data_nef_c15850_2k5w save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLU middle . . 3 A 3 ARG middle . . 4 A 4 ALA middle . . 5 A 5 SER middle . . 6 A 6 LEU middle . . 7 A 7 ASN middle . . 8 A 8 ARG middle . . 9 A 9 ILE middle . . 10 A 10 GLY middle . false 11 A 11 LYS middle . . 12 A 12 ASP middle . . 13 A 13 VAL middle . . 14 A 14 TYR middle . . 15 A 15 TYR middle . . 16 A 16 MET middle . . 17 A 17 GLN middle . . 18 A 18 ILE middle . . 19 A 19 LYS middle . . 20 A 20 GLY middle . false 21 A 21 GLU middle . . 22 A 22 GLY middle . false 23 A 23 THR middle . . 24 A 24 ILE middle . . 25 A 25 GLU middle . . 26 A 26 LYS middle . . 27 A 27 VAL middle . . 28 A 28 ASP middle . . 29 A 29 GLY middle . false 30 A 30 ARG middle . . 31 A 31 ASN middle . . 32 A 32 LEU middle . . 33 A 33 ARG middle . . 34 A 34 ASN middle . . 35 A 35 TYR middle . . 36 A 36 THR middle . . 37 A 37 LEU middle . . 38 A 38 PRO middle . false 39 A 39 ALA middle . . 40 A 40 TYR middle . . 41 A 41 ASP middle . . 42 A 42 GLU middle . . 43 A 43 ASP middle . . 44 A 44 GLY middle . false 45 A 45 VAL middle . . 46 A 46 LYS middle . . 47 A 47 LYS middle . . 48 A 48 GLN middle . . 49 A 49 ILE middle . . 50 A 50 THR middle . . 51 A 51 PHE middle . . 52 A 52 ARG middle . . 53 A 53 SER middle . . 54 A 54 THR middle . . 55 A 55 LYS middle . . 56 A 56 LYS middle . . 57 A 57 GLU middle . . 58 A 58 ASN middle . . 59 A 59 ASP middle . . 60 A 60 HIS middle . . 61 A 61 LYS middle . . 62 A 62 LEU middle . . 63 A 63 ASN middle . . 64 A 64 LYS middle . . 65 A 65 TYR middle . . 66 A 66 ALA middle . . 67 A 67 PHE middle . . 68 A 68 LEU middle . . 69 A 69 ARG middle . . 70 A 70 LEU middle . . 71 A 71 TYR middle . . 72 A 72 VAL middle . . 73 A 73 ASP middle . . 74 A 74 GLN middle . . 75 A 75 ASP middle . . 76 A 76 ASP middle . . 77 A 77 ASN middle . . 78 A 78 SER middle . . 79 A 79 LYS middle . . 80 A 80 ASN middle . . 81 A 81 GLU middle . . 82 A 82 ILE middle . . 83 A 83 SER middle . . 84 A 84 SER middle . . 85 A 85 ILE middle . . 86 A 86 GLU middle . . 87 A 87 VAL middle . . 88 A 88 LYS middle . . 89 A 89 SER middle . . 90 A 90 TYR middle . . 91 A 91 GLU middle . . 92 A 92 GLU middle . . 93 A 93 ILE middle . . 94 A 94 GLN middle . . 95 A 95 LYS middle . . 96 A 96 ALA middle . . 97 A 97 ASP middle . . 98 A 98 LEU middle . . 99 A 99 PRO middle . false 100 A 100 GLU middle . . 101 A 101 LYS middle . . 102 A 102 VAL middle . . 103 A 103 LYS middle . . 104 A 104 ASP middle . . 105 A 105 LYS middle . . 106 A 106 PHE middle . . 107 A 107 THR middle . . 108 A 108 ILE middle . . 109 A 109 LYS middle . . 110 A 110 LEU middle . . 111 A 111 GLU middle . . 112 A 112 HIS middle . . 113 A 113 HIS middle . . 114 A 114 HIS middle . . 115 A 115 HIS middle . . 116 A 116 HIS middle . . 117 A 117 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.690 0.02 A 1 MET HBx H 1 3.136 0.02 A 1 MET HBy H 1 3.136 0.02 A 1 MET HE% H 1 2.218 0.02 A 1 MET CA C 13 56.060 0.3 A 1 MET CB C 13 30.470 0.3 A 1 MET CE C 13 16.985 0.3 A 2 GLU HA H 1 4.420 0.02 A 2 GLU HBy H 1 1.981 0.02 A 2 GLU C C 13 176.068 0.3 A 2 GLU CA C 13 56.254 0.3 A 2 GLU CB C 13 30.433 0.3 A 3 ARG H H 1 8.658 0.02 A 3 ARG HA H 1 4.398 0.02 A 3 ARG HBx H 1 1.925 0.02 A 3 ARG HBy H 1 1.972 0.02 A 3 ARG HDx H 1 3.315 0.02 A 3 ARG HDy H 1 3.315 0.02 A 3 ARG HGx H 1 1.777 0.02 A 3 ARG HGy H 1 1.777 0.02 A 3 ARG C C 13 176.175 0.3 A 3 ARG CA C 13 56.378 0.3 A 3 ARG CB C 13 30.817 0.3 A 3 ARG CD C 13 43.579 0.3 A 3 ARG CG C 13 27.267 0.3 A 3 ARG N N 15 123.161 0.3 A 4 ALA H H 1 8.555 0.02 A 4 ALA HA H 1 4.423 0.02 A 4 ALA HB% H 1 1.511 0.02 A 4 ALA C C 13 177.937 0.3 A 4 ALA CA C 13 52.895 0.3 A 4 ALA CB C 13 19.351 0.3 A 4 ALA N N 15 125.466 0.3 A 5 SER H H 1 8.343 0.02 A 5 SER HA H 1 4.503 0.02 A 5 SER HBx H 1 3.962 0.02 A 5 SER HBy H 1 3.997 0.02 A 5 SER C C 13 174.781 0.3 A 5 SER CA C 13 58.497 0.3 A 5 SER CB C 13 63.885 0.3 A 5 SER N N 15 114.871 0.3 A 6 LEU H H 1 8.280 0.02 A 6 LEU HA H 1 4.420 0.02 A 6 LEU HBx H 1 1.691 0.02 A 6 LEU HBy H 1 1.752 0.02 A 6 LEU HD1% H 1 0.980 0.02 A 6 LEU HD2% H 1 0.909 0.02 A 6 LEU C C 13 177.123 0.3 A 6 LEU CA C 13 55.440 0.3 A 6 LEU CB C 13 42.460 0.3 A 6 LEU CD1 C 13 25.087 0.3 A 6 LEU CD2 C 13 23.682 0.3 A 6 LEU N N 15 123.798 0.3 A 7 ASN H H 1 8.415 0.02 A 7 ASN HA H 1 4.747 0.02 A 7 ASN HBy H 1 2.896 0.02 A 7 ASN HBx H 1 2.811 0.02 A 7 ASN HD21 H 1 7.649 0.02 A 7 ASN HD22 H 1 6.976 0.02 A 7 ASN C C 13 174.762 0.3 A 7 ASN CA C 13 53.402 0.3 A 7 ASN CB C 13 38.856 0.3 A 7 ASN CG C 13 176.984 0.3 A 7 ASN N N 15 118.923 0.3 A 7 ASN ND2 N 15 112.786 0.3 A 8 ARG H H 1 8.173 0.02 A 8 ARG HA H 1 4.345 0.02 A 8 ARG HBy H 1 2.021 0.02 A 8 ARG HBx H 1 1.942 0.02 A 8 ARG HDx H 1 3.315 0.02 A 8 ARG HDy H 1 3.315 0.02 A 8 ARG C C 13 175.867 0.3 A 8 ARG CA C 13 56.204 0.3 A 8 ARG CB C 13 30.860 0.3 A 8 ARG CD C 13 43.579 0.3 A 8 ARG N N 15 120.976 0.3 A 9 ILE H H 1 8.113 0.02 A 9 ILE HA H 1 4.219 0.02 A 9 ILE HB H 1 1.875 0.02 A 9 ILE HD1% H 1 0.912 0.02 A 9 ILE HG1y H 1 1.527 0.02 A 9 ILE HG1x H 1 1.235 0.02 A 9 ILE HG2% H 1 0.947 0.02 A 9 ILE C C 13 176.131 0.3 A 9 ILE CA C 13 61.482 0.3 A 9 ILE CB C 13 38.658 0.3 A 9 ILE CD1 C 13 13.027 0.3 A 9 ILE CG1 C 13 27.385 0.3 A 9 ILE CG2 C 13 17.671 0.3 A 9 ILE N N 15 121.815 0.3 A 10 GLY H H 1 8.648 0.02 A 10 GLY HAx H 1 3.958 0.02 A 10 GLY HAy H 1 3.958 0.02 A 10 GLY C C 13 173.279 0.3 A 10 GLY CA C 13 45.289 0.3 A 10 GLY N N 15 113.366 0.3 A 11 LYS H H 1 8.424 0.02 A 11 LYS HA H 1 4.434 0.02 A 11 LYS HBy H 1 2.048 0.02 A 11 LYS HBx H 1 2.016 0.02 A 11 LYS HDx H 1 1.824 0.02 A 11 LYS HDy H 1 1.824 0.02 A 11 LYS HEx H 1 3.150 0.02 A 11 LYS HEy H 1 3.150 0.02 A 11 LYS HGy H 1 1.707 0.02 A 11 LYS HGx H 1 1.575 0.02 A 11 LYS C C 13 176.426 0.3 A 11 LYS CA C 13 57.428 0.3 A 11 LYS CB C 13 33.430 0.3 A 11 LYS CD C 13 28.840 0.3 A 11 LYS CE C 13 42.010 0.3 A 11 LYS CG C 13 25.549 0.3 A 11 LYS N N 15 121.351 0.3 A 12 ASP H H 1 8.892 0.02 A 12 ASP HA H 1 5.067 0.02 A 12 ASP HBx H 1 2.845 0.02 A 12 ASP HBy H 1 2.957 0.02 A 12 ASP C C 13 174.469 0.3 A 12 ASP CA C 13 54.164 0.3 A 12 ASP CB C 13 42.856 0.3 A 12 ASP N N 15 119.962 0.3 A 13 VAL H H 1 7.745 0.02 A 13 VAL HA H 1 4.863 0.02 A 13 VAL HB H 1 1.767 0.02 A 13 VAL HG1% H 1 0.484 0.02 A 13 VAL HG2% H 1 0.867 0.02 A 13 VAL C C 13 174.815 0.3 A 13 VAL CA C 13 61.236 0.3 A 13 VAL CB C 13 33.908 0.3 A 13 VAL CG1 C 13 21.434 0.3 A 13 VAL CG2 C 13 21.781 0.3 A 13 VAL N N 15 120.886 0.3 A 14 TYR H H 1 8.718 0.02 A 14 TYR HA H 1 4.892 0.02 A 14 TYR HBy H 1 2.764 0.02 A 14 TYR HBx H 1 2.236 0.02 A 14 TYR HDx H 1 6.684 0.02 A 14 TYR HDy H 1 6.684 0.02 A 14 TYR HEx H 1 6.691 0.02 A 14 TYR HEy H 1 6.691 0.02 A 14 TYR C C 13 173.922 0.3 A 14 TYR CA C 13 56.661 0.3 A 14 TYR CB C 13 44.704 0.3 A 14 TYR CDx C 13 132.368 0.3 A 14 TYR CDy C 13 132.368 0.3 A 14 TYR CEx C 13 118.200 0.3 A 14 TYR CEy C 13 118.200 0.3 A 14 TYR N N 15 123.305 0.3 A 15 TYR H H 1 9.633 0.02 A 15 TYR HA H 1 5.616 0.02 A 15 TYR HBx H 1 2.974 0.02 A 15 TYR HBy H 1 3.165 0.02 A 15 TYR HDy H 1 7.276 0.02 A 15 TYR HDx H 1 7.268 0.02 A 15 TYR HEx H 1 6.684 0.02 A 15 TYR HEy H 1 6.684 0.02 A 15 TYR C C 13 175.280 0.3 A 15 TYR CA C 13 57.552 0.3 A 15 TYR CB C 13 42.336 0.3 A 15 TYR CDx C 13 133.810 0.3 A 15 TYR CDy C 13 133.818 0.3 A 15 TYR CEx C 13 117.597 0.3 A 15 TYR CEy C 13 117.597 0.3 A 15 TYR N N 15 117.808 0.3 A 16 MET H H 1 9.001 0.02 A 16 MET HA H 1 5.198 0.02 A 16 MET HBy H 1 2.068 0.02 A 16 MET HBx H 1 1.716 0.02 A 16 MET HE% H 1 1.847 0.02 A 16 MET HGx H 1 2.637 0.02 A 16 MET HGy H 1 2.637 0.02 A 16 MET C C 13 172.659 0.3 A 16 MET CA C 13 54.829 0.3 A 16 MET CB C 13 42.112 0.3 A 16 MET CE C 13 17.715 0.3 A 16 MET CG C 13 30.614 0.3 A 16 MET N N 15 122.443 0.3 A 17 GLN H H 1 8.725 0.02 A 17 GLN HA H 1 5.017 0.02 A 17 GLN HBy H 1 1.832 0.02 A 17 GLN HBx H 1 0.949 0.02 A 17 GLN HE21 H 1 7.327 0.02 A 17 GLN HE22 H 1 6.844 0.02 A 17 GLN HGy H 1 1.770 0.02 A 17 GLN HGx H 1 1.346 0.02 A 17 GLN C C 13 175.345 0.3 A 17 GLN CA C 13 53.412 0.3 A 17 GLN CB C 13 31.460 0.3 A 17 GLN CG C 13 34.004 0.3 A 17 GLN N N 15 124.981 0.3 A 17 GLN NE2 N 15 113.500 0.3 A 18 ILE H H 1 8.811 0.02 A 18 ILE HA H 1 3.720 0.02 A 18 ILE HB H 1 2.063 0.02 A 18 ILE HD1% H 1 0.278 0.02 A 18 ILE HG1x H 1 1.041 0.02 A 18 ILE HG1y H 1 1.286 0.02 A 18 ILE HG2% H 1 0.504 0.02 A 18 ILE C C 13 175.870 0.3 A 18 ILE CA C 13 60.335 0.3 A 18 ILE CB C 13 35.428 0.3 A 18 ILE CD1 C 13 9.210 0.3 A 18 ILE CG1 C 13 25.925 0.3 A 18 ILE CG2 C 13 17.587 0.3 A 18 ILE N N 15 126.576 0.3 A 19 LYS H H 1 6.892 0.02 A 19 LYS HA H 1 4.466 0.02 A 19 LYS HBy H 1 1.985 0.02 A 19 LYS HBx H 1 1.792 0.02 A 19 LYS HEx H 1 3.190 0.02 A 19 LYS HEy H 1 3.190 0.02 A 19 LYS HGx H 1 1.484 0.02 A 19 LYS HGy H 1 1.522 0.02 A 19 LYS C C 13 175.681 0.3 A 19 LYS CA C 13 55.053 0.3 A 19 LYS CB C 13 36.074 0.3 A 19 LYS CE C 13 42.330 0.3 A 19 LYS CG C 13 24.890 0.3 A 19 LYS N N 15 125.959 0.3 A 20 GLY H H 1 8.498 0.02 A 20 GLY HAy H 1 4.326 0.02 A 20 GLY HAx H 1 4.061 0.02 A 20 GLY C C 13 172.778 0.3 A 20 GLY CA C 13 45.228 0.3 A 20 GLY N N 15 108.333 0.3 A 21 GLU H H 1 8.539 0.02 A 21 GLU HA H 1 4.649 0.02 A 21 GLU HBy H 1 2.223 0.02 A 21 GLU HBx H 1 1.926 0.02 A 21 GLU HGy H 1 2.387 0.02 A 21 GLU HGx H 1 2.300 0.02 A 21 GLU C C 13 175.687 0.3 A 21 GLU CA C 13 55.633 0.3 A 21 GLU CB C 13 31.520 0.3 A 21 GLU CG C 13 36.590 0.3 A 21 GLU N N 15 116.471 0.3 A 22 GLY H H 1 8.576 0.02 A 22 GLY HAy H 1 3.583 0.02 A 22 GLY HAx H 1 3.153 0.02 A 22 GLY C C 13 173.642 0.3 A 22 GLY CA C 13 44.916 0.3 A 22 GLY N N 15 108.944 0.3 A 23 THR H H 1 8.909 0.02 A 23 THR HA H 1 4.581 0.02 A 23 THR HB H 1 3.974 0.02 A 23 THR HG2% H 1 1.210 0.02 A 23 THR C C 13 173.098 0.3 A 23 THR CA C 13 61.139 0.3 A 23 THR CB C 13 71.821 0.3 A 23 THR CG2 C 13 21.788 0.3 A 23 THR N N 15 114.982 0.3 A 24 ILE H H 1 8.502 0.02 A 24 ILE HA H 1 4.855 0.02 A 24 ILE HB H 1 1.847 0.02 A 24 ILE HD1% H 1 0.824 0.02 A 24 ILE HG1y H 1 1.551 0.02 A 24 ILE HG1x H 1 1.224 0.02 A 24 ILE HG2% H 1 0.844 0.02 A 24 ILE C C 13 175.796 0.3 A 24 ILE CA C 13 59.745 0.3 A 24 ILE CB C 13 38.463 0.3 A 24 ILE CD1 C 13 11.985 0.3 A 24 ILE CG1 C 13 27.442 0.3 A 24 ILE CG2 C 13 17.607 0.3 A 24 ILE N N 15 124.537 0.3 A 25 GLU H H 1 8.982 0.02 A 25 GLU HA H 1 4.567 0.02 A 25 GLU HBy H 1 1.926 0.02 A 25 GLU HBx H 1 1.772 0.02 A 25 GLU HGy H 1 2.204 0.02 A 25 GLU HGx H 1 2.071 0.02 A 25 GLU C C 13 173.942 0.3 A 25 GLU CA C 13 54.803 0.3 A 25 GLU CB C 13 33.059 0.3 A 25 GLU CG C 13 35.795 0.3 A 25 GLU N N 15 128.960 0.3 A 26 LYS H H 1 8.635 0.02 A 26 LYS HA H 1 5.057 0.02 A 26 LYS HBx H 1 1.778 0.02 A 26 LYS HBy H 1 1.778 0.02 A 26 LYS HDx H 1 1.691 0.02 A 26 LYS HDy H 1 1.691 0.02 A 26 LYS HEx H 1 3.008 0.02 A 26 LYS HEy H 1 3.008 0.02 A 26 LYS HGy H 1 1.369 0.02 A 26 LYS HGx H 1 1.296 0.02 A 26 LYS C C 13 176.481 0.3 A 26 LYS CA C 13 55.952 0.3 A 26 LYS CB C 13 32.900 0.3 A 26 LYS CD C 13 29.175 0.3 A 26 LYS CE C 13 41.733 0.3 A 26 LYS CG C 13 24.716 0.3 A 26 LYS N N 15 125.722 0.3 A 27 VAL H H 1 8.823 0.02 A 27 VAL HA H 1 4.302 0.02 A 27 VAL HB H 1 1.972 0.02 A 27 VAL HG1% H 1 0.944 0.02 A 27 VAL HG2% H 1 0.898 0.02 A 27 VAL C C 13 175.772 0.3 A 27 VAL CA C 13 61.600 0.3 A 27 VAL CB C 13 34.313 0.3 A 27 VAL CG1 C 13 20.860 0.3 A 27 VAL CG2 C 13 20.960 0.3 A 27 VAL N N 15 126.679 0.3 A 28 ASP H H 1 9.328 0.02 A 28 ASP HA H 1 4.417 0.02 A 28 ASP HBy H 1 3.024 0.02 A 28 ASP HBx H 1 2.712 0.02 A 28 ASP C C 13 176.041 0.3 A 28 ASP CA C 13 55.557 0.3 A 28 ASP CB C 13 40.097 0.3 A 28 ASP N N 15 128.011 0.3 A 29 GLY H H 1 8.589 0.02 A 29 GLY HAy H 1 4.240 0.02 A 29 GLY HAx H 1 3.683 0.02 A 29 GLY C C 13 173.921 0.3 A 29 GLY CA C 13 45.745 0.3 A 29 GLY N N 15 103.728 0.3 A 30 ARG H H 1 8.061 0.02 A 30 ARG HA H 1 4.695 0.02 A 30 ARG HBx H 1 1.909 0.02 A 30 ARG HBy H 1 1.909 0.02 A 30 ARG HDx H 1 3.315 0.02 A 30 ARG HDy H 1 3.315 0.02 A 30 ARG C C 13 174.483 0.3 A 30 ARG CA C 13 54.730 0.3 A 30 ARG CB C 13 32.582 0.3 A 30 ARG CD C 13 43.579 0.3 A 30 ARG N N 15 120.588 0.3 A 31 ASN H H 1 8.670 0.02 A 31 ASN HA H 1 5.105 0.02 A 31 ASN HBy H 1 2.917 0.02 A 31 ASN HBx H 1 2.556 0.02 A 31 ASN HD21 H 1 6.866 0.02 A 31 ASN HD22 H 1 7.613 0.02 A 31 ASN C C 13 174.404 0.3 A 31 ASN CA C 13 52.946 0.3 A 31 ASN CB C 13 39.022 0.3 A 31 ASN CG C 13 175.952 0.3 A 31 ASN N N 15 120.623 0.3 A 31 ASN ND2 N 15 111.930 0.3 A 32 LEU H H 1 8.974 0.02 A 32 LEU HA H 1 4.510 0.02 A 32 LEU HBx H 1 1.495 0.02 A 32 LEU HBy H 1 1.760 0.02 A 32 LEU HD1% H 1 0.871 0.02 A 32 LEU HD2% H 1 0.829 0.02 A 32 LEU HG H 1 1.692 0.02 A 32 LEU CA C 13 53.986 0.3 A 32 LEU CB C 13 43.588 0.3 A 32 LEU CD1 C 13 25.448 0.3 A 32 LEU CD2 C 13 23.909 0.3 A 32 LEU CG C 13 26.924 0.3 A 32 LEU N N 15 124.748 0.3 A 33 ARG HBx H 1 1.765 0.02 A 33 ARG HBy H 1 1.765 0.02 A 33 ARG C C 13 174.103 0.3 A 33 ARG CB C 13 33.725 0.3 A 34 ASN H H 1 8.913 0.02 A 34 ASN HA H 1 5.479 0.02 A 34 ASN HBx H 1 2.370 0.02 A 34 ASN HBy H 1 2.477 0.02 A 34 ASN HD21 H 1 7.124 0.02 A 34 ASN HD22 H 1 6.822 0.02 A 34 ASN C C 13 173.950 0.3 A 34 ASN CA C 13 51.390 0.3 A 34 ASN CB C 13 42.078 0.3 A 34 ASN CG C 13 175.501 0.3 A 34 ASN N N 15 124.021 0.3 A 34 ASN ND2 N 15 112.116 0.3 A 35 TYR H H 1 8.574 0.02 A 35 TYR HA H 1 4.677 0.02 A 35 TYR HBy H 1 2.534 0.02 A 35 TYR HBx H 1 2.322 0.02 A 35 TYR HEx H 1 6.550 0.02 A 35 TYR HEy H 1 6.550 0.02 A 35 TYR C C 13 174.635 0.3 A 35 TYR CA C 13 57.645 0.3 A 35 TYR CB C 13 42.330 0.3 A 35 TYR CEx C 13 117.111 0.3 A 35 TYR CEy C 13 117.111 0.3 A 35 TYR N N 15 119.292 0.3 A 36 THR H H 1 8.496 0.02 A 36 THR HA H 1 5.570 0.02 A 36 THR HB H 1 3.914 0.02 A 36 THR HG2% H 1 1.115 0.02 A 36 THR C C 13 174.682 0.3 A 36 THR CA C 13 61.964 0.3 A 36 THR CB C 13 70.835 0.3 A 36 THR CG2 C 13 21.423 0.3 A 36 THR N N 15 117.929 0.3 A 37 LEU H H 1 9.015 0.02 A 37 LEU HA H 1 5.213 0.02 A 37 LEU HBx H 1 1.806 0.02 A 37 LEU HBy H 1 2.029 0.02 A 37 LEU HD1% H 1 1.471 0.02 A 37 LEU HD2% H 1 1.439 0.02 A 37 LEU HG H 1 1.945 0.02 A 37 LEU CA C 13 52.077 0.3 A 37 LEU CB C 13 47.001 0.3 A 37 LEU CD1 C 13 27.961 0.3 A 37 LEU CD2 C 13 24.063 0.3 A 37 LEU CG C 13 28.124 0.3 A 37 LEU N N 15 129.005 0.3 A 38 PRO HA H 1 4.895 0.02 A 38 PRO HBy H 1 2.291 0.02 A 38 PRO HBx H 1 1.870 0.02 A 38 PRO HDy H 1 3.999 0.02 A 38 PRO HDx H 1 3.934 0.02 A 38 PRO HGy H 1 2.409 0.02 A 38 PRO HGx H 1 2.287 0.02 A 38 PRO C C 13 175.147 0.3 A 38 PRO CA C 13 62.412 0.3 A 38 PRO CB C 13 33.001 0.3 A 38 PRO CD C 13 50.644 0.3 A 38 PRO CG C 13 27.609 0.3 A 39 ALA H H 1 8.723 0.02 A 39 ALA HA H 1 5.214 0.02 A 39 ALA HB% H 1 1.258 0.02 A 39 ALA C C 13 174.605 0.3 A 39 ALA CA C 13 50.361 0.3 A 39 ALA CB C 13 24.878 0.3 A 39 ALA N N 15 123.010 0.3 A 40 TYR H H 1 9.255 0.02 A 40 TYR HA H 1 6.035 0.02 A 40 TYR HBy H 1 3.099 0.02 A 40 TYR HBx H 1 2.806 0.02 A 40 TYR HDy H 1 7.074 0.02 A 40 TYR HDx H 1 7.068 0.02 A 40 TYR HEx H 1 6.809 0.02 A 40 TYR HEy H 1 6.809 0.02 A 40 TYR C C 13 176.948 0.3 A 40 TYR CA C 13 56.428 0.3 A 40 TYR CB C 13 44.330 0.3 A 40 TYR CDx C 13 133.366 0.3 A 40 TYR CDy C 13 133.366 0.3 A 40 TYR CEx C 13 117.592 0.3 A 40 TYR CEy C 13 117.592 0.3 A 40 TYR N N 15 115.489 0.3 A 41 ASP H H 1 8.792 0.02 A 41 ASP HA H 1 5.046 0.02 A 41 ASP HBy H 1 3.225 0.02 A 41 ASP HBx H 1 2.385 0.02 A 41 ASP C C 13 177.665 0.3 A 41 ASP CA C 13 52.241 0.3 A 41 ASP CB C 13 41.049 0.3 A 41 ASP N N 15 122.934 0.3 A 42 GLU H H 1 8.833 0.02 A 42 GLU HA H 1 3.965 0.02 A 42 GLU HBy H 1 2.269 0.02 A 42 GLU HBx H 1 2.215 0.02 A 42 GLU HGx H 1 2.322 0.02 A 42 GLU HGy H 1 2.425 0.02 A 42 GLU C C 13 178.471 0.3 A 42 GLU CA C 13 58.939 0.3 A 42 GLU CB C 13 29.591 0.3 A 42 GLU CG C 13 36.135 0.3 A 42 GLU N N 15 113.929 0.3 A 43 ASP H H 1 8.162 0.02 A 43 ASP HA H 1 4.944 0.02 A 43 ASP HBy H 1 2.983 0.02 A 43 ASP HBx H 1 2.861 0.02 A 43 ASP C C 13 176.926 0.3 A 43 ASP CA C 13 54.483 0.3 A 43 ASP CB C 13 42.174 0.3 A 43 ASP N N 15 117.252 0.3 A 44 GLY H H 1 8.751 0.02 A 44 GLY HAy H 1 4.257 0.02 A 44 GLY HAx H 1 3.481 0.02 A 44 GLY C C 13 173.424 0.3 A 44 GLY CA C 13 45.834 0.3 A 44 GLY N N 15 109.652 0.3 A 45 VAL H H 1 8.728 0.02 A 45 VAL HA H 1 3.959 0.02 A 45 VAL HB H 1 2.420 0.02 A 45 VAL HG1% H 1 1.099 0.02 A 45 VAL HG2% H 1 1.108 0.02 A 45 VAL C C 13 175.480 0.3 A 45 VAL CA C 13 64.584 0.3 A 45 VAL CB C 13 31.175 0.3 A 45 VAL CG1 C 13 21.746 0.3 A 45 VAL CG2 C 13 22.573 0.3 A 45 VAL N N 15 125.503 0.3 A 46 LYS H H 1 8.304 0.02 A 46 LYS HA H 1 4.951 0.02 A 46 LYS HBy H 1 1.888 0.02 A 46 LYS HBx H 1 1.860 0.02 A 46 LYS HDx H 1 1.778 0.02 A 46 LYS HDy H 1 1.778 0.02 A 46 LYS HEx H 1 3.080 0.02 A 46 LYS HEy H 1 3.080 0.02 A 46 LYS HGy H 1 1.167 0.02 A 46 LYS HGx H 1 1.077 0.02 A 46 LYS C C 13 176.879 0.3 A 46 LYS CA C 13 55.704 0.3 A 46 LYS CB C 13 34.985 0.3 A 46 LYS CD C 13 29.981 0.3 A 46 LYS CE C 13 41.815 0.3 A 46 LYS