data_nef_c15084_2jn3 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ALA start . . 2 A 2 PHE middle . . 3 A 3 SER middle . . 4 A 4 GLY middle . false 5 A 5 THR middle . . 6 A 6 TRP middle . . 7 A 7 GLN middle . . 8 A 8 VAL middle . . 9 A 9 TYR middle . . 10 A 10 ALA middle . . 11 A 11 GLN middle . . 12 A 12 GLU middle . . 13 A 13 ASN middle . . 14 A 14 TYR middle . . 15 A 15 GLU middle . . 16 A 16 GLU middle . . 17 A 17 PHE middle . . 18 A 18 LEU middle . . 19 A 19 LYS middle . . 20 A 20 ALA middle . . 21 A 21 LEU middle . . 22 A 22 ALA middle . . 23 A 23 LEU middle . . 24 A 24 PRO middle . false 25 A 25 GLU middle . . 26 A 26 ASP middle . . 27 A 27 LEU middle . . 28 A 28 ILE middle . . 29 A 29 LYS middle . . 30 A 30 MET middle . . 31 A 31 ALA middle . . 32 A 32 ARG middle . . 33 A 33 ASP middle . . 34 A 34 ILE middle . . 35 A 35 LYS middle . . 36 A 36 PRO middle . false 37 A 37 ILE middle . . 38 A 38 VAL middle . . 39 A 39 GLU middle . . 40 A 40 ILE middle . . 41 A 41 GLN middle . . 42 A 42 GLN middle . . 43 A 43 LYS middle . . 44 A 44 GLY middle . false 45 A 45 ASP middle . . 46 A 46 ASP middle . . 47 A 47 PHE middle . . 48 A 48 VAL middle . . 49 A 49 VAL middle . . 50 A 50 THR middle . . 51 A 51 SER middle . . 52 A 52 LYS middle . . 53 A 53 THR middle . . 54 A 54 PRO middle . false 55 A 55 ARG middle . . 56 A 56 GLN middle . . 57 A 57 THR middle . . 58 A 58 VAL middle . . 59 A 59 THR middle . . 60 A 60 ASN middle . . 61 A 61 SER middle . . 62 A 62 PHE middle . . 63 A 63 THR middle . . 64 A 64 LEU middle . . 65 A 65 GLY middle . false 66 A 66 LYS middle . . 67 A 67 GLU middle . . 68 A 68 ALA middle . . 69 A 69 ASP middle . . 70 A 70 ILE middle . . 71 A 71 THR middle . . 72 A 72 THR middle . . 73 A 73 MET middle . . 74 A 74 ASP middle . . 75 A 75 GLY middle . false 76 A 76 LYS middle . . 77 A 77 LYS middle . . 78 A 78 LEU middle . . 79 A 79 LYS middle . . 80 A 80 CYS middle . . 81 A 81 THR middle . . 82 A 82 VAL middle . . 83 A 83 HIS middle . . 84 A 84 LEU middle . . 85 A 85 ALA middle . . 86 A 86 ASN middle . . 87 A 87 GLY middle . false 88 A 88 LYS middle . . 89 A 89 LEU middle . . 90 A 90 VAL middle . . 91 A 91 THR middle . . 92 A 92 LYS middle . . 93 A 93 SER middle . . 94 A 94 GLU middle . . 95 A 95 LYS middle . . 96 A 96 PHE middle . . 97 A 97 SER middle . . 98 A 98 HIS middle . . 99 A 99 GLU middle . . 100 A 100 GLN middle . . 101 A 101 GLU middle . . 102 A 102 VAL middle . . 103 A 103 LYS middle . . 104 A 104 GLY middle . false 105 A 105 ASN middle . . 106 A 106 GLU middle . . 107 A 107 MET middle . . 108 A 108 VAL middle . . 109 A 109 GLU middle . . 110 A 110 THR middle . . 111 A 111 ILE middle . . 112 A 112 THR middle . . 113 A 113 PHE middle . . 114 A 114 GLY middle . false 115 A 115 GLY middle . false 116 A 116 VAL middle . . 117 A 117 THR middle . . 118 A 118 LEU middle . . 119 A 119 ILE middle . . 120 A 120 ARG middle . . 121 A 121 ARG middle . . 122 A 122 SER middle . . 123 A 123 LYS middle . . 124 A 124 ARG middle . . 125 A 125 VAL end . . 126 B 1 JN3 . . . 127 B 2 JN3 . . . 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 HA H 1 4.493 0.03 A 1 ALA HB% H 1 1.376 0.03 A 1 ALA C C 13 177.300 0.1 A 1 ALA CA C 13 52.720 0.1 A 1 ALA CB C 13 18.890 0.1 A 2 PHE H H 1 8.436 0.03 A 2 PHE HA H 1 4.382 0.03 A 2 PHE HBx H 1 2.960 0.03 A 2 PHE HBy H 1 3.288 0.03 A 2 PHE HD1 H 1 7.320 0.03 A 2 PHE HD2 H 1 7.320 0.03 A 2 PHE HE1 H 1 7.180 0.03 A 2 PHE HE2 H 1 7.180 0.03 A 2 PHE HZ H 1 7.520 0.03 A 2 PHE C C 13 175.500 0.1 A 2 PHE CA C 13 60.800 0.1 A 2 PHE CB C 13 40.430 0.1 A 2 PHE CD1 C 13 129.300 0.1 A 2 PHE CD2 C 13 129.300 0.1 A 2 PHE CZ C 13 128.900 0.1 A 2 PHE N N 15 116.200 0.1 A 3 SER H H 1 7.952 0.03 A 3 SER HA H 1 4.382 0.03 A 3 SER HB2 H 1 3.999 0.03 A 3 SER HB3 H 1 3.999 0.03 A 3 SER C C 13 174.100 0.1 A 3 SER CA C 13 59.770 0.1 A 3 SER CB C 13 63.780 0.1 A 3 SER N N 15 111.150 0.1 A 4 GLY H H 1 9.035 0.03 A 4 GLY HAx H 1 3.780 0.03 A 4 GLY HAy H 1 4.054 0.03 A 4 GLY C C 13 170.700 0.1 A 4 GLY CA C 13 44.040 0.1 A 4 GLY N N 15 111.300 0.1 A 5 THR H H 1 8.164 0.03 A 5 THR HA H 1 4.984 0.03 A 5 THR HB H 1 3.835 0.03 A 5 THR HG2% H 1 1.070 0.03 A 5 THR C C 13 172.500 0.1 A 5 THR CA C 13 62.310 0.1 A 5 THR CB C 13 68.808 0.1 A 5 THR CG2 C 13 22.190 0.1 A 5 THR N N 15 117.600 0.1 A 6 TRP H H 1 9.626 0.03 A 6 TRP HA H 1 5.146 0.03 A 6 TRP HBy H 1 3.070 0.03 A 6 TRP HBx H 1 3.030 0.03 A 6 TRP HD1 H 1 6.950 0.03 A 6 TRP HE1 H 1 9.410 0.03 A 6 TRP HE3 H 1 6.930 0.03 A 6 TRP HH2 H 1 6.990 0.03 A 6 TRP HZ2 H 1 7.300 0.03 A 6 TRP HZ3 H 1 6.780 0.03 A 6 TRP C C 13 174.900 0.1 A 6 TRP CA C 13 55.160 0.1 A 6 TRP CB C 13 32.130 0.1 A 6 TRP CD1 C 13 125.200 0.1 A 6 TRP CE3 C 13 116.500 0.1 A 6 TRP CH2 C 13 121.500 0.1 A 6 TRP CZ2 C 13 112.200 0.1 A 6 TRP N N 15 127.300 0.1 A 7 GLN H H 1 9.287 0.03 A 7 GLN HA H 1 4.929 0.03 A 7 GLN HBx H 1 1.960 0.03 A 7 GLN HBy H 1 2.085 0.03 A 7 GLN HGx H 1 2.207 0.03 A 7 GLN HGy H 1 2.404 0.03 A 7 GLN C C 13 175.600 0.1 A 7 GLN CA C 13 53.900 0.1 A 7 GLN CB C 13 31.900 0.1 A 7 GLN CD C 13 179.240 0.1 A 7 GLN CG C 13 33.600 0.1 A 7 GLN N N 15 121.699 0.1 A 8 VAL H H 1 8.215 0.03 A 8 VAL HA H 1 4.450 0.03 A 8 VAL HB H 1 1.910 0.03 A 8 VAL HGx% H 1 0.740 0.03 A 8 VAL HGy% H 1 0.820 0.03 A 8 VAL C C 13 175.100 0.1 A 8 VAL CA C 13 63.000 0.1 A 8 VAL CB C 13 31.800 0.1 A 8 VAL CG1 C 13 19.800 0.1 A 8 VAL CG2 C 13 21.600 0.1 A 8 VAL N N 15 131.184 0.1 A 9 TYR H H 1 9.519 0.03 A 9 TYR HA H 1 5.082 0.03 A 9 TYR HBx H 1 2.796 0.03 A 9 TYR HBy H 1 3.343 0.03 A 9 TYR HD1 H 1 7.098 0.03 A 9 TYR HD2 H 1 7.098 0.03 A 9 TYR HEy H 1 6.796 0.03 A 9 TYR HEx H 1 6.790 0.03 A 9 TYR C C 13 173.800 0.1 A 9 TYR CA C 13 56.480 0.1 A 9 TYR CB C 13 40.690 0.1 A 9 TYR CD1 C 13 131.500 0.1 A 9 TYR CD2 C 13 131.500 0.1 A 9 TYR CE1 C 13 116.100 0.1 A 9 TYR CE2 C 13 116.100 0.1 A 9 TYR N N 15 123.200 0.1 A 10 ALA H H 1 7.275 0.03 A 10 ALA HA H 1 4.664 0.03 A 10 ALA HB% H 1 1.060 0.03 A 10 ALA C C 13 174.800 0.1 A 10 ALA CA C 13 