data_nef_c19087_2m5y save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY . . . 2 A 2 SER . . . 3 A 3 SER . . . 4 A 4 PRO . . . 5 A 5 ASN . . . 6 A 6 SER . . . 7 A 7 GLU . . . 8 A 8 ASP . . . 9 A 9 ASP . . . 10 A 10 SER . . . 11 A 11 SER . . . 12 A 12 ALA . . . 13 A 13 ILE . . . 14 A 14 SER . . . 15 A 15 THR . . . 16 A 16 MET . . . 17 A 17 THR . . . 18 A 18 THR . . . 19 A 19 THR . . . 20 A 20 THR . . . 21 A 21 ALA . . . 22 A 22 ALA . . . 23 A 23 PRO . . . 24 A 24 THR . . . 25 A 25 SER . . . 26 A 26 THR . . . 27 A 27 SER . . . 28 A 28 VAL . . . 29 A 29 LYS . . . 30 A 30 PRO . . . 31 A 31 ALA . . . 32 A 32 ALA . . . 33 A 33 PRO . . . 34 A 34 ARG . . . 35 A 35 ALA . . . 36 A 36 GLU . . . 37 A 37 VAL . . . 38 A 38 ARG . . . 39 A 39 VAL . . . 40 A 40 TYR . . . 41 A 41 ASN . . . 42 A 42 ILE . . . 43 A 43 SER . . . 44 A 44 GLY . . . 45 A 45 THR . . . 46 A 46 GLU . . . 47 A 47 GLY . . . 48 A 48 ALA . . . 49 A 49 ALA . . . 50 A 50 ALA . . . 51 A 51 ARG . . . 52 A 52 THR . . . 53 A 53 ALA . . . 54 A 54 ASP . . . 55 A 55 ARG . . . 56 A 56 LEU . . . 57 A 57 LYS . . . 58 A 58 ALA . . . 59 A 59 ALA . . . 60 A 60 GLY . . . 61 A 61 PHE . . . 62 A 62 THR . . . 63 A 63 VAL . . . 64 A 64 THR . . . 65 A 65 ASP . . . 66 A 66 VAL . . . 67 A 67 GLY . . . 68 A 68 ASN . . . 69 A 69 LEU . . . 70 A 70 SER . . . 71 A 71 LEU . . . 72 A 72 PRO . . . 73 A 73 ASP . . . 74 A 74 VAL . . . 75 A 75 ALA . . . 76 A 76 ALA . . . 77 A 77 THR . . . 78 A 78 THR . . . 79 A 79 VAL . . . 80 A 80 TYR . . . 81 A 81 TYR . . . 82 A 82 THR . . . 83 A 83 GLU . . . 84 A 84 VAL . . . 85 A 85 GLU . . . 86 A 86 GLY . . . 87 A 87 GLU . . . 88 A 88 ARG . . . 89 A 89 ALA . . . 90 A 90 THR . . . 91 A 91 ALA . . . 92 A 92 ASP . . . 93 A 93 ALA . . . 94 A 94 VAL . . . 95 A 95 GLY . . . 96 A 96 ARG . . . 97 A 97 THR . . . 98 A 98 LEU . . . 99 A 99 GLY . . . 100 A 100 ALA . . . 101 A 101 ALA . . . 102 A 102 VAL . . . 103 A 103 GLU . . . 104 A 104 LEU . . . 105 A 105 ARG . . . 106 A 106 LEU . . . 107 A 107 PRO . . . 108 A 108 GLU . . . 109 A 109 LEU . . . 110 A 110 SER . . . 111 A 111 ASP . . . 112 A 112 GLN . . . 113 A 113 PRO . . . 114 A 114 PRO . . . 115 A 115 GLY . . . 116 A 116 VAL . . . 117 A 117 ILE . . . 118 A 118 VAL . . . 119 A 119 VAL . . . 120 A 120 VAL . . . 121 A 121 THR . . . 122 A 122 GLY . . . 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 6 SER HBx H 1 3.8984 . A 6 SER C C 13 174.6646 . A 6 SER CA C 13 58.7445 . A 6 SER CB C 13 63.8704 . A 7 GLU H H 1 8.4746 . A 7 GLU HA H 1 4.7279 . A 7 GLU HBy H 1 1.9946 . A 7 GLU HGx H 1 2.2574 . A 7 GLU C C 13 176.2791 . A 7 GLU CA C 13 56.8940 . A 7 GLU CB C 13 30.2093 . A 7 GLU CG C 13 36.5236 . A 7 GLU N N 15 122.2781 . A 8 ASP H H 1 8.2063 . A 8 ASP HA H 1 4.7092 . A 8 ASP HBx H 1 2.6827 . A 8 ASP C C 13 176.0700 . A 8 ASP CA C 13 54.3663 . A 8 ASP CB C 13 41.4587 . A 8 ASP N N 15 120.7527 . A 9 ASP H H 1 8.2564 . A 9 ASP HA H 1 4.7029 . A 9 ASP HBx H 1 2.7284 . A 9 ASP CA C 13 54.4438 . A 9 ASP CB C 13 41.2197 . A 9 ASP N N 15 121.4298 . A 11 SER HBx H 1 3.9192 . A 11 SER C C 13 174.5167 . A 11 SER CA C 13 59.3636 . A 11 SER CB C 13 63.9895 . A 12 ALA H H 1 8.0870 . A 12 ALA HA H 1 4.3564 . A 12 ALA HB% H 1 1.4069 . A 12 ALA C C 13 177.8112 . A 12 ALA CA C 13 52.8152 . A 12 ALA CB C 13 19.2043 . A 12 ALA N N 15 125.4998 . A 13 ILE H H 1 7.9378 . A 13 ILE HA H 1 4.1929 . A 13 ILE HB H 1 0.9295 . A 13 ILE CA C 13 61.1629 . A 13 ILE CB C 13 38.7214 . A 13 ILE N N 15 119.0453 . A 14 SER H H 1 8.3386 . A 14 SER N N 15 119.6615 . A 21 ALA HA H 1 4.2862 . A 21 ALA HB% H 1 1.3645 . A 21 ALA C C 13 177.0127 . A 21 ALA CA C 13 51.5849 . A 21 ALA CB C 13 19.3386 . A 22 ALA H H 1 8.1820 . A 22 ALA HA H 1 4.7254 . A 22 ALA HB% H 1 1.3236 . A 22 ALA CA C 13 50.3102 . A 22 ALA CB C 13 18.2319 . A 22 ALA N N 15 124.5793 . A 28 VAL HA H 1 4.1353 . A 28 VAL HB H 1 2.0616 . A 28 VAL HGx% H 1 0.9199 . A 28 VAL C C 13 175.7789 . A 28 VAL CA C 13 62.1669 . A 28 VAL CB C 13 32.6810 . A 28 VAL CGx C 13 20.8144 . A 29 LYS H H 1 8.3462 . A 29 LYS HA H 1 4.7123 . A 29 LYS HBx H 1 1.7557 . A 29 LYS CA C 13 54.1350 . A 29 LYS CB C 13 32.6462 . A 29 LYS N N 15 126.8584 . A 30 PRO HA H 1 4.4019 . A 30 PRO HBy H 1 2.2910 . A 30 PRO HGx H 1 1.9560 . A 30 PRO C C 13 176.4349 . A 30 PRO CA C 13 62.7758 . A 30 PRO CB C 13 32.1535 . A 30 PRO CG C 13 27.0691 . A 31 ALA H H 1 8.3236 . A 31 ALA HA H 1 4.3466 . A 31 ALA HB% H 1 1.3761 . A 31 ALA C C 13 176.8599 . A 31 ALA CA C 13 52.3156 . A 31 ALA CB C 13 19.3982 . A 31 ALA N N 15 124.6797 . A 32 ALA H H 1 8.2457 . A 32 ALA HA H 1 4.7363 . A 32 ALA CA C 13 50.4868 . A 32 ALA CB C 13 18.2030 . A 32 ALA N N 15 125.0106 . A 33 PRO HA H 1 4.4663 . A 33 PRO HBy H 1 2.2919 . A 33 PRO HDy H 1 2.9359 . A 33 PRO C C 13 176.8339 . A 33 PRO CA C 13 62.8251 . A 33 PRO CB C 13 31.9951 . A 33 PRO CG C 13 27.2422 . A 34 ARG H H 1 8.3489 . A 34 ARG HA H 1 4.3855 . A 34 ARG HBx H 1 1.9371 . A 34 ARG HDy H 1 3.1924 . A 34 ARG HGy H 1 1.7552 . A 34 ARG C C 13 175.8528 . A 34 ARG CA C 13 55.9121 . A 34 ARG CB C 13 31.6715 . A 34 ARG CD C 13 43.4872 . A 34 ARG CG C 13 27.1295 . A 34 ARG N N 15 121.1700 . A 35 ALA H H 1 8.0085 . A 35 ALA HA H 1 4.6117 . A 35 ALA HB% H 1 1.4879 . A 35 ALA C C 13 176.1700 . A 35 ALA CA C 13 51.5665 . A 35 ALA CB C 13 20.7224 . A 35 ALA N N 15 124.8778 . A 36 GLU H H 1 8.4946 . A 36 GLU HA H 1 4.4307 . A 36 GLU HBx H 1 2.0651 . A 36 GLU HGx H 1 2.3601 . A 36 GLU C C 13 174.6178 . A 36 GLU CA C 13 56.4725 . A 36 GLU CB C 13 31.1240 . A 36 GLU CG C 13 37.0945 . A 36 GLU N N 15 119.7760 . A 37 VAL H H 1 8.4944 . A 37 VAL HA H 1 4.9016 . A 37 VAL HB H 1 1.8225 . A 37 VAL HGx% H 1 0.6989 . A 37 VAL C C 13 174.2846 . A 37 VAL CA C 13 60.6390 . A 37 VAL CB C 13 34.6124 . A 37 VAL CGx C 13 22.5964 . A 37 VAL N N 15 119.8077 . A 38 ARG H H 1 8.6524 . A 38 ARG HA H 1 4.9258 . A 38 ARG HBx H 1 1.4277 . A 38 ARG C C 13 174.2394 . A 38 ARG CA C 13 55.0921 . A 38 ARG CB C 13 34.1901 . A 38 ARG CD C 13 45.3136 . A 38 ARG CG C 13 27.8763 . A 38 ARG N N 15 124.5341 . A 39 VAL H H 1 7.9340 . A 39 VAL HA H 1 4.7984 . A 39 VAL HB H 1 1.8069 . A 39 VAL HGx% H 1 0.8702 . A 39 VAL HGy% H 1 0.6498 . A 39 VAL C C 13 173.3569 . A 39 VAL CA C 13 60.6382 . A 39 VAL CB C 13 34.2940 . A 39 VAL CGx C 13 22.1293 . A 39 VAL N N 15 121.2310 . A 40 TYR H H 1 9.3434 . A 40 TYR HA H 1 5.1536 . A 40 TYR HBx H 1 2.5983 . A 40 TYR C C 13 175.1237 . A 40 TYR CA C 13 55.5400 . A 40 TYR CB C 13 42.2231 . A 40 TYR N N 15 122.2622 . A 41 ASN H H 1 9.2865 . A 41 ASN HA H 1 5.0316 . A 41 ASN HBy H 1 3.4985 . A 41 ASN HBx H 1 2.7933 . A 41 ASN C C 13 176.3009 . A 41 ASN CA C 13 52.6349 . A 41 ASN CB C 13 39.8356 . A 41 ASN N N 15 121.6843 . A 42 ILE H H 1 8.5409 . A 42 ILE HA H 1 5.4502 . A 42 ILE HB H 1 2.2429 . A 42 ILE HD1% H 1 0.9108 . A 42 ILE HG2% H 1 1.2629 . A 42 ILE C C 13 176.4504 . A 42 ILE CA C 13 60.5126 . A 42 ILE CB C 13 38.5973 . A 42 ILE CD1 C 13 14.9070 . A 42 ILE CG1 C 13 26.2074 . A 42 ILE CG2 C 13 18.4972 . A 42 ILE N N 15 119.4615 . A 43 SER H H 1 8.1421 . A 43 SER HA H 1 4.7285 . A 43 SER CA C 13 58.5979 . A 43 SER CB C 13 66.2618 . A 43 SER N N 15 118.2117 . A 44 GLY HAx H 1 4.0057 . A 44 GLY C C 13 174.4138 . A 44 GLY CA C 13 45.3788 . A 45 THR H H 1 8.2981 . A 45 THR HA H 1 4.3843 . A 45 THR HB H 1 4.1674 . A 45 THR HG2% H 1 1.2276 . A 45 THR CA C 13 61.8140 . A 45 THR CB C 13 69.7868 . A 45 THR N N 15 116.3708 . A 47 GLY HAy H 1 4.1719 . A 47 GLY HAx H 1 3.9370 . A 47 GLY C C 13 175.6906 . A 47 GLY CA C 13 46.1906 . A 48 ALA H H 1 7.5112 . A 48 ALA HA H 1 4.0295 . A 48 ALA HB% H 1 1.3384 . A 48 ALA CA C 13 55.4020 . A 48 ALA CB C 13 18.4918 . A 48 ALA N N 15 121.9574 . A 49 ALA HA H 1 3.9840 . A 49 ALA HB% H 1 1.3849 . A 49 ALA C C 13 178.0733 . A 49 ALA CA C 13 54.8610 . A 49 ALA CB C 13 18.6885 . A 50 ALA H H 1 7.9654 . A 50 ALA HA H 1 3.9886 . A 50 ALA HB% H 1 1.4806 . A 50 ALA C C 13 179.6418 . A 50 ALA CA C 13 55.8512 . A 50 ALA CB C 13 17.7880 . A 50 ALA N N 15 122.6536 . A 51 ARG H H 1 7.9818 . A 51 ARG HA H 1 4.1909 . A 51 ARG HBx H 1 1.8965 . A 51 ARG HDy H 1 3.2610 . A 51 ARG HGx H 1 1.6694 . A 51 ARG C C 13 179.9308 . A 51 ARG CA C 13 59.5118 . A 51 ARG CB C 13 30.4632 . A 51 ARG CD C 13 43.1094 . A 51 ARG CG C 13 27.5974 . A 51 ARG N N 15 116.6587 . A 52 THR H H 1 7.6612 . A 52 THR HA H 1 4.1622 . A 52 THR HB H 1 3.8591 . A 52 THR HG2% H 1 1.0933 . A 