CG C 13 24.370 0.3 A 46 LYS N N 15 128.801 0.3 A 47 LYS H H 1 9.090 0.02 A 47 LYS HA H 1 4.728 0.02 A 47 LYS HBy H 1 1.454 0.02 A 47 LYS HBx H 1 1.113 0.02 A 47 LYS HEx H 1 2.820 0.02 A 47 LYS HEy H 1 2.820 0.02 A 47 LYS HGx H 1 1.402 0.02 A 47 LYS HGy H 1 1.402 0.02 A 47 LYS C C 13 174.450 0.3 A 47 LYS CA C 13 54.850 0.3 A 47 LYS CB C 13 37.293 0.3 A 47 LYS CE C 13 42.980 0.3 A 47 LYS CG C 13 27.001 0.3 A 47 LYS N N 15 126.008 0.3 A 48 GLN H H 1 8.185 0.02 A 48 GLN HA H 1 4.619 0.02 A 48 GLN HBx H 1 2.030 0.02 A 48 GLN HBy H 1 2.030 0.02 A 48 GLN HE21 H 1 7.439 0.02 A 48 GLN HE22 H 1 6.815 0.02 A 48 GLN HGy H 1 2.221 0.02 A 48 GLN HGx H 1 2.049 0.02 A 48 GLN C C 13 174.748 0.3 A 48 GLN CA C 13 55.509 0.3 A 48 GLN CB C 13 31.229 0.3 A 48 GLN CD C 13 180.044 0.3 A 48 GLN CG C 13 34.341 0.3 A 48 GLN N N 15 120.556 0.3 A 48 GLN NE2 N 15 110.697 0.3 A 49 ILE H H 1 8.757 0.02 A 49 ILE HA H 1 4.596 0.02 A 49 ILE HB H 1 1.524 0.02 A 49 ILE HD1% H 1 0.200 0.02 A 49 ILE HG1x H 1 1.270 0.02 A 49 ILE HG2% H 1 0.597 0.02 A 49 ILE C C 13 174.399 0.3 A 49 ILE CA C 13 61.595 0.3 A 49 ILE CB C 13 39.980 0.3 A 49 ILE CD1 C 13 14.058 0.3 A 49 ILE CG1 C 13 26.839 0.3 A 49 ILE CG2 C 13 17.766 0.3 A 49 ILE N N 15 126.705 0.3 A 50 THR HA H 1 5.906 0.02 A 50 THR HB H 1 4.001 0.02 A 50 THR HG2% H 1 1.165 0.02 A 50 THR CA C 13 61.193 0.3 A 50 THR CB C 13 70.673 0.3 A 50 THR CG2 C 13 21.198 0.3 A 51 PHE HDx H 1 6.860 0.02 A 51 PHE HDy H 1 6.860 0.02 A 51 PHE HEx H 1 6.541 0.02 A 51 PHE HEy H 1 6.541 0.02 A 51 PHE HZ H 1 6.267 0.02 A 51 PHE CDx C 13 131.272 0.3 A 51 PHE CDy C 13 131.272 0.3 A 51 PHE CEx C 13 130.561 0.3 A 51 PHE CEy C 13 130.561 0.3 A 51 PHE CZ C 13 129.107 0.3 A 52 ARG HA H 1 4.947 0.02 A 52 ARG HBx H 1 1.832 0.02 A 52 ARG HBy H 1 1.838 0.02 A 52 ARG HDx H 1 3.230 0.02 A 52 ARG HDy H 1 3.230 0.02 A 52 ARG HGy H 1 1.733 0.02 A 52 ARG HGx H 1 1.666 0.02 A 52 ARG C C 13 176.633 0.3 A 52 ARG CA C 13 54.313 0.3 A 52 ARG CB C 13 32.061 0.3 A 52 ARG CD C 13 43.872 0.3 A 52 ARG CG C 13 26.875 0.3 A 53 SER H H 1 8.840 0.02 A 53 SER HA H 1 4.788 0.02 A 53 SER HBy H 1 4.232 0.02 A 53 SER HBx H 1 4.047 0.02 A 53 SER C C 13 177.244 0.3 A 53 SER CA C 13 57.871 0.3 A 53 SER CB C 13 64.398 0.3 A 53 SER N N 15 118.250 0.3 A 54 THR HA H 1 4.633 0.02 A 54 THR HB H 1 4.645 0.02 A 54 THR HG2% H 1 1.387 0.02 A 54 THR CA C 13 61.278 0.3 A 54 THR CB C 13 69.323 0.3 A 54 THR CG2 C 13 21.813 0.3 A 56 LYS HA H 1 4.283 0.02 A 56 LYS HBx H 1 1.990 0.02 A 56 LYS HBy H 1 1.991 0.02 A 56 LYS CA C 13 58.835 0.3 A 56 LYS CB C 13 33.432 0.3 A 60 HIS HBy H 1 3.303 0.02 A 60 HIS HBx H 1 3.182 0.02 A 60 HIS C C 13 173.971 0.3 A 60 HIS CB C 13 30.441 0.3 A 61 LYS H H 1 8.823 0.02 A 61 LYS HA H 1 4.378 0.02 A 61 LYS C C 13 176.422 0.3 A 61 LYS CA C 13 57.412 0.3 A 61 LYS N N 15 121.166 0.3 A 62 LEU H H 1 8.064 0.02 A 62 LEU HA H 1 4.359 0.02 A 62 LEU HBx H 1 1.396 0.02 A 62 LEU HBy H 1 1.396 0.02 A 62 LEU HD1% H 1 0.782 0.02 A 62 LEU HD2% H 1 1.031 0.02 A 62 LEU HG H 1 1.775 0.02 A 62 LEU C C 13 176.643 0.3 A 62 LEU CA C 13 54.211 0.3 A 62 LEU CB C 13 43.063 0.3 A 62 LEU CD1 C 13 26.236 0.3 A 62 LEU CD2 C 13 24.079 0.3 A 62 LEU CG C 13 27.992 0.3 A 62 LEU N N 15 124.757 0.3 A 63 ASN H H 1 8.887 0.02 A 63 ASN HA H 1 4.523 0.02 A 63 ASN HBy H 1 3.137 0.02 A 63 ASN HBx H 1 2.758 0.02 A 63 ASN HD21 H 1 7.020 0.02 A 63 ASN HD22 H 1 7.645 0.02 A 63 ASN C C 13 174.734 0.3 A 63 ASN CA C 13 53.544 0.3 A 63 ASN CB C 13 38.300 0.3 A 63 ASN CG C 13 177.766 0.3 A 63 ASN N N 15 121.187 0.3 A 63 ASN ND2 N 15 112.317 0.3 A 64 LYS H H 1 8.293 0.02 A 64 LYS HA H 1 3.566 0.02 A 64 LYS HBx H 1 1.360 0.02 A 64 LYS HBy H 1 1.642 0.02 A 64 LYS HEx H 1 2.955 0.02 A 64 LYS HEy H 1 2.955 0.02 A 64 LYS HGx H 1 1.099 0.02 A 64 LYS C C 13 177.154 0.3 A 64 LYS CA C 13 58.808 0.3 A 64 LYS CB C 13 32.197 0.3 A 64 LYS CE C 13 41.970 0.3 A 64 LYS CG C 13 25.551 0.3 A 64 LYS N N 15 122.027 0.3 A 65 TYR H H 1 8.351 0.02 A 65 TYR HA H 1 3.973 0.02 A 65 TYR HBy H 1 3.386 0.02 A 65 TYR HBx H 1 3.196 0.02 A 65 TYR HEx H 1 6.955 0.02 A 65 TYR HEy H 1 6.955 0.02 A 65 TYR C C 13 174.702 0.3 A 65 TYR CA C 13 59.810 0.3 A 65 TYR CB C 13 35.495 0.3 A 65 TYR CEx C 13 118.173 0.3 A 65 TYR CEy C 13 118.173 0.3 A 65 TYR N N 15 116.044 0.3 A 66 ALA H H 1 7.611 0.02 A 66 ALA HA H 1 4.232 0.02 A 66 ALA HB% H 1 1.422 0.02 A 66 ALA C C 13 175.636 0.3 A 66 ALA CA C 13 52.576 0.3 A 66 ALA CB C 13 19.783 0.3 A 66 ALA N N 15 123.082 0.3 A 67 PHE H H 1 8.778 0.02 A 67 PHE HA H 1 5.437 0.02 A 67 PHE HBx H 1 2.757 0.02 A 67 PHE HBy H 1 3.018 0.02 A 67 PHE HDx H 1 6.980 0.02 A 67 PHE C C 13 174.991 0.3 A 67 PHE CA C 13 57.123 0.3 A 67 PHE CB C 13 41.913 0.3 A 67 PHE CDx C 13 131.557 0.3 A 67 PHE N N 15 117.690 0.3 A 68 LEU H H 1 9.292 0.02 A 68 LEU HA H 1 5.414 0.02 A 68 LEU HBx H 1 1.365 0.02 A 68 LEU HBy H 1 1.365 0.02 A 68 LEU HD1% H 1 0.358 0.02 A 68 LEU HD2% H 1 0.644 0.02 A 68 LEU HG H 1 1.354 0.02 A 68 LEU C C 13 175.773 0.3 A 68 LEU CA C 13 53.127 0.3 A 68 LEU CB C 13 47.212 0.3 A 68 LEU CD1 C 13 26.42 0.3 A 68 LEU CD2 C 13 24.19 0.3 A 68 LEU CG C 13 27.66 0.3 A 68 LEU N N 15 119.654 0.3 A 69 ARG H H 1 8.967 0.02 A 69 ARG HA H 1 4.958 0.02 A 69 ARG HBy H 1 1.839 0.02 A 69 ARG HBx H 1 1.484 0.02 A 69 ARG HDy H 1 3.264 0.02 A 69 ARG HDx H 1 3.116 0.02 A 69 ARG HGx H 1 0.926 0.02 A 69 ARG HGy H 1 0.926 0.02 A 69 ARG C C 13 174.614 0.3 A 69 ARG CA C 13 54.282 0.3 A 69 ARG CB C 13 33.832 0.3 A 69 ARG CD C 13 44.333 0.3 A 69 ARG CG C 13 27.343 0.3 A 69 ARG N N 15 121.139 0.3 A 70 LEU H H 1 9.354 0.02 A 70 LEU HA H 1 4.980 0.02 A 70 LEU HBy H 1 1.528 0.02 A 70 LEU HBx H 1 1.266 0.02 A 70 LEU HD1% H 1 0.645 0.02 A 70 LEU HD2% H 1 0.220 0.02 A 70 LEU HG H 1 1.259 0.02 A 70 LEU C C 13 174.056 0.3 A 70 LEU CA C 13 54.865 0.3 A 70 LEU CB C 13 44.662 0.3 A 70 LEU CD1 C 13 27.37 0.3 A 70 LEU CD2 C 13 26.70 0.3 A 70 LEU CG C 13 28.55 0.3 A 70 LEU N N 15 125.126 0.3 A 71 TYR H H 1 8.562 0.02 A 71 TYR HA H 1 5.124 0.02 A 71 TYR HBx H 1 2.949 0.02 A 71 TYR HBy H 1 3.038 0.02 A 71 TYR HDx H 1 7.087 0.02 A 71 TYR HDy H 1 7.087 0.02 A 71 TYR C C 13 176.047 0.3 A 71 TYR CA C 13 57.414 0.3 A 71 TYR CB C 13 39.009 0.3 A 71 TYR CDx C 13 133.835 0.3 A 71 TYR CDy C 13 133.835 0.3 A 71 TYR N N 15 120.603 0.3 A 72 VAL HA H 1 5.206 0.02 A 72 VAL HB H 1 2.193 0.02 A 72 VAL HGx% H 1 0.996 0.02 A 72 VAL HGy% H 1 0.996 0.02 A 72 VAL C C 13 174.513 0.3 A 72 VAL CA C 13 60.441 0.3 A 72 VAL CB C 13 36.815 0.3 A 72 VAL CGx C 13 22.006 0.3 A 72 VAL CGy C 13 22.170 0.3 A 73 ASP H H 1 8.837 0.02 A 73 ASP HA H 1 5.256 0.02 A 73 ASP HBy H 1 2.858 0.02 A 73 ASP HBx H 1 2.521 0.02 A 73 ASP C C 13 175.142 0.3 A 73 ASP CA C 13 53.526 0.3 A 73 ASP CB C 13 43.280 0.3 A 73 ASP N N 15 124.564 0.3 A 74 GLN H H 1 9.258 0.02 A 74 GLN HGx H 1 1.735 0.02 A 74 GLN HGy H 1 1.735 0.02 A 74 GLN C C 13 176.423 0.3 A 74 GLN CG C 13 33.050 0.3 A 74 GLN N N 15 122.712 0.3 A 75 ASP H H 1 9.178 0.02 A 75 ASP HA H 1 4.574 0.02 A 75 ASP HBx H 1 2.768 0.02 A 75 ASP HBy H 1 2.768 0.02 A 75 ASP CA C 13 56.984 0.3 A 75 ASP CB C 13 41.147 0.3 A 75 ASP N N 15 125.711 0.3 A 76 ASP H H 1 8.558 0.02 A 76 ASP HA H 1 4.854 0.02 A 76 ASP HBy H 1 2.906 0.02 A 76 ASP HBx H 1 2.686 0.02 A 76 ASP C C 13 176.264 0.3 A 76 ASP CA C 13 52.718 0.3 A 76 ASP CB C 13 41.495 0.3 A 76 ASP N N 15 118.004 0.3 A 77 ASN H H 1 8.762 0.02 A 77 ASN HA H 1 4.476 0.02 A 77 ASN HBy H 1 3.111 0.02 A 77 ASN HBx H 1 2.940 0.02 A 77 ASN HD21 H 1 7.059 0.02 A 77 ASN HD22 H 1 7.775 0.02 A 77 ASN C C 13 175.717 0.3 A 77 ASN CA C 13 54.029 0.3 A 77 ASN CB C 13 38.093 0.3 A 77 ASN CG C 13 176.962 0.3 A 77 ASN N N 15 122.010 0.3 A 77 ASN ND2 N 15 112.160 0.3 A 78 SER H H 1 8.652 0.02 A 78 SER HA H 1 4.454 0.02 A 78 SER HBx H 1 4.077 0.02 A 78 SER HBy H 1 4.094 0.02 A 78 SER C C 13 175.454 0.3 A 78 SER CA C 13 59.928 0.3 A 78 SER CB C 13 63.779 0.3 A 78 SER N N 15 115.171 0.3 A 79 LYS H H 1 7.585 0.02 A 79 LYS C C 13 177.576 0.3 A 79 LYS N N 15 122.422 0.3 A 81 GLU HBx H 1 1.840 0.02 A 81 GLU CB C 13 31.800 0.3 A 82 ILE HA H 1 4.249 0.02 A 82 ILE HB H 1 1.707 0.02 A 82 ILE HD1% H 1 0.263 0.02 A 82 ILE HG1y H 1 1.321 0.02 A 82 ILE HG1x H 1 0.815 0.02 A 82 ILE HG2% H 1 1.001 0.02 A 82 ILE C C 13 175.406 0.3 A 82 ILE CA C 13 61.339 0.3 A 82 ILE CB C 13 39.772 0.3 A 82 ILE CD1 C 13 13.689 0.3 A 82 ILE CG1 C 13 29.020 0.3 A 82 ILE CG2 C 13 18.562 0.3 A 83 SER HA H 1 4.810 0.02 A 83 SER HBy H 1 4.233 0.02 A 83 SER HBx H 1 4.051 0.02 A 83 SER CA C 13 57.751 0.3 A 83 SER CB C 13 65.802 0.3 A 84 SER H H 1 8.642 0.02 A 84 SER HA H 1 4.763 0.02 A 84 SER HBy H 1 4.025 0.02 A 84 SER HBx H 1 3.770 0.02 A 84 SER CA C 13 61.837 0.3 A 84 SER CB C 13 63.129 0.3 A 84 SER N N 15 115.955 0.3 A 85 ILE H H 1 7.654 0.02 A 85 ILE HA H 1 4.393 0.02 A 85 ILE HB H 1 2.055 0.02 A 85 ILE HD1% H 1 1.006 0.02 A 85 ILE HG1y H 1 1.550 0.02 A 85 ILE HG1x H 1 1.387 0.02 A 85 ILE HG2% H 1 1.063 0.02 A 85 ILE CA C 13 62.388 0.3 A 85 ILE CB C 13 38.525 0.3 A 85 ILE CD1 C 13 13.956 0.3 A 85 ILE CG1 C 13 27.932 0.3 A 85 ILE CG2 C 13 18.108 0.3 A 85 ILE N N 15 117.106 0.3 A 87 VAL HA H 1 4.131 0.02 A 87 VAL HB H 1 2.544 0.02 A 87 VAL HG1% H 1 1.018 0.02 A 87 VAL HG2% H 1 1.018 0.02 A 87 VAL C C 13 175.561 0.3 A 87 VAL CA C 13 63.254 0.3 A 87 VAL CB C 13 31.541 0.3 A 87 VAL CG1 C 13 22.156 0.3 A 87 VAL CG2 C 13 22.161 0.3 A 88 LYS H H 1 9.367 0.02 A 88 LYS HA H 1 4.425 0.02 A 88 LYS HBx H 1 1.828 0.02 A 88 LYS HBy H 1 1.972 0.02 A 88 LYS HGy H 1 1.675 0.02 A 88 LYS HGx H 1 1.589 0.02 A 88 LYS C C 13 177.797 0.3 A 88 LYS CA C 13 55.596 0.3 A 88 LYS CB C 13 32.110 0.3 A 88 LYS CG C 13 24.059 0.3 A 88 LYS N N 15 127.381 0.3 A 89 SER H H 1 8.096 0.02 A 89 SER HA H 1 4.727 0.02 A 89 SER HBx H 1 3.995 0.02 A 89 SER HBy H 1 3.995 0.02 A 89 SER C C 13 172.013 0.3 A 89 SER CA C 13 58.160 0.3 A 89 SER CB C 13 64.346 0.3 A 89 SER N N 15 109.772 0.3 A 90 TYR H H 1 8.069 0.02 A 90 TYR HA H 1 5.829 0.02 A 90 TYR HBx H 1 2.876 0.02 A 90 TYR HBy H 1 2.876 0.02 A 90 TYR HDy H 1 6.846 0.02 A 90 TYR HDx H 1 6.838 0.02 A 90 TYR HEx H 1 7.183 0.02 A 90 TYR HEy H 1 7.183 0.02 A 90 TYR C C 13 173.415 0.3 A 90 TYR CA C 13 56.692 0.3 A 90 TYR CB C 13 41.973 0.3 A 90 TYR CDx C 13 133.560 0.3 A 90 TYR CDy C 13 133.570 0.3 A 90 TYR CEx C 13 118.642 0.3 A 90 TYR CEy C 13 118.642 0.3 A 90 TYR N N 15 114.869 0.3 A 91 GLU H H 1 9.388 0.02 A 91 GLU HA H 1 4.879 0.02 A 91 GLU HBy H 1 2.290 0.02 A 91 GLU HBx H 1 2.149 0.02 A 91 GLU HGx H 1 2.380 0.02 A 91 GLU HGy H 1 2.502 0.02 A 91 GLU C C 13 174.385 0.3 A 91 GLU CA C 13 54.348 0.3 A 91 GLU CB C 13 33.170 0.3 A 91 GLU CG C 13 35.559 0.3 A 91 GLU N N 15 117.854 0.3 A 92 GLU H H 1 8.997 0.02 A 92 GLU HA H 1 5.106 0.02 A 92 GLU HBy H 1 2.215 0.02 A 92 GLU HBx H 1 2.067 0.02 A 92 GLU HGy H 1 2.696 0.02 A 92 GLU HGx H 1 2.410 0.02 A 92 GLU C C 13 176.670 0.3 A 92 GLU CA C 13 57.010 0.3 A 92 GLU CB C 13 30.136 0.3 A 92 GLU CG C 13 37.272 0.3 A 92 GLU N N 15 124.075 0.3 A 93 ILE H H 1 8.676 0.02 A 93 ILE HA H 1 4.999 0.02 A 93 ILE HB H 1 2.448 0.02 A 93 ILE HD1% H 1 1.015 0.02 A 93 ILE HG1x H 1 0.993 0.02 A 93 ILE HG1y H 1 1.406 0.02 A 93 ILE HG2% H 1 1.010 0.02 A 93 ILE C C 13 174.255 0.3 A 93 ILE CA C 13 59.716 0.3 A 93 ILE CB C 13 41.554 0.3 A 93 ILE CD1 C 13 14.631 0.3 A 93 ILE CG1 C 13 25.983 0.3 A 93 ILE CG2 C 13 18.361 0.3 A 93 ILE N N 15 120.045 0.3 A 94 GLN H H 1 8.988 0.02 A 94 GLN HA H 1 4.869 0.02 A 94 GLN HBx H 1 2.008 0.02 A 94 GLN HBy H 1 2.533 0.02 A 94 GLN HE21 H 1 7.843 0.02 A 94 GLN HE22 H 1 7.070 0.02 A 94 GLN HGy H 1 2.590 0.02 A 94 GLN HGx H 1 2.572 0.02 A 94 GLN C C 13 177.374 0.3 A 94 GLN CA C 13 53.743 0.3 A 94 GLN CB C 13 30.700 0.3 A 94 GLN CD C 13 180.690 0.3 A 94 GLN CG C 13 34.092 0.3 A 94 GLN N N 15 117.992 0.3 A 94 GLN NE2 N 15 114.224 0.3 A 95 LYS H H 1 9.010 0.02 A 95 LYS HA H 1 3.245 0.02 A 95 LYS HBy H 1 1.851 0.02 A 95 LYS HBx H 1 1.836 0.02 A 95 LYS HDx H 1 1.815 0.02 A 95 LYS HDy H 1 1.815 0.02 A 95 LYS HEx H 1 3.066 0.02 A 95 LYS HEy H 1 3.066 0.02 A 95 LYS HGx H 1 1.180 0.02 A 95 LYS HGy H 1 1.356 0.02 A 95 LYS C C 13 175.814 0.3 A 95 LYS CA C 13 59.730 0.3 A 95 LYS CB C 13 32.231 0.3 A 95 LYS CD C 13 29.709 0.3 A 95 LYS CE C 13 42.100 0.3 A 95 LYS CG C 13 25.002 0.3 A 95 LYS N N 15 122.622 0.3 A 96 ALA H H 1 8.136 0.02 A 96 ALA HA H 1 4.082 0.02 A 96 ALA HB% H 1 1.437 0.02 A 96 ALA C C 13 177.959 0.3 A 96 ALA CA C 13 54.039 0.3 A 96 ALA CB C 13 18.965 0.3 A 96 ALA N N 15 117.133 0.3 A 97 ASP H H 1 7.761 0.02 A 97 ASP HA H 1 4.655 0.02 A 97 ASP HBx H 1 2.955 0.02 A 97 ASP HBy H 1 2.955 0.02 A 97 ASP C C 13 176.159 0.3 A 97 ASP CA C 13 54.868 0.3 A 97 ASP CB C 13 42.331 0.3 A 97 ASP N N 15 115.016 0.3 A 98 LEU H H 1 7.346 0.02 A 98 LEU HA H 1 3.899 0.02 A 98 LEU HBx H 1 0.772 0.02 A 98 LEU HBy H 1 1.659 0.02 A 98 LEU HD1% H 1 0.292 0.02 A 98 LEU HD2% H 1 0.635 0.02 A 98 LEU HG H 1 1.509 0.02 A 98 LEU CA C 13 52.814 0.3 A 98 LEU CB C 13 42.307 0.3 A 98 LEU CD1 C 13 26.01 0.3 A 98 LEU CD2 C 13 23.66 0.3 A 98 LEU CG C 13 26.150 0.3 A 98 LEU N N 15 120.047 0.3 A 99 PRO HA H 1 4.487 0.02 A 99 PRO HBx H 1 1.765 0.02 A 99 PRO HBy H 1 2.591 0.02 A 99 PRO HDx H 1 2.257 0.02 A 99 PRO HDy H 1 3.294 0.02 A 99 PRO HGx H 1 1.637 0.02 A 99 PRO HGy H 1 2.017 0.02 A 99 PRO C C 13 177.368 0.3 A 99 PRO CA C 13 62.493 0.3 A 99 PRO CB C 13 32.279 0.3 A 99 PRO CD C 13 49.637 0.3 A 99 PRO CG C 13 28.294 0.3 A 100 GLU H H 1 8.930 0.02 A 100 GLU HA H 1 3.818 0.02 A 100 GLU HBx H 1 2.082 0.02 A 100 GLU HBy H 1 2.155 0.02 A 100 GLU HGx H 1 2.391 0.02 A 100 GLU HGy H 1 2.391 0.02 A 100 GLU C C 13 178.504 0.3 A 100 GLU CA C 13 60.634 0.3 A 100 GLU CB C 13 29.940 0.3 A 100 GLU CG C 13 35.970 0.3 A 100 GLU N N 15 124.659 0.3 A 101 LYS H H 1 8.922 0.02 A 101 LYS HA H 1 4.154 0.02 A 101 LYS HBy H 1 1.804 0.02 A 101 LYS HBx H 1 1.785 0.02 A 101 LYS HDx H 1 1.870 0.02 A 101 LYS HDy H 1 1.870 0.02 A 101 LYS HEx H 1 3.110 0.02 A 101 LYS HEy H 1 3.110 0.02 A 101 LYS HGx H 1 1.507 0.02 A 101 LYS HGy H 1 1.667 0.02 A 101 LYS C C 13 177.293 0.3 A 101 LYS CA C 13 58.645 0.3 A 101 LYS CB C 13 32.417 0.3 A 101 LYS CD C 13 29.300 0.3 A 101 LYS CE C 13 42.080 0.3 A 101 LYS CG C 13 26.144 0.3 A 101 LYS N N 15 114.802 0.3 A 102 VAL H H 1 7.277 0.02 A 102 VAL HA H 1 3.695 0.02 A 102 VAL HB H 1 1.816 0.02 A 102 VAL HG1% H 1 0.836 0.02 A 102 VAL HG2% H 1 0.800 0.02 A 102 VAL C C 13 176.669 0.3 A 102 VAL CA C 13 63.136 0.3 A 102 VAL CB C 13 32.239 0.3 A 102 VAL CG1 C 13 23.231 0.3 A 102 VAL CG2 C 13 23.145 0.3 A 102 VAL N N 15 114.257 0.3 A 103 LYS H H 1 7.715 0.02 A 103 LYS HA H 1 3.706 0.02 A 103 LYS HBy H 1 1.796 0.02 A 103 LYS HBx H 1 1.795 0.02 A 103 LYS HDx H 1 1.684 0.02 A 103 LYS HDy H 1 1.749 0.02 A 103 LYS HEx H 1 2.986 0.02 A 103 LYS HEy H 1 2.986 0.02 A 103 LYS HGx H 1 1.311 0.02 A 103 LYS HGy H 1 1.428 0.02 A 103 LYS C C 13 178.288 0.3 A 103 LYS CA C 13 60.816 0.3 A 103 LYS CB C 13 32.558 0.3 A 103 LYS CD C 13 29.510 0.3 A 103 LYS CE C 13 42.280 0.3 A 103 LYS CG C 13 25.729 0.3 A 103 LYS N N 15 119.842 0.3 A 104 ASP H H 1 7.946 0.02 A 104 ASP HA H 1 4.540 0.02 A 104 ASP HBx H 1 2.675 0.02 A 104 ASP HBy H 1 2.675 0.02 A 104 ASP C C 13 177.618 0.3 A 104 ASP CA C 13 55.782 0.3 A 104 ASP CB C 13 40.704 0.3 A 104 ASP N N 15 115.582 0.3 A 105 LYS H H 1 7.461 0.02 A 105 LYS HA H 1 3.983 0.02 A 105 LYS HBy H 1 0.985 0.02 A 105 LYS HBx H 1 0.876 0.02 A 105 LYS HDx H 1 1.171 0.02 A 105 LYS HDy H 1 1.322 0.02 A 105 LYS HEx H 1 2.910 0.02 A 105 LYS HEy H 1 3.030 0.02 A 105 LYS HGx H 1 0.419 0.02 A 105 LYS HGy H 1 1.174 0.02 A 105 LYS C C 13 177.401 0.3 A 105 LYS CA C 13 55.715 0.3 A 105 LYS CB C 13 30.925 0.3 A 105 LYS CD C 13 27.438 0.3 A 105 LYS CE C 13 42.233 0.3 A 105 LYS CG C 13 24.077 0.3 A 105 LYS N N 15 116.672 0.3 A 106 PHE H H 1 7.369 0.02 A 106 PHE HA H 1 5.123 0.02 A 106 PHE HBy H 1 3.687 0.02 A 106 PHE HBx H 1 2.854 0.02 A 106 PHE HDx H 1 7.386 0.02 A 106 PHE HDy H 1 7.386 0.02 A 106 PHE HEx H 1 7.506 0.02 A 106 PHE HEy H 1 7.506 0.02 A 106 PHE HZ H 1 7.534 0.02 A 106 PHE C C 13 175.400 0.3 A 106 PHE CA C 13 56.260 0.3 A 106 PHE CB C 13 40.189 0.3 A 106 PHE CDx C 13 131.832 0.3 A 106 PHE CDy C 13 131.832 0.3 A 106 PHE CEx C 13 131.522 0.3 A 106 PHE CEy C 13 131.522 0.3 A 106 PHE CZ C 13 129.151 0.3 A 106 PHE N N 15 116.305 0.3 A 107 THR H H 1 8.026 0.02 A 107 THR HA H 1 4.520 0.02 A 107 THR HB H 1 4.287 0.02 A 107 THR HG2% H 1 1.304 0.02 A 107 THR C C 13 174.160 0.3 A 107 THR CA C 13 62.338 0.3 A 107 THR CB C 13 70.033 0.3 A 107 THR CG2 C 13 21.766 0.3 A 107 THR N N 15 115.523 0.3 A 108 ILE H H 1 8.461 0.02 A 108 ILE HA H 1 4.321 0.02 A 108 ILE HB H 1 1.968 0.02 A 108 ILE HD1% H 1 0.953 0.02 A 108 ILE HG1y H 1 1.601 0.02 A 108 ILE HG1x H 1 1.328 0.02 A 108 ILE HG2% H 1 0.984 0.02 A 108 ILE C C 13 175.757 0.3 A 108 ILE CA C 13 61.097 0.3 A 108 ILE CB C 13 