data_nef_c18323_2lqp 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_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 58 GLN O 2 2 CA CA 1 52 ASP OD1 2 2 CA CA 1 20 ASN OD1 2 1 CA CA 1 27 GLU OE1 2 1 CA CA 1 22 TYR O 2 1 CA CA 1 16 ASP OD1 2 1 CA CA 1 27 GLU OE2 2 1 CA CA 1 63 GLU OE1 2 2 CA CA 1 58 GLN OE1 2 1 CA CA 1 52 ASP OD2 2 2 CA CA 1 56 ASP OD2 2 2 CA CA 1 56 ASP OD1 2 2 CA CA stop_ 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 78 ASP start . . 2 A 79 THR middle . . 3 A 80 ASP middle . . 4 A 81 SER middle . . 5 A 82 GLU middle . . 6 A 83 GLU middle . . 7 A 84 GLU middle . . 8 A 85 ILE middle . . 9 A 86 ARG middle . . 10 A 87 GLU middle . . 11 A 88 ALA middle . . 12 A 89 PHE middle . . 13 A 90 ARG middle . . 14 A 91 VAL middle . . 15 A 92 PHE middle . . 16 A 93 ASP middle . . 17 A 94 LYS middle . . 18 A 95 ASP middle . . 19 A 96 GLY middle . false 20 A 97 ASN middle . . 21 A 98 GLY middle . false 22 A 99 TYR middle . . 23 A 100 ILE middle . . 24 A 101 SER middle . . 25 A 102 ALA middle . . 26 A 103 ALA middle . . 27 A 104 GLU middle . . 28 A 105 LEU middle . . 29 A 106 ARG middle . . 30 A 107 HIS middle . . 31 A 108 VAL middle . . 32 A 109 MET middle . . 33 A 110 THR middle . . 34 A 111 ASN middle . . 35 A 112 LEU middle . . 36 A 113 GLY middle . false 37 A 114 GLU middle . . 38 A 115 LYS middle . . 39 A 116 LEU middle . . 40 A 117 THR middle . . 41 A 118 ASP middle . . 42 A 119 GLU middle . . 43 A 120 GLU middle . . 44 A 121 VAL middle . . 45 A 122 ASP middle . . 46 A 123 GLU middle . . 47 A 124 MET middle . . 48 A 125 ILE middle . . 49 A 126 ARG middle . . 50 A 127 GLU middle . . 51 A 128 ALA middle . . 52 A 129 ASP middle . . 53 A 130 ILE middle . . 54 A 131 ASP middle . . 55 A 132 GLY middle . false 56 A 133 ASP middle . . 57 A 134 GLY middle . false 58 A 135 GLN middle . . 59 A 136 VAL middle . . 60 A 137 ASN middle . . 61 A 138 TYR middle . . 62 A 139 GLU middle . . 63 A 140 GLU middle . . 64 A 141 PHE middle . . 65 A 142 VAL middle . . 66 A 143 GLN middle . . 67 A 144 MET middle . . 68 A 145 MET middle . . 69 A 146 THR middle . . 70 A 147 ALA middle . . 71 A 148 LYS end . . 72 B 1 CA . . . 73 B 2 CA . . . 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 78 ASP HA H 1 4.7250 0.01 A 78 ASP HBx H 1 2.7610 0.01 A 78 ASP C C 13 176.1730 0.2 A 78 ASP CA C 13 54.6600 0.2 A 78 ASP CB C 13 41.1820 0.2 A 79 THR H H 1 8.2990 0.01 A 79 THR HA H 1 4.2810 0.01 A 79 THR HG2% H 1 1.2080 0.01 A 79 THR C C 13 174.5980 0.2 A 79 THR CA C 13 62.2780 0.2 A 79 THR CB C 13 69.3100 0.2 A 79 THR CG2 C 13 21.7900 0.2 A 79 THR N N 15 114.2870 0.1 A 80 ASP H H 1 8.4470 0.01 A 80 ASP HBx H 1 2.7200 0.01 A 80 ASP C C 13 176.7880 0.2 A 80 ASP CA C 13 54.6600 0.2 A 80 ASP CB C 13 41.1820 0.2 A 80 ASP N N 15 122.3110 0.1 A 81 SER H H 1 8.3510 0.01 A 81 SER HA H 1 4.0220 0.01 A 81 SER C C 13 175.3370 0.2 A 81 SER CA C 13 58.7620 0.2 A 81 SER CB C 13 64.0360 0.2 A 81 SER N N 15 116.9340 0.1 A 82 GLU H H 1 8.5880 0.01 A 82 GLU HA H 1 4.1120 0.01 A 82 GLU HBy H 1 1.8920 0.01 A 82 GLU HBx H 1 1.5450 0.01 A 82 GLU HGx H 1 2.3560 0.01 A 82 GLU C C 13 178.0670 0.2 A 82 GLU CA C 13 59.3480 0.2 A 82 GLU CB C 13 46.7490 0.2 A 82 GLU CG C 13 36.4670 0.2 A 82 GLU N N 15 123.4230 0.1 A 83 GLU H H 1 8.4120 0.01 A 83 GLU CA C 13 59.3480 0.2 A 83 GLU CB C 13 29.4620 0.2 A 83 GLU N N 15 118.9870 0.1 A 84 GLU HA H 1 4.1160 0.01 A 84 GLU HGx H 1 2.3820 0.01 A 84 GLU C C 13 178.9690 0.2 A 84 GLU CA C 13 59.3480 0.2 A 84 GLU CB C 13 29.4620 0.2 A 84 GLU CG C 13 36.5490 0.2 A 85 ILE H H 1 8.0010 0.01 A 85 ILE HA H 1 3.9170 0.01 A 85 ILE HG1x H 1 2.1810 0.01 A 85 ILE C C 13 178.2830 0.2 A 85 ILE CA C 13 65.2080 0.2 A 85 ILE CB C 13 37.0800 0.2 A 85 ILE CD1 C 13 13.1920 0.2 A 85 ILE CG1 C 13 28.7030 0.2 A 85 ILE CG2 C 13 18.9700 0.2 A 85 ILE N N 15 121.8390 0.1 A 86 ARG H H 1 8.5440 0.01 A 86 ARG HA H 1 4.2600 0.01 A 86 ARG HBx H 1 1.8470 0.01 A 86 ARG HDy H 1 3.1610 0.01 A 86 ARG HGx H 1 1.5840 0.01 A 86 ARG C C 13 179.2910 0.2 A 86 ARG CA C 13 59.9340 0.2 A 86 ARG CB C 13 29.4620 0.2 A 86 ARG CD C 13 43.1260 0.2 A 86 ARG CG C 13 27.4140 0.2 A 86 ARG N N 15 121.3280 0.1 A 87 GLU H H 1 8.2250 0.01 A 87 GLU HA H 1 4.1160 0.01 A 87 GLU HGx H 1 2.3820 0.01 A 87 GLU C C 13 179.4980 0.2 A 87 GLU CA C 13 59.3480 0.2 A 87 GLU CB C 13 29.4620 0.2 A 87 GLU CG C 13 36.5490 0.2 A 87 GLU N N 15 118.3320 0.1 A 88 ALA H H 1 8.0010 0.01 A 88 ALA HA H 1 4.2430 0.01 A 88 ALA HB% H 1 1.8930 0.01 A 88 ALA C C 13 176.7150 0.2 A 88 ALA CA C 13 55.2460 0.2 A 88 ALA CB C 13 18.1360 0.2 A 88 ALA N N 15 121.8390 0.1 A 89 PHE H H 1 8.6300 0.01 A 89 PHE HA H 1 4.9340 0.01 A 89 PHE HBx H 1 2.9300 0.01 A 89 PHE C C 13 177.3700 0.2 A 89 PHE CA C 13 62.2780 0.2 A 89 PHE CB C 13 39.4240 0.2 A 89 PHE N N 15 118.7940 0.1 A 90 ARG H H 1 7.8910 0.01 A 90 ARG HA H 1 3.8620 0.01 A 90 ARG HBx H 1 1.9850 0.01 A 90 ARG HDy H 1 3.2580 0.01 A 90 ARG HGx H 1 1.7420 0.01 A 90 ARG C C 13 177.5900 0.2 A 90 ARG CA C 13 58.7620 0.2 A 90 ARG CB C 13 30.0480 0.2 A 90 ARG CD C 13 43.5780 0.2 A 90 ARG CG C 13 28.0550 0.2 A 90 ARG N N 15 115.8370 0.1 A 91 VAL H H 1 7.4070 0.01 A 91 VAL C C 13 176.3430 0.2 A 91 VAL CA C 13 65.7940 0.2 A 91 VAL CB C 13 31.2200 0.2 A 91 VAL CGx C 13 20.9990 0.2 A 91 VAL CGy C 13 23.0330 0.2 A 91 VAL N N 15 118.3820 0.1 A 92 PHE H H 1 6.8920 0.01 A 92 PHE HA H 1 4.6610 0.01 A 92 PHE HBy H 1 2.8540 0.01 A 92 PHE HBx H 1 2.6570 0.01 A 92 PHE C C 13 176.3780 0.2 A 92 PHE CA C 13 59.9340 0.2 A 92 PHE CB C 13 41.1820 0.2 A 92 PHE N N 15 114.2570 0.1 A 93 ASP H H 1 7.8470 0.01 A 93 ASP HA H 1 4.6170 0.01 A 93 ASP HBy H 1 2.1650 0.01 A 93 ASP HBx H 1 1.3450 0.01 A 93 ASP C C 13 177.6950 0.2 A 93 ASP CA C 13 51.7300 0.2 A 93 ASP CB C 13 38.8380 0.2 A 93 ASP N N 15 116.2880 0.1 A 94 LYS H H 1 7.6620 0.01 A 94 LYS HA H 1 3.8890 0.01 A 94 LYS HBx H 1 1.8370 0.01 A 94 LYS HDy H 1 1.5480 0.01 A 94 LYS HEy H 1 2.7790 0.01 A 94 LYS C C 13 178.2900 0.2 A 94 LYS CA C 13 58.7620 0.2 A 94 LYS CB C 13 32.3920 0.2 A 94 LYS CD C 13 28.1670 0.2 A 94 LYS CE C 13 41.4470 0.2 A 94 LYS CG C 13 23.8840 0.2 A 94 LYS N N 15 125.4400 0.1 A 95 ASP H H 1 8.3360 0.01 A 95 ASP HA H 1 4.5670 0.01 A 95 ASP HBy H 1 3.0950 0.01 A 95 ASP HBx H 1 2.6770 0.01 A 95 ASP C C 13 177.8260 0.2 A 95 ASP CA C 13 52.9020 0.2 A 95 ASP CB C 13 39.4240 0.2 A 95 ASP N N 15 114.2920 0.1 A 96 GLY H H 1 7.7970 0.01 A 96 GLY HAx H 1 3.8580 0.01 A 96 GLY C C 13 175.1450 0.2 A 96 GLY CA C 13 47.0420 0.2 A 96 GLY N N 15 109.3740 0.1 A 97 ASN H H 1 8.4300 0.01 A 97 ASN HA H 1 4.6700 0.01 A 97 ASN HBy H 1 3.4290 0.01 A 97 ASN HBx H 1 2.6890 0.01 A 97 ASN C C 13 176.1200 0.2 A 97 ASN CA C 13 52.3160 0.2 A 97 ASN CB C 13 38.2520 0.2 A 97 ASN N N 15 119.9640 0.1 A 98 GLY H H 1 10.6380 0.01 A 98 GLY HAy H 1 4.1190 0.01 A 98 GLY HAx H 1 3.4850 0.01 A 98 GLY C C 13 172.7510 0.2 A 98 GLY CA C 13 44.6980 0.2 A 98 GLY N N 15 112.7260 0.1 A 99 TYR H H 1 7.7080 0.01 A 99 TYR HBx H 1 2.5660 0.01 A 99 TYR C C 13 174.7950 0.2 A 99 TYR CA C 13 56.4180 0.2 A 99 TYR CB C 13 42.9400 0.2 A 99 TYR N N 15 116.4150 0.1 A 100 ILE H H 1 10.1970 0.01 A 100 ILE HG1x H 1 1.1030 0.01 A 100 ILE C C 13 175.5430 0.2 A 100 ILE CA C 13 61.1060 0.2 A 100 ILE CB C 13 39.4240 0.2 A 100 ILE CD1 C 13 16.1250 0.2 A 100 ILE CG1 C 13 26.5390 0.2 A 100 ILE CG2 C 13 17.5180 0.2 A 100 ILE N N 15 127.4880 0.1 A 101 SER H H 1 8.9980 0.01 A 101 SER HA H 1 4.9730 0.01 A 101 SER HBy H 1 4.4900 0.01 A 101 SER HBx H 1 4.0040 0.01 A 101 SER C C 13 175.3000 0.2 A 101 SER CA C 13 55.8320 0.2 A 101 SER CB C 13 66.9660 0.2 A 101 SER N N 15 123.8600 0.1 A 102 ALA H H 1 9.3770 0.01 A 102 ALA HA H 1 3.9380 0.01 A 102 ALA HB% H 1 1.5260 0.01 A 102 ALA C C 13 179.3240 0.2 A 102 ALA CA C 13 55.8320 0.2 A 102 ALA CB C 13 17.7420 0.2 A 102 ALA N N 15 123.3280 0.1 A 103 ALA H H 1 8.3170 0.01 A 103 ALA HA H 1 4.0540 0.01 A 103 ALA HB% H 1 1.4430 0.01 A 103 ALA C C 13 181.5350 0.2 A 103 ALA CA C 13 55.2460 0.2 A 103 ALA CB C 13 18.3280 0.2 A 103 ALA N N 15 118.5360 0.1 A 104 GLU H H 1 7.9770 0.01 A 104 GLU HA H 1 4.0330 0.01 A 104 GLU HBx H 1 2.3110 0.01 A 104 GLU HGx H 1 2.5890 0.01 A 104 GLU HGy H 1 2.8150 0.01 A 104 GLU C C 13 178.9500 0.2 A 104 GLU CA C 13 59.3480 0.2 A 104 GLU CB C 13 28.8760 0.2 A 104 GLU CG C 13 38.2160 0.2 A 104 GLU N N 15 120.4190 0.1 A 105 LEU H H 1 8.5000 0.01 A 105 LEU HA H 1 4.1780 0.01 A 105 LEU HBx H 1 1.9200 0.01 A 105 LEU HDx% H 1 0.6810 0.01 A 105 LEU HG H 1 1.4290 0.01 A 105 LEU C C 13 178.4020 0.2 A 105 LEU CA C 13 58.1760 0.2 A 105 LEU CB C 13 41.7680 0.2 A 105 LEU CDy C 13 23.8800 0.2 A 105 LEU CDx C 13 23.7270 0.2 A 105 LEU CG C 13 26.2740 0.2 A 105 LEU N N 15 120.6580 0.1 A 106 ARG H H 1 8.7270 0.01 A 106 ARG HA H 1 4.0420 0.01 A 106 ARG HBx H 1 1.9510 0.01 A 106 ARG HDy H 1 3.2490 0.01 A 106 ARG HDx H 1 2.6520 0.01 A 106 ARG HGx H 1 1.6530 0.01 A 106 ARG C C 13 177.5060 0.2 A 106 ARG CA C 13 59.9340 0.2 A 106 ARG CB C 13 30.6340 0.2 A 106 ARG CD C 13 43.7000 0.2 A 106 ARG CG C 13 27.6950 0.2 A 106 ARG N N 15 117.8070 0.1 A 107 HIS H H 1 8.0300 0.01 A 107 HIS HBx H 1 3.3760 0.01 A 107 HIS C C 13 177.8620 0.2 A 107 HIS CA C 13 59.9340 0.2 A 107 HIS CB C 13 30.6340 0.2 A 107 HIS N N 15 119.8490 0.1 A 108 VAL H H 1 8.3220 0.01 A 108 VAL C C 13 178.4370 0.2 A 108 VAL CA C 13 66.9660 0.2 A 108 VAL CB C 13 31.8060 0.2 A 108 VAL N N 15 119.7840 0.1 A 109 MET H H 1 8.3970 0.01 A 109 MET HA H 1 4.3430 0.01 A 109 MET HBx H 1 2.0140 0.01 A 109 MET HGx H 1 2.4230 0.01 A 109 MET C C 13 179.2960 0.2 A 109 MET CA C 13 57.0040 0.2 A 109 MET CB C 13 29.4620 0.2 A 109 MET CG C 13 32.0220 0.2 A 109 MET N N 15 115.6990 0.1 A 110 THR H H 1 8.2960 0.01 A 110 THR HG2% H 1 1.2260 0.01 A 110 THR C C 13 178.2900 0.2 A 110 THR CA C 13 66.3800 0.2 A 110 THR CB C 13 68.7240 0.2 A 110 THR CG2 C 13 21.5350 0.2 A 110 THR N N 15 116.3620 0.1 A 111 ASN H H 1 7.9360 0.01 A 111 ASN HA H 1 4.6190 0.01 A 111 ASN HBx H 1 2.8180 0.01 A 111 ASN C C 13 176.6980 0.2 A 111 ASN CA C 13 55.8320 0.2 A 111 ASN CB C 13 38.2520 0.2 A 111 ASN N N 15 122.8090 0.1 A 112 LEU H H 1 7.8150 0.01 A 112 LEU HA H 1 4.3220 0.01 A 112 LEU HBx H 1 1.9130 0.01 A 112 LEU HDx% H 1 0.8010 0.01 A 112 LEU HG H 1 1.6860 0.01 A 112 LEU C C 13 177.2050 0.2 A 112 LEU CA C 13 55.2460 0.2 A 112 LEU CB C 13 42.3540 0.2 A 112 LEU CDx C 13 22.8270 0.2 A 112 LEU CDy C 13 22.8270 0.2 A 112 LEU CG C 13 25.8830 0.2 A 112 LEU N N 15 118.5230 0.1 A 113 GLY H H 1 7.8530 0.01 A 113 GLY HAy H 1 4.2400 0.01 A 113 GLY HAx H 1 3.7450 0.01 A 113 GLY C C 13 174.3540 0.2 A 113 GLY CA C 13 45.2840 0.2 A 113 GLY N N 15 107.2030 0.1 A 114 GLU H H 1 7.9090 0.01 A 114 GLU HA H 1 4.4350 0.01 A 114 GLU HBx H 1 2.0550 0.01 A 114 GLU C C 13 175.3590 0.2 A 114 GLU CA C 13 54.6600 0.2 A 114 GLU CB C 13 30.6340 0.2 A 114 GLU CG C 13 35.0280 0.2 A 114 GLU N N 15 120.1990 0.1 A 115 LYS H H 1 8.6420 0.01 A 115 LYS HA H 1 4.3720 0.01 A 115 LYS HBx H 1 1.6690 0.01 A 115 LYS HDy H 1 1.3530 0.01 A 115 LYS HEy H 1 2.9620 0.01 A 115 LYS C C 13 175.4640 0.2 A 115 LYS CA C 13 55.2460 0.2 A 115 LYS CB C 13 31.8060 0.2 A 115 LYS CD C 13 29.1230 0.2 A 115 LYS CE C 13 42.1070 0.2 A 115 LYS CG C 13 24.4860 0.2 A 115 LYS N N 15 124.4250 