52 THR C C 13 175.6261 . A 52 THR CA C 13 68.5651 . A 52 THR CB C 13 70.7873 . A 52 THR CG2 C 13 21.9823 . A 52 THR N N 15 117.7449 . A 53 ALA H H 1 8.8054 . A 53 ALA HA H 1 3.8862 . A 53 ALA HB% H 1 1.4684 . A 53 ALA C C 13 179.0134 . A 53 ALA CA C 13 56.1974 . A 53 ALA CB C 13 18.7171 . A 53 ALA N N 15 123.9388 . A 54 ASP H H 1 8.3267 . A 54 ASP HA H 1 4.4320 . A 54 ASP HBx H 1 2.8095 . A 54 ASP C C 13 179.3765 . A 54 ASP CA C 13 58.0071 . A 54 ASP CB C 13 40.2418 . A 54 ASP N N 15 118.3507 . A 55 ARG H H 1 7.7229 . A 55 ARG HA H 1 4.1748 . A 55 ARG HBx H 1 1.9933 . A 55 ARG HDy H 1 3.2064 . A 55 ARG HGx H 1 1.6960 . A 55 ARG C C 13 179.5497 . A 55 ARG CA C 13 59.2855 . A 55 ARG CB C 13 30.3202 . A 55 ARG CD C 13 42.6666 . A 55 ARG CG C 13 27.0430 . A 55 ARG N N 15 121.1200 . A 56 LEU H H 1 8.2151 . A 56 LEU HA H 1 4.3318 . A 56 LEU HBx H 1 2.0630 . A 56 LEU HDx% H 1 0.6268 . A 56 LEU HG H 1 1.2041 . A 56 LEU C C 13 179.3054 . A 56 LEU CA C 13 57.4367 . A 56 LEU CB C 13 41.2870 . A 56 LEU CDx C 13 22.8599 . A 56 LEU CG C 13 26.7176 . A 56 LEU N N 15 118.6590 . A 57 LYS H H 1 8.9142 . A 57 LYS HA H 1 4.5127 . A 57 LYS HBx H 1 1.9852 . A 57 LYS HDy H 1 1.5789 . A 57 LYS C C 13 181.4363 . A 57 LYS CA C 13 60.0043 . A 57 LYS CB C 13 32.4366 . A 57 LYS CE C 13 37.5960 . A 57 LYS N N 15 122.7131 . A 58 ALA H H 1 8.0257 . A 58 ALA HA H 1 4.2099 . A 58 ALA HB% H 1 1.5695 . A 58 ALA C C 13 178.5164 . A 58 ALA CA C 13 55.0693 . A 58 ALA CB C 13 17.9088 . A 58 ALA N N 15 122.4232 . A 59 ALA H H 1 7.4135 . A 59 ALA HA H 1 4.4856 . A 59 ALA HB% H 1 1.7434 . A 59 ALA C C 13 176.7968 . A 59 ALA CA C 13 51.7584 . A 59 ALA CB C 13 19.3691 . A 59 ALA N N 15 118.3475 . A 60 GLY H H 1 7.6940 . A 60 GLY HAy H 1 4.0740 . A 60 GLY HAx H 1 3.6586 . A 60 GLY C C 13 174.7413 . A 60 GLY CA C 13 45.2355 . A 60 GLY N N 15 104.9185 . A 61 PHE H H 1 7.8788 . A 61 PHE HA H 1 4.4946 . A 61 PHE HBy H 1 2.9162 . A 61 PHE HBx H 1 2.4456 . A 61 PHE C C 13 175.2042 . A 61 PHE CA C 13 58.4827 . A 61 PHE CB C 13 39.1633 . A 61 PHE N N 15 118.8621 . A 62 THR H H 1 9.4931 . A 62 THR HA H 1 4.3033 . A 62 THR HB H 1 4.1837 . A 62 THR HG2% H 1 1.2088 . A 62 THR C C 13 173.0734 . A 62 THR CA C 13 69.3886 . A 62 THR CB C 13 62.4782 . A 62 THR CG2 C 13 21.5404 . A 62 THR N N 15 121.3190 . A 63 VAL H H 1 8.2931 . A 63 VAL HA H 1 4.6599 . A 63 VAL HB H 1 1.8980 . A 63 VAL HGx% H 1 0.8110 . A 63 VAL C C 13 177.2667 . A 63 VAL CA C 13 60.0994 . A 63 VAL CB C 13 32.5722 . A 63 VAL CGx C 13 21.6235 . A 63 VAL N N 15 128.4065 . A 64 THR H H 1 8.7704 . A 64 THR HA H 1 4.3503 . A 64 THR CA C 13 62.1824 . A 64 THR CB C 13 69.1430 . A 64 THR N N 15 118.4949 . A 65 ASP HA H 1 4.3015 . A 65 ASP HBx H 1 1.2214 . A 65 ASP C C 13 173.7782 . A 65 ASP CA C 13 54.2873 . A 65 ASP CB C 13 44.0177 . A 66 VAL H H 1 7.8495 . A 66 VAL HA H 1 4.8626 . A 66 VAL HB H 1 1.7851 . A 66 VAL HGx% H 1 0.6837 . A 66 VAL C C 13 176.2344 . A 66 VAL CA C 13 60.5971 . A 66 VAL CB C 13 34.1199 . A 66 VAL CGx C 13 21.5134 . A 66 VAL N N 15 121.7052 . A 67 GLY H H 1 8.1514 . A 67 GLY CA C 13 45.6184 . A 67 GLY N N 15 112.0501 . A 68 ASN HBx H 1 2.7646 . A 68 ASN C C 13 173.7706 . A 68 ASN CA C 13 53.0619 . A 68 ASN CB C 13 39.8318 . A 69 LEU H H 1 8.2763 . A 69 LEU HA H 1 4.5365 . A 69 LEU HBx H 1 1.2458 . A 69 LEU HDx% H 1 0.4585 . A 69 LEU HDy% H 1 0.2642 . A 69 LEU C C 13 174.7512 . A 69 LEU CA C 13 53.9250 . A 69 LEU CB C 13 47.3134 . A 69 LEU CDx C 13 23.5502 . A 69 LEU CDy C 13 24.2952 . A 69 LEU N N 15 121.0028 . A 70 SER H H 1 8.1221 . A 70 SER HBx H 1 3.7291 . A 70 SER C C 13 173.7767 . A 70 SER CA C 13 56.9232 . A 70 SER CB C 13 63.2193 . A 70 SER N N 15 116.2687 . A 71 LEU H H 1 8.2932 . A 71 LEU HA H 1 4.7564 . A 71 LEU HBx H 1 1.6473 . A 71 LEU HG H 1 1.3906 . A 71 LEU CA C 13 52.1646 . A 71 LEU CB C 13 44.1789 . A 71 LEU N N 15 127.9994 . A 72 PRO HA H 1 4.3596 . A 72 PRO HBy H 1 2.2821 . A 72 PRO HDy H 1 3.5479 . A 72 PRO HGx H 1 1.9169 . A 72 PRO C C 13 176.9223 . A 72 PRO CA C 13 64.2439 . A 72 PRO CB C 13 32.4658 . A 72 PRO CD C 13 50.3490 . A 72 PRO CG C 13 26.9671 . A 73 ASP H H 1 8.4309 . A 73 ASP HA H 1 4.5575 . A 73 ASP HBy H 1 2.8126 . A 73 ASP HBx H 1 2.5740 . A 73 ASP C C 13 175.8086 . A 73 ASP CA C 13 55.1450 . A 73 ASP CB C 13 40.7784 . A 73 ASP N N 15 115.1063 . A 74 VAL H H 1 7.4678 . A 74 VAL HA H 1 3.9663 . A 74 VAL HB H 1 1.9122 . A 74 VAL HGx% H 1 0.9861 . A 74 VAL C C 13 175.3386 . A 74 VAL CA C 13 63.8707 . A 74 VAL CB C 13 32.0754 . A 74 VAL CGx C 13 21.9056 . A 74 VAL N N 15 122.2180 . A 75 ALA H H 1 8.5808 . A 75 ALA HA H 1 4.4248 . A 75 ALA HB% H 1 1.4051 . A 75 ALA C C 13 176.4039 . A 75 ALA CA C 13 52.4268 . A 75 ALA CB C 13 20.4713 . A 75 ALA N N 15 128.6295 . A 76 ALA H H 1 7.4384 . A 76 ALA HA H 1 4.6573 . A 76 ALA HB% H 1 1.3243 . A 76 ALA C C 13 175.9252 . A 76 ALA CA C 13 50.9948 . A 76 ALA CB C 13 22.3653 . A 76 ALA N N 15 120.4815 . A 77 THR H H 1 8.3901 . A 77 THR HA H 1 4.7335 . A 77 THR HB H 1 4.1104 . A 77 THR HG2% H 1 1.1946 . A 77 THR C C 13 174.1430 . A 77 THR CA C 13 63.9142 . A 77 THR CB C 13 70.0703 . A 77 THR CG2 C 13 20.7980 . A 77 THR N N 15 121.4636 . A 78 THR H H 1 8.3547 . A 78 THR HA H 1 4.6444 . A 78 THR HB H 1 3.4838 . A 78 THR HG2% H 1 0.4610 . A 78 THR C C 13 181.6836 . A 78 THR CA C 13 62.5106 . A 78 THR CB C 13 72.8463 . A 78 THR CG2 C 13 20.7533 . A 78 THR N N 15 123.5383 . A 79 VAL H H 1 8.6847 . A 79 VAL HA H 1 4.5962 . A 79 VAL HB H 1 2.0863 . A 79 VAL HGx% H 1 0.9546 . A 79 VAL HGy% H 1 0.6918 . A 79 VAL C C 13 173.7016 . A 79 VAL CA C 13 60.3850 . A 79 VAL CB C 13 33.0886 . A 79 VAL CGx C 13 21.7925 . A 79 VAL N N 15 126.4548 . A 80 TYR H H 1 9.7016 . A 80 TYR HA H 1 6.3999 . A 80 TYR HBx H 1 2.7220 . A 80 TYR C C 13 176.4103 . A 80 TYR CA C 13 56.6085 . A 80 TYR CB C 13 42.5671 . A 80 TYR N N 15 123.5738 . A 81 TYR H H 1 8.2212 . A 81 TYR HA H 1 5.4742 . A 81 TYR HBy H 1 3.0988 . A 81 TYR HBx H 1 2.6736 . A 81 TYR C C 13 173.2373 . A 81 TYR CA C 13 55.4982 . A 81 TYR CB C 13 42.2493 . A 81 TYR N N 15 117.7543 . A 82 THR H H 1 8.2451 . A 82 THR HA H 1 4.7242 . A 82 THR HB H 1 4.3760 . A 82 THR HG2% H 1 1.1775 . A 82 THR C C 13 174.5213 . A 82 THR CA C 13 60.8958 . A 82 THR CB C 13 71.5064 . A 82 THR CG2 C 13 21.6350 . A 82 THR N N 15 111.0556 . A 83 GLU H H 1 8.7722 . A 83 GLU HA H 1 4.4770 . A 83 GLU HBx H 1 1.9890 . A 83 GLU HGx H 1 2.3534 . A 83 GLU C C 13 176.1518 . A 83 GLU CA C 13 57.1787 . A 83 GLU CB C 13 28.7139 . A 83 GLU CG C 13 36.5667 . A 83 GLU N N 15 117.0584 . A 84 VAL H H 1 7.8180 . A 84 VAL HA H 1 3.8942 . A 84 VAL HB H 1 1.8335 . A 84 VAL HGx% H 1 1.0192 . A 84 VAL C C 13 177.1702 . A 84 VAL CA C 13 63.6778 . A 84 VAL CB C 13 32.4736 . A 84 VAL CGy C 13 22.3767 . A 84 VAL CGx C 13 21.3133 . A 84 VAL N N 15 123.0392 . A 85 GLU H H 1 8.7963 . A 85 GLU HA H 1 3.8917 . A 85 GLU CA C 13 59.0046 . A 85 GLU CB C 13 29.5231 . A 85 GLU N N 15 129.3514 . A 86 GLY HAy H 1 4.4042 . A 86 GLY HAx H 1 3.8700 . A 86 GLY C C 13 176.3209 . A 86 GLY CA C 13 45.8757 . A 87 GLU H H 1 8.1326 . A 87 GLU HA H 1 3.9480 . A 87 GLU HBx H 1 2.0620 . A 87 GLU HGx H 1 2.2746 . A 87 GLU HGy H 1 2.5242 . A 87 GLU C C 13 178.2756 . A 87 GLU CA C 13 61.7622 . A 87 GLU CB C 13 30.0962 . A 87 GLU CG C 13 36.1258 . A 87 GLU N N 15 121.7731 . A 88 ARG H H 1 9.1315 . A 88 ARG HA H 1 3.3617 . A 88 ARG HBx H 1 1.6851 . A 88 ARG HDy H 1 2.4619 . A 88 ARG HGy H 1 1.4425 . A 88 ARG HGx H 1 0.7540 . A 88 ARG C C 13 177.2294 . A 88 ARG CA C 13 59.4926 . A 88 ARG CB C 13 29.0595 . A 88 ARG CD C 13 41.3396 . A 88 ARG CG C 13 26.1917 . A 88 ARG N N 15 121.4659 . A 89 ALA H H 1 8.3882 . A 89 ALA HA H 1 4.1827 . A 89 ALA HB% H 1 1.4541 . A 89 ALA C C 13 181.9491 . A 89 ALA CA C 13 55.2820 . A 89 ALA CB C 13 18.1284 . A 89 ALA N N 15 119.5273 . A 90 THR H H 1 7.6399 . A 90 THR HA H 1 4.1465 . A 90 THR HB H 1 4.2857 . A 90 THR HG2% H 1 1.2964 . A 90 THR C C 13 175.1184 . A 90 THR CA C 13 66.6066 . A 90 THR CB C 13 68.9710 . A 90 THR CG2 C 13 21.1173 . A 90 THR N N 15 115.2795 . A 91 ALA H H 1 9.0945 . A 91 ALA HA H 1 3.7694 . A 91 ALA HB% H 1 1.4826 . A 91 ALA C C 13 178.5458 . A 91 ALA CA C 13 55.5519 . A 91 ALA CB C 13 19.2535 . A 91 ALA N N 15 124.7837 . A 92 ASP H H 1 8.8976 . A 92 ASP HA H 1 4.4167 . A 92 ASP HBx H 1 2.6357 . A 92 ASP C C 13 179.0534 . A 92 ASP CA C 13 57.6420 . A 92 ASP CB C 13 40.4288 . A 