data_nef_c25324_2mwh save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MWH stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 2 ALA start . . 2 A 3 LEU middle . . 3 A 4 TYR middle . . 4 A 5 ASN middle . . 5 A 6 VAL middle . . 6 A 7 GLU middle . . 7 A 8 ASN middle . . 8 A 9 GLN middle . . 9 A 10 TRP middle . . 10 A 11 GLY middle . false 11 A 12 GLY middle . false 12 A 13 SER middle . . 13 A 14 SER middle . . 14 A 15 ALA middle . . 15 A 16 PRO middle . false 16 A 17 TRP middle . . 17 A 18 ASN middle . . 18 A 19 GLU middle . . 19 A 20 GLY middle . false 20 A 21 GLY middle . false 21 A 22 GLN middle . . 22 A 23 TRP middle . . 23 A 24 GLU middle . . 24 A 25 ILE middle . . 25 A 26 GLY middle . false 26 A 27 SER middle . . 27 A 28 ARG middle . . 28 A 29 SER middle . . 29 A 30 ASP middle . . 30 A 31 GLN middle . . 31 A 32 ASN middle . . 32 A 33 VAL middle . . 33 A 34 VAL middle . . 34 A 35 ALA middle . . 35 A 36 ILE middle . . 36 A 37 ASN middle . . 37 A 38 VAL middle . . 38 A 39 GLU middle . . 39 A 40 SER middle . . 40 A 41 GLY middle . false 41 A 42 ASP middle . . 42 A 43 ASP middle . . 43 A 44 GLY middle . false 44 A 45 GLN middle . . 45 A 46 THR middle . . 46 A 47 LEU middle . . 47 A 48 ASN middle . . 48 A 49 GLY middle . false 49 A 50 THR middle . . 50 A 51 MET middle . . 51 A 52 THR middle . . 52 A 53 TYR middle . . 53 A 54 ALA middle . . 54 A 55 GLY middle . false 55 A 56 GLU middle . . 56 A 57 GLY middle . false 57 A 58 PRO middle . false 58 A 59 ILE middle . . 59 A 60 GLY middle . false 60 A 61 PHE middle . . 61 A 62 ARG middle . . 62 A 63 ALA middle . . 63 A 64 THR middle . . 64 A 65 LEU middle . . 65 A 66 LEU middle . . 66 A 67 GLY middle . false 67 A 68 ASN middle . . 68 A 69 ASN middle . . 69 A 70 SER middle . . 70 A 71 TYR middle . . 71 A 72 GLU middle . . 72 A 73 VAL middle . . 73 A 74 GLU middle . . 74 A 75 ASN middle . . 75 A 76 GLN middle . . 76 A 77 TRP middle . . 77 A 78 GLY middle . false 78 A 79 GLY middle . false 79 A 80 ASP middle . . 80 A 81 SER middle . . 81 A 82 ALA middle . . 82 A 83 PRO middle . false 83 A 84 TRP middle . . 84 A 85 HIS middle . . 85 A 86 SER middle . . 86 A 87 GLY middle . false 87 A 88 GLY middle . false 88 A 89 ASN middle . . 89 A 90 TRP middle . . 90 A 91 ILE middle . . 91 A 92 LEU middle . . 92 A 93 GLY middle . false 93 A 94 SER middle . . 94 A 95 ARG middle . . 95 A 96 GLU middle . . 96 A 97 ASN middle . . 97 A 98 GLN middle . . 98 A 99 ASN middle . . 99 A 100 VAL middle . . 100 A 101 VAL middle . . 101 A 102 ALA middle . . 102 A 103 ILE middle . . 103 A 104 ASN middle . . 104 A 105 VAL middle . . 105 A 106 GLU middle . . 106 A 107 SER middle . . 107 A 108 GLY middle . false 108 A 109 ASP middle . . 109 A 110 ASP middle . . 110 A 111 GLY middle . false 111 A 112 GLN middle . . 112 A 113 THR middle . . 113 A 114 LEU middle . . 114 A 115 ASN middle . . 115 A 116 GLY middle . false 116 A 117 THR middle . . 117 A 118 MET middle . . 118 A 119 THR middle . . 119 A 120 TYR middle . . 120 A 121 ALA middle . . 121 A 122 GLY middle . false 122 A 123 GLU middle . . 123 A 124 GLY middle . false 124 A 125 PRO middle . false 125 A 126 ILE middle . . 126 A 127 GLY middle . false 127 A 128 PHE middle . . 128 A 129 LYS middle . . 129 A 130 GLY middle . false 130 A 131 THR middle . . 131 A 132 LEU middle . . 132 A 133 THR end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 ALA HA H 1 3.978 0.020 A 2 ALA HB% H 1 1.502 0.020 A 2 ALA C C 13 172.190 0.3 A 2 ALA CA C 13 51.103 0.3 A 2 ALA CB C 13 19.865 0.3 A 3 LEU H H 1 8.711 0.020 A 3 LEU HA H 1 5.157 0.020 A 3 LEU HBy H 1 1.547 0.020 A 3 LEU HBx H 1 1.475 0.020 A 3 LEU HDx% H 1 0.896 0.020 A 3 LEU HDy% H 1 0.834 0.020 A 3 LEU HG H 1 1.501 0.020 A 3 LEU C C 13 175.786 0.3 A 3 LEU CA C 13 54.284 0.3 A 3 LEU CB C 13 43.330 0.3 A 3 LEU CD1 C 13 24.157 0.3 A 3 LEU CD2 C 13 24.189 0.3 A 3 LEU CG C 13 26.831 0.3 A 3 LEU N N 15 123.202 0.3 A 4 TYR H H 1 9.142 0.020 A 4 TYR HA H 1 5.024 0.020 A 4 TYR HBy H 1 2.437 0.020 A 4 TYR HBx H 1 2.198 0.020 A 4 TYR HD1 H 1 6.692 0.020 A 4 TYR HD2 H 1 6.692 0.020 A 4 TYR HE1 H 1 6.656 0.020 A 4 TYR HE2 H 1 6.656 0.020 A 4 TYR C C 13 175.953 0.3 A 4 TYR CA C 13 56.377 0.3 A 4 TYR CB C 13 41.655 0.3 A 4 TYR CD1 C 13 131.853 0.3 A 4 TYR CE1 C 13 118.210 0.3 A 4 TYR N N 15 120.906 0.3 A 5 ASN H H 1 8.787 0.020 A 5 ASN HA H 1 5.116 0.020 A 5 ASN HB2 H 1 2.626 0.020 A 5 ASN HB3 H 1 2.626 0.020 A 5 ASN HD21 H 1 7.734 0.020 A 5 ASN HD22 H 1 7.096 0.020 A 5 ASN C C 13 174.953 0.3 A 5 ASN CA C 13 52.947 0.3 A 5 ASN CB C 13 38.891 0.3 A 5 ASN N N 15 120.496 0.3 A 5 ASN ND2 N 15 114.076 0.3 A 6 VAL H H 1 8.806 0.020 A 6 VAL HA H 1 4.362 0.020 A 6 VAL HB H 1 1.269 0.020 A 6 VAL HGx% H 1 -0.298 0.020 A 6 VAL HGy% H 1 -0.383 0.020 A 6 VAL C C 13 174.955 0.3 A 6 VAL CA C 13 61.433 0.3 A 6 VAL CB C 13 33.331 0.3 A 6 VAL CG1 C 13 20.674 0.3 A 6 VAL CG2 C 13 20.616 0.3 A 6 VAL N N 15 127.428 0.3 A 7 GLU H H 1 8.800 0.020 A 7 GLU HA H 1 4.982 0.020 A 7 GLU HB2 H 1 1.684 0.020 A 7 GLU HB3 H 1 1.684 0.020 A 7 GLU HG2 H 1 2.050 0.020 A 7 GLU HG3 H 1 2.050 0.020 A 7 GLU C C 13 174.551 0.3 A 7 GLU CA C 13 53.789 0.3 A 7 GLU CB C 13 34.567 0.3 A 7 GLU CG C 13 35.740 0.3 A 7 GLU N N 15 124.355 0.3 A 8 ASN H H 1 9.320 0.020 A 8 ASN HA H 1 6.041 0.020 A 8 ASN HBy H 1 2.869 0.020 A 8 ASN HBx H 1 2.565 0.020 A 8 ASN HD21 H 1 8.015 0.020 A 8 ASN HD22 H 1 5.804 0.020 A 8 ASN C C 13 172.709 0.3 A 8 ASN CA C 13 51.617 0.3 A 8 ASN CB C 13 45.585 0.3 A 8 ASN N N 15 116.231 0.3 A 8 ASN ND2 N 15 105.455 0.3 A 9 GLN H H 1 6.887 0.020 A 9 GLN HA H 1 4.174 0.020 A 9 GLN HBy H 1 0.831 0.020 A 9 GLN HBx H 1 -0.797 0.020 A 9 GLN HE21 H 1 7.373 0.020 A 9 GLN HE22 H 1 5.876 0.020 A 9 GLN HGy H 1 1.189 0.020 A 9 GLN HGx H 1 1.053 0.020 A 9 GLN C C 13 173.454 0.3 A 9 GLN CA C 13 53.960 0.3 A 9 GLN CB C 13 30.691 0.3 A 9 GLN CG C 13 33.195 0.3 A 9 GLN N N 15 120.762 0.3 A 9 GLN NE2 N 15 113.656 0.3 A 10 TRP H H 1 8.518 0.020 A 10 TRP HA H 1 4.988 0.020 A 10 TRP HBy H 1 3.365 0.020 A 10 TRP HBx H 1 3.237 0.020 A 10 TRP HD1 H 1 7.140 0.020 A 10 TRP HE1 H 1 10.281 0.020 A 10 TRP HE3 H 1 7.446 0.020 A 10 TRP HH2 H 1 7.232 0.020 A 10 TRP HZ2 H 1 7.447 0.020 A 10 TRP HZ3 H 1 7.079 0.020 A 10 TRP C C 13 175.281 0.3 A 10 TRP CA C 13 56.293 0.3 A 10 TRP CB C 13 29.742 0.3 A 10 TRP CD1 C 13 127.037 0.3 A 10 TRP CE3 C 13 120.073 0.3 A 10 TRP CH2 C 13 124.424 0.3 A 10 TRP CZ2 C 13 114.898 0.3 A 10 TRP CZ3 C 13 121.633 0.3 A 10 TRP N N 15 127.775 0.3 A 10 TRP NE1 N 15 130.415 0.3 A 11 GLY H H 1 8.461 0.020 A 11 GLY HAy H 1 4.085 0.020 A 11 GLY HAx H 1 3.773 0.020 A 11 GLY C C 13 174.733 0.3 A 11 GLY CA C 13 44.836 0.3 A 11 GLY N N 15 107.838 0.3 A 12 GLY H H 1 8.138 0.020 A 12 GLY HAy H 1 4.395 0.020 A 12 GLY HAx H 1 3.750 0.020 A 12 GLY C C 13 174.133 0.3 A 12 GLY CA C 13 43.789 0.3 A 12 GLY N N 15 109.696 0.3 A 13 SER H H 1 8.215 0.020 A 13 SER HA H 1 4.092 0.020 A 13 SER HBy H 1 3.972 0.020 A 13 SER HBx H 1 3.898 0.020 A 13 SER C C 13 175.622 0.3 A 13 SER CA C 13 60.494 0.3 A 13 SER CB C 13 63.028 0.3 A 13 SER N N 15 111.308 0.3 A 14 SER H H 1 8.213 0.020 A 14 SER HA H 1 4.566 0.020 A 14 SER HBy H 1 3.910 0.020 A 14 SER HBx H 1 3.850 0.020 A 14 SER C C 13 173.532 0.3 A 14 SER CA C 13 57.317 0.3 A 14 SER CB C 13 63.230 0.3 A 14 SER N N 15 115.290 0.3 A 15 ALA H H 1 7.308 0.020 A 15 ALA HA H 1 4.403 0.020 A 15 ALA HB% H 1 1.244 0.020 A 15 ALA CA C 13 50.464 0.3 A 15 ALA CB C 13 18.229 0.3 A 15 ALA N N 15 126.470 0.3 A 16 PRO HA H 1 4.409 0.020 A 16 PRO HBy H 1 2.299 0.020 A 16 PRO HBx H 1 1.752 0.020 A 16 PRO HDy H 1 3.734 0.020 A 16 PRO HDx H 1 3.531 0.020 A 16 PRO HG2 H 1 1.956 0.020 A 16 PRO HG3 H 1 1.956 0.020 A 16 PRO C C 13 175.627 0.3 A 16 PRO CA C 13 62.392 0.3 A 16 PRO CB C 13 32.137 0.3 A 16 PRO CD C 13 50.071 0.3 A 16 PRO CG C 13 27.240 0.3 A 17 TRP H H 1 8.380 0.020 A 17 TRP HA H 1 4.318 0.020 A 17 TRP HBy H 1 2.974 0.020 A 17 TRP HBx H 1 2.844 0.020 A 17 TRP HD1 H 1 7.224 0.020 A 17 TRP HE1 H 1 10.025 0.020 A 17 TRP HE3 H 1 6.917 0.020 A 17 TRP HH2 H 1 6.970 0.020 A 17 TRP HZ2 H 1 7.369 0.020 A 17 TRP HZ3 H 1 6.602 0.020 A 17 TRP C C 13 175.951 0.3 A 17 TRP CA C 13 56.915 0.3 A 17 TRP CB C 13 29.409 0.3 A 17 TRP CD1 C 13 127.083 0.3 A 17 TRP CE3 C 13 119.113 0.3 A 17 TRP CH2 C 13 123.481 0.3 A 17 TRP CZ2 C 13 115.518 0.3 A 17 TRP CZ3 C 13 121.859 0.3 A 17 TRP N N 15 120.228 0.3 A 17 TRP NE1 N 15 129.795 0.3 A 18 ASN H H 1 9.094 0.020 A 18 ASN HA H 1 5.086 0.020 A 18 ASN HBy H 1 2.743 0.020 A 18 ASN HBx H 1 2.338 0.020 A 18 ASN HD21 H 1 6.448 0.020 A 18 ASN HD22 H 1 6.116 0.020 A 18 ASN C C 13 174.793 0.3 A 18 ASN CA C 13 51.601 0.3 A 18 ASN CB C 13 42.648 0.3 A 18 ASN N N 15 120.663 0.3 A 18 ASN ND2 N 15 113.295 0.3 A 19 GLU H H 1 9.013 0.020 A 19 GLU HA H 1 4.139 0.020 A 19 GLU HB2 H 1 2.230 0.020 A 19 GLU HB3 H 1 2.230 0.020 A 19 GLU HG2 H 1 2.505 0.020 A 19 GLU HG3 H 1 2.505 0.020 A 19 GLU C C 13 176.869 0.3 A 19 GLU CA C 13 58.600 0.3 A 19 GLU CB C 13 29.382 0.3 A 19 GLU CG C 13 35.406 0.3 A 19 GLU N N 15 122.202 0.3 A 20 GLY H H 1 8.926 0.020 A 20 GLY HAy H 1 4.777 0.020 A 20 GLY HAx H 1 3.330 0.020 A 20 GLY C C 13 174.878 0.3 A 20 GLY CA C 13 44.995 0.3 A 20 GLY N N 15 112.893 0.3 A 21 GLY H H 1 8.258 0.020 A 21 GLY HAy H 1 4.529 0.020 A 21 GLY HAx H 1 4.059 0.020 A 21 GLY C C 13 171.623 0.3 A 21 GLY CA C 13 44.398 0.3 A 21 GLY N N 15 110.354 0.3 A 22 GLN H H 1 8.564 0.020 A 22 GLN HA H 1 5.677 0.020 A 22 GLN HBy H 1 2.125 0.020 A 22 GLN HBx H 1 2.015 0.020 A 22 GLN HE21 H 1 7.766 0.020 A 22 GLN HE22 H 1 6.922 0.020 A 22 GLN HGy H 1 2.457 0.020 A 22 GLN HGx H 1 2.378 0.020 A 22 GLN C C 13 175.957 0.3 A 22 GLN CA C 13 54.944 0.3 A 22 GLN CB C 13 31.085 0.3 A 22 GLN CG C 13 34.717 0.3 A 22 GLN N N 15 117.541 0.3 A 22 GLN NE2 N 15 112.588 0.3 A 23 TRP H H 1 9.347 0.020 A 23 TRP HA H 1 5.199 0.020 A 23 TRP HBy H 1 3.933 0.020 A 23 TRP HBx H 1 2.799 0.020 A 23 TRP HD1 H 1 7.015 0.020 A 23 TRP HE1 H 1 9.801 0.020 A 23 TRP HE3 H 1 7.672 0.020 A 23 TRP HH2 H 1 7.185 0.020 A 23 TRP HZ2 H 1 7.730 0.020 A 23 TRP HZ3 H 1 6.891 0.020 A 23 TRP CA C 13 54.531 0.3 A 23 TRP CB C 13 31.683 0.3 A 23 TRP CD1 C 13 125.690 0.3 A 23 TRP CE3 C 13 121.160 0.3 A 23 TRP CH2 C 13 125.701 0.3 A 23 TRP CZ2 C 13 114.262 0.3 A 23 TRP CZ3 C 13 121.201 0.3 A 23 TRP N N 15 127.208 0.3 A 23 TRP NE1 N 15 127.602 0.3 A 24 GLU H H 1 9.296 0.020 A 24 GLU HA H 1 5.508 0.020 A 24 GLU HB2 H 1 2.251 0.020 A 24 GLU HB3 H 1 2.251 0.020 A 24 GLU HG2 H 1 2.147 0.020 A 24 GLU HG3 H 1 2.147 0.020 A 24 GLU C C 13 174.222 0.3 A 24 GLU CA C 13 55.591 0.3 A 24 GLU CB C 13 30.615 0.3 A 24 GLU CG C 13 35.124 0.3 A 24 GLU N N 15 123.504 0.3 A 25 ILE H H 1 8.635 0.020 A 25 ILE HA H 1 3.436 0.020 A 25 ILE HB H 1 1.616 0.020 A 25 ILE HD1% H 1 0.382 0.020 A 25 ILE HG12 H 1 0.902 0.020 A 25 ILE HG13 H 1 0.902 0.020 A 25 ILE HG2% H 1 0.330 0.020 A 25 ILE C C 13 175.790 0.3 A 25 ILE CA C 13 59.627 0.3 A 25 ILE CB C 13 40.952 0.3 A 25 ILE CD1 C 13 12.385 0.3 A 25 ILE CG1 C 13 27.016 0.3 A 25 ILE CG2 C 13 17.185 0.3 A 25 ILE N N 15 123.447 0.3 A 26 GLY H H 1 3.381 0.020 A 26 GLY HAy H 1 4.522 0.020 A 26 GLY HAx H 1 3.268 0.020 A 26 GLY C C 13 172.122 0.3 A 26 GLY CA C 13 44.078 0.3 A 26 GLY N N 15 111.544 0.3 A 27 SER H H 1 8.212 0.020 A 27 SER HA H 1 4.876 0.020 A 27 SER HBy H 1 4.174 0.020 A 27 SER HBx H 1 3.999 0.020 A 27 SER C C 13 174.113 0.3 A 27 SER CA C 13 56.954 0.3 A 27 SER CB C 13 64.554 0.3 A 27 SER N N 15 112.279 0.3 A 28 ARG H H 1 7.849 0.020 A 28 ARG HA H 1 4.763 0.020 A 28 ARG HB2 H 1 1.869 0.020 A 28 ARG HB3 H 1 1.869 0.020 A 28 ARG HD2 H 1 2.681 0.020 A 28 ARG HD3 H 1 2.681 0.020 A 28 ARG HE H 1 6.454 0.020 A 28 ARG HG2 H 1 1.250 0.020 A 28 ARG HG3 H 1 1.250 0.020 A 28 ARG C C 13 176.119 0.3 A 28 ARG CA C 13 55.117 0.3 A 28 ARG CB C 13 31.830 0.3 A 28 ARG CD C 13 43.204 0.3 A 28 ARG CG C 13 26.471 0.3 A 28 ARG N N 15 120.872 0.3 A 28 ARG NE N 15 84.869 0.3 A 29 SER H H 1 8.892 0.020 A 29 SER HA H 1 4.192 0.020 A 29 SER HB2 H 1 3.866 0.020 A 29 SER HB3 H 1 3.866 0.020 A 29 SER C C 13 174.622 0.3 A 29 SER CA C 13 60.072 0.3 A 29 SER CB C 13 62.876 0.3 A 29 SER N N 15 118.985 0.3 A 30 ASP H H 1 8.441 0.020 A 30 ASP HA H 1 4.618 0.020 A 30 ASP HBy H 1 2.738 0.020 A 30 ASP HBx H 1 2.614 0.020 A 30 ASP C C 13 175.101 0.3 A 30 ASP CA C 13 53.052 0.3 A 30 ASP CB C 13 40.523 0.3 A 30 ASP N N 15 117.632 0.3 A 31 GLN H H 1 7.029 0.020 A 31 GLN HA H 1 4.485 0.020 A 31 GLN HBy H 1 1.926 0.020 A 31 GLN HBx H 1 1.564 0.020 A 31 GLN HE21 H 1 7.575 0.020 A 31 GLN HE22 H 1 6.867 0.020 A 31 GLN HG2 H 1 2.277 0.020 A 31 GLN HG3 H 1 2.277 0.020 A 31 GLN C C 13 173.453 0.3 A 31 GLN CA C 13 54.868 0.3 A 31 GLN CB C 13 33.249 0.3 A 31 GLN CG C 13 34.213 0.3 A 31 GLN N N 15 118.273 0.3 A 31 GLN NE2 N 15 112.991 0.3 A 32 ASN H H 1 8.713 0.020 A 32 ASN HA H 1 5.120 0.020 A 32 ASN HBy H 1 2.902 0.020 A 32 ASN HBx H 1 2.692 0.020 A 32 ASN HD21 H 1 7.473 0.020 A 32 ASN HD22 H 1 6.836 0.020 A 32 ASN C C 13 175.198 0.3 A 32 ASN CA C 13 51.869 0.3 A 32 ASN CB C 13 39.630 0.3 A 32 ASN N N 15 120.865 0.3 A 32 ASN ND2 N 15 111.560 0.3 A 33 VAL H H 1 8.542 0.020 A 33 VAL HA H 1 3.705 0.020 A 33 VAL HB H 1 1.714 0.020 A 33 VAL HGx% H 1 0.742 0.020 A 33 VAL HGy% H 1 0.624 0.020 A 33 VAL C C 13 174.950 0.3 A 33 VAL CA C 13 63.847 0.3 A 33 VAL CB C 13 32.350 0.3 A 33 VAL CG1 C 13 23.733 0.3 A 33 VAL CG2 C 13 21.926 0.3 A 33 VAL N N 15 122.111 0.3 A 34 VAL H H 1 8.744 0.020 A 34 VAL HA H 1 4.645 0.020 A 34 VAL HB H 1 2.522 0.020 A 34 VAL HGx% H 1 0.822 0.020 A 34 VAL HGy% H 1 0.651 0.020 A 34 VAL C C 13 175.574 0.3 A 34 VAL CA C 13 59.974 0.3 A 34 VAL CB C 13 33.029 0.3 A 34 VAL CG1 C 13 20.479 0.3 A 34 VAL CG2 C 13 18.170 0.3 A 34 VAL N N 15 113.282 0.3 A 35 ALA H H 1 7.677 0.020 A 35 ALA HA H 1 4.803 0.020 A 35 ALA HB% H 1 1.472 0.020 A 35 ALA C C 13 175.947 0.3 A 35 ALA CA C 13 53.250 0.3 A 35 ALA CB C 13 21.628 0.3 A 35 ALA N N 15 122.102 0.3 A 36 ILE H H 1 8.126 0.020 A 36 ILE HA H 1 4.028 0.020 A 36 ILE HB H 1 1.363 0.020 A 36 ILE HD1% H 1 0.592 0.020 A 36 ILE HG1y H 1 1.236 0.020 A 36 ILE HG1x H 1 0.717 0.020 A 36 ILE HG2% H 1 0.457 0.020 A 36 ILE C C 13 173.116 0.3 A 36 ILE CA C 13 62.182 0.3 A 36 ILE CB C 13 42.485 0.3 A 36 ILE CD1 C 13 14.019 0.3 A 36 ILE CG1 C 13 27.663 0.3 A 36 ILE CG2 C 13 17.891 0.3 A 36 ILE N N 15 118.005 0.3 A 37 ASN H H 1 8.577 0.020 A 37 ASN HA H 1 5.681 0.020 A 37 ASN HBy H 1 2.772 0.020 A 37 ASN HBx H 1 2.580 0.020 A 37 ASN HD21 H 1 7.429 0.020 A 37 ASN HD22 H 1 6.626 0.020 A 37 ASN C C 13 174.854 0.3 A 37 ASN CA C 13 52.530 0.3 A 37 ASN CB C 13 38.853 0.3 A 37 ASN N N 15 125.632 0.3 A 37 ASN ND2 N 15 110.032 0.3 A 38 VAL H H 1 8.874 0.020 A 38 VAL HA H 1 5.203 0.020 A 38 VAL HB H 1 1.571 0.020 A 38 VAL HGx% H 1 0.017 0.020 A 38 VAL HGy% H 1 0.317 0.020 A 38 VAL C C 13 174.854 0.3 A 38 VAL CA C 13 57.980 0.3 A 38 VAL CB C 13 36.044 0.3 A 38 VAL CG1 C 13 21.104 0.3 A 38 VAL CG2 C 13 19.183 0.3 A 38 VAL N N 15 114.223 0.3 A 39 GLU H H 1 8.761 0.020 A 39 GLU HA H 1 5.082 0.020 A 39 GLU HB2 H 1 2.098 0.020 A 39 GLU HB3 H 1 2.098 0.020 A 39 GLU HG2 H 1 2.254 0.020 A 39 GLU HG3 H 1 2.254 0.020 A 39 GLU C C 13 174.548 0.3 A 39 GLU CA C 13 54.993 0.3 A 39 GLU CB C 13 33.578 0.3 A 39 GLU CG C 13 34.529 0.3 A 39 GLU N N 15 118.277 0.3 A 40 SER H H 1 8.500 0.020 A 40 SER HA H 1 5.265 0.020 A 40 SER HBy H 1 4.184 0.020 A 40 SER HBx H 1 3.675 0.020 A 40 SER C C 13 175.783 0.3 A 40 SER CA C 13 55.880 0.3 A 40 SER CB C 13 65.911 0.3 A 40 SER N N 15 114.960 0.3 A 41 GLY H H 1 9.533 0.020 A 41 GLY HAy H 1 4.721 0.020 A 41 GLY HAx H 1 3.714 0.020 A 41 GLY C C 13 174.119 0.3 A 41 GLY CA C 13 44.688 0.3 A 41 GLY N N 15 117.567 0.3 A 42 ASP H H 1 8.644 0.020 A 42 ASP HA H 1 4.800 0.020 A 42 ASP HBy H 1 3.006 0.020 A 42 ASP HBx H 1 2.390 0.020 A 42 ASP C C 13 176.121 0.3 A 42 ASP CA C 13 52.146 0.3 A 42 ASP CB C 13 39.354 0.3 A 42 ASP N N 15 122.141 0.3 A 43 ASP H H 1 9.111 0.020 A 43 ASP HA H 1 4.229 0.020 A 43 ASP HBy H 1 2.969 0.020 A 43 ASP HBx H 1 2.836 0.020 A 43 ASP C C 13 176.018 0.3 A 43 ASP CA C 13 55.249 0.3 A 43 ASP CB C 13 38.559 0.3 A 43 ASP N N 15 116.025 0.3 A 44 GLY H H 1 9.063 0.020 A 44 GLY HAy H 1 4.202 0.020 A 44 GLY HAx H 1 3.621 0.020 A 44 GLY C C 13 173.922 0.3 A 44 GLY CA C 13 45.301 0.3 A 44 GLY N N 15 104.263 0.3 A 45 GLN H H 1 7.356 0.020 A 45 GLN HA H 1 4.086 0.020 A 45 GLN HBy H 1 2.105 0.020 A 45 GLN HBx H 1 2.005 0.020 A 45 GLN HE21 H 1 7.442 0.020 A 45 GLN HE22 H 1 6.798 0.020 A 45 GLN HGy H 1 2.476 0.020 A 45 GLN HGx H 1 2.376 0.020 A 45 GLN C C 13 176.284 0.3 A 45 GLN CA C 13 58.118 0.3 A 45 GLN CB C 13 27.674 0.3 A 45 GLN CG C 13 33.793 0.3 A 45 GLN N N 15 121.691 0.3 A 45 GLN NE2 N 15 112.410 0.3 A 46 THR H H 1 10.123 0.020 A 46 THR HA H 1 5.355 0.020 A 46 THR HB H 1 4.120 0.020 A 46 THR HG2% H 1 1.232 0.020 A 46 THR C C 13 174.451 0.3 A 46 THR CA C 13 59.644 0.3 A 46 THR CB C 13 72.714 0.3 A 46 THR CG2 C 13 22.151 0.3 A 46 THR N N 15 111.843 0.3 A 47 LEU H H 1 8.364 0.020 A 47 LEU HA H 1 4.807 0.020 A 47 LEU HBy H 1 1.412 0.020 A 47 LEU HBx H 1 0.961 0.020 A 47 LEU HDx% H 1 0.134 0.020 A 47 LEU HDy% H 1 0.474 0.020 A 47 LEU HG H 1 1.376 0.020 A 47 LEU C C 13 175.487 0.3 A 47 LEU CA C 13 53.070 0.3 A 47 LEU CB C 13 48.003 0.3 A 47 LEU CD1 C 13 25.317 0.3 A 47 LEU CD2 C 13 23.361 0.3 A 47 LEU CG C 13 26.182 0.3 A 47 LEU N N 15 119.302 0.3 A 48 ASN H H 1 8.748 0.020 A 48 ASN HA H 1 5.729 0.020 A 48 ASN HBy H 1 2.889 0.020 A 48 ASN HBx H 1 2.763 0.020 A 48 ASN HD21 H 1 7.580 0.020 A 48 ASN HD22 H 1 6.870 0.020 A 48 ASN C C 13 174.460 0.3 A 48 ASN CA C 13 52.739 0.3 A 48 ASN CB C 13 43.413 0.3 A 48 ASN N N 15 116.844 0.3 A 48 ASN ND2 N 15 113.524 0.3 A 49 GLY H H 1 8.744 0.020 A 49 GLY HAy H 1 5.223 0.020 A 49 GLY HAx H 1 4.105 0.020 A 49 GLY C C 13 172.126 0.3 A 49 GLY CA C 13 46.491 0.3 A 49 GLY N N 15 109.417 0.3 A 50 THR H H 1 8.799 0.020 A 50 THR HA H 1 5.556 0.020 A 50 THR HB H 1 4.241 0.020 A 50 THR HG2% H 1 1.197 0.020 A 50 THR C C 13 171.790 0.3 A 50 THR CA C 13 59.371 0.3 A 50 THR CB C 13 72.799 0.3 A 50 THR CG2 C 13 20.285 0.3 A 50 THR N N 15 119.162 0.3 A 51 MET H H 1 9.062 0.020 A 51 MET HA H 1 4.886 0.020 A 51 MET HB2 H 1 1.728 0.020 A 51 MET HB3 H 1 1.728 0.020 A 51 MET HE% H 1 1.531 0.020 A 51 MET HGy H 1 2.357 0.020 A 51 MET HGx H 1 2.147 0.020 A 51 MET C C 13 172.708 0.3 A 51 MET CA C 13 54.722 0.3 A 51 MET CB C 13 34.557 0.3 A 51 MET CE C 13 17.861 0.3 A 51 MET CG C 13 30.027 0.3 A 51 MET N N 15 115.232 0.3 A 52 THR H H 1 8.685 0.020 A 52 THR HA H 1 4.682 0.020 A 52 THR HB H 1 3.647 0.020 A 52 THR HG2% H 1 1.023 0.020 A 52 THR C C 13 173.952 0.3 A 52 THR CA C 13 61.395 0.3 A 52 THR CB C 13 71.734 0.3 A 52 THR CG2 C 13 22.587 0.3 A 52 THR N N 15 113.697 0.3 A 53 TYR H H 1 10.112 0.020 A 53 TYR HA H 1 4.800 0.020 A 53 TYR HBy H 1 2.761 0.020 A 53 TYR HBx H 1 2.538 0.020 A 53 TYR HD1 H 1 6.910 0.020 A 53 TYR HD2 H 1 6.910 0.020 A 53 TYR HE1 H 1 7.047 0.020 A 53 TYR HE2 H 1 7.047 0.020 A 53 TYR C C 13 175.214 0.3 A 53 TYR CA C 13 58.881 0.3 A 53 TYR CB C 13 40.512 0.3 A 53 TYR CD1 C 13 132.880 0.3 A 53 TYR CE1 C 13 118.386 0.3 A 53 TYR N N 15 129.086 0.3 A 54 ALA H H 1 8.704 0.020 A 54 ALA HA H 1 4.002 0.020 A 54 ALA HB% H 1 1.417 0.020 A 54 ALA C C 13 178.285 0.3 A 54 ALA CA C 13 53.971 0.3 A 54 ALA CB C 13 18.717 0.3 A 54 ALA N N 15 119.947 0.3 A 55 GLY H H 1 8.745 0.020 A 55 GLY HAy H 1 4.202 0.020 A 55 GLY HAx H 1 3.714 0.020 A 55 GLY C C 13 173.903 0.3 A 55 GLY CA C 13 45.016 0.3 A 55 GLY N N 15 110.940 0.3 A 56 GLU H H 1 8.039 0.020 A 56 GLU HA H 1 4.709 0.020 A 56 GLU HB2 H 1 2.392 0.020 A 56 GLU HB3 H 1 2.392 0.020 A 56 GLU HGy H 1 2.174 0.020 A 56 GLU HGx H 1 1.980 0.020 A 56 GLU C C 13 175.906 0.3 A 56 GLU CA C 13 54.423 0.3 A 56 GLU CB C 13 32.824 0.3 A 56 GLU CG C 13 36.333 0.3 A 56 GLU N N 15 120.073 0.3 A 57 GLY H H 1 7.937 0.020 A 57 GLY HAy H 1 4.557 0.020 A 57 GLY HAx H 1 3.789 0.020 A 57 GLY CA C 13 43.802 0.3 A 57 GLY N N 15 105.298 0.3 A 58 PRO HA H 1 4.934 0.020 A 58 PRO HBy H 1 2.089 0.020 A 58 PRO HBx H 1 1.752 0.020 A 58 PRO HD2 H 1 3.626 0.020 A 58 PRO HD3 H 1 3.626 0.020 A 58 PRO HGy H 1 2.045 0.020 A 58 PRO HGx H 1 1.956 0.020 A 58 PRO C C 13 177.785 0.3 A 58 PRO CA C 13 63.132 0.3 A 58 PRO CB C 13 31.840 0.3 A 58 PRO CD C 13 49.050 0.3 A 58 PRO CG C 13 27.347 0.3 A 59 ILE H H 1 9.600 0.020 A 59 ILE HA H 1 4.988 0.020 A 59 ILE HB H 1 2.323 0.020 A 59 ILE HD1% H 1 1.130 0.020 A 59 ILE HG1y H 1 1.666 0.020 A 59 ILE HG1x H 1 1.414 0.020 A 59 ILE HG2% H 1 1.236 0.020 A 59 ILE C C 13 175.688 0.3 A 59 ILE CA C 13 59.543 0.3 A 59 ILE CB C 13 42.288 0.3 A 59 ILE CD1 C 13 14.144 0.3 A 59 ILE CG1 C 13 24.371 0.3 A 59 ILE CG2 C 13 17.854 0.3 A 59 ILE N N 15 117.386 0.3 A 60 GLY H H 1 8.957 0.020 A 60 GLY HAy H 1 4.457 0.020 A 60 GLY HAx H 1 3.834 0.020 A 60 GLY C C 13 173.787 0.3 A 60 GLY CA C 13 46.235 0.3 A 60 GLY N N 15 107.164 0.3 A 61 PHE H H 1 8.788 0.020 A 61 PHE HA H 1 5.223 0.020 A 61 PHE HBy H 1 2.574 0.020 A 61 PHE HBx H 1 2.330 0.020 A 61 PHE HD1 H 1 6.655 0.020 A 61 PHE HD2 H 1 6.655 0.020 A 61 PHE HE1 H 1 6.242 0.020 A 61 PHE HE2 H 1 6.242 0.020 A 61 PHE HZ H 1 6.055 0.020 A 61 PHE C C 13 173.126 0.3 A 61 PHE CA C 13 56.861 0.3 A 61 PHE CB C 13 43.217 0.3 A 61 PHE CD1 C 13 131.368 0.3 A 61 PHE CE1 C 13 131.651 0.3 A 61 PHE CZ C 13 128.222 0.3 A 61 PHE N N 15 124.597 0.3 A 62 ARG H H 1 8.405 0.020 A 62 ARG HA H 1 5.132 0.020 A 62 ARG HBy H 1 1.487 0.020 A 62 ARG HBx H 1 1.292 0.020 A 62 ARG HD2 H 1 2.086 0.020 A 62 ARG HD3 H 1 2.086 0.020 A 62 ARG HE H 1 6.115 0.020 A 62 ARG HG2 H 1 1.020 0.020 A 62 ARG HG3 H 1 1.020 0.020 A 62 ARG C C 13 172.456 0.3 A 62 ARG CA C 13 54.954 0.3 A 62 ARG CB C 13 32.870 0.3 A 62 ARG CD C 13 42.739 0.3 A 62 ARG CG C 13 25.212 0.3 A 62 ARG N N 15 129.706 0.3 A 62 ARG NE N 15 83.993 0.3 A 63 ALA H H 1 8.628 0.020 A 63 ALA HA H 1 5.345 0.020 A 63 ALA HB% H 1 1.031 0.020 A 63 ALA C C 13 176.120 0.3 A 63 ALA CA C 13 49.919 0.3 A 63 ALA CB C 13 24.773 0.3 A 63 ALA N N 15 122.744 0.3 A 64 THR H H 1 8.315 0.020 A 64 THR HA H 1 4.848 0.020 A 64 THR HB H 1 3.863 0.020 A 64 THR HG2% H 1 1.127 0.020 A 64 THR C C 13 172.957 0.3 A 64 THR CA C 13 61.211 0.3 A 64 THR CB C 13 71.064 0.3 A 64 THR CG2 C 13 20.937 0.3 A 64 THR N N 15 116.855 0.3 A 65 LEU H H 1 8.877 0.020 A 65 LEU HA H 1 3.362 0.020 A 65 LEU HBy H 1 1.782 0.020 A 65 LEU HBx H 1 1.351 0.020 A 65 LEU HDx% H 1 0.736 0.020 A 65 LEU HDy% H 1 0.289 0.020 A 65 LEU HG H 1 1.024 0.020 A 65 LEU C C 13 176.459 0.3 A 65 LEU CA C 13 55.687 0.3 A 65 LEU CB C 13 41.711 0.3 A 65 LEU CD1 C 13 26.429 0.3 A 65 LEU CD2 C 13 20.296 0.3 A 65 LEU CG C 13 26.525 0.3 A 65 LEU N N 15 129.360 0.3 A 66 LEU H H 1 9.320 0.020 A 66 LEU HA H 1 4.376 0.020 A 66 LEU HBy H 1 1.565 0.020 A 66 LEU HBx H 1 1.492 0.020 A 66 LEU HDx% H 1 0.812 0.020 A 66 LEU HDy% H 1 0.759 0.020 A 66 LEU HG H 1 1.626 0.020 A 66 LEU C C 13 177.621 0.3 A 66 LEU CA C 13 54.700 0.3 A 66 LEU CB C 13 42.302 0.3 A 66 LEU CD1 C 13 25.155 0.3 A 66 LEU CD2 C 13 21.686 0.3 A 66 LEU CG C 13 26.494 0.3 A 66 LEU N N 15 128.683 0.3 A 67 GLY H H 1 6.639 0.020 A 67 GLY HAy H 1 4.383 0.020 A 67 GLY HAx H 1 3.625 0.020 A 67 GLY C C 13 173.618 0.3 A 67 GLY CA C 13 43.367 0.3 A 67 GLY N N 15 105.361 0.3 A 68 ASN H H 1 9.236 0.020 A 68 ASN HA H 1 4.331 0.020 A 68 ASN HBy H 1 2.921 0.020 A 68 ASN HBx H 1 2.653 0.020 A 68 ASN HD21 H 1 7.561 0.020 A 68 ASN HD22 H 1 6.858 0.020 A 68 ASN C C 13 174.316 0.3 A 68 ASN CA C 13 54.552 0.3 A 68 ASN CB C 13 37.165 0.3 A 68 ASN N N 15 121.848 0.3 A 68 ASN ND2 N 15 112.658 0.3 A 69 ASN H H 1 8.651 0.020 A 69 ASN HA H 1 4.080 0.020 A 69 ASN HBy H 1 3.082 0.020 A 69 ASN HBx H 1 2.861 0.020 A 69 ASN HD21 H 1 7.209 0.020 A 69 ASN HD22 H 1 6.981 0.020 A 69 ASN C C 13 171.456 0.3 A 69 ASN CA C 13 55.750 0.3 A 69 ASN CB C 13 37.306 0.3 A 69 ASN N N 15 109.509 0.3 A 69 ASN ND2 N 15 112.499 0.3 A 70 SER H H 1 7.693 0.020 A 70 SER HA H 1 5.437 0.020 A 70 SER HBy H 1 3.900 0.020 A 70 SER HBx H 1 3.817 0.020 A 70 SER C C 13 173.750 0.3 A 70 SER CA C 13 57.139 0.3 A 70 SER CB C 13 63.818 0.3 A 70 SER N N 15 113.479 0.3 A 71 TYR H H 1 9.326 0.020 A 71 TYR HA H 1 5.143 0.020 A 71 TYR HB2 H 1 2.404 0.020 A 71 TYR HB3 H 1 2.404 0.020 A 71 TYR CA C 13 56.648 0.3 A 71 TYR CB C 13 42.445 0.3 A 71 TYR N N 15 123.132 0.3 A 72 GLU H H 1 8.624 0.020 A 72 GLU HA H 1 4.806 0.020 A 72 GLU HB2 H 1 2.027 0.020 A 72 GLU HB3 H 1 2.027 0.020 A 72 GLU HG2 H 1 2.150 0.020 A 72 GLU HG3 H 1 2.150 0.020 A 72 GLU C C 13 175.698 0.3 A 72 GLU CA C 13 55.167 0.3 A 72 GLU CB C 13 30.184 0.3 A 72 GLU CG C 13 35.120 0.3 A 72 GLU N N 15 122.396 0.3 A 73 VAL H H 1 8.564 0.020 A 73 VAL HA H 1 4.199 0.020 A 73 VAL HB H 1 1.257 0.020 A 73 VAL HGx% H 1 -0.204 0.020 A 73 VAL HGy% H 1 -0.350 0.020 A 73 VAL C C 13 175.369 0.3 A 73 VAL CA C 13 61.480 0.3 A 73 VAL CB C 13 33.333 0.3 A 73 VAL CG1 C 13 20.898 0.3 A 73 VAL CG2 C 13 20.180 0.3 A 73 VAL N N 15 128.513 0.3 A 74 GLU H H 1 9.011 0.020 A 74 GLU HA H 1 5.087 0.020 A 74 GLU HB2 H 1 1.736 0.020 A 74 GLU HB3 H 1 1.736 0.020 A 74 GLU HG2 H 1 2.073 0.020 A 74 GLU HG3 H 1 2.073 0.020 A 74 GLU C C 13 174.415 0.3 A 74 GLU CA C 13 54.337 0.3 A 74 GLU CB C 13 35.157 0.3 A 74 GLU CG C 13 36.428 0.3 A 74 GLU N N 15 124.842 0.3 A 75 ASN H H 1 9.424 0.020 A 75 ASN HA H 1 6.139 0.020 A 75 ASN HBy H 1 3.111 0.020 A 75 ASN HBx H 1 2.682 0.020 A 75 ASN HD21 H 1 8.019 0.020 A 75 ASN HD22 H 1 5.934 0.020 A 75 ASN C C 13 172.703 0.3 A 75 ASN CA C 13 51.825 0.3 A 75 ASN CB C 13 45.896 0.3 A 75 ASN N N 15 116.136 0.3 A 75 ASN ND2 N 15 105.659 0.3 A 76 GLN H H 1 7.106 0.020 A 76 GLN HA H 1 4.040 0.020 A 76 GLN HBy H 1 0.774 0.020 A 76 GLN HBx H 1 -0.947 0.020 A 76 GLN HE21 H 1 7.415 0.020 A 76 GLN HE22 H 1 5.979 0.020 A 76 GLN HGy H 1 1.180 0.020 A 76 GLN HGx H 1 0.995 0.020 A 76 GLN C C 13 173.113 0.3 A 76 GLN CA C 13 54.223 0.3 A 76 GLN CB C 13 30.348 0.3 A 76 GLN CG C 13 33.051 0.3 A 76 GLN N N 15 120.762 0.3 A 76 GLN NE2 N 15 113.634 0.3 A 77 TRP H H 1 8.181 0.020 A 77 TRP HA H 1 5.152 0.020 A 77 TRP HBy H 1 3.456 0.020 A 77 TRP HBx H 1 3.252 0.020 A 77 TRP HD1 H 1 7.076 0.020 A 77 TRP HE1 H 1 10.144 0.020 A 77 TRP HE3 H 1 7.308 0.020 A 77 TRP HH2 H 1 6.942 0.020 A 77 TRP HZ2 H 1 7.009 0.020 A 77 TRP HZ3 H 1 6.985 0.020 A 77 TRP C C 13 175.502 0.3 A 77 TRP CA C 13 55.764 0.3 A 77 TRP CB C 13 29.999 0.3 A 77 TRP CD1 C 13 127.163 0.3 A 77 TRP CE3 C 13 119.490 0.3 A 77 TRP CH2 C 13 124.200 0.3 A 77 TRP CZ2 C 13 114.171 0.3 A 77 TRP CZ3 C 13 121.193 0.3 A 77 TRP N N 15 125.598 0.3 A 77 TRP NE1 N 15 130.430 0.3 A 78 GLY H H 1 8.778 0.020 A 78 GLY HAy H 1 4.174 0.020 A 78 GLY HAx H 1 3.832 0.020 A 78 GLY C C 13 174.611 0.3 A 78 GLY CA C 13 44.902 0.3 A 78 GLY N N 15 107.901 0.3 A 79 GLY H H 1 8.198 0.020 A 79 GLY HAy H 1 4.396 0.020 A 79 GLY HAx H 1 3.750 0.020 A 79 GLY C C 13 173.782 0.3 A 79 GLY CA C 13 43.793 0.3 A 79 GLY N N 15 109.844 0.3 A 80 ASP H H 1 8.132 0.020 A 80 ASP HA H 1 4.241 0.020 A 80 ASP HB2 H 1 2.685 0.020 A 80 ASP HB3 H 1 2.685 0.020 A 80 ASP C C 13 177.285 0.3 A 80 ASP CA C 13 56.183 0.3 A 80 ASP CB C 13 40.523 0.3 A 80 ASP N N 15 115.837 0.3 A 81 SER H H 1 8.179 0.020 A 81 SER HA H 1 4.513 0.020 A 81 SER HBy H 1 3.919 0.020 A 81 SER HBx H 1 3.850 0.020 A 81 SER C C 13 173.684 0.3 A 81 SER CA C 13 57.232 0.3 A 81 SER CB C 13 63.170 0.3 A 81 SER N N 15 112.690 0.3 A 82 ALA H H 1 7.274 0.020 A 82 ALA HA H 1 4.403 0.020 A 82 ALA HB% H 1 1.242 0.020 A 82 ALA CA C 13 50.466 0.3 A 82 ALA CB C 13 18.198 0.3 A 82 ALA N N 15 126.310 0.3 A 83 PRO HA H 1 4.373 0.020 A 83 PRO HBy H 1 2.192 0.020 A 83 PRO HBx H 1 1.357 0.020 A 83 PRO HDy H 1 3.734 0.020 A 83 PRO HDx H 1 3.531 0.020 A 83 PRO HG2 H 1 1.810 0.020 A 83 PRO HG3 H 1 1.810 0.020 A 83 PRO C C 13 175.378 0.3 A 83 PRO CA C 13 62.327 0.3 A 83 PRO CB C 13 32.164 0.3 A 83 PRO CD C 13 50.071 0.3 A 83 PRO CG C 13 27.223 0.3 A 84 TRP H H 1 8.329 0.020 A 84 TRP HA H 1 4.271 0.020 A 84 TRP HBy H 1 2.838 0.020 A 84 TRP HBx H 1 2.726 0.020 A 84 TRP HD1 H 1 7.133 0.020 A 84 TRP HE1 H 1 9.966 0.020 A 84 TRP HE3 H 1 6.906 0.020 A 84 TRP HH2 H 1 6.971 0.020 A 84 TRP HZ2 H 1 7.333 0.020 A 84 TRP HZ3 H 1 6.640 0.020 A 84 TRP C C 13 176.358 0.3 A 84 TRP CA C 13 56.946 0.3 A 84 TRP CB C 13 29.716 0.3 A 84 TRP CD1 C 13 127.150 0.3 A 84 TRP CE3 C 13 119.003 0.3 A 84 TRP CH2 C 13 123.089 0.3 A 84 TRP CZ2 C 13 115.476 0.3 A 84 TRP CZ3 C 13 121.324 0.3 A 84 TRP N N 15 120.106 0.3 A 84 TRP NE1 N 15 130.657 0.3 A 85 HIS H H 1 9.204 0.020 A 85 HIS HA H 1 4.918 0.020 A 85 HIS HBy H 1 3.301 0.020 A 85 HIS HBx H 1 2.712 0.020 A 85 HIS HD2 H 1 6.182 0.020 A 85 HIS HE1 H 1 8.401 0.020 A 85 HIS C C 13 174.950 0.3 A 85 HIS CA C 13 53.469 0.3 A 85 HIS CB C 13 31.673 0.3 A 85 HIS CD2 C 13 121.226 0.3 A 85 HIS CE1 C 13 135.289 0.3 A 85 HIS N N 15 118.543 0.3 A 86 SER H H 1 