0.1 A 116 LEU H H 1 8.1020 0.01 A 116 LEU HA H 1 4.7420 0.01 A 116 LEU HBx H 1 1.6050 0.01 A 116 LEU HDx% H 1 0.7260 0.01 A 116 LEU HG H 1 1.4200 0.01 A 116 LEU C C 13 178.3510 0.2 A 116 LEU CA C 13 54.0740 0.2 A 116 LEU CB C 13 44.1120 0.2 A 116 LEU CDx C 13 24.4390 0.2 A 116 LEU CDy C 13 26.7550 0.2 A 116 LEU CG C 13 27.9720 0.2 A 116 LEU N N 15 125.2580 0.1 A 117 THR H H 1 9.2970 0.01 A 117 THR HA H 1 4.7440 0.01 A 117 THR HB H 1 4.4560 0.01 A 117 THR HG2% H 1 1.3230 0.01 A 117 THR C C 13 175.5220 0.2 A 117 THR CA C 13 60.5200 0.2 A 117 THR CB C 13 71.0680 0.2 A 117 THR CG2 C 13 21.8760 0.2 A 117 THR N N 15 114.8110 0.1 A 118 ASP H H 1 8.9670 0.01 A 118 ASP HBy H 1 2.7450 0.01 A 118 ASP HBx H 1 2.5940 0.01 A 118 ASP C C 13 178.6440 0.2 A 118 ASP CA C 13 57.5900 0.2 A 118 ASP CB C 13 39.4240 0.2 A 118 ASP N N 15 121.2320 0.1 A 119 GLU H H 1 8.6790 0.01 A 119 GLU HA H 1 4.0510 0.01 A 119 GLU HBx H 1 2.0930 0.01 A 119 GLU HGx H 1 2.3600 0.01 A 119 GLU C C 13 178.8470 0.2 A 119 GLU CA C 13 59.9340 0.2 A 119 GLU CB C 13 28.8760 0.2 A 119 GLU CG C 13 36.2010 0.2 A 119 GLU N N 15 119.3570 0.1 A 120 GLU H H 1 7.9980 0.01 A 120 GLU HA H 1 4.0030 0.01 A 120 GLU HGx H 1 2.2470 0.01 A 120 GLU C C 13 179.9960 0.2 A 120 GLU CA C 13 59.3480 0.2 A 120 GLU CB C 13 30.0480 0.2 A 120 GLU CG C 13 37.7610 0.2 A 120 GLU N N 15 118.7610 0.1 A 121 VAL H H 1 8.0510 0.01 A 121 VAL HA H 1 3.4390 0.01 A 121 VAL HGx% H 1 0.9320 0.01 A 121 VAL C C 13 177.4890 0.2 A 121 VAL CA C 13 66.9660 0.2 A 121 VAL CB C 13 31.2200 0.2 A 121 VAL N N 15 121.1650 0.1 A 122 ASP H H 1 8.0920 0.01 A 122 ASP HA H 1 4.3380 0.01 A 122 ASP HBx H 1 2.7020 0.01 A 122 ASP C C 13 179.2260 0.2 A 122 ASP CA C 13 57.5900 0.2 A 122 ASP CB C 13 40.5960 0.2 A 122 ASP N N 15 119.5070 0.1 A 123 GLU H H 1 8.1310 0.01 A 123 GLU HA H 1 4.0330 0.01 A 123 GLU HBx H 1 2.3660 0.01 A 123 GLU HGx H 1 2.6780 0.01 A 123 GLU C C 13 178.6120 0.2 A 123 GLU CA C 13 59.3480 0.2 A 123 GLU CB C 13 29.4620 0.2 A 123 GLU CG C 13 35.9860 0.2 A 123 GLU N N 15 119.8710 0.1 A 124 MET H H 1 7.7810 0.01 A 124 MET CA C 13 60.5200 0.2 A 124 MET CB C 13 32.9780 0.2 A 124 MET N N 15 119.3950 0.1 A 125 ILE HA H 1 4.2340 0.01 A 125 ILE HB H 1 1.8920 0.01 A 125 ILE C C 13 177.5300 0.2 A 125 ILE CA C 13 63.4500 0.2 A 125 ILE CB C 13 35.9080 0.2 A 125 ILE CD1 C 13 10.1100 0.2 A 125 ILE CG1 C 13 27.2470 0.2 A 125 ILE CG2 C 13 16.4530 0.2 A 126 ARG H H 1 8.5550 0.01 A 126 ARG HA H 1 4.1050 0.01 A 126 ARG HBx H 1 1.9090 0.01 A 126 ARG HDy H 1 3.2680 0.01 A 126 ARG HGx H 1 1.7110 0.01 A 126 ARG C C 13 178.9280 0.2 A 126 ARG CA C 13 59.9340 0.2 A 126 ARG CB C 13 30.4140 0.2 A 126 ARG CD C 13 43.4760 0.2 A 126 ARG CG C 13 27.9440 0.2 A 126 ARG N N 15 118.4030 0.1 A 127 GLU H H 1 7.9900 0.01 A 127 GLU HA H 1 4.0390 0.01 A 127 GLU HBx H 1 2.2350 0.01 A 127 GLU HGx H 1 2.4190 0.01 A 127 GLU C C 13 176.9410 0.2 A 127 GLU CA C 13 58.7620 0.2 A 127 GLU CB C 13 30.0480 0.2 A 127 GLU CG C 13 36.0530 0.2 A 127 GLU N N 15 116.3470 0.1 A 128 ALA H H 1 7.1260 0.01 A 128 ALA HA H 1 4.4560 0.01 A 128 ALA HB% H 1 1.1740 0.01 A 128 ALA C C 13 177.7570 0.2 A 128 ALA CA C 13 51.7300 0.2 A 128 ALA CB C 13 21.8440 0.2 A 128 ALA N N 15 117.2510 0.1 A 129 ASP H H 1 7.9620 0.01 A 129 ASP HA H 1 4.5020 0.01 A 129 ASP HBy H 1 2.8450 0.01 A 129 ASP HBx H 1 2.5250 0.01 A 129 ASP C C 13 175.8540 0.2 A 129 ASP CA C 13 54.0740 0.2 A 129 ASP CB C 13 40.5960 0.2 A 129 ASP N N 15 117.9090 0.1 A 130 ILE H H 1 8.2610 0.01 A 130 ILE HD1% H 1 0.9200 0.01 A 130 ILE C C 13 177.9950 0.2 A 130 ILE CA C 13 63.4500 0.2 A 130 ILE CB C 13 38.8380 0.2 A 130 ILE CD1 C 13 12.6000 0.2 A 130 ILE CG1 C 13 27.8000 0.2 A 130 ILE CG2 C 13 17.3560 0.2 A 130 ILE N N 15 127.9000 0.1 A 131 ASP H H 1 8.3720 0.01 A 131 ASP HA H 1 4.5410 0.01 A 131 ASP HBy H 1 3.0930 0.01 A 131 ASP HBx H 1 2.6770 0.01 A 131 ASP C C 13 178.2830 0.2 A 131 ASP CA C 13 54.0740 0.2 A 131 ASP CB C 13 40.0100 0.2 A 131 ASP N N 15 116.6780 0.1 A 132 GLY H H 1 7.6790 0.01 A 132 GLY HAy H 1 4.0000 0.01 A 132 GLY HAx H 1 3.8470 0.01 A 132 GLY C C 13 175.3650 0.2 A 132 GLY CA C 13 47.6280 0.2 A 132 GLY N N 15 108.8660 0.1 A 133 ASP H H 1 8.4150 0.01 A 133 ASP HA H 1 4.4930 0.01 A 133 ASP HBy H 1 2.9820 0.01 A 133 ASP HBx H 1 2.5330 0.01 A 133 ASP C C 13 177.5820 0.2 A 133 ASP CA C 13 53.4880 0.2 A 133 ASP CB C 13 40.0100 0.2 A 133 ASP N N 15 120.9680 0.1 A 134 GLY H H 1 10.3000 0.01 A 134 GLY HAy H 1 4.0810 0.01 A 134 GLY HAx H 1 3.4710 0.01 A 134 GLY C C 13 172.8470 0.2 A 134 GLY CA C 13 45.8700 0.2 A 134 GLY N N 15 112.8210 0.1 A 135 GLN H H 1 8.0220 0.01 A 135 GLN HA H 1 5.0030 0.01 A 135 GLN HBx H 1 2.0260 0.01 A 135 GLN C C 13 175.0190 0.2 A 135 GLN CA C 13 52.9020 0.2 A 135 GLN CB C 13 32.9780 0.2 A 135 GLN N N 15 115.3910 0.1 A 136 VAL H H 1 9.1760 0.01 A 136 VAL HA H 1 5.1340 0.01 A 136 VAL C C 13 175.9120 0.2 A 136 VAL CA C 13 61.6130 0.2 A 136 VAL CB C 13 33.6940 0.2 A 136 VAL N N 15 125.5960 0.1 A 137 ASN H H 1 9.5760 0.01 A 137 ASN HA H 1 5.3710 0.01 A 137 ASN HBx H 1 3.1600 0.01 A 137 ASN C C 13 174.8050 0.2 A 137 ASN CA C 13 51.1440 0.2 A 137 ASN CB C 13 38.2520 0.2 A 137 ASN N N 15 129.2290 0.1 A 138 TYR H H 1 8.2680 0.01 A 138 TYR HBy H 1 2.3770 0.01 A 138 TYR HBx H 1 2.0890 0.01 A 138 TYR C C 13 176.1190 0.2 A 138 TYR CA C 13 62.2780 0.2 A 138 TYR CB C 13 37.6660 0.2 A 138 TYR N N 15 118.5970 0.1 A 139 GLU H H 1 8.0870 0.01 A 139 GLU HA H 1 4.1230 0.01 A 139 GLU HBy H 1 2.0490 0.01 A 139 GLU HGx H 1 2.3600 0.01 A 139 GLU C C 13 179.1890 0.2 A 139 GLU CA C 13 59.9340 0.2 A 139 GLU CB C 13 28.8760 0.2 A 139 GLU CG C 13 36.8720 0.2 A 139 GLU N N 15 118.4410 0.1 A 140 GLU H H 1 7.7610 0.01 A 140 GLU HA H 1 3.9140 0.01 A 140 GLU HBx H 1 2.3780 0.01 A 140 GLU HGx H 1 2.8700 0.01 A 140 GLU C C 13 179.3280 0.2 A 140 GLU CA C 13 58.7620 0.2 A 140 GLU CB C 13 29.4620 0.2 A 140 GLU CG C 13 37.2800 0.2 A 140 GLU N N 15 120.9920 0.1 A 141 PHE H H 1 8.5290 0.01 A 141 PHE C C 13 176.8430 0.2 A 141 PHE CA C 13 61.6920 0.2 A 141 PHE CB C 13 39.9170 0.2 A 141 PHE N N 15 123.7980 0.1 A 142 VAL H H 1 8.6720 0.01 A 142 VAL C C 13 179.4970 0.2 A 142 VAL CA C 13 66.9660 0.2 A 142 VAL CB C 13 31.2200 0.2 A 142 VAL N N 15 119.2180 0.1 A 143 GLN H H 1 7.5500 0.01 A 143 GLN HA H 1 3.8450 0.01 A 143 GLN HGx H 1 2.3740 0.01 A 143 GLN C C 13 177.8810 0.2 A 143 GLN CA C 13 58.7620 0.2 A 143 GLN CB C 13 27.7040 0.2 A 143 GLN CG C 13 33.8930 0.2 A 143 GLN N N 15 118.3620 0.1 A 144 MET H H 1 7.3000 0.01 A 144 MET HBx H 1 2.0370 0.01 A 144 MET HGx H 1 2.8960 0.01 A 144 MET C C 13 177.8030 0.2 A 144 MET CA C 13 56.4180 0.2 A 144 MET CB C 13 31.8060 0.2 A 144 MET CG C 13 30.9780 0.2 A 144 MET N N 15 116.7200 0.1 A 145 MET H H 1 7.7320 0.01 A 145 MET HA H 1 4.1150 0.01 A 145 MET HBx H 1 2.0740 0.01 A 145 MET C C 13 177.2030 0.2 A 145 MET CA C 13 56.4180 0.2 A 145 MET CB C 13 31.8060 0.2 A 145 MET CG C 13 32.2730 0.2 A 145 MET N N 15 116.1160 0.1 A 146 THR H H 1 7.6490 0.01 A 146 THR HA H 1 4.2880 0.01 A 146 THR C C 13 174.1540 0.2 A 146 THR CA C 13 61.6920 0.2 A 146 THR CB C 13 69.8960 0.2 A 146 THR CG2 C 13 21.3340 0.2 A 146 THR N N 15 108.8680 0.1 A 147 ALA H H 1 7.5460 0.01 A 147 ALA HA H 1 4.2870 0.01 A 147 ALA HB% H 1 1.4210 0.01 A 147 ALA C C 13 176.6860 0.2 A 147 ALA CA C 13 52.9020 0.2 A 147 ALA CB C 13 18.9140 0.2 A 147 ALA N N 15 126.9340 0.1 A 148 LYS H H 1 7.9350 0.01 A 148 LYS CA C 13 57.5900 0.2 A 148 LYS CB C 13 34.1500 0.2 A 148 LYS N N 15 126.3110 0.1 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 79 THR H A 79 THR HG2% 1.0 0.0 4.02 2 2 A 110 THR HG2% A 111 ASN H 1.0 0.0 3.83 3 3 A 110 THR HG2% A 111 ASN HA 1.0 0.0 3.55 4 4 A 79 THR HG2% A 79 THR HA 1.0 0.0 3.25 5 5 A 85 ILE HA A 85 ILE HD11 1.0 0.0 4.21 6 6 A 85 ILE HA A 85 ILE HG21 1.0 0.0 3.77 7 7 A 85 ILE HA A 145 MET HE1 1.0 0.0 3.79 8 8 A 85 ILE HA A 84 GLU HA 1.0 0.0 4.93 9 9 A 82 GLU HA A 85 ILE HB 1.0 0.0 4.15 10 10 A 85 ILE H A 85 ILE HG1x 1.0 0.0 5.50 11 11 A 125 ILE HG21 A 128 ALA H 1.0 0.0 4.51 12 12 A 125 ILE HG21 A 135 GLN H 1.0 0.0 3.89 13 13 A 125 ILE HG21 A 132 GLY H 1.0 0.0 5.39 14 14 A 125 ILE HG21 A 136 VAL HB 1.0 0.0 4.24 15 15 A 125 ILE HG21 A 129 ASP HBx 1.0 0.0 4.13 16 16 A 125 ILE HG21 A 134 GLY HAy 1.0 0.0 4.54 17 17 A 125 ILE HG21 A 126 ARG HA 1.0 0.0 3.82 18 18 A 125 ILE HG21 A 134 GLY HAx 1.0 0.0 4.54 19 19 A 125 ILE HG21 A 129 ASP HA 1.0 0.0 4.41 20 20 A 125 ILE HG21 A 122 ASP HA 1.0 0.0 4.95 21 21 A 125 ILE HG21 A 135 GLN HA 1.0 0.0 4.20 22 22 A 125 ILE HG21 A 130 ILE H 1.0 0.0 5.50 23 23 A 86 ARG HBx A 87 GLU HA 1.0 0.0 4.78 24 24 A 87 GLU HA A 86 ARG HBy 1.0 0.0 5.09 25 25 A 118 ASP HBx A 119 GLU HGx 1.0 0.0 5.50 26 26 A 118 ASP HBx A 119 GLU HGy 1.0 0.0 5.50 27 27 A 145 MET HE1 A 89 PHE H 1.0 0.0 4.65 28 28 A 145 MET HE1 A 89 PHE HE% 1.0 0.0 3.43 29 29 A 145 MET HE1 A 145 MET HBx 1.0 0.0 3.52 30 30 A 145 MET HE1 A 145 MET HBy 1.0 0.0 3.52 31 31 A 145 MET HE1 A 85 ILE HG1x 1.0 0.0 3.97 32 32 A 85 ILE HD11 A 145 MET HE1 1.0 0.0 4.08 33 33 A 86 ARG HA A 89 PHE HBx 1.0 0.0 4.68 34 34 A 89 PHE HBy A 138 TYR HD% 1.0 0.0 5.50 35 35 A 89 PHE HBx A 138 TYR HD% 1.0 0.0 5.50 36 36 A 106 ARG HBx A 107 HIS HA 1.0 0.0 4.87 37 37 A 106 ARG HBy A 121 VAL HGx% 1.0 0.0 3.75 38 38 A 90 ARG HA A 90 ARG HDx 1.0 0.0 4.20 39 39 A 90 ARG HA A 90 ARG HDy 1.0 0.0 4.20 40 40 A 126 ARG HA A 126 ARG HDx 1.0 0.0 3.87 41 41 A 126 ARG HA A 126 ARG HDy 1.0 0.0 3.87 42 42 A 108 VAL H A 108 VAL HG21 1.0 0.0 4.24 43 43 A 111 ASN H A 108 VAL HG21 1.0 0.0 5.50 44 44 A 91 VAL H A 91 VAL HG21 1.0 0.0 4.24 45 45 A 92 PHE H A 91 VAL HG21 1.0 0.0 5.50 46 46 A 88 ALA HA A 91 VAL HG21 1.0 0.0 4.41 47 47 A 108 VAL HA A 108 VAL HG21 1.0 0.0 3.59 48 48 A 108 VAL HG21 A 94 LYS HDx 1.0 0.0 5.05 49 49 A 108 VAL HG21 A 94 LYS HDy 1.0 0.0 5.05 50 50 A 89 PHE HBy A 90 ARG HA 1.0 0.0 4.29 51 51 A 94 LYS HBx A 104 GLU HBy 1.0 0.0 4.25 52 52 A 125 ILE HG21 A 126 ARG HGx 1.0 0.0 3.83 53 53 A 126 ARG HA A 126 ARG HGx 1.0 0.0 4.08 54 54 A 122 ASP HA A 126 ARG HGx 1.0 0.0 5.50 55 55 A 126 ARG HGx A 127 GLU H 1.0 0.0 4.94 56 56 A 105 LEU H A 104 GLU HGy 1.0 0.0 5.20 57 57 A 99 TYR HBy A 135 GLN HBx 1.0 0.0 5.50 58 58 A 99 TYR HBy A 135 GLN HBy 1.0 0.0 3.74 59 59 A 125 ILE HG21 A 100 ILE HB 1.0 0.0 4.87 60 60 A 100 ILE HB A 136 VAL HG11 1.0 0.0 4.08 61 61 A 100 ILE HB A 136 VAL H 1.0 0.0 4.97 62 62 A 137 ASN H A 136 VAL HG11 1.0 0.0 4.98 63 63 A 141 PHE HE% A 136 VAL HG11 1.0 0.0 4.67 64 64 A 136 VAL HA A 136 VAL HG11 1.0 0.0 3.90 65 65 A 129 ASP HA A 136 VAL HG11 1.0 0.0 4.69 66 66 A 100 ILE H A 100 ILE HG21 1.0 0.0 4.74 67 67 A 105 LEU H A 100 ILE HG21 1.0 0.0 4.29 68 68 A 141 PHE HE% A 100 ILE HG21 1.0 0.0 4.52 69 69 A 100 ILE HG21 A 101 SER HA 1.0 0.0 5.19 70 70 A 100 ILE HG21 A 100 ILE HA 1.0 0.0 3.88 71 71 A 100 ILE HG21 A 105 LEU HA 1.0 0.0 4.99 72 72 A 100 ILE HG21 A 92 PHE HBx 1.0 0.0 3.65 73 73 A 100 ILE HG21 A 104 GLU HBx 1.0 0.0 3.72 74 74 A 100 ILE HG21 A 100 ILE HG1x 1.0 0.0 3.31 75 75 A 100 ILE HG21 A 105 LEU HG 1.0 0.0 3.55 76 76 A 100 ILE HG21 A 105 LEU HD21 1.0 0.0 3.74 77 77 A 100 ILE HG21 A 100 ILE HG1y 1.0 0.0 3.94 78 78 A 100 ILE HG21 A 100 ILE HD11 1.0 0.0 3.20 79 79 A 100 ILE HB A 100 ILE HD11 1.0 0.0 3.72 80 80 A 100 ILE