38.810 0.3 A 108 ILE CD1 C 13 13.082 0.3 A 108 ILE CG1 C 13 27.410 0.3 A 108 ILE CG2 C 13 17.628 0.3 A 108 ILE N N 15 125.267 0.3 A 109 LYS H H 1 8.508 0.02 A 109 LYS HA H 1 4.432 0.02 A 109 LYS HBx H 1 1.780 0.02 A 109 LYS HBy H 1 1.870 0.02 A 109 LYS HDx H 1 1.818 0.02 A 109 LYS HDy H 1 1.818 0.02 A 109 LYS C C 13 176.006 0.3 A 109 LYS CA C 13 55.964 0.3 A 109 LYS CB C 13 33.200 0.3 A 109 LYS CD C 13 28.961 0.3 A 109 LYS N N 15 126.763 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 49 ILE HA A 49 ILE HD1% 1.0 1.8 4.99 2 2 A 49 ILE HD1% A 39 ALA HA 1.0 1.8 5.69 3 3 A 49 ILE HD1% A 14 TYR HBy 1.0 1.8 4.39 4 4 A 49 ILE HD1% A 14 TYR HBx 1.0 1.8 4.48 5 5 A 49 ILE HD1% A 87 VAL HG2% 1.0 1.8 3.48 6 6 A 49 ILE HD1% A 39 ALA HB% 1.0 1.8 3.31 7 7 A 49 ILE HD1% A 49 ILE HG2% 1.0 1.8 3.25 8 8 A 49 ILE HD1% A 14 TYR HA 1.0 1.8 5.67 9 9 A 49 ILE HD1% A 16 MET HE% 1.0 1.8 4.09 10 10 A 49 ILE HD1% A 16 MET HBy 1.0 1.8 4.70 11 11 A 49 ILE HD1% A 49 ILE HB 1.0 1.8 3.98 12 12 A 49 ILE HD1% A 16 MET HBx 1.0 1.8 5.49 13 13 A 18 ILE HD1% A 19 LYS H 1.0 1.8 5.40 14 14 A 18 ILE HD1% A 62 LEU HD2% 1.0 1.8 4.54 15 15 A 18 ILE HD1% A 37 LEU HBx 1.0 1.8 5.57 16 16 A 18 ILE HD1% A 37 LEU HD1% 1.0 1.8 3.98 17 17 A 18 ILE HD1% A 62 LEU HBy 1.0 1.8 4.42 18 18 A 18 ILE HD1% A 51 PHE HEx 1.0 1.8 5.26 19 19 A 18 ILE HD1% A 51 PHE HEy 1.0 1.8 5.50 20 20 A 98 LEU HD1% A 106 PHE HEx 1.0 1.8 4.81 21 21 A 98 LEU HD1% A 95 LYS HGx 1.0 1.8 4.30 22 22 A 98 LEU HD1% A 93 ILE HD1% 1.0 1.8 4.11 23 23 A 98 LEU HD1% A 95 LYS HGy 1.0 1.8 4.30 24 24 A 98 LEU HD1% A 67 PHE HBx 1.0 1.8 4.83 25 25 A 98 LEU HD1% A 103 LYS HA 1.0 1.8 3.98 26 26 A 98 LEU HD1% A 98 LEU HA 1.0 1.8 4.80 27 27 A 98 LEU HD1% A 98 LEU HBx 1.0 1.8 3.72 28 28 A 98 LEU HD1% A 103 LYS HBx 1.0 1.8 4.06 29 29 A 98 LEU HD1% A 98 LEU HBy 1.0 1.8 3.74 30 30 A 98 LEU HD1% A 67 PHE HDx 1.0 1.8 4.52 31 31 A 98 LEU HD1% A 97 ASP H 1.0 1.8 5.50 32 32 A 16 MET H A 68 LEU HD1% 1.0 1.8 5.80 33 33 A 68 LEU HD1% A 69 ARG H 1.0 1.8 6.05 34 34 A 51 PHE HEx A 68 LEU HD1% 1.0 1.8 5.90 35 35 A 51 PHE HEy A 68 LEU HD1% 1.0 1.8 6.05 36 36 A 68 LEU HD1% A 67 PHE HA 1.0 1.8 5.65 37 37 A 68 LEU HD1% A 90 TYR HBx 1.0 1.8 4.83 38 38 A 68 LEU HD1% A 92 GLU HA 1.0 1.8 5.26 39 39 A 68 LEU HD1% A 18 ILE HG2% 1.0 1.8 4.83 40 40 A 68 LEU HD1% A 62 LEU HD1% 1.0 1.8 4.42 41 41 A 16 MET HBx A 68 LEU HD1% 1.0 1.8 5.16 42 42 A 68 LEU HD1% A 18 ILE HG1x 1.0 1.8 4.46 43 43 A 16 MET HE% A 68 LEU HD1% 1.0 1.8 4.96 44 44 A 68 LEU HD1% A 18 ILE HG1y 1.0 1.8 4.46 45 45 A 68 LEU HD1% A 51 PHE HZ 1.0 1.8 5.31 46 46 A 13 VAL HG1% A 15 TYR HDy 1.0 1.8 4.79 47 47 A 13 VAL HG1% A 69 ARG HDy 1.0 1.8 4.29 48 48 A 13 VAL HG1% A 13 VAL HA 1.0 1.8 3.45 49 49 A 13 VAL HG1% A 15 TYR HEx 1.0 1.8 3.78 50 50 A 13 VAL HG1% A 13 VAL H 1.0 1.8 4.69 51 51 A 13 VAL HG1% A 71 TYR HDy 1.0 1.8 4.37 52 52 A 13 VAL HG1% A 41 ASP HA 1.0 1.8 5.06 53 53 A 14 TYR HBy A 13 VAL HG1% 1.0 1.8 5.97 54 54 A 18 ILE HG2% A 62 LEU HG 1.0 1.8 6.05 55 55 A 18 ILE HG2% A 18 ILE HA 1.0 1.8 3.97 56 56 A 18 ILE HD1% A 18 ILE HG2% 1.0 1.8 3.48 57 57 A 18 ILE HG2% A 64 LYS HA 1.0 1.8 4.17 58 58 A 62 LEU HBy A 18 ILE HG2% 1.0 1.8 3.83 59 59 A 18 ILE HG2% A 65 TYR H 1.0 1.8 5.20 60 60 A 18 ILE HG2% A 19 LYS HA 1.0 1.8 4.60 61 61 A 19 LYS H A 18 ILE HG2% 1.0 1.8 4.36 62 62 A 18 ILE HG2% A 66 ALA H 1.0 1.8 5.28 63 63 A 18 ILE HG2% A 62 LEU HD1% 1.0 1.8 4.31 64 64 A 49 ILE HG2% A 51 PHE HDx 1.0 1.8 4.55 65 65 A 49 ILE HG2% A 70 LEU HD2% 1.0 1.8 3.71 66 66 A 87 VAL HG2% A 49 ILE HG2% 1.0 1.8 3.07 67 67 A 49 ILE HG2% A 37 LEU H 1.0 1.8 5.32 68 68 A 49 ILE HA A 49 ILE HG2% 1.0 1.8 3.96 69 69 A 49 ILE HG2% A 16 MET HBx 1.0 1.8 5.79 70 70 A 49 ILE HG2% A 16 MET HBy 1.0 1.8 5.13 71 71 A 49 ILE HG2% A 87 VAL HB 1.0 1.8 5.52 72 72 A 98 LEU HD2% A 102 VAL HA 1.0 1.8 6.05 73 73 A 98 LEU HD2% A 99 PRO HDy 1.0 1.8 4.25 74 74 A 98 LEU HD2% A 15 TYR HBy 1.0 1.8 4.48 75 75 A 98 LEU HA A 98 LEU HD2% 1.0 1.8 3.65 76 76 A 98 LEU HD2% A 15 TYR HBx 1.0 1.8 3.93 77 77 A 98 LEU HBx A 98 LEU HD2% 1.0 1.8 3.90 78 78 A 98 LEU HD2% A 102 VAL HB 1.0 1.8 4.21 79 79 A 98 LEU HD2% A 99 PRO HDx 1.0 1.8 4.25 80 80 A 106 PHE HEx A 98 LEU HD2% 1.0 1.8 4.35 81 81 A 15 TYR HDy A 98 LEU HD2% 1.0 1.8 3.76 82 82 A 98 LEU HBy A 98 LEU HD2% 1.0 1.8 3.55 83 83 A 98 LEU HD2% A 102 VAL HG1% 1.0 1.8 3.73 84 84 A 67 PHE HDx A 98 LEU HD2% 1.0 1.8 4.40 85 85 A 93 ILE HD1% A 98 LEU HD2% 1.0 1.8 3.22 86 86 A 68 LEU H A 68 LEU HD2% 1.0 1.8 5.15 87 87 A 69 ARG H A 68 LEU HD2% 1.0 1.8 4.44 88 88 A 68 LEU HD2% A 68 LEU HA 1.0 1.8 3.78 89 89 A 14 TYR HDx A 70 LEU HD1% 1.0 1.8 6.05 90 90 A 92 GLU HA A 68 LEU HD2% 1.0 1.8 3.75 91 91 A 51 PHE HDx A 70 LEU HD1% 1.0 1.8 6.05 92 92 A 70 LEU HD1% A 90 TYR HDy 1.0 1.8 6.05 93 93 A 70 LEU HD1% A 87 VAL HG1% 1.0 1.8 4.69 94 94 A 87 VAL HG2% A 70 LEU HD1% 1.0 1.8 5.15 95 95 A 70 LEU HD1% A 69 ARG HA 1.0 1.8 5.12 96 96 A 70 LEU HD1% A 70 LEU HA 1.0 1.8 5.30 97 97 A 90 TYR HBx A 70 LEU HD1% 1.0 1.8 5.18 98 98 A 70 LEU HD1% A 90 TYR HBy 1.0 1.8 5.92 99 99 A 14 TYR HBx A 70 LEU HD1% 1.0 1.8 5.20 100 100 A 68 LEU H A 70 LEU HD1% 1.0 1.8 5.42 101 101 A 16 MET HE% A 70 LEU HD1% 1.0 1.8 3.67 102 102 A 16 MET HBx A 70 LEU HD1% 1.0 1.8 4.00 103 103 A 14 TYR HBy A 70 LEU HD1% 1.0 1.8 4.75 104 104 A 70 LEU HD1% A 16 MET HA 1.0 1.8 5.21 105 105 A 68 LEU HD2% A 91 GLU HA 1.0 1.8 5.53 106 106 A 98 LEU HBy A 103 LYS H 1.0 1.8 5.54 107 107 A 62 LEU HD1% A 90 TYR HEx 1.0 1.8 6.05 108 108 A 62 LEU HD1% A 62 LEU H 1.0 1.8 5.09 109 109 A 62 LEU HD1% A 62 LEU HBx 1.0 1.8 3.65 110 110 A 62 LEU HBy A 62 LEU HD1% 1.0 1.8 4.02 111 111 A 51 PHE HEy A 62 LEU HD1% 1.0 1.8 3.85 112 112 A 18 ILE HD1% A 62 LEU HD1% 1.0 1.8 3.67 113 113 A 62 LEU HD1% A 51 PHE HDy 1.0 1.8 4.97 114 114 A 101 LYS H A 102 VAL HG2% 1.0 1.8 5.36 115 115 A 102 VAL HG2% A 99 PRO HGy 1.0 1.8 4.59 116 116 A 102 VAL HG2% A 40 TYR HBy 1.0 1.8 4.36 117 117 A 102 VAL HG2% A 42 GLU HA 1.0 1.8 3.75 118 118 A 102 VAL HG2% A 15 TYR HDx 1.0 1.8 3.54 119 119 A 103 LYS H A 102 VAL HG2% 1.0 1.8 4.39 120 120 A 98 LEU HD2% A 102 VAL HG2% 1.0 1.8 3.95 121 121 A 102 VAL HA A 102 VAL HG2% 1.0 1.8 3.58 122 122 A 102 VAL HG2% A 40 TYR HDy 1.0 1.8 5.85 123 123 A 102 VAL HG2% A 40 TYR HDx 1.0 1.8 6.05 124 124 A 102 VAL HG2% A 99 PRO HGx 1.0 1.8 4.59 125 125 A 24 ILE HB A 24 ILE HD1% 1.0 1.8 3.84 126 126 A 24 ILE HD1% A 23 THR HA 1.0 1.8 5.15 127 127 A 24 ILE HD1% A 24 ILE H 1.0 1.8 4.73 128 128 A 24 ILE HD1% A 24 ILE HA 1.0 1.8 3.65 129 129 A 24 ILE HD1% A 25 GLU H 1.0 1.8 4.37 130 130 A 30 ARG HBx A 32 LEU HD2% 1.0 1.8 4.32 131 131 A 32 LEU HD2% A 30 ARG HBy 1.0 1.8 4.54 132 132 A 32 LEU HD2% A 32 LEU HA 1.0 1.8 3.66 133 133 A 103 LYS HBx A 102 VAL HG1% 1.0 1.8 4.15 134 134 A 32 LEU HD2% A 32 LEU HBy 1.0 1.8 3.87 135 135 A 32 LEU HD2% A 32 LEU H 1.0 1.8 4.77 136 136 A 102 VAL HA A 102 VAL HG1% 1.0 1.8 3.81 137 137 A 103 LYS HA A 102 VAL HG1% 1.0 1.8 4.28 138 138 A 32 LEU HD2% A 27 VAL H 1.0 1.8 4.98 139 139 A 102 VAL HG1% A 40 TYR HDx 1.0 1.8 5.59 140 140 A 98 LEU HBx A 102 VAL HG1% 1.0 1.8 4.18 141 141 A 102 VAL HG1% A 40 TYR HBy 1.0 1.8 4.48 142 142 A 106 PHE HEx A 102 VAL HG1% 1.0 1.8 3.81 143 143 A 102 VAL HG1% A 15 TYR HDx 1.0 1.8 4.37 144 144 A 102 VAL HG1% A 102 VAL H 1.0 1.8 4.77 145 145 A 15 TYR HBx A 102 VAL HG1% 1.0 1.8 4.15 146 146 A 98 LEU HD1% A 102 VAL HG1% 1.0 1.8 4.19 147 147 A 24 ILE HG2% A 31 ASN HA 1.0 1.8 4.15 148 148 A 24 ILE HG2% A 25 GLU HA 1.0 1.8 4.36 149 149 A 24 ILE HG2% A 26 LYS H 1.0 1.8 4.86 150 150 A 24 ILE HG2% A 31 ASN HBx 1.0 1.8 4.22 151 151 A 25 GLU H A 24 ILE HG2% 1.0 1.8 3.83 152 152 A 24 ILE HG2% A 24 ILE HG1y 1.0 1.8 3.67 153 153 A 24 ILE HA A 24 ILE HG2% 1.0 1.8 3.87 154 154 A 24 ILE HG2% A 24 ILE HG1x 1.0 1.8 3.63 155 155 A 24 ILE H A 24 ILE HG2% 1.0 1.8 4.37 156 156 A 13 VAL HG2% A 14 TYR H 1.0 1.8 4.75 157 157 A 13 VAL HG2% A 12 ASP HA 1.0 1.8 5.12 158 158 A 13 VAL HG2% A 71 TYR HA 1.0 1.8 5.31 159 159 A 13 VAL H A 13 VAL HG2% 1.0 1.8 3.93 160 160 A 27 VAL H A 32 LEU HD1% 1.0 1.8 4.93 161 161 A 32 LEU HD1% A 26 LYS HA 1.0 1.8 5.93 162 162 A 32 LEU HD1% A 27 VAL HB 1.0 1.8 3.67 163 163 A 32 LEU HBy A 32 LEU HD1% 1.0 1.8 3.76 164 164 A 32 LEU HA A 32 LEU HD1% 1.0 1.8 5.02 165 165 A 105 LYS H A 105 LYS HBx 1.0 1.8 4.60 166 166 A 27 VAL HA A 27 VAL HG2% 1.0 1.8 3.58 167 167 A 6 LEU HA A 6 LEU HD2% 1.0 1.8 4.40 168 168 A 9 ILE HB A 9 ILE HD1% 1.0 1.8 3.81 169 169 A 9 ILE HD1% A 9 ILE H 1.0 1.8 4.86 170 170 A 71 TYR HDy A 69 ARG HGx 1.0 1.8 5.36 171 171 A 9 ILE HG2% A 10 GLY HAx 1.0 1.8 4.64 172 172 A 9 ILE HG2% A 10 GLY HAy 1.0 1.8 5.36 173 173 A 9 ILE H A 9 ILE HG2% 1.0 1.8 4.58 174 174 A 27 VAL H A 27 VAL HG1% 1.0 1.8 4.52 175 175 A 9 ILE HG2% A 9 ILE HG1y 1.0 1.8 3.65 176 176 A 9 ILE HG2% A 9 ILE HG1x 1.0 1.8 3.65 177 177 A 27 VAL HG1% A 28 ASP HBx 1.0 1.8 4.76 178 178 A 27 VAL HG1% A 28 ASP H 1.0 1.8 4.74 179 179 A 108 ILE HB A 108 ILE HD1% 1.0 1.8 3.71 180 180 A 108 ILE HD1% A 106 PHE H 1.0 1.8 5.52 181 181 A 108 ILE HD1% A 106 PHE HDy 1.0 1.8 6.05 182 182 A 102 VAL HA A 105 LYS HBy 1.0 1.8 5.29 183 183 A 67 PHE HBx A 93 ILE HG1x 1.0 1.8 5.14 184 184 A 108 ILE HG2% A 108 ILE HG1y 1.0 1.8 3.63 185 185 A 108 ILE HG2% A 108 ILE H 1.0 1.8 4.58 186 186 A 108 ILE HG2% A 108 ILE HA 1.0 1.8 3.58 187 187 A 108 ILE HG2% A 108 ILE HG1x 1.0 1.8 3.63 188 188 A 14 TYR HEx A 72 VAL HGx% 1.0 1.8 3.45 189 189 A 82 ILE HG2% A 82 ILE HD1% 1.0 1.8 3.71 190 190 A 85 ILE HA A 85 ILE HD1% 1.0 1.8 4.80 191 191 A 93 ILE HD1% A 93 ILE H 1.0 1.8 4.55 192 192 A 93 ILE HD1% A 15 TYR HDy 1.0 1.8 3.79 193 193 A 93 ILE HD1% A 69 ARG H 1.0 1.8 4.81 194 194 A 93 ILE HD1% A 67 PHE HBy 1.0 1.8 4.54 195 195 A 93 ILE HD1% A 68 LEU HA 1.0 1.8 4.85 196 196 A 93 ILE HD1% A 69 ARG HDy 1.0 1.8 4.98 197 197 A 93 ILE HD1% A 97 ASP HBy 1.0 1.8 3.71 198 198 A 93 ILE HD1% A 69 ARG HBy 1.0 1.8 4.65 199 199 A 93 ILE HD1% A 98 LEU HA 1.0 1.8 5.13 200 200 A 87 VAL HG2% A 70 LEU HD2% 1.0 1.8 3.37 201 201 A 93 ILE HD1% A 93 ILE HB 1.0 1.8 3.88 202 202 A 93 ILE HD1% A 69 ARG HDx 1.0 1.8 4.98 203 203 A 93 ILE HD1% A 97 ASP H 1.0 1.8 4.91 204 204 A 93 ILE HD1% A 69 ARG HA 1.0 1.8 4.57 205 205 A 93 ILE HG2% A 69 ARG HBy 1.0 1.8 4.27 206 206 A 93 ILE HG2% A 93 ILE HG1y 1.0 1.8 3.74 207 207 A 69 ARG H A 93 ILE HG2% 1.0 1.8 3.76 208 208 A 87 VAL HG2% A 70 LEU HBx 1.0 1.8 5.08 209 209 A 87 VAL HG1% A 70 LEU HG 1.0 1.8 4.47 210 210 A 15 TYR HDy A 93 ILE HG2% 1.0 1.8 5.36 211 211 A 93 ILE H A 93 ILE HG2% 1.0 1.8 4.30 212 212 A 93 ILE HG2% A 97 ASP HBx 1.0 1.8 4.94 213 213 A 97 ASP HBy A 93 ILE HG2% 1.0 1.8 5.14 214 214 A 15 TYR HEx A 93 ILE HG2% 1.0 1.8 4.96 215 215 A 68 LEU HA A 93 ILE HG2% 1.0 1.8 5.36 216 216 A 87 VAL HG2% A 70 LEU HBy 1.0 1.8 5.08 217 217 A 87 VAL HG1% A 90 TYR HBy 1.0 1.8 3.81 218 218 A 68 LEU H A 93 ILE HG2% 1.0 1.8 6.05 219 219 A 87 VAL HG1% A 90 TYR HDx 1.0 1.8 4.60 220 220 A 93 ILE HD1% A 70 LEU H 1.0 1.8 5.92 221 221 A 62 LEU HD2% A 68 LEU HD1% 1.0 1.8 4.50 222 222 A 62 LEU HD2% A 90 TYR HEx 1.0 1.8 4.94 223 223 A 62 LEU HD2% A 62 LEU HBy 1.0 1.8 3.66 224 224 A 62 LEU HD2% A 18 ILE HB 1.0 1.8 4.91 225 225 A 62 LEU HD2% A 18 ILE H 1.0 1.8 6.05 226 226 A 62 LEU HD2% A 61 LYS H 1.0 1.8 6.05 227 227 A 62 LEU HD2% A 51 PHE HEy 1.0 1.8 5.24 228 228 A 85 ILE HG2% A 85 ILE HG1y 1.0 1.8 4.15 229 229 A 85 ILE HG2% A 85 ILE H 1.0 1.8 4.54 230 230 A 85 ILE HG2% A 85 ILE HG1x 1.0 1.8 4.15 231 231 A 40 TYR HEx A 46 LYS HGx 1.0 1.8 5.64 232 232 A 45 VAL HG1% A 46 LYS HBx 1.0 1.8 4.92 233 233 A 45 VAL HG1% A 45 VAL HA 1.0 1.8 3.25 234 234 A 45 VAL HG2% A 43 ASP HBx 1.0 1.8 3.87 235 235 A 36 THR HG2% A 48 GLN HGx 1.0 1.8 3.78 236 236 A 36 THR HG2% A 36 THR HA 1.0 1.8 3.94 237 237 A 36 THR HG2% A 48 GLN HGy 1.0 1.8 3.78 238 238 A 36 THR HG2% A 37 LEU HA 1.0 1.8 5.19 239 239 A 50 THR HA A 50 THR HG2% 1.0 1.8 4.31 240 240 A 50 THR HG2% A 35 TYR H 1.0 1.8 4.74 241 241 A 50 THR HG2% A 34 ASN HBx 1.0 1.8 5.15 242 242 A 105 LYS H A 105 LYS HDx 1.0 1.8 5.52 243 243 A 40 TYR HEx A 46 LYS HGy 1.0 1.8 5.64 244 244 A 105 LYS HA A 105 LYS HDx 1.0 1.8 4.23 245 245 A 40 TYR HDy A 105 LYS HGx 1.0 1.8 6.05 246 246 A 47 LYS H A 46 LYS HGy 1.0 1.8 4.79 247 247 A 23 THR H A 23 THR HG2% 1.0 1.8 4.63 248 248 A 24 ILE HA A 24 ILE HG1x 1.0 1.8 4.30 249 249 A 24 ILE H A 24 ILE HG1x 1.0 1.8 4.64 250 250 A 9 ILE HA A 9 ILE HG1x 1.0 1.8 4.35 251 251 A 39 ALA HB% A 40 TYR HDx 1.0 1.8 5.39 252 252 A 39 ALA HB% A 48 GLN HA 1.0 1.8 5.53 253 253 A 49 ILE HA A 39 ALA HB% 1.0 1.8 6.05 254 254 A 14 TYR HBy A 39 ALA HB% 1.0 1.8 4.26 255 255 A 14 TYR HBx A 39 ALA HB% 1.0 1.8 3.90 256 256 A 39 ALA HB% A 49 ILE HG2% 1.0 1.8 4.66 257 257 A 39 ALA HB% A 70 LEU HD1% 1.0 1.8 4.97 258 258 A 39 ALA HB% A 38 PRO HA 1.0 1.8 4.43 259 259 A 26 LYS HA A 26 LYS HGx 1.0 1.8 4.65 260 260 A 31 ASN HA A 26 LYS HGx 1.0 1.8 5.17 261 261 A 24 ILE HG2% A 26 LYS HGx 1.0 1.8 5.14 262 262 A 107 THR HA A 107 THR HG2% 1.0 1.8 3.62 263 263 A 106 PHE H A 103 LYS HGy 1.0 1.8 6.05 264 264 A 105 LYS H A 105 LYS HDy 1.0 1.8 5.52 265 265 A 32 LEU H A 26 LYS HGy 1.0 1.8 5.87 266 266 A 90 TYR HDy A 68 LEU HG 1.0 1.8 6.05 267 267 A 27 VAL H A 26 LYS HGy 1.0 1.8 5.18 268 268 A 24 ILE HG2% A 26 LYS HGy 1.0 1.8 5.09 269 269 A 26 LYS HA A 26 LYS HGy 1.0 1.8 4.50 270 270 A 26 LYS H A 26 LYS HGy 1.0 1.8 4.92 271 271 A 54 THR HG2% A 90 TYR HEy 1.0 1.8 4.30 272 272 A 54 THR HG2% A 54 THR HA 1.0 1.8 3.50 273 273 A 90 TYR HDx A 54 THR HG2% 1.0 1.8 5.13 274 274 A 48 GLN H A 47 LYS HGx 1.0 1.8 5.68 275 275 A 85 ILE H A 85 ILE HG1x 1.0 1.8 5.13 276 276 A 68 LEU HA A 93 ILE HG1y 1.0 1.8 5.74 277 277 A 47 LYS H A 47 LYS HGx 1.0 1.8 6.05 278 278 A 47 LYS H A 47 LYS HGy 1.0 1.8 6.05 279 279 A 67 PHE HBx A 93 ILE HG1y 1.0 1.8 4.26 280 280 A 98 LEU HD1% A 103 LYS HGx 1.0 1.8 5.81 281 281 A 98 LEU HBy A 103 LYS HGx 1.0 1.8 5.38 282 282 A 103 LYS HA A 103 LYS HGx 1.0 1.8 4.65 283 283 A 94 GLN H A 96 ALA HB% 1.0 1.8 5.70 284 284 A 96 ALA HB% A 95 LYS H 1.0 1.8 5.95 285 285 A 97 ASP HBx A 96 ALA HB% 1.0 1.8 4.91 286 286 A 96 ALA HB% A 97 ASP HA 1.0 1.8 5.06 287 287 A 96 ALA HB% A 94 GLN HGy 1.0 1.8 4.85 288 288 A 96 ALA HB% A 94 GLN HGx 1.0 1.8 5.06 289 289 A 96 ALA HB% A 94 GLN HBx 1.0 1.8 4.38 290 290 A 37 LEU HD2% A 38 PRO HDy 1.0 1.8 3.97 291 291 A 37 LEU HD2% A 37 LEU HBy 1.0 1.8 4.05 292 292 A 96 ALA HB% A 98 LEU H 1.0 1.8 5.54 293 293 A 48 GLN H A 47 LYS HBy 1.0 1.8 4.74 294 294 A 19 LYS H A 37 LEU HD2% 1.0 1.8 4.82 295 295 A 37 LEU H A 37 LEU HD2% 1.0 1.8 5.29 296 296 A 37 LEU HD1% A 18 ILE HG2% 1.0 1.8 5.01 297 297 A 19 LYS H A 37 LEU HD1% 1.0 1.8 4.69 298 298 A 37 LEU HD1% A 37 LEU HA 1.0 1.8 5.39 299 299 A 37 LEU HBx A 37 LEU HD1% 1.0 1.8 4.10 300 300 A 13 VAL HG1% A 69 ARG HBx 1.0 1.8 5.51 301 301 A 93 ILE HG2% A 69 ARG HBx 1.0 1.8 4.27 302 302 A 93 ILE HD1% A 69 ARG HBx 1.0 1.8 4.65 303 303 A 15 TYR HEx A 69 ARG HBx 1.0 1.8 5.40 304 304 A 70 LEU H A 69 ARG HBx 1.0 1.8 5.67 305 305 A 91 GLU H A 69 ARG HBx 1.0 1.8 6.05 306 306 A 39 ALA HB% A 49 ILE HB 1.0 1.8 4.23 307 307 A 87 VAL HG2% A 49 ILE HB 1.0 1.8 5.30 308 308 A 10 GLY H A 9 ILE HG1y 1.0 1.8 5.92 309 309 A 24 ILE HA A 24 ILE HG1y 1.0 1.8 4.10 310 310 A 85 ILE H A 85 ILE HG1y 1.0 1.8 5.13 311 311 A 25 GLU H A 24 ILE HG1y 1.0 1.8 5.70 312 312 A 88 LYS HA A 88 LYS HGx 1.0 1.8 4.64 313 313 A 88 LYS HGx A 89 SER H 1.0 1.8 5.46 314 314 A 108 ILE HA A 108 ILE HG1y 1.0 1.8 4.19 315 315 A 108 ILE H A 108 ILE HG1y 1.0 1.8 4.88 316 316 A 101 LYS HA A 101 LYS HGy 1.0 1.8 4.25 317 317 A 101 LYS H A 101 LYS HGy 1.0 1.8 4.11 318 318 A 103 LYS H A 103 LYS HDy 1.0 1.8 5.25 319 319 A 72 VAL HA A 88 LYS HGy 1.0 1.8 5.50 320 320 A 32 LEU HBx A 32 LEU HG 1.0 1.8 2.80 321 321 A 26 LYS HA A 26 LYS HDx 1.0 1.8 6.05 322 322 A 26 LYS HA A 26 LYS HDy 1.0 1.8 6.05 323 323 A 103 LYS HA A 103 LYS HDy 1.0 1.8 5.41 324 324 A 32 LEU HD1% A 32 LEU HBx 1.0 1.8 3.74 325 325 A 13 VAL HB A 15 TYR HEy 1.0 1.8 5.12 326 326 A 71 TYR HDy A 13 VAL HB 1.0 1.8 6.05 327 327 A 34 ASN H A 33 ARG HBx 1.0 1.8 5.59 328 328 A 34 ASN H A 33 ARG HBy 1.0 1.8 5.59 329 329 A 42 GLU HA A 13 VAL HB 1.0 1.8 6.05 330 330 A 18 ILE HD1% A 62 LEU HG 1.0 1.8 5.42 331 331 A 13 VAL HB A 42 GLU H 1.0 1.8 5.05 332 332 A 51 PHE HEy A 62 LEU HG 1.0 1.8 5.87 333 333 A 102 VAL HG2% A 101 LYS HBy 1.0 1.8 3.95 334 334 A 103 LYS HBx A 100 GLU HA 1.0 1.8 4.83 335 335 A 103 LYS HBx A 103 LYS H 1.0 1.8 3.47 336 336 A 103 LYS HBx A 98 LEU HD2% 1.0 1.8 6.05 337 337 A 95 LYS H A 95 LYS HDx 1.0 1.8 6.05 338 338 A 95 LYS H A 95 LYS HDy 1.0 1.8 6.05 339 339 A 13 VAL HG1% A 69 ARG HBy 1.0 1.8 5.51 340 340 A 91 GLU H A 69 ARG HBy 1.0 1.8 6.05 341 341 A 24 ILE HB A 25 GLU H 1.0 1.8 4.77 342 342 A 15 TYR HEx A 69 ARG HBy 1.0 1.8 5.40 343 343 A 24 ILE HB A 23 THR HA 1.0 1.8 5.67 344 344 A 24 ILE HB A 25 GLU HA 1.0 1.8 6.05 345 345 A 16 MET HE% A 16 MET HA 1.0 1.8 5.02 346 346 A 39 ALA HA A 16 MET HE% 