51.780 0.1 A 10 ALA CB C 13 21.650 0.1 A 10 ALA N N 15 125.600 0.1 A 11 GLN H H 1 8.729 0.03 A 11 GLN HA H 1 5.199 0.03 A 11 GLN HB2 H 1 1.670 0.03 A 11 GLN HB3 H 1 1.670 0.03 A 11 GLN HGx H 1 1.720 0.03 A 11 GLN HGy H 1 1.910 0.03 A 11 GLN C C 13 174.000 0.1 A 11 GLN CA C 13 54.050 0.1 A 11 GLN CB C 13 31.600 0.1 A 11 GLN CD C 13 177.200 0.1 A 11 GLN CG C 13 34.300 0.1 A 11 GLN N N 15 118.700 0.1 A 12 GLU H H 1 8.983 0.03 A 12 GLU HA H 1 4.505 0.03 A 12 GLU HBx H 1 1.887 0.03 A 12 GLU HBy H 1 2.049 0.03 A 12 GLU HGx H 1 2.177 0.03 A 12 GLU HGy H 1 2.240 0.03 A 12 GLU C C 13 175.400 0.1 A 12 GLU CA C 13 55.620 0.1 A 12 GLU CB C 13 31.300 0.1 A 12 GLU CD C 13 182.900 0.1 A 12 GLU CG C 13 35.533 0.1 A 12 GLU N N 15 123.700 0.1 A 13 ASN H H 1 9.083 0.03 A 13 ASN HA H 1 4.701 0.03 A 13 ASN HBy H 1 3.370 0.03 A 13 ASN HBx H 1 3.206 0.03 A 13 ASN HD2x H 1 7.040 0.03 A 13 ASN HD2y H 1 7.680 0.03 A 13 ASN C C 13 175.300 0.1 A 13 ASN CA C 13 53.900 0.1 A 13 ASN CB C 13 36.647 0.1 A 13 ASN CG C 13 178.590 0.1 A 13 ASN N N 15 117.900 0.1 A 14 TYR H H 1 7.808 0.03 A 14 TYR HA H 1 4.327 0.03 A 14 TYR HBx H 1 2.851 0.03 A 14 TYR HBy H 1 3.015 0.03 A 14 TYR HD1 H 1 7.055 0.03 A 14 TYR HD2 H 1 7.055 0.03 A 14 TYR HE1 H 1 6.840 0.03 A 14 TYR HE2 H 1 6.840 0.03 A 14 TYR C C 13 176.400 0.1 A 14 TYR CA C 13 60.340 0.1 A 14 TYR CB C 13 39.040 0.1 A 14 TYR CD1 C 13 129.900 0.1 A 14 TYR CD2 C 13 129.900 0.1 A 14 TYR CE1 C 13 115.500 0.1 A 14 TYR CE2 C 13 115.500 0.1 A 14 TYR N N 15 118.000 0.1 A 15 GLU H H 1 8.954 0.03 A 15 GLU HA H 1 3.479 0.03 A 15 GLU HBy H 1 1.976 0.03 A 15 GLU HBx H 1 1.920 0.03 A 15 GLU HGx H 1 2.167 0.03 A 15 GLU HGy H 1 2.216 0.03 A 15 GLU C C 13 178.600 0.1 A 15 GLU CA C 13 60.770 0.1 A 15 GLU CB C 13 28.390 0.1 A 15 GLU CD C 13 183.040 0.1 A 15 GLU CG C 13 37.000 0.1 A 15 GLU N N 15 118.500 0.1 A 16 GLU H H 1 9.008 0.03 A 16 GLU HA H 1 3.831 0.03 A 16 GLU HBx H 1 1.960 0.03 A 16 GLU HBy H 1 2.002 0.03 A 16 GLU HGy H 1 2.490 0.03 A 16 GLU HGx H 1 2.290 0.03 A 16 GLU C C 13 179.000 0.1 A 16 GLU CA C 13 59.840 0.1 A 16 GLU CB C 13 28.700 0.1 A 16 GLU CD C 13 183.540 0.1 A 16 GLU CG C 13 37.010 0.1 A 16 GLU N N 15 118.300 0.1 A 17 PHE H H 1 8.313 0.03 A 17 PHE HA H 1 3.941 0.03 A 17 PHE HBy H 1 3.281 0.03 A 17 PHE HBx H 1 3.164 0.03 A 17 PHE HD1 H 1 6.920 0.03 A 17 PHE HD2 H 1 6.920 0.03 A 17 PHE HE1 H 1 7.150 0.03 A 17 PHE HE2 H 1 7.150 0.03 A 17 PHE HZ H 1 6.830 0.03 A 17 PHE C C 13 175.900 0.1 A 17 PHE CA C 13 62.290 0.1 A 17 PHE CB C 13 40.100 0.1 A 17 PHE CD1 C 13 129.600 0.1 A 17 PHE CD2 C 13 129.600 0.1 A 17 PHE CE1 C 13 129.100 0.1 A 17 PHE CE2 C 13 129.100 0.1 A 17 PHE CZ C 13 126.700 0.1 A 17 PHE N N 15 123.400 0.1 A 18 LEU H H 1 8.247 0.03 A 18 LEU HA H 1 3.661 0.03 A 18 LEU HBx H 1 1.060 0.03 A 18 LEU HBy H 1 1.720 0.03 A 18 LEU HDx% H 1 0.210 0.03 A 18 LEU HDy% H 1 0.580 0.03 A 18 LEU HG H 1 1.550 0.03 A 18 LEU C C 13 178.900 0.1 A 18 LEU CA C 13 57.860 0.1 A 18 LEU CB C 13 40.550 0.1 A 18 LEU CD1 C 13 25.090 0.1 A 18 LEU CD2 C 13 21.550 0.1 A 18 LEU CG C 13 25.420 0.1 A 18 LEU N N 15 116.800 0.1 A 19 LYS H H 1 7.753 0.03 A 19 LYS HA H 1 3.945 0.03 A 19 LYS HB2 H 1 1.800 0.03 A 19 LYS HB3 H 1 1.800 0.03 A 19 LYS HD2 H 1 1.660 0.03 A 19 LYS HD3 H 1 1.660 0.03 A 19 LYS HE2 H 1 2.860 0.03 A 19 LYS HE3 H 1 2.860 0.03 A 19 LYS HGy H 1 1.539 0.03 A 19 LYS HGx H 1 1.350 0.03 A 19 LYS C C 13 180.400 0.1 A 19 LYS CA C 13 58.820 0.1 A 19 LYS CB C 13 31.500 0.1 A 19 LYS CD C 13 28.500 0.1 A 19 LYS CE C 13 41.700 0.1 A 19 LYS CG C 13 25.108 0.1 A 19 LYS N N 15 116.400 0.1 A 20 ALA H H 1 7.914 0.03 A 20 ALA HA H 1 4.102 0.03 A 20 ALA HB% H 1 1.484 0.03 A 20 ALA C C 13 178.800 0.1 A 20 ALA CA C 13 54.800 0.1 A 20 ALA CB C 13 17.430 0.1 A 20 ALA N N 15 126.400 0.1 A 21 LEU H H 1 7.360 0.03 A 21 LEU HA H 1 3.349 0.03 A 21 LEU HBx H 1 1.101 0.03 A 21 LEU HBy H 1 1.265 0.03 A 21 LEU HDx% H 1 -0.164 0.03 A 21 LEU HDy% H 1 0.185 0.03 A 21 LEU HG H 1 0.888 0.03 A 21 LEU C C 13 176.000 0.1 A 21 LEU CA C 13 55.000 0.1 A 21 LEU CB C 13 42.630 0.1 A 21 LEU CD1 C 13 22.190 0.1 A 21 LEU CD2 C 13 24.780 0.1 A 21 LEU CG C 13 24.770 0.1 A 21 LEU N N 15 116.700 0.1 A 22 ALA H H 1 7.828 0.03 A 22 ALA HA H 1 3.879 0.03 A 22 ALA HB% H 1 1.351 0.03 A 22 ALA C C 13 177.000 0.1 A 22 ALA CA C 13 52.170 0.1 A 22 ALA CB C 13 15.482 0.1 A 22 ALA N N 15 118.200 0.1 A 23 LEU H H 1 6.823 0.03 A 23 LEU HA H 1 4.350 0.03 A 23 LEU HB2 H 1 1.260 0.03 A 23 LEU HB3 H 1 1.260 0.03 A 23 LEU HDx% H 1 0.720 0.03 A 23 LEU HDy% H 1 0.710 0.03 A 23 LEU HG H 1 1.620 0.03 A 23 LEU C C 13 173.800 0.1 A 23 LEU CA C 13 53.290 0.1 A 23 LEU CB C 13 40.340 0.1 A 23 LEU CD1 C 13 26.478 0.1 A 23 LEU CD2 C 13 22.460 0.1 A 23 LEU CG C 13 26.500 0.1 A 23 LEU N N 15 118.000 0.1 A 24 PRO HA H 1 4.385 0.03 A 24 PRO HBx H 1 1.921 0.03 A 24 PRO HBy H 1 2.448 0.03 A 24 PRO HDy H 1 3.950 0.03 A 24 PRO HDx H 1 3.440 0.03 A 24 PRO HG2 H 1 2.090 0.03 A 24 PRO HG3 H 1 2.090 0.03 A 24 PRO C C 13 177.700 0.1 A 24 PRO CA C 13 62.320 0.1 A 24 PRO CB C 13 31.910 0.1 A 24 PRO CD C 13 15.000 0.1 A 24 PRO CG C 13 27.800 0.1 A 25 GLU H H 1 8.840 0.03 A 25 GLU HA H 1 3.784 0.03 A 25 GLU HB2 H 1 2.035 0.03 A 25 GLU HB3 H 1 2.035 0.03 A 25 GLU HG2 H 1 2.264 0.03 A 25 GLU HG3 H 1 2.264 0.03 A 25 GLU C C 13 178.200 0.1 A 25 GLU CA C 13 59.830 0.1 A 25 GLU CB C 13 29.300 0.1 A 25 GLU CD C 13 183.230 0.1 A 25 GLU CG C 13 35.993 0.1 A 25 GLU N N 15 123.700 0.1 A 26 ASP H H 1 8.905 0.03 A 26 ASP HA H 1 4.294 0.03 A 26 ASP HBx H 1 2.503 0.03 A 26 ASP HBy H 1 2.636 0.03 A 26 ASP C C 13 178.100 0.1 A 26 ASP CA C 13 56.700 0.1 A 26 ASP CB C 13 39.500 0.1 A 26 ASP CG C 13 179.280 0.1 A 26 ASP N N 15 116.500 0.1 A 27 LEU H H 1 7.197 0.03 A 27 LEU HA H 1 4.241 0.03 A 27 LEU HBx H 1 1.574 0.03 A 27 LEU HBy H 1 1.812 0.03 A 27 LEU HDx% H 1 0.940 0.03 A 27 LEU HDy% H 1 0.910 0.03 A 27 LEU HG H 1 1.534 0.03 A 27 LEU C C 13 177.800 0.1 A 27 LEU CA C 13 58.900 0.1 A 27 LEU CB C 13 41.620 0.1 A 27 LEU CD1 C 13 23.650 0.1 A 27 LEU CD2 C 