92 ASP N N 15 118.3103 . A 93 ALA H H 1 7.4240 . A 93 ALA HA H 1 4.2740 . A 93 ALA HB% H 1 1.8717 . A 93 ALA C C 13 180.9329 . A 93 ALA CA C 13 55.5748 . A 93 ALA CB C 13 18.1759 . A 93 ALA N N 15 122.9801 . A 94 VAL H H 1 8.8078 . A 94 VAL HA H 1 2.9442 . A 94 VAL HB H 1 1.9748 . A 94 VAL HGx% H 1 0.5596 . A 94 VAL HGy% H 1 0.0751 . A 94 VAL C C 13 178.2689 . A 94 VAL CA C 13 66.3993 . A 94 VAL CB C 13 30.7030 . A 94 VAL CGx C 13 22.8117 . A 94 VAL N N 15 123.9676 . A 95 GLY H H 1 9.3549 . A 95 GLY HAy H 1 3.7042 . A 95 GLY HAx H 1 3.5121 . A 95 GLY C C 13 176.4403 . A 95 GLY CA C 13 47.9194 . A 95 GLY N N 15 108.2816 . A 96 ARG H H 1 8.1124 . A 96 ARG HA H 1 4.2030 . A 96 ARG HBx H 1 1.9911 . A 96 ARG HDy H 1 3.2702 . A 96 ARG HGx H 1 1.6805 . A 96 ARG C C 13 179.1011 . A 96 ARG CA C 13 59.2102 . A 96 ARG CB C 13 30.5344 . A 96 ARG CD C 13 43.4140 . A 96 ARG CG C 13 27.9348 . A 96 ARG N N 15 120.8522 . A 97 THR H H 1 7.8545 . A 97 THR HA H 1 3.9863 . A 97 THR HB H 1 4.3461 . A 97 THR HG2% H 1 1.2200 . A 97 THR C C 13 175.4506 . A 97 THR CA C 13 66.8674 . A 97 THR CB C 13 68.2051 . A 97 THR CG2 C 13 20.9422 . A 97 THR N N 15 117.1699 . A 98 LEU H H 1 7.8548 . A 98 LEU HA H 1 4.3053 . A 98 LEU HBx H 1 1.5044 . A 98 LEU HDx% H 1 0.7613 . A 98 LEU HDy% H 1 0.5610 . A 98 LEU HG H 1 1.7331 . A 98 LEU C C 13 177.5371 . A 98 LEU CA C 13 54.5826 . A 98 LEU CB C 13 43.3728 . A 98 LEU CDx C 13 21.3626 . A 98 LEU CG C 13 26.2672 . A 98 LEU N N 15 115.2938 . A 99 GLY H H 1 8.1015 . A 99 GLY HAx H 1 3.9109 . A 99 GLY C C 13 173.9968 . A 99 GLY CA C 13 46.9928 . A 99 GLY N N 15 111.9311 . A 100 ALA H H 1 8.0333 . A 100 ALA HA H 1 4.7368 . A 100 ALA HB% H 1 1.1425 . A 100 ALA C C 13 175.3509 . A 100 ALA CA C 13 50.4064 . A 100 ALA CB C 13 23.9586 . A 100 ALA N N 15 121.7390 . A 101 ALA H H 1 7.7817 . A 101 ALA HA H 1 4.2092 . A 101 ALA HB% H 1 1.4514 . A 101 ALA C C 13 175.1795 . A 101 ALA CA C 13 52.7374 . A 101 ALA CB C 13 19.8140 . A 101 ALA N N 15 122.8946 . A 102 VAL H H 1 7.8715 . A 102 VAL HA H 1 5.0541 . A 102 VAL HB H 1 1.9496 . A 102 VAL HGx% H 1 0.9045 . A 102 VAL C C 13 176.5872 . A 102 VAL CA C 13 60.9880 . A 102 VAL CB C 13 33.7255 . A 102 VAL CGx C 13 21.9768 . A 102 VAL N N 15 120.0349 . A 103 GLU H H 1 9.2150 . A 103 GLU HA H 1 4.8786 . A 103 GLU HBx H 1 1.5986 . A 103 GLU HGx H 1 2.1833 . A 103 GLU C C 13 174.3432 . A 103 GLU CA C 13 54.3506 . A 103 GLU CB C 13 35.5951 . A 103 GLU CG C 13 37.2447 . A 103 GLU N N 15 126.4685 . A 104 LEU H H 1 8.2731 . A 104 LEU HA H 1 3.5914 . A 104 LEU HBx H 1 1.4199 . A 104 LEU HDx% H 1 0.7843 . A 104 LEU C C 13 178.3785 . A 104 LEU CA C 13 54.9205 . A 104 LEU CB C 13 42.9100 . A 104 LEU CDx C 13 24.9262 . A 104 LEU CG C 13 26.8805 . A 104 LEU N N 15 123.1088 . A 105 ARG H H 1 8.3001 . A 105 ARG HA H 1 4.2614 . A 105 ARG C C 13 177.0435 . A 105 ARG CA C 13 59.3096 . A 105 ARG CB C 13 32.0767 . A 105 ARG N N 15 119.7896 . A 106 LEU H H 1 8.0260 . A 106 LEU HA H 1 4.3980 . A 106 LEU HBx H 1 2.0583 . A 106 LEU HDx% H 1 0.9333 . A 106 LEU HG H 1 1.5695 . A 106 LEU CA C 13 54.7007 . A 106 LEU CB C 13 42.4692 . A 106 LEU N N 15 122.4314 . A 107 PRO HA H 1 4.2388 . A 107 PRO HBy H 1 2.3482 . A 107 PRO HGy H 1 2.1168 . A 107 PRO HGx H 1 1.9147 . A 107 PRO C C 13 179.6272 . A 107 PRO CA C 13 65.8977 . A 107 PRO CB C 13 31.5192 . A 107 PRO CD C 13 37.0759 . A 107 PRO CG C 13 27.7849 . A 108 GLU H H 1 9.6049 . A 108 GLU HA H 1 4.0983 . A 108 GLU HBx H 1 1.8805 . A 108 GLU HGx H 1 2.2620 . A 108 GLU C C 13 176.9566 . A 108 GLU CA C 13 59.5841 . A 108 GLU CB C 13 29.1571 . A 108 GLU CG C 13 35.7086 . A 108 GLU N N 15 116.7443 . A 109 LEU H H 1 7.6301 . A 109 LEU HA H 1 4.5298 . A 109 LEU HBx H 1 1.3854 . A 109 LEU HDx% H 1 0.2409 . A 109 LEU HDy% H 1 0.6205 . A 109 LEU HG H 1 1.1663 . A 109 LEU C C 13 177.8943 . A 109 LEU CA C 13 53.4892 . A 109 LEU CB C 13 42.2407 . A 109 LEU CDx C 13 22.6151 . A 109 LEU CG C 13 26.3798 . A 109 LEU N N 15 116.5746 . A 110 SER H H 1 7.7566 . A 110 SER HA H 1 3.9430 . A 110 SER HBx H 1 4.0051 . A 110 SER C C 13 174.2729 . A 110 SER CA C 13 59.5428 . A 110 SER CB C 13 63.6089 . A 110 SER N N 15 117.0308 . A 111 ASP H H 1 8.3146 . A 111 ASP HA H 1 4.5822 . A 111 ASP HBx H 1 2.6505 . A 111 ASP C C 13 176.7604 . A 111 ASP CA C 13 53.9758 . A 111 ASP CB C 13 40.1832 . A 111 ASP N N 15 117.8041 . A 112 GLN H H 1 7.2120 . A 112 GLN HA H 1 4.2995 . A 112 GLN HBx H 1 1.9190 . A 112 GLN HGx H 1 2.1742 . A 112 GLN CA C 13 55.0135 . A 112 GLN CB C 13 26.5681 . A 112 GLN N N 15 119.2998 . A 114 PRO HA H 1 4.5265 . A 114 PRO HBy H 1 2.4331 . A 114 PRO HDy H 1 1.8947 . A 114 PRO HGx H 1 2.1105 . A 114 PRO C C 13 175.4643 . A 114 PRO CA C 13 64.0691 . A 114 PRO CB C 13 32.4468 . A 114 PRO CD C 13 50.9801 . A 114 PRO CG C 13 27.6852 . A 115 GLY H H 1 8.4429 . A 115 GLY HAy H 1 4.3910 . A 115 GLY HAx H 1 3.7768 . A 115 GLY C C 13 173.5524 . A 115 GLY CA C 13 43.9525 . A 115 GLY N N 15 113.8174 . A 116 VAL H H 1 8.9567 . A 116 VAL HA H 1 4.1309 . A 116 VAL HB H 1 2.0636 . A 116 VAL HGx% H 1 1.1034 . A 116 VAL HGy% H 1 0.8867 . A 116 VAL C C 13 174.5328 . A 116 VAL CA C 13 63.9159 . A 116 VAL CB C 13 32.3419 . A 116 VAL CGy C 13 24.3442 . A 116 VAL CGx C 13 22.1001 . A 116 VAL N N 15 122.0489 . A 117 ILE H H 1 7.8634 . A 117 ILE HA H 1 4.9385 . A 117 ILE HB H 1 1.8164 . A 117 ILE HG21 H 1 0.7558 . A 117 ILE HG22 H 1 1.0482 . A 117 ILE HG23 H 1 1.0482 . A 117 ILE C C 13 174.1808 . A 117 ILE CA C 13 60.0691 . A 117 ILE CB C 13 42.3684 . A 117 ILE CD1 C 13 14.4247 . A 117 ILE CG1 C 13 27.7748 . A 117 ILE CG2 C 13 17.9695 . A 117 ILE N N 15 126.1018 . A 118 VAL H H 1 9.3476 . A 118 VAL HA H 1 4.9244 . A 118 VAL HB H 1 1.9691 . A 118 VAL HGx% H 1 0.7101 . A 118 VAL C C 13 175.2239 . A 118 VAL CA C 13 60.5797 . A 118 VAL CB C 13 33.9453 . A 118 VAL CGy C 13 22.6826 . A 118 VAL CGx C 13 21.1421 . A 118 VAL N N 15 127.6655 . A 119 VAL H H 1 9.0963 . A 119 VAL HA H 1 5.5632 . A 119 VAL HB H 1 2.2524 . A 119 VAL HGx% H 1 1.2495 . A 119 VAL HGy% H 1 1.0225 . A 119 VAL C C 13 174.4255 . A 119 VAL CA C 13 58.6911 . A 119 VAL CB C 13 32.8860 . A 119 VAL CGy C 13 22.1073 . A 119 VAL CGx C 13 21.1567 . A 119 VAL N N 15 121.8281 . A 120 VAL H H 1 8.8095 . A 120 VAL HA H 1 4.8179 . A 120 VAL HB H 1 2.0425 . A 120 VAL HGx% H 1 0.8922 . A 120 VAL C C 13 175.6486 . A 120 VAL CA C 13 60.6308 . A 120 VAL CB C 13 34.5499 . A 120 VAL CGx C 13 21.8473 . A 120 VAL N N 15 120.2605 . A 121 THR H H 1 7.8590 . A 121 THR HA H 1 4.4276 . A 121 THR HB H 1 4.3356 . A 121 THR HG2% H 1 0.8118 . A 121 THR C C 13 173.8332 . A 121 THR CA C 13 60.8340 . A 121 THR CB C 13 69.4132 . A 121 THR CG2 C 13 21.1694 . A 121 THR N N 15 114.5636 . A 122 GLY H H 1 7.5080 . A 122 GLY HAx H 1 3.7906 . A 122 GLY CA C 13 46.4640 . A 122 GLY N N 15 115.3693 . stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 34 ARG H A 34 ARG HGx 1.0 1.8 6.33 2 1 A 34 ARG H A 34 ARG HGy 1.0 1.8 6.33 3 2 A 35 ALA H A 34 ARG HGx 1.0 1.8 6.33 4 2 A 34 ARG HGy A 35 ALA H 1.0 1.8 6.33 5 3 A 36 GLU H A 36 GLU HGx 1.0 1.8 6.33 6 3 A 36 GLU H A 36 GLU HGy 1.0 1.8 6.33 7 4 A 38 ARG H A 38 ARG HGx 1.0 1.8 6.33 8 4 A 38 ARG H A 38 ARG HGy 1.0 1.8 6.33 9 5 A 38 ARG H A 38 ARG HH1% 1.0 1.8 6.33 10 6 A 40 TYR H A 40 TYR HDx 1.0 1.8 6.33 11 6 A 40 TYR H A 40 TYR HDy 1.0 1.8 6.33 12 7 A 45 THR H A 45 THR HG2% 1.0 1.8 6.33 13 8 A 48 ALA H A 48 ALA HA 1.0 1.8 3.22 14 9 A 50 ALA H A 50 ALA HA 1.0 1.8 3.22 15 10 A 51 ARG H A 51 ARG HDx 1.0 1.8 6.33 16 10 A 51 ARG H A 51 ARG HDy 1.0 1.8 6.33 17 11 A 51 ARG H A 51 ARG HGx 1.0 1.8 6.33 18 11 A 51 ARG H A 51 ARG HGy 1.0 1.8 6.33 19 12 A 51 ARG H A 51 ARG HA 1.0 1.8 3.22 20 13 A 52 THR H A 52 THR HA 1.0 1.8 3.22 21 14 A 52 THR H A 52 THR HG2% 1.0 1.8 6.33 22 15 A 53 ALA H A 53 ALA HA 1.0 1.8 3.22 23 16 A 54 ASP H A 54 ASP HA 1.0 1.8 3.22 24 17 A 55 ARG H A 55 ARG HA 1.0 1.8 3.22 25 18 A 56 LEU H A 56 LEU HA 1.0 1.8 3.22 26 19 A 56 LEU H A 56 LEU HD21 1.0 1.8 6.33 27 19 A 56 LEU H A 56 LEU HDx% 1.0 1.8 6.33 28 20 A 56 LEU H A 56 LEU HG 1.0 1.8 6.33 29 21 A 62 THR H A 62 THR HG2% 1.0 1.8 6.33 30 22 A 64 THR H A 64 THR HG21 1.0 1.8 6.33 31 23 A 69 LEU H A 69 LEU HDx% 1.0 1.8 6.33 32 23 A 69 LEU H A 69 LEU HDy% 1.0 1.8 6.33 33 24 A 69 LEU H A 69 LEU HG 1.0 1.8 6.33 34 25 A 71 LEU H A 71 LEU HG 1.0 1.8 6.33 35 26 A 77 THR H A 77 THR HG2% 1.0 1.8 6.33 36 27 A 78 THR H A 78 THR HG2% 