9.168 0.020 A 86 SER HA H 1 4.412 0.020 A 86 SER HBy H 1 4.182 0.020 A 86 SER HBx H 1 4.035 0.020 A 86 SER C C 13 175.691 0.3 A 86 SER CA C 13 60.257 0.3 A 86 SER CB C 13 63.015 0.3 A 86 SER N N 15 117.803 0.3 A 87 GLY H H 1 9.284 0.020 A 87 GLY HAy H 1 4.886 0.020 A 87 GLY HAx H 1 3.348 0.020 A 87 GLY C C 13 174.288 0.3 A 87 GLY CA C 13 44.701 0.3 A 87 GLY N N 15 115.773 0.3 A 88 GLY H H 1 8.054 0.020 A 88 GLY HAy H 1 4.528 0.020 A 88 GLY HAx H 1 3.976 0.020 A 88 GLY C C 13 171.120 0.3 A 88 GLY CA C 13 44.594 0.3 A 88 GLY N N 15 109.162 0.3 A 89 ASN H H 1 8.516 0.020 A 89 ASN HA H 1 6.038 0.020 A 89 ASN HBy H 1 2.754 0.020 A 89 ASN HBx H 1 2.710 0.020 A 89 ASN HD21 H 1 7.313 0.020 A 89 ASN HD22 H 1 6.791 0.020 A 89 ASN C C 13 175.287 0.3 A 89 ASN CA C 13 51.865 0.3 A 89 ASN CB C 13 39.605 0.3 A 89 ASN N N 15 117.048 0.3 A 89 ASN ND2 N 15 110.317 0.3 A 90 TRP H H 1 9.282 0.020 A 90 TRP HA H 1 5.253 0.020 A 90 TRP HBy H 1 3.965 0.020 A 90 TRP HBx H 1 2.715 0.020 A 90 TRP HD1 H 1 7.034 0.020 A 90 TRP HE1 H 1 10.005 0.020 A 90 TRP HE3 H 1 7.781 0.020 A 90 TRP HH2 H 1 7.305 0.020 A 90 TRP HZ2 H 1 7.871 0.020 A 90 TRP HZ3 H 1 6.942 0.020 A 90 TRP C C 13 175.278 0.3 A 90 TRP CA C 13 54.268 0.3 A 90 TRP CB C 13 31.958 0.3 A 90 TRP CD1 C 13 126.375 0.3 A 90 TRP CE3 C 13 120.851 0.3 A 90 TRP CH2 C 13 125.214 0.3 A 90 TRP CZ2 C 13 114.237 0.3 A 90 TRP CZ3 C 13 121.774 0.3 A 90 TRP N N 15 125.844 0.3 A 90 TRP NE1 N 15 128.459 0.3 A 91 ILE H H 1 9.318 0.020 A 91 ILE HA H 1 5.446 0.020 A 91 ILE HB H 1 1.960 0.020 A 91 ILE HD1% H 1 0.956 0.020 A 91 ILE HG1y H 1 1.721 0.020 A 91 ILE HG1x H 1 1.255 0.020 A 91 ILE HG2% H 1 1.006 0.020 A 91 ILE C C 13 175.489 0.3 A 91 ILE CA C 13 60.826 0.3 A 91 ILE CB C 13 39.676 0.3 A 91 ILE CD1 C 13 12.629 0.3 A 91 ILE CG1 C 13 26.757 0.3 A 91 ILE CG2 C 13 16.880 0.3 A 91 ILE N N 15 123.134 0.3 A 92 LEU H H 1 8.463 0.020 A 92 LEU HA H 1 3.942 0.020 A 92 LEU HBy H 1 1.716 0.020 A 92 LEU HBx H 1 0.534 0.020 A 92 LEU HDx% H 1 1.269 0.020 A 92 LEU HDy% H 1 0.220 0.020 A 92 LEU HG H 1 1.592 0.020 A 92 LEU C C 13 173.620 0.3 A 92 LEU CA C 13 52.256 0.3 A 92 LEU CB C 13 43.508 0.3 A 92 LEU CD1 C 13 24.675 0.3 A 92 LEU CD2 C 13 24.054 0.3 A 92 LEU CG C 13 25.826 0.3 A 92 LEU N N 15 123.452 0.3 A 93 GLY H H 1 2.937 0.020 A 93 GLY HAy H 1 4.581 0.020 A 93 GLY HAx H 1 3.145 0.020 A 93 GLY C C 13 172.284 0.3 A 93 GLY CA C 13 43.500 0.3 A 93 GLY N N 15 103.987 0.3 A 94 SER H H 1 7.919 0.020 A 94 SER HA H 1 4.711 0.020 A 94 SER HBy H 1 4.133 0.020 A 94 SER HBx H 1 3.913 0.020 A 94 SER C C 13 174.784 0.3 A 94 SER CA C 13 56.555 0.3 A 94 SER CB C 13 65.051 0.3 A 94 SER N N 15 110.274 0.3 A 95 ARG H H 1 9.148 0.020 A 95 ARG HA H 1 4.672 0.020 A 95 ARG HB2 H 1 1.870 0.020 A 95 ARG HB3 H 1 1.870 0.020 A 95 ARG HD2 H 1 2.727 0.020 A 95 ARG HD3 H 1 2.727 0.020 A 95 ARG HE H 1 6.526 0.020 A 95 ARG HGy H 1 1.311 0.020 A 95 ARG HGx H 1 1.256 0.020 A 95 ARG C C 13 176.120 0.3 A 95 ARG CA C 13 55.374 0.3 A 95 ARG CB C 13 31.848 0.3 A 95 ARG CD C 13 43.199 0.3 A 95 ARG CG C 13 27.149 0.3 A 95 ARG N N 15 123.020 0.3 A 95 ARG NE N 15 85.203 0.3 A 96 GLU H H 1 8.610 0.020 A 96 GLU HA H 1 4.282 0.020 A 96 GLU HB2 H 1 1.915 0.020 A 96 GLU HB3 H 1 1.915 0.020 A 96 GLU HGy H 1 2.270 0.020 A 96 GLU HGx H 1 2.206 0.020 A 96 GLU C C 13 176.278 0.3 A 96 GLU CA C 13 56.530 0.3 A 96 GLU CB C 13 30.153 0.3 A 96 GLU CG C 13 35.663 0.3 A 96 GLU N N 15 120.357 0.3 A 97 ASN H H 1 8.533 0.020 A 97 ASN HA H 1 4.612 0.020 A 97 ASN HBy H 1 2.876 0.020 A 97 ASN HBx H 1 2.714 0.020 A 97 ASN HD21 H 1 7.908 0.020 A 97 ASN HD22 H 1 7.208 0.020 A 97 ASN C C 13 173.949 0.3 A 97 ASN CA C 13 53.015 0.3 A 97 ASN CB C 13 38.166 0.3 A 97 ASN N N 15 117.678 0.3 A 97 ASN ND2 N 15 112.703 0.3 A 98 GLN H H 1 7.663 0.020 A 98 GLN HA H 1 4.360 0.020 A 98 GLN HBy H 1 1.847 0.020 A 98 GLN HBx H 1 1.671 0.020 A 98 GLN HE21 H 1 8.067 0.020 A 98 GLN HE22 H 1 7.260 0.020 A 98 GLN HGy H 1 2.398 0.020 A 98 GLN HGx H 1 2.201 0.020 A 98 GLN C C 13 173.116 0.3 A 98 GLN CA C 13 55.628 0.3 A 98 GLN CB C 13 30.869 0.3 A 98 GLN CG C 13 33.733 0.3 A 98 GLN N N 15 118.592 0.3 A 98 GLN NE2 N 15 113.012 0.3 A 99 ASN H H 1 8.759 0.020 A 99 ASN HA H 1 5.135 0.020 A 99 ASN HBy H 1 3.019 0.020 A 99 ASN HBx H 1 2.691 0.020 A 99 ASN HD21 H 1 7.767 0.020 A 99 ASN HD22 H 1 6.933 0.020 A 99 ASN C C 13 175.287 0.3 A 99 ASN CA C 13 52.990 0.3 A 99 ASN CB C 13 40.491 0.3 A 99 ASN N N 15 122.855 0.3 A 99 ASN ND2 N 15 111.036 0.3 A 100 VAL H H 1 8.717 0.020 A 100 VAL HA H 1 3.748 0.020 A 100 VAL HB H 1 1.732 0.020 A 100 VAL HGx% H 1 0.726 0.020 A 100 VAL HGy% H 1 0.683 0.020 A 100 VAL C C 13 174.956 0.3 A 100 VAL CA C 13 63.843 0.3 A 100 VAL CB C 13 32.443 0.3 A 100 VAL CG1 C 13 23.177 0.3 A 100 VAL CG2 C 13 22.069 0.3 A 100 VAL N N 15 121.385 0.3 A 101 VAL H H 1 8.802 0.020 A 101 VAL HA H 1 4.645 0.020 A 101 VAL HB H 1 2.518 0.020 A 101 VAL HGx% H 1 0.820 0.020 A 101 VAL HGy% H 1 0.651 0.020 A 101 VAL C C 13 175.577 0.3 A 101 VAL CA C 13 59.963 0.3 A 101 VAL CB C 13 33.041 0.3 A 101 VAL CG1 C 13 20.464 0.3 A 101 VAL CG2 C 13 18.179 0.3 A 101 VAL N N 15 112.736 0.3 A 102 ALA H H 1 7.677 0.020 A 102 ALA HA H 1 4.807 0.020 A 102 ALA HB% H 1 1.473 0.020 A 102 ALA C C 13 176.046 0.3 A 102 ALA CA C 13 53.254 0.3 A 102 ALA CB C 13 21.625 0.3 A 102 ALA N N 15 122.104 0.3 A 103 ILE H H 1 8.102 0.020 A 103 ILE HA H 1 4.027 0.020 A 103 ILE HB H 1 1.363 0.020 A 103 ILE HD1% H 1 0.660 0.020 A 103 ILE HG1y H 1 1.296 0.020 A 103 ILE HG1x H 1 0.774 0.020 A 103 ILE HG2% H 1 0.455 0.020 A 103 ILE C C 13 173.118 0.3 A 103 ILE CA C 13 62.227 0.3 A 103 ILE CB C 13 42.471 0.3 A 103 ILE CD1 C 13 15.364 0.3 A 103 ILE CG1 C 13 27.750 0.3 A 103 ILE CG2 C 13 17.895 0.3 A 103 ILE N N 15 118.218 0.3 A 104 ASN H H 1 8.668 0.020 A 104 ASN HA H 1 5.686 0.020 A 104 ASN HBy H 1 2.781 0.020 A 104 ASN HBx H 1 2.580 0.020 A 104 ASN HD21 H 1 7.431 0.020 A 104 ASN HD22 H 1 6.628 0.020 A 104 ASN C C 13 174.870 0.3 A 104 ASN CA C 13 52.553 0.3 A 104 ASN CB C 13 38.852 0.3 A 104 ASN N N 15 125.938 0.3 A 104 ASN ND2 N 15 110.024 0.3 A 105 VAL H H 1 8.933 0.020 A 105 VAL HA H 1 5.205 0.020 A 105 VAL HB H 1 1.498 0.020 A 105 VAL HGx% H 1 0.017 0.020 A 105 VAL HGy% H 1 0.255 0.020 A 105 VAL C C 13 174.788 0.3 A 105 VAL CA C 13 57.979 0.3 A 105 VAL CB C 13 36.040 0.3 A 105 VAL CG1 C 13 21.095 0.3 A 105 VAL CG2 C 13 19.280 0.3 A 105 VAL N N 15 114.631 0.3 A 106 GLU H H 1 8.814 0.020 A 106 GLU HA H 1 5.080 0.020 A 106 GLU HB2 H 1 2.195 0.020 A 106 GLU HB3 H 1 2.195 0.020 A 106 GLU HG2 H 1 2.364 0.020 A 106 GLU HG3 H 1 2.364 0.020 A 106 GLU C C 13 174.777 0.3 A 106 GLU CA C 13 54.967 0.3 A 106 GLU CB C 13 33.643 0.3 A 106 GLU CG C 13 34.719 0.3 A 106 GLU N N 15 118.347 0.3 A 107 SER H H 1 8.576 0.020 A 107 SER HA H 1 5.266 0.020 A 107 SER HBy H 1 4.105 0.020 A 107 SER HBx H 1 3.663 0.020 A 107 SER C C 13 175.787 0.3 A 107 SER CA C 13 55.888 0.3 A 107 SER CB C 13 65.921 0.3 A 107 SER N N 15 115.335 0.3 A 108 GLY H H 1 9.532 0.020 A 108 GLY HAy H 1 4.715 0.020 A 108 GLY HAx H 1 3.716 0.020 A 108 GLY C C 13 173.959 0.3 A 108 GLY CA C 13 44.677 0.3 A 108 GLY N N 15 117.567 0.3 A 109 ASP H H 1 8.605 0.020 A 109 ASP HA H 1 4.801 0.020 A 109 ASP HBy H 1 3.003 0.020 A 109 ASP HBx H 1 2.391 0.020 A 109 ASP C C 13 176.203 0.3 A 109 ASP CA C 13 52.134 0.3 A 109 ASP CB C 13 39.342 0.3 A 109 ASP N N 15 122.108 0.3 A 110 ASP H H 1 9.087 0.020 A 110 ASP HA H 1 4.222 0.020 A 110 ASP HBy H 1 2.976 0.020 A 110 ASP HBx H 1 2.785 0.020 A 110 ASP C C 13 175.951 0.3 A 110 ASP CA C 13 55.198 0.3 A 110 ASP CB C 13 38.630 0.3 A 110 ASP N N 15 116.197 0.3 A 111 GLY H H 1 8.930 0.020 A 111 GLY HAy H 1 4.141 0.020 A 111 GLY HAx H 1 3.567 0.020 A 111 GLY C C 13 173.924 0.3 A 111 GLY CA C 13 45.163 0.3 A 111 GLY N N 15 103.841 0.3 A 112 GLN H H 1 7.351 0.020 A 112 GLN HA H 1 4.070 0.020 A 112 GLN HBy H 1 2.115 0.020 A 112 GLN HBx H 1 2.003 0.020 A 112 GLN HE21 H 1 7.453 0.020 A 112 GLN HE22 H 1 6.812 0.020 A 112 GLN HGy H 1 2.469 0.020 A 112 GLN HGx H 1 2.347 0.020 A 112 GLN C C 13 176.431 0.3 A 112 GLN CA C 13 58.273 0.3 A 112 GLN CB C 13 27.693 0.3 A 112 GLN CG C 13 33.785 0.3 A 112 GLN N N 15 121.626 0.3 A 112 GLN NE2 N 15 112.032 0.3 A 113 THR H H 1 10.053 0.020 A 113 THR HA H 1 5.331 0.020 A 113 THR HB H 1 4.000 0.020 A 113 THR HG2% H 1 1.184 0.020 A 113 THR C C 13 174.452 0.3 A 113 THR CA C 13 59.739 0.3 A 113 THR CB C 13 71.773 0.3 A 113 THR CG2 C 13 22.221 0.3 A 113 THR N N 15 112.322 0.3 A 114 LEU H H 1 8.978 0.020 A 114 LEU HA H 1 4.581 0.020 A 114 LEU HBy H 1 1.325 0.020 A 114 LEU HBx H 1 0.845 0.020 A 114 LEU HDx% H 1 0.092 0.020 A 114 LEU HDy% H 1 0.413 0.020 A 114 LEU HG H 1 1.342 0.020 A 114 LEU C C 13 175.113 0.3 A 114 LEU CA C 13 52.905 0.3 A 114 LEU CB C 13 47.033 0.3 A 114 LEU CD1 C 13 24.901 0.3 A 114 LEU CD2 C 13 22.742 0.3 A 114 LEU CG C 13 25.982 0.3 A 114 LEU N N 15 122.083 0.3 A 115 ASN H H 1 8.837 0.020 A 115 ASN HA H 1 5.770 0.020 A 115 ASN HBy H 1 2.890 0.020 A 115 ASN HBx H 1 2.762 0.020 A 115 ASN HD21 H 1 7.510 0.020 A 115 ASN HD22 H 1 6.792 0.020 A 115 ASN C C 13 174.788 0.3 A 115 ASN CA C 13 52.342 0.3 A 115 ASN CB C 13 43.414 0.3 A 115 ASN N N 15 118.846 0.3 A 115 ASN ND2 N 15 113.413 0.3 A 116 GLY H H 1 8.625 0.020 A 116 GLY HAy H 1 5.223 0.020 A 116 GLY HAx H 1 4.104 0.020 A 116 GLY C C 13 172.452 0.3 A 116 GLY CA C 13 46.471 0.3 A 116 GLY N N 15 109.661 0.3 A 117 THR H H 1 8.911 0.020 A 117 THR HA H 1 5.556 0.020 A 117 THR HB H 1 4.242 0.020 A 117 THR HG2% H 1 1.194 0.020 A 117 THR C C 13 171.619 0.3 A 117 THR CA C 13 59.373 0.3 A 117 THR CB C 13 72.777 0.3 A 117 THR CG2 C 13 20.325 0.3 A 117 THR N N 15 120.009 0.3 A 118 MET H H 1 9.159 0.020 A 118 MET HA H 1 4.889 0.020 A 118 MET HB2 H 1 1.788 0.020 A 118 MET HB3 H 1 1.788 0.020 A 118 MET HE% H 1 1.370 0.020 A 118 MET HGy H 1 2.356 0.020 A 118 MET HGx H 1 2.150 0.020 A 118 MET C C 13 172.707 0.3 A 118 MET CA C 13 54.714 0.3 A 118 MET CB C 13 33.663 0.3 A 118 MET CE C 13 17.045 0.3 A 118 MET CG C 13 30.017 0.3 A 118 MET N N 15 115.550 0.3 A 119 THR H H 1 8.685 0.020 A 119 THR HA H 1 4.682 0.020 A 119 THR HB H 1 3.651 0.020 A 119 THR HG2% H 1 1.024 0.020 A 119 THR C C 13 173.952 0.3 A 119 THR CA C 13 61.395 0.3 A 119 THR CB C 13 71.746 0.3 A 119 THR CG2 C 13 22.562 0.3 A 119 THR N N 15 113.716 0.3 A 120 TYR H H 1 10.107 0.020 A 120 TYR HA H 1 4.800 0.020 A 120 TYR HBy H 1 2.762 0.020 A 120 TYR HBx H 1 2.537 0.020 A 120 TYR HD1 H 1 6.909 0.020 A 120 TYR HD2 H 1 6.909 0.020 A 120 TYR HE1 H 1 7.156 0.020 A 120 TYR HE2 H 1 7.156 0.020 A 120 TYR C C 13 175.214 0.3 A 120 TYR CA C 13 58.877 0.3 A 120 TYR CB C 13 40.502 0.3 A 120 TYR CD1 C 13 132.848 0.3 A 120 TYR CE1 C 13 118.645 0.3 A 120 TYR N N 15 129.153 0.3 A 121 ALA H H 1 8.704 0.020 A 121 ALA HA H 1 4.004 0.020 A 121 ALA HB% H 1 1.416 0.020 A 121 ALA C C 13 178.456 0.3 A 121 ALA CA C 13 53.956 0.3 A 121 ALA CB C 13 18.710 0.3 A 121 ALA N N 15 119.947 0.3 A 122 GLY H H 1 8.792 0.020 A 122 GLY HAy H 1 4.202 0.020 A 122 GLY HAx H 1 3.715 0.020 A 122 GLY C C 13 173.949 0.3 A 122 GLY CA C 13 45.002 0.3 A 122 GLY N N 15 111.186 0.3 A 123 GLU H H 1 8.072 0.020 A 123 GLU HA H 1 4.705 0.020 A 123 GLU HB2 H 1 2.396 0.020 A 123 GLU HB3 H 1 2.396 0.020 A 123 GLU HGy H 1 2.173 0.020 A 123 GLU HGx H 1 1.982 0.020 A 123 GLU C C 13 175.912 0.3 A 123 GLU CA C 13 54.414 0.3 A 123 GLU CB C 13 32.784 0.3 A 123 GLU CG C 13 36.327 0.3 A 123 GLU N N 15 120.099 0.3 A 124 GLY H H 1 7.939 0.020 A 124 GLY HAy H 1 4.555 0.020 A 124 GLY HAx H 1 3.789 0.020 A 124 GLY CA C 13 43.802 0.3 A 124 GLY N N 15 105.303 0.3 A 125 PRO HA H 1 4.935 0.020 A 125 PRO HBy H 1 2.088 0.020 A 125 PRO HBx H 1 1.752 0.020 A 125 PRO HD2 H 1 3.622 0.020 A 125 PRO HD3 H 1 3.622 0.020 A 125 PRO HGy H 1 2.045 0.020 A 125 PRO HGx H 1 1.955 0.020 A 125 PRO C C 13 177.788 0.3 A 125 PRO CA C 13 63.131 0.3 A 125 PRO CB C 13 31.859 0.3 A 125 PRO CD C 13 49.045 0.3 A 125 PRO CG C 13 27.323 0.3 A 126 ILE H H 1 9.599 0.020 A 126 ILE HA H 1 4.899 0.020 A 126 ILE HB H 1 2.095 0.020 A 126 ILE HD1% H 1 1.019 0.020 A 126 ILE HG1y H 1 1.600 0.020 A 126 ILE HG1x H 1 1.287 0.020 A 126 ILE HG2% H 1 1.138 0.020 A 126 ILE C C 13 175.625 0.3 A 126 ILE CA C 13 59.453 0.3 A 126 ILE CB C 13 42.548 0.3 A 126 ILE CD1 C 13 13.867 0.3 A 126 ILE CG1 C 13 24.339 0.3 A 126 ILE CG2 C 13 17.719 0.3 A 126 ILE N N 15 117.387 0.3 A 127 GLY H H 1 8.840 0.020 A 127 GLY HAy H 1 4.471 0.020 A 127 GLY HAx H 1 3.792 0.020 A 127 GLY C C 13 173.627 0.3 A 127 GLY CA C 13 46.283 0.3 A 127 GLY N N 15 106.753 0.3 A 128 PHE H H 1 8.924 0.020 A 128 PHE HA H 1 4.944 0.020 A 128 PHE HBy H 1 2.542 0.020 A 128 PHE HBx H 1 2.210 0.020 A 128 PHE HD1 H 1 6.622 0.020 A 128 PHE HD2 H 1 6.622 0.020 A 128 PHE HE1 H 1 5.928 0.020 A 128 PHE HE2 H 1 5.928 0.020 A 128 PHE HZ H 1 5.951 0.020 A 128 PHE C C 13 173.087 0.3 A 128 PHE CA C 13 57.009 0.3 A 128 PHE CB C 13 43.160 0.3 A 128 PHE CD1 C 13 131.356 0.3 A 128 PHE CE1 C 13 131.084 0.3 A 128 PHE CZ C 13 128.055 0.3 A 128 PHE N N 15 124.826 0.3 A 129 LYS H H 1 8.201 0.020 A 129 LYS HA H 1 4.883 0.020 A 129 LYS HBy H 1 0.980 0.020 A 129 LYS HBx H 1 0.892 0.020 A 129 LYS HD2 H 1 0.782 0.020 A 129 LYS HD3 H 1 0.782 0.020 A 129 LYS HEy H 1 1.982 0.020 A 129 LYS HEx H 1 1.879 0.020 A 129 LYS HGy H 1 0.936 0.020 A 129 LYS HGx H 1 0.812 0.020 A 129 LYS C C 13 173.863 0.3 A 129 LYS CA C 13 55.735 0.3 A 129 LYS CB C 13 34.721 0.3 A 129 LYS CD C 13 28.400 0.3 A 129 LYS CE C 13 40.472 0.3 A 129 LYS CG C 13 23.591 0.3 A 129 LYS N N 15 131.518 0.3 A 130 GLY H H 1 9.325 0.020 A 130 GLY HAy H 1 5.069 0.020 A 130 GLY HAx H 1 2.817 0.020 A 130 GLY C C 13 171.951 0.3 A 130 GLY CA C 13 43.787 0.3 A 130 GLY N N 15 114.030 0.3 A 131 THR H H 1 8.916 0.020 A 131 THR HA H 1 4.939 0.020 A 131 THR HB H 1 3.943 0.020 A 131 THR HG2% H 1 1.204 0.020 A 131 THR C C 13 173.118 0.3 A 131 THR CA C 13 61.266 0.3 A 131 THR CB C 13 70.392 0.3 A 131 THR CG2 C 13 21.081 0.3 A 131 THR N N 15 120.583 0.3 A 132 LEU H H 1 8.527 0.020 A 132 LEU HA H 1 3.500 0.020 A 132 LEU HBy H 1 1.593 0.020 A 132 LEU HBx H 1 1.439 0.020 A 132 LEU HDx% H 1 0.533 0.020 A 132 LEU HDy% H 1 0.526 0.020 A 132 LEU HG H 1 1.482 0.020 A 132 LEU C C 13 176.574 0.3 A 132 LEU CA C 13 56.187 0.3 A 132 LEU CB C 13 42.447 0.3 A 132 LEU CD1 C 13 24.891 0.3 A 132 LEU CD2 C 13 24.432 0.3 A 132 LEU CG C 13 26.005 0.3 A 132 LEU N N 15 130.774 0.3 A 133 THR H H 1 8.050 0.020 A 133 THR HA H 1 4.140 0.020 A 133 THR HB H 1 3.943 0.020 A 133 THR HG2% H 1 1.052 0.020 A 133 THR CA C 13 62.331 0.3 A 133 THR CB C 13 70.389 0.3 A 133 THR CG2 C 13 21.216 0.3 A 133 THR N N 15 124.582 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 129 LYS H A 130 GLY H 1.0 0.0 6.24 2 2 A 129 LYS H A 7 GLU H 1.0 0.0 5.08 3 3 A 129 LYS H A 17 TRP HE3 1.0 0.0 6.20 4 4 A 129 LYS H A 17 TRP HZ3 1.0 0.0 5.02 5 5 A 129 LYS H A 128 PHE HD% 1.0 0.0 5.49 6 6 A 129 LYS H A 8 ASN HA 1.0 0.0 6.40 7 7 A 129 LYS H A 128 PHE HA 1.0 0.0 4.11 8 8 A 129 LYS H A 6 VAL HA 1.0 0.0 6.50 9 9 A 129 LYS H A 128 PHE HBy 1.0 0.0 6.50 10 10 A 129 LYS H A 128 PHE HBx 1.0 0.0 6.50 11 11 A 129 LYS H A 7 GLU HB2 1.0 0.0 6.50 12 11 A 129 LYS H A 7 GLU HB3 1.0 0.0 6.50 13 12 A 129 LYS H A 129 LYS HBx 1.0 0.0 4.72 14 13 A 129 LYS H A 6 VAL HGx% 1.0 0.0 5.35 15 14 A 76 GLN HE22 A 84 TRP HE1 1.0 0.0 5.44 16 15 A 84 TRP HE1 A 62 ARG HD2 1.0 0.0 6.50 17 15 A 84 TRP HE1 A 62 ARG HD3 1.0 0.0 6.50 18 16 A 84 TRP HE1 A 62 ARG HG2 1.0 0.0 6.50 19 16 A 84 TRP HE1 A 62 ARG HG3 1.0 0.0 6.50 20 17 A 84 TRP HE1 A 76 GLN HGx 1.0 0.0 6.50 21 18 A 84 TRP HE1 A 76 GLN HBy 1.0 0.0 6.50 22 19 A 131 THR H A 132 LEU H 1.0 0.0 6.50 23 20 A 132 LEU H A 4 TYR HD% 1.0 0.0 5.37 24 21 A 132 LEU H A 113 THR HA 1.0 0.0 5.56 25 22 A 132 LEU H A 131 THR HA 1.0 0.0 4.16 26 23 A 132 LEU H A 113 THR HG2% 1.0 0.0 5.26 27 24 A 132 LEU H A 131 THR HG2% 1.0 0.0 5.41 28 25 A 132 LEU H A 132 LEU HDx% 1.0 0.0 5.96 29 26 A 132 LEU H A 132 LEU HDy% 1.0 0.0 5.96 30 27 A 10 TRP HE1 A 18 ASN HBy 1.0 0.0 6.50 31 28 A 10 TRP HE1 A 10 TRP H 1.0 0.0 6.50 32 29 A 16 PRO HA A 17 TRP HE1 1.0 0.0 6.50 33 30 A 17 TRP HE1 A 129 LYS HEy 1.0 0.0 6.50 34 31 A 17 TRP HE1 A 129 LYS HD2 1.0 0.0 6.50 35 31 A 17 TRP HE1 A 129 LYS HD3 1.0 0.0 6.50 36 32 A 17 TRP HE1 A 9 GLN HBy 1.0 0.0 6.50 37 33 A 62 ARG H A 74 GLU H 1.0 0.0 5.13 38 34 A 62 ARG H A 63 ALA H 1.0 0.0 6.09 39 35 A 62 ARG H A 84 TRP HE3 1.0 0.0 6.50 40 36 A 62 ARG H A 61 PHE HD% 1.0 0.0 5.60 41 37 A 62 ARG H A 84 TRP HZ3 1.0 0.0 5.75 42 38 A 62 ARG H A 61 PHE HA 1.0 0.0 4.24 43 39 A 62 ARG H A 73 VAL HA 1.0 0.0 6.39 44 40 A 62 ARG H A 61 PHE HBy 1.0 0.0 6.50 45 41 A 62 ARG H A 61 PHE HBx 1.0 0.0 6.50 46 42 A 62 ARG H A 74 GLU HB2 1.0 0.0 6.48 47 42 A 62 ARG H A 74 GLU HB3 1.0 0.0 6.48 48 43 A 62 ARG H A 62 ARG HG2 1.0 0.0 5.44 49 43 A 62 ARG HG3 A 62 ARG H 1.0 0.0 5.44 50 44 A 62 ARG H A 63 ALA HB% 1.0 0.0 5.93 51 45 A 62 ARG H A 38 VAL HGx% 1.0 0.0 6.50 52 46 A 62 ARG H A 73 VAL HGx% 1.0 0.0 5.60 53 47 A 65 LEU H A 66 LEU H 1.0 0.0 6.50 54 48 A 65 LEU H A 46 THR HA 1.0 0.0 5.54 55 49 A 65 LEU H A 71 TYR HA 1.0 0.0 6.50 56 50 A 65 LEU H A 64 THR HA 1.0 0.0 4.24 57 51 A 65 LEU H A 45 GLN HA 1.0 0.0 5.52 58 52 A 65 LEU H A 64 THR HB 1.0 0.0 6.37 59 53 A 65 LEU H A 71 TYR HB2 1.0 0.0 6.50 60 53 A 65 LEU H A 71 TYR HB3 1.0 0.0 6.50 61 54 A 65 LEU H A 65 LEU HBy 1.0 0.0 4.58 62 55 A 65 LEU H A 65 LEU HBx 1.0 0.0 4.58 63 56 A 65 LEU H A 64 THR HG2% 1.0 0.0 4.80 64 57 A 65 LEU H A 65 LEU HDx% 1.0 0.0 6.11 65 58 A 65 LEU H A 65 LEU HDy% 1.0 0.0 6.11 66 59 A 35 ALA H A 53 TYR H 1.0 0.0 6.50 67 60 A 102 ALA H A 120 TYR H 1.0 0.0 6.50 68 61 A 53 TYR H A 52 THR HB 1.0 0.0 6.50 69 62 A 120 TYR H A 119 THR HB 1.0 0.0 6.50 70 63 A 53 TYR H A 52 THR HG2% 1.0 0.0 5.48 71 64 A 120 TYR H A 119 THR HG2% 1.0 0.0 5.72 72 65 A 120 TYR H A 101 VAL HGy% 1.0 0.0 6.50 73 66 A 66 LEU H A 72 GLU H 1.0 0.0 6.14 74 67 A 66 LEU H A 70 SER H 1.0 0.0 6.50 75 68 A 66 LEU H A 71 TYR HA 1.0 0.0 4.94 76 69 A 66 LEU H A 64 THR HB 1.0 0.0 6.50 77 70 A 66 LEU H A 65 LEU HA 1.0 0.0 4.29 78 71 A 66 LEU H A 71 TYR HB2 1.0 0.0 6.50 79 71 A 66 LEU H A 71 TYR HB3 1.0 0.0 6.50 80 72 A 66 LEU H A 65 LEU HG 1.0 0.0 5.53 81 73 A 73 VAL H A 90 TRP HE1 1.0 0.0 6.50 82 74 A 73 VAL H A 64 THR H 1.0 0.0 6.50 83 75 A 73 VAL H A 90 TRP HD1 1.0 0.0 6.50 84 76 A 73 VAL H A 89 ASN HA 1.0 0.0 5.34 85 77 A 73 VAL H A 63 ALA HA 1.0 0.0 6.50 86 78 A 73 VAL H A 72 GLU HA 1.0 0.0 4.13 87 79 A 73 VAL H A 87 GLY HAx 1.0 0.0 6.50 88 80 A 73 VAL H A 71 TYR HB2 1.0 0.0 6.50 89 80 A 71 TYR HB3 A 73 VAL H 1.0 0.0 6.50 90 81 A 73 VAL H A 72 GLU HB2 1.0 0.0 5.46 91 81 A 73 VAL H A 72 GLU HB3 1.0 0.0 5.46 92 82 A 73 VAL H A 74 GLU HG2 1.0 0.0 6.08 93 82 A 73 VAL H A 74 GLU HG3 1.0 0.0 6.08 94 83 A 73 VAL H A 73 VAL HB 1.0 0.0 4.39 95 84 A 63 ALA HB% A 73 VAL H 1.0 0.0 6.50 96 85 A 73 VAL H A 73 VAL HGy% 1.0 0.0 4.66 97 86 A 90 TRP HE1 A 90 TRP H 1.0 0.0 6.50 98 87 A 90 TRP HE1 A 26 GLY HAx 1.0 0.0 6.27 99 88 A 90 TRP HE1 A 26 GLY H 1.0 0.0 5.74 100 89 A 90 TRP HE1 A 51 MET HE% 1.0 0.0 6.50 101 90 A 90 TRP HE1 A 73 VAL HB 1.0 0.0 5.56 102 91 A 73 VAL HGx% A 90 TRP HE1 1.0 0.0 5.51 103 92 A 90 TRP HE1 A 73 VAL HGy% 1.0 0.0 5.65 104 93 A 10 TRP H A 10 TRP HE3 1.0 0.0 6.26 105 94 A 10 TRP H A 10 TRP HD1 1.0 0.0 6.50 106 95 A 10 TRP H A 9 GLN H 1.0 0.0 6.50 107 96 A 10 TRP H A 9 GLN HBy 1.0 0.0 6.50 108 97 A 23 TRP HA A 23 TRP HE1 1.0 0.0 6.50 109 98 A 23 TRP HE1 A 21 GLY HAx 1.0 0.0 6.27 110 99 A 23 TRP HE1 A 94 SER HBy 1.0 0.0 6.22 111 100 A 23 TRP HE1 A 94 SER HBx 1.0 0.0 6.22 112 101 A 23 TRP HE1 A 93 GLY HAy 1.0 0.0 6.50 113 102 A 23 TRP HE1 A 6 VAL HB 1.0 0.0 5.49 114 103 A 6 VAL HGx% A 23 TRP HE1 1.0 0.0 5.16 115 104 A 6 VAL H A 21 GLY H 1.0 0.0 6.50 116 105 A 6 VAL H A 22 GLN HE21 1.0 0.0 6.50 117 106 A 6 VAL H A 23 TRP HD1 1.0 0.0 6.50 118 107 A 6 VAL H A 22 GLN HA 1.0 0.0 5.28 119 108 A 6 VAL H A 5 ASN HA 1.0 0.0 4.10 120 109 A 6 VAL H A 23 TRP HBy 1.0 0.0 6.12 121 110 A 6 VAL H A 4 TYR HBy 1.0 0.0 6.50 122 111 A 6 VAL HB A 6 VAL H 1.0 0.0 4.41 123 112 A 6 VAL H A 6 VAL HGy% 1.0 0.0 4.60 124 113 A 4 TYR H A 23 TRP H 1.0 0.0 5.29 125 114 A 4 TYR HD% A 23 TRP H 1.0 0.0 6.50 126 115 A 22 GLN HA A 23 TRP H 1.0 0.0 4.06 127 116 A 23 TRP HBy A 23 TRP H 1.0 0.0 4.92 128 117 A 4 TYR HBy A 23 TRP H 1.0 0.0 5.19 129 118 A 23 TRP H A 22 GLN HBy 1.0 0.0 5.33 130 119 A 23 TRP H A 25 ILE HD1% 1.0 0.0 6.50 131 120 A 6 VAL HGy% A 23 TRP H 1.0 0.0 5.16 132 121 A 13 SER HA A 15 ALA H 1.0 0.0 6.50 133 122 A 15 ALA H A 15 ALA HB% 1.0 0.0 4.15 134 123 A 73 VAL H A 90 TRP H 1.0 0.0 5.88 135 124 A 90 TRP HD1 A 90 TRP H 1.0 0.0 5.71 136 125 A 89 ASN HA A 90 TRP H 1.0 0.0 4.17 137 126 A 72 GLU HA A 90 TRP H 1.0 0.0 6.02 138 127 A 90 TRP H A 89 ASN HBx 1.0 0.0 5.07 139 128 A 90 TRP H A 71 TYR HB2 1.0 0.0 6.11 140 128 A 71 TYR HB3 A 90 TRP H 1.0 0.0 6.11 141 129 A 73 VAL HB A 90 TRP H 1.0 0.0 6.50 142 130 A 73 VAL HGy% A 90 TRP H 1.0 0.0 5.33 143 131 A 104 ASN H A 117 THR H 1.0 0.0 4.95 144 132 A 104 ASN H A 103 ILE H 1.0 0.0 6.50 145 133 A 104 ASN H A 104 ASN HD22 1.0 0.0 6.50 146 134 A 128 PHE HD% A 104 ASN H 1.0 0.0 6.50 147 135 A 104 ASN H A 105 VAL HA 1.0 0.0 6.50 148 136 A 104 ASN H A 118 MET HA 1.0 0.0 5.13 149 137 A 104 ASN H A 103 ILE HA 1.0 0.0 4.15 150 138 A 104 ASN H A 104 ASN HBy 1.0 0.0 5.17 151 139 A 104 ASN H A 104 ASN HBx 1.0 0.0 5.17 152 140 A 104 ASN H A 118 MET HB2 1.0 0.0 6.50 153 140 A 104 ASN H A 118 MET HB3 1.0 0.0 6.50 154 141 A 104 ASN H A 103 ILE HB 1.0 0.0 6.27 155 142 A 104 ASN H A 103 ILE HG2% 1.0 0.0 4.75 156 143 A 104 ASN H A 105 VAL HGy% 1.0 0.0 6.35 157 144 A 104 ASN H A 105 VAL HGx% 1.0 0.0 6.35 158 145 A 37 ASN H A 50 THR H 1.0 0.0 5.19 159 146 A 37 ASN H A 36 ILE H 1.0 0.0 6.31 160 147 A 37 ASN H A 37 ASN HD22 1.0 0.0 6.50 161 148 A 37 ASN H A 37 ASN HD21 1.0 0.0 6.50 162 149 A 37 ASN H A 38 VAL HA 1.0 0.0 6.50 163 150 A 37 ASN H A 49 GLY HAx 1.0 0.0 6.50 164 151 A 37 ASN H A 51 MET HA 1.0 0.0 5.13 165 152 A 37 ASN H A 36 ILE HA 1.0 0.0 4.20 166 153 A 37 ASN H A 51 MET HB2 1.0 0.0 6.50 167 153 A 37 ASN H A 51 MET HB3 1.0 0.0 6.50 168 154 A 37 ASN H A 36 ILE HG1x 1.0 0.0 6.38 169 155 A 37 ASN H A 36 ILE HG2% 1.0 0.0 4.84 170 156 A 38 VAL HGx% A 37 ASN H 1.0 0.0 4.96 171 157 A 77 TRP H A 78 GLY H 1.0 0.0 6.50 172 158 A 77 TRP H A 77 TRP HE3 1.0 0.0 6.50 173 159 A 77 TRP H A 76 GLN H 1.0 0.0 6.50 174 160 A 77 TRP H A 77 TRP HD1 1.0 0.0 6.50 175 161 A 77 TRP H A 85 HIS HD2 1.0 0.0 6.50 176 162 A 77 TRP H A 76 GLN HGy 1.0 0.0 6.19 177 163 A 76 GLN HGx A 77 TRP H 1.0 0.0 6.50 178 164 A 77 TRP H A 76 GLN HBx 1.0 0.0 6.50 179 165 A 76 GLN HBy A 77 TRP H 1.0 0.0 6.50 180 166 A 74 GLU H A 84 TRP HE3 1.0 0.0 6.50 181 167 A 74 GLU H A 61 PHE HD% 1.0 0.0 6.50 182 168 A 74 GLU H A 84 TRP HZ3 1.0 0.0 6.50 183 169 A 74 GLU H A 63 ALA HA 1.0 0.0 5.40 184 170 A 74 GLU H A 73 VAL HA 1.0 0.0 4.18 185 171 A 74 GLU H A 87 GLY HAx 1.0 0.0 6.50 186 172 A 74 GLU H A 72 GLU HG2 1.0 0.0 5.96 187 172 A 74 GLU H A 72 GLU HG3 1.0 0.0 5.96 188 173 A 74 GLU H A 74 GLU HB2 1.0 0.0 5.18 189 173 A 74 GLU H A 74 GLU HB3 1.0 0.0 5.18 190 174 A 74 GLU H A 73 VAL HB 1.0 0.0 5.74 191 175 A 74 GLU H A 63 ALA HB% 1.0 0.0 5.33 192 176 A 74 GLU H A 73 VAL HGx% 1.0 0.0 4.59 193 177 A 116 GLY H A 128 PHE H 1.0 0.0 5.52 194 178 A 128 PHE H A 17 TRP HZ2 1.0 0.0 6.50 195 179 A 128 PHE H A 17 TRP HH2 1.0 0.0 5.59 196 180 A 17 TRP HZ3 A 128 PHE H 1.0 0.0 5.78 197 181 A 128 PHE H A 117 THR HA 1.0 0.0 4.96 198 182 A 128 PHE H A 127 GLY HAy 1.0 0.0 4.43 199 183 A 128 PHE H A 128 PHE HBy 1.0 0.0 5.05 200 184 A 128 PHE H A 128 PHE HBx 1.0 0.0 5.05 201 185 A 128 PHE H A 117 THR HG2% 1.0 0.0 5.77 202 186 A 128 PHE H A 9 GLN HBx 1.0 0.0 6.50 203 187 A 61 PHE H A 84 TRP HH2 1.0 0.0 6.18 204 188 A 84 TRP HZ3 A 61 PHE H 1.0 0.0 6.25 205 189 A 61 PHE H A 50 THR HA 1.0 0.0 5.28 206 190 A 61 PHE H A 50 THR HG2% 1.0 0.0 5.92 207 191 A 5 ASN H A 133 THR H 1.0 0.0 5.83 208 192 A 132 LEU H A 133 THR H 1.0 0.0 6.12 209 193 A 4 TYR HD% A 133 THR H 1.0 0.0 6.50 210 194 A 133 THR H A 4 TYR HA 1.0 0.0 4.98 211 195 A 133 THR H A 132 LEU HA 1.0 0.0 4.04 212 196 A 4 TYR HBy A 133 THR H 1.0 0.0 6.50 213 197 A 133 THR H A 4 TYR HBx 1.0 0.0 6.50 214 198 A 133 THR H A 132 LEU HG 1.0 0.0 6.18 215 199 A 133 THR H A 133 THR HG2% 1.0 0.0 4.68 216 200 A 7 GLU H A 6 VAL HA 1.0 0.0 4.09 217 201 A 7 GLU H A 6 VAL HGx% 1.0 0.0 4.54 218 202 A 4 TYR HD% A 25 ILE H 1.0 0.0 4.84 219 203 A 25 ILE H A 24 GLU HA 1.0 0.0 4.13 220 204 A 25 ILE H A 24 GLU HB2 1.0 0.0 6.32 221 204 A 25 ILE H A 24 GLU HB3 1.0 0.0 6.32 222 205 A 25 ILE H A 25 ILE HB 1.0 0.0 4.64 223 206 A 25 ILE HD1% A 25 ILE H 1.0 0.0 5.58 224 207 A 71 TYR H A 92 LEU H 1.0 0.0 5.93 225 208 A 92 LEU H A 91 ILE H 1.0 0.0 6.28 226 209 A 70 SER H A 92 LEU H 1.0 0.0 6.50 227 210 A 92 LEU H A 91 ILE HA 1.0 0.0 4.19 228 211 A 92 LEU H A 92 LEU HDx% 1.0 0.0 6.20 229 212 A 92 LEU H A 91 ILE HG2% 1.0 0.0 4.99 230 213 A 92 LEU H A 92 LEU HDy% 1.0 0.0 6.20 231 214 A 25 ILE H A 24 GLU H 1.0 0.0 6.15 232 215 A 24 GLU H A 23 TRP HBx 1.0 0.0 4.52 233 216 A 24 GLU H A 91 ILE HB 1.0 0.0 4.32 234 217 A 91 ILE H A 91 ILE HG1y 1.0 0.0 6.08 235 218 A 91 ILE HG2% A 24 GLU H 1.0 0.0 5.39 236 219 A 91 ILE H A 91 ILE HD1% 1.0 0.0 5.99 237 220 A 133 THR H A 3 LEU H 1.0 0.0 6.50 238 221 A 4 TYR HD% A 3 LEU H 1.0 0.0 6.50 239 222 A 3 LEU H A 4 TYR HE% 1.0 0.0 6.50 240 223 A 3 LEU H A 2 ALA HA 1.0 0.0 4.23 241 224 A 3 LEU H A 2 ALA HB% 1.0 0.0 4.69 242 225 A 3 LEU H A 3 LEU HDx% 1.0 0.0 6.12 243 226 A 3 LEU H A 3 LEU HDy% 1.0 0.0 6.12 244 227 A 89 ASN HA A 71 TYR H 1.0 0.0 6.50 245 228 A 71 TYR H A 70 SER HA 1.0 0.0 4.13 246 229 A 91 ILE H A 25 ILE HA 1.0 0.0 6.50 247 230 A 91 ILE H A 91 ILE HG1x 1.0 0.0 6.08 248 231 A 6 VAL HGy% A 24 GLU H 1.0 0.0 6.50 249 232 A 73 VAL HGy% A 71 TYR H 1.0 0.0 6.50 250 233 A 95 ARG H A 94 SER HBx 1.0 0.0 6.50 251 234 A 95 ARG H A 95 ARG HD2 1.0 0.0 6.50 252 234 A 95 ARG H A 95 ARG HD3 1.0 0.0 6.50 253 235 A 95 ARG H A 120 TYR HE% 1.0 0.0 5.71 254 236 A 95 ARG H A 69 ASN HD22 1.0 0.0 6.21 255 237 A 95 ARG H A 94 SER HBy 1.0 0.0 6.50 256 238 A 93 GLY HAy A 95 ARG H 1.0 0.0 6.34 257 239 A 95 ARG H A 95 ARG HB2 1.0 0.0 4.94 258 239 A 95 ARG H A 95 ARG HB3 1.0 0.0 4.94 259 240 A 99 ASN H A 101 VAL HGx% 1.0 0.0 6.31 260 241 A 99 ASN H A 98 GLN H 1.0 0.0 5.94 261 242 A 99 ASN H A 98 GLN HA 1.0 0.0 4.14 262 243 A 99 ASN H A 98 GLN HGy 1.0 0.0 5.94 263 244 A 99 ASN H A 98 GLN HGx 1.0 0.0 5.94 264 245 A 99 ASN H A 95 ARG HB2 1.0 0.0 6.45 265 245 A 95 ARG HB3 A 99 ASN H 1.0 0.0 6.45 266 246 A 63 ALA H A 61 PHE HE% 1.0 0.0 6.41 267 247 A 63 ALA H A 63 ALA HB% 1.0 0.0 4.60 268 248 A 63 ALA H A 62 ARG HA 1.0 0.0 4.17 269 249 A 71 TYR HA A 72 GLU H 1.0 0.0 4.38 270 250 A 72 GLU H A 65 LEU HA 1.0 0.0 5.98 271 251 A 72 GLU H A 71 TYR HB2 1.0 0.0 5.91 272 251 A 71 TYR HB3 A 72 GLU H 1.0 0.0 5.91 273 252 A 72 GLU H A 72 GLU HB2 1.0 0.0 4.41 274 252 A 72 GLU H A 72 GLU HB3 1.0 0.0 4.41 275 253 A 63 ALA H A 73 VAL HGy% 1.0 0.0 6.50 276 254 A 72 GLU H A 73 VAL HGy% 1.0 0.0 6.50 277 255 A 19 GLU H A 19 GLU HB2 1.0 0.0 4.16 278 255 A 19 GLU H A 19 GLU HB3 1.0 0.0 4.16 279 256 A 19 GLU H A 18 ASN HA 1.0 0.0 4.11 280 257 A 19 GLU H A 18 ASN HBx 1.0 0.0 4.83 281 258 A 128 PHE HD% A 114 LEU H 1.0 0.0 6.50 282 259 A 114 LEU H A 128 PHE HE% 1.0 0.0 6.43 283 260 A 113 THR HA A 114 LEU H 1.0 0.0 4.28 284 261 A 114 LEU H A 113 THR HB 1.0 0.0 4.90 285 262 A 114 LEU H A 114 LEU HBy 1.0 0.0 4.68 286 263 A 114 LEU H A 114 LEU HDy% 1.0 0.0 6.48 287 264 A 114 LEU H A 114 LEU HDx% 1.0 0.0 6.48 288 265 A 42 ASP H A 46 THR H 1.0 0.0 6.41 289 266 A 42 ASP H A 45 GLN H 1.0 0.0 6.45 290 267 A 42 ASP H A 40 SER HBy 1.0 0.0 6.06 291 268 A 42 ASP H A 43 ASP HA 1.0 0.0 6.45 292 269 A 42 ASP H A 40 SER HBx 1.0 0.0 6.06 293 270 A 73 VAL HA A 72 GLU H 1.0 0.0 6.50 294 271 A 108 GLY H A 109 ASP H 1.0 0.0 4.66 295 272 A 33 VAL H A 53 TYR HD% 1.0 0.0 6.50 296 273 A 4 TYR HE% A 33 VAL H 1.0 0.0 6.50 297 274 A 33 VAL H A 32 ASN HA 1.0 0.0 4.53 298 275 A 33 VAL H A 32 ASN HBy 1.0 0.0 5.84 299 276 A 33 VAL H A 32 ASN HBx 1.0 0.0 5.84 300 277 A 33 VAL H A 33 VAL HB 1.0 0.0 4.66 301 278 A 35 ALA H A 34 VAL H 1.0 0.0 3.97 302 279 A 102 ALA H A 39 GLU HA 1.0 0.0 6.37 303 280 A 35 ALA H A 106 GLU HA 1.0 0.0 6.50 304 281 A 35 ALA H A 36 ILE HA 1.0 0.0 6.50 305 282 A 35 ALA H A 54 ALA HA 1.0 0.0 6.50 306 283 A 102 ALA H A 103 ILE HA 1.0 0.0 6.50 307 284 A 35 ALA H A 34 VAL HB 1.0 0.0 6.28 308 285 A 102 ALA H A 101 VAL HB 1.0 0.0 6.50 309 286 A 35 ALA H A 33 VAL HB 1.0 0.0 6.50 310 287 A 102 ALA H A 100 VAL HB 1.0 0.0 6.50 311 288 A 35 ALA H A 35 ALA HB% 1.0 0.0 4.79 312 289 A 102 ALA H A 102 ALA HB% 1.0 0.0 5.07 313 290 A 35 ALA H A 52 THR HG2% 1.0 0.0 6.35 314 291 A 102 ALA H A 119 THR HG2% 1.0 0.0 6.50 315 292 A 102 ALA H A 119 THR HB 1.0 0.0 4.48 316 293 A 35 ALA H A 34 VAL HGy% 1.0 