data_nef_c30245_5us5 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 5US5 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 GLY middle . false 3 A 3 PHE middle . . 4 A 4 THR middle . . 5 A 5 ASP middle . . 6 A 6 GLU middle . . 7 A 7 THR middle . . 8 A 8 VAL middle . . 9 A 9 ARG middle . . 10 A 10 PHE middle . . 11 A 11 ASP middle . . 12 A 12 PHE middle . . 13 A 13 ASP middle . . 14 A 14 ASP middle . . 15 A 15 ASN middle . . 16 A 16 ARG middle . . 17 A 17 LYS middle . . 18 A 18 LYS middle . . 19 A 19 ALA middle . . 20 A 20 ILE middle . . 21 A 21 SER middle . . 22 A 22 GLU middle . . 23 A 23 THR middle . . 24 A 24 LEU middle . . 25 A 25 GLU middle . . 26 A 26 THR middle . . 27 A 27 VAL middle . . 28 A 28 TYR middle . . 29 A 29 ARG middle . . 30 A 30 ALA middle . . 31 A 31 LEU middle . . 32 A 32 GLU middle . . 33 A 33 GLU middle . . 34 A 34 LYS middle . . 35 A 35 GLY middle . false 36 A 36 TYR middle . . 37 A 37 ASN middle . . 38 A 38 PRO middle . false 39 A 39 ILE middle . . 40 A 40 ASN middle . . 41 A 41 GLN middle . . 42 A 42 ILE middle . . 43 A 43 VAL middle . . 44 A 44 GLY middle . false 45 A 45 TYR middle . . 46 A 46 LEU middle . . 47 A 47 LEU middle . . 48 A 48 SER middle . . 49 A 49 GLY middle . false 50 A 50 ASP middle . . 51 A 51 PRO middle . false 52 A 52 ALA middle . . 53 A 53 TYR middle . . 54 A 54 ILE middle . . 55 A 55 PRO middle . false 56 A 56 ARG middle . . 57 A 57 TYR middle . . 58 A 58 GLN middle . . 59 A 59 ASP middle . . 60 A 60 ALA middle . . 61 A 61 ARG middle . . 62 A 62 ASN middle . . 63 A 63 LEU middle . . 64 A 64 ILE middle . . 65 A 65 ARG middle . . 66 A 66 ARG middle . . 67 A 67 HIS middle . . 68 A 68 GLU middle . . 69 A 69 ARG middle . . 70 A 70 ASP middle . . 71 A 71 GLU middle . . 72 A 72 ILE middle . . 73 A 73 MET middle . . 74 A 74 GLU middle . . 75 A 75 GLU middle . . 76 A 76 LEU middle . . 77 A 77 THR middle . . 78 A 78 LYS middle . . 79 A 79 TYR middle . . 80 A 80 TYR middle . . 81 A 81 LEU middle . . 82 A 82 ALA middle . . 83 A 83 ASN middle . . 84 A 84 HIS middle . . 85 A 85 GLY middle . false 86 A 86 ILE middle . . 87 A 87 ASP middle . . 88 A 88 ILE middle . . 89 A 89 LYS end . . 90 B 1 MET start . . 91 B 2 GLY middle . false 92 B 3 PHE middle . . 93 B 4 THR middle . . 94 B 5 ASP middle . . 95 B 6 GLU middle . . 96 B 7 THR middle . . 97 B 8 VAL middle . . 98 B 9 ARG middle . . 99 B 10 PHE middle . . 100 B 11 ASP middle . . 101 B 12 PHE middle . . 102 B 13 ASP middle . . 103 B 14 ASP middle . . 104 B 15 ASN middle . . 105 B 16 ARG middle . . 106 B 17 LYS middle . . 107 B 18 LYS middle . . 108 B 19 ALA middle . . 109 B 20 ILE middle . . 110 B 21 SER middle . . 111 B 22 GLU middle . . 112 B 23 THR middle . . 113 B 24 LEU middle . . 114 B 25 GLU middle . . 115 B 26 THR middle . . 116 B 27 VAL middle . . 117 B 28 TYR middle . . 118 B 29 ARG middle . . 119 B 30 ALA middle . . 120 B 31 LEU middle . . 121 B 32 GLU middle . . 122 B 33 GLU middle . . 123 B 34 LYS middle . . 124 B 35 GLY middle . false 125 B 36 TYR middle . . 126 B 37 ASN middle . . 127 B 38 PRO middle . false 128 B 39 ILE middle . . 129 B 40 ASN middle . . 130 B 41 GLN middle . . 131 B 42 ILE middle . . 132 B 43 VAL middle . . 133 B 44 GLY middle . false 134 B 45 TYR middle . . 135 B 46 LEU middle . . 136 B 47 LEU middle . . 137 B 48 SER middle . . 138 B 49 GLY middle . false 139 B 50 ASP middle . . 140 B 51 PRO middle . false 141 B 52 ALA middle . . 142 B 53 TYR middle . . 143 B 54 ILE middle . . 144 B 55 PRO middle . false 145 B 56 ARG middle . . 146 B 57 TYR middle . . 147 B 58 GLN middle . . 148 B 59 ASP middle . . 149 B 60 ALA middle . . 150 B 61 ARG middle . . 151 B 62 ASN middle . . 152 B 63 LEU middle . . 153 B 64 ILE middle . . 154 B 65 ARG middle . . 155 B 66 ARG middle . . 156 B 67 HIS middle . . 157 B 68 GLU middle . . 158 B 69 ARG middle . . 159 B 70 ASP middle . . 160 B 71 GLU middle . . 161 B 72 ILE middle . . 162 B 73 MET middle . . 163 B 74 GLU middle . . 164 B 75 GLU middle . . 165 B 76 LEU middle . . 166 B 77 THR middle . . 167 B 78 LYS middle . . 168 B 79 TYR middle . . 169 B 80 TYR middle . . 170 B 81 LEU middle . . 171 B 82 ALA middle . . 172 B 83 ASN middle . . 173 B 84 HIS middle . . 174 B 85 GLY middle . false 175 B 86 ILE middle . . 176 B 87 ASP middle . . 177 B 88 ILE middle . . 178 B 89 LYS end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 3 PHE HA H 1 4.728 0.02 A 3 PHE HBy H 1 3.195 0.02 A 3 PHE HBx H 1 3.045 0.02 A 3 PHE CA C 13 58.376 0.1 A 3 PHE CB C 13 40.225 0.1 A 4 THR HA H 1 4.359 0.02 A 4 THR C C 13 174.241 0.1 A 4 THR CA C 13 62.218 0.1 A 4 THR CB C 13 68.084 0.1 A 4 THR CG2 C 13 21.766 0.1 A 5 ASP H H 1 8.166 0.02 A 5 ASP HA H 1 4.624 0.02 A 5 ASP HBy H 1 2.774 0.02 A 5 ASP HBx H 1 2.671 0.02 A 5 ASP C C 13 176.573 0.1 A 5 ASP CA C 13 54.959 0.1 A 5 ASP CB C 13 41.903 0.1 A 5 ASP N N 15 122.703 0.1 A 6 GLU H H 1 8.330 0.02 A 6 GLU HA H 1 4.316 0.02 A 6 GLU HBy H 1 2.109 0.02 A 6 GLU HBx H 1 1.974 0.02 A 6 GLU HG2 H 1 2.273 0.02 A 6 GLU C C 13 177.039 0.1 A 6 GLU CA C 13 57.445 0.1 A 6 GLU CB C 13 30.779 0.1 A 6 GLU CG C 13 37.022 0.1 A 6 GLU N N 15 121.507 0.1 A 7 THR H H 1 8.142 0.02 A 7 THR HA H 1 4.289 0.02 A 7 THR HB H 1 4.170 0.02 A 7 THR HG2% H 1 1.168 0.02 A 7 THR C C 13 174.893 0.1 A 7 THR CA C 13 63.131 0.1 A 7 THR CB C 13 70.469 0.1 A 7 THR CG2 C 13 22.277 0.1 A 7 THR N N 15 115.417 0.1 A 8 VAL H H 1 7.896 0.02 A 8 VAL HA H 1 4.066 0.02 A 8 VAL HB H 1 1.952 0.02 A 8 VAL HGx% H 1 0.831 0.02 A 8 VAL HGy% H 1 0.775 0.02 A 8 VAL C C 13 175.724 0.1 A 8 VAL CA C 13 62.707 0.1 A 8 VAL CB C 13 33.136 0.1 A 8 VAL CG1 C 13 21.344 0.1 A 8 VAL CG2 C 13 21.717 0.1 A 8 VAL N N 15 122.882 0.1 A 9 ARG H H 1 8.012 0.02 A 9 ARG HA H 1 4.309 0.02 A 9 ARG HBy H 1 1.701 0.02 A 9 ARG HBx H 1 1.640 0.02 A 9 ARG HD2 H 1 3.118 0.02 A 9 ARG HGy H 1 1.509 0.02 A 9 ARG HGx H 1 1.420 0.02 A 9 ARG C C 13 176.000 0.1 A 9 ARG CA C 13 56.145 0.1 A 9 ARG CB C 13 31.835 0.1 A 9 ARG CD C 13 43.809 0.1 A 9 ARG CG C 13 27.876 0.1 A 9 ARG N N 15 124.175 0.1 A 10 PHE H H 1 8.226 0.02 A 10 PHE HA H 1 4.615 0.02 A 10 PHE HBy H 1 3.043 0.02 A 10 PHE HBx H 1 2.859 0.02 A 10 PHE HD1 H 1 7.174 0.02 A 10 PHE HD2 H 1 7.174 0.02 A 10 PHE C C 13 175.407 0.1 A 10 PHE CA C 13 58.044 0.1 A 10 PHE CB C 13 40.125 0.1 A 10 PHE CD1 C 13 132.309 0.1 A 10 PHE N N 15 121.954 0.1 A 11 ASP H H 1 8.148 0.02 A 11 ASP HA H 1 4.571 0.02 A 11 ASP HB2 H 1 2.564 0.02 A 11 ASP C C 13 176.000 0.1 A 11 ASP CA C 13 54.553 0.1 A 11 ASP CB C 13 41.889 0.1 A 11 ASP N N 15 121.918 0.1 A 12 PHE H H 1 7.958 0.02 A 12 PHE HA H 1 4.558 0.02 A 12 PHE HBy H 1 3.167 0.02 A 12 PHE HBx H 1 3.032 0.02 A 12 PHE HD1 H 1 7.271 0.02 A 12 PHE HD2 H 1 7.271 0.02 A 12 PHE C C 13 175.947 0.1 A 12 PHE CA C 13 58.541 0.1 A 12 PHE CB C 13 40.094 0.1 A 12 PHE CD1 C 13 132.309 0.1 A 12 PHE N N 15 120.505 0.1 A 13 ASP H H 1 8.193 0.02 A 13 ASP HA H 1 4.580 0.02 A 13 ASP HB2 H 1 2.667 0.02 A 13 ASP C C 13 176.487 0.1 A 13 ASP CA C 13 55.165 0.1 A 13 ASP CB C 13 42.280 0.1 A 13 ASP N N 15 121.885 0.1 A 14 ASP H H 1 8.124 0.02 A 14 ASP HA H 1 4.516 0.02 A 14 ASP HB2 H 1 2.687 0.02 A 14 ASP C C 13 177.039 0.1 A 14 ASP CA C 13 55.539 0.1 A 14 ASP CB C 13 41.856 0.1 A 14 ASP N N 15 121.296 0.1 A 15 ASN H H 1 8.320 0.02 A 15 ASN HA H 1 4.628 0.02 A 15 ASN HB2 H 1 2.827 0.02 A 15 ASN HD2y H 1 7.434 0.02 A 15 ASN HD2x H 1 6.747 0.02 A 15 ASN C C 13 176.256 0.1 A 15 ASN CA C 13 54.629 0.1 A 15 ASN CB C 13 39.216 0.1 A 15 ASN N N 15 118.912 0.1 A 15 ASN ND2 N 15 112.142 0.1 A 16 ARG H H 1 8.006 0.02 A 16 ARG HA H 1 4.242 0.02 A 16 ARG HBy H 1 1.896 0.02 A 16 ARG HBx H 1 1.818 0.02 A 16 ARG HD2 H 1 3.207 0.02 A 16 ARG HG2 H 1 1.616 0.02 A 16 ARG C C 13 177.099 0.1 A 16 ARG CA C 13 57.776 0.1 A 16 ARG CB C 13 30.861 0.1 A 16 ARG CD C 13 43.809 0.1 A 16 ARG CG C 13 27.690 0.1 A 16 ARG N N 15 120.924 0.1 A 17 LYS H H 1 8.114 0.02 A 17 LYS HA H 1 4.138 0.02 A 17 LYS HBy H 1 1.852 0.02 A 17 LYS HBx H 1 1.812 0.02 A 17 LYS HD2 H 1 1.681 0.02 A 17 LYS HE2 H 1 3.010 0.02 A 17 LYS HG2 H 1 1.424 0.02 A 17 LYS C C 13 177.602 0.1 A 17 LYS CA C 13 57.985 0.1 A 17 LYS CB C 13 33.277 0.1 A 17 LYS CD C 13 29.566 0.1 A 17 LYS CG C 13 25.637 0.1 A 17 LYS N N 15 121.442 0.1 A 18 LYS H H 1 8.120 0.02 A 18 LYS HA H 1 4.309 0.02 A 18 LYS HBy H 1 1.867 0.02 A 18 LYS HBx H 1 1.803 0.02 A 18 LYS HD2 H 1 1.672 0.02 A 18 LYS HE2 H 1 3.013 0.02 A 18 LYS HG2 H 1 1.486 0.02 A 18 LYS C C 13 177.096 0.1 A 18 LYS CA C 13 57.117 0.1 A 18 LYS CB C 13 33.900 0.1 A 18 LYS CD C 13 29.566 0.1 A 18 LYS CG C 13 25.682 0.1 A 18 LYS N N 15 122.812 0.1 A 19 ALA H H 1 8.325 0.02 A 19 ALA HA H 1 4.413 0.02 A 19 ALA HB% H 1 1.566 0.02 A 19 ALA C C 13 179.372 0.1 A 19 ALA CA C 13 53.520 0.1 A 19 ALA CB C 13 19.531 0.1 A 19 ALA N N 15 123.622 0.1 A 20 ILE H H 1 8.331 0.02 A 20 ILE HA H 1 3.187 0.02 A 20 ILE HB H 1 1.610 0.02 A 20 ILE HD1% H 1 0.586 0.02 A 20 ILE HG1y H 1 1.342 0.02 A 20 ILE HG1x H 1 0.023 0.02 A 20 ILE HG2% H 1 0.531 0.02 A 20 ILE C C 13 177.753 0.1 A 20 ILE CA C 13 66.247 0.1 A 20 ILE CB C 13 37.983 0.1 A 20 ILE CD1 C 13 14.029 0.1 A 20 ILE CG1 C 13 29.243 0.1 A 20 ILE CG2 C 13 17.589 0.1 A 20 ILE N N 15 122.213 0.1 A 21 SER H H 1 8.237 0.02 A 21 SER HA H 1 3.954 0.02 A 21 SER HBy H 1 3.855 0.02 A 21 SER HBx H 1 3.679 0.02 A 21 SER HG H 1 6.227 0.02 A 21 SER C C 13 176.882 0.1 A 21 SER CA C 13 62.547 0.1 A 21 SER CB C 13 61.937 0.1 A 21 SER N N 15 114.975 0.1 A 22 GLU H H 1 7.287 0.02 A 22 GLU HA H 1 4.218 0.02 A 22 GLU HBy H 1 2.218 0.02 A 22 GLU HBx H 1 2.139 0.02 A 22 GLU HGy H 1 2.403 0.02 A 22 GLU HGx H 1 2.256 0.02 A 22 GLU C C 13 179.947 0.1 A 22 GLU CA C 13 59.660 0.1 A 22 GLU CB C 13 30.449 0.1 A 22 GLU CG C 13 37.335 0.1 A 22 GLU N N 15 122.757 0.1 A 23 THR H H 1 8.466 0.02 A 23 THR HA H 1 3.789 0.02 A 23 THR HB H 1 4.376 0.02 A 23 THR HG2% H 1 1.162 0.02 A 23 THR C C 13 176.326 0.1 A 23 THR CA C 13 67.892 0.1 A 23 THR CB C 13 67.993 0.1 A 23 THR CG2 C 13 23.416 0.1 A 23 THR N N 15 119.291 0.1 A 24 LEU H H 1 8.584 0.02 A 24 LEU HA H 1 3.919 0.02 A 24 LEU HBy H 1 1.886 0.02 A 24 LEU HBx H 1 1.318 0.02 A 24 LEU HDx% H 1 0.594 0.02 A 24 LEU HDy% H 1 0.727 0.02 A 24 LEU HG H 1 1.784 0.02 A 24 LEU C C 13 178.539 0.1 A 24 LEU CA C 13 58.955 0.1 A 24 LEU CB C 13 41.998 0.1 A 24 LEU CD1 C 13 26.395 0.1 A 24 LEU CD2 C 13 22.866 0.1 A 24 LEU CG C 13 27.624 0.1 A 24 LEU N N 15 119.050 0.1 A 25 GLU H H 1 8.167 0.02 A 25 GLU HA H 1 3.849 0.02 A 25 GLU HBy H 1 2.222 0.02 A 25 GLU HBx H 1 2.163 0.02 A 25 GLU HGy H 1 2.305 0.02 A 25 GLU HGx H 1 2.236 0.02 A 25 GLU C C 13 178.186 0.1 A 25 GLU CA C 13 60.992 0.1 A 25 GLU CB C 13 29.700 0.1 A 25 GLU CG C 13 36.365 0.1 A 25 GLU N N 15 119.549 0.1 A 26 THR H H 1 7.998 0.02 A 26 THR HA H 1 3.964 0.02 A 26 THR HB H 1 4.299 0.02 A 26 THR HG2% H 1 1.237 0.02 A 26 THR C C 13 177.285 0.1 A 26 THR CA C 13 67.722 0.1 A 26 THR CB C 13 69.434 0.1 A 26 THR CG2 C 13 22.116 0.1 A 26 THR N N 15 116.364 0.1 A 27 VAL H H 1 8.500 0.02 A 27 VAL HA H 1 3.509 0.02 A 27 VAL HB H 1 2.182 0.02 A 27 VAL HGx% H 1 1.099 0.02 A 27 VAL HGy% H 1 0.909 0.02 A 27 VAL C C 13 177.003 0.1 A 27 VAL CA C 13 67.545 0.1 A 27 VAL CB C 13 32.480 0.1 A 27 VAL CG1 C 13 24.387 0.1 A 27 VAL CG2 C 13 22.445 0.1 A 27 VAL N N 15 121.571 0.1 A 28 TYR H H 1 8.753 0.02 A 28 TYR HA H 1 3.763 0.02 A 28 TYR HBy H 1 3.413 0.02 A 28 TYR HBx H 1 2.934 0.02 A 28 TYR HD1 H 1 6.748 0.02 A 28 TYR HD2 H 1 6.748 0.02 A 28 TYR HE1 H 1 6.697 0.02 A 28 TYR HE2 H 1 6.697 0.02 A 28 TYR C C 13 177.328 0.1 A 28 TYR CA C 13 63.548 0.1 A 28 TYR CB C 13 39.300 0.1 A 28 TYR CD1 C 13 133.344 0.1 A 28 TYR CE1 C 13 118.843 0.1 A 28 TYR N N 15 120.213 0.1 A 29 ARG H H 1 8.341 0.02 A 29 ARG HA H 1 4.231 0.02 A 29 ARG HBy H 1 2.166 0.02 A 29 ARG HBx H 1 2.095 0.02 A 29 ARG HDy H 1 3.432 0.02 A 29 ARG HDx H 1 3.326 0.02 A 29 ARG HGy H 1 2.135 0.02 A 29 ARG HGx H 1 1.984 0.02 A 29 ARG C C 13 179.274 0.1 A 29 ARG CA C 13 59.812 0.1 A 29 ARG CB C 13 30.449 0.1 A 29 ARG CD C 13 43.809 0.1 A 29 ARG CG C 13 28.595 0.1 A 29 ARG N N 15 117.151 0.1 A 30 ALA H H 1 8.179 0.02 A 30 ALA HA H 1 4.240 0.02 A 30 ALA HB% H 1 1.496 0.02 A 30 ALA C C 13 179.604 0.1 A 30 ALA CA C 13 56.006 0.1 A 30 ALA CB C 13 19.278 0.1 A 30 ALA N N 15 122.727 0.1 A 31 LEU H H 1 7.948 0.02 A 31 LEU HA H 1 3.903 0.02 A 31 LEU HBy H 1 2.114 0.02 A 31 LEU HBx H 1 1.034 0.02 A 31 LEU HDx% H 1 0.956 0.02 A 31 LEU HDy% H 1 0.700 0.02 A 31 LEU HG H 1 1.661 0.02 A 31 LEU C C 13 179.025 0.1 A 31 LEU CA C 13 58.740 0.1 A 31 LEU CB C 13 42.940 0.1 A 31 LEU CD1 C 13 26.977 0.1 A 31 LEU CD2 C 13 26.329 0.1 A 31 LEU CG C 13 28.919 0.1 A 31 LEU N N 15 116.115 0.1 A 32 GLU H H 1 8.548 0.02 A 32 GLU HA H 1 4.044 0.02 A 32 GLU HBy H 1 2.228 0.02 A 32 GLU HBx H 1 1.897 0.02 A 32 GLU HGy H 1 2.284 0.02 A 32 GLU HGx H 1 2.253 0.02 A 32 GLU C C 13 180.986 0.1 A 32 GLU CA C 13 60.043 0.1 A 32 GLU CB C 13 30.684 0.1 A 32 GLU CG C 13 37.012 0.1 A 32 GLU N N 15 120.908 0.1 A 33 GLU H H 1 8.327 0.02 A 33 GLU HA H 1 4.128 0.02 A 33 GLU HBy H 1 2.392 0.02 A 33 GLU HBx H 1 2.221 0.02 A 33 GLU HGy H 1 2.553 0.02 A 33 GLU HGx H 1 2.405 0.02 A 33 GLU C C 13 178.439 0.1 A 33 GLU CA C 13 59.729 0.1 A 33 GLU CB C 13 30.355 0.1 A 33 GLU CG C 13 37.012 0.1 A 33 GLU N N 15 120.190 0.1 A 34 LYS H H 1 7.228 0.02 A 34 LYS HA H 1 4.291 0.02 A 34 LYS HBy H 1 2.089 0.02 A 34 LYS HBx H 1 1.852 0.02 A 34 LYS HDy H 1 1.358 0.02 A 34 LYS HDx H 1 1.186 0.02 A 34 LYS HEy H 1 2.541 0.02 A 34 LYS HEx H 1 2.309 0.02 A 34 LYS HG2 H 1 1.229 0.02 A 34 LYS C C 13 176.579 0.1 A 34 LYS CA C 13 54.400 0.1 A 34 LYS CB C 13 32.806 0.1 A 34 LYS CD C 13 27.624 0.1 A 34 LYS CE C 13 42.191 0.1 A 34 LYS CG C 13 25.035 0.1 A 34 LYS N N 15 115.391 0.1 A 35 GLY H H 1 7.712 0.02 A 35 GLY HAy H 1 4.019 0.02 A 35 GLY HAx H 1 3.785 0.02 A 35 GLY C C 13 175.188 0.1 A 35 GLY CA C 13 46.370 0.1 A 35 GLY N N 15 106.626 0.1 A 36 TYR H H 1 7.631 0.02 A 36 TYR HA H 1 4.458 0.02 A 36 TYR HBy H 1 2.793 0.02 A 36 TYR HBx H 1 2.468 0.02 A 36 TYR HD1 H 1 7.145 0.02 A 36 TYR HD2 H 1 7.145 0.02 A 36 TYR HE1 H 1 6.736 0.02 A 36 TYR HE2 H 1 6.736 0.02 A 36 TYR C C 13 175.489 0.1 A 36 TYR CA C 13 58.097 0.1 A 36 TYR CB C 13 40.572 0.1 A 36 TYR CD1 C 13 133.603 0.1 A 36 TYR CE1 C 13 118.843 0.1 A 36 TYR N N 15 117.982 0.1 A 37 ASN H H 1 8.948 0.02 A 37 ASN HA H 1 5.092 0.02 A 37 ASN HBy H 1 3.202 0.02 A 37 ASN HBx H 1 2.883 0.02 A 37 ASN HD2y H 1 7.702 0.02 A 37 ASN HD2x H 1 6.985 0.02 A 37 ASN C C 13 175.347 0.1 A 37 ASN CA C 13 50.931 0.1 A 37 ASN CB C 13 38.630 0.1 A 37 ASN N N 15 120.671 0.1 A 37 ASN ND2 N 15 114.164 0.1 A 38 PRO HA H 1 3.907 0.02 A 38 PRO HBy H 1 1.947 0.02 A 38 PRO HBx H 1 1.528 0.02 A 38 PRO HDy H 1 4.430 0.02 A 38 PRO HDx H 1 3.682 0.02 A 38 PRO HGy H 1 1.266 0.02 A 38 PRO HGx H 1 1.217 0.02 A 38 PRO C C 13 179.369 0.1 A 38 PRO CA C 13 65.497 0.1 A 38 PRO CB C 13 34.422 0.1 A 38 PRO CD C 13 51.902 0.1 A 38 PRO CG C 13 28.595 0.1 A 39 ILE H H 1 7.601 0.02 A 39 ILE HA H 1 3.663 0.02 A 39 ILE HB H 1 2.319 0.02 A 39 ILE HD1% H 1 0.969 0.02 A 39 ILE HG1y H 1 1.748 0.02 A 39 ILE HG1x H 1 1.667 0.02 A 39 ILE HG2% H 1 1.009 0.02 A 39 ILE C C 13 177.572 0.1 A 39 ILE CA C 13 63.931 0.1 A 39 ILE CB C 13 36.000 0.1 A 39 ILE CD1 C 13 11.439 0.1 A 39 ILE CG1 C 13 28.919 0.1 A 39 ILE CG2 C 13 18.560 0.1 A 39 ILE N N 15 113.904 0.1 A 40 ASN H H 1 7.494 0.02 A 40 ASN HA H 1 4.353 0.02 A 40 ASN HBy H 1 2.934 0.02 A 40 ASN HBx H 1 2.845 0.02 A 40 ASN HD2y H 1 7.645 0.02 A 40 ASN HD2x H 1 6.953 0.02 A 40 ASN C C 13 179.017 0.1 A 40 ASN CA C 13 56.757 0.1 A 40 ASN CB C 13 38.630 0.1 A 40 ASN N N 15 117.383 0.1 A 40 ASN ND2 N 15 111.331 0.1 A 41 GLN H H 1 7.551 0.02 A 41 GLN HA H 1 4.268 0.02 A 41 GLN HBy H 1 2.566 0.02 A 41 GLN HBx H 1 2.039 0.02 A 41 GLN HE2y H 1 8.435 0.02 A 41 GLN HE2x H 1 7.436 0.02 A 41 GLN HGy H 1 2.758 0.02 A 41 GLN HGx H 1 2.315 0.02 A 41 GLN C C 13 177.626 0.1 A 41 GLN CA C 13 58.664 0.1 A 41 GLN CB C 13 29.082 0.1 A 41 GLN CG C 13 35.393 0.1 A 41 GLN N N 15 116.237 0.1 A 41 GLN NE2 N 15 112.355 0.1 A 42 ILE H H 1 8.146 0.02 A 42 ILE HA H 1 3.454 0.02 A 42 ILE HB H 1 1.836 0.02 A 42 ILE HD1% H 1 0.833 0.02 A 42 ILE HG1y H 1 1.895 0.02 A 42 ILE HG1x H 1 0.589 0.02 A 42 ILE HG2% H 1 0.836 0.02 A 42 ILE C C 13 177.807 0.1 A 42 ILE CA C 13 67.217 0.1 A 42 ILE CB C 13 38.792 0.1 A 42 ILE CD1 C 13 13.469 0.1 A 42 ILE CG1 C 13 30.637 0.1 A 42 ILE CG2 C 13 17.266 0.1 A 42 ILE N N 15 119.408 0.1 A 43 VAL H H 1 8.636 0.02 A 43 VAL HA H 1 3.296 0.02 A 43 VAL HB H 1 2.176 0.02 A 43 VAL HGx% H 1 0.908 0.02 A 43 VAL HGy% H 1 0.900 0.02 A 43 VAL C C 13 177.301 0.1 A 43 VAL CA C 13 68.211 0.1 A 43 VAL CB C 13 31.800 0.1 A 43 VAL CG1 C 13 24.711 0.1 A 43 VAL CG2 C 13 22.121 0.1 A 43 VAL N N 15 119.749 0.1 A 44 GLY H H 1 7.765 0.02 A 44 GLY HAy H 1 3.331 0.02 A 44 GLY HAx H 1 2.837 0.02 A 44 GLY C C 13 177.705 0.1 A 44 GLY CA C 13 46.924 0.1 A 44 GLY N N 15 105.716 0.1 A 45 TYR H H 1 7.931 0.02 A 45 TYR HA H 1 3.906 0.02 A 45 TYR HB2 H 1 3.033 0.02 A 45 TYR HD1 H 1 6.898 0.02 A 45 TYR HD2 H 1 6.898 0.02 A 45 TYR HE1 H 1 6.445 0.02 A 45 TYR HE2 H 1 6.445 0.02 A 45 TYR C C 13 177.259 0.1 A 45 TYR CA C 13 62.155 0.1 A 45 TYR CB C 13 39.262 0.1 A 45 TYR CD1 C 13 133.344 0.1 A 45 TYR CE1 C 13 117.289 0.1 A 45 TYR N N 15 123.504 0.1 A 46 LEU H H 1 8.582 0.02 A 46 LEU HA H 1 3.383 0.02 A 46 LEU HBy H 1 1.896 0.02 A 46 LEU HBx H 1 1.250 0.02 A 46 LEU HDx% H 1 0.707 0.02 A 46 LEU HDy% H 1 0.815 0.02 A 46 LEU HG H 1 2.000 0.02 A 46 LEU C C 13 178.891 0.1 A 46 LEU CA C 13 58.993 0.1 A 46 LEU CB C 13 41.867 0.1 A 46 LEU CD1 C 13 26.653 0.1 A 46 LEU CD2 C 13 22.769 0.1 A 46 LEU CG C 13 27.300 0.1 A 46 LEU N N 15 120.870 0.1 A 47 LEU H H 1 8.194 0.02 A 47 LEU HA H 1 3.916 0.02 A 47 LEU HBy H 1 1.718 0.02 A 47 LEU HBx H 1 1.345 0.02 A 47 LEU HDx% H 1 0.666 0.02 A 47 LEU HDy% H 1 0.662 0.02 A 47 LEU HG H 1 1.617 0.02 A 47 LEU C C 13 178.042 0.1 A 47 LEU CA C 13 57.385 0.1 A 47 LEU CB C 13 43.129 0.1 A 47 LEU CD1 C 13 26.329 0.1 A 47 LEU CD2 C 13 23.740 0.1 A 47 LEU CG C 13 26.977 0.1 A 47 LEU N N 15 115.227 0.1 A 48 SER H H 1 7.453 0.02 A 48 SER HA H 1 4.547 0.02 A 48 SER HB2 H 1 3.984 0.02 A 48 SER C C 13 176.570 0.1 A 48 SER CA C 13 60.043 0.1 A 48 SER CB C 13 66.839 0.1 A 48 SER N N 15 111.236 0.1 A 49 GLY H H 1 8.869 0.02 A 49 GLY HAy H 1 3.970 0.02 A 49 GLY HAx H 1 2.944 0.02 A 49 GLY C C 13 173.089 0.1 A 49 GLY CA C 13 46.018 0.1 A 49 GLY N N 15 114.119 0.1 A 50 ASP H H 1 8.323 0.02 A 50 ASP HA H 1 5.059 0.02 A 50 ASP HBy H 1 3.363 0.02 A 50 ASP HBx H 1 2.589 0.02 A 50 ASP C C 13 176.996 0.1 A 50 ASP CA C 13 51.578 0.1 A 50 ASP CB C 13 42.191 0.1 A 50 ASP N N 15 121.699 0.1 A 51 PRO HA H 1 4.336 0.02 A 51 PRO HBy H 1 2.116 0.02 A 51 PRO HBx H 1 1.911 0.02 A 51 PRO HDy H 1 4.589 0.02 A 51 PRO HDx H 1 4.088 0.02 A 51 PRO HGy H 1 2.110 0.02 A 51 PRO HGx H 1 2.031 0.02 A 51 PRO C C 13 176.696 0.1 A 51 PRO CA C 13 64.560 0.1 A 51 PRO CB C 13 32.853 0.1 A 51 PRO CD C 13 51.902 0.1 A 51 PRO CG C 13 27.624 0.1 A 52 ALA H H 1 8.455 0.02 A 52 ALA HA H 1 3.963 0.02 A 52 ALA HB% H 1 1.253 0.02 A 52 ALA C C 13 179.252 0.1 A 52 ALA CA C 13 54.591 0.1 A 52 ALA CB C 13 18.712 0.1 A 52 ALA N N 15 120.096 0.1 A 53 TYR H H 1 7.417 0.02 A 53 TYR HA H 1 3.970 0.02 A 53 TYR HBy H 1 3.497 0.02 A 53 TYR HBx H 1 2.713 0.02 A 53 TYR HD1 H 1 7.475 0.02 A 53 TYR HD2 H 1 7.475 0.02 A 53 TYR HE1 H 1 6.903 0.02 A 53 TYR HE2 H 1 6.903 0.02 A 53 TYR C C 13 175.378 0.1 A 53 TYR CA C 13 62.011 0.1 A 53 TYR CB C 13 40.928 0.1 A 53 TYR CD1 C 13 133.344 0.1 A 53 TYR CE1 C 13 119.102 0.1 A 53 TYR N N 15 114.019 0.1 A 54 ILE H H 1 8.083 0.02 A 54 ILE HA H 1 4.543 0.02 A 54 ILE HB H 1 1.903 0.02 A 54 ILE HD1% H 1 0.435 0.02 A 54 ILE HG1y H 1 1.280 0.02 A 54 ILE HG1x H 1 0.832 0.02 A 54 ILE HG2% H 1 0.779 0.02 A 54 ILE C C 13 173.743 0.1 A 54 ILE CA C 13 54.815 0.1 A 54 ILE CB C 13 38.306 0.1 A 54 ILE CD1 C 13 9.173 0.1 A 54 ILE CG1 C 13 26.329 0.1 A 54 ILE CG2 C 13 16.618 0.1 A 54 ILE N N 15 119.458 0.1 A 55 PRO HA H 1 4.510 0.02 A 55 PRO HB2 H 1 1.929 0.02 A 55 PRO HDy H 1 3.501 0.02 A 55 PRO HDx H 1 3.306 0.02 A 55 PRO HGy H 1 1.667 0.02 A 55 PRO HGx H 1 1.620 0.02 A 55 PRO C C 13 175.284 0.1 A 55 PRO CA C 13 63.314 0.1 A 55 PRO CB C 13 33.203 0.1 A 55 PRO CD C 13 51.254 0.1 A 55 PRO CG C 13 26.977 0.1 A 56 ARG H H 1 8.479 0.02 A 56 ARG HA H 1 4.218 0.02 A 56 ARG HBy H 1 1.949 0.02 A 56 ARG HBx H 1 1.750 0.02 A 56 ARG HD2 H 1 3.251 0.02 A 56 ARG HGy H 1 1.657 0.02 A 56 ARG HGx H 1 1.572 0.02 A 56 ARG C C 13 176.985 0.1 A 56 ARG CA C 13 57.565 0.1 A 56 ARG CB C 13 30.537 0.1 A 56 ARG CD C 13 44.133 0.1 A 56 ARG CG C 13 28.919 0.1 A 56 ARG N N 15 117.843 0.1 A 57 TYR H H 1 7.142 0.02 A 57 TYR HA H 1 4.423 0.02 A 57 TYR HBy H 1 3.276 0.02 A 57 TYR HBx H 1 2.562 0.02 A 57 TYR HD1 H 1 7.139 0.02 A 57 TYR HD2 H 1 7.139 0.02 A 57 TYR HE1 H 1 6.965 0.02 A 57 TYR HE2 H 1 6.965 0.02 A 57 TYR C C 13 175.047 0.1 A 57 TYR CA C 13 58.944 0.1 A 57 TYR CB C 13 40.206 0.1 A 57 TYR CD1 C 13 133.862 0.1 A 57 TYR CE1 C 13 119.361 0.1 A 57 TYR N N 15 120.829 0.1 A 58 GLN H H 1 8.582 0.02 A 58 GLN HA H 1 3.546 0.02 A 58 GLN HBy H 1 2.086 0.02 A 58 GLN HBx H 1 1.639 0.02 A 58 GLN HE2y H 1 6.720 0.02 A 58 GLN HE2x H 1 6.575 0.02 A 58 GLN HG2 H 1 1.530 0.02 A 58 GLN C C 13 174.755 0.1 A 58 GLN CA C 13 57.681 0.1 A 58 GLN CB C 13 26.329 0.1 A 58 GLN CG C 13 34.098 0.1 A 58 GLN N N 15 122.570 0.1 A 58 GLN NE2 N 15 110.392 0.1 A 59 ASP H H 1 8.333 0.02 A 59 ASP HA H 1 4.497 0.02 A 59 ASP HBy H 1 3.053 0.02 A 59 ASP HBx H 1 2.539 0.02 A 59 ASP C C 13 177.808 0.1 A 59 ASP CA C 13 55.585 0.1 A 59 ASP CB C 13 41.809 0.1 A 59 ASP N N 15 113.443 0.1 A 60 ALA H H 1 7.690 0.02 A 60 ALA HA H 1 3.719 0.02 A 60 ALA HB% H 1 1.412 0.02 A 60 ALA C C 13 178.223 0.1 A 60 ALA CA C 13 57.163 0.1 A 60 ALA CB C 13 18.005 0.1 A 60 ALA N N 15 122.016 0.1 A 61 ARG H H 1 7.345 0.02 A 61 ARG HA H 1 3.470 0.02 A 61 ARG HB2 H 1 1.755 0.02 A 61 ARG HG2 H 1 0.833 0.02 A 61 ARG C C 13 177.184 0.1 A 61 ARG CA C 13 59.995 0.1 A 61 ARG CB C 13 30.537 0.1 A 61 ARG N N 15 116.857 0.1 A 62 ASN H H 1 7.533 0.02 A 62 ASN HA H 1 4.372 0.02 A 62 ASN HBy H 1 2.748 0.02 A 62 ASN HBx H 1 2.629 0.02 A 62 ASN HD2y H 1 8.012 0.02 A 62 ASN HD2x H 1 6.837 0.02 A 62 ASN C C 13 178.536 0.1 A 62 ASN CA C 13 55.924 0.1 A 62 ASN CB C 13 38.415 0.1 A 62 ASN N N 15 116.341 0.1 A 62 ASN ND2 N 15 114.405 0.1 A 63 LEU H H 1 8.490 0.02 A 63 LEU HA H 1 3.946 0.02 A 63 LEU HBy H 1 1.811 0.02 A 63 LEU HBx H 1 1.449 0.02 A 63 LEU HDx% H 1 0.916 0.02 A 63 LEU HDy% H 1 0.907 0.02 A 63 LEU HG H 1 1.826 0.02 A 63 LEU C C 13 180.408 0.1 A 63 LEU CA C 13 58.619 0.1 A 63 LEU CB C 13 42.658 0.1 A 63 LEU CD1 C 13 25.682 0.1 A 63 LEU CD2 C 13 24.063 0.1 A 63 LEU CG C 13 27.300 0.1 A 63 LEU N N 15 120.683 0.1 A 64 ILE H H 1 7.965 0.02 A 64 ILE HA H 1 3.994 0.02 A 64 ILE HB H 1 1.607 0.02 A 64 ILE HD1% H 1 0.655 0.02 A 64 ILE HG1y H 1 1.346 0.02 A 64 ILE HG1x H 1 1.230 0.02 A 64 ILE HG2% H 1 0.612 0.02 A 64 ILE C C 13 176.642 0.1 A 64 ILE CA C 13 63.879 0.1 A 64 ILE CB C 13 38.600 0.1 A 64 ILE CD1 C 13 14.352 0.1 A 64 ILE CG1 C 13 31.185 0.1 A 64 ILE CG2 C 13 16.942 0.1 A 64 ILE N N 15 117.268 0.1 A 65 ARG H H 1 7.104 0.02 A 65 ARG HA H 1 4.383 0.02 A 65 ARG HBy H 1 2.113 0.02 A 65 ARG HBx H 1 1.867 0.02 A 65 ARG HDy H 1 3.251 0.02 A 65 ARG HDx H 1 3.167 0.02 A 65 ARG HGy H 1 1.944 0.02 A 65 ARG HGx H 1 1.785 0.02 A 65 ARG C C 13 176.778 0.1 A 65 ARG CA C 13 57.240 0.1 A 65 ARG CB C 13 30.590 0.1 A 65 ARG CD C 13 44.133 0.1 A 65 ARG CG C 13 27.948 0.1 A 65 ARG N N 15 118.765 0.1 A 66 ARG H H 1 7.371 0.02 A 66 ARG HA H 1 4.059 0.02 A 66 ARG HBy H 1 1.637 0.02 A 66 ARG HBx H 1 1.576 0.02 A 66 ARG HD2 H 1 3.065 0.02 A 66 ARG HGy H 1 1.642 0.02 A 66 ARG HGx H 1 1.590 0.02 A 66 ARG C C 13 175.369 0.1 A 66 ARG CA C 13 58.014 0.1 A 66 ARG CB C 13 30.213 0.1 A 66 ARG CD C 13 44.133 0.1 A 66 ARG CG C 13 26.977 0.1 A 66 ARG N N 15 118.441 0.1 A 67 HIS H H 1 7.103 0.02 A 67 HIS HA H 1 4.853 0.02 A 67 HIS HBy H 1 3.118 0.02 A 67 HIS HBx H 1 2.733 0.02 A 67 HIS HD2 H 1 6.797 0.02 A 67 HIS HE1 H 1 7.612 0.02 A 67 HIS C C 13 175.441 0.1 A 67 HIS CA C 13 53.701 0.1 A 67 HIS CB C 13 32.193 0.1 A 67 HIS CD2 C 13 125.835 0.1 A 67 HIS CE1 C 13 139.300 0.1 A 67 HIS N N 15 115.596 0.1 A 68 GLU H H 1 9.108 0.02 A 68 GLU HA H 1 4.557 0.02 A 68 GLU HBy H 1 2.443 0.02 A 68 GLU HBx H 1 1.944 0.02 A 68 GLU HGy H 1 2.571 0.02 A 68 GLU HGx H 1 2.405 0.02 A 68 GLU C C 13 179.176 0.1 A 68 GLU CB C 13 30.861 0.1 A 68 GLU CG C 13 36.688 0.1 A 68 GLU N N 15 122.112 0.1 A 69 ARG H H 1 7.161 0.02 A 69 ARG HA H 1 3.834 0.02 A 69 ARG HBy H 1 1.896 0.02 A 69 ARG HBx H 1 1.753 0.02 A 69 ARG HDy H 1 3.129 0.02 A 69 ARG HDx H 1 2.766 0.02 A 69 ARG HGy H 1 1.756 0.02 A 69 ARG HGx H 1 1.427 0.02 A 69 ARG C C 13 178.521 0.1 A 69 ARG CA C 13 61.629 0.1 A 69 ARG CB C 13 31.062 0.1 A 69 ARG CD C 13 44.387 0.1 A 69 ARG CG C 13 29.243 0.1 A 70 ASP H H 1 9.096 0.02 A 70 ASP HA H 1 3.953 0.02 A 70 ASP HB2 H 1 2.554 0.02 A 70 ASP C C 13 177.885 0.1 A 70 ASP CA C 13 57.445 0.1 A 70 ASP CB C 13 39.358 0.1 A 70 ASP N N 15 115.766 0.1 A 71 GLU H H 1 7.154 0.02 A 71 GLU HA H 1 4.126 0.02 A 71 GLU HBy H 1 2.411 0.02 A 71 GLU HBx H 1 2.221 0.02 A 71 GLU HGy H 1 2.426 0.02 A 71 GLU HGx H 1 2.340 0.02 A 71 GLU C C 13 180.288 0.1 A 71 GLU CA C 13 59.345 0.1 A 71 GLU CB C 13 30.449 0.1 A 71 GLU CG C 13 37.012 0.1 A 71 GLU N N 15 121.210 0.1 A 72 ILE H H 1 7.730 0.02 A 72 ILE HA H 1 3.499 0.02 A 72 ILE HB H 1 1.891 0.02 A 72 ILE HD1% H 1 0.964 0.02 A 72 ILE HG1y H 1 1.874 0.02 A 72 ILE HG1x H 1 0.659 0.02 A 72 ILE HG2% H 1 0.755 0.02 A 72 ILE C C 13 177.663 0.1 A 72 ILE CA C 13 66.504 0.1 A 72 ILE CB C 13 38.250 0.1 A 72 ILE CD1 C 13 13.705 0.1 A 72 ILE CG1 C 13 28.919 0.1 A 72 ILE CG2 C 13 18.237 0.1 A 72 ILE N N 15 119.643 0.1 A 73 MET H H 1 8.436 0.02 A 73 MET HA H 1 4.090 0.02 A 73 MET HB2 H 1 2.054 0.02 A 73 MET HE% H 1 1.884 0.02 A 73 MET HGy H 1 2.500 0.02 A 73 MET HGx H 1 2.390 0.02 A 73 MET C C 13 179.600 0.1 A 73 MET CA C 13 58.537 0.1 A 73 MET CB C 13 33.513 0.1 A 73 MET CE C 13 19.531 0.1 A 73 MET CG C 13 33.451 0.1 A 73 MET N N 15 117.584 0.1 A 74 GLU H H 1 8.795 0.02 A 74 GLU HA H 1 3.662 0.02 A 74 GLU HBy H 1 2.269 0.02 A 74 GLU HBx H 1 2.145 0.02 A 74 GLU HGy H 1 2.318 0.02 A 74 GLU HGx H 1 2.145 0.02 A 74 GLU C C 13 177.293 0.1 A 74 GLU CA C 13 61.242 0.1 A 74 GLU CB C 13 29.890 0.1 A 74 GLU CG C 13 37.012 0.1 A 74 GLU N N 15 123.489 0.1 A 75 GLU H H 1 7.550 0.02 A 75 GLU HA H 1 4.415 0.02 A 75 GLU HBy H 1 2.171 0.02 A 75 GLU HBx H 1 1.951 0.02 A 75 GLU HGy H 1 2.245 0.02 A 75 GLU HGx H 1 2.133 0.02 A 75 GLU C C 13 178.837 0.1 A 75 GLU CA C 13 59.599 0.1 A 75 GLU CB C 13 29.243 0.1 A 75 GLU CG C 13 34.098 0.1 A 75 GLU N N 15 120.934 0.1 A 76 LEU H H 1 8.169 0.02 A 76 LEU HA H 1 3.915 0.02 A 76 LEU HBy H 1 1.724 0.02 A 76 LEU HBx H 1 1.270 0.02 A 76 LEU HDx% H 1 0.354 0.02 A 76 LEU HDy% H 1 0.256 0.02 A 76 LEU HG H 1 1.568 0.02 A 76 LEU C C 13 180.643 0.1 A 76 LEU CA C 13 59.222 0.1 A 76 LEU CB C 13 43.412 0.1 A 76 LEU CD1 C 13 24.711 0.1 A 76 LEU CD2 C 13 24.063 0.1 A 76 LEU CG C 13 28.272 0.1 A 76 LEU N N 15 117.710 0.1 A 77 THR H H 1 8.182 0.02 A 77 THR HA H 1 3.805 0.02 A 77 THR HB H 1 4.046 0.02 A 77 THR HG2% H 1 1.126 0.02 A 77 THR C C 13 176.427 0.1 A 77 THR CA C 13 68.434 0.1 A 77 THR CB C 13 68.734 0.1 A 77 THR CG2 C 13 22.121 0.1 A 77 THR N N 15 116.735 0.1 A 78 LYS H H 1 8.898 0.02 A 78 LYS HA H 1 3.842 0.02 A 78 LYS HB2 H 1 2.010 0.02 A 78 LYS HDy H 1 1.863 0.02 A 78 LYS HDx H 1 1.800 0.02 A 78 LYS HE2 H 1 3.000 0.02 A 78 LYS HGy H 1 1.824 0.02 A 78 LYS HGx H 1 1.428 0.02 A 78 LYS C C 13 178.204 0.1 A 78 LYS CA C 13 61.826 0.1 A 78 LYS CB C 13 33.183 0.1 A 78 LYS CD C 13 30.214 0.1 A 78 LYS CE C 13 42.514 0.1 A 78 LYS CG C 13 27.300 0.1 A 78 LYS N N 15 121.955 0.1 A 79 TYR H H 1 8.427 0.02 A 79 TYR HA H 1 4.176 0.02 A 79 TYR HBy H 1 3.689 0.02 A 79 TYR HBx H 1 3.379 0.02 A 79 TYR HD1 H 1 7.580 0.02 A 79 TYR HD2 H 1 7.580 0.02 A 79 TYR HE1 H 1 6.705 0.02 A 79 TYR HE2 H 1 6.705 0.02 A 79 TYR C