data_nef_c17578_2lbw save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17579 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 36 SER start . . 2 A 37 LYS middle . . 3 A 38 LYS middle . . 4 A 39 LEU middle . . 5 A 40 ASN middle . . 6 A 41 LYS middle . . 7 A 42 LYS middle . . 8 A 43 VAL middle . . 9 A 44 LEU middle . . 10 A 45 LYS middle . . 11 A 46 THR middle . . 12 A 47 VAL middle . . 13 A 48 LYS middle . . 14 A 49 LYS middle . . 15 A 50 ALA middle . . 16 A 51 SER middle . . 17 A 52 LYS middle . . 18 A 53 ALA middle . . 19 A 54 LYS middle . . 20 A 55 ASN middle . . 21 A 56 VAL middle . . 22 A 57 LYS middle . . 23 A 58 ARG middle . . 24 A 59 GLY middle . false 25 A 60 VAL middle . . 26 A 61 LYS middle . . 27 A 62 GLU middle . . 28 A 63 VAL middle . . 29 A 64 VAL middle . . 30 A 65 LYS middle . . 31 A 66 ALA middle . . 32 A 67 LEU middle . . 33 A 68 ARG middle . . 34 A 69 LYS middle . . 35 A 70 GLY middle . false 36 A 71 GLU middle . . 37 A 72 LYS middle . . 38 A 73 GLY middle . false 39 A 74 LEU middle . . 40 A 75 VAL middle . . 41 A 76 VAL middle . . 42 A 77 ILE middle . . 43 A 78 ALA middle . . 44 A 79 GLY middle . false 45 A 80 ASP middle . . 46 A 81 ILE middle . . 47 A 82 TRP middle . . 48 A 83 PRO middle . true 49 A 84 ALA middle . . 50 A 85 ASP middle . . 51 A 86 VAL middle . . 52 A 87 ILE middle . . 53 A 88 SER middle . . 54 A 89 HIS middle . . 55 A 90 ILE middle . . 56 A 91 PRO middle . false 57 A 92 VAL middle . . 58 A 93 LEU middle . . 59 A 94 CYS middle . . 60 A 95 GLU middle . . 61 A 96 ASP middle . . 62 A 97 HIS middle . . 63 A 98 SER middle . . 64 A 99 VAL middle . . 65 A 100 PRO middle . false 66 A 101 TYR middle . . 67 A 102 ILE middle . . 68 A 103 PHE middle . . 69 A 104 ILE middle . . 70 A 105 PRO middle . false 71 A 106 SER middle . . 72 A 107 LYS middle . . 73 A 108 GLN middle . . 74 A 109 ASP middle . . 75 A 110 LEU middle . . 76 A 111 GLY middle . false 77 A 112 ALA middle . . 78 A 113 ALA middle . . 79 A 114 GLY middle . false 80 A 115 ALA middle . . 81 A 116 THR middle . . 82 A 117 LYS middle . . 83 A 118 ARG middle . . 84 A 119 PRO middle . false 85 A 120 THR middle . . 86 A 121 SER middle . . 87 A 122 VAL middle . . 88 A 123 VAL middle . . 89 A 124 PHE middle . . 90 A 125 ILE middle . . 91 A 126 VAL middle . . 92 A 127 PRO middle . false 93 A 128 GLY middle . false 94 A 129 SER middle . . 95 A 130 ASN middle . . 96 A 131 LYS middle . . 97 A 132 LYS middle . . 98 A 133 LYS middle . . 99 A 134 ASP middle . . 100 A 135 GLY middle . false 101 A 136 LYS middle . . 102 A 137 ASN middle . . 103 A 138 LYS middle . . 104 A 139 GLU middle . . 105 A 140 GLU middle . . 106 A 141 GLU middle . . 107 A 142 TYR middle . . 108 A 143 LYS middle . . 109 A 144 GLU middle . . 110 A 145 SER middle . . 111 A 146 PHE middle . . 112 A 147 ASN middle . . 113 A 148 GLU middle . . 114 A 149 VAL middle . . 115 A 150 VAL middle . . 116 A 151 LYS middle . . 117 A 152 GLU middle . . 118 A 153 VAL middle . . 119 A 154 GLN middle . . 120 A 155 ALA middle . . 121 A 156 LEU 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 36 SER H1 H 1 8.122 0.03 A 36 SER HA H 1 4.720 0.03 A 36 SER HBy H 1 3.985 0.03 A 36 SER C C 13 179.339 0.30 A 36 SER CA C 13 61.702 0.30 A 36 SER N N 15 116.162 0.30 A 37 LYS H H 1 7.786 0.03 A 37 LYS HA H 1 4.064 0.03 A 37 LYS HBx H 1 1.943 0.03 A 37 LYS HGx H 1 1.543 0.03 A 37 LYS N N 15 124.035 0.30 A 38 LYS HA H 1 4.026 0.03 A 38 LYS HBx H 1 1.759 0.03 A 38 LYS HGx H 1 1.402 0.03 A 38 LYS C C 13 179.176 0.30 A 38 LYS CA C 13 59.781 0.30 A 38 LYS CB C 13 32.626 0.30 A 38 LYS CG C 13 25.503 0.30 A 39 LEU H H 1 7.877 0.03 A 39 LEU HA H 1 4.159 0.03 A 39 LEU HBx H 1 1.811 0.03 A 39 LEU HD11 H 1 0.888 0.03 A 39 LEU HD12 H 1 0.888 0.03 A 39 LEU HD13 H 1 0.888 0.03 A 39 LEU HD21 H 1 0.857 0.03 A 39 LEU HD22 H 1 0.857 0.03 A 39 LEU HD23 H 1 0.857 0.03 A 39 LEU HG H 1 1.479 0.03 A 39 LEU C C 13 178.232 0.30 A 39 LEU CA C 13 57.470 0.30 A 39 LEU CB C 13 40.343 0.30 A 39 LEU CG C 13 26.574 0.30 A 39 LEU N N 15 122.003 0.30 A 40 ASN H H 1 9.313 0.03 A 40 ASN HA H 1 3.997 0.03 A 40 ASN HBy H 1 2.850 0.03 A 40 ASN HBx H 1 2.473 0.03 A 40 ASN HD2y H 1 7.509 0.03 A 40 ASN C C 13 176.054 0.30 A 40 ASN CA C 13 57.622 0.30 A 40 ASN CB C 13 40.113 0.30 A 40 ASN N N 15 118.692 0.30 A 40 ASN ND2 N 15 111.540 0.30 A 41 LYS H H 1 7.230 0.03 A 41 LYS HA H 1 3.928 0.03 A 41 LYS HBx H 1 1.916 0.03 A 41 LYS HDx H 1 1.691 0.03 A 41 LYS HEx H 1 2.907 0.03 A 41 LYS HGx H 1 1.534 0.03 A 41 LYS C C 13 179.133 0.30 A 41 LYS CA C 13 59.909 0.30 A 41 LYS CB C 13 32.256 0.30 A 41 LYS CD C 13 29.220 0.30 A 41 LYS CG C 13 25.433 0.30 A 41 LYS N N 15 115.497 0.30 A 42 LYS H H 1 7.367 0.03 A 42 LYS HA H 1 4.040 0.03 A 42 LYS HBx H 1 1.872 0.03 A 42 LYS HEx H 1 2.853 0.03 A 42 LYS HGx H 1 1.390 0.03 A 42 LYS C C 13 180.272 0.30 A 42 LYS CA C 13 59.988 0.30 A 42 LYS CB C 13 33.462 0.30 A 42 LYS CG C 13 25.501 0.30 A 42 LYS N N 15 118.961 0.30 A 43 VAL H H 1 9.215 0.03 A 43 VAL HA H 1 3.303 0.03 A 43 VAL HB H 1 2.199 0.03 A 43 VAL HG11 H 1 0.816 0.03 A 43 VAL HG12 H 1 0.816 0.03 A 43 VAL HG13 H 1 0.816 0.03 A 43 VAL HG21 H 1 0.722 0.03 A 43 VAL HG22 H 1 0.722 0.03 A 43 VAL HG23 H 1 0.722 0.03 A 43 VAL CA C 13 67.430 0.30 A 43 VAL CB C 13 31.374 0.30 A 43 VAL CGy C 13 23.016 0.30 A 43 VAL N N 15 122.400 0.30 A 44 LEU H H 1 8.471 0.03 A 44 LEU HA H 1 3.833 0.03 A 44 LEU HBy H 1 1.858 0.03 A 44 LEU HBx H 1 1.357 0.03 A 44 LEU HD11 H 1 0.862 0.03 A 44 LEU HD12 H 1 0.862 0.03 A 44 LEU HD13 H 1 0.862 0.03 A 44 LEU HD21 H 1 0.665 0.03 A 44 LEU HD22 H 1 0.665 0.03 A 44 LEU HD23 H 1 0.665 0.03 A 44 LEU HG H 1 1.339 0.03 A 44 LEU CA C 13 58.453 0.30 A 44 LEU CB C 13 41.171 0.30 A 44 LEU CDx C 13 26.512 0.30 A 44 LEU CG C 13 27.044 0.30 A 44 LEU N N 15 119.626 0.30 A 45 LYS H H 1 7.883 0.03 A 45 LYS HA H 1 4.026 0.03 A 45 LYS HBx H 1 1.917 0.03 A 45 LYS HDx H 1 1.663 0.03 A 45 LYS HEx H 1 3.019 0.03 A 45 LYS HGy H 1 1.618 0.03 A 45 LYS HGx H 1 1.382 0.03 A 45 LYS CA C 13 59.919 0.30 A 45 LYS CB C 13 32.430 0.30 A 45 LYS CG C 13 25.375 0.30 A 45 LYS N N 15 119.761 0.30 A 46 THR H H 1 7.805 0.03 A 46 THR HA H 1 4.339 0.03 A 46 THR HB H 1 3.832 0.03 A 46 THR HG2% H 1 1.355 0.03 A 46 THR C C 13 175.987 0.30 A 46 THR CB C 13 68.013 0.30 A 46 THR CG2 C 13 21.840 0.30 A 46 THR N N 15 116.469 0.30 A 47 VAL H H 1 8.782 0.03 A 47 VAL HA H 1 3.232 0.03 A 47 VAL HB H 1 2.180 0.03 A 47 VAL HG11 H 1 0.899 0.03 A 47 VAL HG12 H 1 0.899 0.03 A 47 VAL HG13 H 1 0.899 0.03 A 47 VAL HG21 H 1 0.732 0.03 A 47 VAL HG22 H 1 0.732 0.03 A 47 VAL HG23 H 1 0.732 0.03 A 47 VAL CA C 13 67.331 0.30 A 47 VAL CB C 13 31.438 0.30 A 47 VAL CGy C 13 23.852 0.30 A 47 VAL CGx C 13 19.283 0.30 A 47 VAL N N 15 121.907 0.30 A 48 LYS H H 1 8.171 0.03 A 48 LYS HA H 1 4.258 0.03 A 48 LYS HBx H 1 1.965 0.03 A 48 LYS HDx H 1 1.661 0.03 A 48 LYS HGx H 1 1.409 0.03 A 48 LYS C C 13 179.808 0.30 A 48 LYS CA C 13 59.999 0.30 A 48 LYS CB C 13 32.553 0.30 A 48 LYS CD C 13 29.512 0.30 A 48 LYS CG C 13 24.555 0.30 A 48 LYS N N 15 122.393 0.30 A 49 LYS H H 1 7.941 0.03 A 49 LYS HA H 1 3.973 0.03 A 49 LYS HBx H 1 1.682 0.03 A 49 LYS HEx H 1 2.983 0.03 A 49 LYS HGx H 1 1.500 0.03 A 49 LYS CA C 13 59.811 0.30 A 49 LYS CB C 13 33.389 0.30 A 49 LYS CG C 13 25.932 0.30 A 49 LYS N N 15 118.852 0.30 A 50 ALA H H 1 8.544 0.03 A 50 ALA HA H 1 3.496 0.03 A 50 ALA HB% H 1 0.850 0.03 A 50 ALA CA C 13 54.709 0.30 A 50 ALA CB C 13 18.917 0.30 A 50 ALA N N 15 122.047 0.30 A 51 SER H H 1 8.551 0.03 A 51 SER HA H 1 4.730 0.03 A 51 SER HBy H 1 4.092 0.03 A 51 SER HBx H 1 3.954 0.03 A 51 SER C C 13 178.560 0.30 A 51 SER CA C 13 61.680 0.30 A 51 SER CB C 13 62.551 0.30 A 51 SER N N 15 116.561 0.30 A 52 LYS H H 1 7.578 0.03 A 52 LYS HA H 1 4.072 0.03 A 52 LYS HBx H 1 1.942 0.03 A 52 LYS HEx H 1 3.112 0.03 A 52 LYS HGx H 1 1.551 0.03 A 52 LYS C C 13 177.377 0.30 A 52 LYS CA C 13 58.931 0.30 A 52 LYS CB C 13 31.961 0.30 A 52 LYS CD C 13 29.168 0.30 A 52 LYS CG C 13 24.885 0.30 A 52 LYS N N 15 124.890 0.30 A 53 ALA H H 1 7.112 0.03 A 53 ALA HA H 1 4.285 0.03 A 53 ALA HB% H 1 1.456 0.03 A 53 ALA C C 13 175.061 0.30 A 53 ALA CA C 13 51.822 0.30 A 53 ALA CB C 13 19.390 0.30 A 53 ALA N N 15 118.628 0.30 A 54 LYS H H 1 7.653 0.03 A 54 LYS HA H 1 4.026 0.03 A 54 LYS HBx H 1 1.936 0.03 A 54 LYS HEx H 1 2.966 0.03 A 54 LYS HGx H 1 1.385 0.03 A 54 LYS CA C 13 57.222 0.30 A 54 LYS CB C 13 28.387 0.30 A 54 LYS CG C 13 25.089 0.30 A 54 LYS N N 15 111.984 0.30 A 55 ASN H H 1 8.118 0.03 A 55 ASN HA H 1 5.102 0.03 A 55 ASN HBx H 1 3.351 0.03 A 55 ASN C C 13 172.975 0.30 A 55 ASN CA C 13 51.215 0.30 A 55 ASN CB C 13 40.316 0.30 A 55 ASN N N 15 116.088 0.30 A 56 VAL H H 1 7.628 0.03 A 56 VAL HA H 1 4.938 0.03 A 56 VAL HB H 1 1.804 0.03 A 56 VAL HG11 H 1 0.694 0.03 A 56 VAL HG12 H 1 0.694 0.03 A 56 VAL HG13 H 1 0.694 0.03 A 56 VAL HG21 H 1 0.660 0.03 A 56 VAL HG22 H 1 0.660 0.03 A 56 VAL HG23 H 1 0.660 0.03 A 56 VAL C C 13 175.409 0.30 A 56 VAL CA C 13 60.901 0.30 A 56 VAL CB C 13 35.368 0.30 A 56 VAL CGx C 13 22.406 0.30 A 56 VAL N N 15 114.959 0.30 A 57 LYS H H 1 8.987 0.03 A 57 LYS HA H 1 4.712 0.03 A 57 LYS HBy H 1 1.834 0.03 A 57 LYS HBx H 1 1.598 0.03 A 57 LYS HEx H 1 2.962 0.03 A 57 LYS HGx H 1 1.402 0.03 A 57 LYS C C 13 175.394 0.30 A 57 LYS CA C 13 54.485 0.30 A 57 LYS CB C 13 33.669 0.30 A 57 LYS CD C 13 28.763 0.30 A 57 LYS CG C 13 25.171 0.30 A 57 LYS N N 15 126.485 0.30 A 58 ARG H H 1 9.024 0.03 A 58 ARG HA H 1 4.837 0.03 A 58 ARG HBy H 1 1.759 0.03 A 58 ARG HBx H 1 1.720 0.03 A 58 ARG HDx H 1 3.206 0.03 A 58 ARG HGy H 1 1.551 0.03 A 58 ARG HGx H 1 1.430 0.03 A 58 ARG C C 13 175.930 0.30 A 58 ARG CA C 13 55.872 0.30 A 58 ARG CB C 13 33.513 0.30 A 58 ARG CD C 13 43.456 0.30 A 58 ARG CG C 13 27.885 0.30 A 58 ARG N N 15 122.011 0.30 A 59 GLY H H 1 8.315 0.03 A 59 GLY HAy H 1 4.502 0.03 A 59 GLY HAx H 1 4.088 0.03 A 59 GLY CA C 13 44.790 0.30 A 59 GLY N N 15 111.007 0.30 A 60 VAL H H 1 8.152 0.03 A 60 VAL HA H 1 3.156 0.03 A 60 VAL HB H 1 2.029 0.03 A 60 VAL HG11 H 1 1.070 0.03 A 60 VAL HG12 H 1 1.070 0.03 A 60 VAL HG13 H 1 1.070 0.03 A 60 VAL HG21 H 1 1.035 0.03 A 60 VAL HG22 H 1 1.035 0.03 A 60 VAL HG23 H 1 1.035 0.03 A 60 VAL C C 13 176.562 0.30 A 60 VAL CA C 13 68.037 0.30 A 60 VAL CB C 13 32.050 0.30 A 60 VAL CGy C 13 23.034 0.30 A 60 VAL CGx C 13 21.464 0.30 A 60 VAL N N 15 119.423 0.30 A 61 LYS H H 1 8.156 0.03 A 61 LYS HA H 1 3.919 0.03 A 61 LYS HBx H 1 1.822 0.03 A 61 LYS HEx H 1 2.984 0.03 A 61 LYS HGx H 1 1.537 0.03 A 61 LYS C C 13 180.130 0.30 A 61 LYS CA C 13 60.157 0.30 A 61 LYS CB C 13 32.041 0.30 A 61 LYS CE C 13 42.017 0.30 A 61 LYS CG C 13 25.409 0.30 A 61 LYS N N 15 117.316 0.30 A 62 GLU H H 1 8.531 0.03 A 62 GLU HA H 1 3.961 0.03 A 62 GLU HBx H 1 1.942 0.03 A 62 GLU HGy H 1 2.528 0.03 A 62 GLU HGx H 1 2.325 0.03 A 62 GLU CA C 13 58.787 0.30 A 62 GLU CB C 13 29.843 0.30 A 62 GLU CG C 13 37.129 0.30 A 62 GLU N N 15 117.535 0.30 A 63 VAL H H 1 8.255 0.03 A 63 VAL HA H 1 3.498 0.03 A 63 VAL HB H 1 1.940 0.03 A 63 VAL HG11 H 1 0.899 0.03 A 63 VAL HG12 H 1 0.899 0.03 A 63 VAL HG13 H 1 0.899 0.03 A 63 VAL HG21 H 1 0.572 0.03 A 63 VAL HG22 H 1 0.572 0.03 A 63 VAL HG23 H 1 0.572 0.03 A 63 VAL CA C 13 68.099 0.30 A 63 VAL CB C 13 31.376 0.30 A 63 VAL CGy C 13 24.650 0.30 A 63 VAL CGx C 13 20.364 0.30 A 63 VAL N N 15 120.589 0.30 A 64 VAL H H 1 8.535 0.03 A 64 VAL HA H 1 3.359 0.03 A 64 VAL HB H 1 2.064 0.03 A 64 VAL HG11 H 1 0.934 0.03 A 64 VAL HG12 H 1 0.934 0.03 A 64 VAL HG13 H 1 0.934 0.03 A 64 VAL HG21 H 1 0.868 0.03 A 64 VAL HG22 H 1 0.868 0.03 A 64 VAL HG23 H 1 0.868 0.03 A 64 VAL C C 13 177.549 0.30 A 64 VAL CA C 13 67.456 0.30 A 64 VAL CB C 13 31.233 0.30 A 64 VAL CGy C 13 23.606 0.30 A 64 VAL CGx C 13 21.155 0.30 A 64 VAL N N 15 118.570 0.30 A 65 LYS H H 1 7.538 0.03 A 65 LYS HA H 1 3.875 0.03 A 65 LYS HBx H 1 1.840 0.03 A 65 LYS HEx H 1 2.906 0.03 A 65 LYS HGy H 1 1.536 0.03 A 65 LYS HGx H 1 1.321 0.03 A 65 LYS CA C 13 59.811 0.30 A 65 LYS CB C 13 32.715 0.30 A 65 LYS CG C 13 25.096 0.30 A 65 LYS N N 15 117.926 0.30 A 66 ALA H H 1 7.496 0.03 A 66 ALA HA H 1 4.071 0.03 A 66 ALA HB% H 1 1.489 0.03 A 66 ALA C C 13 179.596 0.30 A 66 ALA CA C 13 55.051 0.30 A 66 ALA CB C 13 18.901 0.30 A 66 ALA N N 15 120.475 0.30 A 67 LEU H H 1 8.376 0.03 A 67 LEU HA H 1 3.854 0.03 A 67 LEU HBy H 1 1.811 0.03 A 67 LEU HBx H 1 0.658 0.03 A 67 LEU HD21 H 1 0.443 0.03 A 67 LEU HDy% H 1 0.443 0.03 A 67 LEU HG H 1 3.155 0.03 A 67 LEU CA C 13 57.859 0.30 A 67 LEU CB C 13 42.442 0.30 A 67 LEU CDy C 13 21.869 0.30 A 67 LEU CG C 13 26.721 0.30 A 67 LEU N N 15 119.357 0.30 A 68 ARG H H 1 8.091 0.03 A 68 ARG HA H 1 3.802 0.03 A 68 ARG HBx H 1 1.824 0.03 A 68 ARG HDx H 1 3.147 0.03 A 68 ARG HGx H 1 1.404 0.03 A 68 ARG CA C 13 59.306 0.30 A 68 ARG CB C 13 29.759 0.30 A 68 ARG CD C 13 43.704 0.30 A 68 ARG CG C 13 28.812 0.30 A 68 ARG N N 15 116.045 0.30 A 69 LYS H H 1 7.616 0.03 A 69 LYS HA H 1 4.255 0.03 A 69 LYS HBx H 1 1.965 0.03 A 69 LYS HDx H 1 1.662 0.03 A 69 LYS HEx H 1 2.968 0.03 A 69 LYS HGx H 1 1.580 0.03 A 69 LYS C C 13 176.831 0.30 A 69 LYS CA C 13 56.548 0.30 A 69 LYS CB C 13 32.710 0.30 A 69 LYS CD C 13 29.158 0.30 A 69 LYS CG C 13 25.087 0.30 A 69 LYS N N 15 117.845 0.30 A 70 GLY H H 1 7.739 0.03 A 70 GLY HAy H 1 4.252 0.03 A 70 GLY HAx H 1 3.867 0.03 A 70 GLY CA C 13 45.537 0.30 A 70 GLY N N 15 106.783 0.30 A 71 GLU H H 1 7.698 0.03 A 71 GLU HA H 1 4.226 0.03 A 71 GLU HBy H 1 1.813 0.03 A 71 GLU HBx H 1 1.579 0.03 A 71 GLU HGx H 1 2.181 0.03 A 71 GLU C C 13 175.400 0.30 A 71 GLU CA C 13 57.414 0.30 A 71 GLU CB C 13 29.442 0.30 A 71 GLU CG C 13 36.831 0.30 A 71 GLU N N 15 119.424 0.30 A 72 LYS H H 1 8.223 0.03 A 72 LYS HA H 1 4.903 0.03 A 72 LYS HBy H 1 2.130 0.03 A 72 LYS HBx H 1 1.739 0.03 A 72 LYS HDx H 1 1.709 0.03 A 72 LYS HEx H 1 3.003 0.03 A 72 LYS HGx H 1 1.572 0.03 A 72 LYS C C 13 175.809 0.30 A 72 LYS CA C 13 53.791 0.30 A 72 LYS CB C 13 34.781 0.30 A 72 LYS CG C 13 24.538 0.30 A 72 LYS N N 15 118.290 0.30 A 73 GLY H H 1 7.217 0.03 A 73 GLY HAy H 1 4.119 0.03 A 73 GLY HAx H 1 3.820 0.03 A 73 GLY C C 13 171.884 0.30 A 73 GLY CA C 13 46.360 0.30 A 73 GLY N N 15 104.682 0.30 A 74 LEU H H 1 8.945 0.03 A 74 LEU HA H 1 4.994 0.03 A 74 LEU HBy H 1 1.801 0.03 A 74 LEU HBx H 1 1.373 0.03 A 74 LEU HD11 H 1 0.702 0.03 A 74 LEU HD12 H 1 0.702 0.03 A 74 LEU HD13 H 1 0.702 0.03 A 74 LEU HD21 H 1 0.606 0.03 A 74 LEU HD22 H 1 0.606 0.03 A 74 LEU HD23 H 1 0.606 0.03 A 74 LEU HG H 1 1.347 0.03 A 74 LEU C C 13 174.380 0.30 A 74 LEU CA C 13 54.363 0.30 A 74 LEU CB C 13 47.028 0.30 A 74 LEU CDy C 13 26.438 0.30 A 74 LEU N N 