0.0 4.36 317 294 A 102 ALA H A 101 VAL HGy% 1.0 0.0 4.17 318 295 A 68 ASN H A 69 ASN H 1.0 0.0 5.50 319 296 A 70 SER H A 68 ASN H 1.0 0.0 6.46 320 297 A 68 ASN H A 67 GLY H 1.0 0.0 5.91 321 298 A 68 ASN H A 69 ASN HA 1.0 0.0 6.50 322 299 A 68 ASN H A 67 GLY HAy 1.0 0.0 4.47 323 300 A 65 LEU HG A 68 ASN H 1.0 0.0 6.50 324 301 A 68 ASN H A 65 LEU HDx% 1.0 0.0 6.45 325 302 A 68 ASN H A 65 LEU HDy% 1.0 0.0 6.45 326 303 A 109 ASP H A 112 GLN H 1.0 0.0 6.50 327 304 A 45 GLN H A 44 GLY H 1.0 0.0 4.65 328 305 A 46 THR HA A 45 GLN H 1.0 0.0 6.50 329 306 A 113 THR HA A 112 GLN H 1.0 0.0 6.50 330 307 A 45 GLN H A 46 THR HG2% 1.0 0.0 6.50 331 308 A 113 THR HG2% A 112 GLN H 1.0 0.0 6.50 332 309 A 112 GLN H A 34 VAL HGx% 1.0 0.0 6.50 333 310 A 101 VAL HGx% A 45 GLN H 1.0 0.0 6.50 334 311 A 99 ASN HD21 A 100 VAL H 1.0 0.0 6.50 335 312 A 120 TYR HE% A 100 VAL H 1.0 0.0 6.50 336 313 A 100 VAL HB A 100 VAL H 1.0 0.0 4.79 337 314 A 4 TYR H A 133 THR H 1.0 0.0 6.50 338 315 A 4 TYR HD% A 4 TYR H 1.0 0.0 4.87 339 316 A 4 TYR H A 24 GLU HA 1.0 0.0 6.00 340 317 A 4 TYR H A 3 LEU HA 1.0 0.0 4.03 341 318 A 4 TYR H A 23 TRP HBx 1.0 0.0 6.50 342 319 A 4 TYR H A 133 THR HB 1.0 0.0 6.50 343 320 A 4 TYR H A 132 LEU HA 1.0 0.0 6.50 344 321 A 23 TRP HBy A 4 TYR H 1.0 0.0 6.40 345 322 A 4 TYR HBy A 4 TYR H 1.0 0.0 4.77 346 323 A 4 TYR H A 3 LEU HG 1.0 0.0 6.11 347 324 A 4 TYR H A 25 ILE HD1% 1.0 0.0 6.50 348 325 A 6 VAL HGy% A 4 TYR H 1.0 0.0 6.47 349 326 A 31 GLN HA A 32 ASN H 1.0 0.0 4.03 350 327 A 32 ASN H A 32 ASN HBy 1.0 0.0 5.14 351 328 A 32 ASN H A 32 ASN HBx 1.0 0.0 5.14 352 329 A 32 ASN H A 31 GLN HG2 1.0 0.0 5.34 353 329 A 32 ASN H A 31 GLN HG3 1.0 0.0 5.34 354 330 A 32 ASN H A 54 ALA HB% 1.0 0.0 4.84 355 331 A 28 ARG H A 53 TYR HE% 1.0 0.0 6.20 356 332 A 28 ARG H A 28 ARG HE 1.0 0.0 6.50 357 333 A 28 ARG H A 26 GLY HAy 1.0 0.0 6.50 358 334 A 28 ARG H A 28 ARG HD2 1.0 0.0 6.50 359 334 A 28 ARG H A 28 ARG HD3 1.0 0.0 6.50 360 335 A 28 ARG H A 28 ARG HG2 1.0 0.0 5.83 361 335 A 28 ARG H A 28 ARG HG3 1.0 0.0 5.83 362 336 A 76 GLN H A 75 ASN H 1.0 0.0 6.50 363 337 A 76 GLN H A 60 GLY H 1.0 0.0 5.59 364 338 A 76 GLN H A 75 ASN HD21 1.0 0.0 6.50 365 339 A 61 PHE HA A 76 GLN H 1.0 0.0 6.50 366 340 A 76 GLN H A 60 GLY HAy 1.0 0.0 6.50 367 341 A 76 GLN H A 60 GLY HAx 1.0 0.0 6.50 368 342 A 76 GLN H A 59 ILE HB 1.0 0.0 6.37 369 343 A 9 GLN H A 8 ASN H 1.0 0.0 6.50 370 344 A 9 GLN H A 127 GLY H 1.0 0.0 5.28 371 345 A 9 GLN H A 8 ASN HD21 1.0 0.0 6.05 372 346 A 17 TRP HZ3 A 9 GLN H 1.0 0.0 6.34 373 347 A 9 GLN H A 126 ILE HA 1.0 0.0 6.50 374 348 A 128 PHE HA A 9 GLN H 1.0 0.0 6.50 375 349 A 9 GLN H A 127 GLY HAx 1.0 0.0 6.04 376 350 A 9 GLN H A 8 ASN HBx 1.0 0.0 5.32 377 351 A 9 GLN H A 8 ASN HBy 1.0 0.0 6.08 378 352 A 9 GLN H A 126 ILE HB 1.0 0.0 6.15 379 353 A 9 GLN H A 126 ILE HD1% 1.0 0.0 6.27 380 354 A 8 ASN H A 18 ASN H 1.0 0.0 5.01 381 355 A 18 ASN H A 17 TRP H 1.0 0.0 6.50 382 356 A 17 TRP HE3 A 18 ASN H 1.0 0.0 6.16 383 357 A 18 ASN H A 18 ASN HD22 1.0 0.0 6.50 384 358 A 18 ASN H A 17 TRP HA 1.0 0.0 4.41 385 359 A 18 ASN HBy A 18 ASN H 1.0 0.0 4.96 386 360 A 9 GLN HBy A 18 ASN H 1.0 0.0 6.50 387 361 A 130 GLY H A 131 THR H 1.0 0.0 6.43 388 362 A 131 THR H A 4 TYR HD% 1.0 0.0 5.34 389 363 A 131 THR H A 128 PHE HE% 1.0 0.0 6.50 390 364 A 131 THR H A 128 PHE HZ 1.0 0.0 6.50 391 365 A 6 VAL HA A 131 THR H 1.0 0.0 5.53 392 366 A 131 THR H A 131 THR HB 1.0 0.0 4.71 393 367 A 131 THR H A 4 TYR HBy 1.0 0.0 6.13 394 368 A 131 THR H A 4 TYR HBx 1.0 0.0 5.50 395 369 A 131 THR H A 6 VAL HGy% 1.0 0.0 5.85 396 370 A 131 THR H A 132 LEU HA 1.0 0.0 6.50 397 371 A 4 TYR HD% A 5 ASN H 1.0 0.0 6.00 398 372 A 22 GLN HA A 5 ASN H 1.0 0.0 6.50 399 373 A 5 ASN H A 4 TYR HA 1.0 0.0 4.10 400 374 A 5 ASN H A 132 LEU HA 1.0 0.0 5.85 401 375 A 5 ASN H A 5 ASN HB2 1.0 0.0 4.63 402 375 A 5 ASN H A 5 ASN HB3 1.0 0.0 4.63 403 376 A 4 TYR HBy A 5 ASN H 1.0 0.0 5.74 404 377 A 5 ASN H A 4 TYR HBx 1.0 0.0 5.36 405 378 A 5 ASN H A 133 THR HG2% 1.0 0.0 5.42 406 379 A 6 VAL HGy% A 5 ASN H 1.0 0.0 6.50 407 380 A 5 ASN H A 131 THR HB 1.0 0.0 6.00 408 381 A 5 ASN H A 133 THR HB 1.0 0.0 6.50 409 382 A 95 ARG H A 96 GLU H 1.0 0.0 6.50 410 383 A 98 GLN H A 96 GLU H 1.0 0.0 6.50 411 384 A 96 GLU H A 95 ARG HA 1.0 0.0 4.29 412 385 A 96 GLU H A 95 ARG HD2 1.0 0.0 6.32 413 385 A 95 ARG HD3 A 96 GLU H 1.0 0.0 6.32 414 386 A 96 GLU H A 95 ARG HB2 1.0 0.0 4.46 415 386 A 95 ARG HB3 A 96 GLU H 1.0 0.0 4.46 416 387 A 96 GLU H A 96 GLU HB2 1.0 0.0 4.66 417 387 A 96 GLU H A 96 GLU HB3 1.0 0.0 4.66 418 388 A 17 TRP HE1 A 17 TRP H 1.0 0.0 6.50 419 389 A 17 TRP H A 17 TRP HD1 1.0 0.0 5.08 420 390 A 17 TRP HE3 A 17 TRP H 1.0 0.0 6.50 421 391 A 18 ASN HA A 17 TRP H 1.0 0.0 6.50 422 392 A 16 PRO HA A 17 TRP H 1.0 0.0 4.14 423 393 A 17 TRP H A 17 TRP HBy 1.0 0.0 4.48 424 394 A 17 TRP H A 16 PRO HBy 1.0 0.0 5.23 425 395 A 17 TRP H A 16 PRO HG2 1.0 0.0 6.15 426 395 A 17 TRP H A 16 PRO HG3 1.0 0.0 6.15 427 396 A 17 TRP H A 16 PRO HBx 1.0 0.0 5.23 428 397 A 117 THR H A 105 VAL HB 1.0 0.0 6.50 429 398 A 117 THR H A 117 THR HG2% 1.0 0.0 4.83 430 399 A 53 TYR H A 54 ALA H 1.0 0.0 6.50 431 400 A 120 TYR H A 121 ALA H 1.0 0.0 6.50 432 401 A 54 ALA H A 53 TYR HBy 1.0 0.0 5.49 433 402 A 121 ALA H A 120 TYR HBx 1.0 0.0 5.38 434 403 A 54 ALA H A 31 GLN HG2 1.0 0.0 6.19 435 403 A 31 GLN HG3 A 54 ALA H 1.0 0.0 6.19 436 404 A 84 TRP HE1 A 84 TRP H 1.0 0.0 6.50 437 405 A 84 TRP H A 84 TRP HD1 1.0 0.0 5.06 438 406 A 84 TRP H A 83 PRO HA 1.0 0.0 4.22 439 407 A 84 TRP H A 83 PRO HBy 1.0 0.0 5.27 440 408 A 84 TRP H A 83 PRO HBx 1.0 0.0 5.39 441 409 A 76 GLN HBy A 84 TRP H 1.0 0.0 6.50 442 410 A 120 TYR H A 123 GLU H 1.0 0.0 6.50 443 411 A 123 GLU H A 122 GLY H 1.0 0.0 4.74 444 412 A 123 GLU H A 98 GLN HE21 1.0 0.0 6.50 445 413 A 123 GLU H A 121 ALA HA 1.0 0.0 6.45 446 414 A 123 GLU H A 123 GLU HB2 1.0 0.0 4.71 447 414 A 123 GLU H A 123 GLU HB3 1.0 0.0 4.71 448 415 A 123 GLU H A 121 ALA HB% 1.0 0.0 6.14 449 416 A 53 TYR H A 56 GLU H 1.0 0.0 6.50 450 417 A 56 GLU H A 55 GLY H 1.0 0.0 4.74 451 418 A 54 ALA HA A 56 GLU H 1.0 0.0 6.08 452 419 A 120 TYR HBx A 123 GLU H 1.0 0.0 6.50 453 420 A 56 GLU H A 56 GLU HB2 1.0 0.0 4.65 454 420 A 56 GLU H A 56 GLU HB3 1.0 0.0 4.65 455 421 A 56 GLU H A 56 GLU HGy 1.0 0.0 5.30 456 422 A 56 GLU H A 56 GLU HGx 1.0 0.0 5.30 457 423 A 54 ALA HB% A 56 GLU H 1.0 0.0 6.36 458 424 A 52 THR HG2% A 56 GLU H 1.0 0.0 5.39 459 425 A 34 VAL HGy% A 56 GLU H 1.0 0.0 6.10 460 426 A 35 ALA H A 54 ALA H 1.0 0.0 6.50 461 427 A 121 ALA H A 120 TYR HD% 1.0 0.0 5.89 462 428 A 54 ALA H A 53 TYR HA 1.0 0.0 4.30 463 429 A 121 ALA H A 120 TYR HA 1.0 0.0 4.51 464 430 A 54 ALA H A 33 VAL HA 1.0 0.0 5.17 465 431 A 121 ALA H A 100 VAL HA 1.0 0.0 5.74 466 432 A 54 ALA H A 53 TYR HBx 1.0 0.0 5.49 467 433 A 121 ALA H A 120 TYR HBy 1.0 0.0 6.00 468 434 A 54 ALA HB% A 54 ALA H 1.0 0.0 4.15 469 435 A 121 ALA H A 121 ALA HB% 1.0 0.0 4.39 470 436 A 34 VAL HGx% A 54 ALA H 1.0 0.0 4.90 471 437 A 101 VAL HGx% A 121 ALA H 1.0 0.0 5.09 472 438 A 34 VAL HGy% A 54 ALA H 1.0 0.0 5.31 473 439 A 101 VAL HGy% A 121 ALA H 1.0 0.0 5.50 474 440 A 61 PHE HD% A 50 THR H 1.0 0.0 6.50 475 441 A 50 THR H A 49 GLY HAx 1.0 0.0 4.30 476 442 A 50 THR H A 50 THR HG2% 1.0 0.0 4.99 477 443 A 38 VAL HGx% A 50 THR H 1.0 0.0 4.80 478 444 A 46 THR H A 47 LEU H 1.0 0.0 6.48 479 445 A 63 ALA H A 47 LEU H 1.0 0.0 4.88 480 446 A 46 THR HA A 47 LEU H 1.0 0.0 4.16 481 447 A 62 ARG HA A 47 LEU H 1.0 0.0 6.29 482 448 A 47 LEU H A 46 THR HB 1.0 0.0 4.97 483 449 A 47 LEU H A 47 LEU HBy 1.0 0.0 4.65 484 450 A 46 THR HG2% A 47 LEU H 1.0 0.0 4.97 485 451 A 47 LEU H A 62 ARG HG2 1.0 0.0 5.70 486 451 A 62 ARG HG3 A 47 LEU H 1.0 0.0 5.70 487 452 A 63 ALA HB% A 47 LEU H 1.0 0.0 5.86 488 453 A 47 LEU H A 47 LEU HDy% 1.0 0.0 6.16 489 454 A 47 LEU H A 47 LEU HDx% 1.0 0.0 6.16 490 455 A 95 ARG H A 95 ARG HE 1.0 0.0 6.50 491 456 A 120 TYR HE% A 95 ARG HE 1.0 0.0 6.50 492 457 A 28 ARG H A 29 SER H 1.0 0.0 6.48 493 458 A 29 SER H A 31 GLN H 1.0 0.0 6.32 494 459 A 29 SER H A 29 SER HB2 1.0 0.0 4.53 495 459 A 29 SER H A 29 SER HB3 1.0 0.0 4.53 496 460 A 114 LEU HA A 115 ASN H 1.0 0.0 4.21 497 461 A 115 ASN H A 114 LEU HBx 1.0 0.0 5.58 498 462 A 106 GLU H A 107 SER H 1.0 0.0 5.99 499 463 A 128 PHE HD% A 115 ASN H 1.0 0.0 6.50 500 464 A 84 TRP H A 85 HIS H 1.0 0.0 6.50 501 465 A 84 TRP HE3 A 85 HIS H 1.0 0.0 6.25 502 466 A 85 HIS HD2 A 85 HIS H 1.0 0.0 6.26 503 467 A 85 HIS H A 76 GLN HA 1.0 0.0 6.40 504 468 A 85 HIS H A 84 TRP HBx 1.0 0.0 5.42 505 469 A 83 PRO HBy A 85 HIS H 1.0 0.0 6.34 506 470 A 85 HIS H A 74 GLU HB2 1.0 0.0 6.50 507 470 A 74 GLU HB3 A 85 HIS H 1.0 0.0 6.50 508 471 A 76 GLN HBy A 85 HIS H 1.0 0.0 6.50 509 472 A 36 ILE H A 106 GLU H 1.0 0.0 6.50 510 473 A 105 VAL HA A 106 GLU H 1.0 0.0 4.09 511 474 A 106 GLU H A 106 GLU HG2 1.0 0.0 5.32 512 474 A 106 GLU H A 106 GLU HG3 1.0 0.0 5.32 513 475 A 105 VAL HB A 106 GLU H 1.0 0.0 4.47 514 476 A 106 GLU H A 105 VAL HGy% 1.0 0.0 5.38 515 477 A 106 GLU H A 105 VAL HGx% 1.0 0.0 5.38 516 478 A 95 ARG H A 98 GLN H 1.0 0.0 6.50 517 479 A 98 GLN H A 97 ASN H 1.0 0.0 4.75 518 480 A 98 GLN H A 99 ASN HD22 1.0 0.0 6.50 519 481 A 98 GLN H A 120 TYR HD% 1.0 0.0 6.50 520 482 A 98 GLN H A 99 ASN HA 1.0 0.0 6.50 521 483 A 98 GLN H A 95 ARG HD2 1.0 0.0 6.50 522 483 A 95 ARG HD3 A 98 GLN H 1.0 0.0 6.50 523 484 A 98 GLN H A 98 GLN HGy 1.0 0.0 6.34 524 485 A 98 GLN H A 98 GLN HGx 1.0 0.0 6.34 525 486 A 98 GLN H A 95 ARG HB2 1.0 0.0 5.16 526 486 A 95 ARG HB3 A 98 GLN H 1.0 0.0 5.16 527 487 A 39 GLU H A 48 ASN HA 1.0 0.0 6.50 528 488 A 38 VAL HA A 39 GLU H 1.0 0.0 4.06 529 489 A 39 GLU H A 47 LEU HA 1.0 0.0 6.15 530 490 A 39 GLU H A 102 ALA HA 1.0 0.0 6.50 531 491 A 39 GLU H A 49 GLY HAy 1.0 0.0 6.06 532 492 A 39 GLU H A 38 VAL HB 1.0 0.0 4.46 533 493 A 39 GLU H A 47 LEU HBx 1.0 0.0 6.50 534 494 A 39 GLU H A 38 VAL HGy% 1.0 0.0 5.76 535 495 A 38 VAL HGx% A 39 GLU H 1.0 0.0 5.35 536 496 A 36 ILE H A 51 MET HGy 1.0 0.0 6.50 537 497 A 36 ILE H A 106 GLU HB2 1.0 0.0 6.50 538 497 A 36 ILE H A 106 GLU HB3 1.0 0.0 6.50 539 498 A 36 ILE H A 35 ALA HB% 1.0 0.0 4.62 540 499 A 103 ILE H A 102 ALA HB% 1.0 0.0 4.89 541 500 A 38 VAL HGx% A 103 ILE H 1.0 0.0 6.50 542 501 A 36 ILE H A 37 ASN HD21 1.0 0.0 6.50 543 502 A 36 ILE H A 37 ASN HA 1.0 0.0 6.50 544 503 A 103 ILE H A 37 ASN HA 1.0 0.0 6.50 545 504 A 103 ILE H A 39 GLU HA 1.0 0.0 5.26 546 505 A 36 ILE H A 106 GLU HA 1.0 0.0 5.64 547 506 A 36 ILE H A 35 ALA HA 1.0 0.0 4.26 548 507 A 103 ILE H A 102 ALA HA 1.0 0.0 4.50 549 508 A 52 THR HB A 36 ILE H 1.0 0.0 6.50 550 509 A 119 THR HB A 103 ILE H 1.0 0.0 6.50 551 510 A 103 ILE H A 103 ILE HD1% 1.0 0.0 6.10 552 511 A 103 ILE H A 38 VAL HGy% 1.0 0.0 4.49 553 512 A 32 ASN H A 31 GLN H 1.0 0.0 5.96 554 513 A 28 ARG H A 31 GLN H 1.0 0.0 6.50 555 514 A 31 GLN H A 29 SER HA 1.0 0.0 6.31 556 515 A 31 GLN H A 29 SER HB2 1.0 0.0 6.50 557 515 A 31 GLN H A 29 SER HB3 1.0 0.0 6.50 558 516 A 31 GLN H A 28 ARG HD2 1.0 0.0 6.50 559 516 A 28 ARG HD3 A 31 GLN H 1.0 0.0 6.50 560 517 A 31 GLN H A 31 GLN HG2 1.0 0.0 5.72 561 517 A 31 GLN HG3 A 31 GLN H 1.0 0.0 5.72 562 518 A 74 GLU H A 62 ARG HE 1.0 0.0 6.50 563 519 A 62 ARG H A 62 ARG HE 1.0 0.0 6.50 564 520 A 84 TRP HE3 A 62 ARG HE 1.0 0.0 6.50 565 521 A 62 ARG HA A 62 ARG HE 1.0 0.0 6.50 566 522 A 62 ARG HE A 74 GLU HA 1.0 0.0 6.50 567 523 A 62 ARG HE A 74 GLU HB2 1.0 0.0 5.70 568 523 A 74 GLU HB3 A 62 ARG HE 1.0 0.0 5.70 569 524 A 62 ARG HE A 62 ARG HG2 1.0 0.0 4.78 570 524 A 62 ARG HG3 A 62 ARG HE 1.0 0.0 4.78 571 525 A 86 SER H A 85 HIS HBx 1.0 0.0 6.05 572 526 A 42 ASP H A 41 GLY H 1.0 0.0 4.56 573 527 A 41 GLY H A 40 SER HA 1.0 0.0 4.17 574 528 A 108 GLY H A 107 SER HA 1.0 0.0 4.44 575 529 A 41 GLY H A 42 ASP HBy 1.0 0.0 6.50 576 530 A 108 GLY H A 109 ASP HBy 1.0 0.0 6.50 577 531 A 41 GLY H A 42 ASP HBx 1.0 0.0 6.50 578 532 A 108 GLY H A 109 ASP HBx 1.0 0.0 6.50 579 533 A 86 SER H A 86 SER HBy 1.0 0.0 4.90 580 534 A 86 SER H A 86 SER HBx 1.0 0.0 4.90 581 535 A 86 SER H A 85 HIS HBy 1.0 0.0 6.05 582 536 A 97 ASN H A 96 GLU HA 1.0 0.0 4.52 583 537 A 29 SER H A 30 ASP H 1.0 0.0 4.95 584 538 A 31 GLN H A 30 ASP H 1.0 0.0 4.52 585 539 A 30 ASP H A 29 SER HB2 1.0 0.0 5.27 586 539 A 29 SER HB3 A 30 ASP H 1.0 0.0 5.27 587 540 A 30 ASP H A 31 GLN HG2 1.0 0.0 6.50 588 540 A 31 GLN HG3 A 30 ASP H 1.0 0.0 6.50 589 541 A 58 PRO HA A 59 ILE H 1.0 0.0 4.46 590 542 A 126 ILE H A 126 ILE HG1y 1.0 0.0 4.76 591 543 A 59 ILE H A 59 ILE HG2% 1.0 0.0 4.95 592 544 A 53 TYR HD% A 59 ILE H 1.0 0.0 6.50 593 545 A 50 THR HA A 59 ILE H 1.0 0.0 6.50 594 546 A 117 THR HA A 126 ILE H 1.0 0.0 6.50 595 547 A 59 ILE H A 50 THR HB 1.0 0.0 6.32 596 548 A 126 ILE H A 117 THR HB 1.0 0.0 6.50 597 549 A 23 TRP H A 22 GLN H 1.0 0.0 6.09 598 550 A 23 TRP HD1 A 22 GLN H 1.0 0.0 5.83 599 551 A 21 GLY HAx A 22 GLN H 1.0 0.0 4.33 600 552 A 22 GLN H A 21 GLY HAy 1.0 0.0 4.39 601 553 A 22 GLN H A 22 GLN HBx 1.0 0.0 4.56 602 554 A 6 VAL HB A 22 GLN H 1.0 0.0 6.50 603 555 A 6 VAL HGy% A 22 GLN H 1.0 0.0 6.50 604 556 A 90 TRP HE1 A 89 ASN H 1.0 0.0 6.50 605 557 A 90 TRP H A 89 ASN H 1.0 0.0 5.97 606 558 A 89 ASN H A 88 GLY H 1.0 0.0 6.50 607 559 A 90 TRP HD1 A 89 ASN H 1.0 0.0 5.73 608 560 A 89 ASN H A 90 TRP HA 1.0 0.0 6.50 609 561 A 72 GLU HA A 89 ASN H 1.0 0.0 6.28 610 562 A 89 ASN H A 88 GLY HAy 1.0 0.0 4.34 611 563 A 89 ASN H A 88 GLY HAx 1.0 0.0 4.43 612 564 A 89 ASN H A 89 ASN HBy 1.0 0.0 4.49 613 565 A 73 VAL HB A 89 ASN H 1.0 0.0 6.50 614 566 A 73 VAL HGy% A 89 ASN H 1.0 0.0 6.50 615 567 A 41 GLY H A 48 ASN H 1.0 0.0 6.50 616 568 A 61 PHE HD% A 48 ASN H 1.0 0.0 6.50 617 569 A 61 PHE HE% A 48 ASN H 1.0 0.0 6.50 618 570 A 40 SER HA A 48 ASN H 1.0 0.0 5.32 619 571 A 47 LEU HA A 48 ASN H 1.0 0.0 4.23 620 572 A 38 VAL HB A 48 ASN H 1.0 0.0 5.35 621 573 A 47 LEU HBy A 48 ASN H 1.0 0.0 5.86 622 574 A 48 ASN H A 47 LEU HG 1.0 0.0 6.27 623 575 A 47 LEU HBx A 48 ASN H 1.0 0.0 5.33 624 576 A 38 VAL HGx% A 48 ASN H 1.0 0.0 6.50 625 577 A 66 LEU H A 64 THR H 1.0 0.0 6.50 626 578 A 72 GLU H A 64 THR H 1.0 0.0 4.91 627 579 A 64 THR H A 63 ALA HA 1.0 0.0 4.13 628 580 A 71 TYR HA A 64 THR H 1.0 0.0 5.94 629 581 A 73 VAL HA A 64 THR H 1.0 0.0 5.59 630 582 A 64 THR HB A 64 THR H 1.0 0.0 4.68 631 583 A 65 LEU HA A 64 THR H 1.0 0.0 6.50 632 584 A 64 THR H A 71 TYR HB2 1.0 0.0 5.41 633 584 A 71 TYR HB3 A 64 THR H 1.0 0.0 5.41 634 585 A 64 THR H A 72 GLU HB2 1.0 0.0 5.33 635 585 A 64 THR H A 72 GLU HB3 1.0 0.0 5.33 636 586 A 63 ALA HB% A 64 THR H 1.0 0.0 4.70 637 587 A 64 THR H A 73 VAL HGy% 1.0 0.0 6.27 638 588 A 17 TRP HE3 A 8 ASN H 1.0 0.0 5.56 639 589 A 17 TRP HZ3 A 8 ASN H 1.0 0.0 6.50 640 590 A 8 ASN H A 7 GLU HA 1.0 0.0 4.26 641 591 A 8 ASN H A 8 ASN HBy 1.0 0.0 5.05 642 592 A 8 ASN H A 19 GLU HB2 1.0 0.0 4.96 643 592 A 19 GLU HB3 A 8 ASN H 1.0 0.0 4.96 644 593 A 8 ASN H A 7 GLU HB2 1.0 0.0 5.62 645 593 A 7 GLU HB3 A 8 ASN H 1.0 0.0 5.62 646 594 A 8 ASN H A 126 ILE HD1% 1.0 0.0 6.50 647 595 A 129 LYS HBx A 8 ASN H 1.0 0.0 6.50 648 596 A 75 ASN H A 85 HIS H 1.0 0.0 5.93 649 597 A 62 ARG H A 75 ASN H 1.0 0.0 6.50 650 598 A 75 ASN H A 75 ASN HD21 1.0 0.0 6.50 651 599 A 75 ASN H A 88 GLY H 1.0 0.0 6.50 652 600 A 84 TRP HE3 A 75 ASN H 1.0 0.0 5.90 653 601 A 75 ASN H A 74 GLU HA 1.0 0.0 4.39 654 602 A 75 ASN H A 86 SER HA 1.0 0.0 6.42 655 603 A 87 GLY HAx A 75 ASN H 1.0 0.0 6.50 656 604 A 75 ASN H A 74 GLU HB2 1.0 0.0 5.79 657 604 A 74 GLU HB3 A 75 ASN H 1.0 0.0 5.79 658 605 A 73 VAL HGx% A 75 ASN H 1.0 0.0 6.50 659 606 A 8 ASN H A 19 GLU HA 1.0 0.0 6.39 660 607 A 6 VAL HGx% A 8 ASN H 1.0 0.0 6.33 661 608 A 46 THR H A 43 ASP H 1.0 0.0 6.50 662 609 A 41 GLY H A 43 ASP H 1.0 0.0 6.45 663 610 A 42 ASP H A 43 ASP H 1.0 0.0 4.73 664 611 A 45 GLN H A 43 ASP H 1.0 0.0 6.50 665 612 A 112 GLN H A 110 ASP H 1.0 0.0 6.50 666 613 A 110 ASP H A 109 ASP HBy 1.0 0.0 6.50 667 614 A 110 ASP H A 109 ASP HBx 1.0 0.0 6.50 668 615 A 54 ALA HB% A 110 ASP H 1.0 0.0 6.50 669 616 A 34 VAL HGx% A 110 ASP H 1.0 0.0 6.11 670 617 A 101 VAL HGx% A 43 ASP H 1.0 0.0 6.50 671 618 A 74 GLU HA A 87 GLY H 1.0 0.0 4.72 672 619 A 87 GLY H A 72 GLU HG2 1.0 0.0 5.49 673 619 A 72 GLU HG3 A 87 GLY H 1.0 0.0 5.49 674 620 A 73 VAL H A 87 GLY H 1.0 0.0 6.50 675 621 A 86 SER HA A 87 GLY H 1.0 0.0 4.28 676 622 A 87 GLY H A 86 SER HBy 1.0 0.0 5.81 677 623 A 87 GLY H A 86 SER HBx 1.0 0.0 5.81 678 624 A 73 VAL HB A 87 GLY H 1.0 0.0 6.42 679 625 A 73 VAL HGx% A 87 GLY H 1.0 0.0 5.91 680 626 A 80 ASP H A 79 GLY HAy 1.0 0.0 4.51 681 627 A 80 ASP H A 79 GLY HAx 1.0 0.0 4.51 682 628 A 80 ASP H A 80 ASP HB2 1.0 0.0 4.36 683 628 A 80 ASP H A 80 ASP HB3 1.0 0.0 4.36 684 629 A 80 ASP H A 82 ALA HB% 1.0 0.0 6.50 685 630 A 126 ILE H A 118 MET H 1.0 0.0 5.09 686 631 A 128 PHE HD% A 118 MET H 1.0 0.0 6.50 687 632 A 117 THR HA A 118 MET H 1.0 0.0 4.55 688 633 A 117 THR HB A 118 MET H 1.0 0.0 4.56 689 634 A 103 ILE HA A 118 MET H 1.0 0.0 6.50 690 635 A 118 MET H A 118 MET HGy 1.0 0.0 5.41 691 636 A 118 MET H A 118 MET HGx 1.0 0.0 5.41 692 637 A 117 THR HG2% A 118 MET H 1.0 0.0 5.41 693 638 A 103 ILE HG2% A 118 MET H 1.0 0.0 6.50 694 639 A 59 ILE H A 51 MET H 1.0 0.0 5.63 695 640 A 61 PHE HD% A 51 MET H 1.0 0.0 6.50 696 641 A 50 THR HB A 51 MET H 1.0 0.0 4.90 697 642 A 51 MET HGy A 51 MET H 1.0 0.0 6.05 698 643 A 50 THR HG2% A 51 MET H 1.0 0.0 5.66 699 644 A 36 ILE HG2% A 51 MET H 1.0 0.0 6.50 700 645 A 38 VAL HGx% A 51 MET H 1.0 0.0 6.50 701 646 A 108 GLY H A 107 SER H 1.0 0.0 6.50 702 647 A 34 VAL HB A 107 SER H 1.0 0.0 6.15 703 648 A 34 VAL HGx% A 107 SER H 1.0 0.0 6.18 704 649 A 34 VAL HGy% A 107 SER H 1.0 0.0 6.47 705 650 A 35 ALA H A 107 SER H 1.0 0.0 6.50 706 651 A 106 GLU HA A 107 SER H 1.0 0.0 4.27 707 652 A 107 SER H A 34 VAL HA 1.0 0.0 5.29 708 653 A 107 SER H A 107 SER HBy 1.0 0.0 5.04 709 654 A 107 SER H A 107 SER HBx 1.0 0.0 5.04 710 655 A 35 ALA HB% A 107 SER H 1.0 0.0 5.83 711 656 A 15 ALA H A 14 SER H 1.0 0.0 4.29 712 657 A 41 GLY H A 40 SER H 1.0 0.0 6.45 713 658 A 39 GLU H A 40 SER H 1.0 0.0 5.66 714 659 A 102 ALA H A 40 SER H 1.0 0.0 6.50 715 660 A 39 GLU HA A 40 SER H 1.0 0.0 4.19 716 661 A 40 SER H A 40 SER HBy 1.0 0.0 4.97 717 662 A 40 SER H A 40 SER HBx 1.0 0.0 4.97 718 663 A 101 VAL HB A 40 SER H 1.0 0.0 5.27 719 664 A 102 ALA HB% A 40 SER H 1.0 0.0 5.72 720 665 A 101 VAL HGx% A 40 SER H 1.0 0.0 6.50 721 666 A 101 VAL HGy% A 40 SER H 1.0 0.0 6.50 722 667 A 36 ILE H A 105 VAL H 1.0 0.0 4.98 723 668 A 105 VAL H A 104 ASN HA 1.0 0.0 4.08 724 669 A 35 ALA HA A 105 VAL H 1.0 0.0 6.50 725 670 A 36 ILE HA A 105 VAL H 1.0 0.0 6.50 726 671 A 105 VAL H A 104 ASN HBy 1.0 0.0 6.21 727 672 A 105 VAL H A 104 ASN HBx 1.0 0.0 6.21 728 673 A 105 VAL H A 36 ILE HB 1.0 0.0 5.35 729 674 A 104 ASN H A 38 VAL H 1.0 0.0 6.43 730 675 A 103 ILE H A 38 VAL H 1.0 0.0 4.78 731 676 A 37 ASN HD21 A 38 VAL H 1.0 0.0 6.50 732 677 A 37 ASN HA A 38 VAL H 1.0 0.0 4.07 733 678 A 102 ALA HA A 38 VAL H 1.0 0.0 6.50 734 679 A 103 ILE HA A 38 VAL H 1.0 0.0 6.38 735 680 A 38 VAL H A 37 ASN HBy 1.0 0.0 6.12 736 681 A 38 VAL H A 37 ASN HBx 1.0 0.0 6.12 737 682 A 103 ILE HB A 38 VAL H 1.0 0.0 5.27 738 683 A 36 ILE HG2% A 38 VAL H 1.0 0.0 5.57 739 684 A 103 ILE HG2% A 38 VAL H 1.0 0.0 6.02 740 685 A 38 VAL HGx% A 38 VAL H 1.0 0.0 5.15 741 686 A 5 ASN HA A 5 ASN HD22 1.0 0.0 6.50 742 687 A 130 GLY H A 114 LEU H 1.0 0.0 5.18 743 688 A 130 GLY H A 129 LYS HA 1.0 0.0 4.23 744 689 A 130 GLY H A 113 THR HB 1.0 0.0 6.50 745 690 A 130 GLY H A 114 LEU HBy 1.0 0.0 5.39 746 691 A 130 GLY H A 129 LYS HBy 1.0 0.0 5.51 747 692 A 130 GLY H A 128 PHE HD% 1.0 0.0 5.42 748 693 A 130 GLY H A 128 PHE HE% 1.0 0.0 5.21 749 694 A 130 GLY H A 6 VAL HGy% 1.0 0.0 6.50 750 695 A 5 ASN H A 5 ASN HD21 1.0 0.0 6.50 751 696 A 5 ASN HA A 5 ASN HD21 1.0 0.0 6.50 752 697 A 5 ASN HD21 A 133 THR HA 1.0 0.0 6.50 753 698 A 22 GLN HBx A 5 ASN HD21 1.0 0.0 6.50 754 699 A 133 THR HG2% A 5 ASN HD21 1.0 0.0 5.29 755 700 A 5 ASN H A 5 ASN HD22 1.0 0.0 6.50 756 701 A 5 ASN HD22 A 133 THR HA 1.0 0.0 6.50 757 702 A 22 GLN HBx A 5 ASN HD22 1.0 0.0 6.50 758 703 A 133 THR HG2% A 5 ASN HD22 1.0 0.0 5.29 759 704 A 53 TYR H A 52 THR H 1.0 0.0 6.49 760 705 A 120 TYR H A 119 THR H 1.0 0.0 6.50 761 706 A 36 ILE H A 52 THR H 1.0 0.0 6.50 762 707 A 103 ILE H A 119 THR H 1.0 0.0 6.50 763 708 A 52 THR HB A 52 THR H 1.0 0.0 4.76 764 709 A 119 THR HB A 119 THR H 1.0 0.0 5.08 765 710 A 119 THR H A 118 MET HB2 1.0 0.0 5.11 766 710 A 118 MET HB3 A 119 THR H 1.0 0.0 5.11 767 711 A 59 ILE H A 52 THR H 1.0 0.0 6.50 768 712 A 126 ILE H A 119 THR H 1.0 0.0 6.50 769 713 A 102 ALA H A 119 THR H 1.0 0.0 4.50 770 714 A 51 MET HA A 52 THR H 1.0 0.0 4.34 771 715 A 36 ILE HA A 52 THR H 1.0 0.0 5.38 772 716 A 103 ILE HA A 119 THR H 1.0 0.0 6.01 773 717 A 51 MET HGy A 52 THR H 1.0 0.0 5.60 774 718 A 102 ALA HB% A 119 THR H 1.0 0.0 4.57 775 719 A 52 THR HG2% A 52 THR H 1.0 0.0 5.81 776 720 A 119 THR HG2% A 119 THR H 1.0 0.0 6.23 777 721 A 84 TRP HE1 A 76 GLN HE21 1.0 0.0 5.95 778 722 A 77 TRP H A 76 GLN HE21 1.0 0.0 6.50 779 723 A 76 GLN HE21 A 81 SER H 1.0 0.0 6.50 780 724 A 76 GLN HE21 A 80 ASP HA 1.0 0.0 6.50 781 725 A 76 GLN HE21 A 84 TRP HA 1.0 0.0 6.50 782 726 A 84 TRP HBx A 76 GLN HE21 1.0 0.0 6.50 783 727 A 76 GLN HBx A 76 GLN HE21 1.0 0.0 6.50 784 728 A 76 GLN HBy A 76 GLN HE21 1.0 0.0 6.48 785 729 A 13 SER HA A 9 GLN HE21 1.0 0.0 5.97 786 730 A 9 GLN HBx A 9 GLN HE21 1.0 0.0 6.50 787 731 A 9 GLN HBy A 9 GLN HE21 1.0 0.0 6.50 788 732 A 76 GLN HE22 A 80 ASP H 1.0 0.0 6.50 789 733 A 76 GLN HE22 A 81 SER HA 1.0 0.0 6.50 790 734 A 76 GLN HE22 A 80 ASP HA 1.0 0.0 5.46 791 735 A 76 GLN HE22 A 80 ASP HB2 1.0 0.0 6.50 792 735 A 76 GLN HE22 A 80 ASP HB3 1.0 0.0 6.50 793 736 A 76 GLN HE22 A 82 ALA HB% 1.0 0.0 6.36 794 737 A 13 SER HA A 9 GLN HE22 1.0 0.0 5.97 795 738 A 9 GLN HBx A 9 GLN HE22 1.0 0.0 6.50 796 739 A 9 GLN HBy A 9 GLN HE22 1.0 0.0 6.50 797 740 A 70 SER H A 71 TYR H 1.0 0.0 5.62 798 741 A 70 SER H A 69 ASN H 1.0 0.0 4.96 799 742 A 70 SER H A 67 GLY H 1.0 0.0 6.40 800 743 A 70 SER H A 68 ASN HA 1.0 0.0 6.48 801 744 A 70 SER H A 69 ASN HBx 1.0 0.0 6.50 802 745 A 70 SER H A 91 ILE HG2% 1.0 0.0 6.50 803 746 A 70 SER H A 91 ILE HD1% 1.0 0.0 6.50 804 747 A 48 ASN HA A 48 ASN HD21 1.0 0.0 6.50 805 748 A 40 SER HA A 48 ASN HD21 1.0 0.0 6.50 806 749 A 46 THR HB A 48 ASN HD21 1.0 0.0 6.50 807 750 A 41 GLY H A 48 ASN HD21 1.0 0.0 6.50 808 751 A 129 LYS HEy A 115 ASN HD21 1.0 0.0 6.50 809 752 A 115 ASN HD21 A 115 ASN HA 1.0 0.0 6.50 810 753 A 107 SER HA A 115 ASN HD21 1.0 0.0 6.50 811 754 A 114 LEU HA A 115 ASN HD21 1.0 0.0 6.50 812 755 A 115 ASN HD21 A 129 LYS HGx 1.0 0.0 6.50 813 756 A 41 GLY H A 48 ASN HD22 1.0 0.0 6.50 814 757 A 48 ASN HA A 48 ASN HD22 1.0 0.0 6.50 815 758 A 40 SER HA A 48 ASN HD22 1.0 0.0 6.50 816 759 A 46 THR HB A 48 ASN HD22 1.0 0.0 6.50 817 760 A 115 ASN HA A 115 ASN HD22 1.0 0.0 6.50 818 761 A 107 SER HA A 115 ASN HD22 1.0 0.0 6.50 819 762 A 114 LEU HA A 115 ASN HD22 1.0 0.0 6.50 820 763 A 129 LYS HEy A 115 ASN HD22 1.0 0.0 6.50 821 764 A 129 LYS HGx A 115 ASN HD22 1.0 0.0 6.50 822 765 A 18 ASN H A 18 ASN HD21 1.0 0.0 6.50 823 766 A 18 ASN HD21 A 9 GLN HA 1.0 0.0 6.50 824 767 A 10 TRP H A 18 ASN HD22 1.0 0.0 6.50 825 768 A 18 ASN HD22 A 9 GLN HA 1.0 0.0 6.50 826 769 A 53 TYR HD% A 34 VAL H 1.0 0.0 6.50 827 770 A 34 VAL H A 34 VAL HGy% 1.0 0.0 5.01 828 771 A 10 TRP HE1 A 18 ASN HD21 1.0 0.0 6.50 829 772 A 10 TRP H A 18 ASN HD21 1.0 0.0 6.50 830 773 A 18 ASN HA A 18 ASN HD21 1.0 0.0 6.50 831 774 A 10 TRP HE1 A 18 ASN HD22 1.0 0.0 6.50 832 775 A 18 ASN HA A 18 ASN HD22 1.0 0.0 6.50 833 776 A 22 GLN HA A 20 GLY H 1.0 0.0 6.50 834 777 A 8 ASN H A 20 GLY H 1.0 0.0 6.39 835 778 A 7 GLU HA A 20 GLY H 1.0 0.0 4.99 836 779 A 19 GLU HA A 20 GLY H 1.0 0.0 4.17 837 780 A 20 GLY H A 19 GLU HB2 1.0 0.0 5.17 838 780 A 19 GLU HB3 A 20 GLY H 1.0 0.0 5.17 839 781 A 6 VAL HB A 20 GLY H 1.0 0.0 6.50 840 782 A 6 VAL HGx% A 20 GLY H 1.0 0.0 6.02 841 783 A 120 TYR H A 101 VAL H 1.0 0.0 6.50 842 784 A 121 ALA H A 98 GLN HE22 1.0 0.0 6.50 843 785 A 120 TYR HBx A 98 GLN HE22 1.0 0.0 5.90 844 786 A 98 GLN HE22 A 123 GLU HB2 1.0 0.0 5.93 845 786 A 123 GLU HB3 A 98 GLN HE22 1.0 0.0 5.93 846 787 A 98 GLN HE22 A 123 GLU HGy 1.0 0.0 5.99 847 788 A 98 GLN HE22 A 123 GLU HGx 1.0 0.0 5.99 848 789 A 121 ALA HB% A 98 GLN HE22 1.0 0.0 6.50 849 790 A 120 TYR H A 98 GLN HE21 1.0 0.0 6.50 850 791 A 120 TYR HBx A 98 GLN HE21 1.0 0.0 5.82 851 792 A 98 GLN HE21 A 123 GLU HB2 1.0 0.0 6.23 852 792 A 98 GLN HE21 A 123 GLU HB3 1.0 0.0 6.23 853 793 A 98 GLN HE21 A 121 ALA HB% 1.0 0.0 6.50 854 794 A 102 ALA H A 101 VAL H 1.0 0.0 4.28 855 795 A 120 TYR HA A 101 VAL H 1.0 0.0 5.01 856 796 A 100 VAL HA A 101 VAL H 1.0 0.0 4.36 857 797 A 120 TYR HBx A 101 VAL H 1.0 0.0 6.50 858 798 A 100 VAL HB A 101 VAL H 1.0 0.0 6.50 859 799 A 119 THR HG2% A 101 VAL H 1.0 0.0 6.37 860 800 A 101 VAL HGy% A 101 VAL H 1.0 0.0 4.86 861 801 A 82 ALA HB% A 81 SER H 1.0 0.0 5.52 862 802 A 76 GLN HE22 A 81 SER H 1.0 0.0 6.50 863 803 A 81 SER H A 80 ASP HB2 1.0 0.0 5.00 864 803 A 80 ASP HB3 A 81 SER H 1.0 0.0 5.00 865 804 A 22 GLN HE21 A 23 TRP H 1.0 0.0 6.50 866 805 A 22 GLN HE21 A 22 GLN HA 1.0 0.0 6.50 867 806 A 22 GLN HE21 A 5 ASN HA 1.0 0.0 6.50 868 807 A 22 GLN HE21 A 133 THR HB 1.0 0.0 6.50 869 808 A 22 GLN HE21 A 22 GLN HBx 1.0 0.0 6.35 870 809 A 22 GLN HE21 A 3 LEU HG 1.0 0.0 6.50 871 810 A 22 GLN HE21 A 133 THR HG2% 1.0 0.0 5.27 872 811 A 68 ASN H A 68 ASN HD21 1.0 0.0 6.50 873 812 A 68 ASN HA A 68 ASN HD21 1.0 0.0 6.50 874 813 A 95 ARG H A 69 ASN HD21 1.0 0.0 6.21 875 814 A 69 ASN H A 69 ASN HD21 1.0 0.0 6.50 876 815 A 91 ILE HG2% A 69 ASN HD22 1.0 0.0 6.50 877 816 A 5 ASN HA A 22 GLN HE22 1.0 0.0 6.50 878 817 A 133 THR HB A 22 GLN HE22 1.0 0.0 6.50 879 818 A 22 GLN HE22 A 3 LEU HBx 1.0 0.0 6.50 880 819 A 3 LEU HG A 22 GLN HE22 1.0 0.0 6.50 881 820 A 133 THR HG2% A 22 GLN HE22 1.0 0.0 5.51 882 821 A 68 ASN H A 68 ASN HD22 1.0 0.0 6.50 883 822 A 68 ASN HA A 68 ASN HD22 1.0 0.0 6.50 884 823 A 114 LEU H A 113 THR H 1.0 0.0 6.50 885 824 A 109 ASP H A 113 THR H 1.0 0.0 6.50 886 825 A 112 GLN H A 113 THR H 1.0 0.0 4.65 887 826 A 113 THR H A 111 GLY HAy 1.0 0.0 6.50 888 827 A 113 THR HG2% A 113 THR H 1.0 0.0 5.47 889 828 A 90 TRP HE1 A 27 SER H 1.0 0.0 6.50 890 829 A 28 ARG H A 27 SER H 1.0 0.0 5.07 891 830 A 53 TYR HE% A 27 SER H 1.0 0.0 6.50 892 831 A 90 TRP HD1 A 27 SER H 1.0 0.0 6.50 893 832 A 27 SER H A 25 ILE HG2% 1.0 0.0 6.50 894 833 A 65 LEU H A 45 GLN HE21 1.0 0.0 6.50 895 834 A 69 ASN HA A 69 ASN HD21 1.0 0.0 6.50 896 835 A 91 ILE HG2% A 69 ASN HD21 1.0 0.0 6.50 897 836 A 69 ASN HD22 A 69 ASN H 1.0 0.0 6.50 898 837 A 69 ASN HD22 A 69 ASN HA 1.0 0.0 6.50 899 838 A 65 LEU H A 45 GLN HE22 1.0 0.0 6.50 900 839 A 45 GLN HA A 45 GLN HE22 1.0 0.0 6.50 901 840 A 45 GLN HA A 45 GLN HE21 1.0 0.0 6.50 902 841 A 46 THR H A 44 GLY H 1.0 0.0 6.06 903 842 A 46 THR H A 45 GLN H 1.0 0.0 4.63 904 843 A 46 THR H A 46 THR HG2% 1.0 0.0 5.34 905 844 A 32 ASN H A 32 ASN HD21 1.0 0.0 6.50 906 845 A 32 ASN HA A 32 ASN HD21 1.0 0.0 6.50 907 846 A 32 ASN HD21 A 111 GLY HAx 1.0 0.0 6.18 908 847 A 111 GLY HAy A 32 ASN HD21 1.0 0.0 6.50 909 848 A 32 ASN H A 32 ASN HD22 1.0 0.0 6.50 910 849 A 32 ASN HA A 32 ASN HD22 1.0 0.0 6.50 911 850 A 111 GLY HAx A 32 ASN HD22 1.0 0.0 6.18 912 851 A 111 GLY HAy A 32 ASN HD22 1.0 0.0 6.50 913 852 A 26 GLY H A 25 ILE H 1.0 0.0 6.50 914 853 A 26 GLY H A 91 ILE H 1.0 0.0 6.50 915 854 A 26 GLY H A 27 SER H 1.0 0.0 6.50 916 855 A 26 GLY H A 90 TRP HH2 1.0 0.0 6.50 917 856 A 26 GLY H A 25 ILE HB 1.0 0.0 6.34 918 857 A 26 GLY H A 25 ILE HG2% 1.0 0.0 5.43 919 858 A 122 GLY H A 120 TYR HA 1.0 0.0 6.50 920 859 A 122 GLY H A 123 GLU HB2 1.0 0.0 6.50 921 859 A 122 GLY H A 123 GLU HB3 1.0 0.0 6.50 922 860 A 101 VAL HGy% A 122 GLY H 1.0 0.0 5.68 923 861 A 122 GLY H A 121 ALA HB% 1.0 0.0 4.96 924 862 A 101 VAL HGx% A 122 GLY H 1.0 0.0 5.85 925 863 A 15 ALA H A 13 SER H 1.0 0.0 6.41 926 864 A 54 ALA HA A 55 GLY H 1.0 0.0 4.08 927 865 A 54 ALA HB% A 55 GLY H 1.0 0.0 4.94 928 866 A 52 THR HG2% A 55 GLY H 1.0 0.0 6.50 929 867 A 34 VAL HGx% A 55 GLY H 1.0 0.0 5.53 930 868 A 34 VAL HGy% A 55 GLY H 1.0 0.0 5.37 931 869 A 99 ASN H A 99 ASN HD21 1.0 0.0 6.22 932 870 A 99 ASN HD21 A 99 ASN HA 1.0 0.0 6.04 933 871 A 99 ASN HD21 A 44 GLY HAy 1.0 0.0 6.50 934 872 A 99 ASN HD21 A 44 GLY HAx 1.0 0.0 6.50 935 873 A 99 ASN HD21 A 121 ALA HB% 1.0 0.0 6.50 936 874 A 99 ASN HD21 A 65 LEU HDx% 1.0 0.0 6.50 937 875 A 99 ASN HD21 A 65 LEU HDy% 1.0 0.0 6.50 938 876 A 99 ASN H A 99 ASN HD22 1.0 0.0 6.33 939 877 A 67 GLY HAy A 99 ASN HD22 1.0 0.0 6.50 940 878 A 121 ALA HB% A 99 ASN HD22 1.0 0.0 6.50 941 879 A 99 ASN HD22 A 65 LEU HDx% 1.0 0.0 6.27 942 880 A 99 ASN HD22 A 65 LEU HDy% 1.0 0.0 6.27 943 881 A 23 TRP HE1 A 21 GLY H 1.0 0.0 6.50 944 882 A 21 GLY H A 20 GLY H 1.0 0.0 4.60 945 883 A 21 GLY H A 22 GLN