C 13 178.512 0.1 A 79 TYR CA C 13 63.212 0.1 A 79 TYR CB C 13 39.925 0.1 A 79 TYR CD1 C 13 134.380 0.1 A 79 TYR CE1 C 13 118.843 0.1 A 79 TYR N N 15 118.386 0.1 A 80 TYR H H 1 7.991 0.02 A 80 TYR HA H 1 3.987 0.02 A 80 TYR HBy H 1 3.894 0.02 A 80 TYR HBx H 1 2.971 0.02 A 80 TYR HD1 H 1 6.699 0.02 A 80 TYR HD2 H 1 6.699 0.02 A 80 TYR HE1 H 1 6.188 0.02 A 80 TYR HE2 H 1 6.188 0.02 A 80 TYR C C 13 180.500 0.1 A 80 TYR CA C 13 63.279 0.1 A 80 TYR CB C 13 39.925 0.1 A 80 TYR CD1 C 13 133.085 0.1 A 80 TYR CE1 C 13 117.807 0.1 A 80 TYR N N 15 119.361 0.1 A 81 LEU H H 1 8.548 0.02 A 81 LEU HA H 1 3.904 0.02 A 81 LEU HBy H 1 1.833 0.02 A 81 LEU HBx H 1 1.085 0.02 A 81 LEU HDx% H 1 0.856 0.02 A 81 LEU HDy% H 1 0.781 0.02 A 81 LEU HG H 1 1.996 0.02 A 81 LEU C C 13 179.008 0.1 A 81 LEU CA C 13 59.090 0.1 A 81 LEU CB C 13 41.543 0.1 A 81 LEU CD1 C 13 27.624 0.1 A 81 LEU CD2 C 13 22.769 0.1 A 81 LEU CG C 13 27.948 0.1 A 81 LEU N N 15 120.908 0.1 A 82 ALA H H 1 8.690 0.02 A 82 ALA HA H 1 4.717 0.02 A 82 ALA HB% H 1 1.428 0.02 A 82 ALA C C 13 181.031 0.1 A 82 ALA CA C 13 54.813 0.1 A 82 ALA CB C 13 18.712 0.1 A 82 ALA N N 15 122.333 0.1 A 83 ASN H H 1 7.279 0.02 A 83 ASN HA H 1 4.512 0.02 A 83 ASN HBy H 1 2.838 0.02 A 83 ASN HBx H 1 2.323 0.02 A 83 ASN HD2y H 1 6.949 0.02 A 83 ASN HD2x H 1 6.173 0.02 A 83 ASN C C 13 174.809 0.1 A 83 ASN CA C 13 55.272 0.1 A 83 ASN CB C 13 40.275 0.1 A 83 ASN N N 15 113.565 0.1 A 83 ASN ND2 N 15 114.119 0.1 A 84 HIS H H 1 7.532 0.02 A 84 HIS HA H 1 4.465 0.02 A 84 HIS HBy H 1 3.599 0.02 A 84 HIS HBx H 1 2.470 0.02 A 84 HIS HD2 H 1 7.030 0.02 A 84 HIS HE1 H 1 7.632 0.02 A 84 HIS C C 13 174.646 0.1 A 84 HIS CA C 13 57.792 0.1 A 84 HIS CB C 13 28.186 0.1 A 84 HIS CD2 C 13 121.174 0.1 A 84 HIS CE1 C 13 139.041 0.1 A 84 HIS N N 15 116.863 0.1 A 85 GLY H H 1 7.586 0.02 A 85 GLY HAy H 1 4.118 0.02 A 85 GLY HAx H 1 3.631 0.02 A 85 GLY C C 13 174.284 0.1 A 85 GLY CA C 13 46.615 0.1 A 85 GLY N N 15 105.790 0.1 A 86 ILE H H 1 7.458 0.02 A 86 ILE HA H 1 3.969 0.02 A 86 ILE HB H 1 1.325 0.02 A 86 ILE HD1% H 1 0.594 0.02 A 86 ILE HG1y H 1 1.055 0.02 A 86 ILE HG1x H 1 1.025 0.02 A 86 ILE HG2% H 1 0.138 0.02 A 86 ILE C C 13 175.218 0.1 A 86 ILE CA C 13 60.353 0.1 A 86 ILE CB C 13 37.640 0.1 A 86 ILE CD1 C 13 12.734 0.1 A 86 ILE CG1 C 13 28.272 0.1 A 86 ILE CG2 C 13 17.913 0.1 A 86 ILE N N 15 121.652 0.1 A 87 ASP H H 1 8.253 0.02 A 87 ASP HA H 1 4.604 0.02 A 87 ASP HBy H 1 2.706 0.02 A 87 ASP HBx H 1 2.553 0.02 A 87 ASP C C 13 175.338 0.1 A 87 ASP CA C 13 54.301 0.1 A 87 ASP CB C 13 40.620 0.1 A 87 ASP N N 15 127.023 0.1 A 88 ILE H H 1 7.831 0.02 A 88 ILE HA H 1 4.254 0.02 A 88 ILE HB H 1 1.904 0.02 A 88 ILE HD1% H 1 0.870 0.02 A 88 ILE HG1y H 1 1.483 0.02 A 88 ILE HG1x H 1 1.220 0.02 A 88 ILE HG2% H 1 0.945 0.02 A 88 ILE C C 13 175.364 0.1 A 88 ILE CA C 13 60.912 0.1 A 88 ILE CB C 13 39.197 0.1 A 88 ILE CD1 C 13 14.029 0.1 A 88 ILE CG1 C 13 27.503 0.1 A 88 ILE CG2 C 13 18.171 0.1 A 88 ILE N N 15 125.104 0.1 A 89 LYS H H 1 7.908 0.02 A 89 LYS HA H 1 4.230 0.02 A 89 LYS HBy H 1 1.865 0.02 A 89 LYS HBx H 1 1.779 0.02 A 89 LYS HD2 H 1 1.709 0.02 A 89 LYS HE2 H 1 3.045 0.02 A 89 LYS HG2 H 1 1.454 0.02 A 89 LYS CA C 13 58.376 0.1 A 89 LYS CB C 13 34.098 0.1 A 89 LYS CD C 13 29.566 0.1 A 89 LYS CG C 13 25.035 0.1 A 89 LYS N N 15 131.647 0.1 B 3 PHE HA H 1 4.728 0.02 B 3 PHE HBy H 1 3.195 0.02 B 3 PHE HBx H 1 3.045 0.02 B 3 PHE CA C 13 58.376 0.1 B 3 PHE CB C 13 40.225 0.1 B 4 THR HA H 1 4.359 0.02 B 4 THR C C 13 174.241 0.1 B 4 THR CA C 13 62.218 0.1 B 4 THR CB C 13 68.084 0.1 B 4 THR CG2 C 13 21.766 0.1 B 5 ASP H H 1 8.166 0.02 B 5 ASP HA H 1 4.624 0.02 B 5 ASP HBy H 1 2.774 0.02 B 5 ASP HBx H 1 2.671 0.02 B 5 ASP C C 13 176.573 0.1 B 5 ASP CA C 13 54.959 0.1 B 5 ASP CB C 13 41.903 0.1 B 5 ASP N N 15 122.703 0.1 B 6 GLU H H 1 8.330 0.02 B 6 GLU HA H 1 4.316 0.02 B 6 GLU HBy H 1 2.109 0.02 B 6 GLU HBx H 1 1.974 0.02 B 6 GLU HG2 H 1 2.273 0.02 B 6 GLU C C 13 177.039 0.1 B 6 GLU CA C 13 57.445 0.1 B 6 GLU CB C 13 30.779 0.1 B 6 GLU CG C 13 37.022 0.1 B 6 GLU N N 15 121.507 0.1 B 7 THR H H 1 8.142 0.02 B 7 THR HA H 1 4.289 0.02 B 7 THR HB H 1 4.170 0.02 B 7 THR HG2% H 1 1.168 0.02 B 7 THR C C 13 174.893 0.1 B 7 THR CA C 13 63.131 0.1 B 7 THR CB C 13 70.469 0.1 B 7 THR CG2 C 13 22.277 0.1 B 7 THR N N 15 115.417 0.1 B 8 VAL H H 1 7.896 0.02 B 8 VAL HA H 1 4.066 0.02 B 8 VAL HB H 1 1.952 0.02 B 8 VAL HGx% H 1 0.831 0.02 B 8 VAL HGy% H 1 0.775 0.02 B 8 VAL C C 13 175.724 0.1 B 8 VAL CA C 13 62.707 0.1 B 8 VAL CB C 13 33.136 0.1 B 8 VAL CG1 C 13 21.344 0.1 B 8 VAL CG2 C 13 21.717 0.1 B 8 VAL N N 15 122.882 0.1 B 9 ARG H H 1 8.012 0.02 B 9 ARG HA H 1 4.309 0.02 B 9 ARG HBy H 1 1.701 0.02 B 9 ARG HBx H 1 1.640 0.02 B 9 ARG HD2 H 1 3.118 0.02 B 9 ARG HGy H 1 1.509 0.02 B 9 ARG HGx H 1 1.420 0.02 B 9 ARG C C 13 176.000 0.1 B 9 ARG CA C 13 56.145 0.1 B 9 ARG CB C 13 31.835 0.1 B 9 ARG CD C 13 43.809 0.1 B 9 ARG CG C 13 27.876 0.1 B 9 ARG N N 15 124.175 0.1 B 10 PHE H H 1 8.226 0.02 B 10 PHE HA H 1 4.615 0.02 B 10 PHE HBy H 1 3.043 0.02 B 10 PHE HBx H 1 2.859 0.02 B 10 PHE HD1 H 1 7.174 0.02 B 10 PHE HD2 H 1 7.174 0.02 B 10 PHE C C 13 175.407 0.1 B 10 PHE CA C 13 58.044 0.1 B 10 PHE CB C 13 40.125 0.1 B 10 PHE CD1 C 13 132.309 0.1 B 10 PHE N N 15 121.954 0.1 B 11 ASP H H 1 8.148 0.02 B 11 ASP HA H 1 4.571 0.02 B 11 ASP HB2 H 1 2.564 0.02 B 11 ASP C C 13 176.000 0.1 B 11 ASP CA C 13 54.553 0.1 B 11 ASP CB C 13 41.889 0.1 B 11 ASP N N 15 121.918 0.1 B 12 PHE H H 1 7.958 0.02 B 12 PHE HA H 1 4.558 0.02 B 12 PHE HBy H 1 3.167 0.02 B 12 PHE HBx H 1 3.032 0.02 B 12 PHE HD1 H 1 7.271 0.02 B 12 PHE HD2 H 1 7.271 0.02 B 12 PHE C C 13 175.947 0.1 B 12 PHE CA C 13 58.541 0.1 B 12 PHE CB C 13 40.094 0.1 B 12 PHE CD1 C 13 132.309 0.1 B 12 PHE N N 15 120.505 0.1 B 13 ASP H H 1 8.193 0.02 B 13 ASP HA H 1 4.580 0.02 B 13 ASP HB2 H 1 2.667 0.02 B 13 ASP C C 13 176.487 0.1 B 13 ASP CA C 13 55.165 0.1 B 13 ASP CB C 13 42.280 0.1 B 13 ASP N N 15 121.885 0.1 B 14 ASP H H 1 8.124 0.02 B 14 ASP HA H 1 4.516 0.02 B 14 ASP HB2 H 1 2.687 0.02 B 14 ASP C C 13 177.039 0.1 B 14 ASP CA C 13 55.539 0.1 B 14 ASP CB C 13 41.856 0.1 B 14 ASP N N 15 121.296 0.1 B 15 ASN H H 1 8.320 0.02 B 15 ASN HA H 1 4.628 0.02 B 15 ASN HB2 H 1 2.827 0.02 B 15 ASN HD2y H 1 7.434 0.02 B 15 ASN HD2x H 1 6.747 0.02 B 15 ASN C C 13 176.256 0.1 B 15 ASN CA C 13 54.629 0.1 B 15 ASN CB C 13 39.216 0.1 B 15 ASN N N 15 118.912 0.1 B 15 ASN ND2 N 15 112.142 0.1 B 16 ARG H H 1 8.006 0.02 B 16 ARG HA H 1 4.242 0.02 B 16 ARG HBy H 1 1.896 0.02 B 16 ARG HBx H 1 1.818 0.02 B 16 ARG HD2 H 1 3.207 0.02 B 16 ARG HG2 H 1 1.616 0.02 B 16 ARG C C 13 177.099 0.1 B 16 ARG CA C 13 57.776 0.1 B 16 ARG CB C 13 30.861 0.1 B 16 ARG CD C 13 43.809 0.1 B 16 ARG CG C 13 27.690 0.1 B 16 ARG N N 15 120.924 0.1 B 17 LYS H H 1 8.114 0.02 B 17 LYS HA H 1 4.138 0.02 B 17 LYS HBy H 1 1.852 0.02 B 17 LYS HBx H 1 1.812 0.02 B 17 LYS HD2 H 1 1.681 0.02 B 17 LYS HE2 H 1 3.010 0.02 B 17 LYS HG2 H 1 1.424 0.02 B 17 LYS C C 13 177.602 0.1 B 17 LYS CA C 13 57.985 0.1 B 17 LYS CB C 13 33.277 0.1 B 17 LYS CD C 13 29.566 0.1 B 17 LYS CG C 13 25.637 0.1 B 17 LYS N N 15 121.442 0.1 B 18 LYS H H 1 8.120 0.02 B 18 LYS HA H 1 4.309 0.02 B 18 LYS HBy H 1 1.867 0.02 B 18 LYS HBx H 1 1.803 0.02 B 18 LYS HD2 H 1 1.672 0.02 B 18 LYS HE2 H 1 3.013 0.02 B 18 LYS HG2 H 1 1.486 0.02 B 18 LYS C C 13 177.096 0.1 B 18 LYS CA C 13 57.117 0.1 B 18 LYS CB C 13 33.900 0.1 B 18 LYS CD C 13 29.566 0.1 B 18 LYS CG C 13 25.682 0.1 B 18 LYS N N 15 122.812 0.1 B 19 ALA H H 1 8.325 0.02 B 19 ALA HA H 1 4.413 0.02 B 19 ALA HB% H 1 1.566 0.02 B 19 ALA C C 13 179.372 0.1 B 19 ALA CA C 13 53.520 0.1 B 19 ALA CB C 13 19.531 0.1 B 19 ALA N N 15 123.622 0.1 B 20 ILE H H 1 8.331 0.02 B 20 ILE HA H 1 3.187 0.02 B 20 ILE HB H 1 1.610 0.02 B 20 ILE HD1% H 1 0.586 0.02 B 20 ILE HG1y H 1 1.342 0.02 B 20 ILE HG1x H 1 0.023 0.02 B 20 ILE HG2% H 1 0.531 0.02 B 20 ILE C C 13 177.753 0.1 B 20 ILE CA C 13 66.247 0.1 B 20 ILE CB C 13 37.983 0.1 B 20 ILE CD1 C 13 14.029 0.1 B 20 ILE CG1 C 13 29.243 0.1 B 20 ILE CG2 C 13 17.589 0.1 B 20 ILE N N 15 122.213 0.1 B 21 SER H H 1 8.237 0.02 B 21 SER HA H 1 3.954 0.02 B 21 SER HBy H 1 3.855 0.02 B 21 SER HBx H 1 3.679 0.02 B 21 SER HG H 1 6.227 0.02 B 21 SER C C 13 176.882 0.1 B 21 SER CA C 13 62.547 0.1 B 21 SER CB C 13 61.937 0.1 B 21 SER N N 15 114.975 0.1 B 22 GLU H H 1 7.287 0.02 B 22 GLU HA H 1 4.218 0.02 B 22 GLU HBy H 1 2.218 0.02 B 22 GLU HBx H 1 2.139 0.02 B 22 GLU HGy H 1 2.403 0.02 B 22 GLU HGx H 1 2.256 0.02 B 22 GLU C C 13 179.947 0.1 B 22 GLU CA C 13 59.660 0.1 B 22 GLU CB C 13 30.449 0.1 B 22 GLU CG C 13 37.335 0.1 B 22 GLU N N 15 122.757 0.1 B 23 THR H H 1 8.466 0.02 B 23 THR HA H 1 3.789 0.02 B 23 THR HB H 1 4.376 0.02 B 23 THR HG2% H 1 1.162 0.02 B 23 THR C C 13 176.326 0.1 B 23 THR CA C 13 67.892 0.1 B 23 THR CB C 13 67.993 0.1 B 23 THR CG2 C 13 23.416 0.1 B 23 THR N N 15 119.291 0.1 B 24 LEU H H 1 8.584 0.02 B 24 LEU HA H 1 3.919 0.02 B 24 LEU HBy H 1 1.886 0.02 B 24 LEU HBx H 1 1.318 0.02 B 24 LEU HDx% H 1 0.594 0.02 B 24 LEU HDy% H 1 0.727 0.02 B 24 LEU HG H 1 1.784 0.02 B 24 LEU C C 13 178.539 0.1 B 24 LEU CA C 13 58.955 0.1 B 24 LEU CB C 13 41.998 0.1 B 24 LEU CD1 C 13 26.395 0.1 B 24 LEU CD2 C 13 22.866 0.1 B 24 LEU CG C 13 27.624 0.1 B 24 LEU N N 15 119.050 0.1 B 25 GLU H H 1 8.167 0.02 B 25 GLU HA H 1 3.849 0.02 B 25 GLU HBy H 1 2.222 0.02 B 25 GLU HBx H 1 2.163 0.02 B 25 GLU HGy H 1 2.305 0.02 B 25 GLU HGx H 1 2.236 0.02 B 25 GLU C C 13 178.186 0.1 B 25 GLU CA C 13 60.992 0.1 B 25 GLU CB C 13 29.700 0.1 B 25 GLU CG C 13 36.365 0.1 B 25 GLU N N 15 119.549 0.1 B 26 THR H H 1 7.998 0.02 B 26 THR HA H 1 3.964 0.02 B 26 THR HB H 1 4.299 0.02 B 26 THR HG2% H 1 1.237 0.02 B 26 THR C C 13 177.285 0.1 B 26 THR CA C 13 67.722 0.1 B 26 THR CB C 13 69.434 0.1 B 26 THR CG2 C 13 22.116 0.1 B 26 THR N N 15 116.364 0.1 B 27 VAL H H 1 8.500 0.02 B 27 VAL HA H 1 3.509 0.02 B 27 VAL HB H 1 2.182 0.02 B 27 VAL HGx% H 1 1.099 0.02 B 27 VAL HGy% H 1 0.909 0.02 B 27 VAL C C 13 177.003 0.1 B 27 VAL CA C 13 67.545 0.1 B 27 VAL CB C 13 32.480 0.1 B 27 VAL CG1 C 13 24.387 0.1 B 27 VAL CG2 C 13 22.445 0.1 B 27 VAL N N 15 121.571 0.1 B 28 TYR H H 1 8.753 0.02 B 28 TYR HA H 1 3.763 0.02 B 28 TYR HBy H 1 3.413 0.02 B 28 TYR HBx H 1 2.934 0.02 B 28 TYR HD1 H 1 6.748 0.02 B 28 TYR HD2 H 1 6.748 0.02 B 28 TYR HE1 H 1 6.697 0.02 B 28 TYR HE2 H 1 6.697 0.02 B 28 TYR C C 13 177.328 0.1 B 28 TYR CA C 13 63.548 0.1 B 28 TYR CB C 13 39.300 0.1 B 28 TYR CD1 C 13 133.344 0.1 B 28 TYR CE1 C 13 118.843 0.1 B 28 TYR N N 15 120.213 0.1 B 29 ARG H H 1 8.341 0.02 B 29 ARG HA H 1 4.231 0.02 B 29 ARG HBy H 1 2.166 0.02 B 29 ARG HBx H 1 2.095 0.02 B 29 ARG HDy H 1 3.432 0.02 B 29 ARG HDx H 1 3.326 0.02 B 29 ARG HGy H 1 2.135 0.02 B 29 ARG HGx H 1 1.984 0.02 B 29 ARG C C 13 179.274 0.1 B 29 ARG CA C 13 59.812 0.1 B 29 ARG CB C 13 30.449 0.1 B 29 ARG CD C 13 43.809 0.1 B 29 ARG CG C 13 28.595 0.1 B 29 ARG N N 15 117.151 0.1 B 30 ALA H H 1 8.179 0.02 B 30 ALA HA H 1 4.240 0.02 B 30 ALA HB% H 1 1.496 0.02 B 30 ALA C C 13 179.604 0.1 B 30 ALA CA C 13 56.006 0.1 B 30 ALA CB C 13 19.278 0.1 B 30 ALA N N 15 122.727 0.1 B 31 LEU H H 1 7.948 0.02 B 31 LEU HA H 1 3.903 0.02 B 31 LEU HBy H 1 2.114 0.02 B 31 LEU HBx H 1 1.034 0.02 B 31 LEU HDx% H 1 0.956 0.02 B 31 LEU HDy% H 1 0.700 0.02 B 31 LEU HG H 1 1.661 0.02 B 31 LEU C C 13 179.025 0.1 B 31 LEU CA C 13 58.740 0.1 B 31 LEU CB C 13 42.940 0.1 B 31 LEU CD1 C 13 26.977 0.1 B 31 LEU CD2 C 13 26.329 0.1 B 31 LEU CG C 13 28.919 0.1 B 31 LEU N N 15 116.115 0.1 B 32 GLU H H 1 8.548 0.02 B 32 GLU HA H 1 4.044 0.02 B 32 GLU HBy H 1 2.228 0.02 B 32 GLU HBx H 1 1.897 0.02 B 32 GLU HGy H 1 2.284 0.02 B 32 GLU HGx H 1 2.253 0.02 B 32 GLU C C 13 180.986 0.1 B 32 GLU CA C 13 60.043 0.1 B 32 GLU CB C 13 30.684 0.1 B 32 GLU CG C 13 37.012 0.1 B 32 GLU N N 15 120.908 0.1 B 33 GLU H H 1 8.327 0.02 B 33 GLU HA H 1 4.128 0.02 B 33 GLU HBy H 1 2.392 0.02 B 33 GLU HBx H 1 2.221 0.02 B 33 GLU HGy H 1 2.553 0.02 B 33 GLU HGx H 1 2.405 0.02 B 33 GLU C C 13 178.439 0.1 B 33 GLU CA C 13 59.729 0.1 B 33 GLU CB C 13 30.355 0.1 B 33 GLU CG C 13 37.012 0.1 B 33 GLU N N 15 120.190 0.1 B 34 LYS H H 1 7.228 0.02 B 34 LYS HA H 1 4.291 0.02 B 34 LYS HBy H 1 2.089 0.02 B 34 LYS HBx H 1 1.852 0.02 B 34 LYS HDy H 1 1.358 0.02 B 34 LYS HDx H 1 1.186 0.02 B 34 LYS HEy H 1 2.541 0.02 B 34 LYS HEx H 1 2.309 0.02 B 34 LYS HG2 H 1 1.229 0.02 B 34 LYS C C 13 176.579 0.1 B 34 LYS CA C 13 54.400 0.1 B 34 LYS CB C 13 32.806 0.1 B 34 LYS CD C 13 27.624 0.1 B 34 LYS CE C 13 42.191 0.1 B 34 LYS CG C 13 25.035 0.1 B 34 LYS N N 15 115.391 0.1 B 35 GLY H H 1 7.712 0.02 B 35 GLY HAy H 1 4.019 0.02 B 35 GLY HAx H 1 3.785 0.02 B 35 GLY C C 13 175.188 0.1 B 35 GLY CA C 13 46.370 0.1 B 35 GLY N N 15 106.626 0.1 B 36 TYR H H 1 7.631 0.02 B 36 TYR HA H 1 4.458 0.02 B 36 TYR HBy H 1 2.793 0.02 B 36 TYR HBx H 1 2.468 0.02 B 36 TYR HD1 H 1 7.145 0.02 B 36 TYR HD2 H 1 7.145 0.02 B 36 TYR HE1 H 1 6.736 0.02 B 36 TYR HE2 H 1 6.736 0.02 B 36 TYR C C 13 175.489 0.1 B 36 TYR CA C 13 58.097 0.1 B 36 TYR CB C 13 40.572 0.1 B 36 TYR CD1 C 13 133.603 0.1 B 36 TYR CE1 C 13 118.843 0.1 B 36 TYR N N 15 117.982 0.1 B 37 ASN H H 1 8.948 0.02 B 37 ASN HA H 1 5.092 0.02 B 37 ASN HBy H 1 3.202 0.02 B 37 ASN HBx H 1 2.883 0.02 B 37 ASN HD2y H 1 7.702 0.02 B 37 ASN HD2x H 1 6.985 0.02 B 37 ASN C C 13 175.347 0.1 B 37 ASN CA C 13 50.931 0.1 B 37 ASN CB C 13 38.630 0.1 B 37 ASN N N 15 120.671 0.1 B 37 ASN ND2 N 15 114.164 0.1 B 38 PRO HA H 1 3.907 0.02 B 38 PRO HBy H 1 1.947 0.02 B 38 PRO HBx H 1 1.528 0.02 B 38 PRO HDy H 1 4.430 0.02 B 38 PRO HDx H 1 3.682 0.02 B 38 PRO HGy H 1 1.266 0.02 B 38 PRO HGx H 1 1.217 0.02 B 38 PRO C C 13 179.369 0.1 B 38 PRO CA C 13 65.497 0.1 B 38 PRO CB C 13 34.422 0.1 B 38 PRO CD C 13 51.902 0.1 B 38 PRO CG C 13 28.595 0.1 B 39 ILE H H 1 7.601 0.02 B 39 ILE HA H 1 3.663 0.02 B 39 ILE HB H 1 2.319 0.02 B 39 ILE HD1% H 1 0.969 0.02 B 39 ILE HG1y H 1 1.748 0.02 B 39 ILE HG1x H 1 1.667 0.02 B 39 ILE HG2% H 1 1.009 0.02 B 39 ILE C C 13 177.572 0.1 B 39 ILE CA C 13 63.931 0.1 B 39 ILE CB C 13 36.000 0.1 B 39 ILE CD1 C 13 11.439 0.1 B 39 ILE CG1 C 13 28.919 0.1 B 39 ILE CG2 C 13 18.560 0.1 B 39 ILE N N 15 113.904 0.1 B 40 ASN H H 1 7.494 0.02 B 40 ASN HA H 1 4.353 0.02 B 40 ASN HBy H 1 2.934 0.02 B 40 ASN HBx H 1 2.845 0.02 B 40 ASN HD2y H 1 7.645 0.02 B 40 ASN HD2x H 1 6.953 0.02 B 40 ASN C C 13 179.017 0.1 B 40 ASN CA C 13 56.757 0.1 B 40 ASN CB C 13 38.630 0.1 B 40 ASN N N 15 117.383 0.1 B 40 ASN ND2 N 15 111.331 0.1 B 41 GLN H H 1 7.551 0.02 B 41 GLN HA H 1 4.268 0.02 B 41 GLN HBy H 1 2.566 0.02 B 41 GLN HBx H 1 2.039 0.02 B 41 GLN HE2y H 1 8.435 0.02 B 41 GLN HE2x H 1 7.436 0.02 B 41 GLN HGy H 1 2.758 0.02 B 41 GLN HGx H 1 2.315 0.02 B 41 GLN C C 13 177.626 0.1 B 41 GLN CA C 13 58.664 0.1 B 41 GLN CB C 13 29.082 0.1 B 41 GLN CG C 13 35.393 0.1 B 41 GLN N N 15 116.237 0.1 B 41 GLN NE2 N 15 112.355 0.1 B 42 ILE H H 1 8.146 0.02 B 42 ILE HA H 1 3.454 0.02 B 42 ILE HB H 1 1.836 0.02 B 42 ILE HD1% H 1 0.833 0.02 B 42 ILE HG1y H 1 1.895 0.02 B 42 ILE HG1x H 1 0.589 0.02 B 42 ILE HG2% H 1 0.836 0.02 B 42 ILE C C 13 177.807 0.1 B 42 ILE CA C 13 67.217 0.1 B 42 ILE CB C 13 38.792 0.1 B 42 ILE CD1 C 13 13.469 0.1 B 42 ILE CG1 C 13 30.637 0.1 B 42 ILE CG2 C 13 17.266 0.1 B 42 ILE N N 15 119.408 0.1 B 43 VAL H H 1 8.636 0.02 B 43 VAL HA H 1 3.296 0.02 B 43 VAL HB H 1 2.176 0.02 B 43 VAL HGx% H 1 0.908 0.02 B 43 VAL HGy% H 1 0.900 0.02 B 43 VAL C C 13 177.301 0.1 B 43 VAL CA C 13 68.211 0.1 B 43 VAL CB C 13 31.800 0.1 B 43 VAL CG1 C 13 24.711 0.1 B 43 VAL CG2 C 13 22.121 0.1 B 43 VAL N N 15 119.749 0.1 B 44 GLY H H 1 7.765 0.02 B 44 GLY HAy H 1 3.331 0.02 B 44 GLY HAx H 1 2.837 0.02 B 44 GLY C C 13 177.705 0.1 B 44 GLY CA C 13 46.924 0.1 B 44 GLY N N 15 105.716 0.1 B 45 TYR H H 1 7.931 0.02 B 45 TYR HA H 1 3.906 0.02 B 45 TYR HB2 H 1 3.033 0.02 B 45 TYR HD1 H 1 6.898 0.02 B 45 TYR HD2 H 1 6.898 0.02 B 45 TYR HE1 H 1 6.445 0.02 B 45 TYR HE2 H 1 6.445 0.02 B 45 TYR C C 13 177.259 0.1 B 45 TYR CA C 13 62.155 0.1 B 45 TYR CB C 13 39.262 0.1 B 45 TYR CD1 C 13 133.344 0.1 B 45 TYR CE1 C 13 117.289 0.1 B 45 TYR N N 15 123.504 0.1 B 46 LEU H H 1 8.582 0.02 B 46 LEU HA H 1 3.383 0.02 B 46 LEU HBy H 1 1.896 0.02 B 46 LEU HBx H 1 1.250 0.02 B 46 LEU HDx% H 1 0.707 0.02 B 46 LEU HDy% H 1 0.815 0.02 B 46 LEU HG H 1 2.000 0.02 B 46 LEU C C 13 178.891 0.1 B 46 LEU CA C 13 58.993 0.1 B 46 LEU CB C 13 41.867 0.1 B 46 LEU CD1 C 13 26.653 0.1 B 46 LEU CD2 C 13 22.769 0.1 B 46 LEU CG C 13 27.300 0.1 B 46 LEU N N 15 120.870 0.1 B 47 LEU H H 1 8.194 0.02 B 47 LEU HA H 1 3.916 0.02 B 47 LEU HBy H 1 1.718 0.02 B 47 LEU HBx H 1 1.345 0.02 B 47 LEU HDx% H 1 0.666 0.02 B 47 LEU HDy% H 1 0.662 0.02 B 47 LEU HG H 1 1.617 0.02 B 47 LEU C C 13 178.042 0.1 B 47 LEU CA C 13 57.385 0.1 B 47 LEU CB C 13 43.129 0.1 B 47 LEU CD1 C 13 26.329 0.1 B 47 LEU CD2 C 13 23.740 0.1 B 47 LEU CG C 13 26.977 0.1 B 47 LEU N N 15 115.227 0.1 B 48 SER H H 1 7.453 0.02 B 48 SER HA H 1 4.547 0.02 B 48 SER HB2 H 1 3.984 0.02 B 48 SER C C 13 176.570 0.1 B 48 SER CA C 13 60.043 0.1 B 48 SER CB C 13 66.839 0.1 B 48 SER N N 15 111.236 0.1 B 49 GLY H H 1 8.869 0.02 B 49 GLY HAy H 1 3.970 0.02 B 49 GLY HAx H 1 2.944 0.02 B 49 GLY C C 13 173.089 0.1 B 49 GLY CA C 13 46.018 0.1 B 49 GLY N N 15 114.119 0.1 B 50 ASP H H 1 8.323 0.02 B 50 ASP HA H 1 5.059 0.02 B 50 ASP HBy H 1 3.363 0.02 B 50 ASP HBx H 1 2.589 0.02 B 50 ASP C C 13 176.996 0.1 B 50 ASP CA C 13 51.578 0.1 B 50 ASP CB C 13 42.191 0.1 B 50 ASP N N 15 121.699 0.1 B 51 PRO HA H 1 4.336 0.02 B 51 PRO HBy H 1 2.116 0.02 B 51 PRO HBx H 1 1.911 0.02 B 51 PRO HDy H 1 4.589 0.02 B 51 PRO HDx H 1 4.088 0.02 B 51 PRO HGy H 1 2.110 0.02 B 51 PRO HGx H 1 2.031 0.02 B 51 PRO C C 13 176.696 0.1 B 51 PRO CA C 13 64.560 0.1 B 51 PRO CB C 13 32.853 0.1 B 51 PRO CD C 13 51.902 0.1 B 51 PRO CG C 13 27.624 0.1 B 52 ALA H H 1 8.455 0.02 B 52 ALA HA H 1 3.963 0.02 B 52 ALA HB% H 1 1.253 0.02 B 52 ALA C C 13 179.252 0.1 B 52 ALA CA C 13 54.591 0.1 B 52 ALA CB C 13 18.712 0.1 B 52 ALA N N 15 120.096 0.1 B 53 TYR H H 1 7.417 0.02 B 53 TYR HA H 1 3.970 0.02 B 53 TYR HBy H 1 3.497 0.02 B 53 TYR HBx H 1 2.713 0.02 B 53 TYR HD1 H 1 7.475 0.02 B 53 TYR HD2 H 1 7.475 0.02 B 53 TYR HE1 H 1 6.903 0.02 B 53 TYR HE2 H 1 6.903 0.02 B 53 TYR C C 13 175.378 0.1 B 53 TYR CA C 13 62.011 0.1 B 53 TYR CB C 13 40.928 0.1 B 53 TYR CD1 C 13 133.344 0.1 B 53 TYR CE1 C 13 119.102 0.1 B 53 TYR N N 15 114.019 0.1 B 54 ILE H H 1 8.083 0.02 B 54 ILE HA H 1 4.543 0.02 B 54 ILE HB H 1 1.903 0.02 B 54 ILE HD1% H 1 0.435 0.02 B 54 ILE HG1y H 1 1.280 0.02 B 54 ILE HG1x H 1 0.832 0.02 B 54 ILE HG2% H 1 0.779 0.02 B 54 ILE C C 13 173.743 0.1 B 54 ILE CA C 13 54.815 0.1 B 54 ILE CB C 13 38.306 0.1 B 54 ILE CD1 C 13 9.173 0.1 B 54 ILE CG1 C 13 26.329 0.1 B 54 ILE CG2 C 13 16.618 0.1 B 54 ILE N N 15 119.458 0.1 B 55 PRO HA H 1 4.510 0.02 B 55 PRO HB2 H 1 1.929 0.02 B 55 PRO HDy H 1 3.501 0.02 B 55 PRO HDx H 1 3.306 0.02 B 55 PRO HGy H 1 1.667 0.02 B 55 PRO HGx H 1 1.620 0.02 B 55 PRO C C 13 175.284 0.1 B 55 PRO CA C 13 63.314 0.1 B 55 PRO CB C 13 33.203 0.1 B 55 PRO CD C 13 51.254 0.1 B 55 PRO CG C 13 26.977 0.1 B 56 ARG H H 1 8.479 0.02 B 56 ARG HA H 1 4.218 0.02 B 56 ARG HBy H 1 1.949 0.02 B 56 ARG HBx H 1 1.750 0.02 B 56 ARG HD2 H 1 3.251 0.02 B 56 ARG HGy H 1 1.657 0.02 B 56 ARG HGx H 1 1.572 0.02 B 56 ARG C C 13 176.985 0.1 B 56 ARG CA C 13 57.565 0.1 B 56 ARG CB C 13 30.537 0.1 B 56 ARG CD C 13 44.133 0.1 B 56 ARG CG C 13 28.919 0.1 B 56 ARG N N 15 117.843 0.1 B 57 TYR H H 1 7.142 0.02 B 57 TYR HA H 1 4.423 0.02 B 57 TYR HBy H 1 3.276 0.02 B 57 TYR HBx H 1 2.562 0.02 B 57 TYR HD1 H 1 7.139 0.02 B 57 TYR HD2 H 1 7.139 0.02 B 57 TYR HE1 H 1 6.965 0.02 B 57 TYR HE2 H 1 6.965 0.02 B 57 TYR C C 13 175.047 0.1 B 57 TYR CA C 13 58.944 0.1 B 57 TYR CB C 13 40.206 0.1 B 57 TYR CD1 C 13 133.862 0.1 B 57 TYR CE1 C 13 119.361 0.1 B 57 TYR N N 15 120.829 0.1 B 58 GLN H H 1 8.582 0.02 B 58 GLN HA H 1 3.546 0.02 B 58 GLN HBy H 1 2.086 0.02 B 58 GLN HBx H 1 1.639 0.02 B 58 GLN HE2y H 1 6.720 0.02 B 58 GLN HE2x H 1 6.575 0.02 B 58 GLN HG2 H 1 1.530 0.02 B 58 GLN C C 13 174.755 0.1 B 58 GLN CA C 13 57.681 0.1 B 58 GLN CB C 13 26.329 0.1 B 58 GLN CG C 13 34.098 0.1 B 58 GLN N N 15 122.570 0.1 B 58 GLN NE2 N 15 110.392 0.1 B 59 ASP H H 1 8.333 0.02 B 59 ASP HA H 1 4.497 0.02 B 59 ASP HBy H 1 3.053 0.02 B 59 ASP HBx H 1 2.539 0.02 B 59 ASP C C 13 177.808 0.1 B 59 ASP CA C 13 55.585 0.1 B 59 ASP CB C 13 41.809 0.1 B 59 ASP N N 15 113.443 0.1 B 60 ALA H H 1 7.690 0.02 B 60 ALA HA H 1 3.719 0.02 B 60 ALA HB% H 1 1.412 0.02 B 60 ALA C C 13 178.223 0.1 B 60 ALA CA C 13 57.163 0.1 B 60 ALA CB C 13 18.005 0.1 B 60 ALA N N 15 122.016 0.1 B 61 ARG H H 1 7.345 0.02 B 61 ARG HA H 1 3.470 0.02 B 61 ARG HB2 H 1 1.755 0.02 B 61 ARG HG2 H 1 0.833 0.02 B 61 ARG C C 13 177.184 0.1 B 61 ARG CA C 13 59.995 0.1 B 61 ARG CB C 13 30.537 0.1 B 61 ARG N N 15 116.857 0.1 B 62 ASN H H 1 7.533 0.02 B 62 ASN HA H 1 4.372 0.02 B 62 ASN HBy H 1 2.748 0.02 B 62 ASN HBx H 1 2.629 0.02 B 62 ASN HD2y H 1 8.012 0.02 B 62 ASN HD2x H 1 6.837 0.02 B 62 ASN C C 13 178.536 0.1 B 62 ASN CA C 13 55.924 0.1 B 62 ASN CB C 13 38.415 0.1 B 62 ASN N N 15 116.341 0.1 B 62 ASN ND2 N 15 114.405 0.1 B 63 LEU H H 1 8.490 0.02 B 63 LEU HA H 1 3.946 0.02 B 63 LEU HBy H 1 1.811 0.02 B 63 LEU HBx H 1 1.449 0.02 B 63 LEU HDx% H 1 0.916 0.02 B 63 LEU HDy% H 1 0.907 0.02 B 63 LEU HG H 1 1.826 0.02 B 63 LEU C C 13 180.408 0.1 B 63 LEU CA C 13 58.619 0.1 B 63 LEU CB C 13 42.658 0.1 B 63 LEU CD1 C 13 25.682 0.1 B 63 LEU CD2 C 13 24.063 0.1 B 63 LEU CG C 13 27.300 0.1 B 63 LEU N N 15 120.683 0.1 B 64 ILE H H 1 7.965 0.02 B 64 ILE HA H 1 3.994 0.02 B 64 ILE HB H 1 1.607 0.02 B 64 ILE HD1% H 1 0.655 0.02 B 64 ILE HG1y H 1 1.346 0.02 B 64 ILE HG1x H 1 1.230 0.02 B 64 ILE HG2% H 1 0.612 0.02 B 64 ILE C C 13 176.642 0.1 B 64 ILE CA C 13 63.879 0.1 B 64 ILE CB C 13 38.600 0.1 B 64 ILE CD1 C 13 14.352 0.1 B 64 ILE CG1 C 13 31.185 0.1 B 64 ILE CG2 C 13 16.942 0.1 B 64 ILE N N 15 117.268 0.1 B 65 ARG H H 1 7.104 0.02 B 65 ARG HA H 1 4.383 0.02 B 65 ARG HBy H 1 2.113 0.02 B 65 ARG HBx H 1 1.867 0.02 B 65 ARG HDy H 1 3.251 0.02 B 65 ARG HDx H 1 3.167 0.02 B 65 ARG HGy H 1 1.944 0.02 B 65 ARG HGx H 1 1.785 0.02 B 65 ARG C C 13 176.778 0.1 B 65 ARG CA C 13 57.240 0.1 B 65 ARG CB C 13 30.590 0.1 B 65 ARG CD C 13 44.133 0.1 B 65 ARG CG C 13 27.948 0.1 B 65 ARG N N 15 118.765 0.1 B 66 ARG H H 1 7.371 0.02 B 66 ARG HA H 1 4.059 0.02 B 66 ARG HBy H 1 1.637 0.02 B 66 ARG HBx H 1 1.576 0.02 B 66 ARG HD2 H 1 3.065 0.02 B 66 ARG HGy H 1 1.642 0.02 B 66 ARG HGx H 1 1.590 0.02 B 66 ARG C C 13 175.369 0.1 B 66 ARG CA C 13 58.014 0.1 B 66 ARG CB C 13 30.213 0.1 B 66 ARG CD C 13 44.133 0.1 B 66 ARG CG C 13 26.977 0.1 B 66 ARG N N 15 118.441 0.1 B 67 HIS H H 1 7.103 0.02 B 67 HIS HA H 1 4.853 0.02 B 67 HIS HBy H 1 3.118 0.02 B 67 HIS HBx H 1 2.733 0.02 B 67 HIS HD2 H 1 6.797 0.02 B 67 HIS HE1 H 1 7.612 0.02 B 67 HIS C C 13 175.441 0.1 B 67 HIS CA C 13 53.701 0.1 B 67 HIS CB C 13 32.193 0.1 B 67 HIS CD2 C 13 125.835 0.1 B 67 HIS CE1 C 13 139.300 0.1 B 67 HIS N N 15 115.596 0.1 B 68 GLU H H 1 9.108 0.02 B 68 GLU HA H 1 4.557 0.02 B 68 GLU HBy H 1 2.443 0.02 B 68 GLU HBx H 1 1.944 0.02 B 68 GLU HGy H 1 2.571 0.02 B 68 GLU HGx H 1 2.405 0.02 B 68 GLU C C 13 179.176 0.1 B 68 GLU CB C 13 30.861 0.1 B 68 GLU CG C 13 36.688 0.1 B 68 GLU N N 15 122.112 0.1 B 69 ARG H H 1 7.161 0.02 B 69 ARG HA H 1 3.834 0.02 B 69 ARG HBy H 1 1.896 0.02 B 69 ARG HBx H 1 1.753 0.02 B 69 ARG HDy H 1 3.129 0.02 B 69 ARG HDx H 1 2.766 0.02 B 69 ARG HGy H 1 1.756 0.02 B 69 ARG HGx H 1 1.427 0.02 B 69 ARG C C 13 178.521 0.1 B 69 ARG CA C 13 61.629 0.1 B 69 ARG CB C 13 31.062 0.1 B 69 ARG CD C 13 44.387 0.1 B 69 ARG CG C 13 29.243 0.1 B 70 ASP H H 1 9.096 0.02 B 70 ASP HA H 1 3.953 0.02 B 70 ASP HB2 H 1 2.554 0.02 B 70 ASP C C 13 177.885 0.1 B 70 ASP CA C 13 57.445 0.1 B 70 ASP CB C 13 39.358 0.1 B 70 ASP N N 15 115.766 0.1 B 71 GLU H H 1 7.154 0.02 B 71 GLU HA H 1 4.126 0.02 B 71 GLU HBy H 1 2.411 0.02 B 71 GLU HBx H 1 2.221 0.02 B 71 GLU HGy H 1 2.426 0.02 B 71 GLU HGx H 1 2.340 0.02 B 71 GLU C C 13 180.288 0.1 B 71 GLU CA C 13 59.345 0.1 B 71 GLU CB C 13 30.449 0.1 B 71 GLU CG C 13 37.012 0.1 B 71 GLU N N 15 121.210 0.1 B 72 ILE H H 1 7.730 0.02 B 72 ILE HA H 1 3.499 0.02 B 72 ILE HB H 1 1.891 0.02 B 72 ILE HD1% H 1 0.964 0.02 B 72 ILE HG1y H 1 1.874 0.02 B 72 ILE HG1x H 1 0.659 0.02 B 72 ILE HG2% H 1 0.755 0.02 B 72 ILE C C 13 177.663 0.1 B 72 ILE CA C 13 66.504 0.1 B 72 ILE CB C 13 38.250 0.1 B 72 ILE CD1 C 13 13.705 0.1 B 72 ILE CG1 C 13 28.919 0.1 B 72 ILE CG2 C 13 18.237 0.1 B 72 ILE N N 15 119.643 0.1 B 73 MET H H 1 8.436 0.02 B 73 MET HA H 1 4.090 0.02 B 73 MET HB2 H 1 2.054 0.02 B 73 MET HE% H 1 1.884 0.02 B 73 MET HGy H 1 2.500 0.02 B 73 MET HGx H 1 2.390 0.02 B 73 MET C C 13 179.600 0.1 B 73 MET CA C 13 58.537 0.1 B 73 MET CB C 13 33.513 0.1 B 73 MET CE C 13 19.531 0.1 B 73 MET CG C 13 33.451 0.1 B 73 MET N N 15 117.584 0.1 B 74 GLU H H 1 8.795 0.02 B 74 GLU HA H 1 3.662 0.02 B 74 GLU HBy H 1 2.269 0.02 B 74 GLU HBx H 1 2.145 0.02 B 74 GLU HGy H 1 2.318 0.02 B 74 GLU HGx H 1 2.145 0.02 B 74 GLU C C 13 177.293 0.1 B 74 GLU CA C 13 61.242 0.1 B 74 GLU CB C 13 29.890 0.1 B 74 GLU CG C 13 37.012 0.1 B 74 GLU N N 15 123.489 0.1 B 75 GLU H H 1 7.550 0.02 B 75 GLU HA H 1 4.415 0.02 B 75 GLU HBy H 1 2.171 0.02 B 75 GLU HBx H 1 1.951 0.02 B 75 GLU HGy H 1 2.245 0.02 B 75 GLU HGx H 1 2.133 0.02 B 75 GLU C C 13 178.837 0.1 B 75 GLU CA C 13 59.599 0.1 B 75 GLU CB C 13 29.243 0.1 B 75 GLU CG C 13 34.098 0.1 B 75 GLU N N 15 120.934 0.1 B 76 LEU H H 1 8.169 0.02 B 76 LEU HA H 1 3.915 0.02 B 76 LEU HBy H 1 1.724 0.02 B 76 LEU HBx H 1 1.270 0.02 B 76 LEU HDx% H 1 0.354 0.02 B 76 LEU HDy% H 1 0.256 0.02 B 76 LEU HG H 1 1.568 0.02 B 76 LEU C C 13 180.643 0.1 B 76 LEU CA C 13 59.222 0.1 B 76 LEU CB C 13 43.412 0.1 B 76 LEU CD1 C 13 24.711 0.1 B 76 LEU CD2 C 13 24.063 0.1 B 76 LEU CG C 13 28.272 0.1 B 76 LEU N N 15 117.710 0.1 B 77 THR H H 1 8.182 0.02 B 77 THR HA H 1 3.805 0.02 B 77 THR HB H 1 4.046 0.02 B 77 THR HG2% H 1 1.126 0.02 B 77 THR C C 13 176.427 0.1 B 77 THR CA C 13 68.434 0.1 B 77 THR CB C 13 68.734 0.1 B 77 THR CG2 C 13 22.121 0.1 B 77 THR N N 15 116.735 0.1 B 78 LYS H H 1 8.898 0.02 B 78 LYS HA H 1 3.842 0.02 B 78 LYS HB2 H 1 2.010 0.02 B 78 LYS HDy H 1 1.863 0.02 B 78 LYS HDx H 1 1.800 0.02 B 78 LYS HE2 H 1 3.000 0.02 B 78 LYS HGy H 1 1.824 0.02 B 78 LYS HGx H 1 1.428 0.02 B 78 LYS C C 13 178.204 0.1 B 78 LYS CA C 13 61.826 0.1 B 78 LYS CB C 13 33.183 0.1 B 78 LYS CD C 13 30.214 0.1 B 78 LYS CE C 13 42.514 0.1 B 78 LYS CG C 13 27.300 0.1 B 78 LYS N N 15 121.955 0.1 B 79 TYR H H 1 8.427 0.02 B 79 TYR HA H 1 4.176 0.02 B 79 TYR HBy H 1 3.689 0.02 B 79 TYR HBx H 1 3.379 0.02 B 79 TYR HD1 H 1 7.580 0.02 B 79 TYR HD2 H 1 7.580 0.02 B 79 TYR HE1 H 1 6.705 0.02 B 79 TYR HE2 H 1 6.705 0.02 B 79 TYR C C 13 178.512 0.1 B 79 TYR CA C 13 63.212 0.1 B 79 TYR CB C 13 39.925 0.1 B 79 TYR CD1 C 13 134.380 0.1 B 79 TYR CE1 C 13 118.843 0.1 B 79 TYR N N 15 118.386 0.1 B 80 TYR H H 1 7.991 0.02 B 80 TYR HA H 1 3.987 0.02 B 80 TYR HBy H 1 3.894 0.02 B 80 TYR HBx H 1 2.971 0.02 B 80 TYR HD1 H 1 6.699 0.02 B 80 TYR HD2 H 1 6.699 0.02 B 80 TYR HE1 H 1 6.188 0.02 B 80 TYR HE2 H 1 6.188 0.02 B 80 TYR C C 13 180.500 0.1 B 80 TYR CA C 13 63.279 0.1 B 80 TYR CB C 13 39.925 0.1 B 80 TYR CD1 C 13 133.085 0.1 B 80 TYR CE1 C 13 117.807 0.1 B 80 TYR N N 15 119.361 0.1 B 81 LEU H H 1 8.548 0.02 B 81 LEU HA H 1 3.904 0.02 B 81 LEU HBy H 1 1.833 0.02 B 81 LEU HBx H 1 1.085 0.02 B 81 LEU HDx% H 1 0.856 0.02 B 81 LEU HDy% H 1 0.781 0.02 B 81 LEU HG H 1 1.996 0.02 B 81 LEU C C 13 179.008 0.1 B 81 LEU CA C 13 59.090 0.1 B 81 LEU CB C 13 41.543 0.1 B 81 LEU CD1 C 13 27.624 0.1 B 81 LEU CD2 C 13 22.769 0.1 B 81 LEU CG C 13 27.948 0.1 B 81 LEU N N 15 120.908 0.1 B 82 ALA H H 1 8.690 0.02 B 82 ALA HA H 1 4.717 0.02 B 82 ALA HB% H 1 1.428 0.02 B 82 ALA C C 13 181.031 0.1 B 82 ALA CA C 13 54.813 0.1 B 82 ALA CB C 13 18.712 0.1 B 82 ALA N N 15 122.333 0.1 B 83 ASN H H 1 7.279 0.02 B 83 ASN HA H 1 4.512 0.02 B 83 ASN HBy H 1 2.838 0.02 B 83 ASN HBx H 1 2.323 0.02 B 83 ASN HD2y H 1 6.949 0.02 B 83 ASN HD2x H 1 6.173 0.02 B 83 ASN C C 13 174.809 0.1 B 83 ASN CA C 13 55.272 0.1 B 83 ASN CB C 13 40.275 0.1 B 83 ASN N N 15 113.565 0.1 B 83 ASN ND2 N 15 114.119 0.1 B 84 HIS H H 1 7.532 0.02 B 84 HIS HA H 1 4.465 0.02 B 84 HIS HBy H 1 3.599 0.02 B 84 HIS HBx H 1 2.470 0.02 B 84 HIS HD2 H 1 7.030 0.02 B 84 HIS HE1 H 1 7.632 0.02 B 84 HIS C C 13 174.646 0.1 B 84 HIS CA C 13 57.792 0.1 B 84 HIS CB C 13 28.186 0.1 B 84 HIS CD2 C 13 121.174 0.1 B 84 HIS CE1 C 13 139.041 0.1 B 84 HIS N N 15 116.863 0.1 B 85 GLY H H 1 7.586 0.02 B 85 GLY HAy H 1 4.118 0.02 B 85 GLY HAx H 1 3.631 0.02 B 85 GLY C C 13 174.284 0.1 B 85 GLY CA C 13 46.615 0.1 B 85 GLY N N 15 105.790 0.1 B 86 ILE H H 1 7.458 0.02 B 86 ILE HA H 1 3.969 0.02 B 86 ILE HB H 1 1.325 0.02 B 86 ILE HD1% H 1 0.594 0.02 B 86 ILE HG1y H 1 1.055 0.02 B 86 ILE HG1x H 1 1.025 0.02 B 86 ILE HG2% H 1 0.138 0.02 B 86 ILE C C 13 175.218 0.1 B 86 ILE CA C 13 60.353 0.1 B 86 ILE CB C 13 37.640 0.1 B 86 ILE CD1 C 13 12.734 0.1 B 86 ILE CG1 C 13 28.272 0.1 B 86 ILE CG2 C 13 17.913 0.1 B 86 ILE N N 15 121.652 0.1 B 87 ASP H H 1 8.253 0.02 B 87 ASP HA H 1 4.604 0.02 B 87 ASP HBy H 1 2.706 0.02 B 87 ASP HBx H 1 2.553 0.02 B 87 ASP C C 13 175.338 0.1 B 87 ASP CA C 13 54.301 0.1 B 87 ASP CB C 13 40.620 0.1 B 87 ASP N N 15 127.023 0.1 B 88 ILE H H 1 7.831 0.02 B 88 ILE HA H 1 4.254 0.02 B 88 ILE HB H 1 1.904 0.02 B 88 ILE HD1% H 1 0.870 0.02 B 88 ILE HG1y H 1 1.483 0.02 B 88 ILE HG1x H 1 1.220 0.02 B 88 ILE HG2% H 1 0.945 0.02 B 88 ILE C C 13 175.364 0.1 B 88 ILE CA C 13 60.912 0.1 B 88 ILE CB C 13 39.197 0.1 B 88 ILE CD1 C 13 14.029 0.1 B 88 ILE CG1 C 13 27.503 0.1 B 88 ILE CG2 C 13 18.171 0.1 B 88 ILE N N 15 125.104 0.1 B 89 LYS H H 1 7.908 0.02 B 89 LYS HA H 1 4.230 0.02 B 89 LYS HBy H 1 1.865 0.02 B 89 LYS HBx H 1 1.779 0.02 B 89 LYS HD2 H 1 1.709 0.02 B 89 LYS HE2 H 1 3.045 0.02 B 89 LYS HG2 H 1 1.454 0.02 B 89 LYS CA C 13 58.376 0.1 B 89 LYS CB C 13 34.098 0.1 B 89 LYS CD C 13 29.566 0.1 B 89 LYS CG C 13 25.035 0.1 B 89 LYS N N 15 131.647 0.1 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 10 PHE HD% A 8 VAL HGy% 1.0 . 