HD11 A 92 PHE HBy 1.0 0.0 3.76 81 81 A 92 PHE HBx A 100 ILE HD11 1.0 0.0 3.81 82 82 A 89 PHE HBx A 100 ILE HD11 1.0 0.0 5.42 83 83 A 100 ILE HD11 A 89 PHE HA 1.0 0.0 5.50 84 84 A 100 ILE HA A 100 ILE HD11 1.0 0.0 4.61 85 85 A 100 ILE HD11 A 89 PHE HD% 1.0 0.0 3.79 86 86 A 100 ILE HD11 A 141 PHE HD% 1.0 0.0 4.35 87 87 A 141 PHE HE% A 100 ILE HD11 1.0 0.0 4.16 88 88 A 89 PHE H A 100 ILE HD11 1.0 0.0 5.50 89 89 A 100 ILE H A 100 ILE HD11 1.0 0.0 4.94 90 90 A 141 PHE HE% A 100 ILE HG1y 1.0 0.0 5.50 91 91 A 141 PHE HE% A 100 ILE HG1x 1.0 0.0 5.50 92 92 A 102 ALA HA A 125 ILE HB 1.0 0.0 5.32 93 93 A 121 VAL HGx% A 102 ALA HA 1.0 0.0 3.61 94 94 A 105 LEU HG A 102 ALA HA 1.0 0.0 3.58 95 95 A 102 ALA HB% A 106 ARG H 1.0 0.0 5.08 96 96 A 105 LEU H A 102 ALA HB% 1.0 0.0 4.68 97 97 A 102 ALA HB% A 103 ALA H 1.0 0.0 3.62 98 98 A 101 SER HA A 102 ALA HB% 1.0 0.0 4.25 99 99 A 102 ALA HB% A 121 VAL HA 1.0 0.0 5.50 100 100 A 102 ALA HB% A 122 ASP HBy 1.0 0.0 5.50 101 101 A 125 ILE HB A 102 ALA HB% 1.0 0.0 4.28 102 102 A 102 ALA HB% A 125 ILE HD11 1.0 0.0 3.26 103 103 A 105 LEU HD21 A 102 ALA HB% 1.0 0.0 5.01 104 104 A 102 ALA H A 103 ALA HB% 1.0 0.0 4.99 105 105 A 103 ALA H A 103 ALA HB% 1.0 0.0 3.28 106 106 A 104 GLU HBy A 103 ALA HB% 1.0 0.0 5.50 107 107 A 94 LYS HBx A 104 GLU HBx 1.0 0.0 5.50 108 108 A 104 GLU HBx A 103 ALA HB% 1.0 0.0 5.50 109 109 A 104 GLU HBx A 105 LEU HBx 1.0 0.0 5.50 110 110 A 104 GLU HBy A 94 LYS HDx 1.0 0.0 5.50 111 111 A 104 GLU HBy A 94 LYS HDy 1.0 0.0 5.50 112 112 A 104 GLU HBy A 100 ILE HG21 1.0 0.0 5.50 113 113 A 93 ASP HA A 104 GLU HGx 1.0 0.0 5.50 114 114 A 93 ASP HA A 104 GLU HGy 1.0 0.0 5.50 115 115 A 103 ALA HB% A 104 GLU HGy 1.0 0.0 4.79 116 116 A 103 ALA HB% A 104 GLU HGx 1.0 0.0 4.79 117 117 A 105 LEU HA A 105 LEU HD21 1.0 0.0 3.47 118 118 A 105 LEU HBx A 105 LEU HDx% 1.0 0.0 3.59 119 119 A 105 LEU HDx% A 105 LEU HBy 1.0 0.0 3.44 120 120 A 102 ALA HA A 105 LEU HBx 1.0 0.0 4.73 121 121 A 102 ALA HA A 105 LEU HBy 1.0 0.0 4.78 122 122 A 106 ARG H A 105 LEU HBy 1.0 0.0 4.69 123 123 A 105 LEU HD21 A 109 MET H 1.0 0.0 5.50 124 124 A 105 LEU HD21 A 102 ALA HA 1.0 0.0 5.50 125 125 A 105 LEU HD21 A 105 LEU HBy 1.0 0.0 3.50 126 126 A 121 VAL HGx% A 105 LEU HD21 1.0 0.0 4.37 127 127 A 105 LEU HG A 102 ALA HB% 1.0 0.0 3.90 128 128 A 121 VAL HG21 A 106 ARG HDx 1.0 0.0 4.88 129 129 A 121 VAL HG21 A 106 ARG HDy 1.0 0.0 4.88 130 130 A 105 LEU HA A 108 VAL HB 1.0 0.0 4.35 131 131 A 108 VAL HB A 112 LEU HDx% 1.0 0.0 4.73 132 132 A 109 MET HGy A 116 LEU HDx% 1.0 0.0 5.08 133 133 A 116 LEU HD21 A 109 MET HGy 1.0 0.0 5.08 134 134 A 109 MET HGx A 116 LEU HDx% 1.0 0.0 5.08 135 135 A 109 MET HGx A 116 LEU HD21 1.0 0.0 5.08 136 136 A 116 LEU HG A 109 MET HGy 1.0 0.0 5.50 137 137 A 116 LEU HG A 109 MET HGx 1.0 0.0 5.50 138 138 A 105 LEU HBy A 109 MET HGy 1.0 0.0 4.42 139 139 A 105 LEU HBy A 109 MET HGx 1.0 0.0 4.42 140 140 A 110 THR HG2% A 110 THR HA 1.0 0.0 3.45 141 141 A 111 ASN H A 110 THR HB 1.0 0.0 3.93 142 142 A 110 THR H A 111 ASN HBx 1.0 0.0 5.50 143 143 A 112 LEU HDx% A 112 LEU HBy 1.0 0.0 3.75 144 144 A 112 LEU HDx% A 112 LEU HBx 1.0 0.0 3.75 145 145 A 112 LEU HDx% A 109 MET HBx 1.0 0.0 5.50 146 146 A 112 LEU HDx% A 109 MET HBy 1.0 0.0 5.50 147 147 A 112 LEU HA A 112 LEU HD21 1.0 0.0 3.45 148 148 A 112 LEU HDx% A 112 LEU H 1.0 0.0 4.28 149 149 A 142 VAL HB A 143 GLN H 1.0 0.0 3.88 150 150 A 142 VAL HB A 144 MET H 1.0 0.0 5.31 151 151 A 130 ILE H A 130 ILE HG1y 1.0 0.0 3.99 152 152 A 126 ARG HBx A 126 ARG HGy 1.0 0.0 2.89 153 153 A 106 ARG H A 121 VAL HG21 1.0 0.0 5.50 154 154 A 121 VAL HG21 A 121 VAL H 1.0 0.0 3.36 155 155 A 121 VAL HA A 121 VAL HG21 1.0 0.0 3.45 156 156 A 106 ARG HBy A 121 VAL HG21 1.0 0.0 3.55 157 157 A 121 VAL HG21 A 116 LEU HG 1.0 0.0 4.76 158 158 A 117 THR HA A 117 THR HG2% 1.0 0.0 3.62 159 159 A 118 ASP HBy A 119 GLU HGx 1.0 0.0 5.50 160 160 A 119 GLU HGy A 118 ASP HBy 1.0 0.0 5.50 161 161 A 120 GLU H A 119 GLU HBx 1.0 0.0 3.84 162 162 A 120 GLU H A 119 GLU HBy 1.0 0.0 3.84 163 163 A 121 VAL HA A 105 LEU HDx% 1.0 0.0 4.05 164 164 A 121 VAL HGx% A 121 VAL HA 1.0 0.0 3.25 165 165 A 102 ALA HB% A 121 VAL HB 1.0 0.0 4.21 166 166 A 121 VAL HGx% A 105 LEU HDx% 1.0 0.0 2.91 167 167 A 121 VAL HGx% A 102 ALA HB% 1.0 0.0 3.05 168 168 A 121 VAL HGx% A 105 LEU HBy 1.0 0.0 3.76 169 169 A 121 VAL HGx% A 122 ASP HBx 1.0 0.0 4.57 170 170 A 121 VAL HGx% A 105 LEU HA 1.0 0.0 4.66 171 171 A 122 ASP HA A 121 VAL HGx% 1.0 0.0 4.14 172 172 A 121 VAL HGx% A 105 LEU H 1.0 0.0 4.99 173 173 A 122 ASP HBy A 119 GLU HA 1.0 0.0 3.62 174 174 A 122 ASP HBx A 119 GLU HA 1.0 0.0 4.10 175 175 A 122 ASP HBy A 121 VAL HB 1.0 0.0 5.25 176 176 A 121 VAL HB A 122 ASP HBx 1.0 0.0 4.53 177 177 A 122 ASP HBy A 122 ASP H 1.0 0.0 3.64 178 178 A 100 ILE HG21 A 125 ILE HD11 1.0 0.0 3.01 179 179 A 100 ILE HB A 125 ILE HD11 1.0 0.0 3.79 180 180 A 104 GLU HBx A 125 ILE HD11 1.0 0.0 4.87 181 181 A 102 ALA HA A 125 ILE HD11 1.0 0.0 3.30 182 182 A 122 ASP HA A 125 ILE HD11 1.0 0.0 4.67 183 183 A 101 SER HA A 125 ILE HD11 1.0 0.0 4.27 184 184 A 135 GLN H A 125 ILE HD11 1.0 0.0 5.29 185 185 A 125 ILE HD11 A 125 ILE H 1.0 0.0 5.25 186 186 A 136 VAL H A 125 ILE HD11 1.0 0.0 5.50 187 187 A 128 ALA H A 144 MET HE1 1.0 0.0 4.07 188 188 A 144 MET HE1 A 127 GLU HA 1.0 0.0 4.44 189 189 A 144 MET HE1 A 144 MET HBx 1.0 0.0 5.00 190 190 A 144 MET HE1 A 144 MET HBy 1.0 0.0 5.00 191 191 A 146 THR H A 146 THR HG21 1.0 0.0 3.97 192 192 A 125 ILE HG21 A 128 ALA HB% 1.0 0.0 3.72 193 193 A 126 ARG HA A 129 ASP HBy 1.0 0.0 4.20 194 194 A 126 ARG HA A 129 ASP HBx 1.0 0.0 4.20 195 195 A 129 ASP H A 129 ASP HBx 1.0 0.0 3.49 196 196 A 143 GLN HA A 143 GLN HGx 1.0 0.0 3.84 197 197 A 143 GLN HA A 143 GLN HGy 1.0 0.0 3.84 198 198 A 130 ILE H A 130 ILE HB 1.0 0.0 3.49 199 199 A 129 ASP HA A 130 ILE HB 1.0 0.0 4.91 200 200 A 130 ILE HB A 140 GLU HGx 1.0 0.0 3.73 201 201 A 130 ILE HB A 130 ILE HD1% 1.0 0.0 3.73 202 202 A 130 ILE HD1% A 130 ILE HA 1.0 0.0 4.01 203 203 A 130 ILE HD1% A 140 GLU HA 1.0 0.0 4.44 204 204 A 129 ASP HA A 130 ILE HD1% 1.0 0.0 5.27 205 205 A 130 ILE HG21 A 130 ILE HG1y 1.0 0.0 3.97 206 206 A 130 ILE HG21 A 130 ILE HG1x 1.0 0.0 3.97 207 207 A 140 GLU HGx A 130 ILE HG21 1.0 0.0 4.54 208 208 A 130 ILE HA A 130 ILE HG21 1.0 0.0 3.73 209 209 A 130 ILE HG21 A 131 ASP HA 1.0 0.0 4.55 210 210 A 130 ILE H A 130 ILE HG21 1.0 0.0 3.98 211 211 A 132 GLY HAx A 134 GLY H 1.0 0.0 5.50 212 212 A 132 GLY HAx A 133 ASP HA 1.0 0.0 4.78 213 213 A 133 ASP HA A 132 GLY HAy 1.0 0.0 4.63 214 214 A 135 GLN HBx A 99 TYR HD% 1.0 0.0 5.50 215 215 A 135 GLN HBy A 99 TYR HD% 1.0 0.0 5.50 216 216 A 141 PHE HE% A 136 VAL HG21 1.0 0.0 4.67 217 217 A 136 VAL HA A 136 VAL HG21 1.0 0.0 3.90 218 218 A 129 ASP HA A 136 VAL HG21 1.0 0.0 4.69 219 219 A 100 ILE HB A 136 VAL HG21 1.0 0.0 4.08 220 220 A 138 TYR HD% A 138 TYR HA 1.0 0.0 3.80 221 221 A 89 PHE HD% A 138 TYR HA 1.0 0.0 4.63 222 222 A 138 TYR HA A 138 TYR HE% 1.0 0.0 4.66 223 223 A 138 TYR H A 138 TYR HBx 1.0 0.0 3.71 224 224 A 144 MET H A 143 GLN HBx 1.0 0.0 4.74 225 225 A 130 ILE H A 140 GLU HGy 1.0 0.0 5.50 226 226 A 138 TYR H A 140 GLU HGy 1.0 0.0 5.50 227 227 A 130 ILE H A 140 GLU HGx 1.0 0.0 3.90 228 228 A 129 ASP HA A 140 GLU HGx 1.0 0.0 5.50 229 229 A 140 GLU HA A 140 GLU HGy 1.0 0.0 4.11 230 230 A 140 GLU HGx A 140 GLU HA 1.0 0.0 3.51 231 231 A 130 ILE HB A 140 GLU HGy 1.0 0.0 4.91 232 232 A 130 ILE HD1% A 140 GLU HGy 1.0 0.0 4.84 233 233 A 140 GLU HGx A 130 ILE HD1% 1.0 0.0 4.31 234 234 A 142 VAL HA A 142 VAL HG11 1.0 0.0 3.62 235 235 A 85 ILE HG21 A 142 VAL HA 1.0 0.0 3.82 236 236 A 145 MET HE1 A 142 VAL HA 1.0 0.0 4.31 237 237 A 108 VAL HA A 108 VAL HG11 1.0 0.0 3.59 238 238 A 108 VAL HA A 112 LEU HG 1.0 0.0 4.37 239 239 A 111 ASN H A 108 VAL HA 1.0 0.0 4.35 240 240 A 91 VAL H A 92 PHE HBy 1.0 0.0 4.74 241 241 A 92 PHE HBx A 93 ASP H 1.0 0.0 4.81 242 242 A 100 ILE HG1y A 92 PHE HBy 1.0 0.0 4.87 243 243 A 92 PHE HBx A 100 ILE HG1y 1.0 0.0 4.91 244 244 A 141 PHE HD% A 142 VAL HG11 1.0 0.0 5.50 245 245 A 138 TYR HD% A 142 VAL HG11 1.0 0.0 5.50 246 246 A 143 GLN HA A 142 VAL HG11 1.0 0.0 5.50 247 247 A 85 ILE HG21 A 142 VAL HG11 1.0 0.0 3.58 248 248 A 144 MET H A 143 GLN HGx 1.0 0.0 5.50 249 249 A 144 MET H A 143 GLN HGy 1.0 0.0 5.50 250 250 A 85 ILE HG21 A 85 ILE H 1.0 0.0 4.60 251 251 A 85 ILE HG21 A 88 ALA H 1.0 0.0 5.30 252 252 A 85 ILE HG21 A 141 PHE HD% 1.0 0.0 4.35 253 253 A 85 ILE HG21 A 89 PHE HD% 1.0 0.0 3.80 254 254 A 85 ILE HG21 A 138 TYR HD% 1.0 0.0 5.46 255 255 A 85 ILE HG21 A 82 GLU HA 1.0 0.0 4.87 256 256 A 85 ILE HG21 A 89 PHE HBx 1.0 0.0 4.64 257 257 A 85 ILE HG21 A 145 MET HE1 1.0 0.0 3.45 258 258 A 85 ILE HD11 A 85 ILE HG21 1.0 0.0 3.24 259 259 A 85 ILE HD11 A 85 ILE HB 1.0 0.0 3.61 260 260 A 85 ILE HD11 A 142 VAL HA 1.0 0.0 4.89 261 261 A 85 ILE HD11 A 82 GLU HA 1.0 0.0 3.91 262 262 A 89 PHE HE% A 88 ALA HB% 1.0 0.0 4.45 263 263 A 85 ILE HD11 A 88 ALA HB% 1.0 0.0 5.50 264 264 A 145 MET HE1 A 88 ALA HB% 1.0 0.0 4.03 265 265 A 88 ALA HB% A 84 GLU HGx 1.0 0.0 5.50 266 266 A 88 ALA HB% A 84 GLU HGy 1.0 0.0 5.50 267 267 A 142 VAL HA A 88 ALA HB% 1.0 0.0 5.50 268 268 A 116 LEU H A 116 LEU HDx% 1.0 0.0 5.50 269 269 A 105 LEU H A 105 LEU HDx% 1.0 0.0 5.50 270 270 A 105 LEU HA A 105 LEU HDx% 1.0 0.0 4.31 271 271 A 102 ALA HA A 105 LEU HDx% 1.0 0.0 5.11 272 272 A 105 LEU HDx% A 124 MET HBx 1.0 0.0 4.27 273 273 A 105 LEU HDx% A 124 MET HBy 1.0 0.0 4.27 274 274 A 105 LEU H A 105 LEU HG 1.0 0.0 5.50 275 275 A 85 ILE HG21 A 142 VAL HG21 1.0 0.0 3.58 276 276 A 142 VAL HA A 142 VAL HG21 1.0 0.0 3.62 277 277 A 143 GLN HA A 142 VAL HG21 1.0 0.0 5.50 278 278 A 138 TYR HD% A 142 VAL HG21 1.0 0.0 5.50 279 279 A 141 PHE HD% A 142 VAL HG21 1.0 0.0 5.50 280 280 A 143 GLN H A 142 VAL HG21 1.0 0.0 4.51 281 281 A 91 VAL HA A 91 VAL HG11 1.0 0.0 3.54 282 282 A 94 LYS HDx A 108 VAL HG11 1.0 0.0 5.05 283 283 A 94 LYS HDy A 108 VAL HG11 1.0 0.0 5.05 284 284 A 88 ALA HA A 91 VAL HG11 1.0 0.0 4.41 285 285 A 91 VAL HA A 91 VAL HG21 1.0 0.0 3.54 286 286 A 139 GLU HA A 139 GLU HGx 1.0 0.0 3.88 287 287 A 139 GLU HA A 139 GLU HGy 1.0 0.0 3.88 288 288 A 85 ILE H A 84 GLU HGx 1.0 0.0 5.50 289 289 A 85 ILE H A 84 GLU HGy 1.0 0.0 5.50 290 290 A 108 VAL HB A 94 LYS HEx 1.0 0.0 5.25 291 291 A 108 VAL HB A 94 LYS HEy 1.0 0.0 5.25 292 292 A 125 ILE HG21 A 129 ASP HBy 1.0 0.0 4.13 293 293 A 85 ILE HD11 A 89 PHE HE% 1.0 0.0 5.50 294 294 A 79 THR HG2% A 80 ASP H 1.0 0.0 5.50 295 295 A 81 SER H A 81 SER HBx 1.0 0.0 4.01 296 296 A 82 GLU H A 83 GLU H 1.0 0.0 3.68 297 297 A 82 GLU H A 82 GLU HGx 1.0 0.0 5.24 298 298 A 82 GLU H A 82 GLU HGy 1.0 0.0 5.24 299 299 A 85 ILE HD11 A 82 GLU H 1.0 0.0 5.50 300 300 A 83 GLU H A 81 SER HA 1.0 0.0 4.90 301 301 A 83 GLU H A 83 GLU HGx 1.0 0.0 4.77 302 302 A 83 GLU H A 83 GLU HGy 1.0 0.0 4.77 303 303 A 83 GLU H A 83 GLU HBx 1.0 0.0 3.45 304 304 A 83 GLU H A 83 GLU HBy 1.0 0.0 3.45 305 305 A 88 ALA H A 87 GLU H 1.0 0.0 3.62 306 306 A 89 PHE HBx A 88 ALA H 1.0 0.0 4.83 307 307 A 85 ILE HB A 85 ILE H 1.0 0.0 3.56 308 308 A 85 ILE H A 85 ILE HG1y 1.0 0.0 2.86 309 309 A 88 ALA H A 88 ALA HB% 1.0 0.0 3.47 310 310 A 85 ILE HD11 A 85 ILE H 1.0 0.0 4.20 311 311 A 85 ILE H A 86 ARG H 1.0 