1.0 1.8 5.59 347 347 A 16 MET HE% A 37 LEU H 1.0 1.8 4.46 348 348 A 16 MET HE% A 49 ILE HB 1.0 1.8 3.29 349 349 A 16 MET HE% A 70 LEU HD2% 1.0 1.8 3.44 350 350 A 49 ILE HG2% A 16 MET HE% 1.0 1.8 3.41 351 351 A 39 ALA HB% A 16 MET HE% 1.0 1.8 3.66 352 352 A 16 MET HE% A 51 PHE HDx 1.0 1.8 4.13 353 353 A 16 MET HE% A 16 MET HBx 1.0 1.8 3.33 354 354 A 16 MET HE% A 16 MET HGx 1.0 1.8 4.46 355 355 A 16 MET HE% A 16 MET HGy 1.0 1.8 4.46 356 356 A 16 MET HE% A 51 PHE HEx 1.0 1.8 4.50 357 357 A 49 ILE HA A 16 MET HE% 1.0 1.8 5.39 358 358 A 16 MET HE% A 90 TYR HBx 1.0 1.8 6.05 359 359 A 16 MET HE% A 90 TYR HBy 1.0 1.8 6.05 360 360 A 47 LYS H A 46 LYS HBy 1.0 1.8 5.57 361 361 A 46 LYS HBx A 47 LYS H 1.0 1.8 5.91 362 362 A 40 TYR HDy A 46 LYS HBy 1.0 1.8 4.95 363 363 A 9 ILE HB A 8 ARG HA 1.0 1.8 6.05 364 364 A 30 ARG HBx A 27 VAL H 1.0 1.8 5.30 365 365 A 30 ARG HBx A 32 LEU HD1% 1.0 1.8 4.51 366 366 A 25 GLU H A 25 GLU HBy 1.0 1.8 4.46 367 367 A 22 GLY H A 21 GLU HBx 1.0 1.8 5.31 368 368 A 108 ILE HB A 107 THR HA 1.0 1.8 5.26 369 369 A 108 ILE HB A 108 ILE H 1.0 1.8 4.13 370 370 A 27 VAL H A 27 VAL HB 1.0 1.8 4.19 371 371 A 26 LYS HA A 27 VAL HB 1.0 1.8 5.36 372 372 A 95 LYS H A 94 GLN HBx 1.0 1.8 3.84 373 373 A 11 LYS HBx A 11 LYS HEx 1.0 1.8 5.79 374 374 A 11 LYS HBx A 11 LYS HEy 1.0 1.8 5.79 375 375 A 48 GLN HA A 48 GLN HGx 1.0 1.8 4.64 376 376 A 48 GLN H A 48 GLN HGx 1.0 1.8 5.24 377 377 A 85 ILE HD1% A 85 ILE HB 1.0 1.8 4.15 378 378 A 85 ILE H A 85 ILE HB 1.0 1.8 4.46 379 379 A 18 ILE HB A 66 ALA HB% 1.0 1.8 5.18 380 380 A 68 LEU HD2% A 92 GLU HBx 1.0 1.8 4.80 381 381 A 39 ALA HB% A 16 MET HBx 1.0 1.8 4.75 382 382 A 99 PRO HA A 100 GLU HBy 1.0 1.8 5.60 383 383 A 27 VAL HG2% A 25 GLU HGx 1.0 1.8 4.19 384 384 A 25 GLU H A 25 GLU HGx 1.0 1.8 5.51 385 385 A 99 PRO HA A 100 GLU HBx 1.0 1.8 5.08 386 386 A 14 TYR HDx A 72 VAL HB 1.0 1.8 6.04 387 387 A 14 TYR HEx A 72 VAL HB 1.0 1.8 6.05 388 388 A 72 VAL HB A 73 ASP H 1.0 1.8 4.66 389 389 A 72 VAL HB A 88 LYS H 1.0 1.8 5.78 390 390 A 25 GLU H A 25 GLU HGy 1.0 1.8 5.51 391 391 A 25 GLU HA A 25 GLU HGy 1.0 1.8 4.49 392 392 A 27 VAL HG2% A 25 GLU HGy 1.0 1.8 4.19 393 393 A 68 LEU HD2% A 92 GLU HBy 1.0 1.8 4.80 394 394 A 48 GLN HA A 48 GLN HGy 1.0 1.8 4.64 395 395 A 49 ILE H A 48 GLN HGy 1.0 1.8 4.93 396 396 A 14 TYR HBy A 70 LEU HD2% 1.0 1.8 5.74 397 397 A 14 TYR HBy A 87 VAL HG2% 1.0 1.8 5.12 398 398 A 15 TYR HDx A 99 PRO HDx 1.0 1.8 5.65 399 399 A 98 LEU HBy A 99 PRO HDx 1.0 1.8 4.95 400 400 A 37 LEU HD2% A 38 PRO HGx 1.0 1.8 5.32 401 401 A 48 GLN HA A 38 PRO HBx 1.0 1.8 5.27 402 402 A 37 LEU HA A 38 PRO HGx 1.0 1.8 5.14 403 403 A 39 ALA H A 38 PRO HGx 1.0 1.8 6.05 404 404 A 21 GLU HA A 21 GLU HGx 1.0 1.8 4.55 405 405 A 21 GLU H A 21 GLU HGx 1.0 1.8 5.04 406 406 A 42 GLU H A 42 GLU HGx 1.0 1.8 5.12 407 407 A 43 ASP H A 42 GLU HGx 1.0 1.8 5.69 408 408 A 103 LYS HGy A 100 GLU HGx 1.0 1.8 5.84 409 409 A 103 LYS HGy A 100 GLU HGy 1.0 1.8 6.05 410 410 A 100 GLU HBx A 100 GLU HGy 1.0 1.8 3.09 411 411 A 103 LYS HDy A 100 GLU HGy 1.0 1.8 4.54 412 412 A 21 GLU HA A 21 GLU HGy 1.0 1.8 4.55 413 413 A 101 LYS HA A 100 GLU HGx 1.0 1.8 5.17 414 414 A 21 GLU H A 21 GLU HGy 1.0 1.8 5.04 415 415 A 14 TYR HEy A 41 ASP HBx 1.0 1.8 6.05 416 416 A 14 TYR HDy A 41 ASP HBx 1.0 1.8 6.05 417 417 A 39 ALA H A 38 PRO HGy 1.0 1.8 6.05 418 418 A 37 LEU HD2% A 38 PRO HGy 1.0 1.8 5.32 419 419 A 37 LEU HA A 38 PRO HGy 1.0 1.8 5.14 420 420 A 92 GLU HA A 92 GLU HGx 1.0 1.8 4.35 421 421 A 66 ALA HB% A 92 GLU HGx 1.0 1.8 4.93 422 422 A 93 ILE HG2% A 92 GLU HGx 1.0 1.8 6.05 423 423 A 93 ILE HG1x A 92 GLU HGx 1.0 1.8 6.05 424 424 A 92 GLU H A 92 GLU HGx 1.0 1.8 5.30 425 425 A 68 LEU HD2% A 92 GLU HGx 1.0 1.8 4.32 426 426 A 43 ASP H A 42 GLU HGy 1.0 1.8 5.69 427 427 A 42 GLU H A 42 GLU HGy 1.0 1.8 5.12 428 428 A 93 ILE HB A 97 ASP HBx 1.0 1.8 4.22 429 429 A 97 ASP HBy A 93 ILE HB 1.0 1.8 4.49 430 430 A 35 TYR H A 34 ASN HBy 1.0 1.8 5.12 431 431 A 50 THR HG2% A 34 ASN HBy 1.0 1.8 5.15 432 432 A 92 GLU H A 91 GLU HGy 1.0 1.8 5.81 433 433 A 74 GLN H A 73 ASP HBx 1.0 1.8 5.24 434 434 A 97 ASP H A 94 GLN HBy 1.0 1.8 5.57 435 435 A 88 LYS HGy A 73 ASP HBx 1.0 1.8 5.03 436 436 A 94 GLN HBy A 96 ALA H 1.0 1.8 5.12 437 437 A 96 ALA HB% A 94 GLN HBy 1.0 1.8 5.48 438 438 A 94 GLN H A 94 GLN HBy 1.0 1.8 4.22 439 439 A 32 LEU H A 31 ASN HBx 1.0 1.8 5.20 440 440 A 94 GLN HGy A 96 ALA H 1.0 1.8 4.93 441 441 A 94 GLN HGy A 94 GLN HA 1.0 1.8 4.04 442 442 A 93 ILE HG2% A 94 GLN HGy 1.0 1.8 6.05 443 443 A 93 ILE HD1% A 94 GLN HGy 1.0 1.8 6.05 444 444 A 101 LYS HBx A 104 ASP HBx 1.0 1.8 5.51 445 445 A 101 LYS HA A 104 ASP HBx 1.0 1.8 4.66 446 446 A 76 ASP H A 76 ASP HBx 1.0 1.8 4.38 447 447 A 68 LEU HD2% A 92 GLU HGy 1.0 1.8 4.32 448 448 A 93 ILE HG2% A 92 GLU HGy 1.0 1.8 6.05 449 449 A 93 ILE HG1x A 92 GLU HGy 1.0 1.8 6.05 450 450 A 92 GLU HA A 92 GLU HGy 1.0 1.8 4.35 451 451 A 66 ALA HB% A 92 GLU HGy 1.0 1.8 4.93 452 452 A 27 VAL HG1% A 28 ASP HBy 1.0 1.8 3.96 453 453 A 67 PHE HBy A 93 ILE HG1y 1.0 1.8 4.59 454 454 A 93 ILE HG1x A 67 PHE HBy 1.0 1.8 4.58 455 455 A 98 LEU HD2% A 67 PHE HBy 1.0 1.8 4.80 456 456 A 14 TYR HBx A 40 TYR HA 1.0 1.8 5.73 457 457 A 14 TYR HBx A 40 TYR H 1.0 1.8 4.50 458 458 A 13 VAL H A 12 ASP HBx 1.0 1.8 5.17 459 459 A 105 LYS HBy A 106 PHE HBy 1.0 1.8 5.13 460 460 A 88 LYS HGy A 73 ASP HBy 1.0 1.8 5.03 461 461 A 74 GLN H A 73 ASP HBy 1.0 1.8 5.24 462 462 A 90 TYR HBx A 70 LEU HD2% 1.0 1.8 5.72 463 463 A 70 LEU HD2% A 90 TYR HBy 1.0 1.8 5.97 464 464 A 105 LYS HGy A 105 LYS HEx 1.0 1.8 4.42 465 465 A 24 ILE HG2% A 31 ASN HBy 1.0 1.8 4.22 466 466 A 32 LEU H A 31 ASN HBy 1.0 1.8 5.20 467 467 A 97 ASP HBx A 94 GLN HGx 1.0 1.8 6.05 468 468 A 45 VAL HG2% A 43 ASP HBy 1.0 1.8 3.87 469 469 A 44 GLY H A 43 ASP HBy 1.0 1.8 4.71 470 470 A 15 TYR HBx A 102 VAL HG2% 1.0 1.8 4.62 471 471 A 103 LYS HGx A 103 LYS HEx 1.0 1.8 3.90 472 472 A 103 LYS HGx A 103 LYS HEy 1.0 1.8 3.90 473 473 A 26 LYS HBy A 26 LYS HEx 1.0 1.8 3.99 474 474 A 26 LYS HBy A 26 LYS HEy 1.0 1.8 3.99 475 475 A 105 LYS HGy A 105 LYS HEy 1.0 1.8 4.42 476 476 A 89 SER H A 71 TYR HBy 1.0 1.8 5.06 477 477 A 71 TYR HBy A 71 TYR H 1.0 1.8 4.61 478 478 A 102 VAL HG2% A 40 TYR HBx 1.0 1.8 4.05 479 479 A 40 TYR HDy A 40 TYR HBx 1.0 1.8 3.85 480 480 A 15 TYR HBx A 40 TYR HBx 1.0 1.8 5.47 481 481 A 13 VAL HG1% A 69 ARG HDx 1.0 1.8 4.29 482 482 A 15 TYR HEx A 69 ARG HDx 1.0 1.8 4.55 483 483 A 101 LYS HA A 101 LYS HEx 1.0 1.8 5.74 484 484 A 101 LYS HA A 101 LYS HEy 1.0 1.8 5.74 485 485 A 93 ILE HD1% A 15 TYR HBy 1.0 1.8 4.44 486 486 A 14 TYR HEy A 41 ASP HBy 1.0 1.8 6.05 487 487 A 14 TYR HDy A 41 ASP HBy 1.0 1.8 6.05 488 488 A 41 ASP H A 41 ASP HBy 1.0 1.8 4.31 489 489 A 52 ARG HDx A 53 SER H 1.0 1.8 6.05 490 490 A 53 SER H A 52 ARG HDy 1.0 1.8 6.05 491 491 A 98 LEU HD2% A 95 LYS HA 1.0 1.8 4.93 492 492 A 95 LYS HA A 95 LYS HGx 1.0 1.8 4.26 493 493 A 95 LYS HA A 95 LYS HGy 1.0 1.8 4.26 494 494 A 95 LYS HA A 98 LEU HG 1.0 1.8 3.89 495 495 A 98 LEU HD1% A 95 LYS HA 1.0 1.8 3.78 496 496 A 97 ASP H A 95 LYS HA 1.0 1.8 4.91 497 497 A 67 PHE HDx A 95 LYS HA 1.0 1.8 5.84 498 498 A 98 LEU HBy A 99 PRO HDy 1.0 1.8 4.95 499 499 A 15 TYR HDx A 99 PRO HDy 1.0 1.8 5.65 500 500 A 3 ARG HA A 3 ARG HDx 1.0 1.8 5.93 501 501 A 3 ARG HA A 3 ARG HDy 1.0 1.8 5.93 502 502 A 40 TYR HDy A 44 GLY HAy 1.0 1.8 5.20 503 503 A 45 VAL HG2% A 44 GLY HAy 1.0 1.8 5.62 504 504 A 101 LYS HBx A 44 GLY HAy 1.0 1.8 5.98 505 505 A 101 LYS HBy A 44 GLY HAy 1.0 1.8 6.05 506 506 A 102 VAL HA A 44 GLY HAy 1.0 1.8 5.31 507 507 A 102 VAL HG2% A 44 GLY HAy 1.0 1.8 4.76 508 508 A 40 TYR HBy A 44 GLY HAy 1.0 1.8 5.20 509 509 A 40 TYR HBx A 44 GLY HAy 1.0 1.8 4.72 510 510 A 67 PHE HDx A 106 PHE HBx 1.0 1.8 6.05 511 511 A 98 LEU HD1% A 106 PHE HBx 1.0 1.8 6.05 512 512 A 28 ASP HBx A 29 GLY HAx 1.0 1.8 5.63 513 513 A 108 ILE HD1% A 106 PHE HBx 1.0 1.8 5.85 514 514 A 106 PHE HDy A 106 PHE HBx 1.0 1.8 4.04 515 515 A 29 GLY HAx A 26 LYS HDx 1.0 1.8 5.73 516 516 A 29 GLY HAx A 26 LYS HDy 1.0 1.8 5.73 517 517 A 102 VAL HA A 105 LYS HGy 1.0 1.8 4.97 518 518 A 102 VAL HA A 105 LYS HGx 1.0 1.8 4.25 519 519 A 103 LYS HA A 98 LEU HD2% 1.0 1.8 6.05 520 520 A 103 LYS HA A 105 LYS HBy 1.0 1.8 6.05 521 521 A 102 VAL HA A 101 LYS HA 1.0 1.8 5.42 522 522 A 103 LYS HA A 106 PHE HDx 1.0 1.8 4.70 523 523 A 103 LYS HA A 98 LEU HBx 1.0 1.8 4.92 524 524 A 103 LYS HA A 103 LYS HGy 1.0 1.8 4.11 525 525 A 37 LEU HD1% A 18 ILE HA 1.0 1.8 3.89 526 526 A 84 SER H A 84 SER HBx 1.0 1.8 4.48 527 527 A 101 LYS HA A 100 GLU HA 1.0 1.8 5.56 528 528 A 103 LYS HGx A 100 GLU HA 1.0 1.8 4.49 529 529 A 100 GLU HA A 103 LYS HDx 1.0 1.8 3.82 530 530 A 102 VAL H A 100 GLU HA 1.0 1.8 5.24 531 531 A 103 LYS HDy A 100 GLU HA 1.0 1.8 4.09 532 532 A 100 GLU HA A 100 GLU HGy 1.0 1.8 3.98 533 533 A 103 LYS HGy A 100 GLU HA 1.0 1.8 4.76 534 534 A 103 LYS H A 100 GLU HA 1.0 1.8 4.58 535 535 A 100 GLU HA A 99 PRO HA 1.0 1.8 5.02 536 536 A 98 LEU HA A 99 PRO HDx 1.0 1.8 4.04 537 537 A 98 LEU HA A 102 VAL HB 1.0 1.8 4.81 538 538 A 98 LEU HA A 99 PRO HDy 1.0 1.8 4.04 539 539 A 37 LEU HA A 38 PRO HDy 1.0 1.8 3.93 540 540 A 37 LEU HBx A 38 PRO HDy 1.0 1.8 4.17 541 541 A 38 PRO HDy A 37 LEU HBy 1.0 1.8 4.68 542 542 A 45 VAL HA A 46 LYS HBy 1.0 1.8 5.50 543 543 A 46 LYS HBx A 45 VAL HA 1.0 1.8 6.02 544 544 A 10 GLY HAx A 11 LYS HA 1.0 1.8 5.92 545 545 A 10 GLY HAy A 11 LYS HA 1.0 1.8 6.05 546 546 A 45 VAL HA A 45 VAL HG2% 1.0 1.8 3.66 547 547 A 5 SER H A 5 SER HBx 1.0 1.8 4.33 548 548 A 42 GLU HA A 99 PRO HGy 1.0 1.8 4.99 549 549 A 10 GLY HAx A 11 LYS HDx 1.0 1.8 5.68 550 550 A 42 GLU HA A 99 PRO HGx 1.0 1.8 4.99 551 551 A 10 GLY HAx A 11 LYS HBy 1.0 1.8 5.32 552 552 A 42 GLU HA A 15 TYR HDx 1.0 1.8 5.10 553 553 A 42 GLU HA A 42 GLU HGx 1.0 1.8 4.52 554 554 A 42 GLU HA A 42 GLU HGy 1.0 1.8 4.52 555 555 A 105 LYS HA A 105 LYS HEy 1.0 1.8 5.38 556 556 A 105 LYS HA A 105 LYS HDy 1.0 1.8 4.23 557 557 A 105 LYS HA A 105 LYS HGx 1.0 1.8 3.69 558 558 A 105 LYS HA A 105 LYS HEx 1.0 1.8 5.38 559 559 A 105 LYS HA A 105 LYS HGy 1.0 1.8 4.60 560 560 A 37 LEU HBy A 38 PRO HDx 1.0 1.8 4.87 561 561 A 5 SER H A 5 SER HBy 1.0 1.8 4.33 562 562 A 49 ILE HG2% A 50 THR HB 1.0 1.8 5.30 563 563 A 37 LEU HBx A 38 PRO HDx 1.0 1.8 5.27 564 564 A 37 LEU HD2% A 38 PRO HDx 1.0 1.8 4.11 565 565 A 84 SER H A 84 SER HBy 1.0 1.8 4.48 566 566 A 84 SER H A 83 SER HBx 1.0 1.8 4.70 567 567 A 82 ILE HG2% A 83 SER HBx 1.0 1.8 5.69 568 568 A 95 LYS H A 96 ALA HA 1.0 1.8 6.05 569 569 A 96 ALA HA A 103 LYS HEx 1.0 1.8 5.96 570 570 A 96 ALA HA A 103 LYS HEy 1.0 1.8 5.96 571 571 A 98 LEU HBx A 96 ALA HA 1.0 1.8 5.78 572 572 A 96 ALA HA A 95 LYS HBy 1.0 1.8 6.05 573 573 A 96 ALA HA A 95 LYS HBx 1.0 1.8 6.05 574 574 A 73 ASP H A 87 VAL HA 1.0 1.8 5.36 575 575 A 88 LYS HGx A 87 VAL HA 1.0 1.8 5.19 576 576 A 87 VAL HG1% A 87 VAL HA 1.0 1.8 3.65 577 577 A 87 VAL HG2% A 87 VAL HA 1.0 1.8 3.97 578 578 A 49 ILE HG2% A 87 VAL HA 1.0 1.8 6.05 579 579 A 102 VAL HG2% A 101 LYS HA 1.0 1.8 6.05 580 580 A 101 LYS HA A 101 LYS HGx 1.0 1.8 4.25 581 581 A 10 GLY HAx A 9 ILE HA 1.0 1.8 5.47 582 582 A 10 GLY HAy A 9 ILE HA 1.0 1.8 5.83 583 583 A 9 ILE HA A 9 ILE HG1y 1.0 1.8 4.35 584 584 A 9 ILE HG2% A 9 ILE HA 1.0 1.8 3.55 585 585 A 9 ILE HD1% A 9 ILE HA 1.0 1.8 3.97 586 586 A 82 ILE HG2% A 83 SER HBy 1.0 1.8 5.69 587 587 A 67 PHE HBx A 66 ALA HA 1.0 1.8 5.47 588 588 A 82 ILE HD1% A 82 ILE HA 1.0 1.8 5.19 589 589 A 26 LYS HBy A 29 GLY HAy 1.0 1.8 4.95 590 590 A 40 TYR HBx A 44 GLY HAx 1.0 1.8 5.04 591 591 A 82 ILE HG2% A 82 ILE HA 1.0 1.8 3.63 592 592 A 82 ILE HA A 82 ILE HG1x 1.0 1.8 4.49 593 593 A 82 ILE HA A 82 ILE HG1y 1.0 1.8 4.49 594 594 A 108 ILE H A 107 THR HB 1.0 1.8 5.08 595 595 A 26 LYS HA A 27 VAL HA 1.0 1.8 5.13 596 596 A 27 VAL HA A 27 VAL HG1% 1.0 1.8 3.16 597 597 A 27 VAL HA A 26 LYS HBy 1.0 1.8 5.09 598 598 A 108 ILE HA A 108 ILE HG1x 1.0 1.8 4.19 599 599 A 9 ILE H A 8 ARG HA 1.0 1.8 3.40 600 600 A 8 ARG HA A 7 ASN H 1.0 1.8 6.04 601 601 A 62 LEU HD1% A 62 LEU HA 1.0 1.8 4.71 602 602 A 62 LEU HG A 62 LEU HA 1.0 1.8 4.11 603 603 A 62 LEU HD2% A 62 LEU HA 1.0 1.8 3.64 604 604 A 85 ILE HA A 85 ILE HG1y 1.0 1.8 4.49 605 605 A 85 ILE HA A 85 ILE HG2% 1.0 1.8 3.63 606 606 A 85 ILE HA A 85 ILE HG1x 1.0 1.8 4.49 607 607 A 6 LEU HA A 6 LEU HD1% 1.0 1.8 4.40 608 608 A 19 LYS HA A 19 LYS HGx 1.0 1.8 4.68 609 609 A 37 LEU HD1% A 19 LYS HA 1.0 1.8 5.22 610 610 A 19 LYS HA A 37 LEU HD2% 1.0 1.8 5.68 611 611 A 19 LYS HA A 19 LYS HGy 1.0 1.8 4.68 612 612 A 108 ILE H A 107 THR HA 1.0 1.8 3.88 613 613 A 104 ASP HA A 104 ASP HBy 1.0 1.8 3.21 614 614 A 25 GLU HA A 25 GLU HGx 1.0 1.8 4.49 615 615 A 23 THR HA A 23 THR HG2% 1.0 1.8 3.54 616 616 A 23 THR HA A 24 ILE HG1y 1.0 1.8 4.59 617 617 A 49 ILE HA A 37 LEU H 1.0 1.8 5.80 618 618 A 48 GLN HA A 49 ILE H 1.0 1.8 3.65 619 619 A 68 LEU HA A 69 ARG HA 1.0 1.8 5.09 620 620 A 93 ILE HG2% A 93 ILE HA 1.0 1.8 3.47 621 621 A 41 ASP HA A 14 TYR HDy 1.0 1.8 5.12 622 622 A 41 ASP HA A 15 TYR HEy 1.0 1.8 5.44 623 623 A 24 ILE HG2% A 26 LYS HA 1.0 1.8 4.83 624 624 A 26 LYS HA A 27 VAL HG2% 1.0 1.8 5.10 625 625 A 26 LYS HA A 30 ARG H 1.0 1.8 4.49 626 626 A 27 VAL H A 26 LYS HA 1.0 1.8 3.71 627 627 A 32 LEU H A 31 ASN HA 1.0 1.8 3.66 628 628 A 92 GLU HA A 93 ILE HG2% 1.0 1.8 4.52 629 629 A 92 GLU HA A 93 ILE HG1x 1.0 1.8 4.97 630 630 A 87 VAL HG1% A 71 TYR HA 1.0 1.8 4.63 631 631 A 13 VAL HG1% A 71 TYR HA 1.0 1.8 4.96 632 632 A 14 TYR H A 71 TYR HA 1.0 1.8 4.47 633 633 A 106 PHE HDy A 106 PHE HA 1.0 1.8 3.51 634 634 A 88 LYS HGx A 72 VAL HA 1.0 1.8 4.69 635 635 A 72 VAL HGx% A 72 VAL HA 1.0 1.8 3.99 636 636 A 72 VAL HA A 72 VAL HGy% 1.0 1.8 4.18 637 637 A 39 ALA HA A 40 TYR HDx 1.0 1.8 4.37 638 638 A 72 VAL HA A 87 VAL HA 1.0 1.8 4.17 639 639 A 37 LEU HA A 38 PRO HDx 1.0 1.8 3.62 640 640 A 37 LEU HA A 37 LEU HD2% 1.0 1.8 3.62 641 641 A 72 VAL HGx% A 73 ASP HA 1.0 1.8 5.61 642 642 A 72 VAL HGy% A 73 ASP HA 1.0 1.8 5.80 643 643 A 92 GLU HA A 68 LEU HA 1.0 1.8 4.08 644 644 A 68 LEU HA A 93 ILE HG1x 1.0 1.8 4.51 645 645 A 68 LEU HD1% A 68 LEU HA 1.0 1.8 4.97 646 646 A 67 PHE HA A 93 ILE HG1x 1.0 1.8 6.05 647 647 A 93 ILE HD1% A 67 PHE HA 1.0 1.8 6.05 648 648 A 67 PHE HA A 17 GLN HA 1.0 1.8 4.66 649 649 A 67 PHE HDx A 67 PHE HA 1.0 1.8 4.66 650 650 A 67 PHE HA A 68 LEU HD2% 1.0 1.8 6.01 651 651 A 67 PHE HA A 98 LEU HD2% 1.0 1.8 6.05 652 652 A 34 ASN HA A 52 ARG HA 1.0 1.8 5.07 653 653 A 36 THR HA A 50 THR HA 1.0 1.8 4.58 654 654 A 69 ARG HA A 15 TYR HA 1.0 1.8 4.59 655 655 A 15 TYR HDy A 15 TYR HA 1.0 1.8 4.43 656 656 A 70 LEU HD1% A 15 TYR HA 1.0 1.8 4.55 657 657 A 90 TYR HDy A 90 TYR HA 1.0 1.8 5.09 658 658 A 90 TYR HDx A 90 TYR HA 1.0 1.8 5.46 659 659 A 70 LEU HG A 90 TYR HA 1.0 1.8 4.84 660 660 A 70 LEU HA A 90 TYR HA 1.0 1.8 4.27 661 661 A 49 ILE HA A 50 THR HA 1.0 1.8 5.25 662 662 A 40 TYR HEx A 40 TYR HA 1.0 1.8 5.73 663 663 A 14 TYR HDy A 40 TYR HA 1.0 1.8 4.92 664 664 A 40 TYR HA A 46 LYS HA 1.0 1.8 4.69 665 665 A 102 VAL HA A 105 LYS HBx 1.0 1.8 4.53 666 666 A 13 VAL HG1% A 69 ARG HGx 1.0 1.8 3.49 667 667 A 13 VAL HG1% A 69 ARG HGy 1.0 1.8 3.67 668 668 A 14 TYR HBx A 70 LEU HBy 1.0 1.8 6.05 669 669 A 14 TYR HBx A 70 LEU HBx 1.0 1.8 6.05 670 670 A 105 LYS HBy A 40 TYR HEx 1.0 1.8 5.96 671 671 A 108 ILE HD1% A 108 ILE HA 1.0 1.8 4.03 672 672 A 72 VAL HGx% A 12 ASP HBx 1.0 1.8 4.16 673 673 A 72 VAL HGx% A 12 ASP HBy 1.0 1.8 4.16 674 674 A 18 ILE HD1% A 18 ILE HA 1.0 1.8 3.85 675 675 A 66 ALA H A 66 ALA HB% 1.0 1.8 3.62 676 676 A 18 ILE HG2% A 37 LEU HD2% 1.0 1.8 5.54 677 677 A 18 ILE HD1% A 37 LEU HD2% 1.0 1.8 5.68 678 678 A 40 TYR HDy A 45 VAL HG1% 1.0 1.8 6.01 679 679 A 98 LEU HBy A 102 VAL HB 1.0 1.8 4.23 680 680 A 102 VAL HG1% A 106 PHE HDx 1.0 1.8 4.13 681 681 A 102 VAL HG2% A 106 PHE HDx 1.0 1.8 4.72 682 682 A 105 LYS HBy A 105 LYS HEy 1.0 1.8 4.31 683 683 A 105 LYS HBy A 105 LYS HEx 1.0 1.8 4.31 684 684 A 62 LEU HD2% A 51 PHE HDy 1.0 1.8 5.75 685 685 A 40 TYR HEx A 44 GLY HAx 1.0 1.8 6.05 686 686 A 40 TYR HDy A 105 LYS HGy 1.0 1.8 4.70 687 687 A 106 PHE HEx A 15 TYR HBx 1.0 1.8 4.66 688 688 A 18 ILE HD1% A 51 PHE HZ 1.0 1.8 3.89 689 689 A 62 LEU HD1% A 51 PHE HZ 1.0 1.8 4.10 690 690 A 62 LEU HD2% A 51 PHE HZ 1.0 1.8 6.05 691 691 A 13 VAL HA A 14 TYR HDx 1.0 1.8 4.36 692 692 A 71 TYR HDy A 13 VAL HG2% 1.0 1.8 3.51 693 693 A 14 TYR HBx A 14 TYR HDy 1.0 1.8 3.93 694 694 A 14 TYR HBy A 14 TYR HDx 1.0 1.8 3.89 695 695 A 16 MET HA A 106 PHE HZ 1.0 1.8 4.15 696 696 A 40 TYR HDx A 38 PRO HBy 1.0 1.8 5.14 697 697 A 38 PRO HBy A 40 TYR HEy 1.0 1.8 4.00 698 698 A 40 TYR HEx A 46 LYS HBy 1.0 1.8 4.16 699 699 A 39 ALA HA A 40 TYR HEy 1.0 1.8 4.94 700 700 A 39 ALA HB% A 14 TYR HDy 1.0 1.8 4.06 701 701 A 40 TYR HDy A 40 TYR HA 1.0 1.8 3.90 702 702 A 15 TYR HDx A 40 TYR HBx 1.0 1.8 5.38 703 703 A 40 TYR HBy A 