data_nef_c16970_2kym save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -2 MET start . . 2 A -1 ALA middle . . 3 A 1 PRO middle . false 4 A 2 LEU middle . . 5 A 3 PHE middle . . 6 A 4 ALA middle . . 7 A 5 VAL middle . . 8 A 6 THR middle . . 9 A 7 LEU middle . . 10 A 8 TYR middle . . 11 A 9 GLU middle . . 12 A 10 PHE middle . . 13 A 11 LYS middle . . 14 A 12 ALA middle . . 15 A 13 GLU middle . . 16 A 14 ARG middle . . 17 A 15 ASP middle . . 18 A 16 ASP middle . . 19 A 17 GLU middle . . 20 A 18 LEU middle . . 21 A 19 ASP middle . . 22 A 20 VAL middle . . 23 A 21 SER middle . . 24 A 22 PRO middle . false 25 A 23 GLY middle . false 26 A 24 GLU middle . . 27 A 25 ASN middle . . 28 A 26 LEU middle . . 29 A 27 SER middle . . 30 A 28 ILE middle . . 31 A 29 CYS middle . . 32 A 30 ALA middle . . 33 A 31 HIS middle . . 34 A 32 TYR middle . . 35 A 33 ASP middle . . 36 A 34 TYR middle . . 37 A 35 GLU middle . . 38 A 36 TRP middle . . 39 A 37 PHE middle . . 40 A 38 ILE middle . . 41 A 39 ALA middle . . 42 A 40 LYS middle . . 43 A 41 PRO middle . false 44 A 42 ILE middle . . 45 A 43 ASN middle . . 46 A 43 ARG middle . . 47 A 44 LEU middle . . 48 A 45 GLY middle . false 49 A 46 GLY middle . false 50 A 47 PRO middle . false 51 A 48 GLY middle . false 52 A 49 LEU middle . . 53 A 50 VAL middle . . 54 A 51 PRO middle . false 55 A 52 VAL middle . . 56 A 53 SER middle . . 57 A 54 TYR middle . . 58 A 55 VAL middle . . 59 A 56 ARG middle . . 60 A 57 ILE middle . . 61 A 58 ILE middle . . 62 A 59 ASP middle . . 63 A 60 LEU middle . . 64 A 61 MET middle . . 65 A 62 ASP middle . . 66 A 63 PRO middle . false 67 A 64 ALA middle . . 68 A 65 LYS middle . . 69 A 66 TYR middle . . 70 A 67 ALA middle . . 71 A 68 SER middle . . 72 A 69 VAL middle . . 73 A 70 ASP middle . . 74 A 71 THR middle . . 75 A 72 TYR middle . . 76 A 73 ASP middle . . 77 A 74 ARG middle . . 78 A 75 GLU middle . . 79 A 76 GLN middle . . 80 A 77 VAL middle . . 81 A 78 MET middle . . 82 A 79 LYS middle . . 83 A 80 ILE middle . . 84 A 81 ILE middle . . 85 A 82 ASP middle . . 86 A 83 GLU middle . . 87 A 84 PHE middle . . 88 A 85 LYS middle . . 89 A 86 ILE middle . . 90 A 87 PRO middle . false 91 A 88 THR middle . . 92 A 89 VAL middle . . 93 A 90 GLU middle . . 94 A 91 GLN middle . . 95 A 92 TRP middle . . 96 A 93 LYS middle . . 97 A 94 ASP middle . . 98 A 95 GLN middle . . 99 A 96 THR middle . . 100 A 97 ARG middle . . 101 A 98 ARG middle . . 102 A 99 TYR middle . . 103 A 100 LYS middle . . 104 A 101 GLU middle . . 105 A 102 SER middle . . 106 A 103 SER middle . . 107 A 104 ILE middle . . 108 A 105 GLN middle . . 109 A 106 ILE middle . . 110 A 107 GLY middle . false 111 A 108 ASN middle . . 112 A 109 GLY middle . false 113 A 110 HIS middle . . 114 A 111 GLY middle . false 115 A 112 GLN middle . . 116 A 113 SER middle . . 117 A 114 GLN middle . . 118 A 115 GLY middle . false 119 A 116 LEU middle . . 120 A 117 GLU end . . 121 B -9 GLY start . false 122 B -8 LYS middle . . 123 B -7 PHE middle . . 124 B -6 ILE middle . . 125 B -5 PRO middle . false 126 B -4 SER middle . . 127 B -3 ARG middle . . 128 B -2 PRO middle . false 129 B -1 ALA middle . . 130 B 0 PRO middle . false 131 B 1 LYS middle . . 132 B 2 PRO middle . false 133 B 3 PRO middle . false 134 B 4 SER middle . . 135 B 5 SER middle . . 136 B 6 ALA end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A -2 MET H1 H 1 8.424 0.020 A -2 MET HA H 1 3.995 0.020 A -2 MET HBx H 1 2.112 0.020 A -2 MET HBy H 1 2.112 0.020 A -2 MET HE% H 1 2.070 0.020 A -2 MET HGx H 1 2.645 0.020 A -2 MET HGy H 1 2.645 0.020 A -2 MET C C 13 175.399 0.400 A -2 MET CA C 13 55.179 0.400 A -2 MET CB C 13 34.250 0.400 A -2 MET CE C 13 17.232 0.400 A -2 MET CG C 13 31.150 0.400 A -2 MET N N 15 128.836 0.400 A -1 ALA H H 1 8.481 0.020 A -1 ALA HA H 1 4.736 0.020 A -1 ALA HB% H 1 1.463 0.020 A -1 ALA C C 13 174.778 0.400 A -1 ALA CA C 13 50.363 0.400 A -1 ALA CB C 13 18.816 0.400 A -1 ALA N N 15 128.205 0.400 A 1 PRO HA H 1 4.342 0.020 A 1 PRO HBy H 1 2.106 0.020 A 1 PRO HBx H 1 1.681 0.020 A 1 PRO HDy H 1 3.852 0.020 A 1 PRO HDx H 1 3.750 0.020 A 1 PRO HGy H 1 2.090 0.020 A 1 PRO HGx H 1 2.050 0.020 A 1 PRO C C 13 174.454 0.400 A 1 PRO CA C 13 62.789 0.400 A 1 PRO CB C 13 32.090 0.400 A 1 PRO CD C 13 50.359 0.400 A 1 PRO CG C 13 27.520 0.400 A 2 LEU H H 1 8.033 0.020 A 2 LEU HA H 1 4.381 0.020 A 2 LEU HBx H 1 1.263 0.020 A 2 LEU HBy H 1 1.263 0.020 A 2 LEU HDx% H 1 0.178 0.020 A 2 LEU HDy% H 1 0.001 0.020 A 2 LEU HG H 1 1.035 0.020 A 2 LEU C C 13 174.361 0.400 A 2 LEU CA C 13 53.616 0.400 A 2 LEU CB C 13 44.869 0.400 A 2 LEU CD1 C 13 25.430 0.400 A 2 LEU CD2 C 13 22.590 0.400 A 2 LEU CG C 13 26.230 0.400 A 2 LEU N N 15 122.392 0.400 A 3 PHE H H 1 8.384 0.020 A 3 PHE HA H 1 5.270 0.020 A 3 PHE HBy H 1 3.066 0.020 A 3 PHE HBx H 1 2.894 0.020 A 3 PHE HD1 H 1 7.230 0.020 A 3 PHE HD2 H 1 7.230 0.020 A 3 PHE HE1 H 1 7.220 0.020 A 3 PHE HE2 H 1 7.220 0.020 A 3 PHE C C 13 173.452 0.400 A 3 PHE CA C 13 56.181 0.400 A 3 PHE CB C 13 42.140 0.400 A 3 PHE CD1 C 13 133.030 0.400 A 3 PHE CD2 C 13 133.030 0.400 A 3 PHE CE1 C 13 130.610 0.400 A 3 PHE CE2 C 13 130.610 0.400 A 3 PHE N N 15 123.720 0.400 A 4 ALA H H 1 8.835 0.020 A 4 ALA HA H 1 5.284 0.020 A 4 ALA HB% H 1 1.016 0.020 A 4 ALA C C 13 174.963 0.400 A 4 ALA CA C 13 50.345 0.400 A 4 ALA CB C 13 23.582 0.400 A 4 ALA N N 15 119.668 0.400 A 5 VAL H H 1 9.103 0.020 A 5 VAL HA H 1 5.278 0.020 A 5 VAL HB H 1 1.914 0.020 A 5 VAL HGx% H 1 0.867 0.020 A 5 VAL HGy% H 1 0.892 0.020 A 5 VAL C C 13 175.264 0.400 A 5 VAL CA C 13 58.812 0.400 A 5 VAL CB C 13 34.856 0.400 A 5 VAL CG1 C 13 19.868 0.400 A 5 VAL CG2 C 13 21.530 0.400 A 5 VAL N N 15 119.401 0.400 A 6 THR H H 1 8.559 0.020 A 6 THR HA H 1 4.395 0.020 A 6 THR HB H 1 4.442 0.020 A 6 THR HG2% H 1 1.284 0.020 A 6 THR C C 13 176.468 0.400 A 6 THR CA C 13 62.960 0.400 A 6 THR CB C 13 68.778 0.400 A 6 THR CG2 C 13 24.329 0.400 A 6 THR N N 15 119.208 0.400 A 7 LEU H H 1 9.413 0.020 A 7 LEU HA H 1 4.086 0.020 A 7 LEU HBy H 1 0.725 0.020 A 7 LEU HBx H 1 0.281 0.020 A 7 LEU HDx% H 1 0.619 0.020 A 7 LEU HDy% H 1 0.619 0.020 A 7 LEU HG H 1 1.219 0.020 A 7 LEU C C 13 175.831 0.400 A 7 LEU CA C 13 55.389 0.400 A 7 LEU CB C 13 43.351 0.400 A 7 LEU CD1 C 13 22.250 0.400 A 7 LEU CD2 C 13 22.250 0.400 A 7 LEU CG C 13 26.618 0.400 A 7 LEU N N 15 125.660 0.400 A 8 TYR H H 1 6.812 0.020 A 8 TYR HA H 1 4.920 0.020 A 8 TYR HBx H 1 2.356 0.020 A 8 TYR HBy H 1 3.176 0.020 A 8 TYR HD1 H 1 6.578 0.020 A 8 TYR HD2 H 1 6.578 0.020 A 8 TYR HE1 H 1 6.696 0.020 A 8 TYR HE2 H 1 6.696 0.020 A 8 TYR C C 13 173.049 0.400 A 8 TYR CA C 13 53.449 0.400 A 8 TYR CB C 13 42.187 0.400 A 8 TYR CD1 C 13 134.952 0.400 A 8 TYR CD2 C 13 134.952 0.400 A 8 TYR CE1 C 13 118.850 0.400 A 8 TYR CE2 C 13 118.850 0.400 A 8 TYR N N 15 113.514 0.400 A 9 GLU H H 1 8.538 0.020 A 9 GLU HA H 1 4.386 0.020 A 9 GLU HBy H 1 2.174 0.020 A 9 GLU HBx H 1 2.098 0.020 A 9 GLU HGy H 1 2.439 0.020 A 9 GLU HGx H 1 2.221 0.020 A 9 GLU C C 13 175.127 0.400 A 9 GLU CA C 13 56.585 0.400 A 9 GLU CB C 13 30.925 0.400 A 9 GLU CG C 13 36.650 0.400 A 9 GLU N N 15 118.647 0.400 A 10 PHE H H 1 8.696 0.020 A 10 PHE HA H 1 5.058 0.020 A 10 PHE HBy H 1 3.184 0.020 A 10 PHE HBx H 1 3.085 0.020 A 10 PHE HD1 H 1 7.391 0.020 A 10 PHE HD2 H 1 7.391 0.020 A 10 PHE HE1 H 1 7.340 0.020 A 10 PHE HE2 H 1 7.340 0.020 A 10 PHE C C 13 173.019 0.400 A 10 PHE CA C 13 57.361 0.400 A 10 PHE CB C 13 41.490 0.400 A 10 PHE CD1 C 13 133.910 0.400 A 10 PHE CD2 C 13 133.910 0.400 A 10 PHE CE1 C 13 130.610 0.400 A 10 PHE CE2 C 13 130.610 0.400 A 10 PHE N N 15 126.216 0.400 A 11 LYS H H 1 7.889 0.020 A 11 LYS HA H 1 4.612 0.020 A 11 LYS HBy H 1 1.552 0.020 A 11 LYS HBx H 1 1.511 0.020 A 11 LYS HDx H 1 1.644 0.020 A 11 LYS HDy H 1 1.644 0.020 A 11 LYS HEx H 1 2.955 0.020 A 11 LYS HEy H 1 2.955 0.020 A 11 LYS HGy H 1 1.341 0.020 A 11 LYS HGx H 1 1.282 0.020 A 11 LYS C C 13 174.351 0.400 A 11 LYS CA C 13 53.219 0.400 A 11 LYS CB C 13 32.669 0.400 A 11 LYS CD C 13 28.541 0.400 A 11 LYS CE C 13 41.790 0.400 A 11 LYS CG C 13 24.301 0.400 A 11 LYS N N 15 128.129 0.400 A 12 ALA H H 1 8.566 0.020 A 12 ALA HA H 1 4.055 0.020 A 12 ALA HB% H 1 1.279 0.020 A 12 ALA C C 13 178.882 0.400 A 12 ALA CA C 13 52.529 0.400 A 12 ALA CB C 13 20.566 0.400 A 12 ALA N N 15 126.865 0.400 A 13 GLU H H 1 9.189 0.020 A 13 GLU HA H 1 4.424 0.020 A 13 GLU HBx H 1 1.673 0.020 A 13 GLU HBy H 1 1.673 0.020 A 13 GLU HGy H 1 2.205 0.020 A 13 GLU HGx H 1 2.113 0.020 A 13 GLU C C 13 175.640 0.400 A 13 GLU CA C 13 55.849 0.400 A 13 GLU CB C 13 32.058 0.400 A 13 GLU CG C 13 36.516 0.400 A 13 GLU N N 15 120.687 0.400 A 14 ARG H H 1 7.345 0.020 A 14 ARG HA H 1 4.621 0.020 A 14 ARG HBx H 1 1.572 0.020 A 14 ARG HBy H 1 1.962 0.020 A 14 ARG HDy H 1 3.287 0.020 A 14 ARG HDx H 1 3.137 0.020 A 14 ARG HGy H 1 1.546 0.020 A 14 ARG HGx H 1 1.474 0.020 A 14 ARG C C 13 176.587 0.400 A 14 ARG CA C 13 52.868 0.400 A 14 ARG CB C 13 33.925 0.400 A 14 ARG CD C 13 42.670 0.400 A 14 ARG CG C 13 26.950 0.400 A 14 ARG N N 15 117.608 0.400 A 15 ASP H H 1 8.517 0.020 A 15 ASP HA H 1 4.308 0.020 A 15 ASP HBx H 1 2.559 0.020 A 15 ASP HBy H 1 2.559 0.020 A 15 ASP C C 13 175.870 0.400 A 15 ASP CA C 13 56.519 0.400 A 15 ASP CB C 13 40.480 0.400 A 15 ASP N N 15 120.300 0.400 A 16 ASP H H 1 8.496 0.020 A 16 ASP HA H 1 4.475 0.020 A 16 ASP HBy H 1 2.790 0.020 A 16 ASP HBx H 1 2.433 0.020 A 16 ASP C C 13 175.671 0.400 A 16 ASP CA C 13 54.350 0.400 A 16 ASP CB C 13 39.439 0.400 A 16 ASP N N 15 114.058 0.400 A 17 GLU H H 1 7.532 0.020 A 17 GLU HA H 1 4.808 0.020 A 17 GLU HBy H 1 2.339 0.020 A 17 GLU HBx H 1 2.301 0.020 A 17 GLU C C 13 175.069 0.400 A 17 GLU CA C 13 56.099 0.400 A 17 GLU CB C 13 31.910 0.400 A 17 GLU N N 15 118.769 0.400 A 18 LEU H H 1 9.164 0.020 A 18 LEU HA H 1 4.588 0.020 A 18 LEU HBx H 1 1.959 0.020 A 18 LEU HBy H 1 1.959 0.020 A 18 LEU HDx% H 1 0.875 0.020 A 18 LEU HDy% H 1 0.636 0.020 A 18 LEU HG H 1 1.511 0.020 A 18 LEU C C 13 173.296 0.400 A 18 LEU CA C 13 53.429 0.400 A 18 LEU CB C 13 45.608 0.400 A 18 LEU CD1 C 13 24.466 0.400 A 18 LEU CD2 C 13 26.320 0.400 A 18 LEU CG C 13 26.200 0.400 A 18 LEU N N 15 126.537 0.400 A 19 ASP H H 1 8.012 0.020 A 19 ASP HA H 1 5.117 0.020 A 19 ASP HBy H 1 2.739 0.020 A 19 ASP HBx H 1 2.549 0.020 A 19 ASP C C 13 177.619 0.400 A 19 ASP CA C 13 54.928 0.400 A 19 ASP CB C 13 42.656 0.400 A 19 ASP N N 15 123.389 0.400 A 20 VAL H H 1 8.961 0.020 A 20 VAL HA H 1 4.772 0.020 A 20 VAL HB H 1 2.499 0.020 A 20 VAL HGx% H 1 1.263 0.020 A 20 VAL HGy% H 1 0.954 0.020 A 20 VAL C C 13 175.153 0.400 A 20 VAL CA C 13 60.157 0.400 A 20 VAL CB C 13 36.803 0.400 A 20 VAL CG1 C 13 20.329 0.400 A 20 VAL CG2 C 13 23.803 0.400 A 20 VAL N N 15 115.176 0.400 A 21 SER H H 1 9.190 0.020 A 21 SER HA H 1 5.028 0.020 A 21 SER HBy H 1 3.983 0.020 A 21 SER HBx H 1 3.621 0.020 A 21 SER C C 13 171.618 0.400 A 21 SER CA C 13 56.587 0.400 A 21 SER CB C 13 63.278 0.400 A 21 SER N N 15 119.367 0.400 A 22 PRO HA H 1 3.749 0.020 A 22 PRO HBx H 1 1.830 0.020 A 22 PRO HBy H 1 1.934 0.020 A 22 PRO HDy H 1 3.791 0.020 A 22 PRO HDx H 1 3.639 0.020 A 22 PRO HGx H 1 1.892 0.020 A 22 PRO HGy H 1 2.232 0.020 A 22 PRO C C 13 176.802 0.400 A 22 PRO CA C 13 63.649 0.400 A 22 PRO CB C 13 31.560 0.400 A 22 PRO CD C 13 50.699 0.400 A 22 PRO CG C 13 28.190 0.400 A 23 GLY H H 1 8.639 0.020 A 23 GLY HAx H 1 3.492 0.020 A 23 GLY HAy H 1 4.149 0.020 A 23 GLY C C 13 174.375 0.400 A 23 GLY CA C 13 45.479 0.400 A 23 GLY N N 15 111.820 0.400 A 24 GLU H H 1 8.157 0.020 A 24 GLU HA H 1 4.532 0.020 A 24 GLU HBy H 1 2.234 0.020 A 24 GLU HBx H 1 1.873 0.020 A 24 GLU HGy H 1 2.467 0.020 A 24 GLU HGx H 1 2.024 0.020 A 24 GLU C C 13 176.125 0.400 A 24 GLU CA C 13 57.179 0.400 A 24 GLU CB C 13 31.950 0.400 A 24 GLU CG C 13 37.940 0.400 A 24 GLU N N 15 118.953 0.400 A 25 ASN H H 1 9.036 0.020 A 25 ASN HA H 1 5.483 0.020 A 25 ASN HBy H 1 2.718 0.020 A 25 ASN HBx H 1 2.507 0.020 A 25 ASN HD2y H 1 7.187 0.020 A 25 ASN HD2x H 1 6.738 0.020 A 25 ASN C C 13 175.387 0.400 A 25 ASN CA C 13 53.054 0.400 A 25 ASN CB C 13 39.620 0.400 A 25 ASN N N 15 122.372 0.400 A 25 ASN ND2 N 15 108.978 0.400 A 26 LEU H H 1 9.648 0.020 A 26 LEU HA H 1 5.108 0.020 A 26 LEU HBy H 1 1.406 0.020 A 26 LEU HBx H 1 1.234 0.020 A 26 LEU HDx% H 1 0.607 0.020 A 26 LEU HDy% H 1 0.627 0.020 A 26 LEU C C 13 175.710 0.400 A 26 LEU CA C 13 53.149 0.400 A 26 LEU CB C 13 46.640 0.400 A 26 LEU CD1 C 13 22.250 0.400 A 26 LEU CD2 C 13 26.320 0.400 A 26 LEU N N 15 122.421 0.400 A 27 SER H H 1 9.046 0.020 A 27 SER HA H 1 4.790 0.020 A 27 SER HBy H 1 3.697 0.020 A 27 SER HBx H 1 3.672 0.020 A 27 SER C C 13 174.277 0.400 A 27 SER CA C 13 56.689 0.400 A 27 SER CB C 13 64.429 0.400 A 27 SER N N 15 115.172 0.400 A 28 ILE H H 1 8.154 0.020 A 28 ILE HA H 1 3.998 0.020 A 28 ILE HB H 1 1.392 0.020 A 28 ILE HD1% H 1 -0.080 0.020 A 28 ILE HG1y H 1 0.554 0.020 A 28 ILE HG1x H 1 0.414 0.020 A 28 ILE HG2% H 1 0.055 0.020 A 28 ILE C C 13 175.303 0.400 A 28 ILE CA C 13 59.419 0.400 A 28 ILE CB C 13 36.510 0.400 A 28 ILE CD1 C 13 10.612 0.400 A 28 ILE CG1 C 13 26.600 0.400 A 28 ILE CG2 C 13 18.328 0.400 A 28 ILE N N 15 124.915 0.400 A 29 CYS H H 1 8.649 0.020 A 29 CYS HA H 1 4.296 0.020 A 29 CYS HBx H 1 1.685 0.020 A 29 CYS HBy H 1 2.103 0.020 A 29 CYS C C 13 173.090 0.400 A 29 CYS CA C 13 58.400 0.400 A 29 CYS CB C 13 28.820 0.400 A 29 CYS N N 15 122.342 0.400 A 30 ALA H H 1 7.315 0.020 A 30 ALA HA H 1 4.919 0.020 A 30 ALA HB% H 1 0.748 0.020 A 30 ALA C C 13 175.703 0.400 A 30 ALA CA C 13 51.347 0.400 A 30 ALA CB C 13 21.521 0.400 A 30 ALA N N 15 115.303 0.400 A 31 HIS H H 1 8.976 0.020 A 31 HIS HA H 1 5.756 0.020 A 31 HIS HBy H 1 3.079 0.020 A 31 HIS HBx H 1 2.736 0.020 A 31 HIS HD2 H 1 6.615 0.020 A 31 HIS HE1 H 1 6.085 0.020 A 31 HIS C C 13 171.885 0.400 A 31 HIS CA C 13 54.770 0.400 A 31 HIS CB C 13 37.197 0.400 A 31 HIS CD2 C 13 118.200 0.400 A 31 HIS CE1 C 13 137.893 0.400 A 31 HIS N N 15 118.030 0.400 A 32 TYR H H 1 9.123 0.020 A 32 TYR HA H 1 4.593 0.020 A 32 TYR HBx H 1 2.559 0.020 A 32 TYR HBy H 1 3.044 0.020 A 32 TYR HD1 H 1 7.191 0.020 A 32 TYR HD2 H 1 7.191 0.020 A 32 TYR HE1 H 1 6.998 0.020 A 32 TYR HE2 H 1 6.998 0.020 A 32 TYR C C 13 174.564 0.400 A 32 TYR CA C 13 57.509 0.400 A 32 TYR CB C 13 41.442 0.400 A 32 TYR CD1 C 13 134.469 0.400 A 32 TYR CD2 C 13 134.469 0.400 A 32 TYR CE1 C 13 120.100 0.400 A 32 TYR CE2 C 13 120.100 0.400 A 32 TYR N N 15 121.040 0.400 A 33 ASP H H 1 8.847 0.020 A 33 ASP HA H 1 4.131 0.020 A 33 ASP HBy H 1 3.044 0.020 A 33 ASP HBx H 1 2.036 0.020 A 33 ASP C C 13 173.477 0.400 A 33 ASP CA C 13 55.339 0.400 A 33 ASP CB C 13 40.970 0.400 A 33 ASP N N 15 129.040 0.400 A 34 TYR H H 1 10.305 0.020 A 34 TYR HA H 1 3.367 0.020 A 34 TYR HBy H 1 3.204 0.020 A 34 TYR HBx H 1 2.940 0.020 A 34 TYR HD1 H 1 6.698 0.020 A 34 TYR HD2 H 1 6.698 0.020 A 34 TYR HE1 H 1 6.744 0.020 A 34 TYR HE2 H 1 6.744 0.020 A 34 TYR C C 13 173.600 0.400 A 34 TYR CA C 13 59.413 0.400 A 34 TYR CB C 13 35.390 0.400 A 34 TYR CD1 C 13 134.280 0.400 A 34 TYR CD2 C 13 134.280 0.400 A 34 TYR CE1 C 13 119.500 0.400 A 34 TYR CE2 C 13 119.500 0.400 A 34 TYR N N 15 113.032 0.400 A 35 GLU H H 1 8.551 0.020 A 35 GLU HA H 1 4.482 0.020 A 35 GLU HBx H 1 2.156 0.020 A 35 GLU HBy H 1 2.156 0.020 A 35 GLU HGy H 1 2.436 0.020 A 35 GLU HGx H 1 2.237 0.020 A 35 GLU C C 13 177.206 0.400 A 35 GLU CA C 13 57.057 0.400 A 35 GLU CB C 13 33.268 0.400 A 35 GLU CG C 13 36.877 0.400 A 35 GLU N N 15 116.227 0.400 A 36 TRP H H 1 8.040 0.020 A 36 TRP HA H 1 4.998 0.020 A 36 TRP HBx H 1 2.936 0.020 A 36 TRP HBy H 1 3.226 0.020 A 36 TRP HD1 H 1 7.456 0.020 A 36 TRP HE1 H 1 9.925 0.020 A 36 TRP HE3 H 1 7.115 0.020 A 36 TRP HH2 H 1 7.068 0.020 A 36 TRP HZ2 H 1 7.453 0.020 A 36 TRP HZ3 H 1 6.641 0.020 A 36 TRP C C 13 175.595 0.400 A 36 TRP CA C 13 55.969 0.400 A 36 TRP CB C 13 33.510 0.400 A 36 TRP CD1 C 13 129.200 0.400 A 36 TRP CE3 C 13 121.050 0.400 A 36 TRP CH2 C 13 125.115 0.400 A 36 TRP CZ2 C 13 116.105 0.400 A 36 TRP CZ3 C 13 121.800 0.400 A 36 TRP N N 15 119.887 0.400 A 36 TRP NE1 N 15 130.475 0.400 A 37 PHE H H 1 9.766 0.020 A 37 PHE HA H 1 5.835 0.020 A 37 PHE HBx H 1 2.637 0.020 A 37 PHE HBy H 1 3.008 0.020 A 37 PHE HD1 H 1 7.163 0.020 A 37 PHE HD2 H 1 7.163 0.020 A 37 PHE HE1 H 1 6.946 0.020 A 37 PHE HE2 H 1 6.946 0.020 A 37 PHE HZ H 1 6.764 0.020 A 37 PHE C C 13 176.278 0.400 A 37 PHE CA C 13 54.779 0.400 A 37 PHE CB C 13 41.640 0.400 A 37 PHE CD1 C 13 132.600 0.400 A 37 PHE CD2 C 13 132.600 0.400 A 37 PHE CE1 C 13 132.111 0.400 A 37 PHE CE2 C 13 132.111 0.400 A 37 PHE CZ C 13 129.677 0.400 A 37 PHE N N 15 119.004 0.400 A 38 ILE H H 1 8.098 0.020 A 38 ILE HA H 1 4.314 0.020 A 38 ILE HB H 1 0.953 0.020 A 38 ILE HD1% H 1 0.465 0.020 A 38 ILE HG1y H 1 0.870 0.020 A 38 ILE HG1x H 1 0.792 0.020 A 38 ILE HG2% H 1 -0.331 0.020 A 38 ILE C C 13 174.375 0.400 A 38 ILE CA C 13 59.749 0.400 A 38 ILE CB C 13 35.520 0.400 A 38 ILE CD1 C 13 12.128 0.400 A 38 ILE CG1 C 13 27.740 0.400 A 38 ILE CG2 C 13 17.870 0.400 A 38 ILE N N 15 118.322 0.400 A 39 ALA H H 1 9.393 0.020 A 39 ALA HA H 1 5.416 0.020 A 39 ALA HB% H 1 1.167 0.020 A 39 ALA C C 13 174.850 0.400 A 39 ALA CA C 13 49.682 0.400 A 39 ALA CB C 13 25.638 0.400 A 39 ALA N N 15 130.698 0.400 A 40 LYS H H 1 8.746 0.020 A 40 LYS HA H 1 4.957 0.020 A 40 LYS HBy H 1 1.909 0.020 A 40 LYS HBx H 1 1.569 0.020 A 40 LYS HDx H 1 1.626 0.020 A 40 LYS HDy H 1 1.626 0.020 A 40 LYS HEx H 1 2.992 0.020 A 40 LYS HEy H 1 2.992 0.020 A 40 LYS HGx H 1 1.492 0.020 A 40 LYS HGy H 1 1.492 0.020 A 40 LYS C C 13 173.268 0.400 A 40 LYS CA C 13 52.579 0.400 A 40 LYS CB C 13 36.470 0.400 A 40 LYS CD C 13 29.160 0.400 A 40 LYS CE C 13 41.910 0.400 A 40 LYS CG C 13 24.780 0.400 A 40 LYS N N 15 117.901 0.400 A 41 PRO HA H 1 4.797 0.020 A 41 PRO HBy H 1 2.233 0.020 A 41 PRO HBx H 1 2.198 0.020 A 41 PRO HDy H 1 3.910 0.020 A 41 PRO HDx H 1 3.514 0.020 A 41 PRO HGx H 1 2.010 0.020 A 41 PRO HGy H 1 2.010 0.020 A 41 PRO C C 13 176.058 0.400 A 41 PRO CA C 13 63.154 0.400 A 41 PRO CB C 13 32.400 0.400 A 41 PRO CD C 13 50.895 0.400 A 41 PRO CG C 13 27.114 0.400 A 42 ILE H H 1 7.739 0.020 A 42 ILE HA H 1 4.288 0.020 A 42 ILE HB H 1 1.778 0.020 A 42 ILE HD1% H 1 0.766 0.020 A 42 ILE HG1y H 1 1.445 0.020 A 42 ILE HG1x H 1 1.015 0.020 A 42 ILE HG2% H 1 0.939 0.020 A 42 ILE C C 13 177.195 0.400 A 42 ILE CA C 13 62.526 0.400 A 42 ILE CB C 13 39.015 0.400 A 42 ILE CD1 C 13 13.681 0.400 A 42 ILE CG1 C 13 27.480 0.400 A 42 ILE CG2 C 13 17.962 0.400 A 42 ILE N N 15 118.520 0.400 A 43 ASN H H 1 9.273 0.020 A 43 ASN HA H 1 5.014 0.020 A 43 ASN HBx H 1 2.680 0.020 A 43 ASN HBy H 1 3.155 0.020 A 43 ASN HD2y H 1 7.867 0.020 A 43 ASN HD2x H 1 7.217 0.020 A 43 ASN C C 13 173.615 0.400 A 43 ASN CA C 13 53.623 0.400 A 43 ASN CB C 13 39.921 0.400 A 43 ASN N N 15 117.622 0.400 A 43 ASN ND2 N 15 112.560 0.400 A 43 ARG H H 1 7.366 0.020 A 43 ARG HA H 1 4.650 0.020 A 43 ARG HBy H 1 2.125 0.020 A 43 ARG HBx H 1 1.838 0.020 A 43 ARG HDy H 1 3.172 0.020 A 43 ARG HDx H 1 3.061 0.020 A 43 ARG HE H 1 9.448 0.020 A 43 ARG HGy H 1 1.519 0.020 A 43 ARG HGx H 1 1.461 0.020 A 43 ARG C C 13 174.218 0.400 A 43 ARG CA C 13 54.372 0.400 A 43 ARG CB C 13 31.870 0.400 A 43 ARG CD C 13 43.570 0.400 A 43 ARG CG C 13 25.700 0.400 A 43 ARG N N 15 113.592 0.400 A 43 ARG NE N 15 88.096 0.400 A 44 LEU H H 1 8.244 0.020 A 44 LEU HA H 1 4.424 0.020 A 44 LEU HBy H 1 1.719 0.020 A 44 LEU HBx H 1 1.573 0.020 A 44 LEU HDx% H 1 0.951 0.020 A 44 LEU HDy% H 1 0.906 0.020 A 44 LEU HG H 1 1.714 0.020 A 44 LEU C C 13 177.300 0.400 A 44 LEU CA C 13 55.208 0.400 A 44 LEU CB C 13 42.390 0.400 A 44 LEU CD1 C 13 25.016 0.400 A 44 LEU CD2 C 13 23.350 0.400 A 44 LEU CG C 13 27.250 0.400 A 44 LEU N N 15 119.086 0.400 A 45 GLY H H 1 8.139 0.020 A 45 GLY HAy H 1 4.371 0.020 A 45 GLY HAx H 1 3.922 0.020 A 45 GLY C C 13 173.814 0.400 A 45 GLY CA C 13 44.120 0.400 A 45 GLY N N 15 108.892 0.400 A 46 GLY H H 1 8.745 0.020 A 46 GLY HAy H 1 4.072 0.020 A 46 GLY HAx H 1 3.560 0.020 A 46 GLY C C 13 171.260 0.400 A 46 GLY CA C 13 44.645 0.400 A 46 GLY N N 15 105.605 0.400 A 47 PRO HA H 1 5.038 0.020 A 47 PRO HBy H 1 2.081 0.020 A 47 PRO HBx H 1 1.661 0.020 A 47 PRO HDy H 1 3.867 0.020 A 47 PRO HDx H 1 3.699 0.020 A 47 PRO HGx H 1 2.024 0.020 A 47 PRO HGy H 1 2.024 0.020 A 47 PRO C C 13 175.391 0.400 A 47 PRO CA C 13 61.669 0.400 A 47 PRO CB C 13 35.390 0.400 A 47 PRO CD C 13 50.839 0.400 A 47 PRO CG C 13 24.811 0.400 A 48 GLY H H 1 8.768 0.020 A 48 GLY HAy H 1 4.525 0.020 A 48 GLY HAx H 1 4.007 0.020 A 48 GLY C C 13 171.065 0.400 A 48 GLY CA C 13 45.995 0.400 A 48 GLY N N 15 104.632 0.400 A 49 LEU H H 1 9.516 0.020 A 49 LEU HA H 1 5.282 0.020 A 49 LEU HBy H 1 1.602 0.020 A 49 LEU HBx H 1 1.431 0.020 A 49 LEU HDx% H 1 0.530 0.020 A 49 LEU HDy% H 1 0.120 0.020 A 49 LEU HG H 1 1.409 0.020 A 49 LEU C C 13 176.658 0.400 A 49 LEU CA C 13 55.066 0.400 A 49 LEU CB C 13 44.850 0.400 A 49 LEU CD1 C 13 23.684 0.400 A 49 LEU CD2 C 13 24.795 0.400 A 49 LEU CG C 13 27.377 0.400 A 49 LEU N N 15 121.124 0.400 A 50 VAL H H 1 9.321 0.020 A 50 VAL HA H 1 4.562 0.020 A 50 VAL HB H 1 1.874 0.020 A 50 VAL HGx% H 1 0.893 0.020 A 50 VAL HGy% H 1 0.870 0.020 A 50 VAL C C 13 172.426 0.400 A 50 VAL CA C 13 58.147 0.400 A 50 VAL CB C 13 36.898 0.400 A 50 VAL CG1 C 13 20.877 0.400 A 50 VAL CG2 C 13 21.613 0.400 A 50 VAL N N 15 117.969 0.400 A 51 PRO HA H 1 3.802 0.020 A 51 PRO C C 13 177.119 0.400 A 51 PRO CA C 13 62.955 0.400 A 52 VAL H H 1 7.684 0.020 A 52 VAL HA H 1 3.219 0.020 A 52 VAL HB H 1 1.456 0.020 A 52 VAL HGx% H 1 -0.541 0.020 A 52 VAL HGy% H 1 0.539 0.020 A 52 VAL C C 13 176.927 0.400 A 52 VAL CA C 13 65.113 0.400 A 52 VAL CB C 13 31.550 0.400 A 52 VAL CG1 C 13 20.390 0.400 A 52 VAL CG2 C 13 20.918 0.400 A 52 VAL N N 15 124.748 0.400 A 53 SER H H 1 8.183 0.020 A 53 SER HA H 1 4.248 0.020 A 53 SER HBx H 1 3.849 0.020 A 53 SER HBy H 1 3.849 0.020 A 53 SER C C 13 174.851 0.400 A 53 SER CA C 13 59.489 0.400 A 53 SER CB C 13 64.796 0.400 A 53 SER N N 15 109.302 0.400 A 54 TYR H H 1 7.728 0.020 A 54 TYR HA H 1 4.844 0.020 A 54 TYR HBy H 1 3.351 0.020 A 54 TYR HBx H 1 3.095 0.020 A 54 TYR HE1 H 1 6.820 0.020 A 54 TYR HE2 H 1 6.820 0.020 A 54 TYR C C 13 175.107 0.400 A 54 TYR CA C 13 58.048 0.400 A 54 TYR CB C 13 37.100 0.400 A 54 TYR CE1 C 13 119.400 0.400 A 54 TYR CE2 C 13 119.400 0.400 A 54 TYR N N 15 120.402 0.400 A 55 VAL H H 1 7.841 0.020 A 55 VAL HA H 1 5.285 0.020 A 55 VAL HB H 1 2.010 0.020 A 55 VAL HGx% H 1 1.004 0.020 A 55 VAL HGy% H 1 0.726 0.020 A 55 VAL C C 13 172.688 0.400 A 55 VAL CA C 13 58.219 0.400 A 55 VAL CB C 13 34.840 0.400 A 55 VAL CG1 C 13 19.110 0.400 A 55 VAL CG2 C 13 20.520 0.400 A 55 VAL N N 15 111.878 0.400 A 56 ARG H H 1 8.873 0.020 A 56 ARG HA H 1 4.789 0.020 A 56 ARG HBy H 1 1.787 0.020 A 56 ARG HBx H 1 1.684 0.020 A 56 ARG HDy H 1 3.227 0.020 A 56 ARG HDx H 1 3.141 0.020 A 56 ARG HE H 1 7.291 0.020 A 56 ARG HGy H 1 1.745 0.020 A 56 ARG HGx H 1 1.549 0.020 A 56 ARG C C 13 175.702 0.400 A 56 ARG CA C 13 53.876 0.400 A 56 ARG CB C 13 33.460 0.400 A 56 ARG CD C 13 43.626 0.400 A 56 ARG CG C 13 26.770 0.400 A 56 ARG N N 15 119.875 0.400 A 56 ARG NE N 15 84.081 0.400 A 57 ILE H H 1 8.810 0.020 A 57 ILE HA H 1 4.077 0.020 A 57 ILE HB H 1 1.672 0.020 A 57 ILE HD1% H 1 0.636 0.020 A 57 ILE HG1y H 1 1.414 0.020 A 57 ILE HG1x H 1 1.208 0.020 A 57 ILE HG2% H 1 0.595 0.020 A 57 ILE C C 13 175.024 0.400 A 57 ILE CA C 13 61.119 0.400 A 57 ILE CB C 13 37.273 0.400 A 57 ILE CD1 C 13 11.503 0.400 A 57 ILE CG1 C 13 27.880 0.400 A 57 ILE CG2 C 13 18.410 0.400 A 57 ILE N N 15 126.551 0.400 A 58 ILE H H 1 8.393 0.020 A 58 ILE HA H 1 4.555 0.020 A 58 ILE HB H 1 1.603 0.020 A 58 ILE HD1% H 1 0.678 0.020 A 58 ILE HG1x H 1 1.264 0.020 A 58 ILE HG1y H 1 1.264 0.020 A 58 ILE HG2% H 1 0.803 0.020 A 58 ILE C C 13 173.443 0.400 A 58 ILE CA C 13 59.514 0.400 A 58 ILE CB C 13 41.350 0.400 A 58 ILE CD1 C 13 13.151 0.400 A 58 ILE CG1 C 13 26.630 0.400 A 58 ILE CG2 C 13 17.621 0.400 A 58 ILE N N 15 123.598 0.400 A 59 ASP HA H 1 4.890 0.020 A 59 ASP HBy H 1 3.133 0.020 A 59 ASP HBx H 1 2.570 0.020 A 59 ASP C C 13 177.029 0.400 A 59 ASP CA C 13 52.799 0.400 A 59 ASP CB C 13 44.070 0.400 A 60 LEU H H 1 8.450 0.020 A 60 LEU HA H 1 3.880 0.020 A 60 LEU HBx H 1 1.423 0.020 A 60 LEU HBy H 1 1.542 0.020 A 60 LEU HDx% H 1 0.411 0.020 A 60 LEU HDy% H 1 0.542 0.020 A 60 LEU HG H 1 1.415 0.020 A 60 LEU C C 13 178.137 0.400 A 60 LEU CA C 13 57.239 0.400 A 60 LEU CB C 13 41.791 0.400 A 60 LEU CD1 C 13 24.659 0.400 A 60 LEU CD2 C 13 22.625 0.400 A 60 LEU CG C 13 27.080 0.400 A 60 LEU N N 15 124.286 0.400 A 61 MET H H 1 8.315 0.020 A 61 MET HA H 1 4.513 0.020 A 61 MET HBx H 1 2.131 0.020 A 61 MET HBy H 1 2.131 0.020 A 61 MET HE% H 1 2.103 0.020 A 61 MET HGy H 1 2.716 0.020 A 61 MET HGx H 1 2.517 0.020 A 61 MET C C 13 176.806 0.400 A 61 MET CA C 13 55.574 0.400 A 61 MET CB C 13 32.514 0.400 A 61 MET CE C 13 16.954 0.400 A 61 MET CG C 13 32.614 0.400 A 61 MET N N 15 115.099 0.400 A 62 ASP H H 1 7.912 0.020 A 62 ASP HA H 1 4.918 0.020 A 62 ASP HBy H 1 2.726 0.020 A 62 ASP HBx H 1 2.499 0.020 A 62 ASP C C 13 174.010 0.400 A 62 ASP CA C 13 51.449 0.400 A 62 ASP CB C 13 41.351 0.400 A 62 ASP N N 15 117.431 0.400 A 63 PRO HA H 1 4.549 0.020 A 63 PRO HBy H 1 2.362 0.020 A 63 PRO HBx H 1 1.997 0.020 A 63 PRO HDy H 1 3.872 0.020 A 63 PRO HDx H 1 3.609 0.020 A 63 PRO HGx H 1 2.009 0.020 A 63 PRO HGy H 1 2.009 0.020 A 63 PRO C C 13 177.528 0.400 A 63 PRO CA C 13 64.659 0.400 A 63 PRO CB C 13 32.305 0.400 A 63 PRO CD C 13 50.639 0.400 A 63 PRO CG C 13 27.094 0.400 A 64 ALA H H 1 8.163 0.020 A 64 ALA HA H 1 4.386 0.020 A 64 ALA HB% H 1 1.420 0.020 A 64 ALA C C 13 179.136 0.400 A 64 ALA CA C 13 52.569 0.400 A 64 ALA CB C 13 19.094 0.400 A 64 ALA N N 15 120.147 0.400 A 65 LYS H H 1 7.600 0.020 A 65 LYS HA H 1 3.748 0.020 A 65 LYS HBy H 1 1.745 0.020 A 65 LYS HBx H 1 1.323 0.020 A 65 LYS HDy H 1 1.535 0.020 A 65 LYS HDx H 1 1.486 0.020 A 65 LYS HEx H 1 2.865 0.020 A 65 LYS HEy H 1 2.865 0.020 A 65 LYS HGy H 1 0.945 0.020 A 65 LYS HGx H 1 0.439 0.020 A 65 LYS C C 13 177.560 0.400 A 65 LYS CA C 13 59.654 0.400 A 65 LYS CB C 13 33.134 0.400 A 65 LYS CD C 13 29.495 0.400 A 65 LYS CE C 13 41.860 0.400 A 65 LYS CG C 13 24.510 0.400 A 65 LYS N N 15 121.143 0.400 A 66 TYR H H 1 8.396 0.020 A 66 TYR HA H 1 4.872 0.020 A 66 TYR HBx H 1 2.851 0.020 A 66 TYR HBy H 1 3.321 0.020 A 66 TYR HD1 H 1 7.010 0.020 A 66 TYR HD2 H 1 7.010 0.020 A 66 TYR HE1 H 1 6.879 0.020 A 66 TYR HE2 H 1 6.879 0.020 A 66 TYR C C 13 176.733 0.400 A 66 TYR CA C 13 56.636 0.400 A 66 TYR CB C 13 37.290 0.400 A 66 TYR CD1 C 13 133.977 0.400 A 66 TYR CD2 C 13 133.977 0.400 A 66 TYR CE1 C 13 119.181 0.400 A 66 TYR CE2 C 13 119.181 0.400 A 66 TYR N N 15 115.078 0.400 A 67 ALA H H 1 7.545 0.020 A 67 ALA HA H 1 4.142 0.020 A 67 ALA HB% H 1 1.509 0.020 A 67 ALA C C 13 178.303 0.400 A 67 ALA CA C 13 54.861 0.400 A 67 ALA CB C 13 18.818 0.400 A 67 ALA N N 15 123.249 0.400 A 68 SER H H 1 8.418 0.020 A 68 SER HA H 1 4.558 0.020 A 68 SER HBy H 1 3.978 0.020 A 68 SER HBx H 1 3.925 0.020 A 68 SER C C 13 174.271 0.400 A 68 SER CA C 13 57.809 0.400 A 68 SER CB C 13 63.299 0.400 A 68 SER N N 15 110.862 0.400 A 69 VAL H H 1 7.496 0.020 A 69 VAL HA H 1 3.985 0.020 A 69 VAL HB H 1 2.286 0.020 A 69 VAL HGx% H 1 1.133 0.020 A 69 VAL HGy% H 1 0.810 0.020 A 69 VAL C C 13 175.154 0.400 A 69 VAL CA C 13 62.889 0.400 A 69 VAL CB C 13 32.079 0.400 A 69 VAL CG1 C 13 22.019 0.400 A 69 VAL CG2 C 13 20.692 0.400 A 69 VAL N N 15 122.510 0.400 A 70 ASP H H 1 8.318 0.020 A 70 ASP HA H 1 4.721 0.020 A 70 ASP HBy H 1 2.862 0.020 A 70 ASP HBx H 1 2.636 0.020 A 70 ASP C C 13 176.637 0.400 A 70 ASP CA C 13 53.060 0.400 A 70 ASP CB C 13 41.269 0.400 A 70 ASP N N 15 127.670 0.400 A 71 THR H H 1 8.090 0.020 A 71 THR HA H 1 3.881 0.020 A 71 THR HB H 1 4.465 0.020 A 71 THR HG2% H 1 1.220 0.020 A 71 THR C C 13 173.858 0.400 A 71 THR CA C 13 62.168 0.400 A 71 THR CB C 13 67.852 0.400 A 71 THR CG2 C 13 22.230 0.400 A 71 THR N N 15 114.361 0.400 A 72 TYR H H 1 8.314 0.020 A 72 TYR HA H 1 4.653 0.020 A 72 TYR HBy H 1 3.172 0.020 A 72 TYR HBx H 1 3.051 0.020 A 72 TYR HD1 H 1 7.191 0.020 A 72 TYR HD2 H 1 7.191 0.020 A 72 TYR HE1 H 1 6.876 0.020 A 72 TYR HE2 H 1 6.876 0.020 A 72 TYR C C 13 175.031 0.400 A 72 TYR CA C 13 56.189 0.400 A 72 TYR CB C 13 39.054 0.400 A 72 TYR CD1 C 13 133.801 0.400 A 72 TYR CD2 C 13 133.801 0.400 A 72 TYR CE1 C 13 119.173 0.400 A 72 TYR CE2 C 13 119.173 0.400 A 72 TYR N N 15 119.965 0.400 A 73 ASP H H 1 7.620 0.020 A 73 ASP HA H 1 4.601 0.020 A 73 ASP HBy H 1 3.169 0.020 A 73 ASP HBx H 1 2.448 0.020 A 73 ASP C C 13 175.418 0.400 A 73 ASP CA C 13 52.392 0.400 A 