0.0 3.39 312 312 A 89 PHE HD% A 86 ARG H 1.0 0.0 5.50 313 313 A 85 ILE HB A 86 ARG H 1.0 0.0 3.23 314 314 A 86 ARG HBx A 86 ARG H 1.0 0.0 3.42 315 315 A 85 ILE HG21 A 86 ARG H 1.0 0.0 4.03 316 316 A 85 ILE HD11 A 86 ARG H 1.0 0.0 4.49 317 317 A 87 GLU H A 86 ARG H 1.0 0.0 3.90 318 318 A 86 ARG HBx A 87 GLU H 1.0 0.0 3.67 319 319 A 85 ILE HG21 A 87 GLU H 1.0 0.0 5.50 320 320 A 89 PHE H A 88 ALA H 1.0 0.0 3.40 321 321 A 89 PHE H A 89 PHE HBy 1.0 0.0 3.73 322 322 A 89 PHE H A 88 ALA HB% 1.0 0.0 4.35 323 323 A 89 PHE H A 90 ARG H 1.0 0.0 4.35 324 324 A 91 VAL H A 90 ARG H 1.0 0.0 3.92 325 325 A 92 PHE H A 90 ARG H 1.0 0.0 4.29 326 326 A 89 PHE HD% A 90 ARG H 1.0 0.0 4.79 327 327 A 87 GLU HA A 90 ARG H 1.0 0.0 4.01 328 328 A 89 PHE HBx A 90 ARG H 1.0 0.0 3.63 329 329 A 89 PHE HBy A 90 ARG H 1.0 0.0 4.15 330 330 A 100 ILE HD11 A 90 ARG H 1.0 0.0 5.50 331 331 A 91 VAL H A 88 ALA HA 1.0 0.0 4.54 332 332 A 91 VAL H A 89 PHE HA 1.0 0.0 5.21 333 333 A 89 PHE HBx A 91 VAL H 1.0 0.0 5.50 334 334 A 91 VAL H A 90 ARG HDx 1.0 0.0 5.50 335 335 A 91 VAL H A 90 ARG HDy 1.0 0.0 5.50 336 336 A 89 PHE HBy A 91 VAL H 1.0 0.0 5.50 337 337 A 91 VAL H A 91 VAL HG11 1.0 0.0 4.24 338 338 A 91 VAL H A 92 PHE H 1.0 0.0 3.56 339 339 A 92 PHE H A 88 ALA HA 1.0 0.0 4.31 340 340 A 90 ARG HA A 92 PHE H 1.0 0.0 5.50 341 341 A 92 PHE H A 92 PHE HBx 1.0 0.0 4.04 342 342 A 92 PHE H A 92 PHE HBy 1.0 0.0 3.90 343 343 A 92 PHE H A 93 ASP HBx 1.0 0.0 5.50 344 344 A 92 PHE H A 91 VAL HB 1.0 0.0 5.50 345 345 A 92 PHE H A 93 ASP HBy 1.0 0.0 5.50 346 346 A 92 PHE H A 91 VAL HG11 1.0 0.0 5.50 347 347 A 92 PHE H A 100 ILE HD11 1.0 0.0 4.46 348 348 A 92 PHE H A 93 ASP H 1.0 0.0 3.80 349 349 A 89 PHE HA A 93 ASP H 1.0 0.0 5.08 350 350 A 92 PHE HBy A 93 ASP H 1.0 0.0 4.06 351 351 A 93 ASP H A 93 ASP HBx 1.0 0.0 3.59 352 352 A 93 ASP H A 93 ASP HBy 1.0 0.0 3.59 353 353 A 100 ILE HD11 A 93 ASP H 1.0 0.0 4.77 354 354 A 100 ILE HG1y A 93 ASP H 1.0 0.0 5.42 355 355 A 94 LYS H A 95 ASP H 1.0 0.0 4.32 356 356 A 93 ASP HA A 94 LYS H 1.0 0.0 3.35 357 357 A 104 GLU HBy A 94 LYS H 1.0 0.0 4.34 358 358 A 104 GLU HBx A 94 LYS H 1.0 0.0 4.53 359 359 A 94 LYS H A 104 GLU HGy 1.0 0.0 4.82 360 360 A 94 LYS H A 104 GLU HGx 1.0 0.0 4.82 361 361 A 94 LYS HBx A 94 LYS H 1.0 0.0 3.28 362 362 A 95 ASP H A 95 ASP HBx 1.0 0.0 4.06 363 363 A 95 ASP H A 95 ASP HBy 1.0 0.0 4.06 364 364 A 94 LYS HBx A 95 ASP H 1.0 0.0 4.07 365 365 A 95 ASP H A 94 LYS HBy 1.0 0.0 4.31 366 366 A 96 GLY H A 98 GLY H 1.0 0.0 4.99 367 367 A 95 ASP H A 96 GLY H 1.0 0.0 3.06 368 368 A 93 ASP HA A 96 GLY H 1.0 0.0 4.36 369 369 A 94 LYS HBx A 96 GLY H 1.0 0.0 5.50 370 370 A 94 LYS HBy A 96 GLY H 1.0 0.0 5.50 371 371 A 98 GLY H A 97 ASN H 1.0 0.0 3.51 372 372 A 96 GLY H A 97 ASN H 1.0 0.0 3.50 373 373 A 97 ASN H A 97 ASN HBx 1.0 0.0 3.76 374 374 A 97 ASN H A 97 ASN HBy 1.0 0.0 3.76 375 375 A 98 GLY H A 99 TYR H 1.0 0.0 3.29 376 376 A 99 TYR HD% A 98 GLY H 1.0 0.0 5.50 377 377 A 99 TYR HD% A 99 TYR H 1.0 0.0 3.66 378 378 A 99 TYR H A 99 TYR HBx 1.0 0.0 3.29 379 379 A 99 TYR HBy A 100 ILE H 1.0 0.0 4.67 380 380 A 100 ILE H A 99 TYR HD% 1.0 0.0 4.67 381 381 A 100 ILE H A 99 TYR HA 1.0 0.0 3.27 382 382 A 100 ILE H A 99 TYR H 1.0 0.0 5.50 383 383 A 100 ILE HB A 100 ILE H 1.0 0.0 3.53 384 384 A 100 ILE H A 100 ILE HG1x 1.0 0.0 3.79 385 385 A 100 ILE H A 100 ILE HD11 1.0 0.0 4.32 386 386 A 100 ILE H A 100 ILE HG1y 1.0 0.0 4.34 387 387 A 104 GLU HBy A 101 SER H 1.0 0.0 4.23 388 388 A 104 GLU HBx A 101 SER H 1.0 0.0 3.50 389 389 A 100 ILE HB A 101 SER H 1.0 0.0 4.88 390 390 A 100 ILE HG1x A 101 SER H 1.0 0.0 5.50 391 391 A 103 ALA HB% A 101 SER H 1.0 0.0 5.50 392 392 A 100 ILE HG21 A 101 SER H 1.0 0.0 3.68 393 393 A 100 ILE HD11 A 101 SER H 1.0 0.0 5.50 394 394 A 105 LEU HD21 A 101 SER H 1.0 0.0 5.50 395 395 A 100 ILE HG1y A 101 SER H 1.0 0.0 5.50 396 396 A 101 SER HA A 102 ALA H 1.0 0.0 3.23 397 397 A 104 GLU HBx A 102 ALA H 1.0 0.0 5.50 398 398 A 102 ALA HB% A 102 ALA H 1.0 0.0 3.05 399 399 A 125 ILE HD11 A 102 ALA H 1.0 0.0 4.14 400 400 A 100 ILE HG21 A 102 ALA H 1.0 0.0 5.50 401 401 A 103 ALA H A 102 ALA H 1.0 0.0 3.69 402 402 A 103 ALA H A 104 GLU H 1.0 0.0 3.37 403 403 A 101 SER HA A 103 ALA H 1.0 0.0 4.53 404 404 A 103 ALA H A 103 ALA HB% 1.0 0.0 2.80 405 405 A 104 GLU HBx A 103 ALA H 1.0 0.0 5.50 406 406 A 105 LEU HG A 103 ALA H 1.0 0.0 5.50 407 407 A 103 ALA H A 125 ILE HD11 1.0 0.0 5.50 408 408 A 102 ALA H A 104 GLU H 1.0 0.0 5.47 409 409 A 101 SER H A 104 GLU H 1.0 0.0 4.35 410 410 A 104 GLU HBy A 104 GLU H 1.0 0.0 3.78 411 411 A 104 GLU HBx A 104 GLU H 1.0 0.0 3.22 412 412 A 104 GLU H A 104 GLU HGy 1.0 0.0 3.84 413 413 A 104 GLU H A 104 GLU HGx 1.0 0.0 3.84 414 414 A 103 ALA HB% A 104 GLU H 1.0 0.0 3.30 415 415 A 100 ILE HG21 A 104 GLU H 1.0 0.0 5.04 416 416 A 105 LEU HG A 104 GLU H 1.0 0.0 5.50 417 417 A 105 LEU H A 106 ARG H 1.0 0.0 3.43 418 418 A 105 LEU H A 104 GLU H 1.0 0.0 3.64 419 419 A 105 LEU H A 102 ALA HA 1.0 0.0 3.73 420 420 A 104 GLU HBy A 105 LEU H 1.0 0.0 4.06 421 421 A 105 LEU H A 104 GLU HBx 1.0 0.0 3.32 422 422 A 105 LEU H A 105 LEU HBy 1.0 0.0 3.75 423 423 A 105 LEU H A 104 GLU HGx 1.0 0.0 5.20 424 424 A 105 LEU H A 105 LEU HBx 1.0 0.0 3.28 425 425 A 105 LEU H A 125 ILE HD11 1.0 0.0 4.07 426 426 A 105 LEU H A 105 LEU HD21 1.0 0.0 4.04 427 427 A 105 LEU H A 101 SER H 1.0 0.0 5.50 428 428 A 106 ARG H A 107 HIS H 1.0 0.0 3.85 429 429 A 106 ARG HBy A 106 ARG H 1.0 0.0 2.90 430 430 A 106 ARG H A 105 LEU HBx 1.0 0.0 3.73 431 431 A 121 VAL HGx% A 106 ARG H 1.0 0.0 3.76 432 432 A 106 ARG H A 105 LEU HDx% 1.0 0.0 4.55 433 433 A 104 GLU HBx A 106 ARG H 1.0 0.0 5.50 434 434 A 106 ARG HBx A 107 HIS H 1.0 0.0 4.33 435 435 A 106 ARG HBy A 107 HIS H 1.0 0.0 4.74 436 436 A 107 HIS H A 106 ARG HGx 1.0 0.0 4.12 437 437 A 107 HIS H A 106 ARG HGy 1.0 0.0 4.12 438 438 A 108 VAL H A 107 HIS H 1.0 0.0 3.03 439 439 A 108 VAL H A 104 GLU HBy 1.0 0.0 5.33 440 440 A 108 VAL H A 108 VAL HB 1.0 0.0 3.54 441 441 A 108 VAL H A 108 VAL HG11 1.0 0.0 4.24 442 442 A 111 ASN H A 109 MET H 1.0 0.0 4.88 443 443 A 109 MET H A 110 THR HB 1.0 0.0 4.87 444 444 A 109 MET H A 109 MET HGy 1.0 0.0 3.89 445 445 A 109 MET H A 109 MET HGx 1.0 0.0 3.89 446 446 A 109 MET H A 108 VAL HG11 1.0 0.0 4.35 447 447 A 109 MET H A 112 LEU HDx% 1.0 0.0 4.52 448 448 A 109 MET H A 108 VAL HG21 1.0 0.0 4.35 449 449 A 110 THR HB A 110 THR H 1.0 0.0 3.97 450 450 A 110 THR H A 111 ASN HBy 1.0 0.0 5.50 451 451 A 110 THR HG2% A 110 THR H 1.0 0.0 4.31 452 452 A 111 ASN H A 110 THR H 1.0 0.0 3.65 453 453 A 111 ASN H A 112 LEU H 1.0 0.0 4.62 454 454 A 111 ASN H A 111 ASN HBx 1.0 0.0 3.51 455 455 A 111 ASN H A 111 ASN HBy 1.0 0.0 3.51 456 456 A 111 ASN H A 112 LEU HG 1.0 0.0 4.88 457 457 A 111 ASN H A 108 VAL HG11 1.0 0.0 5.50 458 458 A 111 ASN H A 109 MET HBx 1.0 0.0 5.50 459 459 A 111 ASN H A 109 MET HBy 1.0 0.0 5.50 460 460 A 112 LEU H A 112 LEU HG 1.0 0.0 3.11 461 461 A 112 LEU HDx% A 112 LEU H 1.0 0.0 4.05 462 462 A 112 LEU HD21 A 112 LEU H 1.0 0.0 4.44 463 463 A 111 ASN HA A 113 GLY H 1.0 0.0 4.61 464 464 A 110 THR HA A 113 GLY H 1.0 0.0 3.84 465 465 A 113 GLY H A 111 ASN HBx 1.0 0.0 5.50 466 466 A 113 GLY H A 111 ASN HBy 1.0 0.0 5.50 467 467 A 113 GLY H A 112 LEU HBy 1.0 0.0 4.78 468 468 A 113 GLY H A 112 LEU HBx 1.0 0.0 4.78 469 469 A 110 THR HG2% A 113 GLY H 1.0 0.0 5.50 470 470 A 112 LEU HDx% A 113 GLY H 1.0 0.0 5.50 471 471 A 112 LEU HD21 A 113 GLY H 1.0 0.0 5.50 472 472 A 109 MET HA A 114 GLU H 1.0 0.0 4.15 473 473 A 112 LEU HDx% A 114 GLU H 1.0 0.0 5.50 474 474 A 112 LEU HD21 A 114 GLU H 1.0 0.0 5.50 475 475 A 115 LYS H A 115 LYS HDx 1.0 0.0 5.50 476 476 A 115 LYS H A 115 LYS HDy 1.0 0.0 5.50 477 477 A 116 LEU H A 115 LYS HA 1.0 0.0 3.21 478 478 A 116 LEU H A 116 LEU HBy 1.0 0.0 3.97 479 479 A 116 LEU H A 116 LEU HBx 1.0 0.0 3.97 480 480 A 121 VAL HG21 A 116 LEU H 1.0 0.0 5.50 481 481 A 116 LEU H A 116 LEU HD21 1.0 0.0 5.50 482 482 A 117 THR HG2% A 117 THR H 1.0 0.0 4.20 483 483 A 117 THR H A 116 LEU HDx% 1.0 0.0 5.50 484 484 A 117 THR H A 116 LEU HD21 1.0 0.0 5.50 485 485 A 117 THR HB A 118 ASP H 1.0 0.0 3.51 486 486 A 118 ASP H A 118 ASP HBx 1.0 0.0 3.68 487 487 A 118 ASP H A 118 ASP HBy 1.0 0.0 3.68 488 488 A 117 THR HG2% A 118 ASP H 1.0 0.0 4.44 489 489 A 121 VAL HG21 A 118 ASP H 1.0 0.0 5.50 490 490 A 118 ASP H A 119 GLU H 1.0 0.0 2.89 491 491 A 143 GLN H A 142 VAL H 1.0 0.0 4.06 492 492 A 141 PHE HD% A 142 VAL H 1.0 0.0 4.85 493 493 A 117 THR HB A 119 GLU H 1.0 0.0 4.74 494 494 A 139 GLU HA A 142 VAL H 1.0 0.0 3.94 495 495 A 138 TYR HA A 142 VAL H 1.0 0.0 4.08 496 496 A 142 VAL HB A 142 VAL H 1.0 0.0 5.50 497 497 A 117 THR HG2% A 119 GLU H 1.0 0.0 5.07 498 498 A 142 VAL H A 142 VAL HG11 1.0 0.0 4.00 499 499 A 142 VAL H A 142 VAL HG21 1.0 0.0 4.00 500 500 A 121 VAL H A 124 MET H 1.0 0.0 4.74 501 501 A 121 VAL H A 121 VAL HB 1.0 0.0 3.14 502 502 A 122 ASP HBx A 122 ASP H 1.0 0.0 3.03 503 503 A 121 VAL HB A 122 ASP H 1.0 0.0 2.92 504 504 A 102 ALA HB% A 122 ASP H 1.0 0.0 4.07 505 505 A 121 VAL HGx% A 122 ASP H 1.0 0.0 3.43 506 506 A 124 MET H A 123 GLU H 1.0 0.0 3.47 507 507 A 121 VAL HG21 A 124 MET H 1.0 0.0 5.43 508 508 A 122 ASP HBy A 123 GLU H 1.0 0.0 3.28 509 509 A 123 GLU H A 123 GLU HGx 1.0 0.0 5.17 510 510 A 123 GLU H A 123 GLU HGy 1.0 0.0 5.17 511 511 A 122 ASP HA A 124 MET H 1.0 0.0 4.92 512 512 A 121 VAL HA A 124 MET H 1.0 0.0 4.74 513 513 A 124 MET H A 123 GLU HGx 1.0 0.0 5.50 514 514 A 124 MET H A 123 GLU HGy 1.0 0.0 5.50 515 515 A 105 LEU HDx% A 124 MET H 1.0 0.0 4.51 516 516 A 127 GLU H A 126 ARG H 1.0 0.0 3.54 517 517 A 122 ASP HA A 126 ARG H 1.0 0.0 5.13 518 518 A 126 ARG H A 126 ARG HDx 1.0 0.0 5.50 519 519 A 126 ARG H A 126 ARG HDy 1.0 0.0 5.50 520 520 A 126 ARG HGy A 126 ARG H 1.0 0.0 3.41 521 521 A 126 ARG HBx A 126 ARG H 1.0 0.0 3.06 522 522 A 125 ILE HG21 A 126 ARG H 1.0 0.0 4.11 523 523 A 127 GLU H A 126 ARG HBx 1.0 0.0 3.93 524 524 A 128 ALA H A 127 GLU H 1.0 0.0 3.60 525 525 A 128 ALA H A 129 ASP HBx 1.0 0.0 5.30 526 526 A 128 ALA H A 127 GLU HBy 1.0 0.0 4.59 527 527 A 128 ALA H A 129 ASP HBy 1.0 0.0 5.30 528 528 A 128 ALA H A 127 GLU HBx 1.0 0.0 4.59 529 529 A 128 ALA H A 128 ALA HB% 1.0 0.0 3.49 530 530 A 128 ALA H A 129 ASP H 1.0 0.0 3.50 531 531 A 126 ARG HA A 129 ASP H 1.0 0.0 4.26 532 532 A 127 GLU HA A 129 ASP H 1.0 0.0 4.67 533 533 A 129 ASP H A 129 ASP HBy 1.0 0.0 3.49 534 534 A 128 ALA HB% A 129 ASP H 1.0 0.0 3.86 535 535 A 125 ILE HG21 A 129 ASP H 1.0 0.0 4.41 536 536 A 132 GLY H A 130 ILE H 1.0 0.0 5.50 537 537 A 129 ASP HA A 130 ILE H 1.0 0.0 3.15 538 538 A 130 ILE H A 129 ASP HBx 1.0 0.0 4.24 539 539 A 130 ILE H A 129 ASP HBy 1.0 0.0 4.24 540 540 A 130 ILE H A 130 ILE HG1x 1.0 0.0 3.99 541 541 A 130 ILE H A 130 ILE HD1% 1.0 0.0 4.71 542 542 A 81 SER H A 81 SER HBy 1.0 0.0 4.01 543 543 A 81 SER H A 80 ASP HBx 1.0 0.0 4.71 544 544 A 81 SER H A 80 ASP HBy 1.0 0.0 4.71 545 545 A 130 ILE HB A 131 ASP H 1.0 0.0 3.24 546 546 A 131 ASP H A 130 ILE HG1y 1.0 0.0 4.65 547 547 A 131 ASP H A 130 ILE HG1x 1.0 0.0 4.65 548 548 A 130 ILE HG21 A 131 ASP H 1.0 0.0 3.86 549 549 A 132 GLY H A 131 ASP H 1.0 0.0 3.04 550 550 A 132 GLY H A 134 GLY H 1.0 0.0 4.77 551 551 A 132 GLY H A 130 ILE HG21 1.0 0.0 5.27 