15 125.372 0.30 A 75 VAL H H 1 8.551 0.03 A 75 VAL HA H 1 4.644 0.03 A 75 VAL HB H 1 1.796 0.03 A 75 VAL HG11 H 1 0.458 0.03 A 75 VAL HG12 H 1 0.458 0.03 A 75 VAL HG13 H 1 0.458 0.03 A 75 VAL HG21 H 1 0.154 0.03 A 75 VAL HG22 H 1 0.154 0.03 A 75 VAL HG23 H 1 0.154 0.03 A 75 VAL C C 13 173.667 0.30 A 75 VAL CA C 13 62.273 0.30 A 75 VAL CB C 13 32.591 0.30 A 75 VAL CGx C 13 21.708 0.30 A 75 VAL CGy C 13 23.727 0.30 A 75 VAL N N 15 130.967 0.30 A 76 VAL H H 1 8.804 0.03 A 76 VAL HA H 1 4.660 0.03 A 76 VAL HB H 1 2.988 0.03 A 76 VAL HG11 H 1 0.697 0.03 A 76 VAL HG12 H 1 0.697 0.03 A 76 VAL HG13 H 1 0.697 0.03 A 76 VAL HG21 H 1 0.574 0.03 A 76 VAL HG22 H 1 0.574 0.03 A 76 VAL HG23 H 1 0.574 0.03 A 76 VAL C C 13 173.669 0.30 A 76 VAL CA C 13 60.899 0.30 A 76 VAL CB C 13 33.346 0.30 A 76 VAL CGy C 13 23.139 0.30 A 76 VAL CGx C 13 20.047 0.30 A 76 VAL N N 15 127.493 0.30 A 77 ILE H H 1 8.613 0.03 A 77 ILE HA H 1 4.444 0.03 A 77 ILE HB H 1 0.536 0.03 A 77 ILE HD11 H 1 -0.002 0.03 A 77 ILE HD12 H 1 -0.002 0.03 A 77 ILE HD13 H 1 -0.002 0.03 A 77 ILE HG1y H 1 1.169 0.03 A 77 ILE HG1x H 1 0.323 0.03 A 77 ILE HG2% H 1 0.872 0.03 A 77 ILE C C 13 174.817 0.30 A 77 ILE CA C 13 59.700 0.30 A 77 ILE CB C 13 39.977 0.30 A 77 ILE CG1 C 13 28.342 0.30 A 77 ILE CG2 C 13 19.826 0.30 A 77 ILE N N 15 125.646 0.30 A 78 ALA H H 1 8.565 0.03 A 78 ALA HA H 1 4.459 0.03 A 78 ALA HB% H 1 1.484 0.03 A 78 ALA C C 13 177.584 0.30 A 78 ALA CA C 13 52.372 0.30 A 78 ALA CB C 13 19.504 0.30 A 78 ALA N N 15 128.691 0.30 A 79 GLY H H 1 9.083 0.03 A 79 GLY HAy H 1 4.288 0.03 A 79 GLY HAx H 1 3.384 0.03 A 79 GLY C C 13 173.252 0.30 A 79 GLY CA C 13 45.764 0.30 A 79 GLY N N 15 103.957 0.30 A 80 ASP H H 1 8.695 0.03 A 80 ASP HA H 1 4.918 0.03 A 80 ASP HBy H 1 2.944 0.03 A 80 ASP HBx H 1 2.619 0.03 A 80 ASP CA C 13 52.689 0.30 A 80 ASP CB C 13 39.118 0.30 A 80 ASP N N 15 118.632 0.30 A 81 ILE H H 1 6.730 0.03 A 81 ILE HA H 1 4.179 0.03 A 81 ILE HB H 1 1.812 0.03 A 81 ILE HD11 H 1 0.922 0.03 A 81 ILE HD12 H 1 0.922 0.03 A 81 ILE HD13 H 1 0.922 0.03 A 81 ILE HG1x H 1 1.395 0.03 A 81 ILE HG2% H 1 0.945 0.03 A 81 ILE C C 13 172.890 0.30 A 81 ILE CA C 13 59.242 0.30 A 81 ILE CB C 13 39.253 0.30 A 81 ILE CG1 C 13 27.813 0.30 A 81 ILE CG2 C 13 18.233 0.30 A 81 ILE N N 15 117.935 0.30 A 82 TRP H H 1 7.804 0.03 A 82 TRP HA H 1 4.587 0.03 A 82 TRP HBx H 1 3.146 0.03 A 82 TRP HD1 H 1 7.222 0.03 A 82 TRP HE1 H 1 10.216 0.03 A 82 TRP CA C 13 55.386 0.30 A 82 TRP CB C 13 32.147 0.30 A 82 TRP N N 15 123.585 0.30 A 82 TRP NE1 N 15 129.730 0.30 A 83 PRO HA H 1 4.248 0.03 A 83 PRO HBy H 1 1.797 0.03 A 83 PRO HDx H 1 3.617 0.03 A 83 PRO HGx H 1 1.272 0.03 A 83 PRO CA C 13 62.712 0.30 A 83 PRO CB C 13 34.011 0.30 A 83 PRO CG C 13 24.780 0.30 A 84 ALA H H 1 8.198 0.03 A 84 ALA HA H 1 3.969 0.03 A 84 ALA HB% H 1 1.316 0.03 A 84 ALA CA C 13 54.183 0.30 A 84 ALA CB C 13 19.404 0.30 A 84 ALA N N 15 121.827 0.30 A 85 ASP H H 1 8.008 0.03 A 85 ASP HA H 1 4.301 0.03 A 85 ASP HBx H 1 2.565 0.03 A 85 ASP C C 13 177.428 0.30 A 85 ASP CA C 13 55.777 0.30 A 85 ASP CB C 13 40.060 0.30 A 85 ASP N N 15 114.049 0.30 A 86 VAL H H 1 7.542 0.03 A 86 VAL HA H 1 3.841 0.03 A 86 VAL HB H 1 2.064 0.03 A 86 VAL HG11 H 1 1.007 0.03 A 86 VAL HG12 H 1 1.007 0.03 A 86 VAL HG13 H 1 1.007 0.03 A 86 VAL HG21 H 1 0.971 0.03 A 86 VAL HG22 H 1 0.971 0.03 A 86 VAL HG23 H 1 0.971 0.03 A 86 VAL C C 13 176.231 0.30 A 86 VAL CA C 13 65.332 0.30 A 86 VAL CB C 13 32.123 0.30 A 86 VAL CGx C 13 21.572 0.30 A 86 VAL N N 15 116.790 0.30 A 87 ILE H H 1 7.310 0.03 A 87 ILE HA H 1 4.638 0.03 A 87 ILE HB H 1 2.111 0.03 A 87 ILE HD11 H 1 0.897 0.03 A 87 ILE HD12 H 1 0.897 0.03 A 87 ILE HD13 H 1 0.897 0.03 A 87 ILE HG1y H 1 1.448 0.03 A 87 ILE HG1x H 1 1.277 0.03 A 87 ILE HG2% H 1 1.020 0.03 A 87 ILE C C 13 178.026 0.30 A 87 ILE CA C 13 59.806 0.30 A 87 ILE CB C 13 40.742 0.30 A 87 ILE CG2 C 13 20.269 0.30 A 87 ILE N N 15 107.529 0.30 A 88 SER H H 1 7.827 0.03 A 88 SER HA H 1 4.566 0.03 A 88 SER HBy H 1 3.658 0.03 A 88 SER CA C 13 61.760 0.30 A 88 SER CB C 13 62.391 0.30 A 88 SER N N 15 116.004 0.30 A 89 HIS HA H 1 4.572 0.03 A 89 HIS HBx H 1 2.969 0.03 A 89 HIS HD2 H 1 6.885 0.03 A 89 HIS CA C 13 56.789 0.30 A 89 HIS CB C 13 30.527 0.30 A 90 ILE H H 1 7.764 0.03 A 90 ILE HA H 1 3.512 0.03 A 90 ILE HB H 1 2.005 0.03 A 90 ILE HD11 H 1 0.413 0.03 A 90 ILE HD12 H 1 0.413 0.03 A 90 ILE HD13 H 1 0.413 0.03 A 90 ILE HG2% H 1 0.520 0.03 A 90 ILE CA C 13 65.424 0.30 A 90 ILE CB C 13 34.176 0.30 A 90 ILE N N 15 120.579 0.30 A 91 PRO HA H 1 2.942 0.03 A 91 PRO HBy H 1 1.660 0.03 A 91 PRO HGx H 1 1.400 0.03 A 91 PRO C C 13 177.032 0.30 A 91 PRO CA C 13 66.842 0.30 A 91 PRO CB C 13 31.206 0.30 A 91 PRO CG C 13 29.086 0.30 A 92 VAL H H 1 6.497 0.03 A 92 VAL HA H 1 3.574 0.03 A 92 VAL HB H 1 1.977 0.03 A 92 VAL HG11 H 1 0.971 0.03 A 92 VAL HG12 H 1 0.971 0.03 A 92 VAL HG13 H 1 0.971 0.03 A 92 VAL HG21 H 1 0.923 0.03 A 92 VAL HG22 H 1 0.923 0.03 A 92 VAL HG23 H 1 0.923 0.03 A 92 VAL CA C 13 65.900 0.30 A 92 VAL CB C 13 31.600 0.30 A 92 VAL CGx C 13 22.169 0.30 A 92 VAL N N 15 114.379 0.30 A 93 LEU H H 1 7.460 0.03 A 93 LEU HA H 1 4.227 0.03 A 93 LEU HBy H 1 1.781 0.03 A 93 LEU HBx H 1 1.501 0.03 A 93 LEU HD11 H 1 0.955 0.03 A 93 LEU HD12 H 1 0.955 0.03 A 93 LEU HD13 H 1 0.955 0.03 A 93 LEU HD21 H 1 0.464 0.03 A 93 LEU HD22 H 1 0.464 0.03 A 93 LEU HD23 H 1 0.464 0.03 A 93 LEU HG H 1 1.068 0.03 A 93 LEU C C 13 180.251 0.30 A 93 LEU CA C 13 57.838 0.30 A 93 LEU CB C 13 43.172 0.30 A 93 LEU CDx C 13 25.926 0.30 A 93 LEU N N 15 120.522 0.30 A 94 CYS H H 1 8.335 0.03 A 94 CYS HA H 1 3.867 0.03 A 94 CYS HBx H 1 2.835 0.03 A 94 CYS HG H 1 1.825 0.03 A 94 CYS C C 13 176.362 0.30 A 94 CYS CA C 13 65.379 0.30 A 94 CYS CB C 13 26.344 0.30 A 94 CYS N N 15 117.195 0.30 A 95 GLU H H 1 8.235 0.03 A 95 GLU HA H 1 4.209 0.03 A 95 GLU HBx H 1 2.178 0.03 A 95 GLU HGx H 1 2.447 0.03 A 95 GLU CA C 13 59.760 0.30 A 95 GLU CB C 13 29.201 0.30 A 95 GLU CG C 13 36.610 0.30 A 95 GLU N N 15 120.777 0.30 A 96 ASP H H 1 8.509 0.03 A 96 ASP HA H 1 4.292 0.03 A 96 ASP HBy H 1 2.789 0.03 A 96 ASP HBx H 1 2.334 0.03 A 96 ASP C C 13 177.890 0.30 A 96 ASP CA C 13 57.235 0.30 A 96 ASP CB C 13 40.580 0.30 A 96 ASP N N 15 120.910 0.30 A 97 HIS H H 1 7.635 0.03 A 97 HIS HA H 1 4.495 0.03 A 97 HIS HBx H 1 2.719 0.03 A 97 HIS HD2 H 1 7.052 0.03 A 97 HIS C C 13 173.548 0.30 A 97 HIS CA C 13 57.290 0.30 A 97 HIS CB C 13 29.997 0.30 A 97 HIS N N 15 115.923 0.30 A 98 SER H H 1 7.888 0.03 A 98 SER HA H 1 4.489 0.03 A 98 SER HBx H 1 4.109 0.03 A 98 SER C C 13 173.949 0.30 A 98 SER CA C 13 58.842 0.30 A 98 SER CB C 13 61.396 0.30 A 98 SER N N 15 114.634 0.30 A 99 VAL H H 1 8.590 0.03 A 99 VAL HA H 1 4.721 0.03 A 99 VAL HB H 1 1.665 0.03 A 99 VAL HG11 H 1 1.106 0.03 A 99 VAL HG12 H 1 1.106 0.03 A 99 VAL HG13 H 1 1.106 0.03 A 99 VAL HG21 H 1 0.985 0.03 A 99 VAL HG22 H 1 0.985 0.03 A 99 VAL HG23 H 1 0.985 0.03 A 99 VAL CA C 13 58.978 0.30 A 99 VAL CB C 13 35.228 0.30 A 99 VAL CGy C 13 22.941 0.30 A 99 VAL CGx C 13 21.311 0.30 A 99 VAL N N 15 123.090 0.30 A 100 PRO HA H 1 4.263 0.03 A 100 PRO HBx H 1 1.683 0.03 A 100 PRO HBy H 1 2.095 0.03 A 100 PRO HDx H 1 3.570 0.03 A 100 PRO HGx H 1 1.678 0.03 A 100 PRO C C 13 173.191 0.30 A 100 PRO CA C 13 63.427 0.30 A 100 PRO CB C 13 31.863 0.30 A 100 PRO CG C 13 27.231 0.30 A 101 TYR H H 1 6.243 0.03 A 101 TYR HA H 1 5.925 0.03 A 101 TYR HBy H 1 3.008 0.03 A 101 TYR HBx H 1 2.256 0.03 A 101 TYR HDy H 1 6.957 0.03 A 101 TYR HEy H 1 6.747 0.03 A 101 TYR CA C 13 53.501 0.30 A 101 TYR CB C 13 41.793 0.30 A 101 TYR N N 15 114.702 0.30 A 102 ILE H H 1 7.986 0.03 A 102 ILE HA H 1 4.502 0.03 A 102 ILE HB H 1 1.736 0.03 A 102 ILE HD11 H 1 0.801 0.03 A 102 ILE HD12 H 1 0.801 0.03 A 102 ILE HD13 H 1 0.801 0.03 A 102 ILE HG2% H 1 1.361 0.03 A 102 ILE C C 13 172.358 0.30 A 102 ILE CA C 13 55.442 0.30 A 102 ILE CB C 13 43.124 0.30 A 102 ILE CD1 C 13 18.789 0.30 A 102 ILE N N 15 111.885 0.30 A 103 PHE H H 1 8.108 0.03 A 103 PHE HA H 1 5.087 0.03 A 103 PHE HBx H 1 3.065 0.03 A 103 PHE HDx H 1 7.228 0.03 A 103 PHE C C 13 176.173 0.30 A 103 PHE CA C 13 56.103 0.30 A 103 PHE CB C 13 39.891 0.30 A 103 PHE N N 15 122.274 0.30 A 104 ILE H H 1 8.843 0.03 A 104 ILE HA H 1 4.927 0.03 A 104 ILE HB H 1 2.441 0.03 A 104 ILE HG1x H 1 1.299 0.03 A 104 ILE HG2% H 1 0.828 0.03 A 104 ILE CA C 13 57.831 0.30 A 104 ILE CB C 13 38.302 0.30 A 104 ILE CG2 C 13 18.723 0.30 A 104 ILE N N 15 114.613 0.30 A 105 PRO HA H 1 4.093 0.03 A 105 PRO HBy H 1 1.930 0.03 A 105 PRO HGx H 1 1.388 0.03 A 105 PRO CA C 13 66.439 0.30 A 105 PRO CB C 13 32.879 0.30 A 105 PRO CG C 13 25.551 0.30 A 106 SER H H 1 7.548 0.03 A 106 SER HA H 1 5.227 0.03 A 106 SER HBy H 1 3.796 0.03 A 106 SER HBx H 1 3.656 0.03 A 106 SER CA C 13 55.373 0.30 A 106 SER CB C 13 64.696 0.30 A 106 SER N N 15 106.896 0.30 A 107 LYS H H 1 8.328 0.03 A 107 LYS HA H 1 4.191 0.03 A 107 LYS HBx H 1 1.845 0.03 A 107 LYS HEx H 1 2.961 0.03 A 107 LYS HGx H 1 1.421 0.03 A 107 LYS CA C 13 58.623 0.30 A 107 LYS CB C 13 30.957 0.30 A 107 LYS CG C 13 24.925 0.30 A 107 LYS N N 15 119.881 0.30 A 108 GLN H H 1 8.543 0.03 A 108 GLN HA H 1 4.013 0.03 A 108 GLN HBx H 1 1.937 0.03 A 108 GLN HGx H 1 2.382 0.03 A 108 GLN CA C 13 58.621 0.30 A 108 GLN CB C 13 28.331 0.30 A 108 GLN CG C 13 33.791 0.30 A 108 GLN N N 15 123.720 0.30 A 109 ASP H H 1 7.998 0.03 A 109 ASP HA H 1 4.353 0.03 A 109 ASP HBy H 1 2.906 0.03 A 109 ASP HBx H 1 2.693 0.03 A 109 ASP CA C 13 56.941 0.30 A 109 ASP CB C 13 40.403 0.30 A 109 ASP N N 15 121.068 0.30 A 110 LEU H H 1 7.999 0.03 A 110 LEU HA H 1 3.967 0.03 A 110 LEU HBy H 1 1.995 0.03 A 110 LEU HBx H 1 1.510 0.03 A 110 LEU HD11 H 1 0.789 0.03 A 110 LEU HD12 H 1 0.789 0.03 A 110 LEU HD13 H 1 0.789 0.03 A 110 LEU HD21 H 1 0.667 0.03 A 110 LEU HD22 H 1 0.667 0.03 A 110 LEU HD23 H 1 0.667 0.03 A 110 LEU C C 13 178.753 0.30 A 110 LEU CA C 13 57.080 0.30 A 110 LEU CB C 13 41.235 0.30 A 110 LEU CDx C 13 26.167 0.30 A 110 LEU N N 15 120.670 0.30 A 111 GLY H H 1 8.012 0.03 A 111 GLY HAy H 1 3.927 0.03 A 111 GLY HAx H 1 3.826 0.03 A 111 GLY C C 13 175.517 0.30 A 111 GLY CA C 13 46.745 0.30 A 111 GLY N N 15 105.512 0.30 A 112 ALA H H 1 7.785 0.03 A 112 ALA HA H 1 4.180 0.03 A 112 ALA HB% H 1 1.447 0.03 A 112 ALA CA C 13 53.652 0.30 A 112 ALA CB C 13 18.482 0.30 A 112 ALA N N 15 122.891 0.30 A 113 ALA H H 1 7.787 0.03 A 113 ALA HA H 1 4.213 0.03 A 113 ALA HB% H 1 1.429 0.03 A 113 ALA CA C 13 53.503 0.30 A 113 ALA CB C 13 18.897 0.30 A 113 ALA N N 15 121.205 0.30 A 114 GLY H H 1 7.756 0.03 A 114 GLY HAx H 1 3.646 0.03 A 114 GLY HAy H 1 4.155 0.03 A 114 GLY CA C 13 44.764 0.30 A 114 GLY N N 15 104.082 0.30 A 115 ALA HA H 1 4.061 0.03 A 115 ALA HB% H 1 1.323 0.03 A 115 ALA CA C 13 53.192 0.30 A 115 ALA CB C 13 19.493 0.30 A 116 THR H H 1 8.121 0.03 A 116 THR HB H 1 3.907 0.03 A 116 THR HG2% H 1 0.881 0.03 A 116 THR CA C 13 57.223 0.30 A 116 THR CB C 13 64.784 0.30 A 116 THR N N 15 116.258 0.30 A 118 ARG H H 1 8.128 0.03 A 118 ARG N N 15 122.269 0.30 A 120 THR H H 1 8.127 0.03 A 120 THR C C 13 172.729 0.30 A 120 THR N N 15 120.171 0.30 A 121 SER H H 1 7.045 0.03 A 121 SER HA H 1 4.280 0.03 A 121 SER HBx H 1 3.831 0.03 A 121 SER CA C 13 59.573 0.30 A 121 SER CB C 13 64.384 0.30 A 121 SER N N 15 115.808 0.30 A 122 VAL H H 1 7.082 0.03 A 122 VAL HA H 1 5.203 0.03 A 122 VAL HB H 1 2.114 0.03 A 122 VAL HG11 H 1 0.800 0.03 A 122 VAL HG12 H 1 0.800 0.03 A 122 VAL HG13 H 1 0.800 0.03 A 122 VAL HG21 H 1 0.684 0.03 A 122 VAL HG22 H 1 0.684 0.03 A 122 VAL HG23 H 1 0.684 0.03 A 122 VAL CA C 13 59.412 0.30 A 122 VAL CB C 13 32.729 0.30 A 122 VAL CGy C 13 23.378 0.30 A 122 VAL CGx C 13 18.852 0.30 A 122 VAL N N 15 115.790 0.30 A 123 VAL H H 1 8.948 0.03 A 123 VAL HA H 1 5.097 0.03 A 123 VAL HB H 1 2.041 0.03 A 123 VAL HG11 H 1 0.806 0.03 A 123 VAL HG12 H 1 0.806 0.03 A 123 VAL HG13 H 1 0.806 0.03 A 123 VAL HG21 H 1 0.777 0.03 A 123 VAL HG22 H 1 0.777 0.03 A 123 VAL HG23 H 1 0.777 0.03 A 123 VAL C C 13 172.990 0.30 A 123 VAL CA C 13 58.925 0.30 A 123 VAL CB C 13 35.929 0.30 A 123 VAL CGy C 13 22.241 0.30 A 123 VAL CGx C 13 20.882 0.30 A 123 VAL N N 15 119.313 0.30 A 124 PHE H H 1 9.065 0.03 A 124 PHE HA H 1 5.641 0.03 A 124 PHE HBy H 1 3.124 0.03 A 124 PHE HBx H 1 2.960 0.03 A 124 PHE HDx H 1 6.908 0.03 A 124 PHE C C 13 174.686 0.30 A 124 PHE CA C 13 52.579 0.30 A 124 PHE CB C 13 42.392 0.30 A 124 PHE N N 15 122.616 0.30 A 125 ILE H H 1 9.498 0.03 A 125 ILE HA H 1 4.268 0.03 A 125 ILE HB H 1 2.078 0.03 A 125 ILE HD11 H 1 0.661 0.03 A 125 ILE HD12 H 1 0.661 0.03 A 125 ILE HD13 H 1 0.661 0.03 A 125 ILE HG1y H 1 1.707 0.03 A 125 ILE HG1x H 1 1.343 0.03 A 125 ILE HG2% H 1 0.873 0.03 A 125 ILE C C 13 173.652 0.30 A 125 ILE CA C 13 61.605 0.30 A 125 ILE CB C 13 39.533 0.30 A 125 ILE CD1 C 13 18.766 0.30 A 125 ILE N N 15 127.599 0.30 A 126 VAL H H 1 8.169 0.03 A 126 VAL HA H 1 4.595 0.03 A 126 VAL HB H 1 1.523 0.03 A 126 VAL HG11 H 1 0.607 0.03 A 126 VAL HG12 H 1 0.607 0.03 A 126 VAL HG13 H 1 0.607 0.03 A 126 VAL HG21 H 1 -0.298 0.03 A 126 VAL HG22 H 1 -0.298 0.03 A 126 VAL HG23 H 1 -0.298 0.03 A 126 VAL CA C 13 58.380 0.30 A 126 VAL CB C 13 32.597 0.30 A 126 VAL CGy C 13 21.090 0.30 A 126 VAL CGx C 13 18.077 0.30 A 126 VAL N N 15 126.693 0.30 A 127 PRO HA H 1 4.044 0.03 A 127 PRO HBy H 1 1.802 0.03 A 127 PRO HGx H 1 1.581 0.03 A 127 PRO CA C 13 63.380 0.30 A 127 PRO CB C 13 31.735 0.30 A 127 PRO CG C 13 25.421 0.30 A 128 GLY H H 1 8.022 0.03 A 128 GLY HAy H 1 4.708 0.03 A 128 GLY HAx H 1 3.920 0.03 A 128 GLY CA C 13 45.443 0.30 A 128 GLY N N 15 108.589 0.30 A 129 SER H H 1 7.992 0.03 A 129 SER N N 15 113.115 0.30 A 130 ASN H H 1 8.313 0.03 A 130 ASN C C 13 178.419 0.30 A 130 ASN CA C 13 57.337 0.30 A 130 ASN CB C 13 41.958 0.30 A 130 ASN N N 15 120.738 0.30 A 131 LYS H H 1 7.881 0.03 A 131 LYS HA H 1 4.021 0.03 A 131 LYS HBx H 1 2.000 0.03 A 131 LYS CA C 13 58.749 0.30 A 131 LYS CB C 13 29.565 0.30 A 131 LYS N N 15 119.159 0.30 A 132 LYS H H 1 7.765 0.03 A 132 LYS CA C 13 58.413 0.30 A 132 LYS CB C 13 30.694 0.30 A 132 LYS N N 15 117.399 0.30 A 133 LYS H H 1 8.070 0.03 A 133 LYS CA C 13 58.266 0.30 A 133 LYS CB C 13 30.981 0.30 A 133 LYS N N 15 119.160 0.30 A 134 ASP H H 1 8.255 0.03 A 134 ASP CA C 13 55.586 0.30 A 134 ASP CB C 13 41.898 0.30 A 134 ASP N N 15 120.602 0.30 A 135 GLY H H 1 8.451 0.03 A 135 GLY HAy H 1 4.717 0.03 A 135 GLY HAx H 1 3.918 0.03 A 135 GLY CA C 13 45.536 0.30 A 135 GLY N N 15 108.785 0.30 A 136 LYS H H 1 8.127 0.03 A 136 LYS N N 15 120.171 0.30 A 137 ASN H H 1 8.481 0.03 A 137 ASN HD2x H 1 6.950 0.03 A 137 ASN HD2y H 1 7.654 0.03 A 137 