1088 A 132 SER HBy A 64 THR HG2% 1.0 . 4.77 1130 1089 A 132 SER HBx A 64 THR HG2% 1.0 . 5.08 1131 1090 A 62 CYS HBy A 64 THR HG2% 1.0 . 5.47 1132 1091 A 35 CYS HBy A 64 THR HG2% 1.0 . 3.15 1133 1092 A 131 GLU HGx A 64 THR HG2% 1.0 . 4.15 1134 1093 A 35 CYS HBx A 64 THR HG2% 1.0 . 4.46 1135 1094 A 36 THR H A 63 VAL HGy% 1.0 . 4.99 1136 1095 A 64 THR H A 63 VAL HGy% 1.0 . 4.40 1137 1096 A 40 PHE H A 63 VAL HGy% 1.0 . 4.48 1138 1097 A 63 VAL HGy% A 63 VAL H 1.0 . 3.49 1139 1098 A 63 VAL HGy% A 40 PHE HD% 1.0 . 4.98 1140 1099 A 63 VAL HGy% A 63 VAL HA 1.0 . 3.22 1141 1100 A 131 GLU HA A 63 VAL HGy% 1.0 . 3.83 1142 1101 A 39 SER HA A 63 VAL HGy% 1.0 . 5.50 1143 1102 A 61 HIS HBy A 63 VAL HGy% 1.0 . 5.50 1144 1103 A 40 PHE HBy A 63 VAL HGy% 1.0 . 4.62 1145 1104 A 61 HIS HBx A 63 VAL HGy% 1.0 . 4.56 1146 1105 A 42 LEU HBy A 63 VAL HGy% 1.0 . 4.06 1147 1106 A 40 PHE HBx A 63 VAL HGy% 1.0 . 4.42 1148 1107 A 42 LEU HDx% A 63 VAL HGy% 1.0 . 4.14 1149 1108 A 53 LEU HDx% A 63 VAL HGy% 1.0 . 4.52 1150 1109 A 36 THR H A 63 VAL HGx% 1.0 . 5.27 1151 1110 A 64 THR H A 63 VAL HGx% 1.0 . 3.62 1152 1111 A 63 VAL H A 63 VAL HGx% 1.0 . 4.20 1153 1112 A 5 PHE HE% A 63 VAL HGx% 1.0 . 4.46 1154 1113 A 5 PHE HD% A 63 VAL HGx% 1.0 . 5.49 1155 1114 A 5 PHE HZ A 63 VAL HGx% 1.0 . 4.48 1156 1115 A 64 THR HA A 63 VAL HGx% 1.0 . 5.03 1157 1116 A 63 VAL HA A 63 VAL HGx% 1.0 . 3.43 1158 1117 A 132 SER HA A 63 VAL HGx% 1.0 . 3.51 1159 1118 A 131 GLU HA A 63 VAL HGx% 1.0 . 4.52 1160 1119 A 53 LEU HDy% A 63 VAL HGx% 1.0 . 3.79 1161 1120 A 42 LEU HBy A 63 VAL HGx% 1.0 . 5.05 1162 1121 A 53 LEU HDx% A 63 VAL HGx% 1.0 . 4.82 1163 1122 A 20 MET HGy A 21 LEU HDy% 1.0 . 3.80 1164 1123 A 10 LEU H A 6 VAL HGy% 1.0 . 5.01 1165 1124 A 6 VAL HGy% A 6 VAL H 1.0 . 4.07 1166 1125 A 68 TYR HE% A 6 VAL HGy% 1.0 . 4.57 1167 1126 A 7 TYR H A 6 VAL HGy% 1.0 . 4.30 1168 1127 A 6 VAL HGy% A 6 VAL HA 1.0 . 3.59 1169 1128 A 11 LYS HBx A 6 VAL HGy% 1.0 . 3.49 1170 1129 A 10 LEU HBx A 6 VAL HGy% 1.0 . 3.69 1171 1130 A 10 LEU HDy% A 6 VAL HGy% 1.0 . 5.19 1172 1131 A 78 LEU HDy% A 78 LEU H 1.0 . 4.04 1173 1132 A 78 LEU HDy% A 81 PHE H 1.0 . 4.97 1174 1133 A 78 LEU HDy% A 78 LEU HA 1.0 . 3.10 1175 1134 A 78 LEU HDy% A 81 PHE HBy 1.0 . 4.02 1176 1135 A 78 LEU HDy% A 81 PHE HBx 1.0 . 4.55 1177 1136 A 78 LEU HDy% A 78 LEU HBx 1.0 . 3.51 1178 1137 A 64 THR HA A 63 VAL HA 1.0 . 4.92 1179 1138 A 86 SER HBx A 86 SER HA 1.0 . 2.99 1180 1139 A 86 SER HA A 85 PRO HGx 1.0 . 5.09 1181 1140 A 58 GLY HAx A 57 PRO HA 1.0 . 4.96 1182 1141 A 115 TYR H A 116 THR HG2% 1.0 . 5.50 1183 1142 A 89 GLN H A 116 THR HG2% 1.0 . 5.49 1184 1143 A 91 THR H A 116 THR HG2% 1.0 . 5.33 1185 1144 A 116 THR H A 116 THR HG2% 1.0 . 3.78 1186 1145 A 117 THR H A 116 THR HG2% 1.0 . 4.17 1187 1146 A 55 TYR HE% A 116 THR HG2% 1.0 . 5.25 1188 1147 A 116 THR HG2% A 116 THR HA 1.0 . 3.37 1189 1148 A 116 THR HG2% A 115 TYR HA 1.0 . 5.10 1190 1149 A 91 THR HB A 116 THR HG2% 1.0 . 3.93 1191 1150 A 55 TYR HBy A 116 THR HG2% 1.0 . 5.26 1192 1151 A 55 TYR HBx A 116 THR HG2% 1.0 . 4.52 1193 1152 A 114 VAL HB A 116 THR HG2% 1.0 . 3.73 1194 1153 A 53 LEU HBy A 116 THR HG2% 1.0 . 4.01 1195 1154 A 4 ILE H A 70 VAL HGx% 1.0 . 4.78 1196 1155 A 29 ALA H A 70 VAL HGx% 1.0 . 4.02 1197 1156 A 70 VAL H A 70 VAL HGx% 1.0 . 3.95 1198 1157 A 71 ASP H A 70 VAL HGx% 1.0 . 4.05 1199 1158 A 68 TYR HD% A 70 VAL HGx% 1.0 . 5.17 1200 1159 A 70 VAL HA A 70 VAL HGx% 1.0 . 3.25 1201 1160 A 28 ALA HA A 70 VAL HGx% 1.0 . 3.38 1202 1161 A 74 MET HGx A 70 VAL HGx% 1.0 . 3.52 1203 1162 A 68 TYR HBx A 70 VAL HGx% 1.0 . 3.77 1204 1163 A 70 VAL HGx% A 4 ILE HG1y 1.0 . 4.71 1205 1164 A 70 VAL HGx% A 4 ILE HG1x 1.0 . 3.78 1206 1165 A 98 LEU HDy% A 98 LEU H 1.0 . 3.99 1207 1166 A 98 LEU HDy% A 99 GLU H 1.0 . 4.87 1208 1167 A 98 LEU HDy% A 96 GLN HE2y 1.0 . 4.32 1209 1168 A 98 LEU HDy% A 96 GLN HE2x 1.0 . 4.42 1210 1169 A 98 LEU HDy% A 98 LEU HA 1.0 . 2.73 1211 1170 A 98 LEU HDy% A 97 VAL HA 1.0 . 4.80 1212 1171 A 98 LEU HDy% A 35 CYS HBy 1.0 . 3.89 1213 1172 A 98 LEU HDy% A 96 GLN HGy 1.0 . 4.42 1214 1173 A 98 LEU HDy% A 35 CYS HBx 1.0 . 4.58 1215 1174 A 98 LEU HBy A 98 LEU HDy% 1.0 . 2.70 1216 1175 A 20 MET H A 21 LEU HDy% 1.0 . 4.98 1217 1176 A 17 HIS HD2 A 21 LEU HDy% 1.0 . 4.28 1218 1177 A 21 LEU H A 21 LEU HDy% 1.0 . 3.88 1219 1178 A 22 ASP H A 21 LEU HDy% 1.0 . 5.09 1220 1179 A 21 LEU HA A 21 LEU HDy% 1.0 . 2.83 1221 1180 A 18 LYS HA A 21 LEU HDy% 1.0 . 4.43 1222 1181 A 21 LEU HBy A 21 LEU HDy% 1.0 . 3.08 1223 1182 A 96 GLN H A 97 VAL HGy% 1.0 . 5.42 1224 1183 A 97 VAL H A 97 VAL HGy% 1.0 . 3.22 1225 1184 A 100 TRP HE3 A 97 VAL HGy% 1.0 . 4.18 1226 1185 A 109 SER HBx A 97 VAL HGy% 1.0 . 4.72 1227 1186 A 100 TRP HBx A 97 VAL HGy% 1.0 . 5.37 1228 1187 A 106 PRO HDy A 97 VAL HGy% 1.0 . 4.54 1229 1188 A 110 VAL HB A 97 VAL HGy% 1.0 . 4.45 1230 1189 A 77 PHE HA A 80 ASP HBy 1.0 . 4.00 1231 1190 A 76 ARG HBx A 77 PHE HA 1.0 . 5.14 1232 1191 A 115 TYR H A 114 VAL HGy% 1.0 . 3.81 1233 1192 A 91 THR H A 114 VAL HGy% 1.0 . 5.45 1234 1193 A 114 VAL H A 114 VAL HGy% 1.0 . 4.00 1235 1194 A 114 VAL HGy% A 114 VAL HA 1.0 . 3.50 1236 1195 A 5 PHE HBx A 114 VAL HGy% 1.0 . 4.61 1237 1196 A 112 CYS HBx A 114 VAL HGy% 1.0 . 5.01 1238 1197 A 93 LEU HBx A 114 VAL HGy% 1.0 . 4.29 1239 1198 A 53 LEU HDx% A 114 VAL HGy% 1.0 . 3.64 1240 1199 A 5 PHE H A 114 VAL HGy% 1.0 . 5.39 1241 1200 A 127 LEU HDy% A 127 LEU H 1.0 . 3.99 1242 1201 A 127 LEU HDy% A 124 TRP HA 1.0 . 3.71 1243 1202 A 127 LEU HDy% A 127 LEU HA 1.0 . 2.90 1244 1203 A 128 PRO HDy A 127 LEU HDy% 1.0 . 3.74 1245 1204 A 128 PRO HDx A 127 LEU HDy% 1.0 . 3.77 1246 1205 A 127 LEU HDy% A 126 PHE HBx 1.0 . 5.50 1247 1206 A 127 LEU HBy A 127 LEU HDy% 1.0 . 3.44 1248 1207 A 127 LEU HBx A 127 LEU HDy% 1.0 . 3.39 1249 1208 A 127 LEU HDy% A 45 ALA HB% 1.0 . 4.80 1250 1209 A 28 ALA H A 70 VAL HGx% 1.0 . 5.20 1251 1210 A 110 VAL H A 97 VAL HGy% 1.0 . 3.74 1252 1211 A 109 SER HA A 97 VAL HGy% 1.0 . 3.35 1253 1212 A 108 ASP HA A 97 VAL HGy% 1.0 . 3.75 1254 1213 A 97 VAL HA A 97 VAL HGy% 1.0 . 3.23 1255 1214 A 106 PRO HGy A 97 VAL HGy% 1.0 . 3.77 1256 1215 A 62 CYS HA A 63 VAL HGx% 1.0 . 5.41 1257 1216 A 62 CYS HA A 36 THR HG2% 1.0 . 5.24 1258 1217 A 76 ARG H A 77 PHE HA 1.0 . 5.21 1259 1218 A 135 SER HA A 137 GLY H 1.0 . 5.39 1260 1219 A 136 GLU HA A 135 SER HA 1.0 . 5.30 1261 1220 A 124 TRP HE1 A 45 ALA HB% 1.0 . 4.21 1262 1221 A 52 TRP H A 45 ALA HB% 1.0 . 5.44 1263 1222 A 45 ALA H A 45 ALA HB% 1.0 . 3.58 1264 1223 A 45 ALA HB% A 52 TRP HE1 1.0 . 3.72 1265 1224 A 46 GLY H A 45 ALA HB% 1.0 . 3.31 1266 1225 A 44 ILE HA A 45 ALA HB% 1.0 . 4.63 1267 1226 A 45 ALA HB% A 46 GLY HAy 1.0 . 4.92 1268 1227 A 124 TRP HBy A 45 ALA HB% 1.0 . 5.37 1269 1228 A 124 TRP HBx A 45 ALA HB% 1.0 . 4.64 1270 1229 A 52 TRP HBy A 45 ALA HB% 1.0 . 5.15 1271 1230 A 43 VAL HB A 45 ALA HB% 1.0 . 4.42 1272 1231 A 127 LEU HG A 45 ALA HB% 1.0 . 5.50 1273 1232 A 127 LEU HDx% A 45 ALA HB% 1.0 . 3.24 1274 1233 A 62 CYS HA A 36 THR HB 1.0 . 4.36 1275 1234 A 62 CYS HA A 63 VAL HGy% 1.0 . 4.93 1276 1235 A 131 GLU HGx A 62 CYS HA 1.0 . 4.77 1277 1236 A 80 ASP H A 81 PHE HA 1.0 . 5.10 1278 1237 A 81 PHE HD% A 81 PHE HA 1.0 . 3.74 1279 1238 A 118 ALA H A 119 THR HG2% 1.0 . 4.44 1280 1239 A 119 THR HG2% A 119 THR H 1.0 . 3.72 1281 1240 A 89 GLN HE2y A 119 THR HG2% 1.0 . 4.36 1282 1241 A 119 THR HG2% A 89 GLN HE2x 1.0 . 3.95 1283 1242 A 119 THR HG2% A 117 THR HA 1.0 . 5.29 1284 1243 A 119 THR HG2% A 118 ALA HA 1.0 . 5.50 1285 1244 A 120 TYR HA A 119 THR HG2% 1.0 . 5.50 1286 1245 A 119 THR HG2% A 89 GLN HGx 1.0 . 5.50 1287 1246 A 119 THR HG2% A 118 ALA HB% 1.0 . 3.99 1288 1247 A 96 GLN H A 95 VAL HA 1.0 . 3.02 1289 1248 A 94 GLN HA A 95 VAL HA 1.0 . 4.88 1290 1249 A 130 HIS H A 43 VAL HGy% 1.0 . 4.91 1291 1250 A 43 VAL HGy% A 44 ILE H 1.0 . 4.23 1292 1251 A 43 VAL H A 43 VAL HGy% 1.0 . 3.92 1293 1252 A 43 VAL HGy% A 42 LEU H 1.0 . 5.50 1294 1253 A 43 VAL HGy% A 130 HIS HD2 1.0 . 5.41 1295 1254 A 43 VAL HGy% A 127 LEU H 1.0 . 4.40 1296 1255 A 43 VAL HGy% A 129 TYR HA 1.0 . 4.14 1297 1256 A 43 VAL HGy% A 43 VAL HA 1.0 . 3.37 1298 1257 A 41 PRO HA A 43 VAL HGy% 1.0 . 5.50 1299 1258 A 129 TYR HBy A 43 VAL HGy% 1.0 . 5.36 1300 1259 A 124 TRP HBy A 43 VAL HGy% 1.0 . 5.50 1301 1260 A 124 TRP HBx A 43 VAL HGy% 1.0 . 5.02 1302 1261 A 127 LEU HBy A 43 VAL HGy% 1.0 . 3.64 1303 1262 A 127 LEU HBx A 43 VAL HGy% 1.0 . 3.93 1304 1263 A 43 VAL HGy% A 45 ALA HB% 1.0 . 5.13 1305 1264 A 129 TYR HBx A 43 VAL HGy% 1.0 . 4.90 1306 1265 A 113 PHE HD% A 91 THR HG2% 1.0 . 5.41 1307 1266 A 95 VAL H A 95 VAL HGx% 1.0 . 4.17 1308 1267 A 95 VAL HGx% A 37 VAL H 1.0 . 5.38 1309 1268 A 95 VAL HGx% A 35 CYS HA 1.0 . 4.72 1310 1269 A 34 GLY HAx A 95 VAL HGx% 1.0 . 3.81 1311 1270 A 5 PHE HBx A 95 VAL HGx% 1.0 . 4.46 1312 1271 A 95 VAL HGx% A 67 ILE HG1y 1.0 . 4.37 1313 1272 A 95 VAL HGx% A 37 VAL HGx% 1.0 . 4.35 1314 1272 A 37 VAL HGy% A 95 VAL HGx% 1.0 . 4.35 1315 1273 A 95 VAL HGx% A 5 PHE HA 1.0 . 5.26 1316 1274 A 98 LEU HDy% A 64 THR HA 1.0 . 5.50 1317 1275 A 44 ILE HA A 52 TRP HD1 1.0 . 4.63 1318 1276 A 44 ILE HA A 44 ILE HG1x 1.0 . 4.18 1319 1277 A 44 ILE HA A 51 PRO HA 1.0 . 3.49 1320 1278 A 29 ALA HB% A 31 ARG HE 1.0 . 5.50 1321 1279 A 27 LEU HDy% A 29 ALA HB% 1.0 . 5.50 1322 1280 A 29 ALA H A 29 ALA HB% 1.0 . 3.13 1323 1281 A 29 ALA HB% A 30 PHE H 1.0 . 3.68 1324 1282 A 28 ALA H A 29 ALA HB% 1.0 . 5.25 1325 1283 A 28 ALA HA A 29 ALA HB% 1.0 . 4.36 1326 1284 A 30 PHE HBy A 29 ALA HB% 1.0 . 5.27 1327 1285 A 29 ALA HB% A 30 PHE HBx 1.0 . 4.84 1328 1286 A 29 ALA HB% A 69 GLU HBy 1.0 . 3.56 1329 1287 A 29 ALA HB% A 27 LEU HDx% 1.0 . 4.63 1330 1288 A 92 ALA H A 91 THR HG2% 1.0 . 3.51 1331 1289 A 91 THR HA A 91 THR HG2% 1.0 . 3.14 1332 1290 A 93 LEU HBx A 91 THR HG2% 1.0 . 3.96 1333 1291 A 91 THR HG2% A 92 ALA HB% 1.0 . 3.71 1334 1292 A 96 GLN H A 95 VAL HGx% 1.0 . 3.47 1335 1293 A 35 CYS H A 95 VAL HGx% 1.0 . 3.33 1336 1294 A 97 VAL H A 95 VAL HGx% 1.0 . 5.50 1337 1295 A 96 GLN HA A 95 VAL HGx% 1.0 . 4.85 1338 1296 A 95 VAL HGx% A 95 VAL HA 1.0 . 3.52 1339 1297 A 34 GLY HAy A 95 VAL HGx% 1.0 . 3.46 1340 1298 A 95 VAL HGx% A 96 GLN HBy 1.0 . 5.11 1341 1299 A 95 VAL HGx% A 36 THR HG2% 1.0 . 4.09 1342 1300 A 95 VAL HGy% A 96 GLN H 1.0 . 4.17 1343 1301 A 95 VAL HGy% A 112 CYS H 1.0 . 3.99 1344 1302 A 95 VAL HGy% A 95 VAL H 1.0 . 3.62 1345 1303 A 95 VAL HGy% A 37 VAL H 1.0 . 4.74 1346 1304 A 5 PHE HZ A 95 VAL HGy% 1.0 . 5.36 1347 1305 A 95 VAL HGy% A 94 GLN HA 1.0 . 4.62 1348 1306 A 95 VAL HGy% A 95 VAL HA 1.0 . 3.37 1349 1307 A 95 VAL HGy% A 36 THR HA 1.0 . 4.06 1350 1308 A 95 VAL HGy% A 5 PHE HBx 1.0 . 3.48 1351 1309 A 95 VAL HGy% A 112 CYS HBy 1.0 . 4.19 1352 1310 A 95 VAL HGy% A 112 CYS HBx 1.0 . 3.62 1353 1311 A 95 VAL HGy% A 36 THR HG2% 1.0 . 3.88 1354 1312 A 95 VAL HGy% A 93 LEU HDx% 1.0 . 4.66 1355 1313 A 95 VAL HGy% A 93 LEU HG 1.0 . 3.67 1356 1314 A 5 PHE HE% A 64 THR HA 1.0 . 4.59 1357 1315 A 16 ASN HA A 19 VAL HGx% 1.0 . 4.89 1358 1316 A 24 SER HBx A 24 SER HA 1.0 . 2.84 1359 1317 A 19 VAL H A 19 VAL HGx% 1.0 . 3.28 1360 1318 A 19 VAL HGx% A 77 PHE HE% 1.0 . 3.74 1361 1319 A 19 VAL HA A 19 VAL HGx% 1.0 . 3.24 1362 1320 A 16 ASN HBy A 19 VAL HGx% 1.0 . 5.42 1363 1321 A 44 ILE HG1x A 51 PRO HA 1.0 . 4.61 1364 1322 A 115 TYR H A 114 VAL HA 1.0 . 3.48 1365 1323 A 110 VAL H A 110 VAL HGy% 1.0 . 3.90 1366 1324 A 100 TRP HZ3 A 110 VAL HGy% 1.0 . 4.28 1367 1325 A 110 VAL HGy% A 110 VAL HA 1.0 . 3.15 1368 1326 A 18 LYS HDx A 19 VAL HGx% 1.0 . 3.97 1369 1327 A 9 THR HG2% A 143 TYR HD% 1.0 . 4.48 1370 1328 A 9 THR HG2% A 16 ASN HD2x 1.0 . 4.35 1371 1329 A 9 THR HG2% A 143 TYR HBy 1.0 . 4.54 1372 1330 A 43 VAL H A 51 PRO HA 1.0 . 4.71 1373 1331 A 91 THR HA A 92 ALA H 1.0 . 2.83 1374 1332 A 91 THR HA A 92 ALA HB% 1.0 . 4.14 1375 1333 A 5 PHE H A 114 VAL HA 1.0 . 4.51 1376 1334 A 95 VAL H A 110 VAL HGy% 1.0 . 5.32 1377 1335 A 109 SER HA A 110 VAL HGy% 1.0 . 5.35 1378 1336 A 9 THR HG2% A 15 PRO HGx 1.0 . 5.50 1379 1337 A 9 THR HG2% A 16 ASN H 1.0 . 4.83 1380 1338 A 9 THR HG2% A 16 ASN HD2y 1.0 . 4.73 1381 1339 A 9 THR HG2% A 9 THR H 1.0 . 3.78 1382 1340 A 109 SER H A 110 VAL HGx% 1.0 . 5.50 1383 1341 A 110 VAL HGx% A 109 SER HBx 1.0 . 5.47 1384 1342 A 110 VAL HGx% A 3 HIS HBx 1.0 . 5.30 1385 1343 A 67 ILE HA A 5 PHE HA 1.0 . 3.74 1386 1344 A 110 VAL HGx% A 67 ILE HA 1.0 . 