13 25.620 0.1 A 27 LEU CG C 13 26.990 0.1 A 27 LEU N N 15 121.700 0.1 A 28 ILE H H 1 7.835 0.03 A 28 ILE HA H 1 3.179 0.03 A 28 ILE HB H 1 1.770 0.03 A 28 ILE HD1% H 1 0.605 0.03 A 28 ILE HG12 H 1 1.530 0.03 A 28 ILE HG13 H 1 1.530 0.03 A 28 ILE HG2% H 1 0.738 0.03 A 28 ILE C C 13 177.500 0.1 A 28 ILE CA C 13 66.508 0.1 A 28 ILE CB C 13 37.110 0.1 A 28 ILE CD1 C 13 47.860 0.1 A 28 ILE CG1 C 13 29.550 0.1 A 28 ILE CG2 C 13 16.290 0.1 A 28 ILE N N 15 119.900 0.1 A 29 LYS H H 1 7.753 0.03 A 29 LYS HA H 1 3.877 0.03 A 29 LYS HB2 H 1 1.851 0.03 A 29 LYS HB3 H 1 1.851 0.03 A 29 LYS HD2 H 1 1.670 0.03 A 29 LYS HD3 H 1 1.670 0.03 A 29 LYS HE2 H 1 2.900 0.03 A 29 LYS HE3 H 1 2.900 0.03 A 29 LYS HGx H 1 1.350 0.03 A 29 LYS HGy H 1 1.540 0.03 A 29 LYS C C 13 179.100 0.1 A 29 LYS CA C 13 59.530 0.1 A 29 LYS CB C 13 32.300 0.1 A 29 LYS CD C 13 28.900 0.1 A 29 LYS CE C 13 41.700 0.1 A 29 LYS CG C 13 25.400 0.1 A 29 LYS N N 15 116.400 0.1 A 30 MET H H 1 7.457 0.03 A 30 MET HA H 1 4.262 0.03 A 30 MET HBx H 1 2.120 0.03 A 30 MET HBy H 1 2.230 0.03 A 30 MET HE% H 1 2.000 0.03 A 30 MET HGx H 1 2.590 0.03 A 30 MET HGy H 1 2.680 0.03 A 30 MET C C 13 177.700 0.1 A 30 MET CA C 13 57.550 0.1 A 30 MET CB C 13 32.800 0.1 A 30 MET CE C 13 16.600 0.1 A 30 MET CG C 13 31.600 0.1 A 30 MET N N 15 116.900 0.1 A 31 ALA H H 1 8.515 0.03 A 31 ALA HA H 1 4.260 0.03 A 31 ALA HB% H 1 1.351 0.03 A 31 ALA C C 13 179.900 0.1 A 31 ALA CA C 13 52.870 0.1 A 31 ALA CB C 13 19.016 0.1 A 31 ALA N N 15 120.200 0.1 A 32 ARG H H 1 7.724 0.03 A 32 ARG HA H 1 4.038 0.03 A 32 ARG HBx H 1 1.820 0.03 A 32 ARG HBy H 1 1.999 0.03 A 32 ARG HD2 H 1 3.199 0.03 A 32 ARG HD3 H 1 3.199 0.03 A 32 ARG HGx H 1 1.669 0.03 A 32 ARG HGy H 1 1.788 0.03 A 32 ARG C C 13 176.300 0.1 A 32 ARG CA C 13 60.320 0.1 A 32 ARG CB C 13 30.180 0.1 A 32 ARG CD C 13 43.370 0.1 A 32 ARG CG C 13 26.670 0.1 A 32 ARG N N 15 121.000 0.1 A 33 ASP H H 1 8.290 0.03 A 33 ASP HA H 1 4.918 0.03 A 33 ASP HBx H 1 2.520 0.03 A 33 ASP HBy H 1 2.880 0.03 A 33 ASP C C 13 175.500 0.1 A 33 ASP CA C 13 53.850 0.1 A 33 ASP CB C 13 41.400 0.1 A 33 ASP CG C 13 180.230 0.1 A 33 ASP N N 15 116.000 0.1 A 34 ILE H H 1 7.257 0.03 A 34 ILE HA H 1 4.085 0.03 A 34 ILE HB H 1 1.931 0.03 A 34 ILE HD1% H 1 0.890 0.03 A 34 ILE HG12 H 1 1.380 0.03 A 34 ILE HG13 H 1 1.660 0.03 A 34 ILE HG2% H 1 0.840 0.03 A 34 ILE C C 13 175.800 0.1 A 34 ILE CA C 13 60.280 0.1 A 34 ILE CB C 13 37.500 0.1 A 34 ILE CD1 C 13 46.960 0.1 A 34 ILE CG1 C 13 27.600 0.1 A 34 ILE CG2 C 13 17.379 0.1 A 34 ILE N N 15 120.300 0.1 A 35 LYS H H 1 8.952 0.03 A 35 LYS HA H 1 4.660 0.03 A 35 LYS HBx H 1 1.610 0.03 A 35 LYS HBy H 1 1.860 0.03 A 35 LYS HDx H 1 1.070 0.03 A 35 LYS HDy H 1 1.320 0.03 A 35 LYS HG2 H 1 1.340 0.03 A 35 LYS HG3 H 1 1.340 0.03 A 35 LYS C C 13 172.800 0.1 A 35 LYS CA C 13 52.430 0.1 A 35 LYS CB C 13 32.160 0.1 A 35 LYS CD C 13 24.100 0.1 A 35 LYS CE C 13 41.700 0.1 A 35 LYS CG C 13 32.100 0.1 A 35 LYS N N 15 130.400 0.1 A 36 PRO HA H 1 4.440 0.03 A 36 PRO HBy H 1 2.120 0.03 A 36 PRO HBx H 1 1.630 0.03 A 36 PRO HDy H 1 3.880 0.03 A 36 PRO HDx H 1 3.340 0.03 A 36 PRO HG2 H 1 1.780 0.03 A 36 PRO HG3 H 1 1.780 0.03 A 36 PRO CA C 13 63.000 0.1 A 36 PRO CB C 13 32.300 0.1 A 36 PRO CD C 13 16.100 0.1 A 36 PRO CG C 13 27.000 0.1 A 37 ILE H H 1 8.420 0.03 A 37 ILE HA H 1 4.820 0.03 A 37 ILE HB H 1 1.671 0.03 A 37 ILE HD1% H 1 0.860 0.03 A 37 ILE HG12 H 1 1.060 0.03 A 37 ILE HG13 H 1 0.864 0.03 A 37 ILE HG2% H 1 0.874 0.03 A 37 ILE C C 13 175.100 0.1 A 37 ILE CA C 13 59.970 0.1 A 37 ILE CB C 13 39.918 0.1 A 37 ILE CD1 C 13 48.000 0.1 A 37 ILE CG1 C 13 28.470 0.1 A 37 ILE CG2 C 13 17.414 0.1 A 38 VAL H H 1 9.436 0.03 A 38 VAL HA H 1 5.170 0.03 A 38 VAL HB H 1 2.004 0.03 A 38 VAL HGx% H 1 0.880 0.03 A 38 VAL HGy% H 1 1.000 0.03 A 38 VAL C C 13 174.500 0.1 A 38 VAL CA C 13 60.542 0.1 A 38 VAL CB C 13 34.720 0.1 A 38 VAL CG1 C 13 21.200 0.1 A 38 VAL N N 15 128.700 0.1 A 39 GLU H H 1 9.525 0.03 A 39 GLU HA H 1 5.413 0.03 A 39 GLU HBy H 1 2.051 0.03 A 39 GLU HBx H 1 1.989 0.03 A 39 GLU HGx H 1 2.176 0.03 A 39 GLU HGy H 1 2.270 0.03 A 39 GLU C C 13 175.800 0.1 A 39 GLU CA C 13 54.250 0.1 A 39 GLU CB C 13 31.900 0.1 A 39 GLU CD C 13 183.160 0.1 A 39 GLU CG C 13 36.000 0.1 A 39 GLU N N 15 128.000 0.1 A 40 ILE H H 1 9.633 0.03 A 40 ILE HA H 1 5.071 0.03 A 40 ILE HB H 1 2.382 0.03 A 40 ILE HD1% H 1 0.803 0.03 A 40 ILE HG12 H 1 1.890 0.03 A 40 ILE HG13 H 1 1.120 0.03 A 40 ILE HG2% H 1 0.880 0.03 A 40 ILE C C 13 175.600 0.1 A 40 ILE CA C 13 61.730 0.1 A 40 ILE CB C 13 40.200 0.1 A 40 ILE CD1 C 13 47.600 0.1 A 40 ILE CG1 C 13 28.300 0.1 A 40 ILE CG2 C 13 16.800 0.1 A 40 ILE N N 15 125.800 0.1 A 41 GLN H H 1 9.262 0.03 A 41 GLN HA H 1 4.661 0.03 A 41 GLN HBy H 1 1.997 0.03 A 41 GLN HBx H 1 1.900 0.03 A 41 GLN HG2 H 1 2.230 0.03 A 41 GLN HG3 H 1 2.230 0.03 A 41 GLN C C 13 173.100 0.1 A 41 GLN CA C 13 54.610 0.1 A 41 GLN CB C 13 31.180 0.1 A 41 GLN CD C 13 180.010 0.1 A 41 GLN CG C 13 33.300 0.1 A 41 GLN N N 15 128.000 0.1 A 42 GLN H H 1 8.210 0.03 A 42 GLN HA H 1 4.387 0.03 A 42 GLN HBx H 1 0.991 0.03 A 42 GLN HBy H 1 1.720 0.03 A 42 GLN HGy H 1 1.703 0.03 A 42 GLN HGx H 1 0.980 0.03 A 42 GLN C C 13 174.000 0.1 A 42 GLN CA C 13 53.820 0.1 A 42 GLN CB C 13 29.970 0.1 A 42 GLN CD C 13 179.100 0.1 A 42 GLN CG C 13 32.170 0.1 A 42 GLN N N 15 126.000 0.1 A 43 LYS H H 1 8.780 0.03 A 43 LYS HA H 1 4.355 0.03 A 43 LYS HBx H 1 1.593 0.03 A 43 LYS HBy H 1 1.727 0.03 A 43 LYS HD2 H 1 1.610 0.03 A 43 LYS HD3 H 1 1.610 0.03 A 43 LYS HE2 H 1 2.850 0.03 A 43 LYS HE3 H 1 2.850 0.03 A 43 LYS HG2 H 1 1.220 0.03 A 43 LYS HG3 H 1 1.220 0.03 A 43 LYS C C 13 175.700 0.1 A 43 LYS CA C 13 55.000 0.1 A 43 LYS CB C 13 32.900 0.1 A 43 LYS CD C 13 28.800 0.1 A 43 LYS CE C 13 41.600 0.1 A 43 LYS CG C 13 24.200 0.1 A 43 LYS N N 15 130.250 0.1 A 44 GLY H H 1 8.920 0.03 A 44 GLY HAx H 1 3.576 0.03 A 44 GLY HAy H 1 3.932 0.03 A 44 GLY C C 13 173.600 0.1 A 44 GLY CA C 13 47.180 0.1 A 44 GLY N N 15 117.400 0.1 A 45 ASP H H 1 8.816 