40 TYR HDx 1.0 1.8 3.56 704 704 A 40 TYR HBy A 40 TYR HEy 1.0 1.8 5.29 705 705 A 42 GLU HA A 15 TYR HEy 1.0 1.8 4.39 706 706 A 40 TYR HDy A 44 GLY HAx 1.0 1.8 4.64 707 707 A 40 TYR HDy A 46 LYS HA 1.0 1.8 3.88 708 708 A 49 ILE HD1% A 14 TYR HDy 1.0 1.8 4.36 709 709 A 62 LEU HD1% A 35 TYR HEy 1.0 1.8 5.63 710 710 A 40 TYR HDx A 106 PHE HZ 1.0 1.8 4.43 711 711 A 68 LEU HD1% A 90 TYR HDy 1.0 1.8 4.22 712 712 A 68 LEU HD2% A 90 TYR HDy 1.0 1.8 3.75 713 713 A 68 LEU HD2% A 90 TYR HEx 1.0 1.8 4.76 714 714 A 15 TYR HEx A 69 ARG HDy 1.0 1.8 4.55 715 715 A 15 TYR HEx A 69 ARG HGy 1.0 1.8 3.33 716 716 A 71 TYR HDy A 71 TYR HA 1.0 1.8 3.93 717 717 A 14 TYR HDx A 72 VAL HGx% 1.0 1.8 4.23 718 718 A 62 LEU HD2% A 90 TYR HDy 1.0 1.8 5.35 719 719 A 88 LYS HGx A 71 TYR HDx 1.0 1.8 5.24 720 720 A 40 TYR HDy A 45 VAL HA 1.0 1.8 5.18 721 721 A 90 TYR HDy A 90 TYR H 1.0 1.8 5.21 722 722 A 90 TYR HA A 71 TYR HDx 1.0 1.8 4.97 723 723 A 90 TYR HBx A 90 TYR HDy 1.0 1.8 3.62 724 724 A 90 TYR HBy A 90 TYR HDx 1.0 1.8 3.93 725 725 A 90 TYR HDy A 91 GLU H 1.0 1.8 4.47 726 726 A 90 TYR HDy A 91 GLU HA 1.0 1.8 4.21 727 727 A 93 ILE HD1% A 15 TYR HEx 1.0 1.8 3.37 728 728 A 15 TYR HEx A 98 LEU HD2% 1.0 1.8 4.81 729 729 A 98 LEU HD2% A 15 TYR HEy 1.0 1.8 5.46 730 730 A 98 LEU HD1% A 106 PHE HDx 1.0 1.8 4.54 731 731 A 102 VAL HG2% A 15 TYR HEy 1.0 1.8 3.43 732 732 A 40 TYR HEx A 45 VAL HA 1.0 1.8 5.94 733 733 A 106 PHE HA A 106 PHE HEy 1.0 1.8 4.85 734 734 A 106 PHE HZ A 40 TYR HEy 1.0 1.8 5.20 735 735 A 40 TYR HEy A 106 PHE HEy 1.0 1.8 5.36 736 736 A 105 LYS HBx A 40 TYR HEx 1.0 1.8 4.85 737 737 A 71 TYR HDy A 71 TYR HBy 1.0 1.8 3.33 738 738 A 71 TYR HDx A 71 TYR HBx 1.0 1.8 3.40 739 739 A 70 LEU HD1% A 14 TYR H 1.0 1.8 5.47 740 740 A 12 ASP H A 12 ASP HBy 1.0 1.8 4.30 741 741 A 13 VAL H A 12 ASP HBy 1.0 1.8 5.17 742 742 A 26 LYS HGy A 30 ARG H 1.0 1.8 4.98 743 743 A 76 ASP H A 75 ASP H 1.0 1.8 4.35 744 744 A 53 SER H A 52 ARG HA 1.0 1.8 3.65 745 745 A 53 SER H A 52 ARG HBx 1.0 1.8 5.32 746 746 A 53 SER H A 52 ARG HBy 1.0 1.8 5.32 747 747 A 9 ILE HG2% A 11 LYS H 1.0 1.8 5.58 748 748 A 25 GLU H A 26 LYS HA 1.0 1.8 5.50 749 749 A 35 TYR H A 52 ARG HA 1.0 1.8 5.13 750 750 A 16 MET H A 15 TYR HDy 1.0 1.8 5.25 751 751 A 26 LYS HGy A 29 GLY H 1.0 1.8 5.57 752 752 A 47 LYS H A 14 TYR HDy 1.0 1.8 6.05 753 753 A 53 SER H A 53 SER HBy 1.0 1.8 4.63 754 754 A 68 LEU HD2% A 92 GLU H 1.0 1.8 4.57 755 755 A 34 ASN HD21 A 25 GLU HBy 1.0 1.8 5.32 756 756 A 34 ASN HD22 A 25 GLU HBy 1.0 1.8 5.32 757 757 A 47 LYS H A 40 TYR H 1.0 1.8 5.86 758 758 A 105 LYS HGx A 104 ASP H 1.0 1.8 5.08 759 759 A 40 TYR HDx A 39 ALA H 1.0 1.8 5.44 760 760 A 9 ILE HB A 8 ARG H 1.0 1.8 5.60 761 761 A 70 LEU HD1% A 15 TYR H 1.0 1.8 5.04 762 762 A 70 LEU HD1% A 40 TYR H 1.0 1.8 6.05 763 763 A 98 LEU HD2% A 40 TYR H 1.0 1.8 6.05 764 764 A 105 LYS H A 106 PHE HBy 1.0 1.8 5.27 765 765 A 106 PHE H A 103 LYS HBy 1.0 1.8 6.05 766 766 A 13 VAL HA A 14 TYR H 1.0 1.8 3.26 767 767 A 38 PRO HA A 39 ALA H 1.0 1.8 3.53 768 768 A 102 VAL H A 105 LYS H 1.0 1.8 5.05 769 769 A 24 ILE H A 25 GLU H 1.0 1.8 5.54 770 770 A 14 TYR HA A 40 TYR H 1.0 1.8 5.26 771 771 A 15 TYR HDx A 40 TYR H 1.0 1.8 5.48 772 772 A 97 ASP H A 98 LEU H 1.0 1.8 3.39 773 773 A 106 PHE H A 104 ASP H 1.0 1.8 4.57 774 774 A 105 LYS H A 106 PHE H 1.0 1.8 3.37 775 775 A 4 ALA H A 3 ARG HBx 1.0 1.8 5.78 776 776 A 4 ALA H A 3 ARG HBy 1.0 1.8 5.78 777 777 A 4 ALA H A 4 ALA HB% 1.0 1.8 3.87 778 778 A 3 ARG HA A 4 ALA H 1.0 1.8 3.76 779 779 A 5 SER H A 4 ALA HB% 1.0 1.8 4.97 780 780 A 5 SER HA A 6 LEU H 1.0 1.8 3.70 781 781 A 6 LEU H A 5 SER HBx 1.0 1.8 5.65 782 782 A 6 LEU H A 5 SER HBy 1.0 1.8 5.65 783 783 A 6 LEU HA A 7 ASN H 1.0 1.8 3.83 784 784 A 7 ASN H A 6 LEU HBx 1.0 1.8 5.28 785 785 A 7 ASN H A 6 LEU HBy 1.0 1.8 5.28 786 786 A 9 ILE HB A 9 ILE H 1.0 1.8 3.40 787 787 A 9 ILE H A 10 GLY H 1.0 1.8 5.02 788 788 A 9 ILE H A 10 GLY HAx 1.0 1.8 6.05 789 789 A 9 ILE H A 10 GLY HAy 1.0 1.8 6.05 790 790 A 9 ILE HA A 10 GLY H 1.0 1.8 3.17 791 791 A 9 ILE HB A 10 GLY H 1.0 1.8 4.54 792 792 A 10 GLY H A 9 ILE HG1x 1.0 1.8 5.92 793 793 A 9 ILE HG2% A 10 GLY H 1.0 1.8 3.86 794 794 A 10 GLY H A 11 LYS HGy 1.0 1.8 5.92 795 795 A 10 GLY H A 11 LYS HGx 1.0 1.8 5.92 796 796 A 10 GLY H A 11 LYS H 1.0 1.8 4.83 797 797 A 11 LYS HBy A 11 LYS H 1.0 1.8 3.76 798 798 A 11 LYS HDx A 11 LYS H 1.0 1.8 5.30 799 799 A 12 ASP H A 11 LYS H 1.0 1.8 4.86 800 800 A 11 LYS HA A 12 ASP H 1.0 1.8 3.64 801 801 A 11 LYS HBx A 12 ASP H 1.0 1.8 3.86 802 802 A 12 ASP H A 11 LYS HDy 1.0 1.8 5.84 803 803 A 13 VAL HB A 12 ASP H 1.0 1.8 6.05 804 804 A 12 ASP H A 12 ASP HBx 1.0 1.8 4.30 805 805 A 13 VAL H A 12 ASP H 1.0 1.8 4.47 806 806 A 13 VAL HA A 12 ASP H 1.0 1.8 5.92 807 807 A 13 VAL HG2% A 12 ASP H 1.0 1.8 4.91 808 808 A 14 TYR HEx A 12 ASP H 1.0 1.8 6.05 809 809 A 72 VAL HGx% A 12 ASP H 1.0 1.8 4.82 810 810 A 13 VAL H A 12 ASP HA 1.0 1.8 3.55 811 811 A 13 VAL H A 13 VAL HB 1.0 1.8 3.93 812 812 A 13 VAL H A 14 TYR H 1.0 1.8 5.27 813 813 A 14 TYR H A 13 VAL HB 1.0 1.8 4.81 814 814 A 13 VAL HG1% A 14 TYR H 1.0 1.8 3.83 815 815 A 14 TYR HBx A 14 TYR H 1.0 1.8 4.47 816 816 A 14 TYR HDx A 14 TYR H 1.0 1.8 4.14 817 817 A 14 TYR H A 70 LEU H 1.0 1.8 4.13 818 818 A 14 TYR H A 72 VAL HGx% 1.0 1.8 5.65 819 819 A 102 VAL HG2% A 15 TYR H 1.0 1.8 5.39 820 820 A 14 TYR H A 15 TYR H 1.0 1.8 5.14 821 821 A 14 TYR HA A 15 TYR H 1.0 1.8 3.56 822 822 A 14 TYR HBx A 15 TYR H 1.0 1.8 4.20 823 823 A 14 TYR HBy A 15 TYR H 1.0 1.8 4.70 824 824 A 14 TYR HDy A 15 TYR H 1.0 1.8 4.61 825 825 A 15 TYR HBx A 15 TYR H 1.0 1.8 4.39 826 826 A 15 TYR HBy A 15 TYR H 1.0 1.8 4.38 827 827 A 15 TYR HDx A 15 TYR H 1.0 1.8 4.11 828 828 A 39 ALA HB% A 15 TYR H 1.0 1.8 4.41 829 829 A 40 TYR H A 15 TYR H 1.0 1.8 4.07 830 830 A 16 MET H A 15 TYR HA 1.0 1.8 3.52 831 831 A 16 MET H A 15 TYR HBx 1.0 1.8 4.68 832 832 A 16 MET HBx A 16 MET H 1.0 1.8 3.95 833 833 A 16 MET H A 70 LEU HD1% 1.0 1.8 4.22 834 834 A 16 MET H A 17 GLN H 1.0 1.8 5.07 835 835 A 16 MET HBx A 17 GLN H 1.0 1.8 4.65 836 836 A 17 GLN H A 16 MET HGx 1.0 1.8 5.07 837 837 A 17 GLN H A 16 MET HGy 1.0 1.8 5.07 838 838 A 17 GLN H A 17 GLN HBy 1.0 1.8 4.19 839 839 A 17 GLN H A 17 GLN HBx 1.0 1.8 4.19 840 840 A 17 GLN H A 17 GLN HGy 1.0 1.8 5.75 841 841 A 17 GLN H A 17 GLN HGx 1.0 1.8 5.75 842 842 A 37 LEU HD1% A 17 GLN H 1.0 1.8 5.50 843 843 A 40 TYR HDx A 17 GLN H 1.0 1.8 6.05 844 844 A 70 LEU HD1% A 17 GLN H 1.0 1.8 6.05 845 845 A 106 PHE HZ A 17 GLN H 1.0 1.8 4.25 846 846 A 16 MET HA A 17 GLN H 1.0 1.8 3.36 847 847 A 18 ILE H A 17 GLN HGy 1.0 1.8 4.89 848 848 A 18 ILE H A 17 GLN HGx 1.0 1.8 4.89 849 849 A 18 ILE HB A 18 ILE H 1.0 1.8 4.03 850 850 A 18 ILE HD1% A 18 ILE H 1.0 1.8 4.83 851 851 A 18 ILE H A 18 ILE HG1x 1.0 1.8 4.33 852 852 A 18 ILE H A 18 ILE HG1y 1.0 1.8 4.33 853 853 A 18 ILE HG2% A 18 ILE H 1.0 1.8 4.65 854 854 A 18 ILE H A 17 GLN HA 1.0 1.8 3.69 855 855 A 27 VAL H A 27 VAL HG2% 1.0 1.8 4.07 856 856 A 20 GLY H A 19 LYS HBy 1.0 1.8 5.05 857 857 A 20 GLY H A 19 LYS HBx 1.0 1.8 5.05 858 858 A 21 GLU H A 21 GLU HBy 1.0 1.8 4.51 859 859 A 21 GLU H A 21 GLU HBx 1.0 1.8 4.51 860 860 A 22 GLY H A 21 GLU HBy 1.0 1.8 5.31 861 861 A 24 ILE H A 23 THR H 1.0 1.8 5.20 862 862 A 23 THR HA A 24 ILE H 1.0 1.8 3.12 863 863 A 24 ILE H A 23 THR HB 1.0 1.8 4.36 864 864 A 24 ILE HB A 24 ILE H 1.0 1.8 3.40 865 865 A 24 ILE H A 24 ILE HG1y 1.0 1.8 4.06 866 866 A 24 ILE H A 23 THR HG2% 1.0 1.8 3.94 867 867 A 24 ILE HA A 25 GLU H 1.0 1.8 3.89 868 868 A 25 GLU H A 25 GLU HBx 1.0 1.8 4.46 869 869 A 25 GLU H A 26 LYS H 1.0 1.8 5.42 870 870 A 32 LEU H A 26 LYS H 1.0 1.8 5.95 871 871 A 25 GLU HA A 26 LYS H 1.0 1.8 3.23 872 872 A 26 LYS H A 25 GLU HGy 1.0 1.8 4.93 873 873 A 26 LYS H A 25 GLU HGx 1.0 1.8 4.93 874 874 A 26 LYS H A 26 LYS HGx 1.0 1.8 4.76 875 875 A 26 LYS H A 27 VAL HG2% 1.0 1.8 5.33 876 876 A 26 LYS H A 26 LYS HBx 1.0 1.8 3.44 877 877 A 27 VAL H A 26 LYS HBy 1.0 1.8 4.93 878 878 A 27 VAL H A 32 LEU HBx 1.0 1.8 5.38 879 879 A 28 ASP H A 29 GLY H 1.0 1.8 5.36 880 880 A 29 GLY H A 28 ASP HA 1.0 1.8 3.89 881 881 A 28 ASP HBx A 29 GLY H 1.0 1.8 4.96 882 882 A 28 ASP HBy A 29 GLY H 1.0 1.8 4.85 883 883 A 27 VAL H A 30 ARG H 1.0 1.8 3.90 884 884 A 27 VAL HG2% A 30 ARG H 1.0 1.8 5.94 885 885 A 32 LEU HD1% A 30 ARG H 1.0 1.8 6.05 886 886 A 28 ASP HBy A 30 ARG H 1.0 1.8 5.13 887 887 A 30 ARG H A 29 GLY H 1.0 1.8 3.86 888 888 A 30 ARG HBx A 30 ARG H 1.0 1.8 3.37 889 889 A 30 ARG H A 30 ARG HDx 1.0 1.8 6.05 890 890 A 30 ARG H A 30 ARG HDy 1.0 1.8 6.05 891 891 A 30 ARG H A 31 ASN H 1.0 1.8 5.02 892 892 A 31 ASN H A 30 ARG HA 1.0 1.8 3.27 893 893 A 30 ARG HBy A 31 ASN H 1.0 1.8 3.95 894 894 A 31 ASN H A 31 ASN HBy 1.0 1.8 4.29 895 895 A 31 ASN H A 31 ASN HBx 1.0 1.8 4.29 896 896 A 32 LEU HD2% A 31 ASN H 1.0 1.8 5.03 897 897 A 32 LEU HG A 31 ASN H 1.0 1.8 6.05 898 898 A 24 ILE HG2% A 31 ASN HD21 1.0 1.8 5.37 899 899 A 24 ILE HG2% A 31 ASN HD22 1.0 1.8 5.37 900 900 A 32 LEU H A 32 LEU HBx 1.0 1.8 4.15 901 901 A 32 LEU H A 24 ILE HG2% 1.0 1.8 4.58 902 902 A 23 THR HG2% A 34 ASN HD21 1.0 1.8 5.31 903 903 A 34 ASN HD21 A 25 GLU HBx 1.0 1.8 5.32 904 904 A 23 THR HG2% A 34 ASN HD22 1.0 1.8 5.31 905 905 A 34 ASN HD22 A 25 GLU HBx 1.0 1.8 5.32 906 906 A 35 TYR H A 34 ASN H 1.0 1.8 5.16 907 907 A 35 TYR H A 34 ASN HBx 1.0 1.8 5.12 908 908 A 35 TYR HA A 36 THR H 1.0 1.8 3.38 909 909 A 36 THR H A 36 THR HB 1.0 1.8 3.86 910 910 A 36 THR HG2% A 36 THR H 1.0 1.8 4.60 911 911 A 37 LEU H A 36 THR H 1.0 1.8 4.86 912 912 A 37 LEU HD1% A 36 THR H 1.0 1.8 5.43 913 913 A 37 LEU H A 36 THR HA 1.0 1.8 3.72 914 914 A 37 LEU H A 36 THR HB 1.0 1.8 4.80 915 915 A 37 LEU H A 36 THR HG2% 1.0 1.8 4.20 916 916 A 37 LEU HBx A 37 LEU H 1.0 1.8 4.28 917 917 A 37 LEU H A 37 LEU HBy 1.0 1.8 4.39 918 918 A 37 LEU HD1% A 37 LEU H 1.0 1.8 4.63 919 919 A 37 LEU H A 49 ILE H 1.0 1.8 4.62 920 920 A 37 LEU H A 50 THR HA 1.0 1.8 5.13 921 921 A 38 PRO HBx A 39 ALA H 1.0 1.8 4.11 922 922 A 39 ALA H A 38 PRO HBy 1.0 1.8 3.99 923 923 A 39 ALA HB% A 39 ALA H 1.0 1.8 3.60 924 924 A 47 LYS H A 39 ALA H 1.0 1.8 4.05 925 925 A 48 GLN HA A 39 ALA H 1.0 1.8 4.09 926 926 A 49 ILE HD1% A 39 ALA H 1.0 1.8 5.01 927 927 A 14 TYR HDy A 40 TYR H 1.0 1.8 5.32 928 928 A 39 ALA H A 40 TYR H 1.0 1.8 4.98 929 929 A 39 ALA HB% A 40 TYR H 1.0 1.8 3.70 930 930 A 40 TYR H A 40 TYR HBx 1.0 1.8 4.40 931 931 A 40 TYR HBy A 40 TYR H 1.0 1.8 4.09 932 932 A 40 TYR HDx A 40 TYR H 1.0 1.8 4.00 933 933 A 102 VAL HG2% A 40 TYR H 1.0 1.8 5.40 934 934 A 39 ALA HA A 40 TYR H 1.0 1.8 3.55 935 935 A 14 TYR HA A 41 ASP H 1.0 1.8 4.98 936 936 A 14 TYR HDy A 41 ASP H 1.0 1.8 4.80 937 937 A 40 TYR HBx A 41 ASP H 1.0 1.8 4.30 938 938 A 40 TYR HBy A 41 ASP H 1.0 1.8 4.74 939 939 A 41 ASP H A 41 ASP HBx 1.0 1.8 4.31 940 940 A 41 ASP H A 45 VAL HB 1.0 1.8 4.60 941 941 A 45 VAL HG2% A 41 ASP H 1.0 1.8 4.61 942 942 A 41 ASP HA A 42 GLU H 1.0 1.8 3.83 943 943 A 42 GLU H A 41 ASP HBy 1.0 1.8 3.87 944 944 A 42 GLU H A 41 ASP HBx 1.0 1.8 3.87 945 945 A 42 GLU H A 42 GLU HBy 1.0 1.8 4.17 946 946 A 42 GLU H A 42 GLU HBx 1.0 1.8 4.17 947 947 A 102 VAL HG2% A 42 GLU H 1.0 1.8 5.49 948 948 A 15 TYR HEy A 42 GLU H 1.0 1.8 4.77 949 949 A 42 GLU H A 43 ASP H 1.0 1.8 3.70 950 950 A 43 ASP H A 43 ASP HBy 1.0 1.8 3.72 951 951 A 43 ASP H A 43 ASP HBx 1.0 1.8 3.72 952 952 A 43 ASP H A 44 GLY H 1.0 1.8 3.18 953 953 A 43 ASP H A 44 GLY HAy 1.0 1.8 5.30 954 954 A 45 VAL HG2% A 43 ASP H 1.0 1.8 4.60 955 955 A 102 VAL HG2% A 43 ASP H 1.0 1.8 5.68 956 956 A 42 GLU HA A 44 GLY H 1.0 1.8 4.89 957 957 A 44 GLY H A 43 ASP HBx 1.0 1.8 4.71 958 958 A 45 VAL HG2% A 44 GLY H 1.0 1.8 4.73 959 959 A 101 LYS HBx A 44 GLY H 1.0 1.8 6.05 960 960 A 101 LYS HBy A 44 GLY H 1.0 1.8 6.05 961 961 A 102 VAL HG2% A 44 GLY H 1.0 1.8 4.58 962 962 A 43 ASP H A 45 VAL H 1.0 1.8 4.81 963 963 A 45 VAL H A 43 ASP HBy 1.0 1.8 5.28 964 964 A 45 VAL H A 43 ASP HBx 1.0 1.8 5.28 965 965 A 45 VAL HB A 45 VAL H 1.0 1.8 3.37 966 966 A 45 VAL HG2% A 45 VAL H 1.0 1.8 3.21 967 967 A 40 TYR HEx A 46 LYS H 1.0 1.8 4.88 968 968 A 45 VAL H A 46 LYS H 1.0 1.8 5.05 969 969 A 45 VAL HA A 46 LYS H 1.0 1.8 2.99 970 970 A 45 VAL HB A 46 LYS H 1.0 1.8 4.89 971 971 A 45 VAL HG1% A 46 LYS H 1.0 1.8 3.25 972 972 A 46 LYS HBy A 46 LYS H 1.0 1.8 3.39 973 973 A 46 LYS HBx A 46 LYS H 1.0 1.8 3.73 974 974 A 47 LYS H A 40 TYR HA 1.0 1.8 4.68 975 975 A 40 TYR HDy A 47 LYS H 1.0 1.8 6.05 976 976 A 40 TYR HDx A 47 LYS H 1.0 1.8 6.05 977 977 A 47 LYS H A 46 LYS H 1.0 1.8 5.16 978 978 A 47 LYS H A 46 LYS HA 1.0 1.8 3.45 979 979 A 47 LYS H A 38 PRO HBy 1.0 1.8 5.65 980 980 A 47 LYS H A 46 LYS HGx 1.0 1.8 4.79 981 981 A 47 LYS H A 48 GLN H 1.0 1.8 5.27 982 982 A 48 GLN H A 47 LYS HA 1.0 1.8 3.33 983 983 A 48 GLN H A 47 LYS HGy 1.0 1.8 5.68 984 984 A 48 GLN H A 47 LYS HBx 1.0 1.8 4.74 985 985 A 48 GLN H A 48 GLN HGy 1.0 1.8 5.24 986 986 A 39 ALA HB% A 48 GLN H 1.0 1.8 6.05 987 987 A 36 THR HG2% A 48 GLN HE21 1.0 1.8 4.51 988 988 A 48 GLN HE21 A 48 GLN HBx 1.0 1.8 6.05 989 989 A 48 GLN HE21 A 48 GLN HBy 1.0 1.8 6.05 990 990 A 36 THR HG2% A 48 GLN HE22 1.0 1.8 4.51 991 991 A 48 GLN HE22 A 48 GLN HBx 1.0 1.8 6.05 992 992 A 48 GLN HE22 A 48 GLN HBy 1.0 1.8 6.05 993 993 A 16 MET HE% A 49 ILE H 1.0 1.8 5.06 994 994 A 49 ILE H A 48 GLN HGx 1.0 1.8 4.93 995 995 A 49 ILE HB A 49 ILE H 1.0 1.8 4.33 996 996 A 49 ILE HD1% A 49 ILE H 1.0 1.8 5.20 997 997 A 49 ILE HG2% A 49 ILE H 1.0 1.8 4.71 998 998 A 39 ALA HB% A 49 ILE H 1.0 1.8 4.69 999 999 A 53 SER H A 53 SER HBx 1.0 1.8 4.63 1000 1000 A 62 LEU HBx A 61 LYS H 1.0 1.8 5.12 1001 1001 A 62 LEU HD2% A 62 LEU H 1.0 1.8 4.97 1002 1002 A 62 LEU HG A 62 LEU H 1.0 1.8 4.33 1003 1003 A 62 LEU H A 62 LEU HBx 1.0 1.8 4.28 1004 1004 A 63 ASN HA A 64 LYS H 1.0 1.8 3.44 1005 1005 A 64 LYS H A 64 LYS HBx 1.0 1.8 3.76 1006 1006 A 64 LYS H A 64 LYS HBy 1.0 1.8 3.76 1007 1007 A 65 TYR H A 18 ILE HB 1.0 1.8 5.12 1008 1008 A 65 TYR H A 64 LYS HBx 1.0 1.8 5.09 1009 1009 A 65 TYR H A 66 ALA HB% 1.0 1.8 5.56 1010 1010 A 65 TYR H A 64 LYS HBy 1.0 1.8 5.09 1011 1011 A 65 TYR H A 66 ALA H 1.0 1.8 4.79 1012 1012 A 66 ALA H A 18 ILE HB 1.0 1.8 4.94 1013 1013 A 66 ALA H A 18 ILE H 1.0 1.8 5.02 1014 1014 A 66 ALA H A 67 PHE H 1.0 1.8 5.19 1015 1015 A 66 ALA HA A 67 PHE H 1.0 1.8 3.18 1016 1016 A 66 ALA HB% A 67 PHE H 1.0 1.8 3.39 1017 1017 A 67 PHE HBy A 67 PHE H 1.0 1.8 4.15 1018 1018 A 67 PHE HBx A 67 PHE H 1.0 1.8 3.87 1019 1019 A 68 LEU HD2% A 67 PHE H 1.0 1.8 5.53 1020 1020 A 93 ILE HG1x A 67 PHE H 1.0 1.8 6.05 1021 1021 A 16 MET HBx A 68 LEU H 1.0 1.8 5.30 1022 1022 A 68 LEU H A 17 GLN HA 1.0 1.8 4.55 1023 1023 A 68 LEU H A 67 PHE H 1.0 1.8 5.05 1024 1024 A 68 LEU H A 67 PHE HBy 1.0 1.8 4.50 1025 1025 A 67 PHE HBx A 68 LEU H 1.0 1.8 4.77 1026 1026 A 68 LEU HD1% A 68 LEU H 1.0 1.8 4.99 1027 1027 A 67 PHE HA A 68 LEU H 1.0 1.8 3.47 1028 1028 A 67 PHE HDx A 68 LEU H 1.0 1.8 4.94 1029 1029 A 68 LEU H A 68 LEU HG 1.0 1.8 4.29 1030 1030 A 98 LEU HD2% A 68 LEU H 1.0 1.8 5.62 1031 1031 A 16 MET H A 68 LEU H 1.0 1.8 4.14 1032 1032 A 68 LEU H A 93 ILE HG1x 1.0 1.8 5.15 1033 1033 A 93 ILE HD1% A 68 LEU H 1.0 1.8 5.65 1034 1034 A 69 ARG H A 68 LEU HA 1.0 1.8 3.42 1035 1035 A 69 ARG H A 69 ARG HGx 1.0 1.8 5.63 1036 1036 A 69 ARG H A 69 ARG HGy 1.0 1.8 6.05 1037 1037 A 69 ARG H A 90 TYR HA 1.0 1.8 5.32 1038 1038 A 69 ARG H A 92 GLU HA 1.0 1.8 4.48 1039 1039 A 69 ARG H A 93 ILE H 1.0 1.8 4.98 1040 1040 A 69 ARG H A 70 LEU HD1% 1.0 1.8 5.02 1041 1041 A 69 ARG H A 91 GLU H 1.0 1.8 4.22 1042 1042 A 69 ARG H A 93 ILE HG1x 1.0 1.8 4.93 1043 1043 A 13 VAL HG1% A 70 LEU H 1.0 1.8 4.66 1044 1044 A 70 LEU H A 15 TYR HA 1.0 1.8 4.83 1045 1045 A 70 LEU HD1% A 70 LEU H 1.0 1.8 3.83 1046 1046 A 70 LEU H A 69 ARG HBy 1.0 1.8 5.67 1047 1047 A 69 ARG HGx A 70 LEU H 1.0 1.8 4.50 1048 1048 A 70 LEU H A 69 ARG HGy 1.0 1.8 4.80 1049 1049 A 16 MET H A 70 LEU H 1.0 1.8 5.49 1050 1050 A 69 ARG H A 70 LEU H 1.0 1.8 5.96 1051 1051 A 69 ARG HA A 70 LEU H 1.0 1.8 3.48 1052 1052 A 70 LEU H A 70 LEU HBy 1.0 1.8 4.28 1053 1053 A 70 LEU H A 70 LEU HBx 1.0 1.8 4.28 1054 1054 A 70 LEU H A 71 TYR H 1.0 1.8 5.71 1055 1055 A 88 LYS H A 71 TYR H 1.0 1.8 6.02 1056 1056 A 70 LEU HA A 71 TYR H 1.0 1.8 3.51 1057 1057 A 71 TYR H A 70 LEU HBy 1.0 1.8 4.87 1058 1058 A 71 TYR H A 71 TYR HBx 1.0 1.8 3.86 1059 1059 A 71 TYR H A 71 TYR HDx 1.0 1.8 4.20 1060 1060 A 87 VAL HG1% A 71 TYR H 1.0 1.8 4.28 1061 1061 A 71 TYR H A 90 TYR HA 1.0 1.8 4.49 1062 1062 A 71 TYR H A 70 LEU HBx 1.0 1.8 4.87 1063 1063 A 72 VAL HA A 73 ASP H 1.0 1.8 3.41 1064 1064 A 73 ASP H A 72 VAL HGy% 1.0 1.8 3.54 1065 1065 A 73 ASP H A 73 ASP HBy 1.0 1.8 4.27 1066 1066 A 73 ASP H A 73 ASP HBx 1.0 1.8 4.27 1067 1067 A 73 ASP H A 88 LYS H 1.0 1.8 4.71 1068 1068 A 88 LYS HGy A 73 ASP H 1.0 1.8 4.61 1069 1069 A 88 LYS HGx A 73 ASP H 1.0 