H 1.0 0.0 6.15 946 884 A 21 GLY H A 22 GLN HA 1.0 0.0 6.50 947 885 A 21 GLY H A 19 GLU HG2 1.0 0.0 5.26 948 885 A 21 GLY H A 19 GLU HG3 1.0 0.0 5.26 949 886 A 21 GLY H A 19 GLU HB2 1.0 0.0 5.43 950 886 A 21 GLY H A 19 GLU HB3 1.0 0.0 5.43 951 887 A 6 VAL HGx% A 21 GLY H 1.0 0.0 6.43 952 888 A 6 VAL HB A 21 GLY H 1.0 0.0 6.22 953 889 A 23 TRP HE1 A 94 SER H 1.0 0.0 6.50 954 890 A 95 ARG H A 94 SER H 1.0 0.0 4.67 955 891 A 94 SER H A 93 GLY H 1.0 0.0 6.15 956 892 A 71 TYR H A 89 ASN HD21 1.0 0.0 6.50 957 893 A 90 TRP H A 89 ASN HD21 1.0 0.0 6.50 958 894 A 73 VAL H A 89 ASN HD21 1.0 0.0 6.50 959 895 A 89 ASN H A 89 ASN HD21 1.0 0.0 6.50 960 896 A 72 GLU HA A 89 ASN HD21 1.0 0.0 6.39 961 897 A 89 ASN HD21 A 72 GLU HB2 1.0 0.0 6.50 962 897 A 72 GLU HB3 A 89 ASN HD21 1.0 0.0 6.50 963 898 A 89 ASN HD21 A 66 LEU HG 1.0 0.0 6.50 964 899 A 73 VAL H A 89 ASN HD22 1.0 0.0 6.50 965 900 A 89 ASN H A 89 ASN HD22 1.0 0.0 6.50 966 901 A 72 GLU HA A 89 ASN HD22 1.0 0.0 6.39 967 902 A 71 TYR H A 89 ASN HD22 1.0 0.0 6.50 968 903 A 90 TRP H A 89 ASN HD22 1.0 0.0 6.50 969 904 A 89 ASN HD22 A 72 GLU HB2 1.0 0.0 6.50 970 904 A 72 GLU HB3 A 89 ASN HD22 1.0 0.0 6.50 971 905 A 66 LEU HG A 89 ASN HD22 1.0 0.0 6.50 972 906 A 78 GLY H A 79 GLY H 1.0 0.0 5.09 973 907 A 79 GLY H A 82 ALA H 1.0 0.0 6.50 974 908 A 79 GLY H A 77 TRP HA 1.0 0.0 6.26 975 909 A 82 ALA HB% A 79 GLY H 1.0 0.0 5.75 976 910 A 37 ASN HD22 A 105 VAL H 1.0 0.0 6.45 977 911 A 104 ASN H A 104 ASN HD21 1.0 0.0 6.50 978 912 A 37 ASN HD22 A 37 ASN HA 1.0 0.0 5.89 979 913 A 37 ASN HD22 A 104 ASN HA 1.0 0.0 6.37 980 914 A 105 VAL HA A 37 ASN HD22 1.0 0.0 6.50 981 915 A 105 VAL HA A 104 ASN HD21 1.0 0.0 6.50 982 916 A 37 ASN HD22 A 35 ALA HB% 1.0 0.0 6.47 983 917 A 117 THR HG2% A 104 ASN HD21 1.0 0.0 6.50 984 918 A 37 ASN HD21 A 105 VAL H 1.0 0.0 6.50 985 919 A 37 ASN HD21 A 37 ASN HA 1.0 0.0 5.79 986 920 A 37 ASN HD21 A 104 ASN HA 1.0 0.0 6.29 987 921 A 105 VAL HA A 37 ASN HD21 1.0 0.0 6.50 988 922 A 104 ASN HD22 A 105 VAL HA 1.0 0.0 6.50 989 923 A 37 ASN HD21 A 35 ALA HB% 1.0 0.0 6.26 990 924 A 104 ASN HD22 A 117 THR HG2% 1.0 0.0 6.50 991 925 A 37 ASN HD21 A 36 ILE HG2% 1.0 0.0 6.50 992 926 A 38 VAL HGx% A 37 ASN HD21 1.0 0.0 6.50 993 927 A 116 GLY H A 115 ASN H 1.0 0.0 5.69 994 928 A 117 THR H A 116 GLY H 1.0 0.0 5.96 995 929 A 128 PHE HD% A 116 GLY H 1.0 0.0 5.54 996 930 A 116 GLY H A 115 ASN HA 1.0 0.0 4.21 997 931 A 116 GLY H A 129 LYS HA 1.0 0.0 6.27 998 932 A 79 GLY H A 80 ASP HB2 1.0 0.0 6.50 999 932 A 80 ASP HB3 A 79 GLY H 1.0 0.0 6.50 1000 933 A 11 GLY H A 12 GLY H 1.0 0.0 4.75 1001 934 A 15 ALA H A 12 GLY H 1.0 0.0 6.50 1002 935 A 12 GLY H A 10 TRP HA 1.0 0.0 5.99 1003 936 A 15 ALA HB% A 12 GLY H 1.0 0.0 5.14 1004 937 A 61 PHE HD% A 49 GLY H 1.0 0.0 5.51 1005 938 A 48 ASN HA A 49 GLY H 1.0 0.0 4.24 1006 939 A 50 THR HG2% A 49 GLY H 1.0 0.0 6.50 1007 940 A 38 VAL HGy% A 49 GLY H 1.0 0.0 6.50 1008 941 A 38 VAL HGx% A 49 GLY H 1.0 0.0 5.44 1009 942 A 90 TRP HE1 A 88 GLY H 1.0 0.0 6.50 1010 943 A 88 GLY H A 87 GLY H 1.0 0.0 4.52 1011 944 A 73 VAL H A 88 GLY H 1.0 0.0 5.78 1012 945 A 90 TRP HD1 A 88 GLY H 1.0 0.0 6.50 1013 946 A 89 ASN HA A 88 GLY H 1.0 0.0 6.50 1014 947 A 72 GLU HA A 88 GLY H 1.0 0.0 6.08 1015 948 A 88 GLY H A 72 GLU HG2 1.0 0.0 6.50 1016 948 A 72 GLU HG3 A 88 GLY H 1.0 0.0 6.50 1017 949 A 73 VAL HB A 88 GLY H 1.0 0.0 6.35 1018 950 A 73 VAL HGx% A 88 GLY H 1.0 0.0 6.50 1019 951 A 78 GLY H A 77 TRP HD1 1.0 0.0 6.50 1020 952 A 78 GLY H A 77 TRP HBy 1.0 0.0 5.96 1021 953 A 78 GLY H A 77 TRP HBx 1.0 0.0 5.96 1022 954 A 78 GLY H A 59 ILE HB 1.0 0.0 6.50 1023 955 A 78 GLY H A 59 ILE HG2% 1.0 0.0 6.35 1024 956 A 78 GLY H A 82 ALA HB% 1.0 0.0 6.50 1025 957 A 10 TRP HD1 A 11 GLY H 1.0 0.0 6.50 1026 958 A 11 GLY H A 10 TRP HBy 1.0 0.0 5.63 1027 959 A 126 ILE HB A 11 GLY H 1.0 0.0 6.50 1028 960 A 15 ALA HB% A 11 GLY H 1.0 0.0 6.50 1029 961 A 60 GLY H A 59 ILE HG2% 1.0 0.0 6.34 1030 962 A 60 GLY H A 59 ILE HB 1.0 0.0 5.48 1031 963 A 76 GLN HBy A 60 GLY H 1.0 0.0 6.50 1032 964 A 76 GLN HBx A 60 GLY H 1.0 0.0 6.50 1033 965 A 127 GLY H A 126 ILE H 1.0 0.0 6.50 1034 966 A 17 TRP HZ3 A 127 GLY H 1.0 0.0 6.50 1035 967 A 8 ASN HA A 127 GLY H 1.0 0.0 6.50 1036 968 A 117 THR HA A 127 GLY H 1.0 0.0 6.50 1037 969 A 127 GLY H A 8 ASN HBx 1.0 0.0 6.50 1038 970 A 127 GLY H A 126 ILE HB 1.0 0.0 5.01 1039 971 A 127 GLY H A 126 ILE HG2% 1.0 0.0 5.64 1040 972 A 9 GLN HBx A 127 GLY H 1.0 0.0 5.88 1041 973 A 9 GLN HBy A 127 GLY H 1.0 0.0 6.50 1042 974 A 75 ASN H A 75 ASN HD22 1.0 0.0 6.50 1043 975 A 76 GLN H A 75 ASN HD22 1.0 0.0 6.50 1044 976 A 128 PHE HD% A 8 ASN HD21 1.0 0.0 6.50 1045 977 A 128 PHE HA A 8 ASN HD21 1.0 0.0 5.84 1046 978 A 8 ASN HD21 A 126 ILE HD1% 1.0 0.0 6.50 1047 979 A 6 VAL HGx% A 8 ASN HD21 1.0 0.0 6.22 1048 980 A 52 THR HG2% A 57 GLY H 1.0 0.0 6.50 1049 981 A 119 THR HG2% A 124 GLY H 1.0 0.0 6.50 1050 982 A 57 GLY H A 56 GLU HB2 1.0 0.0 5.07 1051 982 A 56 GLU HB3 A 57 GLY H 1.0 0.0 5.07 1052 983 A 124 GLY H A 123 GLU HB2 1.0 0.0 5.58 1053 983 A 123 GLU HB3 A 124 GLY H 1.0 0.0 5.58 1054 984 A 67 GLY H A 68 ASN HBy 1.0 0.0 6.50 1055 985 A 66 LEU H A 67 GLY H 1.0 0.0 4.35 1056 986 A 72 GLU H A 67 GLY H 1.0 0.0 6.50 1057 987 A 71 TYR HA A 67 GLY H 1.0 0.0 6.50 1058 988 A 65 LEU HA A 67 GLY H 1.0 0.0 5.41 1059 989 A 67 GLY H A 68 ASN HBx 1.0 0.0 6.50 1060 990 A 65 LEU HG A 67 GLY H 1.0 0.0 4.56 1061 991 A 67 GLY H A 65 LEU HDx% 1.0 0.0 5.24 1062 992 A 67 GLY H A 65 LEU HDy% 1.0 0.0 5.24 1063 993 A 8 ASN H A 8 ASN HD22 1.0 0.0 6.50 1064 994 A 128 PHE HD% A 8 ASN HD22 1.0 0.0 6.33 1065 995 A 8 ASN HA A 8 ASN HD22 1.0 0.0 5.79 1066 996 A 128 PHE HA A 8 ASN HD22 1.0 0.0 6.50 1067 997 A 8 ASN HD22 A 118 MET HGy 1.0 0.0 6.50 1068 998 A 8 ASN HD22 A 118 MET HGx 1.0 0.0 6.50 1069 999 A 6 VAL HB A 8 ASN HD22 1.0 0.0 6.50 1070 1000 A 126 ILE HD1% A 8 ASN HD22 1.0 0.0 6.47 1071 1001 A 6 VAL HGx% A 8 ASN HD22 1.0 0.0 5.61 1072 1002 A 44 GLY H A 40 SER HA 1.0 0.0 6.50 1073 1003 A 44 GLY H A 42 ASP HA 1.0 0.0 6.50 1074 1004 A 101 VAL HB A 44 GLY H 1.0 0.0 6.50 1075 1005 A 44 GLY H A 47 LEU HG 1.0 0.0 6.50 1076 1006 A 44 GLY H A 121 ALA HB% 1.0 0.0 6.50 1077 1007 A 101 VAL HGx% A 44 GLY H 1.0 0.0 5.26 1078 1008 A 23 TRP HE1 A 93 GLY H 1.0 0.0 6.50 1079 1009 A 24 GLU H A 93 GLY H 1.0 0.0 6.50 1080 1010 A 92 LEU H A 93 GLY H 1.0 0.0 6.50 1081 1011 A 93 GLY H A 23 TRP HE3 1.0 0.0 6.29 1082 1012 A 23 TRP HA A 93 GLY H 1.0 0.0 6.50 1083 1013 A 93 GLY H A 92 LEU HA 1.0 0.0 4.52 1084 1014 A 100 VAL HB A 93 GLY H 1.0 0.0 6.50 1085 1015 A 93 GLY H A 92 LEU HBx 1.0 0.0 6.50 1086 1016 A 6 VAL HGy% A 93 GLY H 1.0 0.0 6.50 1087 1017 A 113 THR H A 111 GLY H 1.0 0.0 6.13 1088 1018 A 112 GLN H A 111 GLY H 1.0 0.0 4.91 1089 1019 A 111 GLY H A 109 ASP HA 1.0 0.0 5.97 1090 1020 A 54 ALA HB% A 111 GLY H 1.0 0.0 6.50 1091 1021 A 34 VAL HGx% A 111 GLY H 1.0 0.0 5.22 1092 1022 A 4 TYR HD% A 131 THR HA 1.0 0.0 6.50 1093 1023 A 113 THR HA A 131 THR HA 1.0 0.0 5.92 1094 1024 A 128 PHE HD% A 6 VAL HA 1.0 0.0 6.50 1095 1025 A 6 VAL HA A 128 PHE HE% 1.0 0.0 6.50 1096 1026 A 6 VAL HA A 130 GLY HAy 1.0 0.0 5.38 1097 1027 A 6 VAL HA A 7 GLU HG2 1.0 0.0 6.50 1098 1027 A 6 VAL HA A 7 GLU HG3 1.0 0.0 6.50 1099 1028 A 61 PHE HD% A 73 VAL HA 1.0 0.0 6.50 1100 1029 A 73 VAL HA A 72 GLU HA 1.0 0.0 6.50 1101 1030 A 73 VAL HA A 63 ALA HA 1.0 0.0 4.75 1102 1031 A 73 VAL HA A 74 GLU HG2 1.0 0.0 6.50 1103 1031 A 73 VAL HA A 74 GLU HG3 1.0 0.0 6.50 1104 1032 A 73 VAL HA A 63 ALA HB% 1.0 0.0 4.97 1105 1033 A 73 VAL HA A 73 VAL HGx% 1.0 0.0 4.77 1106 1034 A 73 VAL HA A 73 VAL HGy% 1.0 0.0 4.72 1107 1035 A 131 THR HA A 113 THR HG2% 1.0 0.0 5.52 1108 1036 A 70 SER H A 91 ILE HA 1.0 0.0 6.50 1109 1037 A 91 ILE HA A 91 ILE HG2% 1.0 0.0 4.82 1110 1038 A 13 SER HA A 14 SER HA 1.0 0.0 6.50 1111 1039 A 13 SER HA A 15 ALA HB% 1.0 0.0 6.50 1112 1040 A 74 GLU HA A 86 SER HA 1.0 0.0 5.34 1113 1041 A 87 GLY HAx A 86 SER HA 1.0 0.0 6.50 1114 1042 A 86 SER HA A 74 GLU HG2 1.0 0.0 4.97 1115 1042 A 74 GLU HG3 A 86 SER HA 1.0 0.0 4.97 1116 1043 A 86 SER HA A 74 GLU HB2 1.0 0.0 6.50 1117 1043 A 74 GLU HB3 A 86 SER HA 1.0 0.0 6.50 1118 1044 A 73 VAL HGx% A 86 SER HA 1.0 0.0 6.50 1119 1045 A 101 VAL HA A 40 SER HBy 1.0 0.0 6.50 1120 1046 A 101 VAL HA A 40 SER HBx 1.0 0.0 6.50 1121 1047 A 47 LEU HG A 101 VAL HA 1.0 0.0 6.50 1122 1048 A 34 VAL HA A 114 LEU HG 1.0 0.0 6.50 1123 1049 A 46 THR HA A 64 THR HA 1.0 0.0 4.68 1124 1050 A 46 THR HA A 46 THR HG2% 1.0 0.0 4.56 1125 1051 A 113 THR HA A 113 THR HG2% 1.0 0.0 4.74 1126 1052 A 4 TYR HD% A 113 THR HA 1.0 0.0 6.28 1127 1053 A 77 TRP HE3 A 59 ILE HA 1.0 0.0 6.50 1128 1054 A 59 ILE HG2% A 59 ILE HA 1.0 0.0 5.05 1129 1055 A 4 TYR HD% A 25 ILE HA 1.0 0.0 6.50 1130 1056 A 4 TYR HE% A 25 ILE HA 1.0 0.0 6.50 1131 1057 A 26 GLY HAx A 25 ILE HA 1.0 0.0 6.50 1132 1058 A 23 TRP HBx A 25 ILE HA 1.0 0.0 6.50 1133 1059 A 25 ILE HA A 90 TRP HBy 1.0 0.0 6.50 1134 1060 A 25 ILE HA A 90 TRP HBx 1.0 0.0 6.50 1135 1061 A 25 ILE HA A 25 ILE HG2% 1.0 0.0 4.95 1136 1062 A 61 PHE HD% A 50 THR HA 1.0 0.0 6.50 1137 1063 A 128 PHE HD% A 117 THR HA 1.0 0.0 6.50 1138 1064 A 117 THR HA A 127 GLY HAy 1.0 0.0 5.71 1139 1065 A 50 THR HA A 61 PHE HBy 1.0 0.0 5.90 1140 1066 A 117 THR HA A 128 PHE HBy 1.0 0.0 6.19 1141 1067 A 50 THR HA A 61 PHE HBx 1.0 0.0 5.90 1142 1068 A 50 THR HA A 50 THR HG2% 1.0 0.0 4.56 1143 1069 A 117 THR HA A 117 THR HG2% 1.0 0.0 5.02 1144 1070 A 38 VAL HGx% A 50 THR HA 1.0 0.0 6.30 1145 1071 A 17 TRP HH2 A 117 THR HA 1.0 0.0 6.50 1146 1072 A 117 THR HA A 128 PHE HBx 1.0 0.0 6.19 1147 1073 A 7 GLU HA A 19 GLU HA 1.0 0.0 5.02 1148 1074 A 6 VAL HGx% A 19 GLU HA 1.0 0.0 6.50 1149 1075 A 19 GLU HA A 7 GLU HG2 1.0 0.0 4.97 1150 1075 A 19 GLU HA A 7 GLU HG3 1.0 0.0 4.97 1151 1076 A 46 THR HA A 45 GLN HA 1.0 0.0 6.50 1152 1077 A 113 THR HA A 112 GLN HA 1.0 0.0 6.50 1153 1078 A 45 GLN HA A 65 LEU HBy 1.0 0.0 5.42 1154 1079 A 45 GLN HA A 65 LEU HG 1.0 0.0 6.00 1155 1080 A 45 GLN HA A 65 LEU HDx% 1.0 0.0 6.07 1156 1081 A 45 GLN HA A 65 LEU HDy% 1.0 0.0 6.07 1157 1082 A 4 TYR HD% A 112 GLN HA 1.0 0.0 6.50 1158 1083 A 112 GLN HA A 132 LEU HBy 1.0 0.0 5.12 1159 1084 A 112 GLN HA A 132 LEU HBx 1.0 0.0 5.12 1160 1085 A 61 PHE HD% A 38 VAL HA 1.0 0.0 6.50 1161 1086 A 128 PHE HD% A 105 VAL HA 1.0 0.0 6.50 1162 1087 A 38 VAL HA A 37 ASN HA 1.0 0.0 6.50 1163 1088 A 105 VAL HA A 104 ASN HA 1.0 0.0 6.50 1164 1089 A 38 VAL HGx% A 38 VAL HA 1.0 0.0 4.79 1165 1090 A 71 TYR HA A 70 SER HA 1.0 0.0 6.48 1166 1091 A 89 ASN HBx A 70 SER HA 1.0 0.0 6.50 1167 1092 A 70 SER HA A 71 TYR HB2 1.0 0.0 6.07 1168 1092 A 71 TYR HB3 A 70 SER HA 1.0 0.0 6.07 1169 1093 A 70 SER HA A 91 ILE HG1x 1.0 0.0 5.93 1170 1094 A 91 ILE HG2% A 70 SER HA 1.0 0.0 5.76 1171 1095 A 91 ILE HD1% A 70 SER HA 1.0 0.0 6.08 1172 1096 A 61 PHE HA A 63 ALA HB% 1.0 0.0 6.50 1173 1097 A 61 PHE HA A 73 VAL HGx% 1.0 0.0 6.50 1174 1098 A 128 PHE HA A 117 THR HA 1.0 0.0 6.50 1175 1099 A 128 PHE HA A 6 VAL HGx% 1.0 0.0 6.50 1176 1100 A 17 TRP HA A 17 TRP HD1 1.0 0.0 6.50 1177 1101 A 17 TRP HZ3 A 17 TRP HA 1.0 0.0 6.50 1178 1102 A 9 GLN HBx A 17 TRP HA 1.0 0.0 6.31 1179 1103 A 9 GLN HBy A 17 TRP HA 1.0 0.0 5.89 1180 1104 A 84 TRP HD1 A 84 TRP HA 1.0 0.0 6.50 1181 1105 A 84 TRP HZ3 A 84 TRP HA 1.0 0.0 6.50 1182 1106 A 76 GLN HA A 84 TRP HA 1.0 0.0 5.56 1183 1107 A 76 GLN HGy A 84 TRP HA 1.0 0.0 6.25 1184 1108 A 76 GLN HGx A 84 TRP HA 1.0 0.0 6.07 1185 1109 A 76 GLN HBy A 84 TRP HA 1.0 0.0 5.89 1186 1110 A 71 TYR HA A 72 GLU HB2 1.0 0.0 6.15 1187 1110 A 71 TYR HA A 72 GLU HB3 1.0 0.0 6.15 1188 1111 A 71 TYR HA A 66 LEU HG 1.0 0.0 5.73 1189 1112 A 63 ALA HB% A 71 TYR HA 1.0 0.0 6.50 1190 1113 A 71 TYR HA A 65 LEU HG 1.0 0.0 6.50 1191 1114 A 71 TYR HA A 73 VAL HGy% 1.0 0.0 6.50 1192 1115 A 4 TYR HA A 133 THR HB 1.0 0.0 6.50 1193 1116 A 6 VAL HGy% A 4 TYR HA 1.0 0.0 6.50 1194 1117 A 10 TRP HA A 126 ILE HG2% 1.0 0.0 5.33 1195 1118 A 34 VAL HGy% A 107 SER HA 1.0 0.0 6.50 1196 1119 A 76 GLN HGy A 80 ASP HA 1.0 0.0 6.15 1197 1120 A 4 TYR HD% A 132 LEU HA 1.0 0.0 5.59 1198 1121 A 4 TYR HA A 132 LEU HA 1.0 0.0 4.95 1199 1122 A 132 LEU HA A 133 THR HA 1.0 0.0 6.50 1200 1123 A 132 LEU HA A 133 THR HG2% 1.0 0.0 6.50 1201 1124 A 24 GLU HA A 3 LEU HA 1.0 0.0 5.07 1202 1125 A 24 GLU HA A 23 TRP HBx 1.0 0.0 6.50 1203 1126 A 24 GLU HA A 91 ILE HB 1.0 0.0 5.42 1204 1127 A 24 GLU HA A 25 ILE HB 1.0 0.0 5.94 1205 1128 A 25 ILE HD1% A 24 GLU HA 1.0 0.0 6.50 1206 1129 A 101 VAL HGx% A 40 SER HA 1.0 0.0 5.98 1207 1130 A 47 LEU HA A 40 SER HA 1.0 0.0 5.39 1208 1131 A 34 VAL HB A 107 SER HA 1.0 0.0 6.50 1209 1132 A 101 VAL HB A 40 SER HA 1.0 0.0 6.50 1210 1133 A 107 SER HA A 106 GLU HB2 1.0 0.0 6.40 1211 1133 A 106 GLU HB3 A 107 SER HA 1.0 0.0 6.40 1212 1134 A 40 SER HA A 47 LEU HG 1.0 0.0 6.10 1213 1135 A 76 GLN H A 77 TRP HA 1.0 0.0 6.50 1214 1136 A 59 ILE HB A 77 TRP HA 1.0 0.0 6.18 1215 1137 A 59 ILE HG2% A 77 TRP HA 1.0 0.0 5.03 1216 1138 A 98 GLN HA A 99 ASN HD22 1.0 0.0 6.50 1217 1139 A 98 GLN HA A 120 TYR HD% 1.0 0.0 6.50 1218 1140 A 98 GLN HA A 95 ARG HD2 1.0 0.0 6.50 1219 1140 A 95 ARG HD3 A 98 GLN HA 1.0 0.0 6.50 1220 1141 A 98 GLN HA A 98 GLN HGy 1.0 0.0 5.16 1221 1142 A 98 GLN HA A 98 GLN HGx 1.0 0.0 5.16 1222 1143 A 98 GLN HA A 121 ALA HB% 1.0 0.0 5.43 1223 1144 A 70 SER HA A 69 ASN HA 1.0 0.0 6.50 1224 1145 A 91 ILE HA A 69 ASN HA 1.0 0.0 6.50 1225 1146 A 91 ILE HG2% A 69 ASN HA 1.0 0.0 6.31 1226 1147 A 71 TYR HA A 65 LEU HA 1.0 0.0 5.10 1227 1148 A 64 THR HA A 65 LEU HA 1.0 0.0 6.50 1228 1149 A 45 GLN HA A 65 LEU HA 1.0 0.0 6.50 1229 1150 A 65 LEU HA A 66 LEU HG 1.0 0.0 6.12 1230 1151 A 65 LEU HA A 65 LEU HDy% 1.0 0.0 5.45 1231 1152 A 4 TYR HD% A 24 GLU HA 1.0 0.0 5.95 1232 1153 A 24 GLU HA A 25 ILE HA 1.0 0.0 6.50 1233 1154 A 23 TRP HBy A 24 GLU HA 1.0 0.0 6.50 1234 1155 A 24 GLU HA A 3 LEU HDx% 1.0 0.0 6.50 1235 1156 A 98 GLN HA A 97 ASN HA 1.0 0.0 6.50 1236 1157 A 106 GLU HA A 35 ALA HA 1.0 0.0 4.60 1237 1158 A 39 GLU HA A 102 ALA HA 1.0 0.0 4.84 1238 1159 A 43 ASP HA A 42 ASP HA 1.0 0.0 6.50 1239 1160 A 109 ASP HA A 110 ASP HA 1.0 0.0 6.50 1240 1161 A 43 ASP HA A 101 VAL HB 1.0 0.0 5.98 1241 1162 A 54 ALA HB% A 110 ASP HA 1.0 0.0 5.06 1242 1163 A 34 VAL HGx% A 110 ASP HA 1.0 0.0 4.60 1243 1164 A 101 VAL HGx% A 43 ASP HA 1.0 0.0 4.77 1244 1165 A 34 VAL HGy% A 110 ASP HA 1.0 0.0 6.50 1245 1166 A 101 VAL HGy% A 43 ASP HA 1.0 0.0 6.50 1246 1167 A 22 GLN HA A 5 ASN HA 1.0 0.0 5.00 1247 1168 A 21 GLY HAx A 22 GLN HA 1.0 0.0 6.50 1248 1169 A 22 GLN HA A 23 TRP HBy 1.0 0.0 6.22 1249 1170 A 22 GLN HA A 5 ASN HB2 1.0 0.0 6.50 1250 1170 A 22 GLN HA A 5 ASN HB3 1.0 0.0 6.50 1251 1171 A 22 GLN HA A 6 VAL HGy% 1.0 0.0 5.86 1252 1172 A 61 PHE HD% A 62 ARG HA 1.0 0.0 5.69 1253 1173 A 106 GLU HA A 35 ALA HB% 1.0 0.0 4.80 1254 1174 A 102 ALA H A 118 MET HA 1.0 0.0 6.50 1255 1175 A 65 LEU HA A 66 LEU HA 1.0 0.0 6.50 1256 1176 A 64 THR HG2% A 66 LEU HA 1.0 0.0 6.50 1257 1177 A 66 LEU HA A 66 LEU HDy% 1.0 0.0 5.61 1258 1178 A 23 TRP HA A 91 ILE HB 1.0 0.0 5.26 1259 1179 A 23 TRP HA A 91 ILE HG2% 1.0 0.0 5.21 1260 1180 A 23 TRP HA A 25 ILE HD1% 1.0 0.0 6.50 1261 1181 A 23 TRP HA A 6 VAL HGy% 1.0 0.0 6.50 1262 1182 A 51 MET HA A 36 ILE HA 1.0 0.0 6.16 1263 1183 A 118 MET HA A 103 ILE HA 1.0 0.0 6.46 1264 1184 A 25 ILE HA A 90 TRP HA 1.0 0.0 6.50 1265 1185 A 90 TRP HA A 91 ILE HG1x 1.0 0.0 6.50 1266 1186 A 90 TRP HA A 92 LEU HDx% 1.0 0.0 6.50 1267 1187 A 90 TRP HA A 92 LEU HDy% 1.0 0.0 6.50 1268 1188 A 73 VAL HGy% A 90 TRP HA 1.0 0.0 6.50 1269 1189 A 91 ILE HB A 90 TRP HA 1.0 0.0 5.96 1270 1190 A 4 TYR HBy A 3 LEU HA 1.0 0.0 6.08 1271 1191 A 4 TYR HD% A 3 LEU HA 1.0 0.0 5.95 1272 1192 A 3 LEU HA A 24 GLU HG2 1.0 0.0 5.86 1273 1192 A 3 LEU HA A 24 GLU HG3 1.0 0.0 5.86 1274 1193 A 84 TRP HE3 A 74 GLU HA 1.0 0.0 6.50 1275 1194 A 74 GLU HA A 75 ASN HA 1.0 0.0 6.50 1276 1195 A 73 VAL HA A 74 GLU HA 1.0 0.0 6.50 1277 1196 A 74 GLU HA A 86 SER HBy 1.0 0.0 6.50 1278 1197 A 87 GLY HAx A 74 GLU HA 1.0 0.0 6.50 1279 1198 A 73 VAL HGx% A 74 GLU HA 1.0 0.0 5.87 1280 1199 A 76 GLN HGy A 76 GLN HA 1.0 0.0 5.07 1281 1200 A 84 TRP HE3 A 76 GLN HA 1.0 0.0 6.50 1282 1201 A 76 GLN HGx A 76 GLN HA 1.0 0.0 5.04 1283 1202 A 74 GLU HA A 86 SER HBx 1.0 0.0 6.50 1284 1203 A 8 ASN HA A 9 GLN HA 1.0 0.0 6.50 1285 1204 A 9 GLN HA A 10 TRP HA 1.0 0.0 6.50 1286 1205 A 9 GLN HA A 9 GLN HGy 1.0 0.0 5.02 1287 1206 A 9 GLN HA A 9 GLN HGx 1.0 0.0 5.02 1288 1207 A 17 TRP HZ3 A 9 GLN HA 1.0 0.0 6.50 1289 1208 A 8 ASN HBx A 9 GLN HA 1.0 0.0 6.50 1290 1209 A 54 ALA HA A 53 TYR HA 1.0 0.0 6.19 1291 1210 A 121 ALA HA A 120 TYR HA 1.0 0.0 6.50 1292 1211 A 54 ALA HA A 33 VAL HA 1.0 0.0 6.50 1293 1212 A 120 TYR HBx A 121 ALA HA 1.0 0.0 6.50 1294 1213 A 54 ALA HA A 34 VAL HB 1.0 0.0 6.17 1295 1214 A 101 VAL HB A 121 ALA HA 1.0 0.0 6.50 1296 1215 A 54 ALA HA A 34 VAL HGx% 1.0 0.0 4.47 1297 1216 A 101 VAL HGx% A 121 ALA HA 1.0 0.0 4.68 1298 1217 A 54 ALA HA A 34 VAL HGy% 1.0 0.0 4.50 1299 1218 A 101 VAL HGy% A 121 ALA HA 1.0 0.0 4.76 1300 1219 A 8 ASN HA A 7 GLU HA 1.0 0.0 6.50 1301 1220 A 7 GLU HA A 19 GLU HB2 1.0 0.0 5.53 1302 1220 A 19 GLU HB3 A 7 GLU HA 1.0 0.0 5.53 1303 1221 A 6 VAL HGx% A 7 GLU HA 1.0 0.0 6.36 1304 1222 A 77 TRP HH2 A 85 HIS HA 1.0 0.0 6.50 1305 1223 A 100 VAL HA A 99 ASN HA 1.0 0.0 6.50 1306 1224 A 100 VAL HB A 99 ASN HA 1.0 0.0 6.05 1307 1225 A 6 VAL HB A 5 ASN HA 1.0 0.0 6.50 1308 1226 A 47 LEU HA A 47 LEU HDy% 1.0 0.0 6.50 1309 1227 A 61 PHE HD% A 48 ASN HA 1.0 0.0 5.45 1310 1228 A 61 PHE HE% A 48 ASN HA 1.0 0.0 6.50 1311 1229 A 62 ARG HA A 48 ASN HA 1.0 0.0 5.03 1312 1230 A 48 ASN HA A 62 ARG HBy 1.0 0.0 6.09 1313 1231 A 48 ASN HA A 62 ARG HBx 1.0 0.0 6.43 1314 1232 A 48 ASN HA A 62 ARG HG2 1.0 0.0 6.50 1315 1232 A 62 ARG HG3 A 48 ASN HA 1.0 0.0 6.50 1316 1233 A 63 ALA HB% A 48 ASN HA 1.0 0.0 6.50 1317 1234 A 5 ASN HA A 4 TYR HBy 1.0 0.0 6.50 1318 1235 A 5 ASN HA A 6 VAL HGy% 1.0 0.0 5.98 1319 1236 A 114 LEU HA A 114 LEU HDy% 1.0 0.0 6.03 1320 1237 A 128 PHE HD% A 115 ASN HA 1.0 0.0 5.51 1321 1238 A 36 ILE HA A 37 ASN HA 1.0 0.0 6.50 1322 1239 A 103 ILE HA A 104 ASN HA 1.0 0.0 6.50 1323 1240 A 36 ILE HG2% A 37 ASN HA 1.0 0.0 5.80 1324 1241 A 103 ILE HG2% A 104 ASN HA 1.0 0.0 6.31 1325 1242 A 38 VAL HGy% A 37 ASN HA 1.0 0.0 5.96 1326 1243 A 104 ASN HA A 105 VAL HGy% 1.0 0.0 6.46 1327 1244 A 38 VAL HGx% A 37 ASN HA 1.0 0.0 6.03 1328 1245 A 104 ASN HA A 105 VAL HGx% 1.0 0.0 6.46 1329 1246 A 23 TRP HA A 92 LEU HA 1.0 0.0 6.50 1330 1247 A 129 LYS HA A 115 ASN HA 1.0 0.0 5.08 1331 1248 A 114 LEU HA A 115 ASN HA 1.0 0.0 6.50 1332 1249 A 129 LYS HBy A 115 ASN HA 1.0 0.0 6.44 1333 1250 A 115 ASN HA A 129 LYS HGx 1.0 0.0 6.50 1334 1251 A 23 TRP HE3 A 92 LEU HA 1.0 0.0 5.60 1335 1252 A 91 ILE HA A 92 LEU HA 1.0 0.0 6.50 1336 1253 A 92 LEU HA A 93 GLY HAx 1.0 0.0 6.50 1337 1254 A 93 GLY HAy A 92 LEU HA 1.0 0.0 6.50 1338 1255 A 92 LEU HA A 92 LEU HDx% 1.0 0.0 6.11 1339 1256 A 91 ILE HG2% A 92 LEU HA 1.0 0.0 6.44 1340 1257 A 92 LEU HA A 92 LEU HDy% 1.0 0.0 6.11 1341 1258 A 6 VAL HGy% A 92 LEU HA 1.0 0.0 6.50 1342 1259 A 62 ARG H A 75 ASN HA 1.0 0.0 6.13 1343 1260 A 84 TRP HE3 A 75 ASN HA 1.0 0.0 5.85 1344 1261 A 61 PHE HA A 75 ASN HA 1.0 0.0 5.32 1345 1262 A 76 GLN HA A 75 ASN HA 1.0 0.0 6.50 1346 1263 A 59 ILE HB A 75 ASN HA 1.0 0.0 6.50 1347 1264 A 75 ASN HA A 74 GLU HB2 1.0 0.0 6.50 1348 1264 A 74 GLU HB3 A 75 ASN HA 1.0 0.0 6.50 1349 1265 A 75 ASN HA A 59 ILE HD1% 1.0 0.0 6.46 1350 1266 A 73 VAL HGx% A 75 ASN HA 1.0 0.0 6.50 1351 1267 A 17 TRP HE3 A 8 ASN HA 1.0 0.0 6.10 1352 1268 A 89 ASN HA A 90 TRP HA 1.0 0.0 6.50 1353 1269 A 89 ASN HA A 72 GLU HA 1.0 0.0 4.97 1354 1270 A 8 ASN HA A 7 GLU HG2 1.0 0.0 6.50 1355 1270 A 8 ASN HA A 7 GLU HG3 1.0 0.0 6.50 1356 1271 A 89 ASN HA A 73 VAL HB 1.0 0.0 6.50 1357 1272 A 8 ASN HA A 126 ILE HG1x 1.0 0.0 6.50 1358 1273 A 8 ASN HA A 9 GLN HBx 1.0 0.0 6.50 1359 1274 A 8 ASN HA A 6 VAL HGx% 1.0 0.0 6.50 1360 1275 A 89 ASN HA A 73 VAL HGy% 1.0 0.0 6.50 1361 1276 A 32 ASN HA A 31 GLN H 1.0 0.0 6.50 1362 1277 A 32 ASN HA A 31 GLN HA 1.0 0.0 6.13 1363 1278 A 32 ASN HA A 111 GLY HAx 1.0 0.0 6.15 1364 1279 A 8 ASN HA A 128 PHE HA 1.0 0.0 5.36 1365 1280 A 8 ASN HA A 126 ILE HD1% 1.0 0.0 6.32 1366 1281 A 4 TYR HE% A 2 ALA HA 1.0 0.0 6.50 1367 1282 A 15 ALA HA A 16 PRO HG2 1.0 0.0 5.48 1368 1282 A 16 PRO HG3 A 15 ALA HA 1.0 0.0 5.48 1369 1283 A 82 ALA HA A 83 PRO HG2 1.0 0.0 6.24 1370 1283 A 82 ALA HA A 83 PRO HG3 1.0 0.0 6.24 1371 1284 A 63 ALA HA A 62 ARG HBx 1.0 0.0 6.50 1372 1285 A 63 ALA HA A 73 VAL HB 1.0 0.0 6.50 1373 1286 A 15 ALA HA A 16 PRO HDy 1.0 0.0 4.58 1374 1287 A 82 ALA HA A 83 PRO HDy 1.0 0.0 4.85 1375 1288 A 15 ALA HB% A 16 PRO HDy 1.0 0.0 4.84 1376 1289 A 82 ALA HB% A 83 PRO HDy 1.0 0.0 5.13 1377 1290 A 15 ALA HA A 16 PRO HDx 1.0 0.0 4.58 1378 1291 A 82 ALA HA A 83 PRO HDx 1.0 0.0 4.85 1379 1292 A 15 ALA HB% A 16 PRO HDx 1.0 0.0 4.84 1380 1293 A 82 ALA HB% A 83 PRO HDx 1.0 0.0 5.13 1381 1294 A 63 ALA HA A 61 PHE HE% 1.0 0.0 6.50 1382 1295 A 64 THR HA A 63 ALA HA 1.0 0.0 6.50 1383 1296 A 64 THR HB A 63 ALA HA 1.0 0.0 6.29 1384 1297 A 63 ALA HA A 71 TYR HB2 1.0 0.0 6.39 1385 1297 A 71 TYR HB3 A 63 ALA HA 1.0 0.0 6.39 1386 1298 A 63 ALA HA A 72 GLU HB2 1.0 0.0 6.50 1387 1298 A 63 ALA HA A 72 GLU HB3 1.0 0.0 6.50 1388 1299 A 63 ALA HA A 74 GLU HG2 1.0 0.0 6.50 1389 1299 A 63 ALA HA A 74 GLU HG3 1.0 0.0 6.50 1390 1300 A 73 VAL HGx% A 63 ALA HA 1.0 0.0 6.04 1391 1301 A 63 ALA HA A 73 VAL HGy% 1.0 0.0 5.66 1392 1302 A 52 THR HG2% A 58 PRO HD2 1.0 0.0 5.56 1393 1302 A 52 THR HG2% A 58 PRO HD3 1.0 0.0 5.56 1394 1303 A 50 THR HG2% A 58 PRO HD2 1.0 0.0 6.50 1395 1303 A 50 THR HG2% A 58 PRO HD3 1.0 0.0 6.50 1396 1304 A 61 PHE HD% A 47 LEU HBy 1.0 0.0 6.50 1397 1305 A 47 LEU HBy A 61 PHE HZ 1.0 0.0 6.50 1398 1306 A 46 THR HA A 47 LEU HBy 1.0 0.0 6.50 1399 1307 A 63 ALA HA A 47 LEU HBy 1.0 0.0 6.50 1400 1308 A 47 LEU HBy A 38 VAL HGy% 1.0 0.0 6.01 1401 1309 A 61 PHE HD% A 47 LEU HBx 1.0 0.0 6.50 1402 1310 A 61 PHE HE% A 47 LEU HBx 1.0 0.0 5.56 1403 1311 A 47 LEU HBx A 61 PHE HZ 1.0 0.0 6.50 1404 1312 A 48 ASN HA A 47 LEU HBx 1.0 0.0 6.50 1405 1313 A 47 LEU HBx A 40 SER HA 1.0 0.0 6.50 1406 1314 A 47 LEU HBx A 47 LEU HDy% 1.0 0.0 5.23 1407 1315 A 47 LEU HBx A 38 VAL HGy% 1.0 0.0 5.75 1408 1316 A 47 LEU HBx A 47 LEU HDx% 1.0 0.0 5.23 1409 1317 A 128 PHE HD% A 114 LEU HBy 1.0 0.0 6.35 1410 1318 A 113 THR HA A 114 LEU HBy 1.0 0.0 6.50 1411 1319 A 113 THR HB A 114 LEU HBy 1.0 0.0 6.50 1412 1320 A 114 LEU HBy A 130 GLY HAx 1.0 0.0 6.50 1413 1321 A 128 PHE HD% A 114 LEU HBx 1.0 0.0 6.50 1414 1322 A 114 LEU HBx A 114 LEU HDy% 1.0 0.0 5.21 1415 1323 A 114 LEU HBx A 114 LEU HDx% 1.0 0.0 5.21 1416 1324 A 61 PHE HD% A 49 GLY HAx 1.0 0.0 6.50 1417 1325 A 49 GLY HAx A 38 VAL HB 1.0 0.0 6.06 1418 1326 A 117 THR HG2% A 116 GLY HAy 1.0 0.0 6.04 1419 1327 A 49 GLY HAx A 38 VAL HGy% 1.0 0.0 6.49 1420 1328 A 38 VAL HGx% A 49 GLY HAx 1.0 0.0 4.82 1421 1329 A 48 ASN HA A 49 GLY HAy 1.0 0.0 6.50 1422 1330 A 50 THR HG2% A 49 GLY HAy 1.0 0.0 5.74 1423 1331 A 117 THR HG2% A 116 GLY HAx 1.0 0.0 6.04 1424 1332 A 49 GLY HAy A 38 VAL HGy% 1.0 0.0 6.50 1425 1333 A 61 PHE HD% A 49 GLY HAy 1.0 0.0 6.50 1426 1334 A 128 PHE HA A 127 GLY HAy 1.0 0.0 6.50 1427 1335 A 127 GLY HAy A 117 THR HG2% 1.0 0.0 5.68 1428 1336 A 9 GLN HBx A 127 GLY HAx 1.0 0.0 5.62 1429 1337 A 9 GLN HBy A 127 GLY HAx 1.0 0.0 6.37 1430 1338 A 59 ILE HD1% A 75 ASN HBy 1.0 0.0 5.43 1431 1339 A 73 VAL HGx% A 75 ASN HBy 1.0 0.0 6.50 1432 1340 A 62 ARG H A 75 ASN HBy 1.0 0.0 6.50 1433 1341 A 62 ARG H A 75 ASN HBx 1.0 0.0 6.50 1434 1342 A 59 ILE HD1% A 75 ASN HBx 1.0 0.0 5.43 1435 1343 A 73 VAL HGx% A 75 ASN HBx 1.0 0.0 6.50 1436 1344 A 17 TRP HZ3 A 8 ASN HBx 1.0 0.0 6.50 1437 1345 A 8 ASN HBx A 126 ILE HG1y 1.0 0.0 6.50 1438 1346 A 8 ASN HBx A 126 ILE HG1x 1.0 0.0 6.50 1439 1347 A 8 ASN HBx A 126 ILE HD1% 1.0 0.0 5.26 1440 1348 A 6 VAL HGx% A 8 ASN HBx 1.0 0.0 6.50 1441 1349 A 8 ASN HBy A 126 ILE HB 1.0 0.0 6.50 1442 1350 A 8 ASN HBy A 126 ILE HG1y 1.0 0.0 6.50 1443 1351 A 8 ASN HBy A 126 ILE HG1x 1.0 0.0 6.50 1444 1352 A 8 ASN HBy A 126 ILE HD1% 1.0 0.0 5.37 1445 1353 A 6 VAL HGx% A 8 ASN HBy 1.0 0.0 6.50 1446 1354 A 44 GLY HAy A 99 ASN HBx 1.0 0.0 6.50 1447 1355 A 101 VAL HGx% A 44 GLY HAy 1.0 0.0 5.39 1448 1356 A 44 GLY HAx A 99 ASN HBy 1.0 0.0 6.50 1449 1357 A 44 GLY HAx A 99 ASN HBx 1.0 0.0 6.50 1450 1358 A 101 VAL HGx% A 44 GLY HAx 1.0 0.0 5.39 1451 1359 A 111 GLY HAx A 32 ASN HBy 1.0 0.0 5.16 1452 1360 A 111 GLY HAx A 32 ASN HBx 1.0 0.0 5.16 1453 1361 A 34 VAL HGx% A 111 GLY HAx 1.0 0.0 5.29 1454 1362 A 111 GLY HAx A 114 LEU HDy% 1.0 0.0 6.50 1455 1363 A 111 GLY HAx A 114 LEU HDx% 1.0 0.0 6.50 1456 1364 A 4 TYR HE% A 111 GLY HAy 1.0 0.0 6.50 1457 1365 A 34 VAL HA A 111 GLY HAy 1.0 0.0 6.37 1458 1366 A 111 GLY HAy A 32 ASN HBy 1.0 0.0 6.22 1459 1367 A 111 GLY HAy A 32 ASN HBx 1.0 0.0 6.22 1460 1368 A 34 VAL HB A 111 GLY HAy 1.0 0.0 6.50 1461 1369 A 54 ALA HB% A 111 GLY HAy 1.0 0.0 6.50 1462 1370 A 34 VAL HGx% A 111 GLY HAy 1.0 0.0 5.37 1463 1371 A 34 VAL HGy% A 111 GLY HAy 1.0 0.0 6.50 1464 1372 A 111 GLY HAy A 114 LEU HDy% 1.0 0.0 6.50 1465 1373 A 111 GLY HAy A 114 LEU HDx% 1.0 0.0 6.50 1466 1374 A 19 GLU HA A 20 GLY HAy 1.0 0.0 6.01 1467 1375 A 20 GLY HAy A 19 GLU HB2 1.0 0.0 6.50 1468 1375 A 19 GLU HB3 A 20 GLY HAy 1.0 0.0 6.50 1469 1376 A 20 GLY HAy A 19 GLU HG2 1.0 0.0 6.50 1470 1376 A 19 GLU HG3 A 20 GLY HAy 1.0 0.0 6.50 1471 1377 A 73 VAL HB A 87 GLY HAy 1.0 0.0 6.50 1472 1378 A 73 VAL HGx% A 87 GLY HAy 1.0 0.0 6.50 1473 1379 A 15 ALA HB% A 11 GLY HAy 1.0 0.0 5.93 1474 1380 A 73 VAL HGy% A 88 GLY HAx 1.0 0.0 6.50 1475 1381 A 89 ASN HA A 88 GLY HAx 1.0 0.0 6.50 1476 1382 A 88 GLY HAx A 89 ASN HBy 1.0 0.0 6.50 1477 1383 A 73 VAL HGx% A 88 GLY HAx 1.0 0.0 6.50 1478 1384 A 15 ALA HB% A 11 GLY HAx 1.0 0.0 5.93 1479 1385 A 87 GLY HAx A 77 TRP HZ3 1.0 0.0 6.50 1480 1386 A 87 GLY HAx A 73 VAL HB 1.0 0.0 5.84 1481 1387 A 73 VAL HGx% A 87 GLY HAx 1.0 0.0 5.02 1482 1388 A 21 GLY HAy A 22 GLN HBx 1.0 0.0 6.50 1483 1389 A 23 TRP HD1 A 21 GLY HAy 1.0 0.0 6.50 1484 1390 A 22 GLN HA A 21 GLY HAy 1.0 0.0 6.50 1485 1391 A 26 GLY HAx A 28 ARG H 1.0 0.0 6.50 1486 1392 A 26 GLY HAx A 32 ASN HA 1.0 0.0 6.50 1487 1393 A 26 GLY HAx A 51 MET HE% 1.0 0.0 6.50 1488 1394 A 26 GLY HAx A 25 ILE HG2% 1.0 0.0 6.50 1489 1395 A 51 MET HE% A 26 GLY HAy 1.0 0.0 6.06 1490 1396 A 26 GLY HAy A 25 ILE HG2% 1.0 0.0 6.24 1491 1397 A 4 TYR HD% A 130 GLY HAy 1.0 0.0 6.50 1492 1398 A 4 TYR HBx A 130 GLY HAy 1.0 0.0 6.50 1493 1399 A 114 LEU HBy A 130 GLY HAy 1.0 0.0 6.50 1494 1400 A 114 LEU HBx A 130 GLY HAy 1.0 0.0 6.50 1495 1401 A 6 VAL HGy% A 130 GLY HAy 1.0 0.0 5.79 1496 1402 A 80 ASP HB3 A 79 GLY HAy 1.0 0.0 6.50 1497 1402 A 79 GLY HAy A 80 ASP HB2 1.0 0.0 6.50 1498 1403 A 15 ALA HB% A 12 GLY HAy 1.0 0.0 6.50 1499 1404 A 82 ALA HB% A 79 GLY HAy 1.0 0.0 6.50 1500 1405 A 15 ALA HB% A 12 GLY HAx 1.0 0.0 6.50 1501 1406 A 82 ALA HB% A 79 GLY HAx 1.0 0.0 6.50 1502 1407 A 80 ASP HB3 A 79 GLY HAx 1.0 0.0 6.50 1503 1407 A 79 GLY HAx A 80 ASP HB2 1.0 0.0 6.50 1504 1408 A 4 TYR HD% A 130 GLY HAx 1.0 0.0 6.50 1505 1409 A 128 PHE HZ A 130 GLY HAx 1.0 0.0 6.50 1506 1410 A 6 VAL HA A 130 GLY HAx 1.0 0.0 5.38 1507 1411 A 114 LEU HBx A 130 GLY HAx 1.0 0.0 6.50 1508 1412 A 6 VAL HGy% A 130 GLY HAx 1.0 0.0 5.79 1509 1413 A 65 LEU HG A 67 GLY HAx 1.0 0.0 6.27 1510 1414 A 93 GLY HAy A 120 TYR HD% 1.0 0.0 6.50 1511 1415 A 93 GLY HAy A 100 VAL HB 1.0 0.0 6.50 1512 1416 A 93 GLY HAy A 118 MET HE% 1.0 0.0 6.50 1513 1417 A 49 GLY HAy A 48 ASN HBy 1.0 0.0 6.50 1514 1418 A 49 GLY HAy A 48 ASN HBx 1.0 0.0 6.50 1515 1419 A 23 TRP HE3 A 92 LEU HBy 1.0 0.0 6.50 1516 1420 A 93 GLY H A 92 LEU HBy 1.0 0.0 6.50 1517 1421 A 23 TRP HE3 A 92 LEU HBx 1.0 0.0 6.50 1518 1422 A 67 GLY HAx A 65 LEU HDy% 1.0 0.0 6.50 1519 1423 A 65 LEU HG A 67 GLY HAy 1.0 0.0 5.83 1520 1424 A 67 GLY HAy A 65 LEU HDy% 1.0 0.0 5.80 1521 1425 A 95 ARG HA A 95 ARG HD2 1.0 0.0 5.89 1522 1425 A 95 ARG HD3 A 95 ARG HA 1.0 0.0 5.89 1523 1426 A 95 ARG HB2 A 95 ARG HD2 1.0 0.0 5.06 1524 1426 A 95 ARG HD3 A 95 ARG HB2 1.0 0.0 5.06 1525 1426 A 95 ARG HD3 A 95 ARG HB3 1.0 0.0 5.06 1526 1426 A 95 ARG HB3 A 95 ARG HD2 1.0 0.0 5.06 1527 1427 A 120 TYR HD% A 95 ARG HD2 1.0 0.0 6.50 1528 1427 A 95 ARG HD3 A 120 TYR HD% 1.0 0.0 6.50 1529 1428 A 103 ILE HG2% A 128 PHE HBy 1.0 0.0 6.50 1530 1429 A 38 VAL HGx% A 61 PHE HBy 1.0 0.0 5.89 1531 1430 A 38 VAL HGx% A 61 PHE HBx 1.0 0.0 5.89 1532 1431 A 103 ILE HG2% A 128 PHE HBx 1.0 0.0 6.50 1533 1432 A 22 GLN HE22 A 3 LEU HBy 1.0 0.0 6.50 1534 1433 A 24 GLU HA A 3 LEU HBy 1.0 0.0 6.50 1535 1434 A 2 ALA HA A 3 LEU HBy 1.0 0.0 6.50 1536 1435 A 133 THR HB A 3 LEU HBy 1.0 0.0 6.50 1537 1436 A 133 THR HG2% A 3 LEU HBy 1.0 0.0 6.03 1538 1437 A 2 ALA HA A 3 LEU HBx 1.0 0.0 6.50 1539 1438 A 133 THR HB A 3 LEU HBx 1.0 0.0 6.50 1540 1439 A 24 GLU