0.03 A 45 ASP HA H 1 4.820 0.03 A 45 ASP HBx H 1 2.625 0.03 A 45 ASP HBy H 1 3.062 0.03 A 45 ASP C C 13 174.000 0.1 A 45 ASP CA C 13 54.090 0.1 A 45 ASP CB C 13 40.920 0.1 A 45 ASP CG C 13 179.800 0.1 A 45 ASP N N 15 127.500 0.1 A 46 ASP H H 1 8.002 0.03 A 46 ASP HA H 1 5.136 0.03 A 46 ASP HBx H 1 2.670 0.03 A 46 ASP HBy H 1 2.830 0.03 A 46 ASP C C 13 174.500 0.1 A 46 ASP CA C 13 53.970 0.1 A 46 ASP CB C 13 41.200 0.1 A 46 ASP CG C 13 180.200 0.1 A 46 ASP N N 15 120.300 0.1 A 47 PHE H H 1 9.263 0.03 A 47 PHE HA H 1 4.955 0.03 A 47 PHE HBx H 1 1.210 0.03 A 47 PHE HBy H 1 1.650 0.03 A 47 PHE HD1 H 1 6.660 0.03 A 47 PHE HD2 H 1 6.660 0.03 A 47 PHE HEy H 1 6.930 0.03 A 47 PHE HEx H 1 6.840 0.03 A 47 PHE HZ H 1 7.020 0.03 A 47 PHE C C 13 176.100 0.1 A 47 PHE CA C 13 56.210 0.1 A 47 PHE CB C 13 43.200 0.1 A 47 PHE CD1 C 13 128.600 0.1 A 47 PHE CD2 C 13 128.600 0.1 A 47 PHE CE1 C 13 126.700 0.1 A 47 PHE CE2 C 13 126.700 0.1 A 47 PHE N N 15 122.400 0.1 A 48 VAL H H 1 8.499 0.03 A 48 VAL HA H 1 4.474 0.03 A 48 VAL HB H 1 1.812 0.03 A 48 VAL HGx% H 1 0.827 0.03 A 48 VAL HGy% H 1 0.797 0.03 A 48 VAL C C 13 175.300 0.1 A 48 VAL CA C 13 62.350 0.1 A 48 VAL CB C 13 34.320 0.1 A 48 VAL CG1 C 13 20.640 0.1 A 48 VAL CG2 C 13 21.129 0.1 A 48 VAL N N 15 121.700 0.1 A 49 VAL H H 1 9.338 0.03 A 49 VAL HA H 1 5.151 0.03 A 49 VAL HB H 1 2.050 0.03 A 49 VAL HGx% H 1 0.970 0.03 A 49 VAL HGy% H 1 1.000 0.03 A 49 VAL C C 13 175.500 0.1 A 49 VAL CA C 13 60.870 0.1 A 49 VAL CB C 13 34.190 0.1 A 49 VAL CG1 C 13 21.400 0.1 A 49 VAL CG2 C 13 20.650 0.1 A 49 VAL N N 15 126.800 0.1 A 50 THR H H 1 9.775 0.03 A 50 THR HA H 1 5.308 0.03 A 50 THR HB H 1 4.058 0.03 A 50 THR HG2% H 1 1.090 0.03 A 50 THR C C 13 172.800 0.1 A 50 THR CA C 13 61.360 0.1 A 50 THR CB C 13 70.370 0.1 A 50 THR CG2 C 13 21.807 0.1 A 50 THR N N 15 128.800 0.1 A 51 SER H H 1 9.169 0.03 A 51 SER HA H 1 5.300 0.03 A 51 SER HBx H 1 3.643 0.03 A 51 SER HBy H 1 3.825 0.03 A 51 SER C C 13 172.800 0.1 A 51 SER CA C 13 56.250 0.1 A 51 SER CB C 13 64.040 0.1 A 51 SER N N 15 122.100 0.1 A 52 LYS H H 1 9.334 0.03 A 52 LYS HA H 1 5.340 0.03 A 52 LYS HBx H 1 1.716 0.03 A 52 LYS HBy H 1 1.828 0.03 A 52 LYS HE2 H 1 2.870 0.03 A 52 LYS HE3 H 1 2.870 0.03 A 52 LYS HG2 H 1 1.367 0.03 A 52 LYS HG3 H 1 1.367 0.03 A 52 LYS C C 13 175.500 0.1 A 52 LYS CA C 13 55.588 0.1 A 52 LYS CB C 13 35.900 0.1 A 52 LYS CD C 13 29.400 0.1 A 52 LYS CE C 13 41.900 0.1 A 52 LYS CG C 13 24.400 0.1 A 52 LYS N N 15 126.300 0.1 A 53 THR H H 1 9.108 0.03 A 53 THR HA H 1 4.894 0.03 A 53 THR HB H 1 4.740 0.03 A 53 THR HG2% H 1 1.060 0.03 A 53 THR C C 13 172.800 0.1 A 53 THR CA C 13 58.608 0.1 A 53 THR CB C 13 68.060 0.1 A 53 THR CG2 C 13 22.850 0.1 A 53 THR N N 15 117.100 0.1 A 54 PRO HA H 1 4.278 0.03 A 54 PRO HBy H 1 2.394 0.03 A 54 PRO HBx H 1 1.797 0.03 A 54 PRO HDy H 1 3.900 0.03 A 54 PRO HDx H 1 3.880 0.03 A 54 PRO HGx H 1 1.980 0.03 A 54 PRO HGy H 1 2.150 0.03 A 54 PRO C C 13 177.300 0.1 A 54 PRO CA C 13 65.340 0.1 A 54 PRO CB C 13 31.570 0.1 A 54 PRO CD C 13 50.400 0.1 A 54 PRO CG C 13 28.100 0.1 A 55 ARG H H 1 8.297 0.03 A 55 ARG HA H 1 4.308 0.03 A 55 ARG HB2 H 1 1.798 0.03 A 55 ARG HB3 H 1 1.798 0.03 A 55 ARG HD2 H 1 3.108 0.03 A 55 ARG HD3 H 1 3.108 0.03 A 55 ARG HGx H 1 1.533 0.03 A 55 ARG HGy H 1 1.623 0.03 A 55 ARG C C 13 176.200 0.1 A 55 ARG CA C 13 56.700 0.1 A 55 ARG CB C 13 31.960 0.1 A 55 ARG CD C 13 43.150 0.1 A 55 ARG CG C 13 28.030 0.1 A 55 ARG N N 15 113.000 0.1 A 56 GLN H H 1 7.751 0.03 A 56 GLN HA H 1 4.820 0.03 A 56 GLN HBy H 1 1.921 0.03 A 56 GLN HBx H 1 1.920 0.03 A 56 GLN HGx H 1 2.007 0.03 A 56 GLN HGy H 1 2.161 0.03 A 56 GLN C C 13 173.000 0.1 A 56 GLN CA C 13 55.220 0.1 A 56 GLN CB C 13 32.610 0.1 A 56 GLN CD C 13 179.600 0.1 A 56 GLN CG C 13 33.010 0.1 A 56 GLN N N 15 116.200 0.1 A 57 THR H H 1 8.454 0.03 A 57 THR HA H 1 5.161 0.03 A 57 THR HB H 1 3.916 0.03 A 57 THR HG2% H 1 1.052 0.03 A 57 THR C C 13 173.500 0.1 A 57 THR CA C 13 61.408 0.1 A 57 THR CB C 13 70.994 0.1 A 57 THR CG2 C 13 21.630 0.1 A 57 THR N N 15 117.600 0.1 A 58 VAL H H 1 8.928 0.03 A 58 VAL HA H 1 4.452 0.03 A 58 VAL HB H 1 1.902 0.03 A 58 VAL HGx% H 1 0.733 0.03 A 58 VAL HGy% H 1 0.830 0.03 A 58 VAL C C 13 174.200 0.1 A 58 VAL CA C 13 61.180 0.1 A 58 VAL CB C 13 35.018 0.1 A 58 VAL CG1 C 13 20.810 0.1 A 58 VAL CG2 C 13 22.300 0.1 A 58 VAL N N 15 126.300 0.1 A 59 THR H H 1 8.957 0.03 A 59 THR HA H 1 5.167 0.03 A 59 THR HB H 1 3.781 0.03 A 59 THR HG2% H 1 1.060 0.03 A 59 THR C C 13 172.400 0.1 A 59 THR CA C 13 61.800 0.1 A 59 THR CB C 13 70.339 0.1 A 59 THR CG2 C 13 21.600 0.1 A 59 THR N N 15 126.600 0.1 A 60 ASN H H 1 9.103 0.03 A 60 ASN HA H 1 5.255 0.03 A 60 ASN HBy H 1 2.567 0.03 A 60 ASN HBx H 1 2.405 0.03 A 60 ASN C C 13 172.500 0.1 A 60 ASN CA C 13 52.490 0.1 A 60 ASN CB C 13 44.110 0.1 A 60 ASN CG C 13 176.500 0.1 A 60 ASN N N 15 124.500 0.1 A 61 SER H H 1 8.805 0.03 A 61 SER HA H 1 5.399 0.03 A 61 SER HB2 H 1 3.846 0.03 A 61 SER HB3 H 1 3.846 0.03 A 61 SER C C 13 172.200 0.1 A 61 SER CA C 13 56.470 0.1 A 61 SER CB C 13 65.450 0.1 A 61 SER N N 15 115.600 0.1 A 62 PHE H H 1 8.211 0.03 A 62 PHE HA H 1 4.949 0.03 A 62 PHE HBy H 1 3.227 0.03 A 62 PHE HBx H 1 2.920 0.03 A 62 PHE HD1 H 1 6.370 0.03 A 62 PHE HD2 H 1 6.370 0.03 A 62 PHE HE1 H 1 6.440 0.03 A 62 PHE HE2 H 1 6.440 0.03 A 62 PHE HZ H 1 6.090 0.03 A 62 PHE C C 13 172.100 0.1 A 62 PHE CA C 13 56.250 0.1 A 62 PHE CB C 13 39.830 0.1 A 62 PHE CD1 C 13 129.600 0.1 A 62 PHE CD2 C 13 129.600 0.1 A 62 PHE CE1 C 13 129.300 0.1 A 62 PHE CE2 C 13 129.300 0.1 A 62 PHE CZ C 13 125.600 0.1 A 62 PHE N N 15 116.900 0.1 A 63 THR H H 1 9.738 0.03 A 63 THR HA H 1 5.440 0.03 A 63 THR HB H 1 3.760 0.03 A 63 THR HG2% H 1 1.408 0.03 A 63 THR C C 13 175.400 0.1 A 63 THR CA C 13 60.750 0.1 A 63 THR CB C 13 71.574 0.1 A 63 THR CG2 C 13 21.393 0.1 A 63 THR N N 15 120.000 0.1 A 64 LEU H H 1 9.156 0.03 A 64 LEU HA H 1 4.308 0.03 A 64 LEU HBy H 1 1.868 0.03 A 64 LEU HBx H 1 1.569 0.03 A 64 LEU HDx% H 1 1.170 0.03 A 64 