1.8 5.60 1070 1070 A 76 ASP H A 75 ASP HBx 1.0 1.8 5.05 1071 1071 A 76 ASP H A 75 ASP HBy 1.0 1.8 5.05 1072 1072 A 76 ASP H A 76 ASP HBy 1.0 1.8 4.38 1073 1073 A 76 ASP H A 77 ASN H 1.0 1.8 5.27 1074 1074 A 77 ASN H A 76 ASP HA 1.0 1.8 3.16 1075 1075 A 77 ASN H A 77 ASN HBy 1.0 1.8 4.58 1076 1076 A 77 ASN H A 77 ASN HBx 1.0 1.8 4.58 1077 1077 A 78 SER H A 79 LYS H 1.0 1.8 4.92 1078 1078 A 84 SER H A 83 SER HBy 1.0 1.8 4.70 1079 1079 A 85 ILE H A 84 SER H 1.0 1.8 5.07 1080 1080 A 85 ILE HD1% A 85 ILE H 1.0 1.8 6.05 1081 1081 A 72 VAL HA A 88 LYS H 1.0 1.8 4.08 1082 1082 A 88 LYS H A 87 VAL HA 1.0 1.8 3.56 1083 1083 A 87 VAL HG1% A 88 LYS H 1.0 1.8 3.71 1084 1084 A 88 LYS H A 88 LYS HBx 1.0 1.8 4.35 1085 1085 A 88 LYS H A 88 LYS HBy 1.0 1.8 4.35 1086 1086 A 88 LYS HGy A 88 LYS H 1.0 1.8 3.99 1087 1087 A 88 LYS HGx A 88 LYS H 1.0 1.8 4.05 1088 1088 A 89 SER H A 71 TYR H 1.0 1.8 4.23 1089 1089 A 89 SER H A 71 TYR HBx 1.0 1.8 4.27 1090 1090 A 89 SER H A 71 TYR HDx 1.0 1.8 5.61 1091 1091 A 89 SER H A 87 VAL HA 1.0 1.8 4.68 1092 1092 A 87 VAL HG1% A 89 SER H 1.0 1.8 3.67 1093 1093 A 89 SER H A 88 LYS H 1.0 1.8 3.66 1094 1094 A 89 SER H A 88 LYS HBx 1.0 1.8 4.71 1095 1095 A 89 SER H A 88 LYS HBy 1.0 1.8 4.71 1096 1096 A 89 SER H A 88 LYS HGy 1.0 1.8 4.59 1097 1097 A 87 VAL HG1% A 90 TYR H 1.0 1.8 5.09 1098 1098 A 90 TYR H A 89 SER HA 1.0 1.8 3.40 1099 1099 A 90 TYR HDx A 90 TYR H 1.0 1.8 4.36 1100 1100 A 91 GLU H A 90 TYR H 1.0 1.8 4.94 1101 1101 A 68 LEU HA A 91 GLU H 1.0 1.8 5.26 1102 1102 A 70 LEU HG A 91 GLU H 1.0 1.8 6.05 1103 1103 A 68 LEU HD2% A 91 GLU H 1.0 1.8 5.80 1104 1104 A 70 LEU HD1% A 91 GLU H 1.0 1.8 6.05 1105 1105 A 91 GLU H A 90 TYR HA 1.0 1.8 3.83 1106 1106 A 90 TYR HBx A 91 GLU H 1.0 1.8 4.08 1107 1107 A 91 GLU H A 91 GLU HGx 1.0 1.8 5.62 1108 1108 A 91 GLU H A 91 GLU HGy 1.0 1.8 5.62 1109 1109 A 93 ILE HG2% A 91 GLU H 1.0 1.8 5.37 1110 1110 A 90 TYR HDy A 92 GLU H 1.0 1.8 5.71 1111 1111 A 91 GLU H A 92 GLU H 1.0 1.8 5.15 1112 1112 A 91 GLU HA A 92 GLU H 1.0 1.8 3.05 1113 1113 A 92 GLU H A 92 GLU HBy 1.0 1.8 3.43 1114 1114 A 92 GLU H A 92 GLU HBx 1.0 1.8 3.43 1115 1115 A 92 GLU H A 92 GLU HGy 1.0 1.8 5.30 1116 1116 A 93 ILE H A 92 GLU H 1.0 1.8 5.13 1117 1117 A 93 ILE HG2% A 92 GLU H 1.0 1.8 5.28 1118 1118 A 92 GLU H A 91 GLU HGx 1.0 1.8 5.81 1119 1119 A 67 PHE HBx A 93 ILE H 1.0 1.8 5.25 1120 1120 A 68 LEU HA A 93 ILE H 1.0 1.8 4.19 1121 1121 A 68 LEU HD2% A 93 ILE H 1.0 1.8 4.38 1122 1122 A 92 GLU HA A 93 ILE H 1.0 1.8 3.28 1123 1123 A 93 ILE H A 92 GLU HBy 1.0 1.8 4.85 1124 1124 A 93 ILE H A 92 GLU HBx 1.0 1.8 4.85 1125 1125 A 93 ILE H A 92 GLU HGy 1.0 1.8 4.41 1126 1126 A 93 ILE H A 93 ILE HG1y 1.0 1.8 4.08 1127 1127 A 93 ILE H A 94 GLN H 1.0 1.8 5.56 1128 1128 A 93 ILE H A 92 GLU HGx 1.0 1.8 4.41 1129 1129 A 93 ILE HG1x A 93 ILE H 1.0 1.8 3.63 1130 1130 A 94 GLN H A 93 ILE HA 1.0 1.8 3.42 1131 1131 A 93 ILE HB A 94 GLN H 1.0 1.8 3.37 1132 1132 A 93 ILE HG1y A 94 GLN H 1.0 1.8 4.38 1133 1133 A 94 GLN H A 94 GLN HBx 1.0 1.8 4.21 1134 1134 A 97 ASP HBx A 94 GLN H 1.0 1.8 4.09 1135 1135 A 93 ILE HG2% A 94 GLN H 1.0 1.8 4.39 1136 1136 A 93 ILE HD1% A 94 GLN H 1.0 1.8 4.79 1137 1137 A 94 GLN H A 94 GLN HGy 1.0 1.8 3.53 1138 1138 A 94 GLN HGy A 94 GLN HE21 1.0 1.8 4.31 1139 1139 A 94 GLN HGy A 94 GLN HE22 1.0 1.8 4.31 1140 1140 A 95 LYS H A 94 GLN HA 1.0 1.8 3.17 1141 1141 A 95 LYS H A 94 GLN HBy 1.0 1.8 4.09 1142 1142 A 95 LYS H A 95 LYS HGx 1.0 1.8 5.06 1143 1143 A 95 LYS H A 95 LYS HGy 1.0 1.8 5.06 1144 1144 A 95 LYS H A 95 LYS HBy 1.0 1.8 3.66 1145 1145 A 95 LYS H A 95 LYS HBx 1.0 1.8 3.66 1146 1146 A 94 GLN HBx A 96 ALA H 1.0 1.8 4.07 1147 1147 A 94 GLN HGx A 96 ALA H 1.0 1.8 3.90 1148 1148 A 95 LYS H A 96 ALA H 1.0 1.8 3.75 1149 1149 A 96 ALA HB% A 96 ALA H 1.0 1.8 2.97 1150 1150 A 97 ASP H A 93 ILE HB 1.0 1.8 4.91 1151 1151 A 97 ASP H A 94 GLN HBx 1.0 1.8 4.74 1152 1152 A 97 ASP H A 94 GLN HGy 1.0 1.8 4.44 1153 1153 A 97 ASP H A 96 ALA H 1.0 1.8 3.74 1154 1154 A 97 ASP H A 96 ALA HB% 1.0 1.8 3.66 1155 1155 A 97 ASP H A 97 ASP HBx 1.0 1.8 3.42 1156 1156 A 97 ASP H A 98 LEU HD2% 1.0 1.8 6.05 1157 1157 A 97 ASP H A 94 GLN H 1.0 1.8 4.37 1158 1158 A 93 ILE HD1% A 98 LEU H 1.0 1.8 4.62 1159 1159 A 94 GLN H A 98 LEU H 1.0 1.8 6.05 1160 1160 A 95 LYS H A 98 LEU H 1.0 1.8 6.05 1161 1161 A 98 LEU H A 95 LYS HA 1.0 1.8 4.31 1162 1162 A 98 LEU H A 96 ALA H 1.0 1.8 4.96 1163 1163 A 98 LEU H A 96 ALA HA 1.0 1.8 4.66 1164 1164 A 97 ASP HBx A 98 LEU H 1.0 1.8 4.72 1165 1165 A 97 ASP HBy A 98 LEU H 1.0 1.8 4.93 1166 1166 A 98 LEU HBy A 98 LEU H 1.0 1.8 4.14 1167 1167 A 98 LEU HBx A 98 LEU H 1.0 1.8 3.54 1168 1168 A 98 LEU HD2% A 98 LEU H 1.0 1.8 4.32 1169 1169 A 98 LEU H A 98 LEU HG 1.0 1.8 3.42 1170 1170 A 98 LEU HD1% A 98 LEU H 1.0 1.8 3.96 1171 1171 A 99 PRO HA A 100 GLU H 1.0 1.8 3.41 1172 1172 A 100 GLU H A 99 PRO HBx 1.0 1.8 4.49 1173 1173 A 100 GLU H A 99 PRO HBy 1.0 1.8 4.49 1174 1174 A 100 GLU HBx A 100 GLU H 1.0 1.8 3.53 1175 1175 A 100 GLU HGx A 100 GLU H 1.0 1.8 5.43 1176 1176 A 100 GLU HGy A 100 GLU H 1.0 1.8 5.78 1177 1177 A 101 LYS H A 100 GLU HBy 1.0 1.8 3.73 1178 1178 A 101 LYS H A 101 LYS HBy 1.0 1.8 3.26 1179 1179 A 101 LYS H A 101 LYS HGx 1.0 1.8 4.11 1180 1180 A 101 LYS H A 102 VAL H 1.0 1.8 3.72 1181 1181 A 24 ILE HD1% A 23 THR H 1.0 1.8 5.56 1182 1182 A 103 LYS H A 101 LYS H 1.0 1.8 4.77 1183 1183 A 101 LYS H A 100 GLU HGx 1.0 1.8 5.04 1184 1184 A 102 VAL HG2% A 102 VAL H 1.0 1.8 3.51 1185 1185 A 103 LYS H A 102 VAL H 1.0 1.8 3.30 1186 1186 A 102 VAL H A 101 LYS HBy 1.0 1.8 3.60 1187 1187 A 102 VAL HB A 102 VAL H 1.0 1.8 3.79 1188 1188 A 98 LEU HD2% A 103 LYS H 1.0 1.8 5.43 1189 1189 A 98 LEU HD1% A 103 LYS H 1.0 1.8 5.24 1190 1190 A 102 VAL HG1% A 103 LYS H 1.0 1.8 4.10 1191 1191 A 103 LYS H A 103 LYS HGy 1.0 1.8 4.47 1192 1192 A 103 LYS H A 103 LYS HGx 1.0 1.8 3.98 1193 1193 A 102 VAL HB A 103 LYS H 1.0 1.8 3.34 1194 1194 A 101 LYS HA A 104 ASP H 1.0 1.8 4.98 1195 1195 A 102 VAL H A 104 ASP H 1.0 1.8 4.50 1196 1196 A 102 VAL HG1% A 104 ASP H 1.0 1.8 5.02 1197 1197 A 103 LYS H A 104 ASP H 1.0 1.8 3.77 1198 1198 A 103 LYS HGy A 104 ASP H 1.0 1.8 4.69 1199 1199 A 103 LYS HGx A 104 ASP H 1.0 1.8 4.81 1200 1200 A 104 ASP H A 103 LYS HBy 1.0 1.8 4.15 1201 1201 A 104 ASP HBx A 104 ASP H 1.0 1.8 3.19 1202 1202 A 105 LYS H A 104 ASP H 1.0 1.8 3.56 1203 1203 A 102 VAL HA A 105 LYS H 1.0 1.8 4.16 1204 1204 A 105 LYS H A 101 LYS HBx 1.0 1.8 6.04 1205 1205 A 102 VAL HB A 105 LYS H 1.0 1.8 6.05 1206 1206 A 105 LYS H A 104 ASP HBx 1.0 1.8 4.22 1207 1207 A 105 LYS H A 105 LYS HBy 1.0 1.8 3.62 1208 1208 A 105 LYS H A 103 LYS HGy 1.0 1.8 5.49 1209 1209 A 105 LYS H A 105 LYS HGy 1.0 1.8 4.11 1210 1210 A 105 LYS H A 105 LYS HGx 1.0 1.8 3.52 1211 1211 A 106 PHE H A 104 ASP HA 1.0 1.8 4.66 1212 1212 A 106 PHE H A 105 LYS HBy 1.0 1.8 4.21 1213 1213 A 102 VAL HG1% A 106 PHE H 1.0 1.8 4.81 1214 1214 A 105 LYS HBx A 106 PHE H 1.0 1.8 5.13 1215 1215 A 106 PHE H A 105 LYS HGx 1.0 1.8 5.37 1216 1216 A 103 LYS HA A 106 PHE H 1.0 1.8 4.30 1217 1217 A 106 PHE H A 106 PHE HBx 1.0 1.8 4.55 1218 1218 A 106 PHE H A 106 PHE HBy 1.0 1.8 3.64 1219 1219 A 106 PHE H A 107 THR HG2% 1.0 1.8 4.75 1220 1220 A 108 ILE HD1% A 107 THR H 1.0 1.8 5.12 1221 1221 A 106 PHE H A 107 THR H 1.0 1.8 3.96 1222 1222 A 106 PHE HBx A 107 THR H 1.0 1.8 4.58 1223 1223 A 106 PHE HBy A 107 THR H 1.0 1.8 4.80 1224 1224 A 107 THR HB A 107 THR H 1.0 1.8 4.02 1225 1225 A 107 THR HG2% A 107 THR H 1.0 1.8 4.47 1226 1226 A 108 ILE H A 107 THR H 1.0 1.8 4.96 1227 1227 A 108 ILE H A 107 THR HG2% 1.0 1.8 4.20 1228 1228 A 108 ILE H A 108 ILE HG1x 1.0 1.8 4.88 1229 1229 A 108 ILE HD1% A 108 ILE H 1.0 1.8 4.39 1230 1230 A 108 ILE HA A 109 LYS H 1.0 1.8 3.33 1231 1231 A 108 ILE HB A 109 LYS H 1.0 1.8 5.20 1232 1232 A 107 THR HG2% A 109 LYS H 1.0 1.8 5.98 1233 1233 A 108 ILE HG2% A 109 LYS H 1.0 1.8 4.41 1234 1234 A 40 TYR HA A 41 ASP H 1.0 1.8 3.52 1235 1235 A 8 ARG H A 7 ASN HA 1.0 1.8 3.64 1236 1236 A 3 ARG H A 3 ARG HBy 1.0 1.8 4.06 1237 1236 A 3 ARG H A 3 ARG HBx 1.0 1.8 4.06 1238 1237 A 3 ARG HA A 3 ARG HDy 1.0 1.8 5.07 1239 1237 A 3 ARG HA A 3 ARG HDx 1.0 1.8 5.07 1240 1238 A 5 SER H A 5 SER HBy 1.0 1.8 3.47 1241 1238 A 5 SER H A 5 SER HBx 1.0 1.8 3.47 1242 1239 A 6 LEU H A 5 SER HBy 1.0 1.8 4.93 1243 1239 A 6 LEU H A 5 SER HBx 1.0 1.8 4.93 1244 1240 A 6 LEU H A 6 LEU HBx 1.0 1.8 3.99 1245 1240 A 6 LEU H A 6 LEU HBy 1.0 1.8 3.99 1246 1241 A 6 LEU H A 6 LEU HD1% 1.0 1.8 4.97 1247 1241 A 6 LEU H A 6 LEU HD2% 1.0 1.8 4.97 1248 1242 A 6 LEU HA A 6 LEU HD1% 1.0 1.8 3.16 1249 1242 A 6 LEU HA A 6 LEU HD2% 1.0 1.8 3.16 1250 1243 A 6 LEU HBy A 6 LEU HD1% 1.0 1.8 3.03 1251 1243 A 6 LEU HBx A 6 LEU HD1% 1.0 1.8 3.03 1252 1243 A 6 LEU HD2% A 6 LEU HBx 1.0 1.8 3.03 1253 1243 A 6 LEU HBy A 6 LEU HD2% 1.0 1.8 3.03 1254 1244 A 7 ASN H A 6 LEU HBx 1.0 1.8 4.52 1255 1244 A 7 ASN H A 6 LEU HBy 1.0 1.8 4.52 1256 1245 A 7 ASN H A 6 LEU HD1% 1.0 1.8 5.25 1257 1245 A 7 ASN H A 6 LEU HD2% 1.0 1.8 5.25 1258 1246 A 7 ASN H A 7 ASN HBy 1.0 1.8 3.87 1259 1246 A 7 ASN H A 7 ASN HBx 1.0 1.8 3.87 1260 1247 A 7 ASN HBx A 7 ASN HD22 1.0 1.8 3.50 1261 1247 A 7 ASN HD21 A 7 ASN HBy 1.0 1.8 3.50 1262 1247 A 7 ASN HBx A 7 ASN HD21 1.0 1.8 3.50 1263 1247 A 7 ASN HBy A 7 ASN HD22 1.0 1.8 3.50 1264 1248 A 9 ILE H A 9 ILE HG1x 1.0 1.8 3.64 1265 1248 A 9 ILE H A 9 ILE HG1y 1.0 1.8 3.64 1266 1249 A 9 ILE HG2% A 11 LYS HGy 1.0 1.8 4.58 1267 1249 A 9 ILE HG2% A 11 LYS HGx 1.0 1.8 4.58 1268 1250 A 9 ILE HG2% A 11 LYS HEy 1.0 1.8 4.94 1269 1250 A 9 ILE HG2% A 11 LYS HEx 1.0 1.8 4.94 1270 1251 A 10 GLY H A 9 ILE HG1x 1.0 1.8 5.21 1271 1251 A 10 GLY H A 9 ILE HG1y 1.0 1.8 5.21 1272 1252 A 10 GLY H A 11 LYS HGy 1.0 1.8 5.14 1273 1252 A 10 GLY H A 11 LYS HGx 1.0 1.8 5.14 1274 1253 A 11 LYS H A 11 LYS HGy 1.0 1.8 4.49 1275 1253 A 11 LYS H A 11 LYS HGx 1.0 1.8 4.49 1276 1254 A 11 LYS HA A 11 LYS HGy 1.0 1.8 3.95 1277 1254 A 11 LYS HA A 11 LYS HGx 1.0 1.8 3.95 1278 1255 A 11 LYS HBx A 11 LYS HEy 1.0 1.8 4.99 1279 1255 A 11 LYS HBx A 11 LYS HEx 1.0 1.8 4.99 1280 1256 A 11 LYS HEx A 11 LYS HGy 1.0 1.8 3.66 1281 1256 A 11 LYS HEy A 11 LYS HGy 1.0 1.8 3.66 1282 1256 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 3.66 1283 1256 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 3.66 1284 1257 A 12 ASP H A 11 LYS HGy 1.0 1.8 5.21 1285 1257 A 12 ASP H A 11 LYS HGx 1.0 1.8 5.21 1286 1258 A 12 ASP H A 12 ASP HBy 1.0 1.8 3.70 1287 1258 A 12 ASP H A 12 ASP HBx 1.0 1.8 3.70 1288 1259 A 13 VAL H A 12 ASP HBy 1.0 1.8 4.51 1289 1259 A 13 VAL H A 12 ASP HBx 1.0 1.8 4.51 1290 1260 A 14 TYR HEx A 12 ASP HBy 1.0 1.8 4.19 1291 1260 A 14 TYR HEx A 12 ASP HBx 1.0 1.8 4.19 1292 1261 A 72 VAL HB A 12 ASP HBy 1.0 1.8 4.96 1293 1261 A 72 VAL HB A 12 ASP HBx 1.0 1.8 4.96 1294 1262 A 13 VAL HG1% A 42 GLU HBy 1.0 1.8 5.87 1295 1262 A 13 VAL HG1% A 42 GLU HBx 1.0 1.8 5.87 1296 1263 A 13 VAL HG1% A 69 ARG HBx 1.0 1.8 4.84 1297 1263 A 13 VAL HG1% A 69 ARG HBy 1.0 1.8 4.84 1298 1264 A 13 VAL HG1% A 70 LEU HBy 1.0 1.8 5.87 1299 1264 A 13 VAL HG1% A 70 LEU HBx 1.0 1.8 5.87 1300 1265 A 13 VAL HG2% A 69 ARG HDx 1.0 1.8 5.85 1301 1265 A 13 VAL HG2% A 69 ARG HDy 1.0 1.8 5.85 1302 1266 A 14 TYR HBy A 70 LEU HBy 1.0 1.8 4.46 1303 1266 A 14 TYR HBy A 70 LEU HBx 1.0 1.8 4.46 1304 1267 A 14 TYR HBx A 70 LEU HBy 1.0 1.8 5.27 1305 1267 A 14 TYR HBx A 70 LEU HBx 1.0 1.8 5.27 1306 1268 A 14 TYR HEy A 41 ASP HBx 1.0 1.8 5.24 1307 1268 A 14 TYR HEy A 41 ASP HBy 1.0 1.8 5.24 1308 1269 A 14 TYR HEy A 47 LYS HBx 1.0 1.8 4.61 1309 1269 A 14 TYR HEy A 47 LYS HBy 1.0 1.8 4.61 1310 1270 A 14 TYR HEy A 47 LYS HGx 1.0 1.8 4.20 1311 1270 A 14 TYR HEy A 47 LYS HGy 1.0 1.8 4.20 1312 1271 A 14 TYR HEy A 47 LYS HEx 1.0 1.8 5.87 1313 1271 A 14 TYR HEy A 47 LYS HEy 1.0 1.8 5.87 1314 1272 A 14 TYR HDy A 47 LYS HBx 1.0 1.8 4.39 1315 1272 A 14 TYR HDy A 47 LYS HBy 1.0 1.8 4.39 1316 1273 A 15 TYR HDy A 69 ARG HDx 1.0 1.8 5.70 1317 1273 A 15 TYR HDy A 69 ARG HDy 1.0 1.8 5.70 1318 1274 A 15 TYR HEx A 69 ARG HBx 1.0 1.8 4.75 1319 1274 A 15 TYR HEx A 69 ARG HBy 1.0 1.8 4.75 1320 1275 A 15 TYR HEx A 69 ARG HDx 1.0 1.8 3.70 1321 1275 A 15 TYR HEx A 69 ARG HDy 1.0 1.8 3.70 1322 1276 A 15 TYR HEy A 41 ASP HBx 1.0 1.8 5.87 1323 1276 A 15 TYR HEy A 41 ASP HBy 1.0 1.8 5.87 1324 1277 A 15 TYR HEy A 42 GLU HBy 1.0 1.8 4.16 1325 1277 A 15 TYR HEy A 42 GLU HBx 1.0 1.8 4.16 1326 1278 A 15 TYR HEy A 99 PRO HBy 1.0 1.8 5.78 1327 1278 A 15 TYR HEy A 99 PRO HBx 1.0 1.8 5.78 1328 1279 A 15 TYR HEy A 99 PRO HGy 1.0 1.8 4.23 1329 1279 A 15 TYR HEy A 99 PRO HGx 1.0 1.8 4.23 1330 1280 A 15 TYR HDx A 99 PRO HGy 1.0 1.8 5.78 1331 1280 A 15 TYR HDx A 99 PRO HGx 1.0 1.8 5.78 1332 1281 A 15 TYR HDx A 99 PRO HDy 1.0 1.8 4.70 1333 1281 A 15 TYR HDx A 99 PRO HDx 1.0 1.8 4.70 1334 1282 A 16 MET H A 68 LEU HBx 1.0 1.8 4.13 1335 1282 A 16 MET H A 68 LEU HBy 1.0 1.8 4.13 1336 1283 A 16 MET HA A 17 GLN HBx 1.0 1.8 5.57 1337 1283 A 16 MET HA A 17 GLN HBy 1.0 1.8 5.57 1338 1284 A 16 MET HBx A 68 LEU HBx 1.0 1.8 5.37 1339 1284 A 16 MET HBx A 68 LEU HBy 1.0 1.8 5.37 1340 1285 A 16 MET HE% A 16 MET HGx 1.0 1.8 3.87 1341 1285 A 16 MET HE% A 16 MET HGy 1.0 1.8 3.87 1342 1286 A 17 GLN H A 16 MET HGx 1.0 1.8 4.26 1343 1286 A 17 GLN H A 16 MET HGy 1.0 1.8 4.26 1344 1287 A 37 LEU HD1% A 16 MET HGx 1.0 1.8 5.05 1345 1287 A 37 LEU HD1% A 16 MET HGy 1.0 1.8 5.05 1346 1288 A 39 ALA HB% A 16 MET HGx 1.0 1.8 4.91 1347 1288 A 39 ALA HB% A 16 MET HGy 1.0 1.8 4.91 1348 1289 A 17 GLN H A 17 GLN HBx 1.0 1.8 3.50 1349 1289 A 17 GLN H A 17 GLN HBy 1.0 1.8 3.50 1350 1290 A 17 GLN H A 17 GLN HGy 1.0 1.8 4.87 1351 1290 A 17 GLN H A 17 GLN HGx 1.0 1.8 4.87 1352 1291 A 17 GLN HBx A 17 GLN HE22 1.0 1.8 5.09 1353 1291 A 17 GLN HBy A 17 GLN HE22 1.0 1.8 5.09 1354 1291 A 17 GLN HE21 A 17 GLN HBx 1.0 1.8 5.09 1355 1291 A 17 GLN HBy A 17 GLN HE21 1.0 1.8 5.09 1356 1292 A 67 PHE HDx A 17 GLN HBx 1.0 1.8 4.51 1357 1292 A 67 PHE HDx A 17 GLN HBy 1.0 1.8 4.51 1358 1293 A 106 PHE HBx A 17 GLN HBx 1.0 1.8 5.87 1359 1293 A 106 PHE HBx A 17 GLN HBy 1.0 1.8 5.87 1360 1294 A 106 PHE HEx A 17 GLN HBx 1.0 1.8 5.27 1361 1294 A 106 PHE HEx A 17 GLN HBy 1.0 1.8 5.27 1362 1295 A 106 PHE HZ A 17 GLN HBx 1.0 1.8 5.53 1363 1295 A 106 PHE HZ A 17 GLN HBy 1.0 1.8 5.53 1364 1296 A 106 PHE HEy A 17 GLN HBx 1.0 1.8 5.63 1365 1296 A 106 PHE HEy A 17 GLN HBy 1.0 1.8 5.63 1366 1297 A 18 ILE H A 17 GLN HGy 1.0 1.8 4.05 1367 1297 A 18 ILE H A 17 GLN HGx 1.0 1.8 4.05 1368 1298 A 67 PHE HA A 17 GLN HGy 1.0 1.8 5.01 1369 1298 A 67 PHE HA A 17 GLN HGx 1.0 1.8 5.01 1370 1299 A 67 PHE HDx A 17 GLN HGy 1.0 1.8 5.18 1371 1299 A 67 PHE HDx A 17 GLN HGx 1.0 1.8 5.18 1372 1300 A 17 GLN HE22 A 65 TYR HBy 1.0 1.8 4.08 1373 1300 A 17 GLN HE21 A 65 TYR HBy 1.0 1.8 4.08 1374 1300 A 65 TYR HBx A 17 GLN HE22 1.0 1.8 4.08 1375 1300 A 17 GLN HE21 A 65 TYR HBx 1.0 1.8 4.08 1376 1301 A 18 ILE H A 18 ILE HG1y 1.0 1.8 3.69 1377 1301 A 18 ILE H A 18 ILE HG1x 1.0 1.8 3.69 1378 1302 A 18 ILE HG2% A 18 ILE HG1y 1.0 1.8 3.65 1379 1302 A 18 ILE HG2% A 18 ILE HG1x 1.0 1.8 3.65 1380 1303 A 18 ILE HG2% A 19 LYS HBx 1.0 1.8 5.80 1381 1303 A 18 ILE HG2% A 19 LYS HBy 1.0 1.8 5.80 1382 1304 A 51 PHE HZ A 18 ILE HG1y 1.0 1.8 5.87 1383 1304 A 51 PHE HZ A 18 ILE HG1x 1.0 1.8 5.87 1384 1305 A 62 LEU HD1% A 18 ILE HG1y 1.0 1.8 5.12 1385 1305 A 62 LEU HD1% A 18 ILE HG1x 1.0 1.8 5.12 1386 1306 A 68 LEU HD1% A 18 ILE HG1y 1.0 1.8 3.66 1387 1306 A 68 LEU HD1% A 18 ILE HG1x 1.0 1.8 3.66 1388 1307 A 68 LEU HD2% A 18 ILE HG1y 1.0 1.8 4.65 1389 1307 A 68 LEU HD2% A 18 ILE HG1x 1.0 1.8 4.65 1390 1308 A 19 LYS HA A 19 LYS HGx 1.0 1.8 3.89 1391 1308 A 19 LYS HA A 19 LYS HGy 1.0 1.8 3.89 1392 1309 A 19 LYS HBx A 20 GLY HAy 1.0 1.8 5.22 1393 1309 A 19 LYS HBy A 20 GLY HAy 1.0 1.8 5.22 1394 1309 A 20 GLY HAx A 19 LYS HBx 1.0 1.8 5.22 1395 1309 A 19 LYS HBy A 20 GLY HAx 1.0 1.8 5.22 1396 1310 A 37 LEU HD1% A 19 LYS HBx 1.0 1.8 4.89 1397 1310 A 37 LEU HD1% A 19 LYS HBy 1.0 1.8 4.89 1398 1311 A 37 LEU HD2% A 19 LYS HBx 1.0 1.8 3.84 1399 1311 A 37 LEU HD2% A 19 LYS HBy 1.0 1.8 3.84 1400 1312 A 22 GLY H A 20 GLY HAy 1.0 1.8 4.84 1401 1312 A 22 GLY H A 20 GLY HAx 1.0 1.8 4.84 1402 1313 A 21 GLU H A 21 GLU HBy 1.0 1.8 3.90 1403 1313 A 21 GLU H A 21 GLU HBx 1.0 1.8 3.90 1404 1314 A 21 GLU H A 21 GLU HGy 1.0 1.8 4.14 1405 1314 A 21 GLU H A 21 GLU HGx 1.0 1.8 4.14 1406 1315 A 21 GLU HA A 21 GLU HGy 1.0 1.8 3.98 1407 1315 A 21 GLU HA A 21 GLU HGx 1.0 1.8 3.98 1408 1316 A 22 GLY H A 21 GLU HBy 1.0 1.8 4.61 1409 1316 A 22 GLY H A 21 GLU HBx 1.0 1.8 4.61 1410 1317 A 22 GLY H A 21 GLU HGy 1.0 1.8 5.52 1411 1317 A 22 GLY H A 21 GLU HGx 1.0 1.8 5.52 1412 1318 A 23 THR HG2% A 34 ASN HD21 1.0 1.8 4.57 1413 1318 A 23 THR HG2% A 34 ASN HD22 1.0 1.8 4.57 1414 1319 A 24 ILE HA A 31 ASN HBy 1.0 1.8 5.87 1415 1319 A 24 ILE HA A 31 ASN HBx 1.0 1.8 5.87 