ASN N N 15 118.588 0.30 A 137 ASN ND2 N 15 113.242 0.30 A 138 LYS H H 1 8.318 0.03 A 138 LYS HA H 1 4.241 0.03 A 138 LYS HBx H 1 1.809 0.03 A 138 LYS HEx H 1 2.805 0.03 A 138 LYS HGx H 1 1.588 0.03 A 138 LYS CA C 13 56.760 0.30 A 138 LYS CB C 13 32.691 0.30 A 138 LYS CD C 13 29.106 0.30 A 138 LYS CG C 13 24.830 0.30 A 138 LYS N N 15 121.739 0.30 A 139 GLU H H 1 8.478 0.03 A 139 GLU CA C 13 57.235 0.30 A 139 GLU CB C 13 29.893 0.30 A 139 GLU N N 15 120.980 0.30 A 142 TYR H H 1 7.992 0.03 A 142 TYR HA H 1 5.023 0.03 A 142 TYR HBy H 1 3.329 0.03 A 142 TYR HBx H 1 2.760 0.03 A 142 TYR HDy H 1 7.079 0.03 A 142 TYR C C 13 175.419 0.30 A 142 TYR CA C 13 57.200 0.30 A 142 TYR CB C 13 39.165 0.30 A 142 TYR N N 15 119.214 0.30 A 143 LYS H H 1 7.377 0.03 A 143 LYS HA H 1 3.628 0.03 A 143 LYS HBx H 1 1.686 0.03 A 143 LYS HGx H 1 1.271 0.03 A 143 LYS CA C 13 59.619 0.30 A 143 LYS CB C 13 31.869 0.30 A 143 LYS CG C 13 24.398 0.30 A 143 LYS N N 15 123.500 0.30 A 144 GLU H H 1 8.583 0.03 A 144 GLU HA H 1 4.735 0.03 A 144 GLU HBx H 1 2.069 0.03 A 144 GLU HGx H 1 2.322 0.03 A 144 GLU CA C 13 59.865 0.30 A 144 GLU CB C 13 29.004 0.30 A 144 GLU N N 15 118.669 0.30 A 145 SER H H 1 8.117 0.03 A 145 SER HA H 1 4.448 0.03 A 145 SER HBy H 1 4.382 0.03 A 145 SER HBx H 1 4.195 0.03 A 145 SER CB C 13 64.178 0.30 A 145 SER N N 15 116.081 0.30 A 146 PHE H H 1 8.553 0.03 A 146 PHE HA H 1 4.022 0.03 A 146 PHE HBy H 1 3.359 0.03 A 146 PHE HBx H 1 3.123 0.03 A 146 PHE HDx H 1 7.108 0.03 A 146 PHE HDy H 1 7.227 0.03 A 146 PHE C C 13 175.751 0.30 A 146 PHE CA C 13 62.159 0.30 A 146 PHE CB C 13 39.533 0.30 A 146 PHE N N 15 122.134 0.30 A 147 ASN H H 1 8.809 0.03 A 147 ASN HA H 1 4.269 0.03 A 147 ASN HBy H 1 2.994 0.03 A 147 ASN HBx H 1 2.771 0.03 A 147 ASN HD2x H 1 6.828 0.03 A 147 ASN HD2y H 1 7.649 0.03 A 147 ASN CA C 13 55.881 0.30 A 147 ASN CB C 13 37.663 0.30 A 147 ASN N N 15 117.856 0.30 A 147 ASN ND2 N 15 110.972 0.30 A 148 GLU H H 1 7.778 0.03 A 148 GLU HA H 1 4.021 0.03 A 148 GLU HBx H 1 2.137 0.03 A 148 GLU HGx H 1 2.454 0.03 A 148 GLU CA C 13 59.385 0.30 A 148 GLU CB C 13 29.784 0.30 A 148 GLU CG C 13 36.453 0.30 A 148 GLU N N 15 119.708 0.30 A 149 VAL H H 1 8.023 0.03 A 149 VAL HA H 1 3.556 0.03 A 149 VAL HB H 1 2.103 0.03 A 149 VAL HG11 H 1 0.924 0.03 A 149 VAL HG12 H 1 0.924 0.03 A 149 VAL HG13 H 1 0.924 0.03 A 149 VAL HG21 H 1 0.723 0.03 A 149 VAL HG22 H 1 0.723 0.03 A 149 VAL HG23 H 1 0.723 0.03 A 149 VAL CA C 13 66.625 0.30 A 149 VAL CB C 13 31.368 0.30 A 149 VAL CGy C 13 23.918 0.30 A 149 VAL CGx C 13 23.146 0.30 A 149 VAL N N 15 119.680 0.30 A 150 VAL H H 1 8.480 0.03 A 150 VAL HA H 1 3.163 0.03 A 150 VAL HB H 1 1.713 0.03 A 150 VAL HG11 H 1 0.365 0.03 A 150 VAL HG12 H 1 0.365 0.03 A 150 VAL HG13 H 1 0.365 0.03 A 150 VAL HG21 H 1 0.759 0.03 A 150 VAL HG22 H 1 0.759 0.03 A 150 VAL HG23 H 1 0.759 0.03 A 150 VAL C C 13 177.270 0.30 A 150 VAL CA C 13 67.984 0.30 A 150 VAL CB C 13 30.848 0.30 A 150 VAL CGy C 13 24.191 0.30 A 150 VAL CGx C 13 21.734 0.30 A 150 VAL N N 15 119.684 0.30 A 151 LYS H H 1 7.584 0.03 A 151 LYS HA H 1 4.027 0.03 A 151 LYS HBx H 1 1.862 0.03 A 151 LYS HDx H 1 1.739 0.03 A 151 LYS HGx H 1 1.601 0.03 A 151 LYS CA C 13 59.691 0.30 A 151 LYS CB C 13 32.346 0.30 A 151 LYS CD C 13 29.523 0.30 A 151 LYS CG C 13 25.312 0.30 A 151 LYS N N 15 118.648 0.30 A 152 GLU H H 1 7.528 0.03 A 152 GLU HA H 1 4.046 0.03 A 152 GLU HBx H 1 2.074 0.03 A 152 GLU HGx H 1 2.426 0.03 A 152 GLU CA C 13 59.932 0.30 A 152 GLU CB C 13 29.663 0.30 A 152 GLU CG C 13 36.709 0.30 A 152 GLU N N 15 120.177 0.30 A 153 VAL H H 1 8.665 0.03 A 153 VAL HA H 1 3.421 0.03 A 153 VAL HB H 1 2.027 0.03 A 153 VAL HG11 H 1 0.873 0.03 A 153 VAL HG12 H 1 0.873 0.03 A 153 VAL HG13 H 1 0.873 0.03 A 153 VAL HG21 H 1 0.711 0.03 A 153 VAL HG22 H 1 0.711 0.03 A 153 VAL HG23 H 1 0.711 0.03 A 153 VAL CA C 13 67.196 0.30 A 153 VAL CB C 13 31.600 0.30 A 153 VAL CGy C 13 23.455 0.30 A 153 VAL N N 15 120.413 0.30 A 154 GLN H H 1 8.950 0.03 A 154 GLN HA H 1 3.982 0.03 A 154 GLN HBx H 1 2.227 0.03 A 154 GLN HBy H 1 3.369 0.03 A 154 GLN HE2x H 1 6.826 0.03 A 154 GLN HE2y H 1 7.508 0.03 A 154 GLN HGy H 1 2.493 0.03 A 154 GLN HGx H 1 2.290 0.03 A 154 GLN CA C 13 59.651 0.30 A 154 GLN CB C 13 28.478 0.30 A 154 GLN CG C 13 34.571 0.30 A 154 GLN N N 15 118.232 0.30 A 154 GLN NE2 N 15 111.888 0.30 A 155 ALA H H 1 7.486 0.03 A 155 ALA HA H 1 4.223 0.03 A 155 ALA HB% H 1 1.498 0.03 A 155 ALA CA C 13 55.071 0.30 A 155 ALA CB C 13 17.952 0.30 A 155 ALA N N 15 120.568 0.30 A 156 LEU H H 1 7.781 0.03 A 156 LEU HA H 1 4.187 0.03 A 156 LEU HBx H 1 2.051 0.03 A 156 LEU HD11 H 1 0.894 0.03 A 156 LEU HD12 H 1 0.894 0.03 A 156 LEU HD13 H 1 0.894 0.03 A 156 LEU HD21 H 1 0.851 0.03 A 156 LEU HD22 H 1 0.851 0.03 A 156 LEU HD23 H 1 0.851 0.03 A 156 LEU HG H 1 1.462 0.03 A 156 LEU CA C 13 57.413 0.30 A 156 LEU CB C 13 42.287 0.30 A 156 LEU CDx C 13 26.399 0.30 A 156 LEU N N 15 119.586 0.30 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 37 LYS H A 38 LYS H 1.0 . 4.41 2 2 A 38 LYS H A 39 LEU H 1.0 . 4.48 3 3 A 39 LEU H A 40 ASN H 1.0 . 4.25 4 4 A 40 ASN H A 41 LYS H 1.0 . 4.20 5 5 A 42 LYS H A 43 VAL H 1.0 . 4.30 6 6 A 43 VAL H A 44 LEU H 1.0 . 3.80 7 7 A 44 LEU H A 45 LYS H 1.0 . 3.87 8 8 A 46 THR H A 47 VAL H 1.0 . 4.12 9 9 A 47 VAL H A 48 LYS H 1.0 . 5.50 10 10 A 48 LYS H A 49 LYS H 1.0 . 4.31 11 11 A 51 SER H A 52 LYS H 1.0 . 4.15 12 12 A 52 LYS H A 53 ALA H 1.0 . 3.67 13 13 A 53 ALA H A 54 LYS H 1.0 . 3.21 14 14 A 54 LYS H A 55 ASN H 1.0 . 3.72 15 15 A 55 ASN H A 56 VAL H 1.0 . 4.57 16 16 A 58 ARG H A 59 GLY H 1.0 . 4.85 17 17 A 61 LYS H A 62 GLU H 1.0 . 4.32 18 18 A 62 GLU H A 63 VAL H 1.0 . 4.67 19 19 A 63 VAL H A 64 VAL H 1.0 . 3.67 20 20 A 64 VAL H A 65 LYS H 1.0 . 3.88 21 21 A 66 ALA H A 67 LEU H 1.0 . 3.44 22 22 A 68 ARG H A 69 LYS H 1.0 . 3.88 23 23 A 71 GLU H A 72 LYS H 1.0 . 4.42 24 24 A 73 GLY H A 74 LEU H 1.0 . 4.94 25 25 A 74 LEU H A 75 VAL H 1.0 . 4.77 26 26 A 80 ASP H A 81 ILE H 1.0 . 4.34 27 27 A 87 ILE H A 88 SER H 1.0 . 4.05 28 28 A 92 VAL H A 93 LEU H 1.0 . 4.13 29 29 A 93 LEU H A 94 CYS H 1.0 . 4.03 30 30 A 94 CYS H A 95 GLU H 1.0 . 4.62 31 31 A 96 ASP H A 97 HIS H 1.0 . 4.11 32 32 A 98 SER H A 99 VAL H 1.0 . 4.46 33 33 A 106 SER H A 107 LYS H 1.0 . 4.84 34 34 A 129 SER H A 130 ASN H 1.0 . 4.39 35 35 A 130 ASN H A 131 LYS H 1.0 . 4.26 36 36 A 143 LYS H A 144 GLU H 1.0 . 4.39 37 37 A 144 GLU H A 145 SER H 1.0 . 5.50 38 38 A 145 SER H A 146 PHE H 1.0 . 5.39 39 39 A 146 PHE H A 147 ASN H 1.0 . 3.80 40 40 A 147 ASN H A 148 GLU H 1.0 . 3.71 41 41 A 149 VAL H A 150 VAL H 1.0 . 3.80 42 42 A 150 VAL H A 151 LYS H 1.0 . 3.80 43 43 A 152 GLU H A 153 VAL H 1.0 . 3.87 44 44 A 155 ALA H A 156 LEU H 1.0 . 3.69 45 45 A 56 VAL HA A 57 LYS H 1.0 . 3.53 46 46 A 58 ARG H A 57 LYS HA 1.0 . 3.47 47 47 A 59 GLY H A 58 ARG HA 1.0 . 3.70 48 48 A 71 GLU H A 70 GLY HAy 1.0 . 4.30 49 48 A 71 GLU H A 70 GLY HAx 1.0 . 4.30 50 49 A 74 LEU H A 73 GLY HAy 1.0 . 4.10 51 49 A 74 LEU H A 73 GLY HAx 1.0 . 4.10 52 50 A 75 VAL H A 74 LEU HA 1.0 . 4.30 53 51 A 75 VAL HA A 76 VAL H 1.0 . 4.30 54 52 A 76 VAL HA A 77 ILE H 1.0 . 3.80 55 53 A 77 ILE HA A 78 ALA H 1.0 . 4.30 56 54 A 78 ALA HA A 79 GLY H 1.0 . 4.30 57 55 A 99 VAL H A 98 SER HA 1.0 . 3.80 58 56 A 100 PRO HA A 101 TYR H 1.0 . 3.80 59 57 A 101 TYR HA A 102 ILE H 1.0 . 3.45 60 58 A 102 ILE HA A 103 PHE H 1.0 . 4.30 61 59 A 103 PHE HA A 104 ILE H 1.0 . 4.30 62 60 A 122 VAL HA A 123 VAL H 1.0 . 4.30 63 61 A 123 VAL HA A 124 PHE H 1.0 . 3.80 64 62 A 124 PHE HA A 125 ILE H 1.0 . 3.80 65 63 A 125 ILE HA A 126 VAL H 1.0 . 3.80 66 64 A 40 ASN H A 39 LEU HBx 1.0 . 4.39 67 64 A 40 ASN H A 39 LEU HBy 1.0 . 4.39 68 65 A 41 LYS H A 40 ASN HBy 1.0 . 4.20 69 65 A 41 LYS H A 40 ASN HBx 1.0 . 4.20 70 66 A 42 LYS H A 41 LYS HBx 1.0 . 3.72 71 66 A 42 LYS H A 41 LYS HBy 1.0 . 3.72 72 67 A 43 VAL H A 42 LYS HBx 1.0 . 4.09 73 67 A 43 VAL H A 42 LYS HBy 1.0 . 4.09 74 68 A 44 LEU H A 43 VAL HB 1.0 . 4.02 75 69 A 46 THR H A 45 LYS HBx 1.0 . 3.73 76 69 A 46 THR H A 45 LYS HBy 1.0 . 3.73 77 70 A 47 VAL H A 46 THR HB 1.0 . 4.22 78 71 A 50 ALA H A 49 LYS HBx 1.0 . 3.56 79 71 A 49 LYS HBy A 50 ALA H 1.0 . 3.56 80 72 A 51 SER H A 50 ALA HB% 1.0 . 4.50 81 73 A 52 LYS H A 51 SER HBy 1.0 . 3.96 82 73 A 52 LYS H A 51 SER HBx 1.0 . 3.96 83 74 A 53 ALA H A 52 LYS HBx 1.0 . 3.74 84 74 A 53 ALA H A 52 LYS HBy 1.0 . 3.74 85 75 A 54 LYS H A 53 ALA HB% 1.0 . 3.80 86 76 A 57 LYS H A 56 VAL HB 1.0 . 4.50 87 77 A 58 ARG H A 57 LYS HBy 1.0 . 4.01 88 77 A 58 ARG H A 57 LYS HBx 1.0 . 4.01 89 78 A 59 GLY H A 58 ARG HBy 1.0 . 4.54 90 78 A 59 GLY H A 58 ARG HBx 1.0 . 4.54 91 79 A 62 GLU H A 61 LYS HBx 1.0 . 3.44 92 79 A 62 GLU H A 61 LYS HBy 1.0 . 3.44 93 80 A 63 VAL H A 62 GLU HBx 1.0 . 3.90 94 80 A 63 VAL H A 62 GLU HBy 1.0 . 3.90 95 81 A 64 VAL H A 63 VAL HB 1.0 . 3.72 96 82 A 66 ALA H A 65 LYS HBx 1.0 . 3.42 97 82 A 66 ALA H A 65 LYS HBy 1.0 . 3.42 98 83 A 67 LEU H A 66 ALA HB% 1.0 . 3.55 99 84 A 70 GLY H A 69 LYS HBx 1.0 . 4.05 100 84 A 69 LYS HBy A 70 GLY H 1.0 . 4.05 101 85 A 72 LYS H A 71 GLU HBy 1.0 . 3.86 102 85 A 72 LYS H A 71 GLU HBx 1.0 . 3.86 103 86 A 73 GLY H A 72 LYS HBy 1.0 . 3.84 104 86 A 73 GLY H A 72 LYS HBx 1.0 . 3.84 105 87 A 75 VAL H A 74 LEU HBy 1.0 . 4.35 106 87 A 75 VAL H A 74 LEU HBx 1.0 . 4.35 107 88 A 76 VAL H A 75 VAL HB 1.0 . 5.41 108 89 A 86 VAL H A 85 ASP HBx 1.0 . 5.50 109 89 A 85 ASP HBy A 86 VAL H 1.0 . 5.50 110 90 A 87 ILE H A 86 VAL HB 1.0 . 5.24 111 91 A 94 CYS H A 93 LEU HBy 1.0 . 4.04 112 91 A 94 CYS H A 93 LEU HBx 1.0 . 4.04 113 92 A 95 GLU H A 94 CYS HBx 1.0 . 4.37 114 92 A 95 GLU H A 94 CYS HBy 1.0 . 4.37 115 93 A 97 HIS H A 96 ASP HBy 1.0 . 3.96 116 93 A 97 HIS H A 96 ASP HBx 1.0 . 3.96 117 94 A 101 TYR H A 100 PRO HBx 1.0 . 4.32 118 94 A 101 TYR H A 100 PRO HBy 1.0 . 4.32 119 95 A 102 ILE H A 101 TYR HBy 1.0 . 4.41 120 95 A 102 ILE H A 101 TYR HBx 1.0 . 4.41 121 96 A 103 PHE H A 102 ILE HB 1.0 . 4.03 122 97 A 111 GLY H A 110 LEU HBy 1.0 . 4.82 123 97 A 110 LEU HBx A 111 GLY H 1.0 . 4.82 124 98 A 115 ALA HB% A 116 THR H 1.0 . 3.85 125 99 A 122 VAL H A 121 SER HBx 1.0 . 5.25 126 99 A 121 SER HBy A 122 VAL H 1.0 . 5.25 127 100 A 124 PHE H A 123 VAL HB 1.0 . 4.46 128 101 A 131 LYS H A 130 ASN HBx 1.0 . 3.28 129 101 A 131 LYS H A 130 ASN HBy 1.0 . 3.28 130 102 A 147 ASN H A 146 PHE HBx 1.0 . 4.23 131 102 A 147 ASN H A 146 PHE HBy 1.0 . 4.23 132 103 A 148 GLU H A 147 ASN HBy 1.0 . 3.76 133 103 A 148 GLU H A 147 ASN HBx 1.0 . 3.76 134 104 A 149 VAL H A 148 GLU HBx 1.0 . 3.46 135 104 A 149 VAL H A 148 GLU HBy 1.0 . 3.46 136 105 A 150 VAL H A 149 VAL HB 1.0 . 4.30 137 106 A 153 VAL H A 152 GLU HBx 1.0 . 3.58 138 106 A 153 VAL H A 152 GLU HBy 1.0 . 3.58 139 107 A 38 LYS HA A 37 LYS HBx 1.0 . 3.85 140 107 A 37 LYS HBy A 38 LYS HA 1.0 . 3.85 141 108 A 40 ASN H A 39 LEU HG 1.0 . 5.50 142 109 A 40 ASN H A 39 LEU HD11 1.0 . 5.50 143 110 A 40 ASN H A 39 LEU HD21 1.0 . 5.50 144 111 A 40 ASN HBx A 41 LYS HBx 1.0 . 5.13 145 111 A 40 ASN HBy A 41 LYS HBx 1.0 . 5.13 146 111 A 41 LYS HBy A 40 ASN HBy 1.0 . 5.13 147 111 A 40 ASN HBx A 41 LYS HBy 1.0 . 5.13 148 112 A 43 VAL HA A 42 LYS HBx 1.0 . 4.35 149 112 A 42 LYS HBy A 43 VAL HA 1.0 . 4.35 150 113 A 42 LYS H A 43 VAL HG21 1.0 . 4.15 151 113 A 42 LYS H A 43 VAL HG11 1.0 . 4.15 152 114 A 44 LEU H A 43 VAL HG21 1.0 . 3.40 153 114 A 44 LEU H A 43 VAL HG11 1.0 . 3.40 154 115 A 46 THR H A 45 LYS HGy 1.0 . 4.65 155 115 A 46 THR H A 45 LYS HGx 1.0 . 4.65 156 116 A 46 THR HA A 45 LYS HBx 1.0 . 4.25 157 116 A 45 LYS HBy A 46 THR HA 1.0 . 4.25 158 117 A 46 THR HG2% A 47 VAL HA 1.0 . 3.90 159 118 A 46 THR HG2% A 47 VAL HB 1.0 . 4.50 160 119 A 47 VAL H A 46 THR HG2% 1.0 . 4.30 161 120 A 46 THR HB A 47 VAL HB 1.0 . 4.28 162 121 A 46 THR H A 47 VAL HG21 1.0 . 4.07 163 121 A 46 THR H A 47 VAL HG11 1.0 . 4.07 164 122 A 46 THR HA A 47 VAL HG21 1.0 . 5.32 165 122 A 46 THR HA A 47 VAL HG11 1.0 . 5.32 166 123 A 46 THR HB A 47 VAL HG21 1.0 . 5.21 167 123 A 46 THR HB A 47 VAL HG11 1.0 . 5.21 168 124 A 46 THR HA A 47 VAL HA 1.0 . 4.94 169 125 A 48 LYS H A 47 VAL HG21 1.0 . 3.95 170 125 A 48 LYS H A 47 VAL HG11 1.0 . 3.95 171 126 A 50 ALA HA A 49 LYS HBx 1.0 . 4.82 172 126 A 49 LYS HBy A 50 ALA HA 1.0 . 4.82 173 127 A 51 SER HBx A 50 ALA HB% 1.0 . 4.45 174 127 A 50 ALA HB% A 51 SER HBy 1.0 . 4.45 175 128 A 51 SER HA A 50 ALA HB% 1.0 . 3.96 176 129 A 55 ASN HA A 54 LYS HGx 1.0 . 5.50 177 129 A 54 LYS HGy A 55 ASN HA 1.0 . 5.50 178 130 A 55 ASN HA A 54 LYS HA 1.0 . 4.62 179 131 A 55 ASN H A 54 LYS HGx 1.0 . 4.41 180 131 A 55 ASN H A 54 LYS HGy 1.0 . 4.41 181 132 A 57 LYS H A 56 VAL HG11 1.0 . 3.87 182 132 A 57 LYS H A 56 VAL HG21 1.0 . 3.87 183 133 A 60 VAL H A 61 LYS HBx 1.0 . 4.39 184 133 A 61 LYS HBy A 60 VAL H 1.0 . 4.39 185 134 A 60 VAL HG21 A 61 LYS HBx 1.0 . 3.17 186 134 A 60 VAL HG11 A 61 LYS HBx 1.0 . 3.17 187 134 A 61 LYS HBy A 60 VAL HG11 1.0 . 3.17 188 134 A 61 LYS HBy A 60 VAL HG21 1.0 . 3.17 189 135 A 61 LYS H A 60 VAL HG11 1.0 . 3.73 190 135 A 61 LYS H A 60 VAL HG21 1.0 . 3.73 191 136 A 64 VAL H A 63 VAL HG11 1.0 . 3.67 192 136 A 64 VAL H A 63 VAL HG21 1.0 . 3.67 193 137 A 65 LYS H A 64 VAL HG11 1.0 . 3.83 194 137 A 65 LYS H A 64 VAL HG21 1.0 . 3.83 195 138 A 65 LYS HA A 64 VAL HG11 1.0 . 3.30 196 138 A 64 VAL HG21 A 65 LYS HA 1.0 . 3.30 197 139 A 68 ARG H A 67 LEU HG 1.0 . 3.95 198 140 A 69 LYS HBx A 70 GLY HAy 1.0 . 5.34 199 140 A 69 LYS HBy A 70 GLY HAy 1.0 . 5.34 200 140 A 70 GLY HAx A 69 LYS HBx 1.0 . 5.34 201 140 A 70 GLY HAx A 69 LYS HBy 1.0 . 5.34 202 141 A 70 GLY H A 69 LYS HGx 1.0 . 4.93 203 141 A 70 GLY H A 69 LYS HGy 1.0 . 4.93 204 142 A 70 GLY H A 71 GLU HGx 1.0 . 5.45 205 142 A 70 GLY H A 71 GLU HGy 1.0 . 5.45 206 143 A 70 GLY HAy A 71 GLU HBy 1.0 . 5.34 207 143 A 70 GLY HAx A 71 GLU HBy 1.0 . 5.34 208 143 A 71 GLU HBx A 70 GLY HAy 1.0 . 5.34 209 143 A 70 GLY HAx A 71 GLU HBx 1.0 . 5.34 210 144 A 73 GLY H A 72 LYS HGx 1.0 . 4.86 211 144 A 73 GLY H A 72 LYS HGy 1.0 . 4.86 212 145 A 72 LYS HBy A 73 GLY HAy 1.0 . 5.50 213 145 A 72 LYS HBx A 73 GLY HAy 1.0 . 5.50 214 146 A 73 GLY H A 74 LEU HBy 1.0 . 5.50 215 147 A 73 GLY H A 74 LEU HD11 1.0 . 5.27 216 148 A 73 GLY H A 74 LEU HD21 1.0 . 5.27 217 149 A 73 GLY HAx A 74 LEU HD11 1.0 . 5.50 218 150 A 73 GLY HAx A 74 LEU HD21 1.0 . 5.50 219 151 A 75 VAL H A 74 LEU HD11 1.0 . 4.39 220 151 A 75 VAL H A 74 LEU HD21 1.0 . 4.39 221 152 A 74 LEU HA A 75 VAL HG21 1.0 . 4.42 222 152 A 74 LEU HA A 75 VAL HG11 1.0 . 4.42 223 153 A 75 VAL H A 74 LEU HG 1.0 . 5.17 224 154 A 77 ILE H A 76 VAL HG21 1.0 . 4.14 225 154 A 77 ILE H A 76 VAL HG11 1.0 . 4.14 226 155 A 78 ALA H A 77 ILE HG1y 1.0 . 