LEU HDy% H 1 0.596 0.03 A 64 LEU HG H 1 1.192 0.03 A 64 LEU C C 13 178.000 0.1 A 64 LEU CA C 13 56.020 0.1 A 64 LEU CB C 13 41.275 0.1 A 64 LEU CD1 C 13 26.700 0.1 A 64 LEU CD2 C 13 22.570 0.1 A 64 LEU CG C 13 26.600 0.1 A 64 LEU N N 15 126.900 0.1 A 65 GLY H H 1 9.072 0.03 A 65 GLY HAx H 1 3.105 0.03 A 65 GLY HAy H 1 4.193 0.03 A 65 GLY C C 13 172.900 0.1 A 65 GLY CA C 13 45.420 0.1 A 65 GLY N N 15 107.500 0.1 A 66 LYS H H 1 7.885 0.03 A 66 LYS HA H 1 4.710 0.03 A 66 LYS HBx H 1 1.770 0.03 A 66 LYS HBy H 1 1.880 0.03 A 66 LYS HD2 H 1 1.670 0.03 A 66 LYS HD3 H 1 1.670 0.03 A 66 LYS HEx H 1 3.000 0.03 A 66 LYS HG2 H 1 1.360 0.03 A 66 LYS HG3 H 1 1.360 0.03 A 66 LYS C C 13 175.200 0.1 A 66 LYS CA C 13 54.050 0.1 A 66 LYS CB C 13 34.600 0.1 A 66 LYS CD C 13 28.900 0.1 A 66 LYS CE C 13 41.600 0.1 A 66 LYS CG C 13 25.000 0.1 A 66 LYS N N 15 121.100 0.1 A 67 GLU H H 1 8.807 0.03 A 67 GLU HA H 1 4.181 0.03 A 67 GLU HBx H 1 1.800 0.03 A 67 GLU HBy H 1 1.870 0.03 A 67 GLU HGx H 1 1.897 0.03 A 67 GLU HGy H 1 1.988 0.03 A 67 GLU C C 13 174.500 0.1 A 67 GLU CA C 13 58.470 0.1 A 67 GLU CB C 13 30.300 0.1 A 67 GLU CD C 13 183.510 0.1 A 67 GLU CG C 13 37.601 0.1 A 67 GLU N N 15 129.700 0.1 A 68 ALA H H 1 9.282 0.03 A 68 ALA HA H 1 4.826 0.03 A 68 ALA HB% H 1 1.598 0.03 A 68 ALA C C 13 175.600 0.1 A 68 ALA CA C 13 50.490 0.1 A 68 ALA CB C 13 22.420 0.1 A 68 ALA N N 15 130.900 0.1 A 69 ASP H H 1 8.283 0.03 A 69 ASP HA H 1 5.025 0.03 A 69 ASP HB2 H 1 2.580 0.03 A 69 ASP HB3 H 1 2.580 0.03 A 69 ASP C C 13 174.600 0.1 A 69 ASP CA C 13 54.020 0.1 A 69 ASP CB C 13 41.480 0.1 A 69 ASP CG C 13 180.600 0.1 A 69 ASP N N 15 119.900 0.1 A 70 ILE H H 1 9.078 0.03 A 70 ILE HA H 1 4.551 0.03 A 70 ILE HB H 1 1.855 0.03 A 70 ILE HD1% H 1 0.557 0.03 A 70 ILE HG12 H 1 0.970 0.03 A 70 ILE HG13 H 1 1.517 0.03 A 70 ILE HG2% H 1 0.548 0.03 A 70 ILE C C 13 175.100 0.1 A 70 ILE CA C 13 56.350 0.1 A 70 ILE CB C 13 38.604 0.1 A 70 ILE CD1 C 13 9.400 0.1 A 70 ILE CG1 C 13 26.940 0.1 A 70 ILE CG2 C 13 17.930 0.1 A 70 ILE N N 15 127.000 0.1 A 71 THR H H 1 9.357 0.03 A 71 THR HA H 1 5.220 0.03 A 71 THR HB H 1 3.905 0.03 A 71 THR HG2% H 1 1.233 0.03 A 71 THR C C 13 174.100 0.1 A 71 THR CA C 13 61.060 0.1 A 71 THR CB C 13 70.185 0.1 A 71 THR CG2 C 13 20.877 0.1 A 71 THR N N 15 123.800 0.1 A 72 THR H H 1 8.737 0.03 A 72 THR HA H 1 4.550 0.03 A 72 THR HB H 1 4.551 0.03 A 72 THR HG2% H 1 0.959 0.03 A 72 THR C C 13 177.400 0.1 A 72 THR CA C 13 60.099 0.1 A 72 THR CB C 13 70.698 0.1 A 72 THR CG2 C 13 22.300 0.1 A 72 THR N N 15 116.000 0.1 A 73 MET H H 1 10.350 0.03 A 73 MET HA H 1 4.085 0.03 A 73 MET HBy H 1 2.300 0.03 A 73 MET HBx H 1 2.099 0.03 A 73 MET HE% H 1 2.060 0.03 A 73 MET HGy H 1 2.820 0.03 A 73 MET HGx H 1 2.330 0.03 A 73 MET C C 13 175.800 0.1 A 73 MET CA C 13 58.643 0.1 A 73 MET CB C 13 34.200 0.1 A 73 MET CE C 13 18.600 0.1 A 73 MET CG C 13 34.100 0.1 A 73 MET N N 15 119.400 0.1 A 74 ASP H H 1 8.646 0.03 A 74 ASP HA H 1 4.655 0.03 A 74 ASP HBy H 1 2.769 0.03 A 74 ASP HBx H 1 2.195 0.03 A 74 ASP C C 13 174.900 0.1 A 74 ASP CA C 13 52.510 0.1 A 74 ASP CB C 13 38.410 0.1 A 74 ASP CG C 13 179.430 0.1 A 74 ASP N N 15 112.100 0.1 A 75 GLY H H 1 7.572 0.03 A 75 GLY HAx H 1 3.623 0.03 A 75 GLY HAy H 1 4.008 0.03 A 75 GLY C C 13 174.400 0.1 A 75 GLY CA C 13 45.960 0.1 A 75 GLY N N 15 107.600 0.1 A 76 LYS H H 1 8.080 0.03 A 76 LYS HA H 1 4.378 0.03 A 76 LYS HBy H 1 1.782 0.03 A 76 LYS HBx H 1 1.538 0.03 A 76 LYS HD2 H 1 1.700 0.03 A 76 LYS HD3 H 1 1.700 0.03 A 76 LYS HEx H 1 2.980 0.03 A 76 LYS HGx H 1 1.160 0.03 A 76 LYS HGy H 1 1.250 0.03 A 76 LYS C C 13 175.000 0.1 A 76 LYS CA C 13 55.600 0.1 A 76 LYS CB C 13 33.450 0.1 A 76 LYS CD C 13 29.100 0.1 A 76 LYS CG C 13 25.160 0.1 A 76 LYS N N 15 120.100 0.1 A 77 LYS H H 1 8.029 0.03 A 77 LYS HA H 1 5.319 0.03 A 77 LYS HBy H 1 1.757 0.03 A 77 LYS HBx H 1 1.648 0.03 A 77 LYS HD2 H 1 1.700 0.03 A 77 LYS HD3 H 1 1.700 0.03 A 77 LYS HE2 H 1 2.890 0.03 A 77 LYS HE3 H 1 2.890 0.03 A 77 LYS HG2 H 1 1.390 0.03 A 77 LYS HG3 H 1 1.390 0.03 A 77 LYS C C 13 175.800 0.1 A 77 LYS CA C 13 54.260 0.1 A 77 LYS CB C 13 33.200 0.1 A 77 LYS CD C 13 29.000 0.1 A 77 LYS CE C 13 42.000 0.1 A 77 LYS CG C 13 24.200 0.1 A 77 LYS N N 15 119.600 0.1 A 78 LEU H H 1 9.156 0.03 A 78 LEU HA H 1 4.765 0.03 A 78 LEU HBy H 1 1.538 0.03 A 78 LEU HBx H 1 1.463 0.03 A 78 LEU HDx% H 1 0.628 0.03 A 78 LEU HDy% H 1 0.760 0.03 A 78 LEU HG H 1 1.376 0.03 A 78 LEU C C 13 175.000 0.1 A 78 LEU CA C 13 53.602 0.1 A 78 LEU CB C 13 45.542 0.1 A 78 LEU CD1 C 13 26.370 0.1 A 78 LEU CD2 C 13 24.400 0.1 A 78 LEU CG C 13 26.800 0.1 A 78 LEU N N 15 124.000 0.1 A 79 LYS H H 1 8.327 0.03 A 79 LYS HA H 1 5.546 0.03 A 79 LYS HBx H 1 1.530 0.03 A 79 LYS HBy H 1 1.670 0.03 A 79 LYS HD2 H 1 1.540 0.03 A 79 LYS HD3 H 1 1.540 0.03 A 79 LYS HE2 H 1 2.860 0.03 A 79 LYS HE3 H 1 2.860 0.03 A 79 LYS HGx H 1 1.370 0.03 A 79 LYS HGy H 1 1.410 0.03 A 79 LYS C C 13 176.800 0.1 A 79 LYS CA C 13 54.438 0.1 A 79 LYS CB C 13 34.400 0.1 A 79 LYS CD C 13 29.400 0.1 A 79 LYS CG C 13 24.600 0.1 A 79 LYS N N 15 121.200 0.1 A 80 CYS H H 1 8.642 0.03 A 80 CYS HA H 1 4.874 0.03 A 80 CYS HBy H 1 2.835 0.03 A 80 CYS HBx H 1 2.444 0.03 A 80 CYS C C 13 171.900 0.1 A 80 CYS CA C 13 56.740 0.1 A 80 CYS CB C 13 31.514 0.1 A 80 CYS N N 15 117.900 0.1 A 81 THR H H 1 8.604 0.03 A 81 THR HA H 1 4.218 0.03 A 81 THR HB H 1 3.826 0.03 A 81 THR HG2% H 1 0.560 0.03 A 81 THR C C 13 170.800 0.1 A 81 THR CA C 13 62.080 0.1 A 81 THR CB C 13 69.138 0.1 A 81 THR CG2 C 13 20.600 0.1 A 81 THR N N 15 117.700 0.1 A 82 VAL H H 1 9.383 0.03 A 82 VAL HA H 1 4.156 0.03 A 82 VAL HB H 1 1.214 0.03 A 82 VAL HGx% H 1 0.336 0.03 A 82 VAL HGy% H 1 -0.187 0.03 A 82 VAL C C 13 175.100 0.1 A 82 VAL CA C 13 60.600 0.1 A 82 VAL CB C 13 32.565 0.1 A 82 VAL CG1 C 13 21.090 0.1 A 82 VAL CG2 C 13 19.122 0.1 A 82 VAL N N 15 131.900 0.1 A 83 HIS H H 1 8.597 0.03 A 83 HIS HA H 1 4.919 0.03 A 83 HIS HBx H 1 2.794 0.03 A 83 HIS HBy H 1 3.032 0.03 A 83 HIS HD2 H 1 7.055 0.03 