73 ASP CB C 13 41.630 0.400 A 73 ASP N N 15 121.338 0.400 A 74 ARG H H 1 8.508 0.020 A 74 ARG HA H 1 3.915 0.020 A 74 ARG HBy H 1 1.845 0.020 A 74 ARG HBx H 1 1.665 0.020 A 74 ARG HDy H 1 3.240 0.020 A 74 ARG HDx H 1 3.099 0.020 A 74 ARG HE H 1 7.145 0.020 A 74 ARG HGy H 1 1.574 0.020 A 74 ARG HGx H 1 1.381 0.020 A 74 ARG C C 13 177.496 0.400 A 74 ARG CA C 13 59.441 0.400 A 74 ARG CB C 13 30.500 0.400 A 74 ARG CD C 13 43.159 0.400 A 74 ARG CG C 13 27.531 0.400 A 74 ARG N N 15 126.897 0.400 A 74 ARG NE N 15 84.703 0.400 A 75 GLU H H 1 8.040 0.020 A 75 GLU HA H 1 3.884 0.020 A 75 GLU HBx H 1 2.034 0.020 A 75 GLU HBy H 1 2.086 0.020 A 75 GLU HGy H 1 2.313 0.020 A 75 GLU HGx H 1 2.196 0.020 A 75 GLU C C 13 179.632 0.400 A 75 GLU CA C 13 59.598 0.400 A 75 GLU CB C 13 29.130 0.400 A 75 GLU CG C 13 36.790 0.400 A 75 GLU N N 15 115.757 0.400 A 76 GLN H H 1 7.615 0.020 A 76 GLN HA H 1 4.078 0.020 A 76 GLN HBy H 1 2.270 0.020 A 76 GLN HBx H 1 2.170 0.020 A 76 GLN HE2y H 1 7.921 0.020 A 76 GLN HE2x H 1 7.155 0.020 A 76 GLN HGx H 1 2.333 0.020 A 76 GLN HGy H 1 2.529 0.020 A 76 GLN C C 13 178.998 0.400 A 76 GLN CA C 13 58.616 0.400 A 76 GLN CB C 13 28.791 0.400 A 76 GLN CG C 13 34.358 0.400 A 76 GLN N N 15 117.784 0.400 A 76 GLN NE2 N 15 114.097 0.400 A 77 VAL H H 1 8.079 0.020 A 77 VAL HA H 1 3.517 0.020 A 77 VAL HB H 1 2.076 0.020 A 77 VAL HGx% H 1 0.943 0.020 A 77 VAL HGy% H 1 0.921 0.020 A 77 VAL C C 13 177.744 0.400 A 77 VAL CA C 13 66.328 0.400 A 77 VAL CB C 13 31.750 0.400 A 77 VAL CG1 C 13 22.101 0.400 A 77 VAL CG2 C 13 23.270 0.400 A 77 VAL N N 15 119.358 0.400 A 78 MET H H 1 8.432 0.020 A 78 MET HA H 1 3.719 0.020 A 78 MET HBx H 1 1.681 0.020 A 78 MET HBy H 1 1.681 0.020 A 78 MET HE% H 1 1.700 0.020 A 78 MET HGy H 1 2.038 0.020 A 78 MET HGx H 1 1.157 0.020 A 78 MET C C 13 177.196 0.400 A 78 MET CA C 13 59.651 0.400 A 78 MET CB C 13 32.890 0.400 A 78 MET CE C 13 16.089 0.400 A 78 MET CG C 13 30.220 0.400 A 78 MET N N 15 119.531 0.400 A 79 LYS H H 1 7.018 0.020 A 79 LYS HA H 1 4.082 0.020 A 79 LYS HBx H 1 1.948 0.020 A 79 LYS HBy H 1 1.948 0.020 A 79 LYS HDx H 1 1.737 0.020 A 79 LYS HDy H 1 1.737 0.020 A 79 LYS HEx H 1 3.003 0.020 A 79 LYS HEy H 1 3.003 0.020 A 79 LYS HGy H 1 1.637 0.020 A 79 LYS HGx H 1 1.468 0.020 A 79 LYS C C 13 179.374 0.400 A 79 LYS CA C 13 59.337 0.400 A 79 LYS CB C 13 32.420 0.400 A 79 LYS CD C 13 29.250 0.400 A 79 LYS CE C 13 41.991 0.400 A 79 LYS CG C 13 25.088 0.400 A 79 LYS N N 15 115.701 0.400 A 80 ILE H H 1 7.403 0.020 A 80 ILE HA H 1 3.984 0.020 A 80 ILE HB H 1 1.893 0.020 A 80 ILE HD1% H 1 0.693 0.020 A 80 ILE HG1y H 1 1.627 0.020 A 80 ILE HG1x H 1 1.144 0.020 A 80 ILE HG2% H 1 0.777 0.020 A 80 ILE C C 13 177.360 0.400 A 80 ILE CA C 13 63.919 0.400 A 80 ILE CB C 13 38.260 0.400 A 80 ILE CD1 C 13 13.441 0.400 A 80 ILE CG1 C 13 28.760 0.400 A 80 ILE CG2 C 13 17.628 0.400 A 80 ILE N N 15 119.472 0.400 A 81 ILE H H 1 8.355 0.020 A 81 ILE HA H 1 3.543 0.020 A 81 ILE HB H 1 1.969 0.020 A 81 ILE HD1% H 1 0.606 0.020 A 81 ILE HG1y H 1 1.629 0.020 A 81 ILE HG1x H 1 1.058 0.020 A 81 ILE HG2% H 1 0.549 0.020 A 81 ILE C C 13 178.264 0.400 A 81 ILE CA C 13 65.563 0.400 A 81 ILE CB C 13 36.980 0.400 A 81 ILE CD1 C 13 13.751 0.400 A 81 ILE CG1 C 13 30.690 0.400 A 81 ILE CG2 C 13 17.760 0.400 A 81 ILE N N 15 120.952 0.400 A 82 ASP H H 1 8.346 0.020 A 82 ASP HA H 1 4.669 0.020 A 82 ASP HBy H 1 2.845 0.020 A 82 ASP HBx H 1 2.695 0.020 A 82 ASP C C 13 179.832 0.400 A 82 ASP CA C 13 57.129 0.400 A 82 ASP CB C 13 40.054 0.400 A 82 ASP N N 15 118.522 0.400 A 83 GLU H H 1 8.302 0.020 A 83 GLU HA H 1 4.007 0.020 A 83 GLU HBy H 1 2.264 0.020 A 83 GLU HBx H 1 2.081 0.020 A 83 GLU HGy H 1 2.175 0.020 A 83 GLU HGx H 1 1.956 0.020 A 83 GLU C C 13 178.516 0.400 A 83 GLU CA C 13 59.459 0.400 A 83 GLU CB C 13 29.386 0.400 A 83 GLU CG C 13 35.935 0.400 A 83 GLU N N 15 122.956 0.400 A 84 PHE H H 1 8.038 0.020 A 84 PHE HA H 1 4.326 0.020 A 84 PHE HBy H 1 3.307 0.020 A 84 PHE HBx H 1 2.823 0.020 A 84 PHE HD1 H 1 7.467 0.020 A 84 PHE HD2 H 1 7.467 0.020 A 84 PHE HE1 H 1 7.278 0.020 A 84 PHE HE2 H 1 7.278 0.020 A 84 PHE C C 13 174.161 0.400 A 84 PHE CA C 13 59.337 0.400 A 84 PHE CB C 13 39.137 0.400 A 84 PHE CD1 C 13 133.100 0.400 A 84 PHE CD2 C 13 133.100 0.400 A 84 PHE CE1 C 13 132.489 0.400 A 84 PHE CE2 C 13 132.489 0.400 A 84 PHE N N 15 115.423 0.400 A 85 LYS H H 1 7.944 0.020 A 85 LYS HA H 1 4.050 0.020 A 85 LYS HBy H 1 2.096 0.020 A 85 LYS HBx H 1 1.903 0.020 A 85 LYS HDy H 1 1.822 0.020 A 85 LYS HDx H 1 1.680 0.020 A 85 LYS HEx H 1 3.041 0.020 A 85 LYS HEy H 1 3.041 0.020 A 85 LYS HGx H 1 1.426 0.020 A 85 LYS HGy H 1 1.426 0.020 A 85 LYS C C 13 176.291 0.400 A 85 LYS CA C 13 56.275 0.400 A 85 LYS CB C 13 28.887 0.400 A 85 LYS CD C 13 28.900 0.400 A 85 LYS CE C 13 42.164 0.400 A 85 LYS CG C 13 24.726 0.400 A 85 LYS N N 15 116.516 0.400 A 86 ILE H H 1 7.540 0.020 A 86 ILE HA H 1 4.303 0.020 A 86 ILE HB H 1 2.046 0.020 A 86 ILE HD1% H 1 0.724 0.020 A 86 ILE HG1y H 1 1.456 0.020 A 86 ILE HG1x H 1 1.351 0.020 A 86 ILE HG2% H 1 0.912 0.020 A 86 ILE C C 13 174.447 0.400 A 86 ILE CA C 13 57.909 0.400 A 86 ILE CB C 13 37.051 0.400 A 86 ILE CD1 C 13 10.921 0.400 A 86 ILE CG1 C 13 27.020 0.400 A 86 ILE CG2 C 13 16.103 0.400 A 86 ILE N N 15 120.277 0.400 A 87 PRO HA H 1 4.795 0.020 A 87 PRO HBx H 1 2.404 0.020 A 87 PRO HBy H 1 2.404 0.020 A 87 PRO HDx H 1 3.925 0.020 A 87 PRO HDy H 1 4.056 0.020 A 87 PRO HGy H 1 2.372 0.020 A 87 PRO HGx H 1 2.274 0.020 A 87 PRO C C 13 177.198 0.400 A 87 PRO CA C 13 62.689 0.400 A 87 PRO CB C 13 32.770 0.400 A 87 PRO CD C 13 51.349 0.400 A 87 PRO CG C 13 27.540 0.400 A 88 THR H H 1 8.157 0.020 A 88 THR HA H 1 4.594 0.020 A 88 THR HB H 1 4.640 0.020 A 88 THR HG2% H 1 1.184 0.020 A 88 THR C C 13 177.072 0.400 A 88 THR CA C 13 60.833 0.400 A 88 THR CB C 13 70.841 0.400 A 88 THR CG2 C 13 22.292 0.400 A 88 THR N N 15 108.810 0.400 A 89 VAL H H 1 7.802 0.020 A 89 VAL HA H 1 3.563 0.020 A 89 VAL HB H 1 2.216 0.020 A 89 VAL HGx% H 1 1.088 0.020 A 89 VAL HGy% H 1 1.131 0.020 A 89 VAL C C 13 177.352 0.400 A 89 VAL CA C 13 68.048 0.400 A 89 VAL CB C 13 31.995 0.400 A 89 VAL CG1 C 13 23.220 0.400 A 89 VAL CG2 C 13 22.123 0.400 A 89 VAL N N 15 119.876 0.400 A 90 GLU H H 1 8.950 0.020 A 90 GLU HA H 1 4.019 0.020 A 90 GLU HBx H 1 2.054 0.020 A 90 GLU HBy H 1 2.054 0.020 A 90 GLU HGy H 1 2.417 0.020 A 90 GLU HGx H 1 2.343 0.020 A 90 GLU C C 13 179.238 0.400 A 90 GLU CA C 13 60.562 0.400 A 90 GLU CB C 13 29.360 0.400 A 90 GLU CG C 13 36.765 0.400 A 90 GLU N N 15 118.223 0.400 A 91 GLN H H 1 7.647 0.020 A 91 GLN HA H 1 4.188 0.020 A 91 GLN HBy H 1 2.481 0.020 A 91 GLN HBx H 1 2.099 0.020 A 91 GLN HE2y H 1 7.604 0.020 A 91 GLN HE2x H 1 6.905 0.020 A 91 GLN HGx H 1 2.514 0.020 A 91 GLN HGy H 1 2.514 0.020 A 91 GLN C C 13 178.769 0.400 A 91 GLN CA C 13 58.544 0.400 A 91 GLN CB C 13 28.854 0.400 A 91 GLN CG C 13 34.151 0.400 A 91 GLN N N 15 119.016 0.400 A 91 GLN NE2 N 15 111.184 0.400 A 92 TRP H H 1 9.051 0.020 A 92 TRP HA H 1 4.305 0.020 A 92 TRP HBy H 1 3.466 0.020 A 92 TRP HBx H 1 3.146 0.020 A 92 TRP HD1 H 1 7.246 0.020 A 92 TRP HE1 H 1 10.271 0.020 A 92 TRP HE3 H 1 7.409 0.020 A 92 TRP HH2 H 1 6.037 0.020 A 92 TRP HZ2 H 1 7.107 0.020 A 92 TRP HZ3 H 1 6.155 0.020 A 92 TRP C C 13 178.810 0.400 A 92 TRP CA C 13 60.859 0.400 A 92 TRP CB C 13 28.928 0.400 A 92 TRP CD1 C 13 128.100 0.400 A 92 TRP CE3 C 13 120.888 0.400 A 92 TRP CH2 C 13 124.273 0.400 A 92 TRP CZ2 C 13 114.800 0.400 A 92 TRP CZ3 C 13 122.200 0.400 A 92 TRP N N 15 122.689 0.400 A 92 TRP NE1 N 15 130.765 0.400 A 93 LYS H H 1 8.988 0.020 A 93 LYS HA H 1 3.295 0.020 A 93 LYS HBy H 1 1.867 0.020 A 93 LYS HBx H 1 1.759 0.020 A 93 LYS HDy H 1 1.894 0.020 A 93 LYS HDx H 1 1.738 0.020 A 93 LYS HEx H 1 3.000 0.020 A 93 LYS HEy H 1 3.000 0.020 A 93 LYS HGy H 1 2.004 0.020 A 93 LYS HGx H 1 1.281 0.020 A 93 LYS C C 13 178.755 0.400 A 93 LYS CA C 13 59.839 0.400 A 93 LYS CB C 13 32.230 0.400 A 93 LYS CD C 13 29.845 0.400 A 93 LYS CE C 13 41.864 0.400 A 93 LYS CG C 13 26.260 0.400 A 93 LYS N N 15 120.332 0.400 A 94 ASP H H 1 7.633 0.020 A 94 ASP HA H 1 4.422 0.020 A 94 ASP HBx H 1 2.777 0.020 A 94 ASP HBy H 1 2.777 0.020 A 94 ASP C C 13 177.827 0.400 A 94 ASP CA C 13 56.886 0.400 A 94 ASP CB C 13 41.401 0.400 A 94 ASP N N 15 118.810 0.400 A 95 GLN H H 1 8.159 0.020 A 95 GLN HA H 1 4.032 0.020 A 95 GLN HBx H 1 2.165 0.020 A 95 GLN HBy H 1 2.165 0.020 A 95 GLN HE2y H 1 7.466 0.020 A 95 GLN HE2x H 1 6.871 0.020 A 95 GLN HGy H 1 2.555 0.020 A 95 GLN HGx H 1 2.443 0.020 A 95 GLN C C 13 178.128 0.400 A 95 GLN CA C 13 58.136 0.400 A 95 GLN CB C 13 28.560 0.400 A 95 GLN CG C 13 33.910 0.400 A 95 GLN N N 15 118.720 0.400 A 95 GLN NE2 N 15 110.634 0.400 A 96 THR H H 1 7.917 0.020 A 96 THR HA H 1 3.984 0.020 A 96 THR HB H 1 3.910 0.020 A 96 THR HG2% H 1 0.899 0.020 A 96 THR C C 13 175.628 0.400 A 96 THR CA C 13 64.102 0.400 A 96 THR CB C 13 68.989 0.400 A 96 THR CG2 C 13 21.109 0.400 A 96 THR N N 15 112.430 0.400 A 97 ARG H H 1 7.659 0.020 A 97 ARG HA H 1 4.070 0.020 A 97 ARG HBx H 1 1.854 0.020 A 97 ARG HBy H 1 1.854 0.020 A 97 ARG HDx H 1 3.152 0.020 A 97 ARG HDy H 1 3.152 0.020 A 97 ARG HGy H 1 1.612 0.020 A 97 ARG HGx H 1 1.531 0.020 A 97 ARG C C 13 177.211 0.400 A 97 ARG CA C 13 57.947 0.400 A 97 ARG CB C 13 30.038 0.400 A 97 ARG CD C 13 43.270 0.400 A 97 ARG CG C 13 27.250 0.400 A 97 ARG N N 15 121.852 0.400 A 98 ARG H H 1 7.950 0.020 A 98 ARG HA H 1 4.119 0.020 A 98 ARG HBx H 1 1.684 0.020 A 98 ARG HBy H 1 1.684 0.020 A 98 ARG HDy H 1 3.107 0.020 A 98 ARG HDx H 1 3.052 0.020 A 98 ARG HGy H 1 1.541 0.020 A 98 ARG HGx H 1 1.444 0.020 A 98 ARG C C 13 177.188 0.400 A 98 ARG CA C 13 57.394 0.400 A 98 ARG CB C 13 30.361 0.400 A 98 ARG CD C 13 43.390 0.400 A 98 ARG CG C 13 27.520 0.400 A 98 ARG N N 15 119.241 0.400 A 99 TYR H H 1 7.976 0.020 A 99 TYR HA H 1 4.508 0.020 A 99 TYR HBx H 1 2.981 0.020 A 99 TYR HBy H 1 3.107 0.020 A 99 TYR HD1 H 1 7.094 0.020 A 99 TYR HD2 H 1 7.094 0.020 A 99 TYR HE1 H 1 6.806 0.020 A 99 TYR HE2 H 1 6.806 0.020 A 99 TYR C C 13 176.454 0.400 A 99 TYR CA C 13 58.433 0.400 A 99 TYR CB C 13 38.325 0.400 A 99 TYR CD1 C 13 134.184 0.400 A 99 TYR CD2 C 13 134.184 0.400 A 99 TYR CE1 C 13 119.200 0.400 A 99 TYR CE2 C 13 119.200 0.400 A 99 TYR N N 15 119.677 0.400 A 100 LYS H H 1 8.038 0.020 A 100 LYS HA H 1 4.172 0.020 A 100 LYS HBy H 1 1.842 0.020 A 100 LYS HBx H 1 1.797 0.020 A 100 LYS HDx H 1 1.667 0.020 A 100 LYS HDy H 1 1.667 0.020 A 100 LYS HEx H 1 2.970 0.020 A 100 LYS HEy H 1 2.970 0.020 A 100 LYS HGy H 1 1.448 0.020 A 100 LYS HGx H 1 1.392 0.020 A 100 LYS C C 13 177.029 0.400 A 100 LYS CA C 13 56.959 0.400 A 100 LYS CB C 13 32.886 0.400 A 100 LYS CD C 13 29.120 0.400 A 100 LYS CE C 13 41.910 0.400 A 100 LYS CG C 13 24.805 0.400 A 100 LYS N N 15 121.793 0.400 A 101 GLU H H 1 8.338 0.020 A 101 GLU HA H 1 4.230 0.020 A 101 GLU HBy H 1 2.083 0.020 A 101 GLU HBx H 1 1.992 0.020 A 101 GLU HGy H 1 2.344 0.020 A 101 GLU HGx H 1 2.284 0.020 A 101 GLU C C 13 176.899 0.400 A 101 GLU CA C 13 57.124 0.400 A 101 GLU CB C 13 30.067 0.400 A 101 GLU CG C 13 36.348 0.400 A 101 GLU N N 15 120.936 0.400 A 102 SER H H 1 8.207 0.020 A 102 SER HA H 1 4.454 0.020 A 102 SER HBx H 1 3.925 0.020 A 102 SER HBy H 1 3.925 0.020 A 102 SER C C 13 174.704 0.400 A 102 SER CA C 13 58.519 0.400 A 102 SER CB C 13 63.899 0.400 A 102 SER N N 15 115.800 0.400 A 103 SER H H 1 8.237 0.020 A 103 SER HA H 1 4.454 0.020 A 103 SER HBx H 1 3.874 0.020 A 103 SER HBy H 1 3.874 0.020 A 103 SER C C 13 174.490 0.400 A 103 SER CA C 13 58.519 0.400 A 103 SER CB C 13 63.649 0.400 A 103 SER N N 15 117.611 0.400 A 104 ILE H H 1 7.981 0.020 A 104 ILE HA H 1 4.168 0.020 A 104 ILE HB H 1 1.847 0.020 A 104 ILE HD1% H 1 0.838 0.020 A 104 ILE HG1y H 1 1.457 0.020 A 104 ILE HG1x H 1 1.168 0.020 A 104 ILE HG2% H 1 0.886 0.020 A 104 ILE C C 13 176.034 0.400 A 104 ILE CA C 13 61.121 0.400 A 104 ILE CB C 13 38.702 0.400 A 104 ILE CD1 C 13 12.952 0.400 A 104 ILE CG1 C 13 27.343 0.400 A 104 ILE CG2 C 13 17.259 0.400 A 104 ILE N N 15 121.773 0.400 A 105 GLN H H 1 8.355 0.020 A 105 GLN HA H 1 4.380 0.020 A 105 GLN HBy H 1 2.137 0.020 A 105 GLN HBx H 1 1.982 0.020 A 105 GLN HGx H 1 2.345 0.020 A 105 GLN HGy H 1 2.345 0.020 A 105 GLN C C 13 175.777 0.400 A 105 GLN CA C 13 55.591 0.400 A 105 GLN CB C 13 29.340 0.400 A 105 GLN CG C 13 33.795 0.400 A 105 GLN N N 15 124.276 0.400 A 106 ILE H H 1 8.226 0.020 A 106 ILE HA H 1 4.167 0.020 A 106 ILE HB H 1 1.847 0.020 A 106 ILE HD1% H 1 0.838 0.020 A 106 ILE HG1y H 1 1.457 0.020 A 106 ILE HG1x H 1 1.169 0.020 A 106 ILE HG2% H 1 0.883 0.020 A 106 ILE C C 13 176.495 0.400 A 106 ILE CA C 13 61.121 0.400 A 106 ILE CB C 13 38.699 0.400 A 106 ILE CD1 C 13 12.952 0.400 A 106 ILE CG1 C 13 27.344 0.400 A 106 ILE CG2 C 13 17.516 0.400 A 106 ILE N N 15 122.398 0.400 A 107 GLY H H 1 8.456 0.020 A 107 GLY HAx H 1 3.961 0.020 A 107 GLY HAy H 1 3.961 0.020 A 107 GLY C C 13 172.886 0.400 A 107 GLY CA C 13 45.260 0.400 A 107 GLY N N 15 113.100 0.400 A 108 ASN H H 1 8.006 0.020 A 108 ASN HA H 1 4.527 0.020 A 108 ASN HBy H 1 2.789 0.020 A 108 ASN HBx H 1 2.680 0.020 A 108 ASN C C 13 177.899 0.400 A 108 ASN CA C 13 54.568 0.400 A 108 ASN CB C 13 40.877 0.400 A 108 ASN N N 15 124.257 0.400 A 109 GLY H H 1 8.308 0.020 A 109 GLY HAx H 1 3.873 0.020 A 109 GLY HAy H 1 3.873 0.020 A 109 GLY C C 13 174.412 0.400 A 109 GLY CA C 13 45.404 0.400 A 109 GLY N N 15 113.600 0.400 A 110 HIS H H 1 8.236 0.020 A 110 HIS HA H 1 4.528 0.020 A 110 HIS HBy H 1 2.993 0.020 A 110 HIS HBx H 1 2.947 0.020 A 110 HIS HD2 H 1 6.865 0.020 A 110 HIS C C 13 175.988 0.400 A 110 HIS CA C 13 56.189 0.400 A 110 HIS CB C 13 30.927 0.400 A 110 HIS CD2 C 13 120.679 0.400 A 110 HIS N N 15 119.074 0.400 A 111 GLY H H 1 8.492 0.020 A 111 GLY HAx H 1 3.950 0.020 A 111 GLY HAy H 1 3.950 0.020 A 111 GLY C C 13 174.287 0.400 A 111 GLY CA C 13 45.260 0.400 A 111 GLY N N 15 110.136 0.400 A 112 GLN H H 1 8.355 0.020 A 112 GLN HA H 1 4.397 0.020 A 112 GLN HBy H 1 2.131 0.020 A 112 GLN HBx H 1 1.981 0.020 A 112 GLN HGx H 1 2.331 0.020 A 112 GLN HGy H 1 2.331 0.020 A 112 GLN C C 13 176.266 0.400 A 112 GLN CA C 13 55.840 0.400 A 112 GLN CB C 13 29.450 0.400 A 112 GLN CG C 13 33.800 0.400 A 112 GLN N N 15 119.904 0.400 A 113 SER H H 1 8.436 0.020 A 113 SER HA H 1 4.446 0.020 A 113 SER HBx H 1 3.879 0.020 A 113 SER HBy H 1 3.879 0.020 A 113 SER C C 13 174.630 0.400 A 113 SER CA C 13 58.519 0.400 A 113 SER CB C 13 63.644 0.400 A 113 SER N N 15 116.898 0.400 A 114 GLN H H 1 8.487 0.020 A 114 GLN HA H 1 4.366 0.020 A 114 GLN HBy H 1 2.137 0.020 A 114 GLN HBx H 1 1.983 0.020 A 114 GLN HGx H 1 2.331 0.020 A 114 GLN HGy H 1 2.331 0.020 A 114 GLN C C 13 176.365 0.400 A 114 GLN CA C 13 55.869 0.400 A 114 GLN CB C 13 29.580 0.400 A 114 GLN CG C 13 33.800 0.400 A 114 GLN N N 15 122.009 0.400 A 115 GLY H H 1 8.480 0.020 A 115 GLY HAx H 1 3.957 0.020 A 115 GLY HAy H 1 3.957 0.020 A 115 GLY C C 13 174.171 0.400 A 115 GLY CA C 13 45.260 0.400 A 115 GLY N N 15 109.812 0.400 A 116 LEU H H 1 8.116 0.020 A 116 LEU HA H 1 4.300 0.020 A 116 LEU HBy H 1 1.574 0.020 A 116 LEU HBx H 1 1.511 0.020 A 116 LEU HDx% H 1 0.879 0.020 A 116 LEU HDy% H 1 0.820 0.020 A 116 LEU HG H 1 1.557 0.020 A 116 LEU C C 13 177.542 0.400 A 116 LEU CA C 13 55.139 0.400 A 116 LEU CB C 13 42.310 0.400 A 116 LEU CD1 C 13 25.010 0.400 A 116 LEU CD2 C 13 23.380 0.400 A 116 LEU CG C 13 26.970 0.400 A 116 LEU N N 15 121.297 0.400 A 117 GLU H H 1 8.536 0.020 A 117 GLU HA H 1 4.173 0.020 A 117 GLU HBy H 1 1.903 0.020 A 117 GLU HBx H 1 1.842 0.020 A 117 GLU HGy H 1 2.189 0.020 A 117 GLU HGx H 1 2.115 0.020 A 117 GLU C C 13 176.275 0.400 A 117 GLU CA C 13 56.781 0.400 A 117 GLU CB C 13 30.050 0.400 A 117 GLU CG C 13 36.201 0.400 A 117 GLU N N 15 120.910 0.400 B -9 GLY H1 H 1 8.373 0.020 B -9 GLY HAy H 1 3.905 0.020 B -9 GLY HAx H 1 3.696 0.020 B -8 LYS H H 1 8.166 0.020 B -8 LYS HBy H 1 1.606 0.020 B -8 LYS HBx H 1 1.436 0.020 B -8 LYS HDx H 1 1.456 0.020 B -8 LYS HDy H 1 1.456 0.020 B -8 LYS HEy H 1 2.732 0.020 B -8 LYS HEx H 1 2.579 0.020 B -8 LYS HGy H 1 1.142 0.020 B -8 LYS HGx H 1 0.830 0.020 B -7 PHE H H 1 9.122 0.020 B -7 PHE HA H 1 3.882 0.020 B -7 PHE HBx H 1 3.459 0.020 B -7 PHE HBy H 1 3.459 0.020 B -7 PHE HD1 H 1 7.053 0.020 B -7 PHE HD2 H 1 7.053 0.020 B -7 PHE HE1 H 1 7.462 0.020 B -7 PHE HE2 H 1 7.462 0.020 B -7 PHE HZ H 1 7.386 0.020 B -6 ILE H H 1 7.117 0.020 B -6 ILE HA H 1 4.153 0.020 B -6 ILE HB H 1 1.809 0.020 B -6 ILE HD1% H 1 0.754 0.020 B -6 ILE HG1y H 1 1.241 0.020 B -6 ILE HG1x H 1 1.137 0.020 B -6 ILE HG2% H 1 0.625 0.020 B -5 PRO HA H 1 3.711 0.020 B -5 PRO HBy H 1 1.352 0.020 B -5 PRO HBx H 1 0.756 0.020 B -5 PRO HDx H 1 2.947 0.020 B -5 PRO HDy H 1 2.947 0.020 B -5 PRO HGx H 1 0.852 0.020 B -5 PRO HGy H 1 1.915 0.020 B -4 SER H H 1 8.672 0.020 B -4 SER HA H 1 4.433 0.020 B -4 SER HBx H 1 3.695 0.020 B -4 SER HBy H 1 3.695 0.020 B -3 ARG H H 1 7.571 0.020 B -3 ARG HA H 1 5.016 0.020 B -3 ARG HBy H 1 2.014 0.020 B -3 ARG HBx H 1 1.650 0.020 B -3 ARG HDy H 1 3.351 0.020 B -3 ARG HDx H 1 2.900 0.020 B -3 ARG HGx H 1 1.780 0.020 B -3 ARG HGy H 1 1.780 0.020 B -2 PRO HBy H 1 2.500 0.020 B -2 PRO HBx H 1 1.829 0.020 B -2 PRO HDx H 1 3.707 0.020 B -2 PRO HDy H 1 3.854 0.020 B -2 PRO HGy H 1 2.110 0.020 B -2 PRO HGx H 1 2.040 0.020 B -1 ALA H H 1 8.883 0.020 B -1 ALA HA H 1 3.870 0.020 B -1 ALA HB% H 1 0.410 0.020 B 0 PRO HA H 1 4.303 0.020 B 0 PRO HBy H 1 2.125 0.020 B 0 PRO HBx H 1 1.733 0.020 B 0 PRO HDx H 1 2.849 0.020 B 0 PRO HDy H 1 2.849 0.020 B 0 PRO HGy H 1 1.826 0.020 B 0 PRO HGx H 1 1.498 0.020 B 1 LYS H H 1 8.416 0.020 B 1 LYS HA H 1 4.467 0.020 B 1 LYS HBy H 1 2.317 0.020 B 1 LYS HBx H 1 1.640 0.020 B 1 LYS HDy H 1 1.730 0.020 B 1 LYS HDx H 1 1.580 0.020 B 1 LYS HEx H 1 3.074 0.020 B 1 LYS HEy H 1 3.074 0.020 B 1 LYS HGy H 1 2.053 0.020 B 1 LYS HGx H 1 1.830 0.020 B 2 PRO HBx H 1 1.586 0.020 B 2 PRO HBy H 1 1.586 0.020 B 2 PRO HDy H 1 3.658 0.020 B 2 PRO HDx H 1 3.230 0.020 B 2 PRO HGy H 1 1.829 0.020 B 2 PRO HGx H 1 1.689 0.020 B 3 PRO HBy H 1 1.800 0.020 B 3 PRO HBx H 1 1.736 0.020 B 3 PRO HDx H 1 3.820 0.020 B 3 PRO HDy H 1 3.820 0.020 B 3 PRO HGy H 1 1.497 0.020 B 3 PRO HGx H 1 1.239 0.020 B 4 SER H H 1 8.091 0.020 B 4 SER HA H 1 4.330 0.020 B 4 SER HBy H 1 3.870 0.020 B 4 SER HBx H 1 3.788 0.020 B 5 SER H H 1 8.338 0.020 B 5 SER HA H 1 4.430 0.020 B 5 SER HBy H 1 3.950 0.020 B 5 SER HBx H 1 3.840 0.020 B 6 ALA H H 1 8.266 0.020 B 6 ALA HA H 1 4.443 0.020 B 6 ALA HB% H 1 1.387 0.020 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _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 2 LEU HA A 2 LEU HDy% 1.0 . 4.75 2 2 A 83 GLU HA A 85 LYS HEx 1.0 . 5.48 3 2 A 83 GLU HA A 85 LYS HEy 1.0 . 5.48 4 3 A 4 ALA HB% A 57 ILE HD1% 1.0 . 3.08 5 4 A 4 ALA HB% A 56 ARG HBx 1.0 . 5.30 6 5 A 4 ALA HB% A 57 ILE HA 1.0 . 3.55 7 6 A 5 VAL HB A 58 ILE HG1x 1.0 . 4.62 8 6 A 5 VAL HB A 58 ILE HG1y 1.0 . 4.62 9 7 A 5 VAL HGy% A 25 ASN HA 1.0 . 3.73 10 8 A 5 VAL HGy% A 23 GLY HAy 1.0 . 4.37 11 9 A 5 VAL HGy% A 23 GLY HAx 1.0 . 3.50 12 10 A 105 GLN HA A 105 GLN HGx 1.0 . 3.81 13 10 A 105 GLN HA A 105 GLN HGy 1.0 . 3.81 14 11 A 114 GLN HA A 114 GLN HGx 1.0 . 4.22 15 11 A 114 GLN HA A 114 GLN HGy 1.0 . 4.22 16 12 A 23 GLY HAx A 5 VAL HGx% 1.0 . 5.10 17 13 A 5 VAL HGx% A 67 ALA HA 1.0 . 5.50 18 14 A 6 THR HA A 55 VAL HA 1.0 . 3.84 19 15 A 6 THR HB A 8 TYR H 1.0 . 4.17 20 16 A 105 GLN HGy A 105 GLN HBy 1.0 . 2.95 21 16 A 105 GLN HBy A 105 GLN HGx 1.0 . 2.95 22 17 A 6 THR HG2% A 20 VAL HB 1.0 . 3.49 23 18 A 55 VAL HA A 6 THR HG2% 1.0 . 3.89 24 19 A 57 ILE HD1% A 37 PHE HZ 1.0 . 3.75 25 20 A 57 ILE HD1% A 57 ILE HB 1.0 . 3.54 26 21 A 57 ILE HD1% A 2 LEU HDy% 1.0 . 4.38 27 22 A 4 ALA HA A 58 ILE HG1x 1.0 . 4.23 28 22 A 58 ILE HG1y A 4 ALA HA 1.0 . 4.23 29 23 A 8 TYR HA A 8 TYR HD% 1.0 . 4.18 30 24 A 8 TYR HA A 22 PRO HBy 1.0 . 4.19 31 25 A 10 PHE HA A 10 PHE HD% 1.0 . 3.87 32 26 A 26 LEU HDx% A 20 VAL HGx% 1.0 . 4.23 33 27 A 20 VAL HGx% A 26 LEU HDy% 1.0 . 4.23 34 28 A 12 ALA HB% A 18 LEU H 1.0 . 5.06 35 29 A 101 GLU HA A 101 GLU HGy 1.0 . 3.82 36 30 A 101 GLU HA A 101 GLU HGx 1.0 . 3.82 37 31 A 12 ALA HB% A 19 ASP HA 1.0 . 4.16 38 32 A 19 ASP HA A 20 VAL HGx% 1.0 . 5.50 39 33 A 12 ALA HB% A 19 ASP HBx 1.0 . 4.53 40 34 A 93 LYS HEy A 93 LYS HBy 1.0 . 4.30 41 34 A 93 LYS HBy A 93 LYS HEx 1.0 . 4.30 42 35 A 93 LYS HEy A 93 LYS HBx 1.0 . 4.30 43 35 A 93 LYS HBx A 93 LYS HEx 1.0 . 4.30 44 36 A 100 LYS HBx A 100 LYS HEx 1.0 . 4.43 45 36 A 100 LYS HBx A 100 LYS HEy 1.0 . 4.43 46 37 A 100 LYS HBy A 100 LYS HDx 1.0 . 3.95 47 37 A 100 LYS HBy A 100 LYS HDy 1.0 . 3.95 48 38 A 100 LYS HBx A 100 LYS HDx 1.0 . 4.07 49 38 A 100 LYS HBx A 100 LYS HDy 1.0 . 4.07 50 39 A 6 THR HB A 20 VAL HGx% 1.0 . 4.50 51 40 A 100 LYS HBy A 100 LYS HEx 1.0 . 5.17 52 40 A 100 LYS HEy A 100 LYS HBy 1.0 . 5.17 53 41 A 4 ALA HB% A 37 PHE HD% 1.0 . 5.13 54 42 A 4 ALA HB% A 37 PHE HE% 1.0 . 5.48 55 43 A 19 ASP HA A 20 VAL HGy% 1.0 . 5.50 56 44 A 9 GLU HA A 21 SER HA 1.0 . 3.76 57 45 A 100 LYS HA A 100 LYS HEx 1.0 . 4.41 58 45 A 100 LYS HEy A 100 LYS HA 1.0 . 4.41 59 46 A 24 GLU HBy A 21 SER HBx 1.0 . 5.50 60 47 A 100 LYS HA A 100 LYS HDx 1.0 . 3.97 61 47 A 100 LYS HDy A 100 LYS HA 1.0 . 3.97 62 48 A 6 THR HG2% A 24 GLU HBy 1.0 . 4.24 63 49 A 97 ARG HA A 97 ARG HGx 1.0 . 3.96 64 50 A 97 ARG HA A 97 ARG HGy 1.0 . 3.96 65 51 A 26 LEU HA A 42 ILE HG1x 1.0 . 5.50 66 52 A 96 THR HA A 96 THR HG2% 1.0 . 2.94 67 53 A 96 THR HG2% A 92 TRP HZ2 1.0 . 4.21 68 54 A 10 PHE HD% A 50 VAL HGy% 1.0 . 5.50 69 55 A 50 VAL H A 50 VAL HGy% 1.0 . 4.12 70 56 A 96 THR HG2% A 93 LYS HA 1.0 . 4.54 71 57 A 3 PHE HA A 27 SER HA 1.0 . 4.37 72 58 A 3 PHE HE% A 27 SER HBy 1.0 . 5.13 73 59 A 95 GLN HA A 98 ARG HBx 1.0 . 4.22 74 59 A 95 GLN HA A 98 ARG HBy 1.0 . 4.22 75 60 A 95 GLN HA A 95 GLN HGx 1.0 . 3.75 76 61 A 91 GLN HA A 94 ASP HBx 1.0 . 3.57 77 61 A 91 GLN HA A 94 ASP HBy 1.0 . 3.57 78 62 A 94 ASP HA A 97 ARG HBx 1.0 . 3.63 79 62 A 94 ASP HA A 97 ARG HBy 1.0 . 3.63 80 63 A 25 ASN HA A 5 VAL HA 1.0 . 3.94 81 64 A 75 GLU HA A 78 MET HE% 1.0 . 3.00 82 65 A 78 MET HE% A 34 TYR HBy 1.0 . 4.83 83 66 A 62 ASP HA A 63 PRO HDy 1.0 . 3.50 84 67 A 62 ASP HA A 63 PRO HDx 1.0 . 3.50 85 68 A 30 ALA HA A 86 ILE HG2% 1.0 . 3.62 86 69 A 29 CYS HA A 30 ALA HB% 1.0 . 4.97 87 70 A 88 THR HG2% A 91 GLN HGx 1.0 . 4.75 88 70 A 88 THR HG2% A 91 GLN HGy 1.0 . 4.75 89 71 A 32 TYR HA A 32 TYR HD% 1.0 . 3.76 90 72 A 33 ASP HA A 34 TYR HD% 1.0 . 3.84 91 73 A 92 TRP HE3 A 89 VAL HGx% 1.0 . 4.69 92 74 A 32 TYR HBx A 89 VAL HGx% 1.0 . 4.39 93 75 A 92 TRP HE3 A 89 VAL HA 1.0 . 4.54 94 76 A 88 THR HG2% A 32 TYR HBx 1.0 . 4.45 95 77 A 71 THR HG2% A 77 VAL HB 1.0 . 4.92 96 78 A 35 GLU HA A 35 GLU HGy 1.0 . 3.87 97 79 A 88 THR HG2% A 31 HIS HE1 1.0 . 3.80 98 80 A 37 PHE HE% A 52 VAL HA 1.0 . 4.74 99 81 A 37 PHE HD% A 52 VAL HA 1.0 . 4.53 100 82 A 28 ILE HA A 39 ALA HA 1.0 . 4.32 101 83 A 28 ILE HA A 39 ALA HB% 1.0 . 4.15 102 84 A 37 PHE HD% A 39 ALA HB% 1.0 . 4.93 103 85 A 39 ALA HB% A 39 ALA H 1.0 . 3.83 104 86 A 39 ALA HB% A 28 ILE HD1% 1.0 . 3.65 105 87 A -1 ALA HB% A 84 PHE HA 1.0 . 5.04 106 88 A 84 PHE HA A 85 LYS HGx 1.0 . 5.33 107 88 A 84 PHE HA A 85 LYS HGy 1.0 . 5.33 108 89 A 42 ILE HB A 25 ASN HBy 1.0 . 4.95 109 90 A 42 ILE HD1% A 25 ASN HBx 1.0 . 4.47 110 91 A 42 ILE HD1% A 25 ASN HBy 1.0 . 4.47 111 92 A 27 SER HBy A 42 ILE HD1% 1.0 . 4.20 112 93 A 42 ILE HD1% A 3 PHE HD% 1.0 . 3.59 113 94 A 3 PHE HE% A 42 ILE HD1% 1.0 . 3.88 114 95 A 3 PHE HE% A 42 ILE HG2% 1.0 . 5.26 115 96 A 34 TYR HE% A 82 ASP HA 1.0 . 5.29 116 97 A 82 ASP HA A 85 LYS HGx 1.0 . 5.03 117 97 A 85 LYS HGy A 82 ASP HA 1.0 . 5.03 118 98 A 82 ASP HA A 81 ILE HG2% 1.0 . 4.54 119 99 A 81 ILE HA A 81 ILE HG1x 1.0 . 4.19 120 100 A 36 TRP HE3 A 50 VAL HA 1.0 . 4.25 121 101 A 50 VAL HA A 36 TRP HZ3 1.0 . 4.83 122 102 A 10 PHE HD% A 50 VAL HB 1.0 . 5.24 123 103 A 56 ARG HE A 58 ILE HG2% 1.0 . 4.35 124 104 A 80 ILE HG2% A 84 PHE HD% 1.0 . 3.63 125 105 A 71 THR HG2% A 53 SER HA 1.0 . 5.50 126 106 A 80 ILE HG2% A 2 LEU HDy% 1.0 . 4.28 127 107 A 54 TYR HA A 7 LEU HDx% 1.0 . 4.65 128 107 A 7 LEU HDy% A 54 TYR HA 1.0 . 4.65 129 108 A 80 ILE HG2% A 80 ILE HG1x 1.0 . 3.53 130 109 A 81 ILE HA A 80 ILE HG2% 1.0 . 3.63 131 110 A 71 THR HG2% A 56 ARG HA 1.0 . 3.89 132 111 A 77 VAL HA A 80 ILE HB 1.0 . 3.73 133 112 A 81 ILE HG1x A 80 ILE HB 1.0 . 4.71 134 113 A 65 LYS HA A 67 ALA HB% 1.0 . 5.50 135 114 A 65 LYS HA A 65 LYS HGx 1.0 . 3.95 136 115 A 65 LYS HA A 65 LYS HGy 1.0 . 3.95 137 116 A 57 ILE HA A 71 THR HG2% 1.0 . 4.94 138 117 A 57 ILE HA A 4 ALA HA 1.0 . 3.75 139 118 A 77 VAL HGx% A 52 VAL HGy% 1.0 . 3.76 140 119 A 77 VAL HB A 71 THR HA 1.0 . 3.82 141 120 A 77 VAL HB A 74 ARG HA 1.0 . 4.00 142 121 A 57 ILE HB A 77 VAL HA 1.0 . 5.50 143 122 A 77 VAL HA A 74 ARG HA 1.0 . 5.50 144 123 A 75 GLU HGy A 79 LYS HEx 1.0 . 4.65 145 123 A 75 GLU HGy A 79 LYS HEy 1.0 . 4.65 146 124 A 3 PHE HD% A 60 LEU HDx% 1.0 . 5.24 147 125 A 3 PHE HE% A 60 LEU HDx% 1.0 . 5.45 148 126 A 3 PHE HD% A 60 LEU HDy% 1.0 . 5.24 149 127 A 3 PHE HE% A 60 LEU HDy% 1.0 . 5.45 150 128 A 88 THR HG2% A 90 GLU HBx 1.0 . 5.00 151 128 A 88 THR HG2% A 90 GLU HBy 1.0 . 5.00 152 129 A 90 GLU HBy A 89 VAL HGy% 1.0 . 5.50 153 129 A 89 VAL HGy% A 90 GLU HBx 1.0 . 5.50 154 130 A 74 ARG HA A 73 ASP HA 1.0 . 4.79 155 131 A 77 VAL HGx% A 52 VAL HGx% 1.0 . 3.76 156 132 A 62 ASP HA A 63 PRO HGx 1.0 . 4.25 157 132 A 62 ASP HA A 63 PRO HGy 1.0 . 4.25 158 133 A 64 ALA HB% A 63 PRO HGx 1.0 . 3.84 159 133 A 63 PRO HGy A 64 ALA HB% 1.0 . 3.84 160 134 A 67 ALA HA A 56 ARG HGy 1.0 . 4.40 161 135 A 69 VAL HA A 70 ASP HA 1.0 . 4.76 162 136 A 5 VAL HGy% A 5 VAL HA 1.0 . 3.13 163 137 A 5 VAL HGx% A 5 VAL HA 1.0 . 3.30 164 138 A 11 LYS HA A 11 LYS HDx 1.0 . 4.07 165 138 A 11 LYS HA A 11 LYS HDy 1.0 . 4.07 166 139 A 11 LYS HDy A 11 LYS HEx 1.0 . 2.58 167 139 A 11 LYS HDx A 11 LYS HEx 1.0 . 2.58 168 139 A 11 LYS HEy A 11 LYS HDx 1.0 . 2.58 169 139 A 11 LYS HDy A 11 LYS HEy 1.0 . 2.58 170 140 A 11 LYS HEy A 11 LYS HGy 1.0 . 3.65 171 140 A 11 LYS HGy A 11 LYS HEx 1.0 . 3.65 172 141 A 20 VAL HA A 20 VAL HGx% 1.0 . 3.74 173 142 A 20 VAL HA A 20 VAL HGy% 1.0 . 3.74 174 143 A 24 GLU HA A 24 GLU HGy 1.0 . 4.04 175 144 A 24 GLU HA A 24 GLU HGx 1.0 . 4.04 176 145 A 26 LEU HA A 26 LEU HDy% 1.0 . 4.12 177 146 A 35 GLU HGy A 35 GLU HBx 1.0 . 2.96 178 146 A 35 GLU HBy A 35 GLU HGy 1.0 . 2.96 179 147 A 42 ILE HD1% A 42 ILE HA 1.0 . 4.16 180 148 A 42 ILE HB A 42 ILE HD1% 1.0 . 3.53 181 149 A 42 ILE HD1% A 42 ILE HG2% 1.0 . 2.97 182 150 A 42 ILE HG2% A 42 ILE HA 1.0 . 3.46 183 151 A 60 LEU HA A 60 LEU HDx% 1.0 . 4.09 184 152 A 60 LEU HA A 60 LEU HG 1.0 . 3.82 185 153 A 60 LEU HDx% A 60 LEU HBy 1.0 . 3.69 186 154 A 60 LEU HDx% A 60 LEU HBx 1.0 . 3.69 187 155 A 60 LEU HA A 60 LEU HDy% 1.0 . 4.09 188 156 A 60 LEU HBy A 60 LEU HDy% 1.0 . 3.69 189 157 A 60 LEU HBx A 60 LEU HDy% 1.0 . 3.69 190 158 A 61 MET HA A 61 MET HGy 1.0 . 4.03 191 159 A 61 MET HA A 61 MET HE% 1.0 . 3.82 192 160 A 61 MET HE% A 61 MET HGy 1.0 . 3.47 193 161 A 61 MET HA A 61 MET HGx 1.0 . 4.03 194 162 A 61 MET HE% A 61 MET HGx 1.0 . 3.47 195 163 A 69 VAL HA A 69 VAL HGx% 1.0 . 3.31 196 164 A 69 VAL HA A 69 VAL HGy% 1.0 . 3.31 197 165 A 14 ARG HA A 14 ARG HDx 1.0 . 3.87 198 166 A 75 GLU HA A 75 GLU HBy 1.0 . 3.01 199 167 A 75 GLU HA A 75 GLU HGy 1.0 . 3.39 200 168 A 75 GLU HA A 75 GLU HGx 1.0 . 3.42 201 169 A 76 GLN HA A 76 GLN HGx 1.0 . 3.23 202 170 A 95 GLN HA A 95 GLN HGy 1.0 . 3.75 203 171 A 77 VAL HA A 77 VAL HGx% 1.0 . 3.33 204 172 A 79 LYS HA A 79 LYS HDx 1.0 . 4.13 205 172 A 79 LYS HA A 79 LYS HDy 1.0 . 4.13 206 173 A 79 LYS HA A 79 LYS HBx 1.0 . 2.99 207 173 A 79 LYS HA A 79 LYS HBy 1.0 . 2.99 208 174 A 79 LYS HBx A 79 LYS HEx 1.0 . 4.58 209 174 A 79 LYS HBy A 79 LYS HEx 1.0 . 4.58 210 174 A 79 LYS HEy A 79 LYS HBx 1.0 . 4.58 211 174 A 79 LYS HEy A 79 LYS HBy 1.0 . 4.58 212 175 A 79 LYS HA A 79 LYS HGy 1.0 . 3.50 213 176 A 79 LYS HDx A 79 LYS HGx 1.0 . 2.76 214 176 A 79 LYS HDy A 79 LYS HGx 1.0 . 2.76 215 177 A 76 GLN HA A 79 LYS HEx 1.0 . 4.50 216 177 A 79 LYS HEy A 76 GLN HA 1.0 . 4.50 217 178 A 85 LYS HA A 85 LYS HEx 1.0 . 4.99 218 178 A 85 LYS HEy A 85 LYS HA 1.0 . 4.99 219 179 A 79 LYS HDy A 79 LYS HEx 1.0 . 2.62 220 179 A 79 LYS HDx A 79 LYS HEx 1.0 . 2.62 221 179 A 79 LYS HEy A 79 LYS HDx 1.0 . 2.62 222 179 A 79 LYS HEy A 79 LYS HDy 1.0 . 2.62 223 180 A 76 GLN HA A 79 LYS HDx 1.0 . 3.46 224 180 A 76 GLN HA A 79 LYS HDy 1.0 . 3.46 225 181 A 80 ILE HG2% A 80 ILE HA 1.0 . 3.38 226 182 A 83 GLU HA A 83 GLU HGy 1.0 . 3.74 227 183 A 83 GLU HA A 83 GLU HGx 1.0 . 3.74 228 184 A 80 ILE HA A 83 GLU HBy 1.0 . 3.52 229 185 A 75 GLU HGx A 75 GLU HBx 1.0 . 