4.32 227 155 A 78 ALA H A 77 ILE HG1x 1.0 . 4.32 228 156 A 78 ALA H A 77 ILE HG2% 1.0 . 4.14 229 157 A 78 ALA HA A 77 ILE HG2% 1.0 . 4.00 230 158 A 77 ILE HA A 78 ALA HB% 1.0 . 4.93 231 159 A 77 ILE HD11 A 78 ALA HB% 1.0 . 5.50 232 160 A 81 ILE HA A 80 ASP HBy 1.0 . 5.06 233 160 A 80 ASP HBx A 81 ILE HA 1.0 . 5.06 234 161 A 80 ASP HA A 81 ILE HG1x 1.0 . 4.50 235 161 A 80 ASP HA A 81 ILE HG1y 1.0 . 4.50 236 162 A 84 ALA HA A 85 ASP HBx 1.0 . 5.44 237 162 A 85 ASP HBy A 84 ALA HA 1.0 . 5.44 238 163 A 85 ASP HBx A 86 VAL HG21 1.0 . 4.31 239 163 A 85 ASP HBy A 86 VAL HG21 1.0 . 4.31 240 163 A 86 VAL HG11 A 85 ASP HBx 1.0 . 4.31 241 163 A 85 ASP HBy A 86 VAL HG11 1.0 . 4.31 242 164 A 86 VAL HA A 85 ASP HBx 1.0 . 5.50 243 164 A 85 ASP HBy A 86 VAL HA 1.0 . 5.50 244 165 A 87 ILE H A 86 VAL HG21 1.0 . 4.41 245 165 A 87 ILE H A 86 VAL HG11 1.0 . 4.41 246 166 A 88 SER H A 87 ILE HG2% 1.0 . 5.04 247 167 A 87 ILE H A 88 SER HA 1.0 . 5.09 248 168 A 93 LEU H A 92 VAL HG11 1.0 . 4.32 249 169 A 93 LEU H A 92 VAL HG21 1.0 . 4.32 250 170 A 92 VAL HA A 93 LEU HBy 1.0 . 5.45 251 170 A 93 LEU HBx A 92 VAL HA 1.0 . 5.45 252 171 A 92 VAL HA A 93 LEU HG 1.0 . 6.50 253 172 A 93 LEU HA A 92 VAL HG21 1.0 . 3.57 254 172 A 92 VAL HG11 A 93 LEU HA 1.0 . 3.57 255 173 A 94 CYS H A 93 LEU HD11 1.0 . 3.95 256 173 A 94 CYS H A 93 LEU HD21 1.0 . 3.95 257 174 A 94 CYS HA A 93 LEU HD11 1.0 . 4.90 258 174 A 93 LEU HD21 A 94 CYS HA 1.0 . 4.90 259 175 A 98 SER H A 99 VAL HB 1.0 . 4.99 260 176 A 98 SER HA A 99 VAL HB 1.0 . 5.50 261 177 A 101 TYR HA A 102 ILE HG2% 1.0 . 6.50 262 178 A 103 PHE HA A 102 ILE HG2% 1.0 . 4.21 263 179 A 103 PHE H A 102 ILE HG1x 1.0 . 3.96 264 179 A 103 PHE H A 102 ILE HG1y 1.0 . 3.96 265 180 A 103 PHE H A 102 ILE HG2% 1.0 . 3.89 266 181 A 103 PHE H A 102 ILE HD11 1.0 . 4.45 267 182 A 111 GLY H A 110 LEU HD11 1.0 . 5.50 268 183 A 111 GLY H A 110 LEU HD21 1.0 . 5.50 269 184 A 110 LEU HBx A 111 GLY HAy 1.0 . 5.34 270 184 A 110 LEU HBy A 111 GLY HAy 1.0 . 5.34 271 184 A 111 GLY HAx A 110 LEU HBy 1.0 . 5.34 272 184 A 110 LEU HBx A 111 GLY HAx 1.0 . 5.34 273 185 A 114 GLY HAy A 113 ALA HB% 1.0 . 5.13 274 185 A 113 ALA HB% A 114 GLY HAx 1.0 . 5.13 275 186 A 120 THR HG21 A 121 SER H 1.0 . 4.90 276 187 A 122 VAL HA A 121 SER HA 1.0 . 4.47 277 188 A 121 SER HA A 122 VAL HG21 1.0 . 4.61 278 188 A 121 SER HA A 122 VAL HG11 1.0 . 4.61 279 189 A 122 VAL HB A 121 SER HBx 1.0 . 5.50 280 189 A 121 SER HBy A 122 VAL HB 1.0 . 5.50 281 190 A 121 SER HBy A 122 VAL HG11 1.0 . 4.39 282 190 A 122 VAL HG11 A 121 SER HBx 1.0 . 4.39 283 191 A 121 SER HBx A 122 VAL HG21 1.0 . 4.39 284 191 A 121 SER HBy A 122 VAL HG21 1.0 . 4.39 285 192 A 121 SER H A 122 VAL HG11 1.0 . 6.50 286 193 A 121 SER H A 122 VAL HG21 1.0 . 5.09 287 194 A 122 VAL HA A 123 VAL HG21 1.0 . 4.53 288 194 A 122 VAL HA A 123 VAL HG11 1.0 . 4.53 289 195 A 124 PHE HA A 123 VAL HG21 1.0 . 4.40 290 195 A 124 PHE HA A 123 VAL HG11 1.0 . 4.40 291 196 A 124 PHE HA A 125 ILE HD11 1.0 . 4.43 292 197 A 125 ILE HD11 A 124 PHE HBy 1.0 . 5.50 293 198 A 125 ILE HD11 A 124 PHE HBx 1.0 . 5.50 294 199 A 125 ILE H A 124 PHE HDx 1.0 . 5.18 295 200 A 125 ILE HD11 A 124 PHE HDx 1.0 . 5.50 296 201 A 125 ILE HA A 126 VAL HG21 1.0 . 5.44 297 201 A 125 ILE HA A 126 VAL HG11 1.0 . 5.44 298 202 A 125 ILE HG2% A 126 VAL HA 1.0 . 4.46 299 203 A 126 VAL H A 125 ILE HG2% 1.0 . 4.40 300 204 A 126 VAL H A 125 ILE HD11 1.0 . 4.25 301 205 A 127 PRO HBx A 128 GLY HAy 1.0 . 4.82 302 205 A 127 PRO HBy A 128 GLY HAy 1.0 . 4.82 303 205 A 128 GLY HAx A 127 PRO HBx 1.0 . 4.82 304 205 A 127 PRO HBy A 128 GLY HAx 1.0 . 4.82 305 206 A 127 PRO HGx A 128 GLY HAy 1.0 . 5.27 306 206 A 127 PRO HGy A 128 GLY HAy 1.0 . 5.27 307 206 A 128 GLY HAx A 127 PRO HGx 1.0 . 5.27 308 206 A 128 GLY HAx A 127 PRO HGy 1.0 . 5.27 309 207 A 135 GLY HAx A 136 LYS HBx 1.0 . 5.15 310 207 A 136 LYS HBy A 135 GLY HAy 1.0 . 5.15 311 207 A 135 GLY HAx A 136 LYS HBy 1.0 . 5.15 312 207 A 135 GLY HAy A 136 LYS HBx 1.0 . 5.15 313 208 A 137 ASN HA A 136 LYS HBx 1.0 . 4.62 314 208 A 136 LYS HBy A 137 ASN HA 1.0 . 4.62 315 209 A 145 SER H A 146 PHE HDx 1.0 . 6.50 316 210 A 147 ASN H A 146 PHE HDx 1.0 . 4.95 317 211 A 148 GLU HA A 147 ASN HBy 1.0 . 4.84 318 211 A 147 ASN HBx A 148 GLU HA 1.0 . 4.84 319 212 A 148 GLU H A 149 VAL HG21 1.0 . 4.27 320 212 A 148 GLU H A 149 VAL HG11 1.0 . 4.27 321 213 A 149 VAL HB A 150 VAL HA 1.0 . 4.83 322 214 A 149 VAL HA A 150 VAL HG21 1.0 . 5.01 323 214 A 149 VAL HA A 150 VAL HG11 1.0 . 5.01 324 215 A 149 VAL HB A 150 VAL HG21 1.0 . 4.23 325 215 A 149 VAL HB A 150 VAL HG11 1.0 . 4.23 326 216 A 150 VAL H A 149 VAL HG21 1.0 . 3.86 327 216 A 150 VAL H A 149 VAL HG11 1.0 . 3.86 328 217 A 151 LYS H A 150 VAL HG21 1.0 . 4.19 329 217 A 151 LYS H A 150 VAL HG11 1.0 . 4.19 330 218 A 153 VAL H A 152 GLU HGx 1.0 . 5.50 331 218 A 153 VAL H A 152 GLU HGy 1.0 . 5.50 332 219 A 40 ASN H A 38 LYS HGx 1.0 . 5.50 333 219 A 40 ASN H A 38 LYS HGy 1.0 . 5.50 334 220 A 41 LYS H A 39 LEU HBx 1.0 . 5.50 335 220 A 41 LYS H A 39 LEU HBy 1.0 . 5.50 336 221 A 42 LYS H A 40 ASN HBy 1.0 . 5.34 337 221 A 42 LYS H A 40 ASN HBx 1.0 . 5.34 338 222 A 41 LYS H A 43 VAL H 1.0 . 5.50 339 223 A 44 LEU H A 46 THR H 1.0 . 5.50 340 224 A 52 LYS H A 50 ALA H 1.0 . 5.50 341 225 A 53 ALA H A 51 SER HA 1.0 . 4.11 342 226 A 53 ALA H A 55 ASN H 1.0 . 5.50 343 227 A 55 ASN H A 53 ALA HB% 1.0 . 4.11 344 228 A 53 ALA HB% A 55 ASN HA 1.0 . 5.50 345 229 A 56 VAL H A 54 LYS HA 1.0 . 4.60 346 230 A 62 GLU H A 60 VAL HG11 1.0 . 4.50 347 230 A 62 GLU H A 60 VAL HG21 1.0 . 4.50 348 231 A 63 VAL H A 65 LYS H 1.0 . 4.75 349 232 A 64 VAL H A 66 ALA H 1.0 . 4.62 350 233 A 66 ALA H A 64 VAL HG11 1.0 . 5.04 351 233 A 66 ALA H A 64 VAL HG21 1.0 . 5.04 352 234 A 68 ARG H A 70 GLY H 1.0 . 4.38 353 235 A 70 GLY H A 68 ARG HA 1.0 . 5.50 354 236 A 71 GLU H A 69 LYS HBx 1.0 . 5.50 355 236 A 71 GLU H A 69 LYS HBy 1.0 . 5.50 356 237 A 71 GLU HBx A 73 GLY HAy 1.0 . 6.50 357 237 A 73 GLY HAx A 71 GLU HBy 1.0 . 6.50 358 237 A 73 GLY HAx A 71 GLU HBx 1.0 . 6.50 359 237 A 71 GLU HBy A 73 GLY HAy 1.0 . 6.50 360 238 A 73 GLY H A 71 GLU HBy 1.0 . 5.26 361 238 A 73 GLY H A 71 GLU HBx 1.0 . 5.26 362 239 A 74 LEU H A 72 LYS HA 1.0 . 5.50 363 240 A 80 ASP H A 78 ALA HA 1.0 . 5.50 364 241 A 80 ASP H A 78 ALA HB% 1.0 . 5.50 365 242 A 84 ALA HA A 86 VAL HG21 1.0 . 4.48 366 242 A 84 ALA HA A 86 VAL HG11 1.0 . 4.48 367 243 A 86 VAL H A 84 ALA HA 1.0 . 5.50 368 244 A 88 SER H A 86 VAL HG21 1.0 . 5.39 369 244 A 88 SER H A 86 VAL HG11 1.0 . 5.39 370 245 A 93 LEU H A 95 GLU H 1.0 . 5.10 371 246 A 94 CYS H A 96 ASP H 1.0 . 5.50 372 247 A 98 SER H A 96 ASP HBy 1.0 . 4.59 373 247 A 98 SER H A 96 ASP HBx 1.0 . 4.59 374 248 A 97 HIS H A 99 VAL HG21 1.0 . 5.50 375 248 A 97 HIS H A 99 VAL HG11 1.0 . 5.50 376 249 A 101 TYR H A 99 VAL HB 1.0 . 5.50 377 250 A 99 VAL HB A 101 TYR HBy 1.0 . 5.50 378 250 A 101 TYR HBx A 99 VAL HB 1.0 . 5.50 379 251 A 101 TYR HD% A 99 VAL HG21 1.0 . 4.40 380 251 A 99 VAL HG11 A 101 TYR HD% 1.0 . 4.40 381 252 A 110 LEU H A 112 ALA H 1.0 . 5.50 382 253 A 122 VAL H A 120 THR HG21 1.0 . 5.50 383 254 A 124 PHE HDx A 126 VAL HG21 1.0 . 4.40 384 254 A 124 PHE HDx A 126 VAL HG11 1.0 . 4.40 385 255 A 146 PHE H A 148 GLU H 1.0 . 4.30 386 256 A 153 VAL H A 151 LYS HA 1.0 . 5.50 387 257 A 153 VAL H A 155 ALA H 1.0 . 5.50 388 258 A 43 VAL H A 40 ASN HA 1.0 . 4.83 389 259 A 43 VAL HB A 40 ASN HA 1.0 . 4.25 390 260 A 40 ASN H A 43 VAL HG21 1.0 . 5.44 391 260 A 40 ASN H A 43 VAL HG11 1.0 . 5.44 392 261 A 40 ASN HA A 43 VAL HG21 1.0 . 3.90 393 261 A 43 VAL HG11 A 40 ASN HA 1.0 . 3.90 394 262 A 43 VAL HB A 40 ASN HBy 1.0 . 5.50 395 262 A 40 ASN HBx A 43 VAL HB 1.0 . 5.50 396 263 A 45 LYS H A 42 LYS HA 1.0 . 4.50 397 264 A 42 LYS HA A 45 LYS HBx 1.0 . 5.50 398 264 A 45 LYS HBy A 42 LYS HA 1.0 . 5.50 399 265 A 46 THR H A 43 VAL HA 1.0 . 4.50 400 266 A 47 VAL HB A 44 LEU HA 1.0 . 5.50 401 267 A 46 THR HG2% A 49 LYS HBx 1.0 . 4.12 402 267 A 49 LYS HBy A 46 THR HG2% 1.0 . 4.12 403 268 A 46 THR HA A 49 LYS HGx 1.0 . 4.65 404 268 A 46 THR HA A 49 LYS HGy 1.0 . 4.65 405 269 A 50 ALA H A 47 VAL HA 1.0 . 4.50 406 270 A 47 VAL HA A 50 ALA HA 1.0 . 5.50 407 271 A 52 LYS H A 49 LYS HA 1.0 . 4.50 408 272 A 49 LYS HA A 52 LYS HBx 1.0 . 5.50 409 272 A 52 LYS HBy A 49 LYS HA 1.0 . 5.50 410 273 A 53 ALA H A 50 ALA HA 1.0 . 4.35 411 274 A 53 ALA H A 50 ALA HB% 1.0 . 4.96 412 275 A 53 ALA HB% A 50 ALA HA 1.0 . 3.51 413 276 A 63 VAL HB A 60 VAL HA 1.0 . 5.50 414 277 A 65 LYS H A 62 GLU HA 1.0 . 4.21 415 278 A 62 GLU HA A 65 LYS HBx 1.0 . 5.50 416 278 A 65 LYS HBy A 62 GLU HA 1.0 . 5.50 417 279 A 62 GLU HA A 65 LYS HGy 1.0 . 5.50 418 279 A 62 GLU HA A 65 LYS HGx 1.0 . 5.50 419 280 A 66 ALA H A 63 VAL HG11 1.0 . 4.66 420 280 A 66 ALA H A 63 VAL HG21 1.0 . 4.66 421 281 A 67 LEU H A 64 VAL HA 1.0 . 4.55 422 282 A 64 VAL HA A 67 LEU HD11 1.0 . 4.21 423 282 A 64 VAL HA A 67 LEU HDy% 1.0 . 4.21 424 283 A 68 ARG H A 65 LYS HA 1.0 . 4.50 425 284 A 69 LYS H A 66 ALA HA 1.0 . 4.50 426 285 A 81 ILE H A 78 ALA HB% 1.0 . 5.50 427 286 A 88 SER H A 85 ASP HA 1.0 . 4.50 428 287 A 93 LEU HA A 96 ASP HBy 1.0 . 4.36 429 287 A 96 ASP HBx A 93 LEU HA 1.0 . 4.36 430 288 A 93 LEU HBx A 96 ASP HBy 1.0 . 5.31 431 288 A 93 LEU HBy A 96 ASP HBy 1.0 . 5.31 432 288 A 96 ASP HBx A 93 LEU HBy 1.0 . 5.31 433 288 A 93 LEU HBx A 96 ASP HBx 1.0 . 5.31 434 289 A 93 LEU HG A 96 ASP HBy 1.0 . 5.34 435 289 A 96 ASP HBx A 93 LEU HG 1.0 . 5.34 436 290 A 97 HIS H A 94 CYS HA 1.0 . 4.50 437 291 A 146 PHE HDx A 143 LYS HA 1.0 . 4.56 438 292 A 143 LYS HA A 146 PHE HBx 1.0 . 4.14 439 293 A 146 PHE HBy A 143 LYS HA 1.0 . 4.14 440 294 A 149 VAL H A 146 PHE HA 1.0 . 4.50 441 295 A 146 PHE H A 149 VAL HG21 1.0 . 5.50 442 295 A 146 PHE H A 149 VAL HG11 1.0 . 5.50 443 296 A 146 PHE HA A 149 VAL HG21 1.0 . 5.50 444 296 A 149 VAL HG11 A 146 PHE HA 1.0 . 5.50 445 297 A 149 VAL HB A 146 PHE HA 1.0 . 5.50 446 298 A 147 ASN HA A 150 VAL HG21 1.0 . 4.07 447 298 A 150 VAL HG11 A 147 ASN HA 1.0 . 4.07 448 299 A 147 ASN HA A 150 VAL HB 1.0 . 5.50 449 300 A 150 VAL HA A 153 VAL HB 1.0 . 5.50 450 301 A 150 VAL HA A 153 VAL HG21 1.0 . 5.50 451 301 A 150 VAL HA A 153 VAL HG11 1.0 . 5.50 452 302 A 156 LEU H A 153 VAL HA 1.0 . 4.19 453 303 A 153 VAL HA A 156 LEU HG 1.0 . 3.99 454 304 A 153 VAL HA A 156 LEU HD11 1.0 . 4.12 455 304 A 153 VAL HA A 156 LEU HD21 1.0 . 4.12 456 305 A 46 THR HA A 50 ALA HB% 1.0 . 5.50 457 306 A 54 LYS H A 50 ALA HB% 1.0 . 5.33 458 307 A 55 ASN H A 51 SER HA 1.0 . 5.50 459 308 A 68 ARG H A 64 VAL HA 1.0 . 4.64 460 309 A 69 LYS H A 65 LYS HA 1.0 . 5.50 461 310 A 146 PHE HBx A 150 VAL HG21 1.0 . 4.43 462 310 A 150 VAL HG11 A 146 PHE HBx 1.0 . 4.43 463 310 A 146 PHE HBy A 150 VAL HG11 1.0 . 4.43 464 310 A 146 PHE HBy A 150 VAL HG21 1.0 . 4.43 465 311 A 146 PHE HDx A 150 VAL HG21 1.0 . 4.37 466 311 A 146 PHE HDx A 150 VAL HG11 1.0 . 4.37 467 312 A 55 ASN H A 50 ALA HA 1.0 . 4.76 468 313 A 50 ALA HA A 55 ASN HBy 1.0 . 4.83 469 313 A 50 ALA HA A 55 ASN HBx 1.0 . 4.83 470 314 A 55 ASN HBx A 50 ALA HB% 1.0 . 4.33 471 314 A 50 ALA HB% A 55 ASN HBy 1.0 . 4.33 472 315 A 55 ASN H A 50 ALA HB% 1.0 . 3.91 473 316 A 55 ASN HA A 50 ALA HB% 1.0 . 5.24 474 317 A 56 VAL H A 51 SER HA 1.0 . 5.03 475 318 A 51 SER HBy A 56 VAL HG11 1.0 . 3.29 476 318 A 51 SER HBx A 56 VAL HG11 1.0 . 3.29 477 318 A 56 VAL HG21 A 51 SER HBy 1.0 . 3.29 478 318 A 51 SER HBx A 56 VAL HG21 1.0 . 3.29 479 319 A 51 SER HA A 56 VAL HG11 1.0 . 4.11 480 319 A 51 SER HA A 56 VAL HG21 1.0 . 4.11 481 320 A 51 SER H A 56 VAL HG11 1.0 . 4.53 482 320 A 51 SER H A 56 VAL HG21 1.0 . 4.53 483 321 A 56 VAL HB A 51 SER HA 1.0 . 5.35 484 322 A 51 SER H A 56 VAL HB 1.0 . 5.50 485 323 A 71 GLU H A 66 ALA HA 1.0 . 4.60 486 324 A 94 CYS HA A 99 VAL HB 1.0 . 4.05 487 325 A 99 VAL HB A 94 CYS HBx 1.0 . 5.50 488 325 A 94 CYS HBy A 99 VAL HB 1.0 . 5.50 489 326 A 94 CYS HA A 99 VAL HG21 1.0 . 4.24 490 326 A 94 CYS HA A 99 VAL HG11 1.0 . 4.24 491 327 A 94 CYS HBy A 99 VAL HG21 1.0 . 4.86 492 327 A 99 VAL HG11 A 94 CYS HBx 1.0 . 4.86 493 327 A 94 CYS HBy A 99 VAL HG11 1.0 . 4.86 494 327 A 94 CYS HBx A 99 VAL HG21 1.0 . 4.86 495 328 A 116 THR HG2% A 111 GLY HAy 1.0 . 3.88 496 328 A 111 GLY HAx A 116 THR HG2% 1.0 . 3.88 497 329 A 93 LEU HG A 99 VAL HG21 1.0 . 3.81 498 329 A 93 LEU HG A 99 VAL HG11 1.0 . 3.81 499 330 A 99 VAL HA A 93 LEU HD11 1.0 . 4.41 500 330 A 93 LEU HD21 A 99 VAL HA 1.0 . 4.41 501 331 A 99 VAL HB A 93 LEU HD11 1.0 . 4.50 502 331 A 93 LEU HD21 A 99 VAL HB 1.0 . 4.50 503 332 A 93 LEU HD21 A 99 VAL HG21 1.0 . 3.39 504 332 A 99 VAL HG11 A 93 LEU HD11 1.0 . 3.39 505 332 A 93 LEU HD21 A 99 VAL HG11 1.0 . 3.39 506 332 A 93 LEU HD11 A 99 VAL HG21 1.0 . 3.39 507 333 A 73 GLY HAx A 66 ALA HB% 1.0 . 5.50 508 334 A 66 ALA HB% A 73 GLY HAy 1.0 . 5.50 509 335 A 101 TYR H A 93 LEU HD11 1.0 . 5.44 510 335 A 101 TYR H A 93 LEU HD21 1.0 . 5.44 511 336 A 101 TYR HA A 93 LEU HD11 1.0 . 5.22 512 336 A 101 TYR HA A 93 LEU HD21 1.0 . 5.22 513 337 A 93 LEU HD11 A 101 TYR HBy 1.0 . 4.51 514 337 A 93 LEU HD21 A 101 TYR HBy 1.0 . 4.51 515 337 A 101 TYR HBx A 93 LEU HD11 1.0 . 4.51 516 337 A 101 TYR HBx A 93 LEU HD21 1.0 . 4.51 517 338 A 101 TYR HD% A 93 LEU HD11 1.0 . 5.18 518 338 A 93 LEU HD21 A 101 TYR HD% 1.0 . 5.18 519 339 A 121 SER H A 110 LEU HD11 1.0 . 5.20 520 340 A 133 LYS HA A 143 LYS HBx 1.0 . 5.19 521 340 A 133 LYS HA A 143 LYS HBy 1.0 . 5.19 522 341 A 77 ILE HD11 A 101 TYR HD% 1.0 . 4.37 523 342 A 77 ILE HD11 A 101 TYR HE% 1.0 . 4.75 524 343 A 101 TYR HA A 77 ILE HD11 1.0 . 5.50 525 344 A 77 ILE HG1y A 101 TYR HBy 1.0 . 5.18 526 344 A 77 ILE HG1x A 101 TYR HBy 1.0 . 5.18 527 344 A 101 TYR HBx A 77 ILE HG1y 1.0 . 5.18 528 344 A 101 TYR HBx A 77 ILE HG1x 1.0 . 5.18 529 345 A 77 ILE HD11 A 101 TYR HBy 1.0 . 5.00 530 345 A 101 TYR HBx A 77 ILE HD11 1.0 . 5.00 531 346 A 103 PHE HDx A 79 GLY HAy 1.0 . 4.05 532 346 A 79 GLY HAx A 103 PHE HDx 1.0 . 4.05 533 347 A 146 PHE HDx A 125 ILE HB 1.0 . 5.50 534 348 A 75 VAL H A 100 PRO HBx 1.0 . 5.23 535 348 A 75 VAL H A 100 PRO HBy 1.0 . 5.23 536 349 A 75 VAL H A 100 PRO HGx 1.0 . 5.50 537 349 A 75 VAL H A 100 PRO HGy 1.0 . 5.50 538 350 A 76 VAL H A 101 TYR HD% 1.0 . 5.50 539 351 A 76 VAL HA A 101 TYR HA 1.0 . 5.50 540 352 A 77 ILE H A 102 ILE H 1.0 . 4.87 541 353 A 79 GLY H A 104 ILE H 1.0 . 4.38 542 354 A 79 GLY H A 104 ILE HG1x 1.0 . 4.15 543 354 A 79 GLY H A 104 ILE HG1y 1.0 . 4.15 544 355 A 74 LEU HA A 100 PRO HBx 1.0 . 4.72 545 355 A 74 LEU HA A 100 PRO HBy 1.0 . 4.72 546 356 A 74 LEU HD21 A 100 PRO HBx 1.0 . 4.27 547 356 A 74 LEU HD11 A 100 PRO HBx 1.0 . 4.27 548 356 A 100 PRO HBy A 74 LEU HD11 1.0 . 