data_nef_c19727_2mji save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MJI stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ALA start . . 2 A 2 PHE middle . . 3 A 3 ASP middle . . 4 A 4 SER middle . . 5 A 5 THR middle . . 6 A 6 TRP middle . . 7 A 7 LYS middle . . 8 A 8 VAL middle . . 9 A 9 ASP middle . . 10 A 10 ARG middle . . 11 A 11 SER middle . . 12 A 12 GLU middle . . 13 A 13 ASN middle . . 14 A 14 TYR middle . . 15 A 15 ASP middle . . 16 A 16 LYS middle . . 17 A 17 PHE middle . . 18 A 18 MET middle . . 19 A 19 GLU middle . . 20 A 20 LYS middle . . 21 A 21 MET middle . . 22 A 22 GLY middle . false 23 A 23 VAL middle . . 24 A 24 ASN middle . . 25 A 25 ILE middle . . 26 A 26 VAL middle . . 27 A 27 LYS middle . . 28 A 28 ARG middle . . 29 A 29 LYS middle . . 30 A 30 LEU middle . . 31 A 31 ALA middle . . 32 A 32 ALA middle . . 33 A 33 HIS middle . . 34 A 34 ASP middle . . 35 A 35 ASN middle . . 36 A 36 LEU middle . . 37 A 37 LYS middle . . 38 A 38 LEU middle . . 39 A 39 THR middle . . 40 A 40 ILE middle . . 41 A 41 THR middle . . 42 A 42 GLN middle . . 43 A 43 GLU middle . . 44 A 44 GLY middle . false 45 A 45 ASN middle . . 46 A 46 LYS middle . . 47 A 47 PHE middle . . 48 A 48 THR middle . . 49 A 49 VAL middle . . 50 A 50 LYS middle . . 51 A 51 GLU middle . . 52 A 52 SER middle . . 53 A 53 SER middle . . 54 A 54 ALA middle . . 55 A 55 PHE middle . . 56 A 56 ARG middle . . 57 A 57 ASN middle . . 58 A 58 ILE middle . . 59 A 59 GLU middle . . 60 A 60 VAL middle . . 61 A 61 VAL middle . . 62 A 62 PHE middle . . 63 A 63 GLU middle . . 64 A 64 LEU middle . . 65 A 65 GLY middle . false 66 A 66 VAL middle . . 67 A 67 THR middle . . 68 A 68 PHE middle . . 69 A 69 ASN middle . . 70 A 70 TYR middle . . 71 A 71 ASN middle . . 72 A 72 LEU middle . . 73 A 73 ALA middle . . 74 A 74 ASP middle . . 75 A 75 GLY middle . false 76 A 76 THR middle . . 77 A 77 GLU middle . . 78 A 78 LEU middle . . 79 A 79 ARG middle . . 80 A 80 GLY middle . false 81 A 81 THR middle . . 82 A 82 TRP middle . . 83 A 83 SER middle . . 84 A 84 LEU middle . . 85 A 85 GLU middle . . 86 A 86 GLY middle . false 87 A 87 ASN middle . . 88 A 88 LYS middle . . 89 A 89 LEU middle . . 90 A 90 ILE middle . . 91 A 91 GLY middle . false 92 A 92 LYS middle . . 93 A 93 PHE middle . . 94 A 94 LYS middle . . 95 A 95 ARG middle . . 96 A 96 THR middle . . 97 A 97 ASP middle . . 98 A 98 ASN middle . . 99 A 99 GLY middle . false 100 A 100 ASN middle . . 101 A 101 GLU middle . . 102 A 102 LEU middle . . 103 A 103 ASN middle . . 104 A 104 THR middle . . 105 A 105 VAL middle . . 106 A 106 ARG middle . . 107 A 107 GLU middle . . 108 A 108 ILE middle . . 109 A 109 ILE middle . . 110 A 110 GLY middle . false 111 A 111 ASP middle . . 112 A 112 GLU middle . . 113 A 113 LEU middle . . 114 A 114 VAL middle . . 115 A 115 GLN middle . . 116 A 116 THR middle . . 117 A 117 TYR middle . . 118 A 118 VAL middle . . 119 A 119 TYR middle . . 120 A 120 GLU middle . . 121 A 121 GLY middle . false 122 A 122 VAL middle . . 123 A 123 GLU middle . . 124 A 124 ALA middle . . 125 A 125 LYS middle . . 126 A 126 ARG middle . . 127 A 127 ILE middle . . 128 A 128 PHE middle . . 129 A 129 LYS middle . . 130 A 130 LYS middle . . 131 A 131 ASP end . . 132 B 1 KTR . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ALA H1 H 1 8.319 0.025 A 1 ALA HA H 1 4.090 0.025 A 1 ALA HB% H 1 1.160 0.025 A 1 ALA CA C 13 54.130 0.4 A 1 ALA CB C 13 19.420 0.4 A 1 ALA N N 15 123.172 0.4 A 2 PHE H H 1 8.270 0.025 A 2 PHE HA H 1 4.440 0.025 A 2 PHE HBx H 1 3.080 0.025 A 2 PHE HBy H 1 3.080 0.025 A 2 PHE HDy H 1 7.170 0.025 A 2 PHE HDx H 1 6.910 0.025 A 2 PHE HEy H 1 7.010 0.025 A 2 PHE HEx H 1 6.760 0.025 A 2 PHE CA C 13 59.610 0.4 A 2 PHE CB C 13 39.760 0.4 A 2 PHE CDx C 13 131.110 0.4 A 2 PHE CDy C 13 131.110 0.4 A 2 PHE CEx C 13 131.040 0.4 A 2 PHE CEy C 13 131.040 0.4 A 2 PHE N N 15 113.067 0.4 A 3 ASP H H 1 7.554 0.025 A 3 ASP HA H 1 4.890 0.025 A 3 ASP HBy H 1 2.820 0.025 A 3 ASP HBx H 1 2.690 0.025 A 3 ASP CA C 13 55.030 0.4 A 3 ASP CB C 13 39.460 0.4 A 3 ASP N N 15 118.589 0.4 A 4 SER H H 1 8.250 0.025 A 4 SER HA H 1 4.250 0.025 A 4 SER HBy H 1 3.270 0.025 A 4 SER HBx H 1 2.500 0.025 A 4 SER CA C 13 59.530 0.4 A 4 SER CB C 13 65.300 0.4 A 4 SER N N 15 120.654 0.4 A 5 THR H H 1 8.041 0.025 A 5 THR HA H 1 5.160 0.025 A 5 THR HB H 1 3.970 0.025 A 5 THR HG2% H 1 1.180 0.025 A 5 THR CA C 13 63.480 0.4 A 5 THR CB C 13 69.630 0.4 A 5 THR CG2 C 13 22.060 0.4 A 5 THR N N 15 115.812 0.4 A 6 TRP H H 1 9.514 0.025 A 6 TRP HA H 1 5.240 0.025 A 6 TRP HBy H 1 3.160 0.025 A 6 TRP HBx H 1 2.910 0.025 A 6 TRP HD1 H 1 6.690 0.025 A 6 TRP HE1 H 1 9.787 0.025 A 6 TRP HE3 H 1 7.250 0.025 A 6 TRP HH2 H 1 6.860 0.025 A 6 TRP HZ2 H 1 7.350 0.025 A 6 TRP HZ3 H 1 7.220 0.025 A 6 TRP CA C 13 55.770 0.4 A 6 TRP CB C 13 32.800 0.4 A 6 TRP CD1 C 13 127.280 0.4 A 6 TRP CE3 C 13 119.960 0.4 A 6 TRP CH2 C 13 124.570 0.4 A 6 TRP CZ2 C 13 114.300 0.4 A 6 TRP CZ3 C 13 123.970 0.4 A 6 TRP N N 15 128.256 0.4 A 6 TRP NE1 N 15 126.610 0.4 A 7 LYS H H 1 9.954 0.025 A 7 LYS HA H 1 5.490 0.025 A 7 LYS HBx H 1 1.870 0.025 A 7 LYS HBy H 1 1.870 0.025 A 7 LYS HDx H 1 1.760 0.025 A 7 LYS HDy H 1 1.760 0.025 A 7 LYS HEx H 1 2.980 0.025 A 7 LYS HEy H 1 2.980 0.025 A 7 LYS HGx H 1 1.500 0.025 A 7 LYS HGy H 1 1.500 0.025 A 7 LYS CA C 13 54.680 0.4 A 7 LYS CB C 13 35.840 0.4 A 7 LYS CD C 13 29.450 0.4 A 7 LYS CE C 13 42.280 0.4 A 7 LYS CG C 13 24.730 0.4 A 7 LYS N N 15 122.895 0.4 A 8 VAL H H 1 8.780 0.025 A 8 VAL HA H 1 3.280 0.025 A 8 VAL HB H 1 1.730 0.025 A 8 VAL HGx% H 1 0.880 0.025 A 8 VAL HGy% H 1 0.270 0.025 A 8 VAL CA C 13 64.810 0.4 A 8 VAL CB C 13 31.790 0.4 A 8 VAL CGy C 13 22.470 0.4 A 8 VAL CGx C 13 22.384 0.4 A 8 VAL N N 15 128.078 0.4 A 9 ASP H H 1 9.712 0.025 A 9 ASP HA H 1 4.930 0.025 A 9 ASP HBy H 1 2.560 0.025 A 9 ASP HBx H 1 2.480 0.025 A 9 ASP CA C 13 55.750 0.4 A 9 ASP CB C 13 46.830 0.4 A 9 ASP N N 15 127.565 0.4 A 10 ARG H H 1 7.823 0.025 A 10 ARG HA H 1 4.740 0.025 A 10 ARG HBx H 1 1.860 0.025 A 10 ARG HBy H 1 1.860 0.025 A 10 ARG HDx H 1 3.110 0.025 A 10 ARG HDy H 1 3.110 0.025 A 10 ARG HGy H 1 1.640 0.025 A 10 ARG HGx H 1 1.300 0.025 A 10 ARG CA C 13 55.200 0.4 A 10 ARG CB C 13 31.470 0.4 A 10 ARG CD C 13 43.410 0.4 A 10 ARG CG C 13 26.650 0.4 A 10 ARG N N 15 112.578 0.4 A 11 SER H H 1 8.602 0.025 A 11 SER HA H 1 5.270 0.025 A 11 SER HBy H 1 3.780 0.025 A 11 SER HBx H 1 3.710 0.025 A 11 SER CA C 13 57.490 0.4 A 11 SER CB C 13 66.620 0.4 A 11 SER N N 15 113.123 0.4 A 12 GLU H H 1 9.447 0.025 A 12 GLU HA H 1 4.760 0.025 A 12 GLU HBx H 1 2.030 0.025 A 12 GLU HBy H 1 2.030 0.025 A 12 GLU HGx H 1 2.220 0.025 A 12 GLU HGy H 1 2.220 0.025 A 12 GLU CA C 13 55.420 0.4 A 12 GLU CB C 13 33.060 0.4 A 12 GLU CG C 13 35.570 0.4 A 12 GLU N N 15 121.867 0.4 A 13 ASN H H 1 9.350 0.025 A 13 ASN HA H 1 4.720 0.025 A 13 ASN HBy H 1 3.800 0.025 A 13 ASN HBx H 1 2.790 0.025 A 13 ASN CA C 13 54.200 0.4 A 13 ASN CB C 13 39.870 0.4 A 13 ASN N N 15 121.822 0.4 A 14 TYR H H 1 8.357 0.025 A 14 TYR HA H 1 4.290 0.025 A 14 TYR HBy H 1 3.120 0.025 A 14 TYR HBx H 1 2.870 0.025 A 14 TYR HDy H 1 6.920 0.025 A 14 TYR HDx H 1 6.680 0.025 A 14 TYR HEy H 1 6.490 0.025 A 14 TYR HEx H 1 6.240 0.025 A 14 TYR CA C 13 60.700 0.4 A 14 TYR CB C 13 39.620 0.4 A 14 TYR CDx C 13 131.710 0.4 A 14 TYR CDy C 13 131.710 0.4 A 14 TYR CEx C 13 118.020 0.4 A 14 TYR CEy C 13 118.020 0.4 A 14 TYR N N 15 120.082 0.4 A 15 ASP H H 1 8.562 0.025 A 15 ASP HA H 1 4.060 0.025 A 15 ASP HBx H 1 2.620 0.025 A 15 ASP HBy H 1 2.620 0.025 A 15 ASP CA C 13 58.620 0.4 A 15 ASP CB C 13 41.140 0.4 A 15 ASP N N 15 118.245 0.4 A 16 LYS H H 1 7.801 0.025 A 16 LYS HA H 1 4.050 0.025 A 16 LYS HBx H 1 1.720 0.025 A 16 LYS HBy H 1 1.860 0.025 A 16 LYS HDx H 1 1.750 0.025 A 16 LYS HDy H 1 1.750 0.025 A 16 LYS HEx H 1 3.020 0.025 A 16 LYS HEy H 1 3.020 0.025 A 16 LYS HGy H 1 1.600 0.025 A 16 LYS HGx H 1 1.550 0.025 A 16 LYS CA C 13 58.610 0.4 A 16 LYS CB C 13 31.550 0.4 A 16 LYS CD C 13 28.660 0.4 A 16 LYS CE C 13 42.210 0.4 A 16 LYS CG C 13 25.350 0.4 A 16 LYS N N 15 118.806 0.4 A 17 PHE H H 1 7.543 0.025 A 17 PHE HA H 1 4.020 0.025 A 17 PHE HBx H 1 3.040 0.025 A 17 PHE HBy H 1 3.040 0.025 A 17 PHE HDx H 1 7.130 0.025 A 17 PHE HDy H 1 7.390 0.025 A 17 PHE HEx H 1 6.970 0.025 A 17 PHE HEy H 1 7.230 0.025 A 17 PHE CA C 13 61.620 0.4 A 17 PHE CB C 13 40.250 0.4 A 17 PHE CDx C 13 131.390 0.4 A 17 PHE CDy C 13 131.390 0.4 A 17 PHE CEx C 13 129.540 0.4 A 17 PHE CEy C 13 129.540 0.4 A 17 PHE N N 15 120.733 0.4 A 18 MET H H 1 8.063 0.025 A 18 MET HA H 1 3.210 0.025 A 18 MET HBx H 1 1.190 0.025 A 18 MET HBy H 1 1.190 0.025 A 18 MET HE% H 1 1.526 0.025 A 18 MET HGx H 1 1.460 0.025 A 18 MET HGy H 1 2.010 0.025 A 18 MET CA C 13 59.860 0.4 A 18 MET CB C 13 34.110 0.4 A 18 MET CE C 13 17.565 0.4 A 18 MET CG C 13 32.760 0.4 A 18 MET N N 15 117.590 0.4 A 19 GLU H H 1 8.430 0.025 A 19 GLU HA H 1 3.830 0.025 A 19 GLU HBy H 1 2.200 0.025 A 19 GLU HBx H 1 1.760 0.025 A 19 GLU HGy H 1 2.200 0.025 A 19 GLU HGx H 1 2.070 0.025 A 19 GLU CA C 13 60.040 0.4 A 19 GLU CB C 13 29.790 0.4 A 19 GLU CG C 13 35.870 0.4 A 19 GLU N N 15 120.480 0.4 A 20 LYS H H 1 8.080 0.025 A 20 LYS HA H 1 4.070 0.025 A 20 LYS HBy H 1 2.090 0.025 A 20 LYS HBx H 1 1.990 0.025 A 20 LYS HDy H 1 1.920 0.025 A 20 LYS HDx H 1 1.680 0.025 A 20 LYS HEy H 1 3.160 0.025 A 20 LYS HEx H 1 3.050 0.025 A 20 LYS HGy H 1 1.700 0.025 A 20 LYS HGx H 1 1.550 0.025 A 20 LYS CA C 13 57.400 0.4 A 20 LYS CB C 13 31.940 0.4 A 20 LYS CD C 13 28.340 0.4 A 20 LYS CE C 13 42.450 0.4 A 20 LYS CG C 13 23.920 0.4 A 20 LYS N N 15 122.631 0.4 A 21 MET H H 1 7.554 0.025 A 21 MET HA H 1 3.810 0.025 A 21 MET HBx H 1 1.086 0.025 A 21 MET HBy H 1 1.086 0.025 A 21 MET HE% H 1 1.475 0.025 A 21 MET HGx H 1 1.300 0.025 A 21 MET HGy H 1 1.300 0.025 A 21 MET CA C 13 56.310 0.4 A 21 MET CB C 13 32.729 0.4 A 21 MET CE C 13 16.748 0.4 A 21 MET CG C 13 33.760 0.4 A 21 MET N N 15 114.794 0.4 A 22 GLY H H 1 7.718 0.025 A 22 GLY HAx H 1 3.650 0.025 A 22 GLY HAy H 1 4.200 0.025 A 22 GLY CA C 13 45.310 0.4 A 22 GLY N N 15 107.423 0.4 A 23 VAL H H 1 7.491 0.025 A 23 VAL HA H 1 3.770 0.025 A 23 VAL HB H 1 1.340 0.025 A 23 VAL HGx% H 1 0.810 0.025 A 23 VAL HGy% H 1 0.530 0.025 A 23 VAL CA C 13 62.650 0.4 A 23 VAL CB C 13 32.060 0.4 A 23 VAL CGy C 13 22.030 0.4 A 23 VAL CGx C 13 21.660 0.4 A 23 VAL N N 15 121.380 0.4 A 24 ASN H H 1 8.780 0.025 A 24 ASN HA H 1 4.430 0.025 A 24 ASN HBy H 1 3.180 0.025 A 24 ASN HBx H 1 2.720 0.025 A 24 ASN CA C 13 54.090 0.4 A 24 ASN CB C 13 39.330 0.4 A 24 ASN N N 15 127.861 0.4 A 25 ILE H H 1 8.494 0.025 A 25 ILE HA H 1 3.660 0.025 A 25 ILE HB H 1 1.800 0.025 A 25 ILE HD1% H 1 0.880 0.025 A 25 ILE HG1y H 1 1.480 0.025 A 25 ILE HG1x H 1 1.160 0.025 A 25 ILE HG2% H 1 0.960 0.025 A 25 ILE CA C 13 65.350 0.4 A 25 ILE CB C 13 38.910 0.4 A 25 ILE CD1 C 13 13.980 0.4 A 25 ILE CG1 C 13 29.410 0.4 A 25 ILE CG2 C 13 16.920 0.4 A 25 ILE N N 15 121.002 0.4 A 26 VAL H H 1 7.569 0.025 A 26 VAL HA H 1 3.680 0.025 A 26 VAL HB H 1 2.070 0.025 A 26 VAL HGx% H 1 1.000 0.025 A 26 VAL HGy% H 1 0.920 0.025 A 26 VAL CA C 13 66.080 0.4 A 26 VAL CB C 13 31.930 0.4 A 26 VAL CGy C 13 21.740 0.4 A 26 VAL CGx C 13 21.380 0.4 A 26 VAL N N 15 121.014 0.4 A 27 LYS H H 1 7.729 0.025 A 27 LYS HA H 1 4.140 0.025 A 27 LYS CA C 13 58.240 0.4 A 27 LYS CB C 13 32.610 0.4 A 27 LYS CD C 13 28.750 0.4 A 27 LYS N N 15 118.674 0.4 A 28 ARG H H 1 8.418 0.025 A 28 ARG HA H 1 3.740 0.025 A 28 ARG HBx H 1 1.670 0.025 A 28 ARG HBy H 1 1.880 0.025 A 28 ARG HDx H 1 2.880 0.025 A 28 ARG HDy H 1 3.140 0.025 A 28 ARG HGx H 1 1.190 0.025 A 28 ARG HGy H 1 1.190 0.025 A 28 ARG CA C 13 60.040 0.4 A 28 ARG CB C 13 30.760 0.4 A 28 ARG CD C 13 44.820 0.4 A 28 ARG N N 15 119.667 0.4 A 29 LYS H H 1 7.611 0.025 A 29 LYS HA H 1 4.040 0.025 A 29 LYS HBx H 1 1.890 0.025 A 29 LYS HBy H 1 1.890 0.025 A 29 LYS HDx H 1 1.660 0.025 A 29 LYS HDy H 1 1.660 0.025 A 29 LYS HEx H 1 2.930 0.025 A 29 LYS HEy H 1 2.930 0.025 A 29 LYS HGy H 1 1.620 0.025 A 29 LYS HGx H 1 1.430 0.025 A 29 LYS CA C 13 59.460 0.4 A 29 LYS CB C 13 32.440 0.4 A 29 LYS CD C 13 29.540 0.4 A 29 LYS CE C 13 42.310 0.4 A 29 LYS CG C 13 25.500 0.4 A 29 LYS N N 15 118.502 0.4 A 30 LEU H H 1 7.292 0.025 A 30 LEU HA H 1 4.170 0.025 A 30 LEU HBy H 1 1.750 0.025 A 30 LEU HBx H 1 1.590 0.025 A 30 LEU HDx% H 1 0.890 0.025 A 30 LEU HDy% H 1 0.800 0.025 A 30 LEU HG H 1 1.630 0.025 A 30 LEU CA C 13 57.560 0.4 A 30 LEU CB C 13 42.320 0.4 A 30 LEU CDy C 13 24.930 0.4 A 30 LEU CDx C 13 24.050 0.4 A 30 LEU CG C 13 27.410 0.4 A 30 LEU N N 15 119.200 0.4 A 31 ALA H H 1 8.257 0.025 A 31 ALA HA H 1 4.080 0.025 A 31 ALA HB% H 1 1.170 0.025 A 31 ALA CA C 13 54.370 0.4 A 31 ALA CB C 13 19.300 0.4 A 31 ALA N N 15 120.380 0.4 A 32 ALA H H 1 7.320 0.025 A 32 ALA HA H 1 4.130 0.025 A 32 ALA HB% H 1 1.360 0.025 A 32 ALA CA C 13 54.060 0.4 A 32 ALA CB C 13 18.710 0.4 A 32 ALA N N 15 117.152 0.4 A 33 HIS H H 1 7.675 0.025 A 33 HIS HA H 1 5.000 0.025 A 33 HIS HBy H 1 3.440 0.025 A 33 HIS HBx H 1 3.060 0.025 A 33 HIS HD2 H 1 7.240 0.025 A 33 HIS CA C 13 54.200 0.4 A 33 HIS CB C 13 28.310 0.4 A 33 HIS CD2 C 13 120.550 0.4 A 33 HIS N N 15 115.869 0.4 A 34 ASP H H 1 7.430 0.025 A 34 ASP HA H 1 4.200 0.025 A 34 ASP CA C 13 54.450 0.4 A 34 ASP CB C 13 40.740 0.4 A 34 ASP N N 15 117.892 0.4 A 35 ASN H H 1 9.086 0.025 A 35 ASN HA H 1 4.310 0.025 A 35 ASN HBy H 1 3.000 0.025 A 35 ASN HBx H 1 2.720 0.025 A 35 ASN CA C 13 53.650 0.4 A 35 ASN CB C 13 37.760 0.4 A 35 ASN N N 15 118.996 0.4 A 36 LEU H H 1 6.914 0.025 A 36 LEU CA C 13 57.330 0.4 A 36 LEU CB C 13 42.810 0.4 A 36 LEU N N 15 118.708 0.4 A 37 LYS H H 1 9.246 0.025 A 37 LYS HA H 1 5.650 0.025 A 37 LYS HBx H 1 1.850 0.025 A 37 LYS HBy H 1 1.850 0.025 A 37 LYS HDx H 1 1.660 0.025 A 37 LYS HDy H 1 1.660 0.025 A 37 LYS HEx H 1 2.930 0.025 A 37 LYS HEy H 1 2.930 0.025 A 37 LYS HGx H 1 1.630 0.025 A 37 LYS HGy H 1 1.630 0.025 A 37 LYS CA C 13 55.170 0.4 A 37 LYS CB C 13 36.200 0.4 A 37 LYS CD C 13 29.800 0.4 A 37 LYS CE C 13 41.870 0.4 A 37 LYS CG C 13 25.290 0.4 A 37 LYS N N 15 126.148 0.4 A 38 LEU H H 1 9.324 0.025 A 38 LEU HA H 1 5.550 0.025 A 38 LEU HBy H 1 1.590 0.025 A 38 LEU HBx H 1 1.170 0.025 A 38 LEU HDx% H 1 0.800 0.025 A 38 LEU HDy% H 1 0.330 0.025 A 38 LEU HG H 1 1.490 0.025 A 38 LEU CA C 13 52.870 0.4 A 38 LEU CB C 13 46.720 0.4 A 38 LEU CDx C 13 24.210 0.4 A 38 LEU CDy C 13 25.860 0.4 A 38 LEU CG C 13 25.660 0.4 A 38 LEU N N 15 122.300 0.4 A 39 THR H H 1 9.191 0.025 A 39 THR HA H 1 5.280 0.025 A 39 THR HB H 1 4.040 0.025 A 39 THR HG2% H 1 1.170 0.025 A 39 THR CA C 13 62.950 0.4 A 39 THR CB C 13 70.590 0.4 A 39 THR CG2 C 13 21.220 0.4 A 39 THR N N 15 120.586 0.4 A 40 ILE H H 1 8.531 0.025 A 40 ILE HA H 1 4.860 0.025 A 40 ILE HB H 1 2.390 0.025 A 40 ILE HD1% H 1 0.610 0.025 A 40 ILE HG1x H 1 1.710 0.025 A 40 ILE HG1y H 1 1.710 0.025 A 40 ILE HG2% H 1 0.820 0.025 A 40 ILE CA C 13 61.570 0.4 A 40 ILE CB C 13 40.060 0.4 A 40 ILE CD1 C 13 12.160 0.4 A 40 ILE CG1 C 13 28.140 0.4 A 40 ILE CG2 C 13 17.140 0.4 A 40 ILE N N 15 128.371 0.4 A 41 THR H H 1 8.624 0.025 A 41 THR HA H 1 4.510 0.025 A 41 THR HB H 1 3.850 0.025 A 41 THR HG2% H 1 1.060 0.025 A 41 THR CA C 13 60.930 0.4 A 41 THR CB C 13 71.450 0.4 A 41 THR CG2 C 13 21.780 0.4 A 41 THR N N 15 120.285 0.4 A 42 GLN H H 1 9.050 0.025 A 42 GLN CA C 13 54.400 0.4 A 42 GLN CB C 13 30.560 0.4 A 42 GLN CG C 13 32.600 0.4 A 42 GLN N N 15 126.369 0.4 A 43 GLU H H 1 8.807 0.025 A 43 GLU HA H 1 4.400 0.025 A 43 GLU HBx H 1 1.720 0.025 A 43 GLU HBy H 1 1.850 0.025 A 43 GLU HGx H 1 2.010 0.025 A 43 GLU HGy H 1 2.010 0.025 A 43 GLU CA C 13 55.020 0.4 A 43 GLU CB C 13 31.630 0.4 A 43 GLU CG C 13 36.230 0.4 A 43 GLU N N 15 128.036 0.4 A 44 GLY H H 1 9.060 0.025 A 44 GLY HAx H 1 3.560 0.025 A 44 GLY HAy H 1 3.920 0.025 A 44 GLY CA C 13 47.460 0.4 A 44 GLY N N 15 117.000 0.4 A 45 ASN H H 1 8.769 0.025 A 45 ASN HA H 1 4.830 0.025 A 45 ASN HBy H 1 3.140 0.025 A 45 ASN HBx H 1 2.930 0.025 A 45 ASN CA C 13 53.040 0.4 A 45 ASN CB C 13 39.050 0.4 A 45 ASN N N 15 124.910 0.4 A 46 LYS H H 1 7.873 0.025 A 46 LYS HA H 1 4.890 0.025 A 46 LYS HBy H 1 1.860 0.025 A 46 LYS HBx H 1 1.700 0.025 A 46 LYS HDx H 1 1.560 0.025 A 46 LYS HDy H 1 1.560 0.025 A 46 LYS HEx H 1 2.810 0.025 A 46 LYS HEy H 1 2.810 0.025 A 46 LYS HGy H 1 1.280 0.025 A 46 LYS HGx H 1 1.100 0.025 A 46 LYS CA C 13 55.760 0.4 A 46 LYS CB C 13 34.610 0.4 A 46 LYS CD C 13 29.600 0.4 A 46 LYS CE C 13 42.150 0.4 A 46 LYS CG C 13 25.160 0.4 A 46 LYS N N 15 120.293 0.4 A 47 PHE H H 1 9.130 0.025 A 47 PHE HA H 1 4.700 0.025 A 47 PHE HBy H 1 1.570 0.025 A 47 PHE HBx H 1 1.110 0.025 A 47 PHE HDy H 1 6.730 0.025 A 47 PHE HDx H 1 6.460 0.025 A 47 PHE HEy H 1 7.040 0.025 A 47 PHE HEx H 1 6.790 0.025 A 47 PHE CA C 13 56.450 0.4 A 47 PHE CB C 13 43.050 0.4 A 47 PHE CDx C 13 130.820 0.4 A 47 PHE CDy C 13 130.820 0.4 A 47 PHE CEx C 13 130.600 0.4 A 47 PHE CEy C 13 130.600 0.4 A 47 PHE N N 15 127.531 0.4 A 48 THR H H 1 8.318 0.025 A 48 THR HA H 1 4.770 0.025 A 48 THR HB H 1 3.860 0.025 A 48 THR HG2% H 1 1.030 0.025 A 48 THR CA C 13 62.090 0.4 A 48 THR CB C 13 70.280 0.4 A 48 THR CG2 C 13 20.590 0.4 A 48 THR N N 15 115.162 0.4 A 49 VAL H H 1 9.580 0.025 A 49 VAL HA H 1 4.840 0.025 A 49 VAL HB H 1 2.140 0.025 A 49 VAL HGy% H 1 0.840 0.025 A 49 VAL CA C 13 61.110 0.4 A 49 VAL CB C 13 34.330 0.4 A 49 VAL CGx C 13 20.790 0.4 A 49 VAL CGy C 13 20.820 0.4 A 49 VAL N N 15 127.272 0.4 A 50 LYS H H 1 9.175 0.025 A 50 LYS HA H 1 4.993 0.025 A 50 LYS HBx H 1 1.800 0.025 A 50 LYS HBy H 1 1.990 0.025 A 50 LYS HDx H 1 1.630 0.025 A 50 LYS HDy H 1 1.630 0.025 A 50 LYS HEx H 1 2.930 0.025 A 50 LYS HEy H 1 2.930 0.025 A 50 LYS HGx H 1 1.320 0.025 A 50 LYS HGy H 1 1.460 0.025 A 50 LYS CA C 13 55.500 0.4 A 50 LYS CB C 13 33.320 0.4 A 50 LYS CD C 13 29.490 0.4 A 50 LYS CG C 13 24.960 0.4 A 50 LYS N N 15 127.439 0.4 A 51 GLU H H 1 9.173 0.025 A 51 GLU HA H 1 5.090 0.025 A 51 GLU HBx H 1 2.040 0.025 A 51 GLU HBy H 1 2.040 0.025 A 51 GLU HGx H 1 2.340 0.025 A 51 GLU HGy H 1 2.340 0.025 A 51 GLU CA C 13 55.160 0.4 A 51 GLU CB C 13 31.450 0.4 A 51 GLU CG C 13 36.150 0.4 A 51 GLU N N 15 128.140 0.4 A 52 SER H H 1 9.015 0.025 A 52 SER CA C 13 56.630 0.4 A 52 SER CB C 13 65.290 0.4 A 52 SER N N 15 120.997 0.4 A 53 SER H H 1 9.013 0.025 A 53 SER CA C 13 56.780 0.4 A 53 SER CB C 13 68.320 0.4 A 53 SER N N 15 117.567 0.4 A 54 ALA H H 1 9.009 0.025 A 54 ALA HA H 1 4.030 0.025 A 54 ALA HB% H 1 0.880 0.025 A 54 ALA CA C 13 54.030 0.4 A 54 ALA CB C 13 18.380 0.4 A 54 ALA N N 15 119.830 0.4 A 55 PHE H H 1 8.050 0.025 A 55 PHE N N 15 112.640 0.4 A 57 ASN H H 1 8.487 0.025 A 57 ASN HA H 1 5.840 0.025 A 57 ASN HBx H 1 2.770 0.025 A 57 ASN HBy H 1 2.770 0.025 A 57 ASN CA C 13 53.190 0.4 A 57 ASN CB C 13 40.990 0.4 A 57 ASN N N 15 119.170 0.4 A 58 ILE H H 1 8.803 0.025 A 58 ILE HA H 1 4.860 0.025 A 58 ILE HB H 1 1.930 0.025 A 58 ILE HD1% H 1 0.880 0.025 A 58 ILE HG1x H 1 1.520 0.025 A 58 ILE HG1y H 1 1.520 0.025 A 58 ILE HG2% H 1 0.920 0.025 A 58 ILE CA C 13 60.150 0.4 A 58 ILE CB C 13 43.590 0.4 A 58 ILE CD1 C 13 14.130 0.4 A 58 ILE CG1 C 13 27.700 0.4 A 58 ILE CG2 C 13 18.050 0.4 A 58 ILE N N 15 117.653 0.4 A 59 GLU H H 1 8.519 0.025 A 59 GLU HA H 1 5.260 0.025 A 59 GLU HBx H 1 1.960 0.025 A 59 GLU HBy H 1 1.960 0.025 A 59 GLU HGx H 1 2.010 0.025 A 59 GLU HGy H 1 2.010 0.025 A 59 GLU CA C 13 60.170 0.4 A 59 GLU CB C 13 32.900 0.4 A 59 GLU CG C 13 37.290 0.4 A 59 GLU N N 15 123.376 0.4 A 60 VAL H H 1 9.227 0.025 A 60 VAL HA H 1 4.460 0.025 A 60 VAL HB H 1 2.260 0.025 A 60 VAL HGx% H 1 1.210 0.025 A 60 VAL HGy% H 1 1.210 0.025 A 60 VAL CA C 13 61.730 0.4 A 60 VAL CB C 13 35.030 0.4 A 60 VAL CGy C 13 21.580 0.4 A 60 VAL CGx C 13 21.510 0.4 A 60 VAL N N 15 127.157 0.4 A 61 VAL H H 1 8.179 0.025 A 61 VAL HA H 1 5.160 0.025 A 61 VAL HB H 1 1.890 0.025 A 61 VAL HGx% H 1 0.940 0.025 A 61 VAL HGy% H 1 0.830 0.025 A 61 VAL CA C 13 60.350 0.4 A 61 VAL CB C 13 34.600 0.4 A 61 VAL CGy C 13 21.360 0.4 A 61 VAL CGx C 13 21.170 0.4 A 61 VAL N N 15 125.109 0.4 A 62 PHE H H 1 8.432 