2.62 230 186 A 85 LYS HA A 85 LYS HGx 1.0 . 3.30 231 186 A 85 LYS HGy A 85 LYS HA 1.0 . 3.30 232 187 A 85 LYS HA A 85 LYS HDy 1.0 . 4.17 233 188 A 85 LYS HA A 85 LYS HDx 1.0 . 4.17 234 189 A 75 GLU HBy A 79 LYS HEx 1.0 . 4.35 235 189 A 79 LYS HEy A 75 GLU HBy 1.0 . 4.35 236 190 A 79 LYS HEy A 79 LYS HGy 1.0 . 3.61 237 190 A 79 LYS HGy A 79 LYS HEx 1.0 . 3.61 238 191 A 79 LYS HEx A 79 LYS HGx 1.0 . 3.61 239 191 A 79 LYS HEy A 79 LYS HGx 1.0 . 3.61 240 192 A 85 LYS HEy A 85 LYS HGx 1.0 . 3.79 241 192 A 85 LYS HEx A 85 LYS HGx 1.0 . 3.79 242 192 A 85 LYS HGy A 85 LYS HEx 1.0 . 3.79 243 192 A 85 LYS HEy A 85 LYS HGy 1.0 . 3.79 244 193 A 79 LYS HA A 79 LYS HGx 1.0 . 3.50 245 194 A 88 THR HG2% A 88 THR HA 1.0 . 3.35 246 195 A 88 THR HG2% A 32 TYR HA 1.0 . 3.40 247 196 A 89 VAL HA A 89 VAL HGx% 1.0 . 3.48 248 197 A 90 GLU HA A 90 GLU HGy 1.0 . 3.67 249 198 A 90 GLU HA A 90 GLU HGx 1.0 . 3.67 250 199 A 91 GLN HA A 91 GLN HGx 1.0 . 3.32 251 199 A 91 GLN HA A 91 GLN HGy 1.0 . 3.32 252 200 A -1 ALA HA A 1 PRO HDy 1.0 . 3.60 253 201 A -1 ALA HA A 1 PRO HDx 1.0 . 3.60 254 202 A -1 ALA HA A 1 PRO HGy 1.0 . 5.30 255 203 A -1 ALA HA A 1 PRO HGx 1.0 . 5.30 256 204 A -1 ALA HB% A 1 PRO HDy 1.0 . 3.77 257 205 A -1 ALA HB% A 1 PRO HDx 1.0 . 3.77 258 206 A 55 VAL HA A 7 LEU HDx% 1.0 . 3.89 259 206 A 55 VAL HA A 7 LEU HDy% 1.0 . 3.89 260 207 A 7 LEU HA A 7 LEU HDx% 1.0 . 2.84 261 207 A 7 LEU HDy% A 7 LEU HA 1.0 . 2.84 262 208 A 5 VAL HGx% A 7 LEU HDx% 1.0 . 2.96 263 208 A 5 VAL HGx% A 7 LEU HDy% 1.0 . 2.96 264 209 A 57 ILE HD1% A 2 LEU HDx% 1.0 . 4.38 265 210 A 57 ILE HD1% A 57 ILE HA 1.0 . 3.57 266 211 A 7 LEU HA A 7 LEU HG 1.0 . 4.08 267 212 A 10 PHE HD% A 8 TYR HBx 1.0 . 5.50 268 213 A 9 GLU HBx A 22 PRO HDy 1.0 . 4.87 269 214 A 21 SER HA A 9 GLU HGx 1.0 . 4.95 270 215 A 22 PRO HDx A 9 GLU HGx 1.0 . 4.89 271 216 A 9 GLU HA A 9 GLU HGx 1.0 . 3.94 272 217 A 11 LYS HGy A 9 GLU HGx 1.0 . 4.75 273 218 A 75 GLU HGx A 74 ARG HGx 1.0 . 5.02 274 219 A 9 GLU HGy A 11 LYS HGy 1.0 . 4.75 275 220 A 9 GLU HA A 22 PRO HDx 1.0 . 3.94 276 221 A 9 GLU HA A 22 PRO HDy 1.0 . 4.34 277 222 A 9 GLU HA A 9 GLU HGy 1.0 . 3.94 278 223 A 11 LYS HEy A 11 LYS HBy 1.0 . 5.13 279 223 A 11 LYS HBy A 11 LYS HEx 1.0 . 5.13 280 224 A 11 LYS HEy A 11 LYS HBx 1.0 . 5.13 281 224 A 11 LYS HBx A 11 LYS HEx 1.0 . 5.13 282 225 A 6 THR HA A 6 THR HG2% 1.0 . 3.18 283 226 A 11 LYS HDy A 11 LYS HGx 1.0 . 2.87 284 226 A 11 LYS HDx A 11 LYS HGx 1.0 . 2.87 285 227 A 6 THR HG2% A 55 VAL HB 1.0 . 4.48 286 228 A 19 ASP HA A 11 LYS HA 1.0 . 4.10 287 229 A 11 LYS HA A 19 ASP HBy 1.0 . 5.30 288 230 A 11 LYS HA A 19 ASP HBx 1.0 . 5.30 289 231 A 11 LYS HA A 11 LYS HGy 1.0 . 3.73 290 232 A 12 ALA HB% A 18 LEU HG 1.0 . 5.50 291 233 A 14 ARG HBy A 14 ARG HDx 1.0 . 4.01 292 234 A 14 ARG HBy A 14 ARG HDy 1.0 . 4.01 293 235 A 75 GLU HGx A 74 ARG HDy 1.0 . 5.02 294 236 A 14 ARG HA A 14 ARG HDy 1.0 . 3.87 295 237 A 18 LEU HA A 18 LEU HDx% 1.0 . 4.54 296 238 A 18 LEU HDx% A 41 PRO HDx 1.0 . 5.50 297 239 A 18 LEU HDx% A 41 PRO HDy 1.0 . 5.50 298 240 A 18 LEU HBy A 18 LEU HDx% 1.0 . 3.77 299 240 A 18 LEU HDx% A 18 LEU HBx 1.0 . 3.77 300 241 A 18 LEU HA A 18 LEU HDy% 1.0 . 4.54 301 242 A 18 LEU HBx A 18 LEU HDy% 1.0 . 3.77 302 242 A 18 LEU HBy A 18 LEU HDy% 1.0 . 3.77 303 243 A 21 SER HA A 9 GLU HGy 1.0 . 4.95 304 244 A 21 SER HA A 9 GLU HBy 1.0 . 4.06 305 245 A 22 PRO HBy A 21 SER HA 1.0 . 5.30 306 246 A 21 SER HA A 22 PRO HGx 1.0 . 4.83 307 247 A 21 SER HA A 22 PRO HGy 1.0 . 4.73 308 248 A 21 SER HA A 22 PRO HDy 1.0 . 3.69 309 249 A 21 SER HA A 22 PRO HDx 1.0 . 3.82 310 250 A 28 ILE HA A 28 ILE HD1% 1.0 . 3.89 311 251 A 2 LEU HG A 28 ILE HB 1.0 . 4.83 312 252 A 28 ILE HA A 28 ILE HG2% 1.0 . 4.06 313 253 A 37 PHE HE% A 28 ILE HG2% 1.0 . 4.40 314 254 A 37 PHE HD% A 28 ILE HG2% 1.0 . 4.44 315 255 A 28 ILE HG2% A 30 ALA H 1.0 . 4.34 316 256 A 2 LEU HG A 28 ILE HG2% 1.0 . 4.38 317 257 A 28 ILE HG2% A 28 ILE HG1x 1.0 . 4.16 318 258 A 78 MET HE% A 78 MET HGy 1.0 . 3.40 319 259 A 78 MET HE% A 78 MET HGx 1.0 . 3.27 320 260 A 28 ILE HD1% A 28 ILE HG2% 1.0 . 3.04 321 261 A 28 ILE HD1% A 28 ILE HB 1.0 . 3.64 322 262 A 28 ILE HD1% A 37 PHE HBy 1.0 . 4.24 323 263 A 28 ILE HD1% A 55 VAL HB 1.0 . 4.79 324 264 A 28 ILE HD1% A 37 PHE HBx 1.0 . 4.89 325 265 A 37 PHE HZ A 28 ILE HD1% 1.0 . 4.74 326 266 A 37 PHE HE% A 28 ILE HD1% 1.0 . 4.24 327 267 A 37 PHE HD% A 28 ILE HD1% 1.0 . 4.14 328 268 A 57 ILE HD1% A 28 ILE HD1% 1.0 . 3.27 329 269 A 28 ILE HG2% A 28 ILE HG1y 1.0 . 4.16 330 270 A 32 TYR HBy A 35 GLU HBx 1.0 . 5.50 331 270 A 35 GLU HBy A 32 TYR HBy 1.0 . 5.50 332 271 B -5 PRO HBy A 35 GLU HBx 1.0 . 5.50 333 271 A 35 GLU HBy B -5 PRO HBy 1.0 . 5.50 334 272 A 52 VAL HA A 52 VAL HGx% 1.0 . 3.56 335 273 A 37 PHE HE% A 52 VAL HGx% 1.0 . 4.32 336 274 A 37 PHE HD% A 52 VAL HGx% 1.0 . 4.75 337 275 A 52 VAL H A 52 VAL HGx% 1.0 . 4.06 338 276 A 36 TRP HD1 A 35 GLU HGy 1.0 . 4.33 339 277 A 35 GLU HBx A 35 GLU HGx 1.0 . 2.96 340 277 A 35 GLU HBy A 35 GLU HGx 1.0 . 2.96 341 278 A 35 GLU HA A 35 GLU HGx 1.0 . 3.87 342 279 A 36 TRP HD1 A 36 TRP HA 1.0 . 4.79 343 280 A 52 VAL H A 36 TRP HA 1.0 . 4.16 344 281 A 36 TRP HA A 51 PRO HA 1.0 . 4.35 345 282 A 38 ILE HA A 38 ILE HG2% 1.0 . 3.88 346 283 A 38 ILE HG2% A 92 TRP HH2 1.0 . 4.46 347 284 A 38 ILE HG2% A 92 TRP HZ3 1.0 . 4.59 348 285 A 30 ALA H A 38 ILE HG2% 1.0 . 4.75 349 286 A 38 ILE HG2% A 38 ILE H 1.0 . 4.34 350 287 A 38 ILE HG2% A 29 CYS HBx 1.0 . 3.85 351 288 A 38 ILE HG2% A 47 PRO HBx 1.0 . 4.23 352 289 A 38 ILE HG2% A 89 VAL HGx% 1.0 . 4.89 353 290 A 38 ILE HG2% A 89 VAL HGy% 1.0 . 4.89 354 291 A 38 ILE HG2% A 38 ILE HG1x 1.0 . 3.74 355 292 A 38 ILE HG2% A 38 ILE HG1y 1.0 . 3.49 356 293 A 38 ILE HG2% A 38 ILE HD1% 1.0 . 3.42 357 294 A 38 ILE HD1% A 49 LEU HG 1.0 . 4.33 358 295 A 38 ILE HD1% A 38 ILE HB 1.0 . 3.90 359 296 A 32 TYR HBy A 38 ILE HD1% 1.0 . 4.82 360 297 A 38 ILE HD1% B -7 PHE HBx 1.0 . 3.75 361 297 A 38 ILE HD1% B -7 PHE HBy 1.0 . 3.75 362 298 A 89 VAL HA A 38 ILE HD1% 1.0 . 4.35 363 299 A 38 ILE HA A 38 ILE HD1% 1.0 . 3.90 364 300 A 38 ILE HD1% A 49 LEU HA 1.0 . 4.74 365 301 A 92 TRP HZ3 A 38 ILE HD1% 1.0 . 4.99 366 302 A 38 ILE HD1% B -7 PHE HD% 1.0 . 3.76 367 303 A 32 TYR HD% A 38 ILE HD1% 1.0 . 5.35 368 304 A 37 PHE HD% A 38 ILE HD1% 1.0 . 5.50 369 305 A 38 ILE H A 38 ILE HD1% 1.0 . 4.70 370 306 A 39 ALA H A 38 ILE HD1% 1.0 . 4.54 371 307 A 27 SER HBx A 40 LYS HBy 1.0 . 5.50 372 308 A 27 SER HBx A 40 LYS HBx 1.0 . 5.50 373 309 A 47 PRO HA A 40 LYS HGx 1.0 . 4.82 374 309 A 40 LYS HGy A 47 PRO HA 1.0 . 4.82 375 310 A 58 ILE HD1% A 63 PRO HGx 1.0 . 4.88 376 310 A 63 PRO HGy A 58 ILE HD1% 1.0 . 4.88 377 311 A 40 LYS HA A 41 PRO HGx 1.0 . 4.49 378 311 A 40 LYS HA A 41 PRO HGy 1.0 . 4.49 379 312 A 25 ASN HBx A 42 ILE HG1x 1.0 . 5.50 380 313 A 25 ASN HBy A 42 ILE HG1x 1.0 . 5.50 381 314 A 86 ILE HG2% A 86 ILE HG1y 1.0 . 4.04 382 315 A 42 ILE HB A 25 ASN HBx 1.0 . 4.95 383 316 A 43 ARG HA A 44 LEU HG 1.0 . 5.47 384 317 A 43 ARG HA A 44 LEU HDx% 1.0 . 5.50 385 318 A 43 ARG HA A 44 LEU HDy% 1.0 . 5.50 386 319 A 43 ARG HA A 43 ARG HDx 1.0 . 5.50 387 320 A 43 ARG HA A 43 ARG HDy 1.0 . 5.50 388 321 A 41 PRO HBy A 43 ARG HGx 1.0 . 4.39 389 322 A 41 PRO HBx A 43 ARG HGx 1.0 . 5.02 390 323 A 41 PRO HBy A 43 ARG HGy 1.0 . 4.39 391 324 A 41 PRO HBx A 43 ARG HGy 1.0 . 5.02 392 325 A 75 GLU HGx A 74 ARG HDx 1.0 . 5.02 393 326 A 44 LEU HBx A 44 LEU HDy% 1.0 . 3.58 394 327 A 44 LEU HBy A 44 LEU HDy% 1.0 . 3.58 395 328 A 44 LEU HA A 44 LEU HDy% 1.0 . 4.05 396 329 A 44 LEU HBx A 44 LEU HDx% 1.0 . 3.58 397 330 A 44 LEU HA A 44 LEU HDx% 1.0 . 4.05 398 331 A 44 LEU HG A 44 LEU HA 1.0 . 3.96 399 332 A 44 LEU HDx% A 44 LEU HBy 1.0 . 3.58 400 333 A 92 TRP HH2 A 47 PRO HGx 1.0 . 4.46 401 333 A 92 TRP HH2 A 47 PRO HGy 1.0 . 4.46 402 334 A 40 LYS HDy A 41 PRO HDy 1.0 . 5.50 403 334 A 41 PRO HDy A 40 LYS HDx 1.0 . 5.50 404 335 A 36 TRP HE3 A 49 LEU HA 1.0 . 5.50 405 336 B -5 PRO HGx A 49 LEU HDy% 1.0 . 5.22 406 337 B -5 PRO HGy A 49 LEU HDy% 1.0 . 4.62 407 338 B -5 PRO HDy A 49 LEU HDy% 1.0 . 4.57 408 338 A 49 LEU HDy% B -5 PRO HDx 1.0 . 4.57 409 339 A 38 ILE HA A 49 LEU HDy% 1.0 . 5.25 410 340 A 49 LEU HA A 49 LEU HDy% 1.0 . 4.79 411 341 A 32 TYR HD% A 49 LEU HDy% 1.0 . 5.35 412 342 A 50 VAL H A 49 LEU HDy% 1.0 . 4.98 413 343 A 49 LEU HG B -7 PHE HD% 1.0 . 4.86 414 344 A 49 LEU HG A 49 LEU H 1.0 . 5.08 415 345 B -5 PRO HBx A 49 LEU HDx% 1.0 . 3.81 416 346 B -7 PHE HBy A 49 LEU HDx% 1.0 . 4.73 417 346 A 49 LEU HDx% B -7 PHE HBx 1.0 . 4.73 418 347 A 49 LEU HA A 49 LEU HDx% 1.0 . 4.79 419 348 A 32 TYR HD% A 49 LEU HDx% 1.0 . 5.35 420 349 A 49 LEU H A 49 LEU HDx% 1.0 . 4.95 421 350 A 53 SER HA A 71 THR HB 1.0 . 4.15 422 351 A 77 VAL HGy% A 52 VAL HGy% 1.0 . 3.83 423 352 A 52 VAL HA A 52 VAL HGy% 1.0 . 3.56 424 353 A 37 PHE HZ A 52 VAL HGy% 1.0 . 4.99 425 354 A 37 PHE HD% A 52 VAL HGy% 1.0 . 4.75 426 355 A 52 VAL H A 52 VAL HGy% 1.0 . 4.06 427 356 A 52 VAL HB A 53 SER HBx 1.0 . 5.50 428 356 A 52 VAL HB A 53 SER HBy 1.0 . 5.50 429 357 A 71 THR HB A 52 VAL HB 1.0 . 4.97 430 358 A 54 TYR HA A 8 TYR HE% 1.0 . 4.34 431 359 A 8 TYR HD% A 54 TYR HA 1.0 . 3.91 432 360 A 10 PHE HD% A 54 TYR HBy 1.0 . 4.80 433 361 A 10 PHE HD% A 54 TYR HBx 1.0 . 4.80 434 362 A 8 TYR H A 54 TYR HA 1.0 . 5.06 435 363 A 5 VAL HGx% A 55 VAL HA 1.0 . 5.29 436 364 A 55 VAL HB A 56 ARG H 1.0 . 4.43 437 365 A 4 ALA HB% A 55 VAL HB 1.0 . 3.88 438 366 A 28 ILE HD1% A 55 VAL HGx% 1.0 . 4.15 439 367 A 28 ILE HD1% A 55 VAL HGy% 1.0 . 4.15 440 368 A 28 ILE HD1% A 86 ILE HD1% 1.0 . 4.65 441 369 A 6 THR HA A 55 VAL HGy% 1.0 . 4.77 442 370 A 55 VAL HA A 55 VAL HGy% 1.0 . 3.71 443 371 A 55 VAL H A 55 VAL HGy% 1.0 . 3.79 444 372 A 52 VAL HA A 55 VAL HGx% 1.0 . 4.71 445 373 A 6 THR HA A 55 VAL HGx% 1.0 . 4.77 446 374 A 55 VAL HA A 55 VAL HGx% 1.0 . 3.71 447 375 A 56 ARG H A 55 VAL HGx% 1.0 . 4.21 448 376 A 56 ARG HA A 55 VAL HGy% 1.0 . 5.50 449 377 A 56 ARG HA A 7 LEU HDx% 1.0 . 3.82 450 377 A 7 LEU HDy% A 56 ARG HA 1.0 . 3.82 451 378 A 5 VAL HGx% A 56 ARG HA 1.0 . 4.58 452 379 A 4 ALA HB% A 56 ARG HA 1.0 . 4.96 453 380 A 56 ARG HA A 55 VAL HGx% 1.0 . 5.50 454 381 A 5 VAL HGx% A 56 ARG HBy 1.0 . 4.42 455 382 A 56 ARG HGx A 7 LEU HDx% 1.0 . 4.31 456 382 A 7 LEU HDy% A 56 ARG HGx 1.0 . 4.31 457 383 A 7 LEU HDy% A 56 ARG HDy 1.0 . 3.97 458 383 A 56 ARG HDy A 7 LEU HDx% 1.0 . 3.97 459 384 A 5 VAL HGx% A 56 ARG HDy 1.0 . 3.94 460 385 A 7 LEU HDx% A 56 ARG HDx 1.0 . 3.97 461 385 A 7 LEU HDy% A 56 ARG HDx 1.0 . 3.97 462 386 A 5 VAL HGx% A 56 ARG HDx 1.0 . 3.94 463 387 A 67 ALA HA A 56 ARG HDx 1.0 . 4.40 464 388 A 67 ALA HA A 56 ARG HDy 1.0 . 4.40 465 389 A 7 LEU HDy% A 56 ARG HGy 1.0 . 4.31 466 389 A 7 LEU HDx% A 56 ARG HGy 1.0 . 4.31 467 390 A 14 ARG HGy A 13 GLU HBx 1.0 . 3.52 468 390 A 13 GLU HBy A 14 ARG HGy 1.0 . 3.52 469 391 A 4 ALA HB% A 57 ILE HB 1.0 . 5.13 470 392 A 57 ILE HA A 57 ILE HG2% 1.0 . 3.33 471 393 A 57 ILE HG2% A 66 TYR HBy 1.0 . 4.44 472 394 A 57 ILE HG2% A 66 TYR HBx 1.0 . 4.51 473 395 A 57 ILE HG2% A 58 ILE HA 1.0 . 4.78 474 396 A 2 LEU HA A 57 ILE HG2% 1.0 . 5.50 475 397 A 57 ILE HG2% A 66 TYR HD% 1.0 . 3.93 476 398 A 37 PHE HZ A 57 ILE HG2% 1.0 . 4.87 477 399 A 84 PHE HD% A 57 ILE HG2% 1.0 . 4.95 478 400 A 57 ILE HG2% A 2 LEU HDx% 1.0 . 4.25 479 401 A 57 ILE HG2% A 2 LEU HDy% 1.0 . 4.25 480 402 A 57 ILE HG2% A 57 ILE HG1y 1.0 . 3.50 481 403 A 57 ILE HG2% A 57 ILE HG1x 1.0 . 3.50 482 404 A 57 ILE HA A 5 VAL HGx% 1.0 . 5.26 483 405 A 58 ILE HD1% A 58 ILE HA 1.0 . 4.50 484 406 A 58 ILE HB A 63 PRO HA 1.0 . 4.90 485 407 A 80 ILE HG2% A 84 PHE HE% 1.0 . 3.82 486 408 A 80 ILE HG2% A 80 ILE HG1y 1.0 . 3.53 487 409 A 58 ILE HD1% A 25 ASN HD2y 1.0 . 4.19 488 410 A 4 ALA HA A 58 ILE HD1% 1.0 . 3.97 489 411 A 58 ILE HD1% A 3 PHE HBy 1.0 . 4.03 490 412 A 58 ILE HD1% A 3 PHE HBx 1.0 . 4.03 491 413 A 76 GLN HGy A 80 ILE HD1% 1.0 . 5.50 492 414 A 58 ILE HD1% A 63 PRO HBy 1.0 . 4.70 493 415 A 63 PRO HA A 58 ILE HG1x 1.0 . 5.50 494 415 A 58 ILE HG1y A 63 PRO HA 1.0 . 5.50 495 416 A 5 VAL HGx% A 58 ILE HG1x 1.0 . 3.14 496 416 A 58 ILE HG1y A 5 VAL HGx% 1.0 . 3.14 497 417 A 5 VAL HGx% A 58 ILE HD1% 1.0 . 2.81 498 418 A 58 ILE HG2% A 58 ILE HG1x 1.0 . 3.35 499 418 A 58 ILE HG1y A 58 ILE HG2% 1.0 . 3.35 500 419 A 5 VAL HGx% A 58 ILE HG2% 1.0 . 2.58 501 420 A 3 PHE HD% A 60 LEU HG 1.0 . 5.18 502 421 A 3 PHE HE% A 60 LEU HG 1.0 . 5.48 503 422 A 60 LEU HA A 63 PRO HBx 1.0 . 4.40 504 423 A 3 PHE HD% A 61 MET HE% 1.0 . 5.50 505 424 A 3 PHE HE% A 61 MET HE% 1.0 . 5.50 506 425 A 60 LEU HA A 61 MET HE% 1.0 . 4.69 507 426 A -2 MET HE% A 87 PRO HGy 1.0 . 4.30 508 427 A 64 ALA HB% A 65 LYS HBy 1.0 . 4.86 509 428 A 64 ALA HB% A 65 LYS HEx 1.0 . 5.50 510 428 A 64 ALA HB% A 65 LYS HEy 1.0 . 5.50 511 429 A 64 ALA HB% A 63 PRO HA 1.0 . 5.14 512 430 A 66 TYR HD% A 65 LYS HBx 1.0 . 4.81 513 431 A 65 LYS HBy A 66 TYR HE% 1.0 . 5.00 514 432 A 65 LYS HBy A 65 LYS HDy 1.0 . 3.84 515 433 A 65 LYS HBy A 65 LYS HDx 1.0 . 3.84 516 434 A 65 LYS HBx A 65 LYS HDy 1.0 . 3.86 517 435 A 65 LYS HBx A 65 LYS HDx 1.0 . 3.86 518 436 A 65 LYS HA A 65 LYS HDx 1.0 . 4.98 519 437 A 66 TYR HD% A 65 LYS HEx 1.0 . 5.09 520 437 A 66 TYR HD% A 65 LYS HEy 1.0 . 5.09 521 438 A 65 LYS HBy A 65 LYS HEx 1.0 . 4.05 522 438 A 65 LYS HBy A 65 LYS HEy 1.0 . 4.05 523 439 A 65 LYS HBx A 65 LYS HEx 1.0 . 4.14 524 439 A 65 LYS HEy A 65 LYS HBx 1.0 . 4.14 525 440 A 65 LYS HGy A 65 LYS HEx 1.0 . 3.37 526 440 A 65 LYS HEy A 65 LYS HGy 1.0 . 3.37 527 441 A 65 LYS HEy A 65 LYS HGx 1.0 . 3.37 528 441 A 65 LYS HEx A 65 LYS HGx 1.0 . 3.37 529 442 A 42 ILE HD1% A 3 PHE HBx 1.0 . 5.21 530 443 A 65 LYS HA A 65 LYS HDy 1.0 . 4.98 531 444 A 27 SER HA A 39 ALA HB% 1.0 . 4.84 532 445 A 67 ALA HB% A 63 PRO HBx 1.0 . 5.50 533 446 A 67 ALA HB% A 63 PRO HGx 1.0 . 5.50 534 446 A 67 ALA HB% A 63 PRO HGy 1.0 . 5.50 535 447 A -1 ALA HB% A 2 LEU HBx 1.0 . 5.01 536 447 A -1 ALA HB% A 2 LEU HBy 1.0 . 5.01 537 448 A 67 ALA HB% A 58 ILE HG1x 1.0 . 5.50 538 448 A 58 ILE HG1y A 67 ALA HB% 1.0 . 5.50 539 449 A 67 ALA HB% A 63 PRO HBy 1.0 . 4.87 540 450 A 67 ALA HB% A 56 ARG HDx 1.0 . 4.31 541 451 A 67 ALA HB% A 63 PRO HA 1.0 . 4.74 542 452 A 32 TYR HD% A 33 ASP HA 1.0 . 5.50 543 453 A 67 ALA HB% A 68 SER HA 1.0 . 4.19 544 454 A 66 TYR HD% A 69 VAL HGx% 1.0 . 4.30 545 455 A 32 TYR HD% A 89 VAL HGy% 1.0 . 4.06 546 456 A 66 TYR HE% A 69 VAL HGy% 1.0 . 5.50 547 457 A 69 VAL HA A 80 ILE HD1% 1.0 . 5.18 548 458 A 71 THR HG2% A 70 ASP HA 1.0 . 4.88 549 459 A 71 THR HG2% A 71 THR HA 1.0 . 2.95 550 460 A 71 THR HG2% A 52 VAL HA 1.0 . 4.87 551 461 A 57 ILE HD1% A 71 THR HG2% 1.0 . 3.16 552 462 A 88 THR HG2% A 32 TYR HE% 1.0 . 5.31 553 463 A 37 PHE HE% A 71 THR HG2% 1.0 . 5.50 554 464 A 88 THR HG2% A 32 TYR HD% 1.0 . 5.03 555 465 A 57 ILE HB A 71 THR HG2% 1.0 . 3.99 556 466 A 77 VAL HGx% A 76 GLN HA 1.0 . 5.50 557 467 A 77 VAL HGx% A 78 MET HA 1.0 . 4.10 558 468 A 77 VAL HGx% A 34 TYR HA 1.0 . 3.57 559 469 A 34 TYR HBy A 77 VAL HGx% 1.0 . 3.66 560 470 A 77 VAL HGx% A 34 TYR HBx 1.0 . 3.76 561 471 A 77 VAL HGx% A 52 VAL HB 1.0 . 4.79 562 472 A 77 VAL HGx% A 74 ARG HBy 1.0 . 4.28 563 473 A 72 TYR HA A 72 TYR HD% 1.0 . 3.62 564 474 A 53 SER HA A 72 TYR HA 1.0 . 4.40 565 475 A 71 THR HA A 72 TYR HA 1.0 . 4.91 566 476 A 60 LEU HG A 61 MET HE% 1.0 . 4.66 567 477 A 34 TYR HBy A 74 ARG HBy 1.0 . 4.39 568 478 A 78 MET HE% A 75 GLU HBx 1.0 . 4.43 569 479 A 76 GLN HA A 79 LYS HBx 1.0 . 3.80 570 479 A 76 GLN HA A 79 LYS HBy 1.0 . 3.80 571 480 A 76 GLN HA A 78 MET HBx 1.0 . 5.30 572 480 A 76 GLN HA A 78 MET HBy 1.0 . 5.30 573 481 A 76 GLN HA A 79 LYS HGy 1.0 . 5.50 574 482 A 77 VAL HA A 76 GLN HA 1.0 . 5.04 575 483 A 75 GLU HA A 76 GLN HA 1.0 . 4.86 576 484 A 77 VAL HGy% A 52 VAL HGx% 1.0 . 3.83 577 485 A 71 THR HG2% A 77 VAL HGy% 1.0 . 3.05 578 486 A 37 PHE HE% A 77 VAL HGx% 1.0 . 4.46 579 487 A 77 VAL HA A 77 VAL HGy% 1.0 . 2.99 580 488 A 52 VAL HA A 77 VAL HGy% 1.0 . 4.97 581 489 A 77 VAL HGy% A 34 TYR HBx 1.0 . 4.44 582 490 A 71 THR HB A 77 VAL HGy% 1.0 . 3.91 583 491 A 77 VAL HGy% A 52 VAL HB 1.0 . 4.09 584 492 A 78 MET HGy A 78 MET HA 1.0 . 3.86 585 493 A 78 MET HGx A 78 MET HA 1.0 . 3.97 586 494 A 74 ARG HA A 78 MET HGx 1.0 . 4.79 587 495 A 75 GLU HA A 78 MET HGx 1.0 . 5.18 588 496 A 78 MET HE% A 74 ARG HBy 1.0 . 2.40 589 497 A 78 MET HE% A 75 GLU HGx 1.0 . 3.50 590 498 A 78 MET HE% A 75 GLU HGy 1.0 . 3.58 591 499 A 78 MET HE% A 34 TYR HBx 1.0 . 5.11 592 500 A 34 TYR HE% A 78 MET HGx 1.0 . 4.51 593 501 A 34 TYR HD% A 78 MET HGx 1.0 . 3.99 594 502 A 79 LYS HBy A 79 LYS HDx 1.0 . 3.05 595 502 A 79 LYS HBx A 79 LYS HDx 1.0 . 3.05 596 502 A 79 LYS HDy A 79 LYS HBx 1.0 . 3.05 597 502 A 79 LYS HDy A 79 LYS HBy 1.0 . 3.05 598 503 A 79 LYS HGy A 79 LYS HDx 1.0 . 2.76 599 503 A 79 LYS HDy A 79 LYS HGy 1.0 . 2.76 600 504 A 75 GLU HBy A 79 LYS HDx 1.0 . 3.98 601 504 A 75 GLU HBy A 79 LYS HDy 1.0 . 3.98 602 505 A 79 LYS HA A 82 ASP HBy 1.0 . 4.11 603 506 A 79 LYS HA A 82 ASP HBx 1.0 . 4.11 604 507 A 79 LYS HA A 79 LYS HEx 1.0 . 4.81 605 507 A 79 LYS HEy A 79 LYS HA 1.0 . 4.81 606 508 A 80 ILE HA A 83 GLU HBx 1.0 . 4.94 607 509 A 80 ILE HB A 77 VAL HGy% 1.0 . 4.38 608 510 A 4 ALA HA A 58 ILE HG2% 1.0 . 4.21 609 511 A 58 ILE HD1% A 58 ILE HB 1.0 . 3.25 610 512 A 5 VAL HB A 58 ILE HD1% 1.0 . 3.56 611 513 A 80 ILE HD1% A 69 VAL HB 1.0 . 3.98 612 514 A 80 ILE HD1% A 69 VAL HGy% 1.0 . 3.24 613 515 A 77 VAL HA A 80 ILE HD1% 1.0 . 3.59 614 516 A 80 ILE HA A 80 ILE HD1% 1.0 . 4.05 615 517 A 40 LYS HDy A 41 PRO HDx 1.0 . 5.50 616 517 A 40 LYS HDx A 41 PRO HDx 1.0 . 5.50 617 518 A 80 ILE HB A 80 ILE HD1% 1.0 . 3.58 618 519 A 58 ILE HG2% A 58 ILE HD1% 1.0 . 2.69 619 520 A 80 ILE HG2% A 80 ILE HD1% 1.0 . 3.04 620 521 A 80 ILE HD1% A 69 VAL H 1.0 . 5.50 621 522 A 84 PHE HD% A 80 ILE HD1% 1.0 . 5.50 622 523 A 2 LEU HA A 2 LEU HDx% 1.0 . 4.75 623 524 A 86 ILE HG2% A 2 LEU HG 1.0 . 4.42 624 525 A 2 LEU HDx% A 2 LEU HBx 1.0 . 4.19 625 525 A 2 LEU HBy A 2 LEU HDx% 1.0 . 4.19 626 526 A 84 PHE HD% A 2 LEU HDx% 1.0 . 4.89 627 527 A 84 PHE HE% A 2 LEU HDx% 1.0 . 5.50 628 528 A 86 ILE HG2% A 2 LEU HDx% 1.0 . 4.32 629 529 A 86 ILE HG2% A 2 LEU HDy% 1.0 . 4.32 630 530 A 2 LEU HBy A 2 LEU HDy% 1.0 . 4.19 631 530 A 2 LEU HBx A 2 LEU HDy% 1.0 . 4.19 632 531 A 84 PHE HE% A 2 LEU HDy% 1.0 . 5.50 633 532 A 84 PHE HD% A 2 LEU HDy% 1.0 . 4.89 634 533 A 81 ILE HG2% A 81 ILE HD1% 1.0 . 2.40 635 534 A 78 MET HGx A 81 ILE HD1% 1.0 . 5.10 636 535 A 88 THR HG2% A 81 ILE HD1% 1.0 . 5.50 637 536 A 81 ILE HD1% A 81 ILE HB 1.0 . 3.57 638 537 A 81 ILE HD1% A 31 HIS HBx 1.0 . 4.74 639 538 A 81 ILE HD1% A 31 HIS HBy 1.0 . 4.74 640 539 A 34 TYR HBy A 81 ILE HD1% 1.0 . 4.70 641 540 A 34 TYR HA A 81 ILE HD1% 1.0 . 3.53 642 541 A 77 VAL HA A 81 ILE HD1% 1.0 . 4.41 643 542 A 78 MET HA A 81 ILE HD1% 1.0 . 4.09 644 543 A 37 PHE HE% A 81 ILE HD1% 1.0 . 3.68 645 544 A 37 PHE HD% A 81 ILE HD1% 1.0 . 4.54 646 545 A 81 ILE HG2% A 81 ILE HG1y 1.0 . 4.02 647 546 A 81 ILE HG2% A 81 ILE HG1x 1.0 . 3.85 648 547 A 81 ILE HA A 86 ILE HD1% 1.0 . 4.04 649 548 A 81 ILE HA A 81 ILE HD1% 1.0 . 3.85 650 549 A 81 ILE HG2% A 81 ILE HA 1.0 . 3.71 651 550 A 37 PHE HZ A 81 ILE HA 1.0 . 4.85 652 551 A 34 TYR HD% A 81 ILE HD1% 1.0 . 3.19 653 552 A 86 ILE HG2% A 81 ILE HA 1.0 . 4.52 654 553 A 37 PHE HZ A 77 VAL HGy% 1.0 . 5.18 655 554 A 34 TYR HD% A 77 VAL HGx% 1.0 . 3.39 656 555 A 52 VAL HA A 55 VAL HGy% 1.0 . 4.71 657 556 A 86 ILE HG2% A 30 ALA H 1.0 . 4.90 658 557 A 37 PHE HD% A 86 ILE HG2% 1.0 . 4.70 659 558 A 37 PHE HE% A 86 ILE HG2% 1.0 . 4.56 660 559 A 37 PHE HZ A 86 ILE HG2% 1.0 . 4.61 661 560 A 86 ILE HG2% A 31 HIS HA 1.0 . 5.04 662 561 A 86 ILE HG2% A 86 ILE HA 1.0 . 3.62 663 562 A 86 ILE HG2% A 87 PRO HDy 1.0 . 3.95 664 563 A 86 ILE HG2% A 87 PRO HDx 1.0 . 3.91 665 564 A 86 ILE HG2% A 31 HIS HBy 1.0 . 4.95 666 565 A 86 ILE HG2% A 31 HIS HBx 1.0 . 4.95 667 566 A 86 ILE HG2% A 87 PRO HGy 1.0 . 4.54 668 567 A 86 ILE HG2% A -2 MET HE% 1.0 . 4.07 669 568 A 86 ILE HG2% A 86 ILE HD1% 1.0 . 3.09 670 569 A 86 ILE HG2% A 28 ILE HG2% 1.0 . 3.70 671 570 A 28 ILE HG2% A 86 ILE HD1% 1.0 . 3.83 672 571 A 86 ILE HG2% A 86 ILE HG1x 1.0 . 4.04 673 572 A 86 ILE HD1% A 86 ILE HB 1.0 . 3.85 674 573 A 86 ILE HD1% A 84 PHE HBx 1.0 . 4.91 675 574 A 86 ILE HD1% A 84 PHE HBy 1.0 . 4.91 676 575 A 86 ILE HD1% A 87 PRO HDx 1.0 . 4.88 677 576 A 86 ILE HD1% A 86 ILE HA 1.0 . 3.89 678 577 A 37 PHE HZ A 86 ILE HD1% 1.0 . 4.89 679 578 A 30 ALA HB% A 38 ILE HG2% 1.0 . 4.40 680 579 A 86 ILE HD1% A 57 ILE HG2% 1.0 . 3.98 681 580 A 57 ILE HD1% A 86 ILE HD1% 1.0 . 4.54 682 581 A 81 ILE HG1x A 86 ILE HD1% 1.0 . 4.15 683 582 A 92 TRP HA A 87 PRO HBx 1.0 . 4.33 684 582 A 87 PRO HBy A 92 TRP HA 1.0 . 4.33 685 583 A 30 ALA HB% A 87 PRO HBx 1.0 . 4.69 686 583 A 30 ALA HB% A 87 PRO HBy 1.0 . 4.69 687 584 A 27 SER HA A 3 PHE HD% 1.0 . 4.34 688 585 A 86 ILE HG2% A 87 PRO HGx 1.0 . 4.71 689 586 A 87 PRO HGy A 86 ILE HA 1.0 . 4.67 690 587 A 87 PRO HGy A 92 TRP HA 1.0 . 5.20 691 588 A 86 ILE HA A 87 PRO HGx 1.0 . 4.34 692 589 A 30 ALA HB% A 87 PRO HDy 1.0 . 5.07 693 590 A 88 THR HA A 87 PRO HA 1.0 . 5.00 694 591 A 88 THR HG2% A 31 HIS HD2 1.0 . 4.25 695 592 A 90 GLU HBy A 89 VAL HGx% 1.0 . 5.50 696 592 A 89 VAL HGx% A 90 GLU HBx 1.0 . 5.50 697 593 A 30 ALA HB% A 89 VAL HA 1.0 . 3.55 698 594 B -6 ILE HA A 89 VAL HGy% 1.0 . 4.69 699 595 A 89 VAL HA A 89 VAL HGy% 1.0 . 3.48 700 596 B -7 PHE HBy A 89 VAL HGy% 1.0 . 4.15 701 596 A 89 VAL HGy% B -7 PHE HBx 1.0 . 4.15 702 597 A 92 TRP HE3 A 89 VAL HGy% 1.0 . 4.69 703 598 A 66 TYR HE% A 69 VAL HGx% 1.0 . 5.50 704 599 A 32 TYR HBx A 89 VAL HGy% 1.0 . 4.39 705 600 A 38 ILE HD1% A 89 VAL HGy% 1.0 . 3.61 706 601 A 89 VAL HB B -6 ILE HD1% 1.0 . 4.17 707 602 A 32 TYR HD% A 89 VAL HB 1.0 . 3.94 708 603 A 30 ALA HB% A 92 TRP HBx 1.0 . 4.00 709 604 A 32 TYR HE% A 89 VAL HGx% 1.0 . 4.88 710 605 A 38 ILE HD1% A 89 VAL HGx% 1.0 . 3.61 711 606 A 84 PHE HA A 83 GLU HBx 1.0 . 4.26 712 607 A 30 ALA HB% A 92 TRP HA 1.0 . 4.42 713 608 A 87 PRO HGy A 92 TRP HBx 1.0 . 5.50 714 609 A 87 PRO HGy A 92 TRP HBy 1.0 . 5.50 715 610 A 89 VAL HA A 92 TRP HBx 1.0 . 4.40 716 611 A 92 TRP HA A 95 GLN HBx 1.0 . 3.82 717 611 A 92 TRP HA A 95 GLN HBy 1.0 . 3.82 718 612 A 92 TRP HA A 95 GLN HGx 1.0 . 4.76 719 613 A 92 TRP HA A 95 GLN HGy 1.0 . 4.76 720 614 A 89 VAL HA A 92 TRP HA 1.0 . 5.50 721 615 A 30 ALA HB% A 92 TRP HBy 1.0 . 4.00 722 616 A 30 ALA HB% A 92 TRP HE3 1.0 . 4.27 723 617 A 93 LYS HA A 93 LYS HGx 1.0 . 3.94 724 618 A 93 LYS HA A 93 LYS HGy 1.0 . 3.94 725 619 A 93 LYS HA A 93 LYS HEx 1.0 . 4.57 726 619 A 93 LYS HEy A 93 LYS HA 1.0 . 4.57 727 620 A 93 LYS HA A 96 THR HB 1.0 . 4.59 728 621 A 39 ALA HB% A 37 PHE HBy 1.0 . 3.92 729 622 A 32 TYR HBy B -5 PRO HGx 1.0 . 4.77 730 623 B -6 ILE HD1% A 93 LYS HEx 1.0 . 5.46 731 623 A 93 LYS HEy B -6 ILE HD1% 1.0 . 5.46 732 624 A 93 LYS HA A 97 ARG HGx 1.0 . 5.16 733 625 A 93 LYS HEy A 93 LYS HGy 1.0 . 4.05 734 625 A 93 LYS HGy A 93 LYS HEx 1.0 . 4.05 735 626 A 96 THR HG2% A 95 GLN HA 1.0 . 5.50 736 627 A 97 ARG HA A 96 THR HG2% 1.0 . 5.50 737 628 A 97 ARG HA A 97 ARG HDx 1.0 . 3.81 738 628 A 97 ARG HA A 97 ARG HDy 1.0 . 3.81 739 629 A 97 ARG HBy A 97 ARG HDx 1.0 . 3.18 740 629 A 97 ARG HBx A 97 ARG HDx 1.0 . 3.18 741 629 A 97 ARG HDy A 97 ARG HBx 1.0 . 3.18 742 629 A 97 ARG HBy A 97 ARG HDy 1.0 . 3.18 743 630 A 98 ARG HDy A 98 ARG HBx 1.0 . 3.58 744 630 A 98 ARG HBy A 98 ARG HDy 1.0 . 3.58 745 631 A 98 ARG HBx A 98 ARG HDx 1.0 . 3.58 746 631 A 98 ARG HBy A 98 ARG HDx 1.0 . 3.58 747 632 A 98 ARG HA A 98 ARG HGy 1.0 . 4.10 748 633 A 96 THR HA A 99 TYR HBy 1.0 . 4.73 749 634 A 96 THR HB A 99 TYR HBy 1.0 . 5.05 750 635 A 100 LYS HA A 100 LYS HGy 1.0 . 3.78 751 636 A 40 LYS HDx A 40 LYS HGx 1.0 . 2.83 752 636 A 40 LYS HDy A 40 LYS HGx 1.0 . 2.83 753 636 A 40 LYS HGy A 40 LYS HDx 1.0 . 2.83 754 636 A 40 LYS HGy A 40 LYS HDy 1.0 . 2.83 755 637 A 11 LYS HEx A 11 LYS HGx 1.0 . 3.65 756 637 A 11 LYS HEy A 11 LYS HGx 1.0 . 3.65 757 638 A 93 LYS HEx A 93 LYS HGx 1.0 . 4.05 758 638 A 93 LYS HEy A 93 LYS HGx 1.0 . 4.05 759 639 A 40 LYS HEx A 40 LYS HGx 1.0 . 3.36 760 639 A 40 LYS HEy A 40 LYS HGx 1.0 . 3.36 761 639 A 40 LYS HGy A 40 LYS HEx 1.0 . 3.36 762 639 A 40 LYS HGy A 40 LYS HEy 1.0 . 3.36 763 640 A 37 PHE HBy A 50 VAL HGx% 1.0 . 5.12 764 641 A 9 GLU HBx A 11 LYS HEx 1.0 . 5.20 765 641 A 11 LYS HEy A 9 GLU HBx 1.0 . 5.20 766 642 A 28 ILE HA A 37 PHE HBy 1.0 . 5.25 767 643 A 100 LYS HA A 100 LYS HGx 1.0 . 3.78 768 644 A 117 GLU HA A 117 GLU HGx 1.0 . 3.95 769 645 A 117 GLU HA A 117 GLU HGy 1.0 . 3.95 770 646 A 100 LYS HA A 99 TYR HD% 1.0 . 4.79 771 647 A 98 ARG HA A 101 GLU HBy 1.0 . 4.54 772 648 A 98 ARG HA A 101 GLU HBx 1.0 . 4.54 773 649 A 103 SER HA A 104 ILE HB 1.0 . 5.31 774 650 A 103 SER HA A 103 SER HBx 1.0 . 2.81 775 650 A 103 SER HA A 103 SER HBy 1.0 . 2.81 776 651 A 113 SER HA A 113 SER HBx 1.0 . 3.02 777 651 A 113 SER HA A 113 SER HBy 1.0 . 3.02 778 652 A 103 SER HA A 104 ILE HA 1.0 . 4.85 779 653 A 104 ILE HA A 103 SER HBx 1.0 . 4.57 780 653 A 103 SER HBy A 104 ILE HA 1.0 . 4.57 781 654 A 104 ILE HG2% A 104 ILE HD1% 1.0 . 2.57 782 655 A 106 ILE HG2% A 106 ILE HD1% 1.0 . 2.77 783 656 A 104 ILE HG2% A 104 ILE HG1x 1.0 . 3.66 784 657 A 106 ILE HG2% A 106 ILE HG1x 1.0 . 3.80 785 658 A 104 ILE HG2% A 104 ILE HG1y 1.0 . 3.66 786 659 A 106 ILE HG2% A 106 ILE HG1y 1.0 . 3.80 787 660 A 104 ILE HG2% A 105 GLN HGx 1.0 . 4.42 788 660 A 105 GLN HGy A 104 ILE HG2% 1.0 . 4.42 789 661 A 104 ILE HA A 104 ILE HG1y 1.0 . 4.01 790 662 A 104 ILE HA A 104 ILE HG1x 1.0 . 4.01 791 663 A 104 ILE HA A 104 ILE HG2% 1.0 . 3.01 792 664 A 106 ILE HG2% A 106 ILE HA 1.0 . 3.31 793 665 A 98 ARG HA A 98 ARG HGx 1.0 . 4.10 794 666 A 104 ILE HB A 104 ILE HD1% 1.0 . 3.17 795 667 A 106 ILE HD1% A 106 ILE HB 1.0 . 3.53 796 668 A 104 ILE HA A 104 ILE HD1% 1.0 . 4.11 797 669 A 106 ILE HD1% A 106 ILE HA 1.0 . 4.30 798 670 A 104 ILE HD1% A 103 SER HBx 1.0 . 4.14 799 670 A 103 SER HBy A 104 ILE HD1% 1.0 . 4.14 800 671 A 105 GLN HA A 106 ILE HD1% 1.0 . 5.35 801 672 A 104 ILE HD1% A 105 GLN HGx 1.0 . 5.50 802 672 A 105 GLN HGy A 104 ILE HD1% 1.0 . 5.50 803 673 A 106 ILE HD1% A 105 GLN HGx 1.0 . 5.50 804 673 A 105 GLN HGy A 106 ILE HD1% 1.0 . 5.50 805 674 A 106 ILE HD1% A 105 GLN HBy 1.0 . 5.36 806 675 A 106 ILE HD1% A 105 GLN HBx 1.0 . 5.36 807 676 A 114 GLN HGy A 116 LEU HDx% 1.0 . 5.43 808 676 A 116 LEU HDx% A 114 GLN HGx 1.0 . 5.43 809 677 A 105 GLN HGy A 105 GLN HBx 1.0 . 2.95 810 677 A 105 GLN HBx A 105 GLN HGx 1.0 . 2.95 811 678 A 116 LEU HA A 116 LEU HDx% 1.0 . 4.23 812 679 A 116 LEU HA A 116 LEU HG 1.0 . 3.55 813 680 A 116 LEU HBy A 116 LEU HDy% 1.0 . 3.97 814 681 A 116 LEU HA A 116 LEU HDy% 1.0 . 4.23 815 682 A 116 LEU HDx% A 116 LEU HBy 1.0 . 3.97 816 683 A 116 LEU HDx% A 116 LEU HBx 1.0 . 3.97 817 684 A 116 LEU HBx A 116 LEU HDy% 1.0 . 3.97 818 685 A 86 ILE HA A -2 MET HGx 1.0 . 4.62 819 685 A 86 ILE HA A -2 MET HGy 1.0 . 4.62 820 686 A -2 MET HA A -2 MET HGx 1.0 . 4.02 821 686 A -2 MET HGy A -2 MET HA 1.0 . 4.02 822 687 A 87 PRO HGx A -2 MET HGx 1.0 . 4.68 823 687 A 87 PRO HGx A -2 MET HGy 1.0 . 4.68 824 688 A -2 MET HE% A -2 MET HGx 1.0 . 3.70 825 688 A -2 MET HE% A -2 MET HGy 1.0 . 3.70 826 689 A -2 MET HE% A 87 PRO HDy 1.0 . 4.74 827 690 A -2 MET HE% A 86 ILE HA 1.0 . 4.34 828 691 A 28 ILE HG2% A -2 MET HE% 1.0 . 4.83 829 692 A 6 THR HB A 22 PRO HA 1.0 . 3.80 830 693 A 6 THR HG2% A 22 PRO HA 1.0 . 4.18 831 694 A -2 MET HE% A 1 PRO HA 1.0 . 4.27 832 695 A 4 ALA HB% A 6 THR HA 1.0 . 5.47 833 696 A 6 THR HB A 24 GLU HBy 1.0 . 4.19 834 697 A 26 LEU HA A 41 PRO HA 1.0 . 4.49 835 698 A 58 ILE HG2% A 63 PRO HA 1.0 . 3.65 836 699 A 42 ILE HA A 41 PRO HA 1.0 . 4.82 837 700 A 87 PRO HA A 91 GLN HBx 1.0 . 4.96 838 701 A 51 PRO HA A 52 VAL HB 1.0 . 5.04 839 702 A 51 PRO HA A 36 TRP HBy 1.0 . 4.88 840 703 A 52 VAL HA A 51 PRO HA 1.0 . 5.50 841 704 A 8 TYR HA A 22 PRO HGy 1.0 . 4.55 842 705 A 75 GLU HBy A 76 GLN HA 1.0 . 4.26 843 706 A 86 ILE HD1% A 81 ILE HG1y 1.0 . 4.29 844 707 A 86 ILE HD1% A -2 MET HE% 1.0 . 4.21 845 708 A -1 ALA HB% A 84 PHE HD% 1.0 . 4.34 846 709 A 57 ILE HG2% A 2 LEU HBx 1.0 . 4.60 847 709 A 57 ILE HG2% A 2 LEU HBy 1.0 . 4.60 848 710 A 2 LEU HG A 57 ILE HG2% 1.0 . 5.50 849 711 A 57 ILE HD1% A 2 LEU HG 1.0 . 5.50 850 712 A 80 ILE HG2% A 2 LEU HDx% 1.0 . 4.28 851 713 A 28 ILE HB A 2 LEU HDx% 1.0 . 4.39 852 714 A 39 ALA HB% A 50 VAL HGx% 1.0 . 3.96 853 715 A 56 ARG HBx A 5 VAL HGy% 1.0 . 4.55 854 716 A 50 VAL H A 50 VAL HGx% 1.0 . 4.12 855 717 A 28 ILE HB A 2 LEU HDy% 1.0 . 4.39 856 718 A 3 PHE HA A 27 SER HBy 1.0 . 5.50 857 719 A 3 PHE HA A 27 SER HBx 1.0 . 5.50 858 720 A 5 VAL HGx% A 4 ALA HA 1.0 . 3.89 859 721 A 4 ALA HB% A 26 LEU HBy 1.0 . 4.46 860 722 A 4 ALA HB% A 28 ILE HB 1.0 . 5.08 861 723 A 4 ALA HB% A 28 ILE HG2% 1.0 . 