4.27 549 356 A 100 PRO HBy A 74 LEU HD21 1.0 . 4.27 550 357 A 74 LEU HD21 A 100 PRO HGx 1.0 . 4.02 551 357 A 74 LEU HD11 A 100 PRO HGx 1.0 . 4.02 552 357 A 100 PRO HGy A 74 LEU HD11 1.0 . 4.02 553 357 A 74 LEU HD21 A 100 PRO HGy 1.0 . 4.02 554 358 A 101 TYR HA A 75 VAL HG21 1.0 . 5.46 555 358 A 101 TYR HA A 75 VAL HG11 1.0 . 5.46 556 359 A 75 VAL HB A 101 TYR HBy 1.0 . 5.34 557 359 A 75 VAL HB A 101 TYR HBx 1.0 . 5.34 558 360 A 75 VAL H A 101 TYR HA 1.0 . 4.44 559 361 A 75 VAL H A 101 TYR HD% 1.0 . 5.50 560 362 A 75 VAL H A 101 TYR HE% 1.0 . 5.50 561 363 A 75 VAL HA A 101 TYR HA 1.0 . 5.33 562 364 A 101 TYR HA A 75 VAL HB 1.0 . 4.61 563 365 A 101 TYR H A 75 VAL HG21 1.0 . 5.44 564 365 A 101 TYR H A 75 VAL HG11 1.0 . 5.44 565 366 A 75 VAL HG11 A 101 TYR HBy 1.0 . 5.44 566 366 A 75 VAL HG21 A 101 TYR HBy 1.0 . 5.44 567 367 A 101 TYR HBx A 75 VAL HG21 1.0 . 4.81 568 367 A 101 TYR HBx A 75 VAL HG11 1.0 . 4.81 569 368 A 101 TYR HE% A 75 VAL HG21 1.0 . 4.76 570 368 A 75 VAL HG11 A 101 TYR HE% 1.0 . 4.76 571 369 A 101 TYR H A 75 VAL HB 1.0 . 5.50 572 370 A 75 VAL H A 101 TYR HBy 1.0 . 5.34 573 370 A 75 VAL H A 101 TYR HBx 1.0 . 5.34 574 371 A 101 TYR HD% A 75 VAL HG21 1.0 . 4.38 575 371 A 75 VAL HG11 A 101 TYR HD% 1.0 . 4.38 576 372 A 76 VAL HA A 102 ILE H 1.0 . 4.33 577 373 A 77 ILE H A 103 PHE HA 1.0 . 3.78 578 374 A 78 ALA HA A 104 ILE H 1.0 . 3.83 579 375 A 78 ALA HB% A 104 ILE HG1x 1.0 . 4.18 580 375 A 104 ILE HG1y A 78 ALA HB% 1.0 . 4.18 581 376 A 79 GLY H A 105 PRO HA 1.0 . 4.71 582 377 A 101 TYR H A 74 LEU HD11 1.0 . 4.75 583 377 A 101 TYR H A 74 LEU HD21 1.0 . 4.75 584 378 A 101 TYR HA A 74 LEU HD11 1.0 . 4.81 585 378 A 101 TYR HA A 74 LEU HD21 1.0 . 4.81 586 379 A 102 ILE H A 75 VAL HB 1.0 . 4.67 587 380 A 77 ILE H A 104 ILE H 1.0 . 4.57 588 381 A 106 SER H A 78 ALA HB% 1.0 . 4.25 589 382 A 78 ALA H A 110 LEU HD11 1.0 . 4.38 590 383 A 78 ALA H A 110 LEU HD21 1.0 . 4.38 591 384 A 78 ALA HB% A 110 LEU HD11 1.0 . 3.90 592 385 A 78 ALA HB% A 110 LEU HD21 1.0 . 3.90 593 386 A 81 ILE HB A 121 SER HBx 1.0 . 4.18 594 386 A 121 SER HBy A 81 ILE HB 1.0 . 4.18 595 387 A 121 SER H A 81 ILE HG2% 1.0 . 4.72 596 388 A 81 ILE HG2% A 121 SER HBx 1.0 . 3.72 597 388 A 121 SER HBy A 81 ILE HG2% 1.0 . 3.72 598 389 A 121 SER HA A 81 ILE HB 1.0 . 4.69 599 390 A 121 SER HA A 81 ILE HG1x 1.0 . 5.22 600 390 A 81 ILE HG1y A 121 SER HA 1.0 . 5.22 601 391 A 121 SER HA A 81 ILE HG2% 1.0 . 4.28 602 392 A 82 TRP H A 121 SER HBx 1.0 . 4.70 603 392 A 121 SER HBy A 82 TRP H 1.0 . 4.70 604 393 A 78 ALA H A 121 SER HA 1.0 . 4.24 605 394 A 121 SER HA A 78 ALA HB% 1.0 . 3.58 606 395 A 78 ALA H A 122 VAL HA 1.0 . 4.46 607 396 A 77 ILE HD11 A 121 SER HBx 1.0 . 5.50 608 396 A 121 SER HBy A 77 ILE HD11 1.0 . 5.50 609 397 A 77 ILE HD11 A 122 VAL HB 1.0 . 5.50 610 398 A 77 ILE HD11 A 122 VAL HG21 1.0 . 4.15 611 398 A 77 ILE HD11 A 122 VAL HG11 1.0 . 4.15 612 399 A 122 VAL H A 77 ILE HD11 1.0 . 5.50 613 400 A 76 VAL H A 123 VAL H 1.0 . 4.02 614 401 A 123 VAL H A 76 VAL HB 1.0 . 5.50 615 402 A 123 VAL H A 75 VAL HG21 1.0 . 4.31 616 402 A 123 VAL H A 75 VAL HG11 1.0 . 4.31 617 403 A 76 VAL H A 124 PHE HA 1.0 . 4.72 618 404 A 124 PHE HA A 76 VAL HB 1.0 . 5.50 619 405 A 124 PHE HA A 76 VAL HG21 1.0 . 5.22 620 405 A 124 PHE HA A 76 VAL HG11 1.0 . 5.22 621 406 A 76 VAL H A 124 PHE HA 1.0 . 5.50 622 407 A 102 ILE HB A 150 VAL HG21 1.0 . 4.56 623 407 A 102 ILE HB A 150 VAL HG11 1.0 . 4.56 624 408 A 102 ILE H A 150 VAL HG21 1.0 . 4.83 625 408 A 102 ILE H A 150 VAL HG11 1.0 . 4.83 626 409 A 75 VAL HA A 124 PHE HA 1.0 . 4.06 627 410 A 124 PHE HA A 75 VAL HG21 1.0 . 5.04 628 411 A 124 PHE HA A 75 VAL HG11 1.0 . 5.04 629 412 A 75 VAL HG21 A 124 PHE HBx 1.0 . 4.85 630 412 A 75 VAL HG11 A 124 PHE HBx 1.0 . 4.85 631 412 A 124 PHE HBy A 75 VAL HG21 1.0 . 4.85 632 412 A 75 VAL HG11 A 124 PHE HBy 1.0 . 4.85 633 413 A 101 TYR H A 150 VAL HG21 1.0 . 4.93 634 413 A 101 TYR H A 150 VAL HG11 1.0 . 4.93 635 414 A 101 TYR HA A 150 VAL HG21 1.0 . 5.34 636 414 A 101 TYR HA A 150 VAL HG11 1.0 . 5.34 637 415 A 74 LEU H A 124 PHE HDx 1.0 . 4.98 638 416 A 124 PHE HA A 74 LEU HBy 1.0 . 5.50 639 417 A 124 PHE HA A 74 LEU HBx 1.0 . 5.50 640 418 A 75 VAL HA A 125 ILE H 1.0 . 4.44 641 419 A 75 VAL H A 125 ILE HB 1.0 . 5.50 642 420 A 75 VAL HA A 125 ILE HD11 1.0 . 4.92 643 421 A 100 PRO HA A 150 VAL HG21 1.0 . 4.29 644 421 A 100 PRO HA A 150 VAL HG11 1.0 . 4.29 645 422 A 100 PRO HBy A 150 VAL HG21 1.0 . 4.43 646 422 A 150 VAL HG11 A 100 PRO HBx 1.0 . 4.43 647 422 A 100 PRO HBy A 150 VAL HG11 1.0 . 4.43 648 422 A 100 PRO HBx A 150 VAL HG21 1.0 . 4.43 649 423 A 73 GLY H A 124 PHE HDx 1.0 . 5.24 650 424 A 124 PHE HDx A 73 GLY HAy 1.0 . 4.54 651 425 A 73 GLY HAx A 124 PHE HDx 1.0 . 5.18 652 426 A 74 LEU H A 125 ILE HB 1.0 . 5.01 653 427 A 74 LEU H A 125 ILE HD11 1.0 . 5.04 654 428 A 74 LEU HA A 125 ILE HB 1.0 . 4.40 655 429 A 125 ILE HB A 74 LEU HBy 1.0 . 5.50 656 430 A 74 LEU HBx A 125 ILE HB 1.0 . 5.50 657 431 A 125 ILE HB A 74 LEU HD11 1.0 . 4.71 658 432 A 74 LEU HD21 A 125 ILE HB 1.0 . 4.71 659 433 A 74 LEU H A 125 ILE H 1.0 . 4.35 660 434 A 125 ILE H A 74 LEU HBy 1.0 . 4.39 661 434 A 125 ILE H A 74 LEU HBx 1.0 . 4.39 662 435 A 125 ILE HD11 A 74 LEU HBy 1.0 . 4.59 663 435 A 74 LEU HBx A 125 ILE HD11 1.0 . 4.59 664 436 A 74 LEU H A 125 ILE HG2% 1.0 . 4.95 665 437 A 73 GLY H A 125 ILE HB 1.0 . 5.50 666 438 A 125 ILE HB A 73 GLY HAy 1.0 . 5.34 667 438 A 73 GLY HAx A 125 ILE HB 1.0 . 5.34 668 439 A 125 ILE HD11 A 73 GLY HAy 1.0 . 5.50 669 439 A 73 GLY HAx A 125 ILE HD11 1.0 . 5.50 670 440 A 125 ILE HG2% A 73 GLY HAy 1.0 . 5.11 671 440 A 73 GLY HAx A 125 ILE HG2% 1.0 . 5.11 672 441 A 74 LEU H A 126 VAL HG21 1.0 . 5.50 673 441 A 74 LEU H A 126 VAL HG11 1.0 . 5.50 674 442 A 74 LEU H A 126 VAL HA 1.0 . 5.04 675 443 A 73 GLY H A 126 VAL HA 1.0 . 4.31 676 444 A 126 VAL HA A 73 GLY HAy 1.0 . 4.00 677 444 A 73 GLY HAx A 126 VAL HA 1.0 . 4.00 678 445 A 126 VAL HB A 73 GLY HAy 1.0 . 5.34 679 445 A 73 GLY HAx A 126 VAL HB 1.0 . 5.34 680 446 A 73 GLY HAx A 126 VAL HG21 1.0 . 6.09 681 446 A 73 GLY HAy A 126 VAL HG21 1.0 . 6.09 682 446 A 126 VAL HG11 A 73 GLY HAy 1.0 . 6.09 683 446 A 73 GLY HAx A 126 VAL HG11 1.0 . 6.09 684 447 A 101 TYR H A 154 GLN HGy 1.0 . 4.35 685 447 A 101 TYR H A 154 GLN HGx 1.0 . 4.35 686 448 A 126 VAL HA A 72 LYS HA 1.0 . 4.07 687 449 A 72 LYS HBy A 126 VAL HG21 1.0 . 4.84 688 449 A 72 LYS HBx A 126 VAL HG21 1.0 . 4.84 689 449 A 126 VAL HG11 A 72 LYS HBy 1.0 . 4.84 690 449 A 72 LYS HBx A 126 VAL HG11 1.0 . 4.84 691 450 A 72 LYS HGx A 126 VAL HG21 1.0 . 4.55 692 450 A 72 LYS HGy A 126 VAL HG21 1.0 . 4.55 693 450 A 126 VAL HG11 A 72 LYS HGx 1.0 . 4.55 694 450 A 72 LYS HGy A 126 VAL HG11 1.0 . 4.55 695 451 A 56 VAL HG21 A 113 ALA HB% 1.0 . 3.40 696 451 A 113 ALA HB% A 56 VAL HG11 1.0 . 3.40 697 452 A 56 VAL HG11 A 114 GLY HAx 1.0 . 4.88 698 452 A 56 VAL HG21 A 114 GLY HAx 1.0 . 4.88 699 452 A 114 GLY HAy A 56 VAL HG11 1.0 . 4.88 700 452 A 56 VAL HG21 A 114 GLY HAy 1.0 . 4.88 701 453 A 66 ALA HB% A 126 VAL HG21 1.0 . 4.54 702 453 A 66 ALA HB% A 126 VAL HG11 1.0 . 4.54 703 454 A 122 VAL HB A 60 VAL HA 1.0 . 3.76 704 455 A 122 VAL HB A 60 VAL HB 1.0 . 5.50 705 456 A 59 GLY H A 123 VAL HG21 1.0 . 4.60 706 456 A 59 GLY H A 123 VAL HG11 1.0 . 4.60 707 457 A 59 GLY H A 123 VAL HB 1.0 . 5.50 708 458 A 123 VAL HA A 58 ARG HBy 1.0 . 4.79 709 458 A 123 VAL HA A 58 ARG HBx 1.0 . 4.79 710 459 A 58 ARG HA A 123 VAL HG21 1.0 . 3.58 711 459 A 58 ARG HA A 123 VAL HG11 1.0 . 3.58 712 460 A 58 ARG H A 123 VAL HA 1.0 . 4.56 713 461 A 123 VAL HA A 58 ARG HGy 1.0 . 4.70 714 461 A 123 VAL HA A 58 ARG HGx 1.0 . 4.70 715 462 A 58 ARG HGx A 123 VAL HG21 1.0 . 3.23 716 462 A 58 ARG HGy A 123 VAL HG21 1.0 . 3.23 717 462 A 123 VAL HG11 A 58 ARG HGy 1.0 . 3.23 718 462 A 123 VAL HG11 A 58 ARG HGx 1.0 . 3.23 719 463 A 58 ARG HDx A 123 VAL HG21 1.0 . 3.81 720 463 A 58 ARG HDy A 123 VAL HG21 1.0 . 3.81 721 463 A 123 VAL HG11 A 58 ARG HDx 1.0 . 3.81 722 463 A 123 VAL HG11 A 58 ARG HDy 1.0 . 3.81 723 464 A 113 ALA HA A 48 LYS HBx 1.0 . 4.74 724 464 A 48 LYS HBy A 113 ALA HA 1.0 . 4.74 725 465 A 48 LYS HA A 113 ALA HB% 1.0 . 4.30 726 466 A 48 LYS H A 113 ALA HB% 1.0 . 3.97 727 467 A 113 ALA H A 48 LYS HGx 1.0 . 5.16 728 467 A 48 LYS HGy A 113 ALA H 1.0 . 5.16 729 468 A 113 ALA HA A 48 LYS HGx 1.0 . 4.42 730 468 A 113 ALA HA A 48 LYS HGy 1.0 . 4.42 731 469 A 59 GLY H A 124 PHE H 1.0 . 5.50 732 470 A 113 ALA H A 47 VAL HG21 1.0 . 4.95 733 470 A 47 VAL HG11 A 113 ALA H 1.0 . 4.95 734 471 A 47 VAL HB A 113 ALA HB% 1.0 . 3.88 735 472 A 113 ALA HB% A 47 VAL HG21 1.0 . 3.70 736 473 A 47 VAL HG11 A 113 ALA HB% 1.0 . 3.67 737 474 A 113 ALA HA A 47 VAL HG21 1.0 . 3.90 738 474 A 47 VAL HG11 A 113 ALA HA 1.0 . 3.90 739 475 A 58 ARG HA A 124 PHE H 1.0 . 4.95 740 476 A 124 PHE H A 58 ARG HGy 1.0 . 5.34 741 476 A 124 PHE H A 58 ARG HGx 1.0 . 5.34 742 477 A 57 LYS H A 124 PHE H 1.0 . 3.97 743 478 A 56 VAL HA A 125 ILE HA 1.0 . 4.19 744 479 A 56 VAL HB A 125 ILE HB 1.0 . 5.29 745 480 A 125 ILE HD11 A 56 VAL HG11 1.0 . 3.79 746 480 A 56 VAL HG21 A 125 ILE HD11 1.0 . 3.79 747 481 A 57 LYS HDx A 126 VAL HG21 1.0 . 5.35 748 481 A 57 LYS HDy A 126 VAL HG21 1.0 . 5.35 749 481 A 126 VAL HG11 A 57 LYS HDx 1.0 . 5.35 750 481 A 126 VAL HG11 A 57 LYS HDy 1.0 . 5.35 751 482 A 56 VAL HA A 126 VAL H 1.0 . 4.67 752 483 A 126 VAL H A 55 ASN HBy 1.0 . 4.38 753 483 A 126 VAL H A 55 ASN HBx 1.0 . 4.38 754 484 A 55 ASN HA A 126 VAL HG21 1.0 . 5.50 755 485 A 55 ASN HA A 126 VAL HG11 1.0 . 5.50 756 486 A 55 ASN HA A 126 VAL HB 1.0 . 5.50 757 487 A 126 VAL HA A 55 ASN HBy 1.0 . 5.24 758 487 A 126 VAL HA A 55 ASN HBx 1.0 . 5.24 759 488 A 55 ASN HBx A 126 VAL HG21 1.0 . 4.24 760 488 A 55 ASN HBy A 126 VAL HG21 1.0 . 4.24 761 488 A 126 VAL HG11 A 55 ASN HBy 1.0 . 4.24 762 488 A 126 VAL HG11 A 55 ASN HBx 1.0 . 4.24 763 489 A 127 PRO HA A 55 ASN HBy 1.0 . 4.77 764 489 A 55 ASN HBx A 127 PRO HA 1.0 . 4.77 765 490 A 146 PHE HDx A 74 LEU HBy 1.0 . 5.50 766 491 A 74 LEU HBx A 146 PHE HDx 1.0 . 5.50 767 492 A 74 LEU HD21 A 146 PHE HDx 1.0 . 5.50 768 493 A 146 PHE HDx A 74 LEU HD11 1.0 . 5.50 769 494 A 128 GLY H A 55 ASN HBy 1.0 . 4.15 770 494 A 55 ASN HBx A 128 GLY H 1.0 . 4.15 771 495 A 47 VAL HA A 125 ILE HG1y 1.0 . 4.18 772 495 A 47 VAL HA A 125 ILE HG1x 1.0 . 4.18 773 496 A 47 VAL HA A 125 ILE HD11 1.0 . 5.00 774 497 A 125 ILE HD11 A 47 VAL HG21 1.0 . 3.72 775 497 A 47 VAL HG11 A 125 ILE HD11 1.0 . 3.72 776 498 A 50 ALA H A 138 LYS HGx 1.0 . 5.29 777 498 A 50 ALA H A 138 LYS HGy 1.0 . 5.29 778 499 A 50 ALA HB% A 138 LYS HGx 1.0 . 4.49 779 499 A 138 LYS HGy A 50 ALA HB% 1.0 . 4.49 780 500 A 50 ALA H A 142 TYR HD% 1.0 . 4.05 781 501 A 49 LYS H A 142 TYR HD% 1.0 . 5.26 782 502 A 49 LYS HBy A 142 TYR HBy 1.0 . 5.29 783 502 A 49 LYS HBx A 142 TYR HBy 1.0 . 5.29 784 502 A 142 TYR HBx A 49 LYS HBx 1.0 . 5.29 785 502 A 49 LYS HBy A 142 TYR HBx 1.0 . 5.29 786 503 A 46 THR HA A 142 TYR HBy 1.0 . 5.34 787 503 A 46 THR HA A 142 TYR HBx 1.0 . 5.34 788 504 A 46 THR HG2% A 142 TYR HBy 1.0 . 4.43 789 504 A 46 THR HG2% A 142 TYR HBx 1.0 . 4.43 790 505 A 46 THR HG2% A 143 LYS HA 1.0 . 4.02 791 506 A 46 THR H A 146 PHE HDx 1.0 . 5.42 792 506 A 46 THR H A 146 PHE HDy 1.0 . 5.42 793 507 A 46 THR HG2% A 146 PHE HA 1.0 . 3.88 794 508 A 46 THR HG2% A 146 PHE HBx 1.0 . 4.58 795 509 A 146 PHE HBy A 46 THR HG2% 1.0 . 4.58 796 510 A 46 THR HG2% A 146 PHE HDx 1.0 . 3.72 797 511 A 75 VAL H A 102 ILE H 1.0 . 5.00 798 512 A 77 ILE HA A 122 VAL HA 1.0 . 4.00 799 513 A 57 LYS H A 125 ILE HA 1.0 . 5.00 800 514 A 59 GLY H A 123 VAL HA 1.0 . 5.00 801 515 A 56 VAL HA A 126 VAL H 1.0 . 5.00 802 516 A 125 ILE H A 76 VAL HG11 1.0 . 5.50 803 517 A 104 ILE HD11 A 40 ASN HBy 1.0 . 5.50 804 517 A 40 ASN HBx A 104 ILE HD11 1.0 . 5.50 805 518 A 43 VAL HB A 104 ILE HD11 1.0 . 5.50 806 519 A 43 VAL HB A 149 VAL HG21 1.0 . 5.50 807 520 A 43 VAL H A 149 VAL HG21 1.0 . 5.50 808 520 A 43 VAL H A 149 VAL HG11 1.0 . 5.50 809 521 A 46 THR HG2% A 149 VAL HG21 1.0 . 5.50 810 521 A 46 THR HG2% A 149 VAL HG11 1.0 . 5.50 811 522 A 125 ILE HG2% A 50 ALA HB% 1.0 . 5.50 812 523 A 113 ALA HB% A 48 LYS HBx 1.0 . 5.50 813 523 A 48 LYS HBy A 113 ALA HB% 1.0 . 5.50 814 524 A 66 ALA HB% A 124 PHE HBx 1.0 . 5.50 815 524 A 66 ALA HB% A 124 PHE HBy 1.0 . 5.50 816 525 A 78 ALA H A 121 SER HBx 1.0 . 5.50 817 525 A 78 ALA H A 121 SER HBy 1.0 . 5.50 818 526 A 100 PRO HA A 153 VAL HG21 1.0 . 5.50 819 527 A 101 TYR H A 153 VAL HG11 1.0 . 5.50 820 528 A 102 ILE H A 153 VAL HG21 1.0 . 5.50 821 529 A 102 ILE HB A 153 VAL HG21 1.0 . 5.50 822 530 A 102 ILE HD11 A 153 VAL HG21 1.0 . 5.50 823 531 A 122 VAL H A 110 LEU HD11 1.0 . 5.50 824 531 A 122 VAL H A 110 LEU HD21 1.0 . 5.50 825 532 A 122 VAL HA A 110 LEU HD11 1.0 . 5.50 826 532 A 122 VAL HA A 110 LEU HD21 1.0 . 5.50 827 533 A 111 GLY H A 120 THR H 1.0 . 5.50 828 534 A 102 ILE HD11 A 74 LEU HD11 1.0 . 5.50 829 535 A 74 LEU HD11 A 102 ILE HG1x 1.0 . 5.50 830 535 A 102 ILE HG1y A 74 LEU HD11 1.0 . 5.50 831 536 A 58 ARG H A 120 THR HG21 1.0 . 5.50 832 537 A 58 ARG HA A 120 THR HG21 1.0 . 5.50 833 538 A 120 THR HG21 A 58 ARG HBy 1.0 . 5.50 834 538 A 58 ARG HBx A 120 THR HG21 1.0 . 5.50 835 539 A 59 GLY H A 120 THR HG21 1.0 . 5.50 836 540 A 37 LYS H A 37 LYS HA 1.0 . 5.50 837 541 A 37 LYS H A 37 LYS HBx 1.0 . 5.50 838 541 A 37 LYS H A 37 LYS HBy 1.0 . 5.50 839 542 A 38 LYS H A 38 LYS HBx 1.0 . 3.54 840 542 A 38 LYS H A 38 LYS HBy 1.0 . 3.54 841 543 A 38 LYS HA A 38 LYS HGx 1.0 . 3.97 842 543 A 38 LYS HA A 38 LYS HGy 1.0 . 3.97 843 544 A 38 LYS H A 38 LYS HA 1.0 . 5.50 844 545 A 39 LEU H A 39 LEU HBx 1.0 . 3.69 845 545 A 39 LEU H A 39 LEU HBy 1.0 . 3.69 846 546 A 39 LEU H A 39 LEU HD11 1.0 . 4.97 847 547 A 39 LEU H A 39 LEU HD21 1.0 . 4.97 848 548 A 39 LEU HG A 39 LEU HA 1.0 . 3.05 849 549 A 39 LEU HA A 39 LEU HD11 1.0 . 3.25 850 549 A 39 LEU HA A 39 LEU HD21 1.0 . 3.25 851 550 A 39 LEU H A 39 LEU HG 1.0 . 5.50 852 551 A 39 LEU HBy A 39 LEU HD11 1.0 . 5.50 853 551 A 39 LEU HBx A 39 LEU HD11 1.0 . 5.50 854 551 A 39 LEU HD21 A 39 LEU HBx 1.0 . 5.50 855 551 A 39 LEU HBy A 39 LEU HD21 1.0 . 5.50 856 552 A 40 ASN H A 40 ASN HBy 1.0 . 5.50 857 552 A 40 ASN H A 40 ASN HBx 1.0 . 5.50 858 553 A 40 ASN HBy A 40 ASN HD2y 1.0 . 5.50 859 553 A 40 ASN HBx A 40 ASN HD2y 1.0 . 5.50 860 553 A 40 ASN HD2x A 40 ASN HBy 1.0 . 5.50 861 553 A 40 ASN HBx A 40 ASN HD2x 1.0 . 5.50 862 554 A 41 LYS H A 41 LYS HBx 1.0 . 3.44 863 554 A 41 LYS H A 41 LYS HBy 1.0 . 3.44 864 555 A 41 LYS H A 41 LYS HA 1.0 . 4.00 865 556 A 41 LYS H A 41 LYS HGx 1.0 . 5.50 866 556 A 41 LYS H A 41 LYS HGy 1.0 . 5.50 867 557 A 42 LYS H A 42 LYS HA 1.0 . 