1.0 1.8 6.33 37 28 A 80 TYR H A 80 TYR HD% 1.0 1.8 6.33 38 29 A 81 TYR H A 81 TYR HD% 1.0 1.8 6.33 39 30 A 82 THR HG2% A 82 THR H 1.0 1.8 6.33 40 31 A 87 GLU H A 87 GLU HA 1.0 1.8 3.22 41 32 A 87 GLU H A 87 GLU HGx 1.0 1.8 6.33 42 32 A 87 GLU H A 87 GLU HGy 1.0 1.8 6.33 43 33 A 88 ARG H A 88 ARG HA 1.0 1.8 3.22 44 34 A 89 ALA H A 89 ALA HA 1.0 1.8 3.22 45 35 A 90 THR H A 90 THR HA 1.0 1.8 3.22 46 36 A 90 THR H A 90 THR HG2% 1.0 1.8 6.33 47 37 A 91 ALA H A 91 ALA HA 1.0 1.8 3.22 48 38 A 92 ASP H A 92 ASP HA 1.0 1.8 3.22 49 39 A 93 ALA H A 93 ALA HA 1.0 1.8 3.22 50 40 A 94 VAL H A 94 VAL HA 1.0 1.8 3.22 51 41 A 95 GLY H A 95 GLY HAx 1.0 1.8 3.22 52 41 A 95 GLY H A 95 GLY HAy 1.0 1.8 3.22 53 42 A 96 ARG H A 96 ARG HA 1.0 1.8 3.22 54 43 A 96 ARG H A 96 ARG HGx 1.0 1.8 6.33 55 43 A 96 ARG H A 96 ARG HGy 1.0 1.8 6.33 56 44 A 96 ARG H A 96 ARG HDx 1.0 1.8 6.33 57 44 A 96 ARG H A 96 ARG HDy 1.0 1.8 6.33 58 45 A 97 THR H A 97 THR HA 1.0 1.8 3.22 59 46 A 97 THR H A 97 THR HG2% 1.0 1.8 6.33 60 47 A 98 LEU H A 98 LEU HA 1.0 1.8 3.22 61 48 A 98 LEU H A 98 LEU HG 1.0 1.8 6.33 62 49 A 98 LEU H A 98 LEU HDy% 1.0 1.8 6.33 63 49 A 98 LEU H A 98 LEU HDx% 1.0 1.8 6.33 64 50 A 103 GLU H A 103 GLU HGx 1.0 1.8 6.33 65 50 A 103 GLU H A 103 GLU HGy 1.0 1.8 6.33 66 51 A 104 LEU H A 104 LEU HDx% 1.0 1.8 6.33 67 51 A 104 LEU H A 104 LEU HD21 1.0 1.8 6.33 68 52 A 104 LEU H A 106 LEU HG 1.0 1.8 6.33 69 53 A 104 LEU H A 104 LEU HG 1.0 1.8 6.33 70 54 A 108 GLU H A 108 GLU HA 1.0 1.8 3.22 71 55 A 108 GLU H A 108 GLU HGx 1.0 1.8 6.33 72 55 A 108 GLU H A 108 GLU HGy 1.0 1.8 6.33 73 56 A 109 LEU H A 109 LEU HG 1.0 1.8 6.33 74 57 A 109 LEU H A 109 LEU HDx% 1.0 1.8 6.33 75 57 A 109 LEU H A 109 LEU HDy% 1.0 1.8 6.33 76 58 A 109 LEU H A 109 LEU HA 1.0 1.8 3.22 77 59 A 110 SER H A 110 SER HA 1.0 1.8 3.22 78 60 A 112 GLN H A 112 GLN HE2y 1.0 1.8 6.33 79 60 A 112 GLN H A 112 GLN HE2x 1.0 1.8 6.33 80 61 A 121 THR H A 121 THR HG2% 1.0 1.8 6.33 81 62 A 37 VAL H A 38 ARG HA 1.0 1.8 6.33 82 63 A 38 ARG H A 39 VAL HGy% 1.0 1.8 6.33 83 63 A 38 ARG H A 39 VAL HGx% 1.0 1.8 6.33 84 64 A 40 TYR H A 39 VAL H 1.0 1.8 4.83 85 65 A 40 TYR H A 39 VAL HGy% 1.0 1.8 6.33 86 65 A 40 TYR H A 39 VAL HGx% 1.0 1.8 6.33 87 66 A 39 VAL HGx% A 41 ASN H 1.0 1.8 6.33 88 67 A 41 ASN H A 40 TYR HDx 1.0 1.8 6.33 89 67 A 41 ASN H A 40 TYR HDy 1.0 1.8 6.33 90 68 A 41 ASN H A 42 ILE H 1.0 1.8 5.75 91 69 A 42 ILE H A 41 ASN HA 1.0 1.8 2.53 92 70 A 42 ILE H A 41 ASN HBy 1.0 1.8 6.33 93 71 A 42 ILE H A 41 ASN HBx 1.0 1.8 6.33 94 72 A 41 ASN HA A 43 SER H 1.0 1.8 6.33 95 73 A 43 SER H A 41 ASN HBx 1.0 1.8 6.33 96 73 A 43 SER H A 41 ASN HBy 1.0 1.8 6.33 97 74 A 45 THR H A 41 ASN HD2x 1.0 1.8 6.33 98 75 A 45 THR H A 41 ASN HD2y 1.0 1.8 6.33 99 76 A 43 SER H A 42 ILE HB 1.0 1.8 6.33 100 77 A 42 ILE H A 43 SER HBx 1.0 1.8 6.33 101 77 A 42 ILE H A 43 SER HBy 1.0 1.8 6.33 102 78 A 43 SER H A 42 ILE HG2% 1.0 1.8 6.33 103 79 A 43 SER H A 42 ILE HD1% 1.0 1.8 6.33 104 80 A 42 ILE H A 43 SER H 1.0 1.8 3.30 105 81 A 43 SER H A 45 THR HB 1.0 1.8 6.33 106 82 A 48 ALA HA A 51 ARG H 1.0 1.8 3.91 107 83 A 52 THR H A 49 ALA HA 1.0 1.8 3.91 108 84 A 50 ALA HA A 51 ARG H 1.0 1.8 4.03 109 85 A 52 THR H A 50 ALA HB% 1.0 1.8 6.33 110 86 A 50 ALA HA A 52 THR H 1.0 1.8 5.06 111 87 A 50 ALA HA A 53 ALA H 1.0 1.8 3.91 112 88 A 51 ARG H A 53 ALA H 1.0 1.8 4.60 113 89 A 53 ALA H A 51 ARG HBx 1.0 1.8 6.33 114 89 A 53 ALA H A 51 ARG HBy 1.0 1.8 6.33 115 90 A 52 THR H A 51 ARG HGx 1.0 1.8 6.33 116 90 A 51 ARG HGy A 52 THR H 1.0 1.8 6.33 117 91 A 52 THR H A 51 ARG HDx 1.0 1.8 6.33 118 91 A 51 ARG HDy A 52 THR H 1.0 1.8 6.33 119 92 A 51 ARG H A 52 THR H 1.0 1.8 3.22 120 93 A 51 ARG H A 54 ASP H 1.0 1.8 5.64 121 94 A 51 ARG HA A 54 ASP H 1.0 1.8 3.91 122 95 A 54 ASP H A 51 ARG HDx 1.0 1.8 6.33 123 95 A 51 ARG HDy A 54 ASP H 1.0 1.8 6.33 124 96 A 55 ARG H A 51 ARG HDx 1.0 1.8 6.33 125 96 A 51 ARG HDy A 55 ARG H 1.0 1.8 6.33 126 97 A 52 THR H A 54 ASP H 1.0 1.8 4.60 127 98 A 53 ALA H A 52 THR HB 1.0 1.8 6.33 128 99 A 52 THR HG2% A 53 ALA H 1.0 1.8 6.33 129 100 A 52 THR H A 53 ALA H 1.0 1.8 3.22 130 101 A 53 ALA HA A 54 ASP H 1.0 1.8 4.03 131 102 A 53 ALA H A 54 ASP H 1.0 1.8 3.22 132 103 A 53 ALA H A 55 ARG H 1.0 1.8 4.60 133 104 A 53 ALA HA A 56 LEU H 1.0 1.8 3.91 134 105 A 53 ALA HA A 57 LYS H 1.0 1.8 4.83 135 106 A 54 ASP H A 55 ARG H 1.0 1.8 3.22 136 107 A 54 ASP HA A 55 ARG H 1.0 1.8 4.03 137 108 A 54 ASP H A 55 ARG HBx 1.0 1.8 6.33 138 108 A 54 ASP H A 55 ARG HBy 1.0 1.8 6.33 139 109 A 54 ASP H A 56 LEU HDx% 1.0 1.8 6.33 140 110 A 56 LEU H A 54 ASP HBx 1.0 1.8 6.33 141 110 A 56 LEU H A 54 ASP HBy 1.0 1.8 6.33 142 111 A 57 LYS H A 54 ASP HBx 1.0 1.8 6.33 143 111 A 57 LYS H A 54 ASP HBy 1.0 1.8 6.33 144 112 A 55 ARG H A 57 LYS H 1.0 1.8 4.60 145 113 A 55 ARG H A 54 ASP HBx 1.0 1.8 6.33 146 113 A 55 ARG H A 54 ASP HBy 1.0 1.8 6.33 147 114 A 55 ARG HA A 56 LEU H 1.0 1.8 4.03 148 115 A 55 ARG H A 56 LEU HD21 1.0 1.8 6.33 149 115 A 55 ARG H A 56 LEU HDx% 1.0 1.8 6.33 150 116 A 55 ARG H A 56 LEU H 1.0 1.8 3.22 151 117 A 55 ARG HA A 57 LYS H 1.0 1.8 5.06 152 118 A 55 ARG H A 58 ALA H 1.0 1.8 5.64 153 119 A 55 ARG HA A 58 ALA H 1.0 1.8 3.91 154 120 A 55 ARG H A 58 ALA HB% 1.0 1.8 6.33 155 121 A 56 LEU H A 58 ALA H 1.0 1.8 4.60 156 122 A 56 LEU H A 57 LYS H 1.0 1.8 3.22 157 123 A 56 LEU HA A 57 LYS H 1.0 1.8 4.03 158 124 A 56 LEU HA A 58 ALA H 1.0 1.8 5.18 159 125 A 58 ALA H A 56 LEU HBx 1.0 1.8 6.33 160 125 A 58 ALA H A 56 LEU HBy 1.0 1.8 6.33 161 126 A 56 LEU HA A 59 ALA H 1.0 1.8 3.91 162 127 A 56 LEU HDx% A 59 ALA H 1.0 1.8 6.33 163 128 A 56 LEU H A 59 ALA HB% 1.0 1.8 6.33 164 129 A 56 LEU HG A 57 LYS H 1.0 1.8 6.33 165 130 A 56 LEU HDx% A 57 LYS H 1.0 1.8 6.33 166 131 A 57 LYS H A 56 LEU HD21 1.0 1.8 6.33 167 132 A 56 LEU HG A 59 ALA H 1.0 1.8 6.33 168 133 A 57 LYS H A 59 ALA H 1.0 1.8 5.75 169 134 A 57 LYS H A 58 ALA H 1.0 1.8 3.22 170 135 A 59 ALA H A 57 LYS HBx 1.0 1.8 6.33 171 135 A 59 ALA H A 57 LYS HBy 1.0 1.8 6.33 172 136 A 57 LYS HA A 60 GLY H 1.0 1.8 5.06 173 137 A 61 PHE H A 56 LEU HBx 1.0 1.8 6.33 174 137 A 56 LEU HBy A 61 PHE H 1.0 1.8 6.33 175 138 A 58 ALA H A 59 ALA HB% 1.0 1.8 6.33 176 139 A 58 ALA H A 59 ALA H 1.0 1.8 3.22 177 140 A 59 ALA H A 58 ALA HA 1.0 1.8 4.03 178 141 A 58 ALA HB% A 60 GLY H 1.0 1.8 6.33 179 142 A 60 GLY H A 58 ALA HA 1.0 1.8 5.06 180 143 A 58 ALA H A 60 GLY H 1.0 1.8 5.06 181 144 A 58 ALA H A 61 PHE H 1.0 1.8 6.33 182 145 A 59 ALA H A 61 PHE H 1.0 1.8 5.06 183 146 A 59 ALA H A 60 GLY HAy 1.0 1.8 6.33 184 146 A 59 ALA H A 60 GLY HAx 1.0 1.8 6.33 185 147 A 60 GLY H A 59 ALA HA 1.0 1.8 4.03 186 148 A 59 ALA H A 60 GLY H 1.0 1.8 6.33 187 149 A 59 ALA H A 61 PHE HBx 1.0 1.8 6.33 188 149 A 59 ALA H A 61 PHE HBy 1.0 1.8 6.33 189 150 A 59 ALA HB% A 61 PHE H 1.0 1.8 6.33 190 151 A 60 GLY H A 61 PHE HBx 1.0 1.8 6.33 191 151 A 60 GLY H A 61 PHE HBy 1.0 1.8 6.33 192 152 A 60 GLY H A 61 PHE H 1.0 1.8 3.31 193 153 A 62 THR H A 61 PHE HBx 1.0 1.8 6.33 194 154 A 62 THR H A 61 PHE HBy 1.0 1.8 6.33 195 155 A 62 THR H A 61 PHE H 1.0 1.8 5.28 196 156 A 62 THR H A 61 PHE HD% 1.0 1.8 6.33 197 157 A 61 PHE HA A 63 VAL H 1.0 1.8 6.33 198 158 A 62 THR H A 63 VAL H 1.0 1.8 5.13 199 159 A 62 THR H A 63 VAL HA 1.0 1.8 6.33 200 160 A 62 THR HG2% A 63 VAL H 1.0 1.8 6.33 201 161 A 64 THR H A 63 VAL H 1.0 1.8 4.95 202 162 A 64 THR H A 63 VAL HGx% 1.0 1.8 6.33 203 162 A 64 THR H A 63 VAL HG21 1.0 1.8 6.33 204 163 A 64 THR H A 63 VAL HA 1.0 1.8 2.53 205 164 A 65 ASP HA A 66 VAL H 1.0 1.8 2.53 206 165 A 66 VAL HB A 67 GLY H 1.0 1.8 6.33 207 166 A 67 GLY H A 66 VAL HA 1.0 1.8 2.53 208 167 A 66 VAL H A 67 GLY H 1.0 1.8 4.95 209 168 A 69 LEU H A 68 ASN HA 1.0 1.8 2.99 210 169 A 69 LEU HA A 70 SER H 1.0 1.8 4.03 211 170 A 71 LEU H A 72 PRO HA 1.0 1.8 6.33 212 171 A 71 LEU H A 72 PRO HDx 1.0 1.8 6.33 213 171 A 71 LEU H A 72 PRO HDy 1.0 1.8 6.33 214 172 A 71 LEU HA A 73 ASP H 1.0 1.8 6.33 215 173 A 74 VAL H A 71 LEU HBx 1.0 1.8 6.33 216 173 A 71 LEU HBy A 74 VAL H 1.0 1.8 6.33 217 174 A 73 ASP H A 72 PRO HDx 1.0 1.8 6.33 218 174 A 72 PRO HDy A 73 ASP H 1.0 1.8 6.33 219 175 A 72 PRO HA A 74 VAL H 1.0 1.8 6.33 220 176 A 73 ASP H A 74 VAL HA 1.0 1.8 6.33 221 177 A 73 ASP H A 74 VAL H 1.0 1.8 3.14 222 178 A 73 ASP H A 74 VAL HB 1.0 1.8 6.33 223 179 A 73 ASP H A 75 ALA HB% 1.0 1.8 6.33 224 180 A 74 VAL HA A 75 ALA H 1.0 1.8 4.03 225 181 A 75 ALA H A 74 VAL HG21 1.0 1.8 6.33 226 181 A 75 ALA