5.50 1387 1345 A 67 ILE HA A 6 VAL H 1.0 . 4.41 1388 1346 A 67 ILE HA A 67 ILE HG1x 1.0 . 3.95 1389 1347 A 19 VAL H A 17 HIS HA 1.0 . 4.36 1390 1348 A 17 HIS HA A 17 HIS HD2 1.0 . 5.22 1391 1349 A 2 ALA HB% A 3 HIS H 1.0 . 3.56 1392 1350 A 3 HIS HA A 2 ALA HB% 1.0 . 5.05 1393 1351 A 4 ILE HA A 2 ALA HB% 1.0 . 5.50 1394 1352 A 72 GLU HA A 2 ALA HB% 1.0 . 4.94 1395 1353 A 4 ILE HG2% A 2 ALA HB% 1.0 . 4.71 1396 1354 A 2 ALA HB% A 70 VAL HGy% 1.0 . 3.43 1397 1355 A 70 VAL H A 2 ALA HB% 1.0 . 5.11 1398 1356 A 71 ASP HA A 2 ALA HB% 1.0 . 5.50 1399 1357 A 72 GLU HGx A 2 ALA HB% 1.0 . 5.32 1400 1358 A 110 VAL H A 110 VAL HGx% 1.0 . 3.29 1401 1359 A 110 VAL HGx% A 95 VAL H 1.0 . 4.52 1402 1360 A 110 VAL HGx% A 111 GLN H 1.0 . 4.17 1403 1361 A 100 TRP HZ3 A 110 VAL HGx% 1.0 . 3.89 1404 1362 A 109 SER HA A 110 VAL HGx% 1.0 . 4.25 1405 1363 A 110 VAL HGx% A 110 VAL HA 1.0 . 3.54 1406 1364 A 110 VAL HGx% A 67 ILE HG2% 1.0 . 4.09 1407 1365 A 67 ILE HD1% A 110 VAL HGx% 1.0 . 3.54 1408 1366 A 95 VAL HGy% A 110 VAL HGx% 1.0 . 4.20 1409 1367 A 110 VAL HGx% A 97 VAL H 1.0 . 5.29 1410 1368 A 19 VAL H A 19 VAL HGy% 1.0 . 3.11 1411 1369 A 19 VAL HGy% A 77 PHE HE% 1.0 . 3.74 1412 1370 A 17 HIS HA A 19 VAL HGy% 1.0 . 3.51 1413 1371 A 18 LYS HA A 19 VAL HGy% 1.0 . 5.36 1414 1372 A 16 ASN HBy A 19 VAL HGy% 1.0 . 4.17 1415 1373 A 20 MET HGy A 19 VAL HGy% 1.0 . 4.19 1416 1374 A 118 ALA H A 117 THR HA 1.0 . 2.95 1417 1375 A 89 GLN HE2y A 117 THR HA 1.0 . 4.83 1418 1376 A 88 TYR HA A 117 THR HA 1.0 . 3.99 1419 1377 A 117 THR HG2% A 117 THR HA 1.0 . 4.14 1420 1378 A 89 GLN HE2x A 117 THR HA 1.0 . 4.96 1421 1379 A 53 LEU HBy A 116 THR HA 1.0 . 3.79 1422 1380 A 117 THR HG2% A 116 THR HA 1.0 . 4.83 1423 1381 A 54 LEU HDy% A 116 THR HA 1.0 . 5.50 1424 1382 A 53 LEU HDx% A 116 THR HA 1.0 . 4.28 1425 1383 A 89 GLN H A 116 THR HA 1.0 . 4.80 1426 1384 A 67 ILE HD1% A 67 ILE HA 1.0 . 4.79 1427 1385 A 120 TYR HD% A 119 THR HA 1.0 . 4.63 1428 1386 A 120 TYR H A 119 THR HA 1.0 . 3.14 1429 1387 A 118 ALA HA A 119 THR HA 1.0 . 5.07 1430 1388 A 119 THR HB A 119 THR HA 1.0 . 2.85 1431 1389 A 119 THR HG2% A 119 THR HA 1.0 . 3.27 1432 1390 A 120 TYR HA A 119 THR HA 1.0 . 5.22 1433 1391 A 17 HIS HA A 19 VAL HGx% 1.0 . 5.50 1434 1392 A 17 HIS HA A 10 LEU HA 1.0 . 3.43 1435 1393 A 17 HIS HA A 20 MET HBx 1.0 . 5.03 1436 1394 A 10 LEU HBx A 17 HIS HA 1.0 . 4.93 1437 1395 A 75 LEU H A 2 ALA HB% 1.0 . 5.50 1438 1396 A 118 ALA H A 118 ALA HB% 1.0 . 3.10 1439 1397 A 55 TYR H A 118 ALA HB% 1.0 . 4.59 1440 1398 A 119 THR H A 118 ALA HB% 1.0 . 3.84 1441 1399 A 89 GLN HE2y A 118 ALA HB% 1.0 . 5.50 1442 1400 A 55 TYR HD% A 118 ALA HB% 1.0 . 4.25 1443 1401 A 89 GLN HE2x A 118 ALA HB% 1.0 . 5.23 1444 1402 A 117 THR HA A 118 ALA HB% 1.0 . 4.13 1445 1403 A 119 THR HB A 118 ALA HB% 1.0 . 5.36 1446 1404 A 118 ALA HB% A 119 THR HA 1.0 . 4.57 1447 1405 A 55 TYR HBy A 118 ALA HB% 1.0 . 3.61 1448 1406 A 55 TYR HBx A 118 ALA HB% 1.0 . 4.13 1449 1407 A 118 ALA HB% A 89 GLN HGy 1.0 . 5.50 1450 1408 A 6 VAL HGx% A 12 ARG H 1.0 . 5.50 1451 1409 A 29 ALA HA A 30 PHE HA 1.0 . 5.00 1452 1410 A 31 ARG H A 30 PHE HA 1.0 . 3.20 1453 1411 A 30 PHE HA A 68 TYR HA 1.0 . 3.89 1454 1412 A 69 GLU H A 30 PHE HA 1.0 . 4.74 1455 1413 A 32 GLY H A 30 PHE HA 1.0 . 4.52 1456 1414 A 29 ALA HB% A 30 PHE HA 1.0 . 5.18 1457 1415 A 31 ARG HBy A 30 PHE HA 1.0 . 5.08 1458 1416 A 6 VAL HGx% A 6 VAL H 1.0 . 3.39 1459 1417 A 6 VAL HGx% A 66 GLU H 1.0 . 4.18 1460 1418 A 6 VAL HGx% A 10 LEU H 1.0 . 5.50 1461 1419 A 6 VAL HGx% A 68 TYR HD% 1.0 . 3.53 1462 1420 A 6 VAL HGx% A 5 PHE HA 1.0 . 4.53 1463 1421 A 6 VAL HGx% A 67 ILE HA 1.0 . 5.05 1464 1422 A 6 VAL HGx% A 6 VAL HA 1.0 . 4.12 1465 1423 A 6 VAL HGx% A 11 LYS HA 1.0 . 4.07 1466 1424 A 11 LYS HGy A 6 VAL HGx% 1.0 . 4.11 1467 1425 A 6 VAL HGx% A 10 LEU HDy% 1.0 . 5.50 1468 1426 A 75 LEU H A 72 GLU HA 1.0 . 3.77 1469 1427 A 76 ARG H A 72 GLU HA 1.0 . 4.27 1470 1428 A 71 ASP HA A 72 GLU HA 1.0 . 4.58 1471 1429 A 72 GLU HA A 72 GLU HBx 1.0 . 2.87 1472 1430 A 75 LEU HBy A 72 GLU HA 1.0 . 3.50 1473 1431 A 75 LEU HBx A 72 GLU HA 1.0 . 3.45 1474 1432 A 72 GLU HA A 75 LEU HDy% 1.0 . 4.16 1475 1433 A 109 SER HBx A 110 VAL HA 1.0 . 4.85 1476 1434 A 76 ARG HDx A 73 GLN HA 1.0 . 4.64 1477 1435 A 73 GLN HGx A 73 GLN HA 1.0 . 3.29 1478 1436 A 73 GLN HBx A 73 GLN HA 1.0 . 2.95 1479 1437 A 92 ALA H A 92 ALA HB% 1.0 . 2.99 1480 1438 A 90 ARG HDy A 92 ALA HB% 1.0 . 5.50 1481 1439 A 111 GLN H A 110 VAL HA 1.0 . 2.73 1482 1440 A 109 SER HA A 110 VAL HA 1.0 . 4.99 1483 1441 A 110 VAL HA A 111 GLN HBx 1.0 . 4.48 1484 1441 A 111 GLN HBy A 110 VAL HA 1.0 . 4.48 1485 1442 A 143 TYR HE% A 50 ILE HA 1.0 . 4.90 1486 1443 A 50 ILE HG1y A 50 ILE HA 1.0 . 4.19 1487 1444 A 50 ILE HG1x A 50 ILE HA 1.0 . 4.09 1488 1445 A 44 ILE HG2% A 50 ILE HA 1.0 . 4.85 1489 1446 A 76 ARG H A 73 GLN HA 1.0 . 3.93 1490 1447 A 76 ARG HBy A 73 GLN HA 1.0 . 3.44 1491 1448 A 76 ARG HGy A 73 GLN HA 1.0 . 4.62 1492 1449 A 92 ALA HB% A 93 LEU H 1.0 . 3.43 1493 1450 A 92 ALA HB% A 112 CYS H 1.0 . 4.96 1494 1451 A 92 ALA HB% A 91 THR HB 1.0 . 5.09 1495 1452 A 92 ALA HB% A 111 GLN HGx 1.0 . 3.40 1496 1453 A 93 LEU HBx A 92 ALA HB% 1.0 . 5.23 1497 1454 A 115 TYR HA A 90 ARG HA 1.0 . 3.86 1498 1455 A 68 TYR HD% A 6 VAL HA 1.0 . 4.77 1499 1456 A 76 ARG HA A 80 ASP H 1.0 . 5.24 1500 1457 A 76 ARG HA A 79 ASP HBx 1.0 . 4.22 1501 1458 A 76 ARG HA A 76 ARG HDx 1.0 . 4.34 1502 1459 A 76 ARG HA A 79 ASP HBy 1.0 . 3.77 1503 1460 A 75 LEU H A 70 VAL HGy% 1.0 . 4.27 1504 1461 A 113 PHE HD% A 75 LEU HG 1.0 . 5.39 1505 1462 A 70 VAL HA A 70 VAL HGy% 1.0 . 3.90 1506 1463 A 74 MET HGx A 70 VAL HGy% 1.0 . 4.83 1507 1464 A 70 VAL H A 70 VAL HGy% 1.0 . 3.26 1508 1465 A 71 ASP H A 70 VAL HGy% 1.0 . 4.23 1509 1466 A 3 HIS HA A 70 VAL HGy% 1.0 . 4.72 1510 1467 A 28 ALA HA A 70 VAL HGy% 1.0 . 5.50 1511 1468 A 75 LEU HA A 75 LEU HG 1.0 . 3.92 1512 1469 A 4 ILE HG1x A 70 VAL HGy% 1.0 . 4.57 1513 1470 A 143 TYR HA A 49 ASN HBx 1.0 . 4.71 1514 1471 A 7 TYR H A 6 VAL HA 1.0 . 3.51 1515 1472 A 10 LEU HDx% A 6 VAL HA 1.0 . 5.50 1516 1473 A 123 GLU HBx A 123 GLU HA 1.0 . 2.87 1517 1474 A 125 LEU H A 123 GLU HA 1.0 . 3.81 1518 1475 A 76 ARG HA A 78 LEU H 1.0 . 5.26 1519 1476 A 143 TYR HA A 144 ASN HA 1.0 . 4.60 1520 1477 A 142 ARG HA A 143 TYR HA 1.0 . 4.31 1521 1478 A 143 TYR HA A 49 ASN HBy 1.0 . 3.86 1522 1479 A 125 LEU HBy A 123 GLU HA 1.0 . 5.14 1523 1480 A 126 PHE HBx A 123 GLU HA 1.0 . 4.96 1524 1481 A 123 GLU HA A 122 PRO HBx 1.0 . 5.38 1525 1482 A 49 ASN H A 47 GLU HA 1.0 . 4.32 1526 1483 A 43 VAL HGx% A 52 TRP H 1.0 . 4.13 1527 1484 A 43 VAL HGx% A 44 ILE H 1.0 . 4.24 1528 1485 A 43 VAL H A 43 VAL HGx% 1.0 . 3.20 1529 1486 A 43 VAL HGx% A 127 LEU H 1.0 . 5.49 1530 1487 A 43 VAL HGx% A 52 TRP HD1 1.0 . 3.63 1531 1488 A 43 VAL HGx% A 43 VAL HA 1.0 . 3.95 1532 1489 A 43 VAL HGx% A 124 TRP HZ3 1.0 . 5.50 1533 1490 A 43 VAL HGx% A 124 TRP HA 1.0 . 4.84 1534 1491 A 124 TRP HBy A 43 VAL HGx% 1.0 . 4.10 1535 1492 A 43 VAL HGx% A 124 TRP HBx 1.0 . 3.54 1536 1493 A 54 LEU HDy% A 43 VAL HGx% 1.0 . 4.39 1537 1494 A 43 VAL HGx% A 45 ALA HB% 1.0 . 3.60 1538 1495 A 143 TYR HA A 143 TYR HE% 1.0 . 5.50 1539 1496 A 48 HIS HA A 47 GLU HA 1.0 . 4.45 1540 1497 A 46 GLY HAx A 47 GLU HA 1.0 . 4.70 1541 1498 A 47 GLU HA A 47 GLU HBy 1.0 . 2.95 1542 1499 A 18 LYS HA A 17 HIS HD2 1.0 . 4.93 1543 1500 A 21 LEU H A 18 LYS HA 1.0 . 3.89 1544 1501 A 18 LYS HA A 18 LYS HBx 1.0 . 2.79 1545 1502 A 18 LYS HA A 21 LEU HBx 1.0 . 3.56 1546 1503 A 18 LYS HA A 18 LYS HGy 1.0 . 4.01 1547 1503 A 18 LYS HA A 18 LYS HGx 1.0 . 4.01 1548 1504 A 18 LYS HA A 21 LEU HG 1.0 . 3.70 1549 1505 A 113 PHE HA A 91 THR H 1.0 . 4.74 1550 1506 A 113 PHE HA A 114 VAL HGy% 1.0 . 4.58 1551 1507 A 90 ARG HGx A 113 PHE HA 1.0 . 5.28 1552 1508 A 4 ILE HA A 113 PHE H 1.0 . 2.90 1553 1509 A 4 ILE HA A 3 HIS HA 1.0 . 5.26 1554 1510 A 55 TYR HA A 116 THR HG2% 1.0 . 5.28 1555 1511 A 12 ARG HA A 11 LYS HA 1.0 . 4.93 1556 1512 A 13 GLY HAy A 12 ARG HA 1.0 . 4.67 1557 1513 A 12 ARG HA A 12 ARG HGx 1.0 . 4.14 1558 1514 A 4 ILE HA A 112 CYS HA 1.0 . 4.46 1559 1515 A 78 LEU H A 75 LEU HA 1.0 . 4.11 1560 1516 A 79 ASP H A 75 LEU HA 1.0 . 4.59 1561 1517 A 74 MET HGx A 75 LEU HA 1.0 . 5.34 1562 1518 A 78 LEU HBy A 75 LEU HA 1.0 . 3.77 1563 1519 A 78 LEU HBx A 75 LEU HA 1.0 . 4.85 1564 1520 A 78 LEU HDx% A 75 LEU HA 1.0 . 3.96 1565 1521 A 129 TYR HD% A 43 VAL HA 1.0 . 5.42 1566 1522 A 43 VAL HA A 129 TYR HA 1.0 . 4.75 1567 1523 A 131 GLU HA A 64 THR HG2% 1.0 . 5.50 1568 1524 A 131 GLU HA A 63 VAL HA 1.0 . 3.73 1569 1525 A 61 HIS HBx A 131 GLU HA 1.0 . 3.77 1570 1526 A 131 GLU HGx A 131 GLU HA 1.0 . 3.60 1571 1527 A 133 TYR HA A 44 ILE HD1% 1.0 . 5.47 1572 1528 A 133 TYR HD% A 133 TYR HA 1.0 . 3.98 1573 1529 A 74 MET HE% A 77 PHE HBy 1.0 . 5.41 1574 1530 A 75 LEU HA A 4 ILE HG2% 1.0 . 5.20 1575 1531 A 4 ILE H A 67 ILE HG2% 1.0 . 4.45 1576 1532 A 67 ILE HG2% A 68 TYR H 1.0 . 3.47 1577 1533 A 67 ILE HG2% A 67 ILE H 1.0 . 4.36 1578 1534 A 31 ARG H A 67 ILE HG2% 1.0 . 5.12 1579 1535 A 5 PHE HD% A 67 ILE HG2% 1.0 . 5.50 1580 1536 A 68 TYR HD% A 67 ILE HG2% 1.0 . 5.50 1581 1537 A 100 TRP HZ3 A 67 ILE HG2% 1.0 . 3.54 1582 1538 A 32 GLY H A 67 ILE HG2% 1.0 . 5.39 1583 1539 A 67 ILE HG2% A 67 ILE HA 1.0 . 3.43 1584 1540 A 3 HIS HBx A 67 ILE HG2% 1.0 . 3.76 1585 1541 A 5 PHE HBx A 67 ILE HG2% 1.0 . 5.50 1586 1542 A 67 ILE HG2% A 67 ILE HG1y 1.0 . 4.02 1587 1543 A 110 VAL HGy% A 67 ILE HG2% 1.0 . 4.24 1588 1544 A 31 ARG HBx A 67 ILE HG2% 1.0 . 4.25 1589 1545 A 70 VAL HA A 29 ALA H 1.0 . 4.18 1590 1546 A 28 ALA H A 70 VAL HA 1.0 . 5.14 1591 1547 A 70 VAL HA A 74 MET HGx 1.0 . 5.48 1592 1548 A 71 ASP H A 70 VAL HA 1.0 . 3.08 1593 1549 A 78 LEU HA A 81 PHE H 1.0 . 4.27 1594 1550 A 78 LEU HA A 77 PHE HE% 1.0 . 5.36 1595 1551 A 78 LEU HA A 81 PHE HBx 1.0 . 3.79 1596 1552 A 78 LEU HA A 82 GLU H 1.0 . 4.80 1597 1553 A 87 MET H A 87 MET HE% 1.0 . 5.39 1598 1554 A 88 TYR HD% A 87 MET HE% 1.0 . 4.91 1599 1555 A 87 MET HE% A 52 TRP HH2 1.0 . 3.89 1600 1556 A 87 MET HE% A 88 TYR HE% 1.0 . 3.80 1601 1557 A 87 MET HE% A 52 TRP HZ3 1.0 . 4.98 1602 1558 A 87 MET HE% A 88 TYR HA 1.0 . 5.50 1603 1559 A 87 MET HE% A 87 MET HA 1.0 . 4.38 1604 1560 A 87 MET HE% A 82 GLU HA 1.0 . 4.94 1605 1561 A 83 ASP HBy A 87 MET HE% 1.0 . 4.56 1606 1562 A 87 MET HGy A 87 MET HE% 1.0 . 4.11 1607 1563 A 87 MET HE% A 87 MET HBy 1.0 . 3.77 1608 1564 A 83 ASP HBx A 87 MET HE% 1.0 . 3.72 1609 1565 A 87 MET HE% A 50 ILE HD1% 1.0 . 3.59 1610 1566 A 87 MET HE% A 50 ILE HG2% 1.0 . 4.08 1611 1567 A 71 ASP H A 74 MET HE% 1.0 . 5.09 1612 1568 A 74 MET HE% A 25 HIS H 1.0 . 4.57 1613 1569 A 74 MET HE% A 26 GLY H 1.0 . 3.89 1614 1570 A 74 MET HE% A 77 PHE HE% 1.0 . 5.27 1615 1571 A 70 VAL HA A 74 MET HE% 1.0 . 5.35 1616 1572 A 74 MET HE% A 28 ALA HA 1.0 . 4.73 1617 1573 A 74 MET HE% A 26 GLY HAy 1.0 . 4.81 1618 1574 A 74 MET HE% A 20 MET HBx 1.0 . 3.88 1619 1575 A 74 MET HE% A 78 LEU H 1.0 . 5.33 1620 1576 A 27 LEU H A 74 MET HE% 1.0 . 4.07 1621 1577 A 74 MET HE% A 74 MET H 1.0 . 4.29 1622 1578 A 74 MET HE% A 75 LEU H 1.0 . 5.12 1623 1579 A 74 MET HE% A 20 MET H 1.0 . 4.55 1624 1580 A 74 MET HE% A 26 GLY HAx 1.0 . 3.72 1625 1581 A 74 MET HE% A 20 MET HA 1.0 . 3.00 1626 1582 A 74 MET HE% A 25 HIS HBy 1.0 . 3.38 1627 1583 A 74 MET HE% A 74 MET HGx 1.0 . 3.39 1628 1584 A 74 MET HE% A 25 HIS HBx 1.0 . 3.58 1629 1585 A 74 MET HE% A 74 MET HBy 1.0 . 3.23 1630 1586 A 74 MET HE% A 74 MET HBx 1.0 . 3.34 1631 1587 A 74 MET HE% A 20 MET HBy 1.0 . 3.57 1632 1588 A 74 MET HE% A 28 ALA HB% 1.0 . 3.14 1633 1589 A 74 MET HE% A 70 VAL HGx% 1.0 . 4.36 1634 1590 A 74 MET HE% A 78 LEU HDx% 1.0 . 4.52 1635 1591 A 74 MET HE% A 78 LEU HDy% 1.0 . 3.72 1636 1592 A 4 ILE H A 4 ILE HG2% 1.0 . 3.61 1637 1593 A 4 ILE HG2% A 3 HIS H 1.0 . 4.44 1638 1594 A 113 PHE H A 4 ILE HG2% 1.0 . 3.70 1639 1595 A 4 ILE HG2% A 113 PHE HE% 1.0 . 5.50 1640 1596 A 3 HIS HA A 4 ILE HG2% 1.0 . 4.40 1641 1597 A 4 ILE HA A 4 ILE HG2% 1.0 . 3.41 1642 1598 A 113 PHE HBy A 4 ILE HG2% 1.0 . 3.54 1643 1599 A 113 PHE HBx A 4 ILE HG2% 1.0 . 3.46 1644 1600 A 4 ILE HG1y A 4 ILE HG2% 1.0 . 3.97 1645 1601 A 4 ILE HG1x A 4 ILE HG2% 1.0 . 3.42 1646 1602 A 4 ILE HG2% A 4 ILE HD1% 1.0 . 3.00 1647 1603 A 4 ILE HG2% A 75 LEU HDy% 1.0 . 3.53 1648 1604 A 44 ILE HG2% A 52 TRP H 1.0 . 