4.20 868 558 A 42 LYS HA A 42 LYS HGx 1.0 . 4.23 869 558 A 42 LYS HA A 42 LYS HGy 1.0 . 4.23 870 559 A 42 LYS H A 42 LYS HBx 1.0 . 3.86 871 559 A 42 LYS H A 42 LYS HBy 1.0 . 3.86 872 560 A 42 LYS HA A 42 LYS HBx 1.0 . 5.50 873 560 A 42 LYS HBy A 42 LYS HA 1.0 . 5.50 874 561 A 42 LYS H A 42 LYS HGx 1.0 . 5.50 875 561 A 42 LYS H A 42 LYS HGy 1.0 . 5.50 876 562 A 43 VAL H A 43 VAL HA 1.0 . 5.20 877 563 A 43 VAL H A 43 VAL HB 1.0 . 3.97 878 564 A 43 VAL HA A 43 VAL HG21 1.0 . 3.80 879 565 A 43 VAL HA A 43 VAL HG11 1.0 . 3.80 880 566 A 43 VAL H A 43 VAL HG21 1.0 . 3.72 881 566 A 43 VAL H A 43 VAL HG11 1.0 . 3.72 882 567 A 43 VAL HB A 43 VAL HG21 1.0 . 5.50 883 567 A 43 VAL HB A 43 VAL HG11 1.0 . 5.50 884 568 A 44 LEU H A 44 LEU HD11 1.0 . 5.50 885 569 A 44 LEU H A 44 LEU HD21 1.0 . 5.50 886 570 A 45 LYS H A 45 LYS HA 1.0 . 3.50 887 571 A 45 LYS H A 45 LYS HBx 1.0 . 3.28 888 571 A 45 LYS H A 45 LYS HBy 1.0 . 3.28 889 572 A 45 LYS H A 45 LYS HGy 1.0 . 3.88 890 572 A 45 LYS H A 45 LYS HGx 1.0 . 3.88 891 573 A 46 THR HA A 46 THR HG2% 1.0 . 3.70 892 574 A 46 THR H A 46 THR HA 1.0 . 4.00 893 575 A 46 THR H A 46 THR HG2% 1.0 . 4.91 894 576 A 46 THR H A 46 THR HB 1.0 . 5.50 895 577 A 47 VAL H A 47 VAL HG21 1.0 . 3.52 896 577 A 47 VAL H A 47 VAL HG11 1.0 . 3.52 897 578 A 47 VAL H A 47 VAL HB 1.0 . 3.96 898 579 A 47 VAL HA A 47 VAL HG21 1.0 . 2.77 899 579 A 47 VAL HA A 47 VAL HG11 1.0 . 2.77 900 580 A 47 VAL HB A 47 VAL HG21 1.0 . 5.50 901 580 A 47 VAL HB A 47 VAL HG11 1.0 . 5.50 902 581 A 48 LYS H A 48 LYS HA 1.0 . 4.20 903 582 A 48 LYS H A 48 LYS HGx 1.0 . 4.15 904 582 A 48 LYS H A 48 LYS HGy 1.0 . 4.15 905 583 A 48 LYS H A 48 LYS HBx 1.0 . 3.55 906 583 A 48 LYS H A 48 LYS HBy 1.0 . 3.55 907 584 A 48 LYS HA A 48 LYS HGx 1.0 . 3.92 908 584 A 48 LYS HA A 48 LYS HGy 1.0 . 3.92 909 585 A 48 LYS HA A 48 LYS HBx 1.0 . 5.50 910 585 A 48 LYS HBy A 48 LYS HA 1.0 . 5.50 911 586 A 49 LYS H A 49 LYS HA 1.0 . 5.50 912 587 A 49 LYS HA A 49 LYS HGx 1.0 . 5.50 913 587 A 49 LYS HGy A 49 LYS HA 1.0 . 5.50 914 588 A 49 LYS HA A 49 LYS HBx 1.0 . 5.50 915 588 A 49 LYS HBy A 49 LYS HA 1.0 . 5.50 916 589 A 49 LYS H A 49 LYS HGx 1.0 . 5.50 917 589 A 49 LYS H A 49 LYS HGy 1.0 . 5.50 918 590 A 50 ALA H A 50 ALA HB% 1.0 . 3.40 919 591 A 50 ALA H A 50 ALA HA 1.0 . 5.50 920 592 A 51 SER H A 51 SER HA 1.0 . 3.80 921 593 A 51 SER H A 51 SER HBy 1.0 . 3.58 922 593 A 51 SER H A 51 SER HBx 1.0 . 3.58 923 594 A 51 SER HA A 51 SER HBy 1.0 . 5.50 924 594 A 51 SER HBx A 51 SER HA 1.0 . 5.50 925 595 A 52 LYS H A 52 LYS HA 1.0 . 3.50 926 596 A 52 LYS H A 52 LYS HBx 1.0 . 3.54 927 596 A 52 LYS H A 52 LYS HBy 1.0 . 3.54 928 597 A 52 LYS H A 52 LYS HGx 1.0 . 3.98 929 597 A 52 LYS H A 52 LYS HGy 1.0 . 3.98 930 598 A 53 ALA H A 53 ALA HB% 1.0 . 3.58 931 599 A 53 ALA H A 53 ALA HA 1.0 . 4.00 932 600 A 54 LYS H A 54 LYS HA 1.0 . 3.60 933 601 A 54 LYS H A 54 LYS HBx 1.0 . 4.03 934 601 A 54 LYS H A 54 LYS HBy 1.0 . 4.03 935 602 A 54 LYS H A 54 LYS HGx 1.0 . 4.30 936 602 A 54 LYS H A 54 LYS HGy 1.0 . 4.30 937 603 A 54 LYS HA A 54 LYS HGx 1.0 . 5.50 938 603 A 54 LYS HGy A 54 LYS HA 1.0 . 5.50 939 604 A 55 ASN H A 55 ASN HBx 1.0 . 4.21 940 605 A 55 ASN H A 55 ASN HBy 1.0 . 4.21 941 606 A 56 VAL HA A 56 VAL HG11 1.0 . 3.33 942 606 A 56 VAL HA A 56 VAL HG21 1.0 . 3.33 943 607 A 56 VAL H A 56 VAL HB 1.0 . 3.95 944 608 A 56 VAL H A 56 VAL HG11 1.0 . 5.50 945 608 A 56 VAL H A 56 VAL HG21 1.0 . 5.50 946 609 A 56 VAL H A 56 VAL HA 1.0 . 5.50 947 610 A 57 LYS H A 57 LYS HGx 1.0 . 4.14 948 610 A 57 LYS H A 57 LYS HGy 1.0 . 4.14 949 611 A 57 LYS H A 57 LYS HBy 1.0 . 4.19 950 611 A 57 LYS H A 57 LYS HBx 1.0 . 4.19 951 612 A 57 LYS HA A 57 LYS HDx 1.0 . 4.07 952 612 A 57 LYS HA A 57 LYS HDy 1.0 . 4.07 953 613 A 57 LYS H A 57 LYS HDx 1.0 . 5.50 954 613 A 57 LYS H A 57 LYS HDy 1.0 . 5.50 955 614 A 57 LYS HDy A 57 LYS HGx 1.0 . 5.50 956 614 A 57 LYS HGy A 57 LYS HDx 1.0 . 5.50 957 614 A 57 LYS HDy A 57 LYS HGy 1.0 . 5.50 958 614 A 57 LYS HDx A 57 LYS HGx 1.0 . 5.50 959 615 A 58 ARG H A 58 ARG HBy 1.0 . 3.67 960 615 A 58 ARG H A 58 ARG HBx 1.0 . 3.67 961 616 A 58 ARG HBy A 58 ARG HDx 1.0 . 3.24 962 616 A 58 ARG HBx A 58 ARG HDx 1.0 . 3.24 963 616 A 58 ARG HDy A 58 ARG HBy 1.0 . 3.24 964 616 A 58 ARG HBx A 58 ARG HDy 1.0 . 3.24 965 617 A 58 ARG HA A 58 ARG HGy 1.0 . 3.98 966 617 A 58 ARG HA A 58 ARG HGx 1.0 . 3.98 967 618 A 58 ARG HA A 58 ARG HDx 1.0 . 4.07 968 618 A 58 ARG HA A 58 ARG HDy 1.0 . 4.07 969 619 A 58 ARG H A 58 ARG HA 1.0 . 5.50 970 620 A 58 ARG H A 58 ARG HGy 1.0 . 5.50 971 620 A 58 ARG H A 58 ARG HGx 1.0 . 5.50 972 621 A 58 ARG HBx A 58 ARG HGy 1.0 . 5.50 973 621 A 58 ARG HBy A 58 ARG HGy 1.0 . 5.50 974 621 A 58 ARG HGx A 58 ARG HBy 1.0 . 5.50 975 621 A 58 ARG HBx A 58 ARG HGx 1.0 . 5.50 976 622 A 59 GLY H A 59 GLY HAy 1.0 . 5.50 977 622 A 59 GLY H A 59 GLY HAx 1.0 . 5.50 978 623 A 60 VAL H A 60 VAL HG11 1.0 . 3.61 979 623 A 60 VAL H A 60 VAL HG21 1.0 . 3.61 980 624 A 61 LYS H A 61 LYS HBx 1.0 . 3.57 981 624 A 61 LYS H A 61 LYS HBy 1.0 . 3.57 982 625 A 62 GLU HA A 62 GLU HBx 1.0 . 5.50 983 625 A 62 GLU HBy A 62 GLU HA 1.0 . 5.50 984 626 A 62 GLU H A 62 GLU HBx 1.0 . 5.50 985 626 A 62 GLU H A 62 GLU HBy 1.0 . 5.50 986 627 A 62 GLU H A 62 GLU HA 1.0 . 5.50 987 628 A 63 VAL H A 63 VAL HG11 1.0 . 3.51 988 628 A 63 VAL H A 63 VAL HG21 1.0 . 3.51 989 629 A 63 VAL H A 63 VAL HA 1.0 . 4.00 990 630 A 63 VAL H A 63 VAL HB 1.0 . 3.93 991 631 A 63 VAL HB A 63 VAL HG11 1.0 . 5.50 992 631 A 63 VAL HB A 63 VAL HG21 1.0 . 5.50 993 632 A 64 VAL H A 64 VAL HG11 1.0 . 3.82 994 632 A 64 VAL H A 64 VAL HG21 1.0 . 3.82 995 633 A 64 VAL H A 64 VAL HA 1.0 . 3.80 996 634 A 64 VAL H A 64 VAL HB 1.0 . 3.91 997 635 A 64 VAL HA A 64 VAL HG11 1.0 . 3.31 998 635 A 64 VAL HG21 A 64 VAL HA 1.0 . 3.31 999 636 A 65 LYS H A 65 LYS HA 1.0 . 4.00 1000 637 A 65 LYS H A 65 LYS HBx 1.0 . 3.36 1001 637 A 65 LYS H A 65 LYS HBy 1.0 . 3.36 1002 638 A 65 LYS H A 65 LYS HGy 1.0 . 5.50 1003 638 A 65 LYS H A 65 LYS HGx 1.0 . 5.50 1004 639 A 66 ALA H A 66 ALA HB% 1.0 . 3.05 1005 640 A 66 ALA H A 66 ALA HA 1.0 . 3.00 1006 641 A 67 LEU H A 67 LEU HBy 1.0 . 3.77 1007 642 A 67 LEU H A 67 LEU HBx 1.0 . 3.77 1008 643 A 67 LEU HA A 67 LEU HD11 1.0 . 4.81 1009 644 A 67 LEU HDy% A 67 LEU HA 1.0 . 4.81 1010 645 A 67 LEU H A 67 LEU HG 1.0 . 5.50 1011 646 A 67 LEU HBy A 67 LEU HD11 1.0 . 5.50 1012 646 A 67 LEU HBx A 67 LEU HD11 1.0 . 5.50 1013 646 A 67 LEU HDy% A 67 LEU HBy 1.0 . 5.50 1014 646 A 67 LEU HDy% A 67 LEU HBx 1.0 . 5.50 1015 647 A 67 LEU H A 67 LEU HD11 1.0 . 5.50 1016 647 A 67 LEU H A 67 LEU HDy% 1.0 . 5.50 1017 648 A 68 ARG HA A 68 ARG HDx 1.0 . 4.80 1018 648 A 68 ARG HA A 68 ARG HDy 1.0 . 4.80 1019 649 A 68 ARG HBx A 68 ARG HDx 1.0 . 3.42 1020 649 A 68 ARG HBy A 68 ARG HDx 1.0 . 3.42 1021 649 A 68 ARG HDy A 68 ARG HBx 1.0 . 3.42 1022 649 A 68 ARG HDy A 68 ARG HBy 1.0 . 3.42 1023 650 A 68 ARG HA A 68 ARG HGx 1.0 . 4.19 1024 650 A 68 ARG HA A 68 ARG HGy 1.0 . 4.19 1025 651 A 68 ARG H A 68 ARG HBx 1.0 . 3.20 1026 651 A 68 ARG H A 68 ARG HBy 1.0 . 3.20 1027 652 A 68 ARG H A 68 ARG HA 1.0 . 5.50 1028 653 A 69 LYS H A 69 LYS HBx 1.0 . 3.47 1029 653 A 69 LYS H A 69 LYS HBy 1.0 . 3.47 1030 654 A 69 LYS HA A 69 LYS HBx 1.0 . 2.73 1031 654 A 69 LYS HBy A 69 LYS HA 1.0 . 2.73 1032 655 A 69 LYS H A 69 LYS HGx 1.0 . 5.50 1033 655 A 69 LYS H A 69 LYS HGy 1.0 . 5.50 1034 656 A 69 LYS HBx A 69 LYS HGx 1.0 . 5.50 1035 656 A 69 LYS HBy A 69 LYS HGx 1.0 . 5.50 1036 656 A 69 LYS HGy A 69 LYS HBx 1.0 . 5.50 1037 656 A 69 LYS HBy A 69 LYS HGy 1.0 . 5.50 1038 657 A 69 LYS HA A 69 LYS HGx 1.0 . 5.50 1039 657 A 69 LYS HGy A 69 LYS HA 1.0 . 5.50 1040 658 A 70 GLY H A 70 GLY HAy 1.0 . 3.50 1041 658 A 70 GLY HAx A 70 GLY H 1.0 . 3.50 1042 659 A 71 GLU H A 71 GLU HBy 1.0 . 3.52 1043 659 A 71 GLU H A 71 GLU HBx 1.0 . 3.52 1044 660 A 71 GLU H A 71 GLU HA 1.0 . 3.50 1045 661 A 71 GLU H A 71 GLU HGx 1.0 . 3.91 1046 661 A 71 GLU H A 71 GLU HGy 1.0 . 3.91 1047 662 A 72 LYS H A 72 LYS HBy 1.0 . 3.43 1048 662 A 72 LYS H A 72 LYS HBx 1.0 . 3.43 1049 663 A 72 LYS H A 72 LYS HGx 1.0 . 3.91 1050 663 A 72 LYS H A 72 LYS HGy 1.0 . 3.91 1051 664 A 72 LYS HA A 72 LYS HGx 1.0 . 3.93 1052 664 A 72 LYS HGy A 72 LYS HA 1.0 . 3.93 1053 665 A 72 LYS H A 72 LYS HA 1.0 . 5.50 1054 666 A 73 GLY H A 73 GLY HAy 1.0 . 4.00 1055 666 A 73 GLY H A 73 GLY HAx 1.0 . 4.00 1056 667 A 74 LEU H A 74 LEU HG 1.0 . 5.23 1057 668 A 74 LEU H A 74 LEU HBy 1.0 . 3.42 1058 668 A 74 LEU H A 74 LEU HBx 1.0 . 3.42 1059 669 A 74 LEU HA A 74 LEU HD11 1.0 . 3.60 1060 669 A 74 LEU HA A 74 LEU HD21 1.0 . 3.60 1061 670 A 74 LEU H A 74 LEU HD11 1.0 . 5.33 1062 671 A 74 LEU H A 74 LEU HD21 1.0 . 5.33 1063 672 A 74 LEU HBx A 74 LEU HD11 1.0 . 5.50 1064 672 A 74 LEU HBy A 74 LEU HD11 1.0 . 5.50 1065 672 A 74 LEU HD21 A 74 LEU HBy 1.0 . 5.50 1066 672 A 74 LEU HBx A 74 LEU HD21 1.0 . 5.50 1067 673 A 74 LEU HG A 74 LEU HD11 1.0 . 5.50 1068 673 A 74 LEU HD21 A 74 LEU HG 1.0 . 5.50 1069 674 A 74 LEU H A 74 LEU HA 1.0 . 5.50 1070 675 A 75 VAL H A 75 VAL HB 1.0 . 4.07 1071 676 A 75 VAL H A 75 VAL HG21 1.0 . 4.25 1072 676 A 75 VAL H A 75 VAL HG11 1.0 . 4.25 1073 677 A 75 VAL H A 75 VAL HA 1.0 . 5.50 1074 678 A 75 VAL HA A 75 VAL HB 1.0 . 5.50 1075 679 A 76 VAL H A 76 VAL HA 1.0 . 4.00 1076 680 A 76 VAL H A 76 VAL HB 1.0 . 5.50 1077 681 A 76 VAL H A 76 VAL HG11 1.0 . 4.22 1078 682 A 76 VAL H A 76 VAL HG21 1.0 . 4.22 1079 683 A 77 ILE H A 77 ILE HG2% 1.0 . 4.70 1080 684 A 77 ILE HA A 77 ILE HD11 1.0 . 4.94 1081 685 A 77 ILE HG2% A 77 ILE HD11 1.0 . 4.41 1082 686 A 77 ILE HG2% A 77 ILE HG1y 1.0 . 3.27 1083 686 A 77 ILE HG1x A 77 ILE HG2% 1.0 . 3.27 1084 687 A 77 ILE HA A 77 ILE HG2% 1.0 . 4.14 1085 688 A 77 ILE H A 77 ILE HA 1.0 . 5.50 1086 689 A 77 ILE H A 77 ILE HB 1.0 . 5.50 1087 690 A 77 ILE HD11 A 77 ILE HB 1.0 . 5.50 1088 691 A 78 ALA H A 78 ALA HB% 1.0 . 4.80 1089 692 A 78 ALA H A 78 ALA HA 1.0 . 5.50 1090 693 A 78 ALA HA A 78 ALA HB% 1.0 . 5.50 1091 694 A 79 GLY H A 79 GLY HAy 1.0 . 5.20 1092 694 A 79 GLY H A 79 GLY HAx 1.0 . 5.20 1093 695 A 80 ASP H A 80 ASP HBy 1.0 . 5.50 1094 695 A 80 ASP H A 80 ASP HBx 1.0 . 5.50 1095 696 A 81 ILE H A 81 ILE HG2% 1.0 . 4.79 1096 697 A 81 ILE H A 81 ILE HG1x 1.0 . 4.74 1097 697 A 81 ILE H A 81 ILE HG1y 1.0 . 4.74 1098 698 A 81 ILE H A 81 ILE HB 1.0 . 4.19 1099 699 A 81 ILE HG2% A 81 ILE HG1x 1.0 . 3.51 1100 699 A 81 ILE HG1y A 81 ILE HG2% 1.0 . 3.51 1101 700 A 81 ILE HA A 81 ILE HG2% 1.0 . 5.50 1102 701 A 81 ILE HA A 81 ILE HB 1.0 . 5.50 1103 702 A 81 ILE H A 81 ILE HA 1.0 . 5.50 1104 703 A 81 ILE HB A 81 ILE HG2% 1.0 . 5.50 1105 704 A 84 ALA HA A 84 ALA H 1.0 . 5.50 1106 705 A 84 ALA H A 84 ALA HB% 1.0 . 5.50 1107 706 A 85 ASP HA A 85 ASP H 1.0 . 4.80 1108 707 A 85 ASP H A 85 ASP HBx 1.0 . 5.50 1109 707 A 85 ASP HBy A 85 ASP H 1.0 . 5.50 1110 708 A 85 ASP HA A 85 ASP HBx 1.0 . 5.50 1111 708 A 85 ASP HBy A 85 ASP HA 1.0 . 5.50 1112 709 A 86 VAL H A 86 VAL HG21 1.0 . 4.45 1113 709 A 86 VAL H A 86 VAL HG11 1.0 . 4.45 1114 710 A 86 VAL H A 86 VAL HB 1.0 . 4.80 1115 711 A 86 VAL H A 86 VAL HA 1.0 . 5.00 1116 712 A 86 VAL HA A 86 VAL HG21 1.0 . 3.90 1117 712 A 86 VAL HG11 A 86 VAL HA 1.0 . 3.90 1118 713 A 86 VAL HG11 A 86 VAL HG21 1.0 . 5.50 1119 714 A 87 ILE H A 87 ILE HG1y 1.0 . 4.55 1120 714 A 87 ILE H A 87 ILE HG1x 1.0 . 4.55 1121 715 A 87 ILE H A 87 ILE HG2% 1.0 . 5.01 1122 716 A 87 ILE HG2% A 87 ILE HB 1.0 . 5.50 1123 717 A 88 SER H A 88 SER HBx 1.0 . 3.96 1124 717 A 88 SER H A 88 SER HBy 1.0 . 3.96 1125 718 A 92 VAL H A 92 VAL HB 1.0 . 4.12 1126 719 A 92 VAL HA A 92 VAL HG11 1.0 . 3.79 1127 720 A 92 VAL HA A 92 VAL HG21 1.0 . 3.79 1128 721 A 92 VAL H A 92 VAL HG11 1.0 . 4.50 1129 722 A 92 VAL H A 92 VAL HG21 1.0 . 4.50 1130 723 A 93 LEU H A 93 LEU HBy 1.0 . 3.75 1131 723 A 93 LEU H A 93 LEU HBx 1.0 . 3.75 1132 724 A 93 LEU H A 93 LEU HD11 1.0 . 4.41 1133 724 A 93 LEU H A 93 LEU HD21 1.0 . 4.41 1134 725 A 93 LEU HA A 93 LEU HD11 1.0 . 3.95 1135 725 A 93 LEU HA A 93 LEU HD21 1.0 . 3.95 1136 726 A 93 LEU H A 93 LEU HG 1.0 . 3.38 1137 727 A 93 LEU H A 93 LEU HA 1.0 . 5.50 1138 728 A 94 CYS H A 94 CYS HBx 1.0 . 4.20 1139 728 A 94 CYS H A 94 CYS HBy 1.0 . 4.20 1140 729 A 94 CYS H A 94 CYS HA 1.0 . 4.20 1141 730 A 95 GLU H A 95 GLU HA 1.0 . 4.10 1142 731 A 95 GLU H A 95 GLU HBx 1.0 . 5.20 1143 731 A 95 GLU H A 95 GLU HBy 1.0 . 5.20 1144 732 A 95 GLU H A 95 GLU HGx 1.0 . 5.50 1145 732 A 95 GLU H A 95 GLU HGy 1.0 . 5.50 1146 733 A 95 GLU HA A 95 GLU HGx 1.0 . 5.50 1147 733 A 95 GLU HA A 95 GLU HGy 1.0 . 5.50 1148 734 A 96 ASP H A 96 ASP HBy 1.0 . 4.05 1149 734 A 96 ASP H A 96 ASP HBx 1.0 . 4.05 1150 735 A 96 ASP H A 96 ASP HA 1.0 . 5.20 1151 736 A 97 HIS H A 97 HIS HBx 1.0 . 5.50 1152 736 A 97 HIS H A 97 HIS HBy 1.0 . 5.50 1153 737 A 98 SER H A 98 SER HA 1.0 . 3.50 1154 738 A 98 SER H A 98 SER HBx 1.0 . 3.77 1155 738 A 98 SER H A 98 SER HBy 1.0 . 3.77 1156 739 A 99 VAL H A 99 VAL HG11 1.0 . 4.74 1157 740 A 99 VAL H A 99 VAL HG21 1.0 . 4.74 1158 741 A 99 VAL H A 99 VAL HB 1.0 . 3.95 1159 742 A 99 VAL HA A 99 VAL HG21 1.0 . 5.50 1160 742 A 99 VAL HG11 A 99 VAL HA 1.0 . 5.50 1161 743 A 100 PRO HA A 100 PRO HGx 1.0 . 5.50 1162 743 A 100 PRO HA A 100 PRO HGy 1.0 . 5.50 1163 744 A 100 PRO HBy A 100 PRO HGx 1.0 . 5.50 1164 744 A 100 PRO HBx A 100 PRO HGx 1.0 . 5.50 1165 744 A 100 PRO HGy A 100 PRO HBx 1.0 . 5.50 1166 744 A 100 PRO HBy A 100 PRO HGy 1.0 . 5.50 1167 745 A 101 TYR H A 101 TYR HE% 1.0 . 5.31 1168 746 A 101 TYR H A 101 TYR HD% 1.0 . 4.26 1169 747 A 101 TYR HA A 101 TYR HE% 1.0 . 5.28 1170 748 A 101 TYR HA A 101 TYR HD% 1.0 . 5.50 1171 749 A 101 TYR H A 101 TYR HBy 1.0 . 5.50 1172 749 A 101 TYR H A 101 TYR HBx 1.0 . 5.50 1173 750 A 101 TYR HD% A 101 TYR HBy 1.0 . 5.50 1174 750 A 101 TYR HBx A 101 TYR HD% 1.0 . 5.50 1175 751 A 101 TYR HD% A 101 TYR HE% 1.0 . 5.50 1176 752 A 101 TYR H A 101 TYR HA 1.0 . 5.50 1177 753 A 102 ILE H A 102 ILE HD11 1.0 . 4.20 1178 754 A 102 ILE H A 102 ILE HG2% 1.0 . 4.09 1179 755 A 102 ILE H A 102 ILE HB 1.0 . 5.50 1180 756 A 102 ILE H A 102 ILE HA 1.0 . 5.50 1181 757 A 102 ILE HB A 102 ILE HG2% 1.0 . 5.50 1182 758 A 102 ILE HB A 102 ILE HD11 1.0 . 5.50 1183 759 A 102 ILE HA A 102 ILE HG2% 1.0 . 5.50 1184 760 A 102 ILE HG2% A 102 ILE HD11 1.0 . 5.50 1185 761 A 103 PHE HA A 103 PHE HDx 1.0 . 4.63 1186 762 A 103 PHE H A 103 PHE HA 1.0 . 5.50 1187 763 A 103 PHE H A 103 PHE HDx 1.0 . 5.50 1188 764 A 103 PHE H A 103 PHE HBx 1.0 . 5.50 1189 764 A 103 PHE H A 103 PHE HBy 1.0 . 5.50 1190 765 A 104 ILE H A 104 ILE HD11 1.0 . 5.23 1191 766 A 104 ILE HD11 A 104 ILE HB 1.0 . 3.72 1192 767 A 104 ILE HD11 A 104 ILE HA 1.0 . 