HA A 3 LEU HBx 1.0 0.0 6.50 1541 1440 A 133 THR HG2% A 3 LEU HBx 1.0 0.0 6.03 1542 1441 A 84 TRP HZ3 A 62 ARG HD2 1.0 0.0 6.50 1543 1441 A 62 ARG HD3 A 84 TRP HZ3 1.0 0.0 6.50 1544 1442 A 62 ARG HBx A 62 ARG HD2 1.0 0.0 4.44 1545 1442 A 62 ARG HD3 A 62 ARG HBx 1.0 0.0 4.44 1546 1443 A 91 ILE HA A 71 TYR HB2 1.0 0.0 6.50 1547 1443 A 71 TYR HB3 A 91 ILE HA 1.0 0.0 6.50 1548 1444 A 65 LEU HA A 71 TYR HB2 1.0 0.0 6.50 1549 1444 A 71 TYR HB3 A 65 LEU HA 1.0 0.0 6.50 1550 1445 A 73 VAL HGy% A 71 TYR HB2 1.0 0.0 5.64 1551 1445 A 71 TYR HB3 A 73 VAL HGy% 1.0 0.0 5.64 1552 1446 A 8 ASN HBx A 126 ILE HB 1.0 0.0 6.50 1553 1447 A 84 TRP HBy A 62 ARG HD2 1.0 0.0 6.50 1554 1447 A 62 ARG HD3 A 84 TRP HBy 1.0 0.0 6.50 1555 1448 A 4 TYR HE% A 132 LEU HBy 1.0 0.0 6.50 1556 1449 A 131 THR HA A 132 LEU HBy 1.0 0.0 6.40 1557 1450 A 4 TYR HE% A 132 LEU HBx 1.0 0.0 6.50 1558 1451 A 131 THR HA A 132 LEU HBx 1.0 0.0 6.40 1559 1452 A 103 ILE HB A 37 ASN HA 1.0 0.0 6.50 1560 1453 A 103 ILE HB A 104 ASN HA 1.0 0.0 6.50 1561 1454 A 35 ALA HA A 36 ILE HB 1.0 0.0 6.50 1562 1455 A 103 ILE HB A 102 ALA HA 1.0 0.0 6.50 1563 1456 A 103 ILE HB A 103 ILE HD1% 1.0 0.0 4.69 1564 1457 A 103 ILE HB A 38 VAL HGy% 1.0 0.0 4.51 1565 1458 A 38 VAL HGx% A 103 ILE HB 1.0 0.0 6.50 1566 1459 A 4 TYR HBy A 128 PHE HE% 1.0 0.0 6.50 1567 1460 A 4 TYR HBy A 128 PHE HZ 1.0 0.0 6.50 1568 1461 A 22 GLN HA A 4 TYR HBy 1.0 0.0 6.50 1569 1462 A 4 TYR HBy A 23 TRP HBx 1.0 0.0 6.50 1570 1463 A 4 TYR HBy A 132 LEU HA 1.0 0.0 6.50 1571 1464 A 23 TRP HBy A 4 TYR HBy 1.0 0.0 6.31 1572 1465 A 4 TYR HBy A 25 ILE HB 1.0 0.0 6.50 1573 1466 A 4 TYR HBy A 25 ILE HD1% 1.0 0.0 6.21 1574 1467 A 4 TYR HBy A 6 VAL HGy% 1.0 0.0 5.73 1575 1468 A 4 TYR HBx A 128 PHE HE% 1.0 0.0 6.50 1576 1469 A 132 LEU HA A 4 TYR HBx 1.0 0.0 6.50 1577 1470 A 4 TYR HBx A 130 GLY HAx 1.0 0.0 6.50 1578 1471 A 25 ILE HD1% A 4 TYR HBx 1.0 0.0 6.50 1579 1472 A 6 VAL HGy% A 4 TYR HBx 1.0 0.0 5.82 1580 1473 A 4 TYR HBx A 131 THR HB 1.0 0.0 6.50 1581 1474 A 64 THR HA A 65 LEU HBy 1.0 0.0 6.44 1582 1475 A 64 THR HA A 65 LEU HBx 1.0 0.0 6.44 1583 1476 A 45 GLN HA A 65 LEU HBx 1.0 0.0 5.42 1584 1477 A 25 ILE HB A 23 TRP HE3 1.0 0.0 6.50 1585 1478 A 4 TYR HD% A 25 ILE HB 1.0 0.0 5.44 1586 1479 A 25 ILE HB A 4 TYR HE% 1.0 0.0 5.97 1587 1480 A 25 ILE HB A 23 TRP HBx 1.0 0.0 6.50 1588 1481 A 25 ILE HD1% A 25 ILE HB 1.0 0.0 5.20 1589 1482 A 23 TRP HBy A 25 ILE HB 1.0 0.0 6.50 1590 1483 A 99 ASN HBy A 44 GLY HAy 1.0 0.0 6.50 1591 1484 A 52 THR HG2% A 53 TYR HBy 1.0 0.0 6.50 1592 1485 A 119 THR HG2% A 120 TYR HBx 1.0 0.0 6.50 1593 1486 A 100 VAL HA A 120 TYR HBy 1.0 0.0 6.50 1594 1487 A 52 THR HG2% A 53 TYR HBx 1.0 0.0 6.50 1595 1488 A 119 THR HG2% A 120 TYR HBy 1.0 0.0 6.50 1596 1489 A 17 TRP HE3 A 129 LYS HEy 1.0 0.0 6.50 1597 1490 A 129 LYS HEy A 129 LYS HA 1.0 0.0 6.50 1598 1491 A 17 TRP HZ2 A 129 LYS HEx 1.0 0.0 6.50 1599 1492 A 17 TRP HE3 A 129 LYS HEx 1.0 0.0 6.50 1600 1493 A 129 LYS HA A 129 LYS HEx 1.0 0.0 6.50 1601 1494 A 54 ALA HB% A 32 ASN HBy 1.0 0.0 6.19 1602 1495 A 34 VAL HGx% A 32 ASN HBy 1.0 0.0 6.31 1603 1496 A 90 TRP HD1 A 89 ASN HBx 1.0 0.0 6.50 1604 1497 A 54 ALA HB% A 32 ASN HBx 1.0 0.0 6.19 1605 1498 A 34 VAL HGx% A 32 ASN HBx 1.0 0.0 6.31 1606 1499 A 23 TRP HD1 A 91 ILE HB 1.0 0.0 6.50 1607 1500 A 23 TRP HBx A 91 ILE HB 1.0 0.0 6.50 1608 1501 A 46 THR HG2% A 42 ASP HBy 1.0 0.0 6.50 1609 1502 A 46 THR HG2% A 42 ASP HBx 1.0 0.0 6.50 1610 1503 A 38 VAL HGx% A 37 ASN HBy 1.0 0.0 6.50 1611 1504 A 131 THR HB A 5 ASN HB2 1.0 0.0 5.55 1612 1504 A 131 THR HB A 5 ASN HB3 1.0 0.0 5.55 1613 1505 A 133 THR HG2% A 5 ASN HB2 1.0 0.0 6.23 1614 1505 A 133 THR HG2% A 5 ASN HB3 1.0 0.0 6.23 1615 1506 A 6 VAL HGy% A 5 ASN HB2 1.0 0.0 6.50 1616 1506 A 6 VAL HGy% A 5 ASN HB3 1.0 0.0 6.50 1617 1507 A 54 ALA HB% A 110 ASP HBy 1.0 0.0 6.50 1618 1508 A 34 VAL HGx% A 110 ASP HBy 1.0 0.0 6.50 1619 1509 A 54 ALA HB% A 110 ASP HBx 1.0 0.0 6.50 1620 1510 A 34 VAL HGx% A 110 ASP HBx 1.0 0.0 6.50 1621 1511 A 36 ILE HG2% A 37 ASN HBy 1.0 0.0 6.50 1622 1512 A 103 ILE HG2% A 104 ASN HBy 1.0 0.0 6.50 1623 1513 A 36 ILE HG2% A 37 ASN HBx 1.0 0.0 6.50 1624 1514 A 103 ILE HG2% A 104 ASN HBx 1.0 0.0 6.50 1625 1515 A 38 VAL HGx% A 37 ASN HBx 1.0 0.0 6.50 1626 1516 A 96 GLU HB3 A 97 ASN HBy 1.0 0.0 6.50 1627 1516 A 97 ASN HBy A 96 GLU HB2 1.0 0.0 6.50 1628 1517 A 96 GLU HB2 A 97 ASN HBx 1.0 0.0 6.50 1629 1517 A 96 GLU HB3 A 97 ASN HBx 1.0 0.0 6.50 1630 1518 A 70 SER H A 69 ASN HBy 1.0 0.0 6.50 1631 1519 A 70 SER HA A 69 ASN HBy 1.0 0.0 6.50 1632 1520 A 91 ILE HA A 69 ASN HBy 1.0 0.0 6.50 1633 1521 A 91 ILE HG2% A 69 ASN HBy 1.0 0.0 5.39 1634 1522 A 70 SER HA A 69 ASN HBx 1.0 0.0 6.50 1635 1523 A 91 ILE HA A 69 ASN HBx 1.0 0.0 6.50 1636 1524 A 91 ILE HG2% A 69 ASN HBx 1.0 0.0 5.39 1637 1525 A 73 VAL HGx% A 74 GLU HG2 1.0 0.0 6.50 1638 1525 A 73 VAL HGx% A 74 GLU HG3 1.0 0.0 6.50 1639 1526 A 53 TYR H A 56 GLU HGy 1.0 0.0 6.50 1640 1527 A 120 TYR H A 123 GLU HGy 1.0 0.0 6.50 1641 1528 A 52 THR HG2% A 56 GLU HGy 1.0 0.0 6.50 1642 1529 A 84 TRP HE3 A 74 GLU HG2 1.0 0.0 6.48 1643 1529 A 84 TRP HE3 A 74 GLU HG3 1.0 0.0 6.48 1644 1530 A 74 GLU HA A 74 GLU HG2 1.0 0.0 5.24 1645 1530 A 74 GLU HG3 A 74 GLU HA 1.0 0.0 5.24 1646 1531 A 84 TRP HBy A 74 GLU HG2 1.0 0.0 6.50 1647 1531 A 74 GLU HG3 A 84 TRP HBy 1.0 0.0 6.50 1648 1532 A 62 ARG HG2 A 74 GLU HG2 1.0 0.0 6.50 1649 1532 A 62 ARG HG3 A 74 GLU HG2 1.0 0.0 6.50 1650 1532 A 74 GLU HG3 A 62 ARG HG2 1.0 0.0 6.50 1651 1532 A 62 ARG HG3 A 74 GLU HG3 1.0 0.0 6.50 1652 1533 A 63 ALA HB% A 74 GLU HG2 1.0 0.0 6.50 1653 1533 A 63 ALA HB% A 74 GLU HG3 1.0 0.0 6.50 1654 1534 A 53 TYR H A 56 GLU HGx 1.0 0.0 6.50 1655 1535 A 120 TYR H A 123 GLU HGx 1.0 0.0 6.50 1656 1536 A 52 THR HG2% A 56 GLU HGx 1.0 0.0 6.50 1657 1537 A 61 PHE HE% A 38 VAL HB 1.0 0.0 6.50 1658 1538 A 47 LEU HA A 38 VAL HB 1.0 0.0 6.50 1659 1539 A 61 PHE HD% A 38 VAL HB 1.0 0.0 6.50 1660 1540 A 49 GLY HAy A 38 VAL HB 1.0 0.0 6.50 1661 1541 A 105 VAL HB A 106 GLU HB2 1.0 0.0 6.27 1662 1541 A 105 VAL HB A 106 GLU HB3 1.0 0.0 6.27 1663 1542 A 128 PHE HD% A 105 VAL HB 1.0 0.0 6.49 1664 1543 A 128 PHE HE% A 105 VAL HB 1.0 0.0 6.50 1665 1544 A 105 VAL HB A 115 ASN HA 1.0 0.0 6.50 1666 1545 A 105 VAL HB A 114 LEU HA 1.0 0.0 6.50 1667 1546 A 96 GLU HA A 96 GLU HGy 1.0 0.0 5.17 1668 1547 A 96 GLU HA A 96 GLU HGx 1.0 0.0 5.17 1669 1548 A 129 LYS HGy A 7 GLU HG2 1.0 0.0 6.50 1670 1548 A 7 GLU HG3 A 129 LYS HGy 1.0 0.0 6.50 1671 1549 A 7 GLU HG3 A 129 LYS HD2 1.0 0.0 6.50 1672 1549 A 7 GLU HG2 A 129 LYS HD2 1.0 0.0 6.50 1673 1549 A 129 LYS HD3 A 7 GLU HG2 1.0 0.0 6.50 1674 1549 A 129 LYS HD3 A 7 GLU HG3 1.0 0.0 6.50 1675 1550 A 6 VAL HGx% A 7 GLU HG2 1.0 0.0 6.50 1676 1550 A 6 VAL HGx% A 7 GLU HG3 1.0 0.0 6.50 1677 1551 A 17 TRP HE3 A 7 GLU HG2 1.0 0.0 6.50 1678 1551 A 17 TRP HE3 A 7 GLU HG3 1.0 0.0 6.50 1679 1552 A 17 TRP HBx A 7 GLU HG2 1.0 0.0 6.50 1680 1552 A 7 GLU HG3 A 17 TRP HBx 1.0 0.0 6.50 1681 1553 A 17 TRP HBy A 7 GLU HG2 1.0 0.0 6.50 1682 1553 A 17 TRP HBy A 7 GLU HG3 1.0 0.0 6.50 1683 1554 A 129 LYS HBx A 7 GLU HG2 1.0 0.0 6.50 1684 1554 A 129 LYS HBx A 7 GLU HG3 1.0 0.0 6.50 1685 1555 A 7 GLU HA A 7 GLU HG2 1.0 0.0 5.20 1686 1555 A 7 GLU HA A 7 GLU HG3 1.0 0.0 5.20 1687 1556 A 18 ASN HA A 19 GLU HG2 1.0 0.0 6.50 1688 1556 A 18 ASN HA A 19 GLU HG3 1.0 0.0 6.50 1689 1557 A 19 GLU HA A 19 GLU HG2 1.0 0.0 4.94 1690 1557 A 19 GLU HA A 19 GLU HG3 1.0 0.0 4.94 1691 1558 A 73 VAL HA A 72 GLU HG2 1.0 0.0 6.50 1692 1558 A 73 VAL HA A 72 GLU HG3 1.0 0.0 6.50 1693 1559 A 64 THR HB A 72 GLU HG2 1.0 0.0 6.35 1694 1559 A 64 THR HB A 72 GLU HG3 1.0 0.0 6.35 1695 1560 A 2 ALA HB% A 24 GLU HG2 1.0 0.0 6.50 1696 1560 A 2 ALA HB% A 24 GLU HG3 1.0 0.0 6.50 1697 1561 A 3 LEU HG A 24 GLU HG2 1.0 0.0 6.50 1698 1561 A 3 LEU HG A 24 GLU HG3 1.0 0.0 6.50 1699 1562 A 84 TRP HE3 A 74 GLU HB2 1.0 0.0 5.81 1700 1562 A 84 TRP HE3 A 74 GLU HB3 1.0 0.0 5.81 1701 1563 A 73 VAL HA A 74 GLU HB2 1.0 0.0 6.50 1702 1563 A 73 VAL HA A 74 GLU HB3 1.0 0.0 6.50 1703 1564 A 62 ARG HG3 A 74 GLU HB2 1.0 0.0 5.63 1704 1564 A 62 ARG HG2 A 74 GLU HB2 1.0 0.0 5.63 1705 1564 A 74 GLU HB3 A 62 ARG HG2 1.0 0.0 5.63 1706 1564 A 62 ARG HG3 A 74 GLU HB3 1.0 0.0 5.63 1707 1565 A 73 VAL HGx% A 74 GLU HB2 1.0 0.0 6.50 1708 1565 A 74 GLU HB3 A 73 VAL HGx% 1.0 0.0 6.50 1709 1566 A 129 LYS HBx A 17 TRP HBy 1.0 0.0 6.50 1710 1567 A 17 TRP HZ3 A 129 LYS HBx 1.0 0.0 6.50 1711 1568 A 129 LYS HBx A 115 ASN HA 1.0 0.0 6.50 1712 1569 A 129 LYS HBx A 129 LYS HEy 1.0 0.0 5.88 1713 1570 A 129 LYS HBx A 7 GLU HB2 1.0 0.0 5.63 1714 1570 A 7 GLU HB3 A 129 LYS HBx 1.0 0.0 5.63 1715 1571 A 129 LYS HBx A 6 VAL HGx% 1.0 0.0 6.50 1716 1572 A 17 TRP HE3 A 129 LYS HBy 1.0 0.0 6.50 1717 1573 A 129 LYS HBy A 129 LYS HGx 1.0 0.0 4.00 1718 1574 A 35 ALA HB% A 106 GLU HG2 1.0 0.0 5.33 1719 1574 A 35 ALA HB% A 106 GLU HG3 1.0 0.0 5.33 1720 1575 A 34 VAL HGy% A 106 GLU HG2 1.0 0.0 6.43 1721 1575 A 34 VAL HGy% A 106 GLU HG3 1.0 0.0 6.43 1722 1576 A 102 ALA HA A 39 GLU HG2 1.0 0.0 6.00 1723 1576 A 102 ALA HA A 39 GLU HG3 1.0 0.0 6.00 1724 1577 A 102 ALA HB% A 39 GLU HG2 1.0 0.0 4.99 1725 1577 A 102 ALA HB% A 39 GLU HG3 1.0 0.0 4.99 1726 1578 A 90 TRP HH2 A 51 MET HB2 1.0 0.0 6.50 1727 1578 A 51 MET HB3 A 90 TRP HH2 1.0 0.0 6.50 1728 1579 A 61 PHE HD% A 51 MET HB2 1.0 0.0 6.26 1729 1579 A 61 PHE HD% A 51 MET HB3 1.0 0.0 6.26 1730 1580 A 61 PHE HE% A 51 MET HB2 1.0 0.0 6.50 1731 1580 A 51 MET HB3 A 61 PHE HE% 1.0 0.0 6.50 1732 1581 A 50 THR HA A 51 MET HB2 1.0 0.0 6.50 1733 1581 A 51 MET HB3 A 50 THR HA 1.0 0.0 6.50 1734 1582 A 36 ILE HA A 51 MET HB2 1.0 0.0 6.09 1735 1582 A 36 ILE HA A 51 MET HB3 1.0 0.0 6.09 1736 1583 A 51 MET HE% A 51 MET HB2 1.0 0.0 5.87 1737 1583 A 51 MET HE% A 51 MET HB3 1.0 0.0 5.87 1738 1584 A 36 ILE HG2% A 51 MET HB2 1.0 0.0 6.50 1739 1584 A 51 MET HB3 A 36 ILE HG2% 1.0 0.0 6.50 1740 1585 A 38 VAL HGx% A 51 MET HB2 1.0 0.0 6.50 1741 1585 A 38 VAL HGx% A 51 MET HB3 1.0 0.0 6.50 1742 1586 A 8 ASN HA A 7 GLU HB2 1.0 0.0 6.50 1743 1586 A 8 ASN HA A 7 GLU HB3 1.0 0.0 6.50 1744 1587 A 6 VAL HA A 7 GLU HB2 1.0 0.0 6.50 1745 1587 A 6 VAL HA A 7 GLU HB3 1.0 0.0 6.50 1746 1588 A 17 TRP HA A 7 GLU HB2 1.0 0.0 6.50 1747 1588 A 7 GLU HB3 A 17 TRP HA 1.0 0.0 6.50 1748 1589 A 7 GLU HB3 A 19 GLU HB2 1.0 0.0 4.66 1749 1589 A 7 GLU HB2 A 19 GLU HB2 1.0 0.0 4.66 1750 1589 A 19 GLU HB3 A 7 GLU HB2 1.0 0.0 4.66 1751 1589 A 7 GLU HB3 A 19 GLU HB3 1.0 0.0 4.66 1752 1590 A 6 VAL HGx% A 7 GLU HB2 1.0 0.0 6.50 1753 1590 A 7 GLU HB3 A 6 VAL HGx% 1.0 0.0 6.50 1754 1591 A 31 GLN HA A 31 GLN HG2 1.0 0.0 5.02 1755 1591 A 31 GLN HA A 31 GLN HG3 1.0 0.0 5.02 1756 1592 A 54 ALA HB% A 31 GLN HG2 1.0 0.0 5.90 1757 1592 A 31 GLN HG3 A 54 ALA HB% 1.0 0.0 5.90 1758 1593 A 120 TYR HD% A 98 GLN HGy 1.0 0.0 6.39 1759 1594 A 120 TYR HD% A 98 GLN HGx 1.0 0.0 6.39 1760 1595 A 34 VAL HGy% A 106 GLU HB2 1.0 0.0 6.50 1761 1595 A 34 VAL HGy% A 106 GLU HB3 1.0 0.0 6.50 1762 1596 A 35 ALA HA A 106 GLU HB2 1.0 0.0 5.82 1763 1596 A 106 GLU HB3 A 35 ALA HA 1.0 0.0 5.82 1764 1597 A 35 ALA HB% A 106 GLU HB2 1.0 0.0 5.09 1765 1597 A 35 ALA HB% A 106 GLU HB3 1.0 0.0 5.09 1766 1598 A 102 ALA HA A 39 GLU HB2 1.0 0.0 5.69 1767 1598 A 102 ALA HA A 39 GLU HB3 1.0 0.0 5.69 1768 1599 A 102 ALA HB% A 39 GLU HB2 1.0 0.0 5.45 1769 1599 A 102 ALA HB% A 39 GLU HB3 1.0 0.0 5.45 1770 1600 A 101 VAL HGy% A 39 GLU HB2 1.0 0.0 6.50 1771 1600 A 101 VAL HGy% A 39 GLU HB3 1.0 0.0 6.50 1772 1601 A 38 VAL HGx% A 39 GLU HB2 1.0 0.0 6.50 1773 1601 A 38 VAL HGx% A 39 GLU HB3 1.0 0.0 6.50 1774 1602 A 23 TRP HZ2 A 118 MET HB2 1.0 0.0 6.50 1775 1602 A 118 MET HB3 A 23 TRP HZ2 1.0 0.0 6.50 1776 1603 A 102 ALA H A 118 MET HB2 1.0 0.0 6.50 1777 1603 A 102 ALA H A 118 MET HB3 1.0 0.0 6.50 1778 1604 A 128 PHE HD% A 118 MET HB2 1.0 0.0 6.20 1779 1604 A 128 PHE HD% A 118 MET HB3 1.0 0.0 6.20 1780 1605 A 128 PHE HE% A 118 MET HB2 1.0 0.0 6.50 1781 1605 A 118 MET HB3 A 128 PHE HE% 1.0 0.0 6.50 1782 1606 A 117 THR HA A 118 MET HB2 1.0 0.0 6.50 1783 1606 A 118 MET HB3 A 117 THR HA 1.0 0.0 6.50 1784 1607 A 103 ILE HA A 118 MET HB2 1.0 0.0 6.23 1785 1607 A 103 ILE HA A 118 MET HB3 1.0 0.0 6.23 1786 1608 A 118 MET HE% A 118 MET HB2 1.0 0.0 5.82 1787 1608 A 118 MET HB3 A 118 MET HE% 1.0 0.0 5.82 1788 1609 A 118 MET HB3 A 100 VAL HGx% 1.0 0.0 6.50 1789 1609 A 100 VAL HGx% A 118 MET HB2 1.0 0.0 6.50 1790 1610 A 118 MET HB3 A 100 VAL HGy% 1.0 0.0 6.50 1791 1610 A 100 VAL HGy% A 118 MET HB2 1.0 0.0 6.50 1792 1611 A 103 ILE HG2% A 118 MET HB2 1.0 0.0 6.49 1793 1611 A 118 MET HB3 A 103 ILE HG2% 1.0 0.0 6.49 1794 1612 A 6 VAL HB A 22 GLN HA 1.0 0.0 6.50 1795 1613 A 90 TRP HD1 A 73 VAL HB 1.0 0.0 6.26 1796 1614 A 72 GLU HA A 73 VAL HB 1.0 0.0 6.50 1797 1615 A 127 GLY HAx A 9 GLN HGx 1.0 0.0 6.50 1798 1616 A 39 GLU HA A 101 VAL HB 1.0 0.0 6.50 1799 1617 A 106 GLU HA A 34 VAL HB 1.0 0.0 6.50 1800 1618 A 101 VAL HB A 40 SER HBy 1.0 0.0 5.12 1801 1619 A 101 VAL HB A 40 SER HBx 1.0 0.0 5.12 1802 1620 A 119 THR HG2% A 101 VAL HB 1.0 0.0 6.50 1803 1621 A 84 TRP HH2 A 62 ARG HBy 1.0 0.0 6.50 1804 1622 A 62 ARG HBy A 48 ASN HBy 1.0 0.0 6.50 1805 1623 A 76 GLN HGy A 77 TRP HA 1.0 0.0 6.50 1806 1624 A 127 GLY HAx A 9 GLN HGy 1.0 0.0 6.50 1807 1625 A 76 GLN HGx A 84 TRP HE3 1.0 0.0 6.50 1808 1626 A 53 TYR H A 56 GLU HB2 1.0 0.0 6.03 1809 1626 A 53 TYR H A 56 GLU HB3 1.0 0.0 6.03 1810 1627 A 120 TYR H A 123 GLU HB2 1.0 0.0 6.41 1811 1627 A 120 TYR H A 123 GLU HB3 1.0 0.0 6.41 1812 1628 A 53 TYR HD% A 56 GLU HB2 1.0 0.0 6.50 1813 1628 A 53 TYR HD% A 56 GLU HB3 1.0 0.0 6.50 1814 1629 A 120 TYR HD% A 123 GLU HB2 1.0 0.0 6.50 1815 1629 A 123 GLU HB3 A 120 TYR HD% 1.0 0.0 6.50 1816 1630 A 52 THR HG2% A 56 GLU HB2 1.0 0.0 5.60 1817 1630 A 52 THR HG2% A 56 GLU HB3 1.0 0.0 5.60 1818 1631 A 62 ARG HBy A 48 ASN HBx 1.0 0.0 6.50 1819 1632 A 84 TRP HZ3 A 62 ARG HBy 1.0 0.0 6.50 1820 1633 A 32 ASN HA A 33 VAL HB 1.0 0.0 6.50 1821 1634 A 4 TYR HE% A 33 VAL HB 1.0 0.0 6.50 1822 1635 A 33 VAL HB A 25 ILE HG2% 1.0 0.0 5.43 1823 1636 A 4 TYR HD% A 23 TRP HBx 1.0 0.0 6.50 1824 1637 A 73 VAL HGy% A 90 TRP HBy 1.0 0.0 5.85 1825 1638 A 6 VAL HB A 23 TRP HBy 1.0 0.0 6.50 1826 1639 A 23 TRP HBy A 6 VAL HGy% 1.0 0.0 5.73 1827 1640 A 73 VAL HGy% A 90 TRP HBx 1.0 0.0 5.85 1828 1641 A 50 THR HA A 58 PRO HBy 1.0 0.0 6.50 1829 1642 A 50 THR HB A 58 PRO HBy 1.0 0.0 5.16 1830 1643 A 31 GLN H A 28 ARG HB2 1.0 0.0 6.50 1831 1643 A 31 GLN H A 28 ARG HB3 1.0 0.0 6.50 1832 1644 A 50 THR HA A 58 PRO HBx 1.0 0.0 6.50 1833 1645 A 50 THR HB A 58 PRO HBx 1.0 0.0 5.16 1834 1646 A 25 ILE HD1% A 23 TRP HBx 1.0 0.0 6.10 1835 1647 A 4 TYR HD% A 23 TRP HBy 1.0 0.0 6.50 1836 1648 A 23 TRP HBy A 25 ILE HD1% 1.0 0.0 6.06 1837 1649 A 23 TRP HD1 A 22 GLN HBx 1.0 0.0 6.50 1838 1650 A 5 ASN HA A 22 GLN HBx 1.0 0.0 6.50 1839 1651 A 22 GLN HBx A 3 LEU HDx% 1.0 0.0 6.47 1840 1652 A 6 VAL HGy% A 22 GLN HBx 1.0 0.0 6.50 1841 1653 A 23 TRP HD1 A 22 GLN HBy 1.0 0.0 6.50 1842 1654 A 6 VAL HGy% A 22 GLN HBy 1.0 0.0 6.50 1843 1655 A 133 THR HB A 22 GLN HBx 1.0 0.0 6.50 1844 1656 A 5 ASN HA A 22 GLN HBy 1.0 0.0 6.50 1845 1657 A 120 TYR HD% A 98 GLN HBy 1.0 0.0 6.50 1846 1658 A 98 GLN HBy A 95 ARG HD2 1.0 0.0 6.28 1847 1658 A 95 ARG HD3 A 98 GLN HBy 1.0 0.0 6.28 1848 1659 A 120 TYR HBx A 98 GLN HBy 1.0 0.0 6.50 1849 1660 A 120 TYR HD% A 98 GLN HBx 1.0 0.0 6.50 1850 1661 A 95 ARG HD2 A 98 GLN HBx 1.0 0.0 6.28 1851 1661 A 95 ARG HD3 A 98 GLN HBx 1.0 0.0 6.28 1852 1662 A 120 TYR HBx A 98 GLN HBx 1.0 0.0 6.50 1853 1663 A 91 ILE HB A 24 GLU HB2 1.0 0.0 4.29 1854 1663 A 24 GLU HB3 A 91 ILE HB 1.0 0.0 4.29 1855 1664 A 91 ILE HD1% A 24 GLU HB2 1.0 0.0 5.73 1856 1664 A 24 GLU HB3 A 91 ILE HD1% 1.0 0.0 5.73 1857 1665 A 90 TRP HA A 24 GLU HB2 1.0 0.0 5.71 1858 1665 A 24 GLU HB3 A 90 TRP HA 1.0 0.0 5.71 1859 1666 A 23 TRP HBx A 24 GLU HB2 1.0 0.0 6.50 1860 1666 A 24 GLU HB3 A 23 TRP HBx 1.0 0.0 6.50 1861 1667 A 8 ASN HA A 9 GLN HBy 1.0 0.0 6.50 1862 1668 A 9 GLN HBy A 127 GLY HAy 1.0 0.0 6.50 1863 1669 A 9 GLN HBy A 17 TRP HBy 1.0 0.0 6.50 1864 1670 A 84 TRP HE3 A 76 GLN HBx 1.0 0.0 6.50 1865 1671 A 76 GLN HBx A 84 TRP HH2 1.0 0.0 6.50 1866 1672 A 84 TRP HZ3 A 76 GLN HBx 1.0 0.0 6.50 1867 1673 A 76 GLN HBx A 75 ASN HA 1.0 0.0 6.50 1868 1674 A 85 HIS HD2 A 76 GLN HBx 1.0 0.0 6.50 1869 1675 A 76 GLN HBx A 60 GLY HAy 1.0 0.0 6.36 1870 1676 A 76 GLN HBx A 84 TRP HA 1.0 0.0 6.50 1871 1677 A 76 GLN HBx A 60 GLY HAx 1.0 0.0 6.36 1872 1678 A 76 GLN HBy A 77 TRP HE3 1.0 0.0 6.50 1873 1679 A 76 GLN HBy A 75 ASN HA 1.0 0.0 6.50 1874 1680 A 59 ILE HB A 77 TRP HBy 1.0 0.0 6.50 1875 1681 A 59 ILE HG2% A 77 TRP HBy 1.0 0.0 5.17 1876 1682 A 59 ILE HB A 77 TRP HBx 1.0 0.0 6.50 1877 1683 A 59 ILE HG2% A 77 TRP HBx 1.0 0.0 5.17 1878 1684 A 61 PHE HD% A 51 MET HGx 1.0 0.0 5.68 1879 1685 A 128 PHE HD% A 118 MET HGy 1.0 0.0 6.24 1880 1686 A 117 THR HA A 118 MET HGy 1.0 0.0 6.50 1881 1687 A 117 THR HB A 118 MET HGy 1.0 0.0 6.50 1882 1688 A 36 ILE HA A 51 MET HGx 1.0 0.0 6.44 1883 1689 A 118 MET HE% A 118 MET HGy 1.0 0.0 5.54 1884 1690 A 38 VAL HGx% A 51 MET HGx 1.0 0.0 6.50 1885 1691 A 51 MET HGy A 90 TRP HZ3 1.0 0.0 6.50 1886 1692 A 128 PHE HD% A 118 MET HGx 1.0 0.0 6.24 1887 1693 A 117 THR HA A 118 MET HGx 1.0 0.0 6.50 1888 1694 A 36 ILE HA A 51 MET HGy 1.0 0.0 6.50 1889 1695 A 118 MET HE% A 118 MET HGx 1.0 0.0 5.54 1890 1696 A 38 VAL HGx% A 51 MET HGy 1.0 0.0 6.50 1891 1697 A 117 THR HB A 118 MET HGx 1.0 0.0 6.50 1892 1698 A 89 ASN HA A 72 GLU HB2 1.0 0.0 6.50 1893 1698 A 89 ASN HA A 72 GLU HB3 1.0 0.0 6.50 1894 1699 A 64 THR HB A 72 GLU HB2 1.0 0.0 5.33 1895 1699 A 64 THR HB A 72 GLU HB3 1.0 0.0 5.33 1896 1700 A 73 VAL HGy% A 72 GLU HB2 1.0 0.0 6.50 1897 1700 A 72 GLU HB3 A 73 VAL HGy% 1.0 0.0 6.50 1898 1701 A 126 ILE HB A 10 TRP HBx 1.0 0.0 6.50 1899 1702 A 126 ILE HG2% A 10 TRP HBx 1.0 0.0 5.16 1900 1703 A 126 ILE HB A 10 TRP HBy 1.0 0.0 6.50 1901 1704 A 10 TRP HBy A 126 ILE HG2% 1.0 0.0 5.13 1902 1705 A 84 TRP HBx A 74 GLU HA 1.0 0.0 6.50 1903 1706 A 84 TRP HZ3 A 84 TRP HBx 1.0 0.0 6.50 1904 1707 A 84 TRP HBx A 74 GLU HB2 1.0 0.0 6.50 1905 1707 A 74 GLU HB3 A 84 TRP HBx 1.0 0.0 6.50 1906 1708 A 76 GLN HBy A 84 TRP HBx 1.0 0.0 6.50 1907 1709 A 7 GLU HA A 17 TRP HBx 1.0 0.0 6.50 1908 1710 A 17 TRP HBx A 19 GLU HB2 1.0 0.0 6.30 1909 1710 A 19 GLU HB3 A 17 TRP HBx 1.0 0.0 6.30 1910 1711 A 17 TRP HBx A 7 GLU HB2 1.0 0.0 6.18 1911 1711 A 7 GLU HB3 A 17 TRP HBx 1.0 0.0 6.18 1912 1712 A 129 LYS HGy A 17 TRP HBx 1.0 0.0 6.50 1913 1713 A 9 GLN HBy A 17 TRP HBx 1.0 0.0 6.50 1914 1714 A 17 TRP HBy A 7 GLU HB2 1.0 0.0 6.43 1915 1714 A 7 GLU HB3 A 17 TRP HBy 1.0 0.0 6.43 1916 1715 A 84 TRP HBy A 74 GLU HB2 1.0 0.0 6.50 1917 1715 A 74 GLU HB3 A 84 TRP HBy 1.0 0.0 6.50 1918 1716 A 17 TRP HBy A 129 LYS HD2 1.0 0.0 6.50 1919 1716 A 129 LYS HD3 A 17 TRP HBy 1.0 0.0 6.50 1920 1717 A 18 ASN HA A 17 TRP HBy 1.0 0.0 6.50 1921 1718 A 23 TRP HZ3 A 103 ILE HG1x 1.0 0.0 6.50 1922 1719 A 46 THR HG2% A 45 GLN HBy 1.0 0.0 6.50 1923 1720 A 113 THR HG2% A 112 GLN HBy 1.0 0.0 6.50 1924 1721 A 46 THR HG2% A 45 GLN HBx 1.0 0.0 6.50 1925 1722 A 113 THR HG2% A 112 GLN HBx 1.0 0.0 6.50 1926 1723 A 102 ALA H A 103 ILE HG1y 1.0 0.0 6.50 1927 1724 A 23 TRP HZ3 A 103 ILE HG1y 1.0 0.0 6.50 1928 1725 A 102 ALA H A 103 ILE HG1x 1.0 0.0 6.50 1929 1726 A 90 TRP HH2 A 36 ILE HG1y 1.0 0.0 6.50 1930 1727 A 90 TRP HZ3 A 36 ILE HG1y 1.0 0.0 6.50 1931 1728 A 51 MET HA A 36 ILE HG1y 1.0 0.0 6.50 1932 1729 A 51 MET HGx A 36 ILE HG1y 1.0 0.0 6.25 1933 1730 A 38 VAL HGx% A 36 ILE HG1y 1.0 0.0 6.50 1934 1731 A 36 ILE HG1y A 51 MET HB2 1.0 0.0 6.50 1935 1731 A 51 MET HB3 A 36 ILE HG1y 1.0 0.0 6.50 1936 1732 A 52 THR HG2% A 58 PRO HGy 1.0 0.0 6.45 1937 1733 A 119 THR HG2% A 125 PRO HGy 1.0 0.0 6.50 1938 1734 A 15 ALA HB% A 16 PRO HG2 1.0 0.0 5.33 1939 1734 A 15 ALA HB% A 16 PRO HG3 1.0 0.0 5.33 1940 1735 A 52 THR HG2% A 58 PRO HGx 1.0 0.0 6.45 1941 1736 A 119 THR HG2% A 125 PRO HGx 1.0 0.0 6.50 1942 1737 A 120 TYR HE% A 95 ARG HGy 1.0 0.0 6.50 1943 1738 A 120 TYR HE% A 95 ARG HGx 1.0 0.0 6.50 1944 1739 A 4 TYR HD% A 25 ILE HG12 1.0 0.0 6.50 1945 1739 A 4 TYR HD% A 25 ILE HG13 1.0 0.0 6.50 1946 1740 A 4 TYR HE% A 25 ILE HG12 1.0 0.0 6.50 1947 1740 A 4 TYR HE% A 25 ILE HG13 1.0 0.0 6.50 1948 1741 A 24 GLU HA A 25 ILE HG12 1.0 0.0 6.50 1949 1741 A 24 GLU HA A 25 ILE HG13 1.0 0.0 6.50 1950 1742 A 23 TRP HBx A 25 ILE HG12 1.0 0.0 6.50 1951 1742 A 23 TRP HBx A 25 ILE HG13 1.0 0.0 6.50 1952 1743 A 23 TRP HE3 A 25 ILE HG12 1.0 0.0 6.28 1953 1743 A 23 TRP HE3 A 25 ILE HG13 1.0 0.0 6.28 1954 1744 A 90 TRP HZ3 A 25 ILE HG12 1.0 0.0 6.50 1955 1744 A 90 TRP HZ3 A 25 ILE HG13 1.0 0.0 6.50 1956 1745 A 128 PHE HE% A 25 ILE HG12 1.0 0.0 6.50 1957 1745 A 128 PHE HE% A 25 ILE HG13 1.0 0.0 6.50 1958 1746 A 128 PHE HZ A 25 ILE HG12 1.0 0.0 6.50 1959 1746 A 128 PHE HZ A 25 ILE HG13 1.0 0.0 6.50 1960 1747 A 90 TRP HA A 25 ILE HG12 1.0 0.0 6.50 1961 1747 A 90 TRP HA A 25 ILE HG13 1.0 0.0 6.50 1962 1748 A 23 TRP HBy A 25 ILE HG12 1.0 0.0 6.50 1963 1748 A 23 TRP HBy A 25 ILE HG13 1.0 0.0 6.50 1964 1749 A 25 ILE HG2% A 25 ILE HG12 1.0 0.0 5.20 1965 1749 A 25 ILE HG2% A 25 ILE HG13 1.0 0.0 5.20 1966 1750 A 6 VAL HGy% A 25 ILE HG12 1.0 0.0 6.50 1967 1750 A 6 VAL HGy% A 25 ILE HG13 1.0 0.0 6.50 1968 1751 A 73 VAL HGy% A 25 ILE HG12 1.0 0.0 6.50 1969 1751 A 73 VAL HGy% A 25 ILE HG13 1.0 0.0 6.50 1970 1752 A 70 SER HA A 91 ILE HG1y 1.0 0.0 5.93 1971 1753 A 90 TRP HA A 91 ILE HG1y 1.0 0.0 6.50 1972 1754 A 24 GLU HA A 3 LEU HG 1.0 0.0 6.50 1973 1755 A 22 GLN HBy A 3 LEU HG 1.0 0.0 6.31 1974 1756 A 66 LEU HG A 72 GLU HB2 1.0 0.0 5.83 1975 1756 A 72 GLU HB3 A 66 LEU HG 1.0 0.0 5.83 1976 1757 A 47 LEU HA A 47 LEU HG 1.0 0.0 5.15 1977 1758 A 31 GLN H A 28 ARG HG2 1.0 0.0 6.50 1978 1758 A 28 ARG HG3 A 31 GLN H 1.0 0.0 6.50 1979 1759 A 53 TYR HE% A 28 ARG HG2 1.0 0.0 6.50 1980 1759 A 53 TYR HE% A 28 ARG HG3 1.0 0.0 6.50 1981 1760 A 67 GLY HAx A 65 LEU HDx% 1.0 0.0 6.50 1982 1761 A 67 GLY HAy A 65 LEU HDx% 1.0 0.0 5.80 1983 1762 A 65 LEU HA A 65 LEU HDx% 1.0 0.0 5.45 1984 1763 A 4 TYR HD% A 132 LEU HG 1.0 0.0 6.50 1985 1764 A 132 LEU HG A 4 TYR HE% 1.0 0.0 6.50 1986 1765 A 132 LEU HG A 112 GLN HA 1.0 0.0 6.29 1987 1766 A 46 THR HA A 47 LEU HG 1.0 0.0 6.50 1988 1767 A 47 LEU HG A 40 SER HBy 1.0 0.0 6.50 1989 1768 A 47 LEU HG A 40 SER HBx 1.0 0.0 6.50 1990 1769 A 91 ILE HA A 92 LEU HG 1.0 0.0 6.50 1991 1770 A 25 ILE HA A 92 LEU HG 1.0 0.0 6.50 1992 1771 A 92 LEU HG A 71 TYR HB2 1.0 0.0 6.50 1993 1771 A 71 TYR HB3 A 92 LEU HG 1.0 0.0 6.50 1994 1772 A 73 VAL HGy% A 92 LEU HG 1.0 0.0 6.50 1995 1773 A 4 TYR HD% A 114 LEU HG 1.0 0.0 6.50 1996 1774 A 128 PHE HD% A 114 LEU HG 1.0 0.0 6.50 1997 1775 A 128 PHE HE% A 114 LEU HG 1.0 0.0 6.50 1998 1776 A 66 LEU HA A 66 LEU HDx% 1.0 0.0 5.61 1999 1777 A 47 LEU HA A 47 LEU HDx% 1.0 0.0 6.50 2000 1778 A 114 LEU HA A 114 LEU HDx% 1.0 0.0 6.03 2001 1779 A 90 TRP HE3 A 92 LEU HDx% 1.0 0.0 5.08 2002 1780 A 9 GLN H A 126 ILE HG1x 1.0 0.0 5.58 2003 1781 A 73 VAL HGy% A 92 LEU HDx% 1.0 0.0 6.50 2004 1782 A 63 ALA HB% A 71 TYR HB2 1.0 0.0 4.68 2005 1782 A 63 ALA HB% A 71 TYR HB3 1.0 0.0 4.68 2006 1783 A 63 ALA HB% A 73 VAL HGy% 1.0 0.0 4.57 2007 1784 A 9 GLN H A 126 ILE HG1y 1.0 0.0 6.50 2008 1785 A 120 TYR HD% A 126 ILE HG1y 1.0 0.0 6.50 2009 1786 A 126 ILE HG1y A 125 PRO HA 1.0 0.0 6.40 2010 1787 A 77 TRP HE3 A 59 ILE HG1x 1.0 0.0 6.50 2011 1788 A 126 ILE HG1x A 118 MET HGy 1.0 0.0 6.31 2012 1789 A 126 ILE HG1x A 118 MET HGx 1.0 0.0 6.31 2013 1790 A 24 GLU HA A 3 LEU HDy% 1.0 0.0 6.50 2014 1791 A 22 GLN HBx A 3 LEU HDy% 1.0 0.0 6.47 2015 1792 A 3 LEU HA A 3 LEU HDy% 1.0 0.0 5.11 2016 1793 A 3 LEU HDy% A 22 GLN HGx 1.0 0.0 7.05 2017 1794 A 3 LEU HA A 3 LEU HDx% 1.0 0.0 5.11 2018 1795 A 3 LEU HDx% A 22 GLN HGx 1.0 0.0 7.05 2019 1796 A 23 TRP HZ3 A 92 LEU HDy% 1.0 0.0 6.30 2020 1797 A 90 TRP HZ3 A 92 LEU HDy% 1.0 0.0 6.50 2021 1798 A 73 VAL HGy% A 92 LEU HDy% 1.0 0.0 6.50 2022 1799 A 90 TRP HH2 A 33 VAL HGx% 1.0 0.0 5.60 2023 1800 A 85 HIS HA A 85 HIS HE1 1.0 0.0 6.50 2024 1801 A 83 PRO HBy A 85 HIS HE1 1.0 0.0 6.50 2025 1802 A 85 HIS HE1 A 83 PRO HG2 1.0 0.0 6.00 2026 1802 A 83 PRO HG3 A 85 HIS HE1 1.0 0.0 6.00 2027 1803 A 83 PRO HBx A 85 HIS HE1 1.0 0.0 6.50 2028 1804 A 53 TYR HD% A 32 ASN HA 1.0 0.0 6.50 2029 1805 A 120 TYR HD% A 99 ASN HA 1.0 0.0 6.50 2030 1806 A 53 TYR H A 53 TYR HD% 1.0 0.0 6.00 2031 1807 A 120 TYR H A 120 TYR HD% 1.0 0.0 6.50 2032 1808 A 99 ASN H A 120 TYR HD% 1.0 0.0 6.50 2033 1809 A 100 VAL H A 120 TYR HD% 1.0 0.0 6.50 2034 1810 A 53 TYR HD% A 53 TYR HA 1.0 0.0 5.03 2035 1811 A 120 TYR HD% A 120 TYR HA 1.0 0.0 5.28 2036 1812 A 53 TYR HD% A 33 VAL HA 1.0 0.0 5.47 2037 1813 A 120 TYR HD% A 100 VAL HA 1.0 0.0 6.01 2038 1814 A 53 TYR HD% A 31 GLN HG2 1.0 0.0 5.36 2039 1814 A 53 TYR HD% A 31 GLN HG3 1.0 0.0 5.36 2040 1815 A 53 TYR HD% A 31 GLN HBy 1.0 0.0 5.92 2041 1816 A 120 TYR HD% A 95 ARG HB2 1.0 0.0 6.22 2042 1816 A 95 ARG HB3 A 120 TYR HD% 1.0 0.0 6.22 2043 1817 A 53 TYR HD% A 31 GLN HBx 1.0 0.0 5.92 2044 1818 A 51 MET HE% A 53 TYR HD% 1.0 0.0 5.94 2045 1819 A 120 TYR HD% A 118 MET HE% 1.0 0.0 5.18 2046 1820 A 4 TYR HD% A 4 TYR HA 1.0 0.0 5.48 2047 1821 A 4 TYR HD% A 25 ILE HD1% 1.0 0.0 5.65 2048 1822 A 61 PHE HE% A 47 LEU H 1.0 0.0 6.50 2049 1823 A 64 THR H A 61 PHE HE% 1.0 0.0 6.50 2050 1824 A 73 VAL HA A 61 PHE HE% 1.0 0.0 6.50 2051 1825 A 61 PHE HE% A 47 LEU HBy 1.0 0.0 5.03 2052 1826 A 63 ALA HB% A 61 PHE HE% 1.0 0.0 4.73 2053 1827 A 73 VAL HGx% A 61 PHE HE% 1.0 0.0 5.33 2054 1828 A 61 PHE HE% A 62 ARG HA 1.0 0.0 6.50 2055 1829 A 61 PHE HD% A 90 TRP HH2 1.0 0.0 6.50 2056 1830 A 61 PHE HD% A 63 ALA HB% 1.0 0.0 5.44 2057 1831 A 128 PHE HD% A 129 LYS HA 1.0 0.0 5.08 2058 1832 A 61 PHE HE% A 51 MET HGx 1.0 0.0 5.65 2059 1833 A 61 PHE HD% A 38 VAL HGx% 1.0 0.0 5.53 2060 1834 A 61 PHE HD% A 73 VAL HGx% 1.0 0.0 5.82 2061 1835 A 128 PHE HD% A 6 VAL HGx% 1.0 0.0 5.20 2062 1836 A 128 PHE HA A 128 PHE HE% 1.0 0.0 6.38 2063 1837 A 128 PHE HE% A 129 LYS HA 1.0 0.0 6.50 2064 1838 A 128 PHE HE% A 114 LEU HBy 1.0 0.0 4.98 2065 1839 A 128 PHE HE% A 114 LEU HBx 1.0 0.0 5.37 2066 1840 A 25 ILE HD1% A 128 PHE HE% 1.0 0.0 5.59 2067 1841 A 6 VAL HGx% A 128 PHE HE% 1.0 0.0 4.87 2068 1842 A 23 TRP HBy A 128 PHE HE% 1.0 0.0 6.16 2069 1843 A 61 PHE HZ A 90 TRP HE3 1.0 0.0 6.39 2070 1844 A 61 PHE HZ A 90 TRP HBy 1.0 0.0 6.50 2071 1845 A 63 ALA H A 61 PHE HZ 1.0 0.0 6.50 2072 1846 A 73 VAL HA A 61 PHE HZ 1.0 0.0 6.50 2073 1847 A 61 PHE HZ A 51 MET HGx 1.0 0.0 6.50 2074 1848 A 61 PHE HZ A 71 TYR HB2 1.0 0.0 6.50 2075 1848 A 71 TYR HB3 A 61 PHE HZ 1.0 0.0 6.50 2076 1849 A 63 ALA HB% A 61 PHE HZ 1.0 0.0 4.78 2077 1850 A 73 VAL HGy% A 61 PHE HZ 1.0 0.0 4.93 2078 1851 A 61 PHE HZ A 90 TRP HBx 1.0 0.0 6.50 2079 1852 A 128 PHE HZ A 23 TRP HE3 1.0 0.0 6.41 2080 1853 A 128 PHE HZ A 130 GLY HAy 1.0 0.0 6.50 2081 1854 A 23 TRP HBx A 128 PHE HZ 1.0 0.0 6.50 2082 1855 A 130 GLY H A 128 PHE HZ 1.0 0.0 6.50 2083 1856 A 6 VAL HA A 128 PHE HZ 1.0 0.0 6.50 2084 1857 A 23 TRP HBy A 128 PHE HZ 1.0 0.0 6.09 2085 1858 A 4 TYR HBx A 128 PHE HZ 1.0 0.0 6.50 2086 1859 A 114 LEU HBy A 128 PHE HZ 1.0 0.0 5.48 2087 1860 A 25 ILE HD1% A 128 PHE HZ 1.0 0.0 4.79 2088 1861 A 6 VAL HGy% A 128 PHE HZ 1.0 0.0 4.68 2089 1862 A 77 TRP HD1 A 85 HIS HD2 1.0 0.0 6.50 2090 1863 A 77 TRP HD1 A 77 TRP HA 1.0 0.0 5.67 2091 1864 A 77 TRP HD1 A 78 GLY HAy 1.0 0.0 6.50 2092 1865 A 77 TRP HD1 A 78 GLY HAx 1.0 0.0 6.50 2093 1866 A 16 PRO HA A 17 TRP HD1 1.0 0.0 5.27 2094 1867 A 17 TRP HD1 A 17 TRP HBy 1.0 0.0 4.74 2095 1868 A 17 TRP HD1 A 129 LYS HD2 1.0 0.0 6.50 2096 1868 A 129 LYS HD3 A 17 TRP HD1 1.0 0.0 6.50 2097 1869 A 9 GLN HBy A 17 TRP HD1 1.0 0.0 6.50 2098 1870 A 10 TRP HD1 A 10 TRP HA 1.0 0.0 5.43 2099 1871 A 10 TRP HD1 A 11 GLY HAy 1.0 0.0 6.50 2100 1872 A 10 TRP HD1 A 11 GLY HAx 1.0 0.0 6.50 2101 1873 A 10 TRP HD1 A 10 TRP HBy 1.0 0.0 4.72 2102 1874 A 84 TRP HD1 A 83 PRO HA 1.0 0.0 5.69 2103 1875 A 84 TRP HD1 A 84 TRP HBx 1.0 0.0 4.84 2104 1876 A 76 GLN HBy A 84 TRP HD1 1.0 0.0 6.50 2105 1877 A 90 TRP HD1 A 26 GLY H 1.0 0.0 6.50 2106 1878 A 90 TRP HD1 A 89 ASN HA 1.0 0.0 5.28 2107 1879 A 90 TRP HD1 A 90 TRP HA 1.0 0.0 4.64 2108 1880 A 21 GLY HAx A 23 TRP HD1 1.0 0.0 5.54 2109 1881 A 90 TRP HD1 A 88 GLY HAx 1.0 0.0 5.44 2110 1882 A 128 PHE HE% A 23 TRP HH2 1.0 0.0 5.41 2111 1883 A 92 LEU HA A 23 TRP HH2 1.0 0.0 6.50 2112 1884 A 100 VAL HA A 23 TRP HH2 1.0 0.0 6.50 2113 1885 A 93 GLY HAy A 23 TRP HH2 1.0 0.0 6.39 2114 1886 A 23 TRP HH2 A 118 MET HB2 1.0 0.0 6.11 2115 1886 A 118 MET HB3 A 23 TRP HH2 1.0 0.0 6.11 2116 1887 A 118 MET HE% A 23 TRP HH2 1.0 0.0 4.40 2117 1888 A 103 ILE HG2% A 23 TRP HH2 1.0 0.0 6.04 2118 1889 A 6 VAL HGx% A 23 TRP HH2 1.0 0.0 6.27 2119 1890 A 6 VAL HB A 23 TRP HD1 1.0 0.0 4.90 2120 1891 A 23 TRP HD1 A 6 VAL HGy% 1.0 0.0 4.66 2121 1892 A 23 TRP HD1 A 23 TRP H 1.0 0.0 5.06 2122 1893 A 23 TRP HD1 