5.50 1649 1605 A 44 ILE HG2% A 44 ILE H 1.0 . 4.77 1650 1606 A 44 ILE HG2% A 45 ALA H 1.0 . 3.76 1651 1607 A 44 ILE HG2% A 46 GLY H 1.0 . 5.44 1652 1608 A 44 ILE HG2% A 49 ASN H 1.0 . 4.41 1653 1609 A 44 ILE HG2% A 50 ILE H 1.0 . 4.57 1654 1610 A 44 ILE HG2% A 52 TRP HD1 1.0 . 5.50 1655 1611 A 44 ILE HG2% A 51 PRO HA 1.0 . 4.77 1656 1612 A 44 ILE HG2% A 44 ILE HA 1.0 . 3.45 1657 1613 A 44 ILE HG2% A 49 ASN HA 1.0 . 3.52 1658 1614 A 44 ILE HG2% A 49 ASN HBy 1.0 . 4.23 1659 1615 A 44 ILE HG2% A 49 ASN HBx 1.0 . 3.69 1660 1616 A 44 ILE HG2% A 141 LEU HBy 1.0 . 3.65 1661 1617 A 44 ILE HG2% A 141 LEU HG 1.0 . 4.86 1662 1618 A 44 ILE HG2% A 44 ILE HG1y 1.0 . 4.20 1663 1619 A 44 ILE HG2% A 141 LEU HDx% 1.0 . 3.25 1664 1620 A 44 ILE HG2% A 45 ALA HA 1.0 . 4.74 1665 1621 A 44 ILE HG2% A 45 ALA HB% 1.0 . 5.50 1666 1622 A 86 SER HBx A 87 MET HA 1.0 . 4.84 1667 1623 A 83 ASP HBy A 87 MET HA 1.0 . 5.14 1668 1624 A 40 PHE HA A 58 GLY H 1.0 . 4.91 1669 1625 A 43 VAL HGy% A 124 TRP HA 1.0 . 4.44 1670 1626 A 124 TRP HA A 123 GLU HA 1.0 . 4.63 1671 1627 A 149 ARG HDy A 149 ARG HA 1.0 . 4.01 1672 1628 A 39 SER HA A 40 PHE HD% 1.0 . 4.78 1673 1629 A 11 LYS HGy A 11 LYS HA 1.0 . 4.02 1674 1630 A 6 VAL HGy% A 11 LYS HA 1.0 . 4.98 1675 1631 A 40 PHE HA A 41 PRO HGx 1.0 . 4.92 1676 1632 A 40 PHE HA A 40 PHE HD% 1.0 . 4.03 1677 1633 A 41 PRO HDy A 40 PHE HA 1.0 . 3.23 1678 1634 A 41 PRO HDx A 40 PHE HA 1.0 . 3.57 1679 1635 A 40 PHE HA A 41 PRO HGy 1.0 . 4.32 1680 1636 A 127 LEU HBy A 124 TRP HA 1.0 . 3.90 1681 1637 A 79 ASP HA A 82 GLU H 1.0 . 5.00 1682 1638 A 39 SER HA A 62 CYS HA 1.0 . 3.36 1683 1639 A 69 GLU HGx A 3 HIS HA 1.0 . 5.00 1684 1640 A 113 PHE H A 112 CYS HA 1.0 . 3.15 1685 1641 A 124 TRP HA A 127 LEU H 1.0 . 4.14 1686 1642 A 84 CYS HBy A 79 ASP HA 1.0 . 4.97 1687 1643 A 82 GLU HGy A 79 ASP HA 1.0 . 5.21 1688 1644 A 3 HIS HA A 69 GLU HA 1.0 . 3.57 1689 1645 A 69 GLU HBx A 3 HIS HA 1.0 . 5.29 1690 1646 A 67 ILE HG2% A 3 HIS HA 1.0 . 5.10 1691 1647 A 69 GLU HGy A 3 HIS HA 1.0 . 5.50 1692 1648 A 109 SER HA A 110 VAL H 1.0 . 2.98 1693 1649 A 109 SER HA A 95 VAL H 1.0 . 5.07 1694 1650 A 109 SER HA A 97 VAL H 1.0 . 3.45 1695 1651 A 109 SER HA A 96 GLN HA 1.0 . 3.24 1696 1652 A 109 SER HA A 96 GLN HBx 1.0 . 5.18 1697 1653 A 74 MET HA A 78 LEU H 1.0 . 4.22 1698 1654 A 146 ARG HA A 147 GLU HA 1.0 . 4.85 1699 1655 A 149 ARG H A 147 GLU HA 1.0 . 4.71 1700 1656 A 146 ARG HA A 146 ARG HGy 1.0 . 3.56 1701 1657 A 146 ARG HA A 146 ARG HGx 1.0 . 3.63 1702 1658 A 146 ARG HA A 145 PRO HGx 1.0 . 5.03 1703 1659 A 84 CYS HA A 86 SER H 1.0 . 3.50 1704 1660 A 88 TYR H A 84 CYS HA 1.0 . 3.96 1705 1661 A 85 PRO HA A 84 CYS HA 1.0 . 3.08 1706 1662 A 89 GLN HA A 84 CYS HA 1.0 . 4.82 1707 1663 A 84 CYS HA A 83 ASP HA 1.0 . 5.23 1708 1664 A 87 MET HBx A 84 CYS HA 1.0 . 4.62 1709 1665 A 88 TYR HD% A 84 CYS HA 1.0 . 5.05 1710 1666 A 53 LEU H A 52 TRP HA 1.0 . 3.20 1711 1667 A 74 MET HA A 77 PHE HBx 1.0 . 3.60 1712 1668 A 74 MET HA A 77 PHE HD% 1.0 . 3.72 1713 1669 A 116 THR H A 90 ARG HA 1.0 . 4.14 1714 1670 A 82 GLU H A 80 ASP HA 1.0 . 4.76 1715 1671 A 90 ARG HDx A 90 ARG HA 1.0 . 5.09 1716 1672 A 90 ARG HGx A 90 ARG HA 1.0 . 3.97 1717 1673 A 147 GLU HGy A 147 GLU HA 1.0 . 3.38 1718 1674 A 86 SER HBx A 84 CYS HA 1.0 . 5.31 1719 1675 A 88 TYR HE% A 52 TRP HA 1.0 . 3.86 1720 1676 A 107 GLY HAy A 108 ASP HA 1.0 . 4.80 1721 1677 A 88 TYR HA A 117 THR HB 1.0 . 3.74 1722 1678 A 69 GLU HBy A 68 TYR HA 1.0 . 5.23 1723 1679 A 67 ILE HG2% A 68 TYR HA 1.0 . 5.43 1724 1680 A 100 TRP H A 99 GLU HA 1.0 . 2.72 1725 1681 A 99 GLU HA A 100 TRP HBy 1.0 . 4.64 1726 1682 A 50 ILE HG2% A 52 TRP HE1 1.0 . 4.33 1727 1683 A 50 ILE H A 50 ILE HG2% 1.0 . 4.02 1728 1684 A 50 ILE HG2% A 52 TRP HA 1.0 . 5.40 1729 1685 A 50 ILE HG2% A 50 ILE HA 1.0 . 3.68 1730 1686 A 50 ILE HG1y A 50 ILE HG2% 1.0 . 4.01 1731 1687 A 44 ILE HG2% A 50 ILE HG2% 1.0 . 5.50 1732 1688 A 29 ALA HB% A 68 TYR HA 1.0 . 4.87 1733 1689 A 50 ILE HG1x A 50 ILE HG2% 1.0 . 3.84 1734 1690 A 100 TRP HA A 99 GLU HA 1.0 . 5.02 1735 1691 A 33 ARG H A 100 TRP HA 1.0 . 4.77 1736 1692 A 100 TRP HA A 32 GLY HAx 1.0 . 3.85 1737 1693 A 89 GLN HA A 90 ARG HBy 1.0 . 4.93 1738 1694 A 111 GLN HA A 112 CYS H 1.0 . 2.91 1739 1695 A 111 GLN HA A 94 GLN HA 1.0 . 3.28 1740 1696 A 110 VAL H A 94 GLN HA 1.0 . 5.18 1741 1697 A 94 GLN HA A 111 GLN H 1.0 . 5.22 1742 1698 A 94 GLN HA A 95 VAL H 1.0 . 2.90 1743 1699 A 94 GLN HA A 93 LEU HA 1.0 . 4.99 1744 1700 A 93 LEU HDx% A 94 GLN HA 1.0 . 5.10 1745 1701 A 125 LEU HA A 125 LEU HDx% 1.0 . 4.27 1746 1702 A 100 TRP HA A 32 GLY H 1.0 . 5.17 1747 1703 A 89 GLN HA A 90 ARG HBx 1.0 . 4.96 1748 1704 A 89 GLN HA A 89 GLN HGx 1.0 . 3.73 1749 1705 A 20 MET HGy A 10 LEU HA 1.0 . 4.90 1750 1706 A 10 LEU HDy% A 10 LEU HA 1.0 . 3.49 1751 1707 A 10 LEU HA A 16 ASN H 1.0 . 5.50 1752 1708 A 10 LEU HA A 17 HIS H 1.0 . 5.27 1753 1709 A 16 ASN HBy A 10 LEU HA 1.0 . 5.18 1754 1710 A 97 VAL HA A 98 LEU HA 1.0 . 4.98 1755 1711 A 20 MET HA A 22 ASP H 1.0 . 4.92 1756 1712 A 20 MET HA A 20 MET HGx 1.0 . 3.80 1757 1713 A 20 MET HA A 19 VAL HGy% 1.0 . 4.75 1758 1714 A 20 MET HE% A 20 MET HA 1.0 . 4.66 1759 1715 A 28 ALA H A 20 MET HE% 1.0 . 5.49 1760 1716 A 28 ALA HA A 20 MET HE% 1.0 . 4.71 1761 1717 A 20 MET HE% A 17 HIS HA 1.0 . 5.06 1762 1718 A 64 THR HB A 35 CYS HA 1.0 . 4.76 1763 1719 A 5 PHE HE% A 35 CYS HA 1.0 . 4.04 1764 1720 A 64 THR HA A 35 CYS HA 1.0 . 3.20 1765 1721 A 35 CYS HA A 64 THR HG2% 1.0 . 4.85 1766 1722 A 98 LEU HDy% A 35 CYS HA 1.0 . 5.47 1767 1723 A 36 THR HA A 35 CYS HA 1.0 . 5.36 1768 1724 A 70 VAL HA A 69 GLU HA 1.0 . 4.95 1769 1725 A 108 ASP HBx A 96 GLN HA 1.0 . 5.50 1770 1726 A 20 MET HE% A 20 MET H 1.0 . 4.45 1771 1727 A 20 MET HE% A 68 TYR HE% 1.0 . 3.80 1772 1728 A 20 MET HE% A 68 TYR HD% 1.0 . 3.40 1773 1729 A 20 MET HE% A 10 LEU HA 1.0 . 4.87 1774 1730 A 20 MET HE% A 68 TYR HBy 1.0 . 3.70 1775 1731 A 68 TYR HBx A 20 MET HE% 1.0 . 4.05 1776 1732 A 20 MET HE% A 20 MET HGy 1.0 . 3.43 1777 1733 A 74 MET HE% A 20 MET HE% 1.0 . 4.22 1778 1734 A 20 MET HE% A 20 MET HBy 1.0 . 3.13 1779 1735 A 20 MET HE% A 20 MET HBx 1.0 . 3.31 1780 1736 A 20 MET HE% A 28 ALA HB% 1.0 . 2.92 1781 1737 A 20 MET HE% A 10 LEU HDx% 1.0 . 3.61 1782 1738 A 20 MET HE% A 10 LEU HDy% 1.0 . 4.08 1783 1739 A 5 PHE HA A 4 ILE HG1x 1.0 . 4.90 1784 1740 A 95 VAL HGy% A 5 PHE HA 1.0 . 5.50 1785 1741 A 5 PHE HA A 6 VAL H 1.0 . 3.09 1786 1742 A 5 PHE HA A 67 ILE HG1x 1.0 . 5.50 1787 1743 A 67 ILE HG2% A 5 PHE HA 1.0 . 4.69 1788 1744 A 5 PHE HA A 6 VAL HGy% 1.0 . 5.39 1789 1745 A 69 GLU HGy A 69 GLU HA 1.0 . 3.97 1790 1746 A 69 GLU HGx A 69 GLU HA 1.0 . 3.45 1791 1747 A 4 ILE H A 69 GLU HA 1.0 . 4.47 1792 1748 A 70 VAL HGx% A 69 GLU HA 1.0 . 5.06 1793 1749 A 142 ARG HE A 139 HIS HA 1.0 . 5.47 1794 1750 A 70 VAL HGy% A 69 GLU HA 1.0 . 4.70 1795 1751 A 101 GLU HA A 102 GLY H 1.0 . 2.89 1796 1752 A 100 TRP HD1 A 101 GLU HA 1.0 . 4.72 1797 1753 A 100 TRP HA A 101 GLU HA 1.0 . 4.79 1798 1754 A 101 GLU HA A 102 GLY HAy 1.0 . 4.68 1799 1755 A 110 VAL H A 96 GLN HA 1.0 . 4.54 1800 1756 A 96 GLN HA A 97 VAL HGy% 1.0 . 4.55 1801 1757 A 96 GLN HA A 97 VAL H 1.0 . 2.97 1802 1758 A 81 PHE HA A 82 GLU HA 1.0 . 5.43 1803 1759 A 83 ASP HBy A 82 GLU HA 1.0 . 5.36 1804 1760 A 81 PHE HD% A 82 GLU HA 1.0 . 5.40 1805 1761 A 34 GLY HAy A 33 ARG HA 1.0 . 5.13 1806 1762 A 101 GLU HA A 102 GLY HAx 1.0 . 4.70 1807 1763 A 139 HIS HA A 141 LEU HG 1.0 . 5.46 1808 1764 A 67 ILE HD1% A 33 ARG HA 1.0 . 5.50 1809 1765 A 103 ASP HA A 105 ASP H 1.0 . 4.52 1810 1766 A 103 ASP HA A 102 GLY HAy 1.0 . 4.31 1811 1767 A 67 ILE HD1% A 100 TRP HZ3 1.0 . 3.72 1812 1768 A 67 ILE HD1% A 32 GLY H 1.0 . 5.50 1813 1769 A 67 ILE HD1% A 34 GLY HAy 1.0 . 3.79 1814 1770 A 67 ILE HD1% A 100 TRP HBx 1.0 . 5.19 1815 1771 A 67 ILE HD1% A 95 VAL HGx% 1.0 . 3.53 1816 1772 A 67 ILE HD1% A 95 VAL HGy% 1.0 . 4.97 1817 1773 A 67 ILE HD1% A 68 TYR H 1.0 . 5.49 1818 1774 A 67 ILE HD1% A 98 LEU H 1.0 . 4.79 1819 1775 A 67 ILE HD1% A 67 ILE H 1.0 . 4.64 1820 1776 A 67 ILE HD1% A 99 GLU H 1.0 . 5.50 1821 1777 A 67 ILE HD1% A 5 PHE HD% 1.0 . 4.49 1822 1778 A 67 ILE HD1% A 32 GLY HAy 1.0 . 5.50 1823 1779 A 67 ILE HD1% A 95 VAL HB 1.0 . 4.88 1824 1780 A 6 VAL HA A 4 ILE HD1% 1.0 . 5.50 1825 1781 A 67 ILE HG1x A 66 GLU HA 1.0 . 4.91 1826 1782 A 67 ILE H A 66 GLU HA 1.0 . 3.19 1827 1783 A 67 ILE HD1% A 66 GLU HA 1.0 . 5.39 1828 1784 A 136 GLU HA A 135 SER HBx 1.0 . 5.10 1829 1785 A 67 ILE HD1% A 32 GLY HAx 1.0 . 5.17 1830 1786 A 114 VAL HA A 4 ILE HD1% 1.0 . 5.36 1831 1787 A 4 ILE H A 4 ILE HD1% 1.0 . 4.90 1832 1788 A 68 TYR H A 4 ILE HD1% 1.0 . 5.01 1833 1789 A 6 VAL H A 4 ILE HD1% 1.0 . 5.28 1834 1790 A 5 PHE H A 4 ILE HD1% 1.0 . 4.65 1835 1791 A 113 PHE HD% A 4 ILE HD1% 1.0 . 5.50 1836 1792 A 68 TYR HD% A 4 ILE HD1% 1.0 . 4.72 1837 1793 A 4 ILE HA A 4 ILE HD1% 1.0 . 4.59 1838 1794 A 75 LEU HA A 4 ILE HD1% 1.0 . 5.50 1839 1795 A 68 TYR HBy A 4 ILE HD1% 1.0 . 3.96 1840 1796 A 68 TYR HBx A 4 ILE HD1% 1.0 . 4.90 1841 1797 A 4 ILE HB A 4 ILE HD1% 1.0 . 3.48 1842 1798 A 30 PHE HE% A 66 GLU HA 1.0 . 4.64 1843 1799 A 67 ILE HG1y A 66 GLU HA 1.0 . 5.21 1844 1800 A 6 VAL HGx% A 66 GLU HA 1.0 . 5.38 1845 1801 A 103 ASP HA A 104 GLY H 1.0 . 2.96 1846 1802 A 103 ASP HA A 103 ASP HBy 1.0 . 2.97 1847 1803 A 28 ALA H A 27 LEU HA 1.0 . 2.65 1848 1804 A 74 MET HE% A 27 LEU HA 1.0 . 5.27 1849 1805 A 27 LEU HBx A 27 LEU HA 1.0 . 2.96 1850 1806 A 27 LEU HA A 27 LEU HDx% 1.0 . 4.02 1851 1807 A 83 ASP HA A 80 ASP HA 1.0 . 4.17 1852 1808 A 38 GLU HA A 38 GLU HGx 1.0 . 3.84 1853 1809 A 38 GLU HA A 37 VAL HGx% 1.0 . 4.93 1854 1809 A 38 GLU HA A 37 VAL HGy% 1.0 . 4.93 1855 1810 A 82 GLU H A 83 ASP HA 1.0 . 5.17 1856 1811 A 18 LYS HA A 21 LEU HA 1.0 . 5.25 1857 1812 A 120 TYR HD% A 54 LEU HA 1.0 . 4.32 1858 1813 A 54 LEU HG A 54 LEU HA 1.0 . 4.18 1859 1814 A 20 MET H A 21 LEU HA 1.0 . 5.13 1860 1815 A 21 LEU HG A 21 LEU HA 1.0 . 3.92 1861 1816 A 53 LEU HA A 52 TRP H 1.0 . 4.97 1862 1817 A 117 THR H A 54 LEU HA 1.0 . 3.72 1863 1818 A 55 TYR H A 54 LEU HA 1.0 . 3.13 1864 1819 A 41 PRO HBy A 42 LEU HA 1.0 . 4.60 1865 1820 A 53 LEU HG A 42 LEU HA 1.0 . 5.33 1866 1821 A 42 LEU HA A 52 TRP H 1.0 . 5.11 1867 1822 A 53 LEU HA A 88 TYR HE% 1.0 . 5.50 1868 1823 A 40 PHE H A 61 HIS HA 1.0 . 4.89 1869 1824 A 53 LEU HA A 54 LEU H 1.0 . 3.11 1870 1825 A 62 CYS HBx A 61 HIS HA 1.0 . 5.20 1871 1826 A 53 LEU HA A 54 LEU HBy 1.0 . 4.78 1872 1827 A 50 ILE HB A 49 ASN HA 1.0 . 5.32 1873 1828 A 50 ILE H A 49 ASN HA 1.0 . 3.49 1874 1829 A 48 HIS HA A 49 ASN HA 1.0 . 5.01 1875 1830 A 45 ALA H A 49 ASN HA 1.0 . 4.86 1876 1831 A 53 LEU HBx A 42 LEU HA 1.0 . 4.92 1877 1832 A 53 LEU HA A 42 LEU HA 1.0 . 3.64 1878 1833 A 58 GLY HAx A 59 LYS HA 1.0 . 5.17 1879 1834 A 39 SER HBx A 59 LYS HA 1.0 . 4.74 1880 1835 A 59 LYS HA A 59 LYS HBx 1.0 . 2.97 1881 1835 A 59 LYS HBy A 59 LYS HA 1.0 . 2.97 1882 1836 A 59 LYS HGx A 59 LYS HA 1.0 . 3.82 1883 1837 A 60 GLY HAy A 59 LYS HA 1.0 . 5.09 1884 1838 A 49 ASN H A 50 ILE HD1% 1.0 . 5.19 1885 1839 A 48 HIS H A 50 ILE HD1% 1.0 . 4.90 1886 1840 A 52 TRP HE1 A 50 ILE HD1% 1.0 . 4.76 1887 1841 A 50 ILE HD1% A 52 TRP HZ2 1.0 . 3.96 1888 1842 A 48 HIS HD2 A 50 ILE HD1% 1.0 . 4.52 1889 1843 A 50 ILE H A 50 ILE HD1% 1.0 . 3.86 1890 1844 A 143 TYR HE% A 50 ILE HD1% 1.0 . 4.12 1891 1845 A 50 ILE HA A 50 ILE HD1% 1.0 . 4.18 1892 1846 A 48 HIS HBy A 50 ILE HD1% 1.0 . 3.86 1893 1847 A 48 HIS HBx A 50 ILE HD1% 1.0 . 3.57 1894 1848 A 50 ILE HB A 50 ILE HD1% 1.0 . 3.35 1895 1849 A 50 ILE HG2% A 50 ILE HD1% 1.0 . 3.30 1896 1850 A 128 PRO HDy A 127 LEU HA 1.0 . 3.29 1897 1851 A 128 PRO HDx A 127 LEU HA 1.0 . 3.59 1898 1852 A 127 LEU HA A 127 LEU HDx% 1.0 . 4.40 1899 1853 A 120 TYR HD% A 120 TYR HA 1.0 . 3.72 1900 1854 A 120 TYR HBx A 120 TYR HA 1.0 . 2.99 1901 1855 A 54 LEU HDy% A 120 TYR HA 1.0 . 5.03 1902 1856 A 149 ARG H A 148 ASN HA 1.0 . 3.33 1903 1857 A 49 ASN HD2x A 141 LEU HA 1.0 . 4.39 1904 1858 A 141 LEU HA A 141 LEU HG 1.0 . 3.93 1905 1859 A 141 LEU HBx A 141 LEU HA 1.0 . 2.84 1906 1860 A 44 ILE HG2% A 141 LEU HA 1.0 . 5.50 1907 1861 A 31 ARG HA A 101 GLU HBx 1.0 . 4.32 1908 1862 A 23 HIS HA A 22 ASP HA 1.0 . 4.93 1909 1863 A 21 LEU H A 22 ASP HA 1.0 . 5.13 1910 1864 A 23 HIS HBy A 22 ASP HA 1.0 . 4.70 1911 1865 A 23 HIS HBx A 22 ASP HA 1.0 . 