0.025 A 62 PHE HA H 1 4.840 0.025 A 62 PHE HBx H 1 2.790 0.025 A 62 PHE HBy H 1 2.790 0.025 A 62 PHE HDx H 1 6.390 0.025 A 62 PHE HDy H 1 6.650 0.025 A 62 PHE HEx H 1 6.300 0.025 A 62 PHE HEy H 1 6.560 0.025 A 62 PHE CA C 13 55.320 0.4 A 62 PHE CB C 13 41.060 0.4 A 62 PHE CDx C 13 132.230 0.4 A 62 PHE CDy C 13 132.230 0.4 A 62 PHE N N 15 121.713 0.4 A 63 GLU H H 1 9.386 0.025 A 63 GLU HA H 1 5.330 0.025 A 63 GLU HBy H 1 1.970 0.025 A 63 GLU HBx H 1 1.860 0.025 A 63 GLU HGx H 1 2.230 0.025 A 63 GLU HGy H 1 2.230 0.025 A 63 GLU CA C 13 53.700 0.4 A 63 GLU CB C 13 32.720 0.4 A 63 GLU CG C 13 36.570 0.4 A 63 GLU N N 15 119.775 0.4 A 64 LEU H H 1 8.834 0.025 A 64 LEU HA H 1 4.530 0.025 A 64 LEU HBy H 1 2.020 0.025 A 64 LEU HBx H 1 1.750 0.025 A 64 LEU HDx% H 1 1.180 0.025 A 64 LEU HDy% H 1 0.740 0.025 A 64 LEU HG H 1 2.160 0.025 A 64 LEU CA C 13 56.770 0.4 A 64 LEU CB C 13 41.390 0.4 A 64 LEU CDy C 13 27.060 0.4 A 64 LEU CDx C 13 23.060 0.4 A 64 LEU CG C 13 26.850 0.4 A 64 LEU N N 15 124.568 0.4 A 65 GLY H H 1 9.299 0.025 A 65 GLY HAx H 1 3.690 0.025 A 65 GLY HAy H 1 4.290 0.025 A 65 GLY CA C 13 46.210 0.4 A 65 GLY N N 15 108.336 0.4 A 66 VAL H H 1 7.905 0.025 A 66 VAL HA H 1 4.380 0.025 A 66 VAL HB H 1 2.380 0.025 A 66 VAL HGx% H 1 0.940 0.025 A 66 VAL HGy% H 1 0.940 0.025 A 66 VAL CA C 13 62.660 0.4 A 66 VAL CB C 13 32.900 0.4 A 66 VAL CGx C 13 20.930 0.4 A 66 VAL CGy C 13 21.650 0.4 A 66 VAL N N 15 121.972 0.4 A 67 THR H H 1 8.784 0.025 A 67 THR HA H 1 4.390 0.025 A 67 THR HB H 1 3.920 0.025 A 67 THR HG2% H 1 1.140 0.025 A 67 THR CA C 13 64.580 0.4 A 67 THR CB C 13 69.140 0.4 A 67 THR CG2 C 13 22.490 0.4 A 67 THR N N 15 129.168 0.4 A 68 PHE H H 1 9.687 0.025 A 68 PHE HA H 1 5.120 0.025 A 68 PHE HBy H 1 3.540 0.025 A 68 PHE HBx H 1 3.430 0.025 A 68 PHE HDx H 1 7.570 0.025 A 68 PHE HDy H 1 7.840 0.025 A 68 PHE HEx H 1 7.020 0.025 A 68 PHE HEy H 1 7.280 0.025 A 68 PHE CA C 13 56.240 0.4 A 68 PHE CB C 13 41.980 0.4 A 68 PHE CDx C 13 133.750 0.4 A 68 PHE CDy C 13 133.750 0.4 A 68 PHE CEx C 13 130.520 0.4 A 68 PHE CEy C 13 130.520 0.4 A 68 PHE N N 15 126.387 0.4 A 69 ASN H H 1 8.370 0.025 A 69 ASN HA H 1 5.340 0.025 A 69 ASN HBx H 1 2.280 0.025 A 69 ASN HBy H 1 2.280 0.025 A 69 ASN CA C 13 51.630 0.4 A 69 ASN CB C 13 40.640 0.4 A 69 ASN N N 15 116.298 0.4 A 70 TYR H H 1 8.655 0.025 A 70 TYR N N 15 120.913 0.4 A 73 ALA HA H 1 3.760 0.025 A 73 ALA HB% H 1 1.130 0.025 A 73 ALA CA C 13 53.600 0.4 A 73 ALA CB C 13 17.960 0.4 A 74 ASP H H 1 8.575 0.025 A 74 ASP CA C 13 52.960 0.4 A 74 ASP CB C 13 39.210 0.4 A 74 ASP N N 15 113.641 0.4 A 75 GLY H H 1 7.745 0.025 A 75 GLY HAx H 1 3.440 0.025 A 75 GLY HAy H 1 4.290 0.025 A 75 GLY CA C 13 44.800 0.4 A 75 GLY N N 15 107.874 0.4 A 76 THR H H 1 7.724 0.025 A 76 THR HB H 1 3.700 0.025 A 76 THR HG2% H 1 0.920 0.025 A 76 THR CA C 13 64.980 0.4 A 76 THR CB C 13 68.240 0.4 A 76 THR CG2 C 13 20.840 0.4 A 76 THR N N 15 119.192 0.4 A 77 GLU H H 1 8.468 0.025 A 77 GLU CA C 13 56.450 0.4 A 77 GLU CB C 13 31.500 0.4 A 77 GLU CG C 13 37.030 0.4 A 77 GLU N N 15 128.678 0.4 A 78 LEU H H 1 8.875 0.025 A 78 LEU HA H 1 5.130 0.025 A 78 LEU HBx H 1 1.000 0.025 A 78 LEU HBy H 1 1.000 0.025 A 78 LEU HDx% H 1 0.230 0.025 A 78 LEU HDy% H 1 0.500 0.025 A 78 LEU HG H 1 1.330 0.025 A 78 LEU CA C 13 53.230 0.4 A 78 LEU CB C 13 45.400 0.4 A 78 LEU CDy C 13 25.820 0.4 A 78 LEU CDx C 13 25.150 0.4 A 78 LEU CG C 13 27.750 0.4 A 78 LEU N N 15 124.431 0.4 A 79 ARG HA H 1 5.390 0.025 A 79 ARG HBx H 1 1.510 0.025 A 79 ARG HBy H 1 1.510 0.025 A 79 ARG HDy H 1 3.140 0.025 A 79 ARG HDx H 1 3.050 0.025 A 79 ARG HGx H 1 1.220 0.025 A 79 ARG HGy H 1 1.220 0.025 A 79 ARG CA C 13 54.560 0.4 A 79 ARG CB C 13 33.860 0.4 A 79 ARG CD C 13 43.740 0.4 A 79 ARG CG C 13 27.850 0.4 A 80 GLY H H 1 9.026 0.025 A 80 GLY HAx H 1 3.920 0.025 A 80 GLY HAy H 1 4.380 0.025 A 80 GLY CA C 13 46.730 0.4 A 80 GLY N N 15 115.450 0.4 A 81 THR H H 1 6.937 0.025 A 81 THR HA H 1 4.680 0.025 A 81 THR HB H 1 3.760 0.025 A 81 THR HG2% H 1 0.930 0.025 A 81 THR CA C 13 59.010 0.4 A 81 THR CB C 13 73.140 0.4 A 81 THR CG2 C 13 21.680 0.4 A 81 THR N N 15 106.379 0.4 A 82 TRP H H 1 9.126 0.025 A 82 TRP HA H 1 5.350 0.025 A 82 TRP HE3 H 1 7.140 0.025 A 82 TRP HH2 H 1 6.460 0.025 A 82 TRP HZ2 H 1 6.750 0.025 A 82 TRP HZ3 H 1 6.640 0.025 A 82 TRP CA C 13 56.400 0.4 A 82 TRP CB C 13 33.630 0.4 A 82 TRP CE3 C 13 120.890 0.4 A 82 TRP CH2 C 13 122.230 0.4 A 82 TRP CZ2 C 13 113.600 0.4 A 82 TRP CZ3 C 13 120.830 0.4 A 82 TRP N N 15 120.025 0.4 A 83 SER H H 1 9.045 0.025 A 83 SER HA H 1 5.490 0.025 A 83 SER HBy H 1 3.910 0.025 A 83 SER HBx H 1 3.860 0.025 A 83 SER CA C 13 57.080 0.4 A 83 SER CB C 13 65.680 0.4 A 83 SER N N 15 115.180 0.4 A 84 LEU H H 1 8.889 0.025 A 84 LEU HA H 1 5.200 0.025 A 84 LEU HBy H 1 1.870 0.025 A 84 LEU HBx H 1 1.370 0.025 A 84 LEU HDx% H 1 0.960 0.025 A 84 LEU HDy% H 1 0.880 0.025 A 84 LEU HG H 1 1.520 0.025 A 84 LEU CA C 13 54.600 0.4 A 84 LEU CB C 13 45.130 0.4 A 84 LEU CDy C 13 26.070 0.4 A 84 LEU CDx C 13 24.340 0.4 A 84 LEU CG C 13 27.210 0.4 A 84 LEU N N 15 125.420 0.4 A 85 GLU H H 1 8.964 0.025 A 85 GLU HA H 1 4.610 0.025 A 85 GLU HBy H 1 1.970 0.025 A 85 GLU HBx H 1 1.840 0.025 A 85 GLU HGx H 1 2.140 0.025 A 85 GLU HGy H 1 2.140 0.025 A 85 GLU CA C 13 55.310 0.4 A 85 GLU CB C 13 31.470 0.4 A 85 GLU CG C 13 35.970 0.4 A 85 GLU N N 15 127.397 0.4 A 86 GLY H H 1 9.039 0.025 A 86 GLY HAx H 1 3.680 0.025 A 86 GLY HAy H 1 3.990 0.025 A 86 GLY CA C 13 47.580 0.4 A 86 GLY N N 15 117.395 0.4 A 87 ASN H H 1 8.765 0.025 A 87 ASN HA H 1 4.820 0.025 A 87 ASN HBy H 1 2.980 0.025 A 87 ASN HBx H 1 2.880 0.025 A 87 ASN CA C 13 53.170 0.4 A 87 ASN CB C 13 38.800 0.4 A 87 ASN N N 15 122.457 0.4 A 88 LYS H H 1 7.986 0.025 A 88 LYS HA H 1 4.960 0.025 A 88 LYS HBx H 1 1.930 0.025 A 88 LYS HBy H 1 1.930 0.025 A 88 LYS HDx H 1 1.950 0.025 A 88 LYS HDy H 1 1.950 0.025 A 88 LYS HEx H 1 2.960 0.025 A 88 LYS HEy H 1 2.960 0.025 A 88 LYS HGx H 1 1.630 0.025 A 88 LYS HGy H 1 1.630 0.025 A 88 LYS CA C 13 56.000 0.4 A 88 LYS CB C 13 35.580 0.4 A 88 LYS CD C 13 29.810 0.4 A 88 LYS CE C 13 41.910 0.4 A 88 LYS CG C 13 24.770 0.4 A 88 LYS N N 15 117.971 0.4 A 89 LEU H H 1 8.622 0.025 A 89 LEU HA H 1 5.010 0.025 A 89 LEU HBy H 1 1.110 0.025 A 89 LEU HBx H 1 0.950 0.025 A 89 LEU HDx% H 1 -0.512 0.025 A 89 LEU HDy% H 1 -0.129 0.025 A 89 LEU HG H 1 0.950 0.025 A 89 LEU CA C 13 53.450 0.4 A 89 LEU CB C 13 43.856 0.4 A 89 LEU CDx C 13 23.731 0.4 A 89 LEU CDy C 13 23.931 0.4 A 89 LEU CG C 13 26.970 0.4 A 89 LEU N N 15 122.876 0.4 A 90 ILE H H 1 9.589 0.025 A 90 ILE HA H 1 4.600 0.025 A 90 ILE HB H 1 1.960 0.025 A 90 ILE HD1% H 1 0.820 0.025 A 90 ILE HG1y H 1 1.460 0.025 A 90 ILE HG1x H 1 1.340 0.025 A 90 ILE HG2% H 1 0.820 0.025 A 90 ILE CA C 13 60.250 0.4 A 90 ILE CB C 13 38.760 0.4 A 90 ILE CD1 C 13 12.580 0.4 A 90 ILE CG1 C 13 27.290 0.4 A 90 ILE CG2 C 13 17.650 0.4 A 90 ILE N N 15 124.780 0.4 A 91 GLY H H 1 9.620 0.025 A 91 GLY HAx H 1 2.090 0.025 A 91 GLY HAy H 1 4.460 0.025 A 91 GLY CA C 13 44.680 0.4 A 91 GLY N N 15 121.700 0.4 A 92 LYS H H 1 7.730 0.025 A 92 LYS HA H 1 4.710 0.025 A 92 LYS HBy H 1 1.520 0.025 A 92 LYS HBx H 1 1.400 0.025 A 92 LYS HDx H 1 1.530 0.025 A 92 LYS HDy H 1 1.530 0.025 A 92 LYS HEx H 1 2.830 0.025 A 92 LYS HEy H 1 2.830 0.025 A 92 LYS HGx H 1 1.180 0.025 A 92 LYS HGy H 1 1.180 0.025 A 92 LYS CA C 13 55.450 0.4 A 92 LYS CB C 13 33.530 0.4 A 92 LYS CD C 13 29.190 0.4 A 92 LYS CE C 13 42.060 0.4 A 92 LYS CG C 13 24.310 0.4 A 92 LYS N N 15 127.600 0.4 A 93 PHE H H 1 8.443 0.025 A 93 PHE HA H 1 5.200 0.025 A 93 PHE HBy H 1 2.910 0.025 A 93 PHE HBx H 1 2.660 0.025 A 93 PHE HDx H 1 6.310 0.025 A 93 PHE HDy H 1 6.570 0.025 A 93 PHE HEx H 1 5.740 0.025 A 93 PHE HEy H 1 6.000 0.025 A 93 PHE CA C 13 55.960 0.4 A 93 PHE CB C 13 44.350 0.4 A 93 PHE CDx C 13 130.660 0.4 A 93 PHE CDy C 13 130.660 0.4 A 93 PHE CEx C 13 130.570 0.4 A 93 PHE CEy C 13 130.570 0.4 A 93 PHE N N 15 122.003 0.4 A 94 LYS H H 1 8.803 0.025 A 94 LYS HA H 1 5.050 0.025 A 94 LYS HBx H 1 1.570 0.025 A 94 LYS HBy H 1 1.570 0.025 A 94 LYS HDx H 1 1.630 0.025 A 94 LYS HDy H 1 1.630 0.025 A 94 LYS HEx H 1 2.950 0.025 A 94 LYS HEy H 1 2.950 0.025 A 94 LYS HGy H 1 1.340 0.025 A 94 LYS HGx H 1 1.280 0.025 A 94 LYS CA C 13 55.150 0.4 A 94 LYS CB C 13 36.180 0.4 A 94 LYS CD C 13 30.060 0.4 A 94 LYS CE C 13 42.310 0.4 A 94 LYS CG C 13 24.980 0.4 A 94 LYS N N 15 119.319 0.4 A 95 ARG H H 1 8.738 0.025 A 95 ARG HA H 1 4.760 0.025 A 95 ARG HBx H 1 2.080 0.025 A 95 ARG HBy H 1 2.080 0.025 A 95 ARG HDx H 1 3.620 0.025 A 95 ARG HDy H 1 3.620 0.025 A 95 ARG HGx H 1 1.310 0.025 A 95 ARG HGy H 1 1.770 0.025 A 95 ARG CA C 13 56.030 0.4 A 95 ARG CB C 13 31.720 0.4 A 95 ARG CD C 13 44.530 0.4 A 95 ARG CG C 13 28.430 0.4 A 95 ARG N N 15 122.142 0.4 A 96 THR H H 1 8.520 0.025 A 96 THR HA H 1 4.060 0.025 A 96 THR HB H 1 4.300 0.025 A 96 THR HG2% H 1 1.110 0.025 A 96 THR CA C 13 64.140 0.4 A 96 THR CB C 13 68.570 0.4 A 96 THR CG2 C 13 22.570 0.4 A 96 THR N N 15 117.210 0.4 A 97 ASP H H 1 8.932 0.025 A 97 ASP HA H 1 4.330 0.025 A 97 ASP HBy H 1 2.880 0.025 A 97 ASP HBx H 1 2.720 0.025 A 97 ASP CA C 13 56.200 0.4 A 97 ASP CB C 13 38.860 0.4 A 97 ASP N N 15 120.647 0.4 A 98 ASN H H 1 8.614 0.025 A 98 ASN HA H 1 4.750 0.025 A 98 ASN HBy H 1 3.130 0.025 A 98 ASN HBx H 1 2.620 0.025 A 98 ASN CA C 13 51.640 0.4 A 98 ASN CB C 13 39.340 0.4 A 98 ASN N N 15 116.362 0.4 A 99 GLY H H 1 7.811 0.025 A 99 GLY HAx H 1 3.870 0.025 A 99 GLY HAy H 1 4.120 0.025 A 99 GLY CA C 13 46.300 0.4 A 99 GLY N N 15 107.794 0.4 A 100 ASN H H 1 8.416 0.025 A 100 ASN HA H 1 4.690 0.025 A 100 ASN HBy H 1 3.030 0.025 A 100 ASN HBx H 1 2.690 0.025 A 100 ASN CA C 13 53.210 0.4 A 100 ASN CB C 13 38.970 0.4 A 100 ASN N N 15 118.972 0.4 A 101 GLU H H 1 8.730 0.025 A 101 GLU HA H 1 4.790 0.025 A 101 GLU HBx H 1 2.030 0.025 A 101 GLU HBy H 1 2.030 0.025 A 101 GLU HGy H 1 2.420 0.025 A 101 GLU HGx H 1 2.240 0.025 A 101 GLU CA C 13 57.020 0.4 A 101 GLU CB C 13 31.970 0.4 A 101 GLU CG C 13 37.330 0.4 A 101 GLU N N 15 119.642 0.4 A 102 LEU H H 1 8.908 0.025 A 102 LEU HA H 1 5.200 0.025 A 102 LEU HBy H 1 1.780 0.025 A 102 LEU HBx H 1 1.480 0.025 A 102 LEU HDx% H 1 1.100 0.025 A 102 LEU HDy% H 1 0.930 0.025 A 102 LEU HG H 1 1.840 0.025 A 102 LEU CA C 13 55.260 0.4 A 102 LEU CB C 13 45.870 0.4 A 102 LEU CDy C 13 26.370 0.4 A 102 LEU CDx C 13 26.130 0.4 A 102 LEU CG C 13 29.060 0.4 A 102 LEU N N 15 125.033 0.4 A 103 ASN H H 1 8.452 0.025 A 103 ASN HA H 1 5.670 0.025 A 103 ASN HBy H 1 2.850 0.025 A 103 ASN HBx H 1 2.580 0.025 A 103 ASN CA C 13 52.150 0.4 A 103 ASN CB C 13 41.970 0.4 A 103 ASN N N 15 123.919 0.4 A 104 THR H H 1 9.050 0.025 A 104 THR HA H 1 5.530 0.025 A 104 THR HB H 1 3.940 0.025 A 104 THR HG2% H 1 1.060 0.025 A 104 THR CA C 13 58.550 0.4 A 104 THR CB C 13 70.450 0.4 A 104 THR N N 15 117.100 0.4 A 105 VAL HA H 1 5.290 0.025 A 105 VAL HB H 1 2.000 0.025 A 105 VAL HGx% H 1 0.950 0.025 A 105 VAL HGy% H 1 0.950 0.025 A 105 VAL CA C 13 61.070 0.4 A 105 VAL CB C 13 36.290 0.4 A 105 VAL CGx C 13 21.810 0.4 A 106 ARG H H 1 9.466 0.025 A 106 ARG CA C 13 54.890 0.4 A 106 ARG CB C 13 33.890 0.4 A 106 ARG CD C 13 42.440 0.4 A 106 ARG CG C 13 27.860 0.4 A 106 ARG N N 15 124.249 0.4 A 107 GLU H H 1 8.605 0.025 A 107 GLU HA H 1 4.960 0.025 A 107 GLU HBy H 1 2.030 0.025 A 107 GLU HBx H 1 1.830 0.025 A 107 GLU HGx H 1 2.140 0.025 A 107 GLU HGy H 1 2.140 0.025 A 107 GLU CA C 13 54.810 0.4 A 107 GLU CB C 13 33.800 0.4 A 107 GLU CG C 13 35.700 0.4 A 107 GLU N N 15 120.784 0.4 A 108 ILE H H 1 8.732 0.025 A 108 ILE HA H 1 4.780 0.025 A 108 ILE HB H 1 1.660 0.025 A 108 ILE HD1% H 1 0.310 0.025 A 108 ILE HG1x H 1 0.670 0.025 A 108 ILE HG1y H 1 0.670 0.025 A 108 ILE HG2% H 1 0.740 0.025 A 108 ILE CA C 13 59.050 0.4 A 108 ILE CB C 13 36.670 0.4 A 108 ILE CD1 C 13 12.220 0.4 A 108 ILE CG1 C 13 26.820 0.4 A 108 ILE CG2 C 13 17.160 0.4 A 108 ILE N N 15 124.182 0.4 A 109 ILE H H 1 8.903 0.025 A 109 ILE HA H 1 4.250 0.025 A 109 ILE HB H 1 1.690 0.025 A 109 ILE HD1% H 1 0.770 0.025 A 109 ILE HG1x H 1 1.360 0.025 A 109 ILE HG1y H 1 1.360 0.025 A 109 ILE HG2% H 1 0.830 0.025 A 109 ILE CA C 13 61.100 0.4 A 109 ILE CB C 13 39.290 0.4 A 109 ILE CD1 C 13 12.650 0.4 A 109 ILE CG1 C 13 27.180 0.4 A 109 ILE CG2 C 13 17.030 0.4 A 109 ILE N N 15 129.631 0.4 A 110 GLY H H 1 9.123 0.025 A 110 GLY HAx H 1 3.670 0.025 A 110 GLY HAy H 1 4.000 0.025 A 110 GLY CA C 13 47.690 0.4 A 110 GLY N N 15 119.473 0.4 A 111 ASP H H 1 8.699 0.025 A 111 ASP HA H 1 4.750 0.025 A 111 ASP HBy H 1 2.900 0.025 A 111 ASP HBx H 1 2.820 0.025 A 111 ASP CA C 13 54.100 0.4 A 111 ASP CB C 13 41.490 0.4 A 111 ASP N N 15 123.998 0.4 A 112 GLU H H 1 7.924 0.025 A 112 GLU HA H 1 5.150 0.025 A 112 GLU HBx H 1 2.010 0.025 A 112 GLU HBy H 1 2.010 0.025 A 112 GLU HGy H 1 2.520 0.025 A 112 GLU HGx H 1 2.250 0.025 A 112 GLU CA C 13 55.560 0.4 A 112 GLU CB C 13 33.200 0.4 A 112 GLU CG C 13 37.560 0.4 A 112 GLU N N 15 118.194 0.4 A 113 LEU H H 1 7.851 0.025 A 113 LEU HA H 1 4.400 0.025 A 113 LEU HBy H 1 0.670 0.025 A 113 LEU HBx H 1 -0.817 0.025 A 113 LEU HDx% H 1 -0.434 0.025 A 113 LEU HDy% H 1 0.029 0.025 A 113 LEU HG H 1 0.780 0.025 A 113 LEU CA C 13 54.140 0.4 A 113 LEU CB C 13 42.180 0.4 A 113 LEU CDx C 13 24.300 0.4 A 113 LEU CDy C 13 24.301 0.4 A 113 LEU CG C 13 27.290 0.4 A 113 LEU N N 15 123.501 0.4 A 114 VAL H H 1 9.357 0.025 A 114 VAL HA H 1 4.520 0.025 A 114 VAL HB H 1 2.010 0.025 A 114 VAL HGx% H 1 0.960 0.025 A 114 VAL HGy% H 1 0.840 0.025 A 114 VAL CA C 13 62.290 0.4 A 114 VAL CB C 13 33.430 0.4 A 114 VAL CGy C 13 21.510 0.4 A 114 VAL CGx C 13 20.980 0.4 A 114 VAL N N 15 127.898 0.4 A 115 GLN H H 1 9.552 0.025 A 115 GLN HA H 1 5.710 0.025 A 115 GLN HBx H 1 1.960 0.025 A 115 GLN HBy H 1 1.960 0.025 A 115 GLN HGx H 1 1.970 0.025 A 115 GLN HGy H 1 1.970 0.025 A 115 GLN CA C 13 53.930 0.4 A 115 GLN CB C 13 30.060 0.4 A 115 GLN CG C 13 33.380 0.4 A 115 GLN N N 15 130.218 0.4 A 116 THR H H 1 8.832 0.025 A 116 THR HA H 1 5.080 0.025 A 116 THR HB H 1 3.890 0.025 A 116 THR HG2% H 1 1.190 0.025 A 116 THR CA C 13 61.800 0.4 A 116 THR CB C 13 70.470 0.4 A 116 THR CG2 C 13 21.800 0.4 A 116 THR N N 15 121.078 0.4 A 117 TYR H H 1 9.440 0.025 A 117 TYR HA H 1 4.950 0.025 A 117 TYR HBy H 1 2.250 0.025 A 117 TYR HBx H 1 1.850 0.025 A 117 TYR HDy H 1 6.570 0.025 A 117 TYR HDx H 1 6.310 0.025 A 117 TYR HEy H 1 6.320 0.025 A 117 TYR HEx H 1 6.060 0.025 A 117 TYR CA C 13 56.430 0.4 A 117 TYR CB C 13 42.110 0.4 A 117 TYR CDx C 13 132.390 0.4 A 117 TYR CDy C 13 132.390 0.4 A 117 TYR CEx C 13 117.690 0.4 A 117 TYR CEy C 13 117.690 0.4 A 117 TYR N N 15 125.712 0.4 A 118 VAL H H 1 9.026 0.025 A 118 VAL HA H 1 5.350 0.025 A 118 VAL HB H 1 2.050 0.025 A 118 VAL HGy% H 1 0.930 0.025 A 118 VAL CA C 13 62.170 0.4 A 118 VAL CB C 13 34.810 0.4 A 118 VAL CGy C 13 21.280 0.4 A 118 VAL CGx C 13 20.980 0.4 A 118 VAL N N 15 120.314 0.4 A 119 TYR H H 1 9.041 0.025 A 119 TYR HA H 1 4.940 0.025 A 119 TYR HBy H 1 3.200 0.025 A 119 TYR HBx H 1 2.690 0.025 A 119 TYR HDy H 1 7.150 0.025 A 119 TYR HDx H 1 6.890 0.025 A 119 TYR HEy H 1 6.700 0.025 A 119 TYR HEx H 1 6.440 0.025 A 119 TYR CA C 13 58.170 0.4 A 119 TYR CB C 13 43.490 0.4 A 119 TYR CDx C 13 133.600 0.4 A 119 TYR CDy C 13 133.600 0.4 A 119 TYR CEx C 13 118.630 0.4 A 119 TYR CEy C 13 118.630 0.4 A 119 TYR N N 15 127.564 0.4 A 120 GLU H H 1 9.509 0.025 A 120 GLU HA H 1 3.430 0.025 A 120 GLU HBy H 1 1.940 0.025 A 120 GLU HBx H 1 1.370 0.025 A 120 GLU HGy H 1 1.430 0.025 A 120 GLU HGx H 1 0.890 0.025 A 120 GLU CA C 13 56.140 0.4 A 120 GLU CB C 13 28.400 0.4 A 120 GLU CG C 13 34.990 0.4 A 120 GLU N N 15 125.533 0.4 A 121 GLY H H 1 8.374 0.025 A 121 GLY HAx H 1 3.510 0.025 A 121 GLY HAy H 1 4.070 0.025 A 121 GLY CA C 13 45.480 0.4 A 121 GLY N N 15 102.076 0.4 A 122 VAL H H 1 8.371 0.025 A 122 VAL HA H 1 4.190 0.025 A 122 VAL HB H 1 2.400 0.025 A 122 VAL HGx% H 1 0.960 0.025 A 122 VAL HGy% H 1 0.960 0.025 A 122 VAL CA C 13 62.660 0.4 A 122 VAL CB C 13 32.980 0.4 A 122 VAL CGy C 13 21.610 0.4 A 122 VAL CGx C 13 21.490 0.4 A 122 VAL N N 15 123.797 0.4 A 123 GLU H H 1 8.511 0.025 A 123 GLU HA H 1 5.670 0.025 A 123 GLU HBx H 1 1.980 0.025 A 123 GLU HBy H 1 1.980 0.025 A 123 GLU HGy H 1 2.220 0.025 A 123 GLU HGx H 1 2.040 0.025 A 123 GLU CA C 13 54.010 0.4 A 123 GLU CB C 13 32.850 0.4 A 123 GLU CG C 13 36.900 0.4 A 123 GLU N N 15 126.257 0.4 A 124 ALA H H 1 9.258 0.025 A 124 ALA HA H 1 5.150 0.025 A 124 ALA HB% H 1 1.330 0.025 A 124 ALA CA C 13 50.860 0.4 A 124 ALA CB C 13 24.060 0.4 A 124 ALA N N 15 126.354 0.4 A 125 LYS H H 1 8.847 0.025 A 125 LYS HA H 1 5.760 0.025 A 125 LYS HBx H 1 1.560 0.025 A 125 LYS HBy H 1 1.560 0.025 A 125 LYS HDx H 1 1.500 0.025 A 125 LYS HDy H 1 1.500 0.025 A 125 LYS HEx H 1 2.820 0.025 A 125 LYS HEy H 1 2.820 0.025 A 125 LYS HGx H 1 1.400 0.025 A 125 LYS HGy H 1 1.400 0.025 A 125 LYS CA C 13 55.130 0.4 A 125 LYS CB C 13 38.130 0.4 A 125 LYS CD C 13 29.690 0.4 A 125 LYS CE C 13 42.160 0.4 A 125 LYS CG C 13 25.240 0.4 A 125 LYS N N 15 115.989 0.4 A 126 ARG H H 1 9.241 0.025 A 126 ARG HA H 1 4.750 0.025 A 126 ARG HBy H 1 1.770 0.025 A 126 ARG HBx H 1 1.350 0.025 A 126 ARG HDy H 1 2.330 0.025 A 126 ARG HDx H 1 2.100 0.025 A 126 ARG HGy H 1 1.420 0.025 A 126 ARG HGx H 1 1.010 0.025 A 126 ARG CA C 13 56.940 0.4 A 126 ARG CB C 13 34.040 0.4 A 126 ARG CD C 13 43.130 0.4 A 126 ARG CG C 13 26.730 0.4 A 126 ARG N N 15 120.557 0.4 A 127 ILE H H 1 8.785 0.025 A 127 ILE HA H 1 5.020 0.025 A 127 ILE HB H 1 1.640 0.025 A 127 ILE HD1% H 1 0.800 0.025 A 127 ILE HG1y H 1 1.380 0.025 A 127 ILE HG1x H 1 1.180 0.025 A 127 ILE HG2% H 1 0.920 0.025 A 127 ILE CA C 13 61.670 0.4 A 127 ILE CB C 13 40.200 0.4 A 127 ILE CD1 C 13 14.430 0.4 A 127 ILE CG1 C 13 29.940 0.4 A 127 ILE CG2 C 13 19.460 0.4 A 127 ILE N N 15 122.970 0.4 A 128 PHE H H 1 10.070 0.025 A 128 PHE HA H 1 5.260 0.025 A 128 PHE HBy H 1 3.280 0.025 A 128 PHE HBx H 1 3.120 0.025 A 128 PHE HDx H 1 6.990 0.025 A 128 PHE HDy H 1 7.250 0.025 A 128 PHE HEx H 1 6.880 0.025 A 128 PHE HEy H 1 7.130 0.025 A 128 PHE CA C 13 56.050 0.4 A 128 PHE CB C 13 42.730 0.4 A 128 PHE CDx C 13 132.180 0.4 A 128 PHE CDy C 13 132.180 0.4 A 128 PHE CEx C 13 131.040 0.4 A 128 PHE CEy C 13 131.040 0.4 A 128 PHE N N 15 126.381 0.4 A 129 LYS H H 1 8.866 0.025 A 129 LYS HA H 1 5.310 0.025 A 129 LYS HBy H 1 2.110 0.025 A 129 LYS HBx H 1 1.910 0.025 A 129 LYS HDx H 1 1.770 0.025 A 129 LYS HDy H 1 1.770 0.025 A 129 LYS HEx H 1 3.060 0.025 A 129 LYS HEy H 1 3.060 0.025 A 129 LYS HGy H 1 1.730 0.025 A 129 LYS HGx H 1 1.490 0.025 A 129 LYS CA C 13 54.740 0.4 A 129 LYS CB C 13 37.070 0.4 A 129 LYS CD C 13 29.570 0.4 A 129 LYS CE C 13 42.200 0.4 A 129 LYS CG C 13 26.280 0.4 A 129 LYS N N 15 118.294 0.4 A 130 LYS H H 1 9.057 0.025 A 130 LYS HA H 1 4.090 0.025 A 130 LYS HBx H 1 1.480 0.025 A 130 LYS HBy H 1 1.480 0.025 A 130 LYS HDy H 1 1.380 0.025 A 130 LYS HDx H 1 1.310 0.025 A 130 LYS HEy H 1 2.810 0.025 A 130 LYS HEx H 1 2.690 0.025 A 130 LYS HGy H 1 1.050 0.025 A 130 LYS HGx H 1 0.640 0.025 A 130 LYS CA C 13 57.790 0.4 A 130 LYS CB C 13 33.020 0.4 A 130 LYS CD C 13 29.560 0.4 A 130 LYS CE C 13 42.580 0.4 A 130 LYS CG C 13 25.630 0.4 A 130 LYS N N 15 123.147 0.4 A 131 ASP H H 1 8.135 0.025 A 131 ASP HA H 1 4.500 0.025 A 131 ASP HBx H 1 2.230 0.025 A 131 ASP HBy H 1 2.380 0.025 A 131 ASP CA C 13 57.560 0.4 A 131 ASP CB C 13 44.380 0.4 A 131 ASP N N 15 129.373 0.4 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 1 ALA HB% A 2 PHE H 1.0 1.80 5.04 2 2 A 1 ALA HB% A 3 ASP H 1.0 1.80 5.07 3 3 A 1 ALA HB% A 108 ILE HD1% 1.0 1.80 4.79 4 4 A 1 ALA HB% A 108 ILE HG2% 1.0 1.80 5.16 5 5 A 1 ALA HB% A 130 LYS HDy 1.0 1.80 5.50 6 6 A 2 PHE H A 2 PHE HBx 1.0 1.80 3.84 7 6 A 2 PHE H A 2 PHE HBy 1.0 1.80 3.84 8 7 A 2 PHE HA A 2 PHE HEy 1.0 1.80 4.71 9 7 A 2 PHE HA A 2 PHE HEx 1.0 1.80 4.71 10 8 A 2 PHE HA A 2 PHE HDy 1.0 1.80 4.75 11 9 A 2 PHE HA A 2 PHE HDy 1.0 1.80 4.01 12 9 A 2 PHE HA A 2 PHE HDx 1.0 1.80 4.01 13 10 A 3 ASP H A 2 PHE HBx 1.0 1.80 3.50 14 10 A 3 ASP H A 2 PHE HBy 1.0 1.80 3.50 15 11 A 2 PHE H A 3 ASP