552 552 A 132 GLY H A 130 ILE HB 1.0 0.0 4.88 553 553 A 134 GLY H A 133 ASP H 1.0 0.0 3.28 554 554 A 135 GLN H A 133 ASP H 1.0 0.0 4.55 555 555 A 132 GLY H A 133 ASP H 1.0 0.0 3.29 556 556 A 135 GLN HBx A 133 ASP H 1.0 0.0 5.50 557 557 A 125 ILE HG21 A 133 ASP H 1.0 0.0 5.50 558 558 A 135 GLN HA A 134 GLY H 1.0 0.0 5.50 559 559 A 134 GLY H A 132 GLY HAy 1.0 0.0 4.41 560 560 A 135 GLN HBx A 134 GLY H 1.0 0.0 5.33 561 561 A 125 ILE HG21 A 134 GLY H 1.0 0.0 4.63 562 562 A 135 GLN H A 134 GLY H 1.0 0.0 3.19 563 563 A 135 GLN H A 136 VAL H 1.0 0.0 5.10 564 564 A 135 GLN H A 133 ASP HA 1.0 0.0 4.98 565 565 A 135 GLN H A 132 GLY HAy 1.0 0.0 5.50 566 566 A 135 GLN H A 135 GLN HBx 1.0 0.0 3.32 567 567 A 136 VAL H A 100 ILE H 1.0 0.0 3.98 568 568 A 136 VAL H A 99 TYR HD% 1.0 0.0 5.50 569 569 A 135 GLN HA A 136 VAL H 1.0 0.0 3.10 570 570 A 136 VAL H A 100 ILE HA 1.0 0.0 5.50 571 571 A 99 TYR HBy A 136 VAL H 1.0 0.0 4.52 572 572 A 136 VAL HB A 136 VAL H 1.0 0.0 3.62 573 573 A 125 ILE HG21 A 136 VAL H 1.0 0.0 4.15 574 574 A 136 VAL H A 100 ILE HD11 1.0 0.0 5.40 575 575 A 136 VAL H A 100 ILE HG1y 1.0 0.0 5.50 576 576 A 136 VAL H A 137 ASN H 1.0 0.0 5.50 577 577 A 137 ASN H A 138 TYR H 1.0 0.0 5.50 578 578 A 137 ASN H A 99 TYR HD% 1.0 0.0 5.45 579 579 A 137 ASN H A 136 VAL HA 1.0 0.0 3.43 580 580 A 137 ASN H A 140 GLU HA 1.0 0.0 5.50 581 581 A 137 ASN H A 140 GLU HGy 1.0 0.0 5.04 582 582 A 137 ASN H A 140 GLU HGx 1.0 0.0 4.73 583 583 A 136 VAL HB A 137 ASN H 1.0 0.0 5.50 584 584 A 137 ASN H A 136 VAL HG21 1.0 0.0 4.98 585 585 A 89 PHE HD% A 87 GLU H 1.0 0.0 5.50 586 586 A 138 TYR HD% A 138 TYR H 1.0 0.0 4.40 587 587 A 138 TYR H A 138 TYR HBy 1.0 0.0 3.71 588 588 A 88 ALA HB% A 87 GLU H 1.0 0.0 5.45 589 589 A 138 TYR HD% A 139 GLU H 1.0 0.0 4.59 590 590 A 140 GLU HA A 139 GLU H 1.0 0.0 5.50 591 591 A 140 GLU HGy A 139 GLU H 1.0 0.0 4.98 592 592 A 142 VAL H A 140 GLU H 1.0 0.0 4.64 593 593 A 139 GLU H A 140 GLU H 1.0 0.0 4.54 594 594 A 130 ILE HD1% A 140 GLU H 1.0 0.0 5.50 595 595 A 142 VAL H A 141 PHE H 1.0 0.0 3.21 596 596 A 141 PHE HD% A 141 PHE H 1.0 0.0 4.75 597 597 A 138 TYR HA A 141 PHE H 1.0 0.0 3.96 598 598 A 140 GLU HGy A 141 PHE H 1.0 0.0 4.58 599 599 A 137 ASN H A 141 PHE H 1.0 0.0 5.50 600 600 A 143 GLN H A 144 MET H 1.0 0.0 4.02 601 601 A 143 GLN H A 143 GLN HGx 1.0 0.0 5.24 602 602 A 143 GLN H A 143 GLN HGy 1.0 0.0 5.24 603 603 A 143 GLN H A 143 GLN HBx 1.0 0.0 4.00 604 604 A 143 GLN H A 143 GLN HBy 1.0 0.0 4.00 605 605 A 143 GLN H A 142 VAL HG11 1.0 0.0 4.51 606 606 A 144 MET H A 143 GLN HBy 1.0 0.0 4.74 607 607 A 144 MET H A 128 ALA HB% 1.0 0.0 5.50 608 608 A 144 MET H A 145 MET H 1.0 0.0 4.00 609 609 A 99 TYR H A 97 ASN HA 1.0 0.0 4.82 610 610 A 145 MET H A 145 MET HBx 1.0 0.0 4.02 611 611 A 145 MET H A 145 MET HBy 1.0 0.0 4.02 612 612 A 145 MET HE1 A 145 MET H 1.0 0.0 4.27 613 613 A 146 THR H A 146 THR HG21 1.0 0.0 4.33 614 614 A 147 ALA HB% A 148 LYS H 1.0 0.0 4.65 615 615 A 100 ILE HA A 101 SER H 1.0 0.0 3.08 616 616 A 80 ASP H A 80 ASP HBx 1.0 0.0 3.64 617 616 A 80 ASP H A 80 ASP HBy 1.0 0.0 3.64 618 617 A 81 SER H A 80 ASP HBx 1.0 0.0 3.92 619 617 A 81 SER H A 80 ASP HBy 1.0 0.0 3.92 620 618 A 81 SER H A 81 SER HBx 1.0 0.0 3.25 621 618 A 81 SER H A 81 SER HBy 1.0 0.0 3.25 622 619 A 82 GLU H A 82 GLU HGx 1.0 0.0 4.50 623 619 A 82 GLU H A 82 GLU HGy 1.0 0.0 4.50 624 620 A 82 GLU HA A 82 GLU HGx 1.0 0.0 3.44 625 620 A 82 GLU HA A 82 GLU HGy 1.0 0.0 3.44 626 621 A 82 GLU HBx A 82 GLU HGx 1.0 0.0 2.28 627 621 A 82 GLU HBy A 82 GLU HGx 1.0 0.0 2.28 628 621 A 82 GLU HGy A 82 GLU HBy 1.0 0.0 2.28 629 621 A 82 GLU HGy A 82 GLU HBx 1.0 0.0 2.28 630 622 A 85 ILE HD11 A 82 GLU HGx 1.0 0.0 3.45 631 622 A 85 ILE HD11 A 82 GLU HGy 1.0 0.0 3.45 632 623 A 82 GLU HGx A 86 ARG HGx 1.0 0.0 3.50 633 623 A 82 GLU HGy A 86 ARG HGx 1.0 0.0 3.50 634 623 A 86 ARG HGy A 82 GLU HGx 1.0 0.0 3.50 635 623 A 82 GLU HGy A 86 ARG HGy 1.0 0.0 3.50 636 624 A 83 GLU H A 83 GLU HBy 1.0 0.0 2.86 637 624 A 83 GLU H A 83 GLU HBx 1.0 0.0 2.86 638 625 A 83 GLU HBx A 83 GLU HGx 1.0 0.0 2.34 639 625 A 83 GLU HBy A 83 GLU HGx 1.0 0.0 2.34 640 625 A 83 GLU HGy A 83 GLU HBy 1.0 0.0 2.34 641 625 A 83 GLU HBx A 83 GLU HGy 1.0 0.0 2.34 642 626 A 84 GLU HA A 84 GLU HGx 1.0 0.0 3.55 643 626 A 84 GLU HA A 84 GLU HGy 1.0 0.0 3.55 644 627 A 85 ILE H A 84 GLU HBx 1.0 0.0 3.13 645 627 A 85 ILE H A 84 GLU HBy 1.0 0.0 3.13 646 628 A 85 ILE HA A 84 GLU HBx 1.0 0.0 4.09 647 628 A 85 ILE HA A 84 GLU HBy 1.0 0.0 4.09 648 629 A 85 ILE HG1x A 84 GLU HBx 1.0 0.0 5.02 649 629 A 85 ILE HG1x A 84 GLU HBy 1.0 0.0 5.02 650 630 A 85 ILE H A 84 GLU HGx 1.0 0.0 4.85 651 630 A 85 ILE H A 84 GLU HGy 1.0 0.0 4.85 652 631 A 85 ILE HA A 142 VAL HG11 1.0 0.0 5.44 653 631 A 85 ILE HA A 142 VAL HG21 1.0 0.0 5.44 654 632 A 85 ILE HG21 A 142 VAL HG11 1.0 0.0 3.03 655 632 A 85 ILE HG21 A 142 VAL HG21 1.0 0.0 3.03 656 633 A 85 ILE HG1x A 142 VAL HG11 1.0 0.0 3.60 657 633 A 85 ILE HG1x A 142 VAL HG21 1.0 0.0 3.60 658 634 A 85 ILE HD11 A 86 ARG HGx 1.0 0.0 4.99 659 634 A 85 ILE HD11 A 86 ARG HGy 1.0 0.0 4.99 660 635 A 85 ILE HD11 A 142 VAL HG11 1.0 0.0 4.52 661 635 A 85 ILE HD11 A 142 VAL HG21 1.0 0.0 4.52 662 636 A 86 ARG H A 86 ARG HGx 1.0 0.0 3.65 663 636 A 86 ARG H A 86 ARG HGy 1.0 0.0 3.65 664 637 A 86 ARG H A 87 GLU HBx 1.0 0.0 5.34 665 637 A 86 ARG H A 87 GLU HBy 1.0 0.0 5.34 666 638 A 86 ARG HA A 86 ARG HGx 1.0 0.0 3.72 667 638 A 86 ARG HA A 86 ARG HGy 1.0 0.0 3.72 668 639 A 86 ARG HBx A 87 GLU HBx 1.0 0.0 4.78 669 639 A 86 ARG HBx A 87 GLU HBy 1.0 0.0 4.78 670 640 A 86 ARG HBx A 87 GLU HGx 1.0 0.0 3.90 671 640 A 86 ARG HBx A 87 GLU HGy 1.0 0.0 3.90 672 641 A 87 GLU H A 86 ARG HGx 1.0 0.0 5.34 673 641 A 87 GLU H A 86 ARG HGy 1.0 0.0 5.34 674 642 A 87 GLU H A 87 GLU HBx 1.0 0.0 3.50 675 642 A 87 GLU H A 87 GLU HBy 1.0 0.0 3.50 676 643 A 87 GLU H A 87 GLU HGx 1.0 0.0 3.09 677 643 A 87 GLU H A 87 GLU HGy 1.0 0.0 3.09 678 644 A 87 GLU HA A 87 GLU HGx 1.0 0.0 3.57 679 644 A 87 GLU HA A 87 GLU HGy 1.0 0.0 3.57 680 645 A 87 GLU HA A 91 VAL HG11 1.0 0.0 4.20 681 645 A 87 GLU HA A 91 VAL HG21 1.0 0.0 4.20 682 646 A 87 GLU HBy A 87 GLU HGx 1.0 0.0 2.27 683 646 A 87 GLU HBx A 87 GLU HGx 1.0 0.0 2.27 684 646 A 87 GLU HGy A 87 GLU HBx 1.0 0.0 2.27 685 646 A 87 GLU HBy A 87 GLU HGy 1.0 0.0 2.27 686 647 A 88 ALA H A 87 GLU HBx 1.0 0.0 3.60 687 647 A 88 ALA H A 87 GLU HBy 1.0 0.0 3.60 688 648 A 87 GLU HBx A 91 VAL HG11 1.0 0.0 3.71 689 648 A 87 GLU HBy A 91 VAL HG11 1.0 0.0 3.71 690 648 A 91 VAL HG21 A 87 GLU HBx 1.0 0.0 3.71 691 648 A 87 GLU HBy A 91 VAL HG21 1.0 0.0 3.71 692 649 A 88 ALA H A 87 GLU HGx 1.0 0.0 5.34 693 649 A 88 ALA H A 87 GLU HGy 1.0 0.0 5.34 694 650 A 87 GLU HGx A 91 VAL HG11 1.0 0.0 4.84 695 650 A 87 GLU HGy A 91 VAL HG11 1.0 0.0 4.84 696 650 A 91 VAL HG21 A 87 GLU HGx 1.0 0.0 4.84 697 650 A 87 GLU HGy A 91 VAL HG21 1.0 0.0 4.84 698 651 A 88 ALA H A 91 VAL HG11 1.0 0.0 5.26 699 651 A 88 ALA H A 91 VAL HG21 1.0 0.0 5.26 700 652 A 88 ALA HA A 91 VAL HG11 1.0 0.0 3.28 701 652 A 88 ALA HA A 91 VAL HG21 1.0 0.0 3.28 702 653 A 88 ALA HB% A 91 VAL HG11 1.0 0.0 4.56 703 653 A 88 ALA HB% A 91 VAL HG21 1.0 0.0 4.56 704 654 A 89 PHE HBy A 90 ARG HGx 1.0 0.0 4.61 705 654 A 89 PHE HBy A 90 ARG HGy 1.0 0.0 4.61 706 655 A 89 PHE HD% A 90 ARG HDy 1.0 0.0 5.34 707 655 A 89 PHE HD% A 90 ARG HDx 1.0 0.0 5.34 708 656 A 89 PHE HD% A 142 VAL HG11 1.0 0.0 3.95 709 656 A 89 PHE HD% A 142 VAL HG21 1.0 0.0 3.95 710 657 A 90 ARG H A 90 ARG HBx 1.0 0.0 2.99 711 657 A 90 ARG H A 90 ARG HBy 1.0 0.0 2.99 712 658 A 90 ARG H A 90 ARG HGx 1.0 0.0 3.57 713 658 A 90 ARG H A 90 ARG HGy 1.0 0.0 3.57 714 659 A 90 ARG H A 90 ARG HDy 1.0 0.0 3.96 715 659 A 90 ARG H A 90 ARG HDx 1.0 0.0 3.96 716 660 A 90 ARG H A 91 VAL HG11 1.0 0.0 4.52 717 660 A 90 ARG H A 91 VAL HG21 1.0 0.0 4.52 718 661 A 90 ARG HA A 90 ARG HBx 1.0 0.0 2.57 719 661 A 90 ARG HA A 90 ARG HBy 1.0 0.0 2.57 720 662 A 90 ARG HA A 90 ARG HGx 1.0 0.0 3.15 721 662 A 90 ARG HA A 90 ARG HGy 1.0 0.0 3.15 722 663 A 90 ARG HA A 90 ARG HDy 1.0 0.0 3.63 723 663 A 90 ARG HA A 90 ARG HDx 1.0 0.0 3.63 724 664 A 90 ARG HA A 91 VAL HG11 1.0 0.0 5.44 725 664 A 90 ARG HA A 91 VAL HG21 1.0 0.0 5.44 726 665 A 90 ARG HA A 93 ASP HBy 1.0 0.0 4.06 727 665 A 90 ARG HA A 93 ASP HBx 1.0 0.0 4.06 728 666 A 90 ARG HBx A 90 ARG HDy 1.0 0.0 3.22 729 666 A 90 ARG HBy A 90 ARG HDy 1.0 0.0 3.22 730 666 A 90 ARG HDx A 90 ARG HBx 1.0 0.0 3.22 731 666 A 90 ARG HDx A 90 ARG HBy 1.0 0.0 3.22 732 667 A 91 VAL H A 90 ARG HBx 1.0 0.0 4.20 733 667 A 91 VAL H A 90 ARG HBy 1.0 0.0 4.20 734 668 A 91 VAL H A 91 VAL HG11 1.0 0.0 3.21 735 668 A 91 VAL H A 91 VAL HG21 1.0 0.0 3.21 736 669 A 91 VAL HA A 91 VAL HG11 1.0 0.0 3.00 737 669 A 91 VAL HA A 91 VAL HG21 1.0 0.0 3.00 738 670 A 92 PHE H A 91 VAL HG11 1.0 0.0 4.12 739 670 A 92 PHE H A 91 VAL HG21 1.0 0.0 4.12 740 671 A 92 PHE HD% A 91 VAL HG11 1.0 0.0 5.44 741 671 A 91 VAL HG21 A 92 PHE HD% 1.0 0.0 5.44 742 672 A 92 PHE H A 93 ASP HBy 1.0 0.0 4.70 743 672 A 92 PHE H A 93 ASP HBx 1.0 0.0 4.70 744 673 A 92 PHE HD% A 108 VAL HG11 1.0 0.0 5.44 745 673 A 92 PHE HD% A 108 VAL HG21 1.0 0.0 5.44 746 674 A 95 ASP H A 93 ASP HBy 1.0 0.0 5.34 747 674 A 95 ASP H A 93 ASP HBx 1.0 0.0 5.34 748 675 A 96 GLY H A 93 ASP HBy 1.0 0.0 4.34 749 675 A 96 GLY H A 93 ASP HBx 1.0 0.0 4.34 750 676 A 93 ASP HBy A 96 GLY HAx 1.0 0.0 3.97 751 676 A 93 ASP HBx A 96 GLY HAx 1.0 0.0 3.97 752 676 A 96 GLY HAy A 93 ASP HBy 1.0 0.0 3.97 753 676 A 93 ASP HBx A 96 GLY HAy 1.0 0.0 3.97 754 677 A 98 GLY H A 93 ASP HBy 1.0 0.0 5.34 755 677 A 98 GLY H A 93 ASP HBx 1.0 0.0 5.34 756 678 A 94 LYS H A 94 LYS HDx 1.0 0.0 3.95 757 678 A 94 LYS H A 94 LYS HDy 1.0 0.0 3.95 758 679 A 94 LYS H A 108 VAL HG11 1.0 0.0 5.44 759 679 A 94 LYS H A 108 VAL HG21 1.0 0.0 5.44 760 680 A 94 LYS HA A 94 LYS HDx 1.0 0.0 5.50 761 680 A 94 LYS HDy A 94 LYS HA 1.0 0.0 5.50 762 681 A 94 LYS HBx A 94 LYS HDx 1.0 0.0 2.94 763 681 A 94 LYS HBx A 94 LYS HDy 1.0 0.0 2.94 764 682 A 94 LYS HBx A 104 GLU HGx 1.0 0.0 3.83 765 682 A 94 LYS HBx A 104 GLU HGy 1.0 0.0 3.83 766 683 A 94 LYS HBy A 104 GLU HGx 1.0 0.0 5.34 767 683 A 94 LYS HBy A 104 GLU HGy 1.0 0.0 5.34 768 684 A 95 ASP H A 94 LYS HDx 1.0 0.0 5.34 769 684 A 95 ASP H A 94 LYS HDy 1.0 0.0 5.34 770 685 A 94 LYS HDy A 108 VAL HG11 1.0 0.0 3.46 771 685 A 94 LYS HDx A 108 VAL HG11 1.0 0.0 3.46 772 685 A 108 VAL HG21 A 94 LYS HDx 1.0 0.0 3.46 773 685 A 108 VAL HG21 A 94 LYS HDy 1.0 0.0 3.46 774 686 A 109 MET H A 94 LYS HDx 1.0 0.0 5.34 775 686 A 109 MET H A 94 LYS HDy 1.0 0.0 5.34 776 687 A 108 VAL HB A 94 LYS HEx 1.0 0.0 4.43 777 687 A 108 VAL HB A 94 LYS HEy 1.0 0.0 4.43 778 688 A 94 LYS HEx A 108 VAL HG11 1.0 0.0 4.75 779 688 A 94 LYS HEy A 108 VAL HG11 1.0 0.0 4.75 780 688 A 108 VAL HG21 A 94 LYS HEx 1.0 0.0 4.75 781 688 A 108 VAL HG21 A 94 LYS HEy 1.0 0.0 4.75 782 689 A 95 ASP H A 95 ASP HBy 1.0 0.0 3.32 783 689 A 95 ASP H A 95 ASP HBx 1.0 0.0 3.32 784 690 A 95 ASP H A 104 GLU HGx 1.0 0.0 5.34 785 690 A 95 ASP H A 104 GLU HGy 1.0 0.0 5.34 786 691 A 96 GLY H A 95 ASP HBy 1.0 0.0 4.27 787 691 A 96 GLY H A 95 ASP HBx 1.0 0.0 4.27 788 692 A 95 ASP HBx A 96 GLY HAx 1.0 0.0 4.76 789 692 A 95 ASP HBy A 96 GLY HAx 1.0 0.0 4.76 790 692 A 96 GLY HAy