4.53 1912 1866 A 130 HIS HBx A 129 TYR HA 1.0 . 5.30 1913 1867 A 14 GLN HE2x A 134 ASP HA 1.0 . 3.63 1914 1868 A 44 ILE H A 129 TYR HA 1.0 . 5.50 1915 1869 A 129 TYR HE% A 129 TYR HA 1.0 . 4.50 1916 1870 A 42 LEU HBy A 129 TYR HA 1.0 . 5.18 1917 1871 A 136 GLU H A 134 ASP HA 1.0 . 5.05 1918 1872 A 133 TYR HD% A 134 ASP HA 1.0 . 5.47 1919 1873 A 133 TYR HA A 134 ASP HA 1.0 . 5.32 1920 1874 A 16 ASN HA A 16 ASN HD2x 1.0 . 5.10 1921 1875 A 16 ASN HA A 18 LYS HGy 1.0 . 4.11 1922 1875 A 18 LYS HGx A 16 ASN HA 1.0 . 4.11 1923 1876 A 16 ASN HA A 19 VAL HGy% 1.0 . 4.78 1924 1877 A 44 ILE HD1% A 51 PRO HA 1.0 . 5.50 1925 1878 A 44 ILE HD1% A 141 LEU HBy 1.0 . 4.23 1926 1879 A 44 ILE HD1% A 44 ILE H 1.0 . 4.81 1927 1880 A 44 ILE HD1% A 130 HIS HD2 1.0 . 4.38 1928 1881 A 139 HIS HD2 A 44 ILE HD1% 1.0 . 5.04 1929 1882 A 44 ILE HD1% A 44 ILE HA 1.0 . 4.51 1930 1883 A 44 ILE HD1% A 139 HIS HBx 1.0 . 5.00 1931 1884 A 44 ILE HD1% A 44 ILE HB 1.0 . 3.54 1932 1885 A 44 ILE HD1% A 141 LEU HDx% 1.0 . 3.92 1933 1886 A 44 ILE HD1% A 44 ILE HG2% 1.0 . 3.42 1934 1887 A 16 ASN HA A 19 VAL H 1.0 . 4.70 1935 1888 A 16 ASN HA A 17 HIS HA 1.0 . 5.41 1936 1889 A 15 PRO HDy A 16 ASN H 1.0 . 5.33 1937 1890 A 14 GLN HA A 15 PRO HDx 1.0 . 3.96 1938 1891 A 9 THR HA A 15 PRO HDx 1.0 . 4.64 1939 1892 A 14 GLN HGy A 15 PRO HDx 1.0 . 4.04 1940 1893 A 9 THR HG2% A 15 PRO HDx 1.0 . 5.17 1941 1894 A 9 THR HG2% A 15 PRO HDy 1.0 . 5.50 1942 1895 A 56 LEU HA A 57 PRO HGy 1.0 . 5.19 1943 1896 A 120 TYR HD% A 118 ALA HA 1.0 . 3.79 1944 1897 A 92 ALA HA A 111 GLN HE2x 1.0 . 3.35 1945 1898 A 117 THR HA A 118 ALA HA 1.0 . 4.95 1946 1899 A 55 TYR HBy A 118 ALA HA 1.0 . 4.05 1947 1900 A 55 TYR HBx A 118 ALA HA 1.0 . 4.36 1948 1901 A 46 GLY H A 45 ALA HA 1.0 . 2.93 1949 1902 A 127 LEU HDy% A 45 ALA HA 1.0 . 5.29 1950 1903 A 113 PHE HE% A 2 ALA HA 1.0 . 5.36 1951 1904 A 113 PHE HD% A 2 ALA HA 1.0 . 5.34 1952 1905 A 92 ALA HA A 93 LEU H 1.0 . 2.86 1953 1906 A 113 PHE HD% A 92 ALA HA 1.0 . 4.22 1954 1907 A 91 THR HG2% A 92 ALA HA 1.0 . 5.12 1955 1908 A 71 ASP HA A 74 MET H 1.0 . 4.76 1956 1909 A 127 LEU HDx% A 45 ALA HA 1.0 . 3.99 1957 1910 A 70 VAL HGy% A 2 ALA HA 1.0 . 5.50 1958 1911 A 71 ASP HA A 72 GLU H 1.0 . 3.15 1959 1912 A 71 ASP HA A 70 VAL HGy% 1.0 . 4.99 1960 1913 A 28 ALA HA A 27 LEU HA 1.0 . 5.13 1961 1914 A 70 VAL HA A 28 ALA HA 1.0 . 3.41 1962 1915 A 28 ALA HA A 68 TYR HBy 1.0 . 5.08 1963 1916 A 28 ALA HA A 70 VAL HB 1.0 . 5.21 1964 1917 A 28 ALA HA A 27 LEU HDx% 1.0 . 5.38 1965 1918 A 105 ASP HA A 106 PRO HDy 1.0 . 3.11 1966 1919 A 106 PRO HDx A 105 ASP HA 1.0 . 3.20 1967 1920 A 106 PRO HGy A 105 ASP HA 1.0 . 4.78 1968 1921 A 28 ALA HA A 68 TYR HBx 1.0 . 4.91 1969 1922 A 28 ALA HA A 68 TYR HD% 1.0 . 5.50 1970 1923 A 29 ALA HA A 30 PHE HBx 1.0 . 5.43 1971 1924 A 41 PRO HDy A 42 LEU H 1.0 . 5.50 1972 1925 A 29 ALA HA A 30 PHE H 1.0 . 2.91 1973 1926 A 41 PRO HDy A 40 PHE HBx 1.0 . 5.03 1974 1927 A 27 LEU HDy% A 29 ALA HA 1.0 . 5.50 1975 1928 A 41 PRO HDy A 59 LYS H 1.0 . 5.11 1976 1929 A 41 PRO HDx A 40 PHE H 1.0 . 5.26 1977 1930 A 145 PRO HDy A 144 ASN H 1.0 . 4.77 1978 1931 A 145 PRO HDy A 144 ASN HBy 1.0 . 5.27 1979 1932 A 146 ARG H A 145 PRO HDy 1.0 . 4.91 1980 1933 A 143 TYR HD% A 145 PRO HDy 1.0 . 5.50 1981 1934 A 143 TYR HE% A 145 PRO HDx 1.0 . 5.50 1982 1935 A 143 TYR HD% A 145 PRO HDx 1.0 . 5.50 1983 1936 A 144 ASN H A 145 PRO HDx 1.0 . 4.67 1984 1937 A 146 ARG H A 144 ASN HA 1.0 . 5.13 1985 1938 A 147 GLU HGy A 144 ASN HA 1.0 . 5.17 1986 1939 A 145 PRO HDy A 147 GLU HGy 1.0 . 4.30 1987 1940 A 137 GLY H A 138 PRO HDy 1.0 . 5.01 1988 1940 A 137 GLY H A 138 PRO HDx 1.0 . 5.01 1989 1941 A 145 PRO HGx A 144 ASN HA 1.0 . 4.18 1990 1942 A 145 PRO HDy A 144 ASN HA 1.0 . 3.13 1991 1943 A 144 ASN HA A 145 PRO HDx 1.0 . 3.34 1992 1944 A 139 HIS H A 138 PRO HDy 1.0 . 4.97 1993 1944 A 139 HIS H A 138 PRO HDx 1.0 . 4.97 1994 1945 A 137 GLY HAx A 138 PRO HDy 1.0 . 3.61 1995 1945 A 137 GLY HAx A 138 PRO HDx 1.0 . 3.61 1996 1946 A 128 PRO HDy A 127 LEU HDx% 1.0 . 5.50 1997 1947 A 128 PRO HDy A 127 LEU H 1.0 . 5.50 1998 1948 A 55 TYR HD% A 57 PRO HDy 1.0 . 4.97 1999 1949 A 55 TYR HE% A 57 PRO HDy 1.0 . 5.50 2000 1950 A 56 LEU HA A 57 PRO HDy 1.0 . 3.12 2001 1951 A 56 LEU HBx A 57 PRO HDy 1.0 . 5.35 2002 1952 A 56 LEU HDx% A 57 PRO HDx 1.0 . 5.50 2003 1953 A 56 LEU HA A 57 PRO HDx 1.0 . 3.31 2004 1954 A 56 LEU H A 57 PRO HDx 1.0 . 4.71 2005 1955 A 56 LEU HDy% A 57 PRO HDx 1.0 . 5.35 2006 1956 A 86 SER H A 85 PRO HDy 1.0 . 4.45 2007 1957 A 100 TRP HD1 A 106 PRO HDy 1.0 . 5.33 2008 1958 A 100 TRP HE3 A 106 PRO HDx 1.0 . 5.50 2009 1959 A 106 PRO HDx A 97 VAL HGy% 1.0 . 5.50 2010 1960 A 120 TYR HD% A 124 TRP HBx 1.0 . 4.93 2011 1961 A 54 LEU HDx% A 120 TYR HD% 1.0 . 3.93 2012 1962 A 55 TYR H A 120 TYR HD% 1.0 . 4.23 2013 1963 A 120 TYR HD% A 125 LEU H 1.0 . 4.65 2014 1964 A 120 TYR HD% A 120 TYR H 1.0 . 2.98 2015 1965 A 120 TYR HD% A 124 TRP HBy 1.0 . 4.02 2016 1966 A 88 TYR HD% A 52 TRP HE3 1.0 . 4.02 2017 1967 A 88 TYR H A 88 TYR HD% 1.0 . 3.57 2018 1968 A 88 TYR HD% A 88 TYR HA 1.0 . 3.55 2019 1969 A 88 TYR HD% A 117 THR HB 1.0 . 3.88 2020 1970 A 88 TYR HD% A 82 GLU HA 1.0 . 4.28 2021 1971 A 87 MET HBx A 88 TYR HD% 1.0 . 3.30 2022 1972 A 117 THR HG2% A 88 TYR HD% 1.0 . 4.56 2023 1973 A 88 TYR HD% A 89 GLN H 1.0 . 3.94 2024 1974 A 88 TYR HD% A 116 THR H 1.0 . 4.49 2025 1975 A 87 MET H A 88 TYR HD% 1.0 . 5.00 2026 1976 A 88 TYR HD% A 116 THR HA 1.0 . 4.20 2027 1977 A 82 GLU HBx A 88 TYR HD% 1.0 . 3.51 2028 1978 A 56 LEU H A 55 TYR HD% 1.0 . 4.13 2029 1979 A 55 TYR HD% A 55 TYR HA 1.0 . 2.95 2030 1980 A 116 THR HB A 55 TYR HD% 1.0 . 3.53 2031 1981 A 55 TYR HD% A 57 PRO HDx 1.0 . 4.02 2032 1982 A 55 TYR HD% A 116 THR HG2% 1.0 . 3.07 2033 1983 A 91 THR HG2% A 55 TYR HD% 1.0 . 3.20 2034 1984 A 53 LEU HDx% A 55 TYR HD% 1.0 . 4.34 2035 1985 A 143 TYR HD% A 143 TYR H 1.0 . 4.42 2036 1986 A 143 TYR HD% A 144 ASN H 1.0 . 3.56 2037 1987 A 143 TYR HD% A 143 TYR HA 1.0 . 3.32 2038 1988 A 143 TYR HD% A 50 ILE HA 1.0 . 3.48 2039 1989 A 143 TYR HD% A 15 PRO HGx 1.0 . 3.84 2040 1990 A 143 TYR HD% A 145 PRO HGx 1.0 . 4.66 2041 1991 A 143 TYR HD% A 50 ILE HG1y 1.0 . 3.30 2042 1992 A 143 TYR HD% A 50 ILE HG1x 1.0 . 4.21 2043 1993 A 143 TYR HD% A 50 ILE HD1% 1.0 . 4.57 2044 1994 A 143 TYR HD% A 50 ILE HG2% 1.0 . 4.35 2045 1995 A 113 PHE HE% A 2 ALA HB% 1.0 . 3.18 2046 1996 A 92 ALA HB% A 113 PHE HE% 1.0 . 3.49 2047 1997 A 115 TYR HD% A 90 ARG HA 1.0 . 4.77 2048 1998 A 115 TYR HD% A 115 TYR H 1.0 . 3.80 2049 1999 A 115 TYR HD% A 115 TYR HA 1.0 . 3.61 2050 2000 A 115 TYR HD% A 90 ARG HBy 1.0 . 5.50 2051 2001 A 115 TYR HD% A 90 ARG HBx 1.0 . 4.63 2052 2002 A 5 PHE HD% A 5 PHE H 1.0 . 4.75 2053 2003 A 5 PHE HD% A 95 VAL HGx% 1.0 . 3.34 2054 2004 A 5 PHE HD% A 5 PHE HA 1.0 . 3.62 2055 2005 A 5 PHE HD% A 67 ILE HA 1.0 . 4.15 2056 2006 A 5 PHE HD% A 67 ILE HG1y 1.0 . 3.66 2057 2007 A 5 PHE HD% A 114 VAL HGy% 1.0 . 2.84 2058 2008 A 5 PHE HD% A 95 VAL HGy% 1.0 . 3.59 2059 2009 A 5 PHE HD% A 112 CYS HBx 1.0 . 4.86 2060 2010 A 68 TYR HD% A 68 TYR H 1.0 . 3.36 2061 2011 A 31 ARG H A 68 TYR HD% 1.0 . 4.48 2062 2012 A 68 TYR HD% A 67 ILE HA 1.0 . 4.49 2063 2013 A 68 TYR HD% A 68 TYR HA 1.0 . 3.77 2064 2014 A 68 TYR HD% A 30 PHE HA 1.0 . 3.84 2065 2015 A 28 ALA HB% A 68 TYR HD% 1.0 . 3.33 2066 2016 A 68 TYR HD% A 6 VAL HGy% 1.0 . 3.63 2067 2017 A 133 TYR HD% A 44 ILE HD1% 1.0 . 3.76 2068 2018 A 8 GLY HAx A 133 TYR HD% 1.0 . 4.10 2069 2019 A 133 TYR HD% A 42 LEU HDx% 1.0 . 4.96 2070 2020 A 40 PHE HD% A 57 PRO HDx 1.0 . 4.49 2071 2021 A 41 PRO HDx A 40 PHE HD% 1.0 . 3.76 2072 2022 A 53 LEU HDy% A 40 PHE HD% 1.0 . 3.95 2073 2023 A 41 PRO HDy A 40 PHE HD% 1.0 . 4.13 2074 2024 A 78 LEU H A 77 PHE HD% 1.0 . 3.68 2075 2025 A 77 PHE H A 77 PHE HD% 1.0 . 4.08 2076 2026 A 77 PHE HA A 77 PHE HD% 1.0 . 3.24 2077 2027 A 78 LEU HA A 77 PHE HD% 1.0 . 3.85 2078 2028 A 77 PHE HD% A 80 ASP HBy 1.0 . 4.28 2079 2029 A 74 MET HE% A 77 PHE HD% 1.0 . 3.93 2080 2030 A 77 PHE HD% A 78 LEU HDx% 1.0 . 4.31 2081 2031 A 78 LEU HDy% A 77 PHE HD% 1.0 . 3.10 2082 2032 A 130 HIS H A 129 TYR HD% 1.0 . 4.09 2083 2033 A 60 GLY HAx A 129 TYR HD% 1.0 . 3.77 2084 2034 A 129 TYR HD% A 60 GLY H 1.0 . 3.92 2085 2035 A 129 TYR HD% A 129 TYR HA 1.0 . 2.93 2086 2036 A 60 GLY HAy A 129 TYR HD% 1.0 . 3.33 2087 2037 A 129 TYR HD% A 43 VAL HGy% 1.0 . 2.83 2088 2038 A 56 LEU H A 40 PHE HD% 1.0 . 3.02 2089 2039 A 62 CYS HA A 40 PHE HD% 1.0 . 5.32 2090 2040 A 40 PHE HD% A 36 THR HG2% 1.0 . 3.50 2091 2041 A 93 LEU HDx% A 40 PHE HD% 1.0 . 5.02 2092 2042 A 123 GLU HA A 126 PHE HE% 1.0 . 3.51 2093 2043 A 123 GLU HBx A 126 PHE HE% 1.0 . 4.82 2094 2044 A 125 LEU HBy A 126 PHE HE% 1.0 . 4.83 2095 2045 A 126 PHE HD% A 123 GLU HBx 1.0 . 4.72 2096 2046 A 126 PHE HD% A 126 PHE HA 1.0 . 3.56 2097 2047 A 126 PHE HD% A 123 GLU HA 1.0 . 3.44 2098 2048 A 30 PHE HE% A 33 ARG HA 1.0 . 4.57 2099 2049 A 30 PHE HE% A 66 GLU HBx 1.0 . 4.39 2100 2050 A 30 PHE HE% A 32 GLY H 1.0 . 4.61 2101 2051 A 30 PHE HD% A 30 PHE H 1.0 . 4.51 2102 2052 A 31 ARG H A 30 PHE HD% 1.0 . 4.51 2103 2053 A 30 PHE HD% A 32 GLY H 1.0 . 4.74 2104 2054 A 30 PHE HD% A 30 PHE HA 1.0 . 3.89 2105 2055 A 91 THR HA A 113 PHE HD% 1.0 . 4.51 2106 2056 A 113 PHE HD% A 75 LEU HDy% 1.0 . 3.80 2107 2057 A 38 GLU H A 40 PHE HE% 1.0 . 4.65 2108 2058 A 40 PHE HE% A 36 THR HG2% 1.0 . 3.91 2109 2059 A 113 PHE HD% A 113 PHE H 1.0 . 3.68 2110 2060 A 113 PHE HD% A 4 ILE HA 1.0 . 4.66 2111 2061 A 113 PHE HD% A 113 PHE HA 1.0 . 3.00 2112 2062 A 113 PHE HD% A 2 ALA HB% 1.0 . 3.27 2113 2063 A 113 PHE HD% A 92 ALA HB% 1.0 . 3.47 2114 2064 A 90 ARG HDx A 113 PHE HD% 1.0 . 4.67 2115 2065 A 113 PHE HD% A 4 ILE HG2% 1.0 . 4.06 2116 2066 A 40 PHE HE% A 36 THR HB 1.0 . 3.64 2117 2067 A 40 PHE HE% A 57 PRO HDy 1.0 . 4.24 2118 2068 A 56 LEU H A 40 PHE HE% 1.0 . 4.28 2119 2069 A 40 PHE HE% A 55 TYR HA 1.0 . 4.00 2120 2070 A 57 PRO HA A 40 PHE HE% 1.0 . 4.23 2121 2071 A 40 PHE HE% A 57 PRO HDx 1.0 . 3.86 2122 2072 A 40 PHE HE% A 38 GLU HBy 1.0 . 3.52 2123 2073 A 93 LEU HDx% A 40 PHE HE% 1.0 . 3.82 2124 2074 A 52 TRP H A 52 TRP HD1 1.0 . 3.51 2125 2075 A 52 TRP HBy A 52 TRP HD1 1.0 . 3.43 2126 2076 A 45 ALA HB% A 52 TRP HD1 1.0 . 3.09 2127 2077 A 51 PRO HA A 52 TRP HD1 1.0 . 4.33 2128 2078 A 78 LEU H A 77 PHE HE% 1.0 . 4.91 2129 2079 A 78 LEU HDy% A 77 PHE HE% 1.0 . 3.06 2130 2080 A 19 VAL HB A 77 PHE HE% 1.0 . 3.47 2131 2081 A 5 PHE HZ A 64 THR HA 1.0 . 4.42 2132 2082 A 5 PHE HZ A 36 THR HG2% 1.0 . 3.66 2133 2083 A 5 PHE HZ A 95 VAL HGx% 1.0 . 4.16 2134 2084 A 65 GLY HAy A 5 PHE HE% 1.0 . 4.59 2135 2085 A 5 PHE HZ A 35 CYS HA 1.0 . 4.54 2136 2086 A 57 PRO HA A 40 PHE HZ 1.0 . 4.92 2137 2087 A 93 LEU HDx% A 40 PHE HZ 1.0 . 3.36 2138 2088 A 40 PHE HZ A 38 GLU HBx 1.0 . 3.93 2139 2089 A 93 LEU HBy A 40 PHE HZ 1.0 . 3.96 2140 2090 A 40 PHE HZ A 93 LEU HG 1.0 . 3.98 2141 2091 A 40 PHE HZ A 93 LEU HA 1.0 . 4.40 2142 2092 A 100 TRP HA A 100 TRP HD1 1.0 . 5.04 2143 2093 A 100 TRP HD1 A 100 TRP HBx 1.0 . 3.84 2144 2094 A 105 ASP HBx A 100 TRP HD1 1.0 . 3.94 2145 2095 A 101 GLU H A 100 TRP HD1 1.0 . 4.88 2146 2096 A 100 TRP HD1 A 105 ASP H 1.0 . 4.56 2147 2097 A 100 TRP HD1 A 102 GLY H 1.0 . 4.02 2148 2098 A 100 TRP HD1 A 105 ASP HA 1.0 . 4.22 2149 2099 A 100 TRP HD1 A 100 TRP HBy 1.0 . 3.31 2150 2100 A 45 ALA HB% A 124 TRP HH2 1.0 . 4.25 2151 2101 A 10 LEU HA A 17 HIS HD2 1.0 . 4.79 2152 2102 A 17 HIS HBx A 17 HIS HD2 1.0 . 3.74 2153 2103 A 21 LEU HDx% A 17 HIS HD2 1.0 . 3.20 2154 2104 A 20 MET HGy A 17 HIS HD2 1.0 . 4.32 2155 2105 A 18 LYS H A 17 HIS HD2 1.0 . 4.85 2156 2106 A 52 TRP HH2 A 50 ILE HD1% 1.0 . 4.95 2157 2107 A 50 ILE HG2% A 52 TRP HH2 1.0 . 4.42 2158 2108 A 87 MET HA A 52 TRP HH2 1.0 . 4.71 2159 2109 A 87 MET HBy A 52 TRP HH2 1.0 . 4.07 2160 2110 A 87 MET HGy A 52 TRP HH2 1.0 . 3.64 2161 2111 A 87 MET HBx A 52 TRP HH2 1.0 . 3.96 2162 2112 A 124 TRP HD1 A 124 TRP H 1.0 . 3.44 2163 2113 A 124 TRP HD1 A 124 TRP HA 1.0 . 2.94 2164 2114 A 124 TRP HD1 A 123 GLU HBx 1.0 . 3.76 2165 2115 A 127 LEU HDy% A 124 TRP HD1 1.0 . 4.37 2166 2116 A 124 TRP HD1 A 45 ALA HB% 1.0 . 3.94 2167 2117 A 124 TRP HD1 A 123 GLU H 1.0 . 4.65 2168 2118 A 124 TRP HD1 A 123 GLU HGx 1.0 . 3.30 2169 2119 A 124 TRP HD1 A 127 LEU HG 1.0 . 4.63 2170 2120 A 124 TRP HD1 A 127 LEU HDx% 1.0 . 3.45 2171 2121 A 31 ARG HDx A 100 TRP HH2 1.0 . 