H A 74 VAL HGx% 1.0 1.8 6.33 227 182 A 71 LEU HG A 74 VAL H 1.0 1.8 6.33 228 183 A 74 VAL HA A 76 ALA H 1.0 1.8 5.06 229 184 A 74 VAL HGx% A 76 ALA H 1.0 1.8 6.33 230 185 A 76 ALA H A 75 ALA HA 1.0 1.8 4.03 231 186 A 75 ALA H A 76 ALA H 1.0 1.8 4.83 232 187 A 77 THR H A 76 ALA H 1.0 1.8 4.95 233 188 A 76 ALA H A 78 THR HB 1.0 1.8 6.33 234 189 A 77 THR HG2% A 78 THR H 1.0 1.8 6.33 235 190 A 78 THR HB A 79 VAL H 1.0 1.8 6.33 236 191 A 78 THR HG2% A 79 VAL H 1.0 1.8 6.33 237 192 A 78 THR H A 79 VAL H 1.0 1.8 4.95 238 193 A 79 VAL H A 78 THR HA 1.0 1.8 2.53 239 194 A 78 THR H A 79 VAL HGy% 1.0 1.8 6.33 240 194 A 78 THR H A 79 VAL HGx% 1.0 1.8 6.33 241 195 A 80 TYR H A 79 VAL HB 1.0 1.8 6.33 242 196 A 80 TYR H A 79 VAL HA 1.0 1.8 2.53 243 197 A 80 TYR H A 79 VAL H 1.0 1.8 4.95 244 198 A 80 TYR H A 81 TYR H 1.0 1.8 4.95 245 199 A 81 TYR H A 80 TYR HA 1.0 1.8 2.53 246 200 A 82 THR H A 81 TYR HA 1.0 1.8 3.68 247 201 A 82 THR H A 83 GLU H 1.0 1.8 5.35 248 202 A 83 GLU H A 82 THR HB 1.0 1.8 6.33 249 203 A 83 GLU H A 84 VAL HG21 1.0 1.8 6.33 250 203 A 83 GLU H A 84 VAL HGx% 1.0 1.8 6.33 251 204 A 83 GLU H A 84 VAL H 1.0 1.8 4.21 252 205 A 82 THR HG2% A 83 GLU H 1.0 1.8 6.33 253 206 A 84 VAL HA A 85 GLU H 1.0 1.8 4.03 254 207 A 85 GLU H A 84 VAL HG21 1.0 1.8 6.33 255 207 A 84 VAL HGx% A 85 GLU H 1.0 1.8 6.33 256 208 A 87 GLU H A 84 VAL HGx% 1.0 1.8 6.33 257 209 A 87 GLU H A 84 VAL HB 1.0 1.8 6.33 258 210 A 84 VAL H A 87 GLU HBx 1.0 1.8 6.33 259 210 A 84 VAL H A 87 GLU HBy 1.0 1.8 6.33 260 211 A 87 GLU H A 86 GLY HAy 1.0 1.8 4.03 261 211 A 87 GLU H A 86 GLY HAx 1.0 1.8 4.03 262 212 A 89 ALA H A 86 GLY HAy 1.0 1.8 3.91 263 212 A 89 ALA H A 86 GLY HAx 1.0 1.8 3.91 264 213 A 87 GLU H A 88 ARG H 1.0 1.8 3.22 265 214 A 87 GLU H A 89 ALA HB% 1.0 1.8 6.33 266 215 A 87 GLU HA A 88 ARG H 1.0 1.8 4.03 267 216 A 88 ARG H A 87 GLU HBy 1.0 1.8 6.33 268 217 A 88 ARG H A 87 GLU HBx 1.0 1.8 6.33 269 218 A 87 GLU H A 88 ARG HBy 1.0 1.8 6.33 270 218 A 87 GLU H A 88 ARG HBx 1.0 1.8 6.33 271 219 A 87 GLU HA A 89 ALA H 1.0 1.8 4.83 272 220 A 89 ALA H A 87 GLU HBx 1.0 1.8 6.33 273 220 A 89 ALA H A 87 GLU HBy 1.0 1.8 6.33 274 221 A 87 GLU HA A 90 THR H 1.0 1.8 3.91 275 222 A 87 GLU HA A 91 ALA H 1.0 1.8 4.83 276 223 A 88 ARG H A 89 ALA H 1.0 1.8 3.22 277 224 A 88 ARG HA A 89 ALA H 1.0 1.8 4.03 278 225 A 89 ALA H A 88 ARG HBy 1.0 1.8 6.33 279 226 A 88 ARG HA A 90 THR H 1.0 1.8 4.83 280 227 A 88 ARG H A 90 THR HG2% 1.0 1.8 6.33 281 228 A 88 ARG HA A 91 ALA H 1.0 1.8 3.91 282 229 A 88 ARG HA A 92 ASP H 1.0 1.8 4.83 283 230 A 89 ALA H A 90 THR H 1.0 1.8 3.22 284 231 A 89 ALA H A 91 ALA H 1.0 1.8 4.86 285 232 A 89 ALA HA A 92 ASP H 1.0 1.8 5.18 286 233 A 93 ALA H A 91 ALA HB% 1.0 1.8 4.83 287 234 A 90 THR H A 91 ALA H 1.0 1.8 3.25 288 235 A 90 THR HA A 91 ALA H 1.0 1.8 4.03 289 236 A 91 ALA H A 90 THR HB 1.0 1.8 6.33 290 237 A 90 THR H A 91 ALA HA 1.0 1.8 6.33 291 238 A 90 THR HG2% A 91 ALA H 1.0 1.8 6.33 292 239 A 90 THR H A 92 ASP H 1.0 1.8 4.60 293 240 A 90 THR HG2% A 92 ASP H 1.0 1.8 6.33 294 241 A 90 THR H A 93 ALA H 1.0 1.8 5.64 295 242 A 90 THR HA A 93 ALA H 1.0 1.8 3.91 296 243 A 90 THR HA A 92 ASP H 1.0 1.8 5.18 297 244 A 90 THR HG2% A 93 ALA H 1.0 1.8 6.33 298 245 A 91 ALA H A 92 ASP H 1.0 1.8 3.22 299 246 A 91 ALA HA A 92 ASP H 1.0 1.8 4.03 300 247 A 91 ALA H A 93 ALA H 1.0 1.8 4.60 301 248 A 91 ALA HA A 93 ALA H 1.0 1.8 4.83 302 249 A 91 ALA H A 94 VAL H 1.0 1.8 5.64 303 250 A 91 ALA HA A 94 VAL H 1.0 1.8 3.91 304 251 A 95 GLY H A 91 ALA HB% 1.0 1.8 6.33 305 252 A 92 ASP H A 93 ALA H 1.0 1.8 3.22 306 253 A 92 ASP H A 93 ALA HB% 1.0 1.8 6.33 307 254 A 92 ASP HA A 93 ALA H 1.0 1.8 4.03 308 255 A 94 VAL H A 92 ASP HBx 1.0 1.8 6.33 309 255 A 94 VAL H A 92 ASP HBy 1.0 1.8 6.33 310 256 A 92 ASP HA A 94 VAL H 1.0 1.8 5.06 311 257 A 92 ASP HA A 95 GLY H 1.0 1.8 3.91 312 258 A 92 ASP HA A 96 ARG H 1.0 1.8 4.83 313 259 A 93 ALA H A 94 VAL H 1.0 1.8 3.22 314 260 A 93 ALA HA A 94 VAL H 1.0 1.8 4.03 315 261 A 93 ALA H A 94 VAL HGy% 1.0 1.8 6.33 316 261 A 93 ALA H A 94 VAL HGx% 1.0 1.8 6.33 317 262 A 93 ALA H A 95 GLY H 1.0 1.8 4.60 318 263 A 93 ALA HA A 95 GLY H 1.0 1.8 5.18 319 264 A 93 ALA H A 96 ARG H 1.0 1.8 5.64 320 265 A 94 VAL H A 95 GLY H 1.0 1.8 3.22 321 266 A 94 VAL HA A 95 GLY H 1.0 1.8 4.03 322 267 A 95 GLY H A 94 VAL HB 1.0 1.8 6.33 323 268 A 95 GLY H A 94 VAL HGy% 1.0 1.8 6.33 324 268 A 95 GLY H A 94 VAL HGx% 1.0 1.8 6.33 325 269 A 94 VAL H A 96 ARG H 1.0 1.8 4.60 326 270 A 96 ARG H A 94 VAL HB 1.0 1.8 6.33 327 271 A 96 ARG H A 94 VAL HGx% 1.0 1.8 6.33 328 272 A 94 VAL HA A 96 ARG H 1.0 1.8 4.83 329 273 A 94 VAL H A 97 THR H 1.0 1.8 5.64 330 274 A 94 VAL HA A 97 THR H 1.0 1.8 4.03 331 275 A 97 THR H A 94 VAL HGy% 1.0 1.8 6.33 332 276 A 94 VAL HA A 98 LEU H 1.0 1.8 4.83 333 277 A 98 LEU H A 94 VAL HGx% 1.0 1.8 6.33 334 278 A 95 GLY H A 96 ARG H 1.0 1.8 3.22 335 279 A 96 ARG H A 95 GLY HAx 1.0 1.8 4.03 336 279 A 95 GLY HAy A 96 ARG H 1.0 1.8 4.03 337 280 A 95 GLY H A 97 THR H 1.0 1.8 4.83 338 281 A 97 THR H A 95 GLY HAx 1.0 1.8 5.06 339 281 A 95 GLY HAy A 97 THR H 1.0 1.8 5.06 340 282 A 95 GLY HAy A 98 LEU H 1.0 1.8 4.03 341 283 A 98 LEU H A 95 GLY HAx 1.0 1.8 6.33 342 284 A 99 GLY H A 95 GLY HAx 1.0 1.8 5.18 343 285 A 95 GLY HAy A 99 GLY H 1.0 1.8 5.18 344 286 A 96 ARG H A 97 THR H 1.0 1.8 3.22 345 287 A 96 ARG HA A 97 THR H 1.0 1.8 4.03 346 288 A 97 THR H A 96 ARG HGx 1.0 1.8 6.33 347 288 A 96 ARG HGy A 97 THR H 1.0 1.8 6.33 348 289 A 96 ARG H A 97 THR HA 1.0 1.8 6.33 349 290 A 98 LEU H A 94 VAL HB 1.0 1.8 6.33 350 291 A 99 GLY H A 96 ARG HBx 1.0 1.8 6.33 351 291 A 99 GLY H A 96 ARG HBy 1.0 1.8 6.33 352 292 A 96 ARG HA A 99 GLY H 1.0 1.8 5.18 353 293 A 97 THR HG2% A 98 LEU H 1.0 1.8 6.33 354 294 A 97 THR H A 98 LEU HDy% 1.0 1.8 6.33 355 294 A 97 THR H A 98 LEU HDx% 1.0 1.8 6.33 356 295 A 97 THR H A 98 LEU HA 1.0 1.8 6.33 357 296 A 98 LEU H A 99 GLY H 1.0 1.8 3.23 358 297 A 98 LEU HG A 99 GLY H 1.0 1.8 6.33 359 298 A 99 GLY H A 98 LEU HDy% 1.0 1.8 6.33 360 298 A 98 LEU HDx% A 99 GLY H 1.0 1.8 6.33 361 299 A 100 ALA H A 98 LEU HBx 1.0 1.8 6.33 362 299 A 98 LEU HBy A 100 ALA H 1.0 1.8 6.33 363 300 A 98 LEU HG A 100 ALA H 1.0 1.8 6.33 364 301 A 100 ALA H A 98 LEU HDy% 1.0 1.8 6.33 365 302 A 98 LEU HA A 100 ALA H 1.0 1.8 6.33 366 303 A 99 GLY H A 100 ALA HB% 1.0 1.8 6.33 367 304 A 100 ALA H A 101 ALA H 1.0 1.8 4.97 368 305 A 101 ALA H A 100 ALA HA 1.0 1.8 3.11 369 306 A 101 ALA HA A 102 VAL H 1.0 1.8 2.53 370 307 A 103 GLU H A 102 VAL H 1.0 1.8 4.83 371 308 A 103 GLU H A 102 VAL HA 1.0 1.8 2.53 372 309 A 103 GLU H A 102 VAL HG21 1.0 1.8 6.33 373 309 A 103 GLU H A 102 VAL HGx% 1.0 1.8 6.33 374 310 A 103 GLU H A 102 VAL HB 1.0 1.8 6.33 375 311 A 104 LEU H A 106 LEU HD21 1.0 1.8 6.33 376 311 A 104 LEU H A 106 LEU HDx% 1.0 1.8 6.33 377 312 A 105 ARG H A 106 LEU HD21 1.0 1.8 6.33 378 312 A 106 LEU HDx% A 105 ARG H 1.0 1.8 6.33 379 313 A 106 LEU H A 106 LEU HD21 1.0 1.8 6.33 380 313 A 106 LEU HDx% A 106 LEU H 1.0 1.8 6.33 381 314 A 103 GLU H A 104 LEU H 1.0 1.8 5.18 382 315 A 104 LEU H A 103 GLU HA 1.0 1.8 2.53 383 316 A 105 ARG H A 104 LEU HA 1.0 1.8 4.03 384 317 A 105 ARG H A 104 LEU HDx% 1.0 1.8 6.33 385 317 A 104 LEU HD21 A 105 ARG H 1.0 1.8 6.33 386 318 A 108 GLU H A 106 LEU HDx% 1.0 1.8 6.33 387 319 A 109 LEU H A 106 LEU HDx% 1.0 1.8 6.33 388 320 A 110 SER H A 107 PRO HA 1.0 1.8 4.26 389 321 A 108 GLU H A 109 LEU H 1.0 1.8 3.22 390 322 A 108 GLU HA A 109 LEU H 1.0 1.8 4.03 391 323 A 109 LEU H A 108 GLU HGx 1.0 1.8 6.33 392 323 A 108 GLU HGy A 109 LEU H 1.0 1.8 6.33 393 324 A 108 GLU H A 110 SER H 1.0 1.8 4.83 394 325 A 108 GLU HA A 110 SER H 1.0 1.8 4.60 395 326 A 110 SER H A 108 GLU HBx 1.0 1.8 6.33 396 326 A 110 SER H A 108 GLU HBy 1.0 1.8 6.33 397 327 A 110 SER H A 108 GLU HGx 1.0 1.8 6.33 398 327 A 108 GLU HGy A 110 SER H 1.0 1.8 6.33 399 328 A 108 GLU HA A 111 ASP H 1.0 1.8 4.26 400 329 A 109 LEU H A 110 SER H 1.0 1.8 3.12 401 330 A 109 LEU HG A 110 SER H 1.0 1.8 6.33 402 331 A 110 SER H A 109 LEU HDx% 1.0 1.8 6.33 403 331 A 109 LEU HDy% A 110 SER H 1.0 1.8 6.33 404 332 A 109 LEU HA A 110 SER H 1.0 1.8 4.03 405 333 A 109 LEU HA A 111 ASP H 1.0 1.8 4.60 406 334 A 109 LEU H A 107 PRO HA 1.0 1.8 5.06 407 335 A 112 GLN H A 109 LEU HBx 1.0 1.8 6.33 408 335 A 112 GLN H A 109 LEU HBy 1.0 1.8 6.33 409 336 A 110 SER H A 111 ASP H 1.0 1.8 3.20 410 337 A 110 SER H A 112 GLN H 1.0 1.8 5.18 411 338 A 110 SER HA