A 22 GLN HA 1.0 0.0 5.13 2123 1894 A 23 TRP HA A 23 TRP HD1 1.0 0.0 4.68 2124 1895 A 23 TRP HD1 A 91 ILE HG2% 1.0 0.0 6.50 2125 1896 A 26 GLY HAy A 90 TRP HH2 1.0 0.0 6.06 2126 1897 A 61 PHE HE% A 90 TRP HH2 1.0 0.0 6.03 2127 1898 A 26 GLY HAx A 90 TRP HH2 1.0 0.0 6.50 2128 1899 A 90 TRP HH2 A 51 MET HGx 1.0 0.0 6.12 2129 1900 A 51 MET HE% A 90 TRP HH2 1.0 0.0 4.49 2130 1901 A 90 TRP HH2 A 33 VAL HGy% 1.0 0.0 5.60 2131 1902 A 25 ILE HG2% A 90 TRP HH2 1.0 0.0 5.45 2132 1903 A 73 VAL HGx% A 90 TRP HH2 1.0 0.0 6.50 2133 1904 A 19 GLU HA A 10 TRP HH2 1.0 0.0 6.50 2134 1905 A 20 GLY HAy A 10 TRP HH2 1.0 0.0 6.50 2135 1906 A 18 ASN HBx A 10 TRP HH2 1.0 0.0 5.60 2136 1907 A 18 ASN HBy A 10 TRP HH2 1.0 0.0 5.60 2137 1908 A 126 ILE HD1% A 10 TRP HH2 1.0 0.0 6.39 2138 1909 A 10 TRP HH2 A 20 GLY HAx 1.0 0.0 6.50 2139 1910 A 77 TRP HH2 A 85 HIS HBy 1.0 0.0 5.98 2140 1911 A 77 TRP HH2 A 59 ILE HD1% 1.0 0.0 6.50 2141 1912 A 77 TRP HH2 A 85 HIS HBx 1.0 0.0 5.98 2142 1913 A 128 PHE HA A 17 TRP HH2 1.0 0.0 6.50 2143 1914 A 17 TRP HH2 A 129 LYS HA 1.0 0.0 6.50 2144 1915 A 8 ASN HA A 17 TRP HH2 1.0 0.0 6.50 2145 1916 A 17 TRP HH2 A 129 LYS HBy 1.0 0.0 5.09 2146 1917 A 9 GLN HBy A 17 TRP HH2 1.0 0.0 6.19 2147 1918 A 84 TRP HH2 A 60 GLY HAy 1.0 0.0 5.60 2148 1919 A 17 TRP HH2 A 127 GLY HAy 1.0 0.0 6.23 2149 1920 A 84 TRP HH2 A 60 GLY HAx 1.0 0.0 5.60 2150 1921 A 17 TRP HH2 A 127 GLY HAx 1.0 0.0 5.77 2151 1922 A 61 PHE HA A 84 TRP HH2 1.0 0.0 6.40 2152 1923 A 76 GLN HBy A 84 TRP HH2 1.0 0.0 6.50 2153 1924 A 17 TRP HZ3 A 128 PHE HA 1.0 0.0 5.05 2154 1925 A 17 TRP HZ3 A 9 GLN HBy 1.0 0.0 6.20 2155 1926 A 10 TRP HBx A 10 TRP HZ3 1.0 0.0 6.50 2156 1927 A 25 ILE HG2% A 90 TRP HZ3 1.0 0.0 4.98 2157 1928 A 90 TRP HZ3 A 36 ILE HD1% 1.0 0.0 4.80 2158 1929 A 17 TRP HZ3 A 8 ASN HA 1.0 0.0 4.93 2159 1930 A 17 TRP HZ3 A 127 GLY HAx 1.0 0.0 6.23 2160 1931 A 17 TRP HZ3 A 7 GLU HB2 1.0 0.0 6.37 2161 1931 A 17 TRP HZ3 A 7 GLU HB3 1.0 0.0 6.37 2162 1932 A 17 TRP HZ3 A 129 LYS HBy 1.0 0.0 5.08 2163 1933 A 8 ASN HBx A 10 TRP HZ3 1.0 0.0 5.45 2164 1934 A 126 ILE HD1% A 10 TRP HZ3 1.0 0.0 5.44 2165 1935 A 8 ASN HA A 10 TRP HZ3 1.0 0.0 6.50 2166 1936 A 20 GLY HAx A 10 TRP HZ3 1.0 0.0 6.50 2167 1937 A 51 MET HE% A 90 TRP HZ3 1.0 0.0 6.50 2168 1938 A 8 ASN HBy A 10 TRP HZ3 1.0 0.0 5.06 2169 1939 A 18 ASN HBy A 10 TRP HZ3 1.0 0.0 5.99 2170 1940 A 25 ILE HA A 90 TRP HZ3 1.0 0.0 6.50 2171 1941 A 26 GLY H A 90 TRP HZ3 1.0 0.0 6.50 2172 1942 A 73 VAL HGy% A 90 TRP HZ3 1.0 0.0 6.50 2173 1943 A 90 TRP HZ3 A 92 LEU HDx% 1.0 0.0 6.50 2174 1944 A 84 TRP HZ3 A 74 GLU HB2 1.0 0.0 6.50 2175 1944 A 84 TRP HZ3 A 74 GLU HB3 1.0 0.0 6.50 2176 1945 A 84 TRP HZ3 A 62 ARG HG2 1.0 0.0 6.25 2177 1945 A 62 ARG HG3 A 84 TRP HZ3 1.0 0.0 6.25 2178 1946 A 84 TRP HZ3 A 75 ASN HA 1.0 0.0 4.96 2179 1947 A 84 TRP HZ3 A 61 PHE HA 1.0 0.0 5.08 2180 1948 A 84 TRP HZ3 A 60 GLY HAy 1.0 0.0 6.50 2181 1949 A 84 TRP HZ3 A 60 GLY HAx 1.0 0.0 6.50 2182 1950 A 84 TRP HZ3 A 62 ARG HBx 1.0 0.0 6.50 2183 1951 A 76 GLN HBy A 84 TRP HZ3 1.0 0.0 6.40 2184 1952 A 84 TRP HZ3 A 73 VAL HGx% 1.0 0.0 6.50 2185 1953 A 76 GLN HBy A 85 HIS HD2 1.0 0.0 6.50 2186 1954 A 23 TRP H A 23 TRP HE3 1.0 0.0 6.50 2187 1955 A 24 GLU H A 23 TRP HE3 1.0 0.0 6.50 2188 1956 A 128 PHE HE% A 23 TRP HE3 1.0 0.0 6.23 2189 1957 A 23 TRP HBx A 23 TRP HE3 1.0 0.0 5.16 2190 1958 A 103 ILE HD1% A 23 TRP HE3 1.0 0.0 5.55 2191 1959 A 25 ILE HD1% A 23 TRP HE3 1.0 0.0 5.22 2192 1960 A 6 VAL HGy% A 23 TRP HE3 1.0 0.0 6.50 2193 1961 A 59 ILE HD1% A 77 TRP HZ3 1.0 0.0 5.43 2194 1962 A 75 ASN HA A 77 TRP HZ3 1.0 0.0 6.50 2195 1963 A 87 GLY HAy A 77 TRP HZ3 1.0 0.0 6.50 2196 1964 A 128 PHE HE% A 23 TRP HZ3 1.0 0.0 5.99 2197 1965 A 92 LEU HA A 23 TRP HZ3 1.0 0.0 5.62 2198 1966 A 23 TRP HBy A 23 TRP HZ3 1.0 0.0 6.50 2199 1967 A 23 TRP HZ3 A 92 LEU HDx% 1.0 0.0 6.30 2200 1968 A 103 ILE HD1% A 23 TRP HZ3 1.0 0.0 5.55 2201 1969 A 25 ILE HD1% A 23 TRP HZ3 1.0 0.0 5.29 2202 1970 A 6 VAL HGy% A 23 TRP HZ3 1.0 0.0 6.50 2203 1971 A 119 THR H A 23 TRP HZ3 1.0 0.0 6.50 2204 1972 A 85 HIS HD2 A 77 TRP HZ3 1.0 0.0 6.50 2205 1973 A 85 HIS HD2 A 85 HIS HA 1.0 0.0 6.50 2206 1974 A 85 HIS HD2 A 84 TRP HA 1.0 0.0 6.12 2207 1975 A 85 HIS HD2 A 76 GLN HA 1.0 0.0 5.46 2208 1976 A 85 HIS HD2 A 83 PRO HG2 1.0 0.0 6.50 2209 1976 A 85 HIS HD2 A 83 PRO HG3 1.0 0.0 6.50 2210 1977 A 90 TRP HE3 A 36 ILE HD1% 1.0 0.0 6.27 2211 1978 A 23 TRP HA A 23 TRP HE3 1.0 0.0 6.50 2212 1979 A 61 PHE HE% A 90 TRP HE3 1.0 0.0 6.50 2213 1980 A 51 MET HGx A 90 TRP HE3 1.0 0.0 6.50 2214 1981 A 90 TRP HA A 90 TRP HE3 1.0 0.0 6.50 2215 1982 A 91 ILE H A 90 TRP HE3 1.0 0.0 6.49 2216 1983 A 25 ILE HA A 90 TRP HE3 1.0 0.0 5.46 2217 1984 A 92 LEU HG A 90 TRP HE3 1.0 0.0 5.61 2218 1985 A 90 TRP HE3 A 92 LEU HDy% 1.0 0.0 5.08 2219 1986 A 73 VAL HGy% A 90 TRP HE3 1.0 0.0 6.50 2220 1987 A 18 ASN HBy A 10 TRP HE3 1.0 0.0 6.50 2221 1988 A 10 TRP HE3 A 10 TRP HA 1.0 0.0 5.62 2222 1989 A 10 TRP HE3 A 9 GLN HA 1.0 0.0 6.38 2223 1990 A 10 TRP HE3 A 10 TRP HBx 1.0 0.0 4.69 2224 1991 A 10 TRP HE3 A 8 ASN HBx 1.0 0.0 5.67 2225 1992 A 10 TRP HE3 A 8 ASN HBy 1.0 0.0 5.71 2226 1993 A 10 TRP HE3 A 126 ILE HB 1.0 0.0 5.50 2227 1994 A 8 ASN HA A 10 TRP HE3 1.0 0.0 6.50 2228 1995 A 77 TRP HE3 A 85 HIS HD2 1.0 0.0 6.39 2229 1996 A 77 TRP HE3 A 77 TRP HA 1.0 0.0 5.86 2230 1997 A 77 TRP HE3 A 76 GLN HA 1.0 0.0 6.50 2231 1998 A 77 TRP HE3 A 77 TRP HBy 1.0 0.0 5.12 2232 1999 A 77 TRP HE3 A 77 TRP HBx 1.0 0.0 5.12 2233 2000 A 77 TRP HE3 A 59 ILE HB 1.0 0.0 5.38 2234 2001 A 77 TRP HE3 A 59 ILE HG1y 1.0 0.0 6.50 2235 2002 A 17 TRP HE3 A 7 GLU HA 1.0 0.0 6.07 2236 2003 A 17 TRP HE3 A 128 PHE HA 1.0 0.0 6.50 2237 2004 A 17 TRP HE3 A 9 GLN HBy 1.0 0.0 6.34 2238 2005 A 17 TRP HE3 A 17 TRP HA 1.0 0.0 5.24 2239 2006 A 84 TRP HE3 A 84 TRP HA 1.0 0.0 5.47 2240 2007 A 17 TRP HE3 A 7 GLU HB2 1.0 0.0 4.58 2241 2007 A 17 TRP HE3 A 7 GLU HB3 1.0 0.0 4.58 2242 2008 A 17 TRP HE3 A 129 LYS HBx 1.0 0.0 5.12 2243 2009 A 84 TRP HE3 A 62 ARG HBx 1.0 0.0 5.86 2244 2010 A 76 GLN HBy A 84 TRP HE3 1.0 0.0 5.88 2245 2011 A 120 TYR HE% A 99 ASN H 1.0 0.0 6.50 2246 2012 A 120 TYR HE% A 99 ASN HA 1.0 0.0 6.50 2247 2013 A 120 TYR HE% A 100 VAL HA 1.0 0.0 6.50 2248 2014 A 93 GLY HAy A 120 TYR HE% 1.0 0.0 5.60 2249 2015 A 120 TYR HE% A 95 ARG HD2 1.0 0.0 6.50 2250 2015 A 95 ARG HD3 A 120 TYR HE% 1.0 0.0 6.50 2251 2016 A 120 TYR HE% A 118 MET HE% 1.0 0.0 4.99 2252 2017 A 120 TYR HE% A 126 ILE HD1% 1.0 0.0 5.88 2253 2018 A 120 TYR H A 120 TYR HE% 1.0 0.0 6.50 2254 2019 A 120 TYR HE% A 93 GLY HAx 1.0 0.0 5.39 2255 2020 A 53 TYR H A 53 TYR HE% 1.0 0.0 6.50 2256 2021 A 32 ASN HA A 53 TYR HE% 1.0 0.0 6.50 2257 2022 A 32 ASN H A 53 TYR HE% 1.0 0.0 6.50 2258 2023 A 53 TYR HE% A 54 ALA H 1.0 0.0 6.50 2259 2024 A 53 TYR HE% A 90 TRP HZ2 1.0 0.0 6.50 2260 2025 A 26 GLY HAx A 53 TYR HE% 1.0 0.0 6.44 2261 2026 A 31 GLN HA A 53 TYR HE% 1.0 0.0 6.50 2262 2027 A 53 TYR HE% A 33 VAL HA 1.0 0.0 6.40 2263 2028 A 53 TYR HE% A 26 GLY HAy 1.0 0.0 5.58 2264 2029 A 53 TYR HE% A 28 ARG HB2 1.0 0.0 5.31 2265 2029 A 53 TYR HE% A 28 ARG HB3 1.0 0.0 5.31 2266 2030 A 53 TYR HE% A 51 MET HB2 1.0 0.0 5.65 2267 2030 A 51 MET HB3 A 53 TYR HE% 1.0 0.0 5.65 2268 2031 A 51 MET HE% A 53 TYR HE% 1.0 0.0 4.67 2269 2032 A 53 TYR HE% A 59 ILE HD1% 1.0 0.0 4.69 2270 2033 A 25 ILE H A 4 TYR HE% 1.0 0.0 5.32 2271 2034 A 132 LEU HA A 4 TYR HE% 1.0 0.0 5.47 2272 2035 A 4 TYR HE% A 2 ALA HB% 1.0 0.0 4.13 2273 2036 A 4 TYR HE% A 132 LEU HDx% 1.0 0.0 5.46 2274 2037 A 4 TYR HE% A 132 LEU HDy% 1.0 0.0 5.46 2275 2038 A 4 TYR HE% A 112 GLN HA 1.0 0.0 6.30 2276 2039 A 17 TRP HZ2 A 129 LYS HA 1.0 0.0 6.50 2277 2040 A 17 TRP HZ2 A 9 GLN HBx 1.0 0.0 5.81 2278 2041 A 9 GLN HBy A 17 TRP HZ2 1.0 0.0 6.12 2279 2042 A 17 TRP HZ2 A 127 GLY HAy 1.0 0.0 6.50 2280 2043 A 17 TRP HZ2 A 127 GLY HAx 1.0 0.0 6.24 2281 2044 A 61 PHE H A 84 TRP HZ2 1.0 0.0 6.50 2282 2045 A 84 TRP HZ2 A 62 ARG HD2 1.0 0.0 6.50 2283 2045 A 62 ARG HD3 A 84 TRP HZ2 1.0 0.0 6.50 2284 2046 A 62 ARG HBx A 84 TRP HZ2 1.0 0.0 5.53 2285 2047 A 76 GLN HBy A 84 TRP HZ2 1.0 0.0 6.06 2286 2048 A 62 ARG HA A 84 TRP HZ2 1.0 0.0 6.50 2287 2049 A 18 ASN HBx A 10 TRP HZ2 1.0 0.0 6.14 2288 2050 A 18 ASN HBy A 10 TRP HZ2 1.0 0.0 6.28 2289 2051 A 126 ILE HD1% A 10 TRP HZ2 1.0 0.0 6.50 2290 2052 A 73 VAL HB A 90 TRP HZ2 1.0 0.0 6.50 2291 2053 A 61 PHE HE% A 90 TRP HZ2 1.0 0.0 6.18 2292 2054 A 90 TRP HZ2 A 27 SER HA 1.0 0.0 6.50 2293 2055 A 26 GLY HAx A 90 TRP HZ2 1.0 0.0 5.78 2294 2056 A 26 GLY HAy A 90 TRP HZ2 1.0 0.0 4.95 2295 2057 A 51 MET HGx A 90 TRP HZ2 1.0 0.0 6.50 2296 2058 A 51 MET HE% A 90 TRP HZ2 1.0 0.0 4.76 2297 2059 A 25 ILE HG2% A 90 TRP HZ2 1.0 0.0 6.50 2298 2060 A 73 VAL HGx% A 90 TRP HZ2 1.0 0.0 5.26 2299 2061 A 120 TYR HE% A 23 TRP HZ2 1.0 0.0 4.99 2300 2062 A 120 TYR HD% A 23 TRP HZ2 1.0 0.0 6.50 2301 2063 A 128 PHE HE% A 23 TRP HZ2 1.0 0.0 6.13 2302 2064 A 93 GLY HAx A 23 TRP HZ2 1.0 0.0 6.50 2303 2065 A 92 LEU HA A 23 TRP HZ2 1.0 0.0 6.50 2304 2066 A 93 GLY HAy A 23 TRP HZ2 1.0 0.0 5.00 2305 2067 A 118 MET HE% A 23 TRP HZ2 1.0 0.0 4.64 2306 2068 A 6 VAL HGx% A 23 TRP HZ2 1.0 0.0 5.21 2307 2069 A 85 HIS HE1 A 77 TRP HZ2 1.0 0.0 6.50 2308 2070 A 85 HIS HD2 A 77 TRP HZ2 1.0 0.0 6.50 2309 2071 A 59 ILE HD1% A 77 TRP HZ2 1.0 0.0 6.50 2310 2072 A 2 ALA HA A 3 LEU HDx% 1.0 0.0 6.41 2311 2072 A 2 ALA HA A 3 LEU HDy% 1.0 0.0 6.41 2312 2073 A 2 ALA HA A 132 LEU HDx% 1.0 0.0 6.44 2313 2073 A 2 ALA HA A 132 LEU HDy% 1.0 0.0 6.44 2314 2074 A 3 LEU H A 3 LEU HBy 1.0 0.0 4.66 2315 2074 A 3 LEU H A 3 LEU HBx 1.0 0.0 4.66 2316 2075 A 3 LEU H A 3 LEU HDx% 1.0 0.0 5.34 2317 2075 A 3 LEU H A 3 LEU HDy% 1.0 0.0 5.34 2318 2076 A 3 LEU H A 132 LEU HDx% 1.0 0.0 5.53 2319 2076 A 3 LEU H A 132 LEU HDy% 1.0 0.0 5.53 2320 2077 A 3 LEU HA A 3 LEU HDx% 1.0 0.0 4.58 2321 2077 A 3 LEU HA A 3 LEU HDy% 1.0 0.0 4.58 2322 2078 A 3 LEU HA A 22 GLN HGx 1.0 0.0 6.34 2323 2078 A 3 LEU HA A 22 GLN HGy 1.0 0.0 6.34 2324 2079 A 4 TYR HA A 3 LEU HBy 1.0 0.0 6.34 2325 2079 A 4 TYR HA A 3 LEU HBx 1.0 0.0 6.34 2326 2080 A 22 GLN HBy A 3 LEU HBy 1.0 0.0 6.34 2327 2080 A 22 GLN HBy A 3 LEU HBx 1.0 0.0 6.34 2328 2081 A 3 LEU HBy A 22 GLN HGx 1.0 0.0 6.18 2329 2081 A 3 LEU HBx A 22 GLN HGx 1.0 0.0 6.18 2330 2081 A 22 GLN HGy A 3 LEU HBy 1.0 0.0 6.18 2331 2081 A 3 LEU HBx A 22 GLN HGy 1.0 0.0 6.18 2332 2082 A 22 GLN HE21 A 3 LEU HBy 1.0 0.0 6.34 2333 2082 A 22 GLN HE21 A 3 LEU HBx 1.0 0.0 6.34 2334 2083 A 133 THR HG2% A 3 LEU HBy 1.0 0.0 5.34 2335 2083 A 133 THR HG2% A 3 LEU HBx 1.0 0.0 5.34 2336 2084 A 3 LEU HG A 22 GLN HGx 1.0 0.0 5.47 2337 2084 A 3 LEU HG A 22 GLN HGy 1.0 0.0 5.47 2338 2085 A 4 TYR H A 3 LEU HDx% 1.0 0.0 5.18 2339 2085 A 4 TYR H A 3 LEU HDy% 1.0 0.0 5.18 2340 2086 A 4 TYR HD% A 3 LEU HDx% 1.0 0.0 6.44 2341 2086 A 4 TYR HD% A 3 LEU HDy% 1.0 0.0 6.44 2342 2087 A 5 ASN HD22 A 3 LEU HDy% 1.0 0.0 6.27 2343 2087 A 5 ASN HD22 A 3 LEU HDx% 1.0 0.0 6.27 2344 2087 A 5 ASN HD21 A 3 LEU HDx% 1.0 0.0 6.27 2345 2087 A 5 ASN HD21 A 3 LEU HDy% 1.0 0.0 6.27 2346 2088 A 22 GLN HA A 3 LEU HDx% 1.0 0.0 6.44 2347 2088 A 22 GLN HA A 3 LEU HDy% 1.0 0.0 6.44 2348 2089 A 22 GLN HBy A 3 LEU HDx% 1.0 0.0 5.02 2349 2089 A 22 GLN HBy A 3 LEU HDy% 1.0 0.0 5.02 2350 2090 A 22 GLN HBx A 3 LEU HDx% 1.0 0.0 5.37 2351 2090 A 22 GLN HBx A 3 LEU HDy% 1.0 0.0 5.37 2352 2091 A 3 LEU HDx% A 22 GLN HGx 1.0 0.0 4.74 2353 2091 A 3 LEU HDy% A 22 GLN HGx 1.0 0.0 4.74 2354 2091 A 22 GLN HGy A 3 LEU HDx% 1.0 0.0 4.74 2355 2091 A 3 LEU HDy% A 22 GLN HGy 1.0 0.0 4.74 2356 2092 A 22 GLN HGy A 3 LEU HDx% 1.0 0.0 7.05 2357 2093 A 3 LEU HDy% A 22 GLN HGy 1.0 0.0 7.05 2358 2094 A 22 GLN HE21 A 3 LEU HDx% 1.0 0.0 5.45 2359 2094 A 22 GLN HE21 A 3 LEU HDy% 1.0 0.0 5.45 2360 2095 A 22 GLN HE22 A 3 LEU HDx% 1.0 0.0 5.22 2361 2095 A 22 GLN HE22 A 3 LEU HDy% 1.0 0.0 5.22 2362 2096 A 23 TRP H A 3 LEU HDx% 1.0 0.0 6.42 2363 2096 A 23 TRP H A 3 LEU HDy% 1.0 0.0 6.42 2364 2097 A 24 GLU HA A 3 LEU HDx% 1.0 0.0 5.53 2365 2097 A 24 GLU HA A 3 LEU HDy% 1.0 0.0 5.53 2366 2098 A 3 LEU HDy% A 24 GLU HG2 1.0 0.0 5.71 2367 2098 A 3 LEU HDx% A 24 GLU HG2 1.0 0.0 5.71 2368 2098 A 24 GLU HG3 A 3 LEU HDx% 1.0 0.0 5.71 2369 2098 A 24 GLU HG3 A 3 LEU HDy% 1.0 0.0 5.71 2370 2099 A 133 THR H A 3 LEU HDx% 1.0 0.0 6.44 2371 2099 A 133 THR H A 3 LEU HDy% 1.0 0.0 6.44 2372 2100 A 133 THR HB A 3 LEU HDx% 1.0 0.0 6.31 2373 2100 A 133 THR HB A 3 LEU HDy% 1.0 0.0 6.31 2374 2101 A 4 TYR HD% A 114 LEU HDx% 1.0 0.0 5.39 2375 2101 A 4 TYR HD% A 114 LEU HDy% 1.0 0.0 5.39 2376 2102 A 4 TYR HD% A 132 LEU HBy 1.0 0.0 6.06 2377 2102 A 4 TYR HD% A 132 LEU HBx 1.0 0.0 6.06 2378 2103 A 4 TYR HE% A 114 LEU HDx% 1.0 0.0 5.26 2379 2103 A 4 TYR HE% A 114 LEU HDy% 1.0 0.0 5.26 2380 2104 A 4 TYR HE% A 132 LEU HDx% 1.0 0.0 4.83 2381 2104 A 4 TYR HE% A 132 LEU HDy% 1.0 0.0 4.83 2382 2105 A 5 ASN H A 5 ASN HD21 1.0 0.0 5.74 2383 2105 A 5 ASN H A 5 ASN HD22 1.0 0.0 5.74 2384 2106 A 5 ASN H A 130 GLY HAy 1.0 0.0 5.87 2385 2106 A 5 ASN H A 130 GLY HAx 1.0 0.0 5.87 2386 2107 A 5 ASN H A 132 LEU HDx% 1.0 0.0 6.44 2387 2107 A 5 ASN H A 132 LEU HDy% 1.0 0.0 6.44 2388 2108 A 5 ASN HA A 22 GLN HGx 1.0 0.0 6.34 2389 2108 A 5 ASN HA A 22 GLN HGy 1.0 0.0 6.34 2390 2109 A 6 VAL H A 5 ASN HD21 1.0 0.0 6.34 2391 2109 A 6 VAL H A 5 ASN HD22 1.0 0.0 6.34 2392 2110 A 133 THR HB A 5 ASN HD21 1.0 0.0 5.85 2393 2110 A 133 THR HB A 5 ASN HD22 1.0 0.0 5.85 2394 2111 A 133 THR HG2% A 5 ASN HD21 1.0 0.0 4.70 2395 2111 A 133 THR HG2% A 5 ASN HD22 1.0 0.0 4.70 2396 2112 A 6 VAL H A 130 GLY HAy 1.0 0.0 6.33 2397 2112 A 6 VAL H A 130 GLY HAx 1.0 0.0 6.33 2398 2113 A 6 VAL HA A 130 GLY HAy 1.0 0.0 4.76 2399 2113 A 6 VAL HA A 130 GLY HAx 1.0 0.0 4.76 2400 2114 A 6 VAL HGx% A 128 PHE HBy 1.0 0.0 6.34 2401 2114 A 6 VAL HGx% A 128 PHE HBx 1.0 0.0 6.34 2402 2115 A 6 VAL HGy% A 92 LEU HDx% 1.0 0.0 6.44 2403 2115 A 6 VAL HGy% A 92 LEU HDy% 1.0 0.0 6.44 2404 2116 A 6 VAL HGy% A 130 GLY HAy 1.0 0.0 5.20 2405 2116 A 6 VAL HGy% A 130 GLY HAx 1.0 0.0 5.20 2406 2117 A 9 GLN H A 18 ASN HD21 1.0 0.0 6.34 2407 2117 A 9 GLN H A 18 ASN HD22 1.0 0.0 6.34 2408 2118 A 9 GLN HBx A 9 GLN HE21 1.0 0.0 5.83 2409 2118 A 9 GLN HBx A 9 GLN HE22 1.0 0.0 5.83 2410 2119 A 9 GLN HE22 A 9 GLN HGx 1.0 0.0 4.19 2411 2119 A 9 GLN HE21 A 9 GLN HGy 1.0 0.0 4.19 2412 2119 A 9 GLN HE22 A 9 GLN HGy 1.0 0.0 4.19 2413 2119 A 9 GLN HE21 A 9 GLN HGx 1.0 0.0 4.19 2414 2120 A 10 TRP H A 9 GLN HGx 1.0 0.0 5.72 2415 2120 A 10 TRP H A 9 GLN HGy 1.0 0.0 5.72 2416 2121 A 10 TRP HA A 9 GLN HGx 1.0 0.0 6.34 2417 2121 A 10 TRP HA A 9 GLN HGy 1.0 0.0 6.34 2418 2122 A 11 GLY H A 9 GLN HGx 1.0 0.0 6.26 2419 2122 A 11 GLY H A 9 GLN HGy 1.0 0.0 6.26 2420 2123 A 17 TRP HA A 9 GLN HGx 1.0 0.0 5.98 2421 2123 A 17 TRP HA A 9 GLN HGy 1.0 0.0 5.98 2422 2124 A 17 TRP HE1 A 9 GLN HGx 1.0 0.0 6.34 2423 2124 A 17 TRP HE1 A 9 GLN HGy 1.0 0.0 6.34 2424 2125 A 9 GLN HE21 A 13 SER H 1.0 0.0 6.34 2425 2125 A 9 GLN HE22 A 13 SER H 1.0 0.0 6.34 2426 2126 A 13 SER HA A 9 GLN HE22 1.0 0.0 5.13 2427 2126 A 13 SER HA A 9 GLN HE21 1.0 0.0 5.13 2428 2127 A 14 SER H A 9 GLN HE21 1.0 0.0 6.34 2429 2127 A 14 SER H A 9 GLN HE22 1.0 0.0 6.34 2430 2128 A 9 GLN HE21 A 14 SER HA 1.0 0.0 6.34 2431 2128 A 9 GLN HE22 A 14 SER HA 1.0 0.0 6.34 2432 2129 A 15 ALA H A 9 GLN HE21 1.0 0.0 5.84 2433 2129 A 15 ALA H A 9 GLN HE22 1.0 0.0 5.84 2434 2130 A 9 GLN HE21 A 15 ALA HA 1.0 0.0 6.34 2435 2130 A 9 GLN HE22 A 15 ALA HA 1.0 0.0 6.34 2436 2131 A 15 ALA HB% A 9 GLN HE22 1.0 0.0 6.29 2437 2131 A 15 ALA HB% A 9 GLN HE21 1.0 0.0 6.29 2438 2132 A 16 PRO HA A 9 GLN HE21 1.0 0.0 6.34 2439 2132 A 16 PRO HA A 9 GLN HE22 1.0 0.0 6.34 2440 2133 A 17 TRP HE1 A 9 GLN HE21 1.0 0.0 5.62 2441 2133 A 17 TRP HE1 A 9 GLN HE22 1.0 0.0 5.62 2442 2134 A 10 TRP HD1 A 11 GLY HAy 1.0 0.0 5.72 2443 2134 A 10 TRP HD1 A 11 GLY HAx 1.0 0.0 5.72 2444 2135 A 11 GLY H A 12 GLY HAy 1.0 0.0 6.34 2445 2135 A 11 GLY H A 12 GLY HAx 1.0 0.0 6.34 2446 2136 A 15 ALA H A 11 GLY HAy 1.0 0.0 6.21 2447 2136 A 15 ALA H A 11 GLY HAx 1.0 0.0 6.21 2448 2137 A 15 ALA HB% A 11 GLY HAy 1.0 0.0 5.07 2449 2137 A 15 ALA HB% A 11 GLY HAx 1.0 0.0 5.07 2450 2138 A 13 SER H A 12 GLY HAy 1.0 0.0 4.05 2451 2138 A 13 SER H A 12 GLY HAx 1.0 0.0 4.05 2452 2139 A 14 SER H A 14 SER HBy 1.0 0.0 4.25 2453 2139 A 14 SER H A 14 SER HBx 1.0 0.0 4.25 2454 2140 A 15 ALA H A 14 SER HBy 1.0 0.0 5.41 2455 2140 A 15 ALA H A 14 SER HBx 1.0 0.0 5.41 2456 2141 A 15 ALA H A 16 PRO HDy 1.0 0.0 6.29 2457 2141 A 15 ALA H A 16 PRO HDx 1.0 0.0 6.29 2458 2142 A 15 ALA HA A 16 PRO HBx 1.0 0.0 6.23 2459 2142 A 15 ALA HA A 16 PRO HBy 1.0 0.0 6.23 2460 2143 A 15 ALA HA A 16 PRO HDy 1.0 0.0 4.12 2461 2143 A 15 ALA HA A 16 PRO HDx 1.0 0.0 4.12 2462 2144 A 15 ALA HB% A 16 PRO HDy 1.0 0.0 4.32 2463 2144 A 15 ALA HB% A 16 PRO HDx 1.0 0.0 4.32 2464 2145 A 15 ALA HB% A 18 ASN HD21 1.0 0.0 6.34 2465 2145 A 15 ALA HB% A 18 ASN HD22 1.0 0.0 6.34 2466 2146 A 17 TRP H A 16 PRO HBx 1.0 0.0 4.72 2467 2146 A 17 TRP H A 16 PRO HBy 1.0 0.0 4.72 2468 2147 A 17 TRP HD1 A 16 PRO HBx 1.0 0.0 6.34 2469 2147 A 17 TRP HD1 A 16 PRO HBy 1.0 0.0 6.34 2470 2148 A 18 ASN HD21 A 16 PRO HBy 1.0 0.0 6.18 2471 2148 A 18 ASN HD22 A 16 PRO HBy 1.0 0.0 6.18 2472 2148 A 18 ASN HD21 A 16 PRO HBx 1.0 0.0 6.18 2473 2148 A 18 ASN HD22 A 16 PRO HBx 1.0 0.0 6.18 2474 2149 A 18 ASN HD21 A 16 PRO HG2 1.0 0.0 6.34 2475 2149 A 16 PRO HG3 A 18 ASN HD21 1.0 0.0 6.34 2476 2149 A 18 ASN HD22 A 16 PRO HG2 1.0 0.0 6.34 2477 2149 A 18 ASN HD22 A 16 PRO HG3 1.0 0.0 6.34 2478 2150 A 17 TRP HZ3 A 128 PHE HBy 1.0 0.0 6.34 2479 2150 A 17 TRP HZ3 A 128 PHE HBx 1.0 0.0 6.34 2480 2151 A 17 TRP HZ2 A 115 ASN HBy 1.0 0.0 6.34 2481 2151 A 17 TRP HZ2 A 115 ASN HBx 1.0 0.0 6.34 2482 2152 A 18 ASN H A 18 ASN HD21 1.0 0.0 5.78 2483 2152 A 18 ASN H A 18 ASN HD22 1.0 0.0 5.78 2484 2153 A 21 GLY HAy A 22 GLN HGx 1.0 0.0 6.34 2485 2153 A 21 GLY HAy A 22 GLN HGy 1.0 0.0 6.34 2486 2154 A 22 GLN H A 22 GLN HGx 1.0 0.0 5.36 2487 2154 A 22 GLN H A 22 GLN HGy 1.0 0.0 5.36 2488 2155 A 22 GLN HA A 22 GLN HGx 1.0 0.0 4.73 2489 2155 A 22 GLN HA A 22 GLN HGy 1.0 0.0 4.73 2490 2156 A 23 TRP HBy A 92 LEU HDx% 1.0 0.0 6.44 2491 2156 A 23 TRP HBy A 92 LEU HDy% 1.0 0.0 6.44 2492 2157 A 23 TRP HBx A 92 LEU HDx% 1.0 0.0 5.07 2493 2157 A 23 TRP HBx A 92 LEU HDy% 1.0 0.0 5.07 2494 2158 A 23 TRP HE3 A 92 LEU HDx% 1.0 0.0 4.93 2495 2158 A 23 TRP HE3 A 92 LEU HDy% 1.0 0.0 4.93 2496 2159 A 23 TRP HE1 A 94 SER HBx 1.0 0.0 5.35 2497 2159 A 23 TRP HE1 A 94 SER HBy 1.0 0.0 5.35 2498 2160 A 23 TRP HZ3 A 92 LEU HBy 1.0 0.0 6.34 2499 2160 A 23 TRP HZ3 A 92 LEU HBx 1.0 0.0 6.34 2500 2161 A 23 TRP HZ3 A 92 LEU HDx% 1.0 0.0 4.87 2501 2161 A 23 TRP HZ3 A 92 LEU HDy% 1.0 0.0 4.87 2502 2162 A 23 TRP HZ3 A 100 VAL HGy% 1.0 0.0 5.20 2503 2162 A 23 TRP HZ3 A 100 VAL HGx% 1.0 0.0 5.20 2504 2163 A 23 TRP HZ2 A 94 SER HBx 1.0 0.0 6.34 2505 2163 A 23 TRP HZ2 A 94 SER HBy 1.0 0.0 6.34 2506 2164 A 23 TRP HZ2 A 100 VAL HGy% 1.0 0.0 5.13 2507 2164 A 23 TRP HZ2 A 100 VAL HGx% 1.0 0.0 5.13 2508 2165 A 23 TRP HZ2 A 118 MET HGx 1.0 0.0 6.34 2509 2165 A 23 TRP HZ2 A 118 MET HGy 1.0 0.0 6.34 2510 2166 A 23 TRP HH2 A 100 VAL HGy% 1.0 0.0 4.57 2511 2166 A 23 TRP HH2 A 100 VAL HGx% 1.0 0.0 4.57 2512 2167 A 23 TRP HH2 A 103 ILE HG1x 1.0 0.0 6.34 2513 2167 A 23 TRP HH2 A 103 ILE HG1y 1.0 0.0 6.34 2514 2168 A 23 TRP HH2 A 118 MET HGx 1.0 0.0 5.73 2515 2168 A 23 TRP HH2 A 118 MET HGy 1.0 0.0 5.73 2516 2169 A 24 GLU HB3 A 91 ILE HG1x 1.0 0.0 6.02 2517 2169 A 24 GLU HB2 A 91 ILE HG1x 1.0 0.0 6.02 2518 2169 A 91 ILE HG1y A 24 GLU HB2 1.0 0.0 6.02 2519 2169 A 24 GLU HB3 A 91 ILE HG1y 1.0 0.0 6.02 2520 2170 A 25 ILE HA A 92 LEU HDx% 1.0 0.0 6.17 2521 2170 A 25 ILE HA A 92 LEU HDy% 1.0 0.0 6.17 2522 2171 A 25 ILE HB A 114 LEU HDx% 1.0 0.0 6.44 2523 2171 A 25 ILE HB A 114 LEU HDy% 1.0 0.0 6.44 2524 2172 A 25 ILE HG2% A 33 VAL HGy% 1.0 0.0 4.51 2525 2172 A 25 ILE HG2% A 33 VAL HGx% 1.0 0.0 4.51 2526 2173 A 25 ILE HG12 A 92 LEU HDx% 1.0 0.0 4.66 2527 2173 A 25 ILE HG13 A 92 LEU HDx% 1.0 0.0 4.66 2528 2173 A 92 LEU HDy% A 25 ILE HG12 1.0 0.0 4.66 2529 2173 A 25 ILE HG13 A 92 LEU HDy% 1.0 0.0 4.66 2530 2174 A 26 GLY H A 33 VAL HGy% 1.0 0.0 6.44 2531 2174 A 26 GLY H A 33 VAL HGx% 1.0 0.0 6.44 2532 2175 A 26 GLY H A 90 TRP HBx 1.0 0.0 6.34 2533 2175 A 26 GLY H A 90 TRP HBy 1.0 0.0 6.34 2534 2176 A 26 GLY HAy A 33 VAL HGy% 1.0 0.0 4.96 2535 2176 A 26 GLY HAy A 33 VAL HGx% 1.0 0.0 4.96 2536 2177 A 26 GLY HAx A 33 VAL HGy% 1.0 0.0 4.80 2537 2177 A 26 GLY HAx A 33 VAL HGx% 1.0 0.0 4.80 2538 2178 A 27 SER H A 33 VAL HGy% 1.0 0.0 6.44 2539 2178 A 27 SER H A 33 VAL HGx% 1.0 0.0 6.44 2540 2179 A 90 TRP HE1 A 27 SER HBy 1.0 0.0 5.31 2541 2179 A 90 TRP HE1 A 27 SER HBx 1.0 0.0 5.31 2542 2180 A 90 TRP HZ2 A 27 SER HBy 1.0 0.0 6.34 2543 2180 A 90 TRP HZ2 A 27 SER HBx 1.0 0.0 6.34 2544 2181 A 28 ARG H A 33 VAL HGy% 1.0 0.0 6.44 2545 2181 A 28 ARG H A 33 VAL HGx% 1.0 0.0 6.44 2546 2182 A 31 GLN HA A 30 ASP HBy 1.0 0.0 6.34 2547 2182 A 31 GLN HA A 30 ASP HBx 1.0 0.0 6.34 2548 2183 A 30 ASP HBx A 31 GLN HBx 1.0 0.0 5.76 2549 2183 A 30 ASP HBy A 31 GLN HBx 1.0 0.0 5.76 2550 2183 A 31 GLN HBy A 30 ASP HBy 1.0 0.0 5.76 2551 2183 A 30 ASP HBx A 31 GLN HBy 1.0 0.0 5.76 2552 2184 A 30 ASP HBy A 31 GLN HG2 1.0 0.0 6.29 2553 2184 A 31 GLN HG3 A 30 ASP HBy 1.0 0.0 6.29 2554 2184 A 31 GLN HG3 A 30 ASP HBx 1.0 0.0 6.29 2555 2184 A 30 ASP HBx A 31 GLN HG2 1.0 0.0 6.29 2556 2185 A 31 GLN H A 32 ASN HBx 1.0 0.0 6.34 2557 2185 A 31 GLN H A 32 ASN HBy 1.0 0.0 6.34 2558 2186 A 31 GLN HA A 32 ASN HBx 1.0 0.0 6.34 2559 2186 A 31 GLN HA A 32 ASN HBy 1.0 0.0 6.34 2560 2187 A 31 GLN HBx A 31 GLN HE22 1.0 0.0 5.44 2561 2187 A 31 GLN HE21 A 31 GLN HBx 1.0 0.0 5.44 2562 2187 A 31 GLN HBy A 31 GLN HE21 1.0 0.0 5.44 2563 2187 A 31 GLN HBy A 31 GLN HE22 1.0 0.0 5.44 2564 2188 A 32 ASN H A 31 GLN HBx 1.0 0.0 5.43 2565 2188 A 32 ASN H A 31 GLN HBy 1.0 0.0 5.43 2566 2189 A 31 GLN HBx A 32 ASN HBx 1.0 0.0 6.18 2567 2189 A 31 GLN HBy A 32 ASN HBx 1.0 0.0 6.18 2568 2189 A 32 ASN HBy A 31 GLN HBx 1.0 0.0 6.18 2569 2189 A 31 GLN HBy A 32 ASN HBy 1.0 0.0 6.18 2570 2190 A 31 GLN HBx A 53 TYR HBy 1.0 0.0 6.18 2571 2190 A 31 GLN HBy A 53 TYR HBy 1.0 0.0 6.18 2572 2190 A 53 TYR HBx A 31 GLN HBx 1.0 0.0 6.18 2573 2190 A 31 GLN HBy A 53 TYR HBx 1.0 0.0 6.18 2574 2191 A 53 TYR HD% A 31 GLN HBx 1.0 0.0 5.20 2575 2191 A 53 TYR HD% A 31 GLN HBy 1.0 0.0 5.20 2576 2192 A 31 GLN HG3 A 53 TYR HBy 1.0 0.0 6.34 2577 2192 A 31 GLN HG2 A 53 TYR HBy 1.0 0.0 6.34 2578 2192 A 53 TYR HBx A 31 GLN HG2 1.0 0.0 6.34 2579 2192 A 31 GLN HG3 A 53 TYR HBx 1.0 0.0 6.34 2580 2193 A 32 ASN H A 31 GLN HE22 1.0 0.0 6.34 2581 2193 A 32 ASN H A 31 GLN HE21 1.0 0.0 6.34 2582 2194 A 31 GLN HE22 A 32 ASN HBx 1.0 0.0 5.11 2583 2194 A 31 GLN HE21 A 32 ASN HBx 1.0 0.0 5.11 2584 2194 A 32 ASN HBy A 31 GLN HE22 1.0 0.0 5.11 2585 2194 A 32 ASN HBy A 31 GLN HE21 1.0 0.0 5.11 2586 2195 A 33 VAL H A 31 GLN HE22 1.0 0.0 6.34 2587 2195 A 33 VAL H A 31 GLN HE21 1.0 0.0 6.34 2588 2196 A 53 TYR HA A 31 GLN HE22 1.0 0.0 6.34 2589 2196 A 53 TYR HA A 31 GLN HE21 1.0 0.0 6.34 2590 2197 A 31 GLN HE22 A 53 TYR HBy 1.0 0.0 5.02 2591 2197 A 31 GLN HE21 A 53 TYR HBy 1.0 0.0 5.02 2592 2197 A 53 TYR HBx A 31 GLN HE22 1.0 0.0 5.02 2593 2197 A 31 GLN HE21 A 53 TYR HBx 1.0 0.0 5.02 2594 2198 A 54 ALA H A 31 GLN HE22 1.0 0.0 5.28 2595 2198 A 54 ALA H A 31 GLN HE21 1.0 0.0 5.28 2596 2199 A 32 ASN H A 32 ASN HBx 1.0 0.0 4.38 2597 2199 A 32 ASN H A 32 ASN HBy 1.0 0.0 4.38 2598 2200 A 32 ASN H A 32 ASN HD21 1.0 0.0 5.66 2599 2200 A 32 ASN H A 32 ASN HD22 1.0 0.0 5.66 2600 2201 A 32 ASN HA A 33 VAL HGy% 1.0 0.0 5.85 2601 2201 A 32 ASN HA A 33 VAL HGx% 1.0 0.0 5.85 2602 2202 A 32 ASN HD22 A 32 ASN HBx 1.0 0.0 4.21 2603 2202 A 32 ASN HD21 A 32 ASN HBy 1.0 0.0 4.21 2604 2202 A 32 ASN HD21 A 32 ASN HBx 1.0 0.0 4.21 2605 2202 A 32 ASN HD22 A 32 ASN HBy 1.0 0.0 4.21 2606 2203 A 33 VAL H A 32 ASN HBx 1.0 0.0 4.96 2607 2203 A 33 VAL H A 32 ASN HBy 1.0 0.0 4.96 2608 2204 A 33 VAL HB A 32 ASN HBx 1.0 0.0 6.34 2609 2204 A 33 VAL HB A 32 ASN HBy 1.0 0.0 6.34 2610 2205 A 34 VAL HGx% A 32 ASN HBx 1.0 0.0 5.65 2611 2205 A 34 VAL HGx% A 32 ASN HBy 1.0 0.0 5.65 2612 2206 A 54 ALA HB% A 32 ASN HBx 1.0 0.0 5.53 2613 2206 A 54 ALA HB% A 32 ASN HBy 1.0 0.0 5.53 2614 2207 A 111 GLY HAy A 32 ASN HBx 1.0 0.0 5.38 2615 2207 A 111 GLY HAy A 32 ASN HBy 1.0 0.0 5.38 2616 2208 A 32 ASN HBx A 132 LEU HDx% 1.0 0.0 5.85 2617 2208 A 32 ASN HBy A 132 LEU HDx% 1.0 0.0 5.85 2618 2208 A 132 LEU HDy% A 32 ASN HBx 1.0 0.0 5.85 2619 2208 A 132 LEU HDy% A 32 ASN HBy 1.0 0.0 5.85 2620 2209 A 32 ASN HD21 A 33 VAL HGx% 1.0 0.0 6.27 2621 2209 A 32 ASN HD22 A 33 VAL HGy% 1.0 0.0 6.27 2622 2209 A 32 ASN HD22 A 33 VAL HGx% 1.0 0.0 6.27 2623 2209 A 32 ASN HD21 A 33 VAL HGy% 1.0 0.0 6.27 2624 2210 A 34 VAL HGx% A 32 ASN HD21 1.0 0.0 6.34 2625 2210 A 34 VAL HGx% A 32 ASN HD22 1.0 0.0 6.34 2626 2211 A 54 ALA HB% A 32 ASN HD21 1.0 0.0 6.34 2627 2211 A 54 ALA HB% A 32 ASN HD22 1.0 0.0 6.34 2628 2212 A 32 ASN HD21 A 111 GLY H 1.0 0.0 6.34 2629 2212 A 32 ASN HD22 A 111 GLY H 1.0 0.0 6.34 2630 2213 A 32 ASN HD21 A 111 GLY HAx 1.0 0.0 5.37 2631 2213 A 111 GLY HAx A 32 ASN HD22 1.0 0.0 5.37 2632 2214 A 32 ASN HD22 A 132 LEU HBy 1.0 0.0 6.18 2633 2214 A 32 ASN HD21 A 132 LEU HBx 1.0 0.0 6.18 2634 2214 A 32 ASN HD22 A 132 LEU HBx 1.0 0.0 6.18 2635 2214 A 32 ASN HD21 A 132 LEU HBy 1.0 0.0 6.18 2636 2215 A 32 ASN HD22 A 132 LEU HDx% 1.0 0.0 4.81 2637 2215 A 32 ASN HD21 A 132 LEU HDy% 1.0 0.0 4.81 2638 2215 A 32 ASN HD22 A 132 LEU HDy% 1.0 0.0 4.81 2639 2215 A 32 ASN HD21 A 132 LEU HDx% 1.0 0.0 4.81 2640 2216 A 33 VAL H A 33 VAL HGy% 1.0 0.0 4.73 2641 2216 A 33 VAL H A 33 VAL HGx% 1.0 0.0 4.73 2642 2217 A 33 VAL HA A 53 TYR HBy 1.0 0.0 6.34 2643 2217 A 33 VAL HA A 53 TYR HBx 1.0 0.0 6.34 2644 2218 A 33 VAL HB A 114 LEU HDx% 1.0 0.0 5.97 2645 2218 A 33 VAL HB A 114 LEU HDy% 1.0 0.0 5.97 2646 2219 A 34 VAL H A 33 VAL HGy% 1.0 0.0 4.78 2647 2219 A 34 VAL H A 33 VAL HGx% 1.0 0.0 4.78 2648 2220 A 35 ALA H A 33 VAL HGy% 1.0 0.0 6.38 2649 2220 A 35 ALA H A 33 VAL HGx% 1.0 0.0 6.38 2650 2221 A 51 MET HE% A 33 VAL HGy% 1.0 0.0 4.41 2651 2221 A 51 MET HE% A 33 VAL HGx% 1.0 0.0 4.41 2652 2222 A 53 TYR HD% A 33 VAL HGy% 1.0 0.0 5.26 2653 2222 A 53 TYR HD% A 33 VAL HGx% 1.0 0.0 5.26 2654 2223 A 53 TYR HE% A 33 VAL HGy% 1.0 0.0 4.45 2655 2223 A 53 TYR HE% A 33 VAL HGx% 1.0 0.0 4.45 2656 2224 A 90 TRP HZ2 A 33 VAL HGy% 1.0 0.0 5.48 2657 2224 A 90 TRP HZ2 A 33 VAL HGx% 1.0 0.0 5.48 2658 2225 A 90 TRP HH2 A 33 VAL HGy% 1.0 0.0 4.67 2659 2225 A 90 TRP HH2 A 33 VAL HGx% 1.0 0.0 4.67 2660 2226 A 34 VAL H A 53 TYR HBy 1.0 0.0 6.34 2661 2226 A 34 VAL H A 53 TYR HBx 1.0 0.0 6.34 2662 2227 A 34 VAL HA A 107 SER HBx 1.0 0.0 6.34 2663 2227 A 34 VAL HA A 107 SER HBy 1.0 0.0 6.34 2664 2228 A 34 VAL HA A 114 LEU HDx% 1.0 0.0 6.44 2665 2228 A 34 VAL HA A 114 LEU HDy% 1.0 0.0 6.44 2666 2229 A 34 VAL HB A 107 SER HBx 1.0 0.0 5.41 2667 2229 A 34 VAL HB A 107 SER HBy 1.0 0.0 5.41 2668 2230 A 34 VAL HGy% A 55 GLY HAy 1.0 0.0 6.34 2669 2230 A 34 VAL HGy% A 55 GLY HAx 1.0 0.0 6.34 2670 2231 A 35 ALA H A 114 LEU HDx% 1.0 0.0 5.68 2671 2231 A 35 ALA H A 114 LEU HDy% 1.0 0.0 5.68 2672 2232 A 35 ALA HB% A 37 ASN HBx 1.0 0.0 6.34 2673 2232 A 35 ALA HB% A 37 ASN HBy 1.0 0.0 6.34 2674 2233 A 36 ILE H A 105 VAL HGy% 1.0 0.0 4.49 2675 2233 A 36 ILE H A 105 VAL HGx% 1.0 0.0 4.49 2676 2234 A 36 ILE HA A 37 ASN HBx 1.0 0.0 6.34 2677 2234 A 36 ILE HA A 37 ASN HBy 1.0 0.0 6.34 2678 2235 A 36 ILE HB A 105 VAL HGy% 1.0 0.0 6.28 2679 2235 A 36 ILE HB A 105 VAL HGx% 1.0 0.0 6.28 2680 2236 A 36 ILE HG1y A 105 VAL HGy% 1.0 0.0 6.44 2681 2236 A 36 ILE HG1y A 105 VAL HGx% 1.0 0.0 6.44 2682 2237 A 36 ILE HG1x A 105 VAL HGy% 1.0 0.0 5.89 2683 2237 A 36 ILE HG1x A 105 VAL HGx% 1.0 0.0 5.89 2684 2238 A 38 VAL H A 37 ASN HBx 1.0 0.0 5.42 2685 2238 A 38 VAL H A 37 ASN HBy 1.0 0.0 5.42 2686 2239 A 38 VAL HGy% A 37 ASN HBx 1.0 0.0 6.34 2687 2239 A 38 VAL HGy% A 37 ASN HBy 1.0 0.0 6.34 2688 2240 A 49 GLY HAx A 37 ASN HBx 1.0 0.0 6.34 2689 2240 A 49 GLY HAx A 37 ASN HBy 1.0 0.0 6.34 2690 2241 A 50 THR H A 37 ASN HBx 1.0 0.0 5.96 2691 2241 A 50 THR H A 37 ASN HBy 1.0 0.0 5.96 2692 2242 A 37 ASN HD21 A 105 VAL HGy% 1.0 0.0 6.44 2693 2242 A 37 ASN HD21 A 105 VAL HGx% 1.0 0.0 6.44 2694 2243 A 37 ASN HD22 A 105 VAL HGy% 1.0 0.0 6.44 2695 2243 A 37 ASN HD22 A 105 VAL HGx% 1.0 0.0 6.44 2696 2244 A 38 VAL HGx% A 61 PHE HBy 1.0 0.0 5.26 2697 2244 A 38 VAL HGx% A 61 PHE HBx 1.0 0.0 5.26 2698 2245 A 39 GLU HA A 40 SER HBx 1.0 0.0 6.34 2699 2245 A 39 GLU HA A 40 SER HBy 1.0 0.0 6.34 2700 2246 A 39 GLU HA A 47 LEU HDx% 1.0 0.0 6.28 2701 2246 A 39 GLU HA A 47 LEU HDy% 1.0 0.0 6.28 2702 2247 A 39 GLU HB3 A 47 LEU HDx% 1.0 0.0 6.44 2703 2247 A 39 GLU HB2 A 47 LEU HDx% 1.0 0.0 6.44 2704 2247 A 47 LEU HDy% A 39 GLU HB2 1.0 0.0 6.44 2705 2247 A 39 GLU HB3 A 47 LEU HDy% 1.0 0.0 6.44 2706 2248 A 40 SER H A 40 