4.82 2172 2122 A 31 ARG HGx A 100 TRP HH2 1.0 . 4.62 2173 2123 A 67 ILE HG2% A 100 TRP HH2 1.0 . 4.07 2174 2124 A 100 TRP HA A 100 TRP HE3 1.0 . 3.82 2175 2125 A 97 VAL HGx% A 100 TRP HE3 1.0 . 3.41 2176 2126 A 67 ILE HD1% A 100 TRP HE3 1.0 . 4.36 2177 2127 A 52 TRP HBy A 124 TRP HZ3 1.0 . 4.24 2178 2128 A 101 GLU H A 100 TRP HE3 1.0 . 4.76 2179 2129 A 100 TRP HE3 A 100 TRP HBx 1.0 . 3.92 2180 2130 A 53 LEU H A 52 TRP HE3 1.0 . 4.68 2181 2131 A 87 MET HA A 52 TRP HZ3 1.0 . 4.34 2182 2132 A 117 THR HG2% A 52 TRP HZ3 1.0 . 3.95 2183 2133 A 87 MET HBx A 52 TRP HZ3 1.0 . 4.44 2184 2134 A 124 TRP HZ3 A 120 TYR HA 1.0 . 4.03 2185 2135 A 45 ALA HB% A 124 TRP HZ3 1.0 . 4.50 2186 2136 A 120 TYR HBx A 124 TRP HZ3 1.0 . 4.63 2187 2137 A 117 THR HG2% A 124 TRP HZ3 1.0 . 3.85 2188 2138 A 54 LEU HDy% A 124 TRP HZ3 1.0 . 3.93 2189 2139 A 130 HIS H A 130 HIS HD2 1.0 . 3.49 2190 2140 A 129 TYR HD% A 130 HIS HD2 1.0 . 4.70 2191 2141 A 43 VAL HA A 130 HIS HD2 1.0 . 3.12 2192 2142 A 44 ILE H A 130 HIS HD2 1.0 . 3.88 2193 2143 A 129 TYR HA A 130 HIS HD2 1.0 . 3.94 2194 2144 A 130 HIS HBx A 130 HIS HD2 1.0 . 3.83 2195 2145 A 42 LEU HDx% A 130 HIS HD2 1.0 . 4.86 2196 2146 A 117 THR HB A 52 TRP HE3 1.0 . 4.36 2197 2147 A 117 THR HG2% A 52 TRP HE3 1.0 . 3.47 2198 2148 A 54 LEU HDy% A 52 TRP HE3 1.0 . 4.69 2199 2149 A 129 TYR HA A 61 HIS HD2 1.0 . 4.73 2200 2150 A 129 TYR HBy A 61 HIS HD2 1.0 . 3.60 2201 2151 A 100 TRP HA A 100 TRP HZ3 1.0 . 4.90 2202 2152 A 48 HIS H A 48 HIS HD2 1.0 . 4.14 2203 2153 A 48 HIS HBx A 48 HIS HD2 1.0 . 3.61 2204 2154 A 131 GLU HA A 61 HIS HD2 1.0 . 4.59 2205 2155 A 129 TYR HBx A 61 HIS HD2 1.0 . 3.86 2206 2156 A 61 HIS HBx A 61 HIS HD2 1.0 . 3.70 2207 2157 A 23 HIS HA A 23 HIS HD2 1.0 . 3.43 2208 2158 A 27 LEU HDx% A 23 HIS HD2 1.0 . 4.48 2209 2159 A 27 LEU HDy% A 23 HIS HD2 1.0 . 4.20 2210 2160 A 25 HIS HD2 A 25 HIS H 1.0 . 4.34 2211 2161 A 25 HIS HD2 A 25 HIS HA 1.0 . 3.39 2212 2162 A 27 LEU HA A 23 HIS HD2 1.0 . 4.27 2213 2163 A 3 HIS HD2 A 70 VAL H 1.0 . 4.50 2214 2164 A 120 TYR HA A 124 TRP HE3 1.0 . 4.50 2215 2165 A 124 TRP HBy A 124 TRP HE3 1.0 . 3.67 2216 2166 A 124 TRP HBx A 124 TRP HE3 1.0 . 3.68 2217 2167 A 120 TYR HBy A 124 TRP HE3 1.0 . 3.24 2218 2168 A 117 THR HG2% A 124 TRP HE3 1.0 . 4.35 2219 2169 A 43 VAL HGx% A 124 TRP HE3 1.0 . 3.58 2220 2170 A 54 LEU HDy% A 124 TRP HE3 1.0 . 3.25 2221 2171 A 45 ALA HB% A 124 TRP HE3 1.0 . 4.24 2222 2172 A 54 LEU HDx% A 124 TRP HE3 1.0 . 4.20 2223 2173 A 129 TYR HE% A 129 TYR H 1.0 . 4.83 2224 2174 A 129 TYR HE% A 60 GLY H 1.0 . 3.94 2225 2175 A 129 TYR HE% A 60 GLY HAy 1.0 . 4.02 2226 2176 A 129 TYR HE% A 43 VAL HGy% 1.0 . 3.05 2227 2177 A 4 ILE H A 3 HIS HD2 1.0 . 4.63 2228 2178 A 3 HIS HD2 A 3 HIS HA 1.0 . 3.65 2229 2179 A 3 HIS HD2 A 69 GLU HA 1.0 . 3.57 2230 2180 A 3 HIS HD2 A 3 HIS HBx 1.0 . 3.78 2231 2181 A 3 HIS HD2 A 69 GLU HBx 1.0 . 3.50 2232 2182 A 3 HIS HD2 A 31 ARG HGx 1.0 . 3.76 2233 2183 A 3 HIS HD2 A 67 ILE HG2% 1.0 . 3.37 2234 2184 A 3 HIS HD2 A 31 ARG HBy 1.0 . 4.84 2235 2185 A 139 HIS HD2 A 139 HIS H 1.0 . 3.51 2236 2186 A 139 HIS HD2 A 139 HIS HA 1.0 . 4.57 2237 2187 A 139 HIS HD2 A 138 PRO HDx 1.0 . 4.49 2238 2188 A 68 TYR HE% A 30 PHE HA 1.0 . 4.12 2239 2189 A 30 PHE HBy A 68 TYR HE% 1.0 . 3.74 2240 2190 A 66 GLU HBx A 68 TYR HE% 1.0 . 4.04 2241 2191 A 6 VAL HGx% A 68 TYR HE% 1.0 . 2.95 2242 2192 A 139 HIS HD2 A 139 HIS HBx 1.0 . 3.30 2243 2193 A 68 TYR HE% A 68 TYR H 1.0 . 4.92 2244 2194 A 92 ALA H A 55 TYR HE% 1.0 . 4.86 2245 2195 A 91 THR HB A 55 TYR HE% 1.0 . 4.05 2246 2196 A 91 THR HG2% A 55 TYR HE% 1.0 . 2.73 2247 2197 A 144 ASN H A 143 TYR HE% 1.0 . 4.59 2248 2198 A 145 PRO HBy A 143 TYR HE% 1.0 . 3.87 2249 2199 A 145 PRO HBx A 143 TYR HE% 1.0 . 3.96 2250 2200 A 50 ILE HG1x A 143 TYR HE% 1.0 . 3.25 2251 2201 A 50 ILE HG2% A 143 TYR HE% 1.0 . 3.82 2252 2202 A 15 PRO HBy A 143 TYR HE% 1.0 . 4.46 2253 2203 A 50 ILE HG1y A 143 TYR HE% 1.0 . 3.30 2254 2204 A 88 TYR HE% A 52 TRP HE3 1.0 . 3.42 2255 2205 A 88 TYR HE% A 52 TRP HZ3 1.0 . 3.82 2256 2206 A 117 THR HG2% A 88 TYR HE% 1.0 . 4.18 2257 2207 A 88 TYR HE% A 50 ILE HG2% 1.0 . 4.13 2258 2208 A 88 TYR HE% A 116 THR HA 1.0 . 4.75 2259 2209 A 88 TYR HE% A 82 GLU HA 1.0 . 4.56 2260 2210 A 90 ARG HBx A 115 TYR HE% 1.0 . 4.02 2261 2211 A 115 TYR HE% A 79 ASP HA 1.0 . 3.76 2262 2212 A 78 LEU HBy A 115 TYR HE% 1.0 . 4.04 2263 2213 A 115 TYR HE% A 78 LEU HDx% 1.0 . 3.53 2264 2214 A 79 ASP HBx A 115 TYR HE% 1.0 . 4.46 2265 2215 A 78 LEU HBx A 115 TYR HE% 1.0 . 4.00 2266 2216 A 90 ARG HBy A 115 TYR HE% 1.0 . 4.79 2267 2217 A 100 TRP HZ2 A 105 ASP HA 1.0 . 4.71 2268 2218 A 100 TRP HZ2 A 106 PRO HDx 1.0 . 4.31 2269 2219 A 104 GLY HAx A 100 TRP HZ2 1.0 . 4.34 2270 2220 A 100 TRP HZ2 A 31 ARG HDx 1.0 . 3.67 2271 2221 A 100 TRP HZ2 A 31 ARG HGx 1.0 . 4.24 2272 2222 A 87 MET HBy A 52 TRP HZ2 1.0 . 4.68 2273 2223 A 124 TRP HZ3 A 52 TRP HZ2 1.0 . 4.75 2274 2224 A 52 TRP HZ2 A 124 TRP HH2 1.0 . 3.74 2275 2225 A 87 MET HE% A 52 TRP HZ2 1.0 . 4.53 2276 2226 A 50 ILE HB A 52 TRP HZ2 1.0 . 3.71 2277 2227 A 50 ILE HG2% A 52 TRP HZ2 1.0 . 3.72 2278 2228 A 124 TRP HZ2 A 46 GLY H 1.0 . 4.61 2279 2229 A 124 TRP HZ2 A 46 GLY HAy 1.0 . 3.97 2280 2230 A 124 TRP HZ2 A 45 ALA HB% 1.0 . 3.62 2281 2231 A 46 GLY HAx A 52 TRP HZ2 1.0 . 4.85 2282 2232 A 118 ALA H A 117 THR HB 1.0 . 4.44 2283 2233 A 118 ALA H A 119 THR HA 1.0 . 5.43 2284 2234 A 120 TYR HD% A 118 ALA H 1.0 . 5.50 2285 2235 A 118 ALA H A 89 GLN HE2x 1.0 . 4.55 2286 2236 A 55 TYR HBy A 118 ALA H 1.0 . 5.50 2287 2237 A 41 PRO HDy A 56 LEU H 1.0 . 4.91 2288 2238 A 56 LEU H A 55 TYR H 1.0 . 4.71 2289 2239 A 56 LEU H A 40 PHE HA 1.0 . 4.93 2290 2240 A 56 LEU H A 55 TYR HA 1.0 . 3.10 2291 2241 A 41 PRO HDx A 56 LEU H 1.0 . 4.27 2292 2242 A 56 LEU H A 57 PRO HDy 1.0 . 4.82 2293 2243 A 40 PHE HBy A 56 LEU H 1.0 . 5.05 2294 2244 A 56 LEU H A 53 LEU HDx% 1.0 . 5.50 2295 2245 A 129 TYR HD% A 42 LEU H 1.0 . 5.28 2296 2246 A 41 PRO HBx A 42 LEU H 1.0 . 4.62 2297 2247 A 53 LEU HDy% A 42 LEU H 1.0 . 5.50 2298 2248 A 42 LEU H A 129 TYR HA 1.0 . 4.89 2299 2249 A 41 PRO HA A 42 LEU H 1.0 . 3.29 2300 2250 A 129 TYR HBy A 42 LEU H 1.0 . 4.69 2301 2251 A 129 TYR HBx A 42 LEU H 1.0 . 5.44 2302 2252 A 42 LEU HBy A 42 LEU H 1.0 . 3.84 2303 2253 A 42 LEU HBx A 42 LEU H 1.0 . 3.93 2304 2254 A 52 TRP HE1 A 124 TRP HH2 1.0 . 5.27 2305 2255 A 46 GLY HAx A 52 TRP HE1 1.0 . 5.09 2306 2256 A 50 ILE HB A 52 TRP HE1 1.0 . 3.63 2307 2257 A 124 TRP HZ3 A 52 TRP HE1 1.0 . 5.50 2308 2258 A 97 VAL H A 98 LEU H 1.0 . 5.50 2309 2259 A 98 LEU H A 97 VAL HB 1.0 . 5.45 2310 2260 A 33 ARG H A 98 LEU H 1.0 . 5.50 2311 2261 A 34 GLY HAx A 98 LEU H 1.0 . 3.76 2312 2262 A 98 LEU HBy A 98 LEU H 1.0 . 3.55 2313 2263 A 98 LEU HBx A 98 LEU H 1.0 . 3.79 2314 2264 A 97 VAL HGx% A 98 LEU H 1.0 . 4.38 2315 2265 A 98 LEU H A 97 VAL HGy% 1.0 . 5.31 2316 2266 A 101 GLU H A 102 GLY H 1.0 . 4.21 2317 2267 A 101 GLU H A 100 TRP HA 1.0 . 2.98 2318 2268 A 101 GLU H A 31 ARG HA 1.0 . 4.30 2319 2269 A 101 GLU H A 100 TRP HBy 1.0 . 4.58 2320 2270 A 101 GLU H A 101 GLU HBx 1.0 . 3.67 2321 2271 A 101 GLU H A 100 TRP H 1.0 . 4.90 2322 2272 A 33 ARG H A 101 GLU H 1.0 . 5.04 2323 2273 A 101 GLU H A 100 TRP HBx 1.0 . 4.74 2324 2274 A 101 GLU H A 31 ARG HBx 1.0 . 5.47 2325 2275 A 96 GLN H A 96 GLN HBy 1.0 . 3.42 2326 2276 A 96 GLN H A 96 GLN HBx 1.0 . 3.42 2327 2277 A 109 SER HA A 96 GLN H 1.0 . 5.36 2328 2278 A 101 GLU H A 32 GLY HAx 1.0 . 4.48 2329 2279 A 96 GLN H A 96 GLN HGx 1.0 . 4.58 2330 2280 A 101 GLU H A 100 TRP HE1 1.0 . 5.50 2331 2281 A 104 GLY HAy A 100 TRP HE1 1.0 . 5.49 2332 2282 A 106 PRO HDx A 100 TRP HE1 1.0 . 4.56 2333 2283 A 104 GLY HAx A 100 TRP HE1 1.0 . 4.24 2334 2284 A 105 ASP HA A 100 TRP HE1 1.0 . 4.39 2335 2285 A 100 TRP HBy A 100 TRP HE1 1.0 . 4.93 2336 2286 A 31 ARG HDx A 100 TRP HE1 1.0 . 4.57 2337 2287 A 104 GLY H A 100 TRP HE1 1.0 . 5.33 2338 2288 A 96 GLN H A 97 VAL H 1.0 . 4.94 2339 2289 A 110 VAL H A 97 VAL H 1.0 . 4.69 2340 2290 A 97 VAL H A 109 SER HBx 1.0 . 5.01 2341 2291 A 97 VAL H A 97 VAL HB 1.0 . 3.24 2342 2292 A 115 TYR H A 115 TYR HE% 1.0 . 5.50 2343 2293 A 115 TYR HBy A 115 TYR H 1.0 . 4.12 2344 2294 A 143 TYR H A 135 SER HA 1.0 . 4.35 2345 2295 A 143 TYR HBy A 143 TYR H 1.0 . 3.60 2346 2296 A 142 ARG HDx A 143 TYR H 1.0 . 5.50 2347 2297 A 143 TYR H A 142 ARG HBx 1.0 . 3.83 2348 2298 A 142 ARG HA A 143 TYR H 1.0 . 3.14 2349 2299 A 143 TYR HBx A 143 TYR H 1.0 . 3.54 2350 2300 A 135 SER H A 134 ASP H 1.0 . 5.16 2351 2301 A 133 TYR H A 134 ASP H 1.0 . 4.92 2352 2302 A 133 TYR HD% A 134 ASP H 1.0 . 4.31 2353 2303 A 133 TYR HA A 134 ASP H 1.0 . 2.97 2354 2304 A 133 TYR HBy A 134 ASP H 1.0 . 4.92 2355 2305 A 133 TYR HBx A 134 ASP H 1.0 . 4.63 2356 2306 A 134 ASP HBy A 134 ASP H 1.0 . 3.97 2357 2307 A 134 ASP HBx A 134 ASP H 1.0 . 3.85 2358 2308 A 42 LEU HDx% A 134 ASP H 1.0 . 5.50 2359 2309 A 44 ILE HD1% A 134 ASP H 1.0 . 5.50 2360 2310 A 116 THR H A 115 TYR H 1.0 . 5.26 2361 2311 A 135 SER H A 14 GLN HE2x 1.0 . 4.21 2362 2312 A 133 TYR HD% A 135 SER H 1.0 . 5.44 2363 2313 A 135 SER HBy A 135 SER H 1.0 . 3.74 2364 2314 A 135 SER H A 134 ASP HA 1.0 . 3.03 2365 2315 A 14 GLN HA A 135 SER H 1.0 . 5.43 2366 2316 A 136 GLU HA A 135 SER H 1.0 . 5.35 2367 2317 A 134 ASP HBx A 135 SER H 1.0 . 4.65 2368 2318 A 135 SER H A 136 GLU HBx 1.0 . 5.50 2369 2319 A 124 TRP HE1 A 46 GLY H 1.0 . 4.61 2370 2320 A 124 TRP HE1 A 45 ALA HA 1.0 . 4.67 2371 2321 A 124 TRP HE1 A 46 GLY HAy 1.0 . 5.11 2372 2322 A 124 TRP HE1 A 123 GLU HGx 1.0 . 5.12 2373 2323 A 124 TRP HE1 A 127 LEU HDx% 1.0 . 5.19 2374 2324 A 112 CYS H A 111 GLN H 1.0 . 5.12 2375 2325 A 124 TRP HE1 A 123 GLU HBx 1.0 . 5.50 2376 2326 A 110 VAL H A 111 GLN H 1.0 . 4.83 2377 2327 A 95 VAL H A 111 GLN H 1.0 . 4.98 2378 2328 A 111 GLN HBy A 111 GLN H 1.0 . 3.03 2379 2329 A 110 VAL HGy% A 111 GLN H 1.0 . 3.75 2380 2330 A 110 VAL HB A 111 GLN H 1.0 . 4.05 2381 2331 A 92 ALA H A 113 PHE HE% 1.0 . 5.16 2382 2332 A 92 ALA H A 91 THR H 1.0 . 5.47 2383 2333 A 36 THR H A 63 VAL H 1.0 . 3.78 2384 2334 A 40 PHE HD% A 63 VAL H 1.0 . 5.50 2385 2335 A 62 CYS HA A 63 VAL H 1.0 . 3.08 2386 2336 A 39 SER HA A 63 VAL H 1.0 . 4.51 2387 2337 A 62 CYS HBy A 63 VAL H 1.0 . 4.28 2388 2338 A 63 VAL HB A 63 VAL H 1.0 . 3.29 2389 2339 A 64 THR H A 63 VAL H 1.0 . 5.50 2390 2340 A 43 VAL H A 54 LEU H 1.0 . 5.50 2391 2341 A 54 LEU H A 53 LEU H 1.0 . 5.03 2392 2342 A 54 LEU H A 42 LEU HA 1.0 . 4.25 2393 2343 A 41 PRO HDx A 54 LEU H 1.0 . 4.92 2394 2344 A 54 LEU H A 54 LEU HBy 1.0 . 3.70 2395 2345 A 54 LEU H A 41 PRO HBy 1.0 . 4.81 2396 2346 A 92 ALA H A 113 PHE HD% 1.0 . 4.91 2397 2347 A 111 GLN HA A 95 VAL H 1.0 . 4.19 2398 2348 A 95 VAL H A 109 SER HBx 1.0 . 4.87 2399 2349 A 95 VAL HB A 95 VAL H 1.0 . 3.24 2400 2350 A 95 VAL H A 37 VAL HGx% 1.0 . 4.91 2401 2350 A 37 VAL HGy% A 95 VAL H 1.0 . 4.91 2402 2351 A 96 GLN H A 95 VAL H 1.0 . 5.49 2403 2352 A 29 ALA H A 30 PHE H 1.0 . 4.37 2404 2353 A 31 ARG H A 30 PHE H 1.0 . 4.94 2405 2354 A 68 TYR HE% A 30 PHE H 1.0 . 4.65 2406 2355 A 68 TYR HD% A 30 PHE H 1.0 . 4.44 2407 2356 A 30 PHE HBy A 30 PHE H 1.0 . 3.37 2408 2357 A 30 PHE H A 30 PHE HBx 1.0 . 3.30 2409 2358 A 100 TRP H A 100 TRP HE3 1.0 . 5.50 2410 2359 A 100 TRP H A 100 TRP HD1 1.0 . 5.50 2411 2360 A 100 TRP H A 100 TRP HBy 1.0 . 3.55 2412 2361 A 100 TRP H A 100 TRP HBx 1.0 . 3.65 2413 2362 A 100 TRP H A 99 GLU HGx 1.0 . 4.25 2414 2363 A 100 TRP H A 99 GLU HBy 1.0 . 4.14 2415 2364 A 100 TRP H A 99 GLU HBx 1.0 . 4.14 2416 2365 A 97 VAL HGx% A 100 TRP H 1.0 . 4.60 2417 2366 A 100 TRP H A 99 GLU H 1.0 . 4.61 2418 2367 A 45 ALA H A 52 TRP H 1.0 . 4.86 2419 2368 A 45 ALA H A 44 ILE H 1.0 . 5.50 2420 2369 A 45 ALA H A 50 ILE H 1.0 . 4.15 2421 2370 A 45 ALA H A 52 TRP HD1 1.0 . 3.61 2422 2371 A 45 ALA H A 51 PRO HA 1.0 . 4.17 2423 2372 A 45 ALA H A 44 ILE HA 1.0 . 3.01 2424 2373 A 45 ALA H A 43 VAL HGx% 1.0 . 5.01 2425 2374 A 45 ALA H A 52 TRP HBy 1.0 . 5.50 2426 2375 A 95 VAL HGy% A 5 PHE H 1.0 . 5.50 2427 2376 A 5 PHE H A 113 PHE HA 1.0 . 5.50 2428 2377 A 149 ARG H A 148 ASN H 1.0 . 3.51 2429 2378 A 146 ARG H A 149 ARG H 1.0 . 5.48 2430 2379 A 146 ARG HA A 149 ARG H 1.0 . 5.50 2431 2380 A 149 ARG HDy A 149 ARG H 1.0 . 5.03 2432 2381 A 148 ASN HBx A 149 ARG H 1.0 . 4.81 2433 2382 A 149 ARG HBx A 149 ARG H 1.0 . 