H 1.0 1.80 4.22 16 12 A 2 PHE HA A 6 TRP HE1 1.0 1.80 4.98 17 13 A 2 PHE HA A 6 TRP HH2 1.0 1.80 5.00 18 14 A 2 PHE HA A 6 TRP HZ2 1.0 1.80 3.79 19 15 A 2 PHE HBx A 40 ILE HG1x 1.0 1.80 4.41 20 15 A 2 PHE HBy A 40 ILE HG1x 1.0 1.80 4.41 21 15 A 40 ILE HG1y A 2 PHE HBx 1.0 1.80 4.41 22 15 A 2 PHE HBy A 40 ILE HG1y 1.0 1.80 4.41 23 16 A 2 PHE HEx A 40 ILE HD1% 1.0 1.80 5.05 24 17 A 40 ILE HG2% A 2 PHE HBx 1.0 1.80 3.99 25 17 A 2 PHE HBy A 40 ILE HG2% 1.0 1.80 3.99 26 18 A 2 PHE HA A 40 ILE HG2% 1.0 1.80 5.00 27 19 A 40 ILE HD1% A 2 PHE HBx 1.0 1.80 4.49 28 19 A 2 PHE HBy A 40 ILE HD1% 1.0 1.80 4.49 29 20 A 2 PHE HEx A 40 ILE HG1x 1.0 1.80 5.46 30 20 A 40 ILE HG1y A 2 PHE HEx 1.0 1.80 5.46 31 21 A 108 ILE HD1% A 2 PHE HA 1.0 1.80 4.23 32 22 A 108 ILE HD1% A 2 PHE HDy 1.0 1.80 4.54 33 22 A 108 ILE HD1% A 2 PHE HDx 1.0 1.80 4.54 34 23 A 108 ILE HG2% A 2 PHE HEx 1.0 1.80 5.50 35 24 A 108 ILE HD1% A 2 PHE HEy 1.0 1.80 5.02 36 25 A 108 ILE HD1% A 2 PHE HBx 1.0 1.80 5.36 37 25 A 108 ILE HD1% A 2 PHE HBy 1.0 1.80 5.36 38 26 A 108 ILE HD1% A 2 PHE HEx 1.0 1.80 5.40 39 27 A 2 PHE HEx A 113 LEU HDx% 1.0 1.80 5.15 40 28 A 2 PHE HEx A 113 LEU HG 1.0 1.80 4.78 41 29 A 2 PHE HEy A 113 LEU HDx% 1.0 1.80 4.05 42 29 A 2 PHE HEx A 113 LEU HDx% 1.0 1.80 4.05 43 30 A 3 ASP H A 3 ASP HBy 1.0 1.80 3.18 44 31 A 3 ASP HA A 4 SER H 1.0 1.80 3.13 45 32 A 3 ASP HA A 40 ILE HB 1.0 1.80 4.39 46 33 A 3 ASP HA A 40 ILE H 1.0 1.80 4.53 47 34 A 40 ILE HG2% A 3 ASP HA 1.0 1.80 4.31 48 35 A 3 ASP HA A 41 THR HG2% 1.0 1.80 5.15 49 36 A 4 SER HBy A 4 SER H 1.0 1.80 4.16 50 37 A 4 SER HA A 5 THR HB 1.0 1.80 5.27 51 38 A 4 SER HBx A 5 THR H 1.0 1.80 3.73 52 39 A 4 SER HBy A 5 THR H 1.0 1.80 4.06 53 40 A 4 SER HA A 5 THR H 1.0 1.80 3.15 54 41 A 6 TRP HE1 A 4 SER HBy 1.0 1.80 4.29 55 42 A 4 SER HA A 6 TRP HD1 1.0 1.80 5.47 56 43 A 6 TRP HE1 A 4 SER H 1.0 1.80 4.64 57 44 A 6 TRP HZ2 A 4 SER HBy 1.0 1.80 4.80 58 45 A 6 TRP HE1 A 4 SER HBx 1.0 1.80 4.82 59 46 A 40 ILE H A 4 SER H 1.0 1.80 5.05 60 47 A 40 ILE HG2% A 4 SER H 1.0 1.80 5.01 61 48 A 40 ILE HB A 4 SER H 1.0 1.80 4.30 62 49 A 40 ILE HB A 4 SER HBx 1.0 1.80 4.75 63 50 A 41 THR HA A 4 SER H 1.0 1.80 5.27 64 51 A 5 THR HB A 5 THR H 1.0 1.80 3.41 65 52 A 5 THR HA A 5 THR HG2% 1.0 1.80 3.48 66 53 A 5 THR H A 5 THR HG2% 1.0 1.80 4.70 67 54 A 6 TRP HD1 A 5 THR HA 1.0 1.80 4.30 68 55 A 5 THR HG2% A 6 TRP HA 1.0 1.80 4.57 69 56 A 5 THR HA A 6 TRP H 1.0 1.80 3.15 70 57 A 5 THR HB A 6 TRP H 1.0 1.80 4.83 71 58 A 5 THR HG2% A 6 TRP H 1.0 1.80 3.69 72 59 A 6 TRP HD1 A 5 THR HG2% 1.0 1.80 4.28 73 60 A 5 THR HB A 37 LYS HDx 1.0 1.80 4.79 74 60 A 5 THR HB A 37 LYS HDy 1.0 1.80 4.79 75 61 A 5 THR HG2% A 37 LYS HEx 1.0 1.80 4.12 76 61 A 5 THR HG2% A 37 LYS HEy 1.0 1.80 4.12 77 62 A 5 THR HG2% A 37 LYS HGx 1.0 1.80 4.53 78 62 A 5 THR HG2% A 37 LYS HGy 1.0 1.80 4.53 79 63 A 5 THR HG2% A 37 LYS HDx 1.0 1.80 3.48 80 63 A 5 THR HG2% A 37 LYS HDy 1.0 1.80 3.48 81 64 A 5 THR HA A 39 THR HA 1.0 1.80 3.32 82 65 A 5 THR HA A 40 ILE H 1.0 1.80 4.09 83 66 A 5 THR HB A 131 ASP H 1.0 1.80 4.33 84 67 A 5 THR HG2% A 131 ASP HBy 1.0 1.80 3.44 85 68 A 5 THR HB A 131 ASP HBy 1.0 1.80 3.80 86 69 A 5 THR HG2% A 131 ASP HBx 1.0 1.80 3.97 87 70 A 5 THR HB A 131 ASP HBx 1.0 1.80 4.49 88 71 A 6 TRP HBx A 6 TRP H 1.0 1.80 3.93 89 72 A 6 TRP HD1 A 6 TRP H 1.0 1.80 4.45 90 73 A 6 TRP HD1 A 6 TRP HBx 1.0 1.80 3.81 91 74 A 6 TRP HBy A 6 TRP HE3 1.0 1.80 3.85 92 75 A 6 TRP HA A 7 LYS HBx 1.0 1.80 5.36 93 75 A 6 TRP HA A 7 LYS HBy 1.0 1.80 5.36 94 76 A 6 TRP HBx A 7 LYS H 1.0 1.80 4.83 95 77 A 6 TRP HBy A 7 LYS H 1.0 1.80 4.10 96 78 A 6 TRP HD1 A 7 LYS H 1.0 1.80 5.41 97 79 A 6 TRP HA A 7 LYS H 1.0 1.80 2.97 98 80 A 6 TRP HBx A 37 LYS HDx 1.0 1.80 4.83 99 80 A 37 LYS HDy A 6 TRP HBx 1.0 1.80 4.83 100 81 A 37 LYS HA A 6 TRP H 1.0 1.80 5.35 101 82 A 6 TRP HA A 37 LYS HDx 1.0 1.80 4.56 102 82 A 6 TRP HA A 37 LYS HDy 1.0 1.80 4.56 103 83 A 6 TRP HE3 A 38 LEU HDy% 1.0 1.80 5.50 104 84 A 6 TRP HBx A 38 LEU HBy 1.0 1.80 4.30 105 85 A 6 TRP HE3 A 38 LEU HG 1.0 1.80 4.77 106 86 A 6 TRP HBx A 38 LEU HBx 1.0 1.80 5.31 107 87 A 6 TRP HBy A 38 LEU H 1.0 1.80 4.73 108 88 A 6 TRP H A 38 LEU H 1.0 1.80 4.58 109 89 A 6 TRP HBx A 38 LEU HG 1.0 1.80 4.90 110 90 A 6 TRP HBx A 38 LEU H 1.0 1.80 4.50 111 91 A 39 THR HA A 6 TRP H 1.0 1.80 3.99 112 92 A 6 TRP HE1 A 40 ILE HD1% 1.0 1.80 4.73 113 93 A 6 TRP HD1 A 40 ILE HG1x 1.0 1.80 4.23 114 93 A 40 ILE HG1y A 6 TRP HD1 1.0 1.80 4.23 115 94 A 40 ILE HD1% A 6 TRP HD1 1.0 1.80 3.89 116 95 A 108 ILE HG2% A 6 TRP HH2 1.0 1.80 4.85 117 96 A 108 ILE HD1% A 6 TRP HH2 1.0 1.80 4.63 118 97 A 108 ILE HD1% A 6 TRP HZ3 1.0 1.80 4.71 119 98 A 6 TRP HE3 A 128 PHE HBy 1.0 1.80 4.26 120 99 A 6 TRP HBy A 128 PHE HDx 1.0 1.80 4.81 121 100 A 6 TRP HBy A 128 PHE HEy 1.0 1.80 5.50 122 101 A 6 TRP HBx A 128 PHE HEy 1.0 1.80 5.47 123 102 A 6 TRP HBx A 128 PHE HDx 1.0 1.80 4.33 124 103 A 6 TRP HA A 130 LYS HA 1.0 1.80 3.50 125 104 A 6 TRP HA A 131 ASP H 1.0 1.80 3.83 126 105 A 7 LYS HA A 7 LYS HGx 1.0 1.80 3.96 127 105 A 7 LYS HA A 7 LYS HGy 1.0 1.80 3.96 128 106 A 7 LYS HBy A 7 LYS H 1.0 1.80 3.43 129 106 A 7 LYS H A 7 LYS HBx 1.0 1.80 3.43 130 107 A 7 LYS HEx A 7 LYS HGx 1.0 1.80 3.49 131 107 A 7 LYS HEy A 7 LYS HGx 1.0 1.80 3.49 132 107 A 7 LYS HGy A 7 LYS HEx 1.0 1.80 3.49 133 107 A 7 LYS HGy A 7 LYS HEy 1.0 1.80 3.49 134 108 A 7 LYS HBy A 7 LYS HEx 1.0 1.80 4.20 135 108 A 7 LYS HBx A 7 LYS HEx 1.0 1.80 4.20 136 108 A 7 LYS HEy A 7 LYS HBx 1.0 1.80 4.20 137 108 A 7 LYS HBy A 7 LYS HEy 1.0 1.80 4.20 138 109 A 7 LYS HA A 7 LYS HEx 1.0 1.80 5.42 139 109 A 7 LYS HA A 7 LYS HEy 1.0 1.80 5.42 140 110 A 7 LYS HGy A 7 LYS H 1.0 1.80 4.11 141 110 A 7 LYS H A 7 LYS HGx 1.0 1.80 4.11 142 111 A 7 LYS HA A 8 VAL H 1.0 1.80 2.90 143 112 A 7 LYS HA A 8 VAL HGx% 1.0 1.80 4.93 144 113 A 7 LYS HA A 8 VAL HB 1.0 1.80 4.60 145 114 A 7 LYS HA A 8 VAL HGy% 1.0 1.80 5.19 146 115 A 7 LYS HBy A 8 VAL H 1.0 1.80 3.90 147 115 A 8 VAL H A 7 LYS HBx 1.0 1.80 3.90 148 116 A 8 VAL H A 7 LYS HGx 1.0 1.80 4.15 149 116 A 7 LYS HGy A 8 VAL H 1.0 1.80 4.15 150 117 A 8 VAL HGx% A 7 LYS HGx 1.0 1.80 5.38 151 117 A 7 LYS HGy A 8 VAL HGx% 1.0 1.80 5.38 152 118 A 37 LYS HA A 7 LYS HBx 1.0 1.80 3.74 153 118 A 7 LYS HBy A 37 LYS HA 1.0 1.80 3.74 154 119 A 7 LYS HA A 37 LYS HGx 1.0 1.80 5.50 155 119 A 37 LYS HGy A 7 LYS HA 1.0 1.80 5.50 156 120 A 7 LYS HA A 37 LYS HDx 1.0 1.80 4.14 157 120 A 37 LYS HDy A 7 LYS HA 1.0 1.80 4.14 158 121 A 37 LYS HA A 7 LYS HA 1.0 1.80 3.11 159 122 A 7 LYS HA A 38 LEU H 1.0 1.80 3.70 160 123 A 128 PHE HDx A 7 LYS HA 1.0 1.80 4.47 161 123 A 7 LYS HA A 128 PHE HDy 1.0 1.80 4.47 162 124 A 128 PHE HDx A 7 LYS HGx 1.0 1.80 5.50 163 124 A 128 PHE HDx A 7 LYS HGy 1.0 1.80 5.50 164 125 A 129 LYS HBy A 7 LYS HEx 1.0 1.80 4.21 165 125 A 7 LYS HEy A 129 LYS HBy 1.0 1.80 4.21 166 126 A 129 LYS HGy A 7 LYS HEx 1.0 1.80 4.60 167 126 A 7 LYS HEy A 129 LYS HGy 1.0 1.80 4.60 168 127 A 7 LYS H A 129 LYS H 1.0 1.80 4.23 169 128 A 129 LYS HGx A 7 LYS HEx 1.0 1.80 4.98 170 128 A 7 LYS HEy A 129 LYS HGx 1.0 1.80 4.98 171 129 A 130 LYS HBy A 7 LYS H 1.0 1.80 4.29 172 129 A 7 LYS H A 130 LYS HBx 1.0 1.80 4.29 173 130 A 130 LYS HA A 7 LYS H 1.0 1.80 4.30 174 131 A 131 ASP HBx A 7 LYS H 1.0 1.80 4.67 175 132 A 131 ASP H A 7 LYS H 1.0 1.80 4.85 176 133 A 131 ASP HBx A 7 LYS HEx 1.0 1.80 5.09 177 133 A 131 ASP HBx A 7 LYS HEy 1.0 1.80 5.09 178 134 A 131 ASP HBx A 7 LYS HBx 1.0 1.80 3.75 179 134 A 131 ASP HBx A 7 LYS HBy 1.0 1.80 3.75 180 135 A 131 ASP HA A 7 LYS HEx 1.0 1.80 4.43 181 135 A 7 LYS HEy A 131 ASP HA 1.0 1.80 4.43 182 136 A 131 ASP HBx A 7 LYS HGx 1.0 1.80 5.18 183 136 A 131 ASP HBx A 7 LYS HGy 1.0 1.80 5.18 184 137 A 8 VAL HGx% A 8 VAL H 1.0 1.80 5.00 185 138 A 8 VAL HGy% A 8 VAL HA 1.0 1.80 3.58 186 139 A 8 VAL HGy% A 8 VAL H 1.0 1.80 4.91 187 140 A 8 VAL HB A 8 VAL H 1.0 1.80 3.11 188 141 A 8 VAL HGy% A 9 ASP H 1.0 1.80 4.36 189 142 A 8 VAL HB A 9 ASP H 1.0 1.80 4.67 190 143 A 8 VAL HGx% A 9 ASP H 1.0 1.80 5.17 191 144 A 8 VAL HA A 9 ASP H 1.0 1.80 3.12 192 145 A 8 VAL HA A 9 ASP HA 1.0 1.80 5.08 193 146 A 8 VAL HGy% A 10 ARG H 1.0 1.80 4.37 194 147 A 8 VAL HGx% A 10 ARG H 1.0 1.80 5.43 195 148 A 8 VAL HGx% A 34 ASP HA 1.0 1.80 4.31 196 149 A 37 LYS HA A 8 VAL H 1.0 1.80 4.73 197 150 A 38 LEU HBx A 8 VAL HB 1.0 1.80 4.88 198 151 A 38 LEU HBy A 8 VAL HB 1.0 1.80 4.87 199 152 A 8 VAL HGx% A 126 ARG HGy 1.0 1.80 4.98 200 153 A 8 VAL HGy% A 126 ARG HBx 1.0 1.80 4.65 201 154 A 8 VAL HGy% A 126 ARG HGx 1.0 1.80 3.32 202 155 A 8 VAL HGy% A 126 ARG HBy 1.0 1.80 5.50 203 156 A 8 VAL HGy% A 127 ILE H 1.0 1.80 4.57 204 157 A 128 PHE HDx A 8 VAL HB 1.0 1.80 4.81 205 158 A 128 PHE HDx A 8 VAL HB 1.0 1.80 4.67 206 158 A 8 VAL HB A 128 PHE HDy 1.0 1.80 4.67 207 159 A 128 PHE HDx A 8 VAL HA 1.0 1.80 4.72 208 160 A 8 VAL HA A 128 PHE HBx 1.0 1.80 5.28 209 161 A 128 PHE HDx A 8 VAL HA 1.0 1.80 3.40 210 161 A 8 VAL HA A 128 PHE HDy 1.0 1.80 3.40 211 162 A 8 VAL HA A 128 PHE HA 1.0 1.80 3.13 212 163 A 8 VAL HGy% A 128 PHE HA 1.0 1.80 4.88 213 164 A 8 VAL HA A 129 LYS H 1.0 1.80 4.15 214 165 A 8 VAL HGy% A 129 LYS H 1.0 1.80 5.50 215 166 A 9 ASP HBy A 9 ASP H 1.0 1.80 3.96 216 167 A 9 ASP HBx A 9 ASP H 1.0 1.80 3.79 217 168 A 9 ASP H A 10 ARG H 1.0 1.80 3.36 218 169 A 9 ASP HBx A 10 ARG H 1.0 1.80 3.57 219 170 A 9 ASP HBx A 10 ARG HGy 1.0 1.80 4.50 220 171 A 9 ASP HBx A 127 ILE HB 1.0 1.80 5.31 221 172 A 128 PHE HA A 9 ASP H 1.0 1.80 3.63 222 173 A 9 ASP HBx A 129 LYS HDx 1.0 1.80 4.54 223 173 A 9 ASP HBx A 129 LYS HDy 1.0 1.80 4.54 224 174 A 129 LYS HGx A 9 ASP HBy 1.0 1.80 4.07 225 175 A 9 ASP HBy A 129 LYS HBx 1.0 1.80 5.10 226 176 A 9 ASP HBy A 129 LYS HDx 1.0 1.80 4.21 227 176 A 9 ASP HBy A 129 LYS HDy 1.0 1.80 4.21 228 177 A 129 LYS HGx A 9 ASP HBx 1.0 1.80 4.30 229 178 A 10 ARG HGy A 10 ARG H 1.0 1.80 3.70 230 179 A 10 ARG HBy A 10 ARG H 1.0 1.80 3.93 231 179 A 10 ARG H A 10 ARG HBx 1.0 1.80 3.93 232 180 A 10 ARG HGx A 10 ARG H 1.0 1.80 4.19 233 181 A 10 ARG HBy A 10 ARG HDx 1.0 1.80 3.69 234 181 A 10 ARG HBx A 10 ARG HDx 1.0 1.80 3.69 235 181 A 10 ARG HDy A 10 ARG HBx 1.0 1.80 3.69 236 181 A 10 ARG HBy A 10 ARG HDy 1.0 1.80 3.69 237 182 A 11 SER H A 10 ARG HDx 1.0 1.80 4.65 238 182 A 10 ARG HDy A 11 SER H 1.0 1.80 4.65 239 183 A 10 ARG HGx A 11 SER H 1.0 1.80 5.06 240 184 A 11 SER H A 10 ARG HBx 1.0 1.80 3.19 241 184 A 10 ARG HBy A 11 SER H 1.0 1.80 3.19 242 185 A 11 SER HA A 10 ARG HBx 1.0 1.80 4.97 243 185 A 10 ARG HBy A 11 SER HA 1.0 1.80 4.97 244 186 A 10 ARG HGy A 11 SER H 1.0 1.80 4.80 245 187 A 10 ARG HGx A 11 SER HA 1.0 1.80 5.27 246 188 A 11 SER H A 10 ARG HA 1.0 1.80 2.90 247 189 A 10 ARG HGx A 127 ILE HD1% 1.0 1.80 4.17 248 190 A 10 ARG HGy A 127 ILE HG2% 1.0 1.80 4.55 249 191 A 127 ILE HA A 10 ARG H 1.0 1.80 5.31 250 192 A 10 ARG HGx A 127 ILE HG1y 1.0 1.80 2.62 251 193 A 127 ILE HB A 10 ARG HGx 1.0 1.80 4.27 252 194 A 127 ILE HB A 10 ARG H 1.0 1.80 4.06 253 195 A 127 ILE HG2% A 10 ARG H 1.0 1.80 4.92 254 196 A 127 ILE HD1% A 10 ARG HBx 1.0 1.80 4.79 255 196 A 10 ARG HBy A 127 ILE HD1% 1.0 1.80 4.79 256 197 A 10 ARG H A 127 ILE H 1.0 1.80 4.07 257 198 A 127 ILE HD1% A 10 ARG HDx 1.0 1.80 4.92 258 198 A 10 ARG HDy A 127 ILE HD1% 1.0 1.80 4.92 259 199 A 10 ARG HGy A 127 ILE HD1% 1.0 1.80 4.36 260 200 A 10 ARG H A 128 PHE H 1.0 1.80 5.21 261 201 A 128 PHE HA A 10 ARG H 1.0 1.80 4.60 262 202 A 11 SER H A 11 SER HBx 1.0 1.80 3.61 263 203 A 11 SER HA A 12 GLU HA 1.0 1.80 4.98 264 204 A 11 SER HA A 12 GLU H 1.0 1.80 3.28 265 205 A 11 SER HBx A 12 GLU H 1.0 1.80 3.93 266 206 A 11 SER HBx A 14 TYR HBy 1.0 1.80 4.55 267 207 A 11 SER HBy A 14 TYR HBx 1.0 1.80 3.79 268 208 A 14 TYR HBy A 11 SER HBy 1.0 1.80 4.17 269 209 A 11 SER HBy A 33 HIS HBy 1.0 1.80 4.96 270 210 A 11 SER HBx A 33 HIS HA 1.0 1.80 3.85 271 211 A 11 SER HBy A 33 HIS HA 1.0 1.80 5.07 272 212 A 11 SER HBx A 33 HIS HBy 1.0 1.80 4.77 273 213 A 11 SER HBx A 33 HIS HBx 1.0 1.80 4.67 274 214 A 126 ARG HGx A 11 SER HA 1.0 1.80 5.10 275 215 A 126 ARG HGx A 11 SER HBy 1.0 1.80 5.30 276 216 A 11 SER HA A 126 ARG HA 1.0 1.80 4.01 277 217 A 11 SER HA A 127 ILE HD1% 1.0 1.80 5.19 278 218 A 11 SER HA A 127 ILE H 1.0 1.80 4.52 279 219 A 12 GLU HA A 12 GLU HGx 1.0 1.80 4.06 280 219 A 12 GLU HA A 12 GLU HGy 1.0 1.80 4.06 281 220 A 12 GLU HBy A 12 GLU H 1.0 1.80 4.06 282 220 A 12 GLU H A 12 GLU HBx 1.0 1.80 4.06 283 221 A 13 ASN H A 12 GLU HBx 1.0 1.80 4.06 284 221 A 12 GLU HBy A 13 ASN H 1.0 1.80 4.06 285 222 A 12 GLU HA A 13 ASN H 1.0 1.80 2.97 286 223 A 14 TYR HBx A 12 GLU H 1.0 1.80 5.06 287 224 A 124 ALA HB% A 12 GLU H 1.0 1.80 5.08 288 225 A 12 GLU H A 125 LYS H 1.0 1.80 4.32 289 226 A 125 LYS HBy A 12 GLU H 1.0 1.80 4.39 290 226 A 12 GLU H A 125 LYS HBx 1.0 1.80 4.39 291 227 A 13 ASN H A 13 ASN HBx 1.0 1.80 3.90 292 228 A 13 ASN H A 13 ASN HA 1.0 1.80 2.55 293 229 A 13 ASN HBy A 14 TYR HA 1.0 1.80 5.03 294 230 A 13 ASN HA A 14 TYR H 1.0 1.80 3.43 295 231 A 13 ASN HBy A 14 TYR H 1.0 1.80 4.55 296 232 A 13 ASN H A 14 TYR H 1.0 1.80 3.76 297 233 A 13 ASN HA A 15 ASP H 1.0 1.80 4.33 298 234 A 13 ASN HA A 16 LYS HBy 1.0 1.80 4.18 299 235 A 13 ASN HA A 16 LYS H 1.0 1.80 4.48 300 236 A 13 ASN HA A 16 LYS HDx 1.0 1.80 4.23 301 236 A 13 ASN HA A 16 LYS HDy 1.0 1.80 4.23 302 237 A 13 ASN HBy A 16 LYS HBy 1.0 1.80 5.23 303 238 A 13 ASN HBy A 124 ALA HA 1.0 1.80 3.40 304 239 A 124 ALA HB% A 13 ASN HBy 1.0 1.80 3.99 305 240 A 13 ASN HBy A 125 LYS HEx 1.0 1.80 4.23 306 240 A 13 ASN HBy A 125 LYS HEy 1.0 1.80 4.23 307 241 A 13 ASN H A 125 LYS H 1.0 1.80 5.25 308 242 A 13 ASN HBy A 125 LYS H 1.0 1.80 4.27 309 243 A 14 TYR HBy A 14 TYR H 1.0 1.80 3.33 310 244 A 14 TYR H A 14 TYR HDy 1.0 1.80 4.33 311 244 A 14 TYR H A 14 TYR HDx 1.0 1.80 4.33 312 245 A 14 TYR HA A 14 TYR HDy 1.0 1.80 4.13 313 246 A 14 TYR HBx A 14 TYR H 1.0 1.80 3.26 314 247 A 14 TYR HBx A 15 ASP HA 1.0 1.80 4.83 315 248 A 14 TYR H A 15 ASP HBx 1.0 1.80 4.61 316 248 A 14 TYR H A 15 ASP HBy 1.0 1.80 4.61 317 249 A 15 ASP H A 14 TYR HDy 1.0 1.80 4.51 318 249 A 15 ASP H A 14 TYR HDx 1.0 1.80 4.51 319 250 A 14 TYR H A 15 ASP H 1.0 1.80 3.88 320 251 A 14 TYR HBx A 15 ASP H 1.0 1.80 3.93 321 252 A 14 TYR HBy A 15 ASP H 1.0 1.80 3.73 322 253 A 14 TYR HA A 16 LYS H 1.0 1.80 4.78 323 254 A 14 TYR HA A 17 PHE HBx 1.0 1.80 3.97 324 254 A 14 TYR HA A 17 PHE HBy 1.0 1.80 3.97 325 255 A 14 TYR HA A 17 PHE H 1.0 1.80 4.57 326 256 A 14 TYR HDy A 32 ALA HA 1.0 1.80 5.18 327 257 A 14 TYR HDy A 32 ALA HA 1.0 1.80 4.11 328 257 A 32 ALA HA A 14 TYR HDx 1.0 1.80 4.11 329 258 A 32 ALA HA A 14 TYR HE% 1.0 1.80 4.44 330 259 A 14 TYR HDy A 32 ALA HB% 1.0 1.80 5.14 331 260 A 32 ALA HA A 14 TYR HDx 1.0 1.80 4.92 332 261 A 14 TYR HE% A 32 ALA HB% 1.0 1.80 4.96 333 262 A 32 ALA HB% A 14 TYR HDx 1.0 1.80 5.50 334 263 A 14 TYR HBy A 124 ALA HB% 1.0 1.80 4.06 335 264 A 124 ALA HB% A 14 TYR HDy 1.0 1.80 4.30 336 265 A 14 TYR HBx A 124 ALA HB% 1.0 1.80 4.50 337 266 A 124 ALA HB% A 14 TYR HDx 1.0 1.80 5.50 338 267 A 124 ALA HB% A 14 TYR H 1.0 1.80 4.53 339 268 A 124 ALA HB% A 14 TYR HA 1.0 1.80 3.70 340 269 A 14 TYR HA A 125 LYS H 1.0 1.80 5.34 341 270 A 14 TYR H A 125 LYS H 1.0 1.80 5.11 342 271 A 15 ASP HA A 15 ASP HBx 1.0 1.80 2.89 343 271 A 15 ASP HA A 15 ASP HBy 1.0 1.80 2.89 344 272 A 15 ASP H A 15 ASP HBx 1.0 1.80 2.71 345 272 A 15 ASP H A 15 ASP HBy 1.0 1.80 2.71 346 273 A 15 ASP H A 16 LYS H 1.0 1.80 3.57 347 274 A 16 LYS H A 15 ASP HBx 1.0 1.80 3.30 348 274 A 16 LYS H A 15 ASP HBy 1.0 1.80 3.30 349 275 A 15 ASP HBy A 16 LYS HDx 1.0 1.80 4.67 350 275 A 15 ASP HBx A 16 LYS HDx 1.0 1.80 4.67 351 275 A 16 LYS HDy A 15 ASP HBx 1.0 1.80 4.67 352 275 A 16 LYS HDy A 15 ASP HBy 1.0 1.80 4.67 353 276 A 15 ASP HA A 17 PHE H 1.0 1.80 5.06 354 277 A 15 ASP HA A 18 MET H 1.0 1.80 4.37 355 278 A 15 ASP HA A 28 ARG HDy 1.0 1.80 4.57 356 279 A 15 ASP HA A 28 ARG HGx 1.0 1.80 4.57 357 279 A 15 ASP HA A 28 ARG HGy 1.0 1.80 4.57 358 280 A 16 LYS HA A 16 LYS HGy 1.0 1.80 3.51 359 281 A 16 LYS HGx A 16 LYS HDx 1.0 1.80 2.65 360 281 A 16 LYS HDy A 16 LYS HGx 1.0 1.80 2.65 361 282 A 16 LYS H A 16 LYS HDx 1.0 1.80 4.56 362 282 A 16 LYS H A 16 LYS HDy 1.0 1.80 4.56 363 283 A 16 LYS HA A 16 LYS HEx 1.0 1.80 4.84 364 283 A 16 LYS HA A 16 LYS HEy 1.0 1.80 4.84 365 284 A 16 LYS HA A 16 LYS HDx 1.0 1.80 3.05 366 284 A 16 LYS HDy A 16 LYS HA 1.0 1.80 3.05 367 285 A 16 LYS H A 16 LYS HGx 1.0 1.90 4.41 368 286 A 16 LYS HGy A 16 LYS HDx 1.0 1.80 2.88 369 286 A 16 LYS HDy A 16 LYS HGy 1.0 1.80 2.88 370 287 A 16 LYS HDy A 16 LYS HEx 1.0 1.80 2.76 371 287 A 16 LYS HDx A 16 LYS HEx 1.0 1.80 2.76 372 287 A 16 LYS HEy A 16 LYS HDx 1.0 1.80 2.76 373 287 A 16 LYS HDy A 16 LYS HEy 1.0 1.80 2.76 374 288 A 16 LYS H A 16 LYS HEx 1.0 1.80 5.24 375 288 A 16 LYS H A 16 LYS HEy 1.0 1.80 5.24 376 289 A 16 LYS HGx A 16 LYS HEx 1.0 1.80 3.81 377 289 A 16 LYS HGx A 16 LYS HEy 1.0 1.80 3.81 378 290 A 16 LYS H A 16 LYS HBx 1.0 1.80 3.46 379 291 A 16 LYS HA A 16 LYS HGx 1.0 1.80 3.07 380 292 A 16 LYS HEy A 16 LYS HBy 1.0 1.80 4.48 381 292 A 16 LYS HBy A 16 LYS HEx 1.0 1.80 4.48 382 293 A 16 LYS HEy A 16 LYS HBx 1.0 1.80 4.38 383 293 A 16 LYS HBx A 16 LYS HEx 1.0 1.80 4.38 384 294 A 16 LYS H A 16 LYS HBy 1.0 1.80 2.98 385 295 A 16 LYS H A 16 LYS HBy 1.0 1.80 3.45 386 295 A 16 LYS H A 16 LYS HBx 1.0 1.80 3.45 387 296 A 16 LYS HGy A 17 PHE HEx 1.0 1.80 4.83 388 296 A 16 LYS HGy A 17 PHE HEy 1.0 1.80 4.83 389 297 A 16 LYS HBx A 17 PHE HDx 1.0 1.80 4.68 390 298 A 16 LYS HA A 17 PHE HDx 1.0 1.80 4.12 391 298 A 16 LYS HA A 17 PHE HDy 1.0 1.80 4.12 392 299 A 16 LYS HBx A 17 PHE H 1.0 1.80 4.30 393 300 A 16 LYS HDy A 17 PHE H 1.0 1.80 5.43 394 300 A 17 PHE H A 16 LYS HDx 1.0 1.80 5.43 395 301 A 16 LYS HGx A 17 PHE HEx 1.0 1.80 4.93 396 302 A 16 LYS HBx A 17 PHE HEx 1.0 1.80 4.60 397 303 A 17 PHE HEx A 16 LYS HBy 1.0 1.80 4.43 398 304 A 17 PHE HEx A 16 LYS HDx 1.0 1.80 4.57 399 304 A 16 LYS HDy A 17 PHE HEx 1.0 1.80 4.57 400 305 A 17 PHE H A 16 LYS HBy 1.0 1.80 3.87 401 306 A 16 LYS HGy A 17 PHE HDx 1.0 1.80 4.11 402 306 A 16 LYS HGy A 17 PHE HDy 1.0 1.80 4.11 403 307 A 16 LYS HA A 19 GLU H 1.0 1.80 3.52 404 308 A 16 LYS H A 19 GLU HGy 1.0 1.80 5.15 405 309 A 16 LYS HA A 19 GLU HGx 1.0 1.80 3.93 406 310 A 16 LYS HA A 19 GLU HGy 1.0 1.80 3.39 407 311 A 16 LYS HA A 19 GLU HBy 1.0 1.80 3.60 408 312 A 17 PHE HEx A 17 PHE HA 1.0 1.80 5.11 409 313 A 17 PHE HBy A 17 PHE H 1.0 1.80 3.58 410 313 A 17 PHE H A 17 PHE HBx 1.0 1.80 3.58 411 314 A 17 PHE HEx A 17 PHE HBx 1.0 1.80 5.00 412 314 A 17 PHE HBy A 17 PHE HEx 1.0 1.80 5.00 413 315 A 17 PHE HBy A 18 MET H 1.0 1.80 3.91 414 315 A 18 MET H A 17 PHE HBx 1.0 1.80 3.91 415 316 A 19 GLU H A 17 PHE HBx 1.0 1.80 5.36 416 316 A 17 PHE HBy A 19 GLU H 1.0 1.80 5.36 417 317 A 17 PHE HA A 20 LYS HBy 1.0 1.80 4.49 418 318 A 17 PHE HA A 20 LYS HBx 1.0 1.80 4.64 419 319 A 17 PHE HA A 20 LYS H 1.0 1.80 4.26 420 320 A 122 VAL HB A 17 PHE HBx 1.0 1.60 5.50 421 320 A 17 PHE HBy A 122 VAL HB 1.0 1.60 5.50 422 321 A 17 PHE HA A 122 VAL HGx% 1.0 1.80 3.49 423 321 A 17 PHE HA A 122 VAL HGy% 1.0 1.80 3.49 424 322 A 17 PHE HBy A 122 VAL HGx% 1.0 1.80 3.77 425 322 A 17 PHE HBx A 122 VAL HGx% 1.0 1.80 3.77 426 322 A 122 VAL HGy% A 17 PHE HBx 1.0 1.80 3.77 427 322 A 17 PHE HBy A 122 VAL HGy% 1.0 1.80 3.77 428 323 A 17 PHE HA A 122 VAL HB 1.0 1.80 4.35 429 324 A 122 VAL HGy% A 17 PHE H 1.0 1.80 3.93 430 324 A 17 PHE H A 122 VAL HGx% 1.0 1.80 3.93 431 325 A 124 ALA HB% A 17 PHE HA 1.0 1.80 5.19 432 326 A 124 ALA HB% A 17 PHE H 1.0 1.80 4.47 433 327 A 124 ALA HB% A 17 PHE HBx 1.0 1.80 3.58 434 327 A 124 ALA HB% A 17 PHE HBy 1.0 1.80 3.58 435 328 A 18 MET HGx A 18 MET H 1.0 1.80 5.38 436 329 A 18 MET HGy A 18 MET H 1.0 1.80 3.67 437 330 A 19 GLU H A 18 MET HBx 1.0 1.80 4.78 438 330 A 18 MET HBy A 19 GLU H 1.0 1.80 4.78 439 331 A 18 MET H A 19 GLU H 1.0 1.80 3.97 440 332 A 18 MET HA A 21 MET HBx 1.0 1.80 4.74 441 332 A 18 MET HA A 21 MET HBy 1.0 1.80 4.74 442 333 A 18 MET HA A 21 MET H 1.0 1.80 4.61 443 334 A 18 MET HBy A 23 VAL H 1.0 1.80 5.24 444 334 A 23 VAL H A 18 MET HBx 1.0 1.80 5.24 445 335 A 23 VAL HGx% A 18 MET HBx 1.0 1.80 5.08 446 335 A 18 MET HBy A 23 VAL HGx% 1.0 