5.50 2 2 A 23 THR HA A 27 VAL H 1.0 . 4.73 3 3 A 25 GLU H A 25 GLU HBy 1.0 . 3.49 4 4 A 25 GLU HBx A 26 THR HA 1.0 . 4.94 5 5 A 26 THR HB A 27 VAL HGy% 1.0 . 5.43 6 6 A 26 THR HA A 26 THR HG2% 1.0 . 3.98 7 7 A 27 VAL HA A 27 VAL HGx% 1.0 . 4.21 8 8 A 28 TYR HA A 38 PRO HBy 1.0 . 5.26 9 9 A 28 TYR H A 28 TYR HBy 1.0 . 4.13 10 10 A 30 ALA H A 30 ALA HB% 1.0 . 3.44 11 11 A 27 VAL HA A 30 ALA HB% 1.0 . 4.37 12 12 A 32 GLU HA A 38 PRO HGy 1.0 . 4.78 13 13 A 34 LYS HA A 34 LYS HDy 1.0 . 4.33 14 14 A 28 TYR HA A 38 PRO HBx 1.0 . 5.26 15 15 A 39 ILE HA A 39 ILE HG2% 1.0 . 3.99 16 16 A 39 ILE HA A 39 ILE HD1% 1.0 . 4.09 17 17 A 23 THR HG2% A 64 ILE HB 1.0 . 4.75 18 18 A 31 LEU HDx% A 41 GLN HBy 1.0 . 5.33 19 19 A 42 ILE HA A 54 ILE HD1% 1.0 . 4.44 20 20 A 42 ILE H A 42 ILE HB 1.0 . 3.82 21 21 A 39 ILE HA A 42 ILE HB 1.0 . 5.21 22 22 A 43 VAL H A 43 VAL HB 1.0 . 3.91 23 23 A 43 VAL HB A 44 GLY H 1.0 . 4.12 24 24 A 46 LEU HA A 46 LEU HDy% 1.0 . 5.50 25 25 A 46 LEU HA A 46 LEU HDx% 1.0 . 5.50 26 26 A 47 LEU H A 47 LEU HBx 1.0 . 4.07 27 27 A 52 ALA H A 52 ALA HB% 1.0 . 3.17 28 28 A 56 ARG HA A 61 ARG H 1.0 . 4.37 29 29 A 30 ALA HB% A 57 TYR HBy 1.0 . 5.50 30 30 A 60 ALA HA A 63 LEU HBy 1.0 . 4.81 31 31 A 27 VAL H A 60 ALA HA 1.0 . 5.41 32 32 A 60 ALA H A 60 ALA HB% 1.0 . 3.42 33 33 A 27 VAL HA A 60 ALA HB% 1.0 . 4.54 34 34 A 60 ALA HB% A 54 ILE HG2% 1.0 . 3.98 35 35 A 60 ALA HB% A 27 VAL HGx% 1.0 . 3.97 36 36 A 61 ARG H A 60 ALA HB% 1.0 . 3.85 37 37 A 54 ILE HB A 61 ARG HA 1.0 . 5.12 38 38 A 54 ILE HG2% A 61 ARG HA 1.0 . 4.78 39 39 A 59 ASP HBy A 62 ASN HBx 1.0 . 5.50 40 40 A 63 LEU H A 62 ASN HBx 1.0 . 4.56 41 41 A 63 LEU HA A 63 LEU HDy% 1.0 . 4.84 42 42 A 63 LEU HBy A 64 ILE H 1.0 . 4.07 43 43 A 39 ILE H A 39 ILE HB 1.0 . 3.60 44 44 A 39 ILE HB A 40 ASN H 1.0 . 3.93 45 45 A 72 ILE H A 72 ILE HB 1.0 . 3.76 46 46 A 43 VAL HB B 74 GLU HA 1.0 . 4.79 47 47 A 39 ILE HG2% B 74 GLU HA 1.0 . 5.32 48 48 A 74 GLU HA A 77 THR HB 1.0 . 5.12 49 49 A 76 LEU HA A 76 LEU HDy% 1.0 . 4.69 50 50 A 79 TYR HA A 79 TYR HD% 1.0 . 4.11 51 51 A 79 TYR HA A 82 ALA HB% 1.0 . 5.03 52 52 A 86 ILE H A 86 ILE HB 1.0 . 3.69 53 53 A 88 ILE HA A 89 LYS H 1.0 . 3.08 54 54 A 88 ILE HA A 86 ILE HG2% 1.0 . 5.21 55 55 A 88 ILE HA A 88 ILE HG2% 1.0 . 3.99 56 56 A 88 ILE HG2% A 88 ILE H 1.0 . 4.37 57 57 A 86 ILE HG2% A 88 ILE HG2% 1.0 . 4.25 58 58 A 88 ILE H A 88 ILE HG1y 1.0 . 4.35 59 59 A 86 ILE HG2% A 88 ILE HG1y 1.0 . 4.97 60 60 A 24 LEU H A 24 LEU HG 1.0 . 4.01 61 61 A 24 LEU HA A 27 VAL HB 1.0 . 4.78 62 62 A 27 VAL HA A 27 VAL HGy% 1.0 . 4.21 63 63 A 29 ARG H A 28 TYR HBx 1.0 . 4.57 64 64 A 64 ILE HD1% A 27 VAL HGx% 1.0 . 4.03 65 65 A 64 ILE HD1% A 45 TYR HD% 1.0 . 4.60 66 66 A 39 ILE H A 39 ILE HG1y 1.0 . 4.20 67 67 A 72 ILE HG2% A 76 LEU HDx% 1.0 . 4.66 68 68 A 86 ILE HG2% A 86 ILE HG1y 1.0 . 3.99 69 69 A 86 ILE HG2% A 86 ILE HD1% 1.0 . 3.60 70 70 A 86 ILE HG2% A 88 ILE HG1x 1.0 . 4.97 71 71 A 86 ILE HG2% A 88 ILE HD1% 1.0 . 4.01 72 72 A 88 ILE HA A 88 ILE HD1% 1.0 . 4.59 73 73 A 54 ILE HD1% A 54 ILE HG2% 1.0 . 3.63 74 74 A 73 MET HB2 B 43 VAL HGx% 1.0 . 6.22 75 75 A 73 MET HB2 B 43 VAL HGy% 1.0 . 6.22 76 76 A 41 GLN H A 40 ASN HBy 1.0 . 4.77 77 77 A 41 GLN H A 40 ASN HBx 1.0 . 4.77 78 78 A 54 ILE HD1% A 54 ILE HA 1.0 . 4.38 79 79 A 63 LEU HBx A 63 LEU HDx% 1.0 . 4.20 80 80 A 76 LEU HG A 77 THR H 1.0 . 4.69 81 81 A 63 LEU HBx A 63 LEU HDy% 1.0 . 4.20 82 82 A 59 ASP HBy A 63 LEU HDy% 1.0 . 4.70 83 83 A 54 ILE HD1% A 31 LEU HDx% 1.0 . 4.74 84 84 A 31 LEU HA A 31 LEU HDx% 1.0 . 4.25 85 85 A 31 LEU HA A 31 LEU HDy% 1.0 . 4.25 86 86 A 54 ILE HD1% A 31 LEU HDy% 1.0 . 4.74 87 87 A 77 THR HA A 77 THR HG2% 1.0 . 4.21 88 88 A 42 ILE HG2% B 77 THR HG2% 1.0 . 3.55 89 89 B 77 THR HG2% A 76 LEU HDy% 1.0 . 4.96 90 90 A 33 GLU H A 33 GLU HGx 1.0 . 4.80 91 91 A 29 ARG HA A 29 ARG HDy 1.0 . 4.99 92 92 A 29 ARG H A 29 ARG HGy 1.0 . 4.82 93 93 A 34 LYS HA A 34 LYS HDx 1.0 . 4.33 94 94 A 64 ILE HD1% A 64 ILE HA 1.0 . 4.49 95 95 A 79 TYR H A 79 TYR HBy 1.0 . 4.11 96 96 A 31 LEU HDx% A 41 GLN HBx 1.0 . 5.33 97 97 A 77 THR HG2% B 39 ILE HD1% 1.0 . 3.66 98 98 A 39 ILE HD1% A 28 TYR HD% 1.0 . 4.28 99 99 A 50 ASP H A 50 ASP HBy 1.0 . 4.16 100 100 A 42 ILE H A 42 ILE HG1x 1.0 . 5.50 101 101 A 59 ASP HBy A 63 LEU HDx% 1.0 . 4.70 102 102 A 74 GLU H A 74 GLU HGy 1.0 . 5.50 103 103 A 76 LEU H A 75 GLU HBy 1.0 . 4.45 104 104 A 68 GLU H A 68 GLU HGy 1.0 . 4.02 105 105 A 68 GLU H A 68 GLU HGx 1.0 . 4.02 106 106 A 38 PRO HA A 31 LEU HDy% 1.0 . 5.33 107 107 A 31 LEU HG A 55 PRO HDy 1.0 . 4.93 108 108 A 31 LEU HG A 55 PRO HDx 1.0 . 4.93 109 109 A 54 ILE HG2% A 55 PRO HDx 1.0 . 4.96 110 110 A 47 LEU H A 47 LEU HG 1.0 . 3.85 111 111 A 29 ARG H A 29 ARG HGx 1.0 . 4.82 112 112 A 72 ILE HB A 72 ILE HD1% 1.0 . 3.84 113 113 A 7 THR HA A 7 THR HG2% 1.0 . 3.79 114 114 A 39 ILE HA B 77 THR HG2% 1.0 . 4.70 115 115 A 9 ARG HBy A 10 PHE HA 1.0 . 5.50 116 116 A 10 PHE HA A 9 ARG HBx 1.0 . 5.50 117 117 A 20 ILE HG2% A 21 SER HA 1.0 . 5.46 118 118 A 24 LEU HG A 20 ILE HG2% 1.0 . 4.78 119 119 A 20 ILE HG2% A 24 LEU HBy 1.0 . 4.67 120 120 A 20 ILE HA A 20 ILE HD1% 1.0 . 5.16 121 121 A 86 ILE HD1% B 25 GLU HBy 1.0 . 5.50 122 122 A 86 ILE HD1% B 25 GLU HGy 1.0 . 5.22 123 123 A 86 ILE HD1% B 25 GLU HGx 1.0 . 5.22 124 124 A 26 THR HG2% A 27 VAL HA 1.0 . 5.39 125 125 A 26 THR HG2% A 29 ARG HBy 1.0 . 5.25 126 126 A 24 LEU HA A 27 VAL HGx% 1.0 . 5.15 127 127 A 24 LEU HA A 27 VAL HGy% 1.0 . 5.15 128 128 A 28 TYR HA A 31 LEU HBy 1.0 . 5.50 129 129 A 42 ILE HD1% A 28 TYR HBy 1.0 . 5.50 130 130 A 42 ILE HD1% A 28 TYR HBx 1.0 . 5.50 131 131 A 86 ILE HD1% B 29 ARG HGy 1.0 . 5.50 132 132 A 86 ILE HD1% B 29 ARG HGx 1.0 . 5.50 133 133 A 29 ARG HA A 29 ARG HDx 1.0 . 4.99 134 134 A 30 ALA HB% A 60 ALA HA 1.0 . 5.39 135 135 A 30 ALA HB% A 31 LEU HA 1.0 . 5.47 136 136 A 30 ALA HB% A 27 VAL HGy% 1.0 . 4.94 137 137 A 30 ALA HB% A 31 LEU HDx% 1.0 . 5.39 138 138 A 57 TYR HE% A 33 GLU HBx 1.0 . 4.53 139 139 A 34 LYS HA A 34 LYS HEx 1.0 . 5.50 140 140 A 88 ILE H A 87 ASP HBx 1.0 . 4.66 141 141 A 31 LEU HBx A 36 TYR HBy 1.0 . 5.50 142 142 A 31 LEU HBx A 36 TYR HBx 1.0 . 5.50 143 143 A 38 PRO HGy A 37 ASN HA 1.0 . 5.50 144 144 A 54 ILE HD1% A 38 PRO HA 1.0 . 5.50 145 145 A 42 ILE HD1% A 38 PRO HBx 1.0 . 5.50 146 146 A 42 ILE HD1% A 38 PRO HBy 1.0 . 5.50 147 147 A 38 PRO HA A 31 LEU HDx% 1.0 . 5.33 148 148 A 42 ILE HG2% A 43 VAL HA 1.0 . 5.50 149 149 A 42 ILE HG2% A 46 LEU HG 1.0 . 4.31 150 150 A 43 VAL HA A 46 LEU HBy 1.0 . 5.50 151 151 A 43 VAL HA A 46 LEU HBx 1.0 . 5.50 152 152 A 45 TYR HD% A 50 ASP HBy 1.0 . 5.50 153 153 A 54 ILE HG2% A 31 LEU HG 1.0 . 5.25 154 154 A 54 ILE HG2% A 55 PRO HDy 1.0 . 4.96 155 155 A 54 ILE HD1% A 53 TYR HA 1.0 . 5.47 156 156 A 54 ILE HD1% A 64 ILE HD1% 1.0 . 4.04 157 157 A 54 ILE HD1% A 55 PRO HDy 1.0 . 5.50 158 158 A 64 ILE HG2% A 65 ARG HDy 1.0 . 5.50 159 159 A 65 ARG HA A 65 ARG HDy 1.0 . 5.09 160 160 A 55 PRO HB2 A 57 TYR HBy 1.0 . 5.50 161 161 A 34 LYS HG2 A 57 TYR HBy 1.0 . 5.50 162 162 A 30 ALA HB% A 57 TYR HBx 1.0 . 5.50 163 163 A 34 LYS HG2 A 57 TYR HBx 1.0 . 5.50 164 164 A 26 THR HG2% A 58 GLN HBx 1.0 . 5.21 165 165 A 59 ASP HBy A 63 LEU HG 1.0 . 5.08 166 166 A 60 ALA HB% A 27 VAL HGy% 1.0 . 3.97 167 167 A 63 LEU HBy A 60 ALA HB% 1.0 . 5.17 168 168 A 59 ASP HBy A 62 ASN HBy 1.0 . 5.50 169 169 A 60 ALA HA A 63 LEU HG 1.0 . 5.50 170 170 A 26 THR HB A 63 LEU HDx% 1.0 . 5.47 171 171 A 26 THR HB A 63 LEU HDy% 1.0 . 5.47 172 172 A 64 ILE HG2% A 51 PRO HA 1.0 . 5.02 173 173 A 61 ARG HA A 64 ILE HG2% 1.0 . 4.50 174 174 A 64 ILE HB A 27 VAL HGy% 1.0 . 5.47 175 175 A 64 ILE HB A 54 ILE HG2% 1.0 . 5.50 176 176 A 27 VAL HA A 64 ILE HD1% 1.0 . 5.30 177 177 A 64 ILE HD1% A 27 VAL HGy% 1.0 . 4.03 178 178 A 72 ILE HG2% A 76 LEU HG 1.0 . 4.82 179 179 A 72 ILE HD1% A 69 ARG HA 1.0 . 4.96 180 180 A 73 MET HA A 76 LEU HDy% 1.0 . 5.50 181 181 A 43 VAL HA B 73 MET HGy 1.0 . 5.50 182 182 A 43 VAL HA B 73 MET HGx 1.0 . 5.50 183 183 A 73 MET HE% A 73 MET HGx 1.0 . 4.39 184 184 A 73 MET HA A 76 LEU HBx 1.0 . 5.50 185 185 A 77 THR HA B 76 LEU HDx% 1.0 . 5.13 186 186 B 77 THR HG2% A 76 LEU HDx% 1.0 . 4.96 187 187 A 77 THR HG2% A 81 LEU HG 1.0 . 5.50 188 188 A 86 ILE HG2% A 81 LEU HDy% 1.0 . 5.24 189 189 A 86 ILE HG2% A 81 LEU HDx% 1.0 . 5.24 190 190 A 82 ALA HB% A 88 ILE HB 1.0 . 4.90 191 191 A 86 ILE HB A 82 ALA HA 1.0 . 5.37 192 192 A 86 ILE H A 86 ILE HG2% 1.0 . 4.34 193 193 A 86 ILE HG2% A 87 ASP H 1.0 . 3.96 194 194 A 25 GLU HA B 86 ILE HD1% 1.0 . 4.19 195 195 A 86 ILE HD1% A 86 ILE HA 1.0 . 4.33 196 196 A 86 ILE HG2% A 88 ILE HB 1.0 . 5.48 197 197 A 88 ILE HD1% A 78 LYS HA 1.0 . 4.34 198 198 A 88 ILE HD1% A 88 ILE HB 1.0 . 4.07 199 199 A 88 ILE HG2% A 89 LYS HA 1.0 . 5.30 200 200 A 77 THR HG2% A 81 LEU H 1.0 . 5.50 201 201 B 77 THR HG2% A 28 TYR HD% 1.0 . 5.50 202 202 A 10 PHE HD% A 8 VAL HGx% 1.0 . 5.50 203 203 A 42 ILE H A 42 ILE HG1y 1.0 . 5.50 204 204 A 26 THR HG2% A 58 GLN HBy 1.0 . 5.21 205 205 A 19 ALA HB% A 22 GLU H 1.0 . 4.63 206 206 A 19 ALA HB% A 23 THR H 1.0 . 5.48 207 207 A 20 ILE HB A 21 SER H 1.0 . 5.50 208 208 A 20 ILE HG2% A 21 SER H 1.0 . 4.66 209 209 A 31 LEU HA A 36 TYR HD% 1.0 . 4.09 210 210 A 28 TYR H A 25 GLU HA 1.0 . 5.50 211 211 A 26 THR HG2% A 30 ALA H 1.0 . 5.50 212 212 A 27 VAL H A 26 THR HG2% 1.0 . 4.98 213 213 A 64 ILE H A 27 VAL HGy% 1.0 . 5.50 214 214 A 28 TYR HA A 28 TYR HD% 1.0 . 4.63 215 215 A 28 TYR HD% A 29 ARG HDy 1.0 . 5.50 216 216 A 29 ARG H A 29 ARG HDy 1.0 . 5.50 217 217 A 30 ALA H A 29 ARG HGx 1.0 . 5.50 218 218 A 30 ALA H A 29 ARG HGy 1.0 . 5.50 219 219 A 30 ALA H A 29 ARG HBy 1.0 . 4.07 220 220 A 29 ARG H A 29 ARG HBy 1.0 . 3.93 221 221 A 71 GLU H A 71 GLU HBy 1.0 . 4.12 222 222 A 71 GLU H A 71 GLU HBx 1.0 . 4.12 223 223 A 28 TYR HD% A 29 ARG HDx 1.0 . 5.50 224 224 A 29 ARG H A 29 ARG HDx 1.0 . 5.50 225 225 A 57 TYR HE% A 30 ALA HA 1.0 . 4.36 226 226 A 30 ALA HB% A 57 TYR HE% 1.0 . 5.22 227 227 A 30 ALA HB% A 60 ALA H 1.0 . 5.50 228 228 A 31 LEU HBy A 32 GLU H 1.0 . 5.50 229 229 A 31 LEU HBx A 32 GLU H 1.0 . 5.50 230 230 A 31 LEU H A 31 LEU HDx% 1.0 . 5.38 231 231 A 36 TYR HD% A 31 LEU HDy% 1.0 . 4.73 232 232 A 31 LEU H A 31 LEU HDy% 1.0 . 5.38 233 233 A 47 LEU H A 47 LEU HDx% 1.0 . 5.19 234 234 A 32 GLU HA A 35 GLY H 1.0 . 3.90 235 235 A 34 LYS H A 34 LYS HDx 1.0 . 5.50 236 236 A 34 LYS HA A 34 LYS HEy 1.0 . 5.50 237 237 A 60 ALA H A 59 ASP HBx 1.0 . 5.50 238 238 A 39 ILE H A 37 ASN HBy 1.0 . 5.50 239 239 A 63 LEU H A 62 ASN HBy 1.0 . 4.56 240 240 A 38 PRO HGy A 32 GLU H 1.0 . 5.50 241 241 A 77 THR HB B 39 ILE HG2% 1.0 . 5.16 242 242 A 39 ILE HG2% A 41 GLN H 1.0 . 5.50 243 243 A 39 ILE HG2% A 39 ILE H 1.0 . 4.11 244 244 A 39 ILE HG2% A 42 ILE H 1.0 . 5.50 245 245 A 39 ILE HD1% A 39 ILE H 1.0 . 5.11 246 246 A 28 TYR HA A 32 GLU H 1.0 . 5.50 247 247 A 39 ILE HA A 42 ILE HG2% 1.0 . 5.50 248 248 A 43 VAL H A 42 ILE HG2% 1.0 . 4.30 249 249 A 43 VAL H A 43 VAL HGy% 1.0 . 4.79 250 250 A 74 GLU H B 43 VAL HGy% 1.0 . 5.50 251 251 A 46 LEU HA A 45 TYR HD% 1.0 . 5.50 252 252 A 24 LEU H A 24 LEU HBy 1.0 . 3.95 253 253 A 46 LEU HG A 46 LEU H 1.0 . 3.72 254 254 A 46 LEU H A 46 LEU HDy% 1.0 . 4.70 255 255 A 70 ASP HA A 73 MET H 1.0 . 4.47 256 256 A 47 LEU H A 47 LEU HDy% 1.0 . 5.19 257 257 A 61 ARG H A 54 ILE HG2% 1.0 . 4.53 258 258 A 54 ILE HD1% A 45 TYR H 1.0 . 5.01 259 259 A 60 ALA HB% A 30 ALA HA 1.0 . 5.50 260 260 A 63 LEU H A 63 LEU HG 1.0 . 4.69 261 261 A 64 ILE H A 63 LEU HDy% 1.0 . 5.48 262 262 A 63 LEU H A 63 LEU HDy% 1.0 . 4.75 263 263 A 63 LEU H A 64 ILE HG2% 1.0 . 5.50 264 264 A 45 TYR HD% A 64 ILE HG2% 1.0 . 4.35 265 265 A 64 ILE HG2% A 66 ARG H 1.0 . 5.45 266 266 A 68 GLU H A 67 HIS HBy 1.0 . 4.59 267 267 A 68 GLU H A 67 HIS HBx 1.0 . 4.59 268 268 A 69 ARG HA A 73 MET H 1.0 . 5.50 269 269 A 73 MET H A 71 GLU HA 1.0 . 5.50 270 270 A 72 ILE H A 72 ILE HG2% 1.0 . 4.41 271 271 A 72 ILE HD1% A 73 MET H 1.0 . 4.63 272 272 A 76 LEU H A 73 MET HA 1.0 . 5.48 273 273 A 74 GLU HA A 76 LEU H 1.0 . 5.50 274 274 A 78 LYS H A 78 LYS HGx 1.0 . 4.61 275 275 A 79 TYR HA A 79 TYR HE% 1.0 . 5.50 276 276 A 82 ALA H A 81 LEU HBy 1.0 . 4.97 277 277 A 82 ALA H A 81 LEU HBx 1.0 . 4.97 278 278 A 28 TYR HD% B 81 LEU HG 1.0 . 5.50 279 279 A 81 LEU H A 81 LEU HDx% 1.0 . 4.82 280 280 A 81 LEU H A 81 LEU HDy% 1.0 . 4.82 281 281 A 86 ILE HG2% A 82 ALA H 1.0 . 5.50 282 282 A 86 ILE H A 86 ILE HG1y 1.0 . 4.91 283 283 A 86 ILE HG1y A 87 ASP H 1.0 . 5.50 284 284 A 86 ILE H A 86 ILE HG1x 1.0 . 3.94 285 285 A 28 TYR HD% B 86 ILE HG1y 1.0 . 5.50 286 286 A 28 TYR HD% B 86 ILE HD1% 1.0 . 4.76 287 287 A 29 ARG H B 86 ILE HD1% 1.0 . 5.50 288 288 A 28 TYR HD% B 88 ILE HG2% 1.0 . 5.24 289 289 A 88 ILE HD1% A 82 ALA H 1.0 . 5.01 290 290 A 88 ILE HD1% A 81 LEU H 1.0 . 5.50 291 291 A 82 ALA HA A 88 ILE HG1x 1.0 . 5.50 292 292 A 82 ALA HA A 88 ILE HG1y 1.0 . 5.50 293 293 A 72 ILE HB A 69 ARG HA 1.0 . 5.50 294 294 A 72 ILE HD1% A 64 ILE HG1y 1.0 . 5.27 295 295 A 72 ILE HD1% A 64 ILE HG1x 1.0 . 5.27 296 296 A 72 ILE HG2% A 76 LEU HDy% 1.0 . 4.66 297 297 A 88 ILE HG2% A 78 LYS HGx 1.0 . 3.96 298 298 A 72 ILE H A 72 ILE HG1x 1.0 . 5.50 299 299 A 80 TYR H A 80 TYR HBx 1.0 . 4.06 300 300 A 74 GLU H B 43 VAL HGx% 1.0 . 5.50 301 301 A 74 GLU H A 74 GLU HBy 1.0 . 3.78 302 302 A 22 GLU H A 22 GLU HGx 1.0 . 5.04 303 303 A 75 GLU H A 74 GLU HGx 1.0 . 5.50 304 304 A 75 GLU H A 74 GLU HGy 1.0 . 5.50 305 305 A 64 ILE H A 63 LEU HG 1.0 . 5.50 306 306 A 39 ILE HD1% B 78 LYS HA 1.0 . 4.40 307 307 A 71 GLU H A 71 GLU HGy 1.0 . 5.42 308 308 A 71 GLU H A 71 GLU HGx 1.0 . 5.42 309 309 A 39 ILE HG2% B 74 GLU HGx 1.0 . 4.93 310 310 A 42 ILE HG2% B 73 MET HE% 1.0 . 3.84 311 311 A 43 VAL HB B 73 MET HE% 1.0 . 4.82 312 312 A 73 MET HE% A 73 MET HGy 1.0 . 4.39 313 313 A 43 VAL HA B 73 MET HE% 1.0 . 5.02 314 314 A 46 LEU HA B 73 MET HE% 1.0 . 5.15 315 315 A 73 MET HA B 73 MET HE% 1.0 . 4.15 316 316 A 47 LEU H B 73 MET HE% 1.0 . 4.58 317 317 A 73 MET H B 73 MET HE% 1.0 . 5.29 318 318 A 46 LEU H B 73 MET HE% 1.0 . 5.35 319 319 B 73 MET HE% A 76 LEU HDx% 1.0 . 4.32 320 320 B 73 MET HE% A 76 LEU HDy% 1.0 . 4.32 321 321 A 23 THR HG2% A 24 LEU HG 1.0 . 4.65 322 322 A 23 THR HG2% A 64 ILE HA 1.0 . 4.09 323 323 A 23 THR HG2% A 64 ILE H 1.0 . 5.34 324 324 A 27 VAL H A 23 THR HG2% 1.0 . 5.13 325 325 A 23 THR HG2% A 24 LEU H 1.0 . 4.61 326 326 A 50 ASP HA A 51 PRO HGx 1.0 . 5.50 327 327 A 50 ASP HA A 51 PRO HGy 1.0 . 5.50 328 328 A 39 ILE HD1% B 78 LYS HDy 1.0 . 4.92 329 329 A 39 ILE HD1% B 78 LYS HDx 1.0 . 4.95 330 330 A 78 LYS H A 78 LYS HDy 1.0 . 5.50 331 331 A 78 LYS H A 78 LYS HDx 1.0 . 5.50 332 332 A 39 ILE HB B 78 LYS HDx 1.0 . 5.40 333 333 B 39 ILE HG2% A 78 LYS HGx 1.0 . 4.99 334 334 A 39 ILE HD1% B 78 LYS HGx 1.0 . 4.40 335 335 A 88 ILE HD1% A 78 LYS HGy 1.0 . 3.99 336 336 A 88 ILE HG2% A 88 ILE HG1y 1.0 . 3.97 337 337 A 88 ILE HG2% A 88 ILE HG1x 1.0 . 3.97 338 338 A 88 ILE HD1% A 78 LYS HGx 1.0 . 3.78 339 339 A 28 TYR HD% B 88 ILE HD1% 1.0 . 4.66 340 340 A 77 THR HG2% B 42 ILE HD1% 1.0 . 4.58 341 341 A 27 VAL HB A 42 ILE HD1% 1.0 . 5.50 342 342 A 42 ILE HA A 42 ILE HD1% 1.0 . 4.92 343 343 A 39 ILE HA A 42 ILE HD1% 1.0 . 4.83 344 344 A 28 TYR HA A 42 ILE HD1% 1.0 . 5.07 345 345 A 72 ILE HD1% A 67 HIS HBx 1.0 . 5.17 346 346 A 43 VAL HB A 40 ASN HA 1.0 . 5.27 347 347 A 20 ILE HD1% A 72 ILE HA 1.0 . 4.38 348 348 A 24 LEU HDx% A 76 LEU HDy% 1.0 . 4.90 349 349 A 24 LEU HDx% A 76 LEU HDx% 1.0 . 4.90 350 350 A 24 LEU H A 24 LEU HDx% 1.0 . 4.52 351 351 A 76 LEU HDx% A 24 LEU HDy% 1.0 . 4.90 352 352 A 24 LEU HDy% A 76 LEU HDy% 1.0 . 4.90 353 353 A 24 LEU HA A 24 LEU HDy% 1.0 . 4.61 354 354 A 80 TYR HD% B 24 LEU HDy% 1.0 . 5.50 355 355 A 63 LEU HG A 59 ASP HBx 1.0 . 4.90 356 356 A 25 GLU H A 24 LEU HBy 1.0 . 5.50 357 357 A 25 GLU H A 24 LEU HBx 1.0 . 4.60 358 358 A 36 TYR HD% A 34 LYS HBx 1.0 . 4.16 359 359 A 36 TYR HE% A 34 LYS HBy 1.0 . 4.25 360 360 A 34 LYS HG2 A 36 TYR HE% 1.0 . 5.50 361 361 A 34 LYS HG2 A 57 TYR HD% 1.0 . 5.02 362 362 A 34 LYS HG2 A 34 LYS H 1.0 . 4.25 363 363 A 30 ALA HB% A 31 LEU H 1.0 . 4.18 364 364 A 30 ALA HB% A 57 TYR HD% 1.0 . 3.97 365 365 A 30 ALA HA A 34 LYS H 1.0 . 5.50 366 366 A 66 ARG H A 66 ARG HGy 1.0 . 4.97 367 367 A 66 ARG H A 66 ARG HGx 1.0 . 4.97 368 368 A 24 LEU HA A 24 LEU HDx% 1.0 . 4.61 369 369 A 76 LEU HA A 76 LEU HDx% 1.0 . 4.69 370 370 A 72 ILE HG2% A 20 ILE HG2% 1.0 . 4.09 371 371 A 72 ILE HD1% A 20 ILE HG2% 1.0 . 5.19 372 372 A 77 THR HA B 76 LEU HDy% 1.0 . 5.13 373 373 A 86 ILE HD1% B 25 GLU HBx 1.0 . 5.50 374 374 A 72 ILE HD1% A 72 ILE HA 1.0 . 5.29 375 375 A 73 MET HA A 76 LEU HBy 1.0 . 5.50 376 376 A 39 ILE HG2% B 74 GLU HGy 1.0 . 4.93 377 377 A 74 GLU H A 74 GLU HGx 1.0 . 5.50 378 378 A 84 HIS HBy A 85 GLY H 1.0 . 5.50 379 379 A 85 GLY H A 84 HIS HBx 1.0 . 5.50 380 380 A 20 ILE HD1% A 71 GLU HA 1.0 . 5.33 381 381 A 20 ILE HD1% A 75 GLU HBy 1.0 . 5.41 382 382 A 20 ILE HG2% A 72 ILE HA 1.0 . 4.60 383 383 A 64 ILE HD1% A 45 TYR HE% 1.0 . 4.69 384 384 A 64 ILE HB A 27 VAL HGx% 1.0 . 5.47 385 385 A 80 TYR HD% B 24 LEU HDx% 1.0 . 5.50 386 386 A 45 TYR HD% A 50 ASP HBx 1.0 . 5.50 387 387 A 80 TYR HD% A 81 LEU HA 1.0 . 5.50 388 388 A 23 THR HG2% A 63 LEU HBy 1.0 . 5.08 389 389 A 23 THR HG2% A 63 LEU HBx 1.0 . 4.29 390 390 A 64 ILE HB A 64 ILE HD1% 1.0 . 4.20 391 391 A 76 LEU H A 75 GLU HBx 1.0 . 4.45 392 392 A 20 ILE HD1% A 75 GLU HBx 1.0 . 5.41 393 393 A 73 MET HA A 76 LEU HDx% 1.0 . 5.50 394 394 A 54 ILE HG2% A 64 ILE HD1% 1.0 . 3.99 395 395 A 63 LEU HA A 63 LEU HDx% 1.0 . 4.84 396 396 A 64 ILE HG2% A 65 ARG HDx 1.0 . 5.50 397 397 A 65 ARG HA A 65 ARG HDx 1.0 . 5.09 398 398 A 43 VAL H A 40 ASN HA 1.0 . 5.03 399 399 A 41 GLN HBx A 31 LEU HDy% 1.0 . 5.33 400 400 A 31 LEU HDy% A 41 GLN HBy 1.0 . 5.33 401 401 A 40 ASN H A 37 ASN HBx 1.0 . 5.15 402 402 A 72 ILE HG2% A 72 ILE HD1% 1.0 . 3.51 403 403 A 26 THR HB A 27 VAL HGx% 1.0 . 5.43 404 404 A 20 ILE HA A 23 THR HB 1.0 . 5.50 405 405 A 24 LEU HG A 23 THR HB 1.0 . 5.50 406 406 A 23 THR HA A 26 THR HB 1.0 . 5.36 407 407 A 25 GLU HBy A 22 GLU HA 1.0 . 4.75 408 408 A 74 GLU H A 74 GLU HBx 1.0 . 3.78 409 409 A 72 ILE HB A 20 ILE HD1% 1.0 . 4.59 410 410 A 45 TYR HD% A 51 PRO HA 1.0 . 4.20 411 411 A 19 ALA HB% A 67 HIS HE1 1.0 . 4.10 412 412 A 19 ALA HB% A 21 SER H 1.0 . 4.11 413 413 A 82 ALA HB% A 88 ILE HD1% 1.0 . 4.30 414 414 A 20 ILE HG2% A 75 GLU H 1.0 . 5.50 415 415 A 80 TYR HE% B 20 ILE HG2% 1.0 . 5.50 416 416 A 30 ALA HB% A 29 ARG H 1.0 . 5.02 417 417 A 54 ILE HD1% A 55 PRO HDx 1.0 . 5.50 418 418 A 54 ILE HD1% A 60 ALA HB% 1.0 . 5.29 419 419 A 64 ILE H A 64 ILE HD1% 1.0 . 5.26 420 420 A 72 ILE HD1% A 67 HIS HBy 1.0 . 5.17 421 421 A 76 LEU H A 20 ILE HD1% 1.0 . 5.50 422 422 A 80 TYR HE% A 80 TYR HA 1.0 . 5.50 423 423 A 20 ILE HG2% A 75 GLU HGx 1.0 . 5.36 424 424 A 20 ILE HG2% A 75 GLU HGy 1.0 . 5.36 425 425 A 72 ILE HD1% A 67 HIS H 1.0 . 4.93 426 426 A 55 PRO HB2 A 57 TYR HBx 1.0 . 5.50 427 427 A 62 ASN HA A 65 ARG HGy 1.0 . 4.97 428 428 A 64 ILE HG2% A 65 ARG HGy 1.0 . 4.50 429 429 A 62 ASN HA A 65 ARG HGx 1.0 . 4.97 430 430 A 65 ARG H A 65 ARG HGy 1.0 . 5.24 431 431 A 65 ARG H A 65 ARG HGx 1.0 . 5.24 432 432 A 64 ILE HG2% A 65 ARG HGx 1.0 . 4.50 433 433 A 38 PRO HGx A 32 GLU HGx 1.0 . 5.50 434 434 A 38 PRO HGx A 32 GLU HGy 1.0 . 5.50 435 435 A 38 PRO HGy A 28 TYR HD% 1.0 . 5.50 436 436 A 28 TYR HD% A 38 PRO HGx 1.0 . 5.50 437 437 A 23 THR HG2% A 64 ILE HD1% 1.0 . 4.48 438 438 A 31 LEU HA A 36 TYR HE% 1.0 . 5.30 439 439 A 88 ILE H A 88 ILE HD1% 1.0 . 5.40 440 440 A 72 ILE H A 72 ILE HG1y 1.0 . 5.50 441 441 A 30 ALA HB% A 31 LEU HDy% 1.0 . 5.39 442 442 A 30 ALA HB% A 27 VAL HGx% 1.0 . 4.94 443 443 A 7 THR HG2% A 8 VAL H 1.0 . 5.36 444 444 A 8 VAL HB A 9 ARG H 1.0 . 5.50 445 445 A 22 GLU H A 21 SER H 1.0 . 4.33 446 446 A 22 GLU H A 23 THR H 1.0 . 4.04 447 447 A 24 LEU H A 23 THR H 1.0 . 3.95 448 448 A 25 GLU H A 24 LEU H 1.0 . 3.98 449 449 A 25 GLU H A 26 THR H 1.0 . 3.73 450 450 A 27 VAL H A 26 THR H 1.0 . 4.06 451 451 A 27 VAL H A 28 TYR H 1.0 . 4.17 452 452 A 28 TYR H A 28 TYR HD% 1.0 . 4.63 453 453 A 29 ARG H A 28 TYR HD% 1.0 . 4.54 454 454 A 28 TYR H A 29 ARG H 1.0 . 4.41 455 455 A 30 ALA H A 28 TYR HD% 1.0 . 5.24 456 456 A 30 ALA H A 31 LEU H 1.0 . 3.85 457 457 A 32 GLU H A 31 LEU H 1.0 . 3.72 458 458 A 81 LEU H A 80 TYR HD% 1.0 . 4.51 459 459 A 33 GLU H A 32 GLU H 1.0 . 3.92 460 460 A 33 GLU H A 34 LYS H 1.0 . 4.10 461 461 A 35 GLY H A 34 LYS H 1.0 . 3.87 462 462 A 36 TYR HD% A 36 TYR H 1.0 . 3.87 463 463 A 39 ILE H A 28 TYR HE% 1.0 . 4.87 464 464 A 40 ASN H A 40 ASN HD2x 1.0 . 5.07 465 465 A 40 ASN H A 40 ASN HD2y 1.0 . 5.07 466 466 A 42 ILE H A 41 GLN H 1.0 . 4.25 467 467 A 42 ILE H A 43 VAL H 1.0 . 4.22 468 468 A 43 VAL H A 44 GLY H 1.0 . 4.06 469 469 A 46 LEU H A 45 TYR H 1.0 . 3.88 470 470 A 44 GLY H A 45 TYR H 1.0 . 4.22 471 471 A 45 TYR HD% A 45 TYR H 1.0 . 4.71 472 472 A 44 GLY H A 53 TYR HE% 1.0 . 5.50 473 473 A 45 TYR HD% A 46 LEU H 1.0 . 4.48 474 474 A 47 LEU H A 46 LEU H 1.0 . 4.17 475 475 A 47 LEU H A 48 SER H 1.0 . 4.29 476 476 A 48 SER H A 49 GLY H 1.0 . 3.86 477 477 A 52 ALA H A 53 TYR H 1.0 . 3.76 478 478 A 45 TYR HD% A 53 TYR H 1.0 . 4.71 479 479 A 52 ALA H A 45 TYR HD% 1.0 . 5.42 480 480 A 56 ARG H A 57 TYR H 1.0 . 4.67 481 481 A 58 GLN H A 59 ASP H 1.0 . 4.32 482 482 A 57 TYR H A 58 GLN H 1.0 . 4.82 483 483 A 60 ALA H A 59 ASP H 1.0 . 3.78 484 484 A 61 ARG H A 60 ALA H 1.0 . 4.35 485 485 A 61 ARG H A 62 ASN H 1.0 . 4.03 486 486 A 63 LEU H A 62 ASN H 1.0 . 3.92 487 487 A 63 LEU H A 64 ILE H 1.0 . 4.13 488 488 A 64 ILE H A 62 ASN H 1.0 . 5.20 489 489 A 64 ILE H A 66 ARG H 1.0 . 5.22 490 490 A 64 ILE H A 65 ARG H 1.0 . 4.20 491 491 A 66 ARG H A 65 ARG H 1.0 . 3.59 492 492 A 66 ARG H A 67 HIS H 1.0 . 3.92 493 493 A 68 GLU H A 67 HIS H 1.0 . 5.39 494 494 A 68 GLU H A 69 ARG H 1.0 . 4.64 495 495 A 69 ARG H A 70 ASP H 1.0 . 3.89 496 496 A 71 GLU H A 70 ASP H 1.0 . 3.91 497 497 A 72 ILE H A 71 GLU H 1.0 . 4.07 498 498 A 72 ILE H A 73 MET H 1.0 . 4.02 499 499 A 74 GLU H A 73 MET H 1.0 . 4.29 500 500 A 74 GLU H A 76 LEU H 1.0 . 5.16 501 501 A 74 GLU H A 75 GLU H 1.0 . 4.30 502 502 A 76 LEU H A 75 GLU H 1.0 . 4.09 503 503 A 77 THR H A 75 GLU H 1.0 . 5.11 504 504 A 77 THR H A 78 LYS H 1.0 . 4.01 505 505 A 79 TYR H A 78 LYS H 1.0 . 4.31 506 506 A 79 TYR H A 80 TYR H 1.0 . 4.24 507 507 A 79 TYR HD% A 79 TYR H 1.0 . 4.32 508 508 A 80 TYR HD% B 79 TYR H 1.0 . 4.66 509 509 A 80 TYR HE% B 79 TYR H 1.0 . 5.02 510 510 A 81 LEU H A 80 TYR H 1.0 . 4.22 511 511 A 79 TYR HD% A 80 TYR H 1.0 . 4.53 512 512 A 79 TYR HD% A 82 ALA H 1.0 . 5.10 513 513 A 82 ALA H A 83 ASN H 1.0 . 4.27 514 514 A 81 LEU H A 82 ALA H 1.0 . 4.11 515 515 A 83 ASN H A 83 ASN HD2y 1.0 . 4.76 516 516 A 83 ASN H A 83 ASN HD2x 1.0 . 4.76 517 517 A 83 ASN H A 84 HIS H 1.0 . 3.78 518 518 A 86 ILE H A 87 ASP H 1.0 . 4.90 519 519 A 88 ILE H A 87 ASP H 1.0 . 4.91 520 520 A 23 THR H A 23 THR HB 1.0 . 3.93 521 521 A 25 GLU H A 22 GLU HA 1.0 . 4.21 522 522 A 26 THR HB A 26 THR H 1.0 . 3.91 523 523 A 27 VAL H A 26 THR HB 1.0 . 4.02 524 524 A 29 ARG HA A 31 LEU H 1.0 . 4.72 525 525 A 29 ARG HA A 32 GLU H 1.0 . 4.32 526 526 A 33 GLU H A 29 ARG HA 1.0 . 4.33 527 527 A 31 LEU HA A 34 LYS H 1.0 . 5.05 528 528 A 32 GLU HA A 36 TYR H 1.0 . 4.25 529 529 A 31 LEU HA A 36 TYR H 1.0 . 4.75 530 530 A 39 ILE H A 37 ASN HA 1.0 . 5.20 531 531 A 41 GLN H A 38 PRO HA 1.0 . 4.75 532 532 A 53 TYR HA A 41 GLN HE2y 1.0 . 5.01 533 533 A 53 TYR HA A 41 GLN HE2x 1.0 . 5.01 534 534 A 39 ILE HA A 43 VAL H 1.0 . 5.08 535 535 A 44 GLY H A 40 ASN HA 1.0 . 5.14 536 536 A 44 GLY H A 41 GLN HA 1.0 . 4.83 537 537 A 45 TYR H A 41 GLN HA 1.0 . 4.71 538 538 A 52 ALA H A 50 ASP HA 1.0 . 4.76 539 539 A 51 PRO HA A 53 TYR H 1.0 . 4.80 540 540 A 51 PRO HA A 54 ILE H 1.0 . 5.34 541 541 A 60 ALA H A 58 GLN HA 1.0 . 4.88 542 542 A 60 ALA HA A 63 LEU H 1.0 . 4.56 543 543 A 64 ILE H A 62 ASN HA 1.0 . 4.98 544 544 A 62 ASN HA A 65 ARG H 1.0 . 3.85 545 545 A 63 LEU HA A 66 ARG H 1.0 . 4.98 546 546 A 65 ARG HA A 67 HIS H 1.0 . 4.74 547 547 A 68 GLU H A 67 HIS HA 1.0 . 3.45 548 548 A 72 ILE H A 69 ARG HA 1.0 . 5.21 549 549 A 74 GLU H A 71 GLU HA 1.0 . 4.44 550 550 A 75 GLU H A 72 ILE HA 1.0 . 4.80 551 551 A 71 GLU HA A 75 GLU H 1.0 . 5.02 552 552 A 77 THR HB A 77 THR H 1.0 . 3.46 553 553 A 74 GLU HA A 77 THR H 1.0 . 4.61 554 554 A 77 THR HB A 78 LYS H 1.0 . 3.98 555 555 A 74 GLU HA A 78 LYS H 1.0 . 4.84 556 556 A 80 TYR H A 80 TYR HBy 1.0 . 4.06 557 557 A 80 TYR H A 79 TYR HBy 1.0 . 4.56 558 558 A 79 TYR HA A 81 LEU H 1.0 . 4.51 559 559 A 79 TYR HA A 82 ALA H 1.0 . 5.23 560 560 A 81 LEU HA A 84 HIS H 1.0 . 4.70 561 561 A 86 ILE H A 82 ALA HA 1.0 . 4.37 562 562 A 87 ASP H A 86 ILE HA 1.0 . 3.51 563 563 A 50 ASP H A 50 ASP HBx 1.0 . 4.16 564 564 A 19 ALA H A 18 LYS HBy 1.0 . 5.00 565 565 A 22 GLU H A 22 GLU HGy 1.0 . 5.04 566 566 A 20 ILE HA A 23 THR H 1.0 . 4.52 567 567 A 23 THR H A 22 GLU HBy 1.0 . 4.39 568 568 A 23 THR HG2% A 23 THR H 1.0 . 4.63 569 569 A 24 LEU H A 23 THR HB 1.0 . 4.16 570 570 A 24 LEU H A 20 ILE HA 1.0 . 5.13 571 571 A 24 LEU H A 24 LEU HDy% 1.0 . 4.52 572 572 A 25 GLU HBy A 26 THR H 1.0 . 4.00 573 573 A 26 THR HG2% A 26 THR H 1.0 . 4.52 574 574 A 27 VAL H A 24 LEU HA 1.0 . 4.20 575 575 A 27 VAL H A 27 VAL HB 1.0 . 3.77 576 576 A 27 VAL H A 27 VAL HGx% 1.0 . 4.20 577 577 A 27 VAL H A 27 VAL HGy% 1.0 . 4.20 578 578 A 28 TYR H A 24 LEU HA 1.0 . 4.49 579 579 A 28 TYR H A 28 TYR HBx 1.0 . 4.13 580 580 A 28 TYR H A 27 VAL HB 1.0 . 4.13 581 581 A 26 THR HG2% A 28 TYR H 1.0 . 4.98 582 582 A 28 TYR H A 27 VAL HGx% 1.0 . 5.13 583 583 A 28 TYR H A 27 VAL HGy% 1.0 . 5.13 584 584 A 28 TYR H A 42 ILE HD1% 1.0 . 4.57 585 585 A 26 THR HA A 29 ARG H 1.0 . 4.67 586 586 A 29 ARG H A 28 TYR HBy 1.0 . 4.57 587 587 A 26 THR HA A 30 ALA H 1.0 . 