A 95 ASP HBy 1.0 0.0 4.76 791 692 A 96 GLY HAy A 95 ASP HBx 1.0 0.0 4.76 792 693 A 98 GLY H A 96 GLY HAx 1.0 0.0 4.28 793 693 A 98 GLY H A 96 GLY HAy 1.0 0.0 4.28 794 694 A 97 ASN H A 97 ASN HBx 1.0 0.0 3.14 795 694 A 97 ASN H A 97 ASN HBy 1.0 0.0 3.14 796 695 A 97 ASN H A 98 GLY HAy 1.0 0.0 4.65 797 695 A 97 ASN H A 98 GLY HAx 1.0 0.0 4.65 798 696 A 99 TYR HD% A 97 ASN HBx 1.0 0.0 5.34 799 696 A 99 TYR HD% A 97 ASN HBy 1.0 0.0 5.34 800 697 A 138 TYR HE% A 98 GLY HAy 1.0 0.0 4.37 801 697 A 138 TYR HE% A 98 GLY HAx 1.0 0.0 4.37 802 698 A 100 ILE H A 136 VAL HG11 1.0 0.0 4.07 803 698 A 100 ILE H A 136 VAL HG21 1.0 0.0 4.07 804 699 A 100 ILE HB A 136 VAL HG11 1.0 0.0 3.57 805 699 A 100 ILE HB A 136 VAL HG21 1.0 0.0 3.57 806 700 A 100 ILE HG21 A 101 SER HBy 1.0 0.0 4.73 807 700 A 100 ILE HG21 A 101 SER HBx 1.0 0.0 4.73 808 701 A 100 ILE HG1x A 136 VAL HG11 1.0 0.0 4.12 809 701 A 100 ILE HG1x A 136 VAL HG21 1.0 0.0 4.12 810 702 A 100 ILE HD11 A 101 SER HBy 1.0 0.0 5.34 811 702 A 100 ILE HD11 A 101 SER HBx 1.0 0.0 5.34 812 703 A 100 ILE HD11 A 136 VAL HG11 1.0 0.0 4.71 813 703 A 100 ILE HD11 A 136 VAL HG21 1.0 0.0 4.71 814 704 A 101 SER H A 101 SER HBy 1.0 0.0 3.45 815 704 A 101 SER H A 101 SER HBx 1.0 0.0 3.45 816 705 A 101 SER H A 104 GLU HGx 1.0 0.0 3.62 817 705 A 101 SER H A 104 GLU HGy 1.0 0.0 3.62 818 706 A 102 ALA H A 101 SER HBy 1.0 0.0 3.43 819 706 A 102 ALA H A 101 SER HBx 1.0 0.0 3.43 820 707 A 102 ALA HB% A 101 SER HBy 1.0 0.0 4.49 821 707 A 102 ALA HB% A 101 SER HBx 1.0 0.0 4.49 822 708 A 103 ALA H A 101 SER HBy 1.0 0.0 4.08 823 708 A 103 ALA H A 101 SER HBx 1.0 0.0 4.08 824 709 A 103 ALA HB% A 101 SER HBy 1.0 0.0 4.51 825 709 A 103 ALA HB% A 101 SER HBx 1.0 0.0 4.51 826 710 A 104 GLU H A 101 SER HBy 1.0 0.0 4.56 827 710 A 104 GLU H A 101 SER HBx 1.0 0.0 4.56 828 711 A 101 SER HBy A 104 GLU HGx 1.0 0.0 3.61 829 711 A 104 GLU HGy A 101 SER HBy 1.0 0.0 3.61 830 711 A 104 GLU HGy A 101 SER HBx 1.0 0.0 3.61 831 711 A 101 SER HBx A 104 GLU HGx 1.0 0.0 3.61 832 712 A 125 ILE HD11 A 101 SER HBy 1.0 0.0 4.55 833 712 A 125 ILE HD11 A 101 SER HBx 1.0 0.0 4.55 834 713 A 102 ALA HA A 104 GLU HGx 1.0 0.0 5.34 835 713 A 102 ALA HA A 104 GLU HGy 1.0 0.0 5.34 836 714 A 102 ALA HB% A 106 ARG HDx 1.0 0.0 5.34 837 714 A 102 ALA HB% A 106 ARG HDy 1.0 0.0 5.34 838 715 A 103 ALA H A 104 GLU HGx 1.0 0.0 5.34 839 715 A 103 ALA H A 104 GLU HGy 1.0 0.0 5.34 840 716 A 103 ALA HA A 106 ARG HDx 1.0 0.0 3.71 841 716 A 106 ARG HDy A 103 ALA HA 1.0 0.0 3.71 842 717 A 103 ALA HB% A 104 GLU HGx 1.0 0.0 3.98 843 717 A 103 ALA HB% A 104 GLU HGy 1.0 0.0 3.98 844 718 A 103 ALA HB% A 106 ARG HDx 1.0 0.0 4.86 845 718 A 103 ALA HB% A 106 ARG HDy 1.0 0.0 4.86 846 719 A 104 GLU H A 104 GLU HGx 1.0 0.0 3.30 847 719 A 104 GLU H A 104 GLU HGy 1.0 0.0 3.30 848 720 A 104 GLU HA A 104 GLU HGx 1.0 0.0 3.65 849 720 A 104 GLU HGy A 104 GLU HA 1.0 0.0 3.65 850 721 A 104 GLU HA A 107 HIS HBx 1.0 0.0 3.48 851 721 A 104 GLU HA A 107 HIS HBy 1.0 0.0 3.48 852 722 A 104 GLU HA A 108 VAL HG11 1.0 0.0 4.60 853 722 A 108 VAL HG21 A 104 GLU HA 1.0 0.0 4.60 854 723 A 104 GLU HBx A 108 VAL HG11 1.0 0.0 5.44 855 723 A 104 GLU HBx A 108 VAL HG21 1.0 0.0 5.44 856 724 A 104 GLU HBy A 104 GLU HGx 1.0 0.0 2.62 857 724 A 104 GLU HBy A 104 GLU HGy 1.0 0.0 2.62 858 725 A 104 GLU HBy A 108 VAL HG11 1.0 0.0 4.78 859 725 A 104 GLU HBy A 108 VAL HG21 1.0 0.0 4.78 860 726 A 105 LEU H A 104 GLU HGx 1.0 0.0 4.50 861 726 A 105 LEU H A 104 GLU HGy 1.0 0.0 4.50 862 727 A 105 LEU H A 106 ARG HDx 1.0 0.0 5.34 863 727 A 105 LEU H A 106 ARG HDy 1.0 0.0 5.34 864 728 A 105 LEU H A 108 VAL HG11 1.0 0.0 4.99 865 728 A 105 LEU H A 108 VAL HG21 1.0 0.0 4.99 866 729 A 105 LEU HA A 108 VAL HG11 1.0 0.0 4.22 867 729 A 105 LEU HA A 108 VAL HG21 1.0 0.0 4.22 868 730 A 105 LEU HBy A 109 MET HGy 1.0 0.0 3.64 869 730 A 105 LEU HBy A 109 MET HGx 1.0 0.0 3.64 870 731 A 105 LEU HDx% A 124 MET HBx 1.0 0.0 3.74 871 731 A 105 LEU HDx% A 124 MET HBy 1.0 0.0 3.74 872 732 A 105 LEU HD21 A 108 VAL HG11 1.0 0.0 3.86 873 732 A 105 LEU HD21 A 108 VAL HG21 1.0 0.0 3.86 874 733 A 105 LEU HD21 A 109 MET HGy 1.0 0.0 5.04 875 733 A 105 LEU HD21 A 109 MET HGx 1.0 0.0 5.04 876 734 A 106 ARG H A 106 ARG HGx 1.0 0.0 3.65 877 734 A 106 ARG H A 106 ARG HGy 1.0 0.0 3.65 878 735 A 106 ARG H A 106 ARG HDx 1.0 0.0 4.41 879 735 A 106 ARG H A 106 ARG HDy 1.0 0.0 4.41 880 736 A 106 ARG H A 109 MET HGy 1.0 0.0 5.34 881 736 A 106 ARG H A 109 MET HGx 1.0 0.0 5.34 882 737 A 106 ARG HA A 108 VAL HG11 1.0 0.0 5.31 883 737 A 108 VAL HG21 A 106 ARG HA 1.0 0.0 5.31 884 738 A 106 ARG HBx A 106 ARG HDx 1.0 0.0 3.16 885 738 A 106 ARG HBx A 106 ARG HDy 1.0 0.0 3.16 886 739 A 106 ARG HBy A 106 ARG HDx 1.0 0.0 3.32 887 739 A 106 ARG HBy A 106 ARG HDy 1.0 0.0 3.32 888 740 A 106 ARG HDy A 106 ARG HGx 1.0 0.0 2.36 889 740 A 106 ARG HDx A 106 ARG HGx 1.0 0.0 2.36 890 740 A 106 ARG HGy A 106 ARG HDx 1.0 0.0 2.36 891 740 A 106 ARG HDy A 106 ARG HGy 1.0 0.0 2.36 892 741 A 107 HIS H A 106 ARG HGx 1.0 0.0 3.53 893 741 A 107 HIS H A 106 ARG HGy 1.0 0.0 3.53 894 742 A 107 HIS HA A 106 ARG HGx 1.0 0.0 4.37 895 742 A 107 HIS HA A 106 ARG HGy 1.0 0.0 4.37 896 743 A 121 VAL HGx% A 106 ARG HDx 1.0 0.0 5.07 897 743 A 121 VAL HGx% A 106 ARG HDy 1.0 0.0 5.07 898 744 A 121 VAL HG21 A 106 ARG HDx 1.0 0.0 4.14 899 744 A 121 VAL HG21 A 106 ARG HDy 1.0 0.0 4.14 900 745 A 107 HIS H A 107 HIS HBx 1.0 0.0 2.87 901 745 A 107 HIS H A 107 HIS HBy 1.0 0.0 2.87 902 746 A 107 HIS H A 108 VAL HG11 1.0 0.0 4.04 903 746 A 107 HIS H A 108 VAL HG21 1.0 0.0 4.04 904 747 A 108 VAL H A 107 HIS HBx 1.0 0.0 3.71 905 747 A 108 VAL H A 107 HIS HBy 1.0 0.0 3.71 906 748 A 107 HIS HBx A 108 VAL HG11 1.0 0.0 5.28 907 748 A 107 HIS HBy A 108 VAL HG11 1.0 0.0 5.28 908 748 A 108 VAL HG21 A 107 HIS HBx 1.0 0.0 5.28 909 748 A 108 VAL HG21 A 107 HIS HBy 1.0 0.0 5.28 910 749 A 108 VAL H A 108 VAL HG11 1.0 0.0 3.38 911 749 A 108 VAL H A 108 VAL HG21 1.0 0.0 3.38 912 750 A 108 VAL H A 111 ASN HBy 1.0 0.0 5.34 913 750 A 108 VAL H A 111 ASN HBx 1.0 0.0 5.34 914 751 A 108 VAL HA A 108 VAL HG11 1.0 0.0 3.11 915 751 A 108 VAL HA A 108 VAL HG21 1.0 0.0 3.11 916 752 A 108 VAL HA A 111 ASN HBy 1.0 0.0 3.42 917 752 A 108 VAL HA A 111 ASN HBx 1.0 0.0 3.42 918 753 A 109 MET H A 108 VAL HG11 1.0 0.0 3.67 919 753 A 109 MET H A 108 VAL HG21 1.0 0.0 3.67 920 754 A 108 VAL HG21 A 109 MET HGy 1.0 0.0 4.43 921 754 A 108 VAL HG11 A 109 MET HGy 1.0 0.0 4.43 922 754 A 109 MET HGx A 108 VAL HG11 1.0 0.0 4.43 923 754 A 108 VAL HG21 A 109 MET HGx 1.0 0.0 4.43 924 755 A 111 ASN H A 108 VAL HG11 1.0 0.0 4.59 925 755 A 111 ASN H A 108 VAL HG21 1.0 0.0 4.59 926 756 A 108 VAL HG21 A 111 ASN HBy 1.0 0.0 4.10 927 756 A 111 ASN HBx A 108 VAL HG11 1.0 0.0 4.10 928 756 A 108 VAL HG21 A 111 ASN HBx 1.0 0.0 4.10 929 756 A 108 VAL HG11 A 111 ASN HBy 1.0 0.0 4.10 930 757 A 112 LEU HG A 108 VAL HG11 1.0 0.0 3.74 931 757 A 112 LEU HG A 108 VAL HG21 1.0 0.0 3.74 932 758 A 112 LEU HDx% A 108 VAL HG11 1.0 0.0 3.06 933 758 A 112 LEU HDx% A 108 VAL HG21 1.0 0.0 3.06 934 759 A 109 MET H A 109 MET HBx 1.0 0.0 3.04 935 759 A 109 MET H A 109 MET HBy 1.0 0.0 3.04 936 760 A 109 MET H A 116 LEU HBx 1.0 0.0 5.34 937 760 A 109 MET H A 116 LEU HBy 1.0 0.0 5.34 938 761 A 109 MET HA A 112 LEU HBx 1.0 0.0 4.30 939 761 A 109 MET HA A 112 LEU HBy 1.0 0.0 4.30 940 762 A 110 THR H A 109 MET HBx 1.0 0.0 3.63 941 762 A 110 THR H A 109 MET HBy 1.0 0.0 3.63 942 763 A 110 THR H A 109 MET HGy 1.0 0.0 5.21 943 763 A 110 THR H A 109 MET HGx 1.0 0.0 5.21 944 764 A 109 MET HGx A 116 LEU HBx 1.0 0.0 4.56 945 764 A 109 MET HGy A 116 LEU HBx 1.0 0.0 4.56 946 764 A 116 LEU HBy A 109 MET HGy 1.0 0.0 4.56 947 764 A 109 MET HGx A 116 LEU HBy 1.0 0.0 4.56 948 765 A 109 MET HGy A 116 LEU HDx% 1.0 0.0 3.61 949 765 A 116 LEU HD21 A 109 MET HGy 1.0 0.0 3.61 950 765 A 109 MET HGx A 116 LEU HD21 1.0 0.0 3.61 951 765 A 109 MET HGx A 116 LEU HDx% 1.0 0.0 3.61 952 766 A 121 VAL HG21 A 109 MET HGy 1.0 0.0 4.38 953 766 A 121 VAL HG21 A 109 MET HGx 1.0 0.0 4.38 954 767 A 111 ASN H A 111 ASN HBy 1.0 0.0 3.04 955 767 A 111 ASN H A 111 ASN HBx 1.0 0.0 3.04 956 768 A 111 ASN H A 112 LEU HBx 1.0 0.0 5.34 957 768 A 111 ASN H A 112 LEU HBy 1.0 0.0 5.34 958 769 A 112 LEU H A 111 ASN HBy 1.0 0.0 3.83 959 769 A 112 LEU H A 111 ASN HBx 1.0 0.0 3.83 960 770 A 112 LEU HG A 111 ASN HBy 1.0 0.0 5.34 961 770 A 112 LEU HG A 111 ASN HBx 1.0 0.0 5.34 962 771 A 112 LEU HDx% A 111 ASN HBy 1.0 0.0 5.33 963 771 A 112 LEU HDx% A 111 ASN HBx 1.0 0.0 5.33 964 772 A 112 LEU HD21 A 111 ASN HBy 1.0 0.0 5.34 965 772 A 112 LEU HD21 A 111 ASN HBx 1.0 0.0 5.34 966 773 A 112 LEU H A 112 LEU HBx 1.0 0.0 3.38 967 773 A 112 LEU H A 112 LEU HBy 1.0 0.0 3.38 968 774 A 112 LEU HDx% A 112 LEU HBx 1.0 0.0 3.14 969 774 A 112 LEU HDx% A 112 LEU HBy 1.0 0.0 3.14 970 775 A 113 GLY H A 112 LEU HBx 1.0 0.0 3.94 971 775 A 113 GLY H A 112 LEU HBy 1.0 0.0 3.94 972 776 A 114 GLU H A 112 LEU HBx 1.0 0.0 3.65 973 776 A 114 GLU H A 112 LEU HBy 1.0 0.0 3.65 974 777 A 114 GLU HBx A 116 LEU HDx% 1.0 0.0 4.76 975 777 A 114 GLU HBy A 116 LEU HDx% 1.0 0.0 4.76 976 777 A 116 LEU HD21 A 114 GLU HBx 1.0 0.0 4.76 977 777 A 116 LEU HD21 A 114 GLU HBy 1.0 0.0 4.76 978 778 A 116 LEU H A 116 LEU HBx 1.0 0.0 3.38 979 778 A 116 LEU H A 116 LEU HBy 1.0 0.0 3.38 980 779 A 116 LEU H A 116 LEU HDx% 1.0 0.0 4.39 981 779 A 116 LEU H A 116 LEU HD21 1.0 0.0 4.39 982 780 A 121 VAL H A 116 LEU HBx 1.0 0.0 4.88 983 780 A 121 VAL H A 116 LEU HBy 1.0 0.0 4.88 984 781 A 121 VAL HG21 A 116 LEU HBx 1.0 0.0 3.11 985 781 A 121 VAL HG21 A 116 LEU HBy 1.0 0.0 3.11 986 782 A 121 VAL H A 116 LEU HDx% 1.0 0.0 5.44 987 782 A 121 VAL H A 116 LEU HD21 1.0 0.0 5.44 988 783 A 121 VAL HG21 A 116 LEU HDx% 1.0 0.0 2.72 989 783 A 121 VAL HG21 A 116 LEU HD21 1.0 0.0 2.72 990 784 A 118 ASP H A 118 ASP HBy 1.0 0.0 3.16 991 784 A 118 ASP H A 118 ASP HBx 1.0 0.0 3.16 992 785 A 118 ASP H A 119 GLU HBy 1.0 0.0 5.34 993 785 A 118 ASP H A 119 GLU HBx 1.0 0.0 5.34 994 786 A 118 ASP H A 119 GLU HGx 1.0 0.0 5.34 995 786 A 118 ASP H A 119 GLU HGy 1.0 0.0 5.34 996 787 A 119 GLU H A 118 ASP HBy 1.0 0.0 3.34 997 787 A 119 GLU H A 118 ASP HBx 1.0 0.0 3.34 998 788 A 119 GLU H A 119 GLU HBy 1.0 0.0 2.89 999 788 A 119 GLU H A 119 GLU HBx 1.0 0.0 2.89 1000 789 A 119 GLU H A 119 GLU HGx 1.0 0.0 3.63 1001 789 A 119 GLU H A 119 GLU HGy 1.0 0.0 3.63 1002 790 A 119 GLU HBy A 119 GLU HGx 1.0 0.0 2.33 1003 790 A 119 GLU HBx A 119 GLU HGx 1.0 0.0 2.33 1004 790 A 119 GLU HGy A 119 GLU HBy 1.0 0.0 2.33 1005 790 A 119 GLU HBx A 119 GLU HGy 1.0 0.0 2.33 1006 791 A 120 GLU H A 119 GLU HBy 1.0 0.0 3.13 1007 791 A 120 GLU H A 119 GLU HBx 1.0 0.0 3.13 1008 792 A 119 GLU HBy A 123 GLU HBx 1.0 0.0 4.43 1009 792 A 119 GLU HBx A 123 GLU HBx 1.0 0.0 4.43 1010 792 A 123 GLU HBy A 119 GLU HBy 1.0 0.0 4.43 1011 792 A 119 GLU HBx A 123 GLU HBy 1.0 0.0 4.43 1012 793 A 120 GLU H A 119 GLU HGx 1.0 0.0 3.91 1013 793 A 120 GLU H A 119 GLU HGy 1.0 0.0 3.91 1014 794 A 120 GLU H A 120 GLU HBx 1.0 0.0 3.54 1015 794 A 120 GLU H A 120 GLU HBy 1.0 0.0 3.54 1016 795 A 120 GLU H A 120 GLU HGx 1.0 0.0 4.47 1017 795 A 120 GLU H A 120 GLU HGy 1.0 0.0 4.47 1018 796 A 120 GLU H A 123 GLU HBx 1.0 0.0 5.04 1019 796 A 120 GLU H A 123 GLU