1.80 5.08 447 336 A 28 ARG HDy A 18 MET HGy 1.0 1.80 4.45 448 337 A 18 MET HA A 28 ARG HGx 1.0 1.80 4.95 449 337 A 28 ARG HGy A 18 MET HA 1.0 1.80 4.95 450 338 A 18 MET HGx A 28 ARG HBx 1.0 1.80 3.54 451 339 A 18 MET HGx A 28 ARG HDx 1.0 1.80 4.50 452 340 A 18 MET HGy A 28 ARG HDx 1.0 1.80 5.00 453 341 A 18 MET HA A 28 ARG HBx 1.0 1.80 5.12 454 342 A 19 GLU HBy A 19 GLU H 1.0 1.80 3.14 455 343 A 19 GLU HGx A 19 GLU H 1.0 1.80 3.83 456 344 A 19 GLU HGy A 19 GLU HA 1.0 1.80 3.49 457 345 A 19 GLU HGy A 19 GLU H 1.0 1.80 3.68 458 346 A 19 GLU H A 20 LYS H 1.0 1.80 3.34 459 347 A 19 GLU HBy A 20 LYS H 1.0 1.80 3.74 460 348 A 19 GLU HGy A 20 LYS H 1.0 1.80 4.05 461 349 A 19 GLU HBx A 20 LYS H 1.0 1.80 4.48 462 350 A 19 GLU HA A 22 GLY HAy 1.0 1.80 5.40 463 351 A 19 GLU HA A 23 VAL H 1.0 1.80 4.09 464 352 A 20 LYS HA A 20 LYS HDy 1.0 1.80 3.27 465 353 A 20 LYS HGy A 20 LYS H 1.0 1.80 4.50 466 354 A 20 LYS HBy A 20 LYS H 1.0 1.80 3.56 467 355 A 20 LYS HA A 20 LYS HGx 1.0 1.80 4.16 468 356 A 20 LYS HBy A 20 LYS HDx 1.0 1.80 3.99 469 357 A 20 LYS HA A 20 LYS HEy 1.0 1.80 5.01 470 358 A 20 LYS HBx A 20 LYS H 1.0 1.80 3.32 471 359 A 20 LYS HA A 20 LYS HGy 1.0 1.80 3.71 472 360 A 20 LYS HGy A 20 LYS HEy 1.0 1.80 3.78 473 361 A 20 LYS HDy A 20 LYS H 1.0 1.80 5.18 474 362 A 20 LYS HBy A 21 MET H 1.0 1.80 4.48 475 363 A 20 LYS H A 21 MET H 1.0 1.80 3.59 476 364 A 20 LYS HGx A 119 TYR HDy 1.0 1.80 4.54 477 365 A 20 LYS HGy A 119 TYR HDy 1.0 1.80 4.93 478 366 A 20 LYS HBy A 119 TYR HDy 1.0 1.80 4.36 479 366 A 20 LYS HBy A 119 TYR HDx 1.0 1.80 4.36 480 367 A 20 LYS HA A 119 TYR HDy 1.0 1.80 5.00 481 367 A 20 LYS HA A 119 TYR HDx 1.0 1.80 5.00 482 368 A 20 LYS HDx A 119 TYR HDy 1.0 1.80 4.24 483 369 A 20 LYS HEy A 120 GLU HGy 1.0 1.80 5.50 484 370 A 20 LYS HEx A 120 GLU HBx 1.0 1.80 4.37 485 371 A 20 LYS HEy A 120 GLU HGx 1.0 1.80 5.38 486 372 A 20 LYS HEy A 120 GLU HBx 1.0 1.80 4.21 487 373 A 20 LYS HDx A 121 GLY HAx 1.0 1.80 5.04 488 374 A 20 LYS HEy A 122 VAL HGx% 1.0 1.80 3.99 489 374 A 122 VAL HGy% A 20 LYS HEy 1.0 1.80 3.99 490 375 A 122 VAL HGy% A 20 LYS H 1.0 1.80 5.04 491 375 A 20 LYS H A 122 VAL HGx% 1.0 1.80 5.04 492 376 A 20 LYS HEx A 122 VAL HGx% 1.0 1.80 4.13 493 376 A 122 VAL HGy% A 20 LYS HEx 1.0 1.80 4.13 494 377 A 20 LYS HDx A 122 VAL HGx% 1.0 1.80 3.66 495 377 A 122 VAL HGy% A 20 LYS HDx 1.0 1.80 3.66 496 378 A 122 VAL HB A 20 LYS HGx 1.0 1.80 5.50 497 379 A 20 LYS HA A 122 VAL HGx% 1.0 1.80 4.97 498 379 A 122 VAL HGy% A 20 LYS HA 1.0 1.80 4.97 499 380 A 20 LYS HDy A 122 VAL HGx% 1.0 1.80 4.40 500 380 A 122 VAL HGy% A 20 LYS HDy 1.0 1.80 4.40 501 381 A 20 LYS HEx A 122 VAL H 1.0 1.80 5.01 502 382 A 122 VAL HB A 20 LYS HGy 1.0 0.80 4.29 503 383 A 20 LYS HGy A 122 VAL HGx% 1.0 1.80 3.68 504 383 A 122 VAL HGy% A 20 LYS HGy 1.0 1.80 3.68 505 384 A 21 MET HA A 21 MET HGy 1.0 1.80 4.26 506 384 A 21 MET HA A 21 MET HGx 1.0 1.80 4.26 507 385 A 21 MET HGx A 21 MET H 1.0 1.80 4.72 508 385 A 21 MET H A 21 MET HGy 1.0 1.80 4.72 509 386 A 21 MET H A 22 GLY H 1.0 1.80 3.53 510 387 A 21 MET HGx A 22 GLY H 1.0 1.80 5.47 511 388 A 21 MET HBy A 23 VAL H 1.0 1.80 3.93 512 388 A 23 VAL H A 21 MET HBx 1.0 1.80 3.93 513 389 A 119 TYR HDy A 21 MET HA 1.0 1.80 5.50 514 389 A 21 MET HA A 119 TYR HDx 1.0 1.80 5.50 515 390 A 21 MET HBy A 119 TYR HEy 1.0 1.80 4.74 516 390 A 21 MET HBy A 119 TYR HEx 1.0 1.80 4.74 517 390 A 119 TYR HEx A 21 MET HBx 1.0 1.80 4.74 518 390 A 119 TYR HEy A 21 MET HBx 1.0 1.80 4.74 519 391 A 119 TYR HDy A 21 MET HA 1.0 1.80 4.65 520 391 A 21 MET HA A 119 TYR HDx 1.0 1.80 4.65 521 392 A 21 MET HA A 119 TYR HEy 1.0 1.80 3.62 522 392 A 21 MET HA A 119 TYR HEx 1.0 1.80 3.62 523 393 A 23 VAL HGy% A 22 GLY H 1.0 1.80 4.91 524 394 A 22 GLY H A 23 VAL H 1.0 1.80 4.74 525 395 A 23 VAL HGx% A 23 VAL HA 1.0 1.80 3.24 526 396 A 23 VAL HGy% A 23 VAL HA 1.0 1.80 3.66 527 397 A 23 VAL HGx% A 23 VAL H 1.0 1.80 3.96 528 398 A 23 VAL HB A 23 VAL H 1.0 1.80 3.73 529 399 A 23 VAL HGy% A 23 VAL H 1.0 1.80 3.39 530 400 A 23 VAL HB A 24 ASN H 1.0 1.80 5.18 531 401 A 23 VAL HGx% A 24 ASN H 1.0 1.80 3.80 532 402 A 23 VAL HGy% A 24 ASN H 1.0 1.80 4.92 533 403 A 23 VAL HA A 24 ASN H 1.0 1.80 3.22 534 404 A 24 ASN H A 23 VAL H 1.0 1.80 5.13 535 405 A 24 ASN H A 24 ASN HBy 1.0 1.80 3.35 536 406 A 24 ASN H A 24 ASN HBx 1.0 1.80 3.34 537 407 A 24 ASN HBy A 25 ILE HG2% 1.0 1.80 5.35 538 408 A 24 ASN HA A 25 ILE HA 1.0 1.80 4.98 539 409 A 24 ASN HBx A 25 ILE H 1.0 1.80 3.91 540 410 A 24 ASN HBy A 25 ILE H 1.0 1.80 3.56 541 411 A 24 ASN HA A 26 VAL H 1.0 1.80 5.10 542 412 A 25 ILE HG2% A 25 ILE HG1x 1.0 1.80 3.55 543 413 A 25 ILE HG2% A 25 ILE HG1y 1.0 1.80 4.07 544 414 A 25 ILE H A 25 ILE HB 1.0 1.80 2.90 545 415 A 25 ILE HA A 25 ILE HD1% 1.0 1.80 4.13 546 416 A 25 ILE HG2% A 25 ILE HA 1.0 1.80 3.61 547 417 A 25 ILE HG2% A 25 ILE H 1.0 1.80 3.17 548 418 A 25 ILE HA A 25 ILE HG1y 1.0 1.80 3.51 549 419 A 25 ILE H A 25 ILE HG1x 1.0 1.80 4.54 550 420 A 25 ILE HA A 25 ILE HG1x 1.0 1.80 3.99 551 421 A 25 ILE HB A 25 ILE HD1% 1.0 1.80 3.62 552 422 A 25 ILE H A 25 ILE HD1% 1.0 1.80 4.69 553 423 A 25 ILE HG2% A 26 VAL H 1.0 1.80 3.04 554 424 A 25 ILE HG2% A 26 VAL HB 1.0 1.80 4.93 555 425 A 26 VAL H A 25 ILE HB 1.0 1.80 3.89 556 426 A 26 VAL H A 25 ILE HD1% 1.0 1.80 4.98 557 427 A 26 VAL H A 25 ILE HG1x 1.0 1.80 5.29 558 428 A 25 ILE H A 26 VAL H 1.0 1.80 3.96 559 429 A 28 ARG HBx A 25 ILE H 1.0 1.80 5.19 560 430 A 25 ILE HA A 28 ARG HBy 1.0 1.80 3.81 561 431 A 28 ARG HBx A 25 ILE HA 1.0 1.80 4.00 562 432 A 25 ILE HD1% A 29 LYS HEx 1.0 1.80 4.58 563 432 A 25 ILE HD1% A 29 LYS HEy 1.0 1.80 4.58 564 433 A 25 ILE HG2% A 29 LYS HEx 1.0 1.80 3.90 565 433 A 25 ILE HG2% A 29 LYS HEy 1.0 1.80 3.90 566 434 A 25 ILE HD1% A 29 LYS HA 1.0 1.80 5.09 567 435 A 25 ILE HG1x A 29 LYS HEx 1.0 1.80 3.66 568 435 A 25 ILE HG1x A 29 LYS HEy 1.0 1.80 3.66 569 436 A 26 VAL HA A 26 VAL HGx% 1.0 1.80 2.99 570 437 A 26 VAL H A 26 VAL HGy% 1.0 1.80 3.44 571 438 A 26 VAL HA A 26 VAL HGy% 1.0 1.80 2.92 572 439 A 26 VAL H A 26 VAL HB 1.0 1.80 2.75 573 440 A 26 VAL HB A 27 LYS H 1.0 1.80 3.38 574 441 A 26 VAL HGy% A 27 LYS H 1.0 1.80 4.22 575 442 A 26 VAL H A 27 LYS H 1.0 1.80 3.66 576 443 A 26 VAL HA A 28 ARG H 1.0 1.80 4.60 577 444 A 26 VAL H A 28 ARG HBy 1.0 1.80 4.84 578 445 A 26 VAL HA A 29 LYS HBx 1.0 1.80 3.79 579 445 A 26 VAL HA A 29 LYS HBy 1.0 1.80 3.79 580 446 A 26 VAL HGx% A 29 LYS HDx 1.0 1.80 4.26 581 446 A 26 VAL HGx% A 29 LYS HDy 1.0 1.80 4.26 582 447 A 26 VAL HA A 29 LYS HDx 1.0 1.80 4.33 583 447 A 26 VAL HA A 29 LYS HDy 1.0 1.80 4.33 584 448 A 26 VAL HGx% A 29 LYS HEx 1.0 1.80 4.51 585 448 A 29 LYS HEy A 26 VAL HGx% 1.0 1.80 4.51 586 449 A 26 VAL HA A 29 LYS HGy 1.0 1.80 5.01 587 450 A 27 LYS H A 28 ARG H 1.0 1.80 3.90 588 451 A 28 ARG HBy A 27 LYS H 1.0 1.80 4.58 589 452 A 28 ARG HDy A 28 ARG HA 1.0 1.80 4.24 590 453 A 28 ARG HBy A 28 ARG H 1.0 1.80 3.96 591 454 A 28 ARG HDx A 28 ARG HA 1.0 1.80 5.29 592 455 A 28 ARG HDy A 28 ARG HBx 1.0 1.80 3.98 593 456 A 28 ARG HBy A 29 LYS H 1.0 1.80 3.54 594 457 A 28 ARG HDy A 31 ALA HB% 1.0 1.80 5.50 595 458 A 28 ARG HA A 31 ALA HB% 1.0 1.80 4.22 596 459 A 28 ARG HDx A 31 ALA HB% 1.0 1.80 5.02 597 460 A 28 ARG HBy A 31 ALA HB% 1.0 1.80 4.78 598 461 A 28 ARG HDy A 32 ALA H 1.0 1.80 4.16 599 462 A 28 ARG HDx A 32 ALA H 1.0 1.80 4.44 600 463 A 32 ALA HB% A 28 ARG HA 1.0 1.80 5.34 601 464 A 32 ALA HB% A 28 ARG HDy 1.0 1.80 5.50 602 465 A 29 LYS HBx A 29 LYS HEx 1.0 1.80 4.67 603 465 A 29 LYS HBy A 29 LYS HEx 1.0 1.80 4.67 604 465 A 29 LYS HEy A 29 LYS HBx 1.0 1.80 4.67 605 465 A 29 LYS HEy A 29 LYS HBy 1.0 1.80 4.67 606 466 A 29 LYS HDy A 29 LYS HEx 1.0 1.80 2.62 607 466 A 29 LYS HDx A 29 LYS HEx 1.0 1.80 2.62 608 466 A 29 LYS HEy A 29 LYS HDx 1.0 1.80 2.62 609 466 A 29 LYS HEy A 29 LYS HDy 1.0 1.80 2.62 610 467 A 29 LYS HGy A 29 LYS H 1.0 1.80 4.18 611 468 A 29 LYS HA A 29 LYS HGx 1.0 1.80 3.61 612 469 A 29 LYS HDy A 29 LYS H 1.0 1.80 4.23 613 469 A 29 LYS H A 29 LYS HDx 1.0 1.80 4.23 614 470 A 29 LYS HGx A 29 LYS HEx 1.0 1.80 3.48 615 470 A 29 LYS HEy A 29 LYS HGx 1.0 1.80 3.48 616 471 A 29 LYS HA A 29 LYS HBx 1.0 1.80 2.84 617 471 A 29 LYS HA A 29 LYS HBy 1.0 1.80 2.84 618 472 A 29 LYS HGy A 29 LYS HBx 1.0 1.80 2.74 619 472 A 29 LYS HBy A 29 LYS HGy 1.0 1.80 2.74 620 473 A 29 LYS HGy A 29 LYS HEx 1.0 1.80 3.68 621 473 A 29 LYS HEy A 29 LYS HGy 1.0 1.80 3.68 622 474 A 29 LYS HGx A 29 LYS H 1.0 1.80 4.93 623 475 A 29 LYS HBy A 29 LYS HDx 1.0 1.80 2.81 624 475 A 29 LYS HBx A 29 LYS HDx 1.0 1.80 2.81 625 475 A 29 LYS HDy A 29 LYS HBx 1.0 1.80 2.81 626 475 A 29 LYS HBy A 29 LYS HDy 1.0 1.80 2.81 627 476 A 29 LYS HA A 29 LYS HDx 1.0 1.80 3.72 628 476 A 29 LYS HA A 29 LYS HDy 1.0 1.80 3.72 629 477 A 29 LYS HGx A 29 LYS HDx 1.0 1.80 2.40 630 477 A 29 LYS HDy A 29 LYS HGx 1.0 1.80 2.40 631 478 A 29 LYS HBy A 29 LYS H 1.0 1.80 3.13 632 478 A 29 LYS H A 29 LYS HBx 1.0 1.80 3.13 633 479 A 30 LEU HA A 29 LYS HBx 1.0 1.80 4.94 634 479 A 29 LYS HBy A 30 LEU HA 1.0 1.80 4.94 635 480 A 29 LYS HA A 30 LEU HA 1.0 1.80 4.66 636 481 A 29 LYS HA A 30 LEU HG 1.0 1.80 5.10 637 482 A 30 LEU H A 29 LYS H 1.0 1.80 4.01 638 483 A 30 LEU HBx A 29 LYS HBx 1.0 1.80 5.28 639 483 A 29 LYS HBy A 30 LEU HBx 1.0 1.80 5.28 640 484 A 30 LEU H A 29 LYS HBx 1.0 1.80 3.48 641 484 A 29 LYS HBy A 30 LEU H 1.0 1.80 3.48 642 485 A 32 ALA HB% A 29 LYS HA 1.0 1.80 3.72 643 486 A 32 ALA HB% A 29 LYS HBx 1.0 1.80 5.44 644 486 A 32 ALA HB% A 29 LYS HBy 1.0 1.80 5.44 645 487 A 29 LYS HA A 32 ALA H 1.0 1.80 4.38 646 488 A 29 LYS H A 32 ALA H 1.0 1.80 4.61 647 489 A 30 LEU H A 30 LEU HBy 1.0 1.80 3.38 648 490 A 30 LEU HBx A 30 LEU HDx% 1.0 1.80 3.77 649 491 A 30 LEU HA A 30 LEU HDy% 1.0 1.80 3.92 650 492 A 30 LEU HA A 30 LEU HDx% 1.0 1.80 4.02 651 493 A 30 LEU H A 30 LEU HDy% 1.0 1.80 5.39 652 494 A 30 LEU HBy A 30 LEU HDx% 1.0 1.80 3.57 653 495 A 30 LEU HG A 30 LEU H 1.0 1.80 4.14 654 496 A 30 LEU H A 30 LEU HBx 1.0 1.80 3.67 655 497 A 30 LEU H A 30 LEU HDx% 1.0 1.80 5.49 656 498 A 31 ALA HB% A 30 LEU H 1.0 1.80 5.50 657 499 A 30 LEU HBy A 31 ALA H 1.0 1.80 4.23 658 500 A 30 LEU H A 31 ALA H 1.0 1.80 4.56 659 501 A 30 LEU HBx A 31 ALA H 1.0 1.80 5.24 660 502 A 32 ALA HB% A 30 LEU H 1.0 1.80 4.91 661 503 A 30 LEU H A 58 ILE HD1% 1.0 1.80 5.33 662 504 A 31 ALA HB% A 31 ALA H 1.0 1.80 3.07 663 505 A 31 ALA HA A 32 ALA H 1.0 1.80 3.52 664 506 A 31 ALA H A 32 ALA H 1.0 1.80 4.06 665 507 A 31 ALA HB% A 32 ALA H 1.0 1.80 4.59 666 508 A 32 ALA HB% A 32 ALA H 1.0 1.80 2.90 667 509 A 33 HIS H A 32 ALA H 1.0 1.80 3.43 668 510 A 32 ALA HB% A 33 HIS H 1.0 1.80 3.74 669 511 A 33 HIS HBx A 33 HIS H 1.0 1.80 3.75 670 512 A 33 HIS HA A 33 HIS HD2 1.0 1.80 4.39 671 513 A 33 HIS H A 34 ASP H 1.0 1.80 3.89 672 514 A 33 HIS HBy A 34 ASP H 1.0 1.80 5.26 673 515 A 33 HIS HBx A 34 ASP H 1.0 1.80 4.18 674 516 A 33 HIS HA A 34 ASP H 1.0 1.80 3.52 675 517 A 33 HIS HA A 35 ASN H 1.0 1.80 4.80 676 518 A 33 HIS H A 36 LEU H 1.0 1.80 5.08 677 519 A 33 HIS HA A 36 LEU H 1.0 1.80 5.04 678 520 A 34 ASP H A 35 ASN H 1.0 1.80 4.06 679 521 A 34 ASP H A 35 ASN HA 1.0 1.80 5.36 680 522 A 35 ASN H A 35 ASN HA 1.0 1.80 2.81 681 523 A 35 ASN H A 35 ASN HBy 1.0 1.80 4.01 682 524 A 36 LEU H A 35 ASN HBx 1.0 1.80 4.77 683 525 A 36 LEU H A 35 ASN HBy 1.0 1.80 4.93 684 526 A 35 ASN H A 36 LEU H 1.0 1.80 4.20 685 527 A 36 LEU H A 35 ASN HA 1.0 1.80 3.48 686 528 A 35 ASN HBx A 54 ALA H 1.0 1.80 4.15 687 529 A 35 ASN HBy A 54 ALA H 1.0 1.80 4.20 688 530 A 37 LYS HBy A 37 LYS HDx 1.0 1.80 2.84 689 530 A 37 LYS HBx A 37 LYS HDx 1.0 1.80 2.84 690 530 A 37 LYS HDy A 37 LYS HBx 1.0 1.80 2.84 691 530 A 37 LYS HDy A 37 LYS HBy 1.0 1.80 2.84 692 531 A 37 LYS HBy A 37 LYS HEx 1.0 1.80 3.80 693 531 A 37 LYS HEy A 37 LYS HBx 1.0 1.80 3.80 694 531 A 37 LYS HEy A 37 LYS HBy 1.0 1.80 3.80 695 531 A 37 LYS HBx A 37 LYS HEx 1.0 1.80 3.80 696 532 A 37 LYS HA A 37 LYS HEx 1.0 1.80 5.49 697 532 A 37 LYS HEy A 37 LYS HA 1.0 1.80 5.49 698 533 A 37 LYS HDy A 37 LYS H 1.0 1.80 5.20 699 533 A 37 LYS H A 37 LYS HDx 1.0 1.80 5.20 700 534 A 37 LYS HA A 37 LYS HDx 1.0 1.80 3.96 701 534 A 37 LYS HDy A 37 LYS HA 1.0 1.80 3.96 702 535 A 38 LEU H A 37 LYS HGx 1.0 1.80 4.55 703 535 A 37 LYS HGy A 38 LEU H 1.0 1.80 4.55 704 536 A 37 LYS HDy A 38 LEU H 1.0 1.80 4.85 705 536 A 38 LEU H A 37 LYS HDx 1.0 1.80 4.85 706 537 A 38 LEU HBy A 37 LYS H 1.0 1.80 5.09 707 538 A 38 LEU HBy A 37 LYS HBx 1.0 1.80 5.50 708 538 A 38 LEU HBy A 37 LYS HBy 1.0 1.80 5.50 709 539 A 38 LEU H A 37 LYS HBx 1.0 1.80 3.77 710 539 A 37 LYS HBy A 38 LEU H 1.0 1.80 3.77 711 540 A 37 LYS HA A 38 LEU H 1.0 1.80 2.87 712 541 A 37 LYS HA A 38 LEU HBx 1.0 1.80 4.84 713 542 A 39 THR H A 37 LYS HDx 1.0 1.80 4.24 714 542 A 37 LYS HDy A 39 THR H 1.0 1.80 4.24 715 543 A 38 LEU HBy A 38 LEU H 1.0 1.80 3.66 716 544 A 38 LEU HDx% A 38 LEU H 1.0 1.80 5.24 717 545 A 38 LEU HDy% A 38 LEU HA 1.0 1.80 5.13 718 546 A 38 LEU HBx A 38 LEU HDx% 1.0 1.80 3.75 719 547 A 38 LEU HBx A 38 LEU H 1.0 1.80 3.89 720 548 A 38 LEU HDx% A 38 LEU HA 1.0 1.80 3.72 721 549 A 38 LEU HDy% A 38 LEU HBx 1.0 1.80 4.03 722 550 A 38 LEU HBy A 38 LEU HDx% 1.0 1.80 3.89 723 551 A 38 LEU HDy% A 38 LEU HBy 1.0 1.80 3.89 724 552 A 38 LEU HBx A 39 THR H 1.0 1.80 4.81 725 553 A 38 LEU HA A 39 THR H 1.0 1.80 3.04 726 554 A 38 LEU HDx% A 39 THR H 1.0 1.80 4.79 727 555 A 40 ILE HD1% A 38 LEU HBx 1.0 1.80 5.33 728 556 A 38 LEU HDy% A 40 ILE HG1x 1.0 1.80 5.50 729 556 A 40 ILE HG1y A 38 LEU HDy% 1.0 1.80 5.50 730 557 A 40 ILE HD1% A 38 LEU HDy% 1.0 1.80 5.08 731 558 A 38 LEU HBx A 40 ILE HG1x 1.0 1.80 5.06 732 558 A 40 ILE HG1y A 38 LEU HBx 1.0 1.80 5.06 733 559 A 38 LEU HDx% A 51 GLU HBx 1.0 1.80 4.48 734 559 A 38 LEU HDx% A 51 GLU HBy 1.0 1.80 4.48 735 560 A 38 LEU HA A 51 GLU HA 1.0 1.80 4.02 736 561 A 38 LEU HDx% A 51 GLU HA 1.0 1.80 4.17 737 562 A 38 LEU HDx% A 51 GLU HGx 1.0 1.80 5.09 738 562 A 38 LEU HDx% A 51 GLU HGy 1.0 1.80 5.09 739 563 A 38 LEU H A 52 SER H 1.0 1.80 5.05 740 564 A 38 LEU HDx% A 52 SER H 1.0 1.80 5.18 741 565 A 38 LEU HDy% A 128 PHE HDx 1.0 1.80 5.35 742 566 A 38 LEU HBy A 128 PHE HDx 1.0 1.80 5.34 743 567 A 38 LEU HBx A 128 PHE HEx 1.0 1.80 4.06 744 567 A 38 LEU HBx A 128 PHE HEy 1.0 1.80 4.06 745 568 A 39 THR HG2% A 39 THR H 1.0 1.80 4.42 746 569 A 39 THR HA A 39 THR HG2% 1.0 1.80 3.29 747 570 A 39 THR HB A 39 THR H 1.0 1.80 3.48 748 571 A 39 THR HG2% A 40 ILE HA 1.0 1.80 5.47 749 572 A 39 THR HG2% A 40 ILE H 1.0 1.80 4.15 750 573 A 39 THR HA A 40 ILE H 1.0 1.80 3.21 751 574 A 40 ILE HB A 39 THR HG2% 1.0 1.80 5.50 752 575 A 39 THR HG2% A 50 LYS HBy 1.0 1.80 4.10 753 576 A 50 LYS HBy A 39 THR H 1.0 1.80 4.71 754 577 A 39 THR HB A 50 LYS HBy 1.0 1.80 3.56 755 578 A 39 THR HB A 50 LYS HBx 1.0 1.80 3.22 756 579 A 40 ILE HG2% A 40 ILE H 1.0 1.80 5.34 757 580 A 40 ILE HD1% A 40 ILE HG2% 1.0 1.80 3.56 758 581 A 40 ILE HG2% A 40 ILE HA 1.0 1.80 3.58 759 582 A 40 ILE HB A 40 ILE H 1.0 1.80 4.12 760 583 A 40 ILE HG2% A 40 ILE HG1x 1.0 1.80 4.18 761 583 A 40 ILE HG1y A 40 ILE HG2% 1.0 1.80 4.18 762 584 A 40 ILE HG1y A 40 ILE H 1.0 1.80 4.42 763 584 A 40 ILE H A 40 ILE HG1x 1.0 1.80 4.42 764 585 A 40 ILE HD1% A 41 THR H 1.0 1.80 5.41 765 586 A 40 ILE HA A 41 THR HB 1.0 1.80 5.11 766 587 A 40 ILE HA A 41 THR H 1.0 1.80 3.06 767 588 A 40 ILE HG2% A 41 THR H 1.0 1.80 3.89 768 589 A 40 ILE HG2% A 47 PHE HBy 1.0 1.80 4.67 769 590 A 40 ILE HG2% A 47 PHE HDy 1.0 1.80 3.54 770 590 A 40 ILE HG2% A 47 PHE HDx 1.0 1.80 3.54 771 591 A 40 ILE HG2% A 47 PHE HDy 1.0 1.80 4.63 772 592 A 40 ILE HG2% A 47 PHE HBx 1.0 1.80 4.13 773 593 A 40 ILE HG2% A 47 PHE HDx 1.0 1.80 5.16 774 594 A 40 ILE HA A 48 THR HB 1.0 1.80 5.09 775 595 A 40 ILE HG2% A 48 THR H 1.0 1.80 4.89 776 596 A 41 THR HB A 41 THR H 1.0 1.80 3.79 777 597 A 41 THR HG2% A 41 THR HA 1.0 1.80 3.45 778 598 A 41 THR HG2% A 41 THR H 1.0 1.80 4.41 779 599 A 41 THR HA A 42 GLN H 1.0 1.80 3.40 780 600 A 41 THR HG2% A 42 GLN H 1.0 1.80 4.46 781 601 A 41 THR HG2% A 43 GLU HGx 1.0 1.80 3.93 782 601 A 41 THR HG2% A 43 GLU HGy 1.0 1.80 3.93 783 602 A 41 THR HG2% A 48 THR HB 1.0 1.80 4.39 784 603 A 41 THR H A 48 THR H 1.0 1.80 4.24 785 604 A 48 THR HB A 41 THR H 1.0 1.80 4.57 786 605 A 43 GLU HGy A 43 GLU H 1.0 1.80 4.12 787 605 A 43 GLU H A 43 GLU HGx 1.0 1.80 4.12 788 606 A 43 GLU HBy A 43 GLU HGx 1.0 1.80 2.79 789 606 A 43 GLU HGy A 43 GLU HBy 1.0 1.80 2.79 790 607 A 43 GLU HA A 43 GLU HGx 1.0 1.80 3.74 791 607 A 43 GLU HGy A 43 GLU HA 1.0 1.80 3.74 792 608 A 43 GLU HBx A 43 GLU HGx 1.0 1.80 2.92 793 608 A 43 GLU HGy A 43 GLU HBx 1.0 1.80 2.92 794 609 A 43 GLU HA A 44 GLY H 1.0 1.80 2.79 795 610 A 43 GLU HA A 44 GLY HAx 1.0 1.80 4.57 796 611 A 43 GLU HBy A 44 GLY H 1.0 1.80 3.97 797 612 A 43 GLU HBx A 46 LYS HGx 1.0 1.80 4.13 798 613 A 43 GLU HBy A 46 LYS HDx 1.0 1.80 3.80 799 613 A 43 GLU HBy A 46 LYS HDy 1.0 1.80 3.80 800 614 A 46 LYS HGx A 43 GLU HGx 1.0 1.80 4.46 801 614 A 43 GLU HGy A 46 LYS HGx 1.0 1.80 4.46 802 615 A 44 GLY HAx A 45 ASN H 1.0 1.80 3.28 803 616 A 45 ASN H A 44 GLY HAy 1.0 2.30 3.78 804 617 A 44 GLY HAx A 46 LYS H 1.0 1.80 4.14 805 618 A 44 GLY HAy A 46 LYS H 1.0 1.80 4.87 806 619 A 45 ASN H A 45 ASN HBx 1.0 1.80 3.55 807 620 A 45 ASN H A 45 ASN HBy 1.0 1.80 3.89 808 621 A 45 ASN HBy A 46 LYS H 1.0 1.80 4.81 809 622 A 45 ASN H A 46 LYS HBx 1.0 1.80 4.41 810 623 A 45 ASN H A 46 LYS H 1.0 1.80 3.25 811 624 A 45 ASN HBx A 46 LYS H 1.0 1.80 4.55 812 625 A 45 ASN HBx A 63 GLU HGx 1.0 1.80 5.27 813 625 A 45 ASN HBx A 63 GLU HGy 1.0 1.80 5.27 814 626 A 45 ASN HBy A 63 GLU HGx 1.0 1.80 4.63 815 626 A 45 ASN HBy A 63 GLU HGy 1.0 1.80 4.63 816 627 A 45 ASN H A 63 GLU HGx 1.0 1.80 5.50 817 627 A 45 ASN H A 63 GLU HGy 1.0 1.80 5.50 818 628 A 45 ASN HBx A 64 LEU HDx% 1.0 1.80 4.96 819 629 A 45 ASN HBy A 64 LEU HBx 1.0 1.80 5.17 820 630 A 45 ASN HBy A 64 LEU HG 1.0 1.80 4.74 821 631 A 45 ASN HBx A 64 LEU HG 1.0 1.80 5.15 822 632 A 45 ASN HBy A 64 LEU HBy 1.0 1.80 5.04 823 633 A 45 ASN HBy A 64 LEU HDx% 1.0 1.80 4.34 824 634 A 45 ASN HBy A 64 LEU H 1.0 1.80 4.07 825 635 A 64 LEU HDx% A 45 ASN HA 1.0 1.80 3.83 826 636 A 45 ASN HA A 64 LEU H 1.0 1.80 4.95 827 637 A 64 LEU HG A 45 ASN HA 1.0 1.80 4.44 828 638 A 45 ASN HBx A 64 LEU H 1.0 1.80 5.03 829 639 A 46 LYS HGy A 46 LYS H 1.0 1.80 5.04 830 640 A 46 LYS HBx A 46 LYS H 1.0 1.80 3.30 831 641 A 46 LYS HBy A 46 LYS HEx 1.0 1.80 3.70 832 641 A 46 LYS HBy A 46 LYS HEy 1.0 1.80 3.70 833 642 A 46 LYS HGx A 46 LYS H 1.0 1.80 5.01 834 643 A 46 LYS HDy A 46 LYS H 1.0 1.80 5.22 835 643 A 46 LYS H A 46 LYS HDx 1.0 1.80 5.22 836 644 A 46 LYS HBy A 46 LYS H 1.0 2.32 3.95 837 645 A 46 LYS HGy A 46 LYS HDx 1.0 1.80 2.74 838 645 A 46 LYS HDy A 46 LYS HGy 1.0 1.80 2.74 839 646 A 46 LYS HBy A 46 LYS HDx 1.0 1.80 3.68 840 646 A 46 LYS HDy A 46 LYS HBy 1.0 1.80 3.68 841 647 A 46 LYS HBx A 46 LYS HEx 1.0 1.80 4.61 842 647 A 46 LYS HBx A 46 LYS HEy 1.0 1.80 4.61 843 648 A 46 LYS HBx A 47 PHE H 1.0 1.80 5.10 844 649 A 46 LYS HGy A 47 PHE H 1.0 1.80 4.92 845 650 A 46 LYS HGx A 47 PHE H 1.0 1.80 4.90 846 651 A 47 PHE HDy A 46 LYS HA 1.0 1.80 4.84 847 651 A 47 PHE HDx A 46 LYS HA 1.0 1.80 4.84 848 652 A 61 VAL HA A 46 LYS HDx 1.0 1.80 5.35 849 652 A 46 LYS HDy A 61 VAL HA 1.0 1.80 5.35 850 653 A 46 LYS HGy A 61 VAL HGy% 1.0 1.80 4.03 851 654 A 61 VAL HGx% A 46 LYS HEx 1.0 1.80 4.82 852 654 A 46 LYS HEy A 61 VAL HGx% 1.0 1.80 4.82 853 655 A 61 VAL HGy% A 46 LYS HDx 1.0 1.80 3.42 854 655 A 46 LYS HDy A 61 VAL HGy% 1.0 1.80 3.42 855 656 A 61 VAL HGy% A 46 LYS HEx 1.0 1.80 3.18 856 656 A 46 LYS HEy A 61 VAL HGy% 1.0 1.80 3.18 857 657 A 46 LYS HDy A 62 PHE H 1.0 1.80 5.02 858 657 A 62 PHE H A 46 LYS HDx 1.0 1.80 5.02 859 658 A 46 LYS HGx A 62 PHE H 1.0 1.80 5.14 860 659 A 46 LYS HBy A 62 PHE H 1.0 1.80 4.24 861 660 A 46 LYS HGy A 62 PHE H 1.0 1.80 5.27 862 661 A 46 LYS HGx A 63 GLU HA 1.0 1.80 5.48 863 662 A 46 LYS HEx A 63 GLU HGx 1.0 1.80 4.74 864 662 A 63 GLU HGy A 46 LYS HEx 1.0 1.80 4.74 865 662 A 63 GLU HGy A 46 LYS HEy 1.0 1.80 4.74 866 662 A 46 LYS HEy A 63 GLU HGx 1.0 1.80 4.74 867 663 A 46 LYS HGy A 63 GLU HGx 1.0 1.80 4.25 868 663 A 63 GLU HGy A 46 LYS HGy 1.0 1.80 4.25 869 664 A 46 LYS