4.78 588 588 A 27 VAL HA A 30 ALA H 1.0 . 4.70 589 589 A 31 LEU HBy A 31 LEU H 1.0 . 4.13 590 590 A 31 LEU HG A 31 LEU H 1.0 . 4.19 591 591 A 81 LEU HG A 81 LEU H 1.0 . 3.79 592 592 A 33 GLU H A 33 GLU HGy 1.0 . 4.80 593 593 A 34 LYS H A 33 GLU HBy 1.0 . 4.80 594 594 A 34 LYS H A 33 GLU HBx 1.0 . 4.80 595 595 A 34 LYS H A 34 LYS HDy 1.0 . 5.50 596 596 A 35 GLY H A 34 LYS HBy 1.0 . 5.14 597 597 A 35 GLY H A 34 LYS HBx 1.0 . 5.14 598 598 A 31 LEU HBy A 36 TYR H 1.0 . 4.98 599 599 A 39 ILE H A 37 ASN HBx 1.0 . 5.50 600 600 A 39 ILE H A 39 ILE HG1x 1.0 . 4.20 601 601 A 38 PRO HGy A 39 ILE H 1.0 . 4.69 602 602 A 40 ASN H A 37 ASN HBy 1.0 . 5.15 603 603 A 40 ASN H A 40 ASN HBy 1.0 . 4.02 604 604 A 40 ASN H A 40 ASN HBx 1.0 . 4.02 605 605 A 39 ILE HG2% A 40 ASN H 1.0 . 4.40 606 606 A 41 GLN H A 31 LEU HDx% 1.0 . 4.76 607 607 A 41 GLN H A 31 LEU HDy% 1.0 . 4.76 608 608 A 42 ILE H A 42 ILE HD1% 1.0 . 3.89 609 609 A 42 ILE HB A 43 VAL H 1.0 . 4.41 610 610 A 43 VAL H A 43 VAL HGx% 1.0 . 4.79 611 611 A 42 ILE HA A 45 TYR H 1.0 . 4.55 612 612 A 42 ILE HG2% A 45 TYR H 1.0 . 4.85 613 613 A 46 LEU H A 46 LEU HBx 1.0 . 4.19 614 614 A 42 ILE HG2% A 46 LEU H 1.0 . 4.01 615 615 A 46 LEU H A 46 LEU HDx% 1.0 . 4.70 616 616 A 46 LEU H A 46 LEU HBy 1.0 . 4.19 617 617 A 47 LEU H A 47 LEU HBy 1.0 . 4.07 618 618 A 48 SER H A 47 LEU HBy 1.0 . 4.88 619 619 A 48 SER H A 47 LEU HBx 1.0 . 4.88 620 620 A 49 GLY H A 69 ARG HDy 1.0 . 4.98 621 621 A 49 GLY H A 69 ARG HDx 1.0 . 4.98 622 622 A 52 ALA HB% A 53 TYR H 1.0 . 4.17 623 623 A 54 ILE HB A 54 ILE H 1.0 . 3.90 624 624 A 54 ILE HG2% A 54 ILE H 1.0 . 4.25 625 625 A 54 ILE HD1% A 54 ILE H 1.0 . 4.70 626 626 A 55 PRO HB2 A 56 ARG H 1.0 . 4.11 627 627 A 55 PRO HB2 A 57 TYR H 1.0 . 4.25 628 628 A 59 ASP H A 58 GLN HBx 1.0 . 5.10 629 629 A 60 ALA HB% A 59 ASP H 1.0 . 4.84 630 630 A 59 ASP H A 58 GLN HBy 1.0 . 5.10 631 631 A 60 ALA H A 58 GLN HBy 1.0 . 4.98 632 632 A 60 ALA H A 58 GLN HBx 1.0 . 4.98 633 633 A 61 ARG H A 54 ILE HB 1.0 . 5.00 634 634 A 41 GLN H A 41 GLN HGy 1.0 . 4.21 635 635 A 63 LEU HBy A 63 LEU H 1.0 . 3.64 636 636 A 63 LEU H A 63 LEU HBx 1.0 . 4.04 637 637 A 63 LEU H A 63 LEU HDx% 1.0 . 4.75 638 638 A 64 ILE HB A 64 ILE H 1.0 . 3.79 639 639 A 64 ILE H A 63 LEU HBx 1.0 . 4.29 640 640 A 64 ILE H A 27 VAL HGx% 1.0 . 5.50 641 641 A 64 ILE H A 63 LEU HDx% 1.0 . 5.48 642 642 A 64 ILE H A 64 ILE HG2% 1.0 . 3.91 643 643 A 65 ARG H A 65 ARG HBy 1.0 . 4.16 644 644 A 65 ARG H A 65 ARG HBx 1.0 . 4.16 645 645 A 64 ILE HB A 65 ARG H 1.0 . 4.46 646 646 A 64 ILE HG2% A 65 ARG H 1.0 . 3.94 647 647 A 70 ASP H A 69 ARG HBy 1.0 . 4.32 648 648 A 70 ASP H A 69 ARG HBx 1.0 . 4.32 649 649 A 72 ILE H A 71 GLU HBy 1.0 . 4.60 650 650 A 72 ILE H A 71 GLU HBx 1.0 . 4.60 651 651 A 72 ILE H A 72 ILE HD1% 1.0 . 4.50 652 652 A 72 ILE HB A 73 MET H 1.0 . 3.78 653 653 A 72 ILE HG2% A 73 MET H 1.0 . 4.37 654 654 A 75 GLU H A 75 GLU HBy 1.0 . 3.93 655 655 A 75 GLU H A 75 GLU HBx 1.0 . 3.93 656 656 A 20 ILE HD1% A 75 GLU H 1.0 . 4.54 657 657 A 76 LEU HG A 76 LEU H 1.0 . 4.36 658 658 A 76 LEU H A 76 LEU HDx% 1.0 . 4.71 659 659 A 76 LEU H A 76 LEU HDy% 1.0 . 4.71 660 660 A 77 THR H A 76 LEU HBy 1.0 . 4.58 661 661 A 77 THR H A 73 MET HE% 1.0 . 4.92 662 662 A 43 VAL HB B 77 THR H 1.0 . 5.11 663 663 A 77 THR H A 76 LEU HBx 1.0 . 4.58 664 664 A 77 THR H A 77 THR HG2% 1.0 . 4.49 665 665 A 78 LYS H A 78 LYS HGy 1.0 . 3.99 666 666 A 77 THR HG2% A 78 LYS H 1.0 . 4.55 667 667 A 39 ILE HD1% B 78 LYS H 1.0 . 4.64 668 668 A 79 TYR H A 79 TYR HBx 1.0 . 4.11 669 669 A 79 TYR H A 78 LYS HGy 1.0 . 4.83 670 670 A 82 ALA HB% A 79 TYR H 1.0 . 5.04 671 671 A 80 TYR H A 79 TYR HBx 1.0 . 4.56 672 672 A 82 ALA HB% A 82 ALA H 1.0 . 3.59 673 673 A 82 ALA HB% A 83 ASN H 1.0 . 4.13 674 674 A 82 ALA HB% A 84 HIS H 1.0 . 4.43 675 675 A 82 ALA HB% A 86 ILE H 1.0 . 4.43 676 676 A 86 ILE H A 86 ILE HD1% 1.0 . 4.53 677 677 A 87 ASP H A 87 ASP HBy 1.0 . 3.96 678 678 A 87 ASP HBx A 87 ASP H 1.0 . 3.96 679 679 A 86 ILE HD1% A 87 ASP H 1.0 . 4.93 680 680 A 88 ILE H A 87 ASP HBy 1.0 . 4.66 681 681 A 88 ILE H A 88 ILE HB 1.0 . 3.76 682 682 A 88 ILE H A 88 ILE HG1x 1.0 . 4.35 683 683 A 86 ILE HG2% A 88 ILE H 1.0 . 4.90 684 684 A 89 LYS H A 88 ILE HB 1.0 . 3.94 685 685 A 89 LYS H A 88 ILE HG2% 1.0 . 3.92 686 686 A 23 THR H A 22 GLU HBx 1.0 . 4.39 687 687 A 45 TYR HD% A 50 ASP H 1.0 . 4.69 688 688 A 19 ALA HB% A 20 ILE H 1.0 . 4.98 689 689 A 53 TYR H A 54 ILE H 1.0 . 3.98 690 690 A 50 ASP H A 48 SER H 1.0 . 4.66 691 691 A 6 GLU H A 7 THR H 1.0 . 4.67 692 692 A 50 ASP H A 49 GLY H 1.0 . 3.93 693 693 A 64 ILE HD1% A 54 ILE H 1.0 . 5.05 694 694 A 22 GLU H A 19 ALA HA 1.0 . 5.33 695 695 A 74 GLU H A 70 ASP HA 1.0 . 5.11 696 696 A 39 ILE HA A 41 GLN H 1.0 . 5.25 697 697 A 41 GLN H A 41 GLN HGx 1.0 . 4.21 698 698 A 63 LEU HBy A 62 ASN H 1.0 . 4.66 699 699 A 30 ALA H A 29 ARG H 1.0 . 4.01 700 700 A 23 THR HA A 26 THR H 1.0 . 4.84 701 701 A 27 VAL HA A 31 LEU H 1.0 . 5.20 702 702 A 28 TYR HA A 31 LEU H 1.0 . 5.13 703 703 A 34 LYS HG2 A 35 GLY H 1.0 . 5.33 704 704 A 19 ALA H A 18 LYS HBx 1.0 . 5.00 705 705 A 45 TYR HD% A 49 GLY H 1.0 . 5.24 706 706 A 45 TYR HE% A 49 GLY H 1.0 . 5.29 707 707 A 52 ALA H A 45 TYR HE% 1.0 . 5.16 708 708 A 64 ILE HA A 67 HIS H 1.0 . 5.02 709 709 A 30 ALA H A 29 ARG HBx 1.0 . 4.04 710 710 A 29 ARG H A 29 ARG HBx 1.0 . 3.98 711 711 A 46 LEU HA A 49 GLY H 1.0 . 5.04 712 712 A 49 GLY H A 69 ARG HBy 1.0 . 5.30 713 713 A 49 GLY H A 69 ARG HBx 1.0 . 5.30 714 714 A 80 TYR HA A 83 ASN H 1.0 . 5.34 715 715 A 67 HIS H A 67 HIS HD2 1.0 . 4.66 716 716 A 64 ILE HA A 67 HIS HD2 1.0 . 4.94 717 717 A 23 THR HG2% A 67 HIS HD2 1.0 . 3.98 718 718 A 72 ILE HD1% A 67 HIS HD2 1.0 . 4.64 719 719 A 29 ARG HA A 28 TYR HD% 1.0 . 4.67 720 720 A 28 TYR HD% A 38 PRO HBy 1.0 . 4.79 721 721 A 28 TYR HD% A 42 ILE HD1% 1.0 . 4.08 722 722 A 86 ILE HG2% B 28 TYR HD% 1.0 . 4.94 723 723 A 45 TYR HD% A 45 TYR HA 1.0 . 4.08 724 724 A 45 TYR HD% A 46 LEU HG 1.0 . 4.73 725 725 A 45 TYR HD% A 42 ILE HG2% 1.0 . 4.10 726 726 A 72 ILE HD1% A 45 TYR HE% 1.0 . 4.79 727 727 A 64 ILE HG2% A 45 TYR HE% 1.0 . 4.34 728 728 A 36 TYR HD% A 34 LYS HBy 1.0 . 4.16 729 729 A 36 TYR HE% A 34 LYS HBx 1.0 . 4.25 730 730 A 36 TYR HE% A 55 PRO HGy 1.0 . 4.42 731 731 A 57 TYR HE% A 33 GLU HBy 1.0 . 4.53 732 732 A 57 TYR HE% A 34 LYS HG2 1.0 . 4.87 733 733 A 84 HIS HA A 84 HIS HD2 1.0 . 4.77 734 734 A 25 GLU HA B 84 HIS HD2 1.0 . 4.69 735 735 A 79 TYR HD% B 80 TYR HD% 1.0 . 4.36 736 736 B 80 TYR HD% A 79 TYR HBy 1.0 . 4.59 737 737 B 80 TYR HD% A 79 TYR HBx 1.0 . 4.59 738 738 A 80 TYR HA B 79 TYR HD% 1.0 . 4.17 739 739 A 80 TYR HA B 79 TYR HE% 1.0 . 4.14 740 740 B 79 TYR HE% A 83 ASN HBy 1.0 . 4.38 741 741 B 79 TYR HE% A 83 ASN HBx 1.0 . 4.38 742 742 A 80 TYR HE% B 79 TYR HD% 1.0 . 4.83 743 743 A 30 ALA HA A 57 TYR HD% 1.0 . 4.40 744 744 A 57 TYR HD% A 57 TYR HA 1.0 . 3.88 745 745 A 86 ILE HG2% B 28 TYR HE% 1.0 . 4.39 746 746 A 39 ILE HD1% A 28 TYR HE% 1.0 . 3.96 747 747 B 80 TYR HE% A 24 LEU HDy% 1.0 . 5.05 748 748 A 53 TYR HA A 53 TYR HD% 1.0 . 4.77 749 749 B 80 TYR HE% A 24 LEU HDx% 1.0 . 5.05 750 750 A 53 TYR HE% A 50 ASP HBx 1.0 . 4.51 751 751 A 53 TYR HD% A 50 ASP HBy 1.0 . 5.10 752 752 A 53 TYR HD% A 50 ASP HBx 1.0 . 5.10 753 753 A 80 TYR H A 80 TYR HD% 1.0 . 4.27 754 754 A 46 LEU HG A 45 TYR HE% 1.0 . 4.64 755 755 A 88 ILE HB B 28 TYR HE% 1.0 . 4.62 756 756 A 28 TYR HD% A 38 PRO HBx 1.0 . 4.79 757 757 A 81 LEU HG A 80 TYR HD% 1.0 . 4.82 758 758 A 53 TYR HE% A 50 ASP HBy 1.0 . 4.51 759 759 A 51 PRO HA A 45 TYR HE% 1.0 . 4.41 760 760 A 53 TYR HA A 53 TYR HE% 1.0 . 4.16 761 761 A 20 ILE HA A 67 HIS HE1 1.0 . 4.99 762 762 A 67 HIS HE1 A 20 ILE HG1y 1.0 . 5.19 763 763 A 20 ILE HD1% A 67 HIS HE1 1.0 . 5.07 764 764 A 67 HIS HE1 A 20 ILE HG1x 1.0 . 5.19 765 765 A 36 TYR HD% A 31 LEU HDx% 1.0 . 4.73 766 766 A 76 LEU HA B 80 TYR HD% 1.0 . 3.78 767 767 A 76 LEU HA B 80 TYR HE% 1.0 . 4.16 768 768 B 80 TYR HE% A 75 GLU HGx 1.0 . 5.04 769 769 B 80 TYR HE% A 75 GLU HGy 1.0 . 5.04 770 770 A 55 PRO HB2 A 36 TYR HE% 1.0 . 4.90 771 771 A 36 TYR HE% A 55 PRO HGx 1.0 . 4.42 772 772 A 31 LEU HG A 36 TYR HD% 1.0 . 4.34 773 773 A 6 GLU H A 6 GLU HG2 1.0 . 5.21 774 773 A 6 GLU H A 6 GLU HGy 1.0 . 5.21 775 774 A 9 ARG H A 8 VAL HGy% 1.0 . 5.30 776 774 A 9 ARG H A 8 VAL HGx% 1.0 . 5.30 777 775 A 9 ARG HA A 9 ARG HD2 1.0 . 5.34 778 775 A 9 ARG HA A 9 ARG HDy 1.0 . 5.34 779 776 A 14 ASP H A 13 ASP HB2 1.0 . 4.33 780 776 A 13 ASP HBy A 14 ASP H 1.0 . 4.33 781 777 A 16 ARG H A 16 ARG HG2 1.0 . 5.22 782 777 A 16 ARG H A 16 ARG HGy 1.0 . 5.22 783 778 A 16 ARG HA A 16 ARG HD2 1.0 . 5.34 784 778 A 16 ARG HA A 16 ARG HDy 1.0 . 5.34 785 779 A 17 LYS H A 16 ARG HBy 1.0 . 4.22 786 779 A 16 ARG HBx A 17 LYS H 1.0 . 4.22 787 780 A 17 LYS H A 17 LYS HG2 1.0 . 4.83 788 780 A 17 LYS H A 17 LYS HGy 1.0 . 4.83 789 781 A 17 LYS HBx A 17 LYS HD2 1.0 . 3.28 790 781 A 17 LYS HBy A 17 LYS HD2 1.0 . 3.28 791 781 A 17 LYS HDy A 17 LYS HBy 1.0 . 3.28 792 781 A 17 LYS HBx A 17 LYS HDy 1.0 . 3.28 793 782 A 18 LYS H A 17 LYS HBy 1.0 . 4.39 794 782 A 17 LYS HBx A 18 LYS H 1.0 . 4.39 795 783 A 18 LYS H A 17 LYS HD2 1.0 . 5.19 796 783 A 17 LYS HDy A 18 LYS H 1.0 . 5.19 797 784 A 18 LYS H A 18 LYS HG2 1.0 . 4.50 798 784 A 18 LYS H A 18 LYS HGy 1.0 . 4.50 799 785 A 18 LYS HA A 18 LYS HD2 1.0 . 4.73 800 785 A 18 LYS HA A 18 LYS HDy 1.0 . 4.73 801 786 A 18 LYS HBx A 18 LYS HD2 1.0 . 3.32 802 786 A 18 LYS HBy A 18 LYS HD2 1.0 . 3.32 803 786 A 18 LYS HDy A 18 LYS HBx 1.0 . 3.32 804 786 A 18 LYS HDy A 18 LYS HBy 1.0 . 3.32 805 787 A 19 ALA H A 18 LYS HBx 1.0 . 4.35 806 787 A 19 ALA H A 18 LYS HBy 1.0 . 4.35 807 788 A 19 ALA HB% A 22 GLU HBx 1.0 . 4.53 808 788 A 19 ALA HB% A 22 GLU HBy 1.0 . 4.53 809 789 A 19 ALA HB% A 22 GLU HGx 1.0 . 4.57 810 789 A 19 ALA HB% A 22 GLU HGy 1.0 . 4.57 811 790 A 20 ILE HB A 75 GLU HGx 1.0 . 5.34 812 790 A 20 ILE HB A 75 GLU HGy 1.0 . 5.34 813 791 A 20 ILE HG2% A 75 GLU HBx 1.0 . 4.64 814 791 A 20 ILE HG2% A 75 GLU HBy 1.0 . 4.64 815 792 A 67 HIS HE1 A 20 ILE HG1x 1.0 . 4.40 816 792 A 67 HIS HE1 A 20 ILE HG1y 1.0 . 4.40 817 793 A 72 ILE HD1% A 20 ILE HG1x 1.0 . 4.99 818 793 A 72 ILE HD1% A 20 ILE HG1y 1.0 . 4.99 819 794 A 20 ILE HD1% A 67 HIS HBy 1.0 . 5.34 820 794 A 20 ILE HD1% A 67 HIS HBx 1.0 . 5.34 821 795 A 20 ILE HD1% A 71 GLU HBx 1.0 . 3.96 822 795 A 20 ILE HD1% A 71 GLU HBy 1.0 . 3.96 823 796 A 20 ILE HD1% A 71 GLU HGx 1.0 . 5.34 824 796 A 20 ILE HD1% A 71 GLU HGy 1.0 . 5.34 825 797 A 20 ILE HD1% A 75 GLU HBx 1.0 . 4.75 826 797 A 20 ILE HD1% A 75 GLU HBy 1.0 . 4.75 827 798 A 22 GLU H A 22 GLU HBx 1.0 . 3.65 828 798 A 22 GLU H A 22 GLU HBy 1.0 . 3.65 829 799 A 22 GLU H A 22 GLU HGx 1.0 . 4.19 830 799 A 22 GLU H A 22 GLU HGy 1.0 . 4.19 831 800 A 23 THR H A 22 GLU HBx 1.0 . 3.76 832 800 A 23 THR H A 22 GLU HBy 1.0 . 3.76 833 801 A 23 THR H A 22 GLU HGx 1.0 . 4.93 834 801 A 23 THR H A 22 GLU HGy 1.0 . 4.93 835 802 A 23 THR HG2% A 24 LEU HDy% 1.0 . 4.42 836 802 A 23 THR HG2% A 24 LEU HDx% 1.0 . 4.42 837 803 A 23 THR HG2% A 63 LEU HDy% 1.0 . 4.17 838 803 A 23 THR HG2% A 63 LEU HDx% 1.0 . 4.17 839 804 A 24 LEU H A 24 LEU HDy% 1.0 . 3.97 840 804 A 24 LEU H A 24 LEU HDx% 1.0 . 3.97 841 805 A 24 LEU HA A 24 LEU HDy% 1.0 . 3.78 842 805 A 24 LEU HA A 24 LEU HDx% 1.0 . 3.78 843 806 A 24 LEU HA A 27 VAL HGy% 1.0 . 4.25 844 806 A 24 LEU HA A 27 VAL HGx% 1.0 . 4.25 845 807 A 24 LEU HBy A 76 LEU HDy% 1.0 . 4.52 846 807 A 24 LEU HBy A 76 LEU HDx% 1.0 . 4.52 847 808 A 24 LEU HBx B 81 LEU HDy% 1.0 . 4.17 848 808 A 24 LEU HBx B 81 LEU HDx% 1.0 . 4.17 849 809 A 25 GLU H A 24 LEU HDy% 1.0 . 4.30 850 809 A 25 GLU H A 24 LEU HDx% 1.0 . 4.30 851 810 A 27 VAL HB A 24 LEU HDy% 1.0 . 5.28 852 810 A 27 VAL HB A 24 LEU HDx% 1.0 . 5.28 853 811 A 76 LEU HG A 24 LEU HDy% 1.0 . 5.29 854 811 A 76 LEU HG A 24 LEU HDx% 1.0 . 5.29 855 812 A 24 LEU HDx% A 76 LEU HDy% 1.0 . 3.43 856 812 A 76 LEU HDx% A 24 LEU HDy% 1.0 . 3.43 857 812 A 24 LEU HDx% A 76 LEU HDx% 1.0 . 3.43 858 812 A 24 LEU HDy% A 76 LEU HDy% 1.0 . 3.43 859 813 B 80 TYR HD% A 24 LEU HDy% 1.0 . 4.61 860 813 B 80 TYR HD% A 24 LEU HDx% 1.0 . 4.61 861 814 B 80 TYR HE% A 24 LEU HDy% 1.0 . 4.23 862 814 B 80 TYR HE% A 24 LEU HDx% 1.0 . 4.23 863 815 A 24 LEU HDx% B 81 LEU HDy% 1.0 . 4.36 864 815 A 24 LEU HDy% B 81 LEU HDy% 1.0 . 4.36 865 815 B 81 LEU HDx% A 24 LEU HDy% 1.0 . 4.36 866 815 A 24 LEU HDx% B 81 LEU HDx% 1.0 . 4.36 867 816 A 25 GLU H A 25 GLU HGx 1.0 . 3.93 868 816 A 25 GLU H A 25 GLU HGy 1.0 . 3.93 869 817 A 25 GLU HA A 28 TYR HBy 1.0 . 5.25 870 817 A 25 GLU HA A 28 TYR HBx 1.0 . 5.25 871 818 A 25 GLU HA B 81 LEU HDy% 1.0 . 4.50 872 818 A 25 GLU HA B 81 LEU HDx% 1.0 . 4.50 873 819 A 25 GLU HBy B 81 LEU HDy% 1.0 . 4.85 874 819 A 25 GLU HBy B 81 LEU HDx% 1.0 . 4.85 875 820 A 26 THR H A 25 GLU HGx 1.0 . 5.34 876 820 A 26 THR H A 25 GLU HGy 1.0 . 5.34 877 821 B 86 ILE HG1y A 25 GLU HGx 1.0 . 5.34 878 821 B 86 ILE HG1y A 25 GLU HGy 1.0 . 5.34 879 822 B 86 ILE HD1% A 25 GLU HGx 1.0 . 4.27 880 822 B 86 ILE HD1% A 25 GLU HGy 1.0 . 4.27 881 823 A 26 THR H A 63 LEU HDy% 1.0 . 5.44 882 823 A 26 THR H A 63 LEU HDx% 1.0 . 5.44 883 824 A 26 THR HB A 27 VAL HGy% 1.0 . 4.66 884 824 A 26 THR HB A 27 VAL HGx% 1.0 . 4.66 885 825 A 26 THR HB A 63 LEU HDy% 1.0 . 4.69 886 825 A 26 THR HB A 63 LEU HDx% 1.0 . 4.69 887 826 A 26 THR HG2% A 58 GLN HBy 1.0 . 4.57 888 826 A 26 THR HG2% A 58 GLN HBx 1.0 . 4.57 889 827 A 26 THR HG2% A 63 LEU HDy% 1.0 . 3.57 890 827 A 26 THR HG2% A 63 LEU HDx% 1.0 . 3.57 891 828 A 27 VAL H A 27 VAL HGy% 1.0 . 3.49 892 828 A 27 VAL H A 27 VAL HGx% 1.0 . 3.49 893 829 A 27 VAL H A 63 LEU HDy% 1.0 . 5.17 894 829 A 27 VAL H A 63 LEU HDx% 1.0 . 5.17 895 830 A 27 VAL HB A 42 ILE HG1x 1.0 . 5.12 896 830 A 27 VAL HB A 42 ILE HG1y 1.0 . 5.12 897 831 A 28 TYR H A 27 VAL HGy% 1.0 . 4.21 898 831 A 28 TYR H A 27 VAL HGx% 1.0 . 4.21 899 832 A 30 ALA H A 27 VAL HGy% 1.0 . 5.44 900 832 A 30 ALA H A 27 VAL HGx% 1.0 . 5.44 901 833 A 30 ALA HB% A 27 VAL HGy% 1.0 . 4.24 902 833 A 30 ALA HB% A 27 VAL HGx% 1.0 . 4.24 903 834 A 27 VAL HGy% A 42 ILE HG1x 1.0 . 4.69 904 834 A 27 VAL HGx% A 42 ILE HG1x 1.0 . 4.69 905 834 A 42 ILE HG1y A 27 VAL HGy% 1.0 . 4.69 906 834 A 27 VAL HGx% A 42 ILE HG1y 1.0 . 4.69 907 835 A 54 ILE HD1% A 27 VAL HGy% 1.0 . 3.89 908 835 A 54 ILE HD1% A 27 VAL HGx% 1.0 . 3.89 909 836 A 60 ALA HA A 27 VAL HGy% 1.0 . 4.34 910 836 A 60 ALA HA A 27 VAL HGx% 1.0 . 4.34 911 837 A 63 LEU HBy A 27 VAL HGy% 1.0 . 4.53 912 837 A 63 LEU HBy A 27 VAL HGx% 1.0 . 4.53 913 838 A 27 VAL HGy% A 63 LEU HDy% 1.0 . 4.28 914 838 A 27 VAL HGx% A 63 LEU HDy% 1.0 . 4.28 915 838 A 63 LEU HDx% A 27 VAL HGy% 1.0 . 4.28 916 838 A 63 LEU HDx% A 27 VAL HGx% 1.0 . 4.28 917 839 A 64 ILE H A 27 VAL HGy% 1.0 . 4.40 918 839 A 64 ILE H A 27 VAL HGx% 1.0 . 4.40 919 840 A 64 ILE HB A 27 VAL HGy% 1.0 . 4.13 920 840 A 64 ILE HB A 27 VAL HGx% 1.0 . 4.13 921 841 A 64 ILE HG2% A 27 VAL HGy% 1.0 . 3.92 922 841 A 64 ILE HG2% A 27 VAL HGx% 1.0 . 3.92 923 842 A 64 ILE HD1% A 27 VAL HGy% 1.0 . 3.48 924 842 A 64 ILE HD1% A 27 VAL HGx% 1.0 . 3.48 925 843 A 28 TYR H B 81 LEU HDy% 1.0 . 5.44 926 843 A 28 TYR H B 81 LEU HDx% 1.0 . 5.44 927 844 A 28 TYR HA A 31 LEU HDy% 1.0 . 4.93 928 844 A 28 TYR HA A 31 LEU HDx% 1.0 . 4.93 929 845 A 28 TYR HA A 38 PRO HBy 1.0 . 4.58 930 845 A 28 TYR HA A 38 PRO HBx 1.0 . 4.58 931 846 A 29 ARG H A 28 TYR HBy 1.0 . 3.90 932 846 A 29 ARG H A 28 TYR HBx 1.0 . 3.90 933 847 A 29 ARG HA A 28 TYR HBy 1.0 . 5.14 934 847 A 29 ARG HA A 28 TYR HBx 1.0 . 5.14 935 848 A 28 TYR HBy A 29 ARG HGx 1.0 . 4.22 936 848 A 28 TYR HBx A 29 ARG HGx 1.0 . 4.22 937 848 A 29 ARG HGy A 28 TYR HBy 1.0 . 4.22 938 848 A 28 TYR HBx A 29 ARG HGy 1.0 . 4.22 939 849 A 28 TYR HBy B 81 LEU HDy% 1.0 . 4.74 940 849 A 28 TYR HBx B 81 LEU HDy% 1.0 . 4.74 941 849 B 81 LEU HDx% A 28 TYR HBy 1.0 . 4.74 942 849 B 81 LEU HDx% A 28 TYR HBx 1.0 . 4.74 943 850 B 86 ILE HD1% A 28 TYR HBy 1.0 . 4.79 944 850 B 86 ILE HD1% A 28 TYR HBx 1.0 . 4.79 945 851 A 28 TYR HD% A 29 ARG HGx 1.0 . 4.37 946 851 A 28 TYR HD% A 29 ARG HGy 1.0 . 4.37 947 852 A 28 TYR HD% A 38 PRO HBy 1.0 . 4.19 948 852 A 28 TYR HD% A 38 PRO HBx 1.0 . 4.19 949 853 A 28 TYR HD% A 39 ILE HG1x 1.0 . 5.34 950 853 A 28 TYR HD% A 39 ILE HG1y 1.0 . 5.34 951 854 A 28 TYR HD% B 81 LEU HDy% 1.0 . 4.21 952 854 A 28 TYR HD% B 81 LEU HDx% 1.0 . 4.21 953 855 A 28 TYR HE% A 38 PRO HBy 1.0 . 4.48 954 855 A 28 TYR HE% A 38 PRO HBx 1.0 . 4.48 955 856 A 28 TYR HE% A 39 ILE HG1x 1.0 . 4.42 956 856 A 28 TYR HE% A 39 ILE HG1y 1.0 . 4.42 957 857 A 29 ARG H A 29 ARG HGx 1.0 . 4.03 958 857 A 29 ARG H A 29 ARG HGy 1.0 . 4.03 959 858 A 29 ARG H A 32 GLU HGx 1.0 . 5.13 960 858 A 29 ARG H A 32 GLU HGy 1.0 . 5.13 961 859 A 29 ARG HA A 29 ARG HDx 1.0 . 4.37 962 859 A 29 ARG HA A 29 ARG HDy 1.0 . 4.37 963 860 A 29 ARG HA A 32 GLU HGx 1.0 . 4.76 964 860 A 29 ARG HA A 32 GLU HGy 1.0 . 4.76 965 861 A 29 ARG HA A 33 GLU HGx 1.0 . 5.34 966 861 A 29 ARG HA A 33 GLU HGy 1.0 . 5.34 967 862 B 86 ILE HD1% A 29 ARG HGx 1.0 . 4.91 968 862 B 86 ILE HD1% A 29 ARG HGy 1.0 . 4.91 969 863 A 30 ALA H A 31 LEU HDy% 1.0 . 5.26 970 863 A 30 ALA H A 31 LEU HDx% 1.0 . 5.26 971 864 A 30 ALA HA A 31 LEU HDy% 1.0 . 5.44 972 864 A 30 ALA HA A 31 LEU HDx% 1.0 . 5.44 973 865 A 30 ALA HA A 33 GLU HBx 1.0 . 5.32 974 865 A 30 ALA HA A 33 GLU HBy 1.0 . 5.32 975 866 A 30 ALA HB% A 31 LEU HDy% 1.0 . 4.42 976 866 A 30 ALA HB% A 31 LEU HDx% 1.0 . 4.42 977 867 A 31 LEU H A 31 LEU HDy% 1.0 . 4.23 978 867 A 31 LEU H A 31 LEU HDx% 1.0 . 4.23 979 868 A 31 LEU HA A 31 LEU HDy% 1.0 . 3.55 980 868 A 31 LEU HA A 31 LEU HDx% 1.0 . 3.55 981 869 A 31 LEU HA A 34 LYS HBx 1.0 . 4.64 982 869 A 31 LEU HA A 34 LYS HBy 1.0 . 4.64 983 870 A 31 LEU HG A 38 PRO HDy 1.0 . 5.29 984 870 A 31 LEU HG A 38 PRO HDx 1.0 . 5.29 985 871 A 31 LEU HG A 55 PRO HDy 1.0 . 4.34 986 871 A 31 LEU HG A 55 PRO HDx 1.0 . 4.34 987 872 A 32 GLU H A 31 LEU HDy% 1.0 . 5.44 988 872 A 32 GLU H A 31 LEU HDx% 1.0 . 5.44 989 873 A 36 TYR H A 31 LEU HDy% 1.0 . 4.99 990 873 A 36 TYR H A 31 LEU HDx% 1.0 . 4.99 991 874 A 31 LEU HDy% A 36 TYR HBy 1.0 . 4.85 992 874 A 31 LEU HDx% A 36 TYR HBy 1.0 . 4.85 993 874 A 36 TYR HBx A 31 LEU HDy% 1.0 . 4.85 994 874 A 31 LEU HDx% A 36 TYR HBx 1.0 . 4.85 995 875 A 36 TYR HD% A 31 LEU HDy% 1.0 . 3.95 996 875 A 36 TYR HD% A 31 LEU HDx% 1.0 . 3.95 997 876 A 36 TYR HE% A 31 LEU HDy% 1.0 . 5.44 998 876 A 36 TYR HE% A 31 LEU HDx% 1.0 . 5.44 999 877 A 38 PRO HA A 31 LEU HDy% 1.0 . 4.38 1000 877 A 38 PRO HA A 31 LEU HDx% 1.0 . 4.38 1001 878 A 31 LEU HDx% A 38 PRO HBy 1.0 . 4.17 1002 878 A 31 LEU HDy% A 38 PRO HBy 1.0 . 4.17 1003 878 A 38 PRO HBx A 31 LEU HDy% 1.0 . 4.17 1004 878 A 31 LEU HDx% A 38 PRO HBx 1.0 . 4.17 1005 879 A 39 ILE H A 31 LEU HDy% 1.0 . 5.44 1006 879 A 39 ILE H A 31 LEU HDx% 1.0 . 5.44 1007 880 A 31 LEU HDx% A 41 GLN HBy 1.0 . 3.43 1008 880 A 31 LEU HDy% A 41 GLN HBy 1.0 . 3.43 1009 880 A 41 GLN HBx A 31 LEU HDy% 1.0 . 3.43 1010 880 A 31 LEU HDx% A 41 GLN HBx 1.0 . 3.43 1011 881 A 31 LEU HDx% A 41 GLN HGx 1.0 . 3.73 1012 881 A 31 LEU HDy% A 41 GLN HGx 1.0 . 3.73 1013 881 A 41 GLN HGy A 31 LEU HDy% 1.0 . 3.73 1014 881 A 31 LEU HDx% A 41 GLN HGy 1.0 . 3.73 1015 882 A 41 GLN HE2x A 31 LEU HDx% 1.0 . 5.27 1016 882 A 41 GLN HE2x A 31 LEU HDy% 1.0 . 5.27 1017 882 A 41 GLN HE2y A 31 LEU HDx% 1.0 . 5.27 1018 882 A 41 GLN HE2y A 31 LEU HDy% 1.0 . 5.27 1019 883 A 42 ILE H A 31 LEU HDy% 1.0 . 4.30 1020 883 A 42 ILE H A 31 LEU HDx% 1.0 . 4.30 1021 884 A 42 ILE HA A 31 LEU HDy% 1.0 . 5.44 1022 884 A 42 ILE HA A 31 LEU HDx% 1.0 . 5.44 1023 885 A 31 LEU HDx% A 42 ILE HG1x 1.0 . 4.61 1024 885 A 31 LEU HDy% A 42 ILE HG1x 1.0 . 4.61 1025 885 A 42 ILE HG1y A 31 LEU HDy% 1.0 . 4.61 1026 885 A 42 ILE HG1y A 31 LEU HDx% 1.0 . 4.61 1027 886 A 54 ILE HA A 31 LEU HDy% 1.0 . 4.63 1028 886 A 54 ILE HA A 31 LEU HDx% 1.0 . 4.63 1029 887 A 54 ILE HD1% A 31 LEU HDy% 1.0 . 3.91 1030 887 A 54 ILE HD1% A 31 LEU HDx% 1.0 . 3.91 1031 888 A 31 LEU HDx% A 55 PRO HGx 1.0 . 4.17 1032 888 A 31 LEU HDy% A 55 PRO HGx 1.0 . 4.17 1033 888 A 55 PRO HGy A 31 LEU HDy% 1.0 . 4.17 1034 888 A 31 LEU HDx% A 55 PRO HGy 1.0 . 4.17 1035 889 A 31 LEU HDy% A 55 PRO HDy 1.0 . 4.09 1036 889 A 31 LEU HDx% A 55 PRO HDy 1.0 . 4.09 1037 889 A 55 PRO HDx A 31 LEU HDy% 1.0 . 4.09 1038 889 A 31 LEU HDx% A 55 PRO HDx 1.0 . 4.09 1039 890 A 32 GLU H A 32 GLU HBy 1.0 . 3.38 1040 890 A 32 GLU H A 32 GLU HBx 1.0 . 3.38 1041 891 A 32 GLU H A 32 GLU HGx 1.0 . 3.57 1042 891 A 32 GLU H A 32 GLU HGy 1.0 . 3.57 1043 892 A 33 GLU H A 32 GLU HBy 1.0 . 3.43 1044 892 A 33 GLU H A 32 GLU HBx 1.0 . 3.43 1045 893 A 38 PRO HGy A 32 GLU HGx 1.0 . 5.32 1046 893 A 38 PRO HGy A 32 GLU HGy 1.0 . 5.32 1047 894 A 33 GLU H A 33 GLU HBx 1.0 . 3.43 1048 894 A 33 GLU H A 33 GLU HBy 1.0 . 3.43 1049 895 A 33 GLU H A 33 GLU HGx 1.0 . 3.92 1050 895 A 33 GLU H A 33 GLU HGy 1.0 . 3.92 1051 896 A 33 GLU HBy A 33 GLU HGx 1.0 . 2.37 1052 896 A 33 GLU HBx A 33 GLU HGx 1.0 . 2.37 1053 896 A 33 GLU HGy A 33 GLU HBx 1.0 . 2.37 1054 896 A 33 GLU HGy A 33 GLU HBy 1.0 . 2.37 1055 897 A 34 LYS HG2 A 33 GLU HBx 1.0 . 5.13 1056 897 A 34 LYS HG2 A 33 GLU HBy 1.0 . 5.13 1057 898 A 57 TYR HE% A 33 GLU HBx 1.0 . 3.94 1058 898 A 57 TYR HE% A 33 GLU HBy 1.0 . 3.94 1059 899 A 57 TYR HE% A 33 GLU HGx 1.0 . 4.48 1060 899 A 57 TYR HE% A 33 GLU HGy 1.0 . 4.48 1061 900 A 34 LYS H A 34 LYS HDx 1.0 . 4.66 1062 900 A 34 LYS H A 34 LYS HDy 1.0 . 4.66 1063 901 A 34 LYS H A 35 GLY HAy 1.0 . 5.34 1064 901 A 34 LYS H A 35 GLY HAx 1.0 . 5.34 1065 902 A 34 LYS HBx A 34 LYS HEx 1.0 . 4.69 1066 902 A 34 LYS HEy A 34 LYS HBx 1.0 . 4.69 1067 902 A 34 LYS HBy A 34 LYS HEy 1.0 . 4.69 1068 902 A 34 LYS HBy A 34 LYS HEx 1.0 . 4.69 1069 903 A 36 TYR H A 34 LYS HBx 1.0 . 4.83 1070 903 A 36 TYR H A 34 LYS HBy 1.0 . 4.83 1071 904 A 36 TYR HE% A 34 LYS HBx 1.0 . 3.73 1072 904 A 36 TYR HE% A 34 LYS HBy 1.0 . 3.73 1073 905 A 34 LYS HBy A 55 PRO HGx 1.0 . 4.57 1074 905 A 55 PRO HGy A 34 LYS HBx 1.0 . 4.57 1075 905 A 34 LYS HBy A 55 PRO HGy 1.0 . 4.57 1076 905 A 34 LYS HBx A 55 PRO HGx 1.0 . 4.57 1077 906 A 36 TYR HD% A 34 LYS HDx 1.0 . 5.34 1078 906 A 36 TYR HD% A 34 LYS HDy 1.0 . 5.34 1079 907 A 36 TYR HE% A 34 LYS HDx 1.0 . 4.25 1080 907 A 36 TYR HE% A 34 LYS HDy 1.0 . 4.25 1081 908 A 57 TYR HD% A 34 LYS HDx 1.0 . 4.03 1082 908 A 57 TYR HD% A 34 LYS HDy 1.0 . 4.03 1083 909 A 36 TYR HD% A 34 LYS HEx 1.0 . 5.34 1084 909 A 36 TYR HD% A 34 LYS HEy 1.0 . 5.34 1085 910 A 57 TYR H A 34 LYS HEx 1.0 . 4.50 1086 910 A 57 TYR H A 34 LYS HEy 1.0 . 4.50 1087 911 A 57 TYR HD% A 34 LYS HEx 1.0 . 4.24 1088 911 A 57 TYR HD% A 34 LYS HEy 1.0 . 4.24 1089 912 A 57 TYR HE% A 34 LYS HEx 1.0 . 5.34 1090 912 A 57 TYR HE% A 34 LYS HEy 1.0 . 5.34 1091 913 A 36 TYR H A 36 TYR HBy 1.0 . 3.61 1092 913 A 36 TYR H A 36 TYR HBx 1.0 . 3.61 1093 914 A 36 TYR HD% A 55 PRO HGx 1.0 . 4.03 1094 914 A 36 TYR HD% A 55 PRO HGy 1.0 . 4.03 1095 915 A 39 ILE H A 37 ASN HBy 1.0 . 4.66 1096 915 A 39 ILE H A 37 ASN HBx 1.0 . 4.66 1097 916 A 40 ASN H A 37 ASN HBy 1.0 . 4.44 1098 916 A 40 ASN H A 37 ASN HBx 1.0 . 4.44 1099 917 A 40 ASN HD2x A 37 ASN HBx 1.0 . 4.21 1100 917 A 40 ASN HD2y A 37 ASN HBy 1.0 . 4.21 1101 917 A 40 ASN HD2x A 37 ASN HBy 1.0 . 4.21 1102 917 A 40 ASN HD2y A 37 ASN HBx 1.0 . 4.21 1103 918 A 39 ILE H A 38 PRO HBy 1.0 . 4.11 1104 918 A 39 ILE H A 38 PRO HBx 1.0 . 4.11 1105 919 A 39 ILE H A 38 PRO HDy 1.0 . 4.86 1106 919 A 39 ILE H A 38 PRO HDx 1.0 . 4.86 1107 920 A 39 ILE H A 39 ILE HG1x 1.0 . 3.65 1108 920 A 39 ILE H A 39 ILE HG1y 1.0 . 3.65 1109 921 A 39 ILE HG2% B 74 GLU HGx 1.0 . 4.28 1110 921 A 39 ILE HG2% B 74 GLU HGy 1.0 . 4.28 1111 922 B 78 LYS HGx A 39 ILE HG1x 1.0 . 4.09 1112 922 B 78 LYS HGx A 39 ILE HG1y 1.0 . 4.09 1113 923 A 40 ASN H A 40 ASN HBy 1.0 . 3.51 1114 923 A 40 ASN H A 40 ASN HBx 1.0 . 3.51 1115 924 A 40 ASN H A 40 ASN HD2y 1.0 . 4.34 1116 924 A 40 ASN H A 40 ASN HD2x 1.0 . 4.34 1117 925 A 41 GLN H A 40 ASN HBy 1.0 . 3.92 1118 925 A 41 GLN H A 40 ASN HBx 1.0 . 3.92 1119 926 A 41 GLN H A 41 GLN HGx 1.0 . 3.41 1120 926 A 41 GLN H A 41 GLN HGy 1.0 . 3.41 1121 927 A 41 GLN H A 42 ILE HG1x 1.0 . 4.58 1122 927 A 41 GLN H A 42 ILE HG1y 1.0 . 4.58 1123 928 A 41 GLN HE2y A 41 GLN HA 1.0 . 4.98 1124 928 A 41 GLN HE2x A 41 GLN HA 1.0 . 4.98 1125 929 A 54 ILE HD1% A 41 GLN HBy 1.0 . 5.17 1126 929 A 54 ILE HD1% A 41 GLN HBx 1.0 . 5.17 1127 930 A 54 ILE HD1% A 41 GLN HGx 1.0 . 5.34 1128 930 A 54 ILE HD1% A 41 GLN HGy 1.0 . 5.34 1129 931 A 53 TYR HA A 41 GLN HE2y 1.0 . 4.27 1130 931 A 53 TYR HA A 41 GLN HE2x 1.0 . 4.27 1131 932 A 41 GLN HE2y A 53 TYR HBx 1.0 . 4.52 1132 932 A 41 GLN HE2x A 53 TYR HBy 1.0 . 4.52 1133 932 A 41 GLN HE2x A 53 TYR HBx 1.0 . 4.52 1134 932 A 41 GLN HE2y A 53 TYR HBy 1.0 . 4.52 1135 933 A 54 ILE HD1% A 41 GLN HE2y 1.0 . 5.34 1136 933 A 54 ILE HD1% A 41 GLN HE2x 1.0 . 5.34 1137 934 A 42 ILE H A 43 VAL HGy% 1.0 . 5.44 1138 934 A 42 ILE H A 43 VAL HGx% 1.0 . 5.44 1139 935 A 42 ILE HA A 45 TYR HB2 1.0 . 5.34 1140 935 A 42 ILE HA A 45 TYR HBy 1.0 . 5.34 1141 936 A 42 ILE HB A 43 VAL HGy% 1.0 . 4.86 1142 936 A 42 ILE HB A 43 VAL HGx% 1.0 . 4.86 1143 937 A 42 ILE HG2% A 46 LEU HDy% 1.0 . 3.31 1144 937 A 42 ILE HG2% A 46 LEU HDx% 1.0 . 3.31 1145 938 A 54 ILE HD1% A 42 ILE HG1x 1.0 . 4.51 1146 938 A 54 ILE HD1% A 42 ILE HG1y 1.0 . 4.51 1147 939 A 64 ILE HD1% A 42 ILE HG1x 1.0 . 4.88 1148 939 A 64 ILE HD1% A 42 ILE HG1y 1.0 . 4.88 1149 940 A 43 VAL H A 43 VAL HGy% 1.0 . 3.65 1150 940 A 43 VAL H A 43 VAL HGx% 1.0 . 3.65 1151 941 A 43 VAL HA A 46 LEU HBx 1.0 . 4.79 1152 941 A 43 VAL HA A 46 LEU HBy 1.0 . 4.79 1153 942 A 43 VAL HA A 46 LEU HDy% 1.0 . 4.49 1154 942 A 43 VAL HA A 46 LEU HDx% 1.0 . 4.49 1155 943 A 43 VAL HB A 46 LEU HDy% 1.0 . 5.44 1156 943 A 43 VAL HB A 46 LEU HDx% 1.0 . 5.44 1157 944 A 44 GLY H A 43 VAL HGy% 1.0 . 3.93 1158 944 A 44 GLY H A 43 VAL HGx% 1.0 . 3.93 1159 945 A 43 VAL HGy% A 46 LEU HDy% 1.0 . 4.41 1160 945 A 46 LEU HDx% A 43 VAL HGy% 1.0 . 4.41 1161 945 A 43 VAL HGx% A 46 LEU HDx% 1.0 . 4.41 1162 945 A 43 VAL HGx% A 46 LEU HDy% 1.0 . 4.41 1163 946 A 47 LEU H A 43 VAL HGy% 1.0 . 5.44 1164 946 A 47 LEU H A 43 VAL HGx% 1.0 . 5.44 1165 947 A 47 LEU HG A 43 VAL HGy% 1.0 . 5.01 1166 947 A 47 LEU HG A 43 VAL HGx% 1.0 . 5.01 1167 948 B 73 MET HA A 43 VAL HGy% 1.0 . 5.42 1168 948 A 43 VAL HGx% B 73 MET HA 1.0 . 5.42 1169 949 A 43 VAL HGx% B 73 MET HGx 1.0 . 4.22 1170 949 A 43 VAL HGy% B 73 MET HGx 1.0 . 4.22 1171 949 B 73 MET HGy A 43 VAL HGy% 1.0 . 4.22 1172 949 A 43 VAL HGx% B 73 MET HGy 1.0 . 4.22 1173 950 B 74 GLU H A 43 VAL HGy% 1.0 . 4.41 1174 950 A 43 VAL HGx% B 74 GLU H 1.0 . 4.41 1175 951 A 43 VAL HGx% B 74 GLU HBx 1.0 . 4.85 1176 951 A 43 VAL HGy% B 74 GLU HBx 1.0 . 4.85 1177 951 B 74 GLU HBy A 43 VAL HGy% 1.0 . 4.85 1178 951 A 43 VAL HGx% B 74 GLU HBy 1.0 . 4.85 1179 952 A 44 GLY H A 46 LEU HDy% 1.0 . 5.09 1180 952 A 44 GLY H A 46 LEU HDx% 1.0 . 5.09 1181 953 A 53 TYR HE% A 44 GLY HAy 1.0 . 3.84 1182 953 A 53 TYR HE% A 44 GLY HAx 1.0 . 3.84 1183 954 A 45 TYR H A 45 TYR HB2 1.0 . 3.54 1184 954 A 45 TYR H A 45 TYR HBy 1.0 . 3.54 1185 955 A 46 LEU H A 45 TYR HB2 1.0 . 4.09 1186 955 A 46 LEU H A 45 TYR HBy 1.0 . 4.09 1187 956 A 54 ILE HD1% A 45 TYR HB2 1.0 . 4.62 1188 956 A 54 ILE HD1% A 45 TYR HBy 1.0 . 4.62 1189 957 A 45 TYR HD% A 46 LEU HBx 1.0 . 4.59 1190 957 A 45 TYR HD% A 46 LEU HBy 1.0 . 4.59 1191 958 A 45 TYR HD% A 46 LEU HDy% 1.0 . 4.78 1192 958 A 45 TYR HD% A 46 LEU HDx% 1.0 . 4.78 1193 959 A 45 TYR HD% A 64 ILE HG1x 1.0 . 4.79 1194 959 A 45 TYR HD% A 64 ILE HG1y 1.0 . 4.79 1195 960 A 45 TYR HE% A 46 LEU HDy% 1.0 . 4.37 1196 960 A 45 TYR HE% A 46 LEU HDx% 1.0 . 4.37 1197 961 A 45 TYR HE% A 51 PRO HBy 1.0 . 4.56 1198 961 A 45 TYR HE% A 51 PRO HBx 1.0 . 4.56 1199 962 A 45 TYR HE% A 64 ILE HG1x 1.0 . 4.64 1200 962 A 45 TYR HE% A 64 ILE HG1y 1.0 . 4.64 1201 963 A 45 TYR HE% A 69 ARG HBx 1.0 . 4.65 1202 963 A 45 TYR HE% A 69 ARG HBy 1.0 . 4.65 1203 964 A 45 TYR HE% A 69 ARG HGy 1.0 . 4.85 1204 964 A 45 TYR HE% A 69 ARG HGx 1.0 . 4.85 1205 965 A 46 LEU H A 46 LEU HBx 1.0 . 3.45 1206 965 A 46 LEU H A 46 LEU HBy 1.0 . 3.45 1207 966 A 46 LEU H A 46 LEU HDy% 1.0 . 