SER HBx 1.0 0.0 4.37 2707 2248 A 40 SER H A 40 SER HBy 1.0 0.0 4.37 2708 2249 A 40 SER H A 47 LEU HDx% 1.0 0.0 5.37 2709 2249 A 40 SER H A 47 LEU HDy% 1.0 0.0 5.37 2710 2250 A 40 SER HA A 47 LEU HDx% 1.0 0.0 4.87 2711 2250 A 40 SER HA A 47 LEU HDy% 1.0 0.0 4.87 2712 2251 A 41 GLY H A 40 SER HBx 1.0 0.0 5.46 2713 2251 A 41 GLY H A 40 SER HBy 1.0 0.0 5.46 2714 2252 A 42 ASP H A 40 SER HBx 1.0 0.0 5.44 2715 2252 A 42 ASP H A 40 SER HBy 1.0 0.0 5.44 2716 2253 A 43 ASP H A 40 SER HBx 1.0 0.0 5.91 2717 2253 A 43 ASP H A 40 SER HBy 1.0 0.0 5.91 2718 2254 A 43 ASP HA A 40 SER HBx 1.0 0.0 6.19 2719 2254 A 43 ASP HA A 40 SER HBy 1.0 0.0 6.19 2720 2255 A 44 GLY H A 40 SER HBx 1.0 0.0 4.92 2721 2255 A 44 GLY H A 40 SER HBy 1.0 0.0 4.92 2722 2256 A 47 LEU HBx A 40 SER HBx 1.0 0.0 6.34 2723 2256 A 47 LEU HBx A 40 SER HBy 1.0 0.0 6.34 2724 2257 A 47 LEU HG A 40 SER HBx 1.0 0.0 5.74 2725 2257 A 47 LEU HG A 40 SER HBy 1.0 0.0 5.74 2726 2258 A 40 SER HBx A 47 LEU HDx% 1.0 0.0 6.28 2727 2258 A 40 SER HBy A 47 LEU HDx% 1.0 0.0 6.28 2728 2258 A 47 LEU HDy% A 40 SER HBx 1.0 0.0 6.28 2729 2258 A 40 SER HBy A 47 LEU HDy% 1.0 0.0 6.28 2730 2259 A 48 ASN H A 40 SER HBx 1.0 0.0 6.34 2731 2259 A 48 ASN H A 40 SER HBy 1.0 0.0 6.34 2732 2260 A 101 VAL HB A 40 SER HBx 1.0 0.0 4.58 2733 2260 A 101 VAL HB A 40 SER HBy 1.0 0.0 4.58 2734 2261 A 41 GLY H A 47 LEU HDx% 1.0 0.0 6.44 2735 2261 A 41 GLY H A 47 LEU HDy% 1.0 0.0 6.44 2736 2262 A 43 ASP H A 41 GLY HAy 1.0 0.0 6.34 2737 2262 A 43 ASP H A 41 GLY HAx 1.0 0.0 6.34 2738 2263 A 48 ASN H A 41 GLY HAy 1.0 0.0 6.34 2739 2263 A 48 ASN H A 41 GLY HAx 1.0 0.0 6.34 2740 2264 A 43 ASP H A 42 ASP HBy 1.0 0.0 5.40 2741 2264 A 43 ASP H A 42 ASP HBx 1.0 0.0 5.40 2742 2265 A 44 GLY H A 42 ASP HBy 1.0 0.0 6.34 2743 2265 A 44 GLY H A 42 ASP HBx 1.0 0.0 6.34 2744 2266 A 45 GLN H A 42 ASP HBy 1.0 0.0 6.03 2745 2266 A 45 GLN H A 42 ASP HBx 1.0 0.0 6.03 2746 2267 A 42 ASP HBx A 45 GLN HBx 1.0 0.0 5.29 2747 2267 A 42 ASP HBy A 45 GLN HBx 1.0 0.0 5.29 2748 2267 A 45 GLN HBy A 42 ASP HBy 1.0 0.0 5.29 2749 2267 A 42 ASP HBx A 45 GLN HBy 1.0 0.0 5.29 2750 2268 A 42 ASP HBx A 45 GLN HGy 1.0 0.0 6.06 2751 2268 A 45 GLN HGx A 42 ASP HBy 1.0 0.0 6.06 2752 2268 A 42 ASP HBx A 45 GLN HGx 1.0 0.0 6.06 2753 2268 A 42 ASP HBy A 45 GLN HGy 1.0 0.0 6.06 2754 2269 A 46 THR H A 42 ASP HBy 1.0 0.0 6.34 2755 2269 A 46 THR H A 42 ASP HBx 1.0 0.0 6.34 2756 2270 A 43 ASP HA A 44 GLY HAy 1.0 0.0 6.34 2757 2270 A 43 ASP HA A 44 GLY HAx 1.0 0.0 6.34 2758 2271 A 101 VAL HGx% A 43 ASP HBy 1.0 0.0 6.34 2759 2271 A 101 VAL HGx% A 43 ASP HBx 1.0 0.0 6.34 2760 2272 A 121 ALA HB% A 43 ASP HBy 1.0 0.0 6.34 2761 2272 A 121 ALA HB% A 43 ASP HBx 1.0 0.0 6.34 2762 2273 A 46 THR H A 44 GLY HAy 1.0 0.0 6.34 2763 2273 A 46 THR H A 44 GLY HAx 1.0 0.0 6.34 2764 2274 A 47 LEU HG A 44 GLY HAy 1.0 0.0 6.34 2765 2274 A 47 LEU HG A 44 GLY HAx 1.0 0.0 6.34 2766 2275 A 44 GLY HAy A 47 LEU HDx% 1.0 0.0 5.29 2767 2275 A 44 GLY HAx A 47 LEU HDx% 1.0 0.0 5.29 2768 2275 A 47 LEU HDy% A 44 GLY HAy 1.0 0.0 5.29 2769 2275 A 47 LEU HDy% A 44 GLY HAx 1.0 0.0 5.29 2770 2276 A 44 GLY HAx A 99 ASN HBx 1.0 0.0 4.80 2771 2276 A 44 GLY HAy A 99 ASN HBx 1.0 0.0 4.80 2772 2276 A 99 ASN HBy A 44 GLY HAy 1.0 0.0 4.80 2773 2276 A 44 GLY HAx A 99 ASN HBy 1.0 0.0 4.80 2774 2277 A 99 ASN HD21 A 44 GLY HAy 1.0 0.0 5.84 2775 2277 A 99 ASN HD21 A 44 GLY HAx 1.0 0.0 5.84 2776 2278 A 99 ASN HD22 A 44 GLY HAy 1.0 0.0 6.34 2777 2278 A 99 ASN HD22 A 44 GLY HAx 1.0 0.0 6.34 2778 2279 A 101 VAL HB A 44 GLY HAy 1.0 0.0 6.34 2779 2279 A 101 VAL HB A 44 GLY HAx 1.0 0.0 6.34 2780 2280 A 121 ALA HB% A 44 GLY HAy 1.0 0.0 5.52 2781 2280 A 121 ALA HB% A 44 GLY HAx 1.0 0.0 5.52 2782 2281 A 45 GLN H A 45 GLN HBx 1.0 0.0 4.26 2783 2281 A 45 GLN H A 45 GLN HBy 1.0 0.0 4.26 2784 2282 A 45 GLN HA A 65 LEU HBy 1.0 0.0 4.56 2785 2282 A 45 GLN HA A 65 LEU HBx 1.0 0.0 4.56 2786 2283 A 45 GLN HA A 65 LEU HDx% 1.0 0.0 4.56 2787 2283 A 45 GLN HA A 65 LEU HDy% 1.0 0.0 4.56 2788 2284 A 46 THR H A 45 GLN HBx 1.0 0.0 5.13 2789 2284 A 46 THR H A 45 GLN HBy 1.0 0.0 5.13 2790 2285 A 46 THR HA A 45 GLN HBx 1.0 0.0 6.34 2791 2285 A 46 THR HA A 45 GLN HBy 1.0 0.0 6.34 2792 2286 A 46 THR HG2% A 45 GLN HBx 1.0 0.0 5.63 2793 2286 A 46 THR HG2% A 45 GLN HBy 1.0 0.0 5.63 2794 2287 A 45 GLN HBx A 65 LEU HDx% 1.0 0.0 6.28 2795 2287 A 65 LEU HDy% A 45 GLN HBx 1.0 0.0 6.28 2796 2287 A 45 GLN HBy A 65 LEU HDy% 1.0 0.0 6.28 2797 2287 A 45 GLN HBy A 65 LEU HDx% 1.0 0.0 6.28 2798 2288 A 45 GLN HGy A 65 LEU HDx% 1.0 0.0 6.28 2799 2288 A 45 GLN HGx A 65 LEU HDx% 1.0 0.0 6.28 2800 2288 A 65 LEU HDy% A 45 GLN HGy 1.0 0.0 6.28 2801 2288 A 45 GLN HGx A 65 LEU HDy% 1.0 0.0 6.28 2802 2289 A 64 THR HG2% A 45 GLN HE22 1.0 0.0 5.92 2803 2289 A 64 THR HG2% A 45 GLN HE21 1.0 0.0 5.92 2804 2290 A 45 GLN HE21 A 65 LEU HBx 1.0 0.0 5.76 2805 2290 A 45 GLN HE21 A 65 LEU HBy 1.0 0.0 5.76 2806 2290 A 45 GLN HE22 A 65 LEU HBx 1.0 0.0 5.76 2807 2290 A 45 GLN HE22 A 65 LEU HBy 1.0 0.0 5.76 2808 2291 A 45 GLN HE21 A 65 LEU HDx% 1.0 0.0 5.66 2809 2291 A 45 GLN HE22 A 65 LEU HDy% 1.0 0.0 5.66 2810 2291 A 45 GLN HE22 A 65 LEU HDx% 1.0 0.0 5.66 2811 2291 A 45 GLN HE21 A 65 LEU HDy% 1.0 0.0 5.66 2812 2292 A 46 THR H A 47 LEU HDx% 1.0 0.0 6.44 2813 2292 A 46 THR H A 47 LEU HDy% 1.0 0.0 6.44 2814 2293 A 46 THR HA A 47 LEU HDx% 1.0 0.0 6.44 2815 2293 A 46 THR HA A 47 LEU HDy% 1.0 0.0 6.44 2816 2294 A 46 THR HB A 48 ASN HD21 1.0 0.0 5.68 2817 2294 A 46 THR HB A 48 ASN HD22 1.0 0.0 5.68 2818 2295 A 46 THR HG2% A 48 ASN HD21 1.0 0.0 5.61 2819 2295 A 46 THR HG2% A 48 ASN HD22 1.0 0.0 5.61 2820 2296 A 47 LEU H A 47 LEU HDx% 1.0 0.0 5.45 2821 2296 A 47 LEU H A 47 LEU HDy% 1.0 0.0 5.45 2822 2297 A 48 ASN H A 47 LEU HDx% 1.0 0.0 5.48 2823 2297 A 48 ASN H A 47 LEU HDy% 1.0 0.0 5.48 2824 2298 A 61 PHE HE% A 47 LEU HDx% 1.0 0.0 5.65 2825 2298 A 61 PHE HE% A 47 LEU HDy% 1.0 0.0 5.65 2826 2299 A 61 PHE HZ A 47 LEU HDx% 1.0 0.0 6.44 2827 2299 A 61 PHE HZ A 47 LEU HDy% 1.0 0.0 6.44 2828 2300 A 63 ALA H A 47 LEU HDx% 1.0 0.0 6.44 2829 2300 A 63 ALA H A 47 LEU HDy% 1.0 0.0 6.44 2830 2301 A 63 ALA HB% A 47 LEU HDx% 1.0 0.0 4.99 2831 2301 A 63 ALA HB% A 47 LEU HDy% 1.0 0.0 4.99 2832 2302 A 100 VAL H A 47 LEU HDx% 1.0 0.0 6.44 2833 2302 A 100 VAL H A 47 LEU HDy% 1.0 0.0 6.44 2834 2303 A 100 VAL HB A 47 LEU HDx% 1.0 0.0 5.66 2835 2303 A 100 VAL HB A 47 LEU HDy% 1.0 0.0 5.66 2836 2304 A 47 LEU HDy% A 100 VAL HGy% 1.0 0.0 5.32 2837 2304 A 47 LEU HDx% A 100 VAL HGy% 1.0 0.0 5.32 2838 2304 A 100 VAL HGx% A 47 LEU HDx% 1.0 0.0 5.32 2839 2304 A 100 VAL HGx% A 47 LEU HDy% 1.0 0.0 5.32 2840 2305 A 101 VAL HA A 47 LEU HDx% 1.0 0.0 6.44 2841 2305 A 101 VAL HA A 47 LEU HDy% 1.0 0.0 6.44 2842 2306 A 101 VAL HB A 47 LEU HDx% 1.0 0.0 5.97 2843 2306 A 101 VAL HB A 47 LEU HDy% 1.0 0.0 5.97 2844 2307 A 48 ASN H A 48 ASN HBx 1.0 0.0 4.58 2845 2307 A 48 ASN H A 48 ASN HBy 1.0 0.0 4.58 2846 2308 A 48 ASN H A 48 ASN HD22 1.0 0.0 5.46 2847 2308 A 48 ASN H A 48 ASN HD21 1.0 0.0 5.46 2848 2309 A 48 ASN HD21 A 48 ASN HBx 1.0 0.0 4.19 2849 2309 A 48 ASN HD22 A 48 ASN HBx 1.0 0.0 4.19 2850 2309 A 48 ASN HD21 A 48 ASN HBy 1.0 0.0 4.19 2851 2309 A 48 ASN HD22 A 48 ASN HBy 1.0 0.0 4.19 2852 2310 A 49 GLY H A 48 ASN HBx 1.0 0.0 5.04 2853 2310 A 49 GLY H A 48 ASN HBy 1.0 0.0 5.04 2854 2311 A 61 PHE HD% A 48 ASN HBx 1.0 0.0 6.34 2855 2311 A 61 PHE HD% A 48 ASN HBy 1.0 0.0 6.34 2856 2312 A 62 ARG HA A 48 ASN HBx 1.0 0.0 6.34 2857 2312 A 62 ARG HA A 48 ASN HBy 1.0 0.0 6.34 2858 2313 A 84 TRP HH2 A 48 ASN HBx 1.0 0.0 6.34 2859 2313 A 84 TRP HH2 A 48 ASN HBy 1.0 0.0 6.34 2860 2314 A 49 GLY H A 61 PHE HBy 1.0 0.0 5.21 2861 2314 A 49 GLY H A 61 PHE HBx 1.0 0.0 5.21 2862 2315 A 49 GLY HAx A 61 PHE HBy 1.0 0.0 6.34 2863 2315 A 49 GLY HAx A 61 PHE HBx 1.0 0.0 6.34 2864 2316 A 50 THR H A 61 PHE HBy 1.0 0.0 6.33 2865 2316 A 50 THR H A 61 PHE HBx 1.0 0.0 6.33 2866 2317 A 50 THR HA A 59 ILE HG1x 1.0 0.0 6.34 2867 2317 A 50 THR HA A 59 ILE HG1y 1.0 0.0 6.34 2868 2318 A 50 THR HA A 60 GLY HAy 1.0 0.0 5.86 2869 2318 A 50 THR HA A 60 GLY HAx 1.0 0.0 5.86 2870 2319 A 50 THR HA A 61 PHE HBy 1.0 0.0 5.21 2871 2319 A 50 THR HA A 61 PHE HBx 1.0 0.0 5.21 2872 2320 A 50 THR HB A 58 PRO HGx 1.0 0.0 6.11 2873 2320 A 50 THR HB A 58 PRO HGy 1.0 0.0 6.11 2874 2321 A 50 THR HG2% A 58 PRO HBx 1.0 0.0 5.21 2875 2321 A 50 THR HG2% A 58 PRO HBy 1.0 0.0 5.21 2876 2322 A 50 THR HG2% A 60 GLY HAy 1.0 0.0 5.61 2877 2322 A 50 THR HG2% A 60 GLY HAx 1.0 0.0 5.61 2878 2323 A 51 MET H A 59 ILE HG1x 1.0 0.0 6.34 2879 2323 A 51 MET H A 59 ILE HG1y 1.0 0.0 6.34 2880 2324 A 51 MET H A 61 PHE HBy 1.0 0.0 5.30 2881 2324 A 51 MET H A 61 PHE HBx 1.0 0.0 5.30 2882 2325 A 51 MET HB2 A 61 PHE HBy 1.0 0.0 6.34 2883 2325 A 51 MET HB3 A 61 PHE HBy 1.0 0.0 6.34 2884 2325 A 61 PHE HBx A 51 MET HB2 1.0 0.0 6.34 2885 2325 A 51 MET HB3 A 61 PHE HBx 1.0 0.0 6.34 2886 2326 A 75 ASN HD21 A 51 MET HGx 1.0 0.0 6.34 2887 2326 A 75 ASN HD22 A 51 MET HGx 1.0 0.0 6.34 2888 2327 A 52 THR HA A 58 PRO HBx 1.0 0.0 5.96 2889 2327 A 58 PRO HBy A 52 THR HA 1.0 0.0 5.96 2890 2328 A 52 THR HG2% A 57 GLY HAy 1.0 0.0 5.57 2891 2328 A 52 THR HG2% A 57 GLY HAx 1.0 0.0 5.57 2892 2329 A 52 THR HG2% A 58 PRO HBx 1.0 0.0 6.34 2893 2329 A 52 THR HG2% A 58 PRO HBy 1.0 0.0 6.34 2894 2330 A 54 ALA H A 53 TYR HBy 1.0 0.0 4.83 2895 2330 A 54 ALA H A 53 TYR HBx 1.0 0.0 4.83 2896 2331 A 54 ALA HA A 53 TYR HBy 1.0 0.0 6.34 2897 2331 A 54 ALA HA A 53 TYR HBx 1.0 0.0 6.34 2898 2332 A 53 TYR HBy A 56 GLU HGx 1.0 0.0 6.18 2899 2332 A 53 TYR HBx A 56 GLU HGx 1.0 0.0 6.18 2900 2332 A 56 GLU HGy A 53 TYR HBy 1.0 0.0 6.18 2901 2332 A 53 TYR HBx A 56 GLU HGy 1.0 0.0 6.18 2902 2333 A 53 TYR HD% A 56 GLU HGx 1.0 0.0 6.34 2903 2333 A 53 TYR HD% A 56 GLU HGy 1.0 0.0 6.34 2904 2334 A 53 TYR HD% A 59 ILE HG1x 1.0 0.0 6.34 2905 2334 A 53 TYR HD% A 59 ILE HG1y 1.0 0.0 6.34 2906 2335 A 53 TYR HE% A 75 ASN HD21 1.0 0.0 6.34 2907 2335 A 53 TYR HE% A 75 ASN HD22 1.0 0.0 6.34 2908 2336 A 54 ALA HA A 55 GLY HAy 1.0 0.0 6.34 2909 2336 A 54 ALA HA A 55 GLY HAx 1.0 0.0 6.34 2910 2337 A 54 ALA HB% A 55 GLY HAy 1.0 0.0 6.34 2911 2337 A 54 ALA HB% A 55 GLY HAx 1.0 0.0 6.34 2912 2338 A 54 ALA HB% A 110 ASP HBy 1.0 0.0 5.69 2913 2338 A 54 ALA HB% A 110 ASP HBx 1.0 0.0 5.69 2914 2339 A 55 GLY HAy A 56 GLU HGx 1.0 0.0 5.53 2915 2339 A 55 GLY HAx A 56 GLU HGx 1.0 0.0 5.53 2916 2339 A 56 GLU HGy A 55 GLY HAy 1.0 0.0 5.53 2917 2339 A 55 GLY HAx A 56 GLU HGy 1.0 0.0 5.53 2918 2340 A 56 GLU H A 56 GLU HGx 1.0 0.0 4.69 2919 2340 A 56 GLU H A 56 GLU HGy 1.0 0.0 4.69 2920 2341 A 56 GLU HB2 A 57 GLY HAy 1.0 0.0 6.34 2921 2341 A 56 GLU HB3 A 57 GLY HAy 1.0 0.0 6.34 2922 2341 A 57 GLY HAx A 56 GLU HB2 1.0 0.0 6.34 2923 2341 A 56 GLU HB3 A 57 GLY HAx 1.0 0.0 6.34 2924 2342 A 57 GLY H A 56 GLU HGx 1.0 0.0 6.34 2925 2342 A 57 GLY H A 56 GLU HGy 1.0 0.0 6.34 2926 2343 A 57 GLY HAy A 58 PRO HGx 1.0 0.0 5.49 2927 2343 A 57 GLY HAx A 58 PRO HGx 1.0 0.0 5.49 2928 2343 A 58 PRO HGy A 57 GLY HAy 1.0 0.0 5.49 2929 2343 A 58 PRO HGy A 57 GLY HAx 1.0 0.0 5.49 2930 2344 A 57 GLY HAx A 58 PRO HD2 1.0 0.0 4.33 2931 2344 A 57 GLY HAy A 58 PRO HD2 1.0 0.0 4.33 2932 2344 A 58 PRO HD3 A 57 GLY HAy 1.0 0.0 4.33 2933 2344 A 58 PRO HD3 A 57 GLY HAx 1.0 0.0 4.33 2934 2345 A 59 ILE HA A 77 TRP HBx 1.0 0.0 6.34 2935 2345 A 59 ILE HA A 77 TRP HBy 1.0 0.0 6.34 2936 2346 A 59 ILE HG1y A 75 ASN HBx 1.0 0.0 5.76 2937 2346 A 59 ILE HG1x A 75 ASN HBx 1.0 0.0 5.76 2938 2346 A 75 ASN HBy A 59 ILE HG1x 1.0 0.0 5.76 2939 2346 A 59 ILE HG1y A 75 ASN HBy 1.0 0.0 5.76 2940 2347 A 59 ILE HD1% A 75 ASN HBx 1.0 0.0 4.87 2941 2347 A 59 ILE HD1% A 75 ASN HBy 1.0 0.0 4.87 2942 2348 A 75 ASN HD21 A 59 ILE HD1% 1.0 0.0 6.34 2943 2348 A 75 ASN HD22 A 59 ILE HD1% 1.0 0.0 6.34 2944 2349 A 60 GLY HAy A 61 PHE HBy 1.0 0.0 6.18 2945 2349 A 60 GLY HAx A 61 PHE HBy 1.0 0.0 6.18 2946 2349 A 61 PHE HBx A 60 GLY HAy 1.0 0.0 6.18 2947 2349 A 61 PHE HBx A 60 GLY HAx 1.0 0.0 6.18 2948 2350 A 75 ASN HA A 60 GLY HAy 1.0 0.0 6.34 2949 2350 A 75 ASN HA A 60 GLY HAx 1.0 0.0 6.34 2950 2351 A 76 GLN H A 60 GLY HAy 1.0 0.0 5.63 2951 2351 A 76 GLN H A 60 GLY HAx 1.0 0.0 5.63 2952 2352 A 76 GLN HBy A 60 GLY HAy 1.0 0.0 6.34 2953 2352 A 76 GLN HBy A 60 GLY HAx 1.0 0.0 6.34 2954 2353 A 76 GLN HBx A 60 GLY HAy 1.0 0.0 5.53 2955 2353 A 76 GLN HBx A 60 GLY HAx 1.0 0.0 5.53 2956 2354 A 84 TRP HZ2 A 60 GLY HAy 1.0 0.0 6.34 2957 2354 A 84 TRP HZ2 A 60 GLY HAx 1.0 0.0 6.34 2958 2355 A 61 PHE H A 61 PHE HBy 1.0 0.0 4.65 2959 2355 A 61 PHE H A 61 PHE HBx 1.0 0.0 4.65 2960 2356 A 61 PHE HA A 75 ASN HD21 1.0 0.0 5.63 2961 2356 A 61 PHE HA A 75 ASN HD22 1.0 0.0 5.63 2962 2357 A 73 VAL HGx% A 61 PHE HBy 1.0 0.0 6.34 2963 2357 A 73 VAL HGx% A 61 PHE HBx 1.0 0.0 6.34 2964 2358 A 75 ASN HA A 61 PHE HBy 1.0 0.0 6.34 2965 2358 A 75 ASN HA A 61 PHE HBx 1.0 0.0 6.34 2966 2359 A 75 ASN HD21 A 61 PHE HBx 1.0 0.0 6.18 2967 2359 A 75 ASN HD22 A 61 PHE HBx 1.0 0.0 6.18 2968 2359 A 75 ASN HD21 A 61 PHE HBy 1.0 0.0 6.18 2969 2359 A 75 ASN HD22 A 61 PHE HBy 1.0 0.0 6.18 2970 2360 A 61 PHE HD% A 75 ASN HBx 1.0 0.0 6.34 2971 2360 A 61 PHE HD% A 75 ASN HBy 1.0 0.0 6.34 2972 2361 A 61 PHE HD% A 75 ASN HD21 1.0 0.0 5.55 2973 2361 A 61 PHE HD% A 75 ASN HD22 1.0 0.0 5.55 2974 2362 A 61 PHE HE% A 92 LEU HDx% 1.0 0.0 5.95 2975 2362 A 61 PHE HE% A 92 LEU HDy% 1.0 0.0 5.95 2976 2363 A 61 PHE HZ A 92 LEU HDx% 1.0 0.0 5.23 2977 2363 A 61 PHE HZ A 92 LEU HDy% 1.0 0.0 5.23 2978 2364 A 62 ARG H A 75 ASN HD21 1.0 0.0 6.34 2979 2364 A 62 ARG H A 75 ASN HD22 1.0 0.0 6.34 2980 2365 A 65 LEU H A 65 LEU HDx% 1.0 0.0 5.22 2981 2365 A 65 LEU H A 65 LEU HDy% 1.0 0.0 5.22 2982 2366 A 65 LEU HA A 65 LEU HDx% 1.0 0.0 4.45 2983 2366 A 65 LEU HA A 65 LEU HDy% 1.0 0.0 4.45 2984 2367 A 67 GLY HAy A 65 LEU HBy 1.0 0.0 6.34 2985 2367 A 67 GLY HAy A 65 LEU HBx 1.0 0.0 6.34 2986 2368 A 99 ASN HD21 A 65 LEU HBy 1.0 0.0 6.34 2987 2368 A 99 ASN HD21 A 65 LEU HBx 1.0 0.0 6.34 2988 2369 A 99 ASN HD22 A 65 LEU HBy 1.0 0.0 6.34 2989 2369 A 99 ASN HD22 A 65 LEU HBx 1.0 0.0 6.34 2990 2370 A 66 LEU H A 65 LEU HDx% 1.0 0.0 4.77 2991 2370 A 66 LEU H A 65 LEU HDy% 1.0 0.0 4.77 2992 2371 A 66 LEU HA A 65 LEU HDx% 1.0 0.0 6.44 2993 2371 A 66 LEU HA A 65 LEU HDy% 1.0 0.0 6.44 2994 2372 A 67 GLY H A 65 LEU HDx% 1.0 0.0 4.36 2995 2372 A 67 GLY H A 65 LEU HDy% 1.0 0.0 4.36 2996 2373 A 67 GLY HAx A 65 LEU HDx% 1.0 0.0 5.73 2997 2373 A 67 GLY HAx A 65 LEU HDy% 1.0 0.0 5.73 2998 2374 A 68 ASN H A 65 LEU HDx% 1.0 0.0 5.48 2999 2374 A 68 ASN H A 65 LEU HDy% 1.0 0.0 5.48 3000 2375 A 68 ASN HA A 65 LEU HDx% 1.0 0.0 6.44 3001 2375 A 68 ASN HA A 65 LEU HDy% 1.0 0.0 6.44 3002 2376 A 69 ASN H A 65 LEU HDx% 1.0 0.0 5.71 3003 2376 A 69 ASN H A 65 LEU HDy% 1.0 0.0 5.71 3004 2377 A 69 ASN HA A 65 LEU HDx% 1.0 0.0 4.93 3005 2377 A 69 ASN HA A 65 LEU HDy% 1.0 0.0 4.93 3006 2378 A 65 LEU HDy% A 69 ASN HBx 1.0 0.0 6.28 3007 2378 A 65 LEU HDx% A 69 ASN HBx 1.0 0.0 6.28 3008 2378 A 69 ASN HBy A 65 LEU HDx% 1.0 0.0 6.28 3009 2378 A 65 LEU HDy% A 69 ASN HBy 1.0 0.0 6.28 3010 2379 A 70 SER H A 65 LEU HDx% 1.0 0.0 5.32 3011 2379 A 70 SER H A 65 LEU HDy% 1.0 0.0 5.32 3012 2380 A 70 SER HA A 65 LEU HDx% 1.0 0.0 6.44 3013 2380 A 70 SER HA A 65 LEU HDy% 1.0 0.0 6.44 3014 2381 A 71 TYR HA A 65 LEU HDx% 1.0 0.0 6.02 3015 2381 A 71 TYR HA A 65 LEU HDy% 1.0 0.0 6.02 3016 2382 A 65 LEU HDx% A 71 TYR HB2 1.0 0.0 6.44 3017 2382 A 65 LEU HDy% A 71 TYR HB2 1.0 0.0 6.44 3018 2382 A 71 TYR HB3 A 65 LEU HDx% 1.0 0.0 6.44 3019 2382 A 71 TYR HB3 A 65 LEU HDy% 1.0 0.0 6.44 3020 2383 A 65 LEU HDy% A 99 ASN HBx 1.0 0.0 5.30 3021 2383 A 99 ASN HBy A 65 LEU HDx% 1.0 0.0 5.30 3022 2383 A 99 ASN HBy A 65 LEU HDy% 1.0 0.0 5.30 3023 2383 A 65 LEU HDx% A 99 ASN HBx 1.0 0.0 5.30 3024 2384 A 99 ASN HD21 A 65 LEU HDx% 1.0 0.0 5.52 3025 2384 A 99 ASN HD21 A 65 LEU HDy% 1.0 0.0 5.52 3026 2385 A 99 ASN HD22 A 65 LEU HDx% 1.0 0.0 5.07 3027 2385 A 99 ASN HD22 A 65 LEU HDy% 1.0 0.0 5.07 3028 2386 A 66 LEU H A 66 LEU HBy 1.0 0.0 4.33 3029 2386 A 66 LEU H A 66 LEU HBx 1.0 0.0 4.33 3030 2387 A 66 LEU H A 66 LEU HDx% 1.0 0.0 5.11 3031 2387 A 66 LEU H A 66 LEU HDy% 1.0 0.0 5.11 3032 2388 A 66 LEU H A 70 SER HBy 1.0 0.0 6.34 3033 2388 A 66 LEU H A 70 SER HBx 1.0 0.0 6.34 3034 2389 A 66 LEU HA A 66 LEU HDx% 1.0 0.0 4.37 3035 2389 A 66 LEU HA A 66 LEU HDy% 1.0 0.0 4.37 3036 2390 A 67 GLY H A 66 LEU HBy 1.0 0.0 4.73 3037 2390 A 67 GLY H A 66 LEU HBx 1.0 0.0 4.73 3038 2391 A 70 SER H A 66 LEU HBy 1.0 0.0 6.34 3039 2391 A 70 SER H A 66 LEU HBx 1.0 0.0 6.34 3040 2392 A 66 LEU HBx A 70 SER HBy 1.0 0.0 5.43 3041 2392 A 66 LEU HBy A 70 SER HBy 1.0 0.0 5.43 3042 2392 A 70 SER HBx A 66 LEU HBy 1.0 0.0 5.43 3043 2392 A 66 LEU HBx A 70 SER HBx 1.0 0.0 5.43 3044 2393 A 71 TYR HA A 66 LEU HBy 1.0 0.0 6.34 3045 2393 A 71 TYR HA A 66 LEU HBx 1.0 0.0 6.34 3046 2394 A 66 LEU HBy A 72 GLU HB2 1.0 0.0 6.34 3047 2394 A 66 LEU HBx A 72 GLU HB2 1.0 0.0 6.34 3048 2394 A 72 GLU HB3 A 66 LEU HBy 1.0 0.0 6.34 3049 2394 A 72 GLU HB3 A 66 LEU HBx 1.0 0.0 6.34 3050 2395 A 89 ASN HD21 A 66 LEU HBx 1.0 0.0 5.76 3051 2395 A 89 ASN HD22 A 66 LEU HBx 1.0 0.0 5.76 3052 2395 A 89 ASN HD21 A 66 LEU HBy 1.0 0.0 5.76 3053 2395 A 89 ASN HD22 A 66 LEU HBy 1.0 0.0 5.76 3054 2396 A 67 GLY HAx A 66 LEU HDx% 1.0 0.0 6.44 3055 2396 A 67 GLY HAx A 66 LEU HDy% 1.0 0.0 6.44 3056 2397 A 66 LEU HDx% A 70 SER HBy 1.0 0.0 5.26 3057 2397 A 66 LEU HDy% A 70 SER HBy 1.0 0.0 5.26 3058 2397 A 70 SER HBx A 66 LEU HDx% 1.0 0.0 5.26 3059 2397 A 66 LEU HDy% A 70 SER HBx 1.0 0.0 5.26 3060 2398 A 71 TYR HA A 66 LEU HDx% 1.0 0.0 5.96 3061 2398 A 71 TYR HA A 66 LEU HDy% 1.0 0.0 5.96 3062 2399 A 72 GLU H A 66 LEU HDx% 1.0 0.0 5.40 3063 2399 A 72 GLU H A 66 LEU HDy% 1.0 0.0 5.40 3064 2400 A 72 GLU HA A 66 LEU HDx% 1.0 0.0 5.80 3065 2400 A 72 GLU HA A 66 LEU HDy% 1.0 0.0 5.80 3066 2401 A 66 LEU HDy% A 72 GLU HB2 1.0 0.0 4.75 3067 2401 A 66 LEU HDx% A 72 GLU HB2 1.0 0.0 4.75 3068 2401 A 72 GLU HB3 A 66 LEU HDx% 1.0 0.0 4.75 3069 2401 A 72 GLU HB3 A 66 LEU HDy% 1.0 0.0 4.75 3070 2402 A 66 LEU HDy% A 72 GLU HG2 1.0 0.0 5.92 3071 2402 A 66 LEU HDx% A 72 GLU HG2 1.0 0.0 5.92 3072 2402 A 72 GLU HG3 A 66 LEU HDx% 1.0 0.0 5.92 3073 2402 A 72 GLU HG3 A 66 LEU HDy% 1.0 0.0 5.92 3074 2403 A 89 ASN HA A 66 LEU HDx% 1.0 0.0 6.44 3075 2403 A 89 ASN HA A 66 LEU HDy% 1.0 0.0 6.44 3076 2404 A 89 ASN HBx A 66 LEU HDx% 1.0 0.0 6.44 3077 2404 A 89 ASN HBx A 66 LEU HDy% 1.0 0.0 6.44 3078 2405 A 89 ASN HD21 A 66 LEU HDx% 1.0 0.0 4.72 3079 2405 A 89 ASN HD21 A 66 LEU HDy% 1.0 0.0 4.72 3080 2405 A 89 ASN HD22 A 66 LEU HDx% 1.0 0.0 4.72 3081 2405 A 89 ASN HD22 A 66 LEU HDy% 1.0 0.0 4.72 3082 2406 A 67 GLY H A 68 ASN HD21 1.0 0.0 6.19 3083 2406 A 67 GLY H A 68 ASN HD22 1.0 0.0 6.19 3084 2407 A 67 GLY H A 70 SER HBy 1.0 0.0 6.34 3085 2407 A 67 GLY H A 70 SER HBx 1.0 0.0 6.34 3086 2408 A 67 GLY HAy A 68 ASN HBx 1.0 0.0 6.34 3087 2408 A 67 GLY HAy A 68 ASN HBy 1.0 0.0 6.34 3088 2409 A 68 ASN HA A 68 ASN HD21 1.0 0.0 5.74 3089 2409 A 68 ASN HA A 68 ASN HD22 1.0 0.0 5.74 3090 2410 A 70 SER H A 68 ASN HBx 1.0 0.0 6.34 3091 2410 A 70 SER H A 68 ASN HBy 1.0 0.0 6.34 3092 2411 A 69 ASN HA A 100 VAL HGy% 1.0 0.0 6.44 3093 2411 A 69 ASN HA A 100 VAL HGx% 1.0 0.0 6.44 3094 2412 A 69 ASN HD21 A 69 ASN HBy 1.0 0.0 4.21 3095 2412 A 69 ASN HD22 A 69 ASN HBy 1.0 0.0 4.21 3096 2412 A 69 ASN HD21 A 69 ASN HBx 1.0 0.0 4.21 3097 2412 A 69 ASN HD22 A 69 ASN HBx 1.0 0.0 4.21 3098 2413 A 91 ILE HB A 69 ASN HBx 1.0 0.0 6.34 3099 2413 A 91 ILE HB A 69 ASN HBy 1.0 0.0 6.34 3100 2414 A 69 ASN HBy A 91 ILE HG1x 1.0 0.0 6.18 3101 2414 A 91 ILE HG1y A 69 ASN HBx 1.0 0.0 6.18 3102 2414 A 91 ILE HG1y A 69 ASN HBy 1.0 0.0 6.18 3103 2414 A 69 ASN HBx A 91 ILE HG1x 1.0 0.0 6.18 3104 2415 A 92 LEU H A 69 ASN HBx 1.0 0.0 5.36 3105 2415 A 92 LEU H A 69 ASN HBy 1.0 0.0 5.36 3106 2416 A 95 ARG H A 69 ASN HD21 1.0 0.0 5.36 3107 2416 A 95 ARG H A 69 ASN HD22 1.0 0.0 5.36 3108 2417 A 95 ARG HB3 A 69 ASN HD21 1.0 0.0 6.34 3109 2417 A 69 ASN HD22 A 95 ARG HB2 1.0 0.0 6.34 3110 2417 A 69 ASN HD22 A 95 ARG HB3 1.0 0.0 6.34 3111 2417 A 69 ASN HD21 A 95 ARG HB2 1.0 0.0 6.34 3112 2418 A 96 GLU HA A 69 ASN HD21 1.0 0.0 6.34 3113 2418 A 69 ASN HD22 A 96 GLU HA 1.0 0.0 6.34 3114 2419 A 70 SER H A 70 SER HBy 1.0 0.0 4.28 3115 2419 A 70 SER H A 70 SER HBx 1.0 0.0 4.28 3116 2420 A 70 SER HA A 89 ASN HD21 1.0 0.0 6.34 3117 2420 A 70 SER HA A 89 ASN HD22 1.0 0.0 6.34 3118 2421 A 89 ASN HD22 A 70 SER HBy 1.0 0.0 5.76 3119 2421 A 89 ASN HD21 A 70 SER HBy 1.0 0.0 5.76 3120 2421 A 89 ASN HD22 A 70 SER HBx 1.0 0.0 5.76 3121 2421 A 89 ASN HD21 A 70 SER HBx 1.0 0.0 5.76 3122 2422 A 70 SER HBx A 91 ILE HG1x 1.0 0.0 6.18 3123 2422 A 70 SER HBy A 91 ILE HG1x 1.0 0.0 6.18 3124 2422 A 91 ILE HG1y A 70 SER HBy 1.0 0.0 6.18 3125 2422 A 91 ILE HG1y A 70 SER HBx 1.0 0.0 6.18 3126 2423 A 71 TYR H A 92 LEU HDx% 1.0 0.0 6.44 3127 2423 A 71 TYR H A 92 LEU HDy% 1.0 0.0 6.44 3128 2424 A 71 TYR HB2 A 90 TRP HBx 1.0 0.0 6.34 3129 2424 A 71 TYR HB3 A 90 TRP HBx 1.0 0.0 6.34 3130 2424 A 90 TRP HBy A 71 TYR HB2 1.0 0.0 6.34 3131 2424 A 71 TYR HB3 A 90 TRP HBy 1.0 0.0 6.34 3132 2425 A 71 TYR HB2 A 92 LEU HDx% 1.0 0.0 5.88 3133 2425 A 71 TYR HB3 A 92 LEU HDx% 1.0 0.0 5.88 3134 2425 A 92 LEU HDy% A 71 TYR HB2 1.0 0.0 5.88 3135 2425 A 71 TYR HB3 A 92 LEU HDy% 1.0 0.0 5.88 3136 2426 A 72 GLU H A 89 ASN HD21 1.0 0.0 6.34 3137 2426 A 72 GLU H A 89 ASN HD22 1.0 0.0 6.34 3138 2427 A 72 GLU HA A 89 ASN HD21 1.0 0.0 5.64 3139 2427 A 72 GLU HA A 89 ASN HD22 1.0 0.0 5.64 3140 2428 A 72 GLU HG3 A 86 SER HBx 1.0 0.0 6.34 3141 2428 A 72 GLU HG2 A 86 SER HBx 1.0 0.0 6.34 3142 2428 A 86 SER HBy A 72 GLU HG2 1.0 0.0 6.34 3143 2428 A 72 GLU HG3 A 86 SER HBy 1.0 0.0 6.34 3144 2429 A 73 VAL HGx% A 75 ASN HD21 1.0 0.0 5.60 3145 2429 A 73 VAL HGx% A 75 ASN HD22 1.0 0.0 5.60 3146 2430 A 73 VAL HGy% A 92 LEU HDx% 1.0 0.0 5.75 3147 2430 A 73 VAL HGy% A 92 LEU HDy% 1.0 0.0 5.75 3148 2431 A 74 GLU HA A 86 SER HBx 1.0 0.0 5.68 3149 2431 A 74 GLU HA A 86 SER HBy 1.0 0.0 5.68 3150 2432 A 74 GLU HB2 A 86 SER HBx 1.0 0.0 6.34 3151 2432 A 74 GLU HB3 A 86 SER HBx 1.0 0.0 6.34 3152 2432 A 86 SER HBy A 74 GLU HB2 1.0 0.0 6.34 3153 2432 A 74 GLU HB3 A 86 SER HBy 1.0 0.0 6.34 3154 2433 A 75 ASN H A 75 ASN HBx 1.0 0.0 4.66 3155 2433 A 75 ASN H A 75 ASN HBy 1.0 0.0 4.66 3156 2434 A 76 GLN H A 75 ASN HBx 1.0 0.0 5.32 3157 2434 A 76 GLN H A 75 ASN HBy 1.0 0.0 5.32 3158 2435 A 77 TRP HE3 A 75 ASN HBx 1.0 0.0 5.32 3159 2435 A 77 TRP HE3 A 75 ASN HBy 1.0 0.0 5.32 3160 2436 A 77 TRP HZ3 A 75 ASN HBx 1.0 0.0 4.67 3161 2436 A 77 TRP HZ3 A 75 ASN HBy 1.0 0.0 4.67 3162 2437 A 77 TRP HH2 A 75 ASN HBx 1.0 0.0 6.34 3163 2437 A 77 TRP HH2 A 75 ASN HBy 1.0 0.0 6.34 3164 2438 A 84 TRP HZ3 A 75 ASN HBx 1.0 0.0 6.34 3165 2438 A 84 TRP HZ3 A 75 ASN HBy 1.0 0.0 6.34 3166 2439 A 85 HIS H A 75 ASN HBx 1.0 0.0 6.34 3167 2439 A 85 HIS H A 75 ASN HBy 1.0 0.0 6.34 3168 2440 A 76 GLN H A 75 ASN HD21 1.0 0.0 5.74 3169 2440 A 76 GLN H A 75 ASN HD22 1.0 0.0 5.74 3170 2441 A 77 TRP HE3 A 77 TRP HBx 1.0 0.0 4.54 3171 2441 A 77 TRP HE3 A 77 TRP HBy 1.0 0.0 4.54 3172 2442 A 78 GLY H A 77 TRP HBx 1.0 0.0 5.21 3173 2442 A 78 GLY H A 77 TRP HBy 1.0 0.0 5.21 3174 2443 A 77 TRP HD1 A 78 GLY HAy 1.0 0.0 5.82 3175 2443 A 77 TRP HD1 A 78 GLY HAx 1.0 0.0 5.82 3176 2444 A 77 TRP HE3 A 85 HIS HBx 1.0 0.0 6.34 3177 2444 A 77 TRP HE3 A 85 HIS HBy 1.0 0.0 6.34 3178 2445 A 77 TRP HE1 A 85 HIS HBx 1.0 0.0 6.34 3179 2445 A 85 HIS HBy A 77 TRP HE1 1.0 0.0 6.34 3180 2446 A 77 TRP HZ3 A 85 HIS HBx 1.0 0.0 6.34 3181 2446 A 77 TRP HZ3 A 85 HIS HBy 1.0 0.0 6.34 3182 2447 A 77 TRP HZ2 A 85 HIS HBx 1.0 0.0 6.20 3183 2447 A 77 TRP HZ2 A 85 HIS HBy 1.0 0.0 6.20 3184 2448 A 77 TRP HH2 A 85 HIS HBx 1.0 0.0 5.20 3185 2448 A 77 TRP HH2 A 85 HIS HBy 1.0 0.0 5.20 3186 2449 A 82 ALA HB% A 78 GLY HAy 1.0 0.0 5.16 3187 2449 A 82 ALA HB% A 78 GLY HAx 1.0 0.0 5.16 3188 2450 A 80 ASP HA A 79 GLY HAy 1.0 0.0 6.34 3189 2450 A 80 ASP HA A 79 GLY HAx 1.0 0.0 6.34 3190 2451 A 81 SER H A 81 SER HBy 1.0 0.0 4.44 3191 2451 A 81 SER H A 81 SER HBx 1.0 0.0 4.44 3192 2452 A 82 ALA HA A 83 PRO HDy 1.0 0.0 4.36 3193 2452 A 82 ALA HA A 83 PRO HDx 1.0 0.0 4.36 3194 2453 A 82 ALA HB% A 83 PRO HDy 1.0 0.0 4.56 3195 2453 A 82 ALA HB% A 83 PRO HDx 1.0 0.0 4.56 3196 2454 A 86 SER H A 85 HIS HBx 1.0 0.0 5.23 3197 2454 A 86 SER H A 85 HIS HBy 1.0 0.0 5.23 3198 2455 A 87 GLY H A 86 SER HBx 1.0 0.0 5.14 3199 2455 A 87 GLY H A 86 SER HBy 1.0 0.0 5.14 3200 2456 A 89 ASN HA A 89 ASN HD21 1.0 0.0 5.62 3201 2456 A 89 ASN HA A 89 ASN HD22 1.0 0.0 5.62 3202 2457 A 89 ASN HA A 90 TRP HBx 1.0 0.0 6.34 3203 2457 A 89 ASN HA A 90 TRP HBy 1.0 0.0 6.34 3204 2458 A 90 TRP H A 92 LEU HDx% 1.0 0.0 6.44 3205 2458 A 90 TRP H A 92 LEU HDy% 1.0 0.0 6.44 3206 2459 A 90 TRP HE3 A 90 TRP HBx 1.0 0.0 4.69 3207 2459 A 90 TRP HE3 A 90 TRP HBy 1.0 0.0 4.69 3208 2460 A 91 ILE H A 90 TRP HBx 1.0 0.0 5.03 3209 2460 A 91 ILE H A 90 TRP HBy 1.0 0.0 5.03 3210 2461 A 91 ILE HA A 90 TRP HBx 1.0 0.0 6.34 3211 2461 A 91 ILE HA A 90 TRP HBy 1.0 0.0 6.34 3212 2462 A 92 LEU HG A 90 TRP HBx 1.0 0.0 6.23 3213 2462 A 92 LEU HG A 90 TRP HBy 1.0 0.0 6.23 3214 2463 A 90 TRP HBx A 92 LEU HDx% 1.0 0.0 5.25 3215 2463 A 90 TRP HBy A 92 LEU HDx% 1.0 0.0 5.25 3216 2463 A 92 LEU HDy% A 90 TRP HBx 1.0 0.0 5.25 3217 2463 A 92 LEU HDy% A 90 TRP HBy 1.0 0.0 5.25 3218 2464 A 90 TRP HE3 A 92 LEU HDx% 1.0 0.0 4.33 3219 2464 A 90 TRP HE3 A 92 LEU HDy% 1.0 0.0 4.33 3220 2465 A 90 TRP HZ3 A 92 LEU HDx% 1.0 0.0 5.60 3221 2465 A 90 TRP HZ3 A 92 LEU HDy% 1.0 0.0 5.60 3222 2466 A 91 ILE H A 92 LEU HDx% 1.0 0.0 6.44 3223 2466 A 91 ILE H A 92 LEU HDy% 1.0 0.0 6.44 3224 2467 A 91 ILE HA A 92 LEU HBy 1.0 0.0 6.34 3225 2467 A 91 ILE HA A 92 LEU HBx 1.0 0.0 6.34 3226 2468 A 91 ILE HA A 92 LEU HDx% 1.0 0.0 6.44 3227 2468 A 91 ILE HA A 92 LEU HDy% 1.0 0.0 6.44 3228 2469 A 92 LEU H A 92 LEU HDx% 1.0 0.0 5.44 3229 2469 A 92 LEU H A 92 LEU HDy% 1.0 0.0 5.44 3230 2470 A 92 LEU HA A 92 LEU HDx% 1.0 0.0 4.78 3231 2470 A 92 LEU HA A 92 LEU HDy% 1.0 0.0 4.78 3232 2471 A 93 GLY HAy A 92 LEU HBy 1.0 0.0 6.34 3233 2471 A 93 GLY HAy A 92 LEU HBx 1.0 0.0 6.34 3234 2472 A 93 GLY H A 92 LEU HDx% 1.0 0.0 5.78 3235 2472 A 93 GLY H A 92 LEU HDy% 1.0 0.0 5.78 3236 2473 A 93 GLY H A 100 VAL HGy% 1.0 0.0 6.07 3237 2473 A 93 GLY H A 100 VAL HGx% 1.0 0.0 6.07 3238 2474 A 93 GLY HAy A 100 VAL HGy% 1.0 0.0 5.13 3239 2474 A 93 GLY HAy A 100 VAL HGx% 1.0 0.0 5.13 3240 2475 A 93 GLY HAx A 100 VAL HGy% 1.0 0.0 6.21 3241 2475 A 93 GLY HAx A 100 VAL HGx% 1.0 0.0 6.21 3242 2476 A 94 SER H A 95 ARG HGx 1.0 0.0 5.55 3243 2476 A 94 SER H A 95 ARG HGy 1.0 0.0 5.55 3244 2477 A 94 SER H A 100 VAL HGy% 1.0 0.0 6.12 3245 2477 A 94 SER H A 100 VAL HGx% 1.0 0.0 6.12 3246 2478 A 95 ARG H A 95 ARG HGx 1.0 0.0 5.04 3247 2478 A 95 ARG H A 95 ARG HGy 1.0 0.0 5.04 3248 2479 A 95 ARG H A 100 VAL HGy% 1.0 0.0 6.44 3249 2479 A 95 ARG H A 100 VAL HGx% 1.0 0.0 6.44 3250 2480 A 95 ARG HA A 98 GLN HBx 1.0 0.0 6.34 3251 2480 A 95 ARG HA A 98 GLN HBy 1.0 0.0 6.34 3252 2481 A 96 GLU H A 95 ARG HGx 1.0 0.0 5.57 3253 2481 A 96 GLU H A 95 ARG HGy 1.0 0.0 5.57 3254 2482 A 120 TYR HD% A 95 ARG HGx 1.0 0.0 6.34 3255 2482 A 120 TYR HD% A 95 ARG HGy 1.0 0.0 6.34 3256 2483 A 96 GLU H A 96 GLU HGx 1.0 0.0 5.49 3257 2483 A 96 GLU H A 96 GLU HGy 1.0 0.0 5.49 3258 2484 A 96 GLU H A 97 ASN HD21 1.0 0.0 6.34 3259 2484 A 96 GLU H A 97 ASN HD22 1.0 0.0 6.34 3260 2485 A 96 GLU HB2 A 97 ASN HBx 1.0 0.0 5.64 3261 2485 A 96 GLU HB3 A 97 ASN HBx 1.0 0.0 5.64 3262 2485 A 97 ASN HBy A 96 GLU HB2 1.0 0.0 5.64 3263 2485 A 96 GLU HB3 A 97 ASN HBy 1.0 0.0 5.64 3264 2486 A 97 ASN HA A 96 GLU HGx 1.0 0.0 6.34 3265 2486 A 97 ASN HA A 96 GLU HGy 1.0 0.0 6.34 3266 2487 A 96 GLU HGy A 97 ASN HBx 1.0 0.0 5.53 3267 2487 A 96 GLU HGx A 97 ASN HBx 1.0 0.0 5.53 3268 2487 A 97 ASN HBy A 96 GLU HGx 1.0 0.0 5.53 3269 2487 A 96 GLU HGy A 97 ASN HBy 1.0 0.0 5.53 3270 2488 A 96 GLU HGx A 97 ASN HD21 1.0 0.0 4.66 3271 2488 A 96 GLU HGy A 97 ASN HD21 1.0 0.0 4.66 3272 2488 A 97 ASN HD22 A 96 GLU HGx 1.0 0.0 4.66 3273 2488 A 96 GLU HGy A 97 ASN HD22 1.0 0.0 4.66 3274 2489 A 98 GLN HA A 98 GLN HGx 1.0 0.0 4.53 3275 2489 A 98 GLN HA A 98 GLN HGy 1.0 0.0 4.53 3276 2490 A 98 GLN HA A 99 ASN HBx 1.0 0.0 6.34 3277 2490 A 98 GLN HA A 99 ASN HBy 1.0 0.0 6.34 3278 2491 A 120 TYR HE% A 98 GLN HBx 1.0 0.0 5.54 3279 2491 A 120 TYR HE% A 98 GLN HBy 1.0 0.0 5.54 3280 2492 A 99 ASN H A 98 GLN HGx 1.0 0.0 5.34 3281 2492 A 99 ASN H A 98 GLN HGy 1.0 0.0 5.34 3282 2493 A 101 VAL HGx% A 98 GLN HGx 1.0 0.0 6.34 3283 2493 A 101 VAL HGx% A 98 GLN HGy 1.0 0.0 6.34 3284 2494 A 120 TYR HA A 98 GLN HGx 1.0 0.0 6.24 3285 2494 A 120 TYR HA A 98 GLN HGy 1.0 0.0 6.24 3286 2495 A 120 TYR HBx A 98 GLN HGx 1.0 0.0 5.56 3287 2495 A 120 TYR HBx A 98 GLN HGy 1.0 0.0 5.56 3288 2496 A 120 TYR HD% A 98 GLN HGx 1.0 0.0 5.61 3289 2496 A 120 TYR HD% A 98 GLN HGy 1.0 0.0 5.61 3290 2497 A 121 ALA HB% A 98 GLN