HGx A 63 GLU HGx 1.0 1.80 4.92 870 664 A 46 LYS HGx A 63 GLU HGy 1.0 1.80 4.92 871 665 A 46 LYS HBx A 63 GLU HGx 1.0 1.80 4.78 872 665 A 46 LYS HBx A 63 GLU HGy 1.0 1.80 4.78 873 666 A 46 LYS HBy A 63 GLU HA 1.0 1.80 3.75 874 667 A 46 LYS HA A 63 GLU HA 1.0 1.80 3.41 875 668 A 46 LYS HBy A 63 GLU HGx 1.0 1.80 3.13 876 668 A 63 GLU HGy A 46 LYS HBy 1.0 1.80 3.13 877 669 A 47 PHE HDy A 47 PHE H 1.0 1.80 5.50 878 669 A 47 PHE HDx A 47 PHE H 1.0 1.80 5.50 879 670 A 47 PHE HBx A 47 PHE HEy 1.0 1.80 5.41 880 671 A 47 PHE HBy A 48 THR H 1.0 1.80 4.08 881 672 A 47 PHE HA A 48 THR H 1.0 1.80 3.00 882 673 A 47 PHE HBx A 62 PHE H 1.0 1.80 4.73 883 674 A 63 GLU HA A 47 PHE H 1.0 1.80 4.56 884 675 A 47 PHE HDy A 64 LEU HG 1.0 1.80 4.66 885 675 A 47 PHE HDx A 64 LEU HG 1.0 1.80 4.66 886 676 A 64 LEU HG A 47 PHE H 1.0 1.80 4.98 887 677 A 64 LEU HDx% A 47 PHE HEy 1.0 1.80 4.06 888 677 A 64 LEU HDx% A 47 PHE HEx 1.0 1.80 4.06 889 678 A 47 PHE HEy A 64 LEU HDy% 1.0 1.80 4.84 890 679 A 64 LEU HDx% A 47 PHE HEx 1.0 1.80 4.59 891 680 A 64 LEU HDy% A 47 PHE HEx 1.0 1.80 4.63 892 681 A 64 LEU HG A 47 PHE HEy 1.0 1.80 4.81 893 681 A 64 LEU HG A 47 PHE HEx 1.0 1.80 4.81 894 682 A 47 PHE HDx A 64 LEU HG 1.0 1.80 5.24 895 683 A 64 LEU HG A 47 PHE HEx 1.0 1.80 4.89 896 684 A 64 LEU HDx% A 47 PHE HEy 1.0 1.80 4.76 897 685 A 48 THR HA A 48 THR HG2% 1.0 1.80 3.36 898 686 A 48 THR HG2% A 48 THR H 1.0 1.80 4.33 899 687 A 48 THR HB A 48 THR H 1.0 1.80 3.52 900 688 A 48 THR HA A 49 VAL H 1.0 1.80 3.20 901 689 A 48 THR HB A 49 VAL H 1.0 1.80 4.82 902 690 A 48 THR HB A 50 LYS H 1.0 1.80 5.20 903 691 A 61 VAL HGx% A 48 THR HA 1.0 1.80 4.34 904 692 A 48 THR HG2% A 61 VAL HB 1.0 1.80 5.04 905 693 A 61 VAL HGy% A 48 THR HA 1.0 1.80 4.52 906 694 A 61 VAL HA A 48 THR HG2% 1.0 1.80 4.76 907 695 A 61 VAL HA A 48 THR HA 1.0 1.80 3.98 908 696 A 48 THR HG2% A 62 PHE H 1.0 1.80 5.03 909 697 A 48 THR HA A 62 PHE H 1.0 1.80 4.23 910 698 A 49 VAL HGy% A 49 VAL H 1.0 1.80 4.27 911 699 A 49 VAL HB A 49 VAL H 1.0 1.80 3.87 912 700 A 49 VAL HGy% A 49 VAL HA 1.0 1.80 3.70 913 701 A 49 VAL HA A 50 LYS H 1.0 1.80 3.13 914 702 A 50 LYS HBy A 49 VAL HA 1.0 1.80 5.50 915 703 A 49 VAL HGy% A 59 GLU HA 1.0 1.80 4.99 916 704 A 49 VAL HB A 59 GLU HA 1.0 1.80 4.51 917 705 A 60 VAL HGy% A 49 VAL H 1.0 1.80 4.99 918 705 A 49 VAL H A 60 VAL HGx% 1.0 1.80 4.99 919 706 A 49 VAL HB A 60 VAL HGx% 1.0 1.80 5.03 920 706 A 49 VAL HB A 60 VAL HGy% 1.0 1.80 5.03 921 707 A 49 VAL HGy% A 60 VAL HA 1.0 1.80 5.50 922 708 A 49 VAL HGy% A 60 VAL HGx% 1.0 1.80 3.70 923 708 A 49 VAL HGy% A 60 VAL HGy% 1.0 1.80 3.70 924 709 A 61 VAL HA A 49 VAL H 1.0 1.80 4.71 925 710 A 50 LYS HBx A 50 LYS HEx 1.0 1.80 5.24 926 710 A 50 LYS HBx A 50 LYS HEy 1.0 1.80 5.24 927 711 A 50 LYS HBy A 50 LYS H 1.0 1.80 3.73 928 712 A 50 LYS HGy A 50 LYS H 1.0 1.80 4.41 929 713 A 50 LYS HA A 50 LYS HGx 1.0 1.80 3.96 930 714 A 50 LYS HGx A 50 LYS H 1.0 1.80 4.77 931 715 A 50 LYS HBy A 50 LYS HDx 1.0 1.80 3.76 932 715 A 50 LYS HBy A 50 LYS HDy 1.0 1.80 3.76 933 716 A 50 LYS HBx A 50 LYS H 1.0 1.80 3.48 934 717 A 50 LYS HGx A 50 LYS HDx 1.0 1.80 2.87 935 717 A 50 LYS HGx A 50 LYS HDy 1.0 1.80 2.87 936 718 A 50 LYS HA A 51 GLU H 1.0 1.80 3.01 937 719 A 51 GLU H A 50 LYS HDx 1.0 1.80 5.49 938 719 A 50 LYS HDy A 51 GLU H 1.0 1.80 5.49 939 720 A 50 LYS HBy A 51 GLU H 1.0 1.80 4.81 940 721 A 50 LYS HA A 60 VAL H 1.0 1.80 4.98 941 722 A 51 GLU HBy A 51 GLU H 1.0 1.80 3.63 942 722 A 51 GLU H A 51 GLU HBx 1.0 1.80 3.63 943 723 A 51 GLU HBy A 51 GLU HGx 1.0 1.80 2.97 944 723 A 51 GLU HBx A 51 GLU HGx 1.0 1.80 2.97 945 723 A 51 GLU HGy A 51 GLU HBx 1.0 1.80 2.97 946 723 A 51 GLU HBy A 51 GLU HGy 1.0 1.80 2.97 947 724 A 51 GLU HGy A 51 GLU H 1.0 1.80 5.14 948 724 A 51 GLU H A 51 GLU HGx 1.0 1.80 5.14 949 725 A 51 GLU HA A 52 SER H 1.0 1.80 3.26 950 726 A 52 SER H A 51 GLU HBx 1.0 1.80 4.78 951 726 A 51 GLU HBy A 52 SER H 1.0 1.80 4.78 952 727 A 58 ILE H A 51 GLU HBx 1.0 1.80 4.86 953 727 A 51 GLU HBy A 58 ILE H 1.0 1.80 4.86 954 728 A 51 GLU HBy A 58 ILE HG1x 1.0 1.80 4.50 955 728 A 51 GLU HBx A 58 ILE HG1x 1.0 1.80 4.50 956 728 A 58 ILE HG1y A 51 GLU HBx 1.0 1.80 4.50 957 728 A 51 GLU HBy A 58 ILE HG1y 1.0 1.80 4.50 958 729 A 58 ILE HG2% A 51 GLU HBx 1.0 1.80 4.64 959 729 A 51 GLU HBy A 58 ILE HG2% 1.0 1.80 4.64 960 730 A 58 ILE HG2% A 51 GLU H 1.0 1.80 5.50 961 731 A 58 ILE HD1% A 51 GLU HBx 1.0 1.80 4.84 962 731 A 58 ILE HD1% A 51 GLU HBy 1.0 1.80 4.84 963 732 A 58 ILE HG1y A 51 GLU H 1.0 1.80 5.35 964 732 A 51 GLU H A 58 ILE HG1x 1.0 1.80 5.35 965 733 A 51 GLU H A 58 ILE H 1.0 1.80 4.64 966 734 A 58 ILE HB A 51 GLU HBx 1.0 1.80 4.21 967 734 A 51 GLU HBy A 58 ILE HB 1.0 1.80 4.21 968 735 A 51 GLU H A 60 VAL H 1.0 1.80 5.03 969 736 A 54 ALA H A 54 ALA HB% 1.0 1.80 3.51 970 737 A 54 ALA HB% A 55 PHE H 1.0 1.80 4.78 971 738 A 54 ALA H A 55 PHE H 1.0 1.80 4.20 972 739 A 57 ASN HA A 57 ASN HBx 1.0 1.80 3.06 973 739 A 57 ASN HA A 57 ASN HBy 1.0 1.80 3.06 974 740 A 57 ASN H A 57 ASN HBx 1.0 1.80 3.50 975 740 A 57 ASN HBy A 57 ASN H 1.0 1.80 3.50 976 741 A 58 ILE H A 57 ASN HBx 1.0 1.80 3.93 977 741 A 57 ASN HBy A 58 ILE H 1.0 1.80 3.93 978 742 A 57 ASN HA A 58 ILE H 1.0 1.80 3.08 979 743 A 58 ILE HD1% A 58 ILE HB 1.0 1.80 3.52 980 744 A 58 ILE HG1y A 58 ILE H 1.0 1.80 4.48 981 744 A 58 ILE H A 58 ILE HG1x 1.0 1.80 4.48 982 745 A 58 ILE HG2% A 58 ILE HA 1.0 1.80 3.50 983 746 A 58 ILE HG2% A 58 ILE H 1.0 1.80 4.16 984 747 A 58 ILE HA A 58 ILE HG1x 1.0 1.80 4.17 985 747 A 58 ILE HG1y A 58 ILE HA 1.0 1.80 4.17 986 748 A 58 ILE HD1% A 58 ILE H 1.0 1.80 5.03 987 749 A 59 GLU H A 58 ILE HG1x 1.0 1.80 4.33 988 749 A 58 ILE HG1y A 59 GLU H 1.0 1.80 4.33 989 750 A 59 GLU HBy A 58 ILE H 1.0 1.80 4.60 990 750 A 58 ILE H A 59 GLU HBx 1.0 1.80 4.60 991 751 A 58 ILE HA A 59 GLU H 1.0 1.80 2.98 992 752 A 58 ILE HD1% A 59 GLU H 1.0 1.80 4.85 993 753 A 58 ILE HG2% A 59 GLU H 1.0 1.80 4.09 994 754 A 59 GLU H A 58 ILE H 1.0 1.80 5.00 995 755 A 59 GLU HA A 58 ILE HA 1.0 1.80 4.49 996 756 A 59 GLU H A 59 GLU HGy 1.0 1.80 4.12 997 756 A 59 GLU H A 59 GLU HGx 1.0 1.80 4.12 998 757 A 59 GLU HA A 59 GLU HGy 1.0 1.80 3.82 999 757 A 59 GLU HA A 59 GLU HGx 1.0 1.80 3.82 1000 758 A 60 VAL H A 59 GLU HGy 1.0 1.80 4.64 1001 759 A 60 VAL H A 59 GLU HBx 1.0 1.80 3.76 1002 759 A 59 GLU HBy A 60 VAL H 1.0 1.80 3.76 1003 760 A 60 VAL HA A 60 VAL HGx% 1.0 1.80 3.46 1004 760 A 60 VAL HGy% A 60 VAL HA 1.0 1.80 3.46 1005 761 A 60 VAL HGy% A 60 VAL H 1.0 1.80 3.69 1006 761 A 60 VAL H A 60 VAL HGx% 1.0 1.80 3.69 1007 762 A 60 VAL HB A 61 VAL H 1.0 1.80 4.91 1008 763 A 61 VAL H A 60 VAL H 1.0 1.80 5.12 1009 764 A 61 VAL H A 60 VAL HGx% 1.0 1.80 3.68 1010 764 A 60 VAL HGy% A 61 VAL H 1.0 1.80 3.68 1011 765 A 60 VAL HGy% A 62 PHE HDx 1.0 1.80 3.73 1012 765 A 62 PHE HDy A 60 VAL HGx% 1.0 1.80 3.73 1013 765 A 62 PHE HDx A 60 VAL HGx% 1.0 1.80 3.73 1014 765 A 60 VAL HGy% A 62 PHE HDy 1.0 1.80 3.73 1015 766 A 62 PHE HDx A 60 VAL HGx% 1.0 1.80 4.37 1016 766 A 60 VAL HGy% A 62 PHE HDx 1.0 1.80 4.37 1017 767 A 60 VAL HGx% A 62 PHE HBx 1.0 1.80 4.50 1018 767 A 60 VAL HGy% A 62 PHE HBx 1.0 1.80 4.50 1019 767 A 62 PHE HBy A 60 VAL HGx% 1.0 1.80 4.50 1020 767 A 60 VAL HGy% A 62 PHE HBy 1.0 1.80 4.50 1021 768 A 62 PHE HDy A 60 VAL HGx% 1.0 1.80 4.69 1022 768 A 60 VAL HGy% A 62 PHE HDy 1.0 1.80 4.69 1023 769 A 62 PHE HEx A 60 VAL HGx% 1.0 1.80 5.33 1024 769 A 60 VAL HGy% A 62 PHE HEx 1.0 1.80 5.33 1025 770 A 60 VAL HGy% A 62 PHE H 1.0 1.80 5.50 1026 770 A 62 PHE H A 60 VAL HGx% 1.0 1.80 5.50 1027 771 A 60 VAL HGy% A 68 PHE HEx 1.0 1.80 3.65 1028 771 A 60 VAL HGy% A 68 PHE HEy 1.0 1.80 3.65 1029 771 A 68 PHE HEy A 60 VAL HGx% 1.0 1.80 3.65 1030 771 A 68 PHE HEx A 60 VAL HGx% 1.0 1.80 3.65 1031 772 A 68 PHE HEy A 60 VAL HGx% 1.0 1.80 4.39 1032 772 A 60 VAL HGy% A 68 PHE HEy 1.0 1.80 4.39 1033 773 A 68 PHE HEx A 60 VAL HGx% 1.0 1.80 4.62 1034 773 A 60 VAL HGy% A 68 PHE HEx 1.0 1.80 4.62 1035 774 A 68 PHE HDx A 60 VAL HGx% 1.0 1.80 5.07 1036 774 A 60 VAL HGy% A 68 PHE HDx 1.0 1.80 5.07 1037 775 A 61 VAL HGx% A 61 VAL H 1.0 1.80 3.69 1038 776 A 61 VAL HA A 61 VAL HGx% 1.0 1.80 3.48 1039 777 A 61 VAL HGy% A 61 VAL H 1.0 1.80 4.47 1040 778 A 61 VAL HB A 61 VAL H 1.0 1.80 3.16 1041 779 A 61 VAL HA A 61 VAL HGy% 1.0 1.80 3.40 1042 780 A 61 VAL HGy% A 62 PHE H 1.0 1.80 3.49 1043 781 A 61 VAL HA A 62 PHE H 1.0 1.80 2.73 1044 782 A 61 VAL HGx% A 62 PHE H 1.0 1.80 4.28 1045 783 A 61 VAL HB A 62 PHE H 1.0 1.80 4.14 1046 784 A 62 PHE HDy A 62 PHE HA 1.0 1.80 4.72 1047 785 A 62 PHE HDx A 62 PHE HA 1.0 1.80 5.01 1048 786 A 62 PHE HDx A 62 PHE HA 1.0 1.80 4.79 1049 786 A 62 PHE HDy A 62 PHE HA 1.0 1.80 4.79 1050 787 A 63 GLU H A 62 PHE HBx 1.0 1.80 4.16 1051 787 A 62 PHE HBy A 63 GLU H 1.0 1.80 4.16 1052 788 A 62 PHE HA A 63 GLU HBx 1.0 1.80 4.58 1053 789 A 62 PHE HA A 63 GLU H 1.0 1.80 3.56 1054 790 A 62 PHE HDx A 82 TRP HBy 1.0 1.80 4.71 1055 790 A 62 PHE HDy A 82 TRP HBy 1.0 1.80 4.71 1056 790 A 62 PHE HDx A 82 TRP HBx 1.0 1.80 4.71 1057 790 A 62 PHE HDy A 82 TRP HBx 1.0 1.80 4.71 1058 791 A 62 PHE HA A 82 TRP HE3 1.0 1.80 5.50 1059 792 A 62 PHE HDx A 82 TRP HBx 1.0 1.80 5.14 1060 792 A 62 PHE HDx A 82 TRP HBy 1.0 1.80 5.14 1061 793 A 62 PHE HDy A 82 TRP HBx 1.0 1.80 5.13 1062 793 A 62 PHE HDy A 82 TRP HBy 1.0 1.80 5.13 1063 794 A 63 GLU HBy A 63 GLU HGx 1.0 1.80 2.63 1064 794 A 63 GLU HGy A 63 GLU HBy 1.0 1.80 2.63 1065 795 A 63 GLU H A 63 GLU HBx 1.0 1.80 3.77 1066 796 A 63 GLU HA A 63 GLU HGx 1.0 1.80 3.48 1067 796 A 63 GLU HGy A 63 GLU HA 1.0 1.80 3.48 1068 797 A 63 GLU H A 63 GLU HGx 1.0 1.80 4.47 1069 797 A 63 GLU HGy A 63 GLU H 1.0 1.80 4.47 1070 798 A 63 GLU HA A 64 LEU H 1.0 1.80 3.28 1071 799 A 64 LEU HG A 63 GLU HA 1.0 1.80 4.51 1072 800 A 64 LEU HBy A 63 GLU HA 1.0 1.80 4.71 1073 801 A 63 GLU H A 64 LEU H 1.0 1.80 5.18 1074 802 A 64 LEU H A 63 GLU HGx 1.0 1.80 4.33 1075 802 A 63 GLU HGy A 64 LEU H 1.0 1.80 4.33 1076 803 A 63 GLU HBy A 64 LEU H 1.0 1.80 4.64 1077 804 A 64 LEU HDx% A 63 GLU HA 1.0 1.80 5.47 1078 805 A 63 GLU H A 66 VAL HB 1.0 1.80 4.81 1079 806 A 63 GLU HA A 66 VAL HGx% 1.0 1.80 5.18 1080 806 A 63 GLU HA A 66 VAL HGy% 1.0 1.80 5.18 1081 807 A 63 GLU HBy A 66 VAL HB 1.0 1.80 3.62 1082 808 A 63 GLU HBx A 66 VAL HB 1.0 1.80 3.62 1083 809 A 64 LEU HG A 64 LEU H 1.0 1.80 3.66 1084 810 A 64 LEU HDx% A 64 LEU HA 1.0 1.80 4.92 1085 811 A 64 LEU HBy A 64 LEU H 1.0 1.80 3.97 1086 812 A 64 LEU HDx% A 64 LEU HBy 1.0 1.80 3.62 1087 813 A 64 LEU HDy% A 64 LEU H 1.0 1.80 4.47 1088 814 A 64 LEU HDx% A 64 LEU H 1.0 1.80 4.94 1089 815 A 64 LEU HDx% A 64 LEU HBx 1.0 1.80 3.58 1090 816 A 64 LEU HDy% A 64 LEU HA 1.0 1.80 3.60 1091 817 A 64 LEU HBx A 64 LEU HDy% 1.0 1.80 3.91 1092 818 A 64 LEU HDx% A 65 GLY H 1.0 1.80 5.32 1093 819 A 64 LEU HDy% A 65 GLY H 1.0 1.80 4.54 1094 820 A 64 LEU HBx A 65 GLY H 1.0 1.80 4.56 1095 821 A 64 LEU HBy A 65 GLY H 1.0 1.80 5.11 1096 822 A 64 LEU HA A 65 GLY H 1.0 1.80 3.20 1097 823 A 64 LEU HA A 66 VAL H 1.0 1.80 4.83 1098 824 A 64 LEU HA A 66 VAL HGx% 1.0 1.80 5.50 1099 824 A 66 VAL HGy% A 64 LEU HA 1.0 1.80 5.50 1100 825 A 64 LEU HDy% A 82 TRP HZ3 1.0 1.80 5.50 1101 826 A 64 LEU HDy% A 82 TRP HBx 1.0 1.80 4.06 1102 826 A 64 LEU HDy% A 82 TRP HBy 1.0 1.80 4.06 1103 827 A 64 LEU HBx A 83 SER HBx 1.0 1.80 4.84 1104 828 A 64 LEU HDy% A 83 SER HBx 1.0 1.80 5.10 1105 829 A 64 LEU HDx% A 84 LEU HDx% 1.0 1.80 5.31 1106 830 A 64 LEU HDy% A 84 LEU H 1.0 1.80 4.08 1107 831 A 64 LEU HDy% A 84 LEU HBx 1.0 1.80 4.30 1108 832 A 64 LEU HDx% A 84 LEU HBy 1.0 1.80 4.08 1109 833 A 64 LEU HDy% A 84 LEU HDx% 1.0 1.80 5.39 1110 834 A 64 LEU HDx% A 84 LEU H 1.0 1.80 4.21 1111 835 A 64 LEU HBx A 84 LEU H 1.0 1.80 5.23 1112 836 A 64 LEU HDy% A 84 LEU HBy 1.0 1.80 4.83 1113 837 A 64 LEU HDx% A 84 LEU HBx 1.0 1.80 3.98 1114 838 A 64 LEU HDx% A 84 LEU HG 1.0 1.80 4.91 1115 839 A 64 LEU HDx% A 85 GLU HA 1.0 1.80 5.50 1116 840 A 65 GLY HAy A 66 VAL HGx% 1.0 1.80 3.90 1117 840 A 66 VAL HGy% A 65 GLY HAy 1.0 1.80 3.90 1118 841 A 66 VAL HGy% A 65 GLY H 1.0 1.80 5.17 1119 841 A 65 GLY H A 66 VAL HGx% 1.0 1.80 5.17 1120 842 A 65 GLY HAx A 66 VAL HGx% 1.0 1.80 4.07 1121 842 A 66 VAL HGy% A 65 GLY HAx 1.0 1.80 4.07 1122 843 A 81 THR HB A 65 GLY H 1.0 1.80 4.48 1123 844 A 65 GLY HAx A 81 THR HG2% 1.0 1.80 4.43 1124 845 A 65 GLY H A 82 TRP H 1.0 1.80 4.00 1125 846 A 66 VAL HB A 66 VAL H 1.0 1.80 3.25 1126 847 A 66 VAL HA A 66 VAL HGx% 1.0 1.80 3.12 1127 847 A 66 VAL HGy% A 66 VAL HA 1.0 1.80 3.12 1128 848 A 66 VAL HA A 67 THR HB 1.0 1.80 4.31 1129 849 A 67 THR H A 66 VAL H 1.0 1.80 5.19 1130 850 A 66 VAL HA A 67 THR H 1.0 1.80 2.61 1131 851 A 66 VAL HB A 67 THR H 1.0 1.80 4.54 1132 852 A 67 THR HB A 67 THR H 1.0 1.80 2.95 1133 853 A 67 THR HA A 67 THR HG2% 1.0 1.80 3.46 1134 854 A 67 THR HA A 68 PHE H 1.0 1.80 2.94 1135 855 A 67 THR HG2% A 68 PHE H 1.0 1.80 3.54 1136 856 A 67 THR HG2% A 68 PHE HA 1.0 1.80 4.76 1137 857 A 67 THR HB A 68 PHE H 1.0 1.80 4.67 1138 858 A 67 THR HG2% A 79 ARG HDy 1.0 1.80 4.27 1139 859 A 67 THR HG2% A 79 ARG HDx 1.0 1.80 4.28 1140 860 A 67 THR HG2% A 79 ARG HA 1.0 1.80 4.65 1141 861 A 67 THR HG2% A 80 GLY HAy 1.0 1.80 4.23 1142 862 A 67 THR HG2% A 80 GLY H 1.0 1.80 3.74 1143 863 A 67 THR HA A 80 GLY H 1.0 1.80 4.36 1144 864 A 81 THR HG2% A 67 THR HG2% 1.0 1.80 4.18 1145 865 A 81 THR HG2% A 67 THR HB 1.0 1.80 4.00 1146 866 A 81 THR HG2% A 67 THR H 1.0 1.80 3.73 1147 867 A 81 THR HG2% A 67 THR HA 1.0 1.80 3.22 1148 868 A 68 PHE HDx A 68 PHE HA 1.0 1.80 4.52 1149 869 A 68 PHE HA A 68 PHE HDy 1.0 1.80 4.46 1150 870 A 68 PHE HDx A 68 PHE HA 1.0 1.80 3.90 1151 870 A 68 PHE HA A 68 PHE HDy 1.0 1.80 3.90 1152 871 A 68 PHE HBy A 69 ASN H 1.0 1.80 4.06 1153 872 A 68 PHE HA A 69 ASN H 1.0 1.80 3.06 1154 873 A 68 PHE HDx A 69 ASN H 1.0 1.80 4.22 1155 873 A 68 PHE HDy A 69 ASN H 1.0 1.80 4.22 1156 874 A 69 ASN H A 68 PHE HBx 1.0 1.80 3.44 1157 875 A 79 ARG HA A 68 PHE H 1.0 1.80 4.51 1158 876 A 68 PHE H A 80 GLY H 1.0 1.80 4.02 1159 877 A 81 THR HG2% A 68 PHE H 1.0 1.80 4.41 1160 878 A 69 ASN HBy A 70 TYR H 1.0 1.80 4.20 1161 878 A 70 TYR H A 69 ASN HBx 1.0 1.80 4.20 1162 879 A 69 ASN HA A 70 TYR H 1.0 1.80 3.42 1163 880 A 75 GLY HAx A 76 THR HB 1.0 1.80 4.39 1164 881 A 75 GLY H A 76 THR HG2% 1.0 1.80 4.79 1165 882 A 76 THR HB A 76 THR H 1.0 1.80 3.24 1166 883 A 77 GLU H A 76 THR H 1.0 1.80 4.50 1167 884 A 76 THR HG2% A 77 GLU H 1.0 1.80 4.15 1168 885 A 76 THR HB A 77 GLU H 1.0 1.80 4.00 1169 886 A 76 THR HG2% A 78 LEU HDx% 1.0 1.80 4.08 1170 887 A 76 THR HB A 78 LEU HDx% 1.0 1.80 4.35 1171 888 A 78 LEU HDx% A 76 THR H 1.0 1.80 5.41 1172 889 A 78 LEU HA A 78 LEU HDy% 1.0 1.80 3.79 1173 890 A 78 LEU HDx% A 78 LEU H 1.0 1.80 5.43 1174 891 A 78 LEU HDy% A 78 LEU H 1.0 1.80 5.15 1175 892 A 78 LEU HDx% A 78 LEU HA 1.0 1.80 5.01 1176 893 A 93 PHE HBx A 78 LEU HBx 1.0 1.80 4.86 1177 893 A 78 LEU HBy A 93 PHE HBx 1.0 1.80 4.86 1178 894 A 78 LEU HDy% A 93 PHE HBx 1.0 1.80 4.56 1179 895 A 93 PHE HBx A 78 LEU HG 1.0 1.80 5.16 1180 896 A 78 LEU HA A 93 PHE HBx 1.0 1.80 5.14 1181 897 A 93 PHE HDx A 78 LEU H 1.0 1.80 4.44 1182 897 A 93 PHE HDy A 78 LEU H 1.0 1.80 4.44 1183 898 A 78 LEU HG A 93 PHE HBy 1.0 1.80 4.36 1184 899 A 78 LEU HDx% A 93 PHE HBx 1.0 1.80 4.67 1185 900 A 78 LEU HDy% A 93 PHE HDy 1.0 1.80 5.50 1186 901 A 78 LEU HDy% A 93 PHE HBy 1.0 1.80 4.48 1187 902 A 78 LEU HA A 94 LYS H 1.0 1.80 4.63 1188 903 A 78 LEU HDy% A 94 LYS H 1.0 1.80 5.25 1189 904 A 78 LEU HDy% A 95 ARG HBy 1.0 1.80 5.50 1190 904 A 78 LEU HDy% A 95 ARG HBx 1.0 1.80 5.50 1191 905 A 78 LEU HDy% A 95 ARG HGy 1.0 1.80 4.03 1192 906 A 78 LEU HDy% A 95 ARG HDx 1.0 1.80 5.50 1193 906 A 78 LEU HDy% A 95 ARG HDy 1.0 1.80 5.50 1194 907 A 78 LEU HDx% A 95 ARG HA 1.0 1.80 5.40 1195 908 A 78 LEU HA A 95 ARG HA 1.0 1.80 4.73 1196 909 A 78 LEU HG A 95 ARG HA 1.0 1.80 4.22 1197 910 A 78 LEU HDy% A 95 ARG HA 1.0 1.80 3.82 1198 911 A 78 LEU HDy% A 95 ARG H 1.0 1.80 5.26 1199 912 A 78 LEU HDx% A 96 THR H 1.0 1.80 5.50 1200 913 A 78 LEU HDy% A 102 LEU H 1.0 1.80 5.42 1201 914 A 78 LEU HDx% A 102 LEU HDx% 1.0 1.80 4.81 1202 915 A 78 LEU HDy% A 102 LEU HBy 1.0 1.80 4.81 1203 916 A 78 LEU HDx% A 102 LEU HG 1.0 1.80 5.50 1204 917 A 78 LEU HDx% A 102 LEU HDy% 1.0 1.80 4.18 1205 918 A 78 LEU HDy% A 102 LEU HBx 1.0 1.80 4.16 1206 919 A 78 LEU HDy% A 102 LEU HDy% 1.0 1.80 4.20 1207 920 A 78 LEU HDy% A 102 LEU HDx% 1.0 1.80 4.88 1208 921 A 79 ARG HA A 79 ARG HGx 1.0 1.80 4.16 1209 921 A 79 ARG HA A 79 ARG HGy 1.0 1.80 4.16 1210 922 A 79 ARG HDy A 79 ARG HBx 1.0 1.80 3.31 1211 922 A 79 ARG HDy A 79 ARG HBy 1.0 1.80 3.31 1212 923 A 79 ARG HDx A 79 ARG HBx 1.0 1.80 3.48 1213 923 A 79 ARG HDx A 79 ARG HBy 1.0 1.80 3.48 1214 924 A 79 ARG HBx A 79 ARG HGx 1.0 1.80 2.85 1215 924 A 79 ARG HBy A 79 ARG HGx 1.0 1.80 2.85 1216 924 A 79 ARG HGy A 79 ARG HBx 1.0 1.80 2.85 1217 924 A 79 ARG HGy A 79 ARG HBy 1.0 1.80 2.85 1218 925 A 79 ARG HDx A 79 ARG HA 1.0 1.80 5.05 1219 926 A 80 GLY H A 79 ARG HBx 1.0 1.80 3.85 1220 926 A 79 ARG HBy A 80 GLY H 1.0 1.80 3.85 1221 927 A 79 ARG HA A 80 GLY H 1.0 1.80 3.08 1222 928 A 79 ARG HGy A 80 GLY H 1.0 1.80 4.78 1223 928 A 80 GLY H A 79 ARG HGx 1.0 1.80 4.78 1224 929 A 80 GLY HAy A 79 ARG HBx 1.0 1.80 5.13 1225 929 A 80 GLY HAy A 79 ARG HBy 1.0 1.80 5.13 1226 930 A 79 ARG HA A 93 PHE HDx 1.0 1.80 5.17 1227 931 A 93 PHE HDy A 79 ARG HBx 1.0 1.80 4.72 1228 931 A 93 PHE HDx A 79 ARG HBx 1.0 1.80 4.72 1229 931 A 93 PHE HDy A 79 ARG HBy 1.0 1.80 4.72 1230 931 A 79 ARG HBy A 93 PHE HDx 1.0 1.80 4.72 1231 932 A 79 ARG HA A 93 PHE HBx 1.0 1.80 5.30 1232 933 A 79 ARG HBy A 94 LYS HBx 1.0 1.80 2.99 1233 933 A 79 ARG HBx A 94 LYS HBx 1.0 1.80 2.99 1234 933 A 94 LYS HBy A 79 ARG HBx 1.0 1.80 2.99 1235 933 A 79 ARG HBy A 94 LYS HBy 1.0 1.80 2.99 1236 934 A 79 ARG HBy A 94 LYS H 1.0 1.80 4.76 1237 934 A 94 LYS H A 79 ARG HBx 1.0 1.80 4.76 1238 935 A 79 ARG HGy A 94 LYS H 1.0 1.80 5.44 1239 935 A 94 LYS H A 79 ARG HGx 1.0 1.80 5.44 1240 936 A 80 GLY HAy A 81 THR H 1.0 1.80 3.57 1241 937 A 81 THR HG2% A 80 GLY HAy 1.0 1.80 4.67 1242 938 A 80 GLY HAy A 93 PHE HA 1.0 1.80 3.90 1243 939 A 93 PHE HDx A 80 GLY H 1.0 1.80 4.76 1244 939 A 93 PHE HDy A 80 GLY H 1.0 1.80 4.76 1245 940 A 93 PHE HA A 80 GLY H 1.0 1.80 4.27 1246 941 A 80 GLY H A 94 LYS H 1.0 1.80 4.43 1247 942 A 80 GLY HAx A 94 LYS H 1.0 1.80 4.10 1248 943 A 81 THR HG2% A 81 THR HA 1.0 1.80 3.79 1249 944 A 81 THR HG2% A 81 THR H 1.0 1.80 3.44 1250 945 A 81 THR HA A 82 TRP HA 1.0 1.80 5.20 1251 946 A 81 THR HG2% A 82 TRP H 1.0 1.80 4.52 1252 947 A 81 THR HA A 82 TRP H 1.0 1.80 3.39 1253 948 A 81 THR HA A 82 TRP HBx 1.0 1.80 4.04 1254 948 A 82 TRP HBy A 81 THR HA 1.0 1.80 4.04 1255 949 A 81 THR HB A 82 TRP H 1.0 1.80 3.54 1256 950 A 92 LYS HBx A 81 THR H 1.0 1.80 5.23 1257 951 A 81 THR H A 92 LYS H 1.0 1.80 4.18 1258 952 A 93 PHE HA A 81 THR H 1.0 1.80 4.63 1259 953 A 82 TRP HBy A 82 TRP H 1.0 1.80 3.81 1260 953 A 82 TRP H A 82 TRP HBx 1.0 1.80 3.81 1261 954 A 82 TRP HE3 A 82 TRP HA 1.0 1.80 5.50 1262 955 A 83 SER H A 82 TRP HBx 1.0 1.80 3.95 1263 955 A 82 TRP HBy A 83 SER H 1.0 1.80 3.95 1264 956 A 82 TRP HA A 83 SER H 1.0 1.80 3.13 1265 957 A 82 TRP HZ3 A 84 LEU HDx% 1.0 1.80 4.78 1266 958 A 82 TRP HE3 A 84 LEU HDx% 1.0 1.80 4.04 1267 959 A 82 TRP HA A 90 ILE HB 1.0 1.80 5.07 1268 960 A 82 TRP HA A 90 ILE HG2% 1.0 1.80 5.50 1269 961 A 82 TRP HA A 91 GLY HAx 1.0 1.80 3.88 1270 962 A 82 TRP HA A 91 GLY HAy 1.0 1.80 4.84 1271 963 A 82 TRP HA A 91 GLY H 1.0 1.80 4.40 1272 964 A 91 GLY HAx A 82 TRP H 1.0 1.80 5.01 1273 965 A 82 TRP HA A 92 LYS H 1.0 1.80 4.28 1274 966 A 84 LEU H A 83 SER H 1.0 1.80 5.14 1275 967 A 83 SER HBx A 84 LEU H 1.0 1.80 3.49 1276 968 A 89 LEU HA A 83 SER H 1.0 1.80 4.88 1277 969 A 83 SER HBx A 90 ILE HD1% 1.0 1.80 5.10 1278 970 A 83 SER H A 90 ILE H 1.0 1.80 3.91 1279 971 A 90 ILE HB A 83 SER H 1.0 1.80 4.42 1280 972 A 90 ILE HG2% A 83 SER H 1.0 1.80 5.41 1281 973 A 83 SER HBx A 90 ILE HB 1.0 1.80 4.37 1282 974 A 90 ILE HG2% A 83 SER HBy 1.0 1.80 5.50 1283 975 A 91 GLY HAx A 83 SER H 1.0 1.80 4.87 1284 976 A 84 LEU HDx% A 84 LEU HA 1.0 1.80 4.54 1285 977 A 84 LEU H A 84 LEU HBx 1.0 1.80 3.53 