1416 1320 A 24 ILE HG2% A 31 ASN HBy 1.0 1.8 3.64 1417 1320 A 24 ILE HG2% A 31 ASN HBx 1.0 1.8 3.64 1418 1321 A 24 ILE HG2% A 31 ASN HD21 1.0 1.8 4.48 1419 1321 A 24 ILE HG2% A 31 ASN HD22 1.0 1.8 4.48 1420 1322 A 24 ILE HD1% A 31 ASN HBy 1.0 1.8 4.33 1421 1322 A 24 ILE HD1% A 31 ASN HBx 1.0 1.8 4.33 1422 1323 A 24 ILE HD1% A 31 ASN HD21 1.0 1.8 5.27 1423 1323 A 24 ILE HD1% A 31 ASN HD22 1.0 1.8 5.27 1424 1324 A 25 GLU HA A 25 GLU HGy 1.0 1.8 3.84 1425 1324 A 25 GLU HA A 25 GLU HGx 1.0 1.8 3.84 1426 1325 A 26 LYS H A 25 GLU HBy 1.0 1.8 4.81 1427 1325 A 26 LYS H A 25 GLU HBx 1.0 1.8 4.81 1428 1326 A 34 ASN HD21 A 25 GLU HBx 1.0 1.8 3.73 1429 1326 A 34 ASN HD22 A 25 GLU HBx 1.0 1.8 3.73 1430 1326 A 34 ASN HD21 A 25 GLU HBy 1.0 1.8 3.73 1431 1326 A 34 ASN HD22 A 25 GLU HBy 1.0 1.8 3.73 1432 1327 A 26 LYS H A 25 GLU HGy 1.0 1.8 4.27 1433 1327 A 26 LYS H A 25 GLU HGx 1.0 1.8 4.27 1434 1328 A 32 LEU H A 25 GLU HGy 1.0 1.8 5.87 1435 1328 A 32 LEU H A 25 GLU HGx 1.0 1.8 5.87 1436 1329 A 29 GLY HAx A 26 LYS HDy 1.0 1.8 4.87 1437 1329 A 29 GLY HAx A 26 LYS HDx 1.0 1.8 4.87 1438 1330 A 30 ARG HA A 26 LYS HDy 1.0 1.8 4.54 1439 1330 A 30 ARG HA A 26 LYS HDx 1.0 1.8 4.54 1440 1331 A 31 ASN H A 26 LYS HDy 1.0 1.8 5.25 1441 1331 A 31 ASN H A 26 LYS HDx 1.0 1.8 5.25 1442 1332 A 30 ARG HBx A 30 ARG HDy 1.0 1.8 3.69 1443 1332 A 30 ARG HBx A 30 ARG HDx 1.0 1.8 3.69 1444 1333 A 30 ARG HBy A 30 ARG HDy 1.0 1.8 3.66 1445 1333 A 30 ARG HBy A 30 ARG HDx 1.0 1.8 3.66 1446 1334 A 32 LEU HD2% A 30 ARG HDy 1.0 1.8 4.25 1447 1334 A 32 LEU HD2% A 30 ARG HDx 1.0 1.8 4.25 1448 1335 A 31 ASN H A 31 ASN HBy 1.0 1.8 3.58 1449 1335 A 31 ASN H A 31 ASN HBx 1.0 1.8 3.58 1450 1336 A 31 ASN HD22 A 31 ASN HBx 1.0 1.8 3.52 1451 1336 A 31 ASN HD22 A 31 ASN HBy 1.0 1.8 3.52 1452 1336 A 31 ASN HD21 A 31 ASN HBx 1.0 1.8 3.52 1453 1336 A 31 ASN HD21 A 31 ASN HBy 1.0 1.8 3.52 1454 1337 A 32 LEU H A 31 ASN HBy 1.0 1.8 4.55 1455 1337 A 32 LEU H A 31 ASN HBx 1.0 1.8 4.55 1456 1338 A 35 TYR HEy A 33 ARG HBy 1.0 1.8 5.37 1457 1338 A 35 TYR HEy A 33 ARG HBx 1.0 1.8 5.37 1458 1339 A 35 TYR H A 34 ASN HBx 1.0 1.8 4.30 1459 1339 A 35 TYR H A 34 ASN HBy 1.0 1.8 4.30 1460 1340 A 50 THR HG2% A 34 ASN HBx 1.0 1.8 4.19 1461 1340 A 50 THR HG2% A 34 ASN HBy 1.0 1.8 4.19 1462 1341 A 36 THR H A 35 TYR HBy 1.0 1.8 4.86 1463 1341 A 36 THR H A 35 TYR HBx 1.0 1.8 4.86 1464 1342 A 37 LEU HD1% A 35 TYR HBy 1.0 1.8 5.17 1465 1342 A 37 LEU HD1% A 35 TYR HBx 1.0 1.8 5.17 1466 1343 A 35 TYR HEy A 53 SER HBx 1.0 1.8 4.38 1467 1343 A 35 TYR HEy A 53 SER HBy 1.0 1.8 4.38 1468 1344 A 36 THR HG2% A 48 GLN HE21 1.0 1.8 3.89 1469 1344 A 36 THR HG2% A 48 GLN HE22 1.0 1.8 3.89 1470 1345 A 37 LEU H A 48 GLN HGy 1.0 1.8 5.40 1471 1345 A 37 LEU H A 48 GLN HGx 1.0 1.8 5.40 1472 1346 A 37 LEU HBy A 38 PRO HGx 1.0 1.8 5.04 1473 1346 A 37 LEU HBy A 38 PRO HGy 1.0 1.8 5.04 1474 1347 A 37 LEU HD2% A 38 PRO HGx 1.0 1.8 4.64 1475 1347 A 37 LEU HD2% A 38 PRO HGy 1.0 1.8 4.64 1476 1348 A 38 PRO HBy A 46 LYS HEx 1.0 1.8 3.97 1477 1348 A 38 PRO HBy A 46 LYS HEy 1.0 1.8 3.97 1478 1349 A 38 PRO HBx A 46 LYS HGy 1.0 1.8 4.81 1479 1349 A 38 PRO HBx A 46 LYS HGx 1.0 1.8 4.81 1480 1350 A 38 PRO HBx A 46 LYS HEx 1.0 1.8 4.82 1481 1350 A 38 PRO HBx A 46 LYS HEy 1.0 1.8 4.82 1482 1351 A 39 ALA H A 38 PRO HGx 1.0 1.8 5.12 1483 1351 A 39 ALA H A 38 PRO HGy 1.0 1.8 5.12 1484 1352 A 40 TYR HEy A 38 PRO HGx 1.0 1.8 5.44 1485 1352 A 40 TYR HEy A 38 PRO HGy 1.0 1.8 5.44 1486 1353 A 38 PRO HGy A 46 LYS HEx 1.0 1.8 4.76 1487 1353 A 38 PRO HGx A 46 LYS HEx 1.0 1.8 4.76 1488 1353 A 46 LYS HEy A 38 PRO HGx 1.0 1.8 4.76 1489 1353 A 38 PRO HGy A 46 LYS HEy 1.0 1.8 4.76 1490 1354 A 39 ALA H A 46 LYS HGy 1.0 1.8 5.05 1491 1354 A 39 ALA H A 46 LYS HGx 1.0 1.8 5.05 1492 1355 A 39 ALA H A 47 LYS HBx 1.0 1.8 5.87 1493 1355 A 39 ALA H A 47 LYS HBy 1.0 1.8 5.87 1494 1356 A 40 TYR HDy A 46 LYS HGy 1.0 1.8 5.87 1495 1356 A 40 TYR HDy A 46 LYS HGx 1.0 1.8 5.87 1496 1357 A 40 TYR HDy A 46 LYS HDx 1.0 1.8 5.87 1497 1357 A 40 TYR HDy A 46 LYS HDy 1.0 1.8 5.87 1498 1358 A 40 TYR HDy A 105 LYS HEy 1.0 1.8 3.39 1499 1358 A 40 TYR HDy A 105 LYS HEx 1.0 1.8 3.39 1500 1359 A 40 TYR HEx A 46 LYS HGy 1.0 1.8 4.87 1501 1359 A 40 TYR HEx A 46 LYS HGx 1.0 1.8 4.87 1502 1360 A 40 TYR HEx A 105 LYS HEy 1.0 1.8 3.99 1503 1360 A 40 TYR HEx A 105 LYS HEx 1.0 1.8 3.99 1504 1361 A 40 TYR HEy A 46 LYS HGy 1.0 1.8 5.81 1505 1361 A 40 TYR HEy A 46 LYS HGx 1.0 1.8 5.81 1506 1362 A 40 TYR HDx A 46 LYS HGy 1.0 1.8 5.87 1507 1362 A 40 TYR HDx A 46 LYS HGx 1.0 1.8 5.87 1508 1363 A 42 GLU H A 41 ASP HBx 1.0 1.8 3.28 1509 1363 A 42 GLU H A 41 ASP HBy 1.0 1.8 3.28 1510 1364 A 42 GLU HA A 41 ASP HBx 1.0 1.8 5.19 1511 1364 A 42 GLU HA A 41 ASP HBy 1.0 1.8 5.19 1512 1365 A 43 ASP H A 41 ASP HBx 1.0 1.8 4.04 1513 1365 A 43 ASP H A 41 ASP HBy 1.0 1.8 4.04 1514 1366 A 44 GLY H A 41 ASP HBx 1.0 1.8 4.65 1515 1366 A 44 GLY H A 41 ASP HBy 1.0 1.8 4.65 1516 1367 A 42 GLU H A 42 GLU HBy 1.0 1.8 3.61 1517 1367 A 42 GLU H A 42 GLU HBx 1.0 1.8 3.61 1518 1368 A 42 GLU H A 42 GLU HGx 1.0 1.8 4.50 1519 1368 A 42 GLU H A 42 GLU HGy 1.0 1.8 4.50 1520 1369 A 42 GLU HA A 42 GLU HGx 1.0 1.8 3.87 1521 1369 A 42 GLU HA A 42 GLU HGy 1.0 1.8 3.87 1522 1370 A 42 GLU HA A 99 PRO HBy 1.0 1.8 4.11 1523 1370 A 42 GLU HA A 99 PRO HBx 1.0 1.8 4.11 1524 1371 A 42 GLU HA A 99 PRO HGy 1.0 1.8 4.11 1525 1371 A 42 GLU HA A 99 PRO HGx 1.0 1.8 4.11 1526 1372 A 43 ASP H A 42 GLU HGx 1.0 1.8 4.83 1527 1372 A 43 ASP H A 42 GLU HGy 1.0 1.8 4.83 1528 1373 A 43 ASP H A 43 ASP HBx 1.0 1.8 3.20 1529 1373 A 43 ASP H A 43 ASP HBy 1.0 1.8 3.20 1530 1374 A 44 GLY H A 43 ASP HBx 1.0 1.8 4.13 1531 1374 A 44 GLY H A 43 ASP HBy 1.0 1.8 4.13 1532 1375 A 45 VAL H A 43 ASP HBx 1.0 1.8 4.48 1533 1375 A 45 VAL H A 43 ASP HBy 1.0 1.8 4.48 1534 1376 A 44 GLY HAy A 105 LYS HDy 1.0 1.8 5.87 1535 1376 A 44 GLY HAy A 105 LYS HDx 1.0 1.8 5.87 1536 1377 A 44 GLY HAx A 105 LYS HEy 1.0 1.8 5.21 1537 1377 A 44 GLY HAx A 105 LYS HEx 1.0 1.8 5.21 1538 1378 A 45 VAL HG1% A 47 LYS HGx 1.0 1.8 3.92 1539 1378 A 45 VAL HG1% A 47 LYS HGy 1.0 1.8 3.92 1540 1379 A 46 LYS H A 46 LYS HGy 1.0 1.8 5.33 1541 1379 A 46 LYS H A 46 LYS HGx 1.0 1.8 5.33 1542 1380 A 46 LYS H A 105 LYS HEy 1.0 1.8 5.69 1543 1380 A 46 LYS H A 105 LYS HEx 1.0 1.8 5.69 1544 1381 A 46 LYS HA A 46 LYS HGy 1.0 1.8 3.62 1545 1381 A 46 LYS HA A 46 LYS HGx 1.0 1.8 3.62 1546 1382 A 46 LYS HBy A 46 LYS HEx 1.0 1.8 4.73 1547 1382 A 46 LYS HBy A 46 LYS HEy 1.0 1.8 4.73 1548 1383 A 46 LYS HEx A 46 LYS HGy 1.0 1.8 3.66 1549 1383 A 46 LYS HEy A 46 LYS HGy 1.0 1.8 3.66 1550 1383 A 46 LYS HGx A 46 LYS HEx 1.0 1.8 3.66 1551 1383 A 46 LYS HEy A 46 LYS HGx 1.0 1.8 3.66 1552 1384 A 47 LYS H A 46 LYS HGy 1.0 1.8 3.96 1553 1384 A 47 LYS H A 46 LYS HGx 1.0 1.8 3.96 1554 1385 A 47 LYS H A 46 LYS HEx 1.0 1.8 5.87 1555 1385 A 47 LYS H A 46 LYS HEy 1.0 1.8 5.87 1556 1386 A 47 LYS H A 47 LYS HBx 1.0 1.8 3.89 1557 1386 A 47 LYS H A 47 LYS HBy 1.0 1.8 3.89 1558 1387 A 47 LYS HA A 47 LYS HGx 1.0 1.8 3.76 1559 1387 A 47 LYS HA A 47 LYS HGy 1.0 1.8 3.76 1560 1388 A 48 GLN H A 47 LYS HBx 1.0 1.8 3.96 1561 1388 A 48 GLN H A 47 LYS HBy 1.0 1.8 3.96 1562 1389 A 48 GLN H A 47 LYS HGx 1.0 1.8 4.85 1563 1389 A 48 GLN H A 47 LYS HGy 1.0 1.8 4.85 1564 1390 A 48 GLN H A 48 GLN HGy 1.0 1.8 4.60 1565 1390 A 48 GLN H A 48 GLN HGx 1.0 1.8 4.60 1566 1391 A 48 GLN H A 49 ILE HG1x 1.0 1.8 5.87 1567 1391 A 48 GLN H A 49 ILE HG1y 1.0 1.8 5.87 1568 1392 A 48 GLN HA A 48 GLN HGy 1.0 1.8 4.02 1569 1392 A 48 GLN HA A 48 GLN HGx 1.0 1.8 4.02 1570 1393 A 48 GLN HE21 A 48 GLN HBx 1.0 1.8 4.25 1571 1393 A 48 GLN HE22 A 48 GLN HBx 1.0 1.8 4.25 1572 1393 A 48 GLN HE21 A 48 GLN HBy 1.0 1.8 4.25 1573 1393 A 48 GLN HE22 A 48 GLN HBy 1.0 1.8 4.25 1574 1394 A 48 GLN HE21 A 48 GLN HGx 1.0 1.8 3.29 1575 1394 A 48 GLN HE21 A 48 GLN HGy 1.0 1.8 3.29 1576 1394 A 48 GLN HE22 A 48 GLN HGx 1.0 1.8 3.29 1577 1394 A 48 GLN HE22 A 48 GLN HGy 1.0 1.8 3.29 1578 1395 A 49 ILE H A 48 GLN HGy 1.0 1.8 4.22 1579 1395 A 49 ILE H A 48 GLN HGx 1.0 1.8 4.22 1580 1396 A 49 ILE H A 49 ILE HG1x 1.0 1.8 5.10 1581 1396 A 49 ILE H A 49 ILE HG1y 1.0 1.8 5.10 1582 1397 A 49 ILE HA A 49 ILE HG1x 1.0 1.8 3.98 1583 1397 A 49 ILE HA A 49 ILE HG1y 1.0 1.8 3.98 1584 1398 A 49 ILE HG2% A 49 ILE HG1x 1.0 1.8 3.63 1585 1398 A 49 ILE HG2% A 49 ILE HG1y 1.0 1.8 3.63 1586 1399 A 52 ARG HA A 52 ARG HGy 1.0 1.8 4.11 1587 1399 A 52 ARG HA A 52 ARG HGx 1.0 1.8 4.11 1588 1400 A 53 SER H A 52 ARG HBy 1.0 1.8 4.49 1589 1400 A 53 SER H A 52 ARG HBx 1.0 1.8 4.49 1590 1401 A 53 SER H A 52 ARG HGy 1.0 1.8 4.51 1591 1401 A 53 SER H A 52 ARG HGx 1.0 1.8 4.51 1592 1402 A 53 SER H A 53 SER HBx 1.0 1.8 4.03 1593 1402 A 53 SER H A 53 SER HBy 1.0 1.8 4.03 1594 1403 A 62 LEU HD1% A 53 SER HBx 1.0 1.8 5.05 1595 1403 A 62 LEU HD1% A 53 SER HBy 1.0 1.8 5.05 1596 1404 A 63 ASN HA A 64 LYS HBy 1.0 1.8 4.89 1597 1404 A 63 ASN HA A 64 LYS HBx 1.0 1.8 4.89 1598 1405 A 63 ASN HBx A 63 ASN HD22 1.0 1.8 3.51 1599 1405 A 63 ASN HBy A 63 ASN HD22 1.0 1.8 3.51 1600 1405 A 63 ASN HD21 A 63 ASN HBy 1.0 1.8 3.51 1601 1405 A 63 ASN HBx A 63 ASN HD21 1.0 1.8 3.51 1602 1406 A 64 LYS H A 63 ASN HBy 1.0 1.8 4.33 1603 1406 A 64 LYS H A 63 ASN HBx 1.0 1.8 4.33 1604 1407 A 66 ALA H A 63 ASN HBy 1.0 1.8 5.58 1605 1407 A 66 ALA H A 63 ASN HBx 1.0 1.8 5.58 1606 1408 A 66 ALA HB% A 63 ASN HBy 1.0 1.8 3.83 1607 1408 A 66 ALA HB% A 63 ASN HBx 1.0 1.8 3.83 1608 1409 A 66 ALA HA A 63 ASN HD22 1.0 1.8 5.65 1609 1409 A 66 ALA HA A 63 ASN HD21 1.0 1.8 5.65 1610 1410 A 66 ALA HB% A 63 ASN HD22 1.0 1.8 5.14 1611 1410 A 66 ALA HB% A 63 ASN HD21 1.0 1.8 5.14 1612 1411 A 64 LYS H A 64 LYS HGx 1.0 1.8 4.87 1613 1411 A 64 LYS H A 64 LYS HGy 1.0 1.8 4.87 1614 1412 A 64 LYS HBx A 64 LYS HEx 1.0 1.8 5.02 1615 1412 A 64 LYS HBy A 64 LYS HEx 1.0 1.8 5.02 1616 1412 A 64 LYS HEy A 64 LYS HBy 1.0 1.8 5.02 1617 1412 A 64 LYS HBx A 64 LYS HEy 1.0 1.8 5.02 1618 1413 A 65 TYR H A 64 LYS HBy 1.0 1.8 4.48 1619 1413 A 65 TYR H A 64 LYS HBx 1.0 1.8 4.48 1620 1414 A 64 LYS HEy A 64 LYS HGx 1.0 1.8 3.62 1621 1414 A 64 LYS HEx A 64 LYS HGx 1.0 1.8 3.62 1622 1414 A 64 LYS HGy A 64 LYS HEx 1.0 1.8 3.62 1623 1414 A 64 LYS HGy A 64 LYS HEy 1.0 1.8 3.62 1624 1415 A 65 TYR HEy A 65 TYR HBy 1.0 1.8 4.92 1625 1415 A 65 TYR HBx A 65 TYR HEy 1.0 1.8 4.92 1626 1416 A 66 ALA HB% A 92 GLU HGy 1.0 1.8 4.26 1627 1416 A 66 ALA HB% A 92 GLU HGx 1.0 1.8 4.26 1628 1417 A 67 PHE H A 92 GLU HGy 1.0 1.8 5.58 1629 1417 A 67 PHE H A 92 GLU HGx 1.0 1.8 5.58 1630 1418 A 67 PHE HDx A 95 LYS HGx 1.0 1.8 5.83 1631 1418 A 67 PHE HDx A 95 LYS HGy 1.0 1.8 5.83 1632 1419 A 68 LEU H A 68 LEU HBx 1.0 1.8 3.62 1633 1419 A 68 LEU H A 68 LEU HBy 1.0 1.8 3.62 1634 1420 A 68 LEU HA A 92 GLU HGy 1.0 1.8 5.68 1635 1420 A 68 LEU HA A 92 GLU HGx 1.0 1.8 5.68 1636 1421 A 68 LEU HD2% A 68 LEU HBx 1.0 1.8 3.58 1637 1421 A 68 LEU HD2% A 68 LEU HBy 1.0 1.8 3.58 1638 1422 A 69 ARG H A 68 LEU HBx 1.0 1.8 4.26 1639 1422 A 69 ARG H A 68 LEU HBy 1.0 1.8 4.26 1640 1423 A 90 TYR HDy A 68 LEU HBx 1.0 1.8 5.64 1641 1423 A 90 TYR HDy A 68 LEU HBy 1.0 1.8 5.64 1642 1424 A 69 ARG H A 69 ARG HBx 1.0 1.8 3.90 1643 1424 A 69 ARG H A 69 ARG HBy 1.0 1.8 3.90 1644 1425 A 69 ARG H A 91 GLU HBy 1.0 1.8 5.01 1645 1425 A 69 ARG H A 91 GLU HBx 1.0 1.8 5.01 1646 1426 A 69 ARG H A 91 GLU HGx 1.0 1.8 5.38 1647 1426 A 69 ARG H A 91 GLU HGy 1.0 1.8 5.38 1648 1427 A 69 ARG HBy A 69 ARG HDx 1.0 1.8 3.64 1649 1427 A 69 ARG HBx A 69 ARG HDx 1.0 1.8 3.64 1650 1427 A 69 ARG HDy A 69 ARG HBx 1.0 1.8 3.64 1651 1427 A 69 ARG HBy A 69 ARG HDy 1.0 1.8 3.64 1652 1428 A 70 LEU H A 69 ARG HBx 1.0 1.8 4.71 1653 1428 A 70 LEU H A 69 ARG HBy 1.0 1.8 4.71 1654 1429 A 69 ARG HBx A 91 GLU HGx 1.0 1.8 4.64 1655 1429 A 69 ARG HBy A 91 GLU HGx 1.0 1.8 4.64 1656 1429 A 91 GLU HGy A 69 ARG HBx 1.0 1.8 4.64 1657 1429 A 69 ARG HBy A 91 GLU HGy 1.0 1.8 4.64 1658 1430 A 93 ILE HD1% A 69 ARG HBx 1.0 1.8 3.98 1659 1430 A 93 ILE HD1% A 69 ARG HBy 1.0 1.8 3.98 1660 1431 A 93 ILE HG2% A 69 ARG HDx 1.0 1.8 5.50 1661 1431 A 93 ILE HG2% A 69 ARG HDy 1.0 1.8 5.50 1662 1432 A 71 TYR H A 70 LEU HBy 1.0 1.8 4.14 1663 1432 A 71 TYR H A 70 LEU HBx 1.0 1.8 4.14 1664 1433 A 87 VAL HG1% A 70 LEU HBy 1.0 1.8 3.76 1665 1433 A 87 VAL HG1% A 70 LEU HBx 1.0 1.8 3.76 1666 1434 A 87 VAL HG2% A 70 LEU HBy 1.0 1.8 4.19 1667 1434 A 87 VAL HG2% A 70 LEU HBx 1.0 1.8 4.19 1668 1435 A 71 TYR HBx A 88 LYS HBy 1.0 1.8 5.87 1669 1435 A 71 TYR HBx A 88 LYS HBx 1.0 1.8 5.87 1670 1436 A 71 TYR HBx A 89 SER HBx 1.0 1.8 4.80 1671 1436 A 71 TYR HBx A 89 SER HBy 1.0 1.8 4.80 1672 1437 A 71 TYR HBy A 88 LYS HBy 1.0 1.8 5.87 1673 1437 A 71 TYR HBy A 88 LYS HBx 1.0 1.8 5.87 1674 1438 A 71 TYR HBy A 89 SER HBx 1.0 1.8 5.70 1675 1438 A 71 TYR HBy A 89 SER HBy 1.0 1.8 5.70 1676 1439 A 71 TYR HDx A 89 SER HBx 1.0 1.8 4.55 1677 1439 A 71 TYR HDx A 89 SER HBy 1.0 1.8 4.55 1678 1440 A 72 VAL HGy% A 73 ASP HBx 1.0 1.8 5.53 1679 1440 A 72 VAL HGy% A 73 ASP HBy 1.0 1.8 5.53 1680 1441 A 73 ASP H A 73 ASP HBx 1.0 1.8 3.71 1681 1441 A 73 ASP H A 73 ASP HBy 1.0 1.8 3.71 1682 1442 A 74 GLN H A 73 ASP HBx 1.0 1.8 4.61 1683 1442 A 74 GLN H A 73 ASP HBy 1.0 1.8 4.61 1684 1443 A 88 LYS HGy A 73 ASP HBx 1.0 1.8 4.30 1685 1443 A 88 LYS HGy A 73 ASP HBy 1.0 1.8 4.30 1686 1444 A 88 LYS HGx A 73 ASP HBx 1.0 1.8 5.53 1687 1444 A 88 LYS HGx A 73 ASP HBy 1.0 1.8 5.53 1688 1445 A 75 ASP H A 75 ASP HBy 1.0 1.8 3.97 1689 1445 A 75 ASP H A 75 ASP HBx 1.0 1.8 3.97 1690 1446 A 76 ASP H A 75 ASP HBy 1.0 1.8 4.26 1691 1446 A 76 ASP H A 75 ASP HBx 1.0 1.8 4.26 1692 1447 A 76 ASP H A 76 ASP HBx 1.0 1.8 3.69 1693 1447 A 76 ASP H A 76 ASP HBy 1.0 1.8 3.69 1694 1448 A 77 ASN H A 77 ASN HBy 1.0 1.8 3.92 1695 1448 A 77 ASN H A 77 ASN HBx 1.0 1.8 3.92 1696 1449 A 77 ASN HBy A 77 ASN HD22 1.0 1.8 3.53 1697 1449 A 77 ASN HBx A 77 ASN HD22 1.0 1.8 3.53 1698 1449 A 77 ASN HD21 A 77 ASN HBy 1.0 1.8 3.53 1699 1449 A 77 ASN HBx A 77 ASN HD21 1.0 1.8 3.53 1700 1450 A 82 ILE HA A 82 ILE HG1x 1.0 1.8 3.90 1701 1450 A 82 ILE HA A 82 ILE HG1y 1.0 1.8 3.90 1702 1451 A 82 ILE HG2% A 83 SER HBx 1.0 1.8 4.77 1703 1451 A 82 ILE HG2% A 83 SER HBy 1.0 1.8 4.77 1704 1452 A 84 SER H A 83 SER HBx 1.0 1.8 4.09 1705 1452 A 84 SER H A 83 SER HBy 1.0 1.8 4.09 1706 1453 A 84 SER H A 84 SER HBx 1.0 1.8 3.92 1707 1453 A 84 SER H A 84 SER HBy 1.0 1.8 3.92 1708 1454 A 85 ILE HA A 85 ILE HG1x 1.0 1.8 3.89 1709 1454 A 85 ILE HA A 85 ILE HG1y 1.0 1.8 3.89 1710 1455 A 85 ILE HG2% A 85 ILE HG1x 1.0 1.8 3.58 1711 1455 A 85 ILE HG2% A 85 ILE HG1y 1.0 1.8 3.58 1712 1456 A 88 LYS H A 88 LYS HBy 1.0 1.8 3.78 1713 1456 A 88 LYS H A 88 LYS HBx 1.0 1.8 3.78 1714 1457 A 89 SER H A 88 LYS HBy 1.0 1.8 4.07 1715 1457 A 89 SER H A 88 LYS HBx 1.0 1.8 4.07 1716 1458 A 88 LYS HGy A 89 SER HBx 1.0 1.8 5.54 1717 1458 A 88 LYS HGy A 89 SER HBy 1.0 1.8 5.54 1718 1459 A 88 LYS HGx A 89 SER HBx 1.0 1.8 5.39 1719 1459 A 88 LYS HGx A 89 SER HBy 1.0 1.8 5.39 1720 1460 A 89 SER H A 89 SER HBx 1.0 1.8 3.79 1721 1460 A 89 SER H A 89 SER HBy 1.0 1.8 3.79 1722 1461 A 90 TYR H A 89 SER HBx 1.0 1.8 4.16 1723 1461 A 90 TYR H A 89 SER HBy 1.0 1.8 4.16 1724 1462 A 90 TYR HDx A 89 SER HBx 1.0 1.8 5.80 1725 1462 A 90 TYR HDx A 89 SER HBy 1.0 1.8 5.80 1726 1463 A 91 GLU H A 91 GLU HGx 1.0 1.8 4.66 1727 1463 A 91 GLU H A 91 GLU HGy 1.0 1.8 4.66 1728 1464 A 91 GLU HA A 92 GLU HBy 1.0 1.8 4.99 1729 1464 A 91 GLU HA A 92 GLU HBx 1.0 1.8 4.99 1730 1465 A 92 GLU H A 91 GLU HBy 1.0 1.8 4.30 1731 1465 A 92 GLU H A 91 GLU HBx 1.0 1.8 4.30 1732 1466 A 93 ILE HG2% A 91 GLU HBy 1.0 1.8 4.30 1733 1466 A 93 ILE HG2% A 91 GLU HBx 1.0 1.8 4.30 1734 1467 A 92 GLU H A 91 GLU HGx 1.0 1.8 4.93 1735 1467 A 92 GLU H A 91 GLU HGy 1.0 1.8 4.93 1736 1468 A 93 ILE HG2% A 91 GLU HGx 1.0 1.8 4.38 1737 1468 A 93 ILE HG2% A 91 GLU HGy 1.0 1.8 4.38 1738 1469 A 92 GLU H A 92 GLU HGy 1.0 1.8 4.62 1739 1469 A 92 GLU H A 92 GLU HGx 1.0 1.8 4.62 1740 1470 A 93 ILE H A 92 GLU HBy 1.0 1.8 4.25 1741 1470 A 93 ILE H A 92 GLU HBx 1.0 1.8 4.25 1742 1471 A 93 ILE HA A 94 GLN HE21 1.0 1.8 4.96 1743 1471 A 93 ILE HA A 94 GLN HE22 1.0 1.8 4.96 1744 1472 A 93 ILE HG2% A 94 GLN HE21 1.0 1.8 5.26 1745 1472 A 93 ILE HG2% A 94 GLN HE22 1.0 1.8 5.26 1746 1473 A 94 GLN HGy A 94 GLN HE21 1.0 1.8 3.69 1747 1473 A 94 GLN HGy A 94 GLN HE22 1.0 1.8 3.69 1748 1474 A 96 ALA HB% A 94 GLN HE21 1.0 1.8 5.52 1749 1474 A 96 ALA HB% A 94 GLN HE22 1.0 1.8 5.52 1750 1475 A 95 LYS H A 95 LYS HBx 1.0 1.8 3.17 1751 1475 A 95 LYS H A 95 LYS HBy 1.0 1.8 3.17 1752 1476 A 95 LYS H A 95 LYS HGx 1.0 1.8 4.40 1753 1476 A 95 LYS H A 95 LYS HGy 1.0 1.8 4.40 1754 1477 A 95 LYS HA A 95 LYS HGx 1.0 1.8 3.66 1755 1477 A 95 LYS HA A 95 LYS HGy 1.0 1.8 3.66 1756 1478 A 96 ALA H A 95 LYS HBx 1.0 1.8 3.55 1757 1478 A 96 ALA H A 95 LYS HBy 1.0 1.8 3.55 1758 1479 A 96 ALA HA A 95 LYS HBx 1.0 1.8 5.32 1759 1479 A 96 ALA