HGx 1.0 0.0 5.16 3291 2497 A 121 ALA HB% A 98 GLN HGy 1.0 0.0 5.16 3292 2498 A 122 GLY H A 98 GLN HGx 1.0 0.0 6.34 3293 2498 A 122 GLY H A 98 GLN HGy 1.0 0.0 6.34 3294 2499 A 98 GLN HGx A 122 GLY HAy 1.0 0.0 6.18 3295 2499 A 98 GLN HGy A 122 GLY HAy 1.0 0.0 6.18 3296 2499 A 122 GLY HAx A 98 GLN HGx 1.0 0.0 6.18 3297 2499 A 98 GLN HGy A 122 GLY HAx 1.0 0.0 6.18 3298 2500 A 98 GLN HE21 A 123 GLU HGx 1.0 0.0 6.19 3299 2500 A 98 GLN HE21 A 123 GLU HGy 1.0 0.0 6.19 3300 2501 A 99 ASN H A 99 ASN HBx 1.0 0.0 4.52 3301 2501 A 99 ASN H A 99 ASN HBy 1.0 0.0 4.52 3302 2502 A 99 ASN HA A 100 VAL HGy% 1.0 0.0 5.51 3303 2502 A 99 ASN HA A 100 VAL HGx% 1.0 0.0 5.51 3304 2503 A 100 VAL H A 99 ASN HBx 1.0 0.0 5.13 3305 2503 A 100 VAL H A 99 ASN HBy 1.0 0.0 5.13 3306 2504 A 100 VAL HB A 99 ASN HBx 1.0 0.0 6.34 3307 2504 A 100 VAL HB A 99 ASN HBy 1.0 0.0 6.34 3308 2505 A 99 ASN HBy A 100 VAL HGy% 1.0 0.0 6.28 3309 2505 A 99 ASN HBx A 100 VAL HGy% 1.0 0.0 6.28 3310 2505 A 100 VAL HGx% A 99 ASN HBx 1.0 0.0 6.28 3311 2505 A 100 VAL HGx% A 99 ASN HBy 1.0 0.0 6.28 3312 2506 A 101 VAL HGx% A 99 ASN HBx 1.0 0.0 5.97 3313 2506 A 101 VAL HGx% A 99 ASN HBy 1.0 0.0 5.97 3314 2507 A 121 ALA HB% A 99 ASN HBx 1.0 0.0 5.60 3315 2507 A 121 ALA HB% A 99 ASN HBy 1.0 0.0 5.60 3316 2508 A 100 VAL H A 100 VAL HGy% 1.0 0.0 4.68 3317 2508 A 100 VAL H A 100 VAL HGx% 1.0 0.0 4.68 3318 2509 A 101 VAL H A 100 VAL HGy% 1.0 0.0 4.61 3319 2509 A 101 VAL H A 100 VAL HGx% 1.0 0.0 4.61 3320 2510 A 103 ILE H A 100 VAL HGy% 1.0 0.0 5.79 3321 2510 A 103 ILE H A 100 VAL HGx% 1.0 0.0 5.79 3322 2511 A 120 TYR HBx A 100 VAL HGy% 1.0 0.0 6.44 3323 2511 A 120 TYR HBx A 100 VAL HGx% 1.0 0.0 6.44 3324 2512 A 120 TYR HE% A 100 VAL HGy% 1.0 0.0 4.82 3325 2512 A 120 TYR HE% A 100 VAL HGx% 1.0 0.0 4.82 3326 2513 A 101 VAL HGy% A 122 GLY HAy 1.0 0.0 6.34 3327 2513 A 101 VAL HGy% A 122 GLY HAx 1.0 0.0 6.34 3328 2514 A 103 ILE HA A 104 ASN HBx 1.0 0.0 6.34 3329 2514 A 103 ILE HA A 104 ASN HBy 1.0 0.0 6.34 3330 2515 A 118 MET HA A 103 ILE HG1x 1.0 0.0 6.34 3331 2515 A 118 MET HA A 103 ILE HG1y 1.0 0.0 6.34 3332 2516 A 104 ASN H A 105 VAL HGy% 1.0 0.0 4.84 3333 2516 A 104 ASN H A 105 VAL HGx% 1.0 0.0 4.84 3334 2517 A 104 ASN HA A 105 VAL HGy% 1.0 0.0 5.77 3335 2517 A 104 ASN HA A 105 VAL HGx% 1.0 0.0 5.77 3336 2518 A 104 ASN HD22 A 104 ASN HBx 1.0 0.0 4.19 3337 2518 A 104 ASN HD21 A 104 ASN HBy 1.0 0.0 4.19 3338 2518 A 104 ASN HD22 A 104 ASN HBy 1.0 0.0 4.19 3339 2518 A 104 ASN HD21 A 104 ASN HBx 1.0 0.0 4.19 3340 2519 A 105 VAL H A 104 ASN HBx 1.0 0.0 5.47 3341 2519 A 105 VAL H A 104 ASN HBy 1.0 0.0 5.47 3342 2520 A 104 ASN HBx A 105 VAL HGy% 1.0 0.0 5.53 3343 2520 A 104 ASN HBy A 105 VAL HGy% 1.0 0.0 5.53 3344 2520 A 105 VAL HGx% A 104 ASN HBx 1.0 0.0 5.53 3345 2520 A 105 VAL HGx% A 104 ASN HBy 1.0 0.0 5.53 3346 2521 A 104 ASN HBy A 116 GLY HAy 1.0 0.0 6.18 3347 2521 A 104 ASN HBx A 116 GLY HAy 1.0 0.0 6.18 3348 2521 A 116 GLY HAx A 104 ASN HBx 1.0 0.0 6.18 3349 2521 A 104 ASN HBy A 116 GLY HAx 1.0 0.0 6.18 3350 2522 A 117 THR H A 104 ASN HBx 1.0 0.0 6.02 3351 2522 A 117 THR H A 104 ASN HBy 1.0 0.0 6.02 3352 2523 A 117 THR HG2% A 104 ASN HBx 1.0 0.0 5.55 3353 2523 A 117 THR HG2% A 104 ASN HBy 1.0 0.0 5.55 3354 2524 A 104 ASN HD21 A 105 VAL HGx% 1.0 0.0 6.27 3355 2524 A 104 ASN HD22 A 105 VAL HGx% 1.0 0.0 6.27 3356 2524 A 104 ASN HD22 A 105 VAL HGy% 1.0 0.0 6.27 3357 2524 A 104 ASN HD21 A 105 VAL HGy% 1.0 0.0 6.27 3358 2525 A 105 VAL H A 105 VAL HGy% 1.0 0.0 5.12 3359 2525 A 105 VAL H A 105 VAL HGx% 1.0 0.0 5.12 3360 2526 A 105 VAL HA A 116 GLY HAy 1.0 0.0 4.90 3361 2526 A 105 VAL HA A 116 GLY HAx 1.0 0.0 4.90 3362 2527 A 105 VAL HB A 114 LEU HDx% 1.0 0.0 5.76 3363 2527 A 105 VAL HB A 114 LEU HDy% 1.0 0.0 5.76 3364 2528 A 105 VAL HB A 116 GLY HAy 1.0 0.0 5.90 3365 2528 A 105 VAL HB A 116 GLY HAx 1.0 0.0 5.90 3366 2529 A 106 GLU H A 105 VAL HGy% 1.0 0.0 4.81 3367 2529 A 106 GLU H A 105 VAL HGx% 1.0 0.0 4.81 3368 2530 A 114 LEU HBy A 105 VAL HGy% 1.0 0.0 5.93 3369 2530 A 114 LEU HBy A 105 VAL HGx% 1.0 0.0 5.93 3370 2531 A 114 LEU HBx A 105 VAL HGy% 1.0 0.0 5.54 3371 2531 A 114 LEU HBx A 105 VAL HGx% 1.0 0.0 5.54 3372 2532 A 115 ASN HA A 105 VAL HGy% 1.0 0.0 6.27 3373 2532 A 115 ASN HA A 105 VAL HGx% 1.0 0.0 6.27 3374 2533 A 105 VAL HGx% A 115 ASN HBy 1.0 0.0 5.85 3375 2533 A 105 VAL HGy% A 115 ASN HBy 1.0 0.0 5.85 3376 2533 A 115 ASN HBx A 105 VAL HGy% 1.0 0.0 5.85 3377 2533 A 115 ASN HBx A 105 VAL HGx% 1.0 0.0 5.85 3378 2534 A 116 GLY H A 105 VAL HGy% 1.0 0.0 5.30 3379 2534 A 116 GLY H A 105 VAL HGx% 1.0 0.0 5.30 3380 2535 A 105 VAL HGy% A 116 GLY HAy 1.0 0.0 4.77 3381 2535 A 105 VAL HGx% A 116 GLY HAy 1.0 0.0 4.77 3382 2535 A 116 GLY HAx A 105 VAL HGy% 1.0 0.0 4.77 3383 2535 A 105 VAL HGx% A 116 GLY HAx 1.0 0.0 4.77 3384 2536 A 117 THR H A 105 VAL HGy% 1.0 0.0 4.72 3385 2536 A 117 THR H A 105 VAL HGx% 1.0 0.0 4.72 3386 2537 A 117 THR HA A 105 VAL HGy% 1.0 0.0 6.44 3387 2537 A 117 THR HA A 105 VAL HGx% 1.0 0.0 6.44 3388 2538 A 118 MET H A 105 VAL HGy% 1.0 0.0 6.44 3389 2538 A 118 MET H A 105 VAL HGx% 1.0 0.0 6.44 3390 2539 A 105 VAL HGy% A 118 MET HB2 1.0 0.0 6.44 3391 2539 A 118 MET HB3 A 105 VAL HGy% 1.0 0.0 6.44 3392 2539 A 118 MET HB3 A 105 VAL HGx% 1.0 0.0 6.44 3393 2539 A 105 VAL HGx% A 118 MET HB2 1.0 0.0 6.44 3394 2540 A 128 PHE H A 105 VAL HGy% 1.0 0.0 6.23 3395 2540 A 128 PHE H A 105 VAL HGx% 1.0 0.0 6.23 3396 2541 A 128 PHE HA A 105 VAL HGy% 1.0 0.0 6.44 3397 2541 A 128 PHE HA A 105 VAL HGx% 1.0 0.0 6.44 3398 2542 A 105 VAL HGy% A 128 PHE HBy 1.0 0.0 5.33 3399 2542 A 105 VAL HGx% A 128 PHE HBy 1.0 0.0 5.33 3400 2542 A 128 PHE HBx A 105 VAL HGy% 1.0 0.0 5.33 3401 2542 A 128 PHE HBx A 105 VAL HGx% 1.0 0.0 5.33 3402 2543 A 128 PHE HD% A 105 VAL HGy% 1.0 0.0 5.63 3403 2543 A 128 PHE HD% A 105 VAL HGx% 1.0 0.0 5.63 3404 2544 A 106 GLU HA A 107 SER HBx 1.0 0.0 6.34 3405 2544 A 106 GLU HA A 107 SER HBy 1.0 0.0 6.34 3406 2545 A 106 GLU HA A 114 LEU HDx% 1.0 0.0 6.44 3407 2545 A 106 GLU HA A 114 LEU HDy% 1.0 0.0 6.44 3408 2546 A 107 SER H A 107 SER HBx 1.0 0.0 4.47 3409 2546 A 107 SER H A 107 SER HBy 1.0 0.0 4.47 3410 2547 A 107 SER H A 114 LEU HDx% 1.0 0.0 5.48 3411 2547 A 107 SER H A 114 LEU HDy% 1.0 0.0 5.48 3412 2548 A 109 ASP H A 107 SER HBx 1.0 0.0 5.72 3413 2548 A 109 ASP H A 107 SER HBy 1.0 0.0 5.72 3414 2549 A 108 GLY H A 115 ASN HD21 1.0 0.0 6.34 3415 2549 A 108 GLY H A 115 ASN HD22 1.0 0.0 6.34 3416 2550 A 111 GLY H A 109 ASP HBy 1.0 0.0 6.34 3417 2550 A 111 GLY H A 109 ASP HBx 1.0 0.0 6.34 3418 2551 A 112 GLN H A 109 ASP HBy 1.0 0.0 5.42 3419 2551 A 112 GLN H A 109 ASP HBx 1.0 0.0 5.42 3420 2552 A 109 ASP HBx A 112 GLN HBx 1.0 0.0 5.76 3421 2552 A 109 ASP HBy A 112 GLN HBx 1.0 0.0 5.76 3422 2552 A 112 GLN HBy A 109 ASP HBy 1.0 0.0 5.76 3423 2552 A 109 ASP HBx A 112 GLN HBy 1.0 0.0 5.76 3424 2553 A 109 ASP HBy A 112 GLN HE22 1.0 0.0 5.76 3425 2553 A 112 GLN HE21 A 109 ASP HBy 1.0 0.0 5.76 3426 2553 A 109 ASP HBx A 112 GLN HE21 1.0 0.0 5.76 3427 2553 A 109 ASP HBx A 112 GLN HE22 1.0 0.0 5.76 3428 2554 A 113 THR H A 109 ASP HBy 1.0 0.0 6.34 3429 2554 A 113 THR H A 109 ASP HBx 1.0 0.0 6.34 3430 2555 A 111 GLY H A 112 GLN HBx 1.0 0.0 6.34 3431 2555 A 111 GLY H A 112 GLN HBy 1.0 0.0 6.34 3432 2556 A 111 GLY HAy A 114 LEU HDx% 1.0 0.0 5.70 3433 2556 A 111 GLY HAy A 114 LEU HDy% 1.0 0.0 5.70 3434 2557 A 112 GLN H A 112 GLN HBx 1.0 0.0 4.45 3435 2557 A 112 GLN H A 112 GLN HBy 1.0 0.0 4.45 3436 2558 A 112 GLN HA A 132 LEU HBy 1.0 0.0 4.45 3437 2558 A 112 GLN HA A 132 LEU HBx 1.0 0.0 4.45 3438 2559 A 112 GLN HA A 132 LEU HDx% 1.0 0.0 4.58 3439 2559 A 112 GLN HA A 132 LEU HDy% 1.0 0.0 4.58 3440 2560 A 113 THR H A 112 GLN HBx 1.0 0.0 5.13 3441 2560 A 113 THR H A 112 GLN HBy 1.0 0.0 5.13 3442 2561 A 113 THR HA A 112 GLN HBx 1.0 0.0 6.34 3443 2561 A 113 THR HA A 112 GLN HBy 1.0 0.0 6.34 3444 2562 A 113 THR HG2% A 112 GLN HBx 1.0 0.0 5.76 3445 2562 A 113 THR HG2% A 112 GLN HBy 1.0 0.0 5.76 3446 2563 A 112 GLN HBx A 132 LEU HDx% 1.0 0.0 5.85 3447 2563 A 112 GLN HBy A 132 LEU HDx% 1.0 0.0 5.85 3448 2563 A 132 LEU HDy% A 112 GLN HBx 1.0 0.0 5.85 3449 2563 A 132 LEU HDy% A 112 GLN HBy 1.0 0.0 5.85 3450 2564 A 113 THR HG2% A 112 GLN HGy 1.0 0.0 5.74 3451 2564 A 113 THR HG2% A 112 GLN HGx 1.0 0.0 5.74 3452 2565 A 132 LEU H A 112 GLN HGy 1.0 0.0 6.34 3453 2565 A 132 LEU H A 112 GLN HGx 1.0 0.0 6.34 3454 2566 A 112 GLN HGy A 132 LEU HDx% 1.0 0.0 5.70 3455 2566 A 112 GLN HGx A 132 LEU HDx% 1.0 0.0 5.70 3456 2566 A 132 LEU HDy% A 112 GLN HGy 1.0 0.0 5.70 3457 2566 A 132 LEU HDy% A 112 GLN HGx 1.0 0.0 5.70 3458 2567 A 113 THR HA A 130 GLY HAy 1.0 0.0 6.34 3459 2567 A 113 THR HA A 130 GLY HAx 1.0 0.0 6.34 3460 2568 A 113 THR HB A 115 ASN HD22 1.0 0.0 5.27 3461 2568 A 113 THR HB A 115 ASN HD21 1.0 0.0 5.27 3462 2569 A 113 THR HG2% A 115 ASN HD21 1.0 0.0 5.50 3463 2569 A 113 THR HG2% A 115 ASN HD22 1.0 0.0 5.50 3464 2570 A 114 LEU H A 114 LEU HDx% 1.0 0.0 5.66 3465 2570 A 114 LEU H A 114 LEU HDy% 1.0 0.0 5.66 3466 2571 A 114 LEU HA A 114 LEU HDx% 1.0 0.0 5.32 3467 2571 A 114 LEU HA A 114 LEU HDy% 1.0 0.0 5.32 3468 2572 A 115 ASN H A 114 LEU HDx% 1.0 0.0 5.38 3469 2572 A 115 ASN H A 114 LEU HDy% 1.0 0.0 5.38 3470 2573 A 128 PHE HE% A 114 LEU HDx% 1.0 0.0 5.46 3471 2573 A 128 PHE HE% A 114 LEU HDy% 1.0 0.0 5.46 3472 2574 A 128 PHE HZ A 114 LEU HDx% 1.0 0.0 6.23 3473 2574 A 128 PHE HZ A 114 LEU HDy% 1.0 0.0 6.23 3474 2575 A 114 LEU HDx% A 130 GLY HAy 1.0 0.0 6.28 3475 2575 A 114 LEU HDy% A 130 GLY HAy 1.0 0.0 6.28 3476 2575 A 130 GLY HAx A 114 LEU HDx% 1.0 0.0 6.28 3477 2575 A 114 LEU HDy% A 130 GLY HAx 1.0 0.0 6.28 3478 2576 A 115 ASN H A 115 ASN HBy 1.0 0.0 4.54 3479 2576 A 115 ASN H A 115 ASN HBx 1.0 0.0 4.54 3480 2577 A 115 ASN H A 115 ASN HD21 1.0 0.0 5.48 3481 2577 A 115 ASN H A 115 ASN HD22 1.0 0.0 5.48 3482 2578 A 115 ASN HD21 A 115 ASN HA 1.0 0.0 5.85 3483 2578 A 115 ASN HA A 115 ASN HD22 1.0 0.0 5.85 3484 2579 A 115 ASN HA A 116 GLY HAy 1.0 0.0 6.34 3485 2579 A 115 ASN HA A 116 GLY HAx 1.0 0.0 6.34 3486 2580 A 115 ASN HD21 A 115 ASN HBy 1.0 0.0 4.15 3487 2580 A 115 ASN HD21 A 115 ASN HBx 1.0 0.0 4.15 3488 2580 A 115 ASN HD22 A 115 ASN HBx 1.0 0.0 4.15 3489 2580 A 115 ASN HD22 A 115 ASN HBy 1.0 0.0 4.15 3490 2581 A 115 ASN HBy A 116 GLY HAy 1.0 0.0 5.53 3491 2581 A 115 ASN HBx A 116 GLY HAy 1.0 0.0 5.53 3492 2581 A 116 GLY HAx A 115 ASN HBy 1.0 0.0 5.53 3493 2581 A 115 ASN HBx A 116 GLY HAx 1.0 0.0 5.53 3494 2582 A 128 PHE HD% A 115 ASN HBy 1.0 0.0 6.34 3495 2582 A 128 PHE HD% A 115 ASN HBx 1.0 0.0 6.34 3496 2583 A 129 LYS HA A 115 ASN HBy 1.0 0.0 6.34 3497 2583 A 129 LYS HA A 115 ASN HBx 1.0 0.0 6.34 3498 2584 A 115 ASN HD21 A 129 LYS HGx 1.0 0.0 5.77 3499 2584 A 129 LYS HGx A 115 ASN HD22 1.0 0.0 5.77 3500 2585 A 115 ASN HD21 A 129 LYS HD2 1.0 0.0 6.34 3501 2585 A 129 LYS HD3 A 115 ASN HD21 1.0 0.0 6.34 3502 2585 A 129 LYS HD3 A 115 ASN HD22 1.0 0.0 6.34 3503 2585 A 115 ASN HD22 A 129 LYS HD2 1.0 0.0 6.34 3504 2586 A 116 GLY H A 128 PHE HBy 1.0 0.0 5.40 3505 2586 A 116 GLY H A 128 PHE HBx 1.0 0.0 5.40 3506 2587 A 117 THR H A 116 GLY HAy 1.0 0.0 3.97 3507 2587 A 117 THR H A 116 GLY HAx 1.0 0.0 3.97 3508 2588 A 117 THR HG2% A 116 GLY HAy 1.0 0.0 5.37 3509 2588 A 117 THR HG2% A 116 GLY HAx 1.0 0.0 5.37 3510 2589 A 127 GLY HAy A 116 GLY HAy 1.0 0.0 6.34 3511 2589 A 127 GLY HAy A 116 GLY HAx 1.0 0.0 6.34 3512 2590 A 116 GLY HAx A 128 PHE HBy 1.0 0.0 6.18 3513 2590 A 116 GLY HAy A 128 PHE HBy 1.0 0.0 6.18 3514 2590 A 128 PHE HBx A 116 GLY HAy 1.0 0.0 6.18 3515 2590 A 128 PHE HBx A 116 GLY HAx 1.0 0.0 6.18 3516 2591 A 128 PHE HD% A 116 GLY HAy 1.0 0.0 6.34 3517 2591 A 128 PHE HD% A 116 GLY HAx 1.0 0.0 6.34 3518 2592 A 117 THR H A 128 PHE HBy 1.0 0.0 6.30 3519 2592 A 117 THR H A 128 PHE HBx 1.0 0.0 6.30 3520 2593 A 117 THR HA A 128 PHE HBy 1.0 0.0 5.52 3521 2593 A 117 THR HA A 128 PHE HBx 1.0 0.0 5.52 3522 2594 A 126 ILE H A 118 MET HGx 1.0 0.0 6.34 3523 2594 A 126 ILE H A 118 MET HGy 1.0 0.0 6.34 3524 2595 A 126 ILE HG1y A 118 MET HGx 1.0 0.0 6.27 3525 2595 A 126 ILE HG1y A 118 MET HGy 1.0 0.0 6.27 3526 2596 A 126 ILE HG1x A 118 MET HGx 1.0 0.0 5.64 3527 2596 A 126 ILE HG1x A 118 MET HGy 1.0 0.0 5.64 3528 2597 A 128 PHE HD% A 118 MET HGx 1.0 0.0 5.59 3529 2597 A 128 PHE HD% A 118 MET HGy 1.0 0.0 5.59 3530 2598 A 119 THR HA A 125 PRO HBy 1.0 0.0 6.33 3531 2598 A 119 THR HA A 125 PRO HBx 1.0 0.0 6.33 3532 2599 A 119 THR HG2% A 124 GLY HAy 1.0 0.0 6.08 3533 2599 A 119 THR HG2% A 124 GLY HAx 1.0 0.0 6.08 3534 2600 A 119 THR HG2% A 125 PRO HBy 1.0 0.0 6.34 3535 2600 A 119 THR HG2% A 125 PRO HBx 1.0 0.0 6.34 3536 2601 A 120 TYR HBx A 123 GLU HGx 1.0 0.0 6.34 3537 2601 A 120 TYR HBx A 123 GLU HGy 1.0 0.0 6.34 3538 2602 A 120 TYR HD% A 123 GLU HGx 1.0 0.0 6.34 3539 2602 A 120 TYR HD% A 123 GLU HGy 1.0 0.0 6.34 3540 2603 A 121 ALA HA A 122 GLY HAy 1.0 0.0 6.34 3541 2603 A 121 ALA HA A 122 GLY HAx 1.0 0.0 6.34 3542 2604 A 121 ALA HB% A 122 GLY HAy 1.0 0.0 6.34 3543 2604 A 121 ALA HB% A 122 GLY HAx 1.0 0.0 6.34 3544 2605 A 122 GLY HAy A 123 GLU HB2 1.0 0.0 6.34 3545 2605 A 122 GLY HAx A 123 GLU HB2 1.0 0.0 6.34 3546 2605 A 123 GLU HB3 A 122 GLY HAy 1.0 0.0 6.34 3547 2605 A 123 GLU HB3 A 122 GLY HAx 1.0 0.0 6.34 3548 2606 A 123 GLU H A 123 GLU HGx 1.0 0.0 6.34 3549 2606 A 123 GLU H A 123 GLU HGy 1.0 0.0 6.34 3550 2607 A 123 GLU HB3 A 124 GLY HAy 1.0 0.0 6.34 3551 2607 A 123 GLU HB2 A 124 GLY HAy 1.0 0.0 6.34 3552 2607 A 124 GLY HAx A 123 GLU HB2 1.0 0.0 6.34 3553 2607 A 123 GLU HB3 A 124 GLY HAx 1.0 0.0 6.34 3554 2608 A 124 GLY H A 123 GLU HGx 1.0 0.0 6.34 3555 2608 A 124 GLY H A 123 GLU HGy 1.0 0.0 6.34 3556 2609 A 123 GLU HGy A 124 GLY HAy 1.0 0.0 6.18 3557 2609 A 123 GLU HGx A 124 GLY HAy 1.0 0.0 6.18 3558 2609 A 124 GLY HAx A 123 GLU HGx 1.0 0.0 6.18 3559 2609 A 123 GLU HGy A 124 GLY HAx 1.0 0.0 6.18 3560 2610 A 124 GLY HAx A 125 PRO HBy 1.0 0.0 5.87 3561 2610 A 124 GLY HAy A 125 PRO HBy 1.0 0.0 5.87 3562 2610 A 125 PRO HBx A 124 GLY HAy 1.0 0.0 5.87 3563 2610 A 125 PRO HBx A 124 GLY HAx 1.0 0.0 5.87 3564 2611 A 124 GLY HAx A 125 PRO HGx 1.0 0.0 5.55 3565 2611 A 124 GLY HAy A 125 PRO HGx 1.0 0.0 5.55 3566 2611 A 125 PRO HGy A 124 GLY HAy 1.0 0.0 5.55 3567 2611 A 124 GLY HAx A 125 PRO HGy 1.0 0.0 5.55 3568 2612 A 126 ILE H A 125 PRO HBy 1.0 0.0 5.00 3569 2612 A 126 ILE H A 125 PRO HBx 1.0 0.0 5.00 3570 2613 A 127 GLY HAy A 128 PHE HBy 1.0 0.0 6.34 3571 2613 A 127 GLY HAy A 128 PHE HBx 1.0 0.0 6.34 3572 2614 A 128 PHE H A 128 PHE HBy 1.0 0.0 4.45 3573 2614 A 128 PHE H A 128 PHE HBx 1.0 0.0 4.45 3574 2615 A 128 PHE HE% A 130 GLY HAy 1.0 0.0 5.46 3575 2615 A 128 PHE HE% A 130 GLY HAx 1.0 0.0 5.46 3576 2616 A 128 PHE HZ A 130 GLY HAy 1.0 0.0 5.79 3577 2616 A 128 PHE HZ A 130 GLY HAx 1.0 0.0 5.79 3578 2617 A 131 THR H A 130 GLY HAy 1.0 0.0 4.05 3579 2617 A 131 THR H A 130 GLY HAx 1.0 0.0 4.05 3580 2618 A 131 THR HA A 130 GLY HAy 1.0 0.0 6.34 3581 2618 A 131 THR HA A 130 GLY HAx 1.0 0.0 6.34 3582 2619 A 131 THR HB A 130 GLY HAy 1.0 0.0 6.34 3583 2619 A 131 THR HB A 130 GLY HAx 1.0 0.0 6.34 3584 2620 A 132 LEU H A 132 LEU HBy 1.0 0.0 4.22 3585 2620 A 132 LEU H A 132 LEU HBx 1.0 0.0 4.22 3586 2621 A 132 LEU H A 132 LEU HDx% 1.0 0.0 5.22 3587 2621 A 132 LEU H A 132 LEU HDy% 1.0 0.0 5.22 3588 2622 A 132 LEU HA A 132 LEU HDx% 1.0 0.0 4.51 3589 2622 A 132 LEU HA A 132 LEU HDy% 1.0 0.0 4.51 3590 2623 A 133 THR H A 132 LEU HDx% 1.0 0.0 4.57 3591 2623 A 133 THR H A 132 LEU HDy% 1.0 0.0 4.57 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type lower-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 4 TYR H A 23 TRP O 1.0 1.8 990.0 2 2 A 23 TRP O A 4 TYR N 1.0 2.7 990.0 3 3 A 5 ASN H A 131 THR O 1.0 1.8 990.0 4 4 A 131 THR O A 5 ASN N 1.0 2.7 990.0 5 5 A 7 GLU H A 129 LYS O 1.0 1.8 990.0 6 6 A 129 LYS O A 7 GLU N 1.0 2.7 990.0 7 7 A 8 ASN H A 18 ASN O 1.0 1.8 990.0 8 8 A 18 ASN O A 8 ASN N 1.0 2.7 990.0 9 9 A 9 GLN H A 127 GLY O 1.0 1.8 990.0 10 10 A 127 GLY O A 9 GLN N 1.0 2.7 990.0 11 11 A 18 ASN H A 8 ASN O 1.0 1.8 990.0 12 12 A 8 ASN O A 18 ASN N 1.0 2.7 990.0 13 13 A 23 TRP H A 4 TYR O 1.0 1.8 990.0 14 14 A 4 TYR O A 23 TRP N 1.0 2.7 990.0 15 15 A 24 GLU H A 91 ILE O 1.0 1.8 990.0 16 16 A 91 ILE O A 24 GLU N 1.0 2.7 990.0 17 17 A 35 ALA H A 52 THR O 1.0 1.8 990.0 18 18 A 52 THR O A 35 ALA N 1.0 2.7 990.0 19 19 A 36 ILE H A 105 VAL O 1.0 1.8 990.0 20 20 A 105 VAL O A 36 ILE N 1.0 2.7 990.0 21 21 A 37 ASN H A 50 THR O 1.0 1.8 990.0 22 22 A 50 THR O A 37 ASN N 1.0 2.7 990.0 23 23 A 38 VAL H A 103 ILE O 1.0 1.8 990.0 24 24 A 103 ILE O A 38 VAL N 1.0 2.7 990.0 25 25 A 39 GLU H A 48 ASN O 1.0 1.8 990.0 26 26 A 48 ASN O A 39 GLU N 1.0 2.7 990.0 27 27 A 40 SER H A 101 VAL O 1.0 1.8 990.0 28 28 A 101 VAL O A 40 SER N 1.0 2.7 990.0 29 29 A 41 GLY H A 46 THR O 1.0 1.8 990.0 30 30 A 46 THR O A 41 GLY N 1.0 2.7 990.0 31 31 A 47 LEU H A 63 ALA O 1.0 1.8 990.0 32 32 A 63 ALA O A 47 LEU N 1.0 2.7 990.0 33 33 A 48 ASN H A 39 GLU O 1.0 1.8 990.0 34 34 A 39 GLU O A 48 ASN N 1.0 2.7 990.0 35 35 A 49 GLY H A 61 PHE O 1.0 1.8 990.0 36 36 A 61 PHE O A 49 GLY N 1.0 2.7 990.0 37 37 A 50 THR H A 37 ASN O 1.0 1.8 990.0 38 38 A 37 ASN O A 50 THR N 1.0 2.7 990.0 39 39 A 51 MET H A 59 ILE O 1.0 1.8 990.0 40 40 A 59 ILE O A 51 MET N 1.0 2.7 990.0 41 41 A 54 ALA H A 32 ASN O 1.0 1.8 990.0 42 42 A 32 ASN O A 54 ALA N 1.0 2.7 990.0 43 43 A 60 GLY H A 76 GLN O 1.0 1.8 990.0 44 44 A 76 GLN O A 60 GLY N 1.0 2.7 990.0 45 45 A 61 PHE H A 49 GLY O 1.0 1.8 990.0 46 46 A 49 GLY O A 61 PHE N 1.0 2.7 990.0 47 47 A 62 ARG H A 74 GLU O 1.0 1.8 990.0 48 48 A 74 GLU O A 62 ARG N 1.0 2.7 990.0 49 49 A 63 ALA H A 47 LEU O 1.0 1.8 990.0 50 50 A 47 LEU O A 63 ALA N 1.0 2.7 990.0 51 51 A 64 THR H A 72 GLU O 1.0 1.8 990.0 52 52 A 72 GLU O A 64 THR N 1.0 2.7 990.0 53 53 A 65 LEU H A 45 GLN O 1.0 1.8 990.0 54 54 A 45 GLN O A 65 LEU N 1.0 2.7 990.0 55 55 A 71 TYR H A 90 TRP O 1.0 1.8 990.0 56 56 A 90 TRP O A 71 TYR N 1.0 2.7 990.0 57 57 A 72 GLU H A 64 THR O 1.0 1.8 990.0 58 58 A 64 THR O A 72 GLU N 1.0 2.7 990.0 59 59 A 73 VAL H A 88 GLY O 1.0 1.8 990.0 60 60 A 88 GLY O A 73 VAL N 1.0 2.7 990.0 61 61 A 74 GLU H A 62 ARG O 1.0 1.8 990.0 62 62 A 62 ARG O A 74 GLU N 1.0 2.7 990.0 63 63 A 75 ASN H A 85 HIS O 1.0 1.8 990.0 64 64 A 85 HIS O A 75 ASN N 1.0 2.7 990.0 65 65 A 76 GLN H A 60 GLY O 1.0 1.8 990.0 66 66 A 60 GLY O A 76 GLN N 1.0 2.7 990.0 67 67 A 87 GLY H A 73 VAL O 1.0 1.8 990.0 68 68 A 73 VAL O A 87 GLY N 1.0 2.7 990.0 69 69 A 88 GLY H A 73 VAL O 1.0 1.8 990.0 70 70 A 73 VAL O A 88 GLY N 1.0 2.7 990.0 71 71 A 90 TRP H A 71 TYR O 1.0 1.8 990.0 72 72 A 71 TYR O A 90 TRP N 1.0 2.7 990.0 73 73 A 91 ILE H A 24 GLU O 1.0 1.8 990.0 74 74 A 24 GLU O A 91 ILE N 1.0 2.7 990.0 75 75 A 92 LEU H A 69 ASN O 1.0 1.8 990.0 76 76 A 69 ASN O A 92 LEU N 1.0 2.7 990.0 77 77 A 100 VAL H A 92 LEU O 1.0 1.8 990.0 78 78 A 92 LEU O A 100 VAL N 1.0 2.7 990.0 79 79 A 101 VAL H A 119 THR O 1.0 1.8 990.0 80 80 A 119 THR O A 101 VAL N 1.0 2.7 990.0 81 81 A 102 ALA H A 119 THR O 1.0 1.8 990.0 82 82 A 119 THR O A 102 ALA N 1.0 2.7 990.0 83 83 A 103 ILE H A 38 VAL O 1.0 1.8 990.0 84 84 A 38 VAL O A 103 ILE N 1.0 2.7 990.0 85 85 A 104 ASN H A 117 THR O 1.0 1.8 990.0 86 86 A 117 THR O A 104 ASN N 1.0 2.7 990.0 87 87 A 105 VAL H A 36 ILE O 1.0 1.8 990.0 88 88 A 36 ILE O A 105 VAL N 1.0 2.7 990.0 89 89 A 106 GLU H A 115 ASN O 1.0 1.8 990.0 90 90 A 115 ASN O A 106 GLU N 1.0 2.7 990.0 91 91 A 107 SER H A 34 VAL O 1.0 1.8 990.0 92 92 A 34 VAL O A 107 SER N 1.0 2.7 990.0 93 93 A 114 LEU H A 130 GLY O 1.0 1.8 990.0 94 94 A 130 GLY O A 114 LEU N 1.0 2.7 990.0 95 95 A 116 GLY H A 128 PHE O 1.0 1.8 990.0 96 96 A 128 PHE O A 116 GLY N 1.0 2.7 990.0 97 97 A 117 THR H A 104 ASN O 1.0 1.8 990.0 98 98 A 104 ASN O A 117 THR N 1.0 2.7 990.0 99 99 A 118 MET H A 126 ILE O 1.0 1.8 990.0 100 100 A 126 ILE O A 118 MET N 1.0 2.7 990.0 101 101 A 119 THR H A 102 ALA O 1.0 1.8 990.0 102 102 A 102 ALA O A 119 THR N 1.0 2.7 990.0 103 103 A 121 ALA H A 99 ASN O 1.0 1.8 990.0 104 104 A 99 ASN O A 121 ALA N 1.0 2.7 990.0 105 105 A 126 ILE H A 118 MET O 1.0 1.8 990.0 106 106 A 118 MET O A 126 ILE N 1.0 2.7 990.0 107 107 A 127 GLY H A 9 GLN O 1.0 1.8 990.0 108 108 A 9 GLN O A 127 GLY N 1.0 2.7 990.0 109 109 A 128 PHE H A 116 GLY O 1.0 1.8 990.0 110 110 A 116 GLY O A 128 PHE N 1.0 2.7 990.0 111 111 A 129 LYS H A 7 GLU O 1.0 1.8 990.0 112 112 A 7 GLU O A 129 LYS N 1.0 2.7 990.0 113 113 A 130 GLY H A 114 LEU O 1.0 1.8 990.0 114 114 A 114 LEU O A 130 GLY N 1.0 2.7 990.0 115 115 A 132 LEU H A 112 GLN O 1.0 1.8 990.0 116 116 A 112 GLN O A 132 LEU N 1.0 2.7 990.0 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 4 TYR H A 23 TRP O 1.0 0.0 2.0 2 2 A 23 TRP O A 4 TYR N 1.0 0.0 3.0 3 3 A 5 ASN H A 131 THR O 1.0 0.0 2.0 4 4 A 131 THR O A 5 ASN N 1.0 0.0 3.0 5 5 A 7 GLU H A 129 LYS O 1.0 0.0 2.0 6 6 A 129 LYS O A 7 GLU N 1.0 0.0 3.0 7 7 A 8 ASN H A 18 ASN O 1.0 0.0 2.0 8 8 A 18 ASN O A 8 ASN N 1.0 0.0 3.0 9 9 A 9 GLN H A 127 GLY O 1.0 0.0 2.0 10 10 A 127 GLY O A 9 GLN N 1.0 0.0 3.0 11 11 A 18 ASN H A 8 ASN O 1.0 0.0 2.0 12 12 A 8 ASN O A 18 ASN N 1.0 0.0 3.0 13 13 A 23 TRP H A 4 TYR O 1.0 0.0 2.0 14 14 A 4 TYR O A 23 TRP N 1.0 0.0 3.0 15 15 A 24 GLU H A 91 ILE O 1.0 0.0 2.0 16 16 A 91 ILE O A 24 GLU N 1.0 0.0 3.0 17 17 A 35 ALA H A 52 THR O 1.0 0.0 2.0 18 18 A 52 THR O A 35 ALA N 1.0 0.0 3.0 19 19 A 36 ILE H A 105 VAL O 1.0 0.0 2.0 20 20 A 105 VAL O A 36 ILE N 1.0 0.0 3.0 21 21 A 37 ASN H A 50 THR O 1.0 0.0 2.0 22 22 A 50 THR O A 37 ASN N 1.0 0.0 3.0 23 23 A 38 VAL H A 103 ILE O 1.0 0.0 2.0 24 24 A 103 ILE O A 38 VAL N 1.0 0.0 3.0 25 25 A 39 GLU H A 48 ASN O 1.0 0.0 2.0 26 26 A 48 ASN O A 39 GLU N 1.0 0.0 3.0 27 27 A 40 SER H A 101 VAL O 1.0 0.0 2.0 28 28 A 101 VAL O A 40 SER N 1.0 0.0 3.0 29 29 A 41 GLY H A 46 THR O 1.0 0.0 2.0 30 30 A 46 THR O A 41 GLY N 1.0 0.0 3.0 31 31 A 47 LEU H A 63 ALA O 1.0 0.0 2.0 32 32 A 63 ALA O A 47 LEU N 1.0 0.0 3.0 33 33 A 48 ASN H A 39 GLU O 1.0 0.0 2.0 34 34 A 39 GLU O A 48 ASN N 1.0 0.0 3.0 35 35 A 49 GLY H A 61 PHE O 1.0 0.0 2.0 36 36 A 61 PHE O A 49 GLY N 1.0 0.0 3.0 37 37 A 50 THR H A 37 ASN O 1.0 0.0 2.0 38 38 A 37 ASN O A 50 THR N 1.0 0.0 3.0 39 39 A 51 MET H A 59 ILE O 1.0 0.0 2.0 40 40 A 59 ILE O A 51 MET N 1.0 0.0 3.0 41 41 A 54 ALA H A 32 ASN O 1.0 0.0 2.0 42 42 A 32 ASN O A 54 ALA N 1.0 0.0 3.0 43 43 A 60 GLY H A 76 GLN O 1.0 0.0 2.0 44 44 A 76 GLN O A 60 GLY N 1.0 0.0 3.0 45 45 A 61 PHE H A 49 GLY O 1.0 0.0 2.0 46 46 A 49 GLY O A 61 PHE N 1.0 0.0 3.0 47 47 A 62 ARG H A 74 GLU O 1.0 0.0 2.0 48 48 A 74 GLU O A 62 ARG N 1.0 0.0 3.0 49 49 A 63 ALA H A 47 LEU O 1.0 0.0 2.0 50 50 A 47 LEU O A 63 ALA N 1.0 0.0 3.0 51 51 A 64 THR H A 72 GLU O 1.0 0.0 2.0 52 52 A 72 GLU O A 64 THR N 1.0 0.0 3.0 53 53 A 65 LEU H A 45 GLN O 1.0 0.0 2.0 54 54 A 45 GLN O A 65 LEU N 1.0 0.0 3.0 55 55 A 71 TYR H A 90 TRP O 1.0 0.0 2.0 56 56 A 90 TRP O A 71 TYR N 1.0 0.0 3.0 57 57 A 72 GLU H A 64 THR O 1.0 0.0 2.0 58 58 A 64 THR O A 72 GLU N 1.0 0.0 3.0 59 59 A 73 VAL H A 88 GLY O 1.0 0.0 2.0 60 60 A 88 GLY O A 73 VAL N 1.0 0.0 3.0 61 61 A 74 GLU H A 62 ARG O 1.0 0.0 2.0 62 62 A 62 ARG O A 74 GLU N 1.0 0.0 3.0 63 63 A 75 ASN H A 85 HIS O 1.0 0.0 2.0 64 64 A 85 HIS O A 75 ASN N 1.0 0.0 3.0 65 65 A 76 GLN H A 60 GLY O 1.0 0.0 2.0 66 66 A 60 GLY O A 76 GLN N 1.0 0.0 3.0 67 67 A 87 GLY H A 73 VAL O 1.0 0.0 2.0 68 68 A 73 VAL O A 87 GLY N 1.0 0.0 3.0 69 69 A 88 GLY H A 73 VAL O 1.0 0.0 2.0 70 70 A 73 VAL O A 88 GLY N 1.0 0.0 3.0 71 71 A 90 TRP H A 71 TYR O 1.0 0.0 2.0 72 72 A 71 TYR O A 90 TRP N 1.0 0.0 3.0 73 73 A 91 ILE H A 24 GLU O 1.0 0.0 2.0 74 74 A 24 GLU O A 91 ILE N 1.0 0.0 3.0 75 75 A 92 LEU H A 69 ASN O 1.0 0.0 2.0 76 76 A 69 ASN O A 92 LEU N 1.0 0.0 3.0 77 77 A 100 VAL H A 92 LEU O 1.0 0.0 2.0 78 78 A 92 LEU O A 100 VAL N 1.0 0.0 3.0 79 79 A 101 VAL H A 119 THR O 1.0 0.0 2.0 80 80 A 119 THR O A 101 VAL N 1.0 0.0 3.0 81 81 A 102 ALA H A 119 THR O 1.0 0.0 2.0 82 82 A 119 THR O A 102 ALA N 1.0 0.0 3.0 83 83 A 103 ILE H A 38 VAL O 1.0 0.0 2.0 84 84 A 38 VAL O A 103 ILE N 1.0 0.0 3.0 85 85 A 104 ASN H A 117 THR O 1.0 0.0 2.0 86 86 A 117 THR O A 104 ASN N 1.0 0.0 3.0 87 87 A 105 VAL H A 36 ILE O 1.0 0.0 2.0 88 88 A 36 ILE O A 105 VAL N 1.0 0.0 3.0 89 89 A 106 GLU H A 115 ASN O 1.0 0.0 2.0 90 90 A 115 ASN O A 106 GLU N 1.0 0.0 3.0 91 91 A 107 SER H A 34 VAL O 1.0 0.0 2.0 92 92 A 34 VAL O A 107 SER N 1.0 0.0 3.0 93 93 A 114 LEU H A 130 GLY O 1.0 0.0 2.0 94 94 A 130 GLY O A 114 LEU N 1.0 0.0 3.0 95 95 A 116 GLY H A 128 PHE O 1.0 0.0 2.0 96 96 A 128 PHE O A 116 GLY N 1.0 0.0 3.0 97 97 A 117 THR H A 104 ASN O 1.0 0.0 2.0 98 98 A 104 ASN O A 117 THR N 1.0 0.0 3.0 99 99 A 118 MET H A 126 ILE O 1.0 0.0 2.0 100 100 A 126 ILE O A 118 MET N 1.0 0.0 3.0 101 101 A 119 THR H A 102 ALA O 1.0 0.0 2.0 102 102 A 102 ALA O A 119 THR N 1.0 0.0 3.0 103 103 A 121 ALA H A 99 ASN O 1.0 0.0 2.0 104 104 A 99 ASN O A 121 ALA N 1.0 0.0 3.0 105 105 A 126 ILE H A 118 MET O 1.0 0.0 2.0 106 106 A 118 MET O A 126 ILE N 1.0 0.0 3.0 107 107 A 127 GLY H A 9 GLN O 1.0 0.0 2.0 108 108 A 9 GLN O A 127 GLY N 1.0 0.0 3.0 109 109 A 128 PHE H A 116 GLY O 1.0 0.0 2.0 110 110 A 116 GLY O A 128 PHE N 1.0 0.0 3.0 111 111 A 129 LYS H A 7 GLU O 1.0 0.0 2.0 112 112 A 7 GLU O A 129 LYS N 1.0 0.0 3.0 113 113 A 130 GLY H A 114 LEU O 1.0 0.0 2.0 114 114 A 114 LEU O A 130 GLY N 1.0 0.0 3.0 115 115 A 132 LEU H A 112 GLN O 1.0 0.0 2.0 116 116 A 112 GLN O A 132 LEU N 1.0 0.0 3.0 stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 3 LEU N A 3 LEU H 1.0 . . . 2 2 A 4 TYR N A 4 TYR H 1.0 . . . 3 3 A 5 ASN N A 5 ASN H 1.0 . . . 4 4 A 6 VAL N A 6 VAL H 1.0 . . . 5 5 A 8 ASN N A 8 ASN H 1.0 . . . 6 6 A 9 GLN N A 9 GLN H 1.0 . . . 7 7 A 10 TRP N A 10 TRP H 1.0 . . . 8 8 A 11 GLY N A 11 GLY H 1.0 . . . 9 9 A 12 GLY N A 12 GLY H 1.0 . . . 10 10 A 13 SER N A 13 SER H 1.0 . . . 11 11 A 14 SER N A 14 SER H 1.0 . . . 12 12 A 17 TRP N A 17 TRP H 1.0 . . . 13 13 A 18 ASN N A 18 ASN H 1.0 . . . 14 14 A 20 GLY N A 20 GLY H 1.0 . . . 15 15 A 21 GLY N A 21 GLY H 1.0 . . . 16 16 A 23 TRP N A 23 TRP H 1.0 . . . 17 17 A 25 ILE N A 25 ILE H 1.0 . . . 18 18 A 26 GLY N A 26 GLY H 1.0 . . . 19 19 A 27 SER N A 27 SER H 1.0 . . . 20 20 A 28 ARG N A 28 ARG H 1.0 . . . 21 21 A 30 ASP N A 30 ASP H 1.0 . . . 22 22 A 31 GLN N A 31 GLN H 1.0 . . . 23 23 A 32 ASN N A 32 ASN H 1.0 . . . 24 24 A 33 VAL N A 33 VAL H 1.0 . . . 25 25 A 34 VAL N A 34 VAL H 1.0 . . . 26 26 A 36 ILE N A 36 ILE H 1.0 . . . 27 27 A 37 ASN N A 37 ASN H 1.0 . . . 28 28 A 38 VAL N A 38 VAL H 1.0 . . . 29 29 A 39 GLU N A 39 GLU H 1.0 . . . 30 30 A 40 SER N A 40 SER H 1.0 . . . 31 31 A 44 GLY N A 44 GLY H 1.0 . . . 32 32 A 46 THR N A 46 THR H 1.0 . . . 33 33 A 47 LEU N A 47 LEU H 1.0 . . . 34 34 A 48 ASN N A 48 ASN H 1.0 . . . 35 35 A 49 GLY N A 49 GLY H 1.0 . . . 36 36 A 50 THR N A 50 THR H 1.0 . . . 37 37 A 51 MET N A 51 MET H 1.0 . . . 38 38 A 55 GLY N A 55 GLY H 1.0 . . . 39 39 A 60 GLY N A 60 GLY H 1.0 . . . 40 40 A 62 ARG N A 62 ARG H 1.0 . . . 41 41 A 63 ALA N A 63 ALA H 1.0 . . . 42 42 A 64 THR N A 64 THR H 1.0 . . . 43 43 A 65 LEU N A 65 LEU H 1.0 . . . 44 44 A 66 LEU N A 66 LEU H 1.0 . . . 45 45 A 67 GLY N A 67 GLY H 1.0 . . . 46 46 A 68 ASN N A 68 ASN H 1.0 . . . 47 47 A 73 VAL N A 73 VAL H 1.0 . . . 48 48 A 74 GLU N A 74 GLU H 1.0 . . . 49 49 A 75 ASN N A 75 ASN H 1.0 . . . 50 50 A 76 GLN N A 76 GLN H 1.0 . . . 51 51 A 77 TRP N A 77 TRP H 1.0 . . . 52 52 A 78 GLY N A 78 GLY H 1.0 . . . 53 53 A 79 GLY N A 79 GLY H 1.0 . . . 54 54 A 80 ASP N A 80 ASP H 1.0 . . . 55 55 A 81 SER N A 81 SER H 1.0 . . . 56 56 A 84 TRP N A 84 TRP H 1.0 . . . 57 57 A 85 HIS N A 85 HIS H 1.0 . . . 58 58 A 86 SER N A 86 SER H 1.0 . . . 59 59 A 87 GLY N A 87 GLY H 1.0 . . . 60 60 A 88 GLY N A 88 GLY H 1.0 . . . 61 61 A 89 ASN N A 89 ASN H 1.0 . . . 62 62 A 90 TRP N A 90 TRP H 1.0 . . . 63 63 A 92 LEU N A 92 LEU H 1.0 . . . 64 64 A 93 GLY N A 93 GLY H 1.0 . . . 65 65 A 94 SER N A 94 SER H 1.0 . . . 66 66 A 95 ARG N A 95 ARG H 1.0 . . . 67 67 A 96 GLU N A 96 GLU H 1.0 . . . 68 68 A 98 GLN N A 98 GLN H 1.0 . . . 69 69 A 99 ASN N A 99 ASN H 1.0 . . . 70 70 A 100 VAL N A 100 VAL H 1.0 . . . 71 71 A 101 VAL N A 101 VAL H 1.0 . . . 72 72 A 103 ILE N A 103 ILE H 1.0 . . . 73 73 A 104 ASN N A 104 ASN H 1.0 . . . 74 74 A 105 VAL N A 105 VAL H 1.0 . . . 75 75 A 106 GLU N A 106 GLU H 1.0 . . . 76 76 A 107 SER N A 107 SER H 1.0 . . . 77 77 A 109 ASP N A 109 ASP H 1.0 . . . 78 78 A 111 GLY N A 111 GLY H 1.0 . . . 79 79 A 113 THR N A 113 THR H 1.0 . . . 80 80 A 117 THR N A 117 THR H 1.0 . . . 81 81 A 118 MET N A 118 MET H 1.0 . . . 82 82 A 122 GLY N A 122 GLY H 1.0 . . . 83 83 A 127 GLY N A 127 GLY H 1.0 . . . 84 84 A 128 PHE N A 128 PHE H 1.0 . . . 85 85 A 129 LYS N A 129 LYS H 1.0 . . . 86 86 A 130 GLY N A 130 GLY H 1.0 . . . 87 87 A 131 THR N A 131 THR H 1.0 . . . 88 88 A 132 LEU N A 132 LEU H 1.0 . . . 89 89 A 133 THR N A 133 THR H 1.0 . . . stop_ save_