3.97 1208 966 A 46 LEU H A 46 LEU HDx% 1.0 . 3.97 1209 967 A 46 LEU HA A 46 LEU HDy% 1.0 . 4.02 1210 967 A 46 LEU HA A 46 LEU HDx% 1.0 . 4.02 1211 968 A 47 LEU H A 46 LEU HBx 1.0 . 4.04 1212 968 A 47 LEU H A 46 LEU HBy 1.0 . 4.04 1213 969 A 46 LEU HBy A 47 LEU HDy% 1.0 . 3.91 1214 969 A 46 LEU HBx A 47 LEU HDy% 1.0 . 3.91 1215 969 A 47 LEU HDx% A 46 LEU HBx 1.0 . 3.91 1216 969 A 46 LEU HBy A 47 LEU HDx% 1.0 . 3.91 1217 970 B 73 MET HE% A 46 LEU HBx 1.0 . 3.91 1218 970 B 73 MET HE% A 46 LEU HBy 1.0 . 3.91 1219 971 A 46 LEU HG A 76 LEU HDy% 1.0 . 5.25 1220 971 A 46 LEU HG A 76 LEU HDx% 1.0 . 5.25 1221 972 A 47 LEU H A 46 LEU HDy% 1.0 . 4.93 1222 972 A 47 LEU H A 46 LEU HDx% 1.0 . 4.93 1223 973 A 46 LEU HDx% A 69 ARG HBx 1.0 . 5.28 1224 973 A 46 LEU HDy% A 69 ARG HBx 1.0 . 5.28 1225 973 A 69 ARG HBy A 46 LEU HDy% 1.0 . 5.28 1226 973 A 46 LEU HDx% A 69 ARG HBy 1.0 . 5.28 1227 974 A 46 LEU HDx% A 69 ARG HGy 1.0 . 4.17 1228 974 A 46 LEU HDy% A 69 ARG HGy 1.0 . 4.17 1229 974 A 69 ARG HGx A 46 LEU HDy% 1.0 . 4.17 1230 974 A 46 LEU HDx% A 69 ARG HGx 1.0 . 4.17 1231 975 A 73 MET HA A 46 LEU HDy% 1.0 . 5.40 1232 975 A 73 MET HA A 46 LEU HDx% 1.0 . 5.40 1233 976 A 76 LEU HG A 46 LEU HDy% 1.0 . 5.05 1234 976 A 76 LEU HG A 46 LEU HDx% 1.0 . 5.05 1235 977 A 46 LEU HDx% A 76 LEU HDy% 1.0 . 3.52 1236 977 A 46 LEU HDy% A 76 LEU HDy% 1.0 . 3.52 1237 977 A 76 LEU HDx% A 46 LEU HDy% 1.0 . 3.52 1238 977 A 76 LEU HDx% A 46 LEU HDx% 1.0 . 3.52 1239 978 B 73 MET HE% A 46 LEU HDy% 1.0 . 3.63 1240 978 B 73 MET HE% A 46 LEU HDx% 1.0 . 3.63 1241 979 A 47 LEU H A 47 LEU HBx 1.0 . 3.47 1242 979 A 47 LEU H A 47 LEU HBy 1.0 . 3.47 1243 980 A 47 LEU H A 47 LEU HDy% 1.0 . 3.92 1244 980 A 47 LEU H A 47 LEU HDx% 1.0 . 3.92 1245 981 A 47 LEU H B 73 MET HGx 1.0 . 5.34 1246 981 A 47 LEU H B 73 MET HGy 1.0 . 5.34 1247 982 A 48 SER H A 47 LEU HBx 1.0 . 4.20 1248 982 A 48 SER H A 47 LEU HBy 1.0 . 4.20 1249 983 A 48 SER H A 47 LEU HDy% 1.0 . 5.09 1250 983 A 48 SER H A 47 LEU HDx% 1.0 . 5.09 1251 984 A 47 LEU HDx% B 69 ARG HBx 1.0 . 5.28 1252 984 A 47 LEU HDy% B 69 ARG HBx 1.0 . 5.28 1253 984 B 69 ARG HBy A 47 LEU HDy% 1.0 . 5.28 1254 984 A 47 LEU HDx% B 69 ARG HBy 1.0 . 5.28 1255 985 A 47 LEU HDx% B 73 MET HGx 1.0 . 4.21 1256 985 B 73 MET HGy A 47 LEU HDy% 1.0 . 4.21 1257 985 B 73 MET HGy A 47 LEU HDx% 1.0 . 4.21 1258 985 A 47 LEU HDy% B 73 MET HGx 1.0 . 4.21 1259 986 B 73 MET HE% A 47 LEU HDy% 1.0 . 3.41 1260 986 B 73 MET HE% A 47 LEU HDx% 1.0 . 3.41 1261 987 B 74 GLU H A 47 LEU HDy% 1.0 . 5.25 1262 987 B 74 GLU H A 47 LEU HDx% 1.0 . 5.25 1263 988 A 48 SER H A 49 GLY HAy 1.0 . 4.77 1264 988 A 48 SER H A 49 GLY HAx 1.0 . 4.77 1265 989 A 50 ASP H A 48 SER HB2 1.0 . 5.34 1266 989 A 50 ASP H A 48 SER HBy 1.0 . 5.34 1267 990 A 49 GLY HAy A 69 ARG HDx 1.0 . 4.76 1268 990 A 49 GLY HAx A 69 ARG HDx 1.0 . 4.76 1269 990 A 69 ARG HDy A 49 GLY HAy 1.0 . 4.76 1270 990 A 49 GLY HAx A 69 ARG HDy 1.0 . 4.76 1271 991 A 53 TYR HD% A 50 ASP HBx 1.0 . 4.35 1272 991 A 53 TYR HD% A 50 ASP HBy 1.0 . 4.35 1273 992 A 53 TYR HE% A 50 ASP HBx 1.0 . 3.88 1274 992 A 53 TYR HE% A 50 ASP HBy 1.0 . 3.88 1275 993 A 52 ALA H A 51 PRO HBy 1.0 . 4.07 1276 993 A 52 ALA H A 51 PRO HBx 1.0 . 4.07 1277 994 A 64 ILE HG2% A 51 PRO HBy 1.0 . 4.18 1278 994 A 64 ILE HG2% A 51 PRO HBx 1.0 . 4.18 1279 995 A 65 ARG HA A 51 PRO HBy 1.0 . 4.68 1280 995 A 65 ARG HA A 51 PRO HBx 1.0 . 4.68 1281 996 A 51 PRO HBx A 65 ARG HGx 1.0 . 3.84 1282 996 A 65 ARG HGy A 51 PRO HBy 1.0 . 3.84 1283 996 A 51 PRO HBx A 65 ARG HGy 1.0 . 3.84 1284 996 A 51 PRO HBy A 65 ARG HGx 1.0 . 3.84 1285 997 A 51 PRO HBy A 65 ARG HDx 1.0 . 4.76 1286 997 A 51 PRO HBx A 65 ARG HDx 1.0 . 4.76 1287 997 A 65 ARG HDy A 51 PRO HBy 1.0 . 4.76 1288 997 A 51 PRO HBx A 65 ARG HDy 1.0 . 4.76 1289 998 A 52 ALA H A 51 PRO HGx 1.0 . 4.24 1290 998 A 52 ALA H A 51 PRO HGy 1.0 . 4.24 1291 999 A 51 PRO HGy A 65 ARG HDx 1.0 . 4.76 1292 999 A 51 PRO HGx A 65 ARG HDx 1.0 . 4.76 1293 999 A 65 ARG HDy A 51 PRO HGx 1.0 . 4.76 1294 999 A 65 ARG HDy A 51 PRO HGy 1.0 . 4.76 1295 1000 A 52 ALA H A 51 PRO HDy 1.0 . 4.12 1296 1000 A 52 ALA H A 51 PRO HDx 1.0 . 4.12 1297 1001 A 53 TYR H A 53 TYR HBy 1.0 . 3.69 1298 1001 A 53 TYR H A 53 TYR HBx 1.0 . 3.69 1299 1002 A 54 ILE H A 53 TYR HBy 1.0 . 4.48 1300 1002 A 54 ILE H A 53 TYR HBx 1.0 . 4.48 1301 1003 A 54 ILE H A 54 ILE HG1y 1.0 . 4.14 1302 1003 A 54 ILE H A 54 ILE HG1x 1.0 . 4.14 1303 1004 A 54 ILE HA A 55 PRO HGx 1.0 . 5.11 1304 1004 A 54 ILE HA A 55 PRO HGy 1.0 . 5.11 1305 1005 A 54 ILE HB A 55 PRO HDy 1.0 . 4.97 1306 1005 A 54 ILE HB A 55 PRO HDx 1.0 . 4.97 1307 1006 A 54 ILE HG2% A 55 PRO HDy 1.0 . 4.11 1308 1006 A 54 ILE HG2% A 55 PRO HDx 1.0 . 4.11 1309 1007 A 64 ILE HD1% A 54 ILE HG1y 1.0 . 4.98 1310 1007 A 64 ILE HD1% A 54 ILE HG1x 1.0 . 4.98 1311 1008 A 54 ILE HD1% A 55 PRO HGx 1.0 . 5.23 1312 1008 A 54 ILE HD1% A 55 PRO HGy 1.0 . 5.23 1313 1009 A 54 ILE HD1% A 55 PRO HDy 1.0 . 4.77 1314 1009 A 54 ILE HD1% A 55 PRO HDx 1.0 . 4.77 1315 1010 A 55 PRO HB2 A 57 TYR HBy 1.0 . 4.84 1316 1010 A 55 PRO HB2 A 57 TYR HBx 1.0 . 4.84 1317 1011 A 57 TYR H A 55 PRO HGx 1.0 . 4.89 1318 1011 A 57 TYR H A 55 PRO HGy 1.0 . 4.89 1319 1012 A 56 ARG H A 56 ARG HGy 1.0 . 4.73 1320 1012 A 56 ARG H A 56 ARG HGx 1.0 . 4.73 1321 1013 A 56 ARG H A 56 ARG HD2 1.0 . 4.98 1322 1013 A 56 ARG H A 56 ARG HDy 1.0 . 4.98 1323 1014 A 56 ARG HA A 56 ARG HD2 1.0 . 5.22 1324 1014 A 56 ARG HA A 56 ARG HDy 1.0 . 5.22 1325 1015 A 56 ARG HBy A 56 ARG HD2 1.0 . 3.24 1326 1015 A 56 ARG HBx A 56 ARG HD2 1.0 . 3.24 1327 1015 A 56 ARG HDy A 56 ARG HBy 1.0 . 3.24 1328 1015 A 56 ARG HDy A 56 ARG HBx 1.0 . 3.24 1329 1016 A 57 TYR H A 57 TYR HBy 1.0 . 3.63 1330 1016 A 57 TYR H A 57 TYR HBx 1.0 . 3.63 1331 1017 A 57 TYR HD% A 58 GLN HG2 1.0 . 5.33 1332 1017 A 57 TYR HD% A 58 GLN HGy 1.0 . 5.33 1333 1018 A 57 TYR HE% A 58 GLN HG2 1.0 . 4.27 1334 1018 A 57 TYR HE% A 58 GLN HGy 1.0 . 4.27 1335 1019 A 58 GLN H A 58 GLN HG2 1.0 . 4.74 1336 1019 A 58 GLN H A 58 GLN HGy 1.0 . 4.74 1337 1020 A 59 ASP H A 58 GLN HBy 1.0 . 4.45 1338 1020 A 59 ASP H A 58 GLN HBx 1.0 . 4.45 1339 1021 A 60 ALA H A 58 GLN HBy 1.0 . 4.23 1340 1021 A 60 ALA H A 58 GLN HBx 1.0 . 4.23 1341 1022 A 58 GLN HBy A 63 LEU HDy% 1.0 . 4.85 1342 1022 A 58 GLN HBx A 63 LEU HDy% 1.0 . 4.85 1343 1022 A 63 LEU HDx% A 58 GLN HBy 1.0 . 4.85 1344 1022 A 63 LEU HDx% A 58 GLN HBx 1.0 . 4.85 1345 1023 A 59 ASP H A 58 GLN HG2 1.0 . 4.70 1346 1023 A 59 ASP H A 58 GLN HGy 1.0 . 4.70 1347 1024 A 59 ASP HBy A 63 LEU HDy% 1.0 . 4.04 1348 1024 A 59 ASP HBy A 63 LEU HDx% 1.0 . 4.04 1349 1025 A 59 ASP HBx A 63 LEU HDy% 1.0 . 4.80 1350 1025 A 59 ASP HBx A 63 LEU HDx% 1.0 . 4.80 1351 1026 A 60 ALA HA A 63 LEU HDy% 1.0 . 4.55 1352 1026 A 60 ALA HA A 63 LEU HDx% 1.0 . 4.55 1353 1027 A 62 ASN H A 62 ASN HBy 1.0 . 3.67 1354 1027 A 62 ASN H A 62 ASN HBx 1.0 . 3.67 1355 1028 A 62 ASN H A 62 ASN HD2y 1.0 . 4.72 1356 1028 A 62 ASN H A 62 ASN HD2x 1.0 . 4.72 1357 1029 A 62 ASN H A 63 LEU HDy% 1.0 . 5.44 1358 1029 A 62 ASN H A 63 LEU HDx% 1.0 . 5.44 1359 1030 A 62 ASN HA A 65 ARG HBx 1.0 . 5.04 1360 1030 A 62 ASN HA A 65 ARG HBy 1.0 . 5.04 1361 1031 A 62 ASN HA A 65 ARG HGx 1.0 . 4.32 1362 1031 A 62 ASN HA A 65 ARG HGy 1.0 . 4.32 1363 1032 A 63 LEU H A 62 ASN HBy 1.0 . 3.95 1364 1032 A 63 LEU H A 62 ASN HBx 1.0 . 3.95 1365 1033 A 63 LEU H A 63 LEU HDy% 1.0 . 3.94 1366 1033 A 63 LEU H A 63 LEU HDx% 1.0 . 3.94 1367 1034 A 63 LEU HA A 63 LEU HDy% 1.0 . 3.59 1368 1034 A 63 LEU HA A 63 LEU HDx% 1.0 . 3.59 1369 1035 A 63 LEU HA A 66 ARG HBy 1.0 . 4.74 1370 1035 A 63 LEU HA A 66 ARG HBx 1.0 . 4.74 1371 1036 A 63 LEU HA A 66 ARG HGx 1.0 . 4.79 1372 1036 A 63 LEU HA A 66 ARG HGy 1.0 . 4.79 1373 1037 A 63 LEU HA A 66 ARG HD2 1.0 . 4.75 1374 1037 A 63 LEU HA A 66 ARG HDy 1.0 . 4.75 1375 1038 A 64 ILE H A 63 LEU HDy% 1.0 . 4.48 1376 1038 A 64 ILE H A 63 LEU HDx% 1.0 . 4.48 1377 1039 A 63 LEU HDx% A 66 ARG HGx 1.0 . 4.56 1378 1039 A 63 LEU HDy% A 66 ARG HGx 1.0 . 4.56 1379 1039 A 66 ARG HGy A 63 LEU HDy% 1.0 . 4.56 1380 1039 A 63 LEU HDx% A 66 ARG HGy 1.0 . 4.56 1381 1040 A 63 LEU HDy% A 66 ARG HD2 1.0 . 4.54 1382 1040 A 63 LEU HDx% A 66 ARG HD2 1.0 . 4.54 1383 1040 A 66 ARG HDy A 63 LEU HDy% 1.0 . 4.54 1384 1040 A 63 LEU HDx% A 66 ARG HDy 1.0 . 4.54 1385 1041 A 64 ILE H A 64 ILE HG1x 1.0 . 4.45 1386 1041 A 64 ILE H A 64 ILE HG1y 1.0 . 4.45 1387 1042 A 64 ILE HG2% A 65 ARG HGx 1.0 . 3.95 1388 1042 A 64 ILE HG2% A 65 ARG HGy 1.0 . 3.95 1389 1043 A 64 ILE HG2% A 65 ARG HDx 1.0 . 4.82 1390 1043 A 64 ILE HG2% A 65 ARG HDy 1.0 . 4.82 1391 1044 A 72 ILE HD1% A 64 ILE HG1x 1.0 . 4.39 1392 1044 A 72 ILE HD1% A 64 ILE HG1y 1.0 . 4.39 1393 1045 A 65 ARG H A 65 ARG HBx 1.0 . 3.51 1394 1045 A 65 ARG H A 65 ARG HBy 1.0 . 3.51 1395 1046 A 65 ARG H A 66 ARG HBy 1.0 . 5.34 1396 1046 A 65 ARG H A 66 ARG HBx 1.0 . 5.34 1397 1047 A 66 ARG H A 66 ARG HBy 1.0 . 3.49 1398 1047 A 66 ARG H A 66 ARG HBx 1.0 . 3.49 1399 1048 A 66 ARG H A 66 ARG HD2 1.0 . 5.09 1400 1048 A 66 ARG H A 66 ARG HDy 1.0 . 5.09 1401 1049 A 66 ARG HA A 66 ARG HD2 1.0 . 5.03 1402 1049 A 66 ARG HDy A 66 ARG HA 1.0 . 5.03 1403 1050 A 66 ARG HBy A 66 ARG HD2 1.0 . 3.15 1404 1050 A 66 ARG HBx A 66 ARG HD2 1.0 . 3.15 1405 1050 A 66 ARG HDy A 66 ARG HBy 1.0 . 3.15 1406 1050 A 66 ARG HBx A 66 ARG HDy 1.0 . 3.15 1407 1051 A 68 GLU H A 67 HIS HBy 1.0 . 3.92 1408 1051 A 68 GLU H A 67 HIS HBx 1.0 . 3.92 1409 1052 A 72 ILE HB A 67 HIS HBy 1.0 . 5.34 1410 1052 A 72 ILE HB A 67 HIS HBx 1.0 . 5.34 1411 1053 A 72 ILE HD1% A 67 HIS HBy 1.0 . 4.37 1412 1053 A 72 ILE HD1% A 67 HIS HBx 1.0 . 4.37 1413 1054 A 68 GLU H A 68 GLU HBy 1.0 . 3.58 1414 1054 A 68 GLU H A 68 GLU HBx 1.0 . 3.58 1415 1055 A 68 GLU H A 68 GLU HGx 1.0 . 3.36 1416 1055 A 68 GLU H A 68 GLU HGy 1.0 . 3.36 1417 1056 A 68 GLU H A 71 GLU HBx 1.0 . 4.60 1418 1056 A 68 GLU H A 71 GLU HBy 1.0 . 4.60 1419 1057 A 70 ASP H A 68 GLU HBy 1.0 . 3.98 1420 1057 A 70 ASP H A 68 GLU HBx 1.0 . 3.98 1421 1058 A 70 ASP H A 69 ARG HBx 1.0 . 3.69 1422 1058 A 70 ASP H A 69 ARG HBy 1.0 . 3.69 1423 1059 A 70 ASP H A 70 ASP HB2 1.0 . 3.40 1424 1059 A 70 ASP H A 70 ASP HBy 1.0 . 3.40 1425 1060 A 70 ASP H B 47 LEU HDy% 1.0 . 5.44 1426 1060 A 70 ASP H B 47 LEU HDx% 1.0 . 5.44 1427 1061 A 70 ASP HA A 73 MET HBy 1.0 . 4.87 1428 1061 A 70 ASP HA A 73 MET HB2 1.0 . 4.87 1429 1062 A 70 ASP HA A 73 MET HGx 1.0 . 5.33 1430 1062 A 70 ASP HA A 73 MET HGy 1.0 . 5.33 1431 1063 A 70 ASP HA B 43 VAL HGy% 1.0 . 4.60 1432 1063 A 70 ASP HA B 43 VAL HGx% 1.0 . 4.60 1433 1064 A 70 ASP HA B 47 LEU HDy% 1.0 . 3.81 1434 1064 A 70 ASP HA B 47 LEU HDx% 1.0 . 3.81 1435 1065 A 71 GLU H A 70 ASP HB2 1.0 . 3.74 1436 1065 A 71 GLU H A 70 ASP HBy 1.0 . 3.74 1437 1066 A 70 ASP HBy B 43 VAL HGy% 1.0 . 4.18 1438 1066 A 70 ASP HB2 B 43 VAL HGy% 1.0 . 4.18 1439 1066 B 43 VAL HGx% A 70 ASP HB2 1.0 . 4.18 1440 1066 A 70 ASP HBy B 43 VAL HGx% 1.0 . 4.18 1441 1067 A 70 ASP HBy B 47 LEU HDy% 1.0 . 3.94 1442 1067 A 70 ASP HB2 B 47 LEU HDy% 1.0 . 3.94 1443 1067 B 47 LEU HDx% A 70 ASP HB2 1.0 . 3.94 1444 1067 A 70 ASP HBy B 47 LEU HDx% 1.0 . 3.94 1445 1068 A 71 GLU H A 71 GLU HBx 1.0 . 3.35 1446 1068 A 71 GLU H A 71 GLU HBy 1.0 . 3.35 1447 1069 A 71 GLU H A 71 GLU HGx 1.0 . 4.66 1448 1069 A 71 GLU H A 71 GLU HGy 1.0 . 4.66 1449 1070 A 72 ILE H A 71 GLU HBx 1.0 . 3.98 1450 1070 A 72 ILE H A 71 GLU HBy 1.0 . 3.98 1451 1071 A 72 ILE HB A 76 LEU HDy% 1.0 . 4.20 1452 1071 A 72 ILE HB A 76 LEU HDx% 1.0 . 4.20 1453 1072 A 72 ILE HG2% A 76 LEU HDy% 1.0 . 3.83 1454 1072 A 72 ILE HG2% A 76 LEU HDx% 1.0 . 3.83 1455 1073 A 73 MET H A 73 MET HBy 1.0 . 3.45 1456 1073 A 73 MET H A 73 MET HB2 1.0 . 3.45 1457 1074 A 73 MET H A 73 MET HGx 1.0 . 4.11 1458 1074 A 73 MET H A 73 MET HGy 1.0 . 4.11 1459 1075 A 73 MET H B 47 LEU HDy% 1.0 . 5.44 1460 1075 A 73 MET H B 47 LEU HDx% 1.0 . 5.44 1461 1076 A 73 MET HA A 76 LEU HDy% 1.0 . 4.35 1462 1076 A 73 MET HA A 76 LEU HDx% 1.0 . 4.35 1463 1077 A 73 MET HB2 B 43 VAL HGy% 1.0 . 3.83 1464 1077 A 73 MET HBy B 43 VAL HGy% 1.0 . 3.83 1465 1077 B 43 VAL HGx% A 73 MET HBy 1.0 . 3.83 1466 1077 A 73 MET HB2 B 43 VAL HGx% 1.0 . 3.83 1467 1078 B 43 VAL HGx% A 73 MET HBy 1.0 . 6.22 1468 1079 A 73 MET HBy B 43 VAL HGy% 1.0 . 6.22 1469 1080 A 73 MET HBy B 47 LEU HDy% 1.0 . 4.84 1470 1080 A 73 MET HB2 B 47 LEU HDy% 1.0 . 4.84 1471 1080 B 47 LEU HDx% A 73 MET HBy 1.0 . 4.84 1472 1080 B 47 LEU HDx% A 73 MET HB2 1.0 . 4.84 1473 1081 A 74 GLU H A 73 MET HGx 1.0 . 4.72 1474 1081 A 74 GLU H A 73 MET HGy 1.0 . 4.72 1475 1082 B 47 LEU HG A 73 MET HGx 1.0 . 4.87 1476 1082 A 73 MET HGy B 47 LEU HG 1.0 . 4.87 1477 1083 A 74 GLU HA B 43 VAL HGy% 1.0 . 4.18 1478 1083 A 74 GLU HA B 43 VAL HGx% 1.0 . 4.18 1479 1084 A 75 GLU H A 74 GLU HBx 1.0 . 3.85 1480 1084 A 75 GLU H A 74 GLU HBy 1.0 . 3.85 1481 1085 A 78 LYS HGy A 74 GLU HBx 1.0 . 5.13 1482 1085 A 78 LYS HGy A 74 GLU HBy 1.0 . 5.13 1483 1086 B 39 ILE HG2% A 74 GLU HBx 1.0 . 4.33 1484 1086 B 39 ILE HG2% A 74 GLU HBy 1.0 . 4.33 1485 1087 A 74 GLU HGy B 43 VAL HGy% 1.0 . 4.64 1486 1087 A 74 GLU HGx B 43 VAL HGy% 1.0 . 4.64 1487 1087 B 43 VAL HGx% A 74 GLU HGx 1.0 . 4.64 1488 1087 B 43 VAL HGx% A 74 GLU HGy 1.0 . 4.64 1489 1088 A 75 GLU H A 75 GLU HBx 1.0 . 3.31 1490 1088 A 75 GLU H A 75 GLU HBy 1.0 . 3.31 1491 1089 A 75 GLU H A 75 GLU HGx 1.0 . 5.34 1492 1089 A 75 GLU H A 75 GLU HGy 1.0 . 5.34 1493 1090 A 77 THR H A 75 GLU HBx 1.0 . 4.83 1494 1090 A 77 THR H A 75 GLU HBy 1.0 . 4.83 1495 1091 A 75 GLU HGx A 76 LEU HDy% 1.0 . 4.76 1496 1091 A 75 GLU HGy A 76 LEU HDy% 1.0 . 4.76 1497 1091 A 76 LEU HDx% A 75 GLU HGx 1.0 . 4.76 1498 1091 A 75 GLU HGy A 76 LEU HDx% 1.0 . 4.76 1499 1092 B 80 TYR HE% A 75 GLU HGx 1.0 . 4.29 1500 1092 B 80 TYR HE% A 75 GLU HGy 1.0 . 4.29 1501 1093 A 76 LEU H A 76 LEU HDy% 1.0 . 4.08 1502 1093 A 76 LEU H A 76 LEU HDx% 1.0 . 4.08 1503 1094 A 76 LEU HA A 76 LEU HDy% 1.0 . 3.91 1504 1094 A 76 LEU HA A 76 LEU HDx% 1.0 . 3.91 1505 1095 A 76 LEU HA B 80 TYR HBy 1.0 . 5.00 1506 1095 A 76 LEU HA B 80 TYR HBx 1.0 . 5.00 1507 1096 A 77 THR H A 76 LEU HDy% 1.0 . 4.94 1508 1096 A 77 THR H A 76 LEU HDx% 1.0 . 4.94 1509 1097 B 73 MET HE% A 76 LEU HDy% 1.0 . 3.63 1510 1097 B 73 MET HE% A 76 LEU HDx% 1.0 . 3.63 1511 1098 B 77 THR H A 76 LEU HDy% 1.0 . 4.92 1512 1098 B 77 THR H A 76 LEU HDx% 1.0 . 4.92 1513 1099 B 77 THR HB A 76 LEU HDy% 1.0 . 5.44 1514 1099 A 76 LEU HDx% B 77 THR HB 1.0 . 5.44 1515 1100 B 80 TYR H A 76 LEU HDy% 1.0 . 5.12 1516 1100 A 76 LEU HDx% B 80 TYR H 1.0 . 5.12 1517 1101 B 80 TYR HD% A 76 LEU HDy% 1.0 . 4.66 1518 1101 B 80 TYR HD% A 76 LEU HDx% 1.0 . 4.66 1519 1102 A 77 THR HA B 76 LEU HDy% 1.0 . 3.92 1520 1102 A 77 THR HA B 76 LEU HDx% 1.0 . 3.92 1521 1103 A 77 THR HB B 43 VAL HGy% 1.0 . 4.81 1522 1103 A 77 THR HB B 43 VAL HGx% 1.0 . 4.81 1523 1104 A 77 THR HG2% A 81 LEU HDy% 1.0 . 3.78 1524 1104 A 77 THR HG2% A 81 LEU HDx% 1.0 . 3.78 1525 1105 A 77 THR HG2% B 24 LEU HDy% 1.0 . 5.21 1526 1105 A 77 THR HG2% B 24 LEU HDx% 1.0 . 5.21 1527 1106 A 77 THR HG2% B 43 VAL HGy% 1.0 . 4.35 1528 1106 A 77 THR HG2% B 43 VAL HGx% 1.0 . 4.35 1529 1107 A 77 THR HG2% B 76 LEU HDy% 1.0 . 4.18 1530 1107 A 77 THR HG2% B 76 LEU HDx% 1.0 . 4.18 1531 1108 A 78 LYS H A 78 LYS HB2 1.0 . 3.54 1532 1108 A 78 LYS H A 78 LYS HBy 1.0 . 3.54 1533 1109 A 78 LYS H A 78 LYS HE2 1.0 . 5.34 1534 1109 A 78 LYS H A 78 LYS HEy 1.0 . 5.34 1535 1110 A 78 LYS HA A 81 LEU HDy% 1.0 . 4.60 1536 1110 A 78 LYS HA A 81 LEU HDx% 1.0 . 4.60 1537 1111 A 78 LYS HBy A 78 LYS HE2 1.0 . 4.34 1538 1111 A 78 LYS HB2 A 78 LYS HE2 1.0 . 4.34 1539 1111 A 78 LYS HEy A 78 LYS HB2 1.0 . 4.34 1540 1111 A 78 LYS HBy A 78 LYS HEy 1.0 . 4.34 1541 1112 A 79 TYR H A 78 LYS HB2 1.0 . 4.05 1542 1112 A 79 TYR H A 78 LYS HBy 1.0 . 4.05 1543 1113 A 88 ILE HD1% A 78 LYS HB2 1.0 . 4.35 1544 1113 A 88 ILE HD1% A 78 LYS HBy 1.0 . 4.35 1545 1114 B 39 ILE HD1% A 78 LYS HB2 1.0 . 4.57 1546 1114 B 39 ILE HD1% A 78 LYS HBy 1.0 . 4.57 1547 1115 A 78 LYS HGx A 78 LYS HE2 1.0 . 3.40 1548 1115 A 78 LYS HGx A 78 LYS HEy 1.0 . 3.40 1549 1116 B 39 ILE HD1% A 78 LYS HDx 1.0 . 3.95 1550 1116 B 39 ILE HD1% A 78 LYS HDy 1.0 . 3.95 1551 1117 A 88 ILE HG2% A 78 LYS HE2 1.0 . 4.08 1552 1117 A 88 ILE HG2% A 78 LYS HEy 1.0 . 4.08 1553 1118 A 88 ILE HD1% A 78 LYS HE2 1.0 . 5.02 1554 1118 A 88 ILE HD1% A 78 LYS HEy 1.0 . 5.02 1555 1119 B 39 ILE HG2% A 78 LYS HE2 1.0 . 5.16 1556 1119 B 39 ILE HG2% A 78 LYS HEy 1.0 . 5.16 1557 1120 B 39 ILE HD1% A 78 LYS HE2 1.0 . 5.32 1558 1120 B 39 ILE HD1% A 78 LYS HEy 1.0 . 5.32 1559 1121 A 79 TYR H A 79 TYR HBy 1.0 . 3.59 1560 1121 A 79 TYR H A 79 TYR HBx 1.0 . 3.59 1561 1122 A 80 TYR H A 79 TYR HBy 1.0 . 3.99 1562 1122 A 80 TYR H A 79 TYR HBx 1.0 . 3.99 1563 1123 A 82 ALA HB% A 79 TYR HBy 1.0 . 4.88 1564 1123 A 82 ALA HB% A 79 TYR HBx 1.0 . 4.88 1565 1124 B 80 TYR HD% A 79 TYR HBy 1.0 . 4.02 1566 1124 B 80 TYR HD% A 79 TYR HBx 1.0 . 4.02 1567 1125 B 80 TYR HE% A 79 TYR HBy 1.0 . 4.31 1568 1125 B 80 TYR HE% A 79 TYR HBx 1.0 . 4.31 1569 1126 A 79 TYR HD% B 83 ASN HBy 1.0 . 5.34 1570 1126 A 79 TYR HD% B 83 ASN HBx 1.0 . 5.34 1571 1127 A 80 TYR H A 80 TYR HBy 1.0 . 3.54 1572 1127 A 80 TYR H A 80 TYR HBx 1.0 . 3.54 1573 1128 A 81 LEU H A 80 TYR HBy 1.0 . 4.23 1574 1128 A 81 LEU H A 80 TYR HBx 1.0 . 4.23 1575 1129 A 80 TYR HBy B 76 LEU HDy% 1.0 . 4.68 1576 1129 A 80 TYR HBx B 76 LEU HDy% 1.0 . 4.68 1577 1129 B 76 LEU HDx% A 80 TYR HBy 1.0 . 4.68 1578 1129 B 76 LEU HDx% A 80 TYR HBx 1.0 . 4.68 1579 1130 A 80 TYR HD% A 81 LEU HDy% 1.0 . 4.21 1580 1130 A 80 TYR HD% A 81 LEU HDx% 1.0 . 4.21 1581 1131 A 80 TYR HE% B 76 LEU HDy% 1.0 . 5.44 1582 1131 A 80 TYR HE% B 76 LEU HDx% 1.0 . 5.44 1583 1132 A 81 LEU H A 81 LEU HDy% 1.0 . 4.19 1584 1132 A 81 LEU H A 81 LEU HDx% 1.0 . 4.19 1585 1133 A 81 LEU HA A 81 LEU HDy% 1.0 . 3.72 1586 1133 A 81 LEU HA A 81 LEU HDx% 1.0 . 3.72 1587 1134 A 82 ALA H A 81 LEU HBx 1.0 . 4.18 1588 1134 A 82 ALA H A 81 LEU HBy 1.0 . 4.18 1589 1135 A 84 HIS H A 81 LEU HBx 1.0 . 4.71 1590 1135 A 84 HIS H A 81 LEU HBy 1.0 . 4.71 1591 1136 A 86 ILE HB A 81 LEU HBx 1.0 . 5.34 1592 1136 A 86 ILE HB A 81 LEU HBy 1.0 . 5.34 1593 1137 A 82 ALA H A 81 LEU HDy% 1.0 . 4.52 1594 1137 A 82 ALA H A 81 LEU HDx% 1.0 . 4.52 1595 1138 A 86 ILE HB A 81 LEU HDy% 1.0 . 5.44 1596 1138 A 86 ILE HB A 81 LEU HDx% 1.0 . 5.44 1597 1139 A 86 ILE HG2% A 81 LEU HDy% 1.0 . 4.30 1598 1139 A 86 ILE HG2% A 81 LEU HDx% 1.0 . 4.30 1599 1140 A 86 ILE HD1% A 81 LEU HDy% 1.0 . 4.37 1600 1140 A 86 ILE HD1% A 81 LEU HDx% 1.0 . 4.37 1601 1141 B 28 TYR HE% A 81 LEU HDy% 1.0 . 4.02 1602 1141 B 28 TYR HE% A 81 LEU HDx% 1.0 . 4.02 1603 1142 B 39 ILE HD1% A 81 LEU HDy% 1.0 . 3.37 1604 1142 B 39 ILE HD1% A 81 LEU HDx% 1.0 . 3.37 1605 1143 A 82 ALA HB% A 83 ASN HD2y 1.0 . 5.09 1606 1143 A 82 ALA HB% A 83 ASN HD2x 1.0 . 5.09 1607 1144 A 83 ASN H A 83 ASN HBy 1.0 . 3.69 1608 1144 A 83 ASN H A 83 ASN HBx 1.0 . 3.69 1609 1145 A 83 ASN H A 83 ASN HD2y 1.0 . 4.14 1610 1145 A 83 ASN H A 83 ASN HD2x 1.0 . 4.14 1611 1146 B 79 TYR HE% A 83 ASN HBy 1.0 . 3.77 1612 1146 B 79 TYR HE% A 83 ASN HBx 1.0 . 3.77 1613 1147 A 84 HIS H A 85 GLY HAy 1.0 . 5.34 1614 1147 A 84 HIS H A 85 GLY HAx 1.0 . 5.34 1615 1148 A 86 ILE HB A 88 ILE HG1x 1.0 . 5.34 1616 1148 A 86 ILE HB A 88 ILE HG1y 1.0 . 5.34 1617 1149 A 86 ILE HG2% A 88 ILE HG1x 1.0 . 4.33 1618 1149 A 86 ILE HG2% A 88 ILE HG1y 1.0 . 4.33 1619 1150 A 88 ILE H A 88 ILE HG1x 1.0 . 3.76 1620 1150 A 88 ILE H A 88 ILE HG1y 1.0 . 3.76 1621 1151 A 89 LYS H A 89 LYS HBy 1.0 . 3.55 1622 1151 A 89 LYS H A 89 LYS HBx 1.0 . 3.55 1623 1152 A 89 LYS H A 89 LYS HG2 1.0 . 3.91 1624 1152 A 89 LYS H A 89 LYS HGy 1.0 . 3.91 1625 1153 A 89 LYS H A 89 LYS HD2 1.0 . 5.34 1626 1153 A 89 LYS H A 89 LYS HDy 1.0 . 5.34 1627 1154 A 89 LYS HA A 89 LYS HD2 1.0 . 4.70 1628 1154 A 89 LYS HA A 89 LYS HDy 1.0 . 4.70 1629 1155 A 89 LYS HD2 A 89 LYS HG2 1.0 . 2.35 1630 1155 A 89 LYS HDy A 89 LYS HG2 1.0 . 2.35 1631 1155 A 89 LYS HGy A 89 LYS HD2 1.0 . 2.35 1632 1155 A 89 LYS HGy A 89 LYS HDy 1.0 . 2.35 1633 1156 B 10 PHE HD% B 8 VAL HGy% 1.0 . 5.50 1634 1157 B 23 THR HA B 27 VAL H 1.0 . 4.73 1635 1158 B 25 GLU HBy B 25 GLU H 1.0 . 3.49 1636 1159 B 25 GLU HBx B 26 THR HA 1.0 . 4.94 1637 1160 B 26 THR HB B 27 VAL HGy% 1.0 . 5.43 1638 1161 B 26 THR HA B 26 THR HG2% 1.0 . 3.98 1639 1162 B 27 VAL HA B 27 VAL HGx% 1.0 . 4.21 1640 1163 B 28 TYR HA B 38 PRO HBy 1.0 . 5.26 1641 1164 B 28 TYR H B 28 TYR HBy 1.0 . 4.13 1642 1165 B 30 ALA H B 30 ALA HB% 1.0 . 3.44 1643 1166 B 27 VAL HA B 30 ALA HB% 1.0 . 4.37 1644 1167 B 32 GLU HA B 38 PRO HGy 1.0 . 4.78 1645 1168 B 34 LYS HA B 34 LYS HDy 1.0 . 4.33 1646 1169 B 28 TYR HA B 38 PRO HBx 1.0 . 5.26 1647 1170 B 39 ILE HG2% B 39 ILE HA 1.0 . 3.99 1648 1171 B 39 ILE HD1% B 39 ILE HA 1.0 . 4.09 1649 1172 B 23 THR HG2% B 64 ILE HB 1.0 . 4.75 1650 1173 B 31 LEU HDx% B 41 GLN HBy 1.0 . 5.33 1651 1174 B 42 ILE HA B 54 ILE HD1% 1.0 . 4.44 1652 1175 B 42 ILE H B 42 ILE HB 1.0 . 3.82 1653 1176 B 39 ILE HA B 42 ILE HB 1.0 . 5.21 1654 1177 B 43 VAL H B 43 VAL HB 1.0 . 3.91 1655 1178 B 43 VAL HB B 44 GLY H 1.0 . 4.12 1656 1179 B 46 LEU HA B 46 LEU HDy% 1.0 . 5.50 1657 1180 B 46 LEU HA B 46 LEU HDx% 1.0 . 5.50 1658 1181 B 47 LEU H B 47 LEU HBx 1.0 . 4.07 1659 1182 B 52 ALA H B 52 ALA HB% 1.0 . 3.17 1660 1183 B 56 ARG HA B 61 ARG H 1.0 . 4.37 1661 1184 B 30 ALA HB% B 57 TYR HBy 1.0 . 5.50 1662 1185 B 60 ALA HA B 63 LEU HBy 1.0 . 4.81 1663 1186 B 27 VAL H B 60 ALA HA 1.0 . 5.41 1664 1187 B 60 ALA H B 60 ALA HB% 1.0 . 3.42 1665 1188 B 27 VAL HA B 60 ALA HB% 1.0 . 4.54 1666 1189 B 60 ALA HB% B 54 ILE HG2% 1.0 . 3.98 1667 1190 B 60 ALA HB% B 27 VAL HGx% 1.0 . 3.97 1668 1191 B 61 ARG H B 60 ALA HB% 1.0 . 3.85 1669 1192 B 54 ILE HB B 61 ARG HA 1.0 . 5.12 1670 1193 B 54 ILE HG2% B 61 ARG HA 1.0 . 4.78 1671 1194 B 59 ASP HBy B 62 ASN HBx 1.0 . 5.50 1672 1195 B 63 LEU H B 62 ASN HBx 1.0 . 4.56 1673 1196 B 63 LEU HA B 63 LEU HDy% 1.0 . 4.84 1674 1197 B 63 LEU HBy B 64 ILE H 1.0 . 4.07 1675 1198 B 39 ILE H B 39 ILE HB 1.0 . 3.60 1676 1199 B 39 ILE HB B 40 ASN H 1.0 . 3.93 1677 1200 B 72 ILE H B 72 ILE HB 1.0 . 3.76 1678 1201 A 74 GLU HA B 43 VAL HB 1.0 . 4.79 1679 1202 A 74 GLU HA B 39 ILE HG2% 1.0 . 5.32 1680 1203 B 74 GLU HA B 77 THR HB 1.0 . 5.12 1681 1204 B 76 LEU HA B 76 LEU HDy% 1.0 . 4.69 1682 1205 B 79 TYR HD% B 79 TYR HA 1.0 . 4.11 1683 1206 B 79 TYR HA B 82 ALA HB% 1.0 . 5.03 1684 1207 B 86 ILE H B 86 ILE HB 1.0 . 3.69 1685 1208 B 88 ILE HA B 89 LYS H 1.0 . 3.08 1686 1209 B 88 ILE HA B 86 ILE HG2% 1.0 . 5.21 1687 1210 B 88 ILE HG2% B 88 ILE HA 1.0 . 3.99 1688 1211 B 88 ILE HG2% B 88 ILE H 1.0 . 4.37 1689 1212 B 88 ILE HG2% B 86 ILE HG2% 1.0 . 4.25 1690 1213 B 88 ILE H B 88 ILE HG1y 1.0 . 4.35 1691 1214 B 86 ILE HG2% B 88 ILE HG1y 1.0 . 4.97 1692 1215 B 24 LEU H B 24 LEU HG 1.0 . 4.01 1693 1216 B 24 LEU HA B 27 VAL HB 1.0 . 4.78 1694 1217 B 27 VAL HA B 27 VAL HGy% 1.0 . 4.21 1695 1218 B 29 ARG H B 28 TYR HBx 1.0 . 4.57 1696 1219 B 64 ILE HD1% B 27 VAL HGx% 1.0 . 4.03 1697 1220 B 64 ILE HD1% B 45 TYR HD% 1.0 . 4.60 1698 1221 B 39 ILE H B 39 ILE HG1y 1.0 . 4.20 1699 1222 B 76 LEU HDx% B 72 ILE HG2% 1.0 . 4.66 1700 1223 B 86 ILE HG1y B 86 ILE HG2% 1.0 . 3.99 1701 1224 B 86 ILE HD1% B 86 ILE HG2% 1.0 . 3.60 1702 1225 B 86 ILE HG2% B 88 ILE HG1x 1.0 . 4.97 1703 1226 B 88 ILE HD1% B 86 ILE HG2% 1.0 . 4.01 1704 1227 B 88 ILE HD1% B 88 ILE HA 1.0 . 4.59 1705 1228 B 54 ILE HD1% B 54 ILE HG2% 1.0 . 3.63 1706 1229 A 43 VAL HGx% B 73 MET HB2 1.0 . 6.22 1707 1230 B 73 MET HB2 A 43 VAL HGy% 1.0 . 6.22 1708 1231 B 41 GLN H B 40 ASN HBy 1.0 . 4.77 1709 1232 B 41 GLN H B 40 ASN HBx 1.0 . 4.77 1710 1233 B 54 ILE HD1% B 54 ILE HA 1.0 . 4.38 1711 1234 B 63 LEU HBx B 63 LEU HDx% 1.0 . 4.20 1712 1235 B 77 THR H B 76 LEU HG 1.0 . 4.69 1713 1236 B 63 LEU HBx B 63 LEU HDy% 1.0 . 4.20 1714 1237 B 59 ASP HBy B 63 LEU HDy% 1.0 . 4.70 1715 1238 B 54 ILE HD1% B 31 LEU HDx% 1.0 . 4.74 1716 1239 B 31 LEU HA B 31 LEU HDx% 1.0 . 4.25 1717 1240 B 31 LEU HA B 31 LEU HDy% 1.0 . 4.25 1718 1241 B 54 ILE HD1% B 31 LEU HDy% 1.0 . 4.74 1719 1242 B 77 THR HG2% B 77 THR HA 1.0 . 4.21 1720 1243 A 77 THR HG2% B 42 ILE HG2% 1.0 . 3.55 1721 1244 A 77 THR HG2% B 76 LEU HDy% 1.0 . 4.96 1722 1245 B 33 GLU H B 33 GLU HGx 1.0 . 4.80 1723 1246 B 29 ARG HA B 29 ARG HDy 1.0 . 4.99 1724 1247 B 29 ARG H B 29 ARG HGy 1.0 . 4.82 1725 1248 B 34 LYS HA B 34 LYS HDx 1.0 . 4.33 1726 1249 B 64 ILE HD1% B 64 ILE HA 1.0 . 4.49 1727 1250 B 79 TYR H B 79 TYR HBy 1.0 . 4.11 1728 1251 B 31 LEU HDx% B 41 GLN HBx 1.0 . 5.33 1729 1252 A 39 ILE HD1% B 77 THR HG2% 1.0 . 3.66 1730 1253 B 39 ILE HD1% B 28 TYR HD% 1.0 . 4.28 1731 1254 B 50 ASP H B 50 ASP HBy 1.0 . 4.16 1732 1255 B 42 ILE H B 42 ILE HG1x 1.0 . 5.50 1733 1256 B 59 ASP HBy B 63 LEU HDx% 1.0 . 4.70 1734 1257 B 74 GLU HGy B 74 GLU H 1.0 . 5.50 1735 1258 B 76 LEU H B 75 GLU HBy 1.0 . 4.45 1736 1259 B 68 GLU H B 68 GLU HGy 1.0 . 4.02 1737 1260 B 68 GLU H B 68 GLU HGx 1.0 . 4.02 1738 1261 B 38 PRO HA B 31 LEU HDy% 1.0 . 5.33 1739 1262 B 31 LEU HG B 55 PRO HDy 1.0 . 4.93 1740 1263 B 31 LEU HG B 55 PRO HDx 1.0 . 4.93 1741 1264 B 54 ILE HG2% B 55 PRO HDx 1.0 . 4.96 1742 1265 B 47 LEU HG B 47 LEU H 1.0 . 3.85 1743 1266 B 29 ARG H B 29 ARG HGx 1.0 . 4.82 1744 1267 B 72 ILE HB B 72 ILE HD1% 1.0 . 3.84 1745 1268 B 7 THR HA B 7 THR HG2% 1.0 . 3.79 1746 1269 A 77 THR HG2% B 39 ILE HA 1.0 . 4.70 1747 1270 B 9 ARG HBy B 10 PHE HA 1.0 . 5.50 1748 1271 B 10 PHE HA B 9 ARG HBx 1.0 . 5.50 1749 1272 B 20 ILE HG2% B 21 SER HA 1.0 . 5.46 1750 1273 B 20 ILE HG2% B 24 LEU HG 1.0 . 4.78 1751 1274 B 20 ILE HG2% B 24 LEU HBy 1.0 . 4.67 1752 1275 B 20 ILE HA B 20 ILE HD1% 1.0 . 5.16 1753 1276 A 25 GLU HBy B 86 ILE HD1% 1.0 . 5.50 1754 1277 B 86 ILE HD1% A 25 GLU HGy 1.0 . 5.22 1755 1278 B 86 ILE HD1% A 25 GLU HGx 1.0 . 5.22 1756 1279 B 26 THR HG2% B 27 VAL HA 1.0 . 5.39 1757 1280 B 26 THR HG2% B 29 ARG HBy 1.0 . 5.25 1758 1281 B 24 LEU HA B 27 VAL HGx% 1.0 . 5.15 1759 1282 B 24 LEU HA B 27 VAL HGy% 1.0 . 5.15 1760 1283 B 28 TYR HA B 31 LEU HBy 1.0 . 5.50 1761 1284 B 42 ILE HD1% B 28 TYR HBy 1.0 . 5.50 1762 1285 B 42 ILE HD1% B 28 TYR HBx 1.0 . 5.50 1763 1286 B 86 ILE HD1% A 29 ARG HGy 1.0 . 5.50 1764 1287 B 86 ILE HD1% A 29 ARG HGx 1.0 . 5.50 1765 1288 B 29 ARG HA B 29 ARG HDx 1.0 . 4.99 1766 1289 B 30 ALA HB% B 60 ALA HA 1.0 . 5.39 1767 1290 B 30 ALA HB% B 31 LEU HA 1.0 . 5.47 1768 1291 B 30 ALA HB% B 27 VAL HGy% 1.0 . 4.94 1769 1292 B 30 ALA HB% B 31 LEU HDx% 1.0 . 5.39 1770 1293 B 57 TYR HE% B 33 GLU HBx 1.0 . 4.53 1771 1294 B 34 LYS HA B 34 LYS HEx 1.0 . 5.50 1772 1295 B 88 ILE H B 87 ASP HBx 1.0 . 4.66 1773 1296 B 31 LEU HBx B 36 TYR HBy 1.0 . 5.50 1774 1297 B 31 LEU HBx B 36 TYR HBx 1.0 . 5.50 1775 1298 B 38 PRO HGy B 37 ASN HA 1.0 . 5.50 1776 1299 B 54 ILE HD1% B 38 PRO HA 1.0 . 5.50 1777 1300 B 42 ILE HD1% B 38 PRO HBx 1.0 . 5.50 1778 1301 B 42 ILE HD1% B 38 PRO HBy 1.0 . 5.50 1779 1302 B 38 PRO HA B 31 LEU HDx% 1.0 . 5.33 1780 1303 B 42 ILE HG2% B 43 VAL HA 1.0 . 5.50 1781 1304 B 42 ILE HG2% B 46 LEU HG 1.0 . 4.31 1782 1305 B 43 VAL HA B 46 LEU HBy 1.0 . 5.50 1783 1306 B 43 VAL HA B 46 LEU HBx 1.0 . 5.50 1784 1307 B 45 TYR HD% B 50 ASP HBy 1.0 . 5.50 1785 1308 B 54 ILE HG2% B 31 LEU HG 1.0 . 5.25 1786 1309 B 54 ILE HG2% B 55 PRO HDy 1.0 . 4.96 1787 1310 B 54 ILE HD1% B 53 TYR HA 1.0 . 5.47 1788 1311 B 54 ILE HD1% B 64 ILE HD1% 1.0 . 4.04 1789 1312 B 54 ILE HD1% B 55 PRO HDy 1.0 . 5.50 1790 1313 B 64 ILE HG2% B 65 ARG HDy 1.0 . 5.50 1791 1314 B 65 ARG HA B 65 ARG HDy 1.0 . 5.09 1792 1315 B 55 PRO HB2 B 57 TYR HBy 1.0 . 5.50 1793 1316 B 34 LYS HG2 B 57 TYR HBy 1.0 . 5.50 1794 1317 B 30 ALA HB% B 57 TYR HBx 1.0 . 5.50 1795 1318 B 34 LYS HG2 B 57 TYR HBx 1.0 . 5.50 1796 1319 B 26 THR HG2% B 58 GLN HBx 1.0 . 5.21 1797 1320 B 59 ASP HBy B 63 LEU HG 1.0 . 5.08 1798 1321 B 60 ALA HB% B 27 VAL HGy% 1.0 . 3.97 1799 1322 B 63 LEU HBy B 60 ALA HB% 1.0 . 5.17 1800 1323 B 59 ASP HBy B 62 ASN HBy 1.0 . 5.50 1801 1324 B 60 ALA HA B 63 LEU HG 1.0 . 5.50 1802 1325 B 26 THR HB B 63 LEU HDx% 1.0 . 5.47 1803 1326 B 26 THR HB B 63 LEU HDy% 1.0 . 5.47 1804 1327 B 64 ILE HG2% B 51 PRO HA 1.0 . 5.02 1805 1328 B 61 ARG HA B 64 ILE HG2% 1.0 . 