4.42 1193 768 A 104 ILE H A 104 ILE HB 1.0 . 5.50 1194 769 A 104 ILE H A 104 ILE HA 1.0 . 5.50 1195 770 A 106 SER H A 106 SER HA 1.0 . 5.20 1196 771 A 110 LEU HA A 110 LEU HD11 1.0 . 4.53 1197 772 A 110 LEU HD21 A 110 LEU HA 1.0 . 4.53 1198 773 A 110 LEU H A 110 LEU HBy 1.0 . 5.50 1199 773 A 110 LEU HBx A 110 LEU H 1.0 . 5.50 1200 774 A 110 LEU H A 110 LEU HD11 1.0 . 5.50 1201 774 A 110 LEU H A 110 LEU HD21 1.0 . 5.50 1202 775 A 110 LEU HBy A 110 LEU HD11 1.0 . 5.50 1203 775 A 110 LEU HBx A 110 LEU HD11 1.0 . 5.50 1204 775 A 110 LEU HD21 A 110 LEU HBy 1.0 . 5.50 1205 775 A 110 LEU HBx A 110 LEU HD21 1.0 . 5.50 1206 776 A 111 GLY H A 111 GLY HAy 1.0 . 5.50 1207 776 A 111 GLY H A 111 GLY HAx 1.0 . 5.50 1208 777 A 112 ALA H A 112 ALA HB% 1.0 . 4.00 1209 778 A 113 ALA HB% A 113 ALA H 1.0 . 5.50 1210 779 A 116 THR H A 116 THR HB 1.0 . 5.50 1211 780 A 116 THR H A 116 THR HG2% 1.0 . 5.50 1212 781 A 120 THR HG21 A 120 THR H 1.0 . 3.92 1213 782 A 120 THR H A 120 THR HB 1.0 . 5.50 1214 783 A 120 THR H A 120 THR HA 1.0 . 5.50 1215 784 A 122 VAL H A 122 VAL HG11 1.0 . 5.13 1216 785 A 122 VAL H A 122 VAL HG21 1.0 . 5.13 1217 786 A 122 VAL HA A 122 VAL H 1.0 . 5.50 1218 787 A 122 VAL H A 122 VAL HB 1.0 . 5.50 1219 788 A 123 VAL H A 123 VAL HG11 1.0 . 4.43 1220 789 A 123 VAL H A 123 VAL HG21 1.0 . 4.43 1221 790 A 123 VAL HA A 123 VAL HG11 1.0 . 4.01 1222 791 A 123 VAL HA A 123 VAL HG21 1.0 . 4.01 1223 792 A 123 VAL H A 123 VAL HA 1.0 . 5.50 1224 793 A 123 VAL H A 123 VAL HB 1.0 . 5.50 1225 794 A 124 PHE H A 124 PHE HBx 1.0 . 4.20 1226 794 A 124 PHE H A 124 PHE HBy 1.0 . 4.20 1227 795 A 124 PHE HA A 124 PHE HDx 1.0 . 4.19 1228 796 A 124 PHE H A 124 PHE HA 1.0 . 5.50 1229 797 A 125 ILE H A 125 ILE HD11 1.0 . 4.00 1230 798 A 125 ILE H A 125 ILE HG2% 1.0 . 4.24 1231 799 A 125 ILE HA A 125 ILE HG2% 1.0 . 3.66 1232 800 A 125 ILE HA A 125 ILE HG1y 1.0 . 3.10 1233 800 A 125 ILE HA A 125 ILE HG1x 1.0 . 3.10 1234 801 A 125 ILE H A 125 ILE HB 1.0 . 5.50 1235 802 A 126 VAL H A 126 VAL HB 1.0 . 4.19 1236 803 A 126 VAL H A 126 VAL HG21 1.0 . 4.57 1237 804 A 126 VAL H A 126 VAL HG11 1.0 . 4.57 1238 805 A 126 VAL H A 126 VAL HA 1.0 . 5.50 1239 806 A 126 VAL HA A 126 VAL HG21 1.0 . 5.50 1240 806 A 126 VAL HG11 A 126 VAL HA 1.0 . 5.50 1241 807 A 127 PRO HA A 127 PRO HBx 1.0 . 5.50 1242 807 A 127 PRO HBy A 127 PRO HA 1.0 . 5.50 1243 808 A 127 PRO HBx A 127 PRO HGx 1.0 . 5.50 1244 808 A 127 PRO HBy A 127 PRO HGx 1.0 . 5.50 1245 808 A 127 PRO HGy A 127 PRO HBx 1.0 . 5.50 1246 808 A 127 PRO HBy A 127 PRO HGy 1.0 . 5.50 1247 809 A 127 PRO HA A 127 PRO HGx 1.0 . 5.50 1248 809 A 127 PRO HGy A 127 PRO HA 1.0 . 5.50 1249 810 A 128 GLY H A 128 GLY HAy 1.0 . 4.00 1250 810 A 128 GLY HAx A 128 GLY H 1.0 . 4.00 1251 811 A 129 SER H A 129 SER HA 1.0 . 5.50 1252 812 A 129 SER H A 129 SER HBx 1.0 . 5.50 1253 812 A 129 SER H A 129 SER HBy 1.0 . 5.50 1254 813 A 130 ASN H A 130 ASN HBx 1.0 . 3.52 1255 813 A 130 ASN H A 130 ASN HBy 1.0 . 3.52 1256 814 A 134 ASP HA A 134 ASP HBx 1.0 . 2.85 1257 814 A 134 ASP HA A 134 ASP HBy 1.0 . 2.85 1258 815 A 137 ASN HA A 137 ASN HD2y 1.0 . 3.18 1259 815 A 137 ASN HA A 137 ASN HD2x 1.0 . 3.18 1260 816 A 142 TYR HD% A 142 TYR HA 1.0 . 4.23 1261 817 A 142 TYR HD% A 142 TYR H 1.0 . 5.50 1262 818 A 142 TYR HD% A 142 TYR HBy 1.0 . 5.50 1263 818 A 142 TYR HD% A 142 TYR HBx 1.0 . 5.50 1264 819 A 143 LYS HA A 143 LYS HGx 1.0 . 4.00 1265 819 A 143 LYS HA A 143 LYS HGy 1.0 . 4.00 1266 820 A 143 LYS H A 143 LYS HGx 1.0 . 5.50 1267 820 A 143 LYS H A 143 LYS HGy 1.0 . 5.50 1268 821 A 143 LYS HA A 143 LYS HBx 1.0 . 5.50 1269 821 A 143 LYS HA A 143 LYS HBy 1.0 . 5.50 1270 822 A 143 LYS H A 143 LYS HBx 1.0 . 5.50 1271 822 A 143 LYS H A 143 LYS HBy 1.0 . 5.50 1272 823 A 146 PHE H A 146 PHE HBx 1.0 . 3.90 1273 823 A 146 PHE H A 146 PHE HBy 1.0 . 3.90 1274 824 A 146 PHE HDx A 146 PHE HA 1.0 . 4.50 1275 825 A 146 PHE H A 146 PHE HA 1.0 . 3.80 1276 826 A 146 PHE HA A 146 PHE HBx 1.0 . 5.50 1277 826 A 146 PHE HBy A 146 PHE HA 1.0 . 5.50 1278 827 A 147 ASN H A 147 ASN HBy 1.0 . 4.00 1279 827 A 147 ASN H A 147 ASN HBx 1.0 . 4.00 1280 828 A 147 ASN H A 147 ASN HA 1.0 . 4.10 1281 829 A 147 ASN HA A 147 ASN HBy 1.0 . 5.50 1282 829 A 147 ASN HBx A 147 ASN HA 1.0 . 5.50 1283 830 A 148 GLU H A 148 GLU HBx 1.0 . 3.14 1284 830 A 148 GLU H A 148 GLU HBy 1.0 . 3.14 1285 831 A 148 GLU H A 148 GLU HA 1.0 . 3.50 1286 832 A 148 GLU HBx A 148 GLU HGx 1.0 . 2.54 1287 832 A 148 GLU HBy A 148 GLU HGx 1.0 . 2.54 1288 832 A 148 GLU HGy A 148 GLU HBx 1.0 . 2.54 1289 832 A 148 GLU HBy A 148 GLU HGy 1.0 . 2.54 1290 833 A 148 GLU HA A 148 GLU HGx 1.0 . 3.99 1291 833 A 148 GLU HA A 148 GLU HGy 1.0 . 3.99 1292 834 A 149 VAL H A 149 VAL HG21 1.0 . 2.55 1293 834 A 149 VAL H A 149 VAL HG11 1.0 . 2.55 1294 835 A 149 VAL HA A 149 VAL HG21 1.0 . 3.49 1295 835 A 149 VAL HG11 A 149 VAL HA 1.0 . 3.49 1296 836 A 149 VAL H A 149 VAL HB 1.0 . 3.96 1297 837 A 150 VAL H A 150 VAL HA 1.0 . 4.00 1298 838 A 150 VAL HA A 150 VAL HG11 1.0 . 3.40 1299 839 A 150 VAL HA A 150 VAL HG21 1.0 . 3.40 1300 840 A 150 VAL H A 150 VAL HB 1.0 . 3.92 1301 841 A 150 VAL H A 150 VAL HG21 1.0 . 3.73 1302 841 A 150 VAL H A 150 VAL HG11 1.0 . 3.73 1303 842 A 151 LYS H A 151 LYS HA 1.0 . 4.00 1304 843 A 151 LYS H A 151 LYS HBx 1.0 . 5.50 1305 843 A 151 LYS H A 151 LYS HBy 1.0 . 5.50 1306 844 A 152 GLU H A 152 GLU HBx 1.0 . 3.72 1307 844 A 152 GLU H A 152 GLU HBy 1.0 . 3.72 1308 845 A 152 GLU H A 152 GLU HGx 1.0 . 4.23 1309 845 A 152 GLU H A 152 GLU HGy 1.0 . 4.23 1310 846 A 153 VAL H A 153 VAL HG21 1.0 . 3.56 1311 846 A 153 VAL H A 153 VAL HG11 1.0 . 3.56 1312 847 A 153 VAL H A 153 VAL HB 1.0 . 3.93 1313 848 A 153 VAL HA A 153 VAL HG21 1.0 . 3.82 1314 849 A 153 VAL HG11 A 153 VAL HA 1.0 . 3.82 1315 850 A 153 VAL H A 153 VAL HA 1.0 . 5.50 1316 851 A 155 ALA H A 155 ALA HB% 1.0 . 4.08 1317 852 A 156 LEU H A 156 LEU HD11 1.0 . 4.52 1318 852 A 156 LEU H A 156 LEU HD21 1.0 . 4.52 1319 853 A 156 LEU H A 156 LEU HG 1.0 . 5.20 1320 854 A 156 LEU HA A 156 LEU HD11 1.0 . 5.50 1321 854 A 156 LEU HD21 A 156 LEU HA 1.0 . 5.50 1322 855 A 156 LEU H A 156 LEU HBx 1.0 . 5.50 1323 855 A 156 LEU H A 156 LEU HBy 1.0 . 5.50 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 42 LYS H A 38 LYS O 1.0 . 2.0 2 2 A 38 LYS O A 42 LYS N 1.0 . 3.0 3 3 A 43 VAL H A 39 LEU O 1.0 . 2.0 4 4 A 39 LEU O A 43 VAL N 1.0 . 3.0 5 5 A 44 LEU H A 40 ASN O 1.0 . 2.0 6 6 A 40 ASN O A 44 LEU N 1.0 . 3.0 7 7 A 45 LYS H A 41 LYS O 1.0 . 2.0 8 8 A 41 LYS O A 45 LYS N 1.0 . 3.0 9 9 A 46 THR H A 42 LYS O 1.0 . 2.0 10 10 A 42 LYS O A 46 THR N 1.0 . 3.0 11 11 A 47 VAL H A 43 VAL O 1.0 . 2.0 12 12 A 43 VAL O A 47 VAL N 1.0 . 3.0 13 13 A 48 LYS H A 44 LEU O 1.0 . 2.0 14 14 A 44 LEU O A 48 LYS N 1.0 . 3.0 15 15 A 49 LYS H A 45 LYS O 1.0 . 2.0 16 16 A 45 LYS O A 49 LYS N 1.0 . 3.0 17 17 A 50 ALA H A 46 THR O 1.0 . 2.0 18 18 A 46 THR O A 50 ALA N 1.0 . 3.0 19 19 A 51 SER H A 47 VAL O 1.0 . 2.0 20 20 A 47 VAL O A 51 SER N 1.0 . 3.0 21 21 A 63 VAL H A 59 GLY O 1.0 . 2.0 22 22 A 59 GLY O A 63 VAL N 1.0 . 3.0 23 23 A 64 VAL H A 60 VAL O 1.0 . 2.0 24 24 A 60 VAL O A 64 VAL N 1.0 . 3.0 25 25 A 65 LYS H A 61 LYS O 1.0 . 2.0 26 26 A 61 LYS O A 65 LYS N 1.0 . 3.0 27 27 A 66 ALA H A 62 GLU O 1.0 . 2.0 28 28 A 62 GLU O A 66 ALA N 1.0 . 3.0 29 29 A 67 LEU H A 63 VAL O 1.0 . 2.0 30 30 A 63 VAL O A 67 LEU N 1.0 . 3.0 31 31 A 68 ARG H A 64 VAL O 1.0 . 2.0 32 32 A 64 VAL O A 68 ARG N 1.0 . 3.0 33 33 A 69 LYS H A 65 LYS O 1.0 . 2.0 34 34 A 65 LYS O A 69 LYS N 1.0 . 3.0 35 35 A 85 ASP O A 89 HIS H 1.0 . 2.0 36 36 A 85 ASP O A 89 HIS N 1.0 . 3.0 37 37 A 86 VAL O A 90 ILE H 1.0 . 2.0 38 38 A 86 VAL O A 90 ILE N 1.0 . 3.0 39 39 A 92 VAL H A 88 SER O 1.0 . 2.0 40 40 A 88 SER O A 92 VAL N 1.0 . 3.0 41 41 A 93 LEU H A 89 HIS O 1.0 . 2.0 42 42 A 89 HIS O A 93 LEU N 1.0 . 3.0 43 43 A 94 CYS H A 90 ILE O 1.0 . 2.0 44 44 A 90 ILE O A 94 CYS N 1.0 . 3.0 45 45 A 95 GLU H A 91 PRO O 1.0 . 2.0 46 46 A 91 PRO O A 95 GLU N 1.0 . 3.0 47 47 A 96 ASP H A 92 VAL O 1.0 . 2.0 48 48 A 92 VAL O A 96 ASP N 1.0 . 3.0 49 49 A 97 HIS H A 93 LEU O 1.0 . 2.0 50 50 A 93 LEU O A 97 HIS N 1.0 . 3.0 51 51 A 98 SER H A 94 CYS O 1.0 . 2.0 52 52 A 94 CYS O A 98 SER N 1.0 . 3.0 53 53 A 110 LEU H A 106 SER O 1.0 . 2.0 54 54 A 106 SER O A 110 LEU N 1.0 . 3.0 55 55 A 111 GLY H A 107 LYS O 1.0 . 2.0 56 56 A 107 LYS O A 111 GLY N 1.0 . 3.0 57 57 A 112 ALA H A 108 GLN O 1.0 . 2.0 58 58 A 108 GLN O A 112 ALA N 1.0 . 3.0 59 59 A 113 ALA H A 109 ASP O 1.0 . 2.0 60 60 A 109 ASP O A 113 ALA N 1.0 . 3.0 61 61 A 110 LEU O A 114 GLY H 1.0 . 2.0 62 62 A 110 LEU O A 114 GLY N 1.0 . 3.0 63 63 A 111 GLY O A 115 ALA H 1.0 . 2.0 64 64 A 111 GLY O A 115 ALA N 1.0 . 3.0 65 65 A 142 TYR H A 138 LYS O 1.0 . 2.0 66 66 A 138 LYS O A 142 TYR N 1.0 . 3.0 67 67 A 143 LYS H A 139 GLU O 1.0 . 2.0 68 68 A 139 GLU O A 143 LYS N 1.0 . 3.0 69 69 A 144 GLU H A 140 GLU O 1.0 . 2.0 70 70 A 140 GLU O A 144 GLU N 1.0 . 3.0 71 71 A 145 SER H A 141 GLU O 1.0 . 2.0 72 72 A 141 GLU O A 145 SER N 1.0 . 3.0 73 73 A 146 PHE H A 142 TYR O 1.0 . 2.0 74 74 A 142 TYR O A 146 PHE N 1.0 . 3.0 75 75 A 147 ASN H A 143 LYS O 1.0 . 2.0 76 76 A 143 LYS O A 147 ASN N 1.0 . 3.0 77 77 A 148 GLU H A 144 GLU O 1.0 . 2.0 78 78 A 144 GLU O A 148 GLU N 1.0 . 3.0 79 79 A 149 VAL H A 145 SER O 1.0 . 2.0 80 80 A 145 SER O A 149 VAL N 1.0 . 3.0 81 81 A 150 VAL H A 146 PHE O 1.0 . 2.0 82 82 A 146 PHE O A 150 VAL N 1.0 . 3.0 83 83 A 151 LYS H A 147 ASN O 1.0 . 2.0 84 84 A 147 ASN O A 151 LYS N 1.0 . 3.0 85 85 A 152 GLU H A 148 GLU O 1.0 . 2.0 86 86 A 148 GLU O A 152 GLU N 1.0 . 3.0 87 87 A 153 VAL H A 149 VAL O 1.0 . 2.0 88 88 A 149 VAL O A 153 VAL N 1.0 . 3.0 89 89 A 150 VAL O A 154 GLN H 1.0 . 2.0 90 90 A 150 VAL O A 154 GLN N 1.0 . 3.0 91 91 A 155 ALA H A 151 LYS O 1.0 . 2.0 92 92 A 151 LYS O A 155 ALA N 1.0 . 3.0 93 93 A 156 LEU H A 152 GLU O 1.0 . 2.0 94 94 A 152 GLU O A 156 LEU N 1.0 . 3.0 95 95 A 124 PHE H A 57 LYS O 1.0 . 2.0 96 96 A 57 LYS O A 124 PHE N 1.0 . 3.0 97 97 A 57 LYS H A 124 PHE O 1.0 . 2.0 98 98 A 124 PHE O A 57 LYS N 1.0 . 3.0 99 99 A 123 VAL H A 76 VAL O 1.0 . 2.0 100 100 A 76 VAL O A 123 VAL N 1.0 . 3.0 101 101 A 76 VAL H A 123 VAL O 1.0 . 2.0 102 102 A 123 VAL O A 76 VAL N 1.0 . 3.0 103 103 A 125 ILE H A 74 LEU O 1.0 . 2.0 104 104 A 74 LEU O A 125 ILE N 1.0 . 3.0 105 105 A 104 ILE H A 77 ILE O 1.0 . 2.0 106 106 A 77 ILE O A 104 ILE N 1.0 . 3.0 107 107 A 77 ILE H A 102 ILE O 1.0 . 2.0 108 108 A 102 ILE O A 77 ILE N 1.0 . 3.0 109 109 A 102 ILE H A 75 VAL O 1.0 . 2.0 110 110 A 75 VAL O A 102 ILE N 1.0 . 3.0 111 111 A 75 VAL H A 100 PRO O 1.0 . 2.0 112 112 A 100 PRO O A 75 VAL N 1.0 . 3.0 113 113 A 59 GLY H A 122 VAL O 1.0 . 2.0 114 114 A 122 VAL O A 59 GLY N 1.0 . 3.0 115 115 A 74 LEU H A 125 ILE O 1.0 . 2.0 116 116 A 125 ILE O A 74 LEU N 1.0 . 3.0 117 117 A 42 LYS H A 38 LYS O 1.0 . 1.8 118 118 A 38 LYS O A 42 LYS N 1.0 . 2.7 119 119 A 43 VAL H A 39 LEU O 1.0 . 1.8 120 120 A 39 LEU O A 43 VAL N 1.0 . 2.7 121 121 A 44 LEU H A 40 ASN O 1.0 . 1.8 122 122 A 40 ASN O A 44 LEU N 1.0 . 2.7 123 123 A 45 LYS H A 41 LYS O 1.0 . 1.8 124 124 A 41 LYS O A 45 LYS N 1.0 . 2.7 125 125 A 46 THR H A 42 LYS O 1.0 . 1.8 126 126 A 42 LYS O A 46 THR N 1.0 . 2.7 127 127 A 47 VAL H A 43 VAL O 1.0 . 1.8 128 128 A 43 VAL O A 47 VAL N 1.0 . 2.7 129 129 A 48 LYS H A 44 LEU O 1.0 . 1.8 130 130 A 44 LEU O A 48 LYS N 1.0 . 2.7 131 131 A 49 LYS H A 45 LYS O 1.0 . 1.8 132 132 A 45 LYS O A 49 LYS N 1.0 . 2.7 133 133 A 50 ALA H A 46 THR O 1.0 . 1.8 134 134 A 46 THR O A 50 ALA N 1.0 . 2.7 135 135 A 51 SER H A 47 VAL O 1.0 . 1.8 136 136 A 47 VAL O A 51 SER N 1.0 . 2.7 137 137 A 63 VAL H A 59 GLY O 1.0 . 1.8 138 138 A 59 GLY O A 63 VAL N 1.0 . 2.7 139 139 A 64 VAL H A 60 VAL O 1.0 . 1.8 140 140 A 60 VAL O A 64 VAL N 1.0 . 2.7 141 141 A 65 LYS H A 61 LYS O 1.0 . 1.8 142 142 A 61 LYS O A 65 LYS N 1.0 . 2.7 143 143 A 66 ALA H A 62 GLU O 1.0 . 1.8 144 144 A 62 GLU O A 66 ALA N 1.0 . 2.7 145 145 A 67 LEU H A 63 VAL O 1.0 . 1.8 146 146 A 63 VAL O A 67 LEU N 1.0 . 2.7 147 147 A 68 ARG H A 64 VAL O 1.0 . 1.8 148 148 A 64 VAL O A 68 ARG N 1.0 . 2.7 149 149 A 69 LYS H A 65 LYS O 1.0 . 1.8 150 150 A 65 LYS O A 69 LYS N 1.0 . 2.7 151 151 A 85 ASP O A 89 HIS H 1.0 . 1.8 152 152 A 85 ASP O A 89 HIS N 1.0 . 2.7 153 153 A 86 VAL O A 90 ILE H 1.0 . 1.8 154 154 A 86 VAL O A 90 ILE N 1.0 . 2.7 155 155 A 92 VAL H A 88 SER O 1.0 . 1.8 156 156 A 88 SER O A 92 VAL N 1.0 . 2.7 157 157 A 93 LEU H A 89 HIS O 1.0 . 1.8 158 158 A 89 HIS O A 93 LEU N 1.0 . 2.7 159 159 A 94 CYS H A 90 ILE O 1.0 . 1.8 160 160 A 90 ILE O A 94 CYS N 1.0 . 2.7 161 161 A 95 GLU H A 91 PRO O 1.0 . 1.8 162 162 A 91 PRO O A 95 GLU N 1.0 . 2.7 163 163 A 96 ASP H A 92 VAL O 1.0 . 1.8 164 164 A 92 VAL O A 96 ASP N 1.0 . 2.7 165 165 A 97 HIS H A 93 LEU O 1.0 . 1.8 166 166 A 93 LEU O A 97 HIS N 1.0 . 2.7 167 167 A 98 SER H A 94 CYS O 1.0 . 1.8 168 168 A 94 CYS O A 98 SER N 1.0 . 2.7 169 169 A 110 LEU H A 106 SER O 1.0 . 1.8 170 170 A 106 SER O A 110 LEU N 1.0 . 2.7 171 171 A 111 GLY H A 107 LYS O 1.0 . 1.8 172 172 A 107 LYS O A 111 GLY N 1.0 . 2.7 173 173 A 112 ALA H A 108 GLN O 1.0 . 1.8 174 174 A 108 GLN O A 112 ALA N 1.0 . 2.7 175 175 A 113 ALA H A 109 ASP O 1.0 . 1.8 176 176 A 109 ASP O A 113 ALA N 1.0 . 2.7 177 177 A 110 LEU O A 114 GLY H 1.0 . 1.8 178 178 A 110 LEU O A 114 GLY N 1.0 . 2.7 179 179 A 111 GLY O A 115 ALA H 1.0 . 1.8 180 180 A 111 GLY O A 115 ALA N 1.0 . 2.7 181 181 A 142 TYR H A 138 LYS O 1.0 . 1.8 182 182 A 138 LYS O A 142 TYR N 1.0 . 2.7 183 183 A 143 LYS H A 139 GLU O 1.0 . 1.8 184 184 A 139 GLU O A 143 LYS N 1.0 . 2.7 185 185 A 144 GLU H A 140 GLU O 1.0 . 1.8 186 186 A 140 GLU O A 144 GLU N 1.0 . 2.7 187 187 A 145 SER H A 141 GLU O 1.0 . 1.8 188 188 A 141 GLU O A 145 SER N 1.0 . 2.7 189 189 A 146 PHE H A 142 TYR O 1.0 . 1.8 190 190 A 142 TYR O A 146 PHE N 1.0 . 2.7 191 191 A 147 ASN H A 143 LYS O 1.0 . 1.8 192 192 A 143 LYS O A 147 ASN N 1.0 . 2.7 193 193 A 148 GLU H A 144 GLU O 1.0 . 1.8 194 194 A 144 GLU O A 148 GLU N 1.0 . 2.7 195 195 A 149 VAL H A 145 SER O 1.0 . 1.8 196 196 A 145 SER O A 149 VAL N 1.0 . 2.7 197 197 A 150 VAL H A 146 PHE O 1.0 . 1.8 198 198 A 146 PHE O A 150 VAL N 1.0 . 2.7 199 199 A 151 LYS H A 147 ASN O 1.0 . 1.8 200 200 A 147 ASN O A 151 LYS N 1.0 . 2.7 201 201 A 152 GLU H A 148 GLU O 1.0 . 1.8 202 202 A 148 GLU O A 152 GLU N 1.0 . 2.7 203 203 A 153 VAL H A 149 VAL O 1.0 . 1.8 204 204 A 149 VAL O A 153 VAL N 1.0 . 2.7 205 205 A 150 VAL O A 154 GLN H 1.0 . 1.8 206 206 A 150 VAL O A 154 GLN N 1.0 . 2.7 207 207 A 155 ALA H A 151 LYS O 1.0 . 1.8 208 208 A 151 LYS O A 155 ALA N 1.0 . 2.7 209 209 A 156 LEU H A 152 GLU O 1.0 . 