1286 978 A 84 LEU H A 84 LEU HDy% 1.0 1.80 5.29 1287 979 A 84 LEU H A 84 LEU HBy 1.0 1.80 3.25 1288 980 A 84 LEU HDx% A 84 LEU HBy 1.0 1.80 3.71 1289 981 A 84 LEU HBx A 84 LEU HDy% 1.0 1.80 4.23 1290 982 A 84 LEU HDx% A 84 LEU H 1.0 1.80 5.50 1291 983 A 84 LEU HA A 84 LEU HDy% 1.0 1.80 4.02 1292 984 A 84 LEU H A 84 LEU HG 1.0 1.80 4.56 1293 985 A 84 LEU HDx% A 84 LEU HBx 1.0 1.80 4.05 1294 986 A 84 LEU HA A 85 GLU HBy 1.0 1.80 5.17 1295 987 A 84 LEU HDy% A 85 GLU H 1.0 1.80 3.95 1296 988 A 84 LEU HA A 85 GLU H 1.0 1.80 2.92 1297 989 A 84 LEU HBx A 85 GLU HGx 1.0 1.80 5.50 1298 989 A 84 LEU HBx A 85 GLU HGy 1.0 1.80 5.50 1299 990 A 84 LEU HBy A 85 GLU H 1.0 1.80 4.38 1300 991 A 84 LEU HDx% A 85 GLU H 1.0 1.80 5.44 1301 992 A 84 LEU HG A 85 GLU H 1.0 1.80 3.88 1302 993 A 84 LEU HBx A 85 GLU H 1.0 1.80 4.46 1303 994 A 84 LEU HDy% A 87 ASN HA 1.0 1.80 4.60 1304 995 A 84 LEU HDy% A 88 LYS H 1.0 1.80 4.29 1305 996 A 84 LEU HDy% A 88 LYS HA 1.0 1.80 5.50 1306 997 A 89 LEU HA A 84 LEU HDy% 1.0 1.80 5.43 1307 998 A 89 LEU HA A 84 LEU HA 1.0 1.80 4.23 1308 999 A 84 LEU HBx A 89 LEU HA 1.0 1.80 4.74 1309 1000 A 84 LEU HG A 89 LEU HBx 1.0 1.80 5.47 1310 1001 A 84 LEU HDx% A 89 LEU HBx 1.0 1.80 4.50 1311 1002 A 84 LEU HDy% A 90 ILE H 1.0 1.80 5.50 1312 1003 A 84 LEU HA A 90 ILE H 1.0 1.80 4.15 1313 1004 A 85 GLU HGy A 85 GLU H 1.0 1.80 4.01 1314 1004 A 85 GLU H A 85 GLU HGx 1.0 1.80 4.01 1315 1005 A 85 GLU HBy A 85 GLU HGx 1.0 1.80 2.60 1316 1005 A 85 GLU HBy A 85 GLU HGy 1.0 1.80 2.60 1317 1006 A 85 GLU HA A 85 GLU HGx 1.0 1.80 3.49 1318 1006 A 85 GLU HA A 85 GLU HGy 1.0 1.80 3.49 1319 1007 A 85 GLU HBx A 85 GLU H 1.0 1.80 3.76 1320 1008 A 85 GLU HBx A 85 GLU HGx 1.0 1.80 2.85 1321 1008 A 85 GLU HGy A 85 GLU HBx 1.0 1.80 2.85 1322 1009 A 85 GLU HBy A 85 GLU H 1.0 1.80 3.78 1323 1010 A 86 GLY H A 85 GLU HGx 1.0 1.80 4.68 1324 1010 A 85 GLU HGy A 86 GLY H 1.0 1.80 4.68 1325 1011 A 85 GLU HBy A 86 GLY H 1.0 1.80 4.71 1326 1012 A 85 GLU HA A 86 GLY HAx 1.0 1.80 4.80 1327 1013 A 85 GLU HA A 86 GLY H 1.0 1.80 2.80 1328 1014 A 85 GLU H A 88 LYS H 1.0 1.80 3.75 1329 1015 A 90 ILE HG1x A 85 GLU HGx 1.0 1.80 4.67 1330 1015 A 85 GLU HGy A 90 ILE HG1x 1.0 1.80 4.67 1331 1016 A 90 ILE HG1y A 85 GLU HGx 1.0 1.80 4.40 1332 1016 A 85 GLU HGy A 90 ILE HG1y 1.0 1.80 4.40 1333 1017 A 90 ILE HD1% A 85 GLU HBx 1.0 1.80 4.05 1334 1018 A 90 ILE HG2% A 85 GLU HGx 1.0 1.80 5.27 1335 1018 A 90 ILE HG2% A 85 GLU HGy 1.0 1.80 5.27 1336 1019 A 90 ILE HD1% A 85 GLU HBy 1.0 1.80 3.72 1337 1020 A 90 ILE HB A 85 GLU HGx 1.0 1.80 4.69 1338 1020 A 90 ILE HB A 85 GLU HGy 1.0 1.80 4.69 1339 1021 A 90 ILE HD1% A 85 GLU H 1.0 1.80 5.36 1340 1022 A 90 ILE HD1% A 85 GLU HGx 1.0 1.80 3.88 1341 1022 A 90 ILE HD1% A 85 GLU HGy 1.0 1.80 3.88 1342 1023 A 86 GLY HAx A 87 ASN H 1.0 1.80 3.36 1343 1024 A 87 ASN H A 86 GLY HAy 1.0 1.80 3.34 1344 1025 A 87 ASN HA A 86 GLY H 1.0 1.80 5.50 1345 1026 A 87 ASN HA A 86 GLY HAy 1.0 1.80 4.88 1346 1027 A 87 ASN HA A 86 GLY HAx 1.0 1.80 4.46 1347 1028 A 86 GLY HAx A 88 LYS H 1.0 1.80 4.79 1348 1029 A 86 GLY HAy A 88 LYS H 1.0 1.80 3.95 1349 1030 A 87 ASN HBy A 88 LYS HDx 1.0 1.80 4.68 1350 1030 A 87 ASN HBy A 88 LYS HDy 1.0 1.80 4.68 1351 1031 A 87 ASN H A 88 LYS HBx 1.0 1.80 5.01 1352 1031 A 87 ASN H A 88 LYS HBy 1.0 1.80 5.01 1353 1032 A 87 ASN H A 88 LYS HEx 1.0 1.80 4.67 1354 1032 A 87 ASN H A 88 LYS HEy 1.0 1.80 4.67 1355 1033 A 87 ASN HA A 88 LYS H 1.0 1.80 3.65 1356 1034 A 87 ASN HA A 88 LYS HA 1.0 1.80 5.26 1357 1035 A 87 ASN HBx A 88 LYS H 1.0 1.80 5.08 1358 1036 A 87 ASN H A 88 LYS H 1.0 1.80 3.19 1359 1037 A 88 LYS HBy A 88 LYS H 1.0 1.80 3.30 1360 1037 A 88 LYS H A 88 LYS HBx 1.0 1.80 3.30 1361 1038 A 88 LYS HA A 89 LEU H 1.0 1.80 3.39 1362 1039 A 88 LYS HBy A 89 LEU H 1.0 1.80 4.53 1363 1039 A 89 LEU H A 88 LYS HBx 1.0 1.80 4.53 1364 1040 A 90 ILE HD1% A 88 LYS HEx 1.0 1.80 4.03 1365 1040 A 90 ILE HD1% A 88 LYS HEy 1.0 1.80 4.03 1366 1041 A 90 ILE HD1% A 88 LYS H 1.0 1.80 5.11 1367 1042 A 88 LYS HBy A 106 ARG H 1.0 1.80 5.29 1368 1042 A 106 ARG H A 88 LYS HBx 1.0 1.80 5.29 1369 1043 A 89 LEU HBx A 89 LEU H 1.0 1.80 3.75 1370 1044 A 89 LEU HG A 89 LEU H 1.0 1.80 5.07 1371 1045 A 89 LEU HA A 89 LEU HG 1.0 1.80 3.89 1372 1046 A 90 ILE HD1% A 89 LEU HDx% 1.0 1.80 5.20 1373 1047 A 90 ILE HD1% A 89 LEU H 1.0 1.80 4.72 1374 1048 A 89 LEU H A 90 ILE H 1.0 1.80 5.30 1375 1049 A 89 LEU HA A 90 ILE H 1.0 1.80 2.94 1376 1050 A 89 LEU HG A 90 ILE H 1.0 1.80 5.30 1377 1051 A 89 LEU H A 106 ARG H 1.0 1.80 4.22 1378 1052 A 113 LEU HDx% A 89 LEU HDx% 1.0 1.80 5.05 1379 1053 A 113 LEU HDx% A 89 LEU HG 1.0 1.80 4.98 1380 1054 A 90 ILE HG1y A 90 ILE H 1.0 1.80 4.19 1381 1055 A 90 ILE HD1% A 90 ILE H 1.0 1.80 4.15 1382 1056 A 90 ILE HB A 90 ILE H 1.0 1.80 3.24 1383 1057 A 90 ILE HB A 90 ILE HD1% 1.0 1.80 3.42 1384 1058 A 90 ILE HG2% A 90 ILE HA 1.0 1.80 3.41 1385 1059 A 90 ILE HG1x A 90 ILE H 1.0 1.80 3.93 1386 1060 A 90 ILE HG2% A 90 ILE HG1y 1.0 1.80 3.52 1387 1061 A 90 ILE HG2% A 91 GLY HAy 1.0 1.80 5.23 1388 1062 A 90 ILE HG2% A 91 GLY HAx 1.0 1.80 4.91 1389 1063 A 90 ILE HG2% A 91 GLY H 1.0 1.80 3.65 1390 1064 A 90 ILE HA A 91 GLY H 1.0 1.80 3.09 1391 1065 A 90 ILE HD1% A 92 LYS HEx 1.0 1.80 5.21 1392 1065 A 90 ILE HD1% A 92 LYS HEy 1.0 1.80 5.21 1393 1066 A 90 ILE HG2% A 92 LYS HGx 1.0 1.80 4.09 1394 1066 A 90 ILE HG2% A 92 LYS HGy 1.0 1.80 4.09 1395 1067 A 90 ILE HB A 92 LYS HDx 1.0 1.80 3.96 1396 1067 A 90 ILE HB A 92 LYS HDy 1.0 1.80 3.96 1397 1068 A 90 ILE HG2% A 92 LYS HEx 1.0 1.80 4.03 1398 1068 A 90 ILE HG2% A 92 LYS HEy 1.0 1.80 4.03 1399 1069 A 90 ILE HG2% A 103 ASN HA 1.0 1.80 4.98 1400 1070 A 90 ILE HG2% A 104 THR HA 1.0 1.80 4.52 1401 1071 A 90 ILE HG2% A 104 THR H 1.0 1.80 4.55 1402 1072 A 90 ILE HG2% A 105 VAL HA 1.0 1.80 4.35 1403 1073 A 90 ILE HG2% A 105 VAL HGx% 1.0 1.80 3.38 1404 1073 A 90 ILE HG2% A 105 VAL HGy% 1.0 1.80 3.38 1405 1074 A 90 ILE HA A 105 VAL HA 1.0 1.80 4.00 1406 1075 A 90 ILE HA A 105 VAL HGx% 1.0 1.80 4.02 1407 1075 A 90 ILE HA A 105 VAL HGy% 1.0 1.80 4.02 1408 1076 A 90 ILE H A 106 ARG H 1.0 1.80 5.38 1409 1077 A 91 GLY HAx A 92 LYS H 1.0 1.80 3.51 1410 1078 A 92 LYS HEy A 91 GLY H 1.0 1.80 4.96 1411 1078 A 91 GLY H A 92 LYS HEx 1.0 1.80 4.96 1412 1079 A 91 GLY HAy A 104 THR H 1.0 1.80 5.14 1413 1080 A 91 GLY H A 104 THR H 1.0 1.80 4.63 1414 1081 A 105 VAL HA A 91 GLY H 1.0 1.80 3.84 1415 1082 A 105 VAL HGy% A 91 GLY H 1.0 1.80 4.39 1416 1082 A 91 GLY H A 105 VAL HGx% 1.0 1.80 4.39 1417 1083 A 92 LYS HBx A 92 LYS HGx 1.0 1.80 2.95 1418 1083 A 92 LYS HBx A 92 LYS HGy 1.0 1.80 2.95 1419 1084 A 92 LYS HBy A 92 LYS HEx 1.0 1.80 4.49 1420 1084 A 92 LYS HEy A 92 LYS HBy 1.0 1.80 4.49 1421 1085 A 92 LYS HGy A 92 LYS H 1.0 1.80 4.58 1422 1086 A 92 LYS HBx A 92 LYS H 1.0 1.80 3.75 1423 1087 A 92 LYS HBx A 92 LYS HEx 1.0 1.80 4.36 1424 1087 A 92 LYS HBx A 92 LYS HEy 1.0 1.80 4.36 1425 1088 A 92 LYS HBy A 92 LYS H 1.0 1.80 4.08 1426 1089 A 92 LYS HEx A 92 LYS HGx 1.0 1.80 3.18 1427 1089 A 92 LYS HEy A 92 LYS HGx 1.0 1.80 3.18 1428 1089 A 92 LYS HGy A 92 LYS HEx 1.0 1.80 3.18 1429 1089 A 92 LYS HEy A 92 LYS HGy 1.0 1.80 3.18 1430 1090 A 92 LYS HDx A 92 LYS HEx 1.0 1.80 2.99 1431 1090 A 92 LYS HDy A 92 LYS HEx 1.0 1.80 2.99 1432 1090 A 92 LYS HEy A 92 LYS HDx 1.0 1.80 2.99 1433 1090 A 92 LYS HEy A 92 LYS HDy 1.0 1.80 2.99 1434 1091 A 92 LYS HEy A 92 LYS H 1.0 1.80 4.82 1435 1091 A 92 LYS H A 92 LYS HEx 1.0 1.80 4.82 1436 1092 A 92 LYS HGy A 92 LYS H 1.0 1.80 4.48 1437 1092 A 92 LYS H A 92 LYS HGx 1.0 1.80 4.48 1438 1093 A 92 LYS HDy A 92 LYS H 1.0 1.80 5.09 1439 1093 A 92 LYS H A 92 LYS HDx 1.0 1.80 5.09 1440 1094 A 92 LYS HBy A 92 LYS HGx 1.0 1.80 2.94 1441 1094 A 92 LYS HGy A 92 LYS HBy 1.0 1.80 2.94 1442 1095 A 93 PHE HDx A 92 LYS HA 1.0 1.80 4.74 1443 1095 A 93 PHE HDy A 92 LYS HA 1.0 1.80 4.74 1444 1096 A 92 LYS HA A 93 PHE H 1.0 1.80 3.11 1445 1097 A 93 PHE HBy A 92 LYS HA 1.0 1.80 4.77 1446 1098 A 92 LYS HGy A 93 PHE H 1.0 1.80 5.23 1447 1098 A 93 PHE H A 92 LYS HGx 1.0 1.80 5.23 1448 1099 A 93 PHE H A 92 LYS HEx 1.0 1.80 5.50 1449 1099 A 92 LYS HEy A 93 PHE H 1.0 1.80 5.50 1450 1100 A 104 THR H A 92 LYS HEx 1.0 1.80 4.86 1451 1100 A 92 LYS HEy A 104 THR H 1.0 1.80 4.86 1452 1101 A 93 PHE HBy A 93 PHE H 1.0 1.80 4.15 1453 1102 A 93 PHE HDy A 93 PHE HA 1.0 1.80 4.97 1454 1103 A 93 PHE HA A 94 LYS H 1.0 1.80 3.16 1455 1104 A 93 PHE HBy A 94 LYS H 1.0 1.80 4.05 1456 1105 A 93 PHE HA A 94 LYS HBx 1.0 1.80 5.25 1457 1105 A 94 LYS HBy A 93 PHE HA 1.0 1.80 5.25 1458 1106 A 93 PHE HBx A 94 LYS H 1.0 1.80 3.74 1459 1107 A 102 LEU HBx A 93 PHE H 1.0 1.80 4.98 1460 1108 A 93 PHE HDy A 102 LEU HDx% 1.0 1.80 5.29 1461 1109 A 93 PHE HDy A 102 LEU HDy% 1.0 1.80 4.99 1462 1110 A 93 PHE HBx A 102 LEU HBx 1.0 1.80 4.82 1463 1111 A 93 PHE HBy A 102 LEU HDy% 1.0 1.80 5.28 1464 1112 A 93 PHE HBy A 102 LEU HBy 1.0 1.80 4.23 1465 1113 A 93 PHE H A 102 LEU H 1.0 1.80 4.15 1466 1114 A 93 PHE HBy A 102 LEU HBx 1.0 1.80 4.75 1467 1115 A 93 PHE HBy A 102 LEU H 1.0 1.80 5.04 1468 1116 A 103 ASN HA A 93 PHE H 1.0 1.80 4.65 1469 1117 A 94 LYS HA A 94 LYS HGx 1.0 1.80 4.05 1470 1118 A 94 LYS HBy A 94 LYS H 1.0 1.80 3.26 1471 1118 A 94 LYS H A 94 LYS HBx 1.0 1.80 3.26 1472 1119 A 94 LYS HGx A 94 LYS HEx 1.0 1.80 2.97 1473 1119 A 94 LYS HGx A 94 LYS HEy 1.0 1.80 2.97 1474 1120 A 94 LYS HBy A 94 LYS HEx 1.0 1.80 2.99 1475 1120 A 94 LYS HBx A 94 LYS HEx 1.0 1.80 2.99 1476 1120 A 94 LYS HEy A 94 LYS HBx 1.0 1.80 2.99 1477 1120 A 94 LYS HBy A 94 LYS HEy 1.0 1.80 2.99 1478 1121 A 94 LYS HGy A 94 LYS HBx 1.0 1.80 2.96 1479 1121 A 94 LYS HBy A 94 LYS HGy 1.0 1.80 2.96 1480 1122 A 94 LYS HDx A 94 LYS HEx 1.0 1.80 3.02 1481 1122 A 94 LYS HDy A 94 LYS HEx 1.0 1.80 3.02 1482 1122 A 94 LYS HEy A 94 LYS HDx 1.0 1.80 3.02 1483 1122 A 94 LYS HEy A 94 LYS HDy 1.0 1.80 3.02 1484 1123 A 94 LYS HGx A 94 LYS HBx 1.0 1.80 2.43 1485 1123 A 94 LYS HBy A 94 LYS HGx 1.0 1.80 2.43 1486 1124 A 94 LYS HGx A 94 LYS H 1.0 1.80 4.80 1487 1125 A 94 LYS HA A 95 ARG H 1.0 1.80 2.89 1488 1126 A 94 LYS HGx A 95 ARG H 1.0 1.80 5.20 1489 1127 A 95 ARG H A 94 LYS HBx 1.0 1.80 3.52 1490 1127 A 94 LYS HBy A 95 ARG H 1.0 1.80 3.52 1491 1128 A 99 GLY H A 94 LYS HEx 1.0 1.80 4.80 1492 1128 A 94 LYS HEy A 99 GLY H 1.0 1.80 4.80 1493 1129 A 99 GLY HAy A 94 LYS HDx 1.0 1.80 4.84 1494 1129 A 94 LYS HDy A 99 GLY HAy 1.0 1.80 4.84 1495 1130 A 99 GLY HAy A 94 LYS HBx 1.0 1.80 4.31 1496 1130 A 94 LYS HBy A 99 GLY HAy 1.0 1.80 4.31 1497 1131 A 99 GLY HAx A 94 LYS HDx 1.0 1.80 4.78 1498 1131 A 94 LYS HDy A 99 GLY HAx 1.0 1.80 4.78 1499 1132 A 99 GLY HAx A 94 LYS HBx 1.0 1.80 4.38 1500 1132 A 94 LYS HBy A 99 GLY HAx 1.0 1.80 4.38 1501 1133 A 100 ASN HBy A 94 LYS HDx 1.0 1.80 5.12 1502 1133 A 94 LYS HDy A 100 ASN HBy 1.0 1.80 5.12 1503 1134 A 100 ASN H A 94 LYS HBx 1.0 1.80 5.11 1504 1134 A 94 LYS HBy A 100 ASN H 1.0 1.80 5.11 1505 1135 A 101 GLU HA A 94 LYS HEx 1.0 1.80 5.33 1506 1135 A 94 LYS HEy A 101 GLU HA 1.0 1.80 5.33 1507 1136 A 101 GLU HGx A 94 LYS HEx 1.0 1.80 4.53 1508 1136 A 94 LYS HEy A 101 GLU HGx 1.0 1.80 4.53 1509 1137 A 101 GLU HGy A 94 LYS HEx 1.0 1.80 4.67 1510 1137 A 94 LYS HEy A 101 GLU HGy 1.0 1.80 4.67 1511 1138 A 101 GLU HA A 94 LYS HDx 1.0 1.80 3.05 1512 1138 A 94 LYS HDy A 101 GLU HA 1.0 1.80 3.05 1513 1139 A 94 LYS HA A 101 GLU HA 1.0 1.80 3.91 1514 1140 A 94 LYS HGx A 101 GLU HGy 1.0 1.80 5.35 1515 1141 A 101 GLU H A 94 LYS HEx 1.0 1.80 4.46 1516 1141 A 94 LYS HEy A 101 GLU H 1.0 1.80 4.46 1517 1142 A 94 LYS HA A 102 LEU H 1.0 1.80 3.87 1518 1143 A 102 LEU H A 94 LYS HBx 1.0 1.80 4.75 1519 1143 A 94 LYS HBy A 102 LEU H 1.0 1.80 4.75 1520 1144 A 95 ARG H A 95 ARG HBy 1.0 1.80 3.84 1521 1145 A 95 ARG H A 95 ARG HGx 1.0 1.80 4.39 1522 1146 A 95 ARG HGy A 95 ARG H 1.0 1.80 3.85 1523 1147 A 95 ARG HA A 95 ARG HDx 1.0 1.80 5.07 1524 1147 A 95 ARG HDy A 95 ARG HA 1.0 1.80 5.07 1525 1148 A 95 ARG HGy A 95 ARG H 1.0 1.80 3.79 1526 1148 A 95 ARG H A 95 ARG HGx 1.0 1.80 3.79 1527 1149 A 95 ARG HBx A 95 ARG H 1.0 1.80 3.56 1528 1150 A 95 ARG HA A 95 ARG HGy 1.0 1.80 3.87 1529 1151 A 95 ARG HA A 96 THR HB 1.0 1.80 4.09 1530 1152 A 96 THR HB A 95 ARG HBy 1.0 1.80 4.69 1531 1152 A 95 ARG HBx A 96 THR HB 1.0 1.80 4.69 1532 1153 A 95 ARG HBx A 96 THR H 1.0 1.80 4.69 1533 1154 A 96 THR H A 95 ARG HDx 1.0 1.80 5.31 1534 1154 A 95 ARG HDy A 96 THR H 1.0 1.80 5.31 1535 1155 A 96 THR H A 95 ARG HBy 1.0 1.80 4.69 1536 1155 A 95 ARG HBx A 96 THR H 1.0 1.80 4.69 1537 1156 A 95 ARG HA A 96 THR H 1.0 1.80 3.31 1538 1157 A 96 THR H A 95 ARG HBy 1.0 1.80 5.35 1539 1158 A 95 ARG HGy A 97 ASP HBx 1.0 1.80 5.23 1540 1159 A 97 ASP H A 95 ARG HBy 1.0 1.80 5.31 1541 1160 A 95 ARG HA A 97 ASP H 1.0 1.80 4.00 1542 1161 A 95 ARG HBx A 97 ASP H 1.0 1.80 4.57 1543 1162 A 97 ASP HBx A 95 ARG HBy 1.0 1.80 4.72 1544 1162 A 95 ARG HBx A 97 ASP HBx 1.0 1.80 4.72 1545 1163 A 95 ARG HBx A 98 ASN H 1.0 1.80 4.30 1546 1164 A 95 ARG HBx A 99 GLY H 1.0 1.80 4.70 1547 1165 A 100 ASN H A 95 ARG HBy 1.0 1.80 3.82 1548 1165 A 95 ARG HBx A 100 ASN H 1.0 1.80 3.82 1549 1166 A 100 ASN HBx A 95 ARG HDx 1.0 1.80 4.94 1550 1166 A 95 ARG HDy A 100 ASN HBx 1.0 1.80 4.94 1551 1167 A 100 ASN H A 95 ARG HBy 1.0 1.80 4.62 1552 1168 A 100 ASN HBy A 95 ARG HDx 1.0 1.80 4.44 1553 1168 A 95 ARG HDy A 100 ASN HBy 1.0 1.80 4.44 1554 1169 A 95 ARG HBx A 100 ASN H 1.0 1.80 4.02 1555 1170 A 119 TYR HEy A 95 ARG HDx 1.0 1.80 4.74 1556 1170 A 95 ARG HDy A 119 TYR HEy 1.0 1.80 4.74 1557 1171 A 119 TYR HEx A 95 ARG HDx 1.0 1.80 4.76 1558 1171 A 95 ARG HDy A 119 TYR HEx 1.0 1.80 4.76 1559 1172 A 95 ARG HDy A 119 TYR HEx 1.0 1.80 3.77 1560 1172 A 119 TYR HEx A 95 ARG HDx 1.0 1.80 3.77 1561 1172 A 95 ARG HDy A 119 TYR HEy 1.0 1.80 3.77 1562 1172 A 119 TYR HEy A 95 ARG HDx 1.0 1.80 3.77 1563 1173 A 96 THR HB A 96 THR HA 1.0 1.80 2.86 1564 1174 A 96 THR H A 96 THR HG2% 1.0 1.80 3.62 1565 1175 A 96 THR H A 96 THR HB 1.0 1.80 4.01 1566 1176 A 96 THR HA A 96 THR HG2% 1.0 1.80 3.22 1567 1177 A 97 ASP H A 96 THR HG2% 1.0 1.80 5.50 1568 1178 A 96 THR H A 97 ASP H 1.0 1.80 3.57 1569 1179 A 96 THR HB A 97 ASP H 1.0 1.80 4.33 1570 1180 A 99 GLY H A 96 THR HA 1.0 1.80 4.54 1571 1181 A 97 ASP H A 97 ASP HBy 1.0 1.80 3.78 1572 1182 A 97 ASP HBx A 97 ASP H 1.0 1.80 4.02 1573 1183 A 99 GLY H A 97 ASP H 1.0 1.80 4.71 1574 1184 A 99 GLY HAy A 98 ASN H 1.0 1.80 4.58 1575 1185 A 99 GLY H A 98 ASN H 1.0 1.80 3.33 1576 1186 A 100 ASN HBx A 100 ASN H 1.0 1.80 3.73 1577 1187 A 100 ASN HBy A 100 ASN H 1.0 1.80 3.32 1578 1188 A 100 ASN HBy A 101 GLU H 1.0 1.80 4.20 1579 1189 A 101 GLU H A 100 ASN H 1.0 1.80 4.78 1580 1190 A 100 ASN HA A 101 GLU HBx 1.0 1.80 4.80 1581 1190 A 100 ASN HA A 101 GLU HBy 1.0 1.80 4.80 1582 1191 A 101 GLU H A 100 ASN HBx 1.0 1.80 3.61 1583 1192 A 101 GLU H A 100 ASN HA 1.0 1.80 2.76 1584 1193 A 101 GLU HGy A 100 ASN HA 1.0 1.80 5.15 1585 1194 A 119 TYR HDy A 100 ASN HBy 1.0 1.80 4.66 1586 1194 A 100 ASN HBy A 119 TYR HDx 1.0 1.80 4.66 1587 1195 A 100 ASN HBy A 119 TYR HEx 1.0 1.80 4.98 1588 1196 A 100 ASN HBx A 119 TYR HEx 1.0 1.80 4.53 1589 1197 A 100 ASN HBx A 119 TYR HEy 1.0 1.80 4.47 1590 1198 A 100 ASN HBx A 119 TYR HEy 1.0 1.80 3.37 1591 1198 A 100 ASN HBx A 119 TYR HEx 1.0 1.80 3.37 1592 1199 A 100 ASN HBy A 119 TYR HEy 1.0 1.80 5.00 1593 1200 A 100 ASN HBy A 119 TYR HEy 1.0 1.80 3.55 1594 1200 A 100 ASN HBy A 119 TYR HEx 1.0 1.80 3.55 1595 1201 A 120 GLU HGx A 100 ASN HBx 1.0 1.80 4.75 1596 1202 A 120 GLU HGy A 100 ASN HBy 1.0 1.80 4.49 1597 1203 A 101 GLU HGx A 101 GLU H 1.0 1.80 3.70 1598 1204 A 101 GLU HGx A 101 GLU HBx 1.0 1.80 2.77 1599 1204 A 101 GLU HGx A 101 GLU HBy 1.0 1.80 2.77 1600 1205 A 101 GLU H A 101 GLU HBx 1.0 1.80 2.87 1601 1205 A 101 GLU H A 101 GLU HBy 1.0 1.80 2.87 1602 1206 A 101 GLU HGy A 101 GLU H 1.0 1.80 3.40 1603 1207 A 101 GLU HGy A 102 LEU H 1.0 1.80 4.57 1604 1208 A 102 LEU HBy A 101 GLU H 1.0 1.80 5.19 1605 1209 A 102 LEU HBy A 101 GLU HA 1.0 1.80 4.24 1606 1210 A 101 GLU HGx A 102 LEU H 1.0 1.80 4.90 1607 1211 A 101 GLU HA A 102 LEU H 1.0 1.80 2.97 1608 1212 A 102 LEU H A 101 GLU HBx 1.0 1.80 3.67 1609 1212 A 101 GLU HBy A 102 LEU H 1.0 1.80 3.67 1610 1213 A 101 GLU H A 119 TYR HEy 1.0 1.80 4.93 1611 1213 A 101 GLU H A 119 TYR HEx 1.0 1.80 4.93 1612 1214 A 102 LEU HBy A 102 LEU HDy% 1.0 1.80 4.17 1613 1215 A 102 LEU HG A 102 LEU H 1.0 1.80 5.08 1614 1216 A 102 LEU HBx A 102 LEU H 1.0 1.80 4.08 1615 1217 A 102 LEU HDx% A 102 LEU HA 1.0 1.80 4.28 1616 1218 A 102 LEU HBy A 102 LEU H 1.0 1.80 3.81 1617 1219 A 102 LEU HDy% A 102 LEU HBx 1.0 1.80 3.70 1618 1220 A 102 LEU HDx% A 102 LEU HBx 1.0 1.80 3.50 1619 1221 A 102 LEU HDy% A 102 LEU HA 1.0 1.80 4.30 1620 1222 A 102 LEU HG A 103 ASN H 1.0 1.80 4.85 1621 1223 A 102 LEU HA A 103 ASN H 1.0 1.80 3.03 1622 1224 A 102 LEU HBy A 103 ASN H 1.0 1.80 4.73 1623 1225 A 102 LEU HBx A 103 ASN H 1.0 1.80 4.73 1624 1226 A 102 LEU HDy% A 103 ASN H 1.0 1.80 4.98 1625 1227 A 102 LEU HDy% A 103 ASN HA 1.0 1.80 5.20 1626 1228 A 102 LEU HDx% A 103 ASN H 1.0 1.80 4.70 1627 1229 A 102 LEU HDy% A 117 TYR HDy 1.0 1.80 4.99 1628 1230 A 119 TYR HDy A 102 LEU HA 1.0 1.80 3.86 1629 1230 A 102 LEU HA A 119 TYR HDx 1.0 1.80 3.86 1630 1231 A 119 TYR HDy A 102 LEU HDy% 1.0 1.80 4.07 1631 1231 A 102 LEU HDy% A 119 TYR HDx 1.0 1.80 4.07 1632 1232 A 102 LEU HDy% A 119 TYR HDx 1.0 1.80 5.41 1633 1233 A 102 LEU HDx% A 119 TYR HDx 1.0 1.80 4.92 1634 1234 A 119 TYR HDy A 102 LEU HDx% 1.0 1.80 4.73 1635 1234 A 102 LEU HDx% A 119 TYR HDx 1.0 1.80 4.73 1636 1235 A 102 LEU HBy A 119 TYR HBx 1.0 1.80 4.51 1637 1236 A 102 LEU HDx% A 119 TYR HBy 1.0 1.80 4.63 1638 1237 A 102 LEU HDx% A 119 TYR HBx 1.0 1.80 4.58 1639 1238 A 102 LEU HG A 119 TYR HBx 1.0 1.80 5.30 1640 1239 A 102 LEU HBx A 119 TYR HDx 1.0 1.80 4.65 1641 1240 A 102 LEU HBy A 119 TYR HDx 1.0 1.80 5.29 1642 1241 A 103 ASN HBx A 103 ASN H 1.0 1.80 4.10 1643 1242 A 103 ASN HBy A 103 ASN H 1.0 1.80 3.98 1644 1243 A 103 ASN HBy A 104 THR H 1.0 1.80 4.00 1645 1244 A 103 ASN HBx A 104 THR H 1.0 1.80 4.25 1646 1245 A 103 ASN H A 104 THR H 1.0 1.80 4.46 1647 1246 A 103 ASN HA A 104 THR H 1.0 1.80 2.98 1648 1247 A 103 ASN HBx A 105 VAL HGx% 1.0 1.80 3.74 1649 1247 A 105 VAL HGy% A 103 ASN HBx 1.0 1.80 3.74 1650 1248 A 103 ASN HBy A 118 VAL HB 1.0 1.80 3.85 1651 1249 A 104 THR HA A 105 VAL HGx% 1.0 1.80 4.57 1652 1249 A 104 THR HA A 105 VAL HGy% 1.0 1.80 4.57 1653 1250 A 104 THR HA A 105 VAL HB 1.0 1.80 4.80 1654 1251 A 117 TYR HDy A 104 THR HB 1.0 1.80 4.34 1655 1251 A 104 THR HB A 117 TYR HDx 1.0 1.80 4.34 1656 1252 A 104 THR HA A 117 TYR HA 1.0 1.80 3.95 1657 1253 A 117 TYR HDy A 104 THR HB 1.0 1.80 4.82 1658 1254 A 104 THR HB A 117 TYR HA 1.0 1.80 4.10 1659 1255 A 105 VAL HA A 105 VAL HGx% 1.0 1.80 3.30 1660 1255 A 105 VAL HA A 105 VAL HGy% 1.0 1.80 3.30 1661 1256 A 105 VAL HGy% A 106 ARG H 1.0 1.80 3.58 1662 1256 A 106 ARG H A 105 VAL HGx% 1.0 1.80 3.58 1663 1257 A 105 VAL HA A 106 ARG H 1.0 1.80 3.10 1664 1258 A 105 VAL HB A 116 THR H 1.0 1.80 3.96 1665 1259 A 116 THR HB A 105 VAL HGx% 1.0 1.80 3.75 1666 1259 A 105 VAL HGy% A 116 THR HB 1.0 1.80 3.75 1667 1260 A 105 VAL HGy% A 116 THR H 1.0 1.80 5.30 1668 1260 A 116 THR H A 105 VAL HGx% 1.0 1.80 5.30 1669 1261 A 105 VAL HB A 116 THR HB 1.0 1.80 3.32 1670 1262 A 107 GLU HBy A 107 GLU HGx 1.0 1.80 2.66 1671 1262 A 107 GLU HBy A 107 GLU HGy 1.0 1.80 2.66 1672 1263 A 107 GLU HGy A 107 GLU H 1.0 1.80 4.57 1673 1263 A 107 GLU H A 107 GLU HGx 1.0 1.80 4.57 1674 1264 A 107 GLU HBy A 107 GLU H 1.0 1.80 4.11 1675 1265 A 107 GLU HBx A 107 GLU HGx 1.0 1.80 2.70 1676 1265 A 107 GLU HGy A 107 GLU HBx 1.0 1.80 2.70 1677 1266 A 107 GLU HBy A 108 ILE H 1.0 1.80 3.75 1678 1267 A 108 ILE H A 107 GLU HA 1.0 1.80 3.14 1679 1268 A 107 GLU HBx A 108 ILE H 1.0 1.80 4.24 1680 1269 A 108 ILE H A 107 GLU H 1.0 1.80 4.55 1681 1270 A 107 GLU HBx A 109 ILE HD1% 1.0 1.80 5.36 1682 1271 A 107 GLU HBy A 109 ILE H 1.0 1.80 5.04 1683 1272 A 113 LEU HDx% A 107 GLU HA 1.0 1.80 5.27 1684 1273 A 113 LEU HDx% A 107 GLU HBy 1.0 1.80 4.95 1685 1274 A 113 LEU HDx% A 107 GLU H 1.0 1.80 4.52 1686 1275 A 114 VAL HGy% A 107 GLU HGx 1.0 1.80 4.02 1687 1275 A 107 GLU