4.25 862 724 A 4 ALA HB% A 28 ILE HD1% 1.0 . 3.13 863 725 A 4 ALA HB% A 5 VAL HB 1.0 . 5.02 864 726 A 4 ALA HB% A 39 ALA HB% 1.0 . 3.60 865 727 A 56 ARG HBx A 5 VAL HB 1.0 . 5.43 866 728 A 5 VAL HB A 58 ILE HG2% 1.0 . 4.22 867 729 A 25 ASN HA A 5 VAL HGx% 1.0 . 5.17 868 730 A 5 VAL HGx% A 6 THR H 1.0 . 4.28 869 731 A 5 VAL HGx% A 5 VAL H 1.0 . 3.31 870 732 A 6 THR HA A 55 VAL HB 1.0 . 4.67 871 733 A 5 VAL HGx% A 6 THR HA 1.0 . 4.61 872 734 A 6 THR HA A 7 LEU HDx% 1.0 . 4.74 873 734 A 6 THR HA A 7 LEU HDy% 1.0 . 4.74 874 735 A 5 VAL HGy% A 6 THR HA 1.0 . 4.88 875 736 A 6 THR HB A 22 PRO HBx 1.0 . 5.38 876 737 A 6 THR HB A 22 PRO HBy 1.0 . 4.59 877 738 A 6 THR HB A 20 VAL HB 1.0 . 5.50 878 739 A 6 THR HB A 20 VAL HGy% 1.0 . 4.50 879 740 A 6 THR HA A 7 LEU HG 1.0 . 4.77 880 741 A 55 VAL HA A 7 LEU HG 1.0 . 4.29 881 742 A 26 LEU HA A 26 LEU HDx% 1.0 . 4.12 882 743 A 26 LEU HA A 42 ILE HG1y 1.0 . 5.50 883 744 A 5 VAL HGy% A 5 VAL H 1.0 . 4.39 884 745 A 56 ARG HBx A 7 LEU HDx% 1.0 . 3.18 885 745 A 56 ARG HBx A 7 LEU HDy% 1.0 . 3.18 886 746 A 56 ARG HBy A 7 LEU HDx% 1.0 . 3.19 887 746 A 7 LEU HDy% A 56 ARG HBy 1.0 . 3.19 888 747 A 8 TYR HA A 22 PRO HGx 1.0 . 4.87 889 748 A 21 SER HA A 9 GLU HBx 1.0 . 4.65 890 749 A 22 PRO HDy A 9 GLU HBy 1.0 . 3.81 891 750 A 22 PRO HDx A 9 GLU HBy 1.0 . 3.91 892 751 A 9 GLU HBx A 22 PRO HDx 1.0 . 4.31 893 752 A 11 LYS HEy A 9 GLU HGy 1.0 . 5.12 894 752 A 9 GLU HGy A 11 LYS HEx 1.0 . 5.12 895 753 A 9 GLU HGy A 11 LYS HGx 1.0 . 4.75 896 754 A 11 LYS HDy A 9 GLU HGx 1.0 . 4.67 897 754 A 9 GLU HGx A 11 LYS HDx 1.0 . 4.67 898 755 A 11 LYS HDy A 9 GLU HGy 1.0 . 4.67 899 755 A 9 GLU HGy A 11 LYS HDx 1.0 . 4.67 900 756 A 11 LYS HEy A 9 GLU HGx 1.0 . 5.12 901 756 A 9 GLU HGx A 11 LYS HEx 1.0 . 5.12 902 757 A 11 LYS HA A 11 LYS HGx 1.0 . 3.73 903 758 A 12 ALA HB% A 18 LEU HA 1.0 . 4.00 904 759 A 11 LYS HGy A 11 LYS HDx 1.0 . 2.87 905 759 A 11 LYS HDy A 11 LYS HGy 1.0 . 2.87 906 760 A 92 TRP HA A 93 LYS HEx 1.0 . 5.50 907 760 A 93 LYS HEy A 92 TRP HA 1.0 . 5.50 908 761 A 12 ALA HB% A 19 ASP HBy 1.0 . 4.53 909 762 A 12 ALA HB% A 17 GLU HBy 1.0 . 3.74 910 763 A 12 ALA HB% A 17 GLU HBx 1.0 . 3.74 911 764 A 96 THR HA A 99 TYR HBx 1.0 . 4.77 912 765 A 91 GLN HA A 90 GLU HA 1.0 . 4.86 913 766 A 10 PHE HE% A 17 GLU HA 1.0 . 5.01 914 767 A 12 ALA HB% A 13 GLU HA 1.0 . 4.41 915 768 A 75 GLU HGx A 74 ARG HGy 1.0 . 5.02 916 769 A 10 PHE HE% A 12 ALA HA 1.0 . 5.23 917 770 A 11 LYS HA A 12 ALA HA 1.0 . 5.50 918 771 A 18 LEU HA A 48 GLY HAx 1.0 . 5.50 919 772 A 41 PRO HDy A 18 LEU HDy% 1.0 . 5.50 920 773 A 18 LEU HDy% A 41 PRO HDx 1.0 . 5.50 921 774 A 20 VAL HB A 26 LEU HDy% 1.0 . 4.77 922 775 A 48 GLY HAx A 18 LEU HDx% 1.0 . 4.45 923 776 A 38 ILE HG2% A 47 PRO HA 1.0 . 4.93 924 777 A 48 GLY HAx A 18 LEU HDy% 1.0 . 4.45 925 778 A 41 PRO HGy A 18 LEU HDx% 1.0 . 4.06 926 778 A 18 LEU HDx% A 41 PRO HGx 1.0 . 4.06 927 779 A 41 PRO HGy A 18 LEU HDy% 1.0 . 4.06 928 779 A 18 LEU HDy% A 41 PRO HGx 1.0 . 4.06 929 780 A 20 VAL H A 19 ASP HBx 1.0 . 4.46 930 781 A 19 ASP HA A 20 VAL HA 1.0 . 4.80 931 782 A 20 VAL HA A 18 LEU HG 1.0 . 5.50 932 783 A 20 VAL HA A 26 LEU HDx% 1.0 . 5.34 933 784 A 20 VAL HGy% A 26 LEU HDy% 1.0 . 4.23 934 785 A 26 LEU HDx% A 20 VAL HGy% 1.0 . 4.23 935 786 A 9 GLU HA A 21 SER HBx 1.0 . 5.50 936 787 A 95 GLN HA A 94 ASP HA 1.0 . 5.50 937 788 A 24 GLU HBy A 21 SER HBy 1.0 . 5.50 938 789 A 22 PRO HDy A 21 SER HBy 1.0 . 3.87 939 790 A 22 PRO HDy A 21 SER HBx 1.0 . 3.87 940 791 A 22 PRO HDx A 9 GLU HGy 1.0 . 4.89 941 792 A 9 GLU HBx A 8 TYR HBy 1.0 . 4.66 942 793 A 9 GLU HA A 22 PRO HGx 1.0 . 5.50 943 794 A 9 GLU HA A 22 PRO HGy 1.0 . 4.62 944 795 A 6 THR HG2% A 50 VAL HB 1.0 . 4.49 945 796 A 9 GLU HGx A 11 LYS HGx 1.0 . 4.75 946 797 A 25 ASN HA A 42 ILE HD1% 1.0 . 5.50 947 798 A 42 ILE HG1y A 25 ASN HBx 1.0 . 5.50 948 799 A 42 ILE HG2% A 25 ASN HBx 1.0 . 4.80 949 800 A 4 ALA HB% A 26 LEU HBx 1.0 . 4.46 950 801 A 4 ALA HB% A 58 ILE HG1x 1.0 . 4.44 951 801 A 4 ALA HB% A 58 ILE HG1y 1.0 . 4.44 952 802 A 4 ALA HB% A 57 ILE HG2% 1.0 . 3.80 953 803 A 20 VAL HB A 26 LEU HDx% 1.0 . 4.77 954 804 A 55 VAL HB A 7 LEU HDx% 1.0 . 5.50 955 804 A 7 LEU HDy% A 55 VAL HB 1.0 . 5.50 956 805 A 20 VAL HA A 26 LEU HDy% 1.0 . 5.34 957 806 A 58 ILE HG2% A 63 PRO HGx 1.0 . 5.39 958 806 A 58 ILE HG2% A 63 PRO HGy 1.0 . 5.39 959 807 A 57 ILE HD1% A 4 ALA HA 1.0 . 4.58 960 808 A 27 SER HBy A 42 ILE HG2% 1.0 . 4.23 961 809 A 28 ILE HD1% A 2 LEU HDx% 1.0 . 4.11 962 810 A 28 ILE HD1% A 2 LEU HDy% 1.0 . 4.11 963 811 A 39 ALA HA A 28 ILE HD1% 1.0 . 5.07 964 812 A 3 PHE HA A 28 ILE HD1% 1.0 . 4.90 965 813 A 4 ALA HA A 28 ILE HD1% 1.0 . 5.18 966 814 A 28 ILE HG2% A 2 LEU HDx% 1.0 . 3.55 967 815 A 28 ILE HG2% A 2 LEU HDy% 1.0 . 3.55 968 816 A 28 ILE HG2% A 37 PHE HBy 1.0 . 5.01 969 817 A 38 ILE HB A 29 CYS HBy 1.0 . 4.72 970 818 A 29 CYS HBx A 38 ILE HB 1.0 . 4.55 971 819 A 38 ILE HG2% A 29 CYS HBy 1.0 . 4.89 972 820 A 30 ALA HB% A 29 CYS HBx 1.0 . 4.73 973 821 A 30 ALA HB% A 29 CYS HBy 1.0 . 4.86 974 822 A 30 ALA HB% A -2 MET HE% 1.0 . 5.45 975 823 A 30 ALA HB% A 86 ILE HB 1.0 . 5.50 976 824 A 30 ALA HB% A 38 ILE HD1% 1.0 . 4.33 977 825 A 30 ALA HB% A 87 PRO HGx 1.0 . 4.40 978 826 A 30 ALA HB% A 87 PRO HGy 1.0 . 4.12 979 827 A 30 ALA HB% A 38 ILE H 1.0 . 5.31 980 828 A 30 ALA HB% A 88 THR H 1.0 . 5.50 981 829 A 31 HIS HA A 37 PHE HA 1.0 . 4.50 982 830 A 77 VAL HGy% A 34 TYR HA 1.0 . 4.59 983 831 A 35 GLU HA A 52 VAL H 1.0 . 4.62 984 832 A 35 GLU HA A 52 VAL HB 1.0 . 4.41 985 833 A 35 GLU HA A 77 VAL HGx% 1.0 . 4.91 986 834 A 34 TYR HBy A 35 GLU HA 1.0 . 4.87 987 835 A 36 TRP HA A 52 VAL HB 1.0 . 5.37 988 836 A 37 PHE HBx A 50 VAL HGy% 1.0 . 4.73 989 837 A 37 PHE HBy A 50 VAL HGy% 1.0 . 5.12 990 838 A 37 PHE HBx A 50 VAL HGx% 1.0 . 4.73 991 839 A 92 TRP HZ2 A 38 ILE HG2% 1.0 . 4.77 992 840 A 38 ILE HG2% A 47 PRO HBy 1.0 . 4.23 993 841 A 38 ILE HG2% B -7 PHE HD% 1.0 . 4.81 994 842 A 38 ILE HD1% A 49 LEU HDy% 1.0 . 3.34 995 843 A 38 ILE HD1% A 49 LEU HDx% 1.0 . 3.34 996 844 A 39 ALA HB% A 50 VAL HB 1.0 . 4.73 997 845 A 39 ALA HB% A 38 ILE HA 1.0 . 4.60 998 846 A 39 ALA HB% A 55 VAL HGx% 1.0 . 4.28 999 847 A 39 ALA HB% A 55 VAL HGy% 1.0 . 4.28 1000 848 A 46 GLY H A 18 LEU HDy% 1.0 . 4.89 1001 849 A 40 LYS H A 40 LYS HGx 1.0 . 4.83 1002 849 A 40 LYS HGy A 40 LYS H 1.0 . 4.83 1003 850 A 102 SER HA A 102 SER HBx 1.0 . 2.78 1004 850 A 102 SER HA A 102 SER HBy 1.0 . 2.78 1005 851 A 42 ILE HG2% A 25 ASN HBy 1.0 . 4.80 1006 852 A 42 ILE HG2% A 27 SER H 1.0 . 5.50 1007 853 A 42 ILE HG2% A 25 ASN H 1.0 . 5.50 1008 854 A 42 ILE HG2% A 43 ASN HA 1.0 . 4.77 1009 855 A 26 LEU HA A 42 ILE HG2% 1.0 . 5.19 1010 856 A 42 ILE HD1% A 26 LEU H 1.0 . 4.93 1011 857 A 38 ILE HG2% A 47 PRO HGx 1.0 . 4.68 1012 857 A 38 ILE HG2% A 47 PRO HGy 1.0 . 4.68 1013 858 A 18 LEU HA A 17 GLU HA 1.0 . 5.04 1014 859 A 17 GLU HA A 48 GLY HAy 1.0 . 5.49 1015 860 A 5 VAL HGy% A 7 LEU HDx% 1.0 . 4.29 1016 860 A 5 VAL HGy% A 7 LEU HDy% 1.0 . 4.29 1017 861 A 39 ALA HB% A 50 VAL HGy% 1.0 . 3.96 1018 862 A 10 PHE HD% A 50 VAL HGx% 1.0 . 5.50 1019 863 A 96 THR HG2% A 92 TRP HE3 1.0 . 5.50 1020 864 A 52 VAL HA A 37 PHE HBy 1.0 . 5.28 1021 865 A 55 VAL HB A 50 VAL HGy% 1.0 . 4.65 1022 866 A 55 VAL HB A 50 VAL HGx% 1.0 . 4.65 1023 867 A 56 ARG HBx A 5 VAL HGx% 1.0 . 3.24 1024 868 A 5 VAL HGx% A 56 ARG HGy 1.0 . 3.99 1025 869 A 5 VAL HGx% A 56 ARG HGx 1.0 . 3.99 1026 870 A 67 ALA HB% A 56 ARG HDy 1.0 . 4.31 1027 871 A 67 ALA HA A 56 ARG HGx 1.0 . 4.40 1028 872 A 5 VAL HGx% A 7 LEU HA 1.0 . 5.09 1029 873 A 57 ILE HA A 80 ILE HG2% 1.0 . 5.50 1030 874 A 57 ILE HB A 80 ILE HG2% 1.0 . 4.61 1031 875 A 4 ALA HA A 57 ILE HG2% 1.0 . 4.69 1032 876 A 57 ILE HG2% A 66 TYR HE% 1.0 . 5.11 1033 877 A 57 ILE HD1% A 80 ILE HB 1.0 . 5.50 1034 878 A 57 ILE HD1% A 55 VAL HB 1.0 . 4.75 1035 879 A 58 ILE HG2% A 63 PRO HBy 1.0 . 3.97 1036 880 A 60 LEU HA A 58 ILE HD1% 1.0 . 4.51 1037 881 A 42 ILE HD1% A 60 LEU HDx% 1.0 . 4.83 1038 882 A 42 ILE HD1% A 60 LEU HDy% 1.0 . 4.83 1039 883 A 61 MET HE% A 60 LEU HDx% 1.0 . 4.84 1040 884 A 61 MET HE% A 60 LEU HDy% 1.0 . 4.84 1041 885 A 65 LYS HBy A 62 ASP HBx 1.0 . 4.77 1042 886 A 65 LYS HBy A 62 ASP HBy 1.0 . 4.77 1043 887 A 58 ILE HD1% A 63 PRO HA 1.0 . 3.97 1044 888 A 58 ILE HG2% A 58 ILE HA 1.0 . 3.35 1045 889 A 58 ILE HG2% A 63 PRO HBx 1.0 . 4.28 1046 890 A 64 ALA HA A 63 PRO HGx 1.0 . 5.10 1047 890 A 63 PRO HGy A 64 ALA HA 1.0 . 5.10 1048 891 A 67 ALA HB% A 64 ALA HA 1.0 . 3.09 1049 892 A 67 ALA HA A 7 LEU HDx% 1.0 . 5.50 1050 892 A 67 ALA HA A 7 LEU HDy% 1.0 . 5.50 1051 893 A 67 ALA HA A 58 ILE HD1% 1.0 . 5.50 1052 894 A 67 ALA HB% A 58 ILE HD1% 1.0 . 4.91 1053 895 A 67 ALA HB% A 7 LEU HDx% 1.0 . 5.23 1054 895 A 7 LEU HDy% A 67 ALA HB% 1.0 . 5.23 1055 896 A 66 TYR HD% A 69 VAL HB 1.0 . 5.03 1056 897 A 71 THR HA A 69 VAL HGy% 1.0 . 5.50 1057 898 A 57 ILE HD1% A 71 THR HA 1.0 . 5.50 1058 899 A 56 ARG HBx A 7 LEU HG 1.0 . 4.45 1059 900 A 7 LEU HG A 56 ARG HBy 1.0 . 4.97 1060 901 A 71 THR HG2% A 56 ARG HBy 1.0 . 4.95 1061 902 A 71 THR HG2% A 77 VAL HA 1.0 . 4.87 1062 903 A 88 THR HG2% A 89 VAL HA 1.0 . 5.37 1063 904 A 71 THR HA A 77 VAL HGy% 1.0 . 3.05 1064 905 A 77 VAL HGx% A 74 ARG HA 1.0 . 3.31 1065 906 A 75 GLU HA A 78 MET HA 1.0 . 5.50 1066 907 A 75 GLU HA A 78 MET HBx 1.0 . 3.76 1067 907 A 75 GLU HA A 78 MET HBy 1.0 . 3.76 1068 908 A 80 ILE HG2% A 77 VAL HA 1.0 . 4.70 1069 909 A 77 VAL HB A 80 ILE HB 1.0 . 5.50 1070 910 A 81 ILE HG2% A 78 MET HA 1.0 . 4.35 1071 911 A 76 GLN HGx A 79 LYS HDx 1.0 . 4.33 1072 911 A 76 GLN HGx A 79 LYS HDy 1.0 . 4.33 1073 912 A 96 THR HA A 95 GLN HBx 1.0 . 4.71 1074 912 A 96 THR HA A 95 GLN HBy 1.0 . 4.71 1075 913 A 80 ILE HA A 79 LYS HBx 1.0 . 4.71 1076 913 A 79 LYS HBy A 80 ILE HA 1.0 . 4.71 1077 914 A 81 ILE HA A 86 ILE HB 1.0 . 4.48 1078 915 A 78 MET HA A 81 ILE HB 1.0 . 3.93 1079 916 A 81 ILE HG1x A 86 ILE HB 1.0 . 4.81 1080 917 A 81 ILE HG1y A 86 ILE HB 1.0 . 4.54 1081 918 A 81 ILE HD1% A 31 HIS HD2 1.0 . 4.35 1082 919 A 82 ASP HA A 85 LYS HA 1.0 . 3.86 1083 920 A 84 PHE HD% A 83 GLU HBy 1.0 . 4.84 1084 921 A -1 ALA HB% A 1 PRO HA 1.0 . 4.73 1085 922 A 81 ILE HG2% A 86 ILE HB 1.0 . 3.62 1086 923 A 86 ILE HD1% A 81 ILE HD1% 1.0 . 3.55 1087 924 A 77 VAL HGx% A 78 MET HBx 1.0 . 4.11 1088 924 A 77 VAL HGx% A 78 MET HBy 1.0 . 4.11 1089 925 A 77 VAL HGx% A 81 ILE HD1% 1.0 . 3.21 1090 926 A 86 ILE HG2% A 81 ILE HG2% 1.0 . 3.70 1091 927 A 81 ILE HG1x A 77 VAL HGy% 1.0 . 4.52 1092 928 A 81 ILE HG1x A 77 VAL HGx% 1.0 . 4.96 1093 929 A 77 VAL HGy% A 81 ILE HG1y 1.0 . 5.50 1094 930 A 77 VAL HGx% A 74 ARG HBx 1.0 . 5.50 1095 931 A 77 VAL HB A 81 ILE HD1% 1.0 . 4.44 1096 932 A 81 ILE HD1% A 86 ILE HB 1.0 . 4.69 1097 933 A 81 ILE HG2% A 86 ILE HD1% 1.0 . 3.77 1098 934 A 86 ILE HG2% A 81 ILE HD1% 1.0 . 4.22 1099 935 A 77 VAL HGy% A 81 ILE HD1% 1.0 . 3.63 1100 936 A 84 PHE HD% A 86 ILE HD1% 1.0 . 4.69 1101 937 A 91 GLN HBx A 87 PRO HBx 1.0 . 4.29 1102 937 A 87 PRO HBy A 91 GLN HBx 1.0 . 4.29 1103 938 A 92 TRP HA A 87 PRO HGx 1.0 . 5.39 1104 939 A 78 MET HGx A 74 ARG HBx 1.0 . 5.25 1105 940 A 89 VAL HA A 92 TRP HBy 1.0 . 4.40 1106 941 A 71 THR HA A 69 VAL HGx% 1.0 . 5.50 1107 942 A 90 GLU HA A 93 LYS HEx 1.0 . 5.46 1108 942 A 93 LYS HEy A 90 GLU HA 1.0 . 5.46 1109 943 A 93 LYS HA A 90 GLU HA 1.0 . 5.50 1110 944 A 91 GLN HBy A 87 PRO HBx 1.0 . 3.52 1111 944 A 87 PRO HBy A 91 GLN HBy 1.0 . 3.52 1112 945 A 91 GLN HBy A 94 ASP HBx 1.0 . 5.50 1113 945 A 94 ASP HBy A 91 GLN HBy 1.0 . 5.50 1114 946 A 95 GLN HA A 92 TRP HA 1.0 . 5.50 1115 947 A 93 LYS HA A 97 ARG HGy 1.0 . 5.16 1116 948 A 93 LYS HA A 93 LYS HDy 1.0 . 5.30 1117 949 A 93 LYS HA A 97 ARG HBx 1.0 . 5.50 1118 949 A 93 LYS HA A 97 ARG HBy 1.0 . 5.50 1119 950 A 93 LYS HA A 93 LYS HDx 1.0 . 5.30 1120 951 A 92 TRP HE3 A 93 LYS HEx 1.0 . 5.50 1121 951 A 93 LYS HEy A 92 TRP HE3 1.0 . 5.50 1122 952 A 9 GLU HA A 8 TYR HBy 1.0 . 5.48 1123 953 A 94 ASP HA A 97 ARG HGx 1.0 . 4.76 1124 954 A 94 ASP HA A 97 ARG HGy 1.0 . 4.76 1125 955 A 94 ASP HA A 97 ARG HDx 1.0 . 5.30 1126 955 A 94 ASP HA A 97 ARG HDy 1.0 . 5.30 1127 956 A 90 GLU HA A 94 ASP HBx 1.0 . 5.45 1128 956 A 94 ASP HBy A 90 GLU HA 1.0 . 5.45 1129 957 A 95 GLN HA A 94 ASP HBx 1.0 . 5.50 1130 957 A 95 GLN HA A 94 ASP HBy 1.0 . 5.50 1131 958 A 76 GLN HA A 79 LYS HGx 1.0 . 5.50 1132 959 A 96 THR HG2% A 95 GLN HBx 1.0 . 4.05 1133 959 A 96 THR HG2% A 95 GLN HBy 1.0 . 4.05 1134 960 A 98 ARG HA A 101 GLU HGy 1.0 . 4.97 1135 961 A 98 ARG HA A 101 GLU HGx 1.0 . 4.97 1136 962 A 100 LYS HBy A 97 ARG HA 1.0 . 3.36 1137 963 A 100 LYS HBy A 99 TYR HBy 1.0 . 4.80 1138 964 A 99 TYR HBy A 100 LYS HGy 1.0 . 5.50 1139 965 A 99 TYR HBy A 100 LYS HGx 1.0 . 5.50 1140 966 A 105 GLN HA A 104 ILE HG2% 1.0 . 5.07 1141 967 A 105 GLN HA A 106 ILE HG2% 1.0 . 5.50 1142 968 A 103 SER HA A 104 ILE HD1% 1.0 . 4.85 1143 969 A 104 ILE HA A 105 GLN HGx 1.0 . 5.23 1144 969 A 105 GLN HGy A 104 ILE HA 1.0 . 5.23 1145 970 A 106 ILE HA A 105 GLN HGx 1.0 . 5.50 1146 970 A 105 GLN HGy A 106 ILE HA 1.0 . 5.50 1147 971 A 105 GLN HA A 104 ILE HB 1.0 . 5.50 1148 972 A 105 GLN HA A 106 ILE HB 1.0 . 5.50 1149 973 A 104 ILE HB A 105 GLN HGx 1.0 . 5.50 1150 973 A 105 GLN HGy A 104 ILE HB 1.0 . 5.50 1151 974 A 25 ASN HBy A 42 ILE HG1y 1.0 . 5.50 1152 975 A 104 ILE HB A 103 SER HBx 1.0 . 5.50 1153 975 A 104 ILE HB A 103 SER HBy 1.0 . 5.50 1154 976 A 113 SER HBx A 114 GLN HGx 1.0 . 5.49 1155 976 A 113 SER HBy A 114 GLN HGx 1.0 . 5.49 1156 976 A 114 GLN HGy A 113 SER HBx 1.0 . 5.49 1157 976 A 114 GLN HGy A 113 SER HBy 1.0 . 5.49 1158 977 A 75 GLU HBx A 79 LYS HEx 1.0 . 4.78 1159 977 A 79 LYS HEy A 75 GLU HBx 1.0 . 4.78 1160 978 A 91 GLN HBx A 94 ASP HBx 1.0 . 4.78 1161 978 A 94 ASP HBy A 91 GLN HBx 1.0 . 4.78 1162 979 A 111 GLY HAx A 112 GLN HGx 1.0 . 4.96 1163 979 A 111 GLY HAy A 112 GLN HGx 1.0 . 4.96 1164 979 A 112 GLN HGy A 111 GLY HAx 1.0 . 4.96 1165 979 A 111 GLY HAy A 112 GLN HGy 1.0 . 4.96 1166 980 A 114 GLN HGy A 115 GLY HAx 1.0 . 5.50 1167 980 A 114 GLN HGx A 115 GLY HAx 1.0 . 5.50 1168 980 A 115 GLY HAy A 114 GLN HGx 1.0 . 5.50 1169 980 A 114 GLN HGy A 115 GLY HAy 1.0 . 5.50 1170 981 A 112 GLN HBy A 111 GLY HAx 1.0 . 5.50 1171 981 A 111 GLY HAy A 112 GLN HBy 1.0 . 5.50 1172 982 A 115 GLY HAy A 114 GLN HBy 1.0 . 5.50 1173 982 A 114 GLN HBy A 115 GLY HAx 1.0 . 5.50 1174 983 A 112 GLN HBx A 111 GLY HAx 1.0 . 5.50 1175 983 A 111 GLY HAy A 112 GLN HBx 1.0 . 5.50 1176 984 A 115 GLY HAy A 114 GLN HBx 1.0 . 5.50 1177 984 A 114 GLN HBx A 115 GLY HAx 1.0 . 5.50 1178 985 A 116 LEU HG A 115 GLY HAx 1.0 . 4.32 1179 985 A 116 LEU HG A 115 GLY HAy 1.0 . 4.32 1180 986 A 106 ILE HG2% A 107 GLY HAx 1.0 . 5.27 1181 986 A 106 ILE HG2% A 107 GLY HAy 1.0 . 5.27 1182 987 A 116 LEU HDx% A 115 GLY HAx 1.0 . 5.50 1183 987 A 115 GLY HAy A 116 LEU HDx% 1.0 . 5.50 1184 988 A 115 GLY HAx A 116 LEU HDy% 1.0 . 5.50 1185 988 A 115 GLY HAy A 116 LEU HDy% 1.0 . 5.50 1186 989 A 116 LEU HA A 115 GLY HAx 1.0 . 4.81 1187 989 A 116 LEU HA A 115 GLY HAy 1.0 . 4.81 1188 990 A 114 GLN HGy A 116 LEU HDy% 1.0 . 5.43 1189 990 A 114 GLN HGx A 116 LEU HDy% 1.0 . 5.43 1190 991 A 55 VAL HA A 6 THR HB 1.0 . 5.10 1191 992 A 34 TYR HD% A 77 VAL HGy% 1.0 . 4.72 1192 993 A 30 ALA HB% A 87 PRO HA 1.0 . 4.64 1193 994 A 104 ILE HG2% A 103 SER HBx 1.0 . 5.48 1194 994 A 103 SER HBy A 104 ILE HG2% 1.0 . 5.48 1195 995 A -2 MET HA A 85 LYS HGx 1.0 . 4.95 1196 995 A 85 LYS HGy A -2 MET HA 1.0 . 4.95 1197 996 A 9 GLU HA A 21 SER HBy 1.0 . 5.50 1198 997 A 86 ILE HD1% A 2 LEU HBx 1.0 . 3.81 1199 997 A 86 ILE HD1% A 2 LEU HBy 1.0 . 3.81 1200 998 A 38 ILE HA A 49 LEU HDx% 1.0 . 5.25 1201 999 B -7 PHE HD% A 48 GLY HAy 1.0 . 4.64 1202 1000 A 48 GLY HAy B -7 PHE HZ 1.0 . 4.96 1203 1001 A 38 ILE HD1% B -7 PHE HE% 1.0 . 4.63 1204 1002 B -5 PRO HA A 49 LEU HDy% 1.0 . 4.32 1205 1003 B -5 PRO HBy A 49 LEU HDy% 1.0 . 4.14 1206 1004 B -5 PRO HBy A 49 LEU HDx% 1.0 . 4.14 1207 1005 B -5 PRO HDy A 49 LEU HDx% 1.0 . 4.57 1208 1005 A 49 LEU HDx% B -5 PRO HDx 1.0 . 4.57 1209 1006 A 3 PHE HE% A 1 PRO HBx 1.0 . 4.55 1210 1007 A 92 TRP HE3 A 38 ILE HD1% 1.0 . 4.71 1211 1008 A 3 PHE HE% A 1 PRO HBy 1.0 . 4.55 1212 1009 A 96 THR HG2% A 92 TRP HD1 1.0 . 3.98 1213 1010 A 57 ILE H A 58 ILE H 1.0 . 4.54 1214 1011 A 3 PHE HD% A 3 PHE H 1.0 . 4.24 1215 1012 A 2 LEU HA A 3 PHE H 1.0 . 3.42 1216 1013 A 3 PHE HD% A 4 ALA H 1.0 . 4.15 1217 1014 A 26 LEU H A 4 ALA H 1.0 . 4.03 1218 1015 A 25 ASN HA A 26 LEU H 1.0 . 3.48 1219 1016 A 5 VAL HA A 26 LEU H 1.0 . 4.40 1220 1017 A 5 VAL HA A 6 THR H 1.0 . 3.56 1221 1018 A 25 ASN HA A 6 THR H 1.0 . 4.81 1222 1019 A 6 THR H A 24 GLU H 1.0 . 3.83 1223 1020 A 93 LYS H A 95 GLN H 1.0 . 4.29 1224 1021 A 27 SER HA A 4 ALA H 1.0 . 4.67 1225 1022 A 88 THR HA A 89 VAL H 1.0 . 3.38 1226 1023 A 89 VAL H A 88 THR HB 1.0 . 3.73 1227 1024 A 89 VAL HB A 89 VAL H 1.0 . 3.61 1228 1025 A 102 SER H A 102 SER HBx 1.0 . 3.99 1229 1025 A 102 SER HBy A 102 SER H 1.0 . 3.99 1230 1026 A 104 ILE H A 105 GLN H 1.0 . 4.79 1231 1027 A 90 GLU H A 91 GLN H 1.0 . 3.81 1232 1028 A 90 GLU HA A 94 ASP H 1.0 . 4.87 1233 1029 A 93 LYS H A 94 ASP H 1.0 . 3.73 1234 1030 A 90 GLU HA A 93 LYS H 1.0 . 4.63 1235 1031 A 95 GLN H A 94 ASP H 1.0 . 3.37 1236 1032 A 95 GLN H A 96 THR H 1.0 . 3.43 1237 1033 A 96 THR H A 97 ARG H 1.0 . 3.57 1238 1034 A 6 THR HG2% A 6 THR H 1.0 . 3.89 1239 1035 A 56 ARG H A 7 LEU H 1.0 . 4.67 1240 1036 A 6 THR HA A 7 LEU H 1.0 . 3.56 1241 1037 A 8 TYR H A 9 GLU H 1.0 . 4.47 1242 1038 A 8 TYR H A 7 LEU H 1.0 . 3.61 1243 1039 A 6 THR HA A 8 TYR H 1.0 . 4.31 1244 1040 A 8 TYR H A 6 THR HG2% 1.0 . 4.00 1245 1041 A 8 TYR H A 7 LEU HBx 1.0 . 4.49 1246 1042 A 9 GLU H A 54 TYR HE% 1.0 . 5.36 1247 1043 A 8 TYR HD% A 9 GLU H 1.0 . 4.24 1248 1044 A 8 TYR HA A 9 GLU H 1.0 . 3.38 1249 1045 A 22 PRO HDx A 9 GLU H 1.0 . 4.05 1250 1046 A 8 TYR HBy A 9 GLU H 1.0 . 3.66 1251 1047 A 9 GLU HBy A 9 GLU H 1.0 . 3.00 1252 1048 A 10 PHE HD% A 10 PHE H 1.0 . 4.25 1253 1049 A 10 PHE H A 11 LYS H 1.0 . 4.77 1254 1050 A 9 GLU HA A 10 PHE H 1.0 . 3.26 1255 1051 A 22 PRO HDx A 10 PHE H 1.0 . 4.78 1256 1052 A 10 PHE H A 10 PHE HBx 1.0 . 4.10 1257 1053 A 9 GLU HBy A 10 PHE H 1.0 . 5.07 1258 1054 A 11 LYS H A 12 ALA H 1.0 . 4.68 1259 1055 A 10 PHE HA A 11 LYS H 1.0 . 3.10 1260 1056 A 10 PHE HD% A 11 LYS H 1.0 . 4.15 1261 1057 A 11 LYS HA A 12 ALA H 1.0 . 3.10 1262 1058 A 19 ASP HA A 12 ALA H 1.0 . 3.85 1263 1059 A 20 VAL H A 12 ALA H 1.0 . 4.81 1264 1060 A 20 VAL H A 10 PHE H 1.0 . 3.87 1265 1061 A 19 ASP HA A 20 VAL H 1.0 . 3.02 1266 1062 A 11 LYS HA A 20 VAL H 1.0 . 4.39 1267 1063 A 12 ALA HA A 13 GLU H 1.0 . 3.53 1268 1064 A 12 ALA H A 13 GLU H 1.0 . 4.65 1269 1065 A 13 GLU H A 13 GLU HGy 1.0 . 4.06 1270 1066 A 12 ALA HB% A 13 GLU H 1.0 . 3.82 1271 1067 A 12 ALA HB% A 12 ALA H 1.0 . 3.14 1272 1068 A 14 ARG HA A 15 ASP H 1.0 . 3.57 1273 1069 A 15 ASP H A 15 ASP HBx 1.0 . 3.41 1274 1069 A 15 ASP H A 15 ASP HBy 1.0 . 3.41 1275 1070 A 15 ASP H A 14 ARG HBx 1.0 . 4.14 1276 1071 A 15 ASP H A 14 ARG H 1.0 . 5.09 1277 1072 A 16 ASP H A 17 GLU H 1.0 . 3.58 1278 1073 A 16 ASP H A 16 ASP HBy 1.0 . 4.09 1279 1074 A 16 ASP H A 16 ASP HBx 1.0 . 4.09 1280 1075 A 13 GLU H A 17 GLU H 1.0 . 4.50 1281 1076 A 18 LEU H A 18 LEU HBx 1.0 . 3.82 1282 1076 A 18 LEU H A 18 LEU HBy 1.0 . 3.82 1283 1077 A 18 LEU H A 18 LEU HDx% 1.0 . 4.72 1284 1078 A 18 LEU HA A 19 ASP H 1.0 . 3.10 1285 1079 A 19 ASP H A 19 ASP HBy 1.0 . 3.77 1286 1080 A 19 ASP H A 19 ASP HBx 1.0 . 3.77 1287 1081 A 20 VAL H A 19 ASP H 1.0 . 4.85 1288 1082 A 20 VAL H A 19 ASP HBy 1.0 . 4.46 1289 1083 A 20 VAL H A 20 VAL HGx% 1.0 . 4.19 1290 1084 A 20 VAL H A 20 VAL HGy% 1.0 . 4.19 1291 1085 A 20 VAL H A 21 SER H 1.0 . 4.54 1292 1086 A 22 PRO HA A 24 GLU H 1.0 . 4.39 1293 1087 A 25 ASN H A 24 GLU H 1.0 . 5.25 1294 1088 A 24 GLU HA A 25 ASN H 1.0 . 3.30 1295 1089 A 25 ASN H A 26 LEU H 1.0 . 4.92 1296 1090 A 27 SER H A 26 LEU H 1.0 . 5.28 1297 1091 A 40 LYS H A 27 SER H 1.0 . 4.06 1298 1092 A 39 ALA HA A 40 LYS H 1.0 . 3.41 1299 1093 A 3 PHE HA A 28 ILE H 1.0 . 4.23 1300 1094 A 30 ALA H A 29 CYS H 1.0 . 3.83 1301 1095 A 31 HIS HD2 A 31 HIS H 1.0 . 4.13 1302 1096 A 30 ALA HB% A 31 HIS H 1.0 . 3.42 1303 1097 A 31 HIS HA A 32 TYR H 1.0 . 3.55 1304 1098 A 32 TYR H A 31 HIS HBy 1.0 . 4.17 1305 1099 A 33 ASP H A 34 TYR H 1.0 . 3.91 1306 1100 A 32 TYR HA A 33 ASP H 1.0 . 3.09 1307 1101 A 33 ASP H A 33 ASP HBy 1.0 . 4.11 1308 1102 A 32 TYR HBx A 33 ASP H 1.0 . 4.56 1309 1103 A 33 ASP H A 33 ASP HBx 1.0 . 4.11 1310 1104 A 34 TYR HD% A 33 ASP H 1.0 . 4.56 1311 1105 A 32 TYR H A 33 ASP H 1.0 . 4.53 1312 1106 A 34 TYR H A 35 GLU H 1.0 . 3.71 1313 1107 A 35 GLU H A 36 TRP H 1.0 . 3.08 1314 1108 A 32 TYR HBy A 35 GLU H 1.0 . 4.51 1315 1109 A 35 GLU H A 35 GLU HBx 1.0 . 3.41 1316 1109 A 35 GLU HBy A 35 GLU H 1.0 . 3.41 1317 1110 A 32 TYR H A 35 GLU H 1.0 . 4.35 1318 1111 A 32 TYR H A 36 TRP H 1.0 . 4.09 1319 1112 A 36 TRP H A 37 PHE H 1.0 . 4.76 1320 1113 A 36 TRP H A 36 TRP HBx 1.0 . 3.92 1321 1114 A 36 TRP HBy A 36 TRP H 1.0 . 4.08 1322 1115 A 36 TRP H A 35 GLU HBx 1.0 . 3.81 1323 1115 A 35 GLU HBy A 36 TRP H 1.0 . 3.81 1324 1116 A 50 VAL H A 37 PHE H 1.0 . 3.91 1325 1117 A 38 ILE H A 37 PHE H 1.0 . 5.21 1326 1118 A 52 VAL H A 37 PHE H 1.0 . 4.37 1327 1119 A 51 PRO HA A 37 PHE H 1.0 . 4.28 1328 1120 A 38 ILE H A 38 ILE HB 1.0 . 3.87 1329 1121 A 39 ALA H A 40 LYS H 1.0 . 5.05 1330 1122 A 39 ALA H A 38 ILE HA 1.0 . 3.33 1331 1123 A 42 ILE H A 43 ASN H 1.0 . 4.06 1332 1124 A 41 PRO HA A 43 ASN H 1.0 . 4.04 1333 1125 A 43 ASN H A 43 ARG H 1.0 . 3.54 1334 1126 A 43 ARG H A 44 LEU H 1.0 . 4.80 1335 1127 A 43 ARG H A 43 ASN HBy 1.0 . 4.37 1336 1128 A 43 ARG H A 43 ARG HBy 1.0 . 4.12 1337 1129 A 43 ARG H A 43 ARG HGy 1.0 . 3.60 1338 1130 A 42 ILE HA A 43 ARG H 1.0 . 5.50 1339 1131 A 43 ARG HA A 44 LEU H 1.0 . 3.50 1340 1132 A 44 LEU H A 44 LEU HDx% 1.0 . 4.93 1341 1133 A 44 LEU H A 44 LEU HDy% 1.0 . 4.93 1342 1134 A 46 GLY H A 18 LEU HDx% 1.0 . 4.89 1343 1135 A 46 GLY H A 45 GLY H 1.0 . 4.60 1344 1136 A 39 ALA H A 48 GLY H 1.0 . 4.49 1345 1137 A 48 GLY H A 18 LEU HDy% 1.0 . 4.68 1346 1138 A 38 ILE HG2% A 48 GLY H 1.0 . 4.27 1347 1139 A 49 LEU H A 17 GLU HA 1.0 . 4.52 1348 1140 A 50 VAL H A 49 LEU HA 1.0 . 3.56 1349 1141 A 50 VAL H A 38 ILE HA 1.0 . 4.78 1350 1142 A 52 VAL H A 52 VAL HB 1.0 . 3.69 1351 1143 A 54 TYR H A 54 TYR HBy 1.0 . 3.88 1352 1144 A 56 ARG HA A 57 ILE H 1.0 . 3.29 1353 1145 A 57 ILE HB A 57 ILE H 1.0 . 3.31 1354 1146 A 59 ASP HA A 60 LEU H 1.0 . 3.45 1355 1147 A 60 LEU H A 61 MET H 1.0 . 2.90 1356 1148 A 59 ASP HA A 61 MET H 1.0 . 4.14 1357 1149 A 61 MET H A 61 MET HGy 1.0 . 4.45 1358 1150 A 61 MET H A 61 MET HGx 1.0 . 4.45 1359 1151 A 61 MET H A 62 ASP H 1.0 . 2.93 1360 1152 A 60 LEU HA A 62 ASP H 1.0 . 4.70 1361 1153 A 62 ASP H A 62 ASP HBy 1.0 . 3.92 1362 1154 A 62 ASP H A 62 ASP HBx 1.0 . 3.92 1363 1155 A 62 ASP H A 61 MET HBx 1.0 . 3.47 1364 1155 A 62 ASP H A 61 MET HBy 1.0 . 3.47 1365 1156 A 64 ALA H A 65 LYS H 1.0 . 2.97 1366 1157 A 64 ALA H A 63 PRO HDx 1.0 . 4.16 1367 1158 A 64 ALA HB% A 64 ALA H 1.0 . 2.73 1368 1159 A 65 LYS HBy A 65 LYS H 1.0 . 3.52 1369 1160 A 65 LYS HBx A 65 LYS H 1.0 . 3.78 1370 1161 A 65 LYS H A 65 LYS HGy 1.0 . 4.71 1371 1162 A 66 TYR HD% A 67 ALA H 1.0 . 4.78 1372 1163 A 67 ALA HB% A 67 ALA H 1.0 . 3.16 1373 1164 A 68 SER H A 68 SER HBy 1.0 . 3.88 1374 1165 A 69 VAL H A 68 SER H 1.0 . 3.72 1375 1166 A 66 TYR HBy A 69 VAL H 1.0 . 4.61 1376 1167 A 69 VAL HB A 69 VAL H 1.0 . 3.39 1377 1168 A 69 VAL H A 69 VAL HGx% 1.0 . 3.91 1378 1169 A 69 VAL H A 69 VAL HGy% 1.0 . 3.91 1379 1170 A 69 VAL H A 70 ASP H 1.0 . 4.70 1380 1171 A 70 ASP H A 71 THR H 1.0 . 4.77 1381 1172 A 69 VAL HA A 70 ASP H 1.0 . 3.04 1382 1173 A 70 ASP H A 70 ASP HBy 1.0 . 3.70 1383 1174 A 70 ASP H A 70 ASP HBx 1.0 . 3.70 1384 1175 A 69 VAL HB A 70 ASP H 1.0 . 4.63 1385 1176 A 70 ASP H A 69 VAL HGx% 1.0 . 4.26 1386 1177 A 70 ASP H A 69 VAL HGy% 1.0 . 4.26 1387 1178 A 70 ASP HA A 71 THR H 1.0 . 2.96 1388 1179 A 71 THR HB A 71 THR H 1.0 . 4.18 1389 1180 A 71 THR H A 70 ASP HBy 1.0 . 4.60 1390 1181 A 71 THR H A 70 ASP HBx 1.0 . 4.60 1391 1182 A 71 THR HG2% A 71 THR H 1.0 . 3.34 1392 1183 A 72 TYR H A 73 ASP H 1.0 . 3.29 1393 1184 A 72 TYR HD% A 72 TYR H 1.0 . 4.21 1394 1185 A 72 TYR H A 72 TYR HBy 1.0 . 3.75 1395 1186 A 72 TYR HD% A 73 ASP H 1.0 . 4.38 1396 1187 A 73 ASP H A 73 ASP HBy 1.0 . 3.56 1397 1188 A 73 ASP H A 73 ASP HBx 1.0 . 3.56 1398 1189 A 73 ASP H A 74 ARG H 1.0 . 4.46 1399 1190 A 73 ASP HA A 74 ARG H 1.0 . 3.19 1400 1191 A 75 GLU H A 76 GLN H 1.0 . 3.19 1401 1192 A 74 ARG H A 75 GLU H 1.0 . 3.65 1402 1193 A 75 GLU HBy A 75 GLU H 1.0 . 3.84 1403 1194 A 83 GLU HBx A 84 PHE H 1.0 . 4.02 1404 1195 A 78 MET HE% A 75 GLU H 1.0 . 3.65 1405 1196 A 73 ASP HA A 75 GLU H 1.0 . 4.39 1406 1197 A 76 GLN HGy A 76 GLN H 1.0 . 3.64 1407 1198 A 76 GLN H A 76 GLN HBy 1.0 . 3.80 1408 1199 A 76 GLN H A 76 GLN HBx 1.0 . 3.80 1409 1200 A 76 GLN H A 77 VAL H 1.0 . 3.30 1410 1201 A 74 ARG HA A 77 VAL H 1.0 . 3.88 1411 1202 A 76 GLN HGy A 77 VAL H 1.0 . 4.17 1412 1203 A 77 VAL HB A 77 VAL H 1.0 . 3.80 1413 1204 A 77 VAL H A 78 MET H 1.0 . 3.37 1414 1205 A 78 MET H A 79 LYS H 1.0 . 3.60 1415 1206 A 75 GLU HA A 78 MET H 1.0 . 3.75 1416 1207 A 76 GLN H A 78 MET H 1.0 . 4.34 1417 1208 A 34 TYR HD% A 78 MET H 1.0 . 4.45 1418 1209 A 79 LYS H A 80 ILE H 1.0 . 3.90 1419 1210 A 78 MET H A 78 MET HBx 1.0 . 3.09 1420 1210 A 78 MET HBy A 78 MET H 1.0 . 3.09 1421 1211 A 78 MET HGx A 78 MET H 1.0 . 3.83 1422 1212 A 79 LYS H A 79 LYS HBx 1.0 . 3.27 1423 1212 A 79 LYS HBy A 79 LYS H 1.0 . 3.27 1424 1213 A 77 VAL HA A 80 ILE H 1.0 . 4.70 1425 1214 A 80 ILE HB A 80 ILE H 1.0 . 3.32 1426 1215 A 80 ILE H A 80 ILE HG1y 1.0 . 4.21 1427 1216 A 80 ILE H A 80 ILE HG1x 1.0 . 4.21 1428 1217 A 80 ILE HG2% A 80 ILE H 1.0 . 3.88 1429 1218 A 79 LYS HA A 82 ASP H 1.0 . 3.98 1430 1219 A 81 ILE HB A 82 ASP H 1.0 . 3.62 1431 1220 A 81 ILE HG2% A 82 ASP H 1.0 . 3.76 1432 1221 A 84 PHE H A 83 GLU H 1.0 . 3.52 1433 1222 A 80 ILE HA A 84 PHE H 1.0 . 4.37 1434 1223 A 84 PHE H A 84 PHE HBx 1.0 . 3.86 1435 1224 A 84 PHE H A 84 PHE HBy 1.0 . 3.86 1436 1225 A 80 ILE HG2% A 84 PHE H 1.0 . 4.01 1437 1226 A 85 LYS H A 86 ILE H 1.0 . 3.75 1438 1227 A 86 ILE HB A 86 ILE H 1.0 . 3.83 1439 1228 A 86 ILE H A 86 ILE HG1x 1.0 . 3.79 1440 1229 A 91 GLN H A 92 TRP H 1.0 . 3.64 1441 1230 A 92 TRP H A 92 TRP HBx 1.0 . 3.81 1442 1231 A 93 LYS H A 93 LYS HBx 1.0 . 3.66 1443 1232 A 93 LYS H A 93 LYS HGx 1.0 . 4.66 1444 1233 A 93 LYS H A 92 TRP HBy 1.0 . 4.41 1445 1234 A 93 LYS H A 92 TRP HBx 1.0 . 4.41 1446 1235 A 93 LYS H A 94 ASP HBx 1.0 . 4.75 1447 1235 A 94 ASP HBy A 93 LYS H 1.0 . 4.75 1448 1236 A 91 GLN HBy A 93 LYS H 1.0 . 5.50 1449 1237 A 6 THR HB A 24 GLU H 1.0 . 4.07 1450 1238 A 96 THR H A 95 GLN HBx 1.0 . 3.78 1451 1238 A 95 GLN HBy A 96 THR H 1.0 . 3.78 1452 1239 A 96 THR H A 97 ARG HBx 1.0 . 4.92 1453 1239 A 97 ARG HBy A 96 THR H 1.0 . 4.92 1454 1240 A 96 THR HG2% A 96 THR H 1.0 . 3.77 1455 1241 A 94 ASP HA A 97 ARG H 1.0 . 4.44 1456 1242 A 97 ARG H A 98 ARG H 1.0 . 3.96 1457 1243 A 98 ARG H A 98 ARG HBx 1.0 . 3.47 1458 1243 A 98 ARG HBy A 98 ARG H 1.0 . 3.47 1459 1244 A 98 ARG H A 98 ARG HGy 1.0 . 3.74 1460 1245 A 99 TYR HD% A 99 TYR H 1.0 . 4.19 1461 1246 A 99 TYR HBy A 100 LYS H 1.0 . 4.00 1462 1247 A 100 LYS HBy A 100 LYS H 1.0 . 3.37 1463 1248 A 100 LYS H A 100 LYS HGx 1.0 . 4.26 1464 1249 A 80 ILE H A 81 ILE H 1.0 . 3.64 1465 1250 A 29 CYS HA A 92 TRP HE1 1.0 . 5.47 1466 1251 A 92 TRP HA A 92 TRP HE1 1.0 . 5.50 1467 1252 A 25 ASN HA A 25 ASN HD2y 1.0 . 4.52 1468 1253 A 42 ILE HD1% A 25 ASN HD2y 1.0 . 5.41 1469 1254 A 108 ASN H A 107 GLY HAx 1.0 . 3.33 1470 1254 A 107 GLY HAy A 108 ASN H 1.0 . 3.33 1471 1255 A -1 ALA HB% A -1 ALA H 1.0 . 4.14 1472 1256 A 55 VAL HA A 7 LEU H 1.0 . 4.14 1473 1257 A 65 LYS H A 65 LYS HGx 1.0 . 4.71 1474 1258 A 86 ILE HG2% A 31 HIS H 1.0 . 3.82 1475 1259 A 88 THR HG2% A 31 HIS H 1.0 . 4.40 1476 1260 A 88 THR HG2% A 90 GLU H 1.0 . 4.75 1477 1261 A 91 GLN HE2x A 91 GLN HGx 1.0 . 3.84 1478 1261 A 91 GLN HGy A 91 GLN HE2x 1.0 . 3.84 1479 1262 A 91 GLN HE2x A 90 GLU HBx 1.0 . 5.28 1480 1262 A 90 GLU HBy A 91 GLN HE2x 1.0 . 5.28 1481 1263 A 91 GLN HE2y A 90 GLU HBx 1.0 . 5.10 1482 1263 A 90 GLU HBy A 91 GLN HE2y 1.0 . 5.10 1483 1264 A 20 VAL HA A 21 SER H 1.0 . 3.38 1484 1265 A 53 SER HA A 55 VAL H 1.0 . 4.53 1485 1266 A 36 TRP HE1 B -1 ALA H 1.0 . 4.61 1486 1267 A 32 TYR HD% A 36 TRP HE1 1.0 . 4.79 1487 1268 B -5 PRO HBy A 36 TRP HE1 1.0 . 3.81 1488 1269 A 43 ARG H A 43 ARG HE 1.0 . 4.91 1489 1270 A 74 ARG HBx A 74 ARG HE 1.0 . 3.96 1490 1271 A 56 ARG HE A 7 LEU HDx% 1.0 . 4.02 1491 1271 A 56 ARG HE A 7 LEU HDy% 1.0 . 4.02 1492 1272 A 56 ARG HE A 56 ARG HBy 1.0 . 4.35 1493 1273 A 1 PRO HA A 2 LEU H 1.0 . 