HBy 1.0 0.0 5.04 1020 797 A 120 GLU HA A 123 GLU HBx 1.0 0.0 5.34 1021 797 A 123 GLU HBy A 120 GLU HA 1.0 0.0 5.34 1022 798 A 123 GLU H A 123 GLU HBx 1.0 0.0 3.05 1023 798 A 123 GLU H A 123 GLU HBy 1.0 0.0 3.05 1024 799 A 123 GLU H A 123 GLU HGx 1.0 0.0 4.50 1025 799 A 123 GLU H A 123 GLU HGy 1.0 0.0 4.50 1026 800 A 124 MET H A 123 GLU HBx 1.0 0.0 3.89 1027 800 A 124 MET H A 123 GLU HBy 1.0 0.0 3.89 1028 801 A 124 MET H A 124 MET HBx 1.0 0.0 3.24 1029 801 A 124 MET H A 124 MET HBy 1.0 0.0 3.24 1030 802 A 125 ILE HB A 136 VAL HG11 1.0 0.0 4.22 1031 802 A 125 ILE HB A 136 VAL HG21 1.0 0.0 4.22 1032 803 A 125 ILE HG21 A 125 ILE HG1x 1.0 0.0 3.26 1033 803 A 125 ILE HG21 A 125 ILE HG1y 1.0 0.0 3.26 1034 804 A 125 ILE HG21 A 129 ASP HBy 1.0 0.0 3.62 1035 804 A 125 ILE HG21 A 129 ASP HBx 1.0 0.0 3.62 1036 805 A 125 ILE HG21 A 134 GLY HAy 1.0 0.0 3.88 1037 805 A 125 ILE HG21 A 134 GLY HAx 1.0 0.0 3.88 1038 806 A 125 ILE HG21 A 136 VAL HG11 1.0 0.0 2.96 1039 806 A 125 ILE HG21 A 136 VAL HG21 1.0 0.0 2.96 1040 807 A 125 ILE HD11 A 134 GLY HAy 1.0 0.0 5.00 1041 807 A 125 ILE HD11 A 134 GLY HAx 1.0 0.0 5.00 1042 808 A 126 ARG H A 126 ARG HDy 1.0 0.0 4.85 1043 808 A 126 ARG H A 126 ARG HDx 1.0 0.0 4.85 1044 809 A 126 ARG H A 127 GLU HBy 1.0 0.0 5.34 1045 809 A 126 ARG H A 127 GLU HBx 1.0 0.0 5.34 1046 810 A 126 ARG H A 127 GLU HGx 1.0 0.0 4.62 1047 810 A 126 ARG H A 127 GLU HGy 1.0 0.0 4.62 1048 811 A 126 ARG H A 129 ASP HBy 1.0 0.0 5.34 1049 811 A 126 ARG H A 129 ASP HBx 1.0 0.0 5.34 1050 812 A 126 ARG H A 136 VAL HG11 1.0 0.0 5.44 1051 812 A 126 ARG H A 136 VAL HG21 1.0 0.0 5.44 1052 813 A 126 ARG HA A 126 ARG HDy 1.0 0.0 3.28 1053 813 A 126 ARG HA A 126 ARG HDx 1.0 0.0 3.28 1054 814 A 126 ARG HBy A 126 ARG HDy 1.0 0.0 2.83 1055 814 A 126 ARG HDx A 126 ARG HBy 1.0 0.0 2.83 1056 815 A 127 GLU H A 127 GLU HBy 1.0 0.0 3.25 1057 815 A 127 GLU H A 127 GLU HBx 1.0 0.0 3.25 1058 816 A 127 GLU H A 127 GLU HGx 1.0 0.0 4.02 1059 816 A 127 GLU H A 127 GLU HGy 1.0 0.0 4.02 1060 817 A 144 MET HE1 A 127 GLU HBy 1.0 0.0 4.35 1061 817 A 144 MET HE1 A 127 GLU HBx 1.0 0.0 4.35 1062 818 A 128 ALA H A 129 ASP HBy 1.0 0.0 4.64 1063 818 A 128 ALA H A 129 ASP HBx 1.0 0.0 4.64 1064 819 A 128 ALA H A 144 MET HGx 1.0 0.0 5.34 1065 819 A 128 ALA H A 144 MET HGy 1.0 0.0 5.34 1066 820 A 129 ASP H A 129 ASP HBy 1.0 0.0 2.97 1067 820 A 129 ASP H A 129 ASP HBx 1.0 0.0 2.97 1068 821 A 129 ASP H A 136 VAL HG11 1.0 0.0 5.44 1069 821 A 129 ASP H A 136 VAL HG21 1.0 0.0 5.44 1070 822 A 129 ASP HA A 136 VAL HG11 1.0 0.0 4.13 1071 822 A 129 ASP HA A 136 VAL HG21 1.0 0.0 4.13 1072 823 A 130 ILE H A 129 ASP HBy 1.0 0.0 3.69 1073 823 A 130 ILE H A 129 ASP HBx 1.0 0.0 3.69 1074 824 A 134 GLY H A 129 ASP HBy 1.0 0.0 4.52 1075 824 A 134 GLY H A 129 ASP HBx 1.0 0.0 4.52 1076 825 A 135 GLN H A 129 ASP HBy 1.0 0.0 5.34 1077 825 A 135 GLN H A 129 ASP HBx 1.0 0.0 5.34 1078 826 A 129 ASP HBx A 136 VAL HG11 1.0 0.0 4.39 1079 826 A 129 ASP HBy A 136 VAL HG11 1.0 0.0 4.39 1080 826 A 136 VAL HG21 A 129 ASP HBy 1.0 0.0 4.39 1081 826 A 136 VAL HG21 A 129 ASP HBx 1.0 0.0 4.39 1082 827 A 130 ILE H A 130 ILE HG1y 1.0 0.0 3.39 1083 827 A 130 ILE H A 130 ILE HG1x 1.0 0.0 3.39 1084 828 A 130 ILE H A 140 GLU HBx 1.0 0.0 4.11 1085 828 A 130 ILE H A 140 GLU HBy 1.0 0.0 4.11 1086 829 A 130 ILE HA A 130 ILE HG1y 1.0 0.0 3.38 1087 829 A 130 ILE HA A 130 ILE HG1x 1.0 0.0 3.38 1088 830 A 130 ILE HG21 A 130 ILE HG1y 1.0 0.0 3.18 1089 830 A 130 ILE HG21 A 130 ILE HG1x 1.0 0.0 3.18 1090 831 A 130 ILE HG21 A 131 ASP HBy 1.0 0.0 5.34 1091 831 A 130 ILE HG21 A 131 ASP HBx 1.0 0.0 5.34 1092 832 A 132 GLY H A 130 ILE HG1y 1.0 0.0 5.34 1093 832 A 132 GLY H A 130 ILE HG1x 1.0 0.0 5.34 1094 833 A 140 GLU HA A 130 ILE HG1y 1.0 0.0 3.80 1095 833 A 140 GLU HA A 130 ILE HG1x 1.0 0.0 3.80 1096 834 A 140 GLU HGx A 130 ILE HG1y 1.0 0.0 3.51 1097 834 A 140 GLU HGx A 130 ILE HG1x 1.0 0.0 3.51 1098 835 A 140 GLU HGy A 130 ILE HG1y 1.0 0.0 3.97 1099 835 A 140 GLU HGy A 130 ILE HG1x 1.0 0.0 3.97 1100 836 A 130 ILE HD1% A 140 GLU HBx 1.0 0.0 4.38 1101 836 A 130 ILE HD1% A 140 GLU HBy 1.0 0.0 4.38 1102 837 A 131 ASP H A 131 ASP HBy 1.0 0.0 3.62 1103 837 A 131 ASP H A 131 ASP HBx 1.0 0.0 3.62 1104 838 A 133 ASP H A 131 ASP HBy 1.0 0.0 3.83 1105 838 A 133 ASP H A 131 ASP HBx 1.0 0.0 3.83 1106 839 A 131 ASP HBy A 133 ASP HBy 1.0 0.0 3.09 1107 839 A 131 ASP HBx A 133 ASP HBy 1.0 0.0 3.09 1108 839 A 133 ASP HBx A 131 ASP HBy 1.0 0.0 3.09 1109 839 A 131 ASP HBx A 133 ASP HBx 1.0 0.0 3.09 1110 840 A 132 GLY HAy A 133 ASP HBy 1.0 0.0 5.34 1111 840 A 132 GLY HAy A 133 ASP HBx 1.0 0.0 5.34 1112 841 A 133 ASP H A 133 ASP HBy 1.0 0.0 3.46 1113 841 A 133 ASP H A 133 ASP HBx 1.0 0.0 3.46 1114 842 A 133 ASP H A 134 GLY HAy 1.0 0.0 4.86 1115 842 A 133 ASP H A 134 GLY HAx 1.0 0.0 4.86 1116 843 A 135 GLN H A 133 ASP HBy 1.0 0.0 5.06 1117 843 A 135 GLN H A 133 ASP HBx 1.0 0.0 5.06 1118 844 A 135 GLN HBx A 133 ASP HBy 1.0 0.0 5.34 1119 844 A 135 GLN HBx A 133 ASP HBx 1.0 0.0 5.34 1120 845 A 135 GLN H A 136 VAL HG11 1.0 0.0 5.10 1121 845 A 135 GLN H A 136 VAL HG21 1.0 0.0 5.10 1122 846 A 135 GLN HA A 136 VAL HG11 1.0 0.0 4.55 1123 846 A 135 GLN HA A 136 VAL HG21 1.0 0.0 4.55 1124 847 A 136 VAL H A 136 VAL HG11 1.0 0.0 3.23 1125 847 A 136 VAL H A 136 VAL HG21 1.0 0.0 3.23 1126 848 A 137 ASN H A 136 VAL HG11 1.0 0.0 3.95 1127 848 A 137 ASN H A 136 VAL HG21 1.0 0.0 3.95 1128 849 A 138 TYR H A 136 VAL HG11 1.0 0.0 5.44 1129 849 A 138 TYR H A 136 VAL HG21 1.0 0.0 5.44 1130 850 A 138 TYR HA A 136 VAL HG11 1.0 0.0 4.56 1131 850 A 138 TYR HA A 136 VAL HG21 1.0 0.0 4.56 1132 851 A 139 GLU H A 136 VAL HG11 1.0 0.0 5.44 1133 851 A 139 GLU H A 136 VAL HG21 1.0 0.0 5.44 1134 852 A 140 GLU HA A 136 VAL HG11 1.0 0.0 4.55 1135 852 A 140 GLU HA A 136 VAL HG21 1.0 0.0 4.55 1136 853 A 140 GLU HGy A 136 VAL HG11 1.0 0.0 4.61 1137 853 A 140 GLU HGy A 136 VAL HG21 1.0 0.0 4.61 1138 854 A 141 PHE H A 136 VAL HG11 1.0 0.0 3.92 1139 854 A 141 PHE H A 136 VAL HG21 1.0 0.0 3.92 1140 855 A 136 VAL HG11 A 141 PHE HBx 1.0 0.0 4.06 1141 855 A 136 VAL HG21 A 141 PHE HBx 1.0 0.0 4.06 1142 855 A 141 PHE HBy A 136 VAL HG11 1.0 0.0 4.06 1143 855 A 136 VAL HG21 A 141 PHE HBy 1.0 0.0 4.06 1144 856 A 141 PHE HD% A 136 VAL HG11 1.0 0.0 4.09 1145 856 A 141 PHE HD% A 136 VAL HG21 1.0 0.0 4.09 1146 857 A 141 PHE HE% A 136 VAL HG11 1.0 0.0 3.91 1147 857 A 141 PHE HE% A 136 VAL HG21 1.0 0.0 3.91 1148 858 A 142 VAL H A 136 VAL HG11 1.0 0.0 4.61 1149 858 A 142 VAL H A 136 VAL HG21 1.0 0.0 4.61 1150 859 A 138 TYR H A 137 ASN HBx 1.0 0.0 2.98 1151 859 A 138 TYR H A 137 ASN HBy 1.0 0.0 2.98 1152 860 A 138 TYR H A 138 TYR HBx 1.0 0.0 2.83 1153 860 A 138 TYR H A 138 TYR HBy 1.0 0.0 2.83 1154 861 A 138 TYR HA A 142 VAL HG11 1.0 0.0 4.37 1155 861 A 138 TYR HA A 142 VAL HG21 1.0 0.0 4.37 1156 862 A 139 GLU H A 138 TYR HBx 1.0 0.0 3.11 1157 862 A 139 GLU H A 138 TYR HBy 1.0 0.0 3.11 1158 863 A 138 TYR HBy A 142 VAL HG11 1.0 0.0 5.17 1159 863 A 138 TYR HBx A 142 VAL HG11 1.0 0.0 5.17 1160 863 A 142 VAL HG21 A 138 TYR HBx 1.0 0.0 5.17 1161 863 A 142 VAL HG21 A 138 TYR HBy 1.0 0.0 5.17 1162 864 A 138 TYR HD% A 142 VAL HG11 1.0 0.0 4.52 1163 864 A 138 TYR HD% A 142 VAL HG21 1.0 0.0 4.52 1164 865 A 139 GLU H A 139 GLU HBx 1.0 0.0 3.21 1165 865 A 139 GLU H A 139 GLU HBy 1.0 0.0 3.21 1166 866 A 139 GLU H A 139 GLU HGx 1.0 0.0 2.97 1167 866 A 139 GLU H A 139 GLU HGy 1.0 0.0 2.97 1168 867 A 139 GLU H A 142 VAL HG11 1.0 0.0 5.20 1169 867 A 139 GLU H A 142 VAL HG21 1.0 0.0 5.20 1170 868 A 139 GLU HA A 139 GLU HGx 1.0 0.0 3.25 1171 868 A 139 GLU HA A 139 GLU HGy 1.0 0.0 3.25 1172 869 A 139 GLU HGx A 142 VAL HG11 1.0 0.0 4.77 1173 869 A 139 GLU HGy A 142 VAL HG11 1.0 0.0 4.77 1174 869 A 142 VAL HG21 A 139 GLU HGx 1.0 0.0 4.77 1175 869 A 142 VAL HG21 A 139 GLU HGy 1.0 0.0 4.77 1176 870 A 140 GLU H A 140 GLU HBx 1.0 0.0 3.40 1177 870 A 140 GLU H A 140 GLU HBy 1.0 0.0 3.40 1178 871 A 141 PHE H A 140 GLU HBx 1.0 0.0 4.06 1179 871 A 141 PHE H A 140 GLU HBy 1.0 0.0 4.06 1180 872 A 141 PHE H A 142 VAL HG11 1.0 0.0 5.10 1181 872 A 141 PHE H A 142 VAL HG21 1.0 0.0 5.10 1182 873 A 141 PHE HD% A 142 VAL HG11 1.0 0.0 3.98 1183 873 A 141 PHE HD% A 142 VAL HG21 1.0 0.0 3.98 1184 874 A 142 VAL H A 142 VAL HG11 1.0 0.0 3.13 1185 874 A 142 VAL H A 142 VAL HG21 1.0 0.0 3.13 1186 875 A 142 VAL HA A 142 VAL HG11 1.0 0.0 3.13 1187 875 A 142 VAL HA A 142 VAL HG21 1.0 0.0 3.13 1188 876 A 142 VAL HA A 145 MET HBx 1.0 0.0 4.96 1189 876 A 142 VAL HA A 145 MET HBy 1.0 0.0 4.96 1190 877 A 143 GLN H A 142 VAL HG11 1.0 0.0 3.95 1191 877 A 143 GLN H A 142 VAL HG21 1.0 0.0 3.95 1192 878 A 143 GLN HA A 142 VAL HG11 1.0 0.0 4.26 1193 878 A 143 GLN HA A 142 VAL HG21 1.0 0.0 4.26 1194 879 A 144 MET H A 142 VAL HG11 1.0 0.0 5.44 1195 879 A 144 MET H A 142 VAL HG21 1.0 0.0 5.44 1196 880 A 142 VAL HG11 A 145 MET HBx 1.0 0.0 3.99 1197 880 A 142 VAL HG21 A 145 MET HBx 1.0 0.0 3.99 1198 880 A 145 MET HBy A 142 VAL HG11 1.0 0.0 3.99 1199 880 A 142 VAL HG21 A 145 MET HBy 1.0 0.0 3.99 1200 881 A 143 GLN H A 143 GLN HBx 1.0 0.0 3.34 1201 881 A 143 GLN H A 143 GLN HBy 1.0 0.0 3.34 1202 882 A 143 GLN H A 143 GLN HGx 1.0 0.0 4.47 1203 882 A 143 GLN H A 143 GLN HGy 1.0 0.0 4.47 1204 883 A 143 GLN HA A 143 GLN HGx 1.0 0.0 3.33 1205 883 A 143 GLN HA A 143 GLN HGy 1.0 0.0 3.33 1206 884 A 144 MET HE1 A 144 MET HBx 1.0 0.0 4.28 1207 884 A 144 MET HE1 A 144 MET HBy 1.0 0.0 4.28 1208 885 A 145 MET H A 145 MET HBx 1.0 0.0 3.48 1209 885 A 145 MET H A 145 MET HBy 1.0 0.0 3.48 1210 886 A 145 MET HE1 A 145 MET HBx 1.0 0.0 2.97 1211 886 A 145 MET HE1 A 145 MET HBy 1.0 0.0 2.97 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 97 ASN OD1 B 1 CA CA 1.0 0.0 3.0 2 2 B 1 CA CA A 104 GLU OE1 1.0 0.0 3.0 3 3 B 1 CA CA A 135 GLN OE1 1.0 0.0 3.0 4 4 A 129 ASP OD1 3 1 CA CA 1.0 0.0 3.0 5 5 3 1 CA CA A 129 ASP OD2 1.0 0.0 3.0 6 6 3 1 CA CA A 133 ASP OD1 1.0 0.0 3.0 7 7 3 1 CA CA A 135 GLN O 1.0 0.0 3.0 8 8 3 1 CA CA A 140 GLU OE1 1.0 0.0 3.0 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 79 THR C A 80 ASP N A 80 ASP CA A 80 ASP C 1.0 -135.9 -22.1 PHI 2 2 A 80 ASP N A 80 ASP CA A 80 ASP C A 81 SER N 1.0 -72.2 19.6 PSI 3 3 A 81 SER C A 82 GLU N A 82 GLU CA A 82 GLU C 1.0 -79.4 -44.4 PHI 4 4 A 82 GLU N A 82 GLU CA A 82 GLU C A 83 GLU N 1.0 -66.2 -6.2 PSI 5 5 A 82 GLU C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -76.2 -50.8 PHI 6 6 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 GLU N 1.0 -53.4 -25.2 PSI 7 7 A 83 GLU C A 84 GLU N A 84 GLU CA A 84 GLU C 1.0 -81.9 -52.1 PHI 8 8 A 84 GLU N A 84 GLU CA A 84 GLU C A 85 ILE N 1.0 -54.2 -26.4 PSI 9 9 A 84 GLU C A 85 ILE N A 85 ILE CA A 85 ILE C 1.0 -74.8 -54.8 PHI 10 10 A 85 ILE N A 85 ILE CA A 85 ILE C A 86 ARG N 1.0 -52.0 -31.4 PSI 11 11 A 85 ILE C A 86 ARG N A 86 ARG CA A 86 ARG C 1.0 -72.5 -52.3 PHI 12 12 A 86 ARG N A 86 ARG CA A 86 ARG C A 87 GLU N 1.0 -50.1 -28.7 PSI 13 13 A 86 ARG C A 87 GLU N A 87 GLU CA A 87 GLU C 1.0 -77.0 -55.8 PHI 14 14 A 87 GLU N A 87 GLU CA A 87 GLU C A 88 ALA N 1.0 -61.8 -14.2 PSI 15 15 A 87 GLU C A 88 ALA N A 88 ALA CA A 88 ALA C 1.0 -85.6 -45.6 PHI 16 16 A 88 ALA N A 88 ALA CA A 88 ALA C A 89 PHE N 1.0 -52.8 -32.8 PSI 17 17 A 88 ALA C A 89 PHE N A 89 