3.48 2434 2383 A 146 ARG HGy A 149 ARG H 1.0 . 3.68 2435 2384 A 148 ASN HBy A 149 ARG H 1.0 . 4.65 2436 2385 A 4 ILE H A 5 PHE H 1.0 . 5.50 2437 2386 A 5 PHE H A 6 VAL H 1.0 . 5.12 2438 2387 A 5 PHE H A 4 ILE HA 1.0 . 3.24 2439 2388 A 5 PHE H A 5 PHE HBx 1.0 . 3.56 2440 2389 A 5 PHE H A 112 CYS HBy 1.0 . 4.03 2441 2390 A 5 PHE H A 112 CYS HBx 1.0 . 4.70 2442 2391 A 5 PHE H A 4 ILE HG1y 1.0 . 4.88 2443 2392 A 5 PHE H A 4 ILE HG1x 1.0 . 4.09 2444 2393 A 5 PHE H A 4 ILE HG2% 1.0 . 4.97 2445 2394 A 77 PHE HD% A 81 PHE H 1.0 . 5.23 2446 2395 A 29 ALA H A 68 TYR HD% 1.0 . 4.50 2447 2396 A 28 ALA HA A 29 ALA H 1.0 . 2.96 2448 2397 A 29 ALA H A 68 TYR HA 1.0 . 4.83 2449 2398 A 29 ALA H A 68 TYR HBy 1.0 . 4.75 2450 2399 A 29 ALA H A 69 GLU HBy 1.0 . 4.54 2451 2400 A 81 PHE HD% A 81 PHE H 1.0 . 4.75 2452 2401 A 79 ASP HA A 81 PHE H 1.0 . 5.50 2453 2402 A 81 PHE HBy A 81 PHE H 1.0 . 3.29 2454 2403 A 81 PHE H A 81 PHE HBx 1.0 . 3.46 2455 2404 A 82 GLU HBx A 81 PHE H 1.0 . 5.49 2456 2405 A 77 PHE HA A 81 PHE H 1.0 . 5.47 2457 2406 A 144 ASN H A 143 TYR H 1.0 . 5.04 2458 2407 A 144 ASN H A 48 HIS HA 1.0 . 4.29 2459 2408 A 144 ASN H A 143 TYR HA 1.0 . 3.02 2460 2409 A 144 ASN H A 143 TYR HBy 1.0 . 4.50 2461 2410 A 144 ASN H A 144 ASN HBy 1.0 . 3.81 2462 2411 A 144 ASN H A 49 ASN HBx 1.0 . 5.50 2463 2412 A 144 ASN H A 50 ILE HG1y 1.0 . 5.50 2464 2413 A 144 ASN H A 145 PRO HA 1.0 . 5.50 2465 2414 A 115 TYR HD% A 91 THR H 1.0 . 5.50 2466 2415 A 114 VAL H A 91 THR H 1.0 . 3.63 2467 2416 A 91 THR H A 115 TYR HA 1.0 . 4.48 2468 2417 A 91 THR H A 90 ARG HA 1.0 . 2.91 2469 2418 A 90 ARG HDy A 91 THR H 1.0 . 5.23 2470 2419 A 91 THR H A 90 ARG HBx 1.0 . 5.11 2471 2420 A 91 THR HG2% A 91 THR H 1.0 . 4.60 2472 2421 A 90 ARG HGx A 91 THR H 1.0 . 4.39 2473 2422 A 31 ARG H A 68 TYR HA 1.0 . 3.84 2474 2423 A 31 ARG H A 31 ARG HBy 1.0 . 4.01 2475 2424 A 31 ARG HDy A 31 ARG H 1.0 . 4.74 2476 2425 A 31 ARG H A 30 PHE HBx 1.0 . 5.50 2477 2426 A 31 ARG H A 67 ILE H 1.0 . 5.50 2478 2427 A 53 LEU H A 116 THR HA 1.0 . 4.85 2479 2428 A 53 LEU H A 52 TRP H 1.0 . 4.58 2480 2429 A 88 TYR HE% A 53 LEU H 1.0 . 4.32 2481 2430 A 52 TRP HBy A 53 LEU H 1.0 . 4.41 2482 2431 A 53 LEU HBy A 53 LEU H 1.0 . 3.83 2483 2432 A 117 THR HG2% A 53 LEU H 1.0 . 5.50 2484 2433 A 54 LEU HDy% A 53 LEU H 1.0 . 5.50 2485 2434 A 53 LEU HBx A 53 LEU H 1.0 . 3.81 2486 2435 A 53 LEU H A 53 LEU HG 1.0 . 5.50 2487 2436 A 28 ALA HA A 69 GLU H 1.0 . 4.92 2488 2437 A 31 ARG H A 69 GLU H 1.0 . 4.59 2489 2438 A 69 GLU H A 31 ARG HE 1.0 . 5.50 2490 2439 A 69 GLU H A 68 TYR HD% 1.0 . 4.59 2491 2440 A 3 HIS HD2 A 69 GLU H 1.0 . 5.12 2492 2441 A 69 GLU H A 68 TYR HA 1.0 . 3.09 2493 2442 A 31 ARG HDy A 69 GLU H 1.0 . 5.50 2494 2443 A 68 TYR HBx A 69 GLU H 1.0 . 3.91 2495 2444 A 69 GLU H A 69 GLU HBy 1.0 . 3.43 2496 2445 A 69 GLU H A 29 ALA HB% 1.0 . 3.85 2497 2446 A 69 GLU H A 70 VAL HGx% 1.0 . 5.25 2498 2447 A 90 ARG H A 90 ARG HE 1.0 . 5.50 2499 2448 A 90 ARG HGx A 90 ARG H 1.0 . 5.14 2500 2449 A 115 TYR HD% A 90 ARG H 1.0 . 5.45 2501 2450 A 90 ARG H A 89 GLN H 1.0 . 4.98 2502 2451 A 90 ARG H A 115 TYR HE% 1.0 . 5.45 2503 2452 A 90 ARG H A 85 PRO HA 1.0 . 5.50 2504 2453 A 90 ARG H A 89 GLN HBy 1.0 . 4.29 2505 2454 A 90 ARG H A 91 THR H 1.0 . 5.02 2506 2455 A 90 ARG H A 89 GLN HA 1.0 . 3.20 2507 2456 A 90 ARG H A 84 CYS HBy 1.0 . 5.50 2508 2457 A 90 ARG H A 89 GLN HGx 1.0 . 4.90 2509 2457 A 90 ARG H A 89 GLN HGy 1.0 . 4.90 2510 2458 A 90 ARG H A 89 GLN HBx 1.0 . 3.94 2511 2459 A 90 ARG H A 90 ARG HBy 1.0 . 3.45 2512 2460 A 90 ARG H A 90 ARG HBx 1.0 . 3.65 2513 2461 A 90 ARG H A 90 ARG HGy 1.0 . 5.11 2514 2462 A 4 ILE H A 68 TYR H 1.0 . 3.87 2515 2463 A 68 TYR H A 5 PHE HA 1.0 . 4.25 2516 2464 A 68 TYR H A 67 ILE HA 1.0 . 3.08 2517 2465 A 68 TYR H A 68 TYR HBy 1.0 . 3.90 2518 2466 A 68 TYR H A 4 ILE HG1y 1.0 . 4.59 2519 2467 A 67 ILE HB A 68 TYR H 1.0 . 4.79 2520 2468 A 124 TRP H A 123 GLU HBx 1.0 . 4.29 2521 2469 A 125 LEU HBy A 124 TRP H 1.0 . 5.09 2522 2470 A 55 TYR H A 117 THR H 1.0 . 4.18 2523 2471 A 55 TYR H A 55 TYR HD% 1.0 . 4.89 2524 2472 A 55 TYR H A 118 ALA HA 1.0 . 4.32 2525 2473 A 116 THR HB A 55 TYR H 1.0 . 4.42 2526 2474 A 55 TYR H A 55 TYR HBy 1.0 . 3.53 2527 2475 A 55 TYR H A 55 TYR HBx 1.0 . 3.49 2528 2476 A 55 TYR H A 117 THR HG2% 1.0 . 4.22 2529 2477 A 55 TYR H A 116 THR HG2% 1.0 . 5.50 2530 2478 A 55 TYR H A 54 LEU HBx 1.0 . 4.03 2531 2479 A 23 HIS HD2 A 23 HIS H 1.0 . 4.87 2532 2480 A 22 ASP HA A 23 HIS H 1.0 . 2.96 2533 2481 A 23 HIS HBx A 23 HIS H 1.0 . 3.48 2534 2482 A 22 ASP HBx A 23 HIS H 1.0 . 4.39 2535 2483 A 124 TRP HE1 A 124 TRP H 1.0 . 5.50 2536 2484 A 124 TRP H A 125 LEU H 1.0 . 3.28 2537 2485 A 124 TRP H A 122 PRO HA 1.0 . 4.26 2538 2486 A 124 TRP HBy A 124 TRP H 1.0 . 3.27 2539 2487 A 124 TRP H A 124 TRP HBx 1.0 . 3.58 2540 2488 A 124 TRP H A 123 GLU HGx 1.0 . 4.39 2541 2489 A 124 TRP H A 127 LEU HG 1.0 . 5.07 2542 2490 A 124 TRP H A 125 LEU HDx% 1.0 . 4.96 2543 2491 A 43 VAL H A 52 TRP H 1.0 . 3.90 2544 2492 A 51 PRO HA A 52 TRP H 1.0 . 3.11 2545 2493 A 44 ILE HA A 52 TRP H 1.0 . 4.17 2546 2494 A 52 TRP HBy A 52 TRP H 1.0 . 3.67 2547 2495 A 51 PRO HBx A 52 TRP H 1.0 . 4.19 2548 2496 A 50 ILE HG2% A 52 TRP H 1.0 . 5.50 2549 2497 A 44 ILE H A 43 VAL HA 1.0 . 3.19 2550 2498 A 43 VAL HB A 44 ILE H 1.0 . 3.59 2551 2499 A 44 ILE HB A 44 ILE H 1.0 . 3.62 2552 2500 A 44 ILE HG1x A 44 ILE H 1.0 . 4.88 2553 2501 A 44 ILE H A 45 ALA HB% 1.0 . 5.50 2554 2502 A 28 ALA H A 29 ALA HA 1.0 . 5.50 2555 2503 A 28 ALA H A 29 ALA H 1.0 . 4.57 2556 2504 A 28 ALA H A 74 MET HE% 1.0 . 4.84 2557 2505 A 28 ALA H A 27 LEU HDx% 1.0 . 4.31 2558 2506 A 125 LEU HA A 127 LEU H 1.0 . 4.60 2559 2507 A 127 LEU H A 126 PHE HBx 1.0 . 4.63 2560 2508 A 127 LEU HBy A 127 LEU H 1.0 . 3.23 2561 2509 A 127 LEU HG A 127 LEU H 1.0 . 3.36 2562 2510 A 127 LEU HBx A 127 LEU H 1.0 . 3.69 2563 2511 A 127 LEU HDx% A 127 LEU H 1.0 . 4.19 2564 2512 A 93 LEU H A 91 THR HB 1.0 . 5.50 2565 2513 A 78 LEU H A 77 PHE HBy 1.0 . 3.65 2566 2514 A 78 LEU HBy A 78 LEU H 1.0 . 3.53 2567 2515 A 78 LEU HBx A 78 LEU H 1.0 . 3.94 2568 2516 A 111 GLN HA A 93 LEU H 1.0 . 5.39 2569 2517 A 112 CYS HBx A 93 LEU H 1.0 . 5.50 2570 2518 A 92 ALA H A 93 LEU H 1.0 . 5.30 2571 2519 A 93 LEU H A 94 GLN H 1.0 . 4.94 2572 2520 A 113 PHE HD% A 93 LEU H 1.0 . 5.30 2573 2521 A 93 LEU H A 111 GLN HGy 1.0 . 4.24 2574 2521 A 93 LEU H A 111 GLN HGx 1.0 . 4.24 2575 2522 A 93 LEU HBy A 93 LEU H 1.0 . 4.12 2576 2523 A 93 LEU HBx A 93 LEU H 1.0 . 3.44 2577 2524 A 95 VAL HGy% A 93 LEU H 1.0 . 5.50 2578 2525 A 112 CYS H A 111 GLN HGy 1.0 . 3.74 2579 2525 A 112 CYS H A 111 GLN HGx 1.0 . 3.74 2580 2526 A 112 CYS H A 92 ALA HA 1.0 . 5.50 2581 2527 A 93 LEU HDx% A 112 CYS H 1.0 . 5.50 2582 2528 A 110 VAL HGx% A 112 CYS H 1.0 . 5.50 2583 2529 A 112 CYS H A 93 LEU H 1.0 . 3.97 2584 2530 A 94 GLN HA A 112 CYS H 1.0 . 4.13 2585 2531 A 86 SER H A 85 PRO HDx 1.0 . 3.99 2586 2532 A 130 HIS HA A 131 GLU H 1.0 . 3.01 2587 2533 A 131 GLU H A 130 HIS HBx 1.0 . 4.41 2588 2534 A 131 GLU H A 131 GLU HBy 1.0 . 3.73 2589 2535 A 42 LEU HDx% A 131 GLU H 1.0 . 5.50 2590 2536 A 87 MET H A 86 SER H 1.0 . 3.41 2591 2537 A 86 SER HBx A 86 SER H 1.0 . 3.40 2592 2538 A 85 PRO HBy A 86 SER H 1.0 . 4.55 2593 2539 A 86 SER H A 85 PRO HGx 1.0 . 4.62 2594 2540 A 130 HIS H A 42 LEU H 1.0 . 4.37 2595 2541 A 130 HIS H A 129 TYR HA 1.0 . 3.06 2596 2542 A 130 HIS H A 43 VAL HA 1.0 . 4.58 2597 2543 A 41 PRO HA A 130 HIS H 1.0 . 5.50 2598 2544 A 130 HIS H A 129 TYR HBy 1.0 . 4.13 2599 2545 A 130 HIS H A 130 HIS HBy 1.0 . 4.02 2600 2546 A 130 HIS H A 129 TYR HBx 1.0 . 4.62 2601 2547 A 130 HIS H A 130 HIS HBx 1.0 . 3.50 2602 2548 A 130 HIS H A 42 LEU HBy 1.0 . 4.03 2603 2549 A 133 TYR HD% A 133 TYR H 1.0 . 4.83 2604 2550 A 132 SER HA A 133 TYR H 1.0 . 3.21 2605 2551 A 133 TYR H A 132 SER HBx 1.0 . 3.86 2606 2552 A 133 TYR HBy A 133 TYR H 1.0 . 3.71 2607 2553 A 133 TYR HBx A 133 TYR H 1.0 . 3.94 2608 2554 A 133 TYR H A 63 VAL HGx% 1.0 . 5.50 2609 2555 A 27 LEU H A 71 ASP H 1.0 . 4.07 2610 2556 A 27 LEU H A 28 ALA H 1.0 . 4.74 2611 2557 A 27 LEU H A 26 GLY H 1.0 . 4.98 2612 2558 A 27 LEU H A 70 VAL HA 1.0 . 5.50 2613 2559 A 27 LEU H A 74 MET HA 1.0 . 5.50 2614 2560 A 27 LEU H A 26 GLY HAx 1.0 . 3.20 2615 2561 A 27 LEU H A 71 ASP HBx 1.0 . 5.50 2616 2562 A 27 LEU H A 74 MET HBy 1.0 . 4.10 2617 2563 A 27 LEU H A 74 MET HBx 1.0 . 3.61 2618 2564 A 142 ARG H A 143 TYR H 1.0 . 4.87 2619 2565 A 49 ASN HD2y A 142 ARG H 1.0 . 4.67 2620 2566 A 49 ASN HD2x A 142 ARG H 1.0 . 4.58 2621 2567 A 141 LEU HA A 142 ARG H 1.0 . 2.99 2622 2568 A 142 ARG H A 140 GLY HAy 1.0 . 5.50 2623 2569 A 142 ARG HDx A 142 ARG H 1.0 . 4.53 2624 2570 A 142 ARG H A 142 ARG HBx 1.0 . 2.95 2625 2571 A 141 LEU HBx A 142 ARG H 1.0 . 4.95 2626 2572 A 141 LEU HBy A 142 ARG H 1.0 . 5.36 2627 2573 A 63 VAL HGy% A 62 CYS H 1.0 . 5.50 2628 2574 A 40 PHE H A 62 CYS H 1.0 . 5.50 2629 2575 A 62 CYS H A 63 VAL H 1.0 . 4.90 2630 2576 A 62 CYS H A 61 HIS HA 1.0 . 3.01 2631 2577 A 61 HIS HBy A 62 CYS H 1.0 . 3.17 2632 2578 A 62 CYS H A 39 SER HBy 1.0 . 4.67 2633 2579 A 61 HIS HBx A 62 CYS H 1.0 . 3.68 2634 2580 A 62 CYS HBx A 62 CYS H 1.0 . 3.26 2635 2581 A 131 GLU HGx A 62 CYS H 1.0 . 4.41 2636 2582 A 39 SER HA A 62 CYS H 1.0 . 4.66 2637 2583 A 27 LEU H A 71 ASP HBy 1.0 . 5.50 2638 2584 A 70 VAL HA A 74 MET H 1.0 . 5.50 2639 2585 A 26 GLY HAx A 74 MET H 1.0 . 4.05 2640 2586 A 26 GLY HAy A 74 MET H 1.0 . 4.51 2641 2587 A 74 MET H A 74 MET HGx 1.0 . 4.92 2642 2588 A 74 MET HBy A 74 MET H 1.0 . 3.41 2643 2589 A 74 MET H A 74 MET HBx 1.0 . 3.15 2644 2590 A 74 MET H A 70 VAL HGx% 1.0 . 5.50 2645 2591 A 115 TYR H A 114 VAL H 1.0 . 5.44 2646 2592 A 113 PHE HD% A 114 VAL H 1.0 . 4.17 2647 2593 A 113 PHE HA A 114 VAL H 1.0 . 3.01 2648 2594 A 114 VAL H A 91 THR HB 1.0 . 5.05 2649 2595 A 113 PHE HBy A 114 VAL H 1.0 . 4.46 2650 2596 A 113 PHE HBx A 114 VAL H 1.0 . 4.00 2651 2597 A 114 VAL H A 114 VAL HGx% 1.0 . 3.89 2652 2598 A 90 ARG HGx A 114 VAL H 1.0 . 4.91 2653 2599 A 114 VAL H A 113 PHE H 1.0 . 4.88 2654 2600 A 74 MET H A 70 VAL HGy% 1.0 . 5.50 2655 2601 A 37 VAL H A 36 THR HB 1.0 . 4.30 2656 2602 A 37 VAL H A 95 VAL HA 1.0 . 3.81 2657 2603 A 37 VAL HB A 37 VAL H 1.0 . 3.63 2658 2604 A 96 GLN H A 37 VAL H 1.0 . 4.41 2659 2605 A 91 THR HG2% A 114 VAL H 1.0 . 5.50 2660 2606 A 59 LYS H A 40 PHE HA 1.0 . 4.28 2661 2607 A 68 TYR H A 67 ILE H 1.0 . 5.05 2662 2608 A 30 PHE HE% A 67 ILE H 1.0 . 4.82 2663 2609 A 30 PHE HD% A 67 ILE H 1.0 . 5.50 2664 2610 A 67 ILE HG1y A 67 ILE H 1.0 . 3.98 2665 2611 A 67 ILE HB A 67 ILE H 1.0 . 3.43 2666 2612 A 59 LYS H A 58 GLY H 1.0 . 3.15 2667 2613 A 39 SER H A 59 LYS H 1.0 . 5.12 2668 2614 A 39 SER HBx A 59 LYS H 1.0 . 4.48 2669 2615 A 59 LYS HBy A 59 LYS H 1.0 . 3.18 2670 2616 A 59 LYS H A 59 LYS HGx 1.0 . 4.25 2671 2617 A 59 LYS H A 60 GLY H 1.0 . 4.60 2672 2618 A 88 TYR H A 87 MET H 1.0 . 3.22 2673 2619 A 87 MET H A 85 PRO HA 1.0 . 5.50 2674 2620 A 87 MET H A 84 CYS HA 1.0 . 4.22 2675 2621 A 86 SER HBx A 87 MET H 1.0 . 3.40 2676 2622 A 83 ASP HBy A 87 MET H 1.0 . 4.24 2677 2623 A 87 MET HBx A 87 MET H 1.0 . 3.19 2678 2624 A 62 CYS H A 61 HIS H 1.0 . 4.82 2679 2625 A 40 PHE H A 61 HIS H 1.0 . 3.70 2680 2626 A 61 HIS H A 61 HIS HD2 1.0 . 4.37 2681 2627 A 39 SER HA A 61 HIS H 1.0 . 4.90 2682 2628 A 41 PRO HA A 61 HIS H 1.0 . 4.31 2683 2629 A 129 TYR HBy A 61 HIS H 1.0 . 5.13 2684 2630 A 60 GLY HAx A 61 HIS H 1.0 . 3.18 2685 2631 A 60 GLY HAy A 61 HIS H 1.0 . 3.38 2686 2632 A 39 SER HBx A 61 HIS H 1.0 . 4.69 2687 2633 A 61 HIS HBx A 61 HIS H 1.0 . 3.80 2688 2634 A 63 VAL HGy% A 61 HIS H 1.0 . 5.22 2689 2635 A 31 ARG HE A 31 ARG HBy 1.0 . 5.50 2690 2636 A 31 ARG HA A 31 ARG HE 1.0 . 5.50 2691 2637 A 6 VAL HGy% A 66 GLU H 1.0 . 5.50 2692 2638 A 16 ASN HBx A 17 HIS H 1.0 . 4.92 2693 2639 A 76 ARG HE A 72 GLU HBx 1.0 . 5.50 2694 2640 A 44 ILE HA A 50 ILE H 1.0 . 5.31 2695 2641 A 11 LYS HBy A 66 GLU H 1.0 . 5.50 2696 2642 A 6 VAL H A 66 GLU H 1.0 . 4.09 2697 2643 A 68 TYR HE% A 66 GLU H 1.0 . 5.10 2698 2644 A 6 VAL HB A 66 GLU H 1.0 . 4.62 2699 2645 A 11 LYS HBx A 66 GLU H 1.0 . 5.35 2700 2646 A 11 LYS HGy A 66 GLU H 1.0 . 5.50 2701 2647 A 17 HIS H A 16 ASN H 1.0 . 3.07 2702 2648 A 17 HIS H A 17 HIS HD2 1.0 . 5.24 2703 2649 A 17 HIS HBy A 17 HIS H 1.0 . 3.27 2704 2650 A 17 HIS HBx A 17 HIS H 1.0 . 