A 83 HIS HE1 H 1 7.790 0.03 A 83 HIS C C 13 173.100 0.1 A 83 HIS CA C 13 55.010 0.1 A 83 HIS CB C 13 33.650 0.1 A 83 HIS CD2 C 13 118.000 0.1 A 83 HIS CE1 C 13 108.800 0.1 A 83 HIS N N 15 123.700 0.1 A 83 HIS ND1 N 15 218.100 0.1 A 83 HIS NE2 N 15 184.700 0.1 A 84 LEU H H 1 8.755 0.03 A 84 LEU HA H 1 5.314 0.03 A 84 LEU HBy H 1 1.895 0.03 A 84 LEU HBx H 1 1.412 0.03 A 84 LEU HDx% H 1 0.970 0.03 A 84 LEU HDy% H 1 0.880 0.03 A 84 LEU HG H 1 1.477 0.03 A 84 LEU C C 13 176.200 0.1 A 84 LEU CA C 13 53.550 0.1 A 84 LEU CB C 13 44.369 0.1 A 84 LEU CD1 C 13 25.700 0.1 A 84 LEU CD2 C 13 23.732 0.1 A 84 LEU CG C 13 26.870 0.1 A 84 LEU N N 15 122.900 0.1 A 85 ALA H H 1 9.404 0.03 A 85 ALA HA H 1 4.707 0.03 A 85 ALA HB% H 1 1.267 0.03 A 85 ALA C C 13 176.800 0.1 A 85 ALA CA C 13 51.110 0.1 A 85 ALA CB C 13 20.585 0.1 A 85 ALA N N 15 130.400 0.1 A 86 ASN H H 1 8.690 0.03 A 86 ASN HA H 1 4.364 0.03 A 86 ASN HBy H 1 3.027 0.03 A 86 ASN HBx H 1 2.722 0.03 A 86 ASN HD2y H 1 7.640 0.03 A 86 ASN HD2x H 1 6.930 0.03 A 86 ASN C C 13 175.000 0.1 A 86 ASN CA C 13 53.826 0.1 A 86 ASN CB C 13 37.294 0.1 A 86 ASN CG C 13 178.000 0.1 A 86 ASN N N 15 129.800 0.1 A 87 GLY H H 1 8.511 0.03 A 87 GLY HAx H 1 3.670 0.03 A 87 GLY HAy H 1 4.232 0.03 A 87 GLY C C 13 172.600 0.1 A 87 GLY CA C 13 45.550 0.1 A 87 GLY N N 15 103.000 0.1 A 88 LYS H H 1 7.830 0.03 A 88 LYS HA H 1 5.117 0.03 A 88 LYS HBx H 1 1.640 0.03 A 88 LYS HBy H 1 1.760 0.03 A 88 LYS HD2 H 1 1.470 0.03 A 88 LYS HD3 H 1 1.470 0.03 A 88 LYS HE2 H 1 2.850 0.03 A 88 LYS HE3 H 1 2.850 0.03 A 88 LYS HG2 H 1 1.270 0.03 A 88 LYS HG3 H 1 1.270 0.03 A 88 LYS C C 13 175.500 0.1 A 88 LYS CA C 13 54.620 0.1 A 88 LYS CB C 13 34.500 0.1 A 88 LYS CD C 13 29.800 0.1 A 88 LYS CE C 13 41.700 0.1 A 88 LYS CG C 13 24.800 0.1 A 88 LYS N N 15 120.300 0.1 A 89 LEU H H 1 8.566 0.03 A 89 LEU HA H 1 4.931 0.03 A 89 LEU HBy H 1 1.431 0.03 A 89 LEU HBx H 1 0.979 0.03 A 89 LEU HDx% H 1 0.148 0.03 A 89 LEU HDy% H 1 -0.192 0.03 A 89 LEU HG H 1 0.890 0.03 A 89 LEU C C 13 177.200 0.1 A 89 LEU CA C 13 53.850 0.1 A 89 LEU CB C 13 42.065 0.1 A 89 LEU CD1 C 13 22.746 0.1 A 89 LEU CD2 C 13 23.641 0.1 A 89 LEU CG C 13 26.200 0.1 A 89 LEU N N 15 122.200 0.1 A 90 VAL H H 1 9.425 0.03 A 90 VAL HA H 1 5.156 0.03 A 90 VAL HB H 1 1.940 0.03 A 90 VAL HGx% H 1 0.970 0.03 A 90 VAL HGy% H 1 0.950 0.03 A 90 VAL C C 13 174.900 0.1 A 90 VAL CA C 13 61.180 0.1 A 90 VAL CB C 13 35.000 0.1 A 90 VAL CG1 C 13 21.600 0.1 A 90 VAL CG2 C 13 21.100 0.1 A 90 VAL N N 15 123.600 0.1 A 91 THR H H 1 9.361 0.03 A 91 THR HA H 1 4.653 0.03 A 91 THR HB H 1 4.005 0.03 A 91 THR HG2% H 1 1.153 0.03 A 91 THR C C 13 172.900 0.1 A 91 THR CA C 13 62.700 0.1 A 91 THR CB C 13 69.300 0.1 A 91 THR CG2 C 13 21.217 0.1 A 91 THR N N 15 127.100 0.1 A 92 LYS H H 1 9.110 0.03 A 92 LYS HA H 1 4.849 0.03 A 92 LYS HBx H 1 1.700 0.03 A 92 LYS HBy H 1 1.830 0.03 A 92 LYS HD2 H 1 1.620 0.03 A 92 LYS HD3 H 1 1.620 0.03 A 92 LYS HE2 H 1 2.920 0.03 A 92 LYS HE3 H 1 2.920 0.03 A 92 LYS HG2 H 1 1.389 0.03 A 92 LYS HG3 H 1 1.389 0.03 A 92 LYS C C 13 174.400 0.1 A 92 LYS CA C 13 54.780 0.1 A 92 LYS CB C 13 35.890 0.1 A 92 LYS CD C 13 29.000 0.1 A 92 LYS CE C 13 41.600 0.1 A 92 LYS CG C 13 24.500 0.1 A 92 LYS N N 15 125.400 0.1 A 93 SER H H 1 8.333 0.03 A 93 SER HA H 1 4.608 0.03 A 93 SER HBy H 1 3.767 0.03 A 93 SER HBx H 1 2.967 0.03 A 93 SER C C 13 173.300 0.1 A 93 SER CA C 13 55.252 0.1 A 93 SER CB C 13 65.830 0.1 A 93 SER N N 15 118.300 0.1 A 94 GLU H H 1 8.740 0.03 A 94 GLU HA H 1 4.054 0.03 A 94 GLU HB2 H 1 2.024 0.03 A 94 GLU HB3 H 1 2.024 0.03 A 94 GLU HGy H 1 2.300 0.03 A 94 GLU HGx H 1 2.229 0.03 A 94 GLU C C 13 177.500 0.1 A 94 GLU CA C 13 58.960 0.1 A 94 GLU CB C 13 28.900 0.1 A 94 GLU CD C 13 183.700 0.1 A 94 GLU CG C 13 36.200 0.1 A 94 GLU N N 15 119.600 0.1 A 95 LYS H H 1 8.279 0.03 A 95 LYS HA H 1 4.273 0.03 A 95 LYS HBx H 1 1.750 0.03 A 95 LYS HBy H 1 1.770 0.03 A 95 LYS HDx H 1 1.650 0.03 A 95 LYS HEx H 1 2.910 0.03 A 95 LYS HEy H 1 3.040 0.03 A 95 LYS HG2 H 1 1.290 0.03 A 95 LYS HG3 H 1 1.290 0.03 A 95 LYS C C 13 175.300 0.1 A 95 LYS CA C 13 55.600 0.1 A 95 LYS CB C 13 34.750 0.1 A 95 LYS CD C 13 28.400 0.1 A 95 LYS CE C 13 39.600 0.1 A 95 LYS CG C 13 24.850 0.1 A 95 LYS N N 15 114.300 0.1 A 96 PHE H H 1 6.979 0.03 A 96 PHE HA H 1 5.804 0.03 A 96 PHE HBy H 1 3.452 0.03 A 96 PHE HBx H 1 3.267 0.03 A 96 PHE HD1 H 1 6.990 0.03 A 96 PHE HD2 H 1 6.990 0.03 A 96 PHE HE1 H 1 7.030 0.03 A 96 PHE HE2 H 1 7.030 0.03 A 96 PHE HZ H 1 7.130 0.03 A 96 PHE C C 13 173.000 0.1 A 96 PHE CA C 13 55.610 0.1 A 96 PHE CB C 13 43.350 0.1 A 96 PHE CD1 C 13 130.500 0.1 A 96 PHE CD2 C 13 130.500 0.1 A 96 PHE CE1 C 13 129.000 0.1 A 96 PHE CE2 C 13 129.000 0.1 A 96 PHE CZ C 13 128.600 0.1 A 96 PHE N N 15 113.400 0.1 A 97 SER H H 1 8.705 0.03 A 97 SER HA H 1 5.148 0.03 A 97 SER HB2 H 1 3.870 0.03 A 97 SER HB3 H 1 3.870 0.03 A 97 SER C C 13 171.700 0.1 A 97 SER CA C 13 57.380 0.1 A 97 SER CB C 13 65.710 0.1 A 97 SER N N 15 112.600 0.1 A 98 HIS H H 1 9.545 0.03 A 98 HIS HA H 1 5.122 0.03 A 98 HIS HBy H 1 3.225 0.03 A 98 HIS HBx H 1 2.762 0.03 A 98 HIS HD2 H 1 6.510 0.03 A 98 HIS HE1 H 1 7.810 0.03 A 98 HIS C C 13 173.000 0.1 A 98 HIS CA C 13 57.150 0.1 A 98 HIS CB C 13 34.890 0.1 A 98 HIS CD2 C 13 113.000 0.1 A 98 HIS CE1 C 13 111.160 0.1 A 98 HIS N N 15 128.200 0.1 A 98 HIS ND1 N 15 253.000 0.1 A 98 HIS NE2 N 15 162.200 0.1 A 99 GLU H H 1 7.970 0.03 A 99 GLU HA H 1 5.546 0.03 A 99 GLU HBy H 1 1.894 0.03 A 99 GLU HBx H 1 1.889 0.03 A 99 GLU HGy H 1 2.213 0.03 A 99 GLU HGx H 1 2.162 0.03 A 99 GLU C C 13 174.700 0.1 A 99 GLU CA C 13 54.240 0.1 A 99 GLU CB C 13 34.173 0.1 A 99 GLU CD C 13 183.460 0.1 A 99 GLU CG C 13 37.100 0.1 A 99 GLU N N 15 125.700 0.1 A 100 GLN H H 1 9.196 0.03 A 100 GLN HA H 1 5.205 0.03 A 100 GLN HBy H 1 2.068 0.03 A 100 GLN HBx H 1 1.956 0.03 A 100 GLN HGy H 1 2.000 0.03 A 100 GLN HGx H 1 1.920 0.03 A 100 GLN C C 13 172.800 0.1 A 100 GLN CA C 13 54.545 0.1 A 100 GLN CB C 13 32.480 0.1 A 100 GLN CD C 