3.28 1494 1274 A -2 MET HE% A 2 LEU H 1.0 . 4.07 1495 1275 A 2 LEU H A 2 LEU HDy% 1.0 . 4.87 1496 1276 A 2 LEU H A 2 LEU HDx% 1.0 . 4.87 1497 1277 A 28 ILE HB A 2 LEU H 1.0 . 5.15 1498 1278 A 4 ALA HA A 58 ILE H 1.0 . 4.08 1499 1279 A 4 ALA HB% A 26 LEU H 1.0 . 4.58 1500 1280 A 5 VAL HGy% A 26 LEU H 1.0 . 4.99 1501 1281 A 3 PHE HA A 4 ALA H 1.0 . 3.56 1502 1282 A 4 ALA H A 3 PHE HBy 1.0 . 4.10 1503 1283 A 4 ALA H A 3 PHE HBx 1.0 . 4.10 1504 1284 A 5 VAL HGy% A 6 THR H 1.0 . 3.70 1505 1285 A 4 ALA HA A 5 VAL H 1.0 . 3.45 1506 1286 A 5 VAL HB A 5 VAL H 1.0 . 4.04 1507 1287 A 56 ARG HBx A 5 VAL H 1.0 . 4.47 1508 1288 A 4 ALA HB% A 5 VAL H 1.0 . 3.45 1509 1289 A 58 ILE HD1% A 5 VAL H 1.0 . 4.00 1510 1290 A 5 VAL H A 7 LEU HDx% 1.0 . 5.29 1511 1290 A 7 LEU HDy% A 5 VAL H 1.0 . 5.29 1512 1291 A 57 ILE HD1% A 5 VAL H 1.0 . 5.50 1513 1292 A 57 ILE HA A 5 VAL H 1.0 . 4.65 1514 1293 A 56 ARG H A 5 VAL H 1.0 . 3.82 1515 1294 A 6 THR HA A 56 ARG H 1.0 . 4.14 1516 1295 A 6 THR H A 7 LEU H 1.0 . 4.82 1517 1296 A 22 PRO HBy A 7 LEU H 1.0 . 4.94 1518 1297 A 7 LEU HG A 7 LEU H 1.0 . 3.98 1519 1298 A 7 LEU H A 7 LEU HDx% 1.0 . 3.74 1520 1298 A 7 LEU HDy% A 7 LEU H 1.0 . 3.74 1521 1299 A 8 TYR H A 22 PRO HBy 1.0 . 4.49 1522 1300 A 8 TYR H A 22 PRO HGy 1.0 . 5.50 1523 1301 A 8 TYR H A 7 LEU HBy 1.0 . 4.49 1524 1302 A 8 TYR H A 7 LEU HDx% 1.0 . 4.32 1525 1302 A 8 TYR H A 7 LEU HDy% 1.0 . 4.32 1526 1303 A 8 TYR H A 7 LEU HG 1.0 . 4.76 1527 1304 A 9 GLU H A 10 PHE H 1.0 . 4.39 1528 1305 A 22 PRO HDy A 9 GLU H 1.0 . 5.04 1529 1306 A 9 GLU HBx A 9 GLU H 1.0 . 3.06 1530 1307 A 22 PRO HBy A 9 GLU H 1.0 . 3.97 1531 1308 A 8 TYR HBx A 9 GLU H 1.0 . 3.79 1532 1309 A 10 PHE H A 10 PHE HBy 1.0 . 4.10 1533 1310 A 20 VAL HB A 10 PHE H 1.0 . 5.27 1534 1311 A 54 TYR HE% A 11 LYS H 1.0 . 5.42 1535 1312 A 11 LYS H A 10 PHE HBx 1.0 . 4.74 1536 1313 A 11 LYS H A 11 LYS HEx 1.0 . 5.08 1537 1313 A 11 LYS HEy A 11 LYS H 1.0 . 5.08 1538 1314 A 11 LYS H A 11 LYS HGy 1.0 . 4.27 1539 1315 A 11 LYS H A 11 LYS HGx 1.0 . 4.27 1540 1316 A 11 LYS H A 11 LYS HDx 1.0 . 3.47 1541 1316 A 11 LYS HDy A 11 LYS H 1.0 . 3.47 1542 1317 A 11 LYS H A 10 PHE HBy 1.0 . 4.74 1543 1318 A 92 TRP HA A 96 THR H 1.0 . 4.56 1544 1319 A 93 LYS HA A 96 THR H 1.0 . 4.56 1545 1320 A 92 TRP HA A 95 GLN H 1.0 . 3.90 1546 1321 A 89 VAL HA A 92 TRP H 1.0 . 3.89 1547 1322 A 95 GLN HA A 99 TYR H 1.0 . 4.70 1548 1323 A 96 THR HA A 99 TYR H 1.0 . 4.85 1549 1324 A 18 LEU H A 17 GLU H 1.0 . 4.75 1550 1325 A 18 LEU H A 19 ASP H 1.0 . 4.79 1551 1326 A 13 GLU H A 14 ARG HBx 1.0 . 4.76 1552 1327 A 14 ARG HGy A 13 GLU H 1.0 . 5.26 1553 1328 A 13 GLU H A 13 GLU HGx 1.0 . 4.06 1554 1329 A 13 GLU H A 17 GLU HBy 1.0 . 4.97 1555 1330 A 13 GLU H A 17 GLU HBx 1.0 . 4.97 1556 1331 A 14 ARG H A 16 ASP H 1.0 . 4.86 1557 1332 A 12 ALA HA A 14 ARG H 1.0 . 4.15 1558 1333 A 14 ARG H A 14 ARG HGx 1.0 . 4.26 1559 1334 A 14 ARG HBx A 14 ARG H 1.0 . 3.91 1560 1335 A 12 ALA HB% A 14 ARG H 1.0 . 3.80 1561 1336 A 14 ARG H A 13 GLU HGy 1.0 . 4.24 1562 1337 A 14 ARG H A 13 GLU HGx 1.0 . 4.24 1563 1338 A 17 GLU H A 15 ASP HA 1.0 . 4.71 1564 1339 A 14 ARG HBy A 15 ASP H 1.0 . 4.28 1565 1340 A 16 ASP H A 15 ASP HBx 1.0 . 3.48 1566 1340 A 15 ASP HBy A 16 ASP H 1.0 . 3.48 1567 1341 A 14 ARG HBy A 16 ASP H 1.0 . 4.15 1568 1342 A 14 ARG HBx A 16 ASP H 1.0 . 4.37 1569 1343 A 14 ARG H A 17 GLU H 1.0 . 4.12 1570 1344 A 14 ARG HBx A 17 GLU H 1.0 . 4.47 1571 1345 A 12 ALA HB% A 17 GLU H 1.0 . 4.23 1572 1346 A 48 GLY H A 18 LEU HDx% 1.0 . 4.68 1573 1347 A 39 ALA H A 38 ILE HG2% 1.0 . 3.98 1574 1348 A 18 LEU H A 10 PHE HE% 1.0 . 4.15 1575 1349 A 13 GLU H A 14 ARG H 1.0 . 3.31 1576 1350 A 18 LEU H A 12 ALA HA 1.0 . 4.80 1577 1351 A 18 LEU H A 48 GLY HAx 1.0 . 5.23 1578 1352 A 18 LEU H A 17 GLU HBy 1.0 . 4.32 1579 1353 A 18 LEU H A 17 GLU HBx 1.0 . 4.32 1580 1354 A 18 LEU H A 18 LEU HG 1.0 . 5.00 1581 1355 A 18 LEU H A 49 LEU HBx 1.0 . 5.20 1582 1356 A 18 LEU H A 18 LEU HDy% 1.0 . 4.72 1583 1357 A 10 PHE HD% A 19 ASP H 1.0 . 5.50 1584 1358 A 12 ALA H A 19 ASP H 1.0 . 4.64 1585 1359 A 19 ASP H A 18 LEU HBx 1.0 . 4.33 1586 1359 A 18 LEU HBy A 19 ASP H 1.0 . 4.33 1587 1360 A 18 LEU HG A 19 ASP H 1.0 . 4.31 1588 1361 A 12 ALA HB% A 19 ASP H 1.0 . 3.88 1589 1362 A 10 PHE HD% A 20 VAL H 1.0 . 4.39 1590 1363 A 20 VAL H A 10 PHE HBy 1.0 . 5.11 1591 1364 A 20 VAL H A 10 PHE HBx 1.0 . 5.11 1592 1365 A 20 VAL HB A 20 VAL H 1.0 . 3.86 1593 1366 A 21 SER H A 21 SER HBy 1.0 . 4.17 1594 1367 A 21 SER H A 21 SER HBx 1.0 . 4.17 1595 1368 A 20 VAL HB A 21 SER H 1.0 . 4.30 1596 1369 A 21 SER H A 24 GLU HGy 1.0 . 4.66 1597 1370 A 24 GLU HBy A 21 SER H 1.0 . 4.50 1598 1371 A 21 SER H A 24 GLU HGx 1.0 . 4.66 1599 1372 A 21 SER H A 24 GLU HBx 1.0 . 4.68 1600 1373 A 6 THR HG2% A 21 SER H 1.0 . 4.62 1601 1374 A 21 SER H A 20 VAL HGx% 1.0 . 4.83 1602 1375 A 21 SER H A 20 VAL HGy% 1.0 . 4.83 1603 1376 A 8 TYR H A 23 GLY H 1.0 . 5.23 1604 1377 A 22 PRO HA A 23 GLY H 1.0 . 3.27 1605 1378 A 6 THR HB A 23 GLY H 1.0 . 3.99 1606 1379 A 6 THR HG2% A 23 GLY H 1.0 . 4.89 1607 1380 A 22 PRO HBy A 23 GLY H 1.0 . 4.15 1608 1381 A 24 GLU HBy A 23 GLY H 1.0 . 4.72 1609 1382 A 5 VAL HGy% A 23 GLY H 1.0 . 4.02 1610 1383 A 23 GLY H A 7 LEU HDx% 1.0 . 5.13 1611 1383 A 7 LEU HDy% A 23 GLY H 1.0 . 5.13 1612 1384 A 22 PRO HBx A 23 GLY H 1.0 . 3.75 1613 1385 A 5 VAL HGx% A 56 ARG H 1.0 . 3.68 1614 1386 A 24 GLU H A 23 GLY H 1.0 . 3.55 1615 1387 A 24 GLU HBy A 24 GLU H 1.0 . 3.29 1616 1388 A 24 GLU H A 24 GLU HBx 1.0 . 3.74 1617 1389 A 24 GLU H A 24 GLU HGy 1.0 . 4.17 1618 1390 A 24 GLU H A 24 GLU HGx 1.0 . 4.17 1619 1391 A 5 VAL HGy% A 24 GLU H 1.0 . 3.93 1620 1392 A 95 GLN H A 94 ASP HBx 1.0 . 3.45 1621 1392 A 94 ASP HBy A 95 GLN H 1.0 . 3.45 1622 1393 A 6 THR HG2% A 24 GLU H 1.0 . 4.64 1623 1394 A 25 ASN HD2y A 25 ASN H 1.0 . 5.03 1624 1395 A 25 ASN H A 24 GLU HBx 1.0 . 3.98 1625 1396 A 91 GLN HBy A 92 TRP H 1.0 . 3.63 1626 1397 A 24 GLU HBy A 25 ASN H 1.0 . 4.17 1627 1398 A 92 TRP H A 90 GLU HBx 1.0 . 5.50 1628 1398 A 90 GLU HBy A 92 TRP H 1.0 . 5.50 1629 1399 A 5 VAL HB A 25 ASN HD2y 1.0 . 4.99 1630 1400 A 58 ILE HD1% A 25 ASN HD2x 1.0 . 4.88 1631 1401 A 56 ARG H A 7 LEU HDx% 1.0 . 3.68 1632 1401 A 7 LEU HDy% A 56 ARG H 1.0 . 3.68 1633 1402 A 56 ARG H A 55 VAL HGy% 1.0 . 4.21 1634 1403 A 27 SER HBy A 27 SER H 1.0 . 4.00 1635 1404 A 27 SER H A 26 LEU HBy 1.0 . 4.27 1636 1405 A 27 SER H A 26 LEU HBx 1.0 . 4.27 1637 1406 A 27 SER HBy A 28 ILE H 1.0 . 4.81 1638 1407 A 27 SER HBx A 28 ILE H 1.0 . 5.07 1639 1408 A 28 ILE HB A 28 ILE H 1.0 . 3.84 1640 1409 A 28 ILE H A 28 ILE HG1y 1.0 . 4.62 1641 1410 A 28 ILE H A 28 ILE HG1x 1.0 . 4.62 1642 1411 A 28 ILE HG2% A 28 ILE H 1.0 . 4.41 1643 1412 A 28 ILE HD1% A 28 ILE H 1.0 . 4.49 1644 1413 A 3 PHE HD% A 28 ILE H 1.0 . 4.64 1645 1414 A 4 ALA H A 28 ILE H 1.0 . 4.98 1646 1415 A 39 ALA HA A 29 CYS H 1.0 . 4.68 1647 1416 A 28 ILE HG2% A 29 CYS H 1.0 . 4.39 1648 1417 A 38 ILE HB A 29 CYS H 1.0 . 4.81 1649 1418 A 28 ILE HD1% A 29 CYS H 1.0 . 4.72 1650 1419 A 30 ALA H A 38 ILE H 1.0 . 4.23 1651 1420 A 28 ILE HA A 30 ALA H 1.0 . 4.61 1652 1421 A 30 ALA H A 29 CYS HBy 1.0 . 4.42 1653 1422 A 30 ALA H A 29 CYS HBx 1.0 . 4.74 1654 1423 A 30 ALA H A 38 ILE HB 1.0 . 4.11 1655 1424 A 30 ALA HB% A 30 ALA H 1.0 . 4.01 1656 1425 A 38 ILE H A 31 HIS HA 1.0 . 3.87 1657 1426 A 88 THR HA A 31 HIS H 1.0 . 3.77 1658 1427 A 88 THR HB A 90 GLU H 1.0 . 4.33 1659 1428 A 38 ILE HD1% A 31 HIS H 1.0 . 5.50 1660 1429 A 37 PHE HA A 32 TYR H 1.0 . 4.05 1661 1430 A 32 TYR HD% A 32 TYR H 1.0 . 4.66 1662 1431 A 32 TYR HBx A 32 TYR H 1.0 . 4.11 1663 1432 A 32 TYR H A 31 HIS HBx 1.0 . 4.17 1664 1433 A 38 ILE HG1y A 32 TYR H 1.0 . 5.50 1665 1434 A 33 ASP H A 35 GLU H 1.0 . 4.43 1666 1435 A 31 HIS HE1 A 33 ASP H 1.0 . 4.16 1667 1436 A 32 TYR HD% A 33 ASP H 1.0 . 4.29 1668 1437 A 88 THR HG2% A 33 ASP H 1.0 . 4.40 1669 1438 A 81 ILE HD1% A 33 ASP H 1.0 . 5.50 1670 1439 A 34 TYR H A 36 TRP H 1.0 . 4.52 1671 1440 A 34 TYR HD% A 34 TYR H 1.0 . 3.79 1672 1441 A 31 HIS HE1 A 34 TYR H 1.0 . 3.54 1673 1442 A 34 TYR HBy A 34 TYR H 1.0 . 3.73 1674 1443 A 34 TYR HBx A 34 TYR H 1.0 . 4.09 1675 1444 A 81 ILE HD1% A 34 TYR H 1.0 . 3.92 1676 1445 A 77 VAL HGx% A 34 TYR H 1.0 . 5.50 1677 1446 A 88 THR HG2% A 34 TYR H 1.0 . 4.64 1678 1447 A 32 TYR HD% A 35 GLU H 1.0 . 4.73 1679 1448 A 35 GLU H A 35 GLU HGy 1.0 . 4.29 1680 1449 A 35 GLU H A 35 GLU HGx 1.0 . 4.29 1681 1450 A 36 TRP HD1 A 36 TRP H 1.0 . 4.36 1682 1451 A 32 TYR HBx A 36 TRP H 1.0 . 4.82 1683 1452 A 36 TRP HE1 B -4 SER HA 1.0 . 4.96 1684 1453 A 36 TRP HE1 B -1 ALA HB% 1.0 . 3.74 1685 1454 A 37 PHE HD% A 37 PHE H 1.0 . 4.74 1686 1455 A 36 TRP HE3 A 37 PHE H 1.0 . 4.06 1687 1456 A 37 PHE HBy A 37 PHE H 1.0 . 3.84 1688 1457 A 37 PHE HBx A 37 PHE H 1.0 . 3.83 1689 1458 A 49 LEU HG A 37 PHE H 1.0 . 5.50 1690 1459 A 36 TRP HBy A 37 PHE H 1.0 . 4.12 1691 1460 A 37 PHE HBx A 38 ILE H 1.0 . 4.50 1692 1461 A 37 PHE HBy A 38 ILE H 1.0 . 4.04 1693 1462 A 38 ILE H A 38 ILE HG1y 1.0 . 4.00 1694 1463 A 38 ILE H A 38 ILE HG1x 1.0 . 4.02 1695 1464 A 39 ALA HB% A 40 LYS H 1.0 . 3.46 1696 1465 A 26 LEU HA A 40 LYS H 1.0 . 4.46 1697 1466 A 28 ILE HA A 40 LYS H 1.0 . 4.33 1698 1467 A 27 SER HBy A 40 LYS H 1.0 . 5.43 1699 1468 A 27 SER HBx A 40 LYS H 1.0 . 5.50 1700 1469 A 40 LYS HA A 48 GLY H 1.0 . 3.88 1701 1470 A 26 LEU HA A 42 ILE H 1.0 . 4.32 1702 1471 A 42 ILE HB A 42 ILE H 1.0 . 4.18 1703 1472 A 42 ILE H A 42 ILE HG1y 1.0 . 4.66 1704 1473 A 42 ILE HD1% A 42 ILE H 1.0 . 4.66 1705 1474 A 42 ILE HG2% A 42 ILE H 1.0 . 4.07 1706 1475 A 42 ILE H A 42 ILE HG1x 1.0 . 4.66 1707 1476 A 41 PRO HBy A 43 ASN H 1.0 . 4.37 1708 1477 A 42 ILE HB A 43 ASN H 1.0 . 4.36 1709 1478 A 43 ASN HA A 43 ASN HD2x 1.0 . 4.59 1710 1479 A 43 ASN HA A 43 ASN HD2y 1.0 . 4.59 1711 1480 A 42 ILE H A 43 ARG H 1.0 . 4.61 1712 1481 A 43 ARG H A 43 ARG HBx 1.0 . 4.12 1713 1482 A 43 ARG H A 43 ARG HGx 1.0 . 3.60 1714 1483 A 41 PRO HBy A 43 ARG H 1.0 . 3.65 1715 1484 A 44 LEU H A 45 GLY H 1.0 . 4.26 1716 1485 A 44 LEU H A 44 LEU HBy 1.0 . 3.72 1717 1486 A 44 LEU H A 44 LEU HBx 1.0 . 3.72 1718 1487 A 44 LEU H A 43 ARG HBy 1.0 . 3.79 1719 1488 A 44 LEU H A 43 ARG HBx 1.0 . 3.79 1720 1489 A 88 THR H A 91 GLN H 1.0 . 4.38 1721 1490 A 88 THR H A 91 GLN HE2y 1.0 . 4.68 1722 1491 A 88 THR H A 92 TRP H 1.0 . 4.56 1723 1492 A 87 PRO HA A 88 THR H 1.0 . 3.10 1724 1493 A 88 THR H A 91 GLN HBy 1.0 . 3.49 1725 1494 A 88 THR H A 91 GLN HGx 1.0 . 3.76 1726 1494 A 91 GLN HGy A 88 THR H 1.0 . 3.76 1727 1495 A 91 GLN HBx A 88 THR H 1.0 . 4.03 1728 1496 A 88 THR HG2% A 88 THR H 1.0 . 3.89 1729 1497 A 44 LEU HG A 45 GLY H 1.0 . 5.50 1730 1498 A 45 GLY H A 44 LEU HDx% 1.0 . 5.01 1731 1499 A 45 GLY H A 44 LEU HDy% 1.0 . 5.01 1732 1500 A 47 PRO HA A 46 GLY H 1.0 . 5.33 1733 1501 A 39 ALA HB% A 48 GLY H 1.0 . 5.27 1734 1502 A 48 GLY H A 47 PRO HBy 1.0 . 4.44 1735 1503 A 48 GLY H A 47 PRO HBx 1.0 . 4.44 1736 1504 A 39 ALA H A 49 LEU HA 1.0 . 4.80 1737 1505 A 18 LEU H A 49 LEU H 1.0 . 4.34 1738 1506 A 49 LEU H A 17 GLU H 1.0 . 5.50 1739 1507 A 49 LEU H A 49 LEU HBx 1.0 . 4.00 1740 1508 A 49 LEU H A 49 LEU HDy% 1.0 . 4.95 1741 1509 A 50 VAL H A 49 LEU H 1.0 . 4.68 1742 1510 A 50 VAL H A 49 LEU HDx% 1.0 . 4.98 1743 1511 A 50 VAL H A 49 LEU HBx 1.0 . 4.27 1744 1512 A 50 VAL H A 49 LEU HG 1.0 . 4.66 1745 1513 A 50 VAL H A 49 LEU HBy 1.0 . 4.77 1746 1514 A 50 VAL H A 36 TRP HE3 1.0 . 4.45 1747 1515 A 52 VAL H A 53 SER H 1.0 . 3.93 1748 1516 A 54 TYR H A 53 SER H 1.0 . 4.19 1749 1517 A 53 SER H A 53 SER HBx 1.0 . 3.74 1750 1517 A 53 SER HBy A 53 SER H 1.0 . 3.74 1751 1518 A 52 VAL HB A 53 SER H 1.0 . 3.61 1752 1519 A 53 SER H A 52 VAL HGx% 1.0 . 4.23 1753 1520 A 53 SER H A 52 VAL HGy% 1.0 . 4.23 1754 1521 A 55 VAL H A 54 TYR H 1.0 . 3.08 1755 1522 A 54 TYR HE% A 54 TYR H 1.0 . 5.50 1756 1523 A 54 TYR H A 53 SER HBx 1.0 . 4.29 1757 1523 A 53 SER HBy A 54 TYR H 1.0 . 4.29 1758 1524 A 54 TYR H A 54 TYR HBx 1.0 . 3.88 1759 1525 A 54 TYR H A 55 VAL HGx% 1.0 . 4.87 1760 1526 A 54 TYR H A 55 VAL HGy% 1.0 . 4.87 1761 1527 A 56 ARG H A 55 VAL H 1.0 . 4.76 1762 1528 A 55 VAL H A 55 VAL HGx% 1.0 . 3.79 1763 1529 A 6 THR HG2% A 55 VAL H 1.0 . 5.50 1764 1530 A 7 LEU HG A 55 VAL H 1.0 . 5.50 1765 1531 A 71 THR HG2% A 55 VAL H 1.0 . 5.50 1766 1532 A 55 VAL H A 7 LEU HDx% 1.0 . 4.41 1767 1532 A 7 LEU HDy% A 55 VAL H 1.0 . 4.41 1768 1533 A 7 LEU HG A 56 ARG H 1.0 . 4.13 1769 1534 A 57 ILE HA A 4 ALA H 1.0 . 5.50 1770 1535 A 57 ILE HA A 56 ARG H 1.0 . 5.50 1771 1536 A 56 ARG HBx A 56 ARG H 1.0 . 3.63 1772 1537 A 56 ARG H A 56 ARG HBy 1.0 . 3.76 1773 1538 A 56 ARG H A 56 ARG HGy 1.0 . 4.81 1774 1539 A 56 ARG H A 56 ARG HGx 1.0 . 4.81 1775 1540 A 4 ALA HB% A 4 ALA H 1.0 . 3.63 1776 1541 A 71 THR HG2% A 57 ILE H 1.0 . 3.69 1777 1542 A 57 ILE HD1% A 57 ILE H 1.0 . 3.59 1778 1543 A 58 ILE HG2% A 5 VAL H 1.0 . 4.02 1779 1544 A 3 PHE H A 4 ALA H 1.0 . 4.90 1780 1545 A 58 ILE H A 4 ALA H 1.0 . 5.38 1781 1546 A 57 ILE HD1% A 58 ILE H 1.0 . 4.18 1782 1547 A 58 ILE HD1% A 58 ILE H 1.0 . 4.51 1783 1548 A 58 ILE HG2% A 58 ILE H 1.0 . 3.99 1784 1549 A 58 ILE H A 58 ILE HG1x 1.0 . 4.36 1785 1549 A 58 ILE HG1y A 58 ILE H 1.0 . 4.36 1786 1550 A 58 ILE HB A 58 ILE H 1.0 . 4.21 1787 1551 A 4 ALA HB% A 58 ILE H 1.0 . 3.85 1788 1552 A 57 ILE HG2% A 58 ILE H 1.0 . 3.89 1789 1553 A 3 PHE HD% A 60 LEU H 1.0 . 4.40 1790 1554 A 61 MET HE% A 60 LEU H 1.0 . 4.42 1791 1555 A 60 LEU H A 60 LEU HBy 1.0 . 3.80 1792 1556 A 60 LEU H A 60 LEU HBx 1.0 . 3.80 1793 1557 A 60 LEU HG A 60 LEU H 1.0 . 4.33 1794 1558 A 61 MET H A 61 MET HBx 1.0 . 3.37 1795 1558 A 61 MET H A 61 MET HBy 1.0 . 3.37 1796 1559 A 61 MET HE% A 61 MET H 1.0 . 3.57 1797 1560 A 62 ASP H A 65 LYS H 1.0 . 5.30 1798 1561 A 62 ASP H A 64 ALA H 1.0 . 5.21 1799 1562 A 62 ASP H A 59 ASP HBy 1.0 . 3.98 1800 1563 A 62 ASP H A 59 ASP HBx 1.0 . 3.98 1801 1564 A 63 PRO HBx A 62 ASP H 1.0 . 5.49 1802 1565 A 62 ASP H A 63 PRO HGx 1.0 . 5.50 1803 1565 A 63 PRO HGy A 62 ASP H 1.0 . 5.50 1804 1566 A 62 ASP HA A 64 ALA H 1.0 . 4.16 1805 1567 A 64 ALA H A 63 PRO HDy 1.0 . 4.16 1806 1568 A 63 PRO HBy A 64 ALA H 1.0 . 4.24 1807 1569 A 65 LYS HBy A 64 ALA H 1.0 . 4.15 1808 1570 A 64 ALA H A 63 PRO HGx 1.0 . 3.44 1809 1570 A 63 PRO HGy A 64 ALA H 1.0 . 3.44 1810 1571 A 67 ALA HB% A 65 LYS H 1.0 . 3.94 1811 1572 A 64 ALA HB% A 65 LYS H 1.0 . 3.50 1812 1573 A 67 ALA H A 66 TYR H 1.0 . 3.56 1813 1574 A 66 TYR HD% A 66 TYR H 1.0 . 4.17 1814 1575 A 65 LYS H A 66 TYR H 1.0 . 3.53 1815 1576 A 65 LYS HBy A 66 TYR H 1.0 . 4.27 1816 1577 A 67 ALA HB% A 66 TYR H 1.0 . 4.21 1817 1578 A 65 LYS HBx A 66 TYR H 1.0 . 4.46 1818 1579 A 67 ALA H A 68 SER H 1.0 . 3.98 1819 1580 A 64 ALA HA A 67 ALA H 1.0 . 4.29 1820 1581 A 68 SER H A 68 SER HBx 1.0 . 3.88 1821 1582 A 67 ALA HB% A 68 SER H 1.0 . 3.99 1822 1583 A 66 TYR HBx A 69 VAL H 1.0 . 5.50 1823 1584 A 71 THR H A 72 TYR H 1.0 . 3.33 1824 1585 A 71 THR H A 73 ASP H 1.0 . 4.76 1825 1586 A 72 TYR H A 72 TYR HBx 1.0 . 3.75 1826 1587 A 74 ARG H A 74 ARG HE 1.0 . 4.61 1827 1588 A 74 ARG H A 74 ARG HDy 1.0 . 4.14 1828 1589 A 74 ARG H A 74 ARG HDx 1.0 . 4.14 1829 1590 A 74 ARG H A 73 ASP HBx 1.0 . 4.57 1830 1591 A 74 ARG H A 73 ASP HBy 1.0 . 4.57 1831 1592 A 74 ARG HBy A 74 ARG H 1.0 . 3.61 1832 1593 A 74 ARG HBx A 74 ARG H 1.0 . 3.44 1833 1594 A 74 ARG H A 74 ARG HGy 1.0 . 4.10 1834 1595 A 74 ARG H A 74 ARG HGx 1.0 . 4.10 1835 1596 A 75 GLU HBx A 75 GLU H 1.0 . 3.06 1836 1597 A 75 GLU HGy A 75 GLU H 1.0 . 4.00 1837 1598 A 75 GLU HGx A 75 GLU H 1.0 . 3.20 1838 1599 A 74 ARG HBy A 75 GLU H 1.0 . 4.13 1839 1600 A 75 GLU H A 74 ARG HGy 1.0 . 4.20 1840 1601 A 75 GLU H A 74 ARG HGx 1.0 . 4.20 1841 1602 A 76 GLN HGx A 76 GLN H 1.0 . 3.34 1842 1603 A 75 GLU HBx A 76 GLN H 1.0 . 3.57 1843 1604 A 75 GLU HBy A 76 GLN H 1.0 . 3.35 1844 1605 A 76 GLN HGy A 76 GLN HE2y 1.0 . 3.72 1845 1606 A 76 GLN HGy A 76 GLN HE2x 1.0 . 3.72 1846 1607 A 76 GLN HE2x A 76 GLN HBx 1.0 . 4.98 1847 1608 A 76 GLN HE2y A 76 GLN HBx 1.0 . 4.98 1848 1609 A 76 GLN HE2x A 76 GLN HBy 1.0 . 4.98 1849 1610 A 76 GLN HE2y A 76 GLN HBy 1.0 . 4.98 1850 1611 A 77 VAL HGy% A 77 VAL H 1.0 . 4.03 1851 1612 A 77 VAL HGx% A 77 VAL H 1.0 . 4.20 1852 1613 A 77 VAL H A 78 MET HBx 1.0 . 4.56 1853 1613 A 78 MET HBy A 77 VAL H 1.0 . 4.56 1854 1614 A 77 VAL H A 76 GLN HBy 1.0 . 3.69 1855 1615 A 77 VAL H A 76 GLN HBx 1.0 . 3.69 1856 1616 A 76 GLN HGx A 77 VAL H 1.0 . 4.73 1857 1617 A 77 VAL HGx% A 78 MET H 1.0 . 3.59 1858 1618 A 77 VAL HB A 78 MET H 1.0 . 3.76 1859 1619 A 79 LYS H A 82 ASP H 1.0 . 5.31 1860 1620 A 79 LYS H A 79 LYS HDx 1.0 . 3.61 1861 1620 A 79 LYS HDy A 79 LYS H 1.0 . 3.61 1862 1621 A 100 LYS H A 101 GLU H 1.0 . 3.71 1863 1622 A 79 LYS H A 81 ILE H 1.0 . 4.71 1864 1623 A 80 ILE HD1% A 80 ILE H 1.0 . 3.88 1865 1624 A 80 ILE H A 79 LYS HBx 1.0 . 3.43 1866 1624 A 79 LYS HBy A 80 ILE H 1.0 . 3.43 1867 1625 A 34 TYR HD% A 81 ILE H 1.0 . 4.88 1868 1626 A 34 TYR HE% A 81 ILE H 1.0 . 5.16 1869 1627 A 78 MET HA A 81 ILE H 1.0 . 4.41 1870 1628 A 81 ILE HB A 81 ILE H 1.0 . 3.06 1871 1629 A 81 ILE HG1y A 81 ILE H 1.0 . 3.77 1872 1630 A 81 ILE HG1x A 81 ILE H 1.0 . 3.95 1873 1631 A 81 ILE HG2% A 81 ILE H 1.0 . 3.80 1874 1632 A 81 ILE HD1% A 81 ILE H 1.0 . 3.77 1875 1633 A 101 GLU H A 101 GLU HGy 1.0 . 4.30 1876 1634 A 82 ASP H A 83 GLU H 1.0 . 2.74 1877 1635 A 34 TYR HE% A 82 ASP H 1.0 . 4.25 1878 1636 A 82 ASP H A 82 ASP HBy 1.0 . 3.45 1879 1637 A 82 ASP H A 82 ASP HBx 1.0 . 3.45 1880 1638 A 81 ILE HD1% A 82 ASP H 1.0 . 5.00 1881 1639 A 82 ASP H A 78 MET HBx 1.0 . 5.05 1882 1639 A 78 MET HBy A 82 ASP H 1.0 . 5.05 1883 1640 A 83 GLU H A 85 LYS H 1.0 . 3.96 1884 1641 A 84 PHE HD% A 83 GLU H 1.0 . 4.71 1885 1642 A 83 GLU H A 82 ASP HBy 1.0 . 4.17 1886 1643 A 83 GLU H A 82 ASP HBx 1.0 . 4.17 1887 1644 A 83 GLU HBy A 83 GLU H 1.0 . 3.38 1888 1645 A 83 GLU HBx A 83 GLU H 1.0 . 3.64 1889 1646 A 83 GLU H A 83 GLU HGx 1.0 . 4.02 1890 1647 A 83 GLU H A 83 GLU HGy 1.0 . 4.02 1891 1648 A 84 PHE H A 85 LYS H 1.0 . 3.30 1892 1649 A 84 PHE HD% A 84 PHE H 1.0 . 3.78 1893 1650 A 83 GLU HBy A 84 PHE H 1.0 . 4.17 1894 1651 A 84 PHE H A 85 LYS HGx 1.0 . 5.38 1895 1651 A 85 LYS HGy A 84 PHE H 1.0 . 5.38 1896 1652 A 82 ASP HA A 85 LYS H 1.0 . 4.34 1897 1653 A 85 LYS H A 84 PHE HBy 1.0 . 4.55 1898 1654 A 85 LYS H A 84 PHE HBx 1.0 . 4.55 1899 1655 A 85 LYS H A 85 LYS HBy 1.0 . 4.11 1900 1656 A 85 LYS H A 85 LYS HBx 1.0 . 4.11 1901 1657 A 85 LYS H A 85 LYS HGx 1.0 . 3.55 1902 1657 A 85 LYS HGy A 85 LYS H 1.0 . 3.55 1903 1658 A 86 ILE HD1% A 85 LYS H 1.0 . 5.09 1904 1659 A 87 PRO HA A 86 ILE H 1.0 . 5.50 1905 1660 A 81 ILE HA A 86 ILE H 1.0 . 4.82 1906 1661 A 86 ILE H A 86 ILE HG1y 1.0 . 3.79 1907 1662 A 81 ILE HG2% A 86 ILE H 1.0 . 4.09 1908 1663 A 86 ILE HG2% A 86 ILE H 1.0 . 4.11 1909 1664 A 86 ILE HD1% A 86 ILE H 1.0 . 4.46 1910 1665 A 88 THR H A 87 PRO HBx 1.0 . 3.22 1911 1665 A 87 PRO HBy A 88 THR H 1.0 . 3.22 1912 1666 A 91 GLN HA A 88 THR H 1.0 . 5.40 1913 1667 A 32 TYR HD% A 89 VAL H 1.0 . 4.70 1914 1668 A 30 ALA HB% A 89 VAL H 1.0 . 4.01 1915 1669 A 90 GLU H A 90 GLU HBx 1.0 . 3.27 1916 1669 A 90 GLU HBy A 90 GLU H 1.0 . 3.27 1917 1670 A 90 GLU H A 90 GLU HGy 1.0 . 3.92 1918 1671 A 90 GLU H A 90 GLU HGx 1.0 . 3.92 1919 1672 A 88 THR HG2% A 91 GLN H 1.0 . 4.76 1920 1673 A 91 GLN H A 90 GLU HBx 1.0 . 3.44 1921 1673 A 90 GLU HBy A 91 GLN H 1.0 . 3.44 1922 1674 A 91 GLN H A 91 GLN HGx 1.0 . 3.43 1923 1674 A 91 GLN HGy A 91 GLN H 1.0 . 3.43 1924 1675 A 93 LYS H A 92 TRP H 1.0 . 2.90 1925 1676 A 88 THR HA A 92 TRP H 1.0 . 5.23 1926 1677 A 92 TRP H A 92 TRP HBy 1.0 . 3.81 1927 1678 A 91 GLN HBx A 92 TRP H 1.0 . 4.14 1928 1679 A 30 ALA HB% A 92 TRP H 1.0 . 4.15 1929 1680 A 92 TRP HE3 A 92 TRP H 1.0 . 5.08 1930 1681 A 91 GLN HE2y A 91 GLN HGx 1.0 . 3.38 1931 1681 A 91 GLN HGy A 91 GLN HE2y 1.0 . 3.38 1932 1682 A 91 GLN HBx A 91 GLN HE2y 1.0 . 4.58 1933 1683 A 29 CYS HBy A 92 TRP HE1 1.0 . 3.69 1934 1684 A 29 CYS HBx A 92 TRP HE1 1.0 . 4.48 1935 1685 A 96 THR HG2% A 92 TRP HE1 1.0 . 3.80 1936 1686 A 92 TRP HE3 A 93 LYS H 1.0 . 4.17 1937 1687 A 93 LYS H A 93 LYS HBy 1.0 . 3.66 1938 1688 A 93 LYS H A 93 LYS HGy 1.0 . 4.66 1939 1689 A 94 ASP H A 94 ASP HBx 1.0 . 3.20 1940 1689 A 94 ASP HBy A 94 ASP H 1.0 . 3.20 1941 1690 A 94 ASP H A 93 LYS HBy 1.0 . 4.07 1942 1691 A 94 ASP H A 93 LYS HBx 1.0 . 4.07 1943 1692 A 95 GLN H A 95 GLN HBx 1.0 . 3.08 1944 1692 A 95 GLN HBy A 95 GLN H 1.0 . 3.08 1945 1693 A 96 THR HB A 96 THR H 1.0 . 3.78 1946 1694 A 97 ARG H A 97 ARG HBx 1.0 . 3.28 1947 1694 A 97 ARG HBy A 97 ARG H 1.0 . 3.28 1948 1695 A 97 ARG H A 97 ARG HGy 1.0 . 3.98 1949 1696 A 97 ARG H A 97 ARG HGx 1.0 . 3.98 1950 1697 A 96 THR HG2% A 97 ARG H 1.0 . 4.35 1951 1698 A 96 THR HB A 97 ARG H 1.0 . 3.59 1952 1699 A 95 GLN HA A 98 ARG H 1.0 . 4.08 1953 1700 A 98 ARG H A 98 ARG HGx 1.0 . 3.74 1954 1701 A 98 ARG H A 97 ARG HBx 1.0 . 3.75 1955 1701 A 97 ARG HBy A 98 ARG H 1.0 . 3.75 1956 1702 A 99 TYR H A 100 LYS H 1.0 . 2.74 1957 1703 A 99 TYR HBx A 99 TYR H 1.0 . 3.28 1958 1704 A 99 TYR HD% A 100 LYS H 1.0 . 4.72 1959 1705 A 97 ARG HA A 100 LYS H 1.0 . 3.75 1960 1706 A 99 TYR HBx A 100 LYS H 1.0 . 4.25 1961 1707 A 100 LYS H A 100 LYS HGy 1.0 . 4.26 1962 1708 A 100 LYS H A 98 ARG HBx 1.0 . 5.47 1963 1708 A 98 ARG HBy A 100 LYS H 1.0 . 5.47 1964 1709 A 100 LYS H A 100 LYS HDx 1.0 . 5.50 1965 1709 A 100 LYS HDy A 100 LYS H 1.0 . 5.50 1966 1710 A 100 LYS HA A 101 GLU H 1.0 . 3.46 1967 1711 A 101 GLU H A 101 GLU HGx 1.0 . 4.30 1968 1712 A 100 LYS HBy A 101 GLU H 1.0 . 3.26 1969 1713 A 80 ILE HG2% A 81 ILE H 1.0 . 3.90 1970 1714 A 103 SER HA A 104 ILE H 1.0 . 3.06 1971 1715 A 104 ILE H A 103 SER HBx 1.0 . 3.78 1972 1715 A 103 SER HBy A 104 ILE H 1.0 . 3.78 1973 1716 A 104 ILE HB A 104 ILE H 1.0 . 3.30 1974 1717 A 104 ILE H A 104 ILE HG1y 1.0 . 3.75 1975 1718 A 104 ILE H A 104 ILE HG1x 1.0 . 3.75 1976 1719 A 104 ILE HG2% A 104 ILE H 1.0 . 4.09 1977 1720 A 104 ILE HD1% A 104 ILE H 1.0 . 4.63 1978 1721 A 104 ILE HA A 105 GLN H 1.0 . 3.42 1979 1722 A 104 ILE HB A 105 GLN H 1.0 . 3.93 1980 1723 A 104 ILE HG2% A 105 GLN H 1.0 . 4.32 1981 1724 A 104 ILE HD1% A 105 GLN H 1.0 . 5.50 1982 1725 A 106 ILE HD1% A 105 GLN H 1.0 . 5.50 1983 1726 A 105 GLN HA A 106 ILE H 1.0 . 3.13 1984 1727 A 106 ILE HB A 106 ILE H 1.0 . 3.87 1985 1728 A 106 ILE H A 106 ILE HG1y 1.0 . 4.34 1986 1729 A 106 ILE H A 106 ILE HG1x 1.0 . 4.34 1987 1730 A 106 ILE HD1% A 106 ILE H 1.0 . 4.58 1988 1731 A 116 LEU H A 115 GLY HAx 1.0 . 3.19 1989 1731 A 115 GLY HAy A 116 LEU H 1.0 . 3.19 1990 1732 A 116 LEU HG A 116 LEU H 1.0 . 3.43 1991 1733 A 116 LEU H A 117 GLU H 1.0 . 4.57 1992 1734 A 117 GLU H A 117 GLU HBy 1.0 . 3.72 1993 1735 A 117 GLU H A 117 GLU HBx 1.0 . 3.72 1994 1736 A 117 GLU H A 116 LEU HBy 1.0 . 4.52 1995 1737 A 116 LEU HG A 117 GLU H 1.0 . 5.18 1996 1738 A 117 GLU H A 116 LEU HBx 1.0 . 4.52 1997 1739 A 117 GLU H A 117 GLU HGy 1.0 . 4.87 1998 1740 A 117 GLU H A 117 GLU HGx 1.0 . 4.87 1999 1741 A 79 LYS H A 78 MET HBx 1.0 . 3.41 2000 1741 A 78 MET HBy A 79 LYS H 1.0 . 3.41 2001 1742 A 80 ILE HB A 81 ILE H 1.0 . 3.14 2002 1743 A 80 ILE HA A 82 ASP H 1.0 . 4.38 2003 1744 A 4 ALA HB% A 56 ARG H 1.0 . 4.27 2004 1745 A 42 ILE HG2% A 25 ASN HD2y 1.0 . 5.50 2005 1746 A 5 VAL HGy% A 25 ASN HD2y 1.0 . 4.92 2006 1747 A 88 THR HG2% A 91 GLN HE2y 1.0 . 4.69 2007 1748 A 99 TYR HBy A 99 TYR H 1.0 . 3.38 2008 1749 A 109 GLY H A 108 ASN HBy 1.0 . 4.38 2009 1750 A 109 GLY H A 108 ASN HBx 1.0 . 4.38 2010 1751 A 89 VAL H A 90 GLU H 1.0 . 3.78 2011 1752 A 83 GLU HA A 85 LYS H 1.0 . 3.99 2012 1753 A 36 TRP HE1 B -1 ALA HA 1.0 . 5.08 2013 1754 A 36 TRP HBx A 36 TRP HE1 1.0 . 4.87 2014 1755 A 36 TRP HE1 A 35 GLU HBx 1.0 . 4.11 2015 1755 A 35 GLU HBy A 36 TRP HE1 1.0 . 4.11 2016 1756 B -5 PRO HGx A 36 TRP HE1 1.0 . 4.95 2017 1757 A 3 PHE HA A 3 PHE HD% 1.0 . 4.10 2018 1758 A 8 TYR HD% A 7 LEU HDx% 1.0 . 4.37 2019 1758 A 8 TYR HD% A 7 LEU HDy% 1.0 . 4.37 2020 1759 A 32 TYR HD% A 89 VAL HGx% 1.0 . 4.06 2021 1760 A 32 TYR HD% B -5 PRO HBy 1.0 . 4.43 2022 1761 A 32 TYR HE% A 89 VAL HB 1.0 . 4.23 2023 1762 A 32 TYR HE% A 89 VAL HGy% 1.0 . 4.88 2024 1763 A 32 TYR HE% B -6 ILE HG2% 1.0 . 3.50 2025 1764 B -5 PRO HBy A 32 TYR HE% 1.0 . 5.11 2026 1765 A 32 TYR HA A 32 TYR HE% 1.0 . 4.78 2027 1766 A 34 TYR HD% A 78 MET HA 1.0 . 3.68 2028 1767 A 34 TYR HD% A 34 TYR HA 1.0 . 3.69 2029 1768 A 34 TYR HD% A 78 MET HBx 1.0 . 4.24 2030 1768 A 34 TYR HD% A 78 MET HBy 1.0 . 4.24 2031 1769 A 34 TYR HD% A 81 ILE HG2% 1.0 . 4.00 2032 1770 A 31 HIS HE1 A 34 TYR HE% 1.0 . 4.08 2033 1771 A 33 ASP HA A 34 TYR HE% 1.0 . 4.32 2034 1772 A 34 TYR HE% A 78 MET HA 1.0 . 3.43 2035 1773 A 34 TYR HE% A 34 TYR HA 1.0 . 4.99 2036 1774 A 34 TYR HE% A 78 MET HGy 1.0 . 3.39 2037 1775 A 34 TYR HE% A 77 VAL HGx% 1.0 . 4.42 2038 1776 A 34 TYR HE% A 81 ILE HD1% 1.0 . 3.12 2039 1777 A 37 PHE HD% A 37 PHE HA 1.0 . 4.40 2040 1778 A 66 TYR HD% A 65 LYS HBy 1.0 . 3.93 2041 1779 A 66 TYR HD% A 80 ILE HD1% 1.0 . 3.57 2042 1780 A 66 TYR HD% A 66 TYR HA 1.0 . 4.12 2043 1781 A 66 TYR HD% A 69 VAL HGy% 1.0 . 4.30 2044 1782 A 80 ILE HG2% A 66 TYR HD% 1.0 . 4.53 2045 1783 A 72 TYR HD% B 1 LYS HA 1.0 . 4.66 2046 1784 A 66 TYR HE% A 65 LYS HEx 1.0 . 3.51 2047 1784 A 65 LYS HEy A 66 TYR HE% 1.0 . 3.51 2048 1785 A 66 TYR HE% A 59 ASP HBx 1.0 . 4.48 2049 1786 B 1 LYS HA A 72 TYR HE% 1.0 . 4.02 2050 1787 A 72 TYR HA A 72 TYR HE% 1.0 . 4.83 2051 1788 A 99 TYR HD% A 99 TYR HA 1.0 . 3.19 2052 1789 A 99 TYR HD% A 100 LYS HDx 1.0 . 4.75 2053 1789 A 100 LYS HDy A 99 TYR HD% 1.0 . 4.75 2054 1790 A 99 TYR HD% A 100 LYS HGy 1.0 . 5.12 2055 1791 A 99 TYR HD% A 100 LYS HGx 1.0 . 5.12 2056 1792 A 96 THR HG2% A 99 TYR HD% 1.0 . 4.30 2057 1793 A 96 THR HA A 99 TYR HD% 1.0 . 4.45 2058 1794 A 72 TYR HE% B 2 PRO HDy 1.0 . 3.99 2059 1795 A 84 PHE HD% A 83 GLU HBx 1.0 . 4.18 2060 1796 A 92 TRP HA A 92 TRP HD1 1.0 . 3.69 2061 1797 A 87 PRO HGy A 92 TRP HD1 1.0 . 4.73 2062 1798 A 92 TRP HZ2 A 47 PRO HGx 1.0 . 4.05 2063 1798 A 92 TRP HZ2 A 47 PRO HGy 1.0 . 4.05 2064 1799 A 92 TRP HH2 B -7 PHE HZ 1.0 . 5.14 2065 1800 A 92 TRP HE3 A 38 ILE HG1x 1.0 . 5.38 2066 1801 A 32 TYR HD% A 36 TRP HD1 1.0 . 3.55 2067 1802 A 36 TRP HD1 A 32 TYR HE% 1.0 . 4.39 2068 1803 A 35 GLU HA A 36 TRP HD1 1.0 . 5.29 2069 1804 A 36 TRP HD1 A 36 TRP HBx 1.0 . 3.83 2070 1805 A 36 TRP HD1 A 35 GLU HGx 1.0 . 4.33 2071 1806 A 36 TRP HD1 B -5 PRO HBx 1.0 . 4.97 2072 1807 A 36 TRP HD1 B -1 ALA HB% 1.0 . 5.10 2073 1808 B -5 PRO HBy A 36 TRP HD1 1.0 . 4.09 2074 1809 A 36 TRP HZ2 B -2 PRO HDx 1.0 . 4.28 2075 1810 B -1 ALA HA A 36 TRP HZ2 1.0 . 3.83 2076 1811 A 36 TRP HZ2 B -3 ARG HGx 1.0 . 3.65 2077 1811 A 36 TRP HZ2 B -3 ARG HGy 1.0 . 3.65 2078 1812 A 36 TRP HZ2 B -3 ARG HBx 1.0 . 4.25 2079 1813 A 36 TRP HZ2 B -3 ARG HBy 1.0 . 4.25 2080 1814 A 36 TRP HH2 B -3 ARG HGx 1.0 . 4.11 2081 1814 B -3 ARG HGy A 36 TRP HH2 1.0 . 4.11 2082 1815 A 34 TYR HD% A 78 MET HGy 1.0 . 3.73 2083 1816 A 36 TRP HD1 A 35 GLU HBx 1.0 . 3.42 2084 1816 A 35 GLU HBy A 36 TRP HD1 1.0 . 3.42 2085 1817 A 34 TYR HD% A 31 HIS HE1 1.0 . 4.39 2086 1818 A 33 ASP HA A 31 HIS HE1 1.0 . 4.19 2087 1819 A 31 HIS HE1 A 81 ILE HG2% 1.0 . 5.03 2088 1820 A 31 HIS HE1 A 81 ILE HD1% 1.0 . 5.37 2089 1821 A 110 HIS HA A 110 HIS HD2 1.0 . 3.63 2090 1822 A 36 TRP HE3 A 49 LEU HBx 1.0 . 4.86 2091 1823 A 37 PHE HZ A 81 ILE HG1x 1.0 . 3.96 2092 1824 A 37 PHE HZ A 81 ILE HD1% 1.0 . 4.24 2093 1825 A 37 PHE HZ A 81 ILE HG1y 1.0 . 4.52 2094 1826 A 50 VAL HB A 10 PHE HE% 1.0 . 5.01 2095 1827 A 57 ILE HD1% A 37 PHE HE% 1.0 . 3.86 2096 1828 A 84 PHE HE% A 66 TYR HE% 1.0 . 4.07 2097 1829 A 2 LEU HA A 84 PHE HE% 1.0 . 4.96 2098 1830 A 84 PHE HA A 84 PHE HE% 1.0 . 5.45 2099 1831 A 80 ILE HA A 84 PHE HE% 1.0 . 4.47 2100 1832 A 83 GLU HBy A 84 PHE HE% 1.0 . 4.21 2101 1833 A 84 PHE HE% A 83 GLU HBx 1.0 . 4.51 2102 1834 A -1 ALA HB% A 84 PHE HE% 1.0 . 4.95 2103 1835 A 84 PHE HE% A 2 LEU HBx 1.0 . 4.37 2104 1835 A 84 PHE HE% A 2 LEU HBy 1.0 . 4.37 2105 1836 A 57 ILE HG2% A 84 PHE HE% 1.0 . 4.53 2106 1837 A 8 TYR HA A 8 TYR HE% 1.0 . 4.97 2107 1838 A 8 TYR HE% B 3 PRO HBy 1.0 . 4.16 2108 1839 A 8 TYR HE% B 3 PRO HBx 1.0 . 4.16 2109 1840 A 8 TYR HE% B 3 PRO HGy 1.0 . 3.85 2110 1841 A 10 PHE HA A 54 TYR HE% 1.0 . 3.95 2111 1842 A 10 PHE HD% A 54 TYR HE% 1.0 . 3.55 2112 1843 A 34 TYR HE% A 78 MET HBx 1.0 . 4.19 2113 1843 A 34 TYR HE% A 78 MET HBy 1.0 . 4.19 2114 1844 A 34 TYR HE% A 81 ILE HA 1.0 . 5.38 2115 1845 A 34 TYR HE% A 81 ILE HB 1.0 . 3.32 2116 1846 A 34 TYR HE% A 81 ILE HG1y 1.0 . 4.93 2117 1847 A 34 TYR HE% A 81 ILE HG1x 1.0 . 4.44 2118 1848 A 34 TYR HE% A 81 ILE HG2% 1.0 . 3.05 2119 1849 A 34 TYR HD% A 81 ILE HB 1.0 . 3.67 2120 1850 A 30 ALA HA A 31 HIS HD2 1.0 . 4.58 2121 1851 A 86 ILE HB A 31 HIS HD2 1.0 . 3.79 2122 1852 A 86 ILE HG2% A 31 HIS HD2 1.0 . 