4.50 1806 1329 B 64 ILE HB B 27 VAL HGy% 1.0 . 5.47 1807 1330 B 64 ILE HB B 54 ILE HG2% 1.0 . 5.50 1808 1331 B 27 VAL HA B 64 ILE HD1% 1.0 . 5.30 1809 1332 B 64 ILE HD1% B 27 VAL HGy% 1.0 . 4.03 1810 1333 B 72 ILE HG2% B 76 LEU HG 1.0 . 4.82 1811 1334 B 72 ILE HD1% B 69 ARG HA 1.0 . 4.96 1812 1335 B 73 MET HA B 76 LEU HDy% 1.0 . 5.50 1813 1336 A 73 MET HGy B 43 VAL HA 1.0 . 5.50 1814 1337 B 43 VAL HA A 73 MET HGx 1.0 . 5.50 1815 1338 B 73 MET HE% B 73 MET HGx 1.0 . 4.39 1816 1339 B 73 MET HA B 76 LEU HBx 1.0 . 5.50 1817 1340 A 76 LEU HDx% B 77 THR HA 1.0 . 5.13 1818 1341 A 77 THR HG2% B 76 LEU HDx% 1.0 . 4.96 1819 1342 B 77 THR HG2% B 81 LEU HG 1.0 . 5.50 1820 1343 B 86 ILE HG2% B 81 LEU HDy% 1.0 . 5.24 1821 1344 B 81 LEU HDx% B 86 ILE HG2% 1.0 . 5.24 1822 1345 B 82 ALA HB% B 88 ILE HB 1.0 . 4.90 1823 1346 B 86 ILE HB B 82 ALA HA 1.0 . 5.37 1824 1347 B 86 ILE H B 86 ILE HG2% 1.0 . 4.34 1825 1348 B 86 ILE HG2% B 87 ASP H 1.0 . 3.96 1826 1349 A 86 ILE HD1% B 25 GLU HA 1.0 . 4.19 1827 1350 B 86 ILE HD1% B 86 ILE HA 1.0 . 4.33 1828 1351 B 86 ILE HG2% B 88 ILE HB 1.0 . 5.48 1829 1352 B 78 LYS HA B 88 ILE HD1% 1.0 . 4.34 1830 1353 B 88 ILE HD1% B 88 ILE HB 1.0 . 4.07 1831 1354 B 88 ILE HG2% B 89 LYS HA 1.0 . 5.30 1832 1355 B 77 THR HG2% B 81 LEU H 1.0 . 5.50 1833 1356 A 77 THR HG2% B 28 TYR HD% 1.0 . 5.50 1834 1357 B 10 PHE HD% B 8 VAL HGx% 1.0 . 5.50 1835 1358 B 42 ILE H B 42 ILE HG1y 1.0 . 5.50 1836 1359 B 26 THR HG2% B 58 GLN HBy 1.0 . 5.21 1837 1360 B 19 ALA HB% B 22 GLU H 1.0 . 4.63 1838 1361 B 19 ALA HB% B 23 THR H 1.0 . 5.48 1839 1362 B 20 ILE HB B 21 SER H 1.0 . 5.50 1840 1363 B 20 ILE HG2% B 21 SER H 1.0 . 4.66 1841 1364 B 31 LEU HA B 36 TYR HD% 1.0 . 4.09 1842 1365 B 28 TYR H B 25 GLU HA 1.0 . 5.50 1843 1366 B 26 THR HG2% B 30 ALA H 1.0 . 5.50 1844 1367 B 27 VAL H B 26 THR HG2% 1.0 . 4.98 1845 1368 B 64 ILE H B 27 VAL HGy% 1.0 . 5.50 1846 1369 B 28 TYR HD% B 28 TYR HA 1.0 . 4.63 1847 1370 B 28 TYR HD% B 29 ARG HDy 1.0 . 5.50 1848 1371 B 29 ARG H B 29 ARG HDy 1.0 . 5.50 1849 1372 B 30 ALA H B 29 ARG HGx 1.0 . 5.50 1850 1373 B 30 ALA H B 29 ARG HGy 1.0 . 5.50 1851 1374 B 30 ALA H B 29 ARG HBy 1.0 . 4.07 1852 1375 B 29 ARG H B 29 ARG HBy 1.0 . 3.93 1853 1376 B 71 GLU H B 71 GLU HBy 1.0 . 4.12 1854 1377 B 71 GLU H B 71 GLU HBx 1.0 . 4.12 1855 1378 B 28 TYR HD% B 29 ARG HDx 1.0 . 5.50 1856 1379 B 29 ARG H B 29 ARG HDx 1.0 . 5.50 1857 1380 B 57 TYR HE% B 30 ALA HA 1.0 . 4.36 1858 1381 B 30 ALA HB% B 57 TYR HE% 1.0 . 5.22 1859 1382 B 30 ALA HB% B 60 ALA H 1.0 . 5.50 1860 1383 B 31 LEU HBy B 32 GLU H 1.0 . 5.50 1861 1384 B 31 LEU HBx B 32 GLU H 1.0 . 5.50 1862 1385 B 31 LEU H B 31 LEU HDx% 1.0 . 5.38 1863 1386 B 36 TYR HD% B 31 LEU HDy% 1.0 . 4.73 1864 1387 B 31 LEU H B 31 LEU HDy% 1.0 . 5.38 1865 1388 B 47 LEU HDx% B 47 LEU H 1.0 . 5.19 1866 1389 B 32 GLU HA B 35 GLY H 1.0 . 3.90 1867 1390 B 34 LYS H B 34 LYS HDx 1.0 . 5.50 1868 1391 B 34 LYS HA B 34 LYS HEy 1.0 . 5.50 1869 1392 B 60 ALA H B 59 ASP HBx 1.0 . 5.50 1870 1393 B 39 ILE H B 37 ASN HBy 1.0 . 5.50 1871 1394 B 63 LEU H B 62 ASN HBy 1.0 . 4.56 1872 1395 B 38 PRO HGy B 32 GLU H 1.0 . 5.50 1873 1396 A 39 ILE HG2% B 77 THR HB 1.0 . 5.16 1874 1397 B 39 ILE HG2% B 41 GLN H 1.0 . 5.50 1875 1398 B 39 ILE HG2% B 39 ILE H 1.0 . 4.11 1876 1399 B 39 ILE HG2% B 42 ILE H 1.0 . 5.50 1877 1400 B 39 ILE HD1% B 39 ILE H 1.0 . 5.11 1878 1401 B 28 TYR HA B 32 GLU H 1.0 . 5.50 1879 1402 B 39 ILE HA B 42 ILE HG2% 1.0 . 5.50 1880 1403 B 43 VAL H B 42 ILE HG2% 1.0 . 4.30 1881 1404 B 43 VAL H B 43 VAL HGy% 1.0 . 4.79 1882 1405 B 74 GLU H A 43 VAL HGy% 1.0 . 5.50 1883 1406 B 46 LEU HA B 45 TYR HD% 1.0 . 5.50 1884 1407 B 24 LEU H B 24 LEU HBy 1.0 . 3.95 1885 1408 B 46 LEU HG B 46 LEU H 1.0 . 3.72 1886 1409 B 46 LEU H B 46 LEU HDy% 1.0 . 4.70 1887 1410 B 70 ASP HA B 73 MET H 1.0 . 4.47 1888 1411 B 47 LEU H B 47 LEU HDy% 1.0 . 5.19 1889 1412 B 61 ARG H B 54 ILE HG2% 1.0 . 4.53 1890 1413 B 54 ILE HD1% B 45 TYR H 1.0 . 5.01 1891 1414 B 60 ALA HB% B 30 ALA HA 1.0 . 5.50 1892 1415 B 63 LEU H B 63 LEU HG 1.0 . 4.69 1893 1416 B 64 ILE H B 63 LEU HDy% 1.0 . 5.48 1894 1417 B 63 LEU H B 63 LEU HDy% 1.0 . 4.75 1895 1418 B 63 LEU H B 64 ILE HG2% 1.0 . 5.50 1896 1419 B 45 TYR HD% B 64 ILE HG2% 1.0 . 4.35 1897 1420 B 64 ILE HG2% B 66 ARG H 1.0 . 5.45 1898 1421 B 68 GLU H B 67 HIS HBy 1.0 . 4.59 1899 1422 B 68 GLU H B 67 HIS HBx 1.0 . 4.59 1900 1423 B 69 ARG HA B 73 MET H 1.0 . 5.50 1901 1424 B 73 MET H B 71 GLU HA 1.0 . 5.50 1902 1425 B 72 ILE H B 72 ILE HG2% 1.0 . 4.41 1903 1426 B 72 ILE HD1% B 73 MET H 1.0 . 4.63 1904 1427 B 73 MET HA B 76 LEU H 1.0 . 5.48 1905 1428 B 74 GLU HA B 76 LEU H 1.0 . 5.50 1906 1429 B 78 LYS HGx B 78 LYS H 1.0 . 4.61 1907 1430 B 79 TYR HE% B 79 TYR HA 1.0 . 5.50 1908 1431 B 82 ALA H B 81 LEU HBy 1.0 . 4.97 1909 1432 B 82 ALA H B 81 LEU HBx 1.0 . 4.97 1910 1433 A 81 LEU HG B 28 TYR HD% 1.0 . 5.50 1911 1434 B 81 LEU HDx% B 81 LEU H 1.0 . 4.82 1912 1435 B 81 LEU H B 81 LEU HDy% 1.0 . 4.82 1913 1436 B 86 ILE HG2% B 82 ALA H 1.0 . 5.50 1914 1437 B 86 ILE HG1y B 86 ILE H 1.0 . 4.91 1915 1438 B 86 ILE HG1y B 87 ASP H 1.0 . 5.50 1916 1439 B 86 ILE H B 86 ILE HG1x 1.0 . 3.94 1917 1440 A 86 ILE HG1y B 28 TYR HD% 1.0 . 5.50 1918 1441 A 86 ILE HD1% B 28 TYR HD% 1.0 . 4.76 1919 1442 A 86 ILE HD1% B 29 ARG H 1.0 . 5.50 1920 1443 A 88 ILE HG2% B 28 TYR HD% 1.0 . 5.24 1921 1444 B 88 ILE HD1% B 82 ALA H 1.0 . 5.01 1922 1445 B 88 ILE HD1% B 81 LEU H 1.0 . 5.50 1923 1446 B 82 ALA HA B 88 ILE HG1x 1.0 . 5.50 1924 1447 B 82 ALA HA B 88 ILE HG1y 1.0 . 5.50 1925 1448 B 72 ILE HB B 69 ARG HA 1.0 . 5.50 1926 1449 B 72 ILE HD1% B 64 ILE HG1y 1.0 . 5.27 1927 1450 B 72 ILE HD1% B 64 ILE HG1x 1.0 . 5.27 1928 1451 B 72 ILE HG2% B 76 LEU HDy% 1.0 . 4.66 1929 1452 B 88 ILE HG2% B 78 LYS HGx 1.0 . 3.96 1930 1453 B 72 ILE H B 72 ILE HG1x 1.0 . 5.50 1931 1454 B 80 TYR HBx B 80 TYR H 1.0 . 4.06 1932 1455 A 43 VAL HGx% B 74 GLU H 1.0 . 5.50 1933 1456 B 74 GLU H B 74 GLU HBy 1.0 . 3.78 1934 1457 B 22 GLU H B 22 GLU HGx 1.0 . 5.04 1935 1458 B 75 GLU H B 74 GLU HGx 1.0 . 5.50 1936 1459 B 74 GLU HGy B 75 GLU H 1.0 . 5.50 1937 1460 B 64 ILE H B 63 LEU HG 1.0 . 5.50 1938 1461 B 39 ILE HD1% A 78 LYS HA 1.0 . 4.40 1939 1462 B 71 GLU H B 71 GLU HGy 1.0 . 5.42 1940 1463 B 71 GLU H B 71 GLU HGx 1.0 . 5.42 1941 1464 B 39 ILE HG2% A 74 GLU HGx 1.0 . 4.93 1942 1465 A 73 MET HE% B 42 ILE HG2% 1.0 . 3.84 1943 1466 A 73 MET HE% B 43 VAL HB 1.0 . 4.82 1944 1467 B 73 MET HE% B 73 MET HGy 1.0 . 4.39 1945 1468 A 73 MET HE% B 43 VAL HA 1.0 . 5.02 1946 1469 A 73 MET HE% B 46 LEU HA 1.0 . 5.15 1947 1470 A 73 MET HE% B 73 MET HA 1.0 . 4.15 1948 1471 A 73 MET HE% B 47 LEU H 1.0 . 4.58 1949 1472 A 73 MET HE% B 73 MET H 1.0 . 5.29 1950 1473 A 73 MET HE% B 46 LEU H 1.0 . 5.35 1951 1474 A 73 MET HE% B 76 LEU HDx% 1.0 . 4.32 1952 1475 A 73 MET HE% B 76 LEU HDy% 1.0 . 4.32 1953 1476 B 23 THR HG2% B 24 LEU HG 1.0 . 4.65 1954 1477 B 23 THR HG2% B 64 ILE HA 1.0 . 4.09 1955 1478 B 23 THR HG2% B 64 ILE H 1.0 . 5.34 1956 1479 B 27 VAL H B 23 THR HG2% 1.0 . 5.13 1957 1480 B 23 THR HG2% B 24 LEU H 1.0 . 4.61 1958 1481 B 50 ASP HA B 51 PRO HGx 1.0 . 5.50 1959 1482 B 50 ASP HA B 51 PRO HGy 1.0 . 5.50 1960 1483 B 39 ILE HD1% A 78 LYS HDy 1.0 . 4.92 1961 1484 B 39 ILE HD1% A 78 LYS HDx 1.0 . 4.95 1962 1485 B 78 LYS H B 78 LYS HDy 1.0 . 5.50 1963 1486 B 78 LYS H B 78 LYS HDx 1.0 . 5.50 1964 1487 B 39 ILE HB A 78 LYS HDx 1.0 . 5.40 1965 1488 A 39 ILE HG2% B 78 LYS HGx 1.0 . 4.99 1966 1489 B 39 ILE HD1% A 78 LYS HGx 1.0 . 4.40 1967 1490 B 88 ILE HD1% B 78 LYS HGy 1.0 . 3.99 1968 1491 B 88 ILE HG2% B 88 ILE HG1y 1.0 . 3.97 1969 1492 B 88 ILE HG2% B 88 ILE HG1x 1.0 . 3.97 1970 1493 B 78 LYS HGx B 88 ILE HD1% 1.0 . 3.78 1971 1494 A 88 ILE HD1% B 28 TYR HD% 1.0 . 4.66 1972 1495 B 77 THR HG2% A 42 ILE HD1% 1.0 . 4.58 1973 1496 B 42 ILE HD1% B 27 VAL HB 1.0 . 5.50 1974 1497 B 42 ILE HD1% B 42 ILE HA 1.0 . 4.92 1975 1498 B 42 ILE HD1% B 39 ILE HA 1.0 . 4.83 1976 1499 B 42 ILE HD1% B 28 TYR HA 1.0 . 5.07 1977 1500 B 72 ILE HD1% B 67 HIS HBx 1.0 . 5.17 1978 1501 B 43 VAL HB B 40 ASN HA 1.0 . 5.27 1979 1502 B 20 ILE HD1% B 72 ILE HA 1.0 . 4.38 1980 1503 B 24 LEU HDx% B 76 LEU HDy% 1.0 . 4.90 1981 1504 B 76 LEU HDx% B 24 LEU HDx% 1.0 . 4.90 1982 1505 B 24 LEU HDx% B 24 LEU H 1.0 . 4.52 1983 1506 B 76 LEU HDx% B 24 LEU HDy% 1.0 . 4.90 1984 1507 B 24 LEU HDy% B 76 LEU HDy% 1.0 . 4.90 1985 1508 B 24 LEU HA B 24 LEU HDy% 1.0 . 4.61 1986 1509 B 80 TYR HD% A 24 LEU HDy% 1.0 . 5.50 1987 1510 B 63 LEU HG B 59 ASP HBx 1.0 . 4.90 1988 1511 B 25 GLU H B 24 LEU HBy 1.0 . 5.50 1989 1512 B 25 GLU H B 24 LEU HBx 1.0 . 4.60 1990 1513 B 36 TYR HD% B 34 LYS HBx 1.0 . 4.16 1991 1514 B 36 TYR HE% B 34 LYS HBy 1.0 . 4.25 1992 1515 B 34 LYS HG2 B 36 TYR HE% 1.0 . 5.50 1993 1516 B 34 LYS HG2 B 57 TYR HD% 1.0 . 5.02 1994 1517 B 34 LYS HG2 B 34 LYS H 1.0 . 4.25 1995 1518 B 30 ALA HB% B 31 LEU H 1.0 . 4.18 1996 1519 B 30 ALA HB% B 57 TYR HD% 1.0 . 3.97 1997 1520 B 30 ALA HA B 34 LYS H 1.0 . 5.50 1998 1521 B 66 ARG H B 66 ARG HGy 1.0 . 4.97 1999 1522 B 66 ARG H B 66 ARG HGx 1.0 . 4.97 2000 1523 B 24 LEU HDx% B 24 LEU HA 1.0 . 4.61 2001 1524 B 76 LEU HDx% B 76 LEU HA 1.0 . 4.69 2002 1525 B 20 ILE HG2% B 72 ILE HG2% 1.0 . 4.09 2003 1526 B 20 ILE HG2% B 72 ILE HD1% 1.0 . 5.19 2004 1527 B 77 THR HA A 76 LEU HDy% 1.0 . 5.13 2005 1528 A 25 GLU HBx B 86 ILE HD1% 1.0 . 5.50 2006 1529 B 72 ILE HD1% B 72 ILE HA 1.0 . 5.29 2007 1530 B 73 MET HA B 76 LEU HBy 1.0 . 5.50 2008 1531 B 39 ILE HG2% A 74 GLU HGy 1.0 . 4.93 2009 1532 B 74 GLU H B 74 GLU HGx 1.0 . 5.50 2010 1533 B 84 HIS HBy B 85 GLY H 1.0 . 5.50 2011 1534 B 85 GLY H B 84 HIS HBx 1.0 . 5.50 2012 1535 B 20 ILE HD1% B 71 GLU HA 1.0 . 5.33 2013 1536 B 20 ILE HD1% B 75 GLU HBy 1.0 . 5.41 2014 1537 B 20 ILE HG2% B 72 ILE HA 1.0 . 4.60 2015 1538 B 64 ILE HD1% B 45 TYR HE% 1.0 . 4.69 2016 1539 B 64 ILE HB B 27 VAL HGx% 1.0 . 5.47 2017 1540 B 80 TYR HD% A 24 LEU HDx% 1.0 . 5.50 2018 1541 B 45 TYR HD% B 50 ASP HBx 1.0 . 5.50 2019 1542 B 80 TYR HD% B 81 LEU HA 1.0 . 5.50 2020 1543 B 23 THR HG2% B 63 LEU HBy 1.0 . 5.08 2021 1544 B 23 THR HG2% B 63 LEU HBx 1.0 . 4.29 2022 1545 B 64 ILE HB B 64 ILE HD1% 1.0 . 4.20 2023 1546 B 76 LEU H B 75 GLU HBx 1.0 . 4.45 2024 1547 B 20 ILE HD1% B 75 GLU HBx 1.0 . 5.41 2025 1548 B 73 MET HA B 76 LEU HDx% 1.0 . 5.50 2026 1549 B 54 ILE HG2% B 64 ILE HD1% 1.0 . 3.99 2027 1550 B 63 LEU HA B 63 LEU HDx% 1.0 . 4.84 2028 1551 B 64 ILE HG2% B 65 ARG HDx 1.0 . 5.50 2029 1552 B 65 ARG HA B 65 ARG HDx 1.0 . 5.09 2030 1553 B 43 VAL H B 40 ASN HA 1.0 . 5.03 2031 1554 B 41 GLN HBx B 31 LEU HDy% 1.0 . 5.33 2032 1555 B 31 LEU HDy% B 41 GLN HBy 1.0 . 5.33 2033 1556 B 40 ASN H B 37 ASN HBx 1.0 . 5.15 2034 1557 B 72 ILE HG2% B 72 ILE HD1% 1.0 . 3.51 2035 1558 B 26 THR HB B 27 VAL HGx% 1.0 . 5.43 2036 1559 B 20 ILE HA B 23 THR HB 1.0 . 5.50 2037 1560 B 24 LEU HG B 23 THR HB 1.0 . 5.50 2038 1561 B 23 THR HA B 26 THR HB 1.0 . 5.36 2039 1562 B 25 GLU HBy B 22 GLU HA 1.0 . 4.75 2040 1563 B 74 GLU H B 74 GLU HBx 1.0 . 3.78 2041 1564 B 72 ILE HB B 20 ILE HD1% 1.0 . 4.59 2042 1565 B 45 TYR HD% B 51 PRO HA 1.0 . 4.20 2043 1566 B 19 ALA HB% B 67 HIS HE1 1.0 . 4.10 2044 1567 B 19 ALA HB% B 21 SER H 1.0 . 4.11 2045 1568 B 88 ILE HD1% B 82 ALA HB% 1.0 . 4.30 2046 1569 B 20 ILE HG2% B 75 GLU H 1.0 . 5.50 2047 1570 A 20 ILE HG2% B 80 TYR HE% 1.0 . 5.50 2048 1571 B 30 ALA HB% B 29 ARG H 1.0 . 5.02 2049 1572 B 54 ILE HD1% B 55 PRO HDx 1.0 . 5.50 2050 1573 B 54 ILE HD1% B 60 ALA HB% 1.0 . 5.29 2051 1574 B 64 ILE H B 64 ILE HD1% 1.0 . 5.26 2052 1575 B 72 ILE HD1% B 67 HIS HBy 1.0 . 5.17 2053 1576 B 76 LEU H B 20 ILE HD1% 1.0 . 5.50 2054 1577 B 80 TYR HE% B 80 TYR HA 1.0 . 5.50 2055 1578 B 20 ILE HG2% B 75 GLU HGx 1.0 . 5.36 2056 1579 B 20 ILE HG2% B 75 GLU HGy 1.0 . 5.36 2057 1580 B 72 ILE HD1% B 67 HIS H 1.0 . 4.93 2058 1581 B 55 PRO HB2 B 57 TYR HBx 1.0 . 5.50 2059 1582 B 62 ASN HA B 65 ARG HGy 1.0 . 4.97 2060 1583 B 64 ILE HG2% B 65 ARG HGy 1.0 . 4.50 2061 1584 B 62 ASN HA B 65 ARG HGx 1.0 . 4.97 2062 1585 B 65 ARG H B 65 ARG HGy 1.0 . 5.24 2063 1586 B 65 ARG H B 65 ARG HGx 1.0 . 5.24 2064 1587 B 64 ILE HG2% B 65 ARG HGx 1.0 . 4.50 2065 1588 B 38 PRO HGx B 32 GLU HGx 1.0 . 5.50 2066 1589 B 38 PRO HGx B 32 GLU HGy 1.0 . 5.50 2067 1590 B 28 TYR HD% B 38 PRO HGy 1.0 . 5.50 2068 1591 B 28 TYR HD% B 38 PRO HGx 1.0 . 5.50 2069 1592 B 23 THR HG2% B 64 ILE HD1% 1.0 . 4.48 2070 1593 B 31 LEU HA B 36 TYR HE% 1.0 . 5.30 2071 1594 B 88 ILE HD1% B 88 ILE H 1.0 . 5.40 2072 1595 B 72 ILE H B 72 ILE HG1y 1.0 . 5.50 2073 1596 B 30 ALA HB% B 31 LEU HDy% 1.0 . 5.39 2074 1597 B 30 ALA HB% B 27 VAL HGx% 1.0 . 4.94 2075 1598 B 7 THR HG2% B 8 VAL H 1.0 . 5.36 2076 1599 B 8 VAL HB B 9 ARG H 1.0 . 5.50 2077 1600 B 22 GLU H B 21 SER H 1.0 . 4.33 2078 1601 B 22 GLU H B 23 THR H 1.0 . 4.04 2079 1602 B 24 LEU H B 23 THR H 1.0 . 3.95 2080 1603 B 25 GLU H B 24 LEU H 1.0 . 3.98 2081 1604 B 25 GLU H B 26 THR H 1.0 . 3.73 2082 1605 B 27 VAL H B 26 THR H 1.0 . 4.06 2083 1606 B 27 VAL H B 28 TYR H 1.0 . 4.17 2084 1607 B 28 TYR HD% B 28 TYR H 1.0 . 4.63 2085 1608 B 28 TYR HD% B 29 ARG H 1.0 . 4.54 2086 1609 B 28 TYR H B 29 ARG H 1.0 . 4.41 2087 1610 B 28 TYR HD% B 30 ALA H 1.0 . 5.24 2088 1611 B 30 ALA H B 31 LEU H 1.0 . 3.85 2089 1612 B 32 GLU H B 31 LEU H 1.0 . 3.72 2090 1613 B 80 TYR HD% B 81 LEU H 1.0 . 4.51 2091 1614 B 33 GLU H B 32 GLU H 1.0 . 3.92 2092 1615 B 33 GLU H B 34 LYS H 1.0 . 4.10 2093 1616 B 35 GLY H B 34 LYS H 1.0 . 3.87 2094 1617 B 36 TYR HD% B 36 TYR H 1.0 . 3.87 2095 1618 B 28 TYR HE% B 39 ILE H 1.0 . 4.87 2096 1619 B 40 ASN H B 40 ASN HD2x 1.0 . 5.07 2097 1620 B 40 ASN H B 40 ASN HD2y 1.0 . 5.07 2098 1621 B 42 ILE H B 41 GLN H 1.0 . 4.25 2099 1622 B 42 ILE H B 43 VAL H 1.0 . 4.22 2100 1623 B 43 VAL H B 44 GLY H 1.0 . 4.06 2101 1624 B 46 LEU H B 45 TYR H 1.0 . 3.88 2102 1625 B 44 GLY H B 45 TYR H 1.0 . 4.22 2103 1626 B 45 TYR HD% B 45 TYR H 1.0 . 4.71 2104 1627 B 44 GLY H B 53 TYR HE% 1.0 . 5.50 2105 1628 B 45 TYR HD% B 46 LEU H 1.0 . 4.48 2106 1629 B 47 LEU H B 46 LEU H 1.0 . 4.17 2107 1630 B 47 LEU H B 48 SER H 1.0 . 4.29 2108 1631 B 48 SER H B 49 GLY H 1.0 . 3.86 2109 1632 B 52 ALA H B 53 TYR H 1.0 . 3.76 2110 1633 B 45 TYR HD% B 53 TYR H 1.0 . 4.71 2111 1634 B 52 ALA H B 45 TYR HD% 1.0 . 5.42 2112 1635 B 56 ARG H B 57 TYR H 1.0 . 4.67 2113 1636 B 58 GLN H B 59 ASP H 1.0 . 4.32 2114 1637 B 57 TYR H B 58 GLN H 1.0 . 4.82 2115 1638 B 60 ALA H B 59 ASP H 1.0 . 3.78 2116 1639 B 61 ARG H B 60 ALA H 1.0 . 4.35 2117 1640 B 61 ARG H B 62 ASN H 1.0 . 4.03 2118 1641 B 63 LEU H B 62 ASN H 1.0 . 3.92 2119 1642 B 63 LEU H B 64 ILE H 1.0 . 4.13 2120 1643 B 64 ILE H B 62 ASN H 1.0 . 5.20 2121 1644 B 64 ILE H B 66 ARG H 1.0 . 5.22 2122 1645 B 64 ILE H B 65 ARG H 1.0 . 4.20 2123 1646 B 66 ARG H B 65 ARG H 1.0 . 3.59 2124 1647 B 66 ARG H B 67 HIS H 1.0 . 3.92 2125 1648 B 68 GLU H B 67 HIS H 1.0 . 5.39 2126 1649 B 68 GLU H B 69 ARG H 1.0 . 4.64 2127 1650 B 69 ARG H B 70 ASP H 1.0 . 3.89 2128 1651 B 71 GLU H B 70 ASP H 1.0 . 3.91 2129 1652 B 72 ILE H B 71 GLU H 1.0 . 4.07 2130 1653 B 72 ILE H B 73 MET H 1.0 . 4.02 2131 1654 B 74 GLU H B 73 MET H 1.0 . 4.29 2132 1655 B 74 GLU H B 76 LEU H 1.0 . 5.16 2133 1656 B 74 GLU H B 75 GLU H 1.0 . 4.30 2134 1657 B 76 LEU H B 75 GLU H 1.0 . 4.09 2135 1658 B 77 THR H B 75 GLU H 1.0 . 5.11 2136 1659 B 77 THR H B 78 LYS H 1.0 . 4.01 2137 1660 B 79 TYR H B 78 LYS H 1.0 . 4.31 2138 1661 B 79 TYR H B 80 TYR H 1.0 . 4.24 2139 1662 B 79 TYR H B 79 TYR HD% 1.0 . 4.32 2140 1663 A 79 TYR H B 80 TYR HD% 1.0 . 4.66 2141 1664 A 79 TYR H B 80 TYR HE% 1.0 . 5.02 2142 1665 B 80 TYR H B 81 LEU H 1.0 . 4.22 2143 1666 B 79 TYR HD% B 80 TYR H 1.0 . 4.53 2144 1667 B 79 TYR HD% B 82 ALA H 1.0 . 5.10 2145 1668 B 82 ALA H B 83 ASN H 1.0 . 4.27 2146 1669 B 81 LEU H B 82 ALA H 1.0 . 4.11 2147 1670 B 83 ASN H B 83 ASN HD2y 1.0 . 4.76 2148 1671 B 83 ASN H B 83 ASN HD2x 1.0 . 4.76 2149 1672 B 83 ASN H B 84 HIS H 1.0 . 3.78 2150 1673 B 86 ILE H B 87 ASP H 1.0 . 4.90 2151 1674 B 88 ILE H B 87 ASP H 1.0 . 4.91 2152 1675 B 23 THR H B 23 THR HB 1.0 . 3.93 2153 1676 B 25 GLU H B 22 GLU HA 1.0 . 4.21 2154 1677 B 26 THR HB B 26 THR H 1.0 . 3.91 2155 1678 B 27 VAL H B 26 THR HB 1.0 . 4.02 2156 1679 B 29 ARG HA B 31 LEU H 1.0 . 4.72 2157 1680 B 29 ARG HA B 32 GLU H 1.0 . 4.32 2158 1681 B 33 GLU H B 29 ARG HA 1.0 . 4.33 2159 1682 B 31 LEU HA B 34 LYS H 1.0 . 5.05 2160 1683 B 32 GLU HA B 36 TYR H 1.0 . 4.25 2161 1684 B 31 LEU HA B 36 TYR H 1.0 . 4.75 2162 1685 B 39 ILE H B 37 ASN HA 1.0 . 5.20 2163 1686 B 41 GLN H B 38 PRO HA 1.0 . 4.75 2164 1687 B 53 TYR HA B 41 GLN HE2y 1.0 . 5.01 2165 1688 B 53 TYR HA B 41 GLN HE2x 1.0 . 5.01 2166 1689 B 39 ILE HA B 43 VAL H 1.0 . 5.08 2167 1690 B 44 GLY H B 40 ASN HA 1.0 . 5.14 2168 1691 B 44 GLY H B 41 GLN HA 1.0 . 4.83 2169 1692 B 45 TYR H B 41 GLN HA 1.0 . 4.71 2170 1693 B 52 ALA H B 50 ASP HA 1.0 . 4.76 2171 1694 B 51 PRO HA B 53 TYR H 1.0 . 4.80 2172 1695 B 51 PRO HA B 54 ILE H 1.0 . 5.34 2173 1696 B 60 ALA H B 58 GLN HA 1.0 . 4.88 2174 1697 B 60 ALA HA B 63 LEU H 1.0 . 4.56 2175 1698 B 64 ILE H B 62 ASN HA 1.0 . 4.98 2176 1699 B 62 ASN HA B 65 ARG H 1.0 . 3.85 2177 1700 B 63 LEU HA B 66 ARG H 1.0 . 4.98 2178 1701 B 65 ARG HA B 67 HIS H 1.0 . 4.74 2179 1702 B 68 GLU H B 67 HIS HA 1.0 . 3.45 2180 1703 B 72 ILE H B 69 ARG HA 1.0 . 5.21 2181 1704 B 74 GLU H B 71 GLU HA 1.0 . 4.44 2182 1705 B 75 GLU H B 72 ILE HA 1.0 . 4.80 2183 1706 B 71 GLU HA B 75 GLU H 1.0 . 5.02 2184 1707 B 77 THR H B 77 THR HB 1.0 . 3.46 2185 1708 B 74 GLU HA B 77 THR H 1.0 . 4.61 2186 1709 B 78 LYS H B 77 THR HB 1.0 . 3.98 2187 1710 B 74 GLU HA B 78 LYS H 1.0 . 4.84 2188 1711 B 80 TYR H B 80 TYR HBy 1.0 . 4.06 2189 1712 B 80 TYR H B 79 TYR HBy 1.0 . 4.56 2190 1713 B 79 TYR HA B 81 LEU H 1.0 . 4.51 2191 1714 B 79 TYR HA B 82 ALA H 1.0 . 5.23 2192 1715 B 81 LEU HA B 84 HIS H 1.0 . 4.70 2193 1716 B 86 ILE H B 82 ALA HA 1.0 . 4.37 2194 1717 B 87 ASP H B 86 ILE HA 1.0 . 3.51 2195 1718 B 50 ASP H B 50 ASP HBx 1.0 . 4.16 2196 1719 B 19 ALA H B 18 LYS HBy 1.0 . 5.00 2197 1720 B 22 GLU H B 22 GLU HGy 1.0 . 5.04 2198 1721 B 20 ILE HA B 23 THR H 1.0 . 4.52 2199 1722 B 23 THR H B 22 GLU HBy 1.0 . 4.39 2200 1723 B 23 THR HG2% B 23 THR H 1.0 . 4.63 2201 1724 B 24 LEU H B 23 THR HB 1.0 . 4.16 2202 1725 B 24 LEU H B 20 ILE HA 1.0 . 5.13 2203 1726 B 24 LEU H B 24 LEU HDy% 1.0 . 4.52 2204 1727 B 25 GLU HBy B 26 THR H 1.0 . 4.00 2205 1728 B 26 THR HG2% B 26 THR H 1.0 . 4.52 2206 1729 B 27 VAL H B 24 LEU HA 1.0 . 4.20 2207 1730 B 27 VAL H B 27 VAL HB 1.0 . 3.77 2208 1731 B 27 VAL H B 27 VAL HGx% 1.0 . 4.20 2209 1732 B 27 VAL H B 27 VAL HGy% 1.0 . 4.20 2210 1733 B 28 TYR H B 24 LEU HA 1.0 . 4.49 2211 1734 B 28 TYR H B 28 TYR HBx 1.0 . 4.13 2212 1735 B 28 TYR H B 27 VAL HB 1.0 . 4.13 2213 1736 B 26 THR HG2% B 28 TYR H 1.0 . 4.98 2214 1737 B 28 TYR H B 27 VAL HGx% 1.0 . 5.13 2215 1738 B 28 TYR H B 27 VAL HGy% 1.0 . 5.13 2216 1739 B 42 ILE HD1% B 28 TYR H 1.0 . 4.57 2217 1740 B 26 THR HA B 29 ARG H 1.0 . 4.67 2218 1741 B 29 ARG H B 28 TYR HBy 1.0 . 4.57 2219 1742 B 26 THR HA B 30 ALA H 1.0 . 4.78 2220 1743 B 27 VAL HA B 30 ALA H 1.0 . 4.70 2221 1744 B 31 LEU HBy B 31 LEU H 1.0 . 4.13 2222 1745 B 31 LEU HG B 31 LEU H 1.0 . 4.19 2223 1746 B 81 LEU HG B 81 LEU H 1.0 . 3.79 2224 1747 B 33 GLU H B 33 GLU HGy 1.0 . 4.80 2225 1748 B 34 LYS H B 33 GLU HBy 1.0 . 4.80 2226 1749 B 34 LYS H B 33 GLU HBx 1.0 . 4.80 2227 1750 B 34 LYS H B 34 LYS HDy 1.0 . 5.50 2228 1751 B 35 GLY H B 34 LYS HBy 1.0 . 5.14 2229 1752 B 35 GLY H B 34 LYS HBx 1.0 . 5.14 2230 1753 B 31 LEU HBy B 36 TYR H 1.0 . 4.98 2231 1754 B 39 ILE H B 37 ASN HBx 1.0 . 5.50 2232 1755 B 39 ILE H B 39 ILE HG1x 1.0 . 4.20 2233 1756 B 38 PRO HGy B 39 ILE H 1.0 . 4.69 2234 1757 B 40 ASN H B 37 ASN HBy 1.0 . 5.15 2235 1758 B 40 ASN H B 40 ASN HBy 1.0 . 4.02 2236 1759 B 40 ASN H B 40 ASN HBx 1.0 . 4.02 2237 1760 B 39 ILE HG2% B 40 ASN H 1.0 . 4.40 2238 1761 B 41 GLN H B 31 LEU HDx% 1.0 . 4.76 2239 1762 B 41 GLN H B 31 LEU HDy% 1.0 . 4.76 2240 1763 B 42 ILE HD1% B 42 ILE H 1.0 . 3.89 2241 1764 B 42 ILE HB B 43 VAL H 1.0 . 4.41 2242 1765 B 43 VAL HGx% B 43 VAL H 1.0 . 4.79 2243 1766 B 42 ILE HA B 45 TYR H 1.0 . 4.55 2244 1767 B 42 ILE HG2% B 45 TYR H 1.0 . 4.85 2245 1768 B 46 LEU H B 46 LEU HBx 1.0 . 4.19 2246 1769 B 42 ILE HG2% B 46 LEU H 1.0 . 4.01 2247 1770 B 46 LEU H B 46 LEU HDx% 1.0 . 4.70 2248 1771 B 46 LEU H B 46 LEU HBy 1.0 . 4.19 2249 1772 B 47 LEU H B 47 LEU HBy 1.0 . 4.07 2250 1773 B 48 SER H B 47 LEU HBy 1.0 . 4.88 2251 1774 B 48 SER H B 47 LEU HBx 1.0 . 4.88 2252 1775 B 49 GLY H B 69 ARG HDy 1.0 . 4.98 2253 1776 B 49 GLY H B 69 ARG HDx 1.0 . 4.98 2254 1777 B 52 ALA HB% B 53 TYR H 1.0 . 4.17 2255 1778 B 54 ILE HB B 54 ILE H 1.0 . 3.90 2256 1779 B 54 ILE HG2% B 54 ILE H 1.0 . 4.25 2257 1780 B 54 ILE HD1% B 54 ILE H 1.0 . 4.70 2258 1781 B 55 PRO HB2 B 56 ARG H 1.0 . 4.11 2259 1782 B 55 PRO HB2 B 57 TYR H 1.0 . 4.25 2260 1783 B 59 ASP H B 58 GLN HBx 1.0 . 5.10 2261 1784 B 60 ALA HB% B 59 ASP H 1.0 . 4.84 2262 1785 B 59 ASP H B 58 GLN HBy 1.0 . 5.10 2263 1786 B 60 ALA H B 58 GLN HBy 1.0 . 4.98 2264 1787 B 60 ALA H B 58 GLN HBx 1.0 . 4.98 2265 1788 B 61 ARG H B 54 ILE HB 1.0 . 5.00 2266 1789 B 41 GLN H B 41 GLN HGy 1.0 . 4.21 2267 1790 B 63 LEU HBy B 63 LEU H 1.0 . 3.64 2268 1791 B 63 LEU H B 63 LEU HBx 1.0 . 4.04 2269 1792 B 63 LEU H B 63 LEU HDx% 1.0 . 4.75 2270 1793 B 64 ILE HB B 64 ILE H 1.0 . 3.79 2271 1794 B 64 ILE H B 63 LEU HBx 1.0 . 4.29 2272 1795 B 64 ILE H B 27 VAL HGx% 1.0 . 5.50 2273 1796 B 64 ILE H B 63 LEU HDx% 1.0 . 5.48 2274 1797 B 64 ILE H B 64 ILE HG2% 1.0 . 3.91 2275 1798 B 65 ARG H B 65 ARG HBy 1.0 . 4.16 2276 1799 B 65 ARG H B 65 ARG HBx 1.0 . 4.16 2277 1800 B 64 ILE HB B 65 ARG H 1.0 . 4.46 2278 1801 B 64 ILE HG2% B 65 ARG H 1.0 . 3.94 2279 1802 B 69 ARG HBy B 70 ASP H 1.0 . 4.32 2280 1803 B 70 ASP H B 69 ARG HBx 1.0 . 4.32 2281 1804 B 72 ILE H B 71 GLU HBy 1.0 . 4.60 2282 1805 B 72 ILE H B 71 GLU HBx 1.0 . 4.60 2283 1806 B 72 ILE H B 72 ILE HD1% 1.0 . 4.50 2284 1807 B 72 ILE HB B 73 MET H 1.0 . 3.78 2285 1808 B 72 ILE HG2% B 73 MET H 1.0 . 4.37 2286 1809 B 75 GLU H B 75 GLU HBy 1.0 . 3.93 2287 1810 B 75 GLU H B 75 GLU HBx 1.0 . 3.93 2288 1811 B 20 ILE HD1% B 75 GLU H 1.0 . 4.54 2289 1812 B 76 LEU HG B 76 LEU H 1.0 . 4.36 2290 1813 B 76 LEU HDx% B 76 LEU H 1.0 . 4.71 2291 1814 B 76 LEU H B 76 LEU HDy% 1.0 . 4.71 2292 1815 B 77 THR H B 76 LEU HBy 1.0 . 4.58 2293 1816 B 73 MET HE% B 77 THR H 1.0 . 4.92 2294 1817 A 77 THR H B 43 VAL HB 1.0 . 5.11 2295 1818 B 77 THR H B 76 LEU HBx 1.0 . 4.58 2296 1819 B 77 THR HG2% B 77 THR H 1.0 . 4.49 2297 1820 B 78 LYS H B 78 LYS HGy 1.0 . 3.99 2298 1821 B 77 THR HG2% B 78 LYS H 1.0 . 4.55 2299 1822 B 39 ILE HD1% A 78 LYS H 1.0 . 4.64 2300 1823 B 79 TYR H B 79 TYR HBx 1.0 . 4.11 2301 1824 B 79 TYR H B 78 LYS HGy 1.0 . 4.83 2302 1825 B 79 TYR H B 82 ALA HB% 1.0 . 5.04 2303 1826 B 80 TYR H B 79 TYR HBx 1.0 . 4.56 2304 1827 B 82 ALA HB% B 82 ALA H 1.0 . 3.59 2305 1828 B 82 ALA HB% B 83 ASN H 1.0 . 4.13 2306 1829 B 82 ALA HB% B 84 HIS H 1.0 . 4.43 2307 1830 B 82 ALA HB% B 86 ILE H 1.0 . 4.43 2308 1831 B 86 ILE HD1% B 86 ILE H 1.0 . 4.53 2309 1832 B 87 ASP H B 87 ASP HBy 1.0 . 3.96 2310 1833 B 87 ASP HBx B 87 ASP H 1.0 . 3.96 2311 1834 B 86 ILE HD1% B 87 ASP H 1.0 . 4.93 2312 1835 B 88 ILE H B 87 ASP HBy 1.0 . 4.66 2313 1836 B 88 ILE H B 88 ILE HB 1.0 . 3.76 2314 1837 B 88 ILE H B 88 ILE HG1x 1.0 . 4.35 2315 1838 B 86 ILE HG2% B 88 ILE H 1.0 . 4.90 2316 1839 B 89 LYS H B 88 ILE HB 1.0 . 3.94 2317 1840 B 88 ILE HG2% B 89 LYS H 1.0 . 3.92 2318 1841 B 23 THR H B 22 GLU HBx 1.0 . 4.39 2319 1842 B 45 TYR HD% B 50 ASP H 1.0 . 4.69 2320 1843 B 19 ALA HB% B 20 ILE H 1.0 . 4.98 2321 1844 B 53 TYR H B 54 ILE H 1.0 . 3.98 2322 1845 B 50 ASP H B 48 SER H 1.0 . 4.66 2323 1846 B 6 GLU H B 7 THR H 1.0 . 4.67 2324 1847 B 50 ASP H B 49 GLY H 1.0 . 3.93 2325 1848 B 64 ILE HD1% B 54 ILE H 1.0 . 5.05 2326 1849 B 22 GLU H B 19 ALA HA 1.0 . 5.33 2327 1850 B 74 GLU H B 70 ASP HA 1.0 . 5.11 2328 1851 B 39 ILE HA B 41 GLN H 1.0 . 5.25 2329 1852 B 41 GLN H B 41 GLN HGx 1.0 . 4.21 2330 1853 B 63 LEU HBy B 62 ASN H 1.0 . 4.66 2331 1854 B 30 ALA H B 29 ARG H 1.0 . 4.01 2332 1855 B 23 THR HA B 26 THR H 1.0 . 4.84 2333 1856 B 27 VAL HA B 31 LEU H 1.0 . 5.20 2334 1857 B 28 TYR HA B 31 LEU H 1.0 . 5.13 2335 1858 B 34 LYS HG2 B 35 GLY H 1.0 . 5.33 2336 1859 B 19 ALA H B 18 LYS HBx 1.0 . 5.00 2337 1860 B 45 TYR HD% B 49 GLY H 1.0 . 5.24 2338 1861 B 45 TYR HE% B 49 GLY H 1.0 . 5.29 2339 1862 B 52 ALA H B 45 TYR HE% 1.0 . 5.16 2340 1863 B 64 ILE HA B 67 HIS H 1.0 . 5.02 2341 1864 B 30 ALA H B 29 ARG HBx 1.0 . 4.04 2342 1865 B 29 ARG H B 29 ARG HBx 1.0 . 3.98 2343 1866 B 46 LEU HA B 49 GLY H 1.0 . 5.04 2344 1867 B 69 ARG HBy B 49 GLY H 1.0 . 5.30 2345 1868 B 49 GLY H B 69 ARG HBx 1.0 . 5.30 2346 1869 B 80 TYR HA B 83 ASN H 1.0 . 5.34 2347 1870 B 67 HIS H B 67 HIS HD2 1.0 . 4.66 2348 1871 B 64 ILE HA B 67 HIS HD2 1.0 . 4.94 2349 1872 B 23 THR HG2% B 67 HIS HD2 1.0 . 3.98 2350 1873 B 72 ILE HD1% B 67 HIS HD2 1.0 . 4.64 2351 1874 B 28 TYR HD% B 29 ARG HA 1.0 . 4.67 2352 1875 B 28 TYR HD% B 38 PRO HBy 1.0 . 4.79 2353 1876 B 42 ILE HD1% B 28 TYR HD% 1.0 . 4.08 2354 1877 A 28 TYR HD% B 86 ILE HG2% 1.0 . 4.94 2355 1878 B 45 TYR HD% B 45 TYR HA 1.0 . 4.08 2356 1879 B 45 TYR HD% B 46 LEU HG 1.0 . 4.73 2357 1880 B 45 TYR HD% B 42 ILE HG2% 1.0 . 4.10 2358 1881 B 72 ILE HD1% B 45 TYR HE% 1.0 . 4.79 2359 1882 B 64 ILE HG2% B 45 TYR HE% 1.0 . 4.34 2360 1883 B 36 TYR HD% B 34 LYS HBy 1.0 . 4.16 2361 1884 B 36 TYR HE% B 34 LYS HBx 1.0 . 4.25 2362 1885 B 36 TYR HE% B 55 PRO HGy 1.0 . 4.42 2363 1886 B 57 TYR HE% B 33 GLU HBy 1.0 . 4.53 2364 1887 B 57 TYR HE% B 34 LYS HG2 1.0 . 4.87 2365 1888 B 84 HIS HD2 B 84 HIS HA 1.0 . 4.77 2366 1889 A 84 HIS HD2 B 25 GLU HA 1.0 . 4.69 2367 1890 A 80 TYR HD% B 79 TYR HD% 1.0 . 4.36 2368 1891 A 80 TYR HD% B 79 TYR HBy 1.0 . 4.59 2369 1892 A 80 TYR HD% B 79 TYR HBx 1.0 . 4.59 2370 1893 A 79 TYR HD% B 80 TYR HA 1.0 . 4.17 2371 1894 A 79 TYR HE% B 80 TYR HA 1.0 . 4.14 2372 1895 A 79 TYR HE% B 83 ASN HBy 1.0 . 4.38 2373 1896 A 79 TYR HE% B 83 ASN HBx 1.0 . 4.38 2374 1897 A 79 TYR HD% B 80 TYR HE% 1.0 . 4.83 2375 1898 B 30 ALA HA B 57 TYR HD% 1.0 . 4.40 2376 1899 B 57 TYR HD% B 57 TYR HA 1.0 . 3.88 2377 1900 A 28 TYR HE% B 86 ILE HG2% 1.0 . 4.39 2378 1901 B 39 ILE HD1% B 28 TYR HE% 1.0 . 3.96 2379 1902 A 80 TYR HE% B 24 LEU HDy% 1.0 . 5.05 2380 1903 B 53 TYR HA B 53 TYR HD% 1.0 . 4.77 2381 1904 A 80 TYR HE% B 24 LEU HDx% 1.0 . 5.05 2382 1905 B 53 TYR HE% B 50 ASP HBx 1.0 . 4.51 2383 1906 B 53 TYR HD% B 50 ASP HBy 1.0 . 5.10 2384 1907 B 53 TYR HD% B 50 ASP HBx 1.0 . 5.10 2385 1908 B 80 TYR HD% B 80 TYR H 1.0 . 4.27 2386 1909 B 46 LEU HG B 45 TYR HE% 1.0 . 4.64 2387 1910 A 28 TYR HE% B 88 ILE HB 1.0 . 4.62 2388 1911 B 28 TYR HD% B 38 PRO HBx 1.0 . 4.79 2389 1912 B 81 LEU HG B 80 TYR HD% 1.0 . 4.82 2390 1913 B 53 TYR HE% B 50 ASP HBy 1.0 . 4.51 2391 1914 B 51 PRO HA B 45 TYR HE% 1.0 . 4.41 2392 1915 B 53 TYR HA B 53 TYR HE% 1.0 . 4.16 2393 1916 B 20 ILE HA B 67 HIS HE1 1.0 . 4.99 2394 1917 B 67 HIS HE1 B 20 ILE HG1y 1.0 . 5.19 2395 1918 B 20 ILE HD1% B 67 HIS HE1 1.0 . 5.07 2396 1919 B 67 HIS HE1 B 20 ILE HG1x 1.0 . 5.19 2397 1920 B 36 TYR HD% B 31 LEU HDx% 1.0 . 4.73 2398 1921 A 80 TYR HD% B 76 LEU HA 1.0 . 3.78 2399 1922 A 80 TYR HE% B 76 LEU HA 1.0 . 4.16 2400 1923 A 80 TYR HE% B 75 GLU HGx 1.0 . 5.04 2401 1924 A 80 TYR HE% B 75 GLU HGy 1.0 . 5.04 2402 1925 B 55 PRO HB2 B 36 TYR HE% 1.0 . 4.90 2403 1926 B 36 TYR HE% B 55 PRO HGx 1.0 . 4.42 2404 1927 B 31 LEU HG B 36 TYR HD% 1.0 . 4.34 2405 1928 B 6 GLU H B 6 GLU HG2 1.0 . 5.21 2406 1928 B 6 GLU H B 6 GLU HGy 1.0 . 5.21 2407 1929 B 9 ARG H B 8 VAL HGy% 1.0 . 5.30 2408 1929 B 9 ARG H B 8 VAL HGx% 1.0 . 5.30 2409 1930 B 9 ARG HA B 9 ARG HD2 1.0 . 5.34 2410 1930 B 9 ARG HA B 9 ARG HDy 1.0 . 5.34 2411 1931 B 14 ASP H B 13 ASP HB2 1.0 . 4.33 2412 1931 B 13 ASP HBy B 14 ASP H 1.0 . 4.33 2413 1932 B 16 ARG H B 16 ARG HG2 1.0 . 5.22 2414 1932 B 16 ARG H B 16 ARG HGy 1.0 . 5.22 2415 1933 B 16 ARG HA B 16 ARG HD2 1.0 . 5.34 2416 1933 B 16 ARG HA B 16 ARG HDy 1.0 . 