PHE CA A 89 PHE C 1.0 -69.9 -49.9 PHI 18 18 A 89 PHE N A 89 PHE CA A 89 PHE C A 90 ARG N 1.0 -51.0 -31.0 PSI 19 19 A 89 PHE C A 90 ARG N A 90 ARG CA A 90 ARG C 1.0 -83.3 -43.3 PHI 20 20 A 90 ARG N A 90 ARG CA A 90 ARG C A 91 VAL N 1.0 -60.3 -9.5 PSI 21 21 A 90 ARG C A 91 VAL N A 91 VAL CA A 91 VAL C 1.0 -86.7 -49.9 PHI 22 22 A 91 VAL N A 91 VAL CA A 91 VAL C A 92 PHE N 1.0 -56.8 -16.6 PSI 23 23 A 91 VAL C A 92 PHE N A 92 PHE CA A 92 PHE C 1.0 -85.4 -65.0 PHI 24 24 A 92 PHE N A 92 PHE CA A 92 PHE C A 93 ASP N 1.0 -68.7 -0.9 PSI 25 25 A 92 PHE C A 93 ASP N A 93 ASP CA A 93 ASP C 1.0 -108.4 -52.0 PHI 26 26 A 93 ASP N A 93 ASP CA A 93 ASP C A 94 LYS N 1.0 41.1 131.9 PSI 27 27 A 93 ASP C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -79.8 -29.8 PHI 28 28 A 94 LYS N A 94 LYS CA A 94 LYS C A 95 ASP N 1.0 -64.2 -14.2 PSI 29 29 A 94 LYS C A 95 ASP N A 95 ASP CA A 95 ASP C 1.0 -116.4 -66.4 PHI 30 30 A 95 ASP N A 95 ASP CA A 95 ASP C A 96 GLY N 1.0 -16.6 33.4 PSI 31 31 A 95 ASP C A 96 GLY N A 96 GLY CA A 96 GLY C 1.0 21.7 84.1 PHI 32 32 A 96 GLY N A 96 GLY CA A 96 GLY C A 97 ASN N 1.0 -4.0 65.4 PSI 33 33 A 96 GLY C A 97 ASN N A 97 ASN CA A 97 ASN C 1.0 -117.1 -67.1 PHI 34 34 A 97 ASN N A 97 ASN CA A 97 ASN C A 98 GLY N 1.0 -15.8 24.2 PSI 35 35 A 97 ASN C A 98 GLY N A 98 GLY CA A 98 GLY C 1.0 61.4 111.4 PHI 36 36 A 98 GLY N A 98 GLY CA A 98 GLY C A 99 TYR N 1.0 -17.3 22.7 PSI 37 37 A 98 GLY C A 99 TYR N A 99 TYR CA A 99 TYR C 1.0 -158.6 -118.6 PHI 38 38 A 99 TYR N A 99 TYR CA A 99 TYR C A 100 ILE N 1.0 126.8 176.8 PSI 39 39 A 99 TYR C A 100 ILE N A 100 ILE CA A 100 ILE C 1.0 -148.8 -68.8 PHI 40 40 A 100 ILE N A 100 ILE CA A 100 ILE C A 101 SER N 1.0 96.4 146.4 PSI 41 41 A 100 ILE C A 101 SER N A 101 SER CA A 101 SER C 1.0 -138.0 -38.0 PHI 42 42 A 101 SER N A 101 SER CA A 101 SER C A 102 ALA N 1.0 141.4 191.4 PSI 43 43 A 101 SER C A 102 ALA N A 102 ALA CA A 102 ALA C 1.0 -77.0 -43.8 PHI 44 44 A 102 ALA N A 102 ALA CA A 102 ALA C A 103 ALA N 1.0 -58.6 -24.6 PSI 45 45 A 102 ALA C A 103 ALA N A 103 ALA CA A 103 ALA C 1.0 -83.1 -43.1 PHI 46 46 A 103 ALA N A 103 ALA CA A 103 ALA C A 104 GLU N 1.0 -52.1 -26.7 PSI 47 47 A 103 ALA C A 104 GLU N A 104 GLU CA A 104 GLU C 1.0 -74.4 -54.2 PHI 48 48 A 104 GLU N A 104 GLU CA A 104 GLU C A 105 LEU N 1.0 -53.5 -30.9 PSI 49 49 A 104 GLU C A 105 LEU N A 105 LEU CA A 105 LEU C 1.0 -71.2 -51.2 PHI 50 50 A 105 LEU N A 105 LEU CA A 105 LEU C A 106 ARG N 1.0 -62.1 -22.1 PSI 51 51 A 105 LEU C A 106 ARG N A 106 ARG CA A 106 ARG C 1.0 -87.0 -47.0 PHI 52 52 A 106 ARG N A 106 ARG CA A 106 ARG C A 107 HIS N 1.0 -59.3 -19.3 PSI 53 53 A 106 ARG C A 107 HIS N A 107 HIS CA A 107 HIS C 1.0 -72.3 -52.3 PHI 54 54 A 107 HIS N A 107 HIS CA A 107 HIS C A 108 VAL N 1.0 -67.0 -27.0 PSI 55 55 A 107 HIS C A 108 VAL N A 108 VAL CA A 108 VAL C 1.0 -83.9 -43.9 PHI 56 56 A 108 VAL N A 108 VAL CA A 108 VAL C A 109 MET N 1.0 -54.6 -29.2 PSI 57 57 A 108 VAL C A 109 MET N A 109 MET CA A 109 MET C 1.0 -83.5 -43.5 PHI 58 58 A 109 MET N A 109 MET CA A 109 MET C A 110 THR N 1.0 -56.4 -16.4 PSI 59 59 A 109 MET C A 110 THR N A 110 THR CA A 110 THR C 1.0 -85.8 -45.8 PHI 60 60 A 110 THR N A 110 THR CA A 110 THR C A 111 ASN N 1.0 -54.5 -21.1 PSI 61 61 A 110 THR C A 111 ASN N A 111 ASN CA A 111 ASN C 1.0 -75.8 -55.8 PHI 62 62 A 111 ASN N A 111 ASN CA A 111 ASN C A 112 LEU N 1.0 -45.3 -5.3 PSI 63 63 A 111 ASN C A 112 LEU N A 112 LEU CA A 112 LEU C 1.0 -107.6 -65.0 PHI 64 64 A 112 LEU N A 112 LEU CA A 112 LEU C A 113 GLY N 1.0 -35.6 39.6 PSI 65 65 A 112 LEU C A 113 GLY N A 113 GLY CA A 113 GLY C 1.0 54.0 124.0 PHI 66 66 A 113 GLY N A 113 GLY CA A 113 GLY C A 114 GLU N 1.0 -23.7 43.9 PSI 67 67 A 113 GLY C A 114 GLU N A 114 GLU CA A 114 GLU C 1.0 -137.6 -38.2 PHI 68 68 A 114 GLU N A 114 GLU CA A 114 GLU C A 115 LYS N 1.0 115.2 168.8 PSI 69 69 A 114 GLU C A 115 LYS N A 115 LYS CA A 115 LYS C 1.0 -145.3 -48.9 PHI 70 70 A 115 LYS N A 115 LYS CA A 115 LYS C A 116 LEU N 1.0 59.6 172.6 PSI 71 71 A 115 LYS C A 116 LEU N A 116 LEU CA A 116 LEU C 1.0 -127.6 -58.0 PHI 72 72 A 116 LEU N A 116 LEU CA A 116 LEU C A 117 THR N 1.0 112.0 172.0 PSI 73 73 A 116 LEU C A 117 THR N A 117 THR CA A 117 THR C 1.0 -107.6 -67.6 PHI 74 74 A 117 THR N A 117 THR CA A 117 THR C A 118 ASP N 1.0 147.9 187.9 PSI 75 75 A 117 THR C A 118 ASP N A 118 ASP CA A 118 ASP C 1.0 -69.3 -48.9 PHI 76 76 A 118 ASP N A 118 ASP CA A 118 ASP C A 119 GLU N 1.0 -50.4 -23.4 PSI 77 77 A 118 ASP C A 119 GLU N A 119 GLU CA A 119 GLU C 1.0 -77.6 -57.6 PHI 78 78 A 119 GLU N A 119 GLU CA A 119 GLU C A 120 GLU N 1.0 -51.6 -31.6 PSI 79 79 A 119 GLU C A 120 GLU N A 120 GLU CA A 120 GLU C 1.0 -76.2 -53.8 PHI 80 80 A 120 GLU N A 120 GLU CA A 120 GLU C A 121 VAL N 1.0 -53.2 -24.6 PSI 81 81 A 120 GLU C A 121 VAL N A 121 VAL CA A 121 VAL C 1.0 -75.7 -53.7 PHI 82 82 A 121 VAL N A 121 VAL CA A 121 VAL C A 122 ASP N 1.0 -58.6 -32.2 PSI 83 83 A 121 VAL C A 122 ASP N A 122 ASP CA A 122 ASP C 1.0 -75.6 -48.2 PHI 84 84 A 122 ASP N A 122 ASP CA A 122 ASP C A 123 GLU N 1.0 -56.5 -31.1 PSI 85 85 A 122 ASP C A 123 GLU N A 123 GLU CA A 123 GLU C 1.0 -75.5 -53.1 PHI 86 86 A 123 GLU N A 123 GLU CA A 123 GLU C A 124 MET N 1.0 -62.4 -22.4 PSI 87 87 A 123 GLU C A 124 MET N A 124 MET CA A 124 MET C 1.0 -72.0 -52.0 PHI 88 88 A 124 MET N A 124 MET CA A 124 MET C A 125 ILE N 1.0 -55.6 -27.0 PSI 89 89 A 124 MET C A 125 ILE N A 125 ILE CA A 125 ILE C 1.0 -77.3 -57.3 PHI 90 90 A 125 ILE N A 125 ILE CA A 125 ILE C A 126 ARG N 1.0 -57.4 -23.8 PSI 91 91 A 125 ILE C A 126 ARG N A 126 ARG CA A 126 ARG C 1.0 -82.2 -45.0 PHI 92 92 A 126 ARG N A 126 ARG CA A 126 ARG C A 127 GLU N 1.0 -58.3 -18.7 PSI 93 93 A 126 ARG C A 127 GLU N A 127 GLU CA A 127 GLU C 1.0 -96.7 -45.7 PHI 94 94 A 127 GLU N A 127 GLU CA A 127 GLU C A 128 ALA N 1.0 -54.5 -4.3 PSI 95 95 A 127 GLU C A 128 ALA N A 128 ALA CA A 128 ALA C 1.0 -150.0 -61.6 PHI 96 96 A 128 ALA N A 128 ALA CA A 128 ALA C A 129 ASP N 1.0 -42.2 37.8 PSI 97 97 A 128 ALA C A 129 ASP N A 129 ASP CA A 129 ASP C 1.0 -103.1 -43.3 PHI 98 98 A 129 ASP N A 129 ASP CA A 129 ASP C A 130 ILE N 1.0 75.4 166.8 PSI 99 99 A 131 ASP C A 132 GLY N A 132 GLY CA A 132 GLY C 1.0 27.8 71.0 PHI 100 100 A 132 GLY N A 132 GLY CA A 132 GLY C A 133 ASP N 1.0 8.8 62.4 PSI 101 101 A 132 GLY C A 133 ASP N A 133 ASP CA A 133 ASP C 1.0 -122.1 -62.1 PHI 102 102 A 133 ASP N A 133 ASP CA A 133 ASP C A 134 GLY N 1.0 -15.8 24.2 PSI 103 103 A 133 ASP C A 134 GLY N A 134 GLY CA A 134 GLY C 1.0 59.7 109.7 PHI 104 104 A 134 GLY N A 134 GLY CA A 134 GLY C A 135 GLN N 1.0 -20.8 17.2 PSI 105 105 A 134 GLY C A 135 GLN N A 135 GLN CA A 135 GLN C 1.0 -153.3 -121.7 PHI 106 106 A 135 GLN N A 135 GLN CA A 135 GLN C A 136 VAL N 1.0 118.9 188.9 PSI 107 107 A 135 GLN C A 136 VAL N A 136 VAL CA A 136 VAL C 1.0 -144.6 -81.8 PHI 108 108 A 136 VAL N A 136 VAL CA A 136 VAL C A 137 ASN N 1.0 102.0 144.4 PSI 109 109 A 136 VAL C A 137 ASN N A 137 ASN CA A 137 ASN C 1.0 -111.4 -56.2 PHI 110 110 A 137 ASN N A 137 ASN CA A 137 ASN C A 138 TYR N 1.0 147.0 193.4 PSI 111 111 A 137 ASN C A 138 TYR N A 138 TYR CA A 138 TYR C 1.0 -76.7 -36.7 PHI 112 112 A 138 TYR N A 138 TYR CA A 138 TYR C A 139 GLU N 1.0 -65.1 -31.3 PSI 113 113 A 138 TYR C A 139 GLU N A 139 GLU CA A 139 GLU C 1.0 -73.7 -46.1 PHI 114 114 A 139 GLU N A 139 GLU CA A 139 GLU C A 140 GLU N 1.0 -58.6 -28.0 PSI 115 115 A 139 GLU C A 140 GLU N A 140 GLU CA A 140 GLU C 1.0 -82.1 -51.9 PHI 116 116 A 140 GLU N A 140 GLU CA A 140 GLU C A 141 PHE N 1.0 -48.3 -28.3 PSI 117 117 A 140 GLU C A 141 PHE N A 141 PHE CA A 141 PHE C 1.0 -74.5 -54.5 PHI 118 118 A 141 PHE N A 141 PHE CA A 141 PHE C A 142 VAL N 1.0 -65.2 -25.2 PSI 119 119 A 141 PHE C A 142 VAL N A 142 VAL CA A 142 VAL C 1.0 -81.8 -41.8 PHI 120 120 A 142 VAL N A 142 VAL CA A 142 VAL C A 143 GLN N 1.0 -73.2 -13.2 PSI 121 121 A 142 VAL C A 143 GLN N A 143 GLN CA A 143 GLN C 1.0 -81.9 -41.9 PHI 122 122 A 143 GLN N A 143 GLN CA A 143 GLN C A 144 MET N 1.0 -59.1 -23.1 PSI 123 123 A 143 GLN C A 144 MET N A 144 MET CA A 144 MET C 1.0 -90.2 -50.2 PHI 124 124 A 144 MET N A 144 MET CA A 144 MET C A 145 MET N 1.0 -53.1 -13.1 PSI 125 125 A 145 MET C A 146 THR N A 146 THR CA A 146 THR C 1.0 -133.5 -63.5 PHI 126 126 A 146 THR N A 146 THR CA A 146 THR C A 147 ALA N 1.0 -44.4 35.6 PSI 127 127 A 146 THR C A 147 ALA N A 147 ALA CA A 147 ALA C 1.0 -91.4 -51.0 PHI 128 128 A 147 ALA N A 147 ALA CA A 147 ALA C A 148 LYS N 1.0 75.0 159.0 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 80 ASP N A 80 ASP H 1.0 . . . 2 2 A 81 SER N A 81 SER H 1.0 . . . 3 3 A 82 GLU N A 82 GLU H 1.0 . . . 4 4 A 83 GLU N A 83 GLU H 1.0 . . . 5 5 A 84 GLU N A 84 GLU H 1.0 . . . 6 6 A 85 ILE N A 85 ILE H 1.0 . . . 7 7 A 86 ARG N A 86 ARG H 1.0 . . . 8 8 A 87 GLU N A 87 GLU H 1.0 . . . 9 9 A 88 ALA N A 88 ALA H 1.0 . . . 10 10 A 89 PHE N A 89 PHE H 1.0 . . . 11 11 A 90 ARG N A 90 ARG H 1.0 . . . 12 12 A 91 VAL N A 91 VAL H 1.0 . . . 13 13 A 92 PHE N A 92 PHE H 1.0 . . . 14 14 A 93 ASP N A 93 ASP H 1.0 . . . 15 15 A 94 LYS N A 94 LYS H 1.0 . . . 16 16 A 95 ASP N A 95 ASP H 1.0 . . . 17 17 A 96 GLY N A 96 GLY H 1.0 . . . 18 18 A 97 ASN N A 97 ASN H 1.0 . . . 19 19 A 98 GLY N A 98 GLY H 1.0 . . . 20 20 A 99 TYR N A 99 TYR H 1.0 . . . 21 21 A 100 ILE N A 100 ILE H 1.0 . . . 22 22 A 101 SER N A 101 SER H 1.0 . . . 23 23 A 102 ALA N A 102 ALA H 1.0 . . . 24 24 A 103 ALA N A 103 ALA H 1.0 . . . 25 25 A 104 GLU N A 104 GLU H 1.0 . . . 26 26 A 105 LEU N A 105 LEU H 1.0 . . . 27 27 A 106 ARG N A 106 ARG H 1.0 . . . 28 28 A 107 HIS N A 107 HIS H 1.0 . . . 29 29 A 108 VAL N A 108 VAL H 1.0 . . . 30 30 A 109 MET N A 109 MET H 1.0 . . . 31 31 A 110 THR N A 110 THR H 1.0 . . . 32 32 A 111 ASN N A 111 ASN H 1.0 . . . 33 33 A 112 LEU N A 112 LEU H 1.0 . . . 34 34 A 113 GLY N A 113 GLY H 1.0 . . . 35 35 A 114 GLU N A 114 GLU H 1.0 . . . 36 36 A 115 LYS N A 115 LYS H 1.0 . . . 37 37 A 116 LEU N A 116 LEU H 1.0 . . . 38 38 A 117 THR N A 117 THR H 1.0 . . . 39 39 A 118 ASP N A 118 ASP H 1.0 . . . 40 40 A 119 GLU N A 119 GLU H 1.0 . . . 41 41 A 120 GLU N A 120 GLU H 1.0 . . . 42 42 A 121 VAL N A 121 VAL H 1.0 . . . 43 43 A 122 ASP N A 122 ASP H 1.0 . . . 44 44 A 123 GLU N A 123 GLU H 1.0 . . . 45 45 A 124 MET N A 124 MET H 1.0 . . . 46 46 A 125 ILE N A 125 ILE H 1.0 . . . 47 47 A 126 ARG N A 126 ARG H 1.0 . . . 48 48 A 127 GLU N A 127 GLU H 1.0 . . . 49 49 A 128 ALA N A 128 ALA H 1.0 . . . 50 50 A 129 ASP N A 129 ASP H 1.0 . . . 51 51 A 130 ILE N A 130 ILE H 1.0 . . . 52 52 A 131 ASP N A 131 ASP H 1.0 . . . 53 53 A 132 GLY N A 132 GLY H 1.0 . . . 54 54 A 133 ASP N A 133 ASP H 1.0 . . . 55 55 A 134 GLY N A 134 GLY H 1.0 . . . 56 56 A 135 GLN N A 135 GLN H 1.0 . . . 57 57 A 136 VAL N A 136 VAL H 1.0 . . . 58 58 A 137 ASN N A 137 ASN H 1.0 . . . 59 59 A 138 TYR N A 138 TYR H 1.0 . . . 60 60 A 139 GLU N A 139 GLU H 1.0 . . . 61 61 A 140 GLU N A 140 GLU H 1.0 . . . 62 62 A 141 PHE N A 141 PHE H 1.0 . . . 63 63 A 142 VAL N A 142 VAL H 1.0 . . . 64 64 A 143 GLN N A 143 GLN H 1.0 . . . 65 65 A 144 MET N A 144 MET H 1.0 . . . 66 66 A 145 MET N A 145 MET H 1.0 . . . 67 67 A 146 THR N A 146 THR H 1.0 . . . 68 68 A 147 ALA N A 147 ALA H 1.0 . . . 69 69 A 148 LYS N A 148 LYS H 1.0 . . . stop_ save_