3.47 2123 1853 A 81 ILE HG2% A 31 HIS HD2 1.0 . 3.43 2124 1854 A 37 PHE HD% A 77 VAL HGy% 1.0 . 4.76 2125 1855 A 37 PHE HE% A 77 VAL HGy% 1.0 . 4.34 2126 1856 A 37 PHE HE% A 86 ILE HD1% 1.0 . 4.00 2127 1857 A 37 PHE HD% A 38 ILE H 1.0 . 4.35 2128 1858 A 66 TYR HE% A 59 ASP HBy 1.0 . 4.48 2129 1859 A 8 TYR HBy A 54 TYR HE% 1.0 . 4.26 2130 1860 A 8 TYR HBx A 54 TYR HE% 1.0 . 3.97 2131 1861 A 99 TYR HA A 99 TYR HE% 1.0 . 4.80 2132 1862 A 96 THR HG2% A 99 TYR HE% 1.0 . 5.13 2133 1863 A 54 TYR HE% A 53 SER HBx 1.0 . 4.28 2134 1863 A 53 SER HBy A 54 TYR HE% 1.0 . 4.28 2135 1864 A 29 CYS HBx A 92 TRP HD1 1.0 . 5.27 2136 1865 A 29 CYS HBy A 92 TRP HD1 1.0 . 4.16 2137 1866 A 92 TRP HE3 A 38 ILE HG2% 1.0 . 4.60 2138 1867 A 30 ALA HB% A 92 TRP HD1 1.0 . 4.35 2139 1868 A 37 PHE HD% A 31 HIS HA 1.0 . 4.52 2140 1869 A 88 THR HA A 31 HIS HD2 1.0 . 4.59 2141 1870 A 84 PHE HA A 84 PHE HD% 1.0 . 4.14 2142 1871 A 37 PHE HZ A 52 VAL HGx% 1.0 . 4.99 2143 1872 A 37 PHE HZ A 81 ILE HG2% 1.0 . 5.28 2144 1873 A 37 PHE HE% A 52 VAL HGy% 1.0 . 4.32 2145 1874 A 53 SER HA A 72 TYR HD% 1.0 . 4.60 2146 1875 A 32 TYR HD% B -6 ILE HD1% 1.0 . 4.73 2147 1876 B -2 PRO HDx A 36 TRP HH2 1.0 . 4.28 2148 1877 A 65 LYS HBx A 66 TYR HE% 1.0 . 4.00 2149 1878 A 66 TYR HE% A 80 ILE HG1x 1.0 . 4.24 2150 1879 A 80 ILE HG2% A 66 TYR HE% 1.0 . 3.80 2151 1880 A 80 ILE HD1% A 66 TYR HE% 1.0 . 4.25 2152 1881 A 72 TYR HE% B 2 PRO HDx 1.0 . 3.99 2153 1882 A 8 TYR HE% B 3 PRO HDx 1.0 . 4.30 2154 1882 A 8 TYR HE% B 3 PRO HDy 1.0 . 4.30 2155 1883 A 8 TYR HE% B 3 PRO HGx 1.0 . 3.85 2156 1884 A 54 TYR HE% B 0 PRO HDx 1.0 . 4.36 2157 1884 A 54 TYR HE% B 0 PRO HDy 1.0 . 4.36 2158 1885 A 27 SER HBy A 3 PHE HD% 1.0 . 4.67 2159 1886 A 3 PHE HD% A 42 ILE HG2% 1.0 . 4.45 2160 1887 A 8 TYR HE% A 7 LEU HDx% 1.0 . 3.24 2161 1887 A 7 LEU HDy% A 8 TYR HE% 1.0 . 3.24 2162 1888 A 36 TRP HZ3 A 10 PHE HE% 1.0 . 4.14 2163 1889 A 12 ALA HB% A 10 PHE HE% 1.0 . 4.81 2164 1890 A 36 TRP HH2 B -2 PRO HGy 1.0 . 5.46 2165 1891 A 36 TRP HZ2 B 0 PRO HDx 1.0 . 4.29 2166 1891 A 36 TRP HZ2 B 0 PRO HDy 1.0 . 4.29 2167 1892 A 32 TYR HD% B -5 PRO HGy 1.0 . 3.95 2168 1893 A 32 TYR HE% B -5 PRO HDx 1.0 . 3.77 2169 1893 B -5 PRO HDy A 32 TYR HE% 1.0 . 3.77 2170 1894 A 32 TYR HD% B -5 PRO HGx 1.0 . 4.06 2171 1895 B -5 PRO HGx A 32 TYR HE% 1.0 . 3.79 2172 1896 A 36 TRP HD1 B -5 PRO HGx 1.0 . 4.22 2173 1897 A 32 TYR HE% B -6 ILE HD1% 1.0 . 3.59 2174 1898 A 54 TYR HE% B 0 PRO HGx 1.0 . 4.03 2175 1899 A 32 TYR HE% B -4 SER HBx 1.0 . 5.36 2176 1899 A 32 TYR HE% B -4 SER HBy 1.0 . 5.36 2177 1900 A 32 TYR HD% A 36 TRP HBx 1.0 . 4.11 2178 1901 A 32 TYR HD% B -5 PRO HDx 1.0 . 4.29 2179 1901 A 32 TYR HD% B -5 PRO HDy 1.0 . 4.29 2180 1902 A 66 TYR HE% A 80 ILE HG1y 1.0 . 4.24 2181 1903 A 72 TYR HD% B 2 PRO HBx 1.0 . 4.48 2182 1903 A 72 TYR HD% B 2 PRO HBy 1.0 . 4.48 2183 1904 A 54 TYR HE% B 0 PRO HGy 1.0 . 4.03 2184 1905 A 10 PHE HE% A 36 TRP HH2 1.0 . 5.05 2185 1906 A 48 GLY HAy B -7 PHE HE% 1.0 . 3.95 2186 1907 A 48 GLY HAx B -7 PHE HE% 1.0 . 4.26 2187 1908 B -7 PHE HD% A 93 LYS HEx 1.0 . 4.07 2188 1908 A 93 LYS HEy B -7 PHE HD% 1.0 . 4.07 2189 1909 B -6 ILE HD1% A 90 GLU HGx 1.0 . 3.84 2190 1910 B -6 ILE HD1% A 90 GLU HGy 1.0 . 3.84 2191 1911 B -1 ALA HB% A 35 GLU HBx 1.0 . 3.62 2192 1911 A 35 GLU HBy B -1 ALA HB% 1.0 . 3.62 2193 1912 B -7 PHE HD% A 93 LYS HDy 1.0 . 4.27 2194 1913 B -7 PHE HD% A 93 LYS HDx 1.0 . 4.27 2195 1914 B -7 PHE HBy A 49 LEU HDy% 1.0 . 4.73 2196 1914 A 49 LEU HDy% B -7 PHE HBx 1.0 . 4.73 2197 1915 B -5 PRO HBx A 49 LEU HDy% 1.0 . 3.81 2198 1916 B -5 PRO HGy A 49 LEU HDx% 1.0 . 4.62 2199 1917 B -5 PRO HA A 49 LEU HDx% 1.0 . 4.32 2200 1918 B -7 PHE HBy A 89 VAL HGx% 1.0 . 4.15 2201 1918 A 89 VAL HGx% B -7 PHE HBx 1.0 . 4.15 2202 1919 A 88 THR HG2% A 33 ASP HA 1.0 . 4.76 2203 1920 A 36 TRP HE3 A 49 LEU HG 1.0 . 4.70 2204 1921 A 49 LEU HG B -7 PHE HBx 1.0 . 4.52 2205 1921 A 49 LEU HG B -7 PHE HBy 1.0 . 4.52 2206 1922 B -7 PHE HZ A 47 PRO HGx 1.0 . 4.31 2207 1922 A 47 PRO HGy B -7 PHE HZ 1.0 . 4.31 2208 1923 B -5 PRO HGx A 49 LEU HDx% 1.0 . 5.22 2209 1924 A 80 ILE HD1% A 69 VAL HGx% 1.0 . 3.24 2210 1925 B -6 ILE HA A 89 VAL HGx% 1.0 . 4.69 2211 1926 A 32 TYR HBy A 36 TRP HD1 1.0 . 4.38 2212 1927 B -7 PHE HE% A 93 LYS HEx 1.0 . 4.77 2213 1927 A 93 LYS HEy B -7 PHE HE% 1.0 . 4.77 2214 1928 A 42 ILE HD1% A 3 PHE HBy 1.0 . 5.21 2215 1929 A 35 GLU HA B -1 ALA HB% 1.0 . 4.79 2216 1930 B -3 ARG H B -4 SER HBx 1.0 . 3.82 2217 1930 B -4 SER HBy B -3 ARG H 1.0 . 3.82 2218 1931 B -2 PRO HDx B -3 ARG HA 1.0 . 3.29 2219 1932 A 65 LYS HA A 65 LYS HEx 1.0 . 4.17 2220 1932 A 65 LYS HA A 65 LYS HEy 1.0 . 4.17 2221 1933 A 30 ALA HB% A 87 PRO HDx 1.0 . 4.31 2222 1934 B -6 ILE HG2% B -4 SER HBx 1.0 . 5.32 2223 1934 B -6 ILE HG2% B -4 SER HBy 1.0 . 5.32 2224 1935 B -7 PHE H B -6 ILE H 1.0 . 4.44 2225 1936 B -7 PHE HD% B -7 PHE H 1.0 . 5.04 2226 1937 A 34 TYR HBx A 81 ILE HD1% 1.0 . 4.10 2227 1938 B -6 ILE HG2% B -5 PRO HDx 1.0 . 4.39 2228 1938 B -5 PRO HDy B -6 ILE HG2% 1.0 . 4.39 2229 1939 B -1 ALA HB% B 0 PRO HDx 1.0 . 4.68 2230 1939 B -1 ALA HB% B 0 PRO HDy 1.0 . 4.68 2231 1940 A 43 ARG H A 43 ASN HBx 1.0 . 4.37 2232 1941 B -7 PHE HE% B -8 LYS HEy 1.0 . 5.18 2233 1942 B -7 PHE HE% B -8 LYS HEx 1.0 . 5.18 2234 1943 B -7 PHE HE% B -8 LYS HDx 1.0 . 4.93 2235 1943 B -7 PHE HE% B -8 LYS HDy 1.0 . 4.93 2236 1944 B -6 ILE HA B -5 PRO HDx 1.0 . 3.57 2237 1944 B -5 PRO HDy B -6 ILE HA 1.0 . 3.57 2238 1945 B -6 ILE H B -7 PHE HBx 1.0 . 3.94 2239 1945 B -7 PHE HBy B -6 ILE H 1.0 . 3.94 2240 1946 B 1 LYS HA B 2 PRO HDx 1.0 . 3.70 2241 1947 B 1 LYS HA B 2 PRO HDy 1.0 . 3.70 2242 1948 B -3 ARG HA B -2 PRO HDy 1.0 . 3.08 2243 1949 B -1 ALA HA B 0 PRO HDx 1.0 . 3.54 2244 1949 B -1 ALA HA B 0 PRO HDy 1.0 . 3.54 2245 1950 A -2 MET HA A 85 LYS HBy 1.0 . 4.96 2246 1950 A -2 MET HA A 85 LYS HBx 1.0 . 4.96 2247 1951 A -2 MET HGx A 85 LYS HBy 1.0 . 5.18 2248 1951 A -2 MET HGy A 85 LYS HBy 1.0 . 5.18 2249 1951 A 85 LYS HBx A -2 MET HGx 1.0 . 5.18 2250 1951 A -2 MET HGy A 85 LYS HBx 1.0 . 5.18 2251 1952 A -2 MET HE% A 2 LEU HDy% 1.0 . 4.42 2252 1952 A -2 MET HE% A 2 LEU HDx% 1.0 . 4.42 2253 1953 A -2 MET HE% A 86 ILE HG1x 1.0 . 4.58 2254 1953 A -2 MET HE% A 86 ILE HG1y 1.0 . 4.58 2255 1954 A -1 ALA HA A 1 PRO HGx 1.0 . 4.55 2256 1954 A -1 ALA HA A 1 PRO HGy 1.0 . 4.55 2257 1955 A -1 ALA HB% A 1 PRO HBx 1.0 . 4.90 2258 1955 A -1 ALA HB% A 1 PRO HBy 1.0 . 4.90 2259 1956 A -1 ALA HB% A 1 PRO HGx 1.0 . 3.94 2260 1956 A -1 ALA HB% A 1 PRO HGy 1.0 . 3.94 2261 1957 A -1 ALA HB% A 1 PRO HDx 1.0 . 3.27 2262 1957 A -1 ALA HB% A 1 PRO HDy 1.0 . 3.27 2263 1958 A -1 ALA HB% A 84 PHE HBx 1.0 . 5.34 2264 1958 A -1 ALA HB% A 84 PHE HBy 1.0 . 5.34 2265 1959 A 1 PRO HA A 2 LEU HDy% 1.0 . 4.97 2266 1959 A 1 PRO HA A 2 LEU HDx% 1.0 . 4.97 2267 1960 A 3 PHE HE% A 1 PRO HBx 1.0 . 3.89 2268 1960 A 3 PHE HE% A 1 PRO HBy 1.0 . 3.89 2269 1961 A 3 PHE HE% A 1 PRO HGx 1.0 . 4.16 2270 1961 A 3 PHE HE% A 1 PRO HGy 1.0 . 4.16 2271 1962 A 2 LEU H A 2 LEU HDy% 1.0 . 4.27 2272 1962 A 2 LEU H A 2 LEU HDx% 1.0 . 4.27 2273 1963 A 2 LEU HA A 2 LEU HDy% 1.0 . 3.74 2274 1963 A 2 LEU HA A 2 LEU HDx% 1.0 . 3.74 2275 1964 A 2 LEU HG A 28 ILE HG1x 1.0 . 5.34 2276 1964 A 2 LEU HG A 28 ILE HG1y 1.0 . 5.34 2277 1965 A 3 PHE HD% A 2 LEU HDy% 1.0 . 5.44 2278 1965 A 3 PHE HD% A 2 LEU HDx% 1.0 . 5.44 2279 1966 A 28 ILE HB A 2 LEU HDy% 1.0 . 3.72 2280 1966 A 28 ILE HB A 2 LEU HDx% 1.0 . 3.72 2281 1967 A 28 ILE HG2% A 2 LEU HDy% 1.0 . 2.52 2282 1967 A 28 ILE HG2% A 2 LEU HDx% 1.0 . 2.52 2283 1968 A 2 LEU HDx% A 28 ILE HG1x 1.0 . 4.43 2284 1968 A 2 LEU HDy% A 28 ILE HG1x 1.0 . 4.43 2285 1968 A 28 ILE HG1y A 2 LEU HDy% 1.0 . 4.43 2286 1968 A 2 LEU HDx% A 28 ILE HG1y 1.0 . 4.43 2287 1969 A 28 ILE HD1% A 2 LEU HDy% 1.0 . 3.18 2288 1969 A 28 ILE HD1% A 2 LEU HDx% 1.0 . 3.18 2289 1970 A 37 PHE HE% A 2 LEU HDy% 1.0 . 4.92 2290 1970 A 37 PHE HE% A 2 LEU HDx% 1.0 . 4.92 2291 1971 A 57 ILE HG2% A 2 LEU HDy% 1.0 . 3.20 2292 1971 A 57 ILE HG2% A 2 LEU HDx% 1.0 . 3.20 2293 1972 A 57 ILE HD1% A 2 LEU HDy% 1.0 . 3.68 2294 1972 A 57 ILE HD1% A 2 LEU HDx% 1.0 . 3.68 2295 1973 A 81 ILE HG1y A 2 LEU HDy% 1.0 . 4.77 2296 1973 A 81 ILE HG1y A 2 LEU HDx% 1.0 . 4.77 2297 1974 A 2 LEU HDx% A 84 PHE HBx 1.0 . 4.41 2298 1974 A 2 LEU HDy% A 84 PHE HBx 1.0 . 4.41 2299 1974 A 84 PHE HBy A 2 LEU HDy% 1.0 . 4.41 2300 1974 A 2 LEU HDx% A 84 PHE HBy 1.0 . 4.41 2301 1975 A 84 PHE HE% A 2 LEU HDy% 1.0 . 4.57 2302 1975 A 84 PHE HE% A 2 LEU HDx% 1.0 . 4.57 2303 1976 A 86 ILE HG2% A 2 LEU HDy% 1.0 . 3.47 2304 1976 A 86 ILE HG2% A 2 LEU HDx% 1.0 . 3.47 2305 1977 A 2 LEU HDx% A 86 ILE HG1x 1.0 . 4.33 2306 1977 A 2 LEU HDy% A 86 ILE HG1x 1.0 . 4.33 2307 1977 A 86 ILE HG1y A 2 LEU HDy% 1.0 . 4.33 2308 1977 A 2 LEU HDx% A 86 ILE HG1y 1.0 . 4.33 2309 1978 A 86 ILE HD1% A 2 LEU HDy% 1.0 . 3.42 2310 1978 A 86 ILE HD1% A 2 LEU HDx% 1.0 . 3.42 2311 1979 A 4 ALA H A 3 PHE HBx 1.0 . 3.58 2312 1979 A 4 ALA H A 3 PHE HBy 1.0 . 3.58 2313 1980 A 27 SER HA A 3 PHE HBx 1.0 . 4.56 2314 1980 A 27 SER HA A 3 PHE HBy 1.0 . 4.56 2315 1981 A 42 ILE HD1% A 3 PHE HBx 1.0 . 4.37 2316 1981 A 42 ILE HD1% A 3 PHE HBy 1.0 . 4.37 2317 1982 A 3 PHE HBx A 58 ILE HG1x 1.0 . 4.63 2318 1982 A 3 PHE HBy A 58 ILE HG1x 1.0 . 4.63 2319 1982 A 58 ILE HG1y A 3 PHE HBx 1.0 . 4.63 2320 1982 A 58 ILE HG1y A 3 PHE HBy 1.0 . 4.63 2321 1983 A 3 PHE HBy A 60 LEU HDy% 1.0 . 4.19 2322 1983 A 3 PHE HBx A 60 LEU HDy% 1.0 . 4.19 2323 1983 A 60 LEU HDx% A 3 PHE HBx 1.0 . 4.19 2324 1983 A 3 PHE HBy A 60 LEU HDx% 1.0 . 4.19 2325 1984 A 3 PHE HD% A 60 LEU HBx 1.0 . 4.19 2326 1984 A 3 PHE HD% A 60 LEU HBy 1.0 . 4.19 2327 1985 A 3 PHE HD% A 60 LEU HDy% 1.0 . 3.84 2328 1985 A 3 PHE HD% A 60 LEU HDx% 1.0 . 3.84 2329 1986 A 3 PHE HE% A 60 LEU HDy% 1.0 . 4.33 2330 1986 A 3 PHE HE% A 60 LEU HDx% 1.0 . 4.33 2331 1987 A 4 ALA HB% A 26 LEU HBy 1.0 . 3.86 2332 1987 A 4 ALA HB% A 26 LEU HBx 1.0 . 3.86 2333 1988 A 4 ALA HB% A 28 ILE HG1x 1.0 . 3.40 2334 1988 A 4 ALA HB% A 28 ILE HG1y 1.0 . 3.40 2335 1989 A 4 ALA HB% A 55 VAL HGx% 1.0 . 3.33 2336 1989 A 4 ALA HB% A 55 VAL HGy% 1.0 . 3.33 2337 1990 A 4 ALA HB% A 56 ARG HGy 1.0 . 5.34 2338 1990 A 4 ALA HB% A 56 ARG HGx 1.0 . 5.34 2339 1991 A 4 ALA HB% A 57 ILE HG1x 1.0 . 5.02 2340 1991 A 4 ALA HB% A 57 ILE HG1y 1.0 . 5.02 2341 1992 A 5 VAL H A 26 LEU HDy% 1.0 . 5.44 2342 1992 A 5 VAL H A 26 LEU HDx% 1.0 . 5.44 2343 1993 A 5 VAL HA A 26 LEU HDy% 1.0 . 4.18 2344 1993 A 5 VAL HA A 26 LEU HDx% 1.0 . 4.18 2345 1994 A 5 VAL HGx% A 7 LEU HBy 1.0 . 5.34 2346 1994 A 5 VAL HGx% A 7 LEU HBx 1.0 . 5.34 2347 1995 A 5 VAL HGx% A 56 ARG HGy 1.0 . 3.20 2348 1995 A 5 VAL HGx% A 56 ARG HGx 1.0 . 3.20 2349 1996 A 5 VAL HGy% A 7 LEU HBy 1.0 . 5.34 2350 1996 A 5 VAL HGy% A 7 LEU HBx 1.0 . 5.34 2351 1997 A 6 THR H A 26 LEU HDy% 1.0 . 4.40 2352 1997 A 6 THR H A 26 LEU HDx% 1.0 . 4.40 2353 1998 A 6 THR H A 55 VAL HGx% 1.0 . 4.41 2354 1998 A 6 THR H A 55 VAL HGy% 1.0 . 4.41 2355 1999 A 6 THR HA A 20 VAL HGx% 1.0 . 5.44 2356 1999 A 6 THR HA A 20 VAL HGy% 1.0 . 5.44 2357 2000 A 6 THR HA A 26 LEU HDy% 1.0 . 4.48 2358 2000 A 6 THR HA A 26 LEU HDx% 1.0 . 4.48 2359 2001 A 6 THR HA A 50 VAL HGx% 1.0 . 5.42 2360 2001 A 6 THR HA A 50 VAL HGy% 1.0 . 5.42 2361 2002 A 6 THR HA A 55 VAL HGx% 1.0 . 3.33 2362 2002 A 6 THR HA A 55 VAL HGy% 1.0 . 3.33 2363 2003 A 6 THR HB A 20 VAL HGx% 1.0 . 3.91 2364 2003 A 6 THR HB A 20 VAL HGy% 1.0 . 3.91 2365 2004 A 6 THR HB A 26 LEU HDy% 1.0 . 4.24 2366 2004 A 6 THR HB A 26 LEU HDx% 1.0 . 4.24 2367 2005 A 6 THR HB A 55 VAL HGx% 1.0 . 4.51 2368 2005 A 6 THR HB A 55 VAL HGy% 1.0 . 4.51 2369 2006 A 6 THR HG2% A 20 VAL HGx% 1.0 . 2.99 2370 2006 A 6 THR HG2% A 20 VAL HGy% 1.0 . 2.99 2371 2007 A 6 THR HG2% A 26 LEU HDy% 1.0 . 2.95 2372 2007 A 6 THR HG2% A 26 LEU HDx% 1.0 . 2.95 2373 2008 A 6 THR HG2% A 50 VAL HGx% 1.0 . 3.25 2374 2008 A 6 THR HG2% A 50 VAL HGy% 1.0 . 3.25 2375 2009 A 6 THR HG2% A 55 VAL HGx% 1.0 . 3.24 2376 2009 A 6 THR HG2% A 55 VAL HGy% 1.0 . 3.24 2377 2010 A 7 LEU H A 7 LEU HBy 1.0 . 3.40 2378 2010 A 7 LEU H A 7 LEU HBx 1.0 . 3.40 2379 2011 A 7 LEU H A 26 LEU HDy% 1.0 . 5.44 2380 2011 A 7 LEU H A 26 LEU HDx% 1.0 . 5.44 2381 2012 A 7 LEU HBx A 7 LEU HDx% 1.0 . 2.55 2382 2012 A 7 LEU HDy% A 7 LEU HBy 1.0 . 2.55 2383 2012 A 7 LEU HDy% A 7 LEU HBx 1.0 . 2.55 2384 2012 A 7 LEU HBy A 7 LEU HDx% 1.0 . 2.55 2385 2013 A 8 TYR H A 7 LEU HBy 1.0 . 3.66 2386 2013 A 8 TYR H A 7 LEU HBx 1.0 . 3.66 2387 2014 A 8 TYR HE% A 7 LEU HBy 1.0 . 4.01 2388 2014 A 8 TYR HE% A 7 LEU HBx 1.0 . 4.01 2389 2015 A 54 TYR HA A 7 LEU HBy 1.0 . 5.34 2390 2015 A 54 TYR HA A 7 LEU HBx 1.0 . 5.34 2391 2016 A 7 LEU HDx% A 56 ARG HGy 1.0 . 3.73 2392 2016 A 7 LEU HDy% A 56 ARG HGy 1.0 . 3.73 2393 2016 A 56 ARG HGx A 7 LEU HDx% 1.0 . 3.73 2394 2016 A 7 LEU HDy% A 56 ARG HGx 1.0 . 3.73 2395 2017 A 7 LEU HDx% A 56 ARG HDx 1.0 . 3.49 2396 2017 A 7 LEU HDy% A 56 ARG HDx 1.0 . 3.49 2397 2017 A 56 ARG HDy A 7 LEU HDx% 1.0 . 3.49 2398 2017 A 7 LEU HDy% A 56 ARG HDy 1.0 . 3.49 2399 2018 A 8 TYR HD% B 3 PRO HGx 1.0 . 4.06 2400 2018 A 8 TYR HD% B 3 PRO HGy 1.0 . 4.06 2401 2019 A 8 TYR HE% B 3 PRO HBx 1.0 . 3.65 2402 2019 A 8 TYR HE% B 3 PRO HBy 1.0 . 3.65 2403 2020 A 8 TYR HE% B 3 PRO HGx 1.0 . 3.31 2404 2020 A 8 TYR HE% B 3 PRO HGy 1.0 . 3.31 2405 2021 A 9 GLU H A 9 GLU HGx 1.0 . 4.42 2406 2021 A 9 GLU H A 9 GLU HGy 1.0 . 4.42 2407 2022 A 9 GLU HA A 9 GLU HGx 1.0 . 3.45 2408 2022 A 9 GLU HA A 9 GLU HGy 1.0 . 3.45 2409 2023 A 9 GLU HA A 10 PHE HBx 1.0 . 5.34 2410 2023 A 9 GLU HA A 10 PHE HBy 1.0 . 5.34 2411 2024 A 9 GLU HA A 20 VAL HGx% 1.0 . 4.61 2412 2024 A 9 GLU HA A 20 VAL HGy% 1.0 . 4.61 2413 2025 A 9 GLU HA A 21 SER HBx 1.0 . 4.69 2414 2025 A 9 GLU HA A 21 SER HBy 1.0 . 4.69 2415 2026 A 10 PHE H A 9 GLU HGx 1.0 . 4.45 2416 2026 A 10 PHE H A 9 GLU HGy 1.0 . 4.45 2417 2027 A 10 PHE HA A 9 GLU HGx 1.0 . 5.34 2418 2027 A 10 PHE HA A 9 GLU HGy 1.0 . 5.34 2419 2028 A 9 GLU HGy A 11 LYS HGx 1.0 . 3.31 2420 2028 A 9 GLU HGx A 11 LYS HGx 1.0 . 3.31 2421 2028 A 11 LYS HGy A 9 GLU HGx 1.0 . 3.31 2422 2028 A 9 GLU HGy A 11 LYS HGy 1.0 . 3.31 2423 2029 A 9 GLU HGx A 11 LYS HDx 1.0 . 3.94 2424 2029 A 9 GLU HGy A 11 LYS HDx 1.0 . 3.94 2425 2029 A 11 LYS HDy A 9 GLU HGx 1.0 . 3.94 2426 2029 A 11 LYS HDy A 9 GLU HGy 1.0 . 3.94 2427 2030 A 9 GLU HGy A 11 LYS HEx 1.0 . 4.34 2428 2030 A 9 GLU HGx A 11 LYS HEx 1.0 . 4.34 2429 2030 A 11 LYS HEy A 9 GLU HGx 1.0 . 4.34 2430 2030 A 11 LYS HEy A 9 GLU HGy 1.0 . 4.34 2431 2031 A 21 SER HA A 9 GLU HGx 1.0 . 4.29 2432 2031 A 21 SER HA A 9 GLU HGy 1.0 . 4.29 2433 2032 A 9 GLU HGx A 21 SER HBx 1.0 . 5.18 2434 2032 A 9 GLU HGy A 21 SER HBx 1.0 . 5.18 2435 2032 A 21 SER HBy A 9 GLU HGx 1.0 . 5.18 2436 2032 A 9 GLU HGy A 21 SER HBy 1.0 . 5.18 2437 2033 A 10 PHE H A 20 VAL HGx% 1.0 . 3.70 2438 2033 A 10 PHE H A 20 VAL HGy% 1.0 . 3.70 2439 2034 A 10 PHE HA A 11 LYS HGx 1.0 . 4.49 2440 2034 A 10 PHE HA A 11 LYS HGy 1.0 . 4.49 2441 2035 A 10 PHE HA A 20 VAL HGx% 1.0 . 4.92 2442 2035 A 10 PHE HA A 20 VAL HGy% 1.0 . 4.92 2443 2036 A 20 VAL H A 10 PHE HBx 1.0 . 4.26 2444 2036 A 20 VAL H A 10 PHE HBy 1.0 . 4.26 2445 2037 A 10 PHE HBx A 20 VAL HGx% 1.0 . 3.13 2446 2037 A 10 PHE HBy A 20 VAL HGx% 1.0 . 3.13 2447 2037 A 20 VAL HGy% A 10 PHE HBx 1.0 . 3.13 2448 2037 A 20 VAL HGy% A 10 PHE HBy 1.0 . 3.13 2449 2038 A 10 PHE HBx A 50 VAL HGx% 1.0 . 4.13 2450 2038 A 10 PHE HBy A 50 VAL HGx% 1.0 . 4.13 2451 2038 A 50 VAL HGy% A 10 PHE HBx 1.0 . 4.13 2452 2038 A 50 VAL HGy% A 10 PHE HBy 1.0 . 4.13 2453 2039 A 54 TYR HE% A 10 PHE HBx 1.0 . 4.72 2454 2039 A 54 TYR HE% A 10 PHE HBy 1.0 . 4.72 2455 2040 A 10 PHE HD% A 20 VAL HGx% 1.0 . 3.60 2456 2040 A 10 PHE HD% A 20 VAL HGy% 1.0 . 3.60 2457 2041 A 10 PHE HD% A 50 VAL HGx% 1.0 . 4.05 2458 2041 A 10 PHE HD% A 50 VAL HGy% 1.0 . 4.05 2459 2042 A 10 PHE HE% A 17 GLU HBy 1.0 . 4.58 2460 2042 A 10 PHE HE% A 17 GLU HBx 1.0 . 4.58 2461 2043 A 10 PHE HE% A 20 VAL HGx% 1.0 . 5.36 2462 2043 A 10 PHE HE% A 20 VAL HGy% 1.0 . 5.36 2463 2044 A 11 LYS H A 11 LYS HBy 1.0 . 3.15 2464 2044 A 11 LYS H A 11 LYS HBx 1.0 . 3.15 2465 2045 A 11 LYS H A 11 LYS HGx 1.0 . 3.49 2466 2045 A 11 LYS H A 11 LYS HGy 1.0 . 3.49 2467 2046 A 11 LYS HA A 19 ASP HBx 1.0 . 4.64 2468 2046 A 11 LYS HA A 19 ASP HBy 1.0 . 4.64 2469 2047 A 11 LYS HBy A 11 LYS HDx 1.0 . 2.51 2470 2047 A 11 LYS HBx A 11 LYS HDx 1.0 . 2.51 2471 2047 A 11 LYS HDy A 11 LYS HBy 1.0 . 2.51 2472 2047 A 11 LYS HDy A 11 LYS HBx 1.0 . 2.51 2473 2048 A 11 LYS HBy A 11 LYS HEx 1.0 . 4.45 2474 2048 A 11 LYS HEy A 11 LYS HBy 1.0 . 4.45 2475 2048 A 11 LYS HEy A 11 LYS HBx 1.0 . 4.45 2476 2048 A 11 LYS HBx A 11 LYS HEx 1.0 . 4.45 2477 2049 A 12 ALA H A 11 LYS HBy 1.0 . 3.75 2478 2049 A 12 ALA H A 11 LYS HBx 1.0 . 3.75 2479 2050 A 12 ALA HB% A 11 LYS HBy 1.0 . 5.29 2480 2050 A 12 ALA HB% A 11 LYS HBx 1.0 . 5.29 2481 2051 A 11 LYS HEx A 11 LYS HGx 1.0 . 3.10 2482 2051 A 11 LYS HEy A 11 LYS HGx 1.0 . 3.10 2483 2051 A 11 LYS HGy A 11 LYS HEx 1.0 . 3.10 2484 2051 A 11 LYS HEy A 11 LYS HGy 1.0 . 3.10 2485 2052 A 12 ALA HA A 13 GLU HGx 1.0 . 4.65 2486 2052 A 12 ALA HA A 13 GLU HGy 1.0 . 4.65 2487 2053 A 12 ALA HA A 17 GLU HBy 1.0 . 4.57 2488 2053 A 12 ALA HA A 17 GLU HBx 1.0 . 4.57 2489 2054 A 12 ALA HB% A 13 GLU HGx 1.0 . 4.83 2490 2054 A 12 ALA HB% A 13 GLU HGy 1.0 . 4.83 2491 2055 A 12 ALA HB% A 17 GLU HBy 1.0 . 3.24 2492 2055 A 12 ALA HB% A 17 GLU HBx 1.0 . 3.24 2493 2056 A 13 GLU H A 13 GLU HGx 1.0 . 3.44 2494 2056 A 13 GLU H A 13 GLU HGy 1.0 . 3.44 2495 2057 A 13 GLU H A 17 GLU HBy 1.0 . 4.36 2496 2057 A 13 GLU H A 17 GLU HBx 1.0 . 4.36 2497 2058 A 13 GLU HA A 13 GLU HGx 1.0 . 3.60 2498 2058 A 13 GLU HA A 13 GLU HGy 1.0 . 3.60 2499 2059 A 13 GLU HBy A 17 GLU HBy 1.0 . 4.70 2500 2059 A 13 GLU HBx A 17 GLU HBy 1.0 . 4.70 2501 2059 A 17 GLU HBx A 13 GLU HBx 1.0 . 4.70 2502 2059 A 13 GLU HBy A 17 GLU HBx 1.0 . 4.70 2503 2060 A 14 ARG H A 13 GLU HGx 1.0 . 3.51 2504 2060 A 14 ARG H A 13 GLU HGy 1.0 . 3.51 2505 2061 A 14 ARG HBx A 13 GLU HGx 1.0 . 5.34 2506 2061 A 14 ARG HBx A 13 GLU HGy 1.0 . 5.34 2507 2062 A 14 ARG HGy A 13 GLU HGx 1.0 . 4.24 2508 2062 A 14 ARG HGy A 13 GLU HGy 1.0 . 4.24 2509 2063 A 14 ARG HGx A 13 GLU HGx 1.0 . 4.82 2510 2063 A 14 ARG HGx A 13 GLU HGy 1.0 . 4.82 2511 2064 A 17 GLU HA A 13 GLU HGx 1.0 . 5.34 2512 2064 A 17 GLU HA A 13 GLU HGy 1.0 . 5.34 2513 2065 A 14 ARG H A 17 GLU HBy 1.0 . 3.73 2514 2065 A 14 ARG H A 17 GLU HBx 1.0 . 3.73 2515 2066 A 14 ARG HA A 14 ARG HDx 1.0 . 3.35 2516 2066 A 14 ARG HA A 14 ARG HDy 1.0 . 3.35 2517 2067 A 14 ARG HBx A 17 GLU HBy 1.0 . 4.69 2518 2067 A 14 ARG HBx A 17 GLU HBx 1.0 . 4.69 2519 2068 A 14 ARG HBy A 14 ARG HDx 1.0 . 3.51 2520 2068 A 14 ARG HBy A 14 ARG HDy 1.0 . 3.51 2521 2069 A 16 ASP H A 16 ASP HBx 1.0 . 3.50 2522 2069 A 16 ASP H A 16 ASP HBy 1.0 . 3.50 2523 2070 A 16 ASP HBx A 49 LEU HDy% 1.0 . 4.21 2524 2070 A 16 ASP HBy A 49 LEU HDy% 1.0 . 4.21 2525 2070 A 49 LEU HDx% A 16 ASP HBx 1.0 . 4.21 2526 2070 A 16 ASP HBy A 49 LEU HDx% 1.0 . 4.21 2527 2071 A 16 ASP HBy B -7 PHE HBx 1.0 . 4.90 2528 2071 A 16 ASP HBx B -7 PHE HBx 1.0 . 4.90 2529 2071 B -7 PHE HBy A 16 ASP HBx 1.0 . 4.90 2530 2071 B -7 PHE HBy A 16 ASP HBy 1.0 . 4.90 2531 2072 B -7 PHE HD% A 16 ASP HBx 1.0 . 3.85 2532 2072 B -7 PHE HD% A 16 ASP HBy 1.0 . 3.85 2533 2073 A 17 GLU H A 17 GLU HBy 1.0 . 3.32 2534 2073 A 17 GLU H A 17 GLU HBx 1.0 . 3.32 2535 2074 A 17 GLU HA A 49 LEU HDy% 1.0 . 5.27 2536 2074 A 17 GLU HA A 49 LEU HDx% 1.0 . 5.27 2537 2075 A 18 LEU H A 17 GLU HBy 1.0 . 3.74 2538 2075 A 18 LEU H A 17 GLU HBx 1.0 . 3.74 2539 2076 A 18 LEU H A 18 LEU HDy% 1.0 . 4.08 2540 2076 A 18 LEU H A 18 LEU HDx% 1.0 . 4.08 2541 2077 A 18 LEU HA A 18 LEU HDy% 1.0 . 3.70 2542 2077 A 18 LEU HA A 18 LEU HDx% 1.0 . 3.70 2543 2078 A 18 LEU HA A 19 ASP HBx 1.0 . 5.26 2544 2078 A 18 LEU HA A 19 ASP HBy 1.0 . 5.26 2545 2079 A 18 LEU HG A 20 VAL HGx% 1.0 . 5.44 2546 2079 A 18 LEU HG A 20 VAL HGy% 1.0 . 5.44 2547 2080 A 18 LEU HG A 41 PRO HDx 1.0 . 5.18 2548 2080 A 18 LEU HG A 41 PRO HDy 1.0 . 5.18 2549 2081 A 19 ASP H A 18 LEU HDy% 1.0 . 4.32 2550 2081 A 19 ASP H A 18 LEU HDx% 1.0 . 4.32 2551 2082 A 39 ALA H A 18 LEU HDy% 1.0 . 5.44 2552 2082 A 39 ALA H A 18 LEU HDx% 1.0 . 5.44 2553 2083 A 40 LYS HA A 18 LEU HDy% 1.0 . 5.44 2554 2083 A 40 LYS HA A 18 LEU HDx% 1.0 . 5.44 2555 2084 A 18 LEU HDx% A 41 PRO HGx 1.0 . 3.54 2556 2084 A 18 LEU HDy% A 41 PRO HGx 1.0 . 3.54 2557 2084 A 41 PRO HGy A 18 LEU HDy% 1.0 . 3.54 2558 2084 A 41 PRO HGy A 18 LEU HDx% 1.0 . 3.54 2559 2085 A 18 LEU HDx% A 41 PRO HDx 1.0 . 3.09 2560 2085 A 18 LEU HDy% A 41 PRO HDx 1.0 . 3.09 2561 2085 A 41 PRO HDy A 18 LEU HDy% 1.0 . 3.09 2562 2085 A 18 LEU HDx% A 41 PRO HDy 1.0 . 3.09 2563 2086 A 18 LEU HDx% A 45 GLY HAy 1.0 . 4.99 2564 2086 A 18 LEU HDy% A 45 GLY HAy 1.0 . 4.99 2565 2086 A 45 GLY HAx A 18 LEU HDy% 1.0 . 4.99 2566 2086 A 18 LEU HDx% A 45 GLY HAx 1.0 . 4.99 2567 2087 A 46 GLY H A 18 LEU HDy% 1.0 . 3.80 2568 2087 A 46 GLY H A 18 LEU HDx% 1.0 . 3.80 2569 2088 A 18 LEU HDy% A 46 GLY HAy 1.0 . 3.87 2570 2088 A 18 LEU HDx% A 46 GLY HAy 1.0 . 3.87 2571 2088 A 46 GLY HAx A 18 LEU HDy% 1.0 . 3.87 2572 2088 A 18 LEU HDx% A 46 GLY HAx 1.0 . 3.87 2573 2089 A 47 PRO HA A 18 LEU HDy% 1.0 . 3.96 2574 2089 A 47 PRO HA A 18 LEU HDx% 1.0 . 3.96 2575 2090 A 18 LEU HDy% A 47 PRO HBx 1.0 . 5.28 2576 2090 A 18 LEU HDx% A 47 PRO HBx 1.0 . 5.28 2577 2090 A 47 PRO HBy A 18 LEU HDy% 1.0 . 5.28 2578 2090 A 18 LEU HDx% A 47 PRO HBy 1.0 . 5.28 2579 2091 A 48 GLY H A 18 LEU HDy% 1.0 . 3.91 2580 2091 A 48 GLY H A 18 LEU HDx% 1.0 . 3.91 2581 2092 A 48 GLY HAy A 18 LEU HDy% 1.0 . 4.16 2582 2092 A 48 GLY HAy A 18 LEU HDx% 1.0 . 4.16 2583 2093 A 48 GLY HAx A 18 LEU HDy% 1.0 . 3.58 2584 2093 A 48 GLY HAx A 18 LEU HDx% 1.0 . 3.58 2585 2094 A 19 ASP H A 19 ASP HBx 1.0 . 3.13 2586 2094 A 19 ASP H A 19 ASP HBy 1.0 . 3.13 2587 2095 A 19 ASP HA A 20 VAL HGx% 1.0 . 4.45 2588 2095 A 19 ASP HA A 20 VAL HGy% 1.0 . 4.45 2589 2096 A 20 VAL H A 19 ASP HBx 1.0 . 3.83 2590 2096 A 20 VAL H A 19 ASP HBy 1.0 . 3.83 2591 2097 A 20 VAL H A 20 VAL HGx% 1.0 . 3.14 2592 2097 A 20 VAL H A 20 VAL HGy% 1.0 . 3.14 2593 2098 A 20 VAL HA A 21 SER HBx 1.0 . 4.60 2594 2098 A 20 VAL HA A 21 SER HBy 1.0 . 4.60 2595 2099 A 21 SER H A 20 VAL HGx% 1.0 . 3.66 2596 2099 A 21 SER H A 20 VAL HGy% 1.0 . 3.66 2597 2100 A 21 SER HA A 20 VAL HGx% 1.0 . 5.26 2598 2100 A 21 SER HA A 20 VAL HGy% 1.0 . 5.26 2599 2101 A 20 VAL HGy% A 21 SER HBx 1.0 . 5.19 2600 2101 A 21 SER HBy A 20 VAL HGx% 1.0 . 5.19 2601 2101 A 20 VAL HGy% A 21 SER HBy 1.0 . 5.19 2602 2101 A 20 VAL HGx% A 21 SER HBx 1.0 . 5.19 2603 2102 A 24 GLU HBx A 20 VAL HGx% 1.0 . 4.18 2604 2102 A 24 GLU HBx A 20 VAL HGy% 1.0 . 4.18 2605 2103 A 20 VAL HGx% A 24 GLU HGx 1.0 . 4.15 2606 2103 A 20 VAL HGy% A 24 GLU HGx 1.0 . 4.15 2607 2103 A 24 GLU HGy A 20 VAL HGx% 1.0 . 4.15 2608 2103 A 20 VAL HGy% A 24 GLU HGy 1.0 . 4.15 2609 2104 A 26 LEU HA A 20 VAL HGx% 1.0 . 5.44 2610 2104 A 26 LEU HA A 20 VAL HGy% 1.0 . 5.44 2611 2105 A 20 VAL HGx% A 26 LEU HDy% 1.0 . 2.72 2612 2105 A 20 VAL HGy% A 26 LEU HDy% 1.0 . 2.72 2613 2105 A 26 LEU HDx% A 20 VAL HGx% 1.0 . 2.72 2614 2105 A 26 LEU HDx% A 20 VAL HGy% 1.0 . 2.72 2615 2106 A 41 PRO HBx A 20 VAL HGx% 1.0 . 5.06 2616 2106 A 41 PRO HBx A 20 VAL HGy% 1.0 . 5.06 2617 2107 A 50 VAL HB A 20 VAL HGx% 1.0 . 4.07 2618 2107 A 50 VAL HB A 20 VAL HGy% 1.0 . 4.07 2619 2108 A 20 VAL HGy% A 50 VAL HGx% 1.0 . 3.62 2620 2108 A 50 VAL HGy% A 20 VAL HGx% 1.0 . 3.62 2621 2108 A 20 VAL HGy% A 50 VAL HGy% 1.0 . 3.62 2622 2108 A 20 VAL HGx% A 50 VAL HGx% 1.0 . 3.62 2623 2109 A 21 SER H A 21 SER HBx 1.0 . 3.51 2624 2109 A 21 SER H A 21 SER HBy 1.0 . 3.51 2625 2110 A 21 SER H A 24 GLU HGx 1.0 . 4.07 2626 2110 A 21 SER H A 24 GLU HGy 1.0 . 4.07 2627 2111 A 21 SER H A 26 LEU HDy% 1.0 . 4.78 2628 2111 A 21 SER H A 26 LEU HDx% 1.0 . 4.78 2629 2112 A 22 PRO HA A 21 SER HBx 1.0 . 4.85 2630 2112 A 22 PRO HA A 21 SER HBy 1.0 . 4.85 2631 2113 A 22 PRO HGx A 21 SER HBx 1.0 . 4.52 2632 2113 A 22 PRO HGx A 21 SER HBy 1.0 . 4.52 2633 2114 A 22 PRO HGy A 21 SER HBx 1.0 . 4.75 2634 2114 A 22 PRO HGy A 21 SER HBy 1.0 . 4.75 2635 2115 A 22 PRO HDy A 21 SER HBx 1.0 . 3.16 2636 2115 A 22 PRO HDy A 21 SER HBy 1.0 . 3.16 2637 2116 A 22 PRO HDx A 21 SER HBx 1.0 . 3.89 2638 2116 A 22 PRO HDx A 21 SER HBy 1.0 . 3.89 2639 2117 A 24 GLU HBx A 21 SER HBx 1.0 . 5.34 2640 2117 A 24 GLU HBx A 21 SER HBy 1.0 . 5.34 2641 2118 A 21 SER HBx A 24 GLU HGx 1.0 . 4.16 2642 2118 A 21 SER HBy A 24 GLU HGx 1.0 . 4.16 2643 2118 A 24 GLU HGy A 21 SER HBx 1.0 . 4.16 2644 2118 A 21 SER HBy A 24 GLU HGy 1.0 . 4.16 2645 2119 A 23 GLY H A 26 LEU HDy% 1.0 . 5.44 2646 2119 A 23 GLY H A 26 LEU HDx% 1.0 . 5.44 2647 2120 A 24 GLU H A 26 LEU HDy% 1.0 . 4.80 2648 2120 A 24 GLU H A 26 LEU HDx% 1.0 . 4.80 2649 2121 A 24 GLU HA A 24 GLU HGx 1.0 . 3.49 2650 2121 A 24 GLU HA A 24 GLU HGy 1.0 . 3.49 2651 2122 A 24 GLU HBy A 26 LEU HDy% 1.0 . 4.16 2652 2122 A 24 GLU HBy A 26 LEU HDx% 1.0 . 4.16 2653 2123 A 24 GLU HBx A 26 LEU HDy% 1.0 . 3.82 2654 2123 A 24 GLU HBx A 26 LEU HDx% 1.0 . 3.82 2655 2124 A 25 ASN H A 24 GLU HGx 1.0 . 5.21 2656 2124 A 25 ASN H A 24 GLU HGy 1.0 . 5.21 2657 2125 A 25 ASN H A 25 ASN HBx 1.0 . 3.58 2658 2125 A 25 ASN H A 25 ASN HBy 1.0 . 3.58 2659 2126 A 25 ASN HA A 26 LEU HDy% 1.0 . 4.53 2660 2126 A 25 ASN HA A 26 LEU HDx% 1.0 . 4.53 2661 2127 A 26 LEU H A 25 ASN HBx 1.0 . 4.34 2662 2127 A 26 LEU H A 25 ASN HBy 1.0 . 4.34 2663 2128 A 25 ASN HBx A 42 ILE HG1x 1.0 . 4.31 2664 2128 A 25 ASN HBy A 42 ILE HG1x 1.0 . 4.31 2665 2128 A 42 ILE HG1y A 25 ASN HBx 1.0 . 4.31 2666 2128 A 25 ASN HBy A 42 ILE HG1y 1.0 . 4.31 2667 2129 A 42 ILE HD1% A 25 ASN HBx 1.0 . 3.69 2668 2129 A 42 ILE HD1% A 25 ASN HBy 1.0 . 3.69 2669 2130 A 58 ILE HD1% A 25 ASN HBx 1.0 . 5.34 2670 2130 A 58 ILE HD1% A 25 ASN HBy 1.0 . 5.34 2671 2131 A 26 LEU H A 26 LEU HDy% 1.0 . 4.11 2672 2131 A 26 LEU H A 26 LEU HDx% 1.0 . 4.11 2673 2132 A 26 LEU HA A 26 LEU HDy% 1.0 . 3.49 2674 2132 A 26 LEU HA A 26 LEU HDx% 1.0 . 3.49 2675 2133 A 27 SER H A 26 LEU HBy 1.0 . 3.75 2676 2133 A 27 SER H A 26 LEU HBx 1.0 . 3.75 2677 2134 A 39 ALA HB% A 26 LEU HBy 1.0 . 3.97 2678 2134 A 39 ALA HB% A 26 LEU HBx 1.0 . 3.97 2679 2135 A 26 LEU HBx A 50 VAL HGx% 1.0 . 4.68 2680 2135 A 50 VAL HGy% A 26 LEU HBy 1.0 . 4.68 2681 2135 A 26 LEU HBx A 50 VAL HGy% 1.0 . 4.68 2682 2135 A 26 LEU HBy A 50 VAL HGx% 1.0 . 4.68 2683 2136 A 26 LEU HBx A 55 VAL HGx% 1.0 . 4.23 2684 2136 A 26 LEU HBy A 55 VAL HGx% 1.0 . 4.23 2685 2136 A 55 VAL HGy% A 26 LEU HBy 1.0 . 4.23 2686 2136 A 26 LEU HBx A 55 VAL HGy% 1.0 . 4.23 2687 2137 A 27 SER H A 26 LEU HDy% 1.0 . 4.06 2688 2137 A 27 SER H A 26 LEU HDx% 1.0 . 4.06 2689 2138 A 39 ALA HA A 26 LEU HDy% 1.0 . 4.97 2690 2138 A 39 ALA HA A 26 LEU HDx% 1.0 . 4.97 2691 2139 A 39 ALA HB% A 26 LEU HDy% 1.0 . 3.03 2692 2139 A 39 ALA HB% A 26 LEU HDx% 1.0 . 3.03 2693 2140 A 40 LYS H A 26 LEU HDy% 1.0 . 4.13 2694 2140 A 40 LYS H A 26 LEU HDx% 1.0 . 4.13 2695 2141 A 40 LYS HA A 26 LEU HDy% 1.0 . 4.64 2696 2141 A 40 LYS HA A 26 LEU HDx% 1.0 . 4.64 2697 2142 A 26 LEU HDy% A 40 LYS HBy 1.0 . 5.28 2698 2142 A 26 LEU HDx% A 40 LYS HBy 1.0 . 5.28 2699 2142 A 40 LYS HBx A 26 LEU HDy% 1.0 . 5.28 2700 2142 A 26 LEU HDx% A 40 LYS HBx 1.0 . 5.28 2701 2143 A 41 PRO HA A 26 LEU HDy% 1.0 . 3.62 2702 2143 A 41 PRO HA A 26 LEU HDx% 1.0 . 3.62 2703 2144 A 41 PRO HBx A 26 LEU HDy% 1.0 . 4.08 2704 2144 A 41 PRO HBx A 26 LEU HDx% 1.0 . 4.08 2705 2145 A 26 LEU HDy% A 41 PRO HGx 1.0 . 5.24 2706 2145 A 26 LEU HDx% A 41 PRO HGx 1.0 . 5.24 2707 2145 A 41 PRO HGy A 26 LEU HDy% 1.0 . 5.24 2708 2145 A 41 PRO HGy A 26 LEU HDx% 1.0 . 5.24 2709 2146 A 26 LEU HDx% A 41 PRO HDx 1.0 . 4.17 2710 2146 A 26 LEU HDy% A 41 PRO HDx 1.0 . 4.17 2711 2146 A 41 PRO HDy A 26 LEU HDy% 1.0 . 4.17 2712 2146 A 26 LEU HDx% A 41 PRO HDy 1.0 . 4.17 2713 2147 A 42 ILE H A 26 LEU HDy% 1.0 . 4.94 2714 2147 A 42 ILE H A 26 LEU HDx% 1.0 . 4.94 2715 2148 A 50 VAL HB A 26 LEU HDy% 1.0 . 5.44 2716 2148 A 50 VAL HB A 26 LEU HDx% 1.0 . 5.44 2717 2149 A 26 LEU HDy% A 55 VAL HGx% 1.0 . 3.35 2718 2149 A 55 VAL HGy% A 26 LEU HDy% 1.0 . 3.35 2719 2149 A 55 VAL HGy% A 26 LEU HDx% 1.0 . 3.35 2720 2149 A 26 LEU HDx% A 55 VAL HGx% 1.0 . 3.35 2721 2150 A 56 ARG H A 26 LEU HDy% 1.0 . 5.44 2722 2150 A 56 ARG H A 26 LEU HDx% 1.0 . 5.44 2723 2151 A 27 SER H A 42 ILE HG1x 1.0 . 4.43 2724 2151 A 27 SER H A 42 ILE HG1y 1.0 . 4.43 2725 2152 A 28 ILE HD1% A 50 VAL HGx% 1.0 . 4.35 2726 2152 A 28 ILE HD1% A 50 VAL HGy% 1.0 . 4.35 2727 2153 A 28 ILE HD1% A 55 VAL HGx% 1.0 . 3.64 2728 2153 A 28 ILE HD1% A 55 VAL HGy% 1.0 . 3.64 2729 2154 A 30 ALA HB% A 89 VAL HGx% 1.0 . 3.50 2730 2154 A 30 ALA HB% A 89 VAL HGy% 1.0 . 3.50 2731 2155 A 32 TYR H A 31 HIS HBx 1.0 . 3.40 2732 2155 A 32 TYR H A 31 HIS HBy 1.0 . 3.40 2733 2156 A 34 TYR HA A 31 HIS HBx 1.0 . 