3.37 2705 2651 A 17 HIS H A 18 LYS HGy 1.0 . 5.50 2706 2651 A 18 LYS HGx A 17 HIS H 1.0 . 5.50 2707 2652 A 76 ARG HE A 76 ARG HBy 1.0 . 5.32 2708 2653 A 48 HIS H A 50 ILE H 1.0 . 4.10 2709 2654 A 48 HIS HBy A 50 ILE H 1.0 . 5.17 2710 2655 A 49 ASN HBx A 50 ILE H 1.0 . 5.46 2711 2656 A 50 ILE HB A 50 ILE H 1.0 . 3.29 2712 2657 A 50 ILE H A 50 ILE HG1x 1.0 . 4.56 2713 2658 A 12 ARG H A 11 LYS H 1.0 . 4.55 2714 2659 A 12 ARG HDx A 12 ARG H 1.0 . 4.94 2715 2660 A 12 ARG H A 12 ARG HBy 1.0 . 3.08 2716 2661 A 12 ARG HBx A 12 ARG H 1.0 . 3.86 2717 2662 A 12 ARG H A 12 ARG HGx 1.0 . 4.28 2718 2663 A 12 ARG HDy A 12 ARG H 1.0 . 5.31 2719 2664 A 5 PHE HA A 66 GLU H 1.0 . 5.50 2720 2665 A 50 ILE H A 48 HIS HBx 1.0 . 5.50 2721 2666 A 146 ARG H A 147 GLU H 1.0 . 3.69 2722 2667 A 146 ARG HA A 147 GLU H 1.0 . 3.06 2723 2668 A 148 ASN HBx A 147 GLU H 1.0 . 5.50 2724 2669 A 77 PHE H A 78 LEU H 1.0 . 3.49 2725 2670 A 74 MET HA A 77 PHE H 1.0 . 4.20 2726 2671 A 77 PHE H A 77 PHE HBx 1.0 . 3.14 2727 2672 A 77 PHE H A 76 ARG HBy 1.0 . 3.55 2728 2673 A 71 ASP H A 28 ALA HA 1.0 . 4.91 2729 2674 A 71 ASP H A 74 MET HBx 1.0 . 4.11 2730 2675 A 71 ASP H A 75 LEU H 1.0 . 4.06 2731 2676 A 71 ASP H A 27 LEU HA 1.0 . 5.24 2732 2677 A 71 ASP H A 71 ASP HBx 1.0 . 3.92 2733 2678 A 71 ASP H A 74 MET HGx 1.0 . 4.81 2734 2679 A 71 ASP H A 70 VAL HB 1.0 . 3.27 2735 2680 A 75 LEU H A 75 LEU HBx 1.0 . 3.21 2736 2681 A 75 LEU H A 70 VAL HGx% 1.0 . 5.50 2737 2682 A 74 MET H A 75 LEU H 1.0 . 3.69 2738 2683 A 76 ARG H A 75 LEU H 1.0 . 3.58 2739 2684 A 74 MET HBy A 75 LEU H 1.0 . 3.86 2740 2685 A 75 LEU H A 74 MET HBx 1.0 . 4.50 2741 2686 A 33 ARG HBx A 33 ARG HE 1.0 . 4.96 2742 2687 A 76 ARG H A 79 ASP H 1.0 . 5.50 2743 2688 A 79 ASP H A 78 LEU H 1.0 . 3.54 2744 2689 A 79 ASP H A 80 ASP H 1.0 . 3.49 2745 2690 A 79 ASP H A 115 TYR HE% 1.0 . 5.13 2746 2691 A 76 ARG HA A 79 ASP H 1.0 . 3.96 2747 2692 A 79 ASP H A 79 ASP HBy 1.0 . 3.38 2748 2693 A 79 ASP HBx A 79 ASP H 1.0 . 3.60 2749 2694 A 78 LEU HBy A 79 ASP H 1.0 . 3.87 2750 2695 A 79 ASP H A 78 LEU HG 1.0 . 5.50 2751 2696 A 78 LEU HBx A 79 ASP H 1.0 . 4.28 2752 2697 A 78 LEU HDy% A 79 ASP H 1.0 . 5.27 2753 2698 A 147 GLU HA A 148 ASN H 1.0 . 3.45 2754 2699 A 146 ARG HA A 148 ASN H 1.0 . 4.93 2755 2700 A 148 ASN HBy A 148 ASN H 1.0 . 3.97 2756 2701 A 148 ASN HBx A 148 ASN H 1.0 . 3.47 2757 2702 A 147 GLU HGy A 148 ASN H 1.0 . 4.63 2758 2703 A 147 GLU HBx A 148 ASN H 1.0 . 4.12 2759 2704 A 149 ARG HBx A 148 ASN H 1.0 . 5.50 2760 2705 A 71 ASP HA A 75 LEU H 1.0 . 5.50 2761 2706 A 130 HIS H A 129 TYR H 1.0 . 4.78 2762 2707 A 129 TYR HD% A 129 TYR H 1.0 . 3.96 2763 2708 A 129 TYR HBy A 129 TYR H 1.0 . 3.77 2764 2709 A 129 TYR HBx A 129 TYR H 1.0 . 3.35 2765 2710 A 129 TYR H A 128 PRO HBy 1.0 . 3.73 2766 2711 A 146 ARG H A 145 PRO HDx 1.0 . 5.50 2767 2712 A 6 VAL HB A 10 LEU H 1.0 . 5.49 2768 2713 A 98 LEU HDy% A 33 ARG HE 1.0 . 5.50 2769 2714 A 146 ARG H A 145 PRO HGx 1.0 . 3.75 2770 2715 A 146 ARG H A 146 ARG HBx 1.0 . 3.22 2771 2716 A 74 MET HA A 73 GLN H 1.0 . 5.50 2772 2717 A 71 ASP HBx A 73 GLN H 1.0 . 4.78 2773 2718 A 105 ASP H A 100 TRP HE1 1.0 . 4.58 2774 2719 A 104 GLY H A 105 ASP H 1.0 . 3.41 2775 2720 A 104 GLY HAy A 105 ASP H 1.0 . 3.37 2776 2721 A 105 ASP HBy A 105 ASP H 1.0 . 2.96 2777 2722 A 105 ASP HBx A 105 ASP H 1.0 . 2.97 2778 2723 A 106 PRO HDx A 105 ASP H 1.0 . 5.07 2779 2724 A 70 VAL H A 3 HIS HA 1.0 . 4.14 2780 2725 A 70 VAL H A 69 GLU HA 1.0 . 3.03 2781 2726 A 70 VAL H A 69 GLU HBy 1.0 . 4.63 2782 2727 A 4 ILE H A 70 VAL H 1.0 . 5.29 2783 2728 A 71 ASP H A 70 VAL H 1.0 . 5.07 2784 2729 A 73 GLN H A 74 MET H 1.0 . 3.39 2785 2730 A 73 GLN H A 72 GLU H 1.0 . 3.44 2786 2731 A 71 ASP HA A 73 GLN H 1.0 . 4.86 2787 2732 A 26 GLY HAx A 73 GLN H 1.0 . 5.24 2788 2733 A 73 GLN HBx A 73 GLN H 1.0 . 2.83 2789 2734 A 70 VAL H A 69 GLU H 1.0 . 5.50 2790 2735 A 84 CYS H A 82 GLU H 1.0 . 4.59 2791 2736 A 84 CYS H A 115 TYR HE% 1.0 . 5.49 2792 2737 A 84 CYS H A 85 PRO HA 1.0 . 4.93 2793 2738 A 84 CYS H A 80 ASP HA 1.0 . 4.43 2794 2739 A 84 CYS H A 83 ASP HA 1.0 . 3.10 2795 2740 A 83 ASP HBy A 84 CYS H 1.0 . 4.85 2796 2741 A 84 CYS H A 84 CYS HBy 1.0 . 3.80 2797 2742 A 84 CYS H A 84 CYS HBx 1.0 . 3.48 2798 2743 A 88 TYR H A 84 CYS H 1.0 . 5.37 2799 2744 A 108 ASP H A 97 VAL HGy% 1.0 . 5.50 2800 2745 A 84 CYS H A 87 MET H 1.0 . 4.38 2801 2746 A 40 PHE HZ A 94 GLN H 1.0 . 5.50 2802 2747 A 94 GLN H A 93 LEU HA 1.0 . 3.03 2803 2748 A 94 GLN HBx A 94 GLN H 1.0 . 3.07 2804 2749 A 93 LEU HBy A 94 GLN H 1.0 . 3.67 2805 2750 A 93 LEU HBx A 94 GLN H 1.0 . 3.71 2806 2751 A 95 VAL HGy% A 94 GLN H 1.0 . 5.50 2807 2752 A 40 PHE H A 40 PHE HD% 1.0 . 4.24 2808 2753 A 62 CYS HA A 40 PHE H 1.0 . 3.98 2809 2754 A 39 SER HA A 40 PHE H 1.0 . 2.90 2810 2755 A 60 GLY HAx A 40 PHE H 1.0 . 4.82 2811 2756 A 40 PHE H A 39 SER HBy 1.0 . 3.62 2812 2757 A 40 PHE HBx A 40 PHE H 1.0 . 3.84 2813 2758 A 109 SER H A 108 ASP H 1.0 . 3.17 2814 2759 A 108 ASP H A 107 GLY HAx 1.0 . 2.99 2815 2760 A 107 GLY HAy A 108 ASP H 1.0 . 3.27 2816 2761 A 108 ASP H A 109 SER HA 1.0 . 5.50 2817 2762 A 116 THR H A 91 THR H 1.0 . 4.45 2818 2763 A 115 TYR HD% A 116 THR H 1.0 . 4.92 2819 2764 A 116 THR H A 115 TYR HA 1.0 . 3.04 2820 2765 A 88 TYR HBy A 116 THR H 1.0 . 4.88 2821 2766 A 115 TYR HBx A 116 THR H 1.0 . 4.54 2822 2767 A 38 GLU H A 40 PHE HD% 1.0 . 5.11 2823 2768 A 38 GLU H A 36 THR HG2% 1.0 . 5.50 2824 2769 A 39 SER H A 38 GLU H 1.0 . 4.69 2825 2770 A 38 GLU H A 37 VAL H 1.0 . 3.45 2826 2771 A 38 GLU H A 36 THR HB 1.0 . 3.86 2827 2772 A 38 GLU H A 36 THR HA 1.0 . 4.52 2828 2773 A 38 GLU H A 38 GLU HBy 1.0 . 3.10 2829 2774 A 38 GLU H A 38 GLU HBx 1.0 . 3.73 2830 2775 A 38 GLU H A 37 VAL HGx% 1.0 . 4.02 2831 2775 A 38 GLU H A 37 VAL HGy% 1.0 . 4.02 2832 2776 A 113 PHE HBy A 113 PHE H 1.0 . 3.62 2833 2777 A 112 CYS HBx A 113 PHE H 1.0 . 4.45 2834 2778 A 4 ILE HB A 113 PHE H 1.0 . 5.26 2835 2779 A 39 SER H A 40 PHE H 1.0 . 4.89 2836 2780 A 80 ASP H A 81 PHE HBx 1.0 . 5.40 2837 2781 A 93 LEU HDy% A 113 PHE H 1.0 . 5.50 2838 2782 A 39 SER H A 58 GLY H 1.0 . 4.31 2839 2783 A 39 SER H A 38 GLU HA 1.0 . 2.90 2840 2784 A 39 SER H A 38 GLU HBy 1.0 . 4.55 2841 2785 A 39 SER H A 37 VAL HGx% 1.0 . 5.50 2842 2785 A 39 SER H A 37 VAL HGy% 1.0 . 5.50 2843 2786 A 80 ASP H A 78 LEU H 1.0 . 5.31 2844 2787 A 80 ASP H A 81 PHE H 1.0 . 3.38 2845 2788 A 77 PHE HA A 80 ASP H 1.0 . 4.37 2846 2789 A 80 ASP H A 78 LEU HA 1.0 . 4.71 2847 2790 A 80 ASP H A 79 ASP HBy 1.0 . 3.76 2848 2791 A 80 ASP H A 80 ASP HBy 1.0 . 3.02 2849 2792 A 113 PHE HE% A 3 HIS H 1.0 . 5.49 2850 2793 A 113 PHE HD% A 3 HIS H 1.0 . 5.50 2851 2794 A 3 HIS H A 2 ALA HA 1.0 . 3.13 2852 2795 A 3 HIS HBy A 3 HIS H 1.0 . 3.58 2853 2796 A 4 ILE H A 3 HIS H 1.0 . 5.49 2854 2797 A 3 HIS H A 69 GLU HA 1.0 . 5.50 2855 2798 A 3 HIS H A 70 VAL HGy% 1.0 . 5.50 2856 2799 A 66 GLU HBx A 6 VAL H 1.0 . 5.50 2857 2800 A 103 ASP H A 100 TRP HE1 1.0 . 4.91 2858 2801 A 103 ASP H A 102 GLY H 1.0 . 4.71 2859 2802 A 103 ASP H A 100 TRP HD1 1.0 . 5.50 2860 2803 A 103 ASP H A 102 GLY HAy 1.0 . 2.77 2861 2803 A 103 ASP H A 102 GLY HAx 1.0 . 2.77 2862 2804 A 103 ASP H A 103 ASP HBx 1.0 . 2.99 2863 2805 A 5 PHE HD% A 6 VAL H 1.0 . 4.40 2864 2806 A 5 PHE HBx A 6 VAL H 1.0 . 4.41 2865 2807 A 6 VAL HB A 6 VAL H 1.0 . 4.18 2866 2808 A 68 TYR HD% A 6 VAL H 1.0 . 4.85 2867 2809 A 65 GLY HAy A 6 VAL H 1.0 . 5.50 2868 2810 A 110 VAL H A 95 VAL H 1.0 . 3.95 2869 2811 A 109 SER HBy A 110 VAL H 1.0 . 3.97 2870 2812 A 110 VAL H A 109 SER HBx 1.0 . 3.47 2871 2813 A 110 VAL H A 95 VAL HGx% 1.0 . 5.50 2872 2814 A 95 VAL HGy% A 110 VAL H 1.0 . 5.50 2873 2815 A 110 VAL H A 95 VAL HB 1.0 . 4.09 2874 2816 A 4 ILE H A 113 PHE H 1.0 . 5.38 2875 2817 A 4 ILE H A 3 HIS HA 1.0 . 2.97 2876 2818 A 4 ILE H A 3 HIS HBx 1.0 . 3.74 2877 2819 A 4 ILE H A 68 TYR HBy 1.0 . 4.99 2878 2820 A 4 ILE H A 4 ILE HG1x 1.0 . 3.90 2879 2821 A 4 ILE H A 70 VAL HGy% 1.0 . 4.72 2880 2822 A 99 GLU H A 98 LEU H 1.0 . 3.00 2881 2823 A 33 ARG H A 99 GLU H 1.0 . 3.67 2882 2824 A 34 GLY HAx A 99 GLU H 1.0 . 4.32 2883 2825 A 99 GLU H A 97 VAL HA 1.0 . 3.94 2884 2826 A 99 GLU H A 99 GLU HBy 1.0 . 4.03 2885 2827 A 99 GLU H A 99 GLU HBx 1.0 . 3.92 2886 2828 A 33 ARG HBx A 99 GLU H 1.0 . 5.03 2887 2829 A 98 LEU HBy A 99 GLU H 1.0 . 3.77 2888 2830 A 98 LEU HBx A 99 GLU H 1.0 . 3.66 2889 2831 A 99 GLU H A 97 VAL HGy% 1.0 . 5.50 2890 2832 A 5 PHE HE% A 36 THR H 1.0 . 4.51 2891 2833 A 36 THR H A 35 CYS HA 1.0 . 3.07 2892 2834 A 36 THR H A 64 THR HA 1.0 . 4.18 2893 2835 A 62 CYS HA A 36 THR H 1.0 . 4.76 2894 2836 A 36 THR H A 95 VAL HA 1.0 . 5.50 2895 2837 A 36 THR H A 62 CYS HBx 1.0 . 5.26 2896 2838 A 36 THR H A 35 CYS HBx 1.0 . 4.55 2897 2839 A 95 VAL HGy% A 36 THR H 1.0 . 5.50 2898 2840 A 47 GLU H A 49 ASN H 1.0 . 5.12 2899 2841 A 46 GLY HAx A 47 GLU H 1.0 . 3.41 2900 2842 A 47 GLU H A 46 GLY HAy 1.0 . 3.24 2901 2843 A 47 GLU H A 47 GLU HBy 1.0 . 3.29 2902 2844 A 22 ASP H A 23 HIS H 1.0 . 4.87 2903 2845 A 22 ASP HBx A 22 ASP H 1.0 . 3.15 2904 2846 A 22 ASP H A 21 LEU HBx 1.0 . 4.48 2905 2847 A 20 MET H A 22 ASP H 1.0 . 4.72 2906 2848 A 5 PHE HD% A 36 THR H 1.0 . 5.50 2907 2849 A 5 PHE HZ A 36 THR H 1.0 . 4.98 2908 2850 A 63 VAL HB A 36 THR H 1.0 . 4.64 2909 2851 A 36 THR H A 37 VAL HGx% 1.0 . 5.50 2910 2851 A 37 VAL HGy% A 36 THR H 1.0 . 5.50 2911 2852 A 36 THR H A 95 VAL HGx% 1.0 . 5.50 2912 2853 A 36 THR H A 37 VAL H 1.0 . 5.05 2913 2854 A 72 GLU H A 2 ALA HB% 1.0 . 5.50 2914 2855 A 27 LEU HBx A 72 GLU H 1.0 . 5.50 2915 2856 A 74 MET H A 72 GLU H 1.0 . 4.45 2916 2857 A 71 ASP HBy A 72 GLU H 1.0 . 3.08 2917 2858 A 71 ASP HBx A 72 GLU H 1.0 . 3.48 2918 2859 A 96 GLN H A 35 CYS H 1.0 . 3.79 2919 2860 A 35 CYS H A 34 GLY H 1.0 . 4.95 2920 2861 A 5 PHE HZ A 35 CYS H 1.0 . 5.16 2921 2862 A 35 CYS H A 64 THR HA 1.0 . 5.43 2922 2863 A 34 GLY HAx A 35 CYS H 1.0 . 3.31 2923 2864 A 35 CYS H A 95 VAL HA 1.0 . 4.73 2924 2865 A 34 GLY HAy A 35 CYS H 1.0 . 3.33 2925 2866 A 35 CYS H A 96 GLN HBy 1.0 . 4.00 2926 2867 A 96 GLN HGx A 35 CYS H 1.0 . 5.48 2927 2868 A 35 CYS H A 35 CYS HBx 1.0 . 4.10 2928 2869 A 98 LEU HBy A 35 CYS H 1.0 . 4.32 2929 2870 A 98 LEU HDy% A 35 CYS H 1.0 . 4.35 2930 2871 A 95 VAL HGy% A 35 CYS H 1.0 . 5.48 2931 2872 A 12 ARG H A 14 GLN H 1.0 . 5.50 2932 2873 A 14 GLN H A 11 LYS H 1.0 . 5.11 2933 2874 A 14 GLN H A 13 GLY H 1.0 . 3.59 2934 2875 A 14 GLN H A 9 THR HA 1.0 . 4.82 2935 2876 A 14 GLN H A 14 GLN HBy 1.0 . 3.66 2936 2877 A 14 GLN H A 14 GLN HBx 1.0 . 3.55 2937 2878 A 19 VAL H A 17 HIS H 1.0 . 5.49 2938 2879 A 21 LEU H A 19 VAL H 1.0 . 4.82 2939 2880 A 19 VAL H A 16 ASN HBy 1.0 . 5.50 2940 2881 A 19 VAL H A 19 VAL HB 1.0 . 3.62 2941 2882 A 19 VAL H A 18 LYS HGy 1.0 . 3.93 2942 2882 A 18 LYS HGx A 19 VAL H 1.0 . 3.93 2943 2883 A 23 HIS HA A 25 HIS H 1.0 . 4.08 2944 2884 A 25 HIS HBy A 25 HIS H 1.0 . 3.46 2945 2885 A 25 HIS HBx A 25 HIS H 1.0 . 3.94 2946 2886 A 24 SER HBx A 25 HIS H 1.0 . 4.04 2947 2887 A 22 ASP HBx A 25 HIS H 1.0 . 4.85 2948 2888 A 90 ARG HE A 115 TYR HE% 1.0 . 5.50 2949 2889 A 90 ARG HE A 75 LEU HDy% 1.0 . 5.42 2950 2890 A 43 VAL H A 44 ILE H 1.0 . 4.60 2951 2891 A 43 VAL H A 42 LEU H 1.0 . 5.13 2952 2892 A 43 VAL H A 42 LEU HA 1.0 . 2.95 2953 2893 A 53 LEU HA A 43 VAL H 1.0 . 4.41 2954 2894 A 43 VAL H A 52 TRP HBy 1.0 . 4.50 2955 2895 A 43 VAL H A 42 LEU HBy 1.0 . 5.08 2956 2896 A 118 ALA H A 120 TYR H 1.0 . 5.04 2957 2897 A 120 TYR H A 119 THR H 1.0 . 3.43 2958 2898 A 120 TYR H A 118 ALA HA 1.0 . 4.58 2959 2899 A 120 TYR HBx A 120 TYR H 1.0 . 3.65 2960 2900 A 117 THR HG2% A 120 TYR H 1.0 . 4.53 2961 2901 A 120 TYR H A 119 THR HG2% 1.0 . 4.71 2962 2902 A 43 VAL H A 130 HIS HD2 1.0 . 5.50 2963 2903 A 23 HIS HBx A 24 SER H 1.0 . 4.37 2964 2904 A 25 HIS H A 24 SER H 1.0 . 3.14 2965 2905 A 23 HIS HD2 A 24 SER H 1.0 . 5.50 2966 2906 A 22 ASP HA A 24 SER H 1.0 . 4.19 2967 2907 A 24 SER HBx A 24 SER H 1.0 . 3.12 2968 2908 A 23 HIS HBy A 24 SER H 1.0 . 4.51 2969 2909 A 25 HIS HBy A 24 SER H 1.0 . 5.27 2970 2910 A 22 ASP HBx A 24 SER H 1.0 . 4.63 2971 2911 A 131 GLU HA A 64 THR H 1.0 . 5.01 2972 2912 A 64 THR H A 35 CYS HBy 1.0 . 5.24 2973 2913 A 131 GLU HGx A 64 THR H 1.0 . 5.09 2974 2914 A 7 TYR H A 6 VAL HB 1.0 . 5.23 2975 2915 A 8 GLY HAx A 7 TYR H 1.0 . 5.50 2976 2916 A 64 THR H A 36 THR H 1.0 . 