A 112 GLN H 1.0 1.8 5.18 412 339 A 112 GLN H A 111 ASP H 1.0 1.8 3.92 413 340 A 115 GLY H A 112 GLN HE2y 1.0 1.8 6.33 414 340 A 112 GLN HE2x A 115 GLY H 1.0 1.8 6.33 415 341 A 109 LEU HA A 112 GLN H 1.0 1.8 6.33 416 342 A 112 GLN H A 113 PRO HBx 1.0 1.8 6.33 417 342 A 112 GLN H A 113 PRO HBy 1.0 1.8 6.33 418 343 A 112 GLN H A 113 PRO HGx 1.0 1.8 6.33 419 343 A 112 GLN H A 113 PRO HGy 1.0 1.8 6.33 420 344 A 115 GLY H A 114 PRO HDx 1.0 1.8 6.33 421 344 A 115 GLY H A 114 PRO HDy 1.0 1.8 6.33 422 345 A 115 GLY H A 116 VAL H 1.0 1.8 4.83 423 346 A 116 VAL H A 115 GLY HAy 1.0 1.8 2.53 424 346 A 116 VAL H A 115 GLY HAx 1.0 1.8 2.53 425 347 A 116 VAL HA A 117 ILE H 1.0 1.8 2.53 426 348 A 116 VAL H A 117 ILE HA 1.0 1.8 6.33 427 349 A 117 ILE H A 116 VAL HB 1.0 1.8 6.33 428 350 A 117 ILE H A 116 VAL HGy% 1.0 1.8 6.33 429 350 A 117 ILE H A 116 VAL HGx% 1.0 1.8 6.33 430 351 A 116 VAL H A 117 ILE H 1.0 1.8 4.83 431 352 A 117 ILE H A 118 VAL H 1.0 1.8 5.18 432 353 A 118 VAL H A 117 ILE HB 1.0 1.8 6.33 433 354 A 117 ILE H A 118 VAL HGx% 1.0 1.8 6.33 434 354 A 117 ILE H A 118 VAL HG21 1.0 1.8 6.33 435 355 A 118 VAL H A 119 VAL H 1.0 1.8 5.18 436 356 A 119 VAL H A 118 VAL HA 1.0 1.8 2.53 437 357 A 119 VAL H A 118 VAL HB 1.0 1.8 6.33 438 358 A 118 VAL H A 119 VAL HGy% 1.0 1.8 6.33 439 358 A 118 VAL H A 119 VAL HGx% 1.0 1.8 6.33 440 359 A 120 VAL H A 118 VAL HGx% 1.0 1.8 6.33 441 359 A 118 VAL HG21 A 120 VAL H 1.0 1.8 6.33 442 360 A 119 VAL H A 120 VAL H 1.0 1.8 4.86 443 361 A 120 VAL H A 119 VAL HA 1.0 1.8 2.53 444 362 A 120 VAL H A 119 VAL HB 1.0 1.8 6.33 445 363 A 120 VAL H A 119 VAL HGy% 1.0 1.8 6.33 446 363 A 119 VAL HGx% A 120 VAL H 1.0 1.8 6.33 447 364 A 121 THR H A 120 VAL H 1.0 1.8 4.92 448 365 A 121 THR H A 120 VAL HA 1.0 1.8 2.53 449 366 A 121 THR H A 120 VAL HB 1.0 1.8 6.33 450 367 A 120 VAL HB A 122 GLY H 1.0 1.8 6.33 451 368 A 122 GLY H A 120 VAL HGx% 1.0 1.8 6.33 452 369 A 121 THR H A 122 GLY H 1.0 1.8 4.95 453 370 A 121 THR HG2% A 122 GLY H 1.0 1.8 6.33 454 371 A 69 LEU H A 42 ILE HA 1.0 1.8 3.45 455 372 A 69 LEU H A 41 ASN H 1.0 1.8 4.26 456 373 A 69 LEU H A 40 TYR HDx 1.0 1.8 6.33 457 373 A 69 LEU H A 40 TYR HDy 1.0 1.8 6.33 458 374 A 69 LEU H A 42 ILE HD1% 1.0 1.8 6.33 459 375 A 67 GLY H A 40 TYR HDx 1.0 1.8 6.33 460 376 A 41 ASN H A 68 ASN HA 1.0 1.8 3.45 461 377 A 69 LEU H A 41 ASN HBx 1.0 1.8 6.33 462 377 A 69 LEU H A 41 ASN HBy 1.0 1.8 6.33 463 378 A 64 THR H A 38 ARG HA 1.0 1.8 6.33 464 379 A 63 VAL H A 37 VAL HA 1.0 1.8 6.33 465 380 A 39 VAL H A 66 VAL HA 1.0 1.8 3.45 466 381 A 119 VAL H A 39 VAL HGy% 1.0 1.8 6.33 467 381 A 39 VAL HGx% A 119 VAL H 1.0 1.8 6.33 468 382 A 36 GLU H A 115 GLY HAy 1.0 1.8 6.33 469 382 A 36 GLU H A 115 GLY HAx 1.0 1.8 6.33 470 383 A 40 TYR H A 117 ILE HB 1.0 1.8 6.33 471 384 A 118 VAL H A 40 TYR HDx 1.0 1.8 6.33 472 384 A 118 VAL H A 40 TYR HDy 1.0 1.8 6.33 473 385 A 42 ILE H A 120 VAL H 1.0 1.8 4.30 474 386 A 40 TYR H A 118 VAL HB 1.0 1.8 6.33 475 387 A 42 ILE H A 120 VAL HB 1.0 1.8 6.33 476 388 A 42 ILE H A 120 VAL HA 1.0 1.8 6.33 477 389 A 40 TYR H A 119 VAL H 1.0 1.8 6.33 478 390 A 40 TYR H A 119 VAL HA 1.0 1.8 4.03 479 391 A 40 TYR H A 119 VAL HGx% 1.0 1.8 6.33 480 392 A 118 VAL H A 39 VAL HA 1.0 1.8 3.45 481 393 A 41 ASN HA A 120 VAL H 1.0 1.8 3.45 482 394 A 41 ASN H A 119 VAL HGy% 1.0 1.8 6.33 483 394 A 41 ASN H A 119 VAL HGx% 1.0 1.8 6.33 484 395 A 38 ARG H A 118 VAL H 1.0 1.8 4.75 485 396 A 38 ARG H A 117 ILE HA 1.0 1.8 3.45 486 397 A 40 TYR H A 120 VAL H 1.0 1.8 4.78 487 398 A 122 GLY H A 42 ILE HG1x 1.0 1.8 6.33 488 398 A 122 GLY H A 42 ILE HG1y 1.0 1.8 6.33 489 399 A 80 TYR H A 117 ILE HB 1.0 1.8 6.33 490 400 A 80 TYR H A 116 VAL HA 1.0 1.8 6.33 491 401 A 80 TYR H A 117 ILE H 1.0 1.8 6.33 492 402 A 80 TYR HD% A 117 ILE H 1.0 1.8 6.33 493 403 A 117 ILE H A 80 TYR HBx 1.0 1.8 6.33 494 403 A 117 ILE H A 80 TYR HBy 1.0 1.8 6.33 495 404 A 118 VAL H A 80 TYR HBx 1.0 1.8 6.33 496 404 A 118 VAL H A 80 TYR HBy 1.0 1.8 6.33 497 405 A 80 TYR H A 119 VAL H 1.0 1.8 3.68 498 406 A 80 TYR H A 119 VAL HGy% 1.0 1.8 6.33 499 406 A 80 TYR H A 119 VAL HGx% 1.0 1.8 6.33 500 407 A 78 THR H A 121 THR H 1.0 1.8 4.83 501 408 A 77 THR H A 121 THR HG2% 1.0 1.8 6.33 502 409 A 121 THR HG2% A 76 ALA H 1.0 1.8 6.33 503 410 A 122 GLY H A 77 THR HB 1.0 1.8 6.33 504 411 A 79 VAL HA A 119 VAL H 1.0 1.8 4.37 505 412 A 78 THR H A 119 VAL H 1.0 1.8 6.33 506 413 A 80 TYR H A 118 VAL HA 1.0 1.8 4.37 507 414 A 78 THR H A 120 VAL HA 1.0 1.8 4.37 508 415 A 78 THR H A 119 VAL HB 1.0 1.8 6.33 509 416 A 78 THR H A 121 THR HG2% 1.0 1.8 6.33 510 417 A 77 THR HG2% A 121 THR H 1.0 1.8 6.33 511 418 A 52 THR H A 39 VAL HGx% 1.0 1.8 6.33 512 419 A 54 ASP H A 39 VAL HB 1.0 1.8 6.90 513 420 A 61 PHE H A 37 VAL HG21 1.0 1.8 6.33 514 420 A 61 PHE H A 37 VAL HGx% 1.0 1.8 6.33 515 421 A 62 THR H A 37 VAL H 1.0 1.8 4.83 516 422 A 82 THR H A 87 GLU HGx 1.0 1.8 6.33 517 422 A 82 THR H A 87 GLU HGy 1.0 1.8 6.33 518 423 A 87 GLU H A 83 GLU HBx 1.0 1.8 5.18 519 423 A 87 GLU H A 83 GLU HBy 1.0 1.8 5.18 520 424 A 82 THR H A 87 GLU HBx 1.0 1.8 6.33 521 424 A 82 THR H A 87 GLU HBy 1.0 1.8 6.33 522 425 A 80 TYR H A 91 ALA HB% 1.0 1.8 6.33 523 426 A 81 TYR H A 91 ALA HB% 1.0 1.8 6.33 524 427 A 101 ALA H A 79 VAL HGy% 1.0 1.8 6.33 525 428 A 78 THR HG2% A 101 ALA H 1.0 1.8 6.33 526 429 A 78 THR HA A 100 ALA H 1.0 1.8 6.33 527 430 A 81 TYR H A 103 GLU H 1.0 1.8 4.60 528 431 A 79 VAL H A 101 ALA HB% 1.0 1.8 6.33 529 432 A 79 VAL H A 101 ALA H 1.0 1.8 6.33 530 433 A 81 TYR H A 103 GLU HBx 1.0 1.8 6.33 531 433 A 81 TYR H A 103 GLU HBy 1.0 1.8 6.33 532 434 A 103 GLU H A 80 TYR HA 1.0 1.8 4.03 533 435 A 103 GLU H A 81 TYR HE% 1.0 1.8 6.33 534 436 A 79 VAL H A 102 VAL HGx% 1.0 1.8 6.33 535 437 A 79 VAL H A 102 VAL HA 1.0 1.8 3.45 536 438 A 81 TYR H A 104 LEU HA 1.0 1.8 4.03 537 439 A 102 VAL H A 79 VAL HGy% 1.0 1.8 6.33 538 439 A 79 VAL HGx% A 102 VAL H 1.0 1.8 6.33 539 440 A 103 GLU H A 79 VAL H 1.0 1.8 4.60 540 441 A 78 THR HG2% A 102 VAL H 1.0 1.8 6.33 541 442 A 78 THR HA A 101 ALA H 1.0 1.8 3.45 542 443 A 81 TYR HD% A 104 LEU H 1.0 1.8 6.33 543 444 A 104 LEU H A 81 TYR HE% 1.0 1.8 6.33 544 445 A 81 TYR HD% A 105 ARG H 1.0 1.8 6.33 545 446 A 105 ARG H A 81 TYR HE% 1.0 1.8 6.33 546 447 A 94 VAL H A 116 VAL HGy% 1.0 1.8 6.33 547 447 A 94 VAL H A 116 VAL HGx% 1.0 1.8 6.33 548 448 A 92 ASP H A 116 VAL HGx% 1.0 1.8 6.33 549 449 A 92 ASP H A 116 VAL HGy% 1.0 1.8 6.33 550 450 A 91 ALA H A 116 VAL HGx% 1.0 1.8 6.33 551 451 A 91 ALA H A 116 VAL HGy% 1.0 1.8 6.33 552 452 A 90 THR H A 116 VAL HGx% 1.0 1.8 6.33 553 453 A 90 THR H A 116 VAL HGy% 1.0 1.8 6.33 554 454 A 100 ALA H A 95 GLY HAx 1.0 1.8 6.33 555 455 A 89 ALA H A 116 VAL HGy% 1.0 1.8 6.33 556 455 A 89 ALA H A 116 VAL HGx% 1.0 1.8 6.33 557 456 A 50 ALA H A 66 VAL HGx% 1.0 1.8 6.33 558 457 A 42 ILE HD1% A 73 ASP H 1.0 1.8 6.33 559 458 A 81 TYR H A 88 ARG HA 1.0 1.8 6.33 560 459 A 71 LEU H A 42 ILE HB 1.0 1.8 6.33 561 460 A 42 ILE HB A 74 VAL H 1.0 1.8 6.33 562 461 A 92 ASP H A 56 LEU HD21 1.0 1.8 6.33 563 461 A 56 LEU HDx% A 92 ASP H 1.0 1.8 6.33 564 462 A 35 ALA H A 90 THR HG2% 1.0 1.8 6.33 565 463 A 91 ALA H A 94 VAL HB 1.0 1.8 6.33 566 464 A 112 GLN H A 117 ILE HD11 1.0 1.8 6.33 567 465 A 78 THR HG2% A 103 GLU H 1.0 1.8 6.33 568 466 A 64 THR H A 37 VAL H 1.0 1.8 4.83 569 467 A 64 THR H A 38 ARG HBx 1.0 1.8 6.33 570 467 A 64 THR H A 38 ARG HBy 1.0 1.8 6.33 571 468 A 40 TYR H A 49 ALA HB% 1.0 1.8 6.33 572 469 A 41 ASN H A 49 ALA HB% 1.0 1.8 6.33 573 470 A 109 LEU H A 73 ASP HBy 1.0 1.8 6.33 574 470 A 109 LEU H A 73 ASP HBx 1.0 1.8 6.33 575 471 A 110 SER H A 73 ASP HBy 1.0 1.8 6.33 576 471 A 110 SER H A 73 ASP HBx 1.0 1.8 6.33 577 472 A 112 GLN H A 73 ASP HBy 1.0 1.8 6.33 578 472 A 112 GLN H A 73 ASP HBx 1.0 1.8 6.33 579 473 A 81 TYR HD% A 88 ARG H 1.0 1.8 6.33 580 474 A 69 LEU H A 42 ILE H 1.0 1.8 6.33 581 475 A 62 THR H A 37 VAL HB 1.0 1.8 6.33 582 476 A 89 ALA H A 81 TYR HBy 1.0 1.8 6.33 583 476 A 89 ALA H A 81 TYR HBx 1.0 1.8 6.33 584 477 A 108 GLU H A 107 PRO HA 1.0 1.8 6.33 585 478 A 116 VAL H A 37 VAL HGx% 1.0 1.8 6.33 586 479 A 52 THR H A 97 THR HB 1.0 1.8 6.33 587 480 A 56 LEU HDx% A 94 VAL HGy% 1.0 1.8 6.33 588 480 A 56 LEU HD21 A 94 VAL HGy% 1.0 1.8 6.33 589 480 A 94 VAL HGx% A 56 LEU HD21 1.0 1.8 6.33 590 480 A 56 LEU HDx% A 94 VAL HGx% 1.0 1.8 6.33 591 481 A 93 ALA HB% A 94 VAL HGy% 1.0 1.8 6.33 592 481 A 93 ALA HB% A 94 VAL HGx% 1.0 1.8 6.33 