13 176.500 0.1 A 100 GLN CG C 13 32.600 0.1 A 100 GLN N N 15 126.000 0.1 A 101 GLU H H 1 8.862 0.03 A 101 GLU HA H 1 5.094 0.03 A 101 GLU HB2 H 1 1.893 0.03 A 101 GLU HB3 H 1 1.893 0.03 A 101 GLU HGy H 1 2.139 0.03 A 101 GLU HGx H 1 2.078 0.03 A 101 GLU C C 13 173.300 0.1 A 101 GLU CA C 13 53.930 0.1 A 101 GLU CB C 13 34.280 0.1 A 101 GLU CD C 13 182.510 0.1 A 101 GLU CG C 13 35.788 0.1 A 101 GLU N N 15 125.300 0.1 A 102 VAL H H 1 8.796 0.03 A 102 VAL HA H 1 4.601 0.03 A 102 VAL HB H 1 1.458 0.03 A 102 VAL HGx% H 1 0.504 0.03 A 102 VAL HGy% H 1 0.645 0.03 A 102 VAL C C 13 174.600 0.1 A 102 VAL CA C 13 60.990 0.1 A 102 VAL CB C 13 33.929 0.1 A 102 VAL CG1 C 13 22.591 0.1 A 102 VAL CG2 C 13 20.689 0.1 A 102 VAL N N 15 124.800 0.1 A 103 LYS H H 1 8.897 0.03 A 103 LYS HA H 1 4.491 0.03 A 103 LYS HBx H 1 1.668 0.03 A 103 LYS HBy H 1 1.762 0.03 A 103 LYS HD2 H 1 1.650 0.03 A 103 LYS HD3 H 1 1.650 0.03 A 103 LYS HE2 H 1 2.890 0.03 A 103 LYS HE3 H 1 2.890 0.03 A 103 LYS HG2 H 1 1.270 0.03 A 103 LYS HG3 H 1 1.270 0.03 A 103 LYS C C 13 176.400 0.1 A 103 LYS CA C 13 54.770 0.1 A 103 LYS CB C 13 33.250 0.1 A 103 LYS CD C 13 28.900 0.1 A 103 LYS CE C 13 42.200 0.1 A 103 LYS CG C 13 24.200 0.1 A 103 LYS N N 15 129.100 0.1 A 104 GLY H H 1 9.123 0.03 A 104 GLY HAx H 1 3.684 0.03 A 104 GLY HAy H 1 3.996 0.03 A 104 GLY C C 13 173.800 0.1 A 104 GLY CA C 13 47.450 0.1 A 104 GLY N N 15 117.000 0.1 A 105 ASN H H 1 9.002 0.03 A 105 ASN HA H 1 4.943 0.03 A 105 ASN HBy H 1 3.244 0.03 A 105 ASN HBx H 1 2.872 0.03 A 105 ASN HD2y H 1 7.700 0.03 A 105 ASN HD2x H 1 7.040 0.03 A 105 ASN C C 13 173.200 0.1 A 105 ASN CA C 13 52.733 0.1 A 105 ASN CB C 13 38.671 0.1 A 105 ASN CG C 13 177.540 0.1 A 105 ASN N N 15 125.600 0.1 A 106 GLU H H 1 8.075 0.03 A 106 GLU HA H 1 5.458 0.03 A 106 GLU HBy H 1 2.352 0.03 A 106 GLU HBx H 1 2.103 0.03 A 106 GLU HGx H 1 2.350 0.03 A 106 GLU HGy H 1 2.460 0.03 A 106 GLU C C 13 173.200 0.1 A 106 GLU CA C 13 55.250 0.1 A 106 GLU CB C 13 32.920 0.1 A 106 GLU CD C 13 183.216 0.1 A 106 GLU CG C 13 35.835 0.1 A 106 GLU N N 15 120.300 0.1 A 107 MET H H 1 8.919 0.03 A 107 MET HA H 1 5.104 0.03 A 107 MET HBy H 1 1.412 0.03 A 107 MET HBx H 1 0.606 0.03 A 107 MET HE% H 1 0.950 0.03 A 107 MET HG2 H 1 1.900 0.03 A 107 MET HG3 H 1 1.900 0.03 A 107 MET C C 13 174.400 0.1 A 107 MET CA C 13 53.510 0.1 A 107 MET CB C 13 36.500 0.1 A 107 MET CE C 13 15.500 0.1 A 107 MET CG C 13 30.500 0.1 A 107 MET N N 15 124.000 0.1 A 108 VAL H H 1 9.051 0.03 A 108 VAL HA H 1 4.808 0.03 A 108 VAL HB H 1 1.860 0.03 A 108 VAL HGx% H 1 0.858 0.03 A 108 VAL HGy% H 1 0.767 0.03 A 108 VAL C C 13 175.300 0.1 A 108 VAL CA C 13 61.150 0.1 A 108 VAL CB C 13 35.100 0.1 A 108 VAL CG1 C 13 21.509 0.1 A 108 VAL CG2 C 13 20.840 0.1 A 108 VAL N N 15 126.500 0.1 A 109 GLU H H 1 8.977 0.03 A 109 GLU HA H 1 5.213 0.03 A 109 GLU HBy H 1 1.760 0.03 A 109 GLU HBx H 1 1.658 0.03 A 109 GLU HG2 H 1 1.940 0.03 A 109 GLU HG3 H 1 1.940 0.03 A 109 GLU C C 13 174.000 0.1 A 109 GLU CA C 13 53.780 0.1 A 109 GLU CB C 13 33.130 0.1 A 109 GLU CD C 13 183.050 0.1 A 109 GLU CG C 13 37.200 0.1 A 109 GLU N N 15 127.300 0.1 A 110 THR H H 1 8.736 0.03 A 110 THR HA H 1 4.791 0.03 A 110 THR HB H 1 3.805 0.03 A 110 THR HG2% H 1 0.941 0.03 A 110 THR C C 13 174.500 0.1 A 110 THR CA C 13 61.760 0.1 A 110 THR CB C 13 69.093 0.1 A 110 THR CG2 C 13 20.680 0.1 A 110 THR N N 15 120.900 0.1 A 111 ILE H H 1 9.402 0.03 A 111 ILE HA H 1 5.179 0.03 A 111 ILE HB H 1 1.528 0.03 A 111 ILE HD1% H 1 0.699 0.03 A 111 ILE HG12 H 1 0.854 0.03 A 111 ILE HG13 H 1 1.349 0.03 A 111 ILE HG2% H 1 1.088 0.03 A 111 ILE C C 13 173.800 0.1 A 111 ILE CA C 13 59.810 0.1 A 111 ILE CB C 13 39.311 0.1 A 111 ILE CD1 C 13 49.200 0.1 A 111 ILE CG1 C 13 25.600 0.1 A 111 ILE CG2 C 13 18.855 0.1 A 111 ILE N N 15 129.500 0.1 A 112 THR H H 1 9.498 0.03 A 112 THR HA H 1 5.843 0.03 A 112 THR HB H 1 3.942 0.03 A 112 THR HG2% H 1 1.078 0.03 A 112 THR C C 13 173.500 0.1 A 112 THR CA C 13 61.170 0.1 A 112 THR CB C 13 70.689 0.1 A 112 THR CG2 C 13 20.980 0.1 A 112 THR N N 15 123.000 0.1 A 113 PHE H H 1 9.083 0.03 A 113 PHE HA H 1 4.765 0.03 A 113 PHE HBy H 1 2.916 0.03 A 113 PHE HBx H 1 2.695 0.03 A 113 PHE HD1 H 1 6.840 0.03 A 113 PHE HD2 H 1 6.840 0.03 A 113 PHE HE1 H 1 7.280 0.03 A 113 PHE HE2 H 1 7.280 0.03 A 113 PHE C C 13 175.800 0.1 A 113 PHE CA C 13 58.210 0.1 A 113 PHE CB C 13 43.650 0.1 A 113 PHE CD1 C 13 129.200 0.1 A 113 PHE CD2 C 13 129.200 0.1 A 113 PHE CE1 C 13 129.300 0.1 A 113 PHE CE2 C 13 129.300 0.1 A 113 PHE N N 15 126.700 0.1 A 114 GLY H H 1 8.472 0.03 A 114 GLY HA2 H 1 3.590 0.03 A 114 GLY HA3 H 1 3.590 0.03 A 114 GLY C C 13 175.000 0.1 A 114 GLY CA C 13 46.830 0.1 A 114 GLY N N 15 116.700 0.1 A 115 GLY H H 1 8.533 0.03 A 115 GLY HAx H 1 3.605 0.03 A 115 GLY HAy H 1 4.100 0.03 A 115 GLY C C 13 173.500 0.1 A 115 GLY CA C 13 44.680 0.1 A 115 GLY N N 15 105.500 0.1 A 116 VAL H H 1 8.128 0.03 A 116 VAL HA H 1 4.249 0.03 A 116 VAL HB H 1 2.227 0.03 A 116 VAL HGx% H 1 0.957 0.03 A 116 VAL HGy% H 1 1.020 0.03 A 116 VAL C C 13 174.200 0.1 A 116 VAL CA C 13 61.870 0.1 A 116 VAL CB C 13 33.371 0.1 A 116 VAL CG1 C 13 21.400 0.1 A 116 VAL CG2 C 13 21.600 0.1 A 116 VAL N N 15 123.900 0.1 A 117 THR H H 1 8.739 0.03 A 117 THR HA H 1 5.382 0.03 A 117 THR HB H 1 3.781 0.03 A 117 THR HG2% H 1 0.958 0.03 A 117 THR C C 13 173.200 0.1 A 117 THR CA C 13 61.523 0.1 A 117 THR CB C 13 70.311 0.1 A 117 THR CG2 C 13 21.840 0.1 A 117 THR N N 15 123.500 0.1 A 118 LEU H H 1 9.583 0.03 A 118 LEU HA H 1 4.868 0.03 A 118 LEU HBx H 1 0.819 0.03 A 118 LEU HBy H 1 0.972 0.03 A 118 LEU HDx% H 1 0.760 0.03 A 118 LEU HDy% H 1 0.350 0.03 A 118 LEU HG H 1 1.050 0.03 A 118 LEU C C 13 174.500 0.1 A 118 LEU CA C 13 53.000 0.1 A 118 LEU CB C 13 44.449 0.1 A 118 LEU CD1 C 13 24.400 0.1 A 118 LEU CD2 C 13 28.300 0.1 A 118 LEU CG C 13 24.300 0.1 A 118 LEU N N 15 132.100 0.1 A 119 ILE H H 1 7.742 0.03 A 119 ILE HA H 1 5.088 0.03 A 119 ILE HB H 1 1.614 0.03 A 119 ILE HD1% H 1 0.747 0.03 A 119 ILE