5.50 2977 2917 A 64 THR H A 35 CYS HA 1.0 . 5.08 2978 2918 A 64 THR H A 63 VAL HA 1.0 . 2.92 2979 2919 A 132 SER HA A 64 THR H 1.0 . 3.97 2980 2920 A 63 VAL HB A 64 THR H 1.0 . 4.41 2981 2921 A 30 PHE HE% A 33 ARG H 1.0 . 4.80 2982 2922 A 33 ARG H A 32 GLY H 1.0 . 5.12 2983 2923 A 33 ARG H A 32 GLY HAx 1.0 . 3.49 2984 2924 A 33 ARG H A 99 GLU HBy 1.0 . 3.89 2985 2925 A 67 ILE HD1% A 33 ARG H 1.0 . 5.24 2986 2926 A 33 ARG H A 100 TRP H 1.0 . 4.83 2987 2927 A 33 ARG H A 33 ARG HGx 1.0 . 3.81 2988 2928 A 33 ARG H A 33 ARG HBx 1.0 . 3.57 2989 2929 A 76 ARG H A 77 PHE HBx 1.0 . 5.38 2990 2930 A 76 ARG H A 78 LEU H 1.0 . 4.95 2991 2931 A 76 ARG H A 74 MET H 1.0 . 5.01 2992 2932 A 76 ARG H A 77 PHE H 1.0 . 3.10 2993 2933 A 73 GLN H A 76 ARG H 1.0 . 4.90 2994 2934 A 76 ARG H A 76 ARG HBy 1.0 . 3.07 2995 2935 A 76 ARG H A 76 ARG HGy 1.0 . 3.69 2996 2936 A 76 ARG H A 75 LEU HBy 1.0 . 3.61 2997 2937 A 76 ARG H A 75 LEU HBx 1.0 . 3.73 2998 2938 A 76 ARG H A 75 LEU HG 1.0 . 5.50 2999 2939 A 76 ARG H A 75 LEU HDy% 1.0 . 5.16 3000 2940 A 83 ASP H A 81 PHE H 1.0 . 4.91 3001 2941 A 83 ASP H A 84 CYS H 1.0 . 3.57 3002 2942 A 83 ASP H A 82 GLU H 1.0 . 3.55 3003 2943 A 83 ASP H A 80 ASP HA 1.0 . 4.10 3004 2944 A 83 ASP H A 83 ASP HA 1.0 . 2.92 3005 2945 A 83 ASP H A 81 PHE HA 1.0 . 4.94 3006 2946 A 83 ASP H A 87 MET HE% 1.0 . 5.50 3007 2947 A 82 GLU HBx A 83 ASP H 1.0 . 4.87 3008 2948 A 83 ASP H A 82 GLU HGy 1.0 . 5.07 3009 2949 A 126 PHE H A 127 LEU HG 1.0 . 4.57 3010 2950 A 126 PHE H A 124 TRP H 1.0 . 5.06 3011 2951 A 126 PHE H A 127 LEU H 1.0 . 3.16 3012 2952 A 126 PHE H A 126 PHE HBx 1.0 . 3.35 3013 2953 A 127 LEU HBy A 126 PHE H 1.0 . 4.97 3014 2954 A 126 PHE H A 125 LEU HG 1.0 . 5.50 3015 2955 A 125 LEU HBy A 126 PHE H 1.0 . 4.19 3016 2956 A 125 LEU HBx A 126 PHE H 1.0 . 4.59 3017 2957 A 127 LEU HDy% A 126 PHE H 1.0 . 5.50 3018 2958 A 126 PHE H A 125 LEU HDx% 1.0 . 5.19 3019 2959 A 11 LYS H A 10 LEU H 1.0 . 3.84 3020 2960 A 125 LEU HDy% A 126 PHE H 1.0 . 5.50 3021 2961 A 11 LYS HBx A 11 LYS H 1.0 . 3.41 3022 2962 A 21 LEU H A 20 MET HGx 1.0 . 5.22 3023 2963 A 21 LEU H A 20 MET H 1.0 . 3.28 3024 2964 A 21 LEU H A 22 ASP H 1.0 . 3.31 3025 2965 A 21 LEU H A 21 LEU HBx 1.0 . 3.31 3026 2966 A 21 LEU H A 21 LEU HG 1.0 . 3.64 3027 2967 A 10 LEU HG A 9 THR H 1.0 . 5.50 3028 2968 A 81 PHE HBy A 82 GLU H 1.0 . 3.94 3029 2969 A 81 PHE H A 82 GLU H 1.0 . 3.90 3030 2970 A 81 PHE HD% A 82 GLU H 1.0 . 4.75 3031 2971 A 81 PHE HBx A 82 GLU H 1.0 . 4.38 3032 2972 A 82 GLU HGy A 82 GLU H 1.0 . 3.95 3033 2973 A 116 THR H A 89 GLN H 1.0 . 4.03 3034 2974 A 115 TYR HD% A 89 GLN H 1.0 . 4.72 3035 2975 A 89 GLN H A 89 GLN HE2x 1.0 . 5.50 3036 2976 A 89 GLN H A 117 THR HA 1.0 . 4.21 3037 2977 A 89 GLN H A 88 TYR HA 1.0 . 3.20 3038 2978 A 89 GLN H A 117 THR HB 1.0 . 4.66 3039 2979 A 88 TYR HBy A 89 GLN H 1.0 . 3.62 3040 2980 A 88 TYR HBx A 89 GLN H 1.0 . 4.18 3041 2981 A 89 GLN H A 89 GLN HGx 1.0 . 4.62 3042 2981 A 89 GLN H A 89 GLN HGy 1.0 . 4.62 3043 2982 A 89 GLN H A 89 GLN HBy 1.0 . 4.03 3044 2983 A 123 GLU H A 124 TRP H 1.0 . 3.41 3045 2984 A 123 GLU H A 125 LEU H 1.0 . 4.86 3046 2985 A 123 GLU H A 122 PRO HDx 1.0 . 3.80 3047 2986 A 124 TRP HBy A 123 GLU H 1.0 . 5.50 3048 2987 A 123 GLU H A 123 GLU HGx 1.0 . 3.66 3049 2988 A 123 GLU H A 123 GLU HBx 1.0 . 3.55 3050 2989 A 123 GLU H A 122 PRO HBx 1.0 . 3.56 3051 2990 A 14 GLN HE2y A 135 SER H 1.0 . 4.91 3052 2991 A 48 HIS H A 47 GLU H 1.0 . 3.78 3053 2992 A 48 HIS H A 49 ASN HA 1.0 . 4.47 3054 2993 A 48 HIS H A 48 HIS HBx 1.0 . 3.57 3055 2994 A 48 HIS H A 47 GLU HBy 1.0 . 4.29 3056 2995 A 48 HIS H A 50 ILE HG1y 1.0 . 5.32 3057 2996 A 14 GLN HE2y A 14 GLN HA 1.0 . 5.50 3058 2997 A 14 GLN HE2y A 134 ASP HA 1.0 . 4.25 3059 2998 A 14 GLN HE2y A 14 GLN HBx 1.0 . 5.50 3060 2999 A 48 HIS H A 49 ASN H 1.0 . 3.17 3061 3000 A 50 ILE H A 49 ASN H 1.0 . 3.65 3062 3001 A 49 ASN H A 49 ASN HA 1.0 . 2.94 3063 3002 A 48 HIS HBx A 49 ASN H 1.0 . 4.75 3064 3003 A 50 ILE HB A 49 ASN H 1.0 . 5.19 3065 3004 A 20 MET H A 18 LYS H 1.0 . 5.32 3066 3005 A 10 LEU HDy% A 20 MET H 1.0 . 5.29 3067 3006 A 18 LYS HA A 20 MET H 1.0 . 4.67 3068 3007 A 20 MET H A 20 MET HGx 1.0 . 3.72 3069 3008 A 20 MET H A 20 MET HBx 1.0 . 3.55 3070 3009 A 20 MET H A 19 VAL HGy% 1.0 . 4.39 3071 3010 A 20 MET H A 19 VAL HB 1.0 . 4.24 3072 3011 A 119 THR H A 117 THR HB 1.0 . 4.62 3073 3012 A 118 ALA H A 119 THR H 1.0 . 3.10 3074 3013 A 120 TYR HD% A 119 THR H 1.0 . 4.41 3075 3014 A 119 THR H A 117 THR HA 1.0 . 3.89 3076 3015 A 119 THR HB A 119 THR H 1.0 . 3.93 3077 3016 A 120 TYR HA A 119 THR H 1.0 . 5.38 3078 3017 A 126 PHE HD% A 125 LEU H 1.0 . 4.78 3079 3018 A 125 LEU H A 127 LEU H 1.0 . 4.94 3080 3019 A 124 TRP HBy A 125 LEU H 1.0 . 4.33 3081 3020 A 124 TRP HBx A 125 LEU H 1.0 . 4.71 3082 3021 A 125 LEU HBy A 125 LEU H 1.0 . 3.13 3083 3022 A 125 LEU HBx A 125 LEU H 1.0 . 3.57 3084 3023 A 88 TYR H A 89 GLN H 1.0 . 5.02 3085 3024 A 86 SER HBx A 88 TYR H 1.0 . 5.10 3086 3025 A 88 TYR HBy A 88 TYR H 1.0 . 4.10 3087 3026 A 88 TYR HBx A 88 TYR H 1.0 . 3.82 3088 3027 A 88 TYR H A 87 MET HBx 1.0 . 3.34 3089 3028 A 142 ARG HA A 49 ASN HD2y 1.0 . 5.50 3090 3029 A 49 ASN HD2y A 141 LEU HA 1.0 . 4.53 3091 3030 A 136 GLU H A 135 SER H 1.0 . 3.80 3092 3031 A 136 GLU H A 135 SER HBy 1.0 . 4.51 3093 3032 A 137 GLY HAy A 136 GLU H 1.0 . 5.43 3094 3033 A 134 ASP HBx A 136 GLU H 1.0 . 3.50 3095 3034 A 136 GLU H A 136 GLU HBx 1.0 . 3.46 3096 3035 A 49 ASN HD2x A 141 LEU HG 1.0 . 5.50 3097 3036 A 141 LEU HBx A 49 ASN HD2x 1.0 . 4.30 3098 3037 A 141 LEU HBx A 49 ASN HD2y 1.0 . 4.59 3099 3038 A 18 LYS H A 17 HIS H 1.0 . 3.64 3100 3039 A 19 VAL H A 18 LYS H 1.0 . 3.60 3101 3040 A 16 ASN HA A 18 LYS H 1.0 . 4.28 3102 3041 A 18 LYS H A 17 HIS HBy 1.0 . 4.15 3103 3042 A 18 LYS H A 17 HIS HBx 1.0 . 3.75 3104 3043 A 18 LYS HBx A 18 LYS H 1.0 . 3.03 3105 3044 A 18 LYS H A 18 LYS HGy 1.0 . 3.38 3106 3044 A 18 LYS HGx A 18 LYS H 1.0 . 3.38 3107 3045 A 18 LYS H A 19 VAL HGx% 1.0 . 5.50 3108 3046 A 18 LYS H A 19 VAL HGy% 1.0 . 5.50 3109 3047 A 148 ASN HBx A 148 ASN HD2y 1.0 . 3.84 3110 3048 A 147 GLU HGy A 148 ASN HD2x 1.0 . 5.50 3111 3049 A 58 GLY H A 40 PHE HE% 1.0 . 5.50 3112 3050 A 89 GLN HE2y A 88 TYR HA 1.0 . 5.50 3113 3051 A 89 GLN HE2y A 118 ALA H 1.0 . 5.20 3114 3052 A 89 GLN HE2y A 119 THR H 1.0 . 5.17 3115 3053 A 89 GLN HE2y A 86 SER HA 1.0 . 5.50 3116 3054 A 89 GLN HE2y A 89 GLN HGx 1.0 . 3.84 3117 3054 A 89 GLN HE2y A 89 GLN HGy 1.0 . 3.84 3118 3055 A 88 TYR HA A 89 GLN HE2x 1.0 . 5.50 3119 3056 A 119 THR H A 89 GLN HE2x 1.0 . 5.14 3120 3057 A 89 GLN HE2y A 89 GLN HBx 1.0 . 5.50 3121 3058 A 76 ARG HBx A 73 GLN HE2x 1.0 . 4.00 3122 3059 A 144 ASN HD2y A 144 ASN HA 1.0 . 5.50 3123 3060 A 144 ASN HD2y A 48 HIS HA 1.0 . 4.98 3124 3061 A 144 ASN HD2y A 144 ASN HBy 1.0 . 3.90 3125 3062 A 117 THR H A 55 TYR HD% 1.0 . 5.50 3126 3063 A 117 THR H A 116 THR HA 1.0 . 3.29 3127 3064 A 117 THR H A 117 THR HB 1.0 . 4.17 3128 3065 A 116 THR HB A 117 THR H 1.0 . 3.22 3129 3066 A 117 THR H A 55 TYR HBx 1.0 . 4.68 3130 3067 A 53 LEU HBy A 117 THR H 1.0 . 5.44 3131 3068 A 117 THR H A 53 LEU H 1.0 . 5.02 3132 3069 A 12 ARG HGx A 13 GLY H 1.0 . 5.31 3133 3070 A 12 ARG H A 13 GLY H 1.0 . 5.36 3134 3071 A 14 GLN HA A 13 GLY H 1.0 . 4.04 3135 3072 A 12 ARG HA A 13 GLY H 1.0 . 3.56 3136 3073 A 12 ARG HBy A 13 GLY H 1.0 . 4.66 3137 3074 A 12 ARG HBx A 13 GLY H 1.0 . 4.52 3138 3075 A 92 ALA HB% A 111 GLN HE2y 1.0 . 5.50 3139 3076 A 98 LEU HA A 96 GLN HE2x 1.0 . 5.50 3140 3077 A 109 SER H A 110 VAL H 1.0 . 4.54 3141 3078 A 109 SER H A 109 SER HBx 1.0 . 3.82 3142 3079 A 109 SER H A 97 VAL HGy% 1.0 . 4.77 3143 3080 A 97 VAL H A 96 GLN HE2y 1.0 . 5.50 3144 3081 A 96 GLN HA A 96 GLN HE2y 1.0 . 5.50 3145 3082 A 108 ASP HBx A 96 GLN HE2y 1.0 . 5.26 3146 3083 A 96 GLN HE2y A 96 GLN HGx 1.0 . 4.08 3147 3084 A 96 GLN HE2y A 96 GLN HBx 1.0 . 4.98 3148 3085 A 143 TYR HD% A 16 ASN HD2y 1.0 . 5.50 3149 3086 A 109 SER H A 107 GLY HAx 1.0 . 4.22 3150 3087 A 109 SER H A 109 SER HBy 1.0 . 3.88 3151 3088 A 16 ASN HD2x A 14 GLN HA 1.0 . 5.16 3152 3089 A 9 THR HB A 16 ASN HD2x 1.0 . 5.06 3153 3090 A 16 ASN H A 16 ASN HD2y 1.0 . 3.30 3154 3091 A 16 ASN HD2x A 16 ASN H 1.0 . 5.00 3155 3092 A 14 GLN HA A 16 ASN H 1.0 . 5.50 3156 3093 A 15 PRO HDx A 16 ASN H 1.0 . 4.56 3157 3094 A 16 ASN HBy A 16 ASN H 1.0 . 4.07 3158 3095 A 14 GLN HGy A 16 ASN H 1.0 . 5.06 3159 3096 A 16 ASN HBx A 16 ASN H 1.0 . 3.68 3160 3097 A 10 LEU HDy% A 16 ASN H 1.0 . 5.50 3161 3098 A 14 GLN HA A 16 ASN HD2y 1.0 . 5.50 3162 3099 A 10 LEU HDy% A 16 ASN HD2y 1.0 . 5.50 3163 3100 A 16 ASN HA A 16 ASN HD2y 1.0 . 5.50 3164 3101 A 9 THR HB A 16 ASN HD2y 1.0 . 4.71 3165 3102 A 106 PRO HDx A 107 GLY H 1.0 . 4.52 3166 3103 A 97 VAL HGy% A 107 GLY H 1.0 . 5.39 3167 3104 A 108 ASP H A 107 GLY H 1.0 . 4.35 3168 3105 A 106 PRO HDy A 107 GLY H 1.0 . 3.83 3169 3106 A 106 PRO HGy A 107 GLY H 1.0 . 4.17 3170 3107 A 97 VAL HGx% A 107 GLY H 1.0 . 5.50 3171 3108 A 106 PRO HGx A 107 GLY H 1.0 . 4.81 3172 3109 A 110 VAL H A 94 GLN HE2y 1.0 . 5.50 3173 3110 A 94 GLN HE2y A 111 GLN H 1.0 . 5.50 3174 3111 A 94 GLN HA A 94 GLN HE2y 1.0 . 4.65 3175 3112 A 109 SER HBy A 94 GLN HE2y 1.0 . 4.80 3176 3113 A 94 GLN HE2y A 109 SER HBx 1.0 . 4.48 3177 3114 A 94 GLN HE2y A 94 GLN HBx 1.0 . 3.99 3178 3115 A 94 GLN HE2y A 37 VAL HGx% 1.0 . 5.13 3179 3115 A 37 VAL HGy% A 94 GLN HE2y 1.0 . 5.13 3180 3116 A 95 VAL H A 94 GLN HE2y 1.0 . 5.50 3181 3117 A 111 GLN H A 94 GLN HE2x 1.0 . 4.99 3182 3118 A 111 GLN HA A 94 GLN HE2x 1.0 . 5.50 3183 3119 A 94 GLN HE2x A 110 VAL HA 1.0 . 4.59 3184 3120 A 109 SER HBy A 94 GLN HE2x 1.0 . 5.47 3185 3121 A 109 SER HBx A 94 GLN HE2x 1.0 . 5.38 3186 3122 A 105 ASP HBy A 104 GLY H 1.0 . 5.50 3187 3123 A 103 ASP H A 104 GLY H 1.0 . 4.85 3188 3124 A 103 ASP HBy A 104 GLY H 1.0 . 3.43 3189 3125 A 102 GLY H A 100 TRP HE1 1.0 . 5.50 3190 3126 A 101 GLU HBy A 102 GLY H 1.0 . 4.53 3191 3127 A 139 HIS H A 140 GLY H 1.0 . 3.75 3192 3128 A 140 GLY H A 138 PRO HA 1.0 . 4.60 3193 3129 A 139 HIS HBx A 140 GLY H 1.0 . 4.81 3194 3130 A 141 LEU HG A 140 GLY H 1.0 . 5.50 3195 3131 A 141 LEU HDx% A 140 GLY H 1.0 . 5.50 3196 3132 A 47 GLU H A 46 GLY H 1.0 . 4.71 3197 3133 A 132 SER H A 131 GLU H 1.0 . 3.08 3198 3134 A 132 SER H A 133 TYR H 1.0 . 4.98 3199 3135 A 132 SER H A 132 SER HBy 1.0 . 3.86 3200 3136 A 132 SER H A 132 SER HBx 1.0 . 3.96 3201 3137 A 132 SER H A 130 HIS HBy 1.0 . 3.41 3202 3138 A 132 SER H A 130 HIS HBx 1.0 . 3.82 3203 3139 A 132 SER H A 131 GLU HBy 1.0 . 3.90 3204 3140 A 132 SER H A 131 GLU HBx 1.0 . 3.87 3205 3141 A 65 GLY H A 98 LEU HDy% 1.0 . 5.50 3206 3142 A 5 PHE HE% A 65 GLY H 1.0 . 4.16 3207 3143 A 5 PHE HZ A 65 GLY H 1.0 . 3.72 3208 3144 A 65 GLY H A 35 CYS HA 1.0 . 3.96 3209 3145 A 65 GLY H A 64 THR HA 1.0 . 3.04 3210 3146 A 65 GLY H A 66 GLU HA 1.0 . 4.58 3211 3147 A 65 GLY H A 64 THR HG2% 1.0 . 4.40 3212 3148 A 5 PHE HD% A 34 GLY H 1.0 . 5.20 3213 3149 A 33 ARG HA A 34 GLY H 1.0 . 2.93 3214 3150 A 33 ARG HBy A 34 GLY H 1.0 . 3.90 3215 3151 A 33 ARG HGx A 34 GLY H 1.0 . 4.96 3216 3152 A 33 ARG HBx A 34 GLY H 1.0 . 4.03 3217 3153 A 98 LEU HBy A 34 GLY H 1.0 . 4.62 3218 3154 A 98 LEU HBx A 34 GLY H 1.0 . 4.92 3219 3155 A 67 ILE HG1x A 34 GLY H 1.0 . 5.38 3220 3156 A 98 LEU HDy% A 34 GLY H 1.0 . 4.79 3221 3157 A 95 VAL HGx% A 34 GLY H 1.0 . 5.33 3222 3158 A 136 GLU H A 137 GLY H 1.0 . 3.38 3223 3159 A 135 SER H A 137 GLY H 1.0 . 5.38 3224 3160 A 137 GLY H A 136 GLU HBx 1.0 . 4.89 3225 3161 A 60 GLY H A 61 HIS H 1.0 . 4.63 3226 3162 A 59 LYS HA A 60 GLY H 1.0 . 2.98 3227 3163 A 41 PRO HA A 60 GLY H 1.0 . 5.41 3228 3164 A 59 LYS HGx A 60 GLY H 1.0 . 5.19 3229 3165 A 59 LYS HGy A 60 GLY H 1.0 . 4.97 3230 3166 A 26 GLY H A 24 SER H 1.0 . 4.05 3231 3167 A 25 HIS H A 26 GLY H 1.0 . 3.06 3232 3168 A 23 HIS HA A 26 GLY H 1.0 . 3.80 3233 3169 A 24 SER HA A 26 GLY H 1.0 . 4.63 3234 3170 A 23 HIS HBy A 26 GLY H 1.0 . 5.50 3235 3171 A 25 HIS HBy A 26 GLY H 1.0 . 4.10 3236 3172 A 25 HIS HBx A 26 GLY H 1.0 . 4.38 3237 3173 A 73 GLN HBx A 26 GLY H 1.0 . 4.96 3238 3174 A 101 GLU H A 32 GLY H 1.0 . 3.81 3239 3175 A 67 ILE HB A 32 GLY H 1.0 . 4.75 3240 3176 A 31 ARG HBx A 32 GLY H 1.0 . 5.50 3241 3177 A 101 GLU HGy A 32 GLY H 1.0 . 5.50 3242 3178 A 32 GLY H A 67 ILE H 1.0 . 5.50 stop_ save_