5.34 2417 1934 B 17 LYS H B 16 ARG HBy 1.0 . 4.22 2418 1934 B 16 ARG HBx B 17 LYS H 1.0 . 4.22 2419 1935 B 17 LYS H B 17 LYS HG2 1.0 . 4.83 2420 1935 B 17 LYS H B 17 LYS HGy 1.0 . 4.83 2421 1936 B 17 LYS HBy B 17 LYS HD2 1.0 . 3.28 2422 1936 B 17 LYS HBx B 17 LYS HD2 1.0 . 3.28 2423 1936 B 17 LYS HDy B 17 LYS HBy 1.0 . 3.28 2424 1936 B 17 LYS HBx B 17 LYS HDy 1.0 . 3.28 2425 1937 B 18 LYS H B 17 LYS HBy 1.0 . 4.39 2426 1937 B 17 LYS HBx B 18 LYS H 1.0 . 4.39 2427 1938 B 18 LYS H B 17 LYS HD2 1.0 . 5.19 2428 1938 B 17 LYS HDy B 18 LYS H 1.0 . 5.19 2429 1939 B 18 LYS H B 18 LYS HG2 1.0 . 4.50 2430 1939 B 18 LYS H B 18 LYS HGy 1.0 . 4.50 2431 1940 B 18 LYS HA B 18 LYS HD2 1.0 . 4.73 2432 1940 B 18 LYS HA B 18 LYS HDy 1.0 . 4.73 2433 1941 B 18 LYS HBx B 18 LYS HD2 1.0 . 3.32 2434 1941 B 18 LYS HBy B 18 LYS HD2 1.0 . 3.32 2435 1941 B 18 LYS HDy B 18 LYS HBx 1.0 . 3.32 2436 1941 B 18 LYS HDy B 18 LYS HBy 1.0 . 3.32 2437 1942 B 19 ALA H B 18 LYS HBx 1.0 . 4.35 2438 1942 B 19 ALA H B 18 LYS HBy 1.0 . 4.35 2439 1943 B 19 ALA HB% B 22 GLU HBx 1.0 . 4.53 2440 1943 B 19 ALA HB% B 22 GLU HBy 1.0 . 4.53 2441 1944 B 19 ALA HB% B 22 GLU HGx 1.0 . 4.57 2442 1944 B 19 ALA HB% B 22 GLU HGy 1.0 . 4.57 2443 1945 B 20 ILE HB B 75 GLU HGx 1.0 . 5.34 2444 1945 B 20 ILE HB B 75 GLU HGy 1.0 . 5.34 2445 1946 B 20 ILE HG2% B 75 GLU HBx 1.0 . 4.64 2446 1946 B 20 ILE HG2% B 75 GLU HBy 1.0 . 4.64 2447 1947 B 67 HIS HE1 B 20 ILE HG1x 1.0 . 4.40 2448 1947 B 67 HIS HE1 B 20 ILE HG1y 1.0 . 4.40 2449 1948 B 72 ILE HD1% B 20 ILE HG1x 1.0 . 4.99 2450 1948 B 72 ILE HD1% B 20 ILE HG1y 1.0 . 4.99 2451 1949 B 20 ILE HD1% B 67 HIS HBy 1.0 . 5.34 2452 1949 B 20 ILE HD1% B 67 HIS HBx 1.0 . 5.34 2453 1950 B 20 ILE HD1% B 71 GLU HBx 1.0 . 3.96 2454 1950 B 20 ILE HD1% B 71 GLU HBy 1.0 . 3.96 2455 1951 B 20 ILE HD1% B 71 GLU HGx 1.0 . 5.34 2456 1951 B 20 ILE HD1% B 71 GLU HGy 1.0 . 5.34 2457 1952 B 20 ILE HD1% B 75 GLU HBx 1.0 . 4.75 2458 1952 B 20 ILE HD1% B 75 GLU HBy 1.0 . 4.75 2459 1953 B 22 GLU H B 22 GLU HBx 1.0 . 3.65 2460 1953 B 22 GLU H B 22 GLU HBy 1.0 . 3.65 2461 1954 B 22 GLU H B 22 GLU HGx 1.0 . 4.19 2462 1954 B 22 GLU H B 22 GLU HGy 1.0 . 4.19 2463 1955 B 23 THR H B 22 GLU HBx 1.0 . 3.76 2464 1955 B 23 THR H B 22 GLU HBy 1.0 . 3.76 2465 1956 B 23 THR H B 22 GLU HGx 1.0 . 4.93 2466 1956 B 23 THR H B 22 GLU HGy 1.0 . 4.93 2467 1957 B 23 THR HG2% B 24 LEU HDy% 1.0 . 4.42 2468 1957 B 24 LEU HDx% B 23 THR HG2% 1.0 . 4.42 2469 1958 B 23 THR HG2% B 63 LEU HDy% 1.0 . 4.17 2470 1958 B 23 THR HG2% B 63 LEU HDx% 1.0 . 4.17 2471 1959 B 24 LEU H B 24 LEU HDy% 1.0 . 3.97 2472 1959 B 24 LEU HDx% B 24 LEU H 1.0 . 3.97 2473 1960 B 24 LEU HA B 24 LEU HDy% 1.0 . 3.78 2474 1960 B 24 LEU HDx% B 24 LEU HA 1.0 . 3.78 2475 1961 B 24 LEU HA B 27 VAL HGy% 1.0 . 4.25 2476 1961 B 24 LEU HA B 27 VAL HGx% 1.0 . 4.25 2477 1962 B 24 LEU HBy B 76 LEU HDy% 1.0 . 4.52 2478 1962 B 76 LEU HDx% B 24 LEU HBy 1.0 . 4.52 2479 1963 B 24 LEU HBx A 81 LEU HDy% 1.0 . 4.17 2480 1963 A 81 LEU HDx% B 24 LEU HBx 1.0 . 4.17 2481 1964 B 25 GLU H B 24 LEU HDy% 1.0 . 4.30 2482 1964 B 24 LEU HDx% B 25 GLU H 1.0 . 4.30 2483 1965 B 27 VAL HB B 24 LEU HDy% 1.0 . 5.28 2484 1965 B 24 LEU HDx% B 27 VAL HB 1.0 . 5.28 2485 1966 B 76 LEU HG B 24 LEU HDy% 1.0 . 5.29 2486 1966 B 24 LEU HDx% B 76 LEU HG 1.0 . 5.29 2487 1967 B 24 LEU HDy% B 76 LEU HDy% 1.0 . 3.43 2488 1967 B 76 LEU HDx% B 24 LEU HDy% 1.0 . 3.43 2489 1967 B 76 LEU HDx% B 24 LEU HDx% 1.0 . 3.43 2490 1967 B 24 LEU HDx% B 76 LEU HDy% 1.0 . 3.43 2491 1968 A 80 TYR HD% B 24 LEU HDy% 1.0 . 4.61 2492 1968 A 80 TYR HD% B 24 LEU HDx% 1.0 . 4.61 2493 1969 A 80 TYR HE% B 24 LEU HDy% 1.0 . 4.23 2494 1969 A 80 TYR HE% B 24 LEU HDx% 1.0 . 4.23 2495 1970 A 81 LEU HDy% B 24 LEU HDy% 1.0 . 4.36 2496 1970 B 24 LEU HDx% A 81 LEU HDy% 1.0 . 4.36 2497 1970 A 81 LEU HDx% B 24 LEU HDx% 1.0 . 4.36 2498 1970 A 81 LEU HDx% B 24 LEU HDy% 1.0 . 4.36 2499 1971 B 25 GLU H B 25 GLU HGx 1.0 . 3.93 2500 1971 B 25 GLU H B 25 GLU HGy 1.0 . 3.93 2501 1972 B 25 GLU HA B 28 TYR HBy 1.0 . 5.25 2502 1972 B 25 GLU HA B 28 TYR HBx 1.0 . 5.25 2503 1973 B 25 GLU HA A 81 LEU HDy% 1.0 . 4.50 2504 1973 A 81 LEU HDx% B 25 GLU HA 1.0 . 4.50 2505 1974 B 25 GLU HBy A 81 LEU HDy% 1.0 . 4.85 2506 1974 B 25 GLU HBy A 81 LEU HDx% 1.0 . 4.85 2507 1975 B 26 THR H B 25 GLU HGx 1.0 . 5.34 2508 1975 B 26 THR H B 25 GLU HGy 1.0 . 5.34 2509 1976 A 86 ILE HG1y B 25 GLU HGx 1.0 . 5.34 2510 1976 A 86 ILE HG1y B 25 GLU HGy 1.0 . 5.34 2511 1977 A 86 ILE HD1% B 25 GLU HGx 1.0 . 4.27 2512 1977 A 86 ILE HD1% B 25 GLU HGy 1.0 . 4.27 2513 1978 B 26 THR H B 63 LEU HDy% 1.0 . 5.44 2514 1978 B 26 THR H B 63 LEU HDx% 1.0 . 5.44 2515 1979 B 26 THR HB B 27 VAL HGy% 1.0 . 4.66 2516 1979 B 26 THR HB B 27 VAL HGx% 1.0 . 4.66 2517 1980 B 26 THR HB B 63 LEU HDy% 1.0 . 4.69 2518 1980 B 26 THR HB B 63 LEU HDx% 1.0 . 4.69 2519 1981 B 26 THR HG2% B 58 GLN HBy 1.0 . 4.57 2520 1981 B 26 THR HG2% B 58 GLN HBx 1.0 . 4.57 2521 1982 B 26 THR HG2% B 63 LEU HDy% 1.0 . 3.57 2522 1982 B 26 THR HG2% B 63 LEU HDx% 1.0 . 3.57 2523 1983 B 27 VAL H B 27 VAL HGy% 1.0 . 3.49 2524 1983 B 27 VAL H B 27 VAL HGx% 1.0 . 3.49 2525 1984 B 27 VAL H B 63 LEU HDy% 1.0 . 5.17 2526 1984 B 27 VAL H B 63 LEU HDx% 1.0 . 5.17 2527 1985 B 27 VAL HB B 42 ILE HG1x 1.0 . 5.12 2528 1985 B 27 VAL HB B 42 ILE HG1y 1.0 . 5.12 2529 1986 B 28 TYR H B 27 VAL HGy% 1.0 . 4.21 2530 1986 B 28 TYR H B 27 VAL HGx% 1.0 . 4.21 2531 1987 B 30 ALA H B 27 VAL HGy% 1.0 . 5.44 2532 1987 B 30 ALA H B 27 VAL HGx% 1.0 . 5.44 2533 1988 B 30 ALA HB% B 27 VAL HGy% 1.0 . 4.24 2534 1988 B 30 ALA HB% B 27 VAL HGx% 1.0 . 4.24 2535 1989 B 27 VAL HGx% B 42 ILE HG1x 1.0 . 4.69 2536 1989 B 27 VAL HGy% B 42 ILE HG1x 1.0 . 4.69 2537 1989 B 42 ILE HG1y B 27 VAL HGy% 1.0 . 4.69 2538 1989 B 27 VAL HGx% B 42 ILE HG1y 1.0 . 4.69 2539 1990 B 54 ILE HD1% B 27 VAL HGy% 1.0 . 3.89 2540 1990 B 54 ILE HD1% B 27 VAL HGx% 1.0 . 3.89 2541 1991 B 60 ALA HA B 27 VAL HGy% 1.0 . 4.34 2542 1991 B 60 ALA HA B 27 VAL HGx% 1.0 . 4.34 2543 1992 B 63 LEU HBy B 27 VAL HGy% 1.0 . 4.53 2544 1992 B 63 LEU HBy B 27 VAL HGx% 1.0 . 4.53 2545 1993 B 27 VAL HGy% B 63 LEU HDy% 1.0 . 4.28 2546 1993 B 27 VAL HGx% B 63 LEU HDy% 1.0 . 4.28 2547 1993 B 63 LEU HDx% B 27 VAL HGy% 1.0 . 4.28 2548 1993 B 63 LEU HDx% B 27 VAL HGx% 1.0 . 4.28 2549 1994 B 64 ILE H B 27 VAL HGy% 1.0 . 4.40 2550 1994 B 64 ILE H B 27 VAL HGx% 1.0 . 4.40 2551 1995 B 64 ILE HB B 27 VAL HGy% 1.0 . 4.13 2552 1995 B 64 ILE HB B 27 VAL HGx% 1.0 . 4.13 2553 1996 B 64 ILE HG2% B 27 VAL HGy% 1.0 . 3.92 2554 1996 B 64 ILE HG2% B 27 VAL HGx% 1.0 . 3.92 2555 1997 B 64 ILE HD1% B 27 VAL HGy% 1.0 . 3.48 2556 1997 B 64 ILE HD1% B 27 VAL HGx% 1.0 . 3.48 2557 1998 B 28 TYR H A 81 LEU HDy% 1.0 . 5.44 2558 1998 A 81 LEU HDx% B 28 TYR H 1.0 . 5.44 2559 1999 B 28 TYR HA B 31 LEU HDy% 1.0 . 4.93 2560 1999 B 28 TYR HA B 31 LEU HDx% 1.0 . 4.93 2561 2000 B 28 TYR HA B 38 PRO HBy 1.0 . 4.58 2562 2000 B 28 TYR HA B 38 PRO HBx 1.0 . 4.58 2563 2001 B 29 ARG H B 28 TYR HBy 1.0 . 3.90 2564 2001 B 29 ARG H B 28 TYR HBx 1.0 . 3.90 2565 2002 B 29 ARG HA B 28 TYR HBy 1.0 . 5.14 2566 2002 B 29 ARG HA B 28 TYR HBx 1.0 . 5.14 2567 2003 B 28 TYR HBy B 29 ARG HGx 1.0 . 4.22 2568 2003 B 28 TYR HBx B 29 ARG HGx 1.0 . 4.22 2569 2003 B 29 ARG HGy B 28 TYR HBy 1.0 . 4.22 2570 2003 B 28 TYR HBx B 29 ARG HGy 1.0 . 4.22 2571 2004 A 81 LEU HDy% B 28 TYR HBy 1.0 . 4.74 2572 2004 A 81 LEU HDx% B 28 TYR HBy 1.0 . 4.74 2573 2004 B 28 TYR HBx A 81 LEU HDy% 1.0 . 4.74 2574 2004 A 81 LEU HDx% B 28 TYR HBx 1.0 . 4.74 2575 2005 A 86 ILE HD1% B 28 TYR HBy 1.0 . 4.79 2576 2005 A 86 ILE HD1% B 28 TYR HBx 1.0 . 4.79 2577 2006 B 28 TYR HD% B 29 ARG HGx 1.0 . 4.37 2578 2006 B 28 TYR HD% B 29 ARG HGy 1.0 . 4.37 2579 2007 B 28 TYR HD% B 38 PRO HBy 1.0 . 4.19 2580 2007 B 28 TYR HD% B 38 PRO HBx 1.0 . 4.19 2581 2008 B 28 TYR HD% B 39 ILE HG1x 1.0 . 5.34 2582 2008 B 28 TYR HD% B 39 ILE HG1y 1.0 . 5.34 2583 2009 B 28 TYR HD% A 81 LEU HDy% 1.0 . 4.21 2584 2009 B 28 TYR HD% A 81 LEU HDx% 1.0 . 4.21 2585 2010 B 28 TYR HE% B 38 PRO HBy 1.0 . 4.48 2586 2010 B 28 TYR HE% B 38 PRO HBx 1.0 . 4.48 2587 2011 B 28 TYR HE% B 39 ILE HG1x 1.0 . 4.42 2588 2011 B 28 TYR HE% B 39 ILE HG1y 1.0 . 4.42 2589 2012 B 29 ARG H B 29 ARG HGx 1.0 . 4.03 2590 2012 B 29 ARG H B 29 ARG HGy 1.0 . 4.03 2591 2013 B 29 ARG H B 32 GLU HGx 1.0 . 5.13 2592 2013 B 29 ARG H B 32 GLU HGy 1.0 . 5.13 2593 2014 B 29 ARG HA B 29 ARG HDx 1.0 . 4.37 2594 2014 B 29 ARG HA B 29 ARG HDy 1.0 . 4.37 2595 2015 B 29 ARG HA B 32 GLU HGx 1.0 . 4.76 2596 2015 B 29 ARG HA B 32 GLU HGy 1.0 . 4.76 2597 2016 B 29 ARG HA B 33 GLU HGx 1.0 . 5.34 2598 2016 B 29 ARG HA B 33 GLU HGy 1.0 . 5.34 2599 2017 A 86 ILE HD1% B 29 ARG HGx 1.0 . 4.91 2600 2017 A 86 ILE HD1% B 29 ARG HGy 1.0 . 4.91 2601 2018 B 30 ALA H B 31 LEU HDy% 1.0 . 5.26 2602 2018 B 30 ALA H B 31 LEU HDx% 1.0 . 5.26 2603 2019 B 30 ALA HA B 31 LEU HDy% 1.0 . 5.44 2604 2019 B 30 ALA HA B 31 LEU HDx% 1.0 . 5.44 2605 2020 B 30 ALA HA B 33 GLU HBx 1.0 . 5.32 2606 2020 B 30 ALA HA B 33 GLU HBy 1.0 . 5.32 2607 2021 B 30 ALA HB% B 31 LEU HDy% 1.0 . 4.42 2608 2021 B 30 ALA HB% B 31 LEU HDx% 1.0 . 4.42 2609 2022 B 31 LEU H B 31 LEU HDy% 1.0 . 4.23 2610 2022 B 31 LEU H B 31 LEU HDx% 1.0 . 4.23 2611 2023 B 31 LEU HA B 31 LEU HDy% 1.0 . 3.55 2612 2023 B 31 LEU HA B 31 LEU HDx% 1.0 . 3.55 2613 2024 B 31 LEU HA B 34 LYS HBx 1.0 . 4.64 2614 2024 B 31 LEU HA B 34 LYS HBy 1.0 . 4.64 2615 2025 B 31 LEU HG B 38 PRO HDy 1.0 . 5.29 2616 2025 B 31 LEU HG B 38 PRO HDx 1.0 . 5.29 2617 2026 B 31 LEU HG B 55 PRO HDy 1.0 . 4.34 2618 2026 B 31 LEU HG B 55 PRO HDx 1.0 . 4.34 2619 2027 B 32 GLU H B 31 LEU HDy% 1.0 . 5.44 2620 2027 B 32 GLU H B 31 LEU HDx% 1.0 . 5.44 2621 2028 B 36 TYR H B 31 LEU HDy% 1.0 . 4.99 2622 2028 B 36 TYR H B 31 LEU HDx% 1.0 . 4.99 2623 2029 B 31 LEU HDx% B 36 TYR HBy 1.0 . 4.85 2624 2029 B 31 LEU HDy% B 36 TYR HBy 1.0 . 4.85 2625 2029 B 36 TYR HBx B 31 LEU HDy% 1.0 . 4.85 2626 2029 B 31 LEU HDx% B 36 TYR HBx 1.0 . 4.85 2627 2030 B 36 TYR HD% B 31 LEU HDy% 1.0 . 3.95 2628 2030 B 36 TYR HD% B 31 LEU HDx% 1.0 . 3.95 2629 2031 B 36 TYR HE% B 31 LEU HDy% 1.0 . 5.44 2630 2031 B 36 TYR HE% B 31 LEU HDx% 1.0 . 5.44 2631 2032 B 38 PRO HA B 31 LEU HDy% 1.0 . 4.38 2632 2032 B 38 PRO HA B 31 LEU HDx% 1.0 . 4.38 2633 2033 B 31 LEU HDy% B 38 PRO HBy 1.0 . 4.17 2634 2033 B 31 LEU HDx% B 38 PRO HBy 1.0 . 4.17 2635 2033 B 38 PRO HBx B 31 LEU HDy% 1.0 . 4.17 2636 2033 B 31 LEU HDx% B 38 PRO HBx 1.0 . 4.17 2637 2034 B 39 ILE H B 31 LEU HDy% 1.0 . 5.44 2638 2034 B 39 ILE H B 31 LEU HDx% 1.0 . 5.44 2639 2035 B 31 LEU HDx% B 41 GLN HBy 1.0 . 3.43 2640 2035 B 41 GLN HBx B 31 LEU HDy% 1.0 . 3.43 2641 2035 B 31 LEU HDx% B 41 GLN HBx 1.0 . 3.43 2642 2035 B 31 LEU HDy% B 41 GLN HBy 1.0 . 3.43 2643 2036 B 31 LEU HDy% B 41 GLN HGx 1.0 . 3.73 2644 2036 B 31 LEU HDx% B 41 GLN HGx 1.0 . 3.73 2645 2036 B 41 GLN HGy B 31 LEU HDy% 1.0 . 3.73 2646 2036 B 31 LEU HDx% B 41 GLN HGy 1.0 . 3.73 2647 2037 B 41 GLN HE2y B 31 LEU HDx% 1.0 . 5.27 2648 2037 B 41 GLN HE2x B 31 LEU HDx% 1.0 . 5.27 2649 2037 B 41 GLN HE2y B 31 LEU HDy% 1.0 . 5.27 2650 2037 B 41 GLN HE2x B 31 LEU HDy% 1.0 . 5.27 2651 2038 B 42 ILE H B 31 LEU HDy% 1.0 . 4.30 2652 2038 B 42 ILE H B 31 LEU HDx% 1.0 . 4.30 2653 2039 B 42 ILE HA B 31 LEU HDy% 1.0 . 5.44 2654 2039 B 42 ILE HA B 31 LEU HDx% 1.0 . 5.44 2655 2040 B 31 LEU HDx% B 42 ILE HG1x 1.0 . 4.61 2656 2040 B 31 LEU HDy% B 42 ILE HG1x 1.0 . 4.61 2657 2040 B 42 ILE HG1y B 31 LEU HDy% 1.0 . 4.61 2658 2040 B 42 ILE HG1y B 31 LEU HDx% 1.0 . 4.61 2659 2041 B 54 ILE HA B 31 LEU HDy% 1.0 . 4.63 2660 2041 B 54 ILE HA B 31 LEU HDx% 1.0 . 4.63 2661 2042 B 54 ILE HD1% B 31 LEU HDy% 1.0 . 3.91 2662 2042 B 54 ILE HD1% B 31 LEU HDx% 1.0 . 3.91 2663 2043 B 31 LEU HDy% B 55 PRO HGx 1.0 . 4.17 2664 2043 B 55 PRO HGy B 31 LEU HDy% 1.0 . 4.17 2665 2043 B 31 LEU HDx% B 55 PRO HGy 1.0 . 4.17 2666 2043 B 31 LEU HDx% B 55 PRO HGx 1.0 . 4.17 2667 2044 B 31 LEU HDx% B 55 PRO HDy 1.0 . 4.09 2668 2044 B 55 PRO HDx B 31 LEU HDy% 1.0 . 4.09 2669 2044 B 31 LEU HDx% B 55 PRO HDx 1.0 . 4.09 2670 2044 B 31 LEU HDy% B 55 PRO HDy 1.0 . 4.09 2671 2045 B 32 GLU H B 32 GLU HBy 1.0 . 3.38 2672 2045 B 32 GLU H B 32 GLU HBx 1.0 . 3.38 2673 2046 B 32 GLU H B 32 GLU HGx 1.0 . 3.57 2674 2046 B 32 GLU H B 32 GLU HGy 1.0 . 3.57 2675 2047 B 33 GLU H B 32 GLU HBy 1.0 . 3.43 2676 2047 B 33 GLU H B 32 GLU HBx 1.0 . 3.43 2677 2048 B 38 PRO HGy B 32 GLU HGx 1.0 . 5.32 2678 2048 B 38 PRO HGy B 32 GLU HGy 1.0 . 5.32 2679 2049 B 33 GLU H B 33 GLU HBx 1.0 . 3.43 2680 2049 B 33 GLU H B 33 GLU HBy 1.0 . 3.43 2681 2050 B 33 GLU H B 33 GLU HGx 1.0 . 3.92 2682 2050 B 33 GLU H B 33 GLU HGy 1.0 . 3.92 2683 2051 B 33 GLU HBx B 33 GLU HGx 1.0 . 2.37 2684 2051 B 33 GLU HBy B 33 GLU HGx 1.0 . 2.37 2685 2051 B 33 GLU HGy B 33 GLU HBx 1.0 . 2.37 2686 2051 B 33 GLU HGy B 33 GLU HBy 1.0 . 2.37 2687 2052 B 34 LYS HG2 B 33 GLU HBx 1.0 . 5.13 2688 2052 B 34 LYS HG2 B 33 GLU HBy 1.0 . 5.13 2689 2053 B 57 TYR HE% B 33 GLU HBx 1.0 . 3.94 2690 2053 B 57 TYR HE% B 33 GLU HBy 1.0 . 3.94 2691 2054 B 57 TYR HE% B 33 GLU HGx 1.0 . 4.48 2692 2054 B 57 TYR HE% B 33 GLU HGy 1.0 . 4.48 2693 2055 B 34 LYS H B 34 LYS HDx 1.0 . 4.66 2694 2055 B 34 LYS H B 34 LYS HDy 1.0 . 4.66 2695 2056 B 34 LYS H B 35 GLY HAy 1.0 . 5.34 2696 2056 B 34 LYS H B 35 GLY HAx 1.0 . 5.34 2697 2057 B 34 LYS HBx B 34 LYS HEx 1.0 . 4.69 2698 2057 B 34 LYS HBy B 34 LYS HEx 1.0 . 4.69 2699 2057 B 34 LYS HEy B 34 LYS HBx 1.0 . 4.69 2700 2057 B 34 LYS HBy B 34 LYS HEy 1.0 . 4.69 2701 2058 B 36 TYR H B 34 LYS HBx 1.0 . 4.83 2702 2058 B 36 TYR H B 34 LYS HBy 1.0 . 4.83 2703 2059 B 36 TYR HE% B 34 LYS HBx 1.0 . 3.73 2704 2059 B 36 TYR HE% B 34 LYS HBy 1.0 . 3.73 2705 2060 B 34 LYS HBx B 55 PRO HGx 1.0 . 4.57 2706 2060 B 34 LYS HBy B 55 PRO HGx 1.0 . 4.57 2707 2060 B 55 PRO HGy B 34 LYS HBx 1.0 . 4.57 2708 2060 B 34 LYS HBy B 55 PRO HGy 1.0 . 4.57 2709 2061 B 36 TYR HD% B 34 LYS HDx 1.0 . 5.34 2710 2061 B 36 TYR HD% B 34 LYS HDy 1.0 . 5.34 2711 2062 B 36 TYR HE% B 34 LYS HDx 1.0 . 4.25 2712 2062 B 36 TYR HE% B 34 LYS HDy 1.0 . 4.25 2713 2063 B 57 TYR HD% B 34 LYS HDx 1.0 . 4.03 2714 2063 B 57 TYR HD% B 34 LYS HDy 1.0 . 4.03 2715 2064 B 36 TYR HD% B 34 LYS HEx 1.0 . 5.34 2716 2064 B 36 TYR HD% B 34 LYS HEy 1.0 . 5.34 2717 2065 B 57 TYR H B 34 LYS HEx 1.0 . 4.50 2718 2065 B 57 TYR H B 34 LYS HEy 1.0 . 4.50 2719 2066 B 57 TYR HD% B 34 LYS HEx 1.0 . 4.24 2720 2066 B 57 TYR HD% B 34 LYS HEy 1.0 . 4.24 2721 2067 B 57 TYR HE% B 34 LYS HEx 1.0 . 5.34 2722 2067 B 57 TYR HE% B 34 LYS HEy 1.0 . 5.34 2723 2068 B 36 TYR H B 36 TYR HBy 1.0 . 3.61 2724 2068 B 36 TYR H B 36 TYR HBx 1.0 . 3.61 2725 2069 B 36 TYR HD% B 55 PRO HGx 1.0 . 4.03 2726 2069 B 36 TYR HD% B 55 PRO HGy 1.0 . 4.03 2727 2070 B 39 ILE H B 37 ASN HBy 1.0 . 4.66 2728 2070 B 39 ILE H B 37 ASN HBx 1.0 . 4.66 2729 2071 B 40 ASN H B 37 ASN HBy 1.0 . 4.44 2730 2071 B 40 ASN H B 37 ASN HBx 1.0 . 4.44 2731 2072 B 40 ASN HD2y B 37 ASN HBy 1.0 . 4.21 2732 2072 B 40 ASN HD2x B 37 ASN HBy 1.0 . 4.21 2733 2072 B 40 ASN HD2y B 37 ASN HBx 1.0 . 4.21 2734 2072 B 40 ASN HD2x B 37 ASN HBx 1.0 . 4.21 2735 2073 B 39 ILE H B 38 PRO HBy 1.0 . 4.11 2736 2073 B 39 ILE H B 38 PRO HBx 1.0 . 4.11 2737 2074 B 39 ILE H B 38 PRO HDy 1.0 . 4.86 2738 2074 B 39 ILE H B 38 PRO HDx 1.0 . 4.86 2739 2075 B 39 ILE H B 39 ILE HG1x 1.0 . 3.65 2740 2075 B 39 ILE H B 39 ILE HG1y 1.0 . 3.65 2741 2076 B 39 ILE HG2% A 74 GLU HGx 1.0 . 4.28 2742 2076 B 39 ILE HG2% A 74 GLU HGy 1.0 . 4.28 2743 2077 A 78 LYS HGx B 39 ILE HG1x 1.0 . 4.09 2744 2077 A 78 LYS HGx B 39 ILE HG1y 1.0 . 4.09 2745 2078 B 40 ASN H B 40 ASN HBy 1.0 . 3.51 2746 2078 B 40 ASN H B 40 ASN HBx 1.0 . 3.51 2747 2079 B 40 ASN H B 40 ASN HD2y 1.0 . 4.34 2748 2079 B 40 ASN H B 40 ASN HD2x 1.0 . 4.34 2749 2080 B 41 GLN H B 40 ASN HBy 1.0 . 3.92 2750 2080 B 41 GLN H B 40 ASN HBx 1.0 . 3.92 2751 2081 B 41 GLN H B 41 GLN HGx 1.0 . 3.41 2752 2081 B 41 GLN H B 41 GLN HGy 1.0 . 3.41 2753 2082 B 41 GLN H B 42 ILE HG1x 1.0 . 4.58 2754 2082 B 41 GLN H B 42 ILE HG1y 1.0 . 4.58 2755 2083 B 41 GLN HE2y B 41 GLN HA 1.0 . 4.98 2756 2083 B 41 GLN HE2x B 41 GLN HA 1.0 . 4.98 2757 2084 B 54 ILE HD1% B 41 GLN HBy 1.0 . 5.17 2758 2084 B 54 ILE HD1% B 41 GLN HBx 1.0 . 5.17 2759 2085 B 54 ILE HD1% B 41 GLN HGx 1.0 . 5.34 2760 2085 B 54 ILE HD1% B 41 GLN HGy 1.0 . 5.34 2761 2086 B 53 TYR HA B 41 GLN HE2y 1.0 . 4.27 2762 2086 B 53 TYR HA B 41 GLN HE2x 1.0 . 4.27 2763 2087 B 41 GLN HE2y B 53 TYR HBx 1.0 . 4.52 2764 2087 B 41 GLN HE2x B 53 TYR HBx 1.0 . 4.52 2765 2087 B 41 GLN HE2x B 53 TYR HBy 1.0 . 4.52 2766 2087 B 41 GLN HE2y B 53 TYR HBy 1.0 . 4.52 2767 2088 B 54 ILE HD1% B 41 GLN HE2y 1.0 . 5.34 2768 2088 B 54 ILE HD1% B 41 GLN HE2x 1.0 . 5.34 2769 2089 B 42 ILE H B 43 VAL HGy% 1.0 . 5.44 2770 2089 B 43 VAL HGx% B 42 ILE H 1.0 . 5.44 2771 2090 B 42 ILE HA B 45 TYR HB2 1.0 . 5.34 2772 2090 B 42 ILE HA B 45 TYR HBy 1.0 . 5.34 2773 2091 B 42 ILE HB B 43 VAL HGy% 1.0 . 4.86 2774 2091 B 43 VAL HGx% B 42 ILE HB 1.0 . 4.86 2775 2092 B 42 ILE HG2% B 46 LEU HDy% 1.0 . 3.31 2776 2092 B 42 ILE HG2% B 46 LEU HDx% 1.0 . 3.31 2777 2093 B 54 ILE HD1% B 42 ILE HG1x 1.0 . 4.51 2778 2093 B 54 ILE HD1% B 42 ILE HG1y 1.0 . 4.51 2779 2094 B 64 ILE HD1% B 42 ILE HG1x 1.0 . 4.88 2780 2094 B 64 ILE HD1% B 42 ILE HG1y 1.0 . 4.88 2781 2095 B 43 VAL H B 43 VAL HGy% 1.0 . 3.65 2782 2095 B 43 VAL HGx% B 43 VAL H 1.0 . 3.65 2783 2096 B 43 VAL HA B 46 LEU HBx 1.0 . 4.79 2784 2096 B 43 VAL HA B 46 LEU HBy 1.0 . 4.79 2785 2097 B 43 VAL HA B 46 LEU HDy% 1.0 . 4.49 2786 2097 B 43 VAL HA B 46 LEU HDx% 1.0 . 4.49 2787 2098 B 43 VAL HB B 46 LEU HDy% 1.0 . 5.44 2788 2098 B 43 VAL HB B 46 LEU HDx% 1.0 . 5.44 2789 2099 B 44 GLY H B 43 VAL HGy% 1.0 . 3.93 2790 2099 B 43 VAL HGx% B 44 GLY H 1.0 . 3.93 2791 2100 B 43 VAL HGy% B 46 LEU HDy% 1.0 . 4.41 2792 2100 B 43 VAL HGx% B 46 LEU HDy% 1.0 . 4.41 2793 2100 B 46 LEU HDx% B 43 VAL HGy% 1.0 . 4.41 2794 2100 B 43 VAL HGx% B 46 LEU HDx% 1.0 . 4.41 2795 2101 B 47 LEU H B 43 VAL HGy% 1.0 . 5.44 2796 2101 B 43 VAL HGx% B 47 LEU H 1.0 . 5.44 2797 2102 B 47 LEU HG B 43 VAL HGy% 1.0 . 5.01 2798 2102 B 43 VAL HGx% B 47 LEU HG 1.0 . 5.01 2799 2103 A 73 MET HA B 43 VAL HGy% 1.0 . 5.42 2800 2103 A 73 MET HA B 43 VAL HGx% 1.0 . 5.42 2801 2104 A 73 MET HGx B 43 VAL HGy% 1.0 . 4.22 2802 2104 A 73 MET HGy B 43 VAL HGy% 1.0 . 4.22 2803 2104 B 43 VAL HGx% A 73 MET HGx 1.0 . 4.22 2804 2104 A 73 MET HGy B 43 VAL HGx% 1.0 . 4.22 2805 2105 A 74 GLU H B 43 VAL HGy% 1.0 . 4.41 2806 2105 A 74 GLU H B 43 VAL HGx% 1.0 . 4.41 2807 2106 A 74 GLU HBx B 43 VAL HGy% 1.0 . 4.85 2808 2106 A 74 GLU HBy B 43 VAL HGy% 1.0 . 4.85 2809 2106 B 43 VAL HGx% A 74 GLU HBx 1.0 . 4.85 2810 2106 B 43 VAL HGx% A 74 GLU HBy 1.0 . 4.85 2811 2107 B 44 GLY H B 46 LEU HDy% 1.0 . 5.09 2812 2107 B 44 GLY H B 46 LEU HDx% 1.0 . 5.09 2813 2108 B 53 TYR HE% B 44 GLY HAy 1.0 . 3.84 2814 2108 B 53 TYR HE% B 44 GLY HAx 1.0 . 3.84 2815 2109 B 45 TYR H B 45 TYR HB2 1.0 . 3.54 2816 2109 B 45 TYR H B 45 TYR HBy 1.0 . 3.54 2817 2110 B 46 LEU H B 45 TYR HB2 1.0 . 4.09 2818 2110 B 46 LEU H B 45 TYR HBy 1.0 . 4.09 2819 2111 B 54 ILE HD1% B 45 TYR HB2 1.0 . 4.62 2820 2111 B 54 ILE HD1% B 45 TYR HBy 1.0 . 4.62 2821 2112 B 45 TYR HD% B 46 LEU HBx 1.0 . 4.59 2822 2112 B 45 TYR HD% B 46 LEU HBy 1.0 . 4.59 2823 2113 B 45 TYR HD% B 46 LEU HDy% 1.0 . 4.78 2824 2113 B 45 TYR HD% B 46 LEU HDx% 1.0 . 4.78 2825 2114 B 45 TYR HD% B 64 ILE HG1x 1.0 . 4.79 2826 2114 B 45 TYR HD% B 64 ILE HG1y 1.0 . 4.79 2827 2115 B 45 TYR HE% B 46 LEU HDy% 1.0 . 4.37 2828 2115 B 45 TYR HE% B 46 LEU HDx% 1.0 . 4.37 2829 2116 B 45 TYR HE% B 51 PRO HBy 1.0 . 4.56 2830 2116 B 45 TYR HE% B 51 PRO HBx 1.0 . 4.56 2831 2117 B 45 TYR HE% B 64 ILE HG1x 1.0 . 4.64 2832 2117 B 45 TYR HE% B 64 ILE HG1y 1.0 . 4.64 2833 2118 B 45 TYR HE% B 69 ARG HBx 1.0 . 4.65 2834 2118 B 69 ARG HBy B 45 TYR HE% 1.0 . 4.65 2835 2119 B 45 TYR HE% B 69 ARG HGy 1.0 . 4.85 2836 2119 B 45 TYR HE% B 69 ARG HGx 1.0 . 4.85 2837 2120 B 46 LEU H B 46 LEU HBx 1.0 . 3.45 2838 2120 B 46 LEU H B 46 LEU HBy 1.0 . 3.45 2839 2121 B 46 LEU H B 46 LEU HDy% 1.0 . 3.97 2840 2121 B 46 LEU H B 46 LEU HDx% 1.0 . 3.97 2841 2122 B 46 LEU HA B 46 LEU HDy% 1.0 . 4.02 2842 2122 B 46 LEU HA B 46 LEU HDx% 1.0 . 4.02 2843 2123 B 47 LEU H B 46 LEU HBx 1.0 . 4.04 2844 2123 B 47 LEU H B 46 LEU HBy 1.0 . 4.04 2845 2124 B 46 LEU HBx B 47 LEU HDy% 1.0 . 3.91 2846 2124 B 46 LEU HBy B 47 LEU HDy% 1.0 . 3.91 2847 2124 B 47 LEU HDx% B 46 LEU HBx 1.0 . 3.91 2848 2124 B 47 LEU HDx% B 46 LEU HBy 1.0 . 3.91 2849 2125 A 73 MET HE% B 46 LEU HBx 1.0 . 3.91 2850 2125 A 73 MET HE% B 46 LEU HBy 1.0 . 3.91 2851 2126 B 46 LEU HG B 76 LEU HDy% 1.0 . 5.25 2852 2126 B 76 LEU HDx% B 46 LEU HG 1.0 . 5.25 2853 2127 B 47 LEU H B 46 LEU HDy% 1.0 . 4.93 2854 2127 B 47 LEU H B 46 LEU HDx% 1.0 . 4.93 2855 2128 B 46 LEU HDx% B 69 ARG HBx 1.0 . 5.28 2856 2128 B 46 LEU HDy% B 69 ARG HBx 1.0 . 5.28 2857 2128 B 69 ARG HBy B 46 LEU HDy% 1.0 . 5.28 2858 2128 B 69 ARG HBy B 46 LEU HDx% 1.0 . 5.28 2859 2129 B 46 LEU HDy% B 69 ARG HGy 1.0 . 4.17 2860 2129 B 46 LEU HDx% B 69 ARG HGy 1.0 . 4.17 2861 2129 B 69 ARG HGx B 46 LEU HDy% 1.0 . 4.17 2862 2129 B 46 LEU HDx% B 69 ARG HGx 1.0 . 4.17 2863 2130 B 73 MET HA B 46 LEU HDy% 1.0 . 5.40 2864 2130 B 73 MET HA B 46 LEU HDx% 1.0 . 5.40 2865 2131 B 76 LEU HG B 46 LEU HDy% 1.0 . 5.05 2866 2131 B 76 LEU HG B 46 LEU HDx% 1.0 . 5.05 2867 2132 B 46 LEU HDy% B 76 LEU HDy% 1.0 . 3.52 2868 2132 B 46 LEU HDx% B 76 LEU HDy% 1.0 . 3.52 2869 2132 B 76 LEU HDx% B 46 LEU HDy% 1.0 . 3.52 2870 2132 B 76 LEU HDx% B 46 LEU HDx% 1.0 . 3.52 2871 2133 A 73 MET HE% B 46 LEU HDy% 1.0 . 3.63 2872 2133 A 73 MET HE% B 46 LEU HDx% 1.0 . 3.63 2873 2134 B 47 LEU H B 47 LEU HBx 1.0 . 3.47 2874 2134 B 47 LEU H B 47 LEU HBy 1.0 . 3.47 2875 2135 B 47 LEU H B 47 LEU HDy% 1.0 . 3.92 2876 2135 B 47 LEU HDx% B 47 LEU H 1.0 . 3.92 2877 2136 B 47 LEU H A 73 MET HGx 1.0 . 5.34 2878 2136 A 73 MET HGy B 47 LEU H 1.0 . 5.34 2879 2137 B 48 SER H B 47 LEU HBx 1.0 . 4.20 2880 2137 B 48 SER H B 47 LEU HBy 1.0 . 4.20 2881 2138 B 48 SER H B 47 LEU HDy% 1.0 . 5.09 2882 2138 B 47 LEU HDx% B 48 SER H 1.0 . 5.09 2883 2139 A 69 ARG HBx B 47 LEU HDy% 1.0 . 5.28 2884 2139 A 69 ARG HBy B 47 LEU HDy% 1.0 . 5.28 2885 2139 B 47 LEU HDx% A 69 ARG HBx 1.0 . 5.28 2886 2139 A 69 ARG HBy B 47 LEU HDx% 1.0 . 5.28 2887 2140 A 73 MET HGy B 47 LEU HDy% 1.0 . 4.21 2888 2140 A 73 MET HGx B 47 LEU HDy% 1.0 . 4.21 2889 2140 B 47 LEU HDx% A 73 MET HGx 1.0 . 4.21 2890 2140 B 47 LEU HDx% A 73 MET HGy 1.0 . 4.21 2891 2141 A 73 MET HE% B 47 LEU HDy% 1.0 . 3.41 2892 2141 A 73 MET HE% B 47 LEU HDx% 1.0 . 3.41 2893 2142 A 74 GLU H B 47 LEU HDy% 1.0 . 5.25 2894 2142 A 74 GLU H B 47 LEU HDx% 1.0 . 5.25 2895 2143 B 48 SER H B 49 GLY HAy 1.0 . 4.77 2896 2143 B 48 SER H B 49 GLY HAx 1.0 . 4.77 2897 2144 B 50 ASP H B 48 SER HB2 1.0 . 5.34 2898 2144 B 50 ASP H B 48 SER HBy 1.0 . 5.34 2899 2145 B 49 GLY HAx B 69 ARG HDx 1.0 . 4.76 2900 2145 B 49 GLY HAy B 69 ARG HDx 1.0 . 4.76 2901 2145 B 69 ARG HDy B 49 GLY HAy 1.0 . 4.76 2902 2145 B 49 GLY HAx B 69 ARG HDy 1.0 . 4.76 2903 2146 B 53 TYR HD% B 50 ASP HBx 1.0 . 4.35 2904 2146 B 53 TYR HD% B 50 ASP HBy 1.0 . 4.35 2905 2147 B 53 TYR HE% B 50 ASP HBx 1.0 . 3.88 2906 2147 B 53 TYR HE% B 50 ASP HBy 1.0 . 3.88 2907 2148 B 52 ALA H B 51 PRO HBy 1.0 . 4.07 2908 2148 B 52 ALA H B 51 PRO HBx 1.0 . 4.07 2909 2149 B 64 ILE HG2% B 51 PRO HBy 1.0 . 4.18 2910 2149 B 64 ILE HG2% B 51 PRO HBx 1.0 . 4.18 2911 2150 B 65 ARG HA B 51 PRO HBy 1.0 . 4.68 2912 2150 B 65 ARG HA B 51 PRO HBx 1.0 . 4.68 2913 2151 B 51 PRO HBx B 65 ARG HGx 1.0 . 3.84 2914 2151 B 51 PRO HBy B 65 ARG HGx 1.0 . 3.84 2915 2151 B 65 ARG HGy B 51 PRO HBy 1.0 . 3.84 2916 2151 B 51 PRO HBx B 65 ARG HGy 1.0 . 3.84 2917 2152 B 51 PRO HBy B 65 ARG HDx 1.0 . 4.76 2918 2152 B 51 PRO HBx B 65 ARG HDx 1.0 . 4.76 2919 2152 B 65 ARG HDy B 51 PRO HBy 1.0 . 4.76 2920 2152 B 51 PRO HBx B 65 ARG HDy 1.0 . 4.76 2921 2153 B 52 ALA H B 51 PRO HGx 1.0 . 4.24 2922 2153 B 52 ALA H B 51 PRO HGy 1.0 . 4.24 2923 2154 B 51 PRO HGx B 65 ARG HDx 1.0 . 4.76 2924 2154 B 51 PRO HGy B 65 ARG HDx 1.0 . 4.76 2925 2154 B 65 ARG HDy B 51 PRO HGx 1.0 . 4.76 2926 2154 B 65 ARG HDy B 51 PRO HGy 1.0 . 4.76 2927 2155 B 52 ALA H B 51 PRO HDy 1.0 . 4.12 2928 2155 B 52 ALA H B 51 PRO HDx 1.0 . 4.12 2929 2156 B 53 TYR H B 53 TYR HBy 1.0 . 3.69 2930 2156 B 53 TYR H B 53 TYR HBx 1.0 . 3.69 2931 2157 B 54 ILE H B 53 TYR HBy 1.0 . 4.48 2932 2157 B 54 ILE H B 53 TYR HBx 1.0 . 4.48 2933 2158 B 54 ILE H B 54 ILE HG1y 1.0 . 4.14 2934 2158 B 54 ILE H B 54 ILE HG1x 1.0 . 4.14 2935 2159 B 54 ILE HA B 55 PRO HGx 1.0 . 5.11 2936 2159 B 54 ILE HA B 55 PRO HGy 1.0 . 5.11 2937 2160 B 54 ILE HB B 55 PRO HDy 1.0 . 4.97 2938 2160 B 54 ILE HB B 55 PRO HDx 1.0 . 4.97 2939 2161 B 54 ILE HG2% B 55 PRO HDy 1.0 . 4.11 2940 2161 B 54 ILE HG2% B 55 PRO HDx 1.0 . 4.11 2941 2162 B 64 ILE HD1% B 54 ILE HG1y 1.0 . 4.98 2942 2162 B 64 ILE HD1% B 54 ILE HG1x 1.0 . 4.98 2943 2163 B 54 ILE HD1% B 55 PRO HGx 1.0 . 5.23 2944 2163 B 54 ILE HD1% B 55 PRO HGy 1.0 . 5.23 2945 2164 B 54 ILE HD1% B 55 PRO HDy 1.0 . 4.77 2946 2164 B 54 ILE HD1% B 55 PRO HDx 1.0 . 4.77 2947 2165 B 55 PRO HB2 B 57 TYR HBy 1.0 . 4.84 2948 2165 B 55 PRO HB2 B 57 TYR HBx 1.0 . 4.84 2949 2166 B 57 TYR H B 55 PRO HGx 1.0 . 4.89 2950 2166 B 57 TYR H B 55 PRO HGy 1.0 . 4.89 2951 2167 B 56 ARG H B 56 ARG HGy 1.0 . 4.73 2952 2167 B 56 ARG H B 56 ARG HGx 1.0 . 4.73 2953 2168 B 56 ARG H B 56 ARG HD2 1.0 . 4.98 2954 2168 B 56 ARG H B 56 ARG HDy 1.0 . 4.98 2955 2169 B 56 ARG HA B 56 ARG HD2 1.0 . 5.22 2956 2169 B 56 ARG HA B 56 ARG HDy 1.0 . 5.22 2957 2170 B 56 ARG HBy B 56 ARG HD2 1.0 . 3.24 2958 2170 B 56 ARG HBx B 56 ARG HD2 1.0 . 3.24 2959 2170 B 56 ARG HDy B 56 ARG HBy 1.0 . 3.24 2960 2170 B 56 ARG HDy B 56 ARG HBx 1.0 . 3.24 2961 2171 B 57 TYR H B 57 TYR HBy 1.0 . 3.63 2962 2171 B 57 TYR H B 57 TYR HBx 1.0 . 3.63 2963 2172 B 57 TYR HD% B 58 GLN HG2 1.0 . 5.33 2964 2172 B 57 TYR HD% B 58 GLN HGy 1.0 . 5.33 2965 2173 B 57 TYR HE% B 58 GLN HG2 1.0 . 4.27 2966 2173 B 57 TYR HE% B 58 GLN HGy 1.0 . 4.27 2967 2174 B 58 GLN H B 58 GLN HG2 1.0 . 4.74 2968 2174 B 58 GLN H B 58 GLN HGy 1.0 . 4.74 2969 2175 B 59 ASP H B 58 GLN HBy 1.0 . 4.45 2970 2175 B 59 ASP H B 58 GLN HBx 1.0 . 4.45 2971 2176 B 60 ALA H B 58 GLN HBy 1.0 . 4.23 2972 2176 B 60 ALA H B 58 GLN HBx 1.0 . 4.23 2973 2177 B 58 GLN HBx B 63 LEU HDy% 1.0 . 4.85 2974 2177 B 58 GLN HBy B 63 LEU HDy% 1.0 . 4.85 2975 2177 B 63 LEU HDx% B 58 GLN HBy 1.0 . 4.85 2976 2177 B 63 LEU HDx% B 58 GLN HBx 1.0 . 4.85 2977 2178 B 59 ASP H B 58 GLN HG2 1.0 . 4.70 2978 2178 B 59 ASP H B 58 GLN HGy 1.0 . 4.70 2979 2179 B 59 ASP HBy B 63 LEU HDy% 1.0 . 4.04 2980 2179 B 59 ASP HBy B 63 LEU HDx% 1.0 . 4.04 2981 2180 B 59 ASP HBx B 63 LEU HDy% 1.0 . 4.80 2982 2180 B 59 ASP HBx B 63 LEU HDx% 1.0 . 4.80 2983 2181 B 60 ALA HA B 63 LEU HDy% 1.0 . 4.55 2984 2181 B 60 ALA HA B 63 LEU HDx% 1.0 . 4.55 2985 2182 B 62 ASN H B 62 ASN HBy 1.0 . 3.67 2986 2182 B 62 ASN H B 62 ASN HBx 1.0 . 3.67 2987 2183 B 62 ASN H B 62 ASN HD2y 1.0 . 4.72 2988 2183 B 62 ASN H B 62 ASN HD2x 1.0 . 4.72 2989 2184 B 62 ASN H B 63 LEU HDy% 1.0 . 5.44 2990 2184 B 62 ASN H B 63 LEU HDx% 1.0 . 5.44 2991 2185 B 62 ASN HA B 65 ARG HBx 1.0 . 5.04 2992 2185 B 62 ASN HA B 65 ARG HBy 1.0 . 5.04 2993 2186 B 62 ASN HA B 65 ARG HGx 1.0 . 4.32 2994 2186 B 62 ASN HA B 65 ARG HGy 1.0 . 4.32 2995 2187 B 63 LEU H B 62 ASN HBy 1.0 . 3.95 2996 2187 B 63 LEU H B 62 ASN HBx 1.0 . 3.95 2997 2188 B 63 LEU H B 63 LEU HDy% 1.0 . 3.94 2998 2188 B 63 LEU H B 63 LEU HDx% 1.0 . 3.94 2999 2189 B 63 LEU HA B 63 LEU HDy% 1.0 . 3.59 3000 2189 B 63 LEU HA B 63 LEU HDx% 1.0 . 3.59 3001 2190 B 63 LEU HA B 66 ARG HBy 1.0 . 4.74 3002 2190 B 63 LEU HA B 66 ARG HBx 1.0 . 4.74 3003 2191 B 63 LEU HA B 66 ARG HGx 1.0 . 4.79 3004 2191 B 63 LEU HA B 66 ARG HGy 1.0 . 4.79 3005 2192 B 63 LEU HA B 66 ARG HD2 1.0 . 4.75 3006 2192 B 63 LEU HA B 66 ARG HDy 1.0 . 4.75 3007 2193 B 64 ILE H B 63 LEU HDy% 1.0 . 4.48 3008 2193 B 64 ILE H B 63 LEU HDx% 1.0 . 4.48 3009 2194 B 63 LEU HDy% B 66 ARG HGx 1.0 . 