593 482 A 90 THR HG2% A 94 VAL HGy% 1.0 1.8 6.33 594 482 A 90 THR HG2% A 94 VAL HGx% 1.0 1.8 6.33 595 483 A 97 THR HG2% A 94 VAL HGy% 1.0 1.8 6.33 596 483 A 97 THR HG2% A 94 VAL HGx% 1.0 1.8 6.33 597 484 A 94 VAL HGx% A 98 LEU HDy% 1.0 1.8 6.33 598 484 A 94 VAL HGy% A 98 LEU HDy% 1.0 1.8 6.33 599 484 A 98 LEU HDx% A 94 VAL HGy% 1.0 1.8 6.33 600 484 A 98 LEU HDx% A 94 VAL HGx% 1.0 1.8 6.33 601 485 A 79 VAL HGx% A 94 VAL HGy% 1.0 1.8 6.33 602 485 A 79 VAL HGy% A 94 VAL HGy% 1.0 1.8 6.33 603 485 A 94 VAL HGx% A 79 VAL HGy% 1.0 1.8 6.33 604 485 A 79 VAL HGx% A 94 VAL HGx% 1.0 1.8 6.33 605 486 A 78 THR HG2% A 101 ALA HB% 1.0 1.8 6.33 606 487 A 78 THR HG2% A 103 GLU HGy 1.0 1.8 6.33 607 487 A 78 THR HG2% A 103 GLU HGx 1.0 1.8 6.33 608 488 A 81 TYR HA A 87 GLU HGx 1.0 1.8 6.33 609 488 A 87 GLU HGy A 81 TYR HA 1.0 1.8 6.33 610 489 A 81 TYR HA A 91 ALA HB% 1.0 1.8 6.33 611 490 A 81 TYR HA A 116 VAL HGy% 1.0 1.8 6.33 612 490 A 81 TYR HA A 116 VAL HGx% 1.0 1.8 6.33 613 491 A 94 VAL HA A 97 THR HB 1.0 1.8 3.45 614 492 A 94 VAL HA A 94 VAL HB 1.0 1.8 3.45 615 493 A 94 VAL HA A 79 VAL HGy% 1.0 1.8 6.33 616 493 A 94 VAL HA A 79 VAL HGx% 1.0 1.8 6.33 617 494 A 39 VAL HGx% A 120 VAL H 1.0 1.8 6.33 618 495 A 38 ARG H A 117 ILE HB 1.0 1.8 6.33 619 496 A 40 TYR H A 119 VAL HGy% 1.0 1.8 6.33 620 497 A 116 VAL H A 37 VAL HA 1.0 1.8 6.33 621 498 A 116 VAL H A 37 VAL HB 1.0 1.8 6.90 622 499 A 118 VAL H A 39 VAL HGy% 1.0 1.8 6.33 623 500 A 42 ILE H A 121 THR HA 1.0 1.8 6.33 624 501 A 38 ARG H A 116 VAL H 1.0 1.8 6.33 625 502 A 42 ILE H A 120 VAL HGx% 1.0 1.8 6.33 626 503 A 43 SER H A 121 THR HA 1.0 1.8 5.75 627 504 A 38 ARG H A 91 ALA HB% 1.0 1.8 6.33 628 505 A 77 THR H A 121 THR HA 1.0 1.8 6.33 629 506 A 78 THR H A 119 VAL HGy% 1.0 1.8 6.33 630 507 A 119 VAL H A 79 VAL HGy% 1.0 1.8 6.33 631 508 A 80 TYR H A 117 ILE HD11 1.0 1.8 6.33 632 509 A 80 TYR H A 117 ILE HA 1.0 1.8 6.33 633 510 A 80 TYR H A 116 VAL HGy% 1.0 1.8 6.33 634 511 A 81 TYR H A 116 VAL HGy% 1.0 1.8 6.33 635 511 A 81 TYR H A 116 VAL HGx% 1.0 1.8 6.33 636 512 A 82 THR H A 116 VAL HGy% 1.0 1.8 6.33 637 513 A 42 ILE HD1% A 74 VAL H 1.0 1.8 6.33 638 514 A 64 THR H A 37 VAL HB 1.0 1.8 6.33 639 515 A 67 GLY H A 40 TYR HA 1.0 1.8 6.33 640 516 A 64 THR HG21 A 37 VAL H 1.0 1.8 6.33 641 517 A 41 ASN H A 68 ASN HBx 1.0 1.8 6.33 642 517 A 41 ASN H A 68 ASN HBy 1.0 1.8 6.33 643 518 A 91 ALA HB% A 117 ILE H 1.0 1.8 6.33 644 519 A 91 ALA HB% A 116 VAL H 1.0 1.8 6.33 645 520 A 79 VAL H A 101 ALA HA 1.0 1.8 6.33 646 521 A 79 VAL H A 100 ALA HB% 1.0 1.8 6.33 647 522 A 100 ALA H A 79 VAL HGy% 1.0 1.8 6.33 648 523 A 96 ARG H A 79 VAL HGx% 1.0 1.8 6.33 649 524 A 96 ARG H A 79 VAL HGy% 1.0 1.8 6.33 650 525 A 95 GLY H A 79 VAL HGx% 1.0 1.8 6.33 651 526 A 95 GLY H A 79 VAL HGy% 1.0 1.8 6.33 652 527 A 54 ASP H A 39 VAL HGy% 1.0 1.8 6.33 653 528 A 53 ALA H A 39 VAL HGy% 1.0 1.8 6.33 654 529 A 53 ALA H A 39 VAL HGx% 1.0 1.8 6.33 655 530 A 52 THR H A 39 VAL HGy% 1.0 1.8 6.33 656 531 A 92 ASP H A 81 TYR HBy 1.0 1.8 6.33 657 531 A 92 ASP H A 81 TYR HBx 1.0 1.8 6.33 658 532 A 91 ALA H A 81 TYR HBy 1.0 1.8 6.33 659 532 A 91 ALA H A 81 TYR HBx 1.0 1.8 6.33 660 533 A 62 THR H A 56 LEU HD21 1.0 1.8 6.33 661 534 A 82 THR H A 88 ARG HA 1.0 1.8 6.33 662 535 A 82 THR H A 88 ARG HBy 1.0 1.8 6.33 663 535 A 82 THR H A 88 ARG HBx 1.0 1.8 6.33 664 536 A 56 LEU HA A 61 PHE H 1.0 1.8 6.33 665 537 A 56 LEU HG A 61 PHE H 1.0 1.8 6.33 666 538 A 95 GLY H A 100 ALA HB% 1.0 1.8 6.33 667 539 A 95 GLY HAy A 100 ALA H 1.0 1.8 6.33 668 540 A 57 LYS HA A 61 PHE H 1.0 1.8 6.33 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 38 ARG H A 116 VAL O 1.0 1.90 2.10 2 2 A 116 VAL O A 38 ARG N 1.0 2.85 3.15 3 3 A 118 VAL H A 38 ARG O 1.0 1.90 2.10 4 4 A 38 ARG O A 118 VAL N 1.0 2.85 3.15 5 5 A 40 TYR H A 118 VAL O 1.0 1.90 2.10 6 6 A 118 VAL O A 40 TYR N 1.0 2.85 3.15 7 7 A 120 VAL H A 40 TYR O 1.0 1.90 2.10 8 8 A 40 TYR O A 120 VAL N 1.0 2.85 3.15 9 9 A 42 ILE H A 120 VAL O 1.0 1.90 2.10 10 10 A 120 VAL O A 42 ILE N 1.0 2.85 3.15 11 11 A 41 ASN H A 67 GLY O 1.0 1.90 2.10 12 12 A 67 GLY O A 41 ASN N 1.0 2.85 3.15 13 13 A 69 LEU H A 41 ASN O 1.0 1.90 2.10 14 14 A 41 ASN O A 69 LEU N 1.0 2.85 3.15 15 15 A 39 VAL H A 65 ASP O 1.0 1.90 2.10 16 16 A 65 ASP O A 39 VAL N 1.0 2.85 3.15 17 17 A 67 GLY H A 39 VAL O 1.0 1.90 2.10 18 18 A 39 VAL O A 67 GLY N 1.0 2.85 3.15 19 19 A 37 VAL H A 63 VAL O 1.0 1.90 2.10 20 20 A 63 VAL O A 37 VAL N 1.0 2.85 3.15 21 21 A 37 VAL O A 65 ASP H 1.0 1.90 2.10 22 22 A 37 VAL O A 65 ASP N 1.0 2.85 3.15 23 23 A 79 VAL H A 101 ALA O 1.0 1.90 2.10 24 24 A 101 ALA O A 79 VAL N 1.0 2.85 3.15 25 25 A 103 GLU H A 79 VAL O 1.0 1.90 2.10 26 26 A 79 VAL O A 103 GLU N 1.0 2.85 3.15 27 27 A 81 TYR H A 103 GLU O 1.0 1.90 2.10 28 28 A 103 GLU O A 81 TYR N 1.0 2.85 3.15 29 29 A 81 TYR O A 105 ARG N 1.0 2.85 3.15 30 30 A 38 ARG H A 116 VAL O 1.0 1.90 2.10 31 31 A 116 VAL O A 38 ARG N 1.0 2.85 3.15 32 32 A 118 VAL H A 38 ARG O 1.0 1.90 2.10 33 33 A 38 ARG O A 118 VAL N 1.0 2.85 3.15 34 34 A 40 TYR H A 118 VAL O 1.0 1.90 2.10 35 35 A 118 VAL O A 40 TYR N 1.0 2.85 3.15 36 36 A 120 VAL H A 40 TYR O 1.0 1.90 2.10 37 37 A 40 TYR O A 120 VAL N 1.0 2.85 3.15 38 38 A 117 ILE H A 80 TYR O 1.0 1.90 2.10 39 39 A 80 TYR O A 117 ILE N 1.0 2.85 3.15 40 40 A 80 TYR H A 117 ILE O 1.0 1.90 2.10 41 41 A 117 ILE O A 80 TYR N 1.0 2.85 3.15 42 42 A 78 THR H A 119 VAL O 1.0 1.90 2.10 43 43 A 119 VAL O A 78 THR N 1.0 2.85 3.15 44 44 A 119 VAL H A 78 THR O 1.0 1.90 2.10 45 45 A 78 THR O A 119 VAL N 1.0 2.85 3.15 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 6 SER C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -90.4 -49.3 PHI 2 2 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 ASP N 1.0 -78.5 13.5 PSI 3 3 A 7 GLU C A 8 ASP N A 8 ASP CA A 8 ASP C 1.0 -129.3 -26.6 PHI 4 4 A 8 ASP N A 8 ASP CA A 8 ASP C A 9 ASP N 1.0 -72.9 21.2 PSI 5 5 A 21 ALA C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -146.5 -23.4 PHI 6 6 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 PRO N 1.0 109.4 167.2 PSI 7 7 A 28 VAL C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -122.3 -50.4 PHI 8 8 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 PRO N 1.0 97.5 186.2 PSI 9 9 A 30 PRO N A 30 PRO CA A 30 PRO C A 31 ALA N 1.0 124.8 168.5 PSI 10 10 A 33 PRO N A 33 PRO CA A 33 PRO C A 34 ARG N 1.0 130.4 170.4 PSI 11 11 A 34 ARG C A 35 ALA N A 35 ALA CA A 35 ALA C 1.0 -174.6 -51.6 PHI 12 12 A 35 ALA N A 35 ALA CA A 35 ALA C A 36 GLU N 1.0 85.5 223.2 PSI 13 13 A 35 ALA C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -149.4 -66.8 PHI 14 14 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 VAL N 1.0 84.0 189.0 PSI 15 15 A 36 GLU C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -161.3 -97.5 PHI 16 16 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 ARG N 1.0 114.3 171.0 PSI 17 17 A 37 VAL C A 38 ARG N A 38 ARG CA A 38 ARG C 1.0 -149.1 -97.7 PHI 18 18 A 38 ARG N A 38 ARG CA A 38 ARG C A 39 VAL N 1.0 112.5 183.6 PSI 19 19 A 38 ARG C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -153.0 -84.6 PHI 20 20 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 TYR N 1.0 99.9 170.8 PSI 21 21 A 39 VAL C A 40 TYR N A 40 TYR CA A 40 TYR C 1.0 -154.9 -101.0 PHI 22 22 A 40 TYR N A 40 TYR CA A 40 TYR C A 41 ASN N 1.0 109.2 187.1 PSI 23 23 A 40 TYR C A 41 ASN N A 41 ASN CA A 41 ASN C 1.0 -96.5 -50.3 PHI 24 24 A 41 ASN N A 41 ASN CA A 41 ASN C A 42 ILE N 1.0 113.7 153.7 PSI 25 25 A 45 THR C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -147.0 -32.8 PHI 26 26 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 GLY N 1.0 90.4 171.9 PSI 27 27 A 46 GLU C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 -86.7 -46.7 PHI 28 28 A 47 GLY N A 47 GLY CA A 47 GLY C A 48 ALA N 1.0 -63.2 -2.3 PSI 29 29 A 47 GLY C A 48 ALA N A 48 ALA CA A 48 ALA C 1.0 -81.9 -41.9 PHI 30 30 A 48 ALA N A 48 ALA CA A 48 ALA C A 49 ALA N 1.0 -61.8 -21.8 PSI 31 31 A 48 ALA C A 49 ALA N A 49 ALA CA A 49 ALA C 1.0 -86.7 -46.7 PHI 32 32 A 49 ALA N A 49 ALA CA A 49 ALA C A 50 ALA N 1.0 -60.2 -20.2 PSI 33 33 A 49 ALA C A 50 ALA N A 50 ALA CA A 50 ALA C 1.0 -80.9 -40.9 PHI 34 34 A 50 ALA N A 50 ALA CA A 50 ALA C A 51 ARG N 1.0 -62.2 -22.2 PSI 35 35 A 50 ALA C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -87.0 -47.0 PHI 36 36 A 51 ARG N A 51 ARG CA A 51 ARG C A 52 THR N 1.0 -55.4 -14.0 PSI 37 37 A 51 ARG C A 52 THR N A 52 THR