4.72 2734 2156 A 34 TYR HA A 31 HIS HBy 1.0 . 4.72 2735 2157 A 81 ILE HG1x A 31 HIS HBx 1.0 . 4.97 2736 2157 A 81 ILE HG1x A 31 HIS HBy 1.0 . 4.97 2737 2158 A 81 ILE HD1% A 31 HIS HBx 1.0 . 3.96 2738 2158 A 81 ILE HD1% A 31 HIS HBy 1.0 . 3.96 2739 2159 A 86 ILE HG2% A 31 HIS HBx 1.0 . 4.33 2740 2159 A 86 ILE HG2% A 31 HIS HBy 1.0 . 4.33 2741 2160 A 32 TYR H A 89 VAL HGx% 1.0 . 4.33 2742 2160 A 32 TYR H A 89 VAL HGy% 1.0 . 4.33 2743 2161 A 32 TYR HA A 89 VAL HGx% 1.0 . 3.93 2744 2161 A 32 TYR HA A 89 VAL HGy% 1.0 . 3.93 2745 2162 A 32 TYR HBx A 89 VAL HGx% 1.0 . 3.56 2746 2162 A 32 TYR HBx A 89 VAL HGy% 1.0 . 3.56 2747 2163 A 32 TYR HBy A 35 GLU HGx 1.0 . 4.83 2748 2163 A 32 TYR HBy A 35 GLU HGy 1.0 . 4.83 2749 2164 A 32 TYR HBy A 89 VAL HGx% 1.0 . 3.82 2750 2164 A 32 TYR HBy A 89 VAL HGy% 1.0 . 3.82 2751 2165 A 32 TYR HD% A 33 ASP HBx 1.0 . 4.14 2752 2165 A 32 TYR HD% A 33 ASP HBy 1.0 . 4.14 2753 2166 A 32 TYR HD% A 49 LEU HDy% 1.0 . 4.72 2754 2166 A 32 TYR HD% A 49 LEU HDx% 1.0 . 4.72 2755 2167 A 32 TYR HD% A 89 VAL HGx% 1.0 . 3.38 2756 2167 A 32 TYR HD% A 89 VAL HGy% 1.0 . 3.38 2757 2168 A 32 TYR HE% A 33 ASP HBx 1.0 . 4.11 2758 2168 A 32 TYR HE% A 33 ASP HBy 1.0 . 4.11 2759 2169 A 32 TYR HE% A 89 VAL HGx% 1.0 . 4.04 2760 2169 A 32 TYR HE% A 89 VAL HGy% 1.0 . 4.04 2761 2170 A 33 ASP H A 33 ASP HBx 1.0 . 3.50 2762 2170 A 33 ASP H A 33 ASP HBy 1.0 . 3.50 2763 2171 A 34 TYR H A 33 ASP HBx 1.0 . 4.27 2764 2171 A 34 TYR H A 33 ASP HBy 1.0 . 4.27 2765 2172 A 35 GLU H A 33 ASP HBx 1.0 . 4.79 2766 2172 A 35 GLU H A 33 ASP HBy 1.0 . 4.79 2767 2173 A 33 ASP HBy A 35 GLU HBx 1.0 . 5.34 2768 2173 A 33 ASP HBx A 35 GLU HBx 1.0 . 5.34 2769 2173 A 35 GLU HBy A 33 ASP HBx 1.0 . 5.34 2770 2173 A 35 GLU HBy A 33 ASP HBy 1.0 . 5.34 2771 2174 A 33 ASP HBy A 35 GLU HGx 1.0 . 2.98 2772 2174 A 33 ASP HBx A 35 GLU HGx 1.0 . 2.98 2773 2174 A 35 GLU HGy A 33 ASP HBx 1.0 . 2.98 2774 2174 A 35 GLU HGy A 33 ASP HBy 1.0 . 2.98 2775 2175 A 34 TYR HA A 52 VAL HGx% 1.0 . 4.79 2776 2175 A 34 TYR HA A 52 VAL HGy% 1.0 . 4.79 2777 2176 A 35 GLU H A 35 GLU HGx 1.0 . 3.42 2778 2176 A 35 GLU H A 35 GLU HGy 1.0 . 3.42 2779 2177 A 35 GLU H A 52 VAL HGx% 1.0 . 4.17 2780 2177 A 35 GLU H A 52 VAL HGy% 1.0 . 4.17 2781 2178 A 35 GLU HA A 35 GLU HGx 1.0 . 3.35 2782 2178 A 35 GLU HA A 35 GLU HGy 1.0 . 3.35 2783 2179 A 35 GLU HA A 52 VAL HGx% 1.0 . 3.73 2784 2179 A 35 GLU HA A 52 VAL HGy% 1.0 . 3.73 2785 2180 A 36 TRP H A 35 GLU HGx 1.0 . 3.86 2786 2180 A 36 TRP H A 35 GLU HGy 1.0 . 3.86 2787 2181 A 36 TRP HBx A 35 GLU HGx 1.0 . 5.34 2788 2181 A 36 TRP HBx A 35 GLU HGy 1.0 . 5.34 2789 2182 A 36 TRP HD1 A 35 GLU HGx 1.0 . 3.80 2790 2182 A 36 TRP HD1 A 35 GLU HGy 1.0 . 3.80 2791 2183 A 36 TRP HE1 A 35 GLU HGx 1.0 . 4.71 2792 2183 A 36 TRP HE1 A 35 GLU HGy 1.0 . 4.71 2793 2184 A 36 TRP H A 49 LEU HDy% 1.0 . 5.11 2794 2184 A 36 TRP H A 49 LEU HDx% 1.0 . 5.11 2795 2185 A 36 TRP H A 52 VAL HGx% 1.0 . 4.18 2796 2185 A 36 TRP H A 52 VAL HGy% 1.0 . 4.18 2797 2186 A 36 TRP HA A 49 LEU HDy% 1.0 . 4.49 2798 2186 A 36 TRP HA A 49 LEU HDx% 1.0 . 4.49 2799 2187 A 36 TRP HA A 52 VAL HGx% 1.0 . 4.07 2800 2187 A 36 TRP HA A 52 VAL HGy% 1.0 . 4.07 2801 2188 A 36 TRP HBx A 49 LEU HDy% 1.0 . 3.96 2802 2188 A 36 TRP HBx A 49 LEU HDx% 1.0 . 3.96 2803 2189 A 36 TRP HBy A 49 LEU HDy% 1.0 . 4.13 2804 2189 A 36 TRP HBy A 49 LEU HDx% 1.0 . 4.13 2805 2190 A 36 TRP HBy A 89 VAL HGx% 1.0 . 5.44 2806 2190 A 36 TRP HBy A 89 VAL HGy% 1.0 . 5.44 2807 2191 A 36 TRP HD1 A 49 LEU HDy% 1.0 . 4.72 2808 2191 A 36 TRP HD1 A 49 LEU HDx% 1.0 . 4.72 2809 2192 A 36 TRP HE3 A 49 LEU HDy% 1.0 . 4.29 2810 2192 A 36 TRP HE3 A 49 LEU HDx% 1.0 . 4.29 2811 2193 A 36 TRP HE1 B -3 ARG HBy 1.0 . 4.43 2812 2193 A 36 TRP HE1 B -3 ARG HBx 1.0 . 4.43 2813 2194 A 36 TRP HZ2 B -3 ARG HBy 1.0 . 3.44 2814 2194 A 36 TRP HZ2 B -3 ARG HBx 1.0 . 3.44 2815 2195 A 36 TRP HH2 A 49 LEU HDy% 1.0 . 5.25 2816 2195 A 36 TRP HH2 A 49 LEU HDx% 1.0 . 5.25 2817 2196 A 37 PHE H A 49 LEU HDy% 1.0 . 4.17 2818 2196 A 37 PHE H A 49 LEU HDx% 1.0 . 4.17 2819 2197 A 37 PHE H A 50 VAL HGx% 1.0 . 4.39 2820 2197 A 37 PHE H A 50 VAL HGy% 1.0 . 4.39 2821 2198 A 37 PHE H A 52 VAL HGx% 1.0 . 4.22 2822 2198 A 37 PHE H A 52 VAL HGy% 1.0 . 4.22 2823 2199 A 37 PHE HBy A 50 VAL HGx% 1.0 . 3.70 2824 2199 A 37 PHE HBy A 50 VAL HGy% 1.0 . 3.70 2825 2200 A 37 PHE HBy A 55 VAL HGx% 1.0 . 4.86 2826 2200 A 37 PHE HBy A 55 VAL HGy% 1.0 . 4.86 2827 2201 A 37 PHE HD% A 52 VAL HGx% 1.0 . 4.03 2828 2201 A 37 PHE HD% A 52 VAL HGy% 1.0 . 4.03 2829 2202 A 37 PHE HD% A 55 VAL HGx% 1.0 . 3.58 2830 2202 A 37 PHE HD% A 55 VAL HGy% 1.0 . 3.58 2831 2203 A 37 PHE HE% A 52 VAL HGx% 1.0 . 3.53 2832 2203 A 37 PHE HE% A 52 VAL HGy% 1.0 . 3.53 2833 2204 A 37 PHE HE% A 55 VAL HGx% 1.0 . 4.69 2834 2204 A 37 PHE HE% A 55 VAL HGy% 1.0 . 4.69 2835 2205 A 37 PHE HZ A 52 VAL HGx% 1.0 . 4.25 2836 2205 A 37 PHE HZ A 52 VAL HGy% 1.0 . 4.25 2837 2206 A 38 ILE H A 49 LEU HDy% 1.0 . 5.44 2838 2206 A 38 ILE H A 49 LEU HDx% 1.0 . 5.44 2839 2207 A 38 ILE H A 89 VAL HGx% 1.0 . 4.87 2840 2207 A 38 ILE H A 89 VAL HGy% 1.0 . 4.87 2841 2208 A 38 ILE HA A 49 LEU HDy% 1.0 . 4.54 2842 2208 A 38 ILE HA A 49 LEU HDx% 1.0 . 4.54 2843 2209 A 38 ILE HG2% A 47 PRO HBx 1.0 . 3.50 2844 2209 A 38 ILE HG2% A 47 PRO HBy 1.0 . 3.50 2845 2210 A 38 ILE HG2% A 89 VAL HGx% 1.0 . 4.12 2846 2210 A 38 ILE HG2% A 89 VAL HGy% 1.0 . 4.12 2847 2211 A 38 ILE HG1y A 49 LEU HDy% 1.0 . 4.96 2848 2211 A 38 ILE HG1y A 49 LEU HDx% 1.0 . 4.96 2849 2212 A 38 ILE HG1y A 89 VAL HGx% 1.0 . 3.72 2850 2212 A 38 ILE HG1y A 89 VAL HGy% 1.0 . 3.72 2851 2213 A 38 ILE HG1x A 89 VAL HGx% 1.0 . 3.32 2852 2213 A 38 ILE HG1x A 89 VAL HGy% 1.0 . 3.32 2853 2214 A 38 ILE HD1% A 49 LEU HDy% 1.0 . 2.88 2854 2214 A 38 ILE HD1% A 49 LEU HDx% 1.0 . 2.88 2855 2215 A 38 ILE HD1% A 89 VAL HGx% 1.0 . 3.16 2856 2215 A 38 ILE HD1% A 89 VAL HGy% 1.0 . 3.16 2857 2216 A 39 ALA H A 50 VAL HGx% 1.0 . 4.17 2858 2216 A 39 ALA H A 50 VAL HGy% 1.0 . 4.17 2859 2217 A 39 ALA HB% A 50 VAL HGx% 1.0 . 3.10 2860 2217 A 39 ALA HB% A 50 VAL HGy% 1.0 . 3.10 2861 2218 A 39 ALA HB% A 55 VAL HGx% 1.0 . 3.73 2862 2218 A 39 ALA HB% A 55 VAL HGy% 1.0 . 3.73 2863 2219 A 40 LYS H A 40 LYS HBy 1.0 . 3.62 2864 2219 A 40 LYS H A 40 LYS HBx 1.0 . 3.62 2865 2220 A 40 LYS HBx A 40 LYS HDx 1.0 . 2.75 2866 2220 A 40 LYS HBy A 40 LYS HDx 1.0 . 2.75 2867 2220 A 40 LYS HDy A 40 LYS HBy 1.0 . 2.75 2868 2220 A 40 LYS HDy A 40 LYS HBx 1.0 . 2.75 2869 2221 A 40 LYS HBx A 40 LYS HEx 1.0 . 4.07 2870 2221 A 40 LYS HBy A 40 LYS HEx 1.0 . 4.07 2871 2221 A 40 LYS HEy A 40 LYS HBy 1.0 . 4.07 2872 2221 A 40 LYS HEy A 40 LYS HBx 1.0 . 4.07 2873 2222 A 40 LYS HBy A 41 PRO HGx 1.0 . 3.82 2874 2222 A 40 LYS HBx A 41 PRO HGx 1.0 . 3.82 2875 2222 A 41 PRO HGy A 40 LYS HBy 1.0 . 3.82 2876 2222 A 41 PRO HGy A 40 LYS HBx 1.0 . 3.82 2877 2223 A 40 LYS HBx A 41 PRO HDx 1.0 . 4.03 2878 2223 A 40 LYS HBy A 41 PRO HDx 1.0 . 4.03 2879 2223 A 41 PRO HDy A 40 LYS HBy 1.0 . 4.03 2880 2223 A 41 PRO HDy A 40 LYS HBx 1.0 . 4.03 2881 2224 A 46 GLY H A 40 LYS HBy 1.0 . 5.33 2882 2224 A 46 GLY H A 40 LYS HBx 1.0 . 5.33 2883 2225 A 40 LYS HBx A 47 PRO HDy 1.0 . 4.76 2884 2225 A 40 LYS HBy A 47 PRO HDy 1.0 . 4.76 2885 2225 A 47 PRO HDx A 40 LYS HBy 1.0 . 4.76 2886 2225 A 40 LYS HBx A 47 PRO HDx 1.0 . 4.76 2887 2226 A 40 LYS HGy A 41 PRO HDx 1.0 . 4.57 2888 2226 A 40 LYS HGx A 41 PRO HDx 1.0 . 4.57 2889 2226 A 41 PRO HDy A 40 LYS HGx 1.0 . 4.57 2890 2226 A 40 LYS HGy A 41 PRO HDy 1.0 . 4.57 2891 2227 A 40 LYS HDx A 47 PRO HDy 1.0 . 5.05 2892 2227 A 40 LYS HDy A 47 PRO HDy 1.0 . 5.05 2893 2227 A 47 PRO HDx A 40 LYS HDx 1.0 . 5.05 2894 2227 A 40 LYS HDy A 47 PRO HDx 1.0 . 5.05 2895 2228 A 41 PRO HBy A 43 ARG HDx 1.0 . 5.34 2896 2228 A 41 PRO HBy A 43 ARG HDy 1.0 . 5.34 2897 2229 A 41 PRO HBx A 43 ARG HGy 1.0 . 4.37 2898 2229 A 41 PRO HBx A 43 ARG HGx 1.0 . 4.37 2899 2230 A 41 PRO HBx A 43 ARG HDx 1.0 . 5.34 2900 2230 A 41 PRO HBx A 43 ARG HDy 1.0 . 5.34 2901 2231 A 41 PRO HGy A 43 ARG HGy 1.0 . 4.70 2902 2231 A 41 PRO HGx A 43 ARG HGy 1.0 . 4.70 2903 2231 A 43 ARG HGx A 41 PRO HGx 1.0 . 4.70 2904 2231 A 41 PRO HGy A 43 ARG HGx 1.0 . 4.70 2905 2232 A 46 GLY H A 41 PRO HDx 1.0 . 3.69 2906 2232 A 46 GLY H A 41 PRO HDy 1.0 . 3.69 2907 2233 A 41 PRO HDy A 46 GLY HAy 1.0 . 4.38 2908 2233 A 41 PRO HDx A 46 GLY HAy 1.0 . 4.38 2909 2233 A 46 GLY HAx A 41 PRO HDx 1.0 . 4.38 2910 2233 A 41 PRO HDy A 46 GLY HAx 1.0 . 4.38 2911 2234 A 47 PRO HA A 41 PRO HDx 1.0 . 4.63 2912 2234 A 47 PRO HA A 41 PRO HDy 1.0 . 4.63 2913 2235 A 42 ILE HG2% A 42 ILE HG1x 1.0 . 2.61 2914 2235 A 42 ILE HG2% A 42 ILE HG1y 1.0 . 2.61 2915 2236 A 42 ILE HG2% A 43 ASN HBy 1.0 . 4.77 2916 2236 A 42 ILE HG2% A 43 ASN HBx 1.0 . 4.77 2917 2237 A 42 ILE HG2% A 60 LEU HDy% 1.0 . 5.02 2918 2237 A 42 ILE HG2% A 60 LEU HDx% 1.0 . 5.02 2919 2238 A 42 ILE HD1% A 60 LEU HDy% 1.0 . 3.86 2920 2238 A 42 ILE HD1% A 60 LEU HDx% 1.0 . 3.86 2921 2239 A 43 ASN H A 43 ASN HBy 1.0 . 3.67 2922 2239 A 43 ASN H A 43 ASN HBx 1.0 . 3.67 2923 2240 A 43 ASN HA A 43 ASN HD2y 1.0 . 3.96 2924 2240 A 43 ASN HA A 43 ASN HD2x 1.0 . 3.96 2925 2241 A 43 ASN HD2x A 43 ASN HBx 1.0 . 3.21 2926 2241 A 43 ASN HD2y A 43 ASN HBx 1.0 . 3.21 2927 2241 A 43 ASN HD2y A 43 ASN HBy 1.0 . 3.21 2928 2241 A 43 ASN HD2x A 43 ASN HBy 1.0 . 3.21 2929 2242 A 43 ARG HA A 43 ASN HBy 1.0 . 5.18 2930 2242 A 43 ARG HA A 43 ASN HBx 1.0 . 5.18 2931 2243 A 43 ARG H A 43 ARG HBy 1.0 . 3.47 2932 2243 A 43 ARG H A 43 ARG HBx 1.0 . 3.47 2933 2244 A 43 ARG H A 43 ARG HDx 1.0 . 4.52 2934 2244 A 43 ARG H A 43 ARG HDy 1.0 . 4.52 2935 2245 A 43 ARG HA A 43 ARG HDx 1.0 . 4.62 2936 2245 A 43 ARG HA A 43 ARG HDy 1.0 . 4.62 2937 2246 A 43 ARG HA A 44 LEU HBy 1.0 . 4.72 2938 2246 A 43 ARG HA A 44 LEU HBx 1.0 . 4.72 2939 2247 A 43 ARG HBx A 43 ARG HDx 1.0 . 3.23 2940 2247 A 43 ARG HBy A 43 ARG HDx 1.0 . 3.23 2941 2247 A 43 ARG HDy A 43 ARG HBy 1.0 . 3.23 2942 2247 A 43 ARG HDy A 43 ARG HBx 1.0 . 3.23 2943 2248 A 43 ARG HE A 43 ARG HBy 1.0 . 4.25 2944 2248 A 43 ARG HE A 43 ARG HBx 1.0 . 4.25 2945 2249 A 44 LEU H A 43 ARG HBy 1.0 . 3.26 2946 2249 A 44 LEU H A 43 ARG HBx 1.0 . 3.26 2947 2250 A 44 LEU H A 44 LEU HBy 1.0 . 2.95 2948 2250 A 44 LEU H A 44 LEU HBx 1.0 . 2.95 2949 2251 A 44 LEU H A 44 LEU HDy% 1.0 . 4.29 2950 2251 A 44 LEU H A 44 LEU HDx% 1.0 . 4.29 2951 2252 A 44 LEU HA A 44 LEU HDy% 1.0 . 2.88 2952 2252 A 44 LEU HA A 44 LEU HDx% 1.0 . 2.88 2953 2253 A 44 LEU HBx A 44 LEU HDy% 1.0 . 2.51 2954 2253 A 44 LEU HBy A 44 LEU HDy% 1.0 . 2.51 2955 2253 A 44 LEU HDx% A 44 LEU HBy 1.0 . 2.51 2956 2253 A 44 LEU HBx A 44 LEU HDx% 1.0 . 2.51 2957 2254 A 45 GLY H A 44 LEU HBy 1.0 . 4.03 2958 2254 A 45 GLY H A 44 LEU HBx 1.0 . 4.03 2959 2255 A 44 LEU HBy A 45 GLY HAy 1.0 . 4.34 2960 2255 A 44 LEU HBx A 45 GLY HAy 1.0 . 4.34 2961 2255 A 45 GLY HAx A 44 LEU HBy 1.0 . 4.34 2962 2255 A 45 GLY HAx A 44 LEU HBx 1.0 . 4.34 2963 2256 A 45 GLY HAx A 46 GLY HAy 1.0 . 4.76 2964 2256 A 45 GLY HAy A 46 GLY HAy 1.0 . 4.76 2965 2256 A 46 GLY HAx A 45 GLY HAy 1.0 . 4.76 2966 2256 A 45 GLY HAx A 46 GLY HAx 1.0 . 4.76 2967 2257 A 47 PRO HA A 46 GLY HAy 1.0 . 4.26 2968 2257 A 47 PRO HA A 46 GLY HAx 1.0 . 4.26 2969 2258 A 48 GLY H A 47 PRO HBx 1.0 . 3.74 2970 2258 A 48 GLY H A 47 PRO HBy 1.0 . 3.74 2971 2259 A 92 TRP HH2 A 47 PRO HBx 1.0 . 4.98 2972 2259 A 92 TRP HH2 A 47 PRO HBy 1.0 . 4.98 2973 2260 A 49 LEU H A 49 LEU HDy% 1.0 . 4.21 2974 2260 A 49 LEU H A 49 LEU HDx% 1.0 . 4.21 2975 2261 A 49 LEU HA A 49 LEU HDy% 1.0 . 3.81 2976 2261 A 49 LEU HA A 49 LEU HDx% 1.0 . 3.81 2977 2262 A 50 VAL H A 49 LEU HDy% 1.0 . 3.89 2978 2262 A 50 VAL H A 49 LEU HDx% 1.0 . 3.89 2979 2263 A 49 LEU HDx% A 50 VAL HGx% 1.0 . 4.35 2980 2263 A 49 LEU HDy% A 50 VAL HGx% 1.0 . 4.35 2981 2263 A 50 VAL HGy% A 49 LEU HDy% 1.0 . 4.35 2982 2263 A 50 VAL HGy% A 49 LEU HDx% 1.0 . 4.35 2983 2264 A 51 PRO HA A 49 LEU HDy% 1.0 . 4.69 2984 2264 A 51 PRO HA A 49 LEU HDx% 1.0 . 4.69 2985 2265 A 89 VAL HB A 49 LEU HDy% 1.0 . 5.44 2986 2265 A 89 VAL HB A 49 LEU HDx% 1.0 . 5.44 2987 2266 A 49 LEU HDy% A 89 VAL HGx% 1.0 . 3.96 2988 2266 A 49 LEU HDx% A 89 VAL HGx% 1.0 . 3.96 2989 2266 A 89 VAL HGy% A 49 LEU HDy% 1.0 . 3.96 2990 2266 A 49 LEU HDx% A 89 VAL HGy% 1.0 . 3.96 2991 2267 A 49 LEU HDy% B -7 PHE HBx 1.0 . 3.45 2992 2267 B -7 PHE HBy A 49 LEU HDy% 1.0 . 3.45 2993 2267 B -7 PHE HBy A 49 LEU HDx% 1.0 . 3.45 2994 2267 A 49 LEU HDx% B -7 PHE HBx 1.0 . 3.45 2995 2268 B -7 PHE HD% A 49 LEU HDy% 1.0 . 3.73 2996 2268 B -7 PHE HD% A 49 LEU HDx% 1.0 . 3.73 2997 2269 B -7 PHE HE% A 49 LEU HDy% 1.0 . 4.30 2998 2269 B -7 PHE HE% A 49 LEU HDx% 1.0 . 4.30 2999 2270 B -5 PRO HA A 49 LEU HDy% 1.0 . 3.59 3000 2270 B -5 PRO HA A 49 LEU HDx% 1.0 . 3.59 3001 2271 B -5 PRO HBy A 49 LEU HDy% 1.0 . 3.61 3002 2271 B -5 PRO HBy A 49 LEU HDx% 1.0 . 3.61 3003 2272 B -5 PRO HBx A 49 LEU HDy% 1.0 . 3.26 3004 2272 B -5 PRO HBx A 49 LEU HDx% 1.0 . 3.26 3005 2273 B -5 PRO HGx A 49 LEU HDy% 1.0 . 4.38 3006 2273 B -5 PRO HGx A 49 LEU HDx% 1.0 . 4.38 3007 2274 B -5 PRO HGy A 49 LEU HDy% 1.0 . 3.87 3008 2274 B -5 PRO HGy A 49 LEU HDx% 1.0 . 3.87 3009 2275 A 49 LEU HDx% B -5 PRO HDx 1.0 . 3.94 3010 2275 A 49 LEU HDy% B -5 PRO HDx 1.0 . 3.94 3011 2275 B -5 PRO HDy A 49 LEU HDy% 1.0 . 3.94 3012 2275 B -5 PRO HDy A 49 LEU HDx% 1.0 . 3.94 3013 2276 A 50 VAL H A 50 VAL HGx% 1.0 . 3.48 3014 2276 A 50 VAL H A 50 VAL HGy% 1.0 . 3.48 3015 2277 A 50 VAL HGy% A 54 TYR HBx 1.0 . 4.14 3016 2277 A 50 VAL HGx% A 54 TYR HBx 1.0 . 4.14 3017 2277 A 54 TYR HBy A 50 VAL HGx% 1.0 . 4.14 3018 2277 A 50 VAL HGy% A 54 TYR HBy 1.0 . 4.14 3019 2278 A 55 VAL HA A 50 VAL HGx% 1.0 . 5.44 3020 2278 A 55 VAL HA A 50 VAL HGy% 1.0 . 5.44 3021 2279 A 55 VAL HB A 50 VAL HGx% 1.0 . 3.70 3022 2279 A 55 VAL HB A 50 VAL HGy% 1.0 . 3.70 3023 2280 A 50 VAL HGx% A 55 VAL HGx% 1.0 . 2.91 3024 2280 A 50 VAL HGy% A 55 VAL HGx% 1.0 . 2.91 3025 2280 A 55 VAL HGy% A 50 VAL HGx% 1.0 . 2.91 3026 2280 A 55 VAL HGy% A 50 VAL HGy% 1.0 . 2.91 3027 2281 A 51 PRO HA A 52 VAL HGx% 1.0 . 4.43 3028 2281 A 51 PRO HA A 52 VAL HGy% 1.0 . 4.43 3029 2282 A 52 VAL H A 52 VAL HGx% 1.0 . 3.34 3030 2282 A 52 VAL H A 52 VAL HGy% 1.0 . 3.34 3031 2283 A 52 VAL HA A 55 VAL HGx% 1.0 . 3.61 3032 2283 A 52 VAL HA A 55 VAL HGy% 1.0 . 3.61 3033 2284 A 53 SER HA A 52 VAL HGx% 1.0 . 4.46 3034 2284 A 53 SER HA A 52 VAL HGy% 1.0 . 4.46 3035 2285 A 52 VAL HGx% A 55 VAL HGx% 1.0 . 4.25 3036 2285 A 52 VAL HGy% A 55 VAL HGx% 1.0 . 4.25 3037 2285 A 55 VAL HGy% A 52 VAL HGx% 1.0 . 4.25 3038 2285 A 55 VAL HGy% A 52 VAL HGy% 1.0 . 4.25 3039 2286 A 57 ILE HD1% A 52 VAL HGx% 1.0 . 4.64 3040 2286 A 57 ILE HD1% A 52 VAL HGy% 1.0 . 4.64 3041 2287 A 71 THR HA A 52 VAL HGx% 1.0 . 4.13 3042 2287 A 71 THR HA A 52 VAL HGy% 1.0 . 4.13 3043 2288 A 71 THR HB A 52 VAL HGx% 1.0 . 3.40 3044 2288 A 71 THR HB A 52 VAL HGy% 1.0 . 3.40 3045 2289 A 71 THR HG2% A 52 VAL HGx% 1.0 . 3.45 3046 2289 A 71 THR HG2% A 52 VAL HGy% 1.0 . 3.45 3047 2290 A 77 VAL HB A 52 VAL HGx% 1.0 . 4.67 3048 2290 A 77 VAL HB A 52 VAL HGy% 1.0 . 4.67 3049 2291 A 77 VAL HGx% A 52 VAL HGx% 1.0 . 3.21 3050 2291 A 77 VAL HGx% A 52 VAL HGy% 1.0 . 3.21 3051 2292 A 77 VAL HGy% A 52 VAL HGx% 1.0 . 2.82 3052 2292 A 77 VAL HGy% A 52 VAL HGy% 1.0 . 2.82 3053 2293 A 81 ILE HD1% A 52 VAL HGx% 1.0 . 4.24 3054 2293 A 81 ILE HD1% A 52 VAL HGy% 1.0 . 4.24 3055 2294 A 53 SER HA A 72 TYR HBx 1.0 . 5.34 3056 2294 A 53 SER HA A 72 TYR HBy 1.0 . 5.34 3057 2295 A 54 TYR H A 54 TYR HBx 1.0 . 3.36 3058 2295 A 54 TYR H A 54 TYR HBy 1.0 . 3.36 3059 2296 A 54 TYR H A 55 VAL HGx% 1.0 . 4.13 3060 2296 A 54 TYR H A 55 VAL HGy% 1.0 . 4.13 3061 2297 A 54 TYR HBx A 55 VAL HGx% 1.0 . 4.57 3062 2297 A 54 TYR HBy A 55 VAL HGx% 1.0 . 4.57 3063 2297 A 55 VAL HGy% A 54 TYR HBx 1.0 . 4.57 3064 2297 A 55 VAL HGy% A 54 TYR HBy 1.0 . 4.57 3065 2298 A 54 TYR HE% B 0 PRO HBy 1.0 . 3.74 3066 2298 A 54 TYR HE% B 0 PRO HBx 1.0 . 3.74 3067 2299 A 54 TYR HE% B 0 PRO HGx 1.0 . 3.40 3068 2299 A 54 TYR HE% B 0 PRO HGy 1.0 . 3.40 3069 2300 A 55 VAL H A 55 VAL HGx% 1.0 . 3.28 3070 2300 A 55 VAL H A 55 VAL HGy% 1.0 . 3.28 3071 2301 A 55 VAL HA A 55 VAL HGx% 1.0 . 3.15 3072 2301 A 55 VAL HA A 55 VAL HGy% 1.0 . 3.15 3073 2302 A 56 ARG H A 55 VAL HGx% 1.0 . 3.51 3074 2302 A 56 ARG H A 55 VAL HGy% 1.0 . 3.51 3075 2303 A 56 ARG HA A 55 VAL HGx% 1.0 . 4.77 3076 2303 A 56 ARG HA A 55 VAL HGy% 1.0 . 4.77 3077 2304 A 56 ARG HBx A 55 VAL HGx% 1.0 . 5.44 3078 2304 A 56 ARG HBx A 55 VAL HGy% 1.0 . 5.44 3079 2305 A 55 VAL HGy% A 57 ILE HG1x 1.0 . 4.28 3080 2305 A 55 VAL HGx% A 57 ILE HG1x 1.0 . 4.28 3081 2305 A 57 ILE HG1y A 55 VAL HGx% 1.0 . 4.28 3082 2305 A 55 VAL HGy% A 57 ILE HG1y 1.0 . 4.28 3083 2306 A 57 ILE HD1% A 55 VAL HGx% 1.0 . 3.46 3084 2306 A 57 ILE HD1% A 55 VAL HGy% 1.0 . 3.46 3085 2307 A 71 THR HG2% A 55 VAL HGx% 1.0 . 3.76 3086 2307 A 71 THR HG2% A 55 VAL HGy% 1.0 . 3.76 3087 2308 A 56 ARG H A 56 ARG HGy 1.0 . 4.02 3088 2308 A 56 ARG H A 56 ARG HGx 1.0 . 4.02 3089 2309 A 56 ARG H A 56 ARG HDx 1.0 . 5.34 3090 2309 A 56 ARG H A 56 ARG HDy 1.0 . 5.34 3091 2310 A 56 ARG HA A 56 ARG HDx 1.0 . 4.63 3092 2310 A 56 ARG HA A 56 ARG HDy 1.0 . 4.63 3093 2311 A 56 ARG HBy A 56 ARG HDx 1.0 . 3.43 3094 2311 A 56 ARG HBy A 56 ARG HDy 1.0 . 3.43 3095 2312 A 56 ARG HBx A 56 ARG HDx 1.0 . 3.58 3096 2312 A 56 ARG HBx A 56 ARG HDy 1.0 . 3.58 3097 2313 A 56 ARG HE A 56 ARG HGy 1.0 . 3.63 3098 2313 A 56 ARG HE A 56 ARG HGx 1.0 . 3.63 3099 2314 A 56 ARG HGx A 58 ILE HG1x 1.0 . 4.67 3100 2314 A 56 ARG HGy A 58 ILE HG1x 1.0 . 4.67 3101 2314 A 58 ILE HG1y A 56 ARG HGy 1.0 . 4.67 3102 2314 A 58 ILE HG1y A 56 ARG HGx 1.0 . 4.67 3103 2315 A 58 ILE HD1% A 56 ARG HGy 1.0 . 4.72 3104 2315 A 58 ILE HD1% A 56 ARG HGx 1.0 . 4.72 3105 2316 A 71 THR HG2% A 56 ARG HGy 1.0 . 5.33 3106 2316 A 71 THR HG2% A 56 ARG HGx 1.0 . 5.33 3107 2317 A 58 ILE HG2% A 56 ARG HDx 1.0 . 4.29 3108 2317 A 58 ILE HG2% A 56 ARG HDy 1.0 . 4.29 3109 2318 A 58 ILE HD1% A 56 ARG HDx 1.0 . 4.70 3110 2318 A 58 ILE HD1% A 56 ARG HDy 1.0 . 4.70 3111 2319 A 67 ALA HA A 56 ARG HDx 1.0 . 3.86 3112 2319 A 67 ALA HA A 56 ARG HDy 1.0 . 3.86 3113 2320 A 67 ALA HB% A 56 ARG HDx 1.0 . 3.72 3114 2320 A 67 ALA HB% A 56 ARG HDy 1.0 . 3.72 3115 2321 A 57 ILE H A 57 ILE HG1x 1.0 . 3.79 3116 2321 A 57 ILE H A 57 ILE HG1y 1.0 . 3.79 3117 2322 A 57 ILE HB A 69 VAL HGx% 1.0 . 4.81 3118 2322 A 57 ILE HB A 69 VAL HGy% 1.0 . 4.81 3119 2323 A 57 ILE HG2% A 84 PHE HBx 1.0 . 5.34 3120 2323 A 57 ILE HG2% A 84 PHE HBy 1.0 . 5.34 3121 2324 A 71 THR HG2% A 57 ILE HG1x 1.0 . 3.55 3122 2324 A 71 THR HG2% A 57 ILE HG1y 1.0 . 3.55 3123 2325 A 77 VAL HGy% A 57 ILE HG1x 1.0 . 4.22 3124 2325 A 77 VAL HGy% A 57 ILE HG1y 1.0 . 4.22 3125 2326 A 60 LEU H A 59 ASP HBx 1.0 . 4.48 3126 2326 A 60 LEU H A 59 ASP HBy 1.0 . 4.48 3127 2327 A 61 MET HE% A 59 ASP HBx 1.0 . 5.34 3128 2327 A 61 MET HE% A 59 ASP HBy 1.0 . 5.34 3129 2328 A 62 ASP H A 59 ASP HBx 1.0 . 3.27 3130 2328 A 62 ASP H A 59 ASP HBy 1.0 . 3.27 3131 2329 A 65 LYS HBy A 59 ASP HBx 1.0 . 4.75 3132 2329 A 65 LYS HBy A 59 ASP HBy 1.0 . 4.75 3133 2330 A 65 LYS HBx A 59 ASP HBx 1.0 . 4.82 3134 2330 A 65 LYS HBx A 59 ASP HBy 1.0 . 4.82 3135 2331 A 59 ASP HBx A 65 LYS HDy 1.0 . 4.37 3136 2331 A 59 ASP HBy A 65 LYS HDy 1.0 . 4.37 3137 2331 A 65 LYS HDx A 59 ASP HBx 1.0 . 4.37 3138 2331 A 59 ASP HBy A 65 LYS HDx 1.0 . 4.37 3139 2332 A 66 TYR HD% A 59 ASP HBx 1.0 . 4.03 3140 2332 A 66 TYR HD% A 59 ASP HBy 1.0 . 4.03 3141 2333 A 66 TYR HE% A 59 ASP HBx 1.0 . 3.72 3142 2333 A 66 TYR HE% A 59 ASP HBy 1.0 . 3.72 3143 2334 A 84 PHE HE% A 59 ASP HBx 1.0 . 4.81 3144 2334 A 84 PHE HE% A 59 ASP HBy 1.0 . 4.81 3145 2335 A 60 LEU H A 60 LEU HBx 1.0 . 3.08 3146 2335 A 60 LEU H A 60 LEU HBy 1.0 . 3.08 3147 2336 A 60 LEU H A 60 LEU HDy% 1.0 . 3.80 3148 2336 A 60 LEU H A 60 LEU HDx% 1.0 . 3.80 3149 2337 A 60 LEU HA A 60 LEU HDy% 1.0 . 3.02 3150 2337 A 60 LEU HA A 60 LEU HDx% 1.0 . 3.02 3151 2338 A 60 LEU HBx A 60 LEU HDy% 1.0 . 2.84 3152 2338 A 60 LEU HBy A 60 LEU HDy% 1.0 . 2.84 3153 2338 A 60 LEU HDx% A 60 LEU HBx 1.0 . 2.84 3154 2338 A 60 LEU HDx% A 60 LEU HBy 1.0 . 2.84 3155 2339 A 61 MET H A 60 LEU HBx 1.0 . 3.66 3156 2339 A 61 MET H A 60 LEU HBy 1.0 . 3.66 3157 2340 A 60 LEU HBy A 61 MET HBx 1.0 . 4.95 3158 2340 A 60 LEU HBx A 61 MET HBx 1.0 . 4.95 3159 2340 A 61 MET HBy A 60 LEU HBx 1.0 . 4.95 3160 2340 A 61 MET HBy A 60 LEU HBy 1.0 . 4.95 3161 2341 A 61 MET HE% A 60 LEU HBx 1.0 . 4.70 3162 2341 A 61 MET HE% A 60 LEU HBy 1.0 . 4.70 3163 2342 A 61 MET H A 61 MET HGx 1.0 . 3.81 3164 2342 A 61 MET H A 61 MET HGy 1.0 . 3.81 3165 2343 A 61 MET HA A 61 MET HGx 1.0 . 3.46 3166 2343 A 61 MET HA A 61 MET HGy 1.0 . 3.46 3167 2344 A 61 MET HA A 63 PRO HDx 1.0 . 4.84 3168 2344 A 61 MET HA A 63 PRO HDy 1.0 . 4.84 3169 2345 A 61 MET HE% A 61 MET HGx 1.0 . 3.01 3170 2345 A 61 MET HE% A 61 MET HGy 1.0 . 3.01 3171 2346 A 62 ASP H A 62 ASP HBx 1.0 . 3.21 3172 2346 A 62 ASP H A 62 ASP HBy 1.0 . 3.21 3173 2347 A 62 ASP H A 63 PRO HDx 1.0 . 3.72 3174 2347 A 62 ASP H A 63 PRO HDy 1.0 . 3.72 3175 2348 A 65 LYS HBy A 62 ASP HBx 1.0 . 4.18 3176 2348 A 65 LYS HBy A 62 ASP HBy 1.0 . 4.18 3177 2349 A 62 ASP HBx A 65 LYS HDy 1.0 . 3.92 3178 2349 A 62 ASP HBy A 65 LYS HDy 1.0 . 3.92 3179 2349 A 65 LYS HDx A 62 ASP HBx 1.0 . 3.92 3180 2349 A 65 LYS HDx A 62 ASP HBy 1.0 . 3.92 3181 2350 A 62 ASP HBx A 65 LYS HEx 1.0 . 5.23 3182 2350 A 62 ASP HBy A 65 LYS HEx 1.0 . 5.23 3183 2350 A 65 LYS HEy A 62 ASP HBx 1.0 . 5.23 3184 2350 A 65 LYS HEy A 62 ASP HBy 1.0 . 5.23 3185 2351 A 64 ALA H A 63 PRO HDx 1.0 . 3.48 3186 2351 A 64 ALA H A 63 PRO HDy 1.0 . 3.48 3187 2352 A 64 ALA HB% A 63 PRO HDx 1.0 . 5.35 3188 2352 A 64 ALA HB% A 63 PRO HDy 1.0 . 5.35 3189 2353 A 64 ALA HB% A 65 LYS HGx 1.0 . 5.34 3190 2353 A 64 ALA HB% A 65 LYS HGy 1.0 . 5.34 3191 2354 A 65 LYS H A 65 LYS HGx 1.0 . 4.05 3192 2354 A 65 LYS H A 65 LYS HGy 1.0 . 4.05 3193 2355 A 65 LYS HA A 65 LYS HGx 1.0 . 3.37 3194 2355 A 65 LYS HA A 65 LYS HGy 1.0 . 3.37 3195 2356 A 65 LYS HA A 65 LYS HDy 1.0 . 4.27 3196 2356 A 65 LYS HA A 65 LYS HDx 1.0 . 4.27 3197 2357 A 65 LYS HBy A 65 LYS HDy 1.0 . 3.22 3198 2357 A 65 LYS HBy A 65 LYS HDx 1.0 . 3.22 3199 2358 A 66 TYR HD% A 65 LYS HGx 1.0 . 4.87 3200 2358 A 66 TYR HD% A 65 LYS HGy 1.0 . 4.87 3201 2359 A 66 TYR HE% A 65 LYS HGx 1.0 . 5.15 3202 2359 A 66 TYR HE% A 65 LYS HGy 1.0 . 5.15 3203 2360 A 66 TYR HD% A 65 LYS HDy 1.0 . 4.06 3204 2360 A 66 TYR HD% A 65 LYS HDx 1.0 . 4.06 3205 2361 A 66 TYR HE% A 65 LYS HDy 1.0 . 3.32 3206 2361 A 66 TYR HE% A 65 LYS HDx 1.0 . 3.32 3207 2362 A 66 TYR HA A 69 VAL HGx% 1.0 . 4.21 3208 2362 A 66 TYR HA A 69 VAL HGy% 1.0 . 4.21 3209 2363 A 66 TYR HBx A 69 VAL HGx% 1.0 . 4.11 3210 2363 A 66 TYR HBx A 69 VAL HGy% 1.0 . 4.11 3211 2364 A 66 TYR HBy A 69 VAL HGx% 1.0 . 3.60 3212 2364 A 66 TYR HBy A 69 VAL HGy% 1.0 . 3.60 3213 2365 A 66 TYR HD% A 69 VAL HGx% 1.0 . 3.29 3214 2365 A 66 TYR HD% A 69 VAL HGy% 1.0 . 3.29 3215 2366 A 66 TYR HD% A 80 ILE HG1x 1.0 . 4.06 3216 2366 A 66 TYR HD% A 80 ILE HG1y 1.0 . 4.06 3217 2367 A 66 TYR HE% A 69 VAL HGx% 1.0 . 4.67 3218 2367 A 66 TYR HE% A 69 VAL HGy% 1.0 . 4.67 3219 2368 A 66 TYR HE% A 80 ILE HG1x 1.0 . 3.39 3220 2368 A 66 TYR HE% A 80 ILE HG1y 1.0 . 3.39 3221 2369 A 68 SER H A 69 VAL HGx% 1.0 . 4.55 3222 2369 A 68 SER H A 69 VAL HGy% 1.0 . 4.55 3223 2370 A 68 SER HA A 68 SER HBx 1.0 . 2.65 3224 2370 A 68 SER HA A 68 SER HBy 1.0 . 2.65 3225 2371 A 68 SER HA A 69 VAL HGx% 1.0 . 5.00 3226 2371 A 68 SER HA A 69 VAL HGy% 1.0 . 5.00 3227 2372 A 69 VAL H A 68 SER HBx 1.0 . 3.97 3228 2372 A 69 VAL H A 68 SER HBy 1.0 . 3.97 3229 2373 A 69 VAL H A 69 VAL HGx% 1.0 . 3.17 3230 2373 A 69 VAL H A 69 VAL HGy% 1.0 . 3.17 3231 2374 A 69 VAL HA A 69 VAL HGx% 1.0 . 2.77 3232 2374 A 69 VAL HA A 69 VAL HGy% 1.0 . 2.77 3233 2375 A 70 ASP H A 69 VAL HGx% 1.0 . 3.43 3234 2375 A 70 ASP H A 69 VAL HGy% 1.0 . 3.43 3235 2376 A 70 ASP HA A 69 VAL HGx% 1.0 . 4.82 3236 2376 A 70 ASP HA A 69 VAL HGy% 1.0 . 4.82 3237 2377 A 71 THR HA A 69 VAL HGx% 1.0 . 4.03 3238 2377 A 71 THR HA A 69 VAL HGy% 1.0 . 4.03 3239 2378 A 71 THR HG2% A 69 VAL HGx% 1.0 . 4.20 3240 2378 A 71 THR HG2% A 69 VAL HGy% 1.0 . 4.20 3241 2379 A 76 GLN HA A 69 VAL HGx% 1.0 . 4.13 3242 2379 A 76 GLN HA A 69 VAL HGy% 1.0 . 4.13 3243 2380 A 69 VAL HGy% A 76 GLN HBy 1.0 . 3.38 3244 2380 A 69 VAL HGx% A 76 GLN HBy 1.0 . 3.38 3245 2380 A 76 GLN HBx A 69 VAL HGx% 1.0 . 3.38 3246 2380 A 69 VAL HGy% A 76 GLN HBx 1.0 . 3.38 3247 2381 A 76 GLN HGx A 69 VAL HGx% 1.0 . 4.53 3248 2381 A 76 GLN HGx A 69 VAL HGy% 1.0 . 4.53 3249 2382 A 76 GLN HGy A 69 VAL HGx% 1.0 . 4.26 3250 2382 A 76 GLN HGy A 69 VAL HGy% 1.0 . 4.26 3251 2383 A 77 VAL HA A 69 VAL HGx% 1.0 . 4.42 3252 2383 A 77 VAL HA A 69 VAL HGy% 1.0 . 4.42 3253 2384 A 69 VAL HGy% A 79 LYS HDx 1.0 . 5.44 3254 2384 A 69 VAL HGx% A 79 LYS HDx 1.0 . 5.44 3255 2384 A 79 LYS HDy A 69 VAL HGx% 1.0 . 5.44 3256 2384 A 79 LYS HDy A 69 VAL HGy% 1.0 . 5.44 3257 2385 A 69 VAL HGx% A 80 ILE HG1x 1.0 . 4.94 3258 2385 A 69 VAL HGy% A 80 ILE HG1x 1.0 . 4.94 3259 2385 A 80 ILE HG1y A 69 VAL HGx% 1.0 . 4.94 3260 2385 A 69 VAL HGy% A 80 ILE HG1y 1.0 . 4.94 3261 2386 A 80 ILE HD1% A 69 VAL HGx% 1.0 . 2.70 3262 2386 A 80 ILE HD1% A 69 VAL HGy% 1.0 . 2.70 3263 2387 A 70 ASP H A 70 ASP HBx 1.0 . 3.23 3264 2387 A 70 ASP H A 70 ASP HBy 1.0 . 3.23 3265 2388 A 70 ASP H A 76 GLN HBy 1.0 . 4.94 3266 2388 A 70 ASP H A 76 GLN HBx 1.0 . 4.94 3267 2389 A 71 THR H A 70 ASP HBx 1.0 . 3.81 3268 2389 A 71 THR H A 70 ASP HBy 1.0 . 3.81 3269 2390 A 73 ASP H A 70 ASP HBx 1.0 . 4.84 3270 2390 A 73 ASP H A 70 ASP HBy 1.0 . 4.84 3271 2391 A 76 GLN HE2y A 70 ASP HBy 1.0 . 3.91 3272 2391 A 76 GLN HE2x A 70 ASP HBy 1.0 . 3.91 3273 2391 A 76 GLN HE2x A 70 ASP HBx 1.0 . 3.91 3274 2391 A 76 GLN HE2y A 70 ASP HBx 1.0 . 3.91 3275 2392 A 72 TYR H A 72 TYR HBx 1.0 . 3.10 3276 2392 A 72 TYR H A 72 TYR HBy 1.0 . 3.10 3277 2393 A 73 ASP H A 72 TYR HBx 1.0 . 3.59 3278 2393 A 73 ASP H A 72 TYR HBy 1.0 . 3.59 3279 2394 A 72 TYR HD% B 1 LYS HGy 1.0 . 4.65 3280 2394 A 72 TYR HD% B 1 LYS HGx 1.0 . 4.65 3281 2395 A 72 TYR HD% B 2 PRO HGy 1.0 . 4.04 3282 2395 A 72 TYR HD% B 2 PRO HGx 1.0 . 4.04 3283 2396 A 72 TYR HE% B 1 LYS HBy 1.0 . 4.30 3284 2396 A 72 TYR HE% B 1 LYS HBx 1.0 . 4.30 3285 2397 A 72 TYR HE% B 1 LYS HGy 1.0 . 4.84 3286 2397 A 72 TYR HE% B 1 LYS HGx 1.0 . 4.84 3287 2398 A 72 TYR HE% B 2 PRO HGy 1.0 . 5.20 3288 2398 A 72 TYR HE% B 2 PRO HGx 1.0 . 5.20 3289 2399 A 72 TYR HE% B 2 PRO HDx 1.0 . 3.34 3290 2399 A 72 TYR HE% B 2 PRO HDy 1.0 . 3.34 3291 2400 A 73 ASP H A 73 ASP HBx 1.0 . 3.07 3292 2400 A 73 ASP H A 73 ASP HBy 1.0 . 3.07 3293 2401 A 74 ARG H A 73 ASP HBx 1.0 . 4.02 3294 2401 A 74 ARG H A 73 ASP HBy 1.0 . 4.02 3295 2402 A 76 GLN H A 73 ASP HBx 1.0 . 4.26 3296 2402 A 76 GLN H A 73 ASP HBy 1.0 . 4.26 3297 2403 A 73 ASP HBy A 76 GLN HBy 1.0 . 4.94 3298 2403 A 73 ASP HBx A 76 GLN HBy 1.0 . 4.94 3299 2403 A 76 GLN HBx A 73 ASP HBx 1.0 . 4.94 3300 2403 A 76 GLN HBx A 73 ASP HBy 1.0 . 4.94 3301 2404 A 76 GLN HGx A 73 ASP HBx 1.0 . 4.71 3302 2404 A 76 GLN HGx A 73 ASP HBy 1.0 . 4.71 3303 2405 A 76 GLN HGy A 73 ASP HBx 1.0 . 4.57 3304 2405 A 76 GLN HGy A 73 ASP HBy 1.0 . 4.57 3305 2406 A 76 GLN HE2y A 73 ASP HBx 1.0 . 4.21 3306 2406 A 76 GLN HE2y A 73 ASP HBy 1.0 . 4.21 3307 2406 A 76 GLN HE2x A 73 ASP HBy 1.0 . 4.21 3308 2406 A 76 GLN HE2x A 73 ASP HBx 1.0 . 4.21 3309 2407 A 77 VAL H A 73 ASP HBx 1.0 . 4.43 3310 2407 A 77 VAL H A 73 ASP HBy 1.0 . 4.43 3311 2408 A 74 ARG H A 74 ARG HGy 1.0 . 3.39 3312 2408 A 74 ARG H A 74 ARG HGx 1.0 . 3.39 3313 2409 A 74 ARG HA A 74 ARG HGy 1.0 . 3.69 3314 2409 A 74 ARG HA A 74 ARG HGx 1.0 . 3.69 3315 2410 A 74 ARG HA A 74 ARG HDx 1.0 . 3.95 3316 2410 A 74 ARG HA A 74 ARG HDy 1.0 . 3.95 3317 2411 A 74 ARG HBy A 74 ARG HDx 1.0 . 3.58 3318 2411 A 74 ARG HBy A 74 ARG HDy 1.0 . 3.58 3319 2412 A 74 ARG HBx A 74 ARG HDx 1.0 . 3.69 3320 2412 A 74 ARG HBx A 74 ARG HDy 1.0 . 3.69 3321 2413 A 75 GLU H A 74 ARG HGy 1.0 . 3.49 3322 2413 A 75 GLU H A 74 ARG HGx 1.0 . 3.49 3323 2414 A 75 GLU HA A 74 ARG HGy 1.0 . 4.13 3324 2414 A 75 GLU HA A 74 ARG HGx 1.0 . 4.13 3325 2415 A 75 GLU HBx A 74 ARG HGy 1.0 . 4.62 3326 2415 A 75 GLU HBx A 74 ARG HGx 1.0 . 4.62 3327 2416 A 75 GLU HGx A 74 ARG HGy 1.0 . 4.15 3328 2416 A 75 GLU HGx A 74 ARG HGx 1.0 . 4.15 3329 2417 A 78 MET HE% A 74 ARG HGy 1.0 . 2.53 3330 2417 A 78 MET HE% A 74 ARG HGx 1.0 . 2.53 3331 2418 A 75 GLU HA A 74 ARG HDx 1.0 . 4.58 3332 2418 A 75 GLU HA A 74 ARG HDy 1.0 . 4.58 3333 2419 A 75 GLU HGx A 74 ARG HDx 1.0 . 4.20 3334 2419 A 75 GLU HGx A 74 ARG HDy 1.0 . 4.20 3335 2420 A 78 MET HE% A 74 ARG HDx 1.0 . 3.97 3336 2420 A 78 MET HE% A 74 ARG HDy 1.0 . 3.97 3337 2421 A 76 GLN H A 76 GLN HBy 1.0 . 3.12 3338 2421 A 76 GLN H A 76 GLN HBx 1.0 . 3.12 3339 2422 A 76 GLN HE2x A 76 GLN HBx 1.0 . 