4.56 3010 2194 B 63 LEU HDx% B 66 ARG HGx 1.0 . 4.56 3011 2194 B 66 ARG HGy B 63 LEU HDy% 1.0 . 4.56 3012 2194 B 63 LEU HDx% B 66 ARG HGy 1.0 . 4.56 3013 2195 B 63 LEU HDx% B 66 ARG HD2 1.0 . 4.54 3014 2195 B 63 LEU HDy% B 66 ARG HD2 1.0 . 4.54 3015 2195 B 66 ARG HDy B 63 LEU HDy% 1.0 . 4.54 3016 2195 B 63 LEU HDx% B 66 ARG HDy 1.0 . 4.54 3017 2196 B 64 ILE H B 64 ILE HG1x 1.0 . 4.45 3018 2196 B 64 ILE H B 64 ILE HG1y 1.0 . 4.45 3019 2197 B 64 ILE HG2% B 65 ARG HGx 1.0 . 3.95 3020 2197 B 64 ILE HG2% B 65 ARG HGy 1.0 . 3.95 3021 2198 B 64 ILE HG2% B 65 ARG HDx 1.0 . 4.82 3022 2198 B 64 ILE HG2% B 65 ARG HDy 1.0 . 4.82 3023 2199 B 72 ILE HD1% B 64 ILE HG1x 1.0 . 4.39 3024 2199 B 72 ILE HD1% B 64 ILE HG1y 1.0 . 4.39 3025 2200 B 65 ARG H B 65 ARG HBx 1.0 . 3.51 3026 2200 B 65 ARG H B 65 ARG HBy 1.0 . 3.51 3027 2201 B 65 ARG H B 66 ARG HBy 1.0 . 5.34 3028 2201 B 65 ARG H B 66 ARG HBx 1.0 . 5.34 3029 2202 B 66 ARG H B 66 ARG HBy 1.0 . 3.49 3030 2202 B 66 ARG H B 66 ARG HBx 1.0 . 3.49 3031 2203 B 66 ARG H B 66 ARG HD2 1.0 . 5.09 3032 2203 B 66 ARG H B 66 ARG HDy 1.0 . 5.09 3033 2204 B 66 ARG HA B 66 ARG HD2 1.0 . 5.03 3034 2204 B 66 ARG HDy B 66 ARG HA 1.0 . 5.03 3035 2205 B 66 ARG HBy B 66 ARG HD2 1.0 . 3.15 3036 2205 B 66 ARG HBx B 66 ARG HD2 1.0 . 3.15 3037 2205 B 66 ARG HDy B 66 ARG HBy 1.0 . 3.15 3038 2205 B 66 ARG HBx B 66 ARG HDy 1.0 . 3.15 3039 2206 B 68 GLU H B 67 HIS HBy 1.0 . 3.92 3040 2206 B 68 GLU H B 67 HIS HBx 1.0 . 3.92 3041 2207 B 72 ILE HB B 67 HIS HBy 1.0 . 5.34 3042 2207 B 72 ILE HB B 67 HIS HBx 1.0 . 5.34 3043 2208 B 72 ILE HD1% B 67 HIS HBy 1.0 . 4.37 3044 2208 B 72 ILE HD1% B 67 HIS HBx 1.0 . 4.37 3045 2209 B 68 GLU H B 68 GLU HBy 1.0 . 3.58 3046 2209 B 68 GLU H B 68 GLU HBx 1.0 . 3.58 3047 2210 B 68 GLU H B 68 GLU HGx 1.0 . 3.36 3048 2210 B 68 GLU H B 68 GLU HGy 1.0 . 3.36 3049 2211 B 68 GLU H B 71 GLU HBx 1.0 . 4.60 3050 2211 B 68 GLU H B 71 GLU HBy 1.0 . 4.60 3051 2212 B 70 ASP H B 68 GLU HBy 1.0 . 3.98 3052 2212 B 70 ASP H B 68 GLU HBx 1.0 . 3.98 3053 2213 B 70 ASP H B 69 ARG HBx 1.0 . 3.69 3054 2213 B 69 ARG HBy B 70 ASP H 1.0 . 3.69 3055 2214 B 70 ASP H B 70 ASP HB2 1.0 . 3.40 3056 2214 B 70 ASP H B 70 ASP HBy 1.0 . 3.40 3057 2215 B 70 ASP H A 47 LEU HDy% 1.0 . 5.44 3058 2215 A 47 LEU HDx% B 70 ASP H 1.0 . 5.44 3059 2216 B 70 ASP HA B 73 MET HBy 1.0 . 4.87 3060 2216 B 70 ASP HA B 73 MET HB2 1.0 . 4.87 3061 2217 B 70 ASP HA B 73 MET HGx 1.0 . 5.33 3062 2217 B 73 MET HGy B 70 ASP HA 1.0 . 5.33 3063 2218 B 70 ASP HA A 43 VAL HGy% 1.0 . 4.60 3064 2218 A 43 VAL HGx% B 70 ASP HA 1.0 . 4.60 3065 2219 B 70 ASP HA A 47 LEU HDy% 1.0 . 3.81 3066 2219 A 47 LEU HDx% B 70 ASP HA 1.0 . 3.81 3067 2220 B 71 GLU H B 70 ASP HB2 1.0 . 3.74 3068 2220 B 71 GLU H B 70 ASP HBy 1.0 . 3.74 3069 2221 A 43 VAL HGx% B 70 ASP HB2 1.0 . 4.18 3070 2221 A 43 VAL HGy% B 70 ASP HB2 1.0 . 4.18 3071 2221 B 70 ASP HBy A 43 VAL HGy% 1.0 . 4.18 3072 2221 A 43 VAL HGx% B 70 ASP HBy 1.0 . 4.18 3073 2222 A 47 LEU HDx% B 70 ASP HB2 1.0 . 3.94 3074 2222 A 47 LEU HDy% B 70 ASP HB2 1.0 . 3.94 3075 2222 B 70 ASP HBy A 47 LEU HDy% 1.0 . 3.94 3076 2222 A 47 LEU HDx% B 70 ASP HBy 1.0 . 3.94 3077 2223 B 71 GLU H B 71 GLU HBx 1.0 . 3.35 3078 2223 B 71 GLU H B 71 GLU HBy 1.0 . 3.35 3079 2224 B 71 GLU H B 71 GLU HGx 1.0 . 4.66 3080 2224 B 71 GLU H B 71 GLU HGy 1.0 . 4.66 3081 2225 B 72 ILE H B 71 GLU HBx 1.0 . 3.98 3082 2225 B 72 ILE H B 71 GLU HBy 1.0 . 3.98 3083 2226 B 72 ILE HB B 76 LEU HDy% 1.0 . 4.20 3084 2226 B 76 LEU HDx% B 72 ILE HB 1.0 . 4.20 3085 2227 B 72 ILE HG2% B 76 LEU HDy% 1.0 . 3.83 3086 2227 B 76 LEU HDx% B 72 ILE HG2% 1.0 . 3.83 3087 2228 B 73 MET H B 73 MET HBy 1.0 . 3.45 3088 2228 B 73 MET H B 73 MET HB2 1.0 . 3.45 3089 2229 B 73 MET H B 73 MET HGx 1.0 . 4.11 3090 2229 B 73 MET HGy B 73 MET H 1.0 . 4.11 3091 2230 B 73 MET H A 47 LEU HDy% 1.0 . 5.44 3092 2230 A 47 LEU HDx% B 73 MET H 1.0 . 5.44 3093 2231 B 73 MET HA B 76 LEU HDy% 1.0 . 4.35 3094 2231 B 73 MET HA B 76 LEU HDx% 1.0 . 4.35 3095 2232 A 43 VAL HGx% B 73 MET HBy 1.0 . 3.83 3096 2232 A 43 VAL HGy% B 73 MET HBy 1.0 . 3.83 3097 2232 B 73 MET HB2 A 43 VAL HGy% 1.0 . 3.83 3098 2232 A 43 VAL HGx% B 73 MET HB2 1.0 . 3.83 3099 2233 A 43 VAL HGx% B 73 MET HBy 1.0 . 6.22 3100 2234 A 43 VAL HGy% B 73 MET HBy 1.0 . 6.22 3101 2235 A 47 LEU HDx% B 73 MET HBy 1.0 . 4.84 3102 2235 A 47 LEU HDy% B 73 MET HBy 1.0 . 4.84 3103 2235 B 73 MET HB2 A 47 LEU HDy% 1.0 . 4.84 3104 2235 A 47 LEU HDx% B 73 MET HB2 1.0 . 4.84 3105 2236 B 74 GLU H B 73 MET HGx 1.0 . 4.72 3106 2236 B 73 MET HGy B 74 GLU H 1.0 . 4.72 3107 2237 A 47 LEU HG B 73 MET HGx 1.0 . 4.87 3108 2237 A 47 LEU HG B 73 MET HGy 1.0 . 4.87 3109 2238 B 74 GLU HA A 43 VAL HGy% 1.0 . 4.18 3110 2238 B 74 GLU HA A 43 VAL HGx% 1.0 . 4.18 3111 2239 B 75 GLU H B 74 GLU HBx 1.0 . 3.85 3112 2239 B 74 GLU HBy B 75 GLU H 1.0 . 3.85 3113 2240 B 78 LYS HGy B 74 GLU HBx 1.0 . 5.13 3114 2240 B 74 GLU HBy B 78 LYS HGy 1.0 . 5.13 3115 2241 A 39 ILE HG2% B 74 GLU HBx 1.0 . 4.33 3116 2241 A 39 ILE HG2% B 74 GLU HBy 1.0 . 4.33 3117 2242 A 43 VAL HGy% B 74 GLU HGx 1.0 . 4.64 3118 2242 A 43 VAL HGx% B 74 GLU HGx 1.0 . 4.64 3119 2242 B 74 GLU HGy A 43 VAL HGy% 1.0 . 4.64 3120 2242 B 74 GLU HGy A 43 VAL HGx% 1.0 . 4.64 3121 2243 B 75 GLU H B 75 GLU HBx 1.0 . 3.31 3122 2243 B 75 GLU H B 75 GLU HBy 1.0 . 3.31 3123 2244 B 75 GLU H B 75 GLU HGx 1.0 . 5.34 3124 2244 B 75 GLU H B 75 GLU HGy 1.0 . 5.34 3125 2245 B 77 THR H B 75 GLU HBx 1.0 . 4.83 3126 2245 B 77 THR H B 75 GLU HBy 1.0 . 4.83 3127 2246 B 75 GLU HGy B 76 LEU HDy% 1.0 . 4.76 3128 2246 B 75 GLU HGx B 76 LEU HDy% 1.0 . 4.76 3129 2246 B 76 LEU HDx% B 75 GLU HGx 1.0 . 4.76 3130 2246 B 76 LEU HDx% B 75 GLU HGy 1.0 . 4.76 3131 2247 A 80 TYR HE% B 75 GLU HGx 1.0 . 4.29 3132 2247 A 80 TYR HE% B 75 GLU HGy 1.0 . 4.29 3133 2248 B 76 LEU H B 76 LEU HDy% 1.0 . 4.08 3134 2248 B 76 LEU HDx% B 76 LEU H 1.0 . 4.08 3135 2249 B 76 LEU HA B 76 LEU HDy% 1.0 . 3.91 3136 2249 B 76 LEU HDx% B 76 LEU HA 1.0 . 3.91 3137 2250 B 76 LEU HA A 80 TYR HBy 1.0 . 5.00 3138 2250 A 80 TYR HBx B 76 LEU HA 1.0 . 5.00 3139 2251 B 77 THR H B 76 LEU HDy% 1.0 . 4.94 3140 2251 B 77 THR H B 76 LEU HDx% 1.0 . 4.94 3141 2252 A 73 MET HE% B 76 LEU HDy% 1.0 . 3.63 3142 2252 A 73 MET HE% B 76 LEU HDx% 1.0 . 3.63 3143 2253 A 77 THR H B 76 LEU HDy% 1.0 . 4.92 3144 2253 A 77 THR H B 76 LEU HDx% 1.0 . 4.92 3145 2254 A 77 THR HB B 76 LEU HDy% 1.0 . 5.44 3146 2254 A 77 THR HB B 76 LEU HDx% 1.0 . 5.44 3147 2255 A 80 TYR H B 76 LEU HDy% 1.0 . 5.12 3148 2255 A 80 TYR H B 76 LEU HDx% 1.0 . 5.12 3149 2256 A 80 TYR HD% B 76 LEU HDy% 1.0 . 4.66 3150 2256 A 80 TYR HD% B 76 LEU HDx% 1.0 . 4.66 3151 2257 B 77 THR HA A 76 LEU HDy% 1.0 . 3.92 3152 2257 A 76 LEU HDx% B 77 THR HA 1.0 . 3.92 3153 2258 B 77 THR HB A 43 VAL HGy% 1.0 . 4.81 3154 2258 A 43 VAL HGx% B 77 THR HB 1.0 . 4.81 3155 2259 B 77 THR HG2% B 81 LEU HDy% 1.0 . 3.78 3156 2259 B 77 THR HG2% B 81 LEU HDx% 1.0 . 3.78 3157 2260 B 77 THR HG2% A 24 LEU HDy% 1.0 . 5.21 3158 2260 B 77 THR HG2% A 24 LEU HDx% 1.0 . 5.21 3159 2261 B 77 THR HG2% A 43 VAL HGy% 1.0 . 4.35 3160 2261 B 77 THR HG2% A 43 VAL HGx% 1.0 . 4.35 3161 2262 B 77 THR HG2% A 76 LEU HDy% 1.0 . 4.18 3162 2262 B 77 THR HG2% A 76 LEU HDx% 1.0 . 4.18 3163 2263 B 78 LYS H B 78 LYS HB2 1.0 . 3.54 3164 2263 B 78 LYS H B 78 LYS HBy 1.0 . 3.54 3165 2264 B 78 LYS H B 78 LYS HE2 1.0 . 5.34 3166 2264 B 78 LYS H B 78 LYS HEy 1.0 . 5.34 3167 2265 B 78 LYS HA B 81 LEU HDy% 1.0 . 4.60 3168 2265 B 78 LYS HA B 81 LEU HDx% 1.0 . 4.60 3169 2266 B 78 LYS HB2 B 78 LYS HE2 1.0 . 4.34 3170 2266 B 78 LYS HBy B 78 LYS HE2 1.0 . 4.34 3171 2266 B 78 LYS HEy B 78 LYS HB2 1.0 . 4.34 3172 2266 B 78 LYS HBy B 78 LYS HEy 1.0 . 4.34 3173 2267 B 79 TYR H B 78 LYS HB2 1.0 . 4.05 3174 2267 B 79 TYR H B 78 LYS HBy 1.0 . 4.05 3175 2268 B 88 ILE HD1% B 78 LYS HB2 1.0 . 4.35 3176 2268 B 88 ILE HD1% B 78 LYS HBy 1.0 . 4.35 3177 2269 A 39 ILE HD1% B 78 LYS HB2 1.0 . 4.57 3178 2269 A 39 ILE HD1% B 78 LYS HBy 1.0 . 4.57 3179 2270 B 78 LYS HGx B 78 LYS HE2 1.0 . 3.40 3180 2270 B 78 LYS HGx B 78 LYS HEy 1.0 . 3.40 3181 2271 A 39 ILE HD1% B 78 LYS HDx 1.0 . 3.95 3182 2271 A 39 ILE HD1% B 78 LYS HDy 1.0 . 3.95 3183 2272 B 88 ILE HG2% B 78 LYS HE2 1.0 . 4.08 3184 2272 B 88 ILE HG2% B 78 LYS HEy 1.0 . 4.08 3185 2273 B 88 ILE HD1% B 78 LYS HE2 1.0 . 5.02 3186 2273 B 88 ILE HD1% B 78 LYS HEy 1.0 . 5.02 3187 2274 A 39 ILE HG2% B 78 LYS HE2 1.0 . 5.16 3188 2274 A 39 ILE HG2% B 78 LYS HEy 1.0 . 5.16 3189 2275 A 39 ILE HD1% B 78 LYS HE2 1.0 . 5.32 3190 2275 A 39 ILE HD1% B 78 LYS HEy 1.0 . 5.32 3191 2276 B 79 TYR H B 79 TYR HBy 1.0 . 3.59 3192 2276 B 79 TYR H B 79 TYR HBx 1.0 . 3.59 3193 2277 B 80 TYR H B 79 TYR HBy 1.0 . 3.99 3194 2277 B 80 TYR H B 79 TYR HBx 1.0 . 3.99 3195 2278 B 82 ALA HB% B 79 TYR HBy 1.0 . 4.88 3196 2278 B 82 ALA HB% B 79 TYR HBx 1.0 . 4.88 3197 2279 A 80 TYR HD% B 79 TYR HBy 1.0 . 4.02 3198 2279 A 80 TYR HD% B 79 TYR HBx 1.0 . 4.02 3199 2280 A 80 TYR HE% B 79 TYR HBy 1.0 . 4.31 3200 2280 A 80 TYR HE% B 79 TYR HBx 1.0 . 4.31 3201 2281 B 79 TYR HD% A 83 ASN HBy 1.0 . 5.34 3202 2281 B 79 TYR HD% A 83 ASN HBx 1.0 . 5.34 3203 2282 B 80 TYR H B 80 TYR HBy 1.0 . 3.54 3204 2282 B 80 TYR HBx B 80 TYR H 1.0 . 3.54 3205 2283 B 81 LEU H B 80 TYR HBy 1.0 . 4.23 3206 2283 B 80 TYR HBx B 81 LEU H 1.0 . 4.23 3207 2284 A 76 LEU HDx% B 80 TYR HBy 1.0 . 4.68 3208 2284 A 76 LEU HDy% B 80 TYR HBy 1.0 . 4.68 3209 2284 B 80 TYR HBx A 76 LEU HDy% 1.0 . 4.68 3210 2284 A 76 LEU HDx% B 80 TYR HBx 1.0 . 4.68 3211 2285 B 80 TYR HD% B 81 LEU HDy% 1.0 . 4.21 3212 2285 B 80 TYR HD% B 81 LEU HDx% 1.0 . 4.21 3213 2286 B 80 TYR HE% A 76 LEU HDy% 1.0 . 5.44 3214 2286 B 80 TYR HE% A 76 LEU HDx% 1.0 . 5.44 3215 2287 B 81 LEU H B 81 LEU HDy% 1.0 . 4.19 3216 2287 B 81 LEU HDx% B 81 LEU H 1.0 . 4.19 3217 2288 B 81 LEU HA B 81 LEU HDy% 1.0 . 3.72 3218 2288 B 81 LEU HDx% B 81 LEU HA 1.0 . 3.72 3219 2289 B 82 ALA H B 81 LEU HBx 1.0 . 4.18 3220 2289 B 82 ALA H B 81 LEU HBy 1.0 . 4.18 3221 2290 B 84 HIS H B 81 LEU HBx 1.0 . 4.71 3222 2290 B 84 HIS H B 81 LEU HBy 1.0 . 4.71 3223 2291 B 86 ILE HB B 81 LEU HBx 1.0 . 5.34 3224 2291 B 86 ILE HB B 81 LEU HBy 1.0 . 5.34 3225 2292 B 82 ALA H B 81 LEU HDy% 1.0 . 4.52 3226 2292 B 81 LEU HDx% B 82 ALA H 1.0 . 4.52 3227 2293 B 86 ILE HB B 81 LEU HDy% 1.0 . 5.44 3228 2293 B 81 LEU HDx% B 86 ILE HB 1.0 . 5.44 3229 2294 B 86 ILE HG2% B 81 LEU HDy% 1.0 . 4.30 3230 2294 B 81 LEU HDx% B 86 ILE HG2% 1.0 . 4.30 3231 2295 B 86 ILE HD1% B 81 LEU HDy% 1.0 . 4.37 3232 2295 B 86 ILE HD1% B 81 LEU HDx% 1.0 . 4.37 3233 2296 A 28 TYR HE% B 81 LEU HDy% 1.0 . 4.02 3234 2296 A 28 TYR HE% B 81 LEU HDx% 1.0 . 4.02 3235 2297 A 39 ILE HD1% B 81 LEU HDy% 1.0 . 3.37 3236 2297 A 39 ILE HD1% B 81 LEU HDx% 1.0 . 3.37 3237 2298 B 82 ALA HB% B 83 ASN HD2y 1.0 . 5.09 3238 2298 B 82 ALA HB% B 83 ASN HD2x 1.0 . 5.09 3239 2299 B 83 ASN H B 83 ASN HBy 1.0 . 3.69 3240 2299 B 83 ASN HBx B 83 ASN H 1.0 . 3.69 3241 2300 B 83 ASN H B 83 ASN HD2y 1.0 . 4.14 3242 2300 B 83 ASN H B 83 ASN HD2x 1.0 . 4.14 3243 2301 A 79 TYR HE% B 83 ASN HBy 1.0 . 3.77 3244 2301 A 79 TYR HE% B 83 ASN HBx 1.0 . 3.77 3245 2302 B 84 HIS H B 85 GLY HAy 1.0 . 5.34 3246 2302 B 84 HIS H B 85 GLY HAx 1.0 . 5.34 3247 2303 B 86 ILE HB B 88 ILE HG1x 1.0 . 5.34 3248 2303 B 86 ILE HB B 88 ILE HG1y 1.0 . 5.34 3249 2304 B 86 ILE HG2% B 88 ILE HG1x 1.0 . 4.33 3250 2304 B 86 ILE HG2% B 88 ILE HG1y 1.0 . 4.33 3251 2305 B 88 ILE H B 88 ILE HG1x 1.0 . 3.76 3252 2305 B 88 ILE H B 88 ILE HG1y 1.0 . 3.76 3253 2306 B 89 LYS H B 89 LYS HBy 1.0 . 3.55 3254 2306 B 89 LYS H B 89 LYS HBx 1.0 . 3.55 3255 2307 B 89 LYS H B 89 LYS HG2 1.0 . 3.91 3256 2307 B 89 LYS H B 89 LYS HGy 1.0 . 3.91 3257 2308 B 89 LYS H B 89 LYS HD2 1.0 . 5.34 3258 2308 B 89 LYS H B 89 LYS HDy 1.0 . 5.34 3259 2309 B 89 LYS HA B 89 LYS HD2 1.0 . 4.70 3260 2309 B 89 LYS HA B 89 LYS HDy 1.0 . 4.70 3261 2310 B 89 LYS HD2 B 89 LYS HG2 1.0 . 2.35 3262 2310 B 89 LYS HDy B 89 LYS HG2 1.0 . 2.35 3263 2310 B 89 LYS HGy B 89 LYS HD2 1.0 . 2.35 3264 2310 B 89 LYS HGy B 89 LYS HDy 1.0 . 2.35 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 18 LYS C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -73.0 -53.0 PHI 2 2 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 ILE N 1.0 -48.0 -28.0 PSI 3 3 A 19 ALA C A 20 ILE N A 20 ILE CA A 20 ILE C 1.0 -73.0 -53.0 PHI 4 4 A 20 ILE N A 20 ILE CA A 20 ILE C A 21 SER N 1.0 -53.0 -33.0 PSI 5 5 A 20 ILE C A 21 SER N A 21 SER CA A 21 SER C 1.0 -75.0 -55.0 PHI 6 6 A 21 SER N A 21 SER CA A 21 SER C A 22 GLU N 1.0 -51.0 -31.0 PSI 7 7 A 21 SER C A 22 GLU N A 22 GLU CA A 22 GLU C 1.0 -75.0 -55.0 PHI 8 8 A 22 GLU N A 22 GLU CA A 22 GLU C A 23 THR N 1.0 -48.0 -28.0 PSI 9 9 A 22 GLU C A 23 THR N A 23 THR CA A 23 THR C 1.0 -75.0 -55.0 PHI 10 10 A 23 THR N A 23 THR CA A 23 THR C A 24 LEU N 1.0 -52.0 -32.0 PSI 11 11 A 23 THR C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -73.0 -53.0 PHI 12 12 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 GLU N 1.0 -50.0 -30.0 PSI 13 13 A 24 LEU C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -74.0 -54.0 PHI 14 14 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 THR N 1.0 -48.0 -28.0 PSI 15 15 A 25 GLU C A 26 THR N A 26 THR CA A 26 THR C 1.0 -73.0 -53.0 PHI 16 16 A 26 THR N A 26 THR CA A 26 THR C A 27 VAL N 1.0 -56.0 -36.0 PSI 17 17 A 26 THR C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -74.0 -54.0 PHI 18 18 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 TYR N 1.0 -53.0 -33.0 PSI 19 19 A 27 VAL C A 28 TYR N A 28 TYR CA A 28 TYR C 1.0 -69.0 -49.0 PHI 20 20 A 28 TYR N A 28 TYR CA A 28 TYR C A 29 ARG N 1.0 -55.0 -35.0 PSI 21 21 A 28 TYR C A 29 ARG N A 29 ARG CA A 29 ARG C 1.0 -70.0 -50.0 PHI 22 22 A 29 ARG N A 29 ARG CA A 29 ARG C A 30 ALA N 1.0 -51.0 -31.0 PSI 23 23 A 29 ARG C A 30 ALA N A 30 ALA CA A 30 ALA C 1.0 -71.0 -51.0 PHI 24 24 A 30 ALA N A 30 ALA CA A 30 ALA C A 31 LEU N 1.0 -56.0 -36.0 PSI 25 25 A 30 ALA C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -73.0 -53.0 PHI 26 26 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 GLU N 1.0 -50.0 -30.0 PSI 27 27 A 31 LEU C A 32 GLU N A 32 GLU CA A 32 GLU C 1.0 -76.0 -56.0 PHI 28 28 A 32 GLU N A 32 GLU CA A 32 GLU C A 33 GLU N 1.0 -49.0 -29.0 PSI 29 29 A 32 GLU C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -75.0 -55.0 PHI 30 30 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 LYS N 1.0 -45.0 -25.0 PSI 31 31 A 33 GLU C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -96.0 -76.0 PHI 32 32 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 GLY N 1.0 -9.0 13.0 PSI 33 33 A 34 LYS C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 63.0 99.0 PHI 34 34 A 35 GLY N A 35 GLY CA A 35 GLY C A 36 TYR N 1.0 -2.0 38.0 PSI 35 35 A 38 PRO N A 38 PRO CA A 38 PRO C A 39 ILE N 1.0 -40.0 -32.0 PSI 36 36 A 38 PRO C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 -78.0 -56.0 PHI 37 37 A 39 ILE N A 39 ILE CA A 39 ILE C A 40 ASN N 1.0 -47.0 -25.0 PSI 38 38 A 39 ILE C A 40 ASN N A 40 ASN CA A 40 ASN C 1.0 -70.0 -50.0 PHI 39 39 A 40 ASN N A 40 ASN CA A 40 ASN C A 41 GLN N 1.0 -52.0 -32.0 PSI 40 40 A 40 ASN C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -73.0 -53.0 PHI 41 41 A 41 GLN N A 41 GLN CA A 41 GLN C A 42 ILE N 1.0 -54.0 -34.0 PSI 42 42 A 41 GLN C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -73.0 -53.0 PHI 43 43 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 VAL N 1.0 -56.0 -36.0 PSI 44 44 A 42 ILE C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -71.0 -51.0 PHI 45 45 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 GLY N 1.0 -56.0 -36.0 PSI 46 46 A 43 VAL C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 -74.0 -54.0 PHI 47 47 A 44 GLY N A 44 GLY CA A 44 GLY C A 45 TYR N 1.0 -52.0 -32.0 PSI 48 48 A 44 GLY C A 45 TYR N A 45 TYR CA A 45 TYR C 1.0 -73.0 -53.0 PHI 49 49 A 45 TYR N A 45 TYR CA A 45 TYR C A 46 LEU N 1.0 -55.0 -35.0 PSI 50 50 A 45 TYR C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 -68.0 -48.0 PHI 51 51 A 46 LEU N A 46 LEU CA A 46 LEU C A 47 LEU N 1.0 -56.0 -36.0 PSI 52 52 A 47 LEU C A 48 SER N A 48 SER CA A 48 SER C 1.0 -128.0 -92.0 PHI 53 53 A 48 SER N A 48 SER CA A 48 SER C A 49 GLY N 1.0 -24.0 -4.0 PSI 54 54 A 51 PRO N A 51 PRO CA A 51 PRO C A 52 ALA N 1.0 -42.0 -26.0 PSI 55 55 A 51 PRO C A 52 ALA N A 52 ALA CA A 52 ALA C 1.0 -77.0 -57.0 PHI 56 56 A 52 ALA N A 52 ALA CA A 52 ALA C A 53 TYR N 1.0 -43.0 -13.0 PSI 57 57 A 52 ALA C A 53 TYR N A 53 TYR CA A 53 TYR C 1.0 -89.0 -67.0 PHI 58 58 A 53 TYR N A 53 TYR CA A 53 TYR C A 54 ILE N 1.0 -31.0 -7.0 PSI 59 59 A 55 PRO N A 55 PRO CA A 55 PRO C A 56 ARG N 1.0 139.0 163.0 PSI 60 60 A 58 GLN C A 59 ASP N A 59 ASP CA A 59 ASP C 1.0 -86.0 -56.0 PHI 61 61 A 59 ASP N A 59 ASP CA A 59 ASP C A 60 ALA N 1.0 -46.0 -14.0 PSI 62 62 A 59 ASP C A 60 ALA N A 60 ALA CA A 60 ALA C 1.0 -70.0 -50.0 PHI 63 63 A 60 ALA N A 60 ALA CA A 60 ALA C A 61 ARG N 1.0 -53.0 -31.0 PSI 64 64 A 60 ALA C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -73.0 -53.0 PHI 65 65 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 ASN N 1.0 -55.0 -35.0 PSI 66 66 A 61 ARG C A 62 ASN N A 62 ASN CA A 62 ASN C 1.0 -75.0 -55.0 PHI 67 67 A 62 ASN N A 62 ASN CA A 62 ASN C A 63 LEU N 1.0 -51.0 -31.0 PSI 68 68 A 62 ASN C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -75.0 -55.0 PHI 69 69 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 ILE N 1.0 -49.0 -29.0 PSI 70 70 A 63 LEU C A 64 ILE N A 64 ILE CA A 64 ILE C 1.0 -79.0 -59.0 PHI 71 71 A 64 ILE N A 64 ILE CA A 64 ILE C A 65 ARG N 1.0 -34.0 -12.0 PSI 72 72 A 65 ARG C A 66 ARG N A 66 ARG CA A 66 ARG C 1.0 -108.0 -78.0 PHI 73 73 A 66 ARG N A 66 ARG CA A 66 ARG C A 67 HIS N 1.0 -39.0 9.0 PSI 74 74 A 70 ASP C A 71 GLU N A 71 GLU CA A 71 GLU C 1.0 -74.0 -54.0 PHI 75 75 A 71 GLU N A 71 GLU CA A 71 GLU C A 72 ILE N 1.0 -55.0 -35.0 PSI 76 76 A 71 GLU C A 72 ILE N A 72 ILE CA A 72 ILE C 1.0 -74.0 -54.0 PHI 77 77 A 72 ILE N A 72 ILE CA A 72 ILE C A 73 MET N 1.0 -54.0 -34.0 PSI 78 78 A 72 ILE C A 73 MET N A 73 MET CA A 73 MET C 1.0 -73.0 -53.0 PHI 79 79 A 73 MET N A 73 MET CA A 73 MET C A 74 GLU N 1.0 -51.0 -29.0 PSI 80 80 A 73 MET C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -78.0 -58.0 PHI 81 81 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 GLU N 1.0 -51.0 -31.0 PSI 82 82 A 74 GLU C A 75 GLU N A 75 GLU CA A 75 GLU C 1.0 -71.0 -51.0 PHI 83 83 A 75 GLU N A 75 GLU CA A 75 GLU C A 76 LEU N 1.0 -54.0 -34.0 PSI 84 84 A 75 GLU C A 76 LEU N A 76 LEU CA A 76 LEU C 1.0 -72.0 -52.0 PHI 85 85 A 76 LEU N A 76 LEU CA A 76 LEU C A 77 THR N 1.0 -49.0 -29.0 PSI 86 86 A 76 LEU C A 77 THR N A 77 THR CA A 77 THR C 1.0 -78.0 -58.0 PHI 87 87 A 77 THR N A 77 THR CA A 77 THR C A 78 LYS N 1.0 -51.0 -31.0 PSI 88 88 A 77 THR C A 78 LYS N A 78 LYS CA A 78 LYS C 1.0 -71.0 -51.0 PHI 89 89 A 78 LYS N A 78 LYS CA A 78 LYS C A 79 TYR N 1.0 -54.0 -34.0 PSI 90 90 A 78 LYS C A 79 TYR N A 79 TYR CA A 79 TYR C 1.0 -73.0 -53.0 PHI 91 91 A 79 TYR N A 79 TYR CA A 79 TYR C A 80 TYR N 1.0 -53.0 -33.0 PSI 92 92 A 79 TYR C A 80 TYR N A 80 TYR CA A 80 TYR C 1.0 -72.0 -52.0 PHI 93 93 A 80 TYR N A 80 TYR CA A 80 TYR C A 81 LEU N 1.0 -54.0 -34.0 PSI 94 94 A 80 TYR C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -72.0 -52.0 PHI 95 95 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 ALA N 1.0 -47.0 -25.0 PSI 96 96 A 81 LEU C A 82 ALA N A 82 ALA CA A 82 ALA C 1.0 -72.0 -52.0 PHI 97 97 A 82 ALA N A 82 ALA CA A 82 ALA C A 83 ASN N 1.0 -47.0 -25.0 PSI 98 98 A 82 ALA C A 83 ASN N A 83 ASN CA A 83 ASN C 1.0 -87.0 -61.0 PHI 99 99 A 83 ASN N A 83 ASN CA A 83 ASN C A 84 HIS N 1.0 -30.0 4.0 PSI 100 100 A 84 HIS C A 85 GLY N A 85 GLY CA A 85 GLY C 1.0 69.0 103.0 PHI 101 101 A 85 GLY N A 85 GLY CA A 85 GLY C A 86 ILE N 1.0 -4.0 22.0 PSI 102 102 A 85 GLY C A 86 ILE N A 86 ILE CA A 86 ILE C 1.0 -100.0 -72.0 PHI 103 103 A 86 ILE N A 86 ILE CA A 86 ILE C A 87 ASP N 1.0 118.0 146.0 PSI 104 104 A 86 ILE C A 87 ASP N A 87 ASP CA A 87 ASP C 1.0 -102.0 -68.0 PHI 105 105 A 87 ASP N A 87 ASP CA A 87 ASP C A 88 ILE N 1.0 120.0 150.0 PSI 106 106 A 87 ASP C A 88 ILE N A 88 ILE CA A 88 ILE C 1.0 -124.0 -90.0 PHI 107 107 A 88 ILE N A 88 ILE CA A 88 ILE C A 89 LYS N 1.0 111.0 149.0 PSI 108 108 B 18 LYS C B 19 ALA N B 19 ALA CA B 19 ALA C 1.0 -73.0 -53.0 PHI 109 109 B 19 ALA N B 19 ALA CA B 19 ALA C B 20 ILE N 1.0 -48.0 -28.0 PSI 110 110 B 19 ALA C B 20 ILE N B 20 ILE CA B 20 ILE C 1.0 -73.0 -53.0 PHI 111 111 B 20 ILE N B 20 ILE CA B 20 ILE C B 21 SER N 1.0 -53.0 -33.0 PSI 112 112 B 20 ILE C B 21 SER N B 21 SER CA B 21 SER C 1.0 -75.0 -55.0 PHI 113 113 B 21 SER N B 21 SER CA B 21 SER C B 22 GLU N 1.0 -51.0 -31.0 PSI 114 114 B 21 SER C B 22 GLU N B 22 GLU CA B 22 GLU C 1.0 -75.0 -55.0 PHI 115 115 B 22 GLU N B 22 GLU CA B 22 GLU C B 23 THR N 1.0 -48.0 -28.0 PSI 116 116 B 22 GLU C B 23 THR N B 23 THR CA B 23 THR C 1.0 -75.0 -55.0 PHI 117 117 B 23 THR N B 23 THR CA B 23 THR C B 24 LEU N 1.0 -52.0 -32.0 PSI 118 118 B 23 THR C B 24 LEU N B 24 LEU CA B 24 LEU C 1.0 -73.0 -53.0 PHI 119 119 B 24 LEU N B 24 LEU CA B 24 LEU C B 25 GLU N 1.0 -50.0 -30.0 PSI 120 120 B 24 LEU C B 25 GLU N B 25 GLU CA B 25 GLU C 1.0 -74.0 -54.0 PHI 121 121 B 25 GLU N B 25 GLU CA B 25 GLU C B 26 THR N 1.0 -48.0 -28.0 PSI 122 122 B 25 GLU C B 26 THR N B 26 THR CA B 26 THR C 1.0 -73.0 -53.0 PHI 123 123 B 26 THR N B 26 THR CA B 26 THR C B 27 VAL N 1.0 -56.0 -36.0 PSI 124 124 B 26 THR C B 27 VAL N B 27 VAL CA B 27 VAL C 1.0 -74.0 -54.0 PHI 125 125 B 27 VAL N B 27 VAL CA B 27 VAL C B 28 TYR N 1.0 -53.0 -33.0 PSI 126 126 B 27 VAL C B 28 TYR N B 28 TYR CA B 28 TYR C 1.0 -69.0 -49.0 PHI 127 127 B 28 TYR N B 28 TYR CA B 28 TYR C B 29 ARG N 1.0 -55.0 -35.0 PSI 128 128 B 28 TYR C B 29 ARG N B 29 ARG CA B 29 ARG C 1.0 -70.0 -50.0 PHI 129 129 B 29 ARG N B 29 ARG CA B 29 ARG C B 30 ALA N 1.0 -51.0 -31.0 PSI 130 130 B 29 ARG C B 30 ALA N B 30 ALA CA B 30 ALA C 1.0 -71.0 -51.0 PHI 131 131 B 30 ALA N B 30 ALA CA B 30 ALA C B 31 LEU N 1.0 -56.0 -36.0 PSI 132 132 B 30 ALA C B 31 LEU N B 31 LEU CA B 31 LEU C 1.0 -73.0 -53.0 PHI 133 133 B 31 LEU N B 31 LEU CA B 31 LEU C B 32 GLU N 1.0 -50.0 -30.0 PSI 134 134 B 31 LEU C B 32 GLU N B 32 GLU CA B 32 GLU C 1.0 -76.0 -56.0 PHI 135 135 B 32 GLU N B 32 GLU CA B 32 GLU C B 33 GLU N 1.0 -49.0 -29.0 PSI 136 136 B 32 GLU C B 33 GLU N B 33 GLU CA B 33 GLU C 1.0 -75.0 -55.0 PHI 137 137 B 33 GLU N B 33 GLU CA B 33 GLU C B 34 LYS N 1.0 -45.0 -25.0 PSI 138 138 B 33 GLU C B 34 LYS N B 34 LYS CA B 34 LYS C 1.0 -96.0 -76.0 PHI 139 139 B 34 LYS N B 34 LYS CA B 34 LYS C B 35 GLY N 1.0 -9.0 13.0 PSI 140 140 B 34 LYS C B 35 GLY N B 35 GLY CA B 35 GLY C 1.0 63.0 99.0 PHI 141 141 B 35 GLY N B 35 GLY CA B 35 GLY C B 36 TYR N 1.0 -2.0 38.0 PSI 142 142 B 38 PRO N B 38 PRO CA B 38 PRO C B 39 ILE N 1.0 -40.0 -32.0 PSI 143 143 B 38 PRO C B 39 ILE N B 39 ILE CA B 39 ILE C 1.0 -78.0 -56.0 PHI 144 144 B 39 ILE N B 39 ILE CA B 39 ILE C B 40 ASN N 1.0 -47.0 -25.0 PSI 145 145 B 39 ILE C B 40 ASN N B 40 ASN CA B 40 ASN C 1.0 -70.0 -50.0 PHI 146 146 B 40 ASN N B 40 ASN CA B 40 ASN C B 41 GLN N 1.0 -52.0 -32.0 PSI 147 147 B 40 ASN C B 41 GLN N B 41 GLN CA B 41 GLN C 1.0 -73.0 -53.0 PHI 148 148 B 41 GLN N B 41 GLN CA B 41 GLN C B 42 ILE N 1.0 -54.0 -34.0 PSI 149 149 B 41 GLN C B 42 ILE N B 42 ILE CA B 42 ILE C 1.0 -73.0 -53.0 PHI 150 150 B 42 ILE N B 42 ILE CA B 42 ILE C B 43 VAL N 1.0 -56.0 -36.0 PSI 151 151 B 42 ILE C B 43 VAL N B 43 VAL CA B 43 VAL C 1.0 -71.0 -51.0 PHI 152 152 B 43 VAL N B 43 VAL CA B 43 VAL C B 44 GLY N 1.0 -56.0 -36.0 PSI 153 153 B 43 VAL C B 44 GLY N B 44 GLY CA B 44 GLY C 1.0 -74.0 -54.0 PHI 154 154 B 44 GLY N B 44 GLY CA B 44 GLY C B 45 TYR N 1.0 -52.0 -32.0 PSI 155 155 B 44 GLY C B 45 TYR N B 45 TYR CA B 45 TYR C 1.0 -73.0 -53.0 PHI 156 156 B 45 TYR N B 45 TYR CA B 45 TYR C B 46 LEU N 1.0 -55.0 -35.0 PSI 157 157 B 45 TYR C B 46 LEU N B 46 LEU CA B 46 LEU C 1.0 -68.0 -48.0 PHI 158 158 B 46 LEU N B 46 LEU CA B 46 LEU C B 47 LEU N 1.0 -56.0 -36.0 PSI 159 159 B 47 LEU C B 48 SER N B 48 SER CA B 48 SER C 1.0 -128.0 -92.0 PHI 160 160 B 48 SER N B 48 SER CA B 48 SER C B 49 GLY N 1.0 -24.0 -4.0 PSI 161 161 B 51 PRO N B 51 PRO CA B 51 PRO C B 52 ALA N 1.0 -42.0 -26.0 PSI 162 162 B 51 PRO C B 52 ALA N B 52 ALA CA B 52 ALA C 1.0 -77.0 -57.0 PHI 163 163 B 52 ALA N B 52 ALA CA B 52 ALA C B 53 TYR N 1.0 -43.0 -13.0 PSI 164 164 B 52 ALA C B 53 TYR N B 53 TYR CA B 53 TYR C 1.0 -89.0 -67.0 PHI 165 165 B 53 TYR N B 53 TYR CA B 53 TYR C B 54 ILE N 1.0 -31.0 -7.0 PSI 166 166 B 55 PRO N B 55 PRO CA B 55 PRO C B 56 ARG N 1.0 139.0 163.0 PSI 167 167 B 58 GLN C B 59 ASP N B 59 ASP CA B 59 ASP C 1.0 -86.0 -56.0 PHI 168 168 B 59 ASP N B 59 ASP CA B 59 ASP C B 60 ALA N 1.0 -46.0 -14.0 PSI 169 169 B 59 ASP C B 60 ALA N B 60 ALA CA B 60 ALA C 1.0 -70.0 -50.0 PHI 170 170 B 60 ALA N B 60 ALA CA B 60 ALA C B 61 ARG N 1.0 -53.0 -31.0 PSI 171 171 B 60 ALA C B 61 ARG N B 61 ARG CA B 61 ARG C 1.0 -73.0 -53.0 PHI 172 172 B 61 ARG N B 61 ARG CA B 61 ARG C B 62 ASN N 1.0 -55.0 -35.0 PSI 173 173 B 61 ARG C B 62 ASN N B 62 ASN CA B 62 ASN C 1.0 -75.0 -55.0 PHI 174 174 B 62 ASN N B 62 ASN CA B 62 ASN C B 63 LEU N 1.0 -51.0 -31.0 PSI 175 175 B 62 ASN C B 63 LEU N B 63 LEU CA B 63 LEU C 1.0 -75.0 -55.0 PHI 176 176 B 63 LEU N B 63 LEU CA B 63 LEU C B 64 ILE N 1.0 -49.0 -29.0 PSI 177 177 B 63 LEU C B 64 ILE N B 64 ILE CA B 64 ILE C 1.0 -79.0 -59.0 PHI 178 178 B 64 ILE N B 64 ILE CA B 64 ILE C B 65 ARG N 1.0 -34.0 -12.0 PSI 179 179 B 65 ARG C B 66 ARG N B 66 ARG CA B 66 ARG C 1.0 -108.0 -78.0 PHI 180 180 B 66 ARG N B 66 ARG CA B 66 ARG C B 67 HIS N 1.0 -39.0 9.0 PSI 181 181 B 70 ASP C B 71 GLU N B 71 GLU CA B 71 GLU C 1.0 -74.0 -54.0 PHI 182 182 B 71 GLU N B 71 GLU CA B 71 GLU C B 72 ILE N 1.0 -55.0 -35.0 PSI 183 183 B 71 GLU C B 72 ILE N B 72 ILE CA B 72 ILE C 1.0 -74.0 -54.0 PHI 184 184 B 72 ILE N B 72 ILE CA B 72 ILE C B 73 MET N 1.0 -54.0 -34.0 PSI 185 185 B 72 ILE C B 73 MET N B 73 MET CA B 73 MET C 1.0 -73.0 -53.0 PHI 186 186 B 73 MET N B 73 MET CA B 73 MET C B 74 GLU N 1.0 -51.0 -29.0 PSI 187 187 B 73 MET C B 74 GLU N B 74 GLU CA B 74 GLU C 1.0 -78.0 -58.0 PHI 188 188 B 74 GLU N B 74 GLU CA B 74 GLU C B 75 GLU N 1.0 -51.0 -31.0 PSI 189 189 B 74 GLU C B 75 GLU N B 75 GLU CA B 75 GLU C 1.0 -71.0 -51.0 PHI 190 190 B 75 GLU N B 75 GLU CA B 75 GLU C B 76 LEU N 1.0 -54.0 -34.0 PSI 191 191 B 75 GLU C B 76 LEU N B 76 LEU CA B 76 LEU C 1.0 -72.0 -52.0 PHI 192 192 B 76 LEU N B 76 LEU CA B 76 LEU C B 77 THR N 1.0 -49.0 -29.0 PSI 193 193 B 76 LEU C B 77 THR N B 77 THR CA B 77 THR C 1.0 -78.0 -58.0 PHI 194 194 B 77 THR N B 77 THR CA B 77 THR C B 78 LYS N 1.0 -51.0 -31.0 PSI 195 195 B 77 THR C B 78 LYS N B 78 LYS CA B 78 LYS C 1.0 -71.0 -51.0 PHI 196 196 B 78 LYS N B 78 LYS CA B 78 LYS C B 79 TYR N 1.0 -54.0 -34.0 PSI 197 197 B 78 LYS C B 79 TYR N B 79 TYR CA B 79 TYR C 1.0 -73.0 -53.0 PHI 198 198 B 79 TYR N B 79 TYR CA B 79 TYR C B 80 TYR N 1.0 -53.0 -33.0 PSI 199 199 B 79 TYR C B 80 TYR N B 80 TYR CA B 80 TYR C 1.0 -72.0 -52.0 PHI 200 200 B 80 TYR N B 80 TYR CA B 80 TYR C B 81 LEU N 1.0 -54.0 -34.0 PSI 201 201 B 80 TYR C B 81 LEU N B 81 LEU CA B 81 LEU C 1.0 -72.0 -52.0 PHI 202 202 B 81 LEU N B 81 LEU CA B 81 LEU C B 82 ALA N 1.0 -47.0 -25.0 PSI 203 203 B 81 LEU C B 82 ALA N B 82 ALA CA B 82 ALA C 1.0 -72.0 -52.0 PHI 204 204 B 82 ALA N B 82 ALA CA B 82 ALA C B 83 ASN N 1.0 -47.0 -25.0 PSI 205 205 B 82 ALA C B 83 ASN N B 83 ASN CA B 83 ASN C 1.0 -87.0 -61.0 PHI 206 206 B 83 ASN N B 83 ASN CA B 83 ASN C B 84 HIS N 1.0 -30.0 4.0 PSI 207 207 B 84 HIS C B 85 GLY N B 85 GLY CA B 85 GLY C 1.0 69.0 103.0 PHI 208 208 B 85 GLY N B 85 GLY CA B 85 GLY C B 86 ILE N 1.0 -4.0 22.0 PSI 209 209 B 85 GLY C B 86 ILE N B 86 ILE CA B 86 ILE C 1.0 -100.0 -72.0 PHI 210 210 B 86 ILE N B 86 ILE CA B 86 ILE C B 87 ASP N 1.0 118.0 146.0 PSI 211 211 B 86 ILE C B 87 ASP N B 87 ASP CA B 87 ASP C 1.0 -102.0 -68.0 PHI 212 212 B 87 ASP N B 87 ASP CA B 87 ASP C B 88 ILE N 1.0 120.0 150.0 PSI 213 213 B 87 ASP C B 88 ILE N B 88 ILE CA B 88 ILE C 1.0 -124.0 -90.0 PHI 214 214 B 88 ILE N B 88 ILE CA B 88 ILE C B 89 LYS N 1.0 111.0 149.0 PSI stop_ save_