CA A 52 THR C 1.0 -88.7 -48.7 PHI 38 38 A 52 THR N A 52 THR CA A 52 THR C A 53 ALA N 1.0 -61.4 -21.4 PSI 39 39 A 52 THR C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -80.5 -40.5 PHI 40 40 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 ASP N 1.0 -62.4 -22.4 PSI 41 41 A 53 ALA C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -84.8 -44.8 PHI 42 42 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 ARG N 1.0 -61.4 -21.4 PSI 43 43 A 54 ASP C A 55 ARG N A 55 ARG CA A 55 ARG C 1.0 -85.2 -45.2 PHI 44 44 A 55 ARG N A 55 ARG CA A 55 ARG C A 56 LEU N 1.0 -62.1 -22.1 PSI 45 45 A 55 ARG C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -86.0 -46.0 PHI 46 46 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 LYS N 1.0 -58.1 -18.1 PSI 47 47 A 56 LEU C A 57 LYS N A 57 LYS CA A 57 LYS C 1.0 -84.6 -44.6 PHI 48 48 A 57 LYS N A 57 LYS CA A 57 LYS C A 58 ALA N 1.0 -60.4 -20.4 PSI 49 49 A 57 LYS C A 58 ALA N A 58 ALA CA A 58 ALA C 1.0 -84.0 -44.0 PHI 50 50 A 58 ALA N A 58 ALA CA A 58 ALA C A 59 ALA N 1.0 -45.6 -5.6 PSI 51 51 A 58 ALA C A 59 ALA N A 59 ALA CA A 59 ALA C 1.0 -118.3 -65.0 PHI 52 52 A 59 ALA N A 59 ALA CA A 59 ALA C A 60 GLY N 1.0 -21.1 24.7 PSI 53 53 A 59 ALA C A 60 GLY N A 60 GLY CA A 60 GLY C 1.0 61.4 118.8 PHI 54 54 A 60 GLY N A 60 GLY CA A 60 GLY C A 61 PHE N 1.0 -20.9 44.2 PSI 55 55 A 60 GLY C A 61 PHE N A 61 PHE CA A 61 PHE C 1.0 -105.8 -58.8 PHI 56 56 A 61 PHE N A 61 PHE CA A 61 PHE C A 62 THR N 1.0 108.2 155.7 PSI 57 57 A 63 VAL C A 64 THR N A 64 THR CA A 64 THR C 1.0 -150.5 -43.4 PHI 58 58 A 64 THR N A 64 THR CA A 64 THR C A 65 ASP N 1.0 81.8 171.3 PSI 59 59 A 64 THR C A 65 ASP N A 65 ASP CA A 65 ASP C 1.0 -176.2 -104.6 PHI 60 60 A 65 ASP N A 65 ASP CA A 65 ASP C A 66 VAL N 1.0 128.0 168.1 PSI 61 61 A 65 ASP C A 66 VAL N A 66 VAL CA A 66 VAL C 1.0 -142.9 -78.4 PHI 62 62 A 66 VAL N A 66 VAL CA A 66 VAL C A 67 GLY N 1.0 114.6 166.9 PSI 63 63 A 68 ASN C A 69 LEU N A 69 LEU CA A 69 LEU C 1.0 -155.2 -114.2 PHI 64 64 A 69 LEU N A 69 LEU CA A 69 LEU C A 70 SER N 1.0 131.9 171.9 PSI 65 65 A 69 LEU C A 70 SER N A 70 SER CA A 70 SER C 1.0 -150.4 -69.2 PHI 66 66 A 70 SER N A 70 SER CA A 70 SER C A 71 LEU N 1.0 101.3 143.7 PSI 67 67 A 70 SER C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -119.8 -43.8 PHI 68 68 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 PRO N 1.0 89.6 165.6 PSI 69 69 A 72 PRO C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 -107.8 -67.8 PHI 70 70 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 VAL N 1.0 -21.6 19.5 PSI 71 71 A 73 ASP C A 74 VAL N A 74 VAL CA A 74 VAL C 1.0 -132.4 -48.0 PHI 72 72 A 74 VAL N A 74 VAL CA A 74 VAL C A 75 ALA N 1.0 111.2 156.5 PSI 73 73 A 75 ALA C A 76 ALA N A 76 ALA CA A 76 ALA C 1.0 -174.4 -81.9 PHI 74 74 A 76 ALA N A 76 ALA CA A 76 ALA C A 77 THR N 1.0 115.5 155.7 PSI 75 75 A 76 ALA C A 77 THR N A 77 THR CA A 77 THR C 1.0 -145.9 -43.4 PHI 76 76 A 77 THR N A 77 THR CA A 77 THR C A 78 THR N 1.0 103.8 150.5 PSI 77 77 A 77 THR C A 78 THR N A 78 THR CA A 78 THR C 1.0 -149.6 -63.4 PHI 78 78 A 78 THR N A 78 THR CA A 78 THR C A 79 VAL N 1.0 105.6 157.5 PSI 79 79 A 78 THR C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -139.7 -97.1 PHI 80 80 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 TYR N 1.0 117.2 157.2 PSI 81 81 A 79 VAL C A 80 TYR N A 80 TYR CA A 80 TYR C 1.0 -146.5 -87.3 PHI 82 82 A 80 TYR N A 80 TYR CA A 80 TYR C A 81 TYR N 1.0 112.9 178.2 PSI 83 83 A 80 TYR C A 81 TYR N A 81 TYR CA A 81 TYR C 1.0 -160.3 -102.4 PHI 84 84 A 81 TYR N A 81 TYR CA A 81 TYR C A 82 THR N 1.0 127.2 185.7 PSI 85 85 A 82 THR C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -136.5 -52.2 PHI 86 86 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 VAL N 1.0 -28.2 28.1 PSI 87 87 A 83 GLU C A 84 VAL N A 84 VAL CA A 84 VAL C 1.0 -128.2 -47.2 PHI 88 88 A 84 VAL N A 84 VAL CA A 84 VAL C A 85 GLU N 1.0 89.1 158.9 PSI 89 89 A 86 GLY C A 87 GLU N A 87 GLU CA A 87 GLU C 1.0 -81.7 -41.7 PHI 90 90 A 87 GLU N A 87 GLU CA A 87 GLU C A 88 ARG N 1.0 -59.2 -19.2 PSI 91 91 A 87 GLU C A 88 ARG N A 88 ARG CA A 88 ARG C 1.0 -84.0 -44.0 PHI 92 92 A 88 ARG N A 88 ARG CA A 88 ARG C A 89 ALA N 1.0 -66.1 -26.1 PSI 93 93 A 88 ARG C A 89 ALA N A 89 ALA CA A 89 ALA C 1.0 -84.4 -44.4 PHI 94 94 A 89 ALA N A 89 ALA CA A 89 ALA C A 90 THR N 1.0 -52.7 -12.7 PSI 95 95 A 89 ALA C A 90 THR N A 90 THR CA A 90 THR C 1.0 -87.6 -47.6 PHI 96 96 A 90 THR N A 90 THR CA A 90 THR C A 91 ALA N 1.0 -59.9 -19.9 PSI 97 97 A 90 THR C A 91 ALA N A 91 ALA CA A 91 ALA C 1.0 -80.0 -40.0 PHI 98 98 A 91 ALA N A 91 ALA CA A 91 ALA C A 92 ASP N 1.0 -63.0 -23.0 PSI 99 99 A 91 ALA C A 92 ASP N A 92 ASP CA A 92 ASP C 1.0 -82.2 -42.2 PHI 100 100 A 92 ASP N A 92 ASP CA A 92 ASP C A 93 ALA N 1.0 -61.8 -21.8 PSI 101 101 A 92 ASP C A 93 ALA N A 93 ALA CA A 93 ALA C 1.0 -84.1 -44.1 PHI 102 102 A 93 ALA N A 93 ALA CA A 93 ALA C A 94 VAL N 1.0 -57.3 -17.3 PSI 103 103 A 93 ALA C A 94 VAL N A 94 VAL CA A 94 VAL C 1.0 -86.2 -46.2 PHI 104 104 A 94 VAL N A 94 VAL CA A 94 VAL C A 95 GLY N 1.0 -60.8 -20.8 PSI 105 105 A 94 VAL C A 95 GLY N A 95 GLY CA A 95 GLY C 1.0 -81.9 -41.9 PHI 106 106 A 95 GLY N A 95 GLY CA A 95 GLY C A 96 ARG N 1.0 -61.7 -21.7 PSI 107 107 A 95 GLY C A 96 ARG N A 96 ARG CA A 96 ARG C 1.0 -84.9 -44.9 PHI 108 108 A 96 ARG N A 96 ARG CA A 96 ARG C A 97 THR N 1.0 -62.5 -22.5 PSI 109 109 A 96 ARG C A 97 THR N A 97 THR CA A 97 THR C 1.0 -83.3 -43.3 PHI 110 110 A 97 THR N A 97 THR CA A 97 THR C A 98 LEU N 1.0 -60.4 -20.4 PSI 111 111 A 97 THR C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -135.1 -66.4 PHI 112 112 A 98 LEU N A 98 LEU CA A 98 LEU C A 99 GLY N 1.0 -31.3 25.2 PSI 113 113 A 99 GLY C A 100 ALA N A 100 ALA CA A 100 ALA C 1.0 -142.6 -85.3 PHI 114 114 A 100 ALA N A 100 ALA CA A 100 ALA C A 101 ALA N 1.0 118.0 191.3 PSI 115 115 A 100 ALA C A 101 ALA N A 101 ALA CA A 101 ALA C 1.0 -117.8 -60.9 PHI 116 116 A 101 ALA N A 101 ALA CA A 101 ALA C A 102 VAL N 1.0 106.3 164.6 PSI 117 117 A 101 ALA C A 102 VAL N A 102 VAL CA A 102 VAL C 1.0 -145.1 -87.2 PHI 118 118 A 102 VAL N A 102 VAL CA A 102 VAL C A 103 GLU N 1.0 99.9 159.1 PSI 119 119 A 102 VAL C A 103 GLU N A 103 GLU CA A 103 GLU C 1.0 -154.6 -114.6 PHI 120 120 A 103 GLU N A 103 GLU CA A 103 GLU C A 104 LEU N 1.0 135.6 176.1 PSI 121 121 A 103 GLU C A 104 LEU N A 104 LEU CA A 104 LEU C 1.0 -95.3 -55.3 PHI 122 122 A 104 LEU N A 104 LEU CA A 104 LEU C A 105 ARG N 1.0 126.7 193.2 PSI 123 123 A 104 LEU C A 105 ARG N A 105 ARG CA A 105 ARG C 1.0 -136.0 -52.5 PHI 124 124 A 105 ARG N A 105 ARG CA A 105 ARG C A 106 LEU N 1.0 -44.4 25.9 PSI 125 125 A 107 PRO N A 107 PRO CA A 107 PRO C A 108 GLU N 1.0 -53.0 -13.0 PSI 126 126 A 107 PRO C A 108 GLU N A 108 GLU CA A 108 GLU C 1.0 -81.8 -41.8 PHI 127 127 A 108 GLU N A 108 GLU CA A 108 GLU C A 109 LEU N 1.0 -53.5 -11.1 PSI 128 128 A 108 GLU C A 109 LEU N A 109 LEU CA A 109 LEU C 1.0 -134.0 -65.9 PHI 129 129 A 109 LEU N A 109 LEU CA A 109 LEU C A 110 SER N 1.0 -43.0 24.7 PSI 130 130 A 109 LEU C A 110 SER N A 110 SER CA A 110 SER C 1.0 -87.5 -47.5 PHI 131 131 A 110 SER N A 110 SER CA A 110 SER C A 111 ASP N 1.0 -48.3 -4.2 PSI 132 132 A 110 SER C A 111 ASP N A 111 ASP CA A 111 ASP C 1.0 -125.3 -69.4 PHI 133 133 A 111 ASP N A 111 ASP CA A 111 ASP C A 112 GLN N 1.0 -31.2 24.8 PSI 134 134 A 113 PRO N A 113 PRO CA A 113 PRO C A 114 PRO N 1.0 126.2 166.2 PSI 135 135 A 114 PRO N A 114 PRO CA A 114 PRO C A 115 GLY N 1.0 119.4 159.4 PSI 136 136 A 115 GLY C A 116 VAL N A 116 VAL CA A 116 VAL C 1.0 -147.2 -54.6 PHI 137 137 A 116 VAL N A 116 VAL CA A 116 VAL C A 117 ILE N 1.0 108.2 149.9 PSI 138 138 A 116 VAL C A 117 ILE N A 117 ILE CA A 117 ILE C 1.0 -144.6 -95.3 PHI 139 139 A 117 ILE N A 117 ILE CA A 117 ILE C A 118 VAL N 1.0 109.0 149.0 PSI 140 140 A 117 ILE C A 118 VAL N A 118 VAL CA A 118 VAL C 1.0 -144.0 -90.4 PHI 141 141 A 118 VAL N A 118 VAL CA A 118 VAL C A 119 VAL N 1.0 107.0 162.4 PSI 142 142 A 118 VAL C A 119 VAL N A 119 VAL CA A 119 VAL C 1.0 -165.1 -95.6 PHI 143 143 A 119 VAL N A 119 VAL CA A 119 VAL C A 120 VAL N 1.0 118.2 181.2 PSI 144 144 A 119 VAL C A 120 VAL N A 120 VAL CA A 120 VAL C 1.0 -159.3 -81.5 PHI 145 145 A 120 VAL N A 120 VAL CA A 120 VAL C A 121 THR N 1.0 130.9 185.7 PSI 146 146 A 120 VAL C A 121 THR N A 121 THR CA A 121 THR C 1.0 -166.6 -53.5 PHI 147 147 A 121 THR N A 121 THR CA A 121 THR C A 122 GLY N 1.0 103.9 164.7 PSI stop_ save_