3.53 3340 2422 A 76 GLN HE2x A 76 GLN HBy 1.0 . 3.53 3341 2422 A 76 GLN HE2y A 76 GLN HBy 1.0 . 3.53 3342 2422 A 76 GLN HE2y A 76 GLN HBx 1.0 . 3.53 3343 2423 A 77 VAL H A 76 GLN HBy 1.0 . 3.21 3344 2423 A 77 VAL H A 76 GLN HBx 1.0 . 3.21 3345 2424 A 77 VAL HGx% A 76 GLN HBy 1.0 . 5.32 3346 2424 A 77 VAL HGx% A 76 GLN HBx 1.0 . 5.32 3347 2425 A 77 VAL HA A 80 ILE HG1x 1.0 . 4.46 3348 2425 A 77 VAL HA A 80 ILE HG1y 1.0 . 4.46 3349 2426 A 79 LYS H A 79 LYS HGx 1.0 . 4.33 3350 2426 A 79 LYS H A 79 LYS HGy 1.0 . 4.33 3351 2427 A 79 LYS HA A 79 LYS HGx 1.0 . 3.06 3352 2427 A 79 LYS HA A 79 LYS HGy 1.0 . 3.06 3353 2428 A 79 LYS HA A 82 ASP HBx 1.0 . 3.54 3354 2428 A 79 LYS HA A 82 ASP HBy 1.0 . 3.54 3355 2429 A 79 LYS HBy A 82 ASP HBx 1.0 . 4.58 3356 2429 A 79 LYS HBx A 82 ASP HBx 1.0 . 4.58 3357 2429 A 82 ASP HBy A 79 LYS HBx 1.0 . 4.58 3358 2429 A 79 LYS HBy A 82 ASP HBy 1.0 . 4.58 3359 2430 A 79 LYS HDx A 79 LYS HGx 1.0 . 2.29 3360 2430 A 79 LYS HGy A 79 LYS HDx 1.0 . 2.29 3361 2430 A 79 LYS HDy A 79 LYS HGy 1.0 . 2.29 3362 2430 A 79 LYS HDy A 79 LYS HGx 1.0 . 2.29 3363 2431 A 79 LYS HEx A 79 LYS HGx 1.0 . 3.03 3364 2431 A 79 LYS HGy A 79 LYS HEx 1.0 . 3.03 3365 2431 A 79 LYS HEy A 79 LYS HGy 1.0 . 3.03 3366 2431 A 79 LYS HEy A 79 LYS HGx 1.0 . 3.03 3367 2432 A 80 ILE H A 80 ILE HG1x 1.0 . 3.59 3368 2432 A 80 ILE H A 80 ILE HG1y 1.0 . 3.59 3369 2433 A 80 ILE HA A 80 ILE HG1x 1.0 . 3.66 3370 2433 A 80 ILE HA A 80 ILE HG1y 1.0 . 3.66 3371 2434 A 80 ILE HA A 83 GLU HGx 1.0 . 5.19 3372 2434 A 80 ILE HA A 83 GLU HGy 1.0 . 5.19 3373 2435 A 80 ILE HG2% A 80 ILE HG1x 1.0 . 3.01 3374 2435 A 80 ILE HG2% A 80 ILE HG1y 1.0 . 3.01 3375 2436 A 80 ILE HG2% A 84 PHE HBx 1.0 . 3.87 3376 2436 A 80 ILE HG2% A 84 PHE HBy 1.0 . 3.87 3377 2437 A 84 PHE HD% A 80 ILE HG1x 1.0 . 4.98 3378 2437 A 84 PHE HD% A 80 ILE HG1y 1.0 . 4.98 3379 2438 A 81 ILE HA A 86 ILE HG1x 1.0 . 4.67 3380 2438 A 81 ILE HA A 86 ILE HG1y 1.0 . 4.67 3381 2439 A 81 ILE HG2% A 86 ILE HG1x 1.0 . 4.30 3382 2439 A 81 ILE HG2% A 86 ILE HG1y 1.0 . 4.30 3383 2440 A 81 ILE HD1% A 86 ILE HG1x 1.0 . 5.25 3384 2440 A 81 ILE HD1% A 86 ILE HG1y 1.0 . 5.25 3385 2441 A 82 ASP H A 82 ASP HBx 1.0 . 2.99 3386 2441 A 82 ASP H A 82 ASP HBy 1.0 . 2.99 3387 2442 A 83 GLU H A 82 ASP HBx 1.0 . 3.46 3388 2442 A 83 GLU H A 82 ASP HBy 1.0 . 3.46 3389 2443 A 83 GLU H A 83 GLU HGx 1.0 . 3.21 3390 2443 A 83 GLU H A 83 GLU HGy 1.0 . 3.21 3391 2444 A 83 GLU HA A 83 GLU HGx 1.0 . 3.11 3392 2444 A 83 GLU HA A 83 GLU HGy 1.0 . 3.11 3393 2445 A 83 GLU HBy A 83 GLU HGx 1.0 . 2.58 3394 2445 A 83 GLU HBy A 83 GLU HGy 1.0 . 2.58 3395 2446 A 84 PHE HD% A 83 GLU HGx 1.0 . 4.76 3396 2446 A 84 PHE HD% A 83 GLU HGy 1.0 . 4.76 3397 2447 A 84 PHE HE% A 83 GLU HGx 1.0 . 5.34 3398 2447 A 84 PHE HE% A 83 GLU HGy 1.0 . 5.34 3399 2448 A 84 PHE H A 84 PHE HBx 1.0 . 3.31 3400 2448 A 84 PHE H A 84 PHE HBy 1.0 . 3.31 3401 2449 A 85 LYS H A 84 PHE HBx 1.0 . 4.00 3402 2449 A 85 LYS H A 84 PHE HBy 1.0 . 4.00 3403 2450 A 86 ILE H A 84 PHE HBx 1.0 . 4.66 3404 2450 A 86 ILE H A 84 PHE HBy 1.0 . 4.66 3405 2451 A 84 PHE HBy A 86 ILE HG1x 1.0 . 4.20 3406 2451 A 84 PHE HBx A 86 ILE HG1x 1.0 . 4.20 3407 2451 A 86 ILE HG1y A 84 PHE HBx 1.0 . 4.20 3408 2451 A 86 ILE HG1y A 84 PHE HBy 1.0 . 4.20 3409 2452 A 86 ILE HD1% A 84 PHE HBx 1.0 . 4.13 3410 2452 A 86 ILE HD1% A 84 PHE HBy 1.0 . 4.13 3411 2453 A 84 PHE HD% A 86 ILE HG1x 1.0 . 4.87 3412 2453 A 84 PHE HD% A 86 ILE HG1y 1.0 . 4.87 3413 2454 A 85 LYS H A 85 LYS HBy 1.0 . 3.61 3414 2454 A 85 LYS H A 85 LYS HBx 1.0 . 3.61 3415 2455 A 85 LYS HA A 85 LYS HDy 1.0 . 3.43 3416 2455 A 85 LYS HA A 85 LYS HDx 1.0 . 3.43 3417 2456 A 85 LYS HBx A 85 LYS HDy 1.0 . 2.69 3418 2456 A 85 LYS HBy A 85 LYS HDy 1.0 . 2.69 3419 2456 A 85 LYS HDx A 85 LYS HBy 1.0 . 2.69 3420 2456 A 85 LYS HBx A 85 LYS HDx 1.0 . 2.69 3421 2457 A 87 PRO HDx A 86 ILE HG1x 1.0 . 5.34 3422 2457 A 87 PRO HDx A 86 ILE HG1y 1.0 . 5.34 3423 2458 A 87 PRO HGy A 92 TRP HBx 1.0 . 4.63 3424 2458 A 87 PRO HGy A 92 TRP HBy 1.0 . 4.63 3425 2459 A 88 THR HA A 89 VAL HGx% 1.0 . 4.72 3426 2459 A 88 THR HA A 89 VAL HGy% 1.0 . 4.72 3427 2460 A 88 THR HG2% A 89 VAL HGx% 1.0 . 3.58 3428 2460 A 88 THR HG2% A 89 VAL HGy% 1.0 . 3.58 3429 2461 A 89 VAL H A 89 VAL HGx% 1.0 . 3.23 3430 2461 A 89 VAL H A 89 VAL HGy% 1.0 . 3.23 3431 2462 A 89 VAL HA A 89 VAL HGx% 1.0 . 3.04 3432 2462 A 89 VAL HA A 89 VAL HGy% 1.0 . 3.04 3433 2463 A 89 VAL HA A 92 TRP HBx 1.0 . 3.87 3434 2463 A 89 VAL HA A 92 TRP HBy 1.0 . 3.87 3435 2464 A 90 GLU H A 89 VAL HGx% 1.0 . 3.91 3436 2464 A 90 GLU H A 89 VAL HGy% 1.0 . 3.91 3437 2465 A 90 GLU HA A 89 VAL HGx% 1.0 . 3.79 3438 2465 A 90 GLU HA A 89 VAL HGy% 1.0 . 3.79 3439 2466 A 89 VAL HGy% A 90 GLU HGx 1.0 . 4.12 3440 2466 A 89 VAL HGx% A 90 GLU HGx 1.0 . 4.12 3441 2466 A 90 GLU HGy A 89 VAL HGx% 1.0 . 4.12 3442 2466 A 89 VAL HGy% A 90 GLU HGy 1.0 . 4.12 3443 2467 A 89 VAL HGy% A 92 TRP HBx 1.0 . 5.28 3444 2467 A 92 TRP HBy A 89 VAL HGx% 1.0 . 5.28 3445 2467 A 89 VAL HGy% A 92 TRP HBy 1.0 . 5.28 3446 2467 A 89 VAL HGx% A 92 TRP HBx 1.0 . 5.28 3447 2468 A 92 TRP HE3 A 89 VAL HGx% 1.0 . 3.68 3448 2468 A 92 TRP HE3 A 89 VAL HGy% 1.0 . 3.68 3449 2469 A 92 TRP HZ3 A 89 VAL HGx% 1.0 . 4.86 3450 2469 A 92 TRP HZ3 A 89 VAL HGy% 1.0 . 4.86 3451 2470 A 93 LYS H A 89 VAL HGx% 1.0 . 4.54 3452 2470 A 93 LYS H A 89 VAL HGy% 1.0 . 4.54 3453 2471 A 89 VAL HGx% A 93 LYS HGx 1.0 . 3.28 3454 2471 A 89 VAL HGy% A 93 LYS HGx 1.0 . 3.28 3455 2471 A 93 LYS HGy A 89 VAL HGx% 1.0 . 3.28 3456 2471 A 89 VAL HGy% A 93 LYS HGy 1.0 . 3.28 3457 2472 A 89 VAL HGy% A 93 LYS HDy 1.0 . 3.27 3458 2472 A 89 VAL HGx% A 93 LYS HDy 1.0 . 3.27 3459 2472 A 93 LYS HDx A 89 VAL HGx% 1.0 . 3.27 3460 2472 A 89 VAL HGy% A 93 LYS HDx 1.0 . 3.27 3461 2473 A 89 VAL HGy% A 93 LYS HEx 1.0 . 3.48 3462 2473 A 89 VAL HGx% A 93 LYS HEx 1.0 . 3.48 3463 2473 A 93 LYS HEy A 89 VAL HGx% 1.0 . 3.48 3464 2473 A 93 LYS HEy A 89 VAL HGy% 1.0 . 3.48 3465 2474 A 89 VAL HGx% B -9 GLY HAy 1.0 . 5.28 3466 2474 A 89 VAL HGy% B -9 GLY HAy 1.0 . 5.28 3467 2474 B -9 GLY HAx A 89 VAL HGx% 1.0 . 5.28 3468 2474 A 89 VAL HGy% B -9 GLY HAx 1.0 . 5.28 3469 2475 B -7 PHE HA A 89 VAL HGx% 1.0 . 5.44 3470 2475 A 89 VAL HGy% B -7 PHE HA 1.0 . 5.44 3471 2476 A 89 VAL HGy% B -7 PHE HBx 1.0 . 3.27 3472 2476 A 89 VAL HGx% B -7 PHE HBx 1.0 . 3.27 3473 2476 B -7 PHE HBy A 89 VAL HGx% 1.0 . 3.27 3474 2476 B -7 PHE HBy A 89 VAL HGy% 1.0 . 3.27 3475 2477 B -7 PHE HD% A 89 VAL HGx% 1.0 . 4.64 3476 2477 B -7 PHE HD% A 89 VAL HGy% 1.0 . 4.64 3477 2478 B -6 ILE HA A 89 VAL HGx% 1.0 . 3.80 3478 2478 B -6 ILE HA A 89 VAL HGy% 1.0 . 3.80 3479 2479 B -6 ILE HD1% A 89 VAL HGx% 1.0 . 3.08 3480 2479 B -6 ILE HD1% A 89 VAL HGy% 1.0 . 3.08 3481 2480 B -5 PRO HGy A 89 VAL HGx% 1.0 . 4.62 3482 2480 B -5 PRO HGy A 89 VAL HGy% 1.0 . 4.62 3483 2481 A 89 VAL HGy% B -5 PRO HDx 1.0 . 4.03 3484 2481 A 89 VAL HGx% B -5 PRO HDx 1.0 . 4.03 3485 2481 B -5 PRO HDy A 89 VAL HGx% 1.0 . 4.03 3486 2481 B -5 PRO HDy A 89 VAL HGy% 1.0 . 4.03 3487 2482 A 90 GLU H A 90 GLU HGx 1.0 . 3.43 3488 2482 A 90 GLU H A 90 GLU HGy 1.0 . 3.43 3489 2483 A 90 GLU HA A 90 GLU HGx 1.0 . 3.21 3490 2483 A 90 GLU HA A 90 GLU HGy 1.0 . 3.21 3491 2484 A 90 GLU HA A 93 LYS HBy 1.0 . 3.72 3492 2484 A 90 GLU HA A 93 LYS HBx 1.0 . 3.72 3493 2485 A 90 GLU HA A 93 LYS HGx 1.0 . 4.79 3494 2485 A 90 GLU HA A 93 LYS HGy 1.0 . 4.79 3495 2486 B -6 ILE HD1% A 90 GLU HGx 1.0 . 3.30 3496 2486 B -6 ILE HD1% A 90 GLU HGy 1.0 . 3.30 3497 2487 A 92 TRP H A 93 LYS HGx 1.0 . 5.34 3498 2487 A 92 TRP H A 93 LYS HGy 1.0 . 5.34 3499 2488 A 92 TRP HBx A 95 GLN HBx 1.0 . 5.34 3500 2488 A 92 TRP HBy A 95 GLN HBx 1.0 . 5.34 3501 2488 A 95 GLN HBy A 92 TRP HBx 1.0 . 5.34 3502 2488 A 95 GLN HBy A 92 TRP HBy 1.0 . 5.34 3503 2489 A 93 LYS H A 93 LYS HGx 1.0 . 3.83 3504 2489 A 93 LYS H A 93 LYS HGy 1.0 . 3.83 3505 2490 A 93 LYS HA A 93 LYS HDy 1.0 . 4.51 3506 2490 A 93 LYS HA A 93 LYS HDx 1.0 . 4.51 3507 2491 A 93 LYS HA A 97 ARG HGy 1.0 . 4.35 3508 2491 A 93 LYS HA A 97 ARG HGx 1.0 . 4.35 3509 2492 A 93 LYS HBy A 93 LYS HEx 1.0 . 3.70 3510 2492 A 93 LYS HBx A 93 LYS HEx 1.0 . 3.70 3511 2492 A 93 LYS HEy A 93 LYS HBy 1.0 . 3.70 3512 2492 A 93 LYS HEy A 93 LYS HBx 1.0 . 3.70 3513 2493 A 94 ASP H A 93 LYS HBy 1.0 . 3.55 3514 2493 A 94 ASP H A 93 LYS HBx 1.0 . 3.55 3515 2494 A 93 LYS HEx A 93 LYS HGx 1.0 . 3.26 3516 2494 A 93 LYS HEy A 93 LYS HGx 1.0 . 3.26 3517 2494 A 93 LYS HGy A 93 LYS HEx 1.0 . 3.26 3518 2494 A 93 LYS HEy A 93 LYS HGy 1.0 . 3.26 3519 2495 A 93 LYS HDx B -7 PHE HBx 1.0 . 4.25 3520 2495 B -7 PHE HBy A 93 LYS HDy 1.0 . 4.25 3521 2495 B -7 PHE HBy A 93 LYS HDx 1.0 . 4.25 3522 2495 A 93 LYS HDy B -7 PHE HBx 1.0 . 4.25 3523 2496 B -7 PHE HD% A 93 LYS HDy 1.0 . 3.57 3524 2496 B -7 PHE HD% A 93 LYS HDx 1.0 . 3.57 3525 2497 B -6 ILE HD1% A 93 LYS HDy 1.0 . 4.58 3526 2497 B -6 ILE HD1% A 93 LYS HDx 1.0 . 4.58 3527 2498 A 94 ASP HBy A 95 GLN HGx 1.0 . 4.17 3528 2498 A 95 GLN HGy A 94 ASP HBx 1.0 . 4.17 3529 2498 A 94 ASP HBy A 95 GLN HGy 1.0 . 4.17 3530 2498 A 94 ASP HBx A 95 GLN HGx 1.0 . 4.17 3531 2499 A 95 GLN H A 95 GLN HGx 1.0 . 3.40 3532 2499 A 95 GLN H A 95 GLN HGy 1.0 . 3.40 3533 2500 A 95 GLN HA A 95 GLN HGx 1.0 . 3.28 3534 2500 A 95 GLN HA A 95 GLN HGy 1.0 . 3.28 3535 2501 A 95 GLN HA A 95 GLN HE2x 1.0 . 4.95 3536 2501 A 95 GLN HA A 95 GLN HE2y 1.0 . 4.95 3537 2502 A 95 GLN HA A 98 ARG HGy 1.0 . 4.10 3538 2502 A 95 GLN HA A 98 ARG HGx 1.0 . 4.10 3539 2503 A 95 GLN HA A 98 ARG HDx 1.0 . 4.56 3540 2503 A 95 GLN HA A 98 ARG HDy 1.0 . 4.56 3541 2504 A 95 GLN HBx A 95 GLN HE2x 1.0 . 4.08 3542 2504 A 95 GLN HBy A 95 GLN HE2x 1.0 . 4.08 3543 2504 A 95 GLN HE2y A 95 GLN HBx 1.0 . 4.08 3544 2504 A 95 GLN HBy A 95 GLN HE2y 1.0 . 4.08 3545 2505 A 95 GLN HE2y A 95 GLN HGx 1.0 . 3.01 3546 2505 A 95 GLN HE2x A 95 GLN HGx 1.0 . 3.01 3547 2505 A 95 GLN HGy A 95 GLN HE2x 1.0 . 3.01 3548 2505 A 95 GLN HGy A 95 GLN HE2y 1.0 . 3.01 3549 2506 A 96 THR HG2% A 100 LYS HGx 1.0 . 5.17 3550 2506 A 96 THR HG2% A 100 LYS HGy 1.0 . 5.17 3551 2507 A 97 ARG H A 97 ARG HGy 1.0 . 3.45 3552 2507 A 97 ARG H A 97 ARG HGx 1.0 . 3.45 3553 2508 A 97 ARG HA A 97 ARG HGy 1.0 . 3.39 3554 2508 A 97 ARG HA A 97 ARG HGx 1.0 . 3.39 3555 2509 A 98 ARG HA A 98 ARG HGy 1.0 . 3.45 3556 2509 A 98 ARG HA A 98 ARG HGx 1.0 . 3.45 3557 2510 A 98 ARG HA A 98 ARG HDx 1.0 . 4.33 3558 2510 A 98 ARG HA A 98 ARG HDy 1.0 . 4.33 3559 2511 A 98 ARG HA A 101 GLU HBy 1.0 . 3.93 3560 2511 A 98 ARG HA A 101 GLU HBx 1.0 . 3.93 3561 2512 A 98 ARG HA A 101 GLU HGx 1.0 . 4.37 3562 2512 A 98 ARG HA A 101 GLU HGy 1.0 . 4.37 3563 2513 A 98 ARG HBx A 98 ARG HDx 1.0 . 3.05 3564 2513 A 98 ARG HBy A 98 ARG HDx 1.0 . 3.05 3565 2513 A 98 ARG HDy A 98 ARG HBx 1.0 . 3.05 3566 2513 A 98 ARG HBy A 98 ARG HDy 1.0 . 3.05 3567 2514 A 99 TYR HD% A 100 LYS HGx 1.0 . 4.48 3568 2514 A 99 TYR HD% A 100 LYS HGy 1.0 . 4.48 3569 2515 A 100 LYS HA A 100 LYS HGx 1.0 . 3.21 3570 2515 A 100 LYS HA A 100 LYS HGy 1.0 . 3.21 3571 2516 A 100 LYS HEy A 100 LYS HGx 1.0 . 2.98 3572 2516 A 100 LYS HGy A 100 LYS HEx 1.0 . 2.98 3573 2516 A 100 LYS HEy A 100 LYS HGy 1.0 . 2.98 3574 2516 A 100 LYS HEx A 100 LYS HGx 1.0 . 2.98 3575 2517 A 101 GLU H A 101 GLU HBy 1.0 . 3.15 3576 2517 A 101 GLU H A 101 GLU HBx 1.0 . 3.15 3577 2518 A 101 GLU H A 101 GLU HGx 1.0 . 3.61 3578 2518 A 101 GLU H A 101 GLU HGy 1.0 . 3.61 3579 2519 A 103 SER HA A 104 ILE HG1x 1.0 . 4.41 3580 2519 A 103 SER HA A 104 ILE HG1y 1.0 . 4.41 3581 2520 A 103 SER HBx A 104 ILE HG1x 1.0 . 4.48 3582 2520 A 103 SER HBy A 104 ILE HG1x 1.0 . 4.48 3583 2520 A 104 ILE HG1y A 103 SER HBx 1.0 . 4.48 3584 2520 A 103 SER HBy A 104 ILE HG1y 1.0 . 4.48 3585 2521 A 104 ILE HA A 104 ILE HG1x 1.0 . 3.48 3586 2521 A 104 ILE HA A 104 ILE HG1y 1.0 . 3.48 3587 2522 A 104 ILE HB A 105 GLN HBy 1.0 . 5.06 3588 2522 A 104 ILE HB A 105 GLN HBx 1.0 . 5.06 3589 2523 A 104 ILE HG2% A 104 ILE HG1x 1.0 . 3.08 3590 2523 A 104 ILE HG2% A 104 ILE HG1y 1.0 . 3.08 3591 2524 A 106 ILE HD1% A 105 GLN HBy 1.0 . 4.54 3592 2524 A 106 ILE HD1% A 105 GLN HBx 1.0 . 4.54 3593 2525 A 106 ILE H A 106 ILE HG1x 1.0 . 3.73 3594 2525 A 106 ILE H A 106 ILE HG1y 1.0 . 3.73 3595 2526 A 108 ASN H A 108 ASN HBx 1.0 . 3.63 3596 2526 A 108 ASN H A 108 ASN HBy 1.0 . 3.63 3597 2527 A 110 HIS HA A 110 HIS HBy 1.0 . 2.47 3598 2527 A 110 HIS HA A 110 HIS HBx 1.0 . 2.47 3599 2528 A 110 HIS HD2 A 110 HIS HBy 1.0 . 3.05 3600 2528 A 110 HIS HD2 A 110 HIS HBx 1.0 . 3.05 3601 2529 A 113 SER HA A 114 GLN HBy 1.0 . 4.62 3602 2529 A 113 SER HA A 114 GLN HBx 1.0 . 4.62 3603 2530 A 113 SER HBy A 114 GLN HBy 1.0 . 4.71 3604 2530 A 114 GLN HBx A 113 SER HBx 1.0 . 4.71 3605 2530 A 113 SER HBy A 114 GLN HBx 1.0 . 4.71 3606 2530 A 113 SER HBx A 114 GLN HBy 1.0 . 4.71 3607 2531 A 116 LEU HG A 114 GLN HBy 1.0 . 5.34 3608 2531 A 116 LEU HG A 114 GLN HBx 1.0 . 5.34 3609 2532 A 114 GLN HBx A 116 LEU HDy% 1.0 . 4.08 3610 2532 A 114 GLN HBy A 116 LEU HDy% 1.0 . 4.08 3611 2532 A 116 LEU HDx% A 114 GLN HBy 1.0 . 4.08 3612 2532 A 114 GLN HBx A 116 LEU HDx% 1.0 . 4.08 3613 2533 A 114 GLN HGy A 116 LEU HDy% 1.0 . 4.62 3614 2533 A 114 GLN HGx A 116 LEU HDy% 1.0 . 4.62 3615 2533 A 116 LEU HDx% A 114 GLN HGx 1.0 . 4.62 3616 2533 A 114 GLN HGy A 116 LEU HDx% 1.0 . 4.62 3617 2534 A 115 GLY HAx A 116 LEU HDy% 1.0 . 4.53 3618 2534 A 115 GLY HAy A 116 LEU HDy% 1.0 . 4.53 3619 2534 A 116 LEU HDx% A 115 GLY HAx 1.0 . 4.53 3620 2534 A 115 GLY HAy A 116 LEU HDx% 1.0 . 4.53 3621 2535 A 116 LEU H A 116 LEU HBy 1.0 . 3.42 3622 2535 A 116 LEU H A 116 LEU HBx 1.0 . 3.42 3623 2536 A 116 LEU HA A 116 LEU HDy% 1.0 . 3.45 3624 2536 A 116 LEU HA A 116 LEU HDx% 1.0 . 3.45 3625 2537 A 117 GLU H A 116 LEU HBy 1.0 . 3.94 3626 2537 A 117 GLU H A 116 LEU HBx 1.0 . 3.94 3627 2538 A 116 LEU HDy% A 117 GLU HBy 1.0 . 4.81 3628 2538 A 117 GLU HBx A 116 LEU HDy% 1.0 . 4.81 3629 2538 A 116 LEU HDx% A 117 GLU HBx 1.0 . 4.81 3630 2538 A 116 LEU HDx% A 117 GLU HBy 1.0 . 4.81 3631 2539 A 117 GLU H A 117 GLU HGx 1.0 . 4.25 3632 2539 A 117 GLU H A 117 GLU HGy 1.0 . 4.25 3633 2540 A 117 GLU HBy A 117 GLU HGx 1.0 . 2.36 3634 2540 A 117 GLU HBx A 117 GLU HGx 1.0 . 2.36 3635 2540 A 117 GLU HGy A 117 GLU HBy 1.0 . 2.36 3636 2540 A 117 GLU HBx A 117 GLU HGy 1.0 . 2.36 3637 2541 B -7 PHE HE% B -8 LYS HEx 1.0 . 4.37 3638 2541 B -7 PHE HE% B -8 LYS HEy 1.0 . 4.37 3639 2542 B -7 PHE HZ B -8 LYS HEx 1.0 . 5.19 3640 2542 B -7 PHE HZ B -8 LYS HEy 1.0 . 5.19 3641 2543 B -1 ALA H B -2 PRO HBy 1.0 . 3.71 3642 2543 B -1 ALA H B -2 PRO HBx 1.0 . 3.71 3643 2544 B 1 LYS HA B 2 PRO HDx 1.0 . 3.11 3644 2544 B 1 LYS HA B 2 PRO HDy 1.0 . 3.11 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _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 5 VAL H A 56 ARG O 1.0 . 2.0 2 2 A 56 ARG O A 5 VAL N 1.0 . 3.0 3 3 A 56 ARG H A 5 VAL O 1.0 . 2.0 4 4 A 5 VAL O A 56 ARG N 1.0 . 3.0 5 5 A 4 ALA H A 26 LEU O 1.0 . 2.0 6 6 A 26 LEU O A 4 ALA N 1.0 . 3.0 7 7 A 26 LEU H A 4 ALA O 1.0 . 2.0 8 8 A 4 ALA O A 26 LEU N 1.0 . 3.0 9 9 A 40 LYS H A 27 SER O 1.0 . 2.0 10 10 A 27 SER O A 40 LYS N 1.0 . 3.0 11 11 A 27 SER H A 40 LYS O 1.0 . 2.0 12 12 A 40 LYS O A 27 SER N 1.0 . 3.0 13 13 A 50 VAL H A 37 PHE O 1.0 . 2.0 14 14 A 37 PHE O A 50 VAL N 1.0 . 3.0 15 15 A 37 PHE H A 50 VAL O 1.0 . 2.0 16 16 A 50 VAL O A 37 PHE N 1.0 . 3.0 17 17 A 38 ILE H A 30 ALA O 1.0 . 2.0 18 18 A 30 ALA O A 38 ILE N 1.0 . 3.0 19 19 A 32 TYR H A 36 TRP O 1.0 . 2.0 20 20 A 36 TRP O A 32 TYR N 1.0 . 3.0 21 21 A 79 LYS H A 75 GLU O 1.0 . 2.0 22 22 A 75 GLU O A 79 LYS N 1.0 . 3.0 23 23 A 80 ILE H A 76 GLN O 1.0 . 2.0 24 24 A 76 GLN O A 80 ILE N 1.0 . 3.0 25 25 A 81 ILE H A 77 VAL O 1.0 . 2.0 26 26 A 77 VAL O A 81 ILE N 1.0 . 3.0 27 27 A 82 ASP H A 78 MET O 1.0 . 2.0 28 28 A 78 MET O A 82 ASP N 1.0 . 3.0 29 29 A 94 ASP H A 90 GLU O 1.0 . 2.0 30 30 A 90 GLU O A 94 ASP N 1.0 . 3.0 31 31 A 95 GLN H A 91 GLN O 1.0 . 2.0 32 32 A 91 GLN O A 95 GLN N 1.0 . 3.0 33 33 A 96 THR H A 92 TRP O 1.0 . 2.0 34 34 A 92 TRP O A 96 THR N 1.0 . 3.0 35 35 A 97 ARG H A 93 LYS O 1.0 . 2.0 36 36 A 93 LYS O A 97 ARG N 1.0 . 3.0 37 37 A 98 ARG H A 94 ASP O 1.0 . 2.0 38 38 A 94 ASP O A 98 ARG N 1.0 . 3.0 39 39 A 99 TYR H A 95 GLN O 1.0 . 2.0 40 40 A 95 GLN O A 99 TYR N 1.0 . 3.0 41 41 A 100 LYS H A 96 THR O 1.0 . 2.0 42 42 A 56 ARG O A 5 VAL N 1.0 . 2.7 43 43 A 56 ARG H A 5 VAL O 1.0 . 1.8 44 44 A 5 VAL O A 56 ARG N 1.0 . 2.7 45 45 A 4 ALA H A 26 LEU O 1.0 . 1.8 46 46 A 26 LEU O A 4 ALA N 1.0 . 2.7 47 47 A 26 LEU H A 4 ALA O 1.0 . 1.8 48 48 A 4 ALA O A 26 LEU N 1.0 . 2.7 49 49 A 40 LYS H A 27 SER O 1.0 . 1.8 50 50 A 27 SER O A 40 LYS N 1.0 . 2.7 51 51 A 27 SER H A 40 LYS O 1.0 . 1.8 52 52 A 40 LYS O A 27 SER N 1.0 . 2.7 53 53 A 50 VAL H A 37 PHE O 1.0 . 1.8 54 54 A 37 PHE O A 50 VAL N 1.0 . 2.7 55 55 A 37 PHE H A 50 VAL O 1.0 . 1.8 56 56 A 50 VAL O A 37 PHE N 1.0 . 2.7 57 57 A 38 ILE H A 30 ALA O 1.0 . 1.8 58 58 A 30 ALA O A 38 ILE N 1.0 . 2.7 59 59 A 32 TYR H A 36 TRP O 1.0 . 1.8 60 60 A 36 TRP O A 32 TYR N 1.0 . 2.7 61 61 A 79 LYS H A 75 GLU O 1.0 . 1.8 62 62 A 75 GLU O A 79 LYS N 1.0 . 2.7 63 63 A 80 ILE H A 76 GLN O 1.0 . 1.8 64 64 A 76 GLN O A 80 ILE N 1.0 . 2.7 65 65 A 81 ILE H A 77 VAL O 1.0 . 1.8 66 66 A 77 VAL O A 81 ILE N 1.0 . 2.7 67 67 A 82 ASP H A 78 MET O 1.0 . 1.8 68 68 A 78 MET O A 82 ASP N 1.0 . 2.7 69 69 A 94 ASP H A 90 GLU O 1.0 . 1.8 70 70 A 90 GLU O A 94 ASP N 1.0 . 2.7 71 71 A 95 GLN H A 91 GLN O 1.0 . 1.8 72 72 A 91 GLN O A 95 GLN N 1.0 . 2.7 73 73 A 96 THR H A 92 TRP O 1.0 . 1.8 74 74 A 92 TRP O A 96 THR N 1.0 . 2.7 75 75 A 97 ARG H A 93 LYS O 1.0 . 1.8 76 76 A 93 LYS O A 97 ARG N 1.0 . 2.7 77 77 A 98 ARG H A 94 ASP O 1.0 . 1.8 78 78 A 94 ASP O A 98 ARG N 1.0 . 2.7 79 79 A 99 TYR H A 95 GLN O 1.0 . 1.8 80 80 A 95 GLN O A 99 TYR N 1.0 . 2.7 81 81 A 100 LYS H A 96 THR O 1.0 . 1.8 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A -2 MET C A -1 ALA N A -1 ALA CA A -1 ALA C 1.0 -161.0 -33.0 PHI 2 2 A 1 PRO C A 2 LEU N A 2 LEU CA A 2 LEU C 1.0 -155.0 -67.0 PHI 3 3 A 2 LEU C A 3 PHE N A 3 PHE CA A 3 PHE C 1.0 -155.0 -91.0 PHI 4 4 A 3 PHE C A 4 ALA N A 4 ALA CA A 4 ALA C 1.0 -167.0 -99.0 PHI 5 5 A 4 ALA C A 5 VAL N A 5 VAL CA A 5 VAL C 1.0 -158.0 -98.0 PHI 6 6 A 6 THR C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -118.0 -58.0 PHI 7 7 A 7 LEU C A 8 TYR N A 8 TYR CA A 8 TYR C 1.0 -164.0 -112.0 PHI 8 8 A 8 TYR C A 9 GLU N A 9 GLU CA A 9 GLU C 1.0 -156.0 -80.0 PHI 9 9 A 9 GLU C A 10 PHE N A 10 PHE CA A 10 PHE C 1.0 -130.0 -78.0 PHI 10 10 A 10 PHE C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 -139.0 -79.0 PHI 11 11 A 11 LYS C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -137.0 -41.0 PHI 12 12 A 13 GLU C A 14 ARG N A 14 ARG CA A 14 ARG C 1.0 -172.0 -56.0 PHI 13 13 A 14 ARG C A 15 ASP N A 15 ASP CA A 15 ASP C 1.0 -74.0 -46.0 PHI 14 14 A 17 GLU C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -164.0 -68.0 PHI 15 15 A 18 LEU C A 19 ASP N A 19 ASP CA A 19 ASP C 1.0 -140.0 -48.0 PHI 16 16 A 19 ASP C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -153.0 -117.0 PHI 17 17 A 20 VAL C A 21 SER N A 21 SER CA A 21 SER C 1.0 -161.0 -65.0 PHI 18 18 A 22 PRO C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 77.0 109.0 PHI 19 19 A 23 GLY C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -92.0 -52.0 PHI 20 20 A 24 GLU C A 25 ASN N A 25 ASN CA A 25 ASN C 1.0 -135.0 -59.0 PHI 21 21 A 25 ASN C A 26 LEU N A 26 LEU CA A 26 LEU C 1.0 -158.0 -98.0 PHI 22 22 A 26 LEU C A 27 SER N A 27 SER CA A 27 SER C 1.0 -123.0 -75.0 PHI 23 23 A 30 ALA C A 31 HIS N A 31 HIS CA A 31 HIS C 1.0 -172.0 -120.0 PHI 24 24 A 31 HIS C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -163.0 -87.0 PHI 25 25 A 35 GLU C A 36 TRP N A 36 TRP CA A 36 TRP C 1.0 -165.0 -81.0 PHI 26 26 A 36 TRP C A 37 PHE N A 37 PHE CA A 37 PHE C 1.0 -165.0 -85.0 PHI 27 27 A 37 PHE C A 38 ILE N A 38 ILE CA A 38 ILE C 1.0 -142.0 -70.0 PHI 28 28 A 38 ILE C A 39 ALA N A 39 ALA CA A 39 ALA C 1.0 -150.0 -106.0 PHI 29 29 A 39 ALA C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -154.0 -102.0 PHI 30 30 A 41 PRO C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -132.0 -44.0 PHI 31 31 A 48 GLY C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -172.0 -56.0 PHI 32 32 A 49 LEU C A 50 VAL N A 50 VAL CA A 50 VAL C 1.0 -150.0 -126.0 PHI 33 33 A 51 PRO C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -91.0 -31.0 PHI 34 34 A 52 VAL C A 53 SER N A 53 SER CA A 53 SER C 1.0 -98.0 -54.0 PHI 35 35 A 54 TYR C A 55 VAL N A 55 VAL CA A 55 VAL C 1.0 -159.0 -107.0 PHI 36 36 A 55 VAL C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -151.0 -83.0 PHI 37 37 A 56 ARG C A 57 ILE N A 57 ILE CA A 57 ILE C 1.0 -110.0 -58.0 PHI 38 38 A 57 ILE C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -146.0 -98.0 PHI 39 39 A 59 ASP C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -83.0 -47.0 PHI 40 40 A 60 LEU C A 61 MET N A 61 MET CA A 61 MET C 1.0 -93.0 -49.0 PHI 41 41 A 63 PRO C A 64 ALA N A 64 ALA CA A 64 ALA C 1.0 -113.0 -41.0 PHI 42 42 A 64 ALA C A 65 LYS N A 65 LYS CA A 65 LYS C 1.0 -84.0 -40.0 PHI 43 43 A 65 LYS C A 66 TYR N A 66 TYR CA A 66 TYR C 1.0 -121.0 -69.0 PHI 44 44 A 67 ALA C A 68 SER N A 68 SER CA A 68 SER C 1.0 -117.0 -77.0 PHI 45 45 A 68 SER C A 69 VAL N A 69 VAL CA A 69 VAL C 1.0 -138.0 -30.0 PHI 46 46 A 72 TYR C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 -124.0 -64.0 PHI 47 47 A 73 ASP C A 74 ARG N A 74 ARG CA A 74 ARG C 1.0 -66.0 -46.0 PHI 48 48 A 74 ARG C A 75 GLU N A 75 GLU CA A 75 GLU C 1.0 -66.0 -50.0 PHI 49 49 A 75 GLU C A 76 GLN N A 76 GLN CA A 76 GLN C 1.0 -79.0 -51.0 PHI 50 50 A 76 GLN C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -84.0 -52.0 PHI 51 51 A 77 VAL C A 78 MET N A 78 MET CA A 78 MET C 1.0 -66.0 -54.0 PHI 52 52 A 78 MET C A 79 LYS N A 79 LYS CA A 79 LYS C 1.0 -76.0 -48.0 PHI 53 53 A 79 LYS C A 80 ILE N A 80 ILE CA A 80 ILE C 1.0 -80.0 -52.0 PHI 54 54 A 80 ILE C A 81 ILE N A 81 ILE CA A 81 ILE C 1.0 -75.0 -55.0 PHI 55 55 A 81 ILE C A 82 ASP N A 82 ASP CA A 82 ASP C 1.0 -71.0 -59.0 PHI 56 56 A 82 ASP C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -76.0 -52.0 PHI 57 57 A 83 GLU C A 84 PHE N A 84 PHE CA A 84 PHE C 1.0 -112.0 -68.0 PHI 58 58 A 85 LYS C A 86 ILE N A 86 ILE CA A 86 ILE C 1.0 -145.0 -45.0 PHI 59 59 A 88 THR C A 89 VAL N A 89 VAL CA A 89 VAL C 1.0 -70.0 -46.0 PHI 60 60 A 89 VAL C A 90 GLU N A 90 GLU CA A 90 GLU C 1.0 -72.0 -48.0 PHI 61 61 A 90 GLU C A 91 GLN N A 91 GLN CA A 91 GLN C 1.0 -77.0 -57.0 PHI 62 62 A 91 GLN C A 92 TRP N A 92 TRP CA A 92 TRP C 1.0 -77.0 -57.0 PHI 63 63 A 92 TRP C A 93 LYS N A 93 LYS CA A 93 LYS C 1.0 -75.0 -51.0 PHI 64 64 A 93 LYS C A 94 ASP N A 94 ASP CA A 94 ASP C 1.0 -77.0 -49.0 PHI 65 65 A 94 ASP C A 95 GLN N A 95 GLN CA A 95 GLN C 1.0 -77.0 -45.0 PHI 66 66 A 95 GLN C A 96 THR N A 96 THR CA A 96 THR C 1.0 -77.0 -49.0 PHI 67 67 A 96 THR C A 97 ARG N A 97 ARG CA A 97 ARG C 1.0 -73.0 -49.0 PHI 68 68 A 97 ARG C A 98 ARG N A 98 ARG CA A 98 ARG C 1.0 -102.0 -38.0 PHI 69 69 A 98 ARG C A 99 TYR N A 99 TYR CA A 99 TYR C 1.0 -128.0 -28.0 PHI 70 70 A 107 GLY C A 108 ASN N A 108 ASN CA A 108 ASN C 1.0 -120.0 -24.0 PHI 71 71 B 0 PRO C B 1 LYS N B 1 LYS CA B 1 LYS C 1.0 -100.0 -55.0 PHI 72 72 A -1 ALA N A -1 ALA CA A -1 ALA C A 1 PRO N 1.0 64.0 164.0 PSI 73 73 A 2 LEU N A 2 LEU CA A 2 LEU C A 3 PHE N 1.0 100.0 156.0 PSI 74 74 A 3 PHE N A 3 PHE CA A 3 PHE C A 4 ALA N 1.0 140.0 164.0 PSI 75 75 A 4 ALA N A 4 ALA CA A 4 ALA C A 5 VAL N 1.0 130.0 170.0 PSI 76 76 A 5 VAL N A 5 VAL CA A 5 VAL C A 6 THR N 1.0 112.0 184.0 PSI 77 77 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 TYR N 1.0 -72.0 4.0 PSI 78 78 A 8 TYR N A 8 TYR CA A 8 TYR C A 9 GLU N 1.0 112.0 204.0 PSI 79 79 A 9 GLU N A 9 GLU CA A 9 GLU C A 10 PHE N 1.0 105.0 145.0 PSI 80 80 A 10 PHE N A 10 PHE CA A 10 PHE C A 11 LYS N 1.0 100.0 148.0 PSI 81 81 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 ALA N 1.0 86.0 146.0 PSI 82 82 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 GLU N 1.0 113.0 165.0 PSI 83 83 A 14 ARG N A 14 ARG CA A 14 ARG C A 15 ASP N 1.0 126.0 186.0 PSI 84 84 A 15 ASP N A 15 ASP CA A 15 ASP C A 16 ASP N 1.0 -60.0 0.0 PSI 85 85 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 ASP N 1.0 105.0 169.0 PSI 86 86 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 VAL N 1.0 111.0 163.0 PSI 87 87 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 SER N 1.0 135.0 159.0 PSI 88 88 A 21 SER N A 21 SER CA A 21 SER C A 22 PRO N 1.0 86.0 182.0 PSI 89 89 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 GLU N 1.0 -37.0 7.0 PSI 90 90 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 ASN N 1.0 116.0 172.0 PSI 91 91 A 25 ASN N A 25 ASN CA A 25 ASN C A 26 LEU N 1.0 101.0 153.0 PSI 92 92 A 26 LEU N A 26 LEU CA A 26 LEU C A 27 SER N 1.0 142.0 178.0 PSI 93 93 A 27 SER N A 27 SER CA A 27 SER C A 28 ILE N 1.0 113.0 157.0 PSI 94 94 A 31 HIS N A 31 HIS CA A 31 HIS C A 32 TYR N 1.0 130.0 178.0 PSI 95 95 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 ASP N 1.0 101.0 153.0 PSI 96 96 A 36 TRP N A 36 TRP CA A 36 TRP C A 37 PHE N 1.0 136.0 164.0 PSI 97 97 A 37 PHE N A 37 PHE CA A 37 PHE C A 38 ILE N 1.0 120.0 180.0 PSI 98 98 A 38 ILE N A 38 ILE CA A 38 ILE C A 39 ALA N 1.0 96.0 168.0 PSI 99 99 A 39 ALA N A 39 ALA CA A 39 ALA C A 40 LYS N 1.0 135.0 175.0 PSI 100 100 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 PRO N 1.0 115.0 167.0 PSI 101 101 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 ASN N 1.0 -60.0 -8.0 PSI 102 102 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 VAL N 1.0 125.0 161.0 PSI 103 103 A 50 VAL N A 50 VAL CA A 50 VAL C A 51 PRO N 1.0 131.0 175.0 PSI 104 104 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 SER N 1.0 -47.0 -23.0 PSI 105 105 A 53 SER N A 53 SER CA A 53 SER C A 54 TYR N 1.0 -42.0 18.0 PSI 106 106 A 55 VAL N A 55 VAL CA A 55 VAL C A 56 ARG N 1.0 120.0 192.0 PSI 107 107 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 ILE N 1.0 111.0 139.0 PSI 108 108 A 57 ILE N A 57 ILE CA A 57 ILE C A 58 ILE N 1.0 109.0 157.0 PSI 109 109 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 ASP N 1.0 101.0 197.0 PSI 110 110 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 MET N 1.0 -56.0 4.0 PSI 111 111 A 61 MET N A 61 MET CA A 61 MET C A 62 ASP N 1.0 -39.0 5.0 PSI 112 112 A 64 ALA N A 64 ALA CA A 64 ALA C A 65 LYS N 1.0 -63.0 33.0 PSI 113 113 A 65 LYS N A 65 LYS CA A 65 LYS C A 66 TYR N 1.0 -52.0 -12.0 PSI 114 114 A 66 TYR N A 66 TYR CA A 66 TYR C A 67 ALA N 1.0 -17.0 23.0 PSI 115 115 A 68 SER N A 68 SER CA A 68 SER C A 69 VAL N 1.0 -24.0 24.0 PSI 116 116 A 69 VAL N A 69 VAL CA A 69 VAL C A 70 ASP N 1.0 103.0 159.0 PSI 117 117 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 ARG N 1.0 57.0 173.0 PSI 118 118 A 74 ARG N A 74 ARG CA A 74 ARG C A 75 GLU N 1.0 -67.0 -7.0 PSI 119 119 A 75 GLU N A 75 GLU CA A 75 GLU C A 76 GLN N 1.0 -58.0 -26.0 PSI 120 120 A 76 GLN N A 76 GLN CA A 76 GLN C A 77 VAL N 1.0 -59.0 -31.0 PSI 121 121 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 MET N 1.0 -59.0 -31.0 PSI 122 122 A 78 MET N A 78 MET CA A 78 MET C A 79 LYS N 1.0 -57.0 -33.0 PSI 123 123 A 79 LYS N A 79 LYS CA A 79 LYS C A 80 ILE N 1.0 -61.0 -21.0 PSI 124 124 A 80 ILE N A 80 ILE CA A 80 ILE C A 81 ILE N 1.0 -58.0 -34.0 PSI 125 125 A 81 ILE N A 81 ILE CA A 81 ILE C A 82 ASP N 1.0 -50.0 -30.0 PSI 126 126 A 82 ASP N A 82 ASP CA A 82 ASP C A 83 GLU N 1.0 -52.0 -28.0 PSI 127 127 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 PHE N 1.0 -55.0 -11.0 PSI 128 128 A 84 PHE N A 84 PHE CA A 84 PHE C A 85 LYS N 1.0 -28.0 24.0 PSI 129 129 A 86 ILE N A 86 ILE CA A 86 ILE C A 87 PRO N 1.0 78.0 174.0 PSI 130 130 A 89 VAL N A 89 VAL CA A 89 VAL C A 90 GLU N 1.0 -58.0 -22.0 PSI 131 131 A 90 GLU N A 90 GLU CA A 90 GLU C A 91 GLN N 1.0 -52.0 -24.0 PSI 132 132 A 91 GLN N A 91 GLN CA A 91 GLN C A 92 TRP N 1.0 -55.0 -27.0 PSI 133 133 A 92 TRP N A 92 TRP CA A 92 TRP C A 93 LYS N 1.0 -62.0 -26.0 PSI 134 134 A 93 LYS N A 93 LYS CA A 93 LYS C A 94 ASP N 1.0 -55.0 -27.0 PSI 135 135 A 94 ASP N A 94 ASP CA A 94 ASP C A 95 GLN N 1.0 -61.0 -25.0 PSI 136 136 A 95 GLN N A 95 GLN CA A 95 GLN C A 96 THR N 1.0 -64.0 -12.0 PSI 137 137 A 96 THR N A 96 THR CA A 96 THR C A 97 ARG N 1.0 -57.0 -25.0 PSI 138 138 A 97 ARG N A 97 ARG CA A 97 ARG C A 98 ARG N 1.0 -65.0 -17.0 PSI 139 139 A 98 ARG N A 98 ARG CA A 98 ARG C A 99 TYR N 1.0 -64.0 -4.0 PSI 140 140 A 99 TYR N A 99 TYR CA A 99 TYR C A 100 LYS N 1.0 -66.0 2.0 PSI 141 141 A 108 ASN N A 108 ASN CA A 108 ASN C A 109 GLY N 1.0 114.0 150.0 PSI 142 142 B 0 PRO N B 0 PRO CA B 0 PRO C B 1 LYS N 1.0 110.0 180.0 PSI 143 143 B 1 LYS N B 1 LYS CA B 1 LYS C B 2 PRO N 1.0 110.0 180.0 PSI 144 144 B 2 PRO N B 2 PRO CA B 2 PRO C B 3 PRO N 1.0 110.0 180.0 PSI stop_ save_