HA A 95 LYS HBy 1.0 1.8 5.32 1760 1480 A 96 ALA HB% A 95 LYS HBx 1.0 1.8 4.54 1761 1480 A 96 ALA HB% A 95 LYS HBy 1.0 1.8 4.54 1762 1481 A 95 LYS HEx A 95 LYS HGx 1.0 1.8 3.58 1763 1481 A 95 LYS HEy A 95 LYS HGx 1.0 1.8 3.58 1764 1481 A 95 LYS HGy A 95 LYS HEx 1.0 1.8 3.58 1765 1481 A 95 LYS HGy A 95 LYS HEy 1.0 1.8 3.58 1766 1482 A 96 ALA H A 95 LYS HGx 1.0 1.8 5.10 1767 1482 A 96 ALA H A 95 LYS HGy 1.0 1.8 5.10 1768 1483 A 98 LEU HD1% A 95 LYS HGx 1.0 1.8 3.75 1769 1483 A 98 LEU HD1% A 95 LYS HGy 1.0 1.8 3.75 1770 1484 A 96 ALA HA A 103 LYS HEy 1.0 1.8 5.02 1771 1484 A 96 ALA HA A 103 LYS HEx 1.0 1.8 5.02 1772 1485 A 98 LEU HA A 99 PRO HGy 1.0 1.8 4.81 1773 1485 A 98 LEU HA A 99 PRO HGx 1.0 1.8 4.81 1774 1486 A 98 LEU HA A 99 PRO HDy 1.0 1.8 3.52 1775 1486 A 98 LEU HA A 99 PRO HDx 1.0 1.8 3.52 1776 1487 A 98 LEU HBy A 99 PRO HDy 1.0 1.8 4.20 1777 1487 A 98 LEU HBy A 99 PRO HDx 1.0 1.8 4.20 1778 1488 A 98 LEU HD1% A 103 LYS HEy 1.0 1.8 5.50 1779 1488 A 98 LEU HD1% A 103 LYS HEx 1.0 1.8 5.50 1780 1489 A 100 GLU H A 99 PRO HBy 1.0 1.8 3.89 1781 1489 A 100 GLU H A 99 PRO HBx 1.0 1.8 3.89 1782 1490 A 101 LYS H A 99 PRO HBy 1.0 1.8 4.53 1783 1490 A 101 LYS H A 99 PRO HBx 1.0 1.8 4.53 1784 1491 A 102 VAL H A 99 PRO HBy 1.0 1.8 4.82 1785 1491 A 102 VAL H A 99 PRO HBx 1.0 1.8 4.82 1786 1492 A 102 VAL HG2% A 99 PRO HBy 1.0 1.8 4.32 1787 1492 A 102 VAL HG2% A 99 PRO HBx 1.0 1.8 4.32 1788 1493 A 101 LYS H A 99 PRO HGy 1.0 1.8 4.22 1789 1493 A 101 LYS H A 99 PRO HGx 1.0 1.8 4.22 1790 1494 A 102 VAL H A 99 PRO HGy 1.0 1.8 4.87 1791 1494 A 102 VAL H A 99 PRO HGx 1.0 1.8 4.87 1792 1495 A 102 VAL HG2% A 99 PRO HGy 1.0 1.8 3.67 1793 1495 A 102 VAL HG2% A 99 PRO HGx 1.0 1.8 3.67 1794 1496 A 102 VAL H A 99 PRO HDy 1.0 1.8 5.83 1795 1496 A 102 VAL H A 99 PRO HDx 1.0 1.8 5.83 1796 1497 A 102 VAL HB A 99 PRO HDy 1.0 1.8 4.27 1797 1497 A 102 VAL HB A 99 PRO HDx 1.0 1.8 4.27 1798 1498 A 102 VAL HG1% A 99 PRO HDy 1.0 1.8 4.54 1799 1498 A 102 VAL HG1% A 99 PRO HDx 1.0 1.8 4.54 1800 1499 A 102 VAL HG2% A 99 PRO HDy 1.0 1.8 3.73 1801 1499 A 102 VAL HG2% A 99 PRO HDx 1.0 1.8 3.73 1802 1500 A 100 GLU HA A 103 LYS HEy 1.0 1.8 4.48 1803 1500 A 100 GLU HA A 103 LYS HEx 1.0 1.8 4.48 1804 1501 A 100 GLU HGy A 103 LYS HEy 1.0 1.8 5.06 1805 1501 A 100 GLU HGy A 103 LYS HEx 1.0 1.8 5.06 1806 1502 A 101 LYS HA A 101 LYS HGx 1.0 1.8 3.45 1807 1502 A 101 LYS HA A 101 LYS HGy 1.0 1.8 3.45 1808 1503 A 101 LYS HA A 101 LYS HEy 1.0 1.8 4.97 1809 1503 A 101 LYS HA A 101 LYS HEx 1.0 1.8 4.97 1810 1504 A 101 LYS HBy A 101 LYS HGx 1.0 1.8 2.86 1811 1504 A 101 LYS HBy A 101 LYS HGy 1.0 1.8 2.86 1812 1505 A 101 LYS HBx A 101 LYS HEy 1.0 1.8 2.64 1813 1505 A 101 LYS HBx A 101 LYS HEx 1.0 1.8 2.64 1814 1506 A 102 VAL H A 101 LYS HGx 1.0 1.8 4.99 1815 1506 A 102 VAL H A 101 LYS HGy 1.0 1.8 4.99 1816 1507 A 102 VAL HA A 105 LYS HDy 1.0 1.8 5.87 1817 1507 A 102 VAL HA A 105 LYS HDx 1.0 1.8 5.87 1818 1508 A 103 LYS HBx A 103 LYS HEy 1.0 1.8 3.29 1819 1508 A 103 LYS HBx A 103 LYS HEx 1.0 1.8 3.29 1820 1509 A 103 LYS HGx A 103 LYS HEy 1.0 1.8 3.31 1821 1509 A 103 LYS HGx A 103 LYS HEx 1.0 1.8 3.31 1822 1510 A 103 LYS HGy A 103 LYS HEy 1.0 1.8 3.81 1823 1510 A 103 LYS HGy A 103 LYS HEx 1.0 1.8 3.81 1824 1511 A 103 LYS HDy A 103 LYS HEy 1.0 1.8 2.79 1825 1511 A 103 LYS HDy A 103 LYS HEx 1.0 1.8 2.79 1826 1512 A 105 LYS H A 105 LYS HDy 1.0 1.8 4.66 1827 1512 A 105 LYS H A 105 LYS HDx 1.0 1.8 4.66 1828 1513 A 105 LYS HA A 105 LYS HDy 1.0 1.8 3.47 1829 1513 A 105 LYS HA A 105 LYS HDx 1.0 1.8 3.47 1830 1514 A 105 LYS HBx A 105 LYS HEy 1.0 1.8 4.46 1831 1514 A 105 LYS HBx A 105 LYS HEx 1.0 1.8 4.46 1832 1515 A 106 PHE HBx A 108 ILE HG1x 1.0 1.8 5.87 1833 1515 A 106 PHE HBx A 108 ILE HG1y 1.0 1.8 5.87 1834 1516 A 107 THR HA A 108 ILE HG1x 1.0 1.8 5.33 1835 1516 A 107 THR HA A 108 ILE HG1y 1.0 1.8 5.33 1836 1517 A 108 ILE H A 108 ILE HG1x 1.0 1.8 4.13 1837 1517 A 108 ILE H A 108 ILE HG1y 1.0 1.8 4.13 1838 1518 A 108 ILE HB A 109 LYS HBx 1.0 1.8 5.18 1839 1518 A 108 ILE HB A 109 LYS HBy 1.0 1.8 5.18 1840 1519 A 109 LYS H A 108 ILE HG1x 1.0 1.8 5.87 1841 1519 A 109 LYS H A 108 ILE HG1y 1.0 1.8 5.87 1842 1520 A 109 LYS H A 109 LYS HBx 1.0 1.8 3.69 1843 1520 A 109 LYS H A 109 LYS HBy 1.0 1.8 3.69 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 14 TYR O A 70 LEU N 1.0 1.8 3.52 2 2 A 70 LEU H A 14 TYR O 1.0 1.8 2.31 3 3 A 16 MET O A 68 LEU N 1.0 1.8 3.52 4 4 A 68 LEU H A 16 MET O 1.0 1.8 2.31 5 5 A 25 GLU O A 32 LEU N 1.0 1.8 3.41 6 6 A 32 LEU H A 25 GLU O 1.0 1.8 2.20 7 7 A 27 VAL O A 30 ARG N 1.0 1.8 3.41 8 8 A 30 ARG H A 27 VAL O 1.0 1.8 2.20 9 9 A 32 LEU O A 25 GLU N 1.0 1.8 3.41 10 10 A 25 GLU H A 32 LEU O 1.0 1.8 2.20 11 11 A 30 ARG O A 27 VAL N 1.0 1.8 3.41 12 12 A 27 VAL H A 30 ARG O 1.0 1.8 2.20 13 13 A 37 LEU O A 49 ILE N 1.0 1.8 3.52 14 14 A 49 ILE H A 37 LEU O 1.0 1.8 2.31 15 15 A 39 ALA O A 47 LYS N 1.0 1.8 3.52 16 16 A 47 LYS H A 39 ALA O 1.0 1.8 2.31 17 17 A 40 TYR O A 15 TYR N 1.0 1.8 3.52 18 18 A 15 TYR H A 40 TYR O 1.0 1.8 2.31 19 19 A 41 ASP O A 44 GLY N 1.0 1.8 3.52 20 20 A 44 GLY H A 41 ASP O 1.0 1.8 2.31 21 21 A 47 LYS O A 39 ALA N 1.0 1.8 3.52 22 22 A 39 ALA H A 47 LYS O 1.0 1.8 2.31 23 23 A 49 ILE O A 37 LEU N 1.0 1.8 3.52 24 24 A 37 LEU H A 49 ILE O 1.0 1.8 2.31 25 25 A 68 LEU O A 16 MET N 1.0 1.8 3.52 26 26 A 16 MET H A 68 LEU O 1.0 1.8 2.31 27 27 A 69 ARG O A 91 GLU N 1.0 1.8 3.52 28 28 A 91 GLU H A 69 ARG O 1.0 1.8 2.31 29 29 A 70 LEU O A 14 TYR N 1.0 1.8 3.52 30 30 A 14 TYR H A 70 LEU O 1.0 1.8 2.31 31 31 A 89 SER O A 71 TYR N 1.0 1.8 3.52 32 32 A 71 TYR H A 89 SER O 1.0 1.8 2.31 33 33 A 91 GLU O A 69 ARG N 1.0 1.8 3.52 34 34 A 69 ARG H A 91 GLU O 1.0 1.8 2.31 35 35 A 105 LYS H A 101 LYS O 1.0 1.8 2.20 36 36 A 106 PHE H A 102 VAL O 1.0 1.8 2.20 37 37 A 107 THR H A 103 LYS O 1.0 1.8 2.20 38 38 A 108 ILE H A 104 ASP O 1.0 1.8 2.20 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 ILE C A 10 GLY N A 10 GLY CA A 10 GLY C 1.0 -157.97 -117.97 PHI 2 2 A 10 GLY N A 10 GLY CA A 10 GLY C A 11 LYS N 1.0 -171.18 -131.18 PSI 3 3 A 12 ASP C A 13 VAL N A 13 VAL CA A 13 VAL C 1.0 -129.97 -89.97 PHI 4 4 A 13 VAL N A 13 VAL CA A 13 VAL C A 14 TYR N 1.0 114.35 154.35 PSI 5 5 A 13 VAL C A 14 TYR N A 14 TYR CA A 14 TYR C 1.0 -145.07 -105.07 PHI 6 6 A 14 TYR N A 14 TYR CA A 14 TYR C A 15 TYR N 1.0 133.84 173.84 PSI 7 7 A 14 TYR C A 15 TYR N A 15 TYR CA A 15 TYR C 1.0 -137.50 -97.50 PHI 8 8 A 15 TYR N A 15 TYR CA A 15 TYR C A 16 MET N 1.0 116.28 156.28 PSI 9 9 A 15 TYR C A 16 MET N A 16 MET CA A 16 MET C 1.0 -162.31 -122.31 PHI 10 10 A 16 MET N A 16 MET CA A 16 MET C A 17 GLN N 1.0 122.62 162.62 PSI 11 11 A 16 MET C A 17 GLN N A 17 GLN CA A 17 GLN C 1.0 -125.36 -85.36 PHI 12 12 A 17 GLN N A 17 GLN CA A 17 GLN C A 18 ILE N 1.0 104.07 144.07 PSI 13 13 A 17 GLN C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -100.22 -60.22 PHI 14 14 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 LYS N 1.0 113.13 153.13 PSI 15 15 A 22 GLY C A 23 THR N A 23 THR CA A 23 THR C 1.0 -123.56 -83.56 PHI 16 16 A 23 THR N A 23 THR CA A 23 THR C A 24 ILE N 1.0 123.01 163.01 PSI 17 17 A 23 THR C A 24 ILE N A 24 ILE CA A 24 ILE C 1.0 -121.37 -81.37 PHI 18 18 A 24 ILE N A 24 ILE CA A 24 ILE C A 25 GLU N 1.0 109.06 149.06 PSI 19 19 A 24 ILE C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -145.88 -105.88 PHI 20 20 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 LYS N 1.0 110.76 150.76 PSI 21 21 A 25 GLU C A 26 LYS N A 26 LYS CA A 26 LYS C 1.0 -117.28 -77.28 PHI 22 22 A 26 LYS N A 26 LYS CA A 26 LYS C A 27 VAL N 1.0 105.53 145.53 PSI 23 23 A 26 LYS C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -135.97 -95.97 PHI 24 24 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 ASP N 1.0 105.36 145.36 PSI 25 25 A 29 GLY C A 30 ARG N A 30 ARG CA A 30 ARG C 1.0 -129.78 -89.78 PHI 26 26 A 30 ARG N A 30 ARG CA A 30 ARG C A 31 ASN N 1.0 121.31 161.31 PSI 27 27 A 30 ARG C A 31 ASN N A 31 ASN CA A 31 ASN C 1.0 -115.38 -75.38 PHI 28 28 A 31 ASN N A 31 ASN CA A 31 ASN C A 32 LEU N 1.0 101.80 141.80 PSI 29 29 A 31 ASN C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -132.00 -90.38 PHI 30 30 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 ARG N 1.0 110.00 160.80 PSI 31 31 A 32 LEU C A 33 ARG N A 33 ARG CA A 33 ARG C 1.0 -130.00 -90.38 PHI 32 32 A 33 ARG N A 33 ARG CA A 33 ARG C A 34 ASN N 1.0 105.00 160.00 PSI 33 33 A 33 ARG C A 34 ASN N A 34 ASN CA A 34 ASN C 1.0 -133.23 -93.23 PHI 34 34 A 34 ASN N A 34 ASN CA A 34 ASN C A 35 TYR N 1.0 120.72 160.72 PSI 35 35 A 34 ASN C A 35 TYR N A 35 TYR CA A 35 TYR C 1.0 -146.56 -106.56 PHI 36 36 A 35 TYR N A 35 TYR CA A 35 TYR C A 36 THR N 1.0 124.82 164.82 PSI 37 37 A 35 TYR C A 36 THR N A 36 THR CA A 36 THR C 1.0 -133.12 -93.12 PHI 38 38 A 36 THR N A 36 THR CA A 36 THR C A 37 LEU N 1.0 110.39 150.39 PSI 39 39 A 36 THR C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -145.69 -105.69 PHI 40 40 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 PRO N 1.0 124.48 164.48 PSI 41 41 A 38 PRO N A 38 PRO CA A 38 PRO C A 39 ALA N 1.0 109.21 149.21 PSI 42 42 A 38 PRO C A 39 ALA N A 39 ALA CA A 39 ALA C 1.0 -158.53 -118.53 PHI 43 43 A 39 ALA N A 39 ALA CA A 39 ALA C A 40 TYR N 1.0 137.94 177.94 PSI 44 44 A 39 ALA C A 40 TYR N A 40 TYR CA A 40 TYR C 1.0 -146.47 -106.47 PHI 45 45 A 40 TYR N A 40 TYR CA A 40 TYR C A 41 ASP N 1.0 123.60 163.60 PSI 46 46 A 41 ASP C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -79.28 -39.28 PHI 47 47 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 ASP N 1.0 -50.11 -10.11 PSI 48 48 A 42 GLU C A 43 ASP N A 43 ASP CA A 43 ASP C 1.0 -113.27 -73.27 PHI 49 49 A 43 ASP N A 43 ASP CA A 43 ASP C A 44 GLY N 1.0 -30.59 9.41 PSI 50 50 A 44 GLY C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -99.72 -59.72 PHI 51 51 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 LYS N 1.0 109.49 149.49 PSI 52 52 A 46 LYS C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -151.82 -111.82 PHI 53 53 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 GLN N 1.0 130.21 170.21 PSI 54 54 A 47 LYS C A 48 GLN N A 48 GLN CA A 48 GLN C 1.0 -138.46 -98.46 PHI 55 55 A 48 GLN N A 48 GLN CA A 48 GLN C A 49 ILE N 1.0 107.44 147.44 PSI 56 56 A 48 GLN C A 49 ILE N A 49 ILE CA A 49 ILE C 1.0 -144.37 -100.37 PHI 57 57 A 49 ILE N A 49 ILE CA A 49 ILE C A 50 THR N 1.0 115.00 160.06 PSI 58 58 A 49 ILE C A 50 THR N A 50 THR CA A 50 THR C 1.0 -133.11 -93.11 PHI 59 59 A 50 THR N A 50 THR CA A 50 THR C A 51 PHE N 1.0 115.87 155.87 PSI 60 60 A 50 THR C A 51 PHE N A 51 PHE CA A 51 PHE C 1.0 -151.77 -111.77 PHI 61 61 A 51 PHE N A 51 PHE CA A 51 PHE C A 52 ARG N 1.0 132.07 172.07 PSI 62 62 A 55 LYS C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -93.67 -53.67 PHI 63 63 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 GLU N 1.0 -49.93 -9.93 PSI 64 64 A 66 ALA C A 67 PHE N A 67 PHE CA A 67 PHE C 1.0 -131.54 -91.54 PHI 65 65 A 67 PHE N A 67 PHE CA A 67 PHE C A 68 LEU N 1.0 127.94 167.94 PSI 66 66 A 67 PHE C A 68 LEU N A 68 LEU CA A 68 LEU C 1.0 -147.94 -107.94 PHI 67 67 A 68 LEU N A 68 LEU CA A 68 LEU C A 69 ARG N 1.0 125.65 165.65 PSI 68 68 A 68 LEU C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -155.24 -115.24 PHI 69 69 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 LEU N 1.0 118.21 158.21 PSI 70 70 A 69 ARG C A 70 LEU N A 70 LEU CA A 70 LEU C 1.0 -132.00 -90.38 PHI 71 71 A 70 LEU N A 70 LEU CA A 70 LEU C A 71 TYR N 1.0 110.00 160.80 PSI 72 72 A 73 ASP C A 74 GLN N A 74 GLN CA A 74 GLN C 1.0 -130.00 -90.38 PHI 73 73 A 74 GLN N A 74 GLN CA A 74 GLN C A 75 ASP N 1.0 105.00 160.00 PSI 74 74 A 91 GLU C A 92 GLU N A 92 GLU CA A 92 GLU C 1.0 -130.00 -90.38 PHI 75 75 A 92 GLU N A 92 GLU CA A 92 GLU C A 93 ILE N 1.0 105.00 160.00 PSI 76 76 A 71 TYR C A 72 VAL N A 72 VAL CA A 72 VAL C 1.0 -145.95 -105.95 PHI 77 77 A 72 VAL N A 72 VAL CA A 72 VAL C A 73 ASP N 1.0 129.13 169.13 PSI 78 78 A 72 VAL C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 -144.80 -104.80 PHI 79 79 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 GLN N 1.0 112.78 152.78 PSI 80 80 A 74 GLN C A 75 ASP N A 75 ASP CA A 75 ASP C 1.0 -84.36 -44.36 PHI 81 81 A 75 ASP N A 75 ASP CA A 75 ASP C A 76 ASP N 1.0 -47.80 -7.80 PSI 82 82 A 81 GLU C A 82 ILE N A 82 ILE CA A 82 ILE C 1.0 -135.32 -95.32 PHI 83 83 A 82 ILE N A 82 ILE CA A 82 ILE C A 83 SER N 1.0 105.04 145.04 PSI 84 84 A 84 SER C A 85 ILE N A 85 ILE CA A 85 ILE C 1.0 -108.56 -68.56 PHI 85 85 A 85 ILE N A 85 ILE CA A 85 ILE C A 86 GLU N 1.0 -36.69 3.31 PSI 86 86 A 89 SER C A 90 TYR N A 90 TYR CA A 90 TYR C 1.0 -152.62 -112.62 PHI 87 87 A 90 TYR N A 90 TYR CA A 90 TYR C A 91 GLU N 1.0 125.64 165.64 PSI 88 88 A 90 TYR C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -158.07 -118.07 PHI 89 89 A 91 GLU N A 91 GLU CA A 91 GLU C A 92 GLU N 1.0 124.80 164.80 PSI 90 90 A 92 GLU C A 93 ILE N A 93 ILE CA A 93 ILE C 1.0 -154.94 -114.94 PHI 91 91 A 93 ILE N A 93 ILE CA A 93 ILE C A 94 GLN N 1.0 137.58 177.58 PSI 92 92 A 93 ILE C A 94 GLN N A 94 GLN CA A 94 GLN C 1.0 -127.03 -87.03 PHI 93 93 A 94 GLN N A 94 GLN CA A 94 GLN C A 95 LYS N 1.0 132.98 172.98 PSI 94 94 A 94 GLN C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -78.32 -38.32 PHI 95 95 A 95 LYS N A 95 LYS CA A 95 LYS C A 96 ALA N 1.0 -55.11 -15.11 PSI 96 96 A 95 LYS C A 96 ALA N A 96 ALA CA A 96 ALA C 1.0 -93.22 -53.22 PHI 97 97 A 96 ALA N A 96 ALA CA A 96 ALA C A 97 ASP N 1.0 -45.79 -5.79 PSI 98 98 A 96 ALA C A 97 ASP N A 97 ASP CA A 97 ASP C 1.0 -106.76 -66.76 PHI 99 99 A 97 ASP N A 97 ASP CA A 97 ASP C A 98 LEU N 1.0 -41.58 -1.58 PSI 100 100 A 99 PRO N A 99 PRO CA A 99 PRO C A 100 GLU N 1.0 130.58 170.58 PSI 101 101 A 101 LYS C A 102 VAL N A 102 VAL CA A 102 VAL C 1.0 -93.57 -53.57 PHI 102 102 A 102 VAL N A 102 VAL CA A 102 VAL C A 103 LYS N 1.0 -55.88 -15.88 PSI 103 103 A 102 VAL C A 103 LYS N A 103 LYS CA A 103 LYS C 1.0 -80.78 -40.78 PHI 104 104 A 103 LYS N A 103 LYS CA A 103 LYS C A 104 ASP N 1.0 -61.48 -21.48 PSI 105 105 A 103 LYS C A 104 ASP N A 104 ASP CA A 104 ASP C 1.0 -91.65 -51.65 PHI 106 106 A 104 ASP N A 104 ASP CA A 104 ASP C A 105 LYS N 1.0 -48.24 -8.24 PSI 107 107 A 16 MET N A 16 MET CA A 16 MET CB A 16 MET CG 1.0 165.00 195.00 CHI1 108 108 A 16 MET CA A 16 MET CB A 16 MET CG A 16 MET SD 1.0 165.00 195.00 CHI2 109 109 A 17 GLN N A 17 GLN CA A 17 GLN CB A 17 GLN CG 1.0 165.00 195.00 CHI1 110 110 A 17 GLN CA A 17 GLN CB A 17 GLN CG A 17 GLN CD 1.0 165.00 195.00 CHI2 111 111 A 25 GLU N A 25 GLU CA A 25 GLU CB A 25 GLU CG 1.0 165.00 195.00 CHI1 112 112 A 25 GLU CA A 25 GLU CB A 25 GLU CG A 25 GLU CD 1.0 165.00 195.00 CHI2 113 113 A 30 ARG N A 30 ARG CA A 30 ARG CB A 30 ARG CG 1.0 -70.00 -50.00 CHI1 114 114 A 30 ARG CA A 30 ARG CB A 30 ARG CG A 30 ARG CD 1.0 165.00 195.00 CHI2 115 115 A 32 LEU N A 32 LEU CA A 32 LEU CB A 32 LEU CG 1.0 -70.00 -50.00 CHI1 116 116 A 32 LEU CA A 32 LEU CB A 32 LEU CG A 32 LEU CD1 1.0 165.00 195.00 CHI2 117 117 A 33 ARG CA A 33 ARG CB A 33 ARG CG A 33 ARG CD 1.0 165.00 195.00 CHI2 118 118 A 35 TYR N A 35 TYR CA A 35 TYR CB A 35 TYR CG 1.0 -70.00 -50.00 CHI1 119 119 A 40 TYR N A 40 TYR CA A 40 TYR CB A 40 TYR CG 1.0 -70.00 -50.00 CHI1 120 120 A 40 TYR CA A 40 TYR CB A 40 TYR CG A 40 TYR CD1 1.0 -100.00 -60.00 CHI2 121 121 A 42 GLU CA A 42 GLU CB A 42 GLU CG A 42 GLU CD 1.0 -195.00 -60.00 CHI2 122 122 A 48 GLN N A 48 GLN CA A 48 GLN CB A 48 GLN CG 1.0 165.00 195.00 CHI1 123 123 A 48 GLN CA A 48 GLN CB A 48 GLN CG A 48 GLN CD 1.0 165.00 195.00 CHI2 124 124 A 51 PHE N A 51 PHE CA A 51 PHE CB A 51 PHE CG 1.0 50.00 70.00 CHI1 125 125 A 51 PHE CA A 51 PHE CB A 51 PHE CG A 51 PHE CD1 1.0 -100.00 -80.00 CHI2 126 126 A 70 LEU N A 70 LEU CA A 70 LEU CB A 70 LEU CG 1.0 -100.00 -60.00 CHI1 127 127 A 70 LEU CA A 70 LEU CB A 70 LEU CG A 70 LEU CD1 1.0 30.00 60.00 CHI2 128 128 A 95 LYS N A 95 LYS CA A 95 LYS CB A 95 LYS CG 1.0 165.00 195.00 CHI1 129 129 A 95 LYS CA A 95 LYS CB A 95 LYS CG A 95 LYS CD 1.0 165.00 195.00 CHI2 130 130 A 100 GLU N A 100 GLU CA A 100 GLU CB A 100 GLU CG 1.0 165.00 195.00 CHI1 131 131 A 100 GLU CA A 100 GLU CB A 100 GLU CG A 100 GLU CD 1.0 165.00 195.00 CHI2 132 132 A 101 LYS N A 101 LYS CA A 101 LYS CB A 101 LYS CG 1.0 -70.00 -50.00 CHI1 133 133 A 101 LYS CA A 101 LYS CB A 101 LYS CG A 101 LYS CD 1.0 -70.00 -50.00 CHI2 134 134 A 103 LYS N A 103 LYS CA A 103 LYS CB A 103 LYS CG 1.0 50.00 70.00 CHI1 135 135 A 103 LYS CA A 103 LYS CB A 103 LYS CG A 103 LYS CD 1.0 160.00 180.00 CHI2 136 136 A 104 ASP N A 104 ASP CA A 104 ASP CB A 104 ASP CG 1.0 -80.00 -60.00 CHI1 137 137 A 104 ASP N A 104 ASP CA A 104 ASP CB A 104 ASP CG 1.0 -60.00 0.00 CHI1 stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 14 2 15N 50 3 1H 14 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 14 2 13C 150 3 1H 14 stop_ save_