HGy A 114 VAL HGy% 1.0 1.80 4.02 1688 1276 A 114 VAL HGx% A 107 GLU HGx 1.0 1.80 4.88 1689 1276 A 107 GLU HGy A 114 VAL HGx% 1.0 1.80 4.88 1690 1277 A 107 GLU HA A 114 VAL H 1.0 1.80 5.41 1691 1278 A 114 VAL HGx% A 107 GLU H 1.0 1.80 5.13 1692 1279 A 107 GLU H A 114 VAL H 1.0 1.80 4.15 1693 1280 A 108 ILE HG2% A 108 ILE H 1.0 1.80 4.66 1694 1281 A 108 ILE HD1% A 108 ILE HA 1.0 1.80 4.44 1695 1282 A 108 ILE HD1% A 108 ILE H 1.0 1.80 5.50 1696 1283 A 108 ILE H A 108 ILE HB 1.0 1.80 3.27 1697 1284 A 108 ILE HG2% A 108 ILE HA 1.0 1.80 3.84 1698 1285 A 108 ILE HD1% A 108 ILE HG2% 1.0 1.80 3.66 1699 1286 A 108 ILE H A 108 ILE HG1x 1.0 1.80 3.72 1700 1286 A 108 ILE H A 108 ILE HG1y 1.0 1.80 3.72 1701 1287 A 108 ILE HG2% A 109 ILE H 1.0 1.80 3.65 1702 1288 A 108 ILE H A 109 ILE HD1% 1.0 1.80 5.50 1703 1289 A 108 ILE HD1% A 109 ILE H 1.0 1.80 5.43 1704 1290 A 108 ILE HA A 109 ILE H 1.0 1.80 3.12 1705 1291 A 108 ILE HD1% A 109 ILE HG2% 1.0 1.80 5.34 1706 1292 A 108 ILE HA A 109 ILE HG2% 1.0 1.80 4.54 1707 1293 A 108 ILE HA A 109 ILE HB 1.0 1.80 5.08 1708 1294 A 108 ILE HB A 109 ILE H 1.0 1.80 5.18 1709 1295 A 108 ILE HG2% A 110 GLY H 1.0 1.80 4.84 1710 1296 A 108 ILE HG2% A 111 ASP H 1.0 1.80 4.97 1711 1297 A 108 ILE HG2% A 111 ASP HA 1.0 1.80 4.32 1712 1298 A 108 ILE HG2% A 112 GLU H 1.0 1.80 4.35 1713 1299 A 108 ILE HA A 113 LEU HA 1.0 1.80 4.20 1714 1300 A 113 LEU HDx% A 108 ILE HB 1.0 1.80 4.92 1715 1301 A 113 LEU HDx% A 108 ILE H 1.0 1.80 5.50 1716 1302 A 108 ILE HD1% A 113 LEU HDx% 1.0 1.80 4.05 1717 1303 A 113 LEU HDx% A 108 ILE HA 1.0 1.80 5.11 1718 1304 A 108 ILE HG2% A 113 LEU HDx% 1.0 1.80 5.35 1719 1305 A 108 ILE HD1% A 113 LEU HA 1.0 1.80 4.66 1720 1306 A 114 VAL HGx% A 108 ILE HA 1.0 1.80 5.50 1721 1307 A 108 ILE HG2% A 114 VAL H 1.0 1.80 5.50 1722 1308 A 108 ILE HD1% A 114 VAL H 1.0 1.80 5.09 1723 1309 A 108 ILE HA A 114 VAL H 1.0 1.80 3.82 1724 1310 A 109 ILE HG1y A 109 ILE H 1.0 1.80 4.09 1725 1310 A 109 ILE H A 109 ILE HG1x 1.0 1.80 4.09 1726 1311 A 109 ILE HD1% A 109 ILE HA 1.0 1.80 3.71 1727 1312 A 109 ILE HG2% A 109 ILE HA 1.0 1.80 3.10 1728 1313 A 109 ILE HG2% A 109 ILE HG1x 1.0 1.80 3.95 1729 1313 A 109 ILE HG2% A 109 ILE HG1y 1.0 1.80 3.95 1730 1314 A 109 ILE HB A 109 ILE H 1.0 1.80 3.49 1731 1315 A 109 ILE HD1% A 109 ILE H 1.0 1.80 4.95 1732 1316 A 109 ILE HD1% A 109 ILE HB 1.0 1.80 3.36 1733 1317 A 109 ILE HA A 109 ILE HG1x 1.0 1.80 4.10 1734 1317 A 109 ILE HG1y A 109 ILE HA 1.0 1.80 4.10 1735 1318 A 109 ILE HG2% A 110 GLY HAy 1.0 1.80 5.33 1736 1319 A 109 ILE HA A 110 GLY HAx 1.0 1.80 4.38 1737 1320 A 110 GLY H A 109 ILE HA 1.0 1.80 2.78 1738 1321 A 110 GLY H A 109 ILE HG1x 1.0 1.80 5.26 1739 1321 A 110 GLY H A 109 ILE HG1y 1.0 1.80 5.26 1740 1322 A 109 ILE HD1% A 110 GLY H 1.0 1.80 3.85 1741 1323 A 109 ILE HB A 110 GLY H 1.0 1.80 4.67 1742 1324 A 109 ILE HG2% A 110 GLY H 1.0 1.80 3.77 1743 1325 A 109 ILE HG2% A 110 GLY HAx 1.0 1.80 4.62 1744 1326 A 112 GLU HBy A 109 ILE H 1.0 1.80 5.06 1745 1326 A 109 ILE H A 112 GLU HBx 1.0 1.80 5.06 1746 1327 A 109 ILE H A 112 GLU H 1.0 1.80 4.30 1747 1328 A 113 LEU HDx% A 109 ILE HG2% 1.0 1.80 4.66 1748 1329 A 114 VAL HGx% A 109 ILE HA 1.0 1.80 3.89 1749 1330 A 114 VAL HGx% A 109 ILE H 1.0 1.80 4.20 1750 1331 A 109 ILE H A 114 VAL H 1.0 1.80 5.28 1751 1332 A 114 VAL HGx% A 109 ILE HG1x 1.0 1.80 3.20 1752 1332 A 114 VAL HGx% A 109 ILE HG1y 1.0 1.80 3.20 1753 1333 A 109 ILE HD1% A 114 VAL HGx% 1.0 1.80 2.98 1754 1334 A 111 ASP HA A 110 GLY HAy 1.0 1.80 4.80 1755 1335 A 111 ASP H A 110 GLY HAy 1.0 1.80 3.32 1756 1336 A 111 ASP H A 110 GLY HAx 1.0 1.80 3.04 1757 1337 A 110 GLY HAy A 112 GLU H 1.0 1.80 5.37 1758 1338 A 110 GLY HAx A 112 GLU H 1.0 1.80 4.36 1759 1339 A 111 ASP H A 111 ASP HBx 1.0 1.80 3.60 1760 1340 A 111 ASP H A 112 GLU H 1.0 1.80 3.40 1761 1341 A 111 ASP HBx A 112 GLU H 1.0 1.80 5.05 1762 1342 A 111 ASP H A 112 GLU HBx 1.0 1.80 4.87 1763 1342 A 111 ASP H A 112 GLU HBy 1.0 1.80 4.87 1764 1343 A 112 GLU HA A 112 GLU HGx 1.0 1.80 3.88 1765 1344 A 112 GLU HGy A 112 GLU H 1.0 1.80 3.81 1766 1345 A 112 GLU HGx A 112 GLU H 1.0 1.80 4.02 1767 1346 A 112 GLU HA A 112 GLU HGy 1.0 1.80 3.98 1768 1347 A 112 GLU HBy A 112 GLU H 1.0 1.80 3.31 1769 1347 A 112 GLU H A 112 GLU HBx 1.0 1.80 3.31 1770 1348 A 112 GLU HA A 113 LEU H 1.0 1.80 3.16 1771 1349 A 112 GLU HBy A 113 LEU H 1.0 1.80 4.04 1772 1349 A 113 LEU H A 112 GLU HBx 1.0 1.80 4.04 1773 1350 A 112 GLU HGx A 113 LEU H 1.0 1.80 4.73 1774 1351 A 127 ILE HG2% A 112 GLU HA 1.0 1.80 5.36 1775 1352 A 127 ILE HG2% A 112 GLU HBx 1.0 1.80 3.66 1776 1352 A 127 ILE HG2% A 112 GLU HBy 1.0 1.80 3.66 1777 1353 A 127 ILE HG2% A 112 GLU HGy 1.0 1.80 5.08 1778 1354 A 128 PHE HEy A 112 GLU HA 1.0 1.80 4.25 1779 1355 A 112 GLU HGy A 129 LYS HA 1.0 1.80 5.14 1780 1356 A 112 GLU HA A 129 LYS HA 1.0 1.80 4.85 1781 1357 A 129 LYS HGy A 112 GLU HGy 1.0 1.80 5.50 1782 1358 A 113 LEU HBy A 113 LEU H 1.0 1.80 3.91 1783 1359 A 113 LEU HDx% A 113 LEU HA 1.0 1.80 3.97 1784 1360 A 113 LEU HG A 113 LEU HA 1.0 1.80 4.18 1785 1361 A 113 LEU HDx% A 113 LEU H 1.0 1.80 5.26 1786 1362 A 113 LEU HA A 114 VAL H 1.0 1.80 3.03 1787 1363 A 113 LEU HDx% A 114 VAL H 1.0 1.80 3.95 1788 1364 A 113 LEU HDx% A 114 VAL HGx% 1.0 1.80 5.05 1789 1365 A 114 VAL HGx% A 113 LEU HA 1.0 1.80 4.13 1790 1366 A 113 LEU HDx% A 115 GLN HGx 1.0 1.80 4.97 1791 1366 A 113 LEU HDx% A 115 GLN HGy 1.0 1.80 4.97 1792 1367 A 127 ILE HG2% A 113 LEU H 1.0 1.80 5.50 1793 1368 A 113 LEU HBy A 128 PHE HDy 1.0 1.80 4.69 1794 1369 A 128 PHE HDx A 113 LEU HBy 1.0 1.80 5.22 1795 1370 A 113 LEU H A 128 PHE H 1.0 1.80 4.45 1796 1371 A 113 LEU HBy A 128 PHE H 1.0 1.80 4.86 1797 1372 A 113 LEU HG A 128 PHE HDy 1.0 1.80 4.83 1798 1373 A 128 PHE HBy A 113 LEU H 1.0 1.80 4.67 1799 1374 A 128 PHE HEy A 113 LEU HBy 1.0 1.80 4.99 1800 1375 A 113 LEU HDx% A 128 PHE HBx 1.0 1.80 5.21 1801 1376 A 128 PHE HBy A 113 LEU HBy 1.0 1.80 4.01 1802 1377 A 128 PHE HBx A 113 LEU HBy 1.0 1.80 4.34 1803 1378 A 113 LEU HG A 128 PHE HBy 1.0 1.80 5.50 1804 1379 A 114 VAL HB A 114 VAL H 1.0 1.80 3.29 1805 1380 A 114 VAL HGy% A 114 VAL H 1.0 1.80 4.36 1806 1381 A 114 VAL HGx% A 114 VAL HA 1.0 1.80 3.72 1807 1382 A 114 VAL HGx% A 114 VAL H 1.0 1.80 3.55 1808 1383 A 114 VAL HGy% A 114 VAL HA 1.0 1.80 3.59 1809 1384 A 114 VAL HGy% A 115 GLN H 1.0 1.80 4.00 1810 1385 A 114 VAL HA A 115 GLN H 1.0 1.80 3.30 1811 1386 A 114 VAL HGy% A 125 LYS HBx 1.0 1.80 4.18 1812 1386 A 125 LYS HBy A 114 VAL HGy% 1.0 1.80 4.18 1813 1387 A 114 VAL HGy% A 125 LYS HGx 1.0 1.80 5.18 1814 1387 A 114 VAL HGy% A 125 LYS HGy 1.0 1.80 5.18 1815 1388 A 114 VAL HGy% A 126 ARG H 1.0 1.80 5.50 1816 1389 A 127 ILE HA A 114 VAL HA 1.0 1.80 4.16 1817 1390 A 114 VAL HA A 127 ILE H 1.0 1.80 5.00 1818 1391 A 127 ILE HG2% A 114 VAL HA 1.0 1.80 4.45 1819 1392 A 127 ILE HA A 114 VAL HGy% 1.0 1.80 4.69 1820 1393 A 127 ILE HD1% A 114 VAL HA 1.0 1.80 4.61 1821 1394 A 116 THR H A 115 GLN HBx 1.0 1.80 3.84 1822 1394 A 115 GLN HBy A 116 THR H 1.0 1.80 3.84 1823 1395 A 115 GLN HA A 116 THR H 1.0 1.80 3.40 1824 1396 A 125 LYS HA A 115 GLN H 1.0 1.80 5.12 1825 1397 A 125 LYS HGy A 115 GLN H 1.0 1.80 5.50 1826 1397 A 115 GLN H A 125 LYS HGx 1.0 1.80 5.50 1827 1398 A 126 ARG HBy A 115 GLN HBx 1.0 1.80 3.31 1828 1398 A 126 ARG HBy A 115 GLN HBy 1.0 1.80 3.31 1829 1399 A 126 ARG H A 115 GLN HBx 1.0 1.80 5.29 1830 1399 A 115 GLN HBy A 126 ARG H 1.0 1.80 5.29 1831 1400 A 126 ARG HA A 115 GLN H 1.0 1.80 5.50 1832 1401 A 126 ARG HBx A 115 GLN HBx 1.0 1.80 3.49 1833 1401 A 126 ARG HBx A 115 GLN HBy 1.0 1.80 3.49 1834 1402 A 127 ILE HA A 115 GLN H 1.0 1.80 4.71 1835 1403 A 116 THR HB A 116 THR H 1.0 1.80 3.83 1836 1404 A 116 THR HA A 116 THR HG2% 1.0 1.80 3.53 1837 1405 A 117 TYR HDy A 116 THR HA 1.0 1.80 4.36 1838 1405 A 116 THR HA A 117 TYR HDx 1.0 1.80 4.36 1839 1406 A 116 THR HA A 117 TYR HDx 1.0 1.80 4.95 1840 1407 A 116 THR HA A 117 TYR HEx 1.0 1.80 5.50 1841 1408 A 116 THR HB A 117 TYR H 1.0 1.80 4.55 1842 1409 A 116 THR HG2% A 117 TYR H 1.0 1.80 3.52 1843 1410 A 116 THR HA A 117 TYR H 1.0 1.80 3.10 1844 1411 A 116 THR HG2% A 123 GLU HA 1.0 1.80 5.27 1845 1412 A 116 THR HG2% A 123 GLU HGy 1.0 1.80 3.87 1846 1413 A 116 THR HA A 123 GLU HGx 1.0 1.80 5.46 1847 1414 A 116 THR HB A 123 GLU HGy 1.0 1.80 5.19 1848 1415 A 116 THR HG2% A 123 GLU HGx 1.0 1.80 4.15 1849 1416 A 124 ALA HB% A 116 THR HA 1.0 1.80 5.50 1850 1417 A 124 ALA HA A 116 THR HG2% 1.0 1.80 5.50 1851 1418 A 116 THR HG2% A 125 LYS HBx 1.0 1.80 4.77 1852 1418 A 125 LYS HBy A 116 THR HG2% 1.0 1.80 4.77 1853 1419 A 116 THR HA A 125 LYS HGx 1.0 1.80 4.73 1854 1419 A 125 LYS HGy A 116 THR HA 1.0 1.80 4.73 1855 1420 A 116 THR HA A 125 LYS HDx 1.0 1.80 4.65 1856 1420 A 116 THR HA A 125 LYS HDy 1.0 1.80 4.65 1857 1421 A 116 THR HG2% A 125 LYS HGx 1.0 1.80 4.23 1858 1421 A 125 LYS HGy A 116 THR HG2% 1.0 1.80 4.23 1859 1422 A 116 THR HG2% A 125 LYS HEx 1.0 1.80 3.45 1860 1422 A 125 LYS HEy A 116 THR HG2% 1.0 1.80 3.45 1861 1423 A 125 LYS HA A 116 THR HA 1.0 1.80 3.54 1862 1424 A 116 THR HB A 125 LYS HA 1.0 1.80 4.94 1863 1425 A 125 LYS HA A 116 THR HG2% 1.0 1.80 4.88 1864 1426 A 116 THR HA A 126 ARG H 1.0 1.80 5.32 1865 1427 A 117 TYR HDy A 117 TYR HA 1.0 1.80 4.43 1866 1427 A 117 TYR HA A 117 TYR HDx 1.0 1.80 4.43 1867 1428 A 117 TYR HDy A 117 TYR H 1.0 1.80 4.00 1868 1428 A 117 TYR HDx A 117 TYR H 1.0 1.80 4.00 1869 1429 A 117 TYR HA A 117 TYR HDx 1.0 1.80 4.67 1870 1430 A 118 VAL HA A 117 TYR H 1.0 1.80 4.97 1871 1431 A 117 TYR HBy A 118 VAL H 1.0 1.80 4.75 1872 1432 A 118 VAL HA A 117 TYR HBy 1.0 1.80 5.13 1873 1433 A 118 VAL HB A 117 TYR HA 1.0 1.80 5.38 1874 1434 A 117 TYR HA A 118 VAL H 1.0 1.80 3.36 1875 1435 A 117 TYR HBx A 118 VAL H 1.0 1.80 4.36 1876 1436 A 123 GLU HGy A 117 TYR H 1.0 1.80 4.99 1877 1437 A 117 TYR HBx A 124 ALA H 1.0 1.80 4.56 1878 1438 A 124 ALA HA A 117 TYR H 1.0 1.80 4.55 1879 1439 A 124 ALA HB% A 117 TYR H 1.0 1.80 4.50 1880 1440 A 124 ALA HB% A 117 TYR HEx 1.0 1.80 5.07 1881 1441 A 124 ALA HB% A 117 TYR HBy 1.0 1.80 5.50 1882 1442 A 124 ALA HB% A 117 TYR HDx 1.0 1.80 5.50 1883 1443 A 124 ALA HB% A 117 TYR HBx 1.0 1.80 4.36 1884 1444 A 125 LYS HA A 117 TYR H 1.0 1.80 3.98 1885 1445 A 125 LYS HA A 117 TYR HDx 1.0 1.80 4.89 1886 1446 A 125 LYS HA A 117 TYR HEx 1.0 1.80 4.78 1887 1447 A 117 TYR HDy A 125 LYS H 1.0 1.80 5.12 1888 1447 A 117 TYR HDx A 125 LYS H 1.0 1.80 5.12 1889 1448 A 125 LYS HEy A 117 TYR H 1.0 1.80 5.17 1890 1448 A 117 TYR H A 125 LYS HEx 1.0 1.80 5.17 1891 1449 A 117 TYR HDy A 125 LYS HA 1.0 1.80 4.56 1892 1449 A 125 LYS HA A 117 TYR HDx 1.0 1.80 4.56 1893 1450 A 117 TYR HDx A 126 ARG H 1.0 1.80 5.28 1894 1450 A 117 TYR HDy A 126 ARG H 1.0 1.80 5.28 1895 1451 A 126 ARG HBx A 117 TYR HDy 1.0 1.80 4.12 1896 1451 A 126 ARG HBx A 117 TYR HDx 1.0 1.80 4.12 1897 1452 A 126 ARG HA A 117 TYR HEx 1.0 1.80 5.34 1898 1453 A 118 VAL HB A 118 VAL H 1.0 1.80 3.48 1899 1454 A 118 VAL HA A 118 VAL HGy% 1.0 1.80 3.13 1900 1455 A 118 VAL HGy% A 118 VAL H 1.0 1.80 3.85 1901 1456 A 118 VAL HB A 119 TYR H 1.0 1.80 4.57 1902 1457 A 118 VAL HA A 119 TYR H 1.0 1.80 2.78 1903 1458 A 118 VAL HGy% A 119 TYR H 1.0 1.80 3.53 1904 1459 A 119 TYR HBy A 118 VAL HGy% 1.0 1.80 5.50 1905 1460 A 121 GLY HAx A 118 VAL HGy% 1.0 1.80 5.05 1906 1461 A 118 VAL HGy% A 121 GLY H 1.0 1.80 3.96 1907 1462 A 118 VAL HGy% A 121 GLY HAy 1.0 2.30 5.33 1908 1463 A 122 VAL HB A 118 VAL HA 1.0 1.80 5.00 1909 1464 A 118 VAL HGy% A 123 GLU HBx 1.0 1.80 3.13 1910 1464 A 118 VAL HGy% A 123 GLU HBy 1.0 1.80 3.13 1911 1465 A 123 GLU HA A 118 VAL HGy% 1.0 1.80 3.45 1912 1466 A 118 VAL HB A 123 GLU HGy 1.0 1.80 3.33 1913 1467 A 123 GLU HA A 118 VAL HA 1.0 1.80 3.47 1914 1468 A 123 GLU HGy A 118 VAL HGy% 1.0 1.80 4.31 1915 1469 A 118 VAL HGy% A 124 ALA H 1.0 1.80 4.79 1916 1470 A 118 VAL HA A 124 ALA H 1.0 1.80 4.08 1917 1471 A 119 TYR HBx A 119 TYR H 1.0 1.80 4.02 1918 1472 A 119 TYR HDy A 119 TYR H 1.0 1.80 4.48 1919 1472 A 119 TYR HDx A 119 TYR H 1.0 1.80 4.48 1920 1473 A 119 TYR HDy A 119 TYR HA 1.0 1.80 3.68 1921 1473 A 119 TYR HDx A 119 TYR HA 1.0 1.80 3.68 1922 1474 A 119 TYR HDx A 119 TYR HA 1.0 1.80 4.07 1923 1475 A 119 TYR HDy A 119 TYR HA 1.0 1.80 4.22 1924 1476 A 119 TYR HBy A 120 GLU H 1.0 1.80 4.72 1925 1477 A 119 TYR H A 120 GLU H 1.0 1.80 5.20 1926 1478 A 119 TYR HA A 120 GLU H 1.0 1.80 3.08 1927 1479 A 120 GLU HGy A 119 TYR HEy 1.0 1.80 5.30 1928 1480 A 121 GLY H A 119 TYR H 1.0 1.80 5.12 1929 1481 A 119 TYR H A 122 VAL H 1.0 1.80 3.72 1930 1482 A 122 VAL HB A 119 TYR H 1.0 1.80 4.13 1931 1483 A 123 GLU HA A 119 TYR H 1.0 1.80 4.85 1932 1484 A 120 GLU HGy A 120 GLU H 1.0 1.80 4.09 1933 1485 A 120 GLU HBx A 120 GLU H 1.0 1.80 3.77 1934 1486 A 120 GLU HGy A 120 GLU HA 1.0 1.80 3.86 1935 1487 A 120 GLU HA A 120 GLU H 1.0 1.80 2.90 1936 1488 A 120 GLU HGx A 120 GLU H 1.0 1.80 3.76 1937 1489 A 120 GLU HGx A 120 GLU HA 1.0 1.80 3.82 1938 1490 A 120 GLU HBx A 121 GLY H 1.0 1.80 5.12 1939 1491 A 121 GLY H A 120 GLU HBy 1.0 1.80 5.30 1940 1492 A 121 GLY H A 120 GLU HA 1.0 1.80 3.22 1941 1493 A 122 VAL HGy% A 122 VAL H 1.0 1.80 3.15 1942 1493 A 122 VAL H A 122 VAL HGx% 1.0 1.80 3.15 1943 1494 A 122 VAL HA A 122 VAL HGx% 1.0 1.80 3.17 1944 1494 A 122 VAL HGy% A 122 VAL HA 1.0 1.80 3.17 1945 1495 A 122 VAL HB A 122 VAL H 1.0 1.80 2.96 1946 1496 A 122 VAL HB A 123 GLU H 1.0 1.80 4.58 1947 1497 A 123 GLU H A 122 VAL HGx% 1.0 1.80 3.63 1948 1497 A 122 VAL HGy% A 123 GLU H 1.0 1.80 3.63 1949 1498 A 122 VAL HA A 123 GLU H 1.0 1.80 2.61 1950 1499 A 123 GLU HA A 122 VAL HA 1.0 1.80 5.11 1951 1500 A 123 GLU H A 122 VAL H 1.0 1.80 4.79 1952 1501 A 124 ALA HB% A 122 VAL HB 1.0 1.80 5.50 1953 1502 A 123 GLU HGx A 123 GLU H 1.0 1.80 4.56 1954 1503 A 123 GLU HGy A 123 GLU H 1.0 1.80 4.82 1955 1504 A 123 GLU H A 123 GLU HBx 1.0 1.80 3.08 1956 1504 A 123 GLU HBy A 123 GLU H 1.0 1.80 3.08 1957 1505 A 123 GLU HA A 123 GLU HGy 1.0 1.80 3.89 1958 1506 A 123 GLU HA A 123 GLU HGx 1.0 1.80 4.07 1959 1507 A 123 GLU HGy A 123 GLU HBx 1.0 1.80 2.63 1960 1507 A 123 GLU HGy A 123 GLU HBy 1.0 1.80 2.63 1961 1508 A 123 GLU HGy A 124 ALA H 1.0 1.80 4.17 1962 1509 A 123 GLU HGx A 124 ALA H 1.0 1.80 3.76 1963 1510 A 123 GLU HA A 124 ALA H 1.0 1.80 2.86 1964 1511 A 124 ALA H A 123 GLU HBx 1.0 1.80 4.12 1965 1511 A 123 GLU HBy A 124 ALA H 1.0 1.80 4.12 1966 1512 A 124 ALA HB% A 123 GLU HA 1.0 1.80 4.79 1967 1513 A 123 GLU HGx A 125 LYS HEx 1.0 1.80 5.50 1968 1513 A 125 LYS HEy A 123 GLU HGx 1.0 1.80 5.50 1969 1514 A 124 ALA HB% A 124 ALA H 1.0 1.80 3.76 1970 1515 A 124 ALA HB% A 125 LYS HA 1.0 1.80 4.79 1971 1516 A 124 ALA HB% A 125 LYS H 1.0 1.80 3.58 1972 1517 A 124 ALA HA A 125 LYS HEx 1.0 1.80 3.73 1973 1517 A 124 ALA HA A 125 LYS HEy 1.0 1.80 3.73 1974 1518 A 124 ALA HA A 125 LYS H 1.0 1.80 3.02 1975 1519 A 124 ALA HB% A 125 LYS HBx 1.0 1.80 4.63 1976 1519 A 124 ALA HB% A 125 LYS HBy 1.0 1.80 4.63 1977 1520 A 125 LYS HBy A 125 LYS HDx 1.0 1.80 2.73 1978 1520 A 125 LYS HBx A 125 LYS HDx 1.0 1.80 2.73 1979 1520 A 125 LYS HDy A 125 LYS HBx 1.0 1.80 2.73 1980 1520 A 125 LYS HBy A 125 LYS HDy 1.0 1.80 2.73 1981 1521 A 125 LYS HA A 125 LYS HDx 1.0 1.80 4.32 1982 1521 A 125 LYS HA A 125 LYS HDy 1.0 1.80 4.32 1983 1522 A 125 LYS HEy A 125 LYS H 1.0 1.80 5.07 1984 1522 A 125 LYS H A 125 LYS HEx 1.0 1.80 5.07 1985 1523 A 125 LYS HBy A 125 LYS H 1.0 1.80 3.80 1986 1523 A 125 LYS H A 125 LYS HBx 1.0 1.80 3.80 1987 1524 A 125 LYS HEx A 125 LYS HGx 1.0 1.80 3.95 1988 1524 A 125 LYS HGy A 125 LYS HEx 1.0 1.80 3.95 1989 1524 A 125 LYS HEy A 125 LYS HGy 1.0 1.80 3.95 1990 1524 A 125 LYS HEy A 125 LYS HGx 1.0 1.80 3.95 1991 1525 A 125 LYS HBy A 125 LYS HEx 1.0 1.80 4.11 1992 1525 A 125 LYS HBx A 125 LYS HEx 1.0 1.80 4.11 1993 1525 A 125 LYS HEy A 125 LYS HBx 1.0 1.80 4.11 1994 1525 A 125 LYS HBy A 125 LYS HEy 1.0 1.80 4.11 1995 1526 A 125 LYS HA A 126 ARG H 1.0 1.80 3.21 1996 1527 A 125 LYS HBy A 126 ARG H 1.0 1.80 3.88 1997 1527 A 126 ARG H A 125 LYS HBx 1.0 1.80 3.88 1998 1528 A 125 LYS HDy A 126 ARG H 1.0 1.80 5.38 1999 1528 A 126 ARG H A 125 LYS HDx 1.0 1.80 5.38 2000 1529 A 126 ARG HBx A 125 LYS HA 1.0 1.80 4.43 2001 1530 A 127 ILE HD1% A 125 LYS HBx 1.0 1.80 4.32 2002 1530 A 127 ILE HD1% A 125 LYS HBy 1.0 1.80 4.32 2003 1531 A 126 ARG HGy A 126 ARG H 1.0 1.80 5.23 2004 1532 A 127 ILE HD1% A 126 ARG HA 1.0 1.80 5.50 2005 1533 A 126 ARG HA A 127 ILE H 1.0 1.80 3.27 2006 1534 A 127 ILE HD1% A 126 ARG H 1.0 1.80 5.50 2007 1535 A 126 ARG H A 127 ILE H 1.0 1.80 4.57 2008 1536 A 127 ILE HD1% A 127 ILE HA 1.0 1.80 4.62 2009 1537 A 127 ILE HG1x A 127 ILE H 1.0 1.80 5.05 2010 1538 A 127 ILE HD1% A 127 ILE H 1.0 1.80 4.26 2011 1539 A 127 ILE HG2% A 127 ILE HG1y 1.0 1.80 4.29 2012 1540 A 127 ILE HB A 127 ILE H 1.0 1.80 3.59 2013 1541 A 127 ILE HG1y A 127 ILE H 1.0 1.80 3.91 2014 1542 A 127 ILE HB A 127 ILE HD1% 1.0 1.80 3.37 2015 1543 A 127 ILE HA A 127 ILE HG1y 1.0 1.80 4.11 2016 1544 A 127 ILE HG2% A 127 ILE HA 1.0 1.80 3.78 2017 1545 A 127 ILE HD1% A 127 ILE HG2% 1.0 1.80 3.43 2018 1546 A 127 ILE HG1x A 128 PHE H 1.0 1.80 5.39 2019 1547 A 127 ILE HG2% A 128 PHE H 1.0 1.80 3.87 2020 1548 A 127 ILE HA A 128 PHE H 1.0 1.80 3.28 2021 1549 A 128 PHE HA A 127 ILE HG2% 1.0 1.80 5.08 2022 1550 A 128 PHE HBy A 127 ILE HG2% 1.0 1.80 5.50 2023 1551 A 127 ILE HG2% A 128 PHE HDy 1.0 1.80 5.50 2024 1552 A 128 PHE HBy A 128 PHE H 1.0 1.80 4.08 2025 1553 A 128 PHE HDx A 128 PHE HA 1.0 1.80 4.17 2026 1553 A 128 PHE HA A 128 PHE HDy 1.0 1.80 4.17 2027 1554 A 129 LYS HA A 128 PHE HDy 1.0 1.80 4.49 2028 1555 A 128 PHE HDy A 129 LYS H 1.0 1.80 4.51 2029 1555 A 128 PHE HDx A 129 LYS H 1.0 1.80 4.51 2030 1556 A 128 PHE HEy A 129 LYS HA 1.0 1.80 4.87 2031 1557 A 128 PHE HA A 129 LYS H 1.0 1.80 3.17 2032 1558 A 129 LYS HBx A 129 LYS HDx 1.0 1.80 3.41 2033 1558 A 129 LYS HDy A 129 LYS HBx 1.0 1.80 3.41 2034 1559 A 129 LYS HGy A 129 LYS HDx 1.0 1.80 2.65 2035 1559 A 129 LYS HGy A 129 LYS HDy 1.0 1.80 2.65 2036 1560 A 129 LYS HBx A 129 LYS H 1.0 1.80 3.92 2037 1561 A 129 LYS HBy A 129 LYS H 1.0 1.80 4.16 2038 1562 A 129 LYS HGx A 129 LYS HA 1.0 1.80 4.24 2039 1563 A 129 LYS HBy A 129 LYS HDx 1.0 1.80 3.38 2040 1563 A 129 LYS HBy A 129 LYS HDy 1.0 1.80 3.38 2041 1564 A 129 LYS HGy A 129 LYS H 1.0 1.80 4.91 2042 1565 A 129 LYS HDy A 129 LYS H 1.0 1.80 5.09 2043 1565 A 129 LYS H A 129 LYS HDx 1.0 1.80 5.09 2044 1566 A 129 LYS HGy A 129 LYS HA 1.0 1.80 3.98 2045 1567 A 129 LYS HA A 129 LYS HDx 1.0 1.80 3.95 2046 1567 A 129 LYS HDy A 129 LYS HA 1.0 1.80 3.95 2047 1568 A 129 LYS HBx A 130 LYS H 1.0 1.80 3.89 2048 1569 A 129 LYS HA A 130 LYS HGy 1.0 1.80 5.18 2049 1570 A 129 LYS HA A 130 LYS H 1.0 1.80 3.02 2050 1571 A 129 LYS HGy A 130 LYS H 1.0 1.80 4.89 2051 1572 A 130 LYS H A 129 LYS HDx 1.0 1.80 4.77 2052 1572 A 129 LYS HDy A 130 LYS H 1.0 1.80 4.77 2053 1573 A 129 LYS HBy A 130 LYS H 1.0 1.80 3.58 2054 1574 A 129 LYS HA A 130 LYS HBx 1.0 1.80 4.61 2055 1574 A 130 LYS HBy A 129 LYS HA 1.0 1.80 4.61 2056 1575 A 130 LYS H A 130 LYS HGx 1.0 1.80 4.16 2057 1576 A 130 LYS HDx A 130 LYS HBx 1.0 1.80 3.94 2058 1576 A 130 LYS HBy A 130 LYS HDx 1.0 1.80 3.94 2059 1577 A 130 LYS H A 130 LYS HGy 1.0 1.80 3.75 2060 1578 A 130 LYS HGy A 130 LYS HEy 1.0 1.80 3.96 2061 1579 A 130 LYS HA A 130 LYS HGx 1.0 1.80 4.05 2062 1580 A 130 LYS HGy A 130 LYS HEx 1.0 1.80 4.12 2063 1581 A 130 LYS H A 130 LYS HBx 1.0 1.80 3.12 2064 1581 A 130 LYS HBy A 130 LYS H 1.0 1.80 3.12 2065 1582 A 130 LYS HGx A 130 LYS HEx 1.0 1.80 4.22 2066 1583 A 131 ASP HBx A 130 LYS HA 1.0 1.80 4.61 2067 1584 A 131 ASP H A 130 LYS HGy 1.0 1.80 4.95 2068 1585 A 131 ASP H A 130 LYS HA 1.0 1.80 2.82 2069 1586 A 131 ASP H A 130 LYS HBx 1.0 1.80 3.65 2070 1586 A 131 ASP H A 130 LYS HBy 1.0 1.80 3.65 2071 1587 A 131 ASP HBx A 130 LYS HBx 1.0 1.80 4.61 2072 1587 A 131 ASP HBx A 130 LYS HBy 1.0 1.80 4.61 2073 1588 A 131 ASP HBy A 130 LYS HA 1.0 1.80 5.17 2074 1589 A 131 ASP H A 130 LYS HGx 1.0 1.80 5.08 2075 1590 A 131 ASP H A 131 ASP HBx 1.0 1.80 3.46 2076 1591 A 131 ASP H A 131 ASP HBy 1.0 1.80 3.45 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 noe _nef_distance_restraint_list.potential_type . save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 6 TRP H A 38 LEU O 1.0 1.65 2.60 2 2 A 38 LEU O A 6 TRP N 1.0 2.45 3.60 3 3 A 7 LYS H A 129 LYS O 1.0 1.65 2.60 4 4 A 129 LYS O A 7 LYS N 1.0 2.45 3.60 5 5 A 8 VAL H A 36 LEU O 1.0 1.65 2.60 6 6 A 36 LEU O A 8 VAL N 1.0 2.45 3.60 7 7 A 9 ASP H A 127 ILE O 1.0 1.60 2.55 8 8 A 127 ILE O A 9 ASP N 1.0 2.40 3.55 9 9 A 127 ILE O A 10 ARG H 1.0 1.65 2.60 10 10 A 127 ILE O A 10 ARG N 1.0 2.45 3.60 11 11 A 12 GLU H A 125 LYS O 1.0 1.65 2.60 12 12 A 125 LYS O A 12 GLU N 1.0 2.45 3.60 13 13 A 17 PHE H A 13 ASN O 1.0 1.60 2.55 14 14 A 13 ASN O A 17 PHE N 1.0 2.40 3.55 15 15 A 18 MET H A 14 TYR O 1.0 1.65 2.60 16 16 A 14 TYR O A 18 MET N 1.0 2.45 3.60 17 17 A 19 GLU H A 15 ASP O 1.0 1.65 2.60 18 18 A 15 ASP O A 19 GLU N 1.0 2.45 3.60 19 19 A 20 LYS N A 16 LYS O 1.0 2.40 3.55 20 20 A 16 LYS O A 20 LYS H 1.0 1.50 2.45 21 21 A 21 MET N A 17 PHE O 1.0 2.45 3.60 22 22 A 17 PHE O A 21 MET H 1.0 1.65 2.60 23 23 A 22 GLY N A 18 MET O 1.0 2.45 3.60 24 24 A 18 MET O A 22 GLY H 1.0 1.65 2.60 25 25 A 18 MET O A 23 VAL N 1.0 2.45 3.60 26 26 A 18 MET O A 23 VAL H 1.0 1.65 2.60 27 27 A 37 LYS N A 52 SER O 1.0 2.45 3.60 28 28 A 52 SER O A 37 LYS H 1.0 1.65 2.60 29 29 A 38 LEU N A 6 TRP O 1.0 2.45 3.60 30 30 A 6 TRP O A 38 LEU H 1.0 1.65 2.60 31 31 A 39 THR N A 50 LYS O 1.0 2.45 3.60 32 32 A 50 LYS O A 39 THR H 1.0 1.65 2.60 33 33 A 40 ILE N A 4 SER O 1.0 2.45 3.60 34 34 A 4 SER O A 40 ILE H 1.0 1.65 2.60 35 35 A 41 THR N A 48 THR O 1.0 2.45 3.60 36 36 A 48 THR O A 41 THR H 1.0 1.65 2.60 37 37 A 43 GLU N A 46 LYS O 1.0 2.45 3.60 38 38 A 46 LYS O A 43 GLU H 1.0 1.65 2.60 39 39 A 46 LYS N A 43 GLU O 1.0 2.45 3.60 40 40 A 43 GLU O A 46 LYS H 1.0 1.65 2.60 41 41 A 47 PHE N A 62 PHE O 1.0 2.45 3.60 42 42 A 62 PHE O A 47 PHE H 1.0 1.65 2.60 43 43 A 48 THR N A 41 THR O 1.0 2.45 3.60 44 44 A 41 THR O A 48 THR H 1.0 1.65 2.60 45 45 A 49 VAL N A 60 VAL O 1.0 2.45 3.60 46 46 A 60 VAL O A 49 VAL H 1.0 1.65 2.60 47 47 A 50 LYS N A 39 THR O 1.0 2.45 3.60 48 48 A 39 THR O A 50 LYS H 1.0 1.65 2.60 49 49 A 51 GLU N A 58 ILE O 1.0 2.45 3.60 50 50 A 58 ILE O A 51 GLU H 1.0 1.65 2.60 51 51 A 52 SER N A 37 LYS O 1.0 2.45 3.60 52 52 A 37 LYS O A 52 SER H 1.0 1.65 2.60 53 53 A 58 ILE N A 51 GLU O 1.0 2.45 3.60 54 54 A 51 GLU O A 58 ILE H 1.0 1.65 2.60 55 55 A 60 VAL N A 49 VAL O 1.0 2.45 3.60 56 56 A 49 VAL O A 60 VAL H 1.0 1.65 2.60 57 57 A 62 PHE N A 47 PHE O 1.0 2.45 3.60 58 58 A 47 PHE O A 62 PHE H 1.0 1.65 2.60 59 59 A 64 LEU N A 45 ASN O 1.0 2.45 3.60 60 60 A 45 ASN O A 64 LEU H 1.0 1.65 2.60 61 61 A 65 GLY N A 82 TRP O 1.0 2.45 3.60 62 62 A 82 TRP O A 65 GLY H 1.0 1.65 2.60 63 63 A 66 VAL N A 63 GLU O 1.0 2.45 3.60 64 64 A 63 GLU O A 66 VAL H 1.0 1.65 2.60 65 65 A 68 PHE N A 80 GLY O 1.0 2.45 3.60 66 66 A 80 GLY O A 68 PHE H 1.0 1.65 2.60 67 67 A 70 TYR N A 78 LEU O 1.0 2.45 3.60 68 68 A 78 LEU O A 70 TYR H 1.0 1.65 2.60 69 69 A 76 THR N A 72 LEU O 1.0 2.45 3.60 70 70 A 72 LEU O A 76 THR H 1.0 1.65 2.60 71 71 A 78 LEU N A 70 TYR O 1.0 2.45 3.60 72 72 A 70 TYR O A 78 LEU H 1.0 1.65 2.60 73 73 A 80 GLY N A 68 PHE O 1.0 2.45 3.60 74 74 A 68 PHE O A 80 GLY H 1.0 1.65 2.60 75 75 A 81 THR N A 92 LYS O 1.0 2.40 3.55 76 76 A 92 LYS O A 81 THR H 1.0 1.50 2.45 77 77 A 83 SER N A 90 ILE O 1.0 2.40 3.55 78 78 A 90 ILE O A 83 SER H 1.0 1.50 2.45 79 79 A 85 GLU H A 88 LYS O 1.0 1.50 2.45 80 80 A 88 LYS O A 85 GLU N 1.0 2.40 3.55 81 81 A 88 LYS N A 85 GLU O 1.0 2.40 3.55 82 82 A 85 GLU O A 88 LYS H 1.0 1.50 2.45 83 83 A 89 LEU N A 106 ARG O 1.0 2.45 3.60 84 84 A 106 ARG O A 89 LEU H 1.0 1.65 2.60 85 85 A 90 ILE N A 83 SER O 1.0 2.40 3.55 86 86 A 83 SER O A 90 ILE H 1.0 1.50 2.45 87 87 A 91 GLY N A 104 THR O 1.0 2.45 3.60 88 88 A 104 THR O A 91 GLY H 1.0 1.65 2.60 89 89 A 92 LYS N A 81 THR O 1.0 2.40 3.55 90 90 A 81 THR O A 92 LYS H 1.0 1.50 2.45 91 91 A 93 PHE N A 102 LEU O 1.0 2.45 3.60 92 92 A 102 LEU O A 93 PHE H 1.0 1.65 2.60 93 93 A 94 LYS N A 79 ARG O 1.0 2.45 3.60 94 94 A 79 ARG O A 94 LYS H 1.0 1.65 2.60 95 95 A 95 ARG N A 100 ASN O 1.0 2.45 3.60 96 96 A 100 ASN O A 95 ARG H 1.0 1.65 2.60 97 97 A 100 ASN N A 95 ARG O 1.0 2.45 3.60 98 98 A 95 ARG O A 100 ASN H 1.0 1.65 2.60 99 99 A 102 LEU N A 93 PHE O 1.0 2.45 3.60 100 100 A 93 PHE O A 102 LEU H 1.0 1.65 2.60 101 101 A 103 ASN N A 118 VAL O 1.0 2.45 3.60 102 102 A 118 VAL O A 103 ASN H 1.0 1.65 2.60 103 103 A 104 THR N A 91 GLY O 1.0 2.45 3.60 104 104 A 91 GLY O A 104 THR H 1.0 1.65 2.60 105 105 A 106 ARG N A 89 LEU O 1.0 2.45 3.60 106 106 A 89 LEU O A 106 ARG H 1.0 1.65 2.60 107 107 A 107 GLU N A 114 VAL O 1.0 2.45 3.60 108 108 A 114 VAL O A 107 GLU H 1.0 1.65 2.60 109 109 A 109 ILE N A 112 GLU O 1.0 2.45 3.60 110 110 A 112 GLU O A 109 ILE H 1.0 1.65 2.60 111 111 A 112 GLU H A 109 ILE O 1.0 1.65 2.60 112 112 A 109 ILE O A 112 GLU N 1.0 2.45 3.60 113 113 A 113 LEU H A 128 PHE O 1.0 1.65 2.60 114 114 A 128 PHE O A 113 LEU N 1.0 2.45 3.60 115 115 A 114 VAL H A 107 GLU O 1.0 1.50 2.45 116 116 A 107 GLU O A 114 VAL N 1.0 2.40 3.55 117 117 A 115 GLN H A 126 ARG O 1.0 1.65 2.60 118 118 A 126 ARG O A 115 GLN N 1.0 2.45 3.60 119 119 A 116 THR H A 105 VAL O 1.0 1.65 2.60 120 120 A 105 VAL O A 116 THR N 1.0 2.45 3.60 121 121 A 117 TYR H A 124 ALA O 1.0 1.65 2.60 122 122 A 124 ALA O A 117 TYR N 1.0 2.45 3.60 123 123 A 118 VAL H A 103 ASN O 1.0 1.65 2.60 124 124 A 103 ASN O A 118 VAL N 1.0 2.45 3.60 125 125 A 119 TYR H A 122 VAL O 1.0 1.65 2.60 126 126 A 122 VAL O A 119 TYR N 1.0 2.45 3.60 127 127 A 120 GLU H A 101 GLU O 1.0 1.65 2.60 128 128 A 101 GLU O A 120 GLU N 1.0 2.45 3.60 129 129 A 122 VAL H A 119 TYR O 1.0 1.65 2.60 130 130 A 119 TYR O A 122 VAL N 1.0 2.45 3.60 131 131 A 124 ALA H A 117 TYR O 1.0 1.65 2.60 132 132 A 117 TYR O A 124 ALA N 1.0 2.45 3.60 133 133 A 125 LYS H A 12 GLU O 1.0 1.65 2.60 134 134 A 12 GLU O A 125 LYS N 1.0 2.45 3.60 135 135 A 126 ARG H A 115 GLN O 1.0 1.65 2.60 136 136 A 115 GLN O A 126 ARG N 1.0 2.45 3.60 137 137 A 127 ILE H A 10 ARG O 1.0 1.50 2.45 138 138 A 10 ARG O A 127 ILE N 1.0 2.40 3.55 139 139 A 128 PHE H A 113 LEU O 1.0 1.65 2.60 140 140 A 113 LEU O A 128 PHE N 1.0 2.45 3.60 141 141 A 129 LYS H A 7 LYS O 1.0 1.50 2.45 142 142 A 7 LYS O A 129 LYS N 1.0 2.40 3.55 143 143 A 4 SER H A 40 ILE O 1.0 1.65 2.60 144 144 A 40 ILE O A 4 SER N 1.0 2.45 3.60 145 145 A 28 ARG H A 24 ASN O 1.0 1.65 2.60 146 146 A 24 ASN O A 28 ARG N 1.0 2.45 3.60 147 147 A 29 LYS H A 25 ILE O 1.0 1.65 2.60 148 148 A 25 ILE O A 29 LYS N 1.0 2.45 3.60 149 149 A 32 ALA H A 28 ARG O 1.0 1.65 2.60 150 150 A 28 ARG O A 32 ALA N 1.0 2.45 3.60 151 151 A 82 TRP H A 66 VAL O 1.0 1.65 2.60 152 152 A 66 VAL O A 82 TRP N 1.0 2.45 3.60 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 1 ALA C A 2 PHE N A 2 PHE CA A 2 PHE C 1.0 -89.43 -49.43 PHI 2 2 A 4 SER C A 5 THR N A 5 THR CA A 5 THR C 1.0 -130.06 -90.06 PHI 3 3 A 5 THR C A 6 TRP N A 6 TRP CA A 6 TRP C 1.0 -141.24 -101.24 PHI 4 4 A 6 TRP C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -147.26 -107.26 PHI 5 5 A 7 LYS C A 8 VAL N A 8 VAL CA A 8 VAL C 1.0 -96.14 -56.14 PHI 6 6 A 9 ASP C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -174.36 -113.92 PHI 7 7 A 10 ARG C A 11 SER N A 11 SER CA A 11 SER C 1.0 -148.79 -93.77 PHI 8 8 A 11 SER C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -153.08 -104.22 PHI 9 9 A 13 ASN C A 14 TYR N A 14 TYR CA A 14 TYR C 1.0 -83.17 -43.17 PHI 10 10 A 14 TYR C A 15 ASP N A 15 ASP CA A 15 ASP C 1.0 -81.35 -41.35 PHI 11 11 A 15 ASP C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -83.24 -43.24 PHI 12 12 A 16 LYS C A 17 PHE N A 17 PHE CA A 17 PHE C 1.0 -83.59 -43.59 PHI 13 13 A 17 PHE C A 18 MET N A 18 MET CA A 18 MET C 1.0 -84.47 -44.47 PHI 14 14 A 18 MET C A 19 GLU N A 19 GLU CA A 19 GLU C 1.0 -86.13 -46.13 PHI 15 15 A 19 GLU C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -84.25 -44.25 PHI 16 16 A 23 VAL C A 24 ASN N A 24 ASN CA A 24 ASN C 1.0 -103.07 -44.11 PHI 17 17 A 25 ILE C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -81.90 -41.90 PHI 18 18 A 26 VAL C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -84.43 -44.43 PHI 19 19 A 27 LYS C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -90.99 -41.11 PHI 20 20 A 28 ARG C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -92.21 -32.21 PHI 21 21 A 29 LYS C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -107.72 -17.72 PHI 22 22 A 30 LEU C A 31 ALA N A 31 ALA CA A 31 ALA C 1.0 -92.99 -32.99 PHI 23 23 A 31 ALA C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -97.89 -57.89 PHI 24 24 A 35 ASN C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -140.28 -79.60 PHI 25 25 A 36 LEU C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -139.25 -99.25 PHI 26 26 A 37 LYS C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -147.25 -107.25 PHI 27 27 A 38 LEU C A 39 THR N A 39 THR CA A 39 THR C 1.0 -125.45 -62.29 PHI 28 28 A 39 THR C A 40 ILE N A 40 ILE CA A 40 ILE C 1.0 -154.13 -98.37 PHI 29 29 A 43 GLU C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 50.57 90.57 PHI 30 30 A 44 GLY C A 45 ASN N A 45 ASN CA A 45 ASN C 1.0 -118.16 -78.16 PHI 31 31 A 46 LYS C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -152.34 -112.34 PHI 32 32 A 47 PHE C A 48 THR N A 48 THR CA A 48 THR C 1.0 -124.45 -77.17 PHI 33 33 A 48 THR C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -134.77 -94.77 PHI 34 34 A 49 VAL C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -127.27 -87.27 PHI 35 35 A 50 LYS C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -126.73 -86.73 PHI 36 36 A 51 GLU C A 52 SER N A 52 SER CA A 52 SER C 1.0 -142.03 -102.03 PHI 37 37 A 52 SER C A 53 SER N A 53 SER CA A 53 SER C 1.0 -149.04 -94.34 PHI 38 38 A 54 ALA C A 55 PHE N A 55 PHE CA A 55 PHE C 1.0 -122.23 -77.17 PHI 39 39 A 56 ARG C A 57 ASN N A 57 ASN CA A 57 ASN C 1.0 -141.66 -86.58 PHI 40 40 A 57 ASN C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -153.47 -104.65 PHI 41 41 A 60 VAL C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -180.00 0.00 PHI 42 42 A 61 VAL C A 62 PHE N A 62 PHE CA A 62 PHE C 1.0 -154.92 -114.84 PHI 43 43 A 62 PHE C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -147.56 -107.56 PHI 44 44 A 63 GLU C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -111.69 -60.45 PHI 45 45 A 67 THR C A 68 PHE N A 68 PHE CA A 68 PHE C 1.0 -123.29 -83.29 PHI 46 46 A 68 PHE C A 69 ASN N A 69 ASN CA A 69 ASN C 1.0 -142.30 -102.30 PHI 47 47 A 78 LEU C A 79 ARG N A 79 ARG CA A 79 ARG C 1.0 -137.38 -97.38 PHI 48 48 A 80 GLY C A 81 THR N A 81 THR CA A 81 THR C 1.0 -156.30 -113.04 PHI 49 49 A 81 THR C A 82 TRP N A 82 TRP CA A 82 TRP C 1.0 -155.88 -111.94 PHI 50 50 A 82 TRP C A 83 SER N A 83 SER CA A 83 SER C 1.0 -152.74 -110.42 PHI 51 51 A 83 SER C A 84 LEU N A 84 LEU CA A 84 LEU C 1.0 -140.81 -100.81 PHI 52 52 A 84 LEU C A 85 GLU N A 85 GLU CA A 85 GLU C 1.0 -139.55 -90.91 PHI 53 53 A 85 GLU C A 86 GLY N A 86 GLY CA A 86 GLY C 1.0 52.95 92.95 PHI 54 54 A 86 GLY C A 87 ASN N A 87 ASN CA A 87 ASN C 1.0 -114.40 -74.40 PHI 55 55 A 87 ASN C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -149.93 -101.73 PHI 56 56 A 88 LYS C A 89 LEU N A 89 LEU CA A 89 LEU C 1.0 -129.25 -88.67 PHI 57 57 A 89 LEU C A 90 ILE N A 90 ILE CA A 90 ILE C 1.0 -127.87 -87.87 PHI 58 58 A 91 GLY C A 92 LYS N A 92 LYS CA A 92 LYS C 1.0 -152.22 -86.18 PHI 59 59 A 92 LYS C A 93 PHE N A 93 PHE CA A 93 PHE C 1.0 -144.61 -104.61 PHI 60 60 A 93 PHE C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -156.40 -121.04 PHI 61 61 A 94 LYS C A 95 ARG N A 95 ARG CA A 95 ARG C 1.0 -142.81 -74.29 PHI 62 62 A 95 ARG C A 96 THR N A 96 THR CA A 96 THR C 1.0 -85.61 -45.61 PHI 63 63 A 100 ASN C A 101 GLU N A 101 GLU CA A 101 GLU C 1.0 -112.22 -63.12 PHI 64 64 A 101 GLU C A 102 LEU N A 102 LEU CA A 102 LEU C 1.0 -143.74 -103.74 PHI 65 65 A 102 LEU C A 103 ASN N A 103 ASN CA A 103 ASN C 1.0 -139.26 -99.26 PHI 66 66 A 103 ASN C A 104 THR N A 104 THR CA A 104 THR C 1.0 -145.20 -105.20 PHI 67 67 A 104 THR C A 105 VAL N A 105 VAL CA A 105 VAL C 1.0 -145.01 -105.01 PHI 68 68 A 105 VAL C A 106 ARG N A 106 ARG CA A 106 ARG C 1.0 -146.11 -106.11 PHI 69 69 A 106 ARG C A 107 GLU N A 107 GLU CA A 107 GLU C 1.0 -151.36 -111.36 PHI 70 70 A 110 GLY C A 111 ASP N A 111 ASP CA A 111 ASP C 1.0 -114.32 -74.32 PHI 71 71 A 111 ASP C A 112 GLU N A 112 GLU CA A 112 GLU C 1.0 -141.34 -75.22 PHI 72 72 A 112 GLU C A 113 LEU N A 113 LEU CA A 113 LEU C 1.0 -118.47 -62.31 PHI 73 73 A 113 LEU C A 114 VAL N A 114 VAL CA A 114 VAL C 1.0 -130.65 -89.51 PHI 74 74 A 114 VAL C A 115 GLN N A 115 GLN CA A 115 GLN C 1.0 -127.97 -87.97 PHI 75 75 A 115 GLN C A 116 THR N A 116 THR CA A 116 THR C 1.0 -136.97 -96.97 PHI 76 76 A 116 THR C A 117 TYR N A 117 TYR CA A 117 TYR C 1.0 -142.37 -102.37 PHI 77 77 A 117 TYR C A 118 VAL N A 118 VAL CA A 118 VAL C 1.0 -150.18 -110.18 PHI 78 78 A 118 VAL C A 119 TYR N A 119 TYR CA A 119 TYR C 1.0 -154.89 -114.89 PHI 79 79 A 121 GLY C A 122 VAL N A 122 VAL CA A 122 VAL C 1.0 -106.33 -66.33 PHI 80 80 A 123 GLU C A 124 ALA N A 124 ALA CA A 124 ALA C 1.0 -161.69 -121.69 PHI 81 81 A 124 ALA C A 125 LYS N A 125 LYS CA A 125 LYS C 1.0 -151.10 -111.10 PHI 82 82 A 125 LYS C A 126 ARG N A 126 ARG CA A 126 ARG C 1.0 -161.93 -121.93 PHI 83 83 A 128 PHE C A 129 LYS N A 129 LYS CA A 129 LYS C 1.0 -142.00 -99.00 PHI 84 84 A 129 LYS C A 130 LYS N A 130 LYS CA A 130 LYS C 1.0 -107.31 -56.73 PHI 85 85 A 2 PHE N A 2 PHE CA A 2 PHE C A 3 ASP N 1.0 -54.56 -14.56 PSI 86 86 A 5 THR N A 5 THR CA A 5 THR C A 6 TRP N 1.0 109.66 149.66 PSI 87 87 A 6 TRP N A 6 TRP CA A 6 TRP C A 7 LYS N 1.0 117.10 157.10 PSI 88 88 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 VAL N 1.0 109.24 149.24 PSI 89 89 A 8 VAL N A 8 VAL CA A 8 VAL C A 9 ASP N 1.0 111.64 151.64 PSI 90 90 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 SER N 1.0 141.39 181.39 PSI 91 91 A 11 SER N A 11 SER CA A 11 SER C A 12 GLU N 1.0 128.83 168.83 PSI 92 92 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 ASN N 1.0 122.87 162.87 PSI 93 93 A 14 TYR N A 14 TYR CA A 14 TYR C A 15 ASP N 1.0 -63.30 -23.30 PSI 94 94 A 15 ASP N A 15 ASP CA A 15 ASP C A 16 LYS N 1.0 -62.56 -22.56 PSI 95 95 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 PHE N 1.0 -59.33 -19.33 PSI 96 96 A 17 PHE N A 17 PHE CA A 17 PHE C A 18 MET N 1.0 -65.08 -25.08 PSI 97 97 A 18 MET N A 18 MET CA A 18 MET C A 19 GLU N 1.0 -58.90 -18.90 PSI 98 98 A 19 GLU N A 19 GLU CA A 19 GLU C A 20 LYS N 1.0 -58.33 -18.33 PSI 99 99 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 MET N 1.0 -47.28 -7.28 PSI 100 100 A 25 ILE N A 25 ILE CA A 25 ILE C A 26 VAL N 1.0 -67.91 -27.91 PSI 101 101 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 LYS N 1.0 -60.06 -20.06 PSI 102 102 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 ARG N 1.0 -57.58 -17.58 PSI 103 103 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 LYS N 1.0 -61.64 -21.64 PSI 104 104 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 LEU N 1.0 -65.70 -25.70 PSI 105 105 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 ALA N 1.0 -53.05 -13.05 PSI 106 106 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 ALA N 1.0 -56.54 -16.54 PSI 107 107 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 HIS N 1.0 -44.48 -1.06 PSI 108 108 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 LYS N 1.0 116.44 156.44 PSI 109 109 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 LEU N 1.0 117.33 157.33 PSI 110 110 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 THR N 1.0 113.15 153.15 PSI 111 111 A 39 THR N A 39 THR CA A 39 THR C A 40 ILE N 1.0 123.50 163.50 PSI 112 112 A 40 ILE N A 40 ILE CA A 40 ILE C A 41 THR N 1.0 116.33 156.33 PSI 113 113 A 44 GLY N A 44 GLY CA A 44 GLY C A 45 ASN N 1.0 -143.09 -103.09 PSI 114 114 A 45 ASN N A 45 ASN CA A 45 ASN C A 46 LYS N 1.0 -19.10 20.90 PSI 115 115 A 47 PHE N A 47 PHE CA A 47 PHE C A 48 THR N 1.0 133.97 173.97 PSI 116 116 A 48 THR N A 48 THR CA A 48 THR C A 49 VAL N 1.0 120.29 161.51 PSI 117 117 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 LYS N 1.0 112.19 152.19 PSI 118 118 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 GLU N 1.0 112.69 152.69 PSI 119 119 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 SER N 1.0 117.87 157.87 PSI 120 120 A 52 SER N A 52 SER CA A 52 SER C A 53 SER N 1.0 117.92 170.18 PSI 121 121 A 53 SER N A 53 SER CA A 53 SER C A 54 ALA N 1.0 148.84 188.84 PSI 122 122 A 55 PHE N A 55 PHE CA A 55 PHE C A 56 ARG N 1.0 -26.49 14.55 PSI 123 123 A 57 ASN N A 57 ASN CA A 57 ASN C A 58 ILE N 1.0 125.94 165.94 PSI 124 124 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 GLU N 1.0 129.96 169.96 PSI 125 125 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 PHE N 1.0 119.45 159.45 PSI 126 126 A 62 PHE N A 62 PHE CA A 62 PHE C A 63 GLU N 1.0 124.77 164.77 PSI 127 127 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 LEU N 1.0 118.67 158.67 PSI 128 128 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 GLY N 1.0 102.51 142.51 PSI 129 129 A 68 PHE N A 68 PHE CA A 68 PHE C A 69 ASN N 1.0 126.81 172.85 PSI 130 130 A 69 ASN N A 69 ASN CA A 69 ASN C A 70 TYR N 1.0 118.92 158.92 PSI 131 131 A 79 ARG N A 79 ARG CA A 79 ARG C A 80 GLY N 1.0 106.78 146.78 PSI 132 132 A 81 THR N A 81 THR CA A 81 THR C A 82 TRP N 1.0 134.56 174.56 PSI 133 133 A 82 TRP N A 82 TRP CA A 82 TRP C A 83 SER N 1.0 127.97 167.97 PSI 134 134 A 83 SER N A 83 SER CA A 83 SER C A 84 LEU N 1.0 109.16 149.16 PSI 135 135 A 84 LEU N A 84 LEU CA A 84 LEU C A 85 GLU N 1.0 107.93 147.93 PSI 136 136 A 85 GLU N A 85 GLU CA A 85 GLU C A 86 GLY N 1.0 94.57 139.81 PSI 137 137 A 86 GLY N A 86 GLY CA A 86 GLY C A 87 ASN N 1.0 -141.68 -101.68 PSI 138 138 A 87 ASN N A 87 ASN CA A 87 ASN C A 88 LYS N 1.0 -19.46 20.54 PSI 139 139 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 LEU N 1.0 118.28 158.28 PSI 140 140 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 ILE N 1.0 104.74 144.74 PSI 141 141 A 90 ILE N A 90 ILE CA A 90 ILE C A 91 GLY N 1.0 96.28 136.28 PSI 142 142 A 92 LYS N A 92 LYS CA A 92 LYS C A 93 PHE N 1.0 117.74 157.74 PSI 143 143 A 93 PHE N A 93 PHE CA A 93 PHE C A 94 LYS N 1.0 130.33 170.33 PSI 144 144 A 94 LYS N A 94 LYS CA A 94 LYS C A 95 ARG N 1.0 120.34 160.34 PSI 145 145 A 95 ARG N A 95 ARG CA A 95 ARG C A 96 THR N 1.0 121.70 161.70 PSI 146 146 A 96 THR N A 96 THR CA A 96 THR C A 97 ASP N 1.0 -57.71 -8.47 PSI 147 147 A 101 GLU N A 101 GLU CA A 101 GLU C A 102 LEU N 1.0 112.78 152.78 PSI 148 148 A 102 LEU N A 102 LEU CA A 102 LEU C A 103 ASN N 1.0 111.95 151.95 PSI 149 149 A 103 ASN N A 103 ASN CA A 103 ASN C A 104 THR N 1.0 112.25 152.25 PSI 150 150 A 104 THR N A 104 THR CA A 104 THR C A 105 VAL N 1.0 118.25 158.25 PSI 151 151 A 105 VAL N A 105 VAL CA A 105 VAL C A 106 ARG N 1.0 114.86 154.86 PSI 152 152 A 106 ARG N A 106 ARG CA A 106 ARG C A 107 GLU N 1.0 116.64 156.64 PSI 153 153 A 107 GLU N A 107 GLU CA A 107 GLU C A 108 ILE N 1.0 118.41 158.41 PSI 154 154 A 111 ASP N A 111 ASP CA A 111 ASP C A 112 GLU N 1.0 -24.49 15.51 PSI 155 155 A 112 GLU N A 112 GLU CA A 112 GLU C A 113 LEU N 1.0 125.16 176.64 PSI 156 156 A 113 LEU N A 113 LEU CA A 113 LEU C A 114 VAL N 1.0 130.85 170.85 PSI 157 157 A 114 VAL N A 114 VAL CA A 114 VAL C A 115 GLN N 1.0 108.60 148.60 PSI 158 158 A 115 GLN N A 115 GLN CA A 115 GLN C A 116 THR N 1.0 100.12 140.12 PSI 159 159 A 116 THR N A 116 THR CA A 116 THR C A 117 TYR N 1.0 103.28 143.28 PSI 160 160 A 117 TYR N A 117 TYR CA A 117 TYR C A 118 VAL N 1.0 121.49 161.49 PSI 161 161 A 118 VAL N A 118 VAL CA A 118 VAL C A 119 TYR N 1.0 130.04 170.04 PSI 162 162 A 120 GLU N A 120 GLU CA A 120 GLU C A 121 GLY N 1.0 92.55 132.55 PSI 163 163 A 124 ALA N A 124 ALA CA A 124 ALA C A 125 LYS N 1.0 136.32 176.32 PSI 164 164 A 125 LYS N A 125 LYS CA A 125 LYS C A 126 ARG N 1.0 124.24 164.24 PSI 165 165 A 126 ARG N A 126 ARG CA A 126 ARG C A 127 ILE N 1.0 115.79 155.79 PSI 166 166 A 129 LYS N A 129 LYS CA A 129 LYS C A 130 LYS N 1.0 121.39 161.39 PSI 167 167 A 130 LYS N A 130 LYS CA A 130 LYS C A 131 ASP N 1.0 111.06 151.06 PSI stop_ save_