1.8 210 210 A 152 GLU O A 156 LEU N 1.0 . 2.7 211 211 A 124 PHE H A 57 LYS O 1.0 . 1.8 212 212 A 57 LYS O A 124 PHE N 1.0 . 2.7 213 213 A 57 LYS H A 124 PHE O 1.0 . 1.8 214 214 A 124 PHE O A 57 LYS N 1.0 . 2.7 215 215 A 76 VAL H A 123 VAL O 1.0 . 1.8 216 216 A 123 VAL O A 76 VAL N 1.0 . 2.7 217 217 A 123 VAL H A 76 VAL O 1.0 . 1.8 218 218 A 76 VAL O A 123 VAL N 1.0 . 2.7 219 219 A 125 ILE H A 74 LEU O 1.0 . 1.8 220 220 A 74 LEU O A 125 ILE N 1.0 . 2.7 221 221 A 104 ILE H A 77 ILE O 1.0 . 1.8 222 222 A 77 ILE O A 104 ILE N 1.0 . 2.7 223 223 A 77 ILE H A 102 ILE O 1.0 . 1.8 224 224 A 102 ILE O A 77 ILE N 1.0 . 2.7 225 225 A 102 ILE H A 75 VAL O 1.0 . 1.8 226 226 A 75 VAL O A 102 ILE N 1.0 . 2.7 227 227 A 75 VAL H A 100 PRO O 1.0 . 1.8 228 228 A 100 PRO O A 75 VAL N 1.0 . 2.7 229 229 A 59 GLY H A 122 VAL O 1.0 . 1.8 230 230 A 122 VAL O A 59 GLY N 1.0 . 2.7 231 231 A 74 LEU H A 125 ILE O 1.0 . 1.8 232 232 A 125 ILE O A 74 LEU N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 36 SER N A 36 SER CA A 36 SER C A 37 LYS N 1.0 -62.3 -1.1 PSI 2 2 A 36 SER C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -82.2 -42.2 PHI 3 3 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 LYS N 1.0 -66.6 -26.6 PSI 4 4 A 37 LYS C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -85.0 -45.0 PHI 5 5 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 LEU N 1.0 -60.0 -20.0 PSI 6 6 A 38 LYS C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -87.5 -47.5 PHI 7 7 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 ASN N 1.0 -58.7 -18.7 PSI 8 8 A 39 LEU C A 40 ASN N A 40 ASN CA A 40 ASN C 1.0 -84.2 -44.2 PHI 9 9 A 40 ASN N A 40 ASN CA A 40 ASN C A 41 LYS N 1.0 -64.7 -24.7 PSI 10 10 A 40 ASN C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -81.1 -41.1 PHI 11 11 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 LYS N 1.0 -61.7 -21.7 PSI 12 12 A 41 LYS C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -84.3 -44.3 PHI 13 13 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 VAL N 1.0 -61.6 -21.6 PSI 14 14 A 42 LYS C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -88.2 -47.2 PHI 15 15 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 LEU N 1.0 -60.6 -19.6 PSI 16 16 A 43 VAL C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -85.2 -45.2 PHI 17 17 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 LYS N 1.0 -61.2 -21.2 PSI 18 18 A 44 LEU C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -86.5 -46.5 PHI 19 19 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 THR N 1.0 -60.2 -10.2 PSI 20 20 A 45 LYS C A 46 THR N A 46 THR CA A 46 THR C 1.0 -86.0 -46.0 PHI 21 21 A 46 THR N A 46 THR CA A 46 THR C A 47 VAL N 1.0 -64.9 -24.9 PSI 22 22 A 46 THR C A 47 VAL N A 47 VAL CA A 47 VAL C 1.0 -82.1 -42.1 PHI 23 23 A 47 VAL N A 47 VAL CA A 47 VAL C A 48 LYS N 1.0 -62.3 -22.3 PSI 24 24 A 47 VAL C A 48 LYS N A 48 LYS CA A 48 LYS C 1.0 -84.6 -44.6 PHI 25 25 A 48 LYS N A 48 LYS CA A 48 LYS C A 49 LYS N 1.0 -64.1 -24.1 PSI 26 26 A 48 LYS C A 49 LYS N A 49 LYS CA A 49 LYS C 1.0 -83.7 -43.7 PHI 27 27 A 49 LYS N A 49 LYS CA A 49 LYS C A 50 ALA N 1.0 -59.3 -19.3 PSI 28 28 A 49 LYS C A 50 ALA N A 50 ALA CA A 50 ALA C 1.0 -83.6 -43.6 PHI 29 29 A 50 ALA N A 50 ALA CA A 50 ALA C A 51 SER N 1.0 -60.8 -20.8 PSI 30 30 A 50 ALA C A 51 SER N A 51 SER CA A 51 SER C 1.0 -85.7 -45.7 PHI 31 31 A 51 SER N A 51 SER CA A 51 SER C A 52 LYS N 1.0 -63.1 -23.1 PSI 32 32 A 51 SER C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -84.8 -44.8 PHI 33 33 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 ALA N 1.0 -45.3 -5.3 PSI 34 34 A 52 LYS C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -112.5 -71.5 PHI 35 35 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 LYS N 1.0 -16.5 38.2 PSI 36 36 A 53 ALA C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 40.9 80.9 PHI 37 37 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 ASN N 1.0 6.1 63.4 PSI 38 38 A 56 VAL C A 57 LYS N A 57 LYS CA A 57 LYS C 1.0 -155.5 -79.3 PHI 39 39 A 57 LYS N A 57 LYS CA A 57 LYS C A 58 ARG N 1.0 105.1 162.3 PSI 40 40 A 59 GLY C A 60 VAL N A 60 VAL CA A 60 VAL C 1.0 -78.7 -38.7 PHI 41 41 A 60 VAL N A 60 VAL CA A 60 VAL C A 61 LYS N 1.0 -63.6 -23.6 PSI 42 42 A 60 VAL C A 61 LYS N A 61 LYS CA A 61 LYS C 1.0 -80.0 -40.0 PHI 43 43 A 61 LYS N A 61 LYS CA A 61 LYS C A 62 GLU N 1.0 -60.2 -20.2 PSI 44 44 A 61 LYS C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -86.5 -46.5 PHI 45 45 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 VAL N 1.0 -62.4 -22.4 PSI 46 46 A 62 GLU C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -84.7 -44.7 PHI 47 47 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 VAL N 1.0 -63.4 -23.4 PSI 48 48 A 63 VAL C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -82.8 -42.8 PHI 49 49 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 LYS N 1.0 -63.6 -23.6 PSI 50 50 A 64 VAL C A 65 LYS N A 65 LYS CA A 65 LYS C 1.0 -79.8 -39.8 PHI 51 51 A 65 LYS N A 65 LYS CA A 65 LYS C A 66 ALA N 1.0 -60.0 -20.0 PSI 52 52 A 65 LYS C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -82.5 -42.5 PHI 53 53 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 LEU N 1.0 -61.6 -21.6 PSI 54 54 A 66 ALA C A 67 LEU N A 67 LEU CA A 67 LEU C 1.0 -85.2 -45.2 PHI 55 55 A 67 LEU N A 67 LEU CA A 67 LEU C A 68 ARG N 1.0 -60.9 -20.9 PSI 56 56 A 67 LEU C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -84.7 -44.7 PHI 57 57 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 LYS N 1.0 -58.1 -2.8 PSI 58 58 A 68 ARG C A 69 LYS N A 69 LYS CA A 69 LYS C 1.0 -119.5 -64.9 PHI 59 59 A 69 LYS N A 69 LYS CA A 69 LYS C A 70 GLY N 1.0 -54.7 22.9 PSI 60 60 A 70 GLY C A 71 GLU N A 71 GLU CA A 71 GLU C 1.0 -108.4 -59.3 PHI 61 61 A 71 GLU N A 71 GLU CA A 71 GLU C A 72 LYS N 1.0 -51.8 9.9 PSI 62 62 A 73 GLY C A 74 LEU N A 74 LEU CA A 74 LEU C 1.0 -168.5 -85.0 PHI 63 63 A 74 LEU N A 74 LEU CA A 74 LEU C A 75 VAL N 1.0 109.0 149.0 PSI 64 64 A 74 LEU C A 75 VAL N A 75 VAL CA A 75 VAL C 1.0 -134.2 -90.2 PHI 65 65 A 75 VAL N A 75 VAL CA A 75 VAL C A 76 VAL N 1.0 97.7 153.6 PSI 66 66 A 75 VAL C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -162.7 -82.9 PHI 67 67 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 ILE N 1.0 101.8 165.2 PSI 68 68 A 76 VAL C A 77 ILE N A 77 ILE CA A 77 ILE C 1.0 -148.1 -66.4 PHI 69 69 A 77 ILE N A 77 ILE CA A 77 ILE C A 78 ALA N 1.0 101.9 152.8 PSI 70 70 A 77 ILE C A 78 ALA N A 78 ALA CA A 78 ALA C 1.0 -109.8 -52.1 PHI 71 71 A 78 ALA N A 78 ALA CA A 78 ALA C A 79 GLY N 1.0 114.3 206.7 PSI 72 72 A 79 GLY C A 80 ASP N A 80 ASP CA A 80 ASP C 1.0 -126.4 -57.8 PHI 73 73 A 80 ASP N A 80 ASP CA A 80 ASP C A 81 ILE N 1.0 -55.1 47.3 PSI 74 74 A 80 ASP C A 81 ILE N A 81 ILE CA A 81 ILE C 1.0 -173.5 -66.4 PHI 75 75 A 81 ILE N A 81 ILE CA A 81 ILE C A 82 TRP N 1.0 104.1 185.6 PSI 76 76 A 81 ILE C A 82 TRP N A 82 TRP CA A 82 TRP C 1.0 -157.6 -85.7 PHI 77 77 A 82 TRP N A 82 TRP CA A 82 TRP C A 83 PRO N 1.0 55.4 173.3 PSI 78 78 A 83 PRO C A 84 ALA N A 84 ALA CA A 84 ALA C 1.0 -81.3 -26.7 PHI 79 79 A 84 ALA N A 84 ALA CA A 84 ALA C A 85 ASP N 1.0 -74.2 8.4 PSI 80 80 A 84 ALA C A 85 ASP N A 85 ASP CA A 85 ASP C 1.0 -86.1 -46.1 PHI 81 81 A 85 ASP N A 85 ASP CA A 85 ASP C A 86 VAL N 1.0 -49.1 -8.8 PSI 82 82 A 85 ASP C A 86 VAL N A 86 VAL CA A 86 VAL C 1.0 -84.8 -44.8 PHI 83 83 A 86 VAL N A 86 VAL CA A 86 VAL C A 87 ILE N 1.0 -59.6 -16.3 PSI 84 84 A 86 VAL C A 87 ILE N A 87 ILE CA A 87 ILE C 1.0 -133.6 -47.9 PHI 85 85 A 87 ILE N A 87 ILE CA A 87 ILE C A 88 SER N 1.0 -56.4 11.1 PSI 86 86 A 87 ILE C A 88 SER N A 88 SER CA A 88 SER C 1.0 -81.7 -41.7 PHI 87 87 A 88 SER N A 88 SER CA A 88 SER C A 89 HIS N 1.0 -55.8 -2.5 PSI 88 88 A 88 SER C A 89 HIS N A 89 HIS CA A 89 HIS C 1.0 -91.7 -49.1 PHI 89 89 A 89 HIS N A 89 HIS CA A 89 HIS C A 90 ILE N 1.0 -63.8 -12.0 PSI 90 90 A 89 HIS C A 90 ILE N A 90 ILE CA A 90 ILE C 1.0 -80.4 -27.6 PHI 91 91 A 90 ILE N A 90 ILE CA A 90 ILE C A 91 PRO N 1.0 -65.1 -25.1 PSI 92 92 A 91 PRO C A 92 VAL N A 92 VAL CA A 92 VAL C 1.0 -80.7 -40.7 PHI 93 93 A 92 VAL N A 92 VAL CA A 92 VAL C A 93 LEU N 1.0 -56.0 -16.0 PSI 94 94 A 92 VAL C A 93 LEU N A 93 LEU CA A 93 LEU C 1.0 -86.7 -46.7 PHI 95 95 A 93 LEU N A 93 LEU CA A 93 LEU C A 94 CYS N 1.0 -58.0 -18.0 PSI 96 96 A 93 LEU C A 94 CYS N A 94 CYS CA A 94 CYS C 1.0 -83.1 -43.1 PHI 97 97 A 94 CYS N A 94 CYS CA A 94 CYS C A 95 GLU N 1.0 -60.2 -20.2 PSI 98 98 A 94 CYS C A 95 GLU N A 95 GLU CA A 95 GLU C 1.0 -86.2 -46.2 PHI 99 99 A 95 GLU N A 95 GLU CA A 95 GLU C A 96 ASP N 1.0 -59.2 -19.2 PSI 100 100 A 95 GLU C A 96 ASP N A 96 ASP CA A 96 ASP C 1.0 -85.4 -45.4 PHI 101 101 A 96 ASP N A 96 ASP CA A 96 ASP C A 97 HIS N 1.0 -49.8 -9.8 PSI 102 102 A 96 ASP C A 97 HIS N A 97 HIS CA A 97 HIS C 1.0 -105.9 -42.8 PHI 103 103 A 97 HIS N A 97 HIS CA A 97 HIS C A 98 SER N 1.0 -63.4 23.6 PSI 104 104 A 98 SER C A 99 VAL N A 99 VAL CA A 99 VAL C 1.0 -178.9 -51.3 PHI 105 105 A 99 VAL N A 99 VAL CA A 99 VAL C A 100 PRO N 1.0 77.3 187.9 PSI 106 106 A 100 PRO C A 101 TYR N A 101 TYR CA A 101 TYR C 1.0 -168.6 -68.0 PHI 107 107 A 101 TYR N A 101 TYR CA A 101 TYR C A 102 ILE N 1.0 132.2 186.8 PSI 108 108 A 101 TYR C A 102 ILE N A 102 ILE CA A 102 ILE C 1.0 -154.9 -114.9 PHI 109 109 A 102 ILE N A 102 ILE CA A 102 ILE C A 103 PHE N 1.0 137.2 177.2 PSI 110 110 A 105 PRO C A 106 SER N A 106 SER CA A 106 SER C 1.0 -128.6 -65.5 PHI 111 111 A 106 SER N A 106 SER CA A 106 SER C A 107 LYS N 1.0 -50.7 25.0 PSI 112 112 A 106 SER C A 107 LYS N A 107 LYS CA A 107 LYS C 1.0 -107.9 -28.6 PHI 113 113 A 107 LYS N A 107 LYS CA A 107 LYS C A 108 GLN N 1.0 -59.9 -19.9 PSI 114 114 A 107 LYS C A 108 GLN N A 108 GLN CA A 108 GLN C 1.0 -85.9 -45.9 PHI 115 115 A 108 GLN N A 108 GLN CA A 108 GLN C A 109 ASP N 1.0 -63.9 -23.9 PSI 116 116 A 108 GLN C A 109 ASP N A 109 ASP CA A 109 ASP C 1.0 -88.4 -48.4 PHI 117 117 A 109 ASP N A 109 ASP CA A 109 ASP C A 110 LEU N 1.0 -62.7 -22.7 PSI 118 118 A 109 ASP C A 110 LEU N A 110 LEU CA A 110 LEU C 1.0 -86.8 -46.8 PHI 119 119 A 110 LEU N A 110 LEU CA A 110 LEU C A 111 GLY N 1.0 -58.6 -8.6 PSI 120 120 A 110 LEU C A 111 GLY N A 111 GLY CA A 111 GLY C 1.0 -85.2 -45.2 PHI 121 121 A 111 GLY N A 111 GLY CA A 111 GLY C A 112 ALA N 1.0 -59.1 -19.1 PSI 122 122 A 111 GLY C A 112 ALA N A 112 ALA CA A 112 ALA C 1.0 -84.6 -44.6 PHI 123 123 A 112 ALA N A 112 ALA CA A 112 ALA C A 113 ALA N 1.0 -55.2 -15.2 PSI 124 124 A 112 ALA C A 113 ALA N A 113 ALA CA A 113 ALA C 1.0 -108.0 -53.3 PHI 125 125 A 113 ALA N A 113 ALA CA A 113 ALA C A 114 GLY N 1.0 -31.5 13.3 PSI 126 126 A 115 ALA C A 116 THR N A 116 THR CA A 116 THR C 1.0 -112.9 -62.3 PHI 127 127 A 116 THR N A 116 THR CA A 116 THR C A 117 LYS N 1.0 66.1 164.4 PSI 128 128 A 120 THR C A 121 SER N A 121 SER CA A 121 SER C 1.0 -113.2 -68.0 PHI 129 129 A 121 SER N A 121 SER CA A 121 SER C A 122 VAL N 1.0 -76.4 11.0 PSI 130 130 A 121 SER C A 122 VAL N A 122 VAL CA A 122 VAL C 1.0 -172.9 -81.3 PHI 131 131 A 122 VAL N A 122 VAL CA A 122 VAL C A 123 VAL N 1.0 109.6 199.9 PSI 132 132 A 122 VAL C A 123 VAL N A 123 VAL CA A 123 VAL C 1.0 -152.9 -112.0 PHI 133 133 A 123 VAL N A 123 VAL CA A 123 VAL C A 124 PHE N 1.0 121.3 173.6 PSI 134 134 A 123 VAL C A 124 PHE N A 124 PHE CA A 124 PHE C 1.0 -147.5 -103.6 PHI 135 135 A 124 PHE N A 124 PHE CA A 124 PHE C A 125 ILE N 1.0 96.3 160.3 PSI 136 136 A 124 PHE C A 125 ILE N A 125 ILE CA A 125 ILE C 1.0 -157.8 -63.1 PHI 137 137 A 125 ILE N A 125 ILE CA A 125 ILE C A 126 VAL N 1.0 94.4 149.3 PSI 138 138 A 125 ILE C A 126 VAL N A 126 VAL CA A 126 VAL C 1.0 -154.5 -60.5 PHI 139 139 A 126 VAL N A 126 VAL CA A 126 VAL C A 127 PRO N 1.0 80.7 167.2 PSI 140 140 A 129 SER C A 130 ASN N A 130 ASN CA A 130 ASN C 1.0 -85.2 -45.2 PHI 141 141 A 130 ASN N A 130 ASN CA A 130 ASN C A 131 LYS N 1.0 -62.7 -22.7 PSI 142 142 A 130 ASN C A 131 LYS N A 131 LYS CA A 131 LYS C 1.0 -84.4 -44.4 PHI 143 143 A 131 LYS N A 131 LYS CA A 131 LYS C A 132 LYS N 1.0 -61.9 -21.9 PSI 144 144 A 131 LYS C A 132 LYS N A 132 LYS CA A 132 LYS C 1.0 -84.1 -44.1 PHI 145 145 A 132 LYS N A 132 LYS CA A 132 LYS C A 133 LYS N 1.0 -56.2 -16.1 PSI 146 146 A 132 LYS C A 133 LYS N A 133 LYS CA A 133 LYS C 1.0 -82.4 -42.4 PHI 147 147 A 133 LYS N A 133 LYS CA A 133 LYS C A 134 ASP N 1.0 -59.3 -16.1 PSI 148 148 A 133 LYS C A 134 ASP N A 134 ASP CA A 134 ASP C 1.0 -127.3 -43.8 PHI 149 149 A 134 ASP N A 134 ASP CA A 134 ASP C A 135 GLY N 1.0 -43.7 25.5 PSI 150 150 A 141 GLU C A 142 TYR N A 142 TYR CA A 142 TYR C 1.0 -113.0 -35.3 PHI 151 151 A 142 TYR N A 142 TYR CA A 142 TYR C A 143 LYS N 1.0 -68.8 19.5 PSI 152 152 A 142 TYR C A 143 LYS N A 143 LYS CA A 143 LYS C 1.0 -83.3 -43.3 PHI 153 153 A 143 LYS N A 143 LYS CA A 143 LYS C A 144 GLU N 1.0 -60.5 -20.5 PSI 154 154 A 143 LYS C A 144 GLU N A 144 GLU CA A 144 GLU C 1.0 -84.2 -44.2 PHI 155 155 A 144 GLU N A 144 GLU CA A 144 GLU C A 145 SER N 1.0 -60.5 -20.5 PSI 156 156 A 144 GLU C A 145 SER N A 145 SER CA A 145 SER C 1.0 -84.8 -44.8 PHI 157 157 A 145 SER N A 145 SER CA A 145 SER C A 146 PHE N 1.0 -60.9 -20.9 PSI 158 158 A 145 SER C A 146 PHE N A 146 PHE CA A 146 PHE C 1.0 -85.1 -45.1 PHI 159 159 A 146 PHE N A 146 PHE CA A 146 PHE C A 147 ASN N 1.0 -62.7 -22.7 PSI 160 160 A 146 PHE C A 147 ASN N A 147 ASN CA A 147 ASN C 1.0 -83.1 -43.1 PHI 161 161 A 147 ASN N A 147 ASN CA A 147 ASN C A 148 GLU N 1.0 -62.1 -22.1 PSI 162 162 A 147 ASN C A 148 GLU N A 148 GLU CA A 148 GLU C 1.0 -86.5 -46.5 PHI 163 163 A 148 GLU N A 148 GLU CA A 148 GLU C A 149 VAL N 1.0 -60.5 -20.5 PSI 164 164 A 148 GLU C A 149 VAL N A 149 VAL CA A 149 VAL C 1.0 -85.5 -45.5 PHI 165 165 A 149 VAL N A 149 VAL CA A 149 VAL C A 150 VAL N 1.0 -62.3 -22.3 PSI 166 166 A 149 VAL C A 150 VAL N A 150 VAL CA A 150 VAL C 1.0 -82.1 -42.1 PHI 167 167 A 150 VAL N A 150 VAL CA A 150 VAL C A 151 LYS N 1.0 -62.7 -22.7 PSI 168 168 A 150 VAL C A 151 LYS N A 151 LYS CA A 151 LYS C 1.0 -81.1 -41.1 PHI 169 169 A 151 LYS N A 151 LYS CA A 151 LYS C A 152 GLU N 1.0 -60.7 -20.7 PSI 170 170 A 151 LYS C A 152 GLU N A 152 GLU CA A 152 GLU C 1.0 -87.1 -47.1 PHI 171 171 A 152 GLU N A 152 GLU CA A 152 GLU C A 153 VAL N 1.0 -61.7 -21.7 PSI 172 172 A 152 GLU C A 153 VAL N A 153 VAL CA A 153 VAL C 1.0 -88.1 -43.9 PHI 173 173 A 153 VAL N A 153 VAL CA A 153 VAL C A 154 GLN N 1.0 -58.4 -18.4 PSI 174 174 A 153 VAL C A 154 GLN N A 154 GLN CA A 154 GLN C 1.0 -80.7 -40.7 PHI 175 175 A 154 GLN N A 154 GLN CA A 154 GLN C A 155 ALA N 1.0 -61.2 -21.2 PSI 176 176 A 154 GLN C A 155 ALA N A 155 ALA CA A 155 ALA C 1.0 -91.4 -40.7 PHI 177 177 A 155 ALA N A 155 ALA CA A 155 ALA C A 156 LEU N 1.0 -61.0 -21.0 PSI stop_ save_