HG12 H 1 1.085 0.03 A 119 ILE HG13 H 1 1.360 0.03 A 119 ILE HG2% H 1 0.659 0.03 A 119 ILE C C 13 175.400 0.1 A 119 ILE CA C 13 59.282 0.1 A 119 ILE CB C 13 38.991 0.1 A 119 ILE CD1 C 13 47.900 0.1 A 119 ILE CG1 C 13 27.289 0.1 A 119 ILE CG2 C 13 17.197 0.1 A 119 ILE N N 15 125.200 0.1 A 120 ARG HA H 1 4.989 0.03 A 120 ARG HBx H 1 1.810 0.03 A 120 ARG HBy H 1 1.812 0.03 A 120 ARG HDx H 1 2.830 0.03 A 120 ARG HDy H 1 3.100 0.03 A 120 ARG HG2 H 1 1.390 0.03 A 120 ARG HG3 H 1 1.390 0.03 A 120 ARG C C 13 174.800 0.1 A 120 ARG CA C 13 54.580 0.1 A 120 ARG CB C 13 33.900 0.1 A 120 ARG CD C 13 44.700 0.1 A 120 ARG CG C 13 27.300 0.1 A 121 ARG H H 1 9.144 0.03 A 121 ARG HA H 1 5.312 0.03 A 121 ARG HBy H 1 1.812 0.03 A 121 ARG HBx H 1 1.065 0.03 A 121 ARG HDx H 1 2.940 0.03 A 121 ARG HDy H 1 3.220 0.03 A 121 ARG HGx H 1 1.339 0.03 A 121 ARG HGy H 1 1.407 0.03 A 121 ARG C C 13 174.600 0.1 A 121 ARG CA C 13 55.040 0.1 A 121 ARG CB C 13 31.430 0.1 A 121 ARG CD C 13 42.700 0.1 A 121 ARG CG C 13 28.300 0.1 A 121 ARG N N 15 127.700 0.1 A 122 SER H H 1 9.356 0.03 A 122 SER HA H 1 5.695 0.03 A 122 SER HBy H 1 3.829 0.03 A 122 SER HBx H 1 3.670 0.03 A 122 SER C C 13 171.700 0.1 A 122 SER CA C 13 57.820 0.1 A 122 SER CB C 13 66.500 0.1 A 122 SER N N 15 118.200 0.1 A 123 LYS H H 1 8.707 0.03 A 123 LYS HA H 1 5.759 0.03 A 123 LYS HB2 H 1 1.921 0.03 A 123 LYS HB3 H 1 1.921 0.03 A 123 LYS HD2 H 1 1.420 0.03 A 123 LYS HD3 H 1 1.420 0.03 A 123 LYS HE2 H 1 2.550 0.03 A 123 LYS HE3 H 1 2.550 0.03 A 123 LYS HGx H 1 1.430 0.03 A 123 LYS HGy H 1 1.560 0.03 A 123 LYS C C 13 175.100 0.1 A 123 LYS CA C 13 53.560 0.1 A 123 LYS CB C 13 35.900 0.1 A 123 LYS CD C 13 29.000 0.1 A 123 LYS CE C 13 41.500 0.1 A 123 LYS CG C 13 24.000 0.1 A 123 LYS N N 15 120.500 0.1 A 124 ARG H H 1 8.121 0.03 A 124 ARG HA H 1 3.920 0.03 A 124 ARG HBy H 1 1.330 0.03 A 124 ARG HBx H 1 1.101 0.03 A 124 ARG HDx H 1 2.780 0.03 A 124 ARG HDy H 1 2.940 0.03 A 124 ARG HGx H 1 0.640 0.03 A 124 ARG HGy H 1 0.730 0.03 A 124 ARG C C 13 176.300 0.1 A 124 ARG CA C 13 56.670 0.1 A 124 ARG CB C 13 30.100 0.1 A 124 ARG CD C 13 42.800 0.1 A 124 ARG CG C 13 27.100 0.1 A 124 ARG N N 15 124.800 0.1 A 125 VAL H H 1 8.167 0.03 A 125 VAL HA H 1 3.985 0.03 A 125 VAL HB H 1 1.962 0.03 A 125 VAL HGx% H 1 0.733 0.03 A 125 VAL HGy% H 1 0.860 0.03 A 125 VAL C C 13 180.600 0.1 A 125 VAL CA C 13 63.106 0.1 A 125 VAL CB C 13 33.046 0.1 A 125 VAL CG1 C 13 20.328 0.1 A 125 VAL CG2 C 13 21.700 0.1 A 125 VAL N N 15 128.400 0.1 stop_ 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 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 123 LYS H A 123 LYS HB3 1.0 1.8 6.0 2 1 A 123 LYS HB2 A 123 LYS H 1.0 1.8 6.0 3 2 A 50 THR HG2% A 52 LYS HE3 1.0 1.8 6.0 4 2 A 50 THR HG2% A 52 LYS HE2 1.0 1.8 6.0 5 3 A 17 PHE HE1 A 113 PHE HBx 1.0 1.8 6.0 6 3 A 17 PHE HE2 A 113 PHE HBx 1.0 1.8 6.0 7 4 A 1 ALA HA A 2 PHE HA 1.0 1.8 6.0 8 5 A 1 ALA HA A 2 PHE H 1.0 1.8 6.0 9 6 A 3 SER HA A 2 PHE HBx 1.0 1.8 6.0 10 7 A 4 GLY HAy A 4 GLY H 1.0 1.8 4.5 11 8 A 4 GLY H A 4 GLY HAx 1.0 1.8 4.5 12 9 A 42 GLN H A 3 SER HB2 1.0 1.8 6.0 13 10 A 4 GLY HAx A 5 THR H 1.0 1.8 4.5 14 11 A 4 GLY HAy A 6 TRP HE1 1.0 1.8 6.0 15 12 A 4 GLY HAx A 6 TRP HE1 1.0 1.8 6.0 16 13 A 5 THR HG2% A 6 TRP HA 1.0 1.8 6.0 17 14 A 5 THR HB A 125 VAL HB 1.0 1.8 6.0 18 15 A 6 TRP HA A 7 GLN HA 1.0 1.8 6.0 19 16 A 6 TRP HA A 7 GLN HBy 1.0 1.8 6.0 20 17 A 6 TRP HA A 7 GLN HBx 1.0 1.8 6.0 21 18 A 6 TRP HA A 7 GLN H 1.0 1.8 4.5 22 19 A 6 TRP HA A 8 VAL H 1.0 1.8 6.0 23 20 A 9 TYR HA A 8 VAL HGx% 1.0 1.8 6.0 24 21 A 10 ALA HA A 9 TYR HD1 1.0 1.8 6.0 25 22 A 10 ALA HA A 9 TYR H 1.0 1.8 6.0 26 23 A 10 ALA HB% A 9 TYR HEy 1.0 1.8 6.0 27 24 A 9 TYR HA A 10 ALA H 1.0 1.8 6.0 28 25 A 10 ALA HA A 11 GLN HB2 1.0 1.8 6.0 29 26 A 10 ALA HA A 11 GLN H 1.0 1.8 6.0 30 27 A 10 ALA HB% A 11 GLN H 1.0 1.8 6.0 31 28 A 119 ILE HG13 A 12 GLU HGx 1.0 1.8 6.0 32 28 A 12 GLU HGx A 119 ILE HG12 1.0 1.8 6.0 33 29 A 10 ALA HB% A 12 GLU H 1.0 1.8 6.0 34 30 A 12 GLU H A 11 GLN HB2 1.0 1.8 6.0 35 31 A 109 GLU HA A 110 THR HA 1.0 1.8 6.0 36 32 A 13 ASN HA A 12 GLU HA 1.0 1.8 6.0 37 33 A 11 GLN HB2 A 14 TYR HBy 1.0 1.8 6.0 38 34 A 11 GLN HB2 A 14 TYR HBx 1.0 1.8 6.0 39 35 A 14 TYR H A 12 GLU HGx 1.0 1.8 6.0 40 36 A 15 GLU HBy A 32 ARG HD3 1.0 1.8 6.0 41 36 A 15 GLU HBy A 32 ARG HD2 1.0 1.8 6.0 42 37 A 14 TYR H A 15 GLU HA 1.0 1.8 6.0 43 38 A 15 GLU HBx A 19 LYS H 1.0 1.8 6.0 44 39 A 15 GLU H A 14 TYR HBy 1.0 1.8 6.0 45 40 A 15 GLU H A 14 TYR HBx 1.0 1.8 6.0 46 41 A 14 TYR HA A 17 PHE HBx 1.0 1.8 6.0 47 42 A 15 GLU HA A 17 PHE H 1.0 1.8 6.0 48 43 A 18 LEU HDx% A 14 TYR HD2 1.0 1.8 6.0 49 44 A 18 LEU HDy% A 14 TYR HE1 1.0 1.8 6.0 50 45 A 15 GLU HA A 18 LEU HBx 1.0 1.8 6.0 51 46 A 15 GLU HA A 18 LEU HDx% 1.0 1.8 6.0 52 47 A 15 GLU HA A 18 LEU HG 1.0 1.8 6.0 53 48 A 15 GLU HBx A 18 LEU HBy 1.0 1.8 6.0 54 49 A 19 LYS HA A 23 LEU H 1.0 1.8 6.0 55 50 A 17 PHE H A 19 LYS HD2 1.0 1.8 6.0 56 51 A 19 LYS HA A 28 ILE HD1% 1.0 1.8 4.5 57 52 A 19 LYS H A 18 LEU HBy 1.0 1.8 6.0 58 53 A 19 LYS H A 18 LEU HBx 1.0 1.8 6.0 59 54 A 20 ALA HB% A 17 PHE HA 1.0 1.8 6.0 60 55 A 20 ALA HB% A 113 PHE HD1 1.0 1.8 6.0 61 56 A 19 LYS HA A 20 ALA HA 1.0 1.8 6.0 62 57 A 20 ALA HA A 19 LYS HB3 1.0 1.8 6.0 63 58 A 19 LYS H A 20 ALA HB% 1.0 1.8 6.0 64 59 A 19 LYS HA A 20 ALA H 1.0 1.8 6.0 65 60 A 20 ALA H A 19 LYS HB2 1.0 1.8 6.0 66 61 A 21 LEU HDx% A 17 PHE HE2 1.0 1.8 6.0 67 62 A 21 LEU HDy% A 17 PHE HD2 1.0 1.8 6.0 68 63 A 17 PHE HE2 A 21 LEU HDy% 1.0 1.8 6.0 69 64 A 18 LEU HA A 21 LEU HBy 1.0 1.8 6.0 70 65 A 18 LEU HA A 21 LEU HBx 1.0 1.8 6.0 71 66 A 21 LEU HDy% A 18 LEU HA 1.0 1.8 6.0 72 67 A 19 LYS HB2 A 21 LEU H 1.0 1.8 6.0 73 68 A 20 ALA HA A 21 LEU H 1.0 1.8 6.0 74 69 A 22 ALA H A 21 LEU HBy 1.0 1.8 6.0 75 70 A 22 ALA H A 21 LEU HBx 1.0 1.8 6.0 76 71 A 18 LEU HA A 23 LEU HDx% 1.0 1.8 6.0 77 72 A 18 LEU HDy% A 23 LEU HDx% 1.0 1.8 6.0 78 73 A 23 LEU HDx% A 18 LEU H 1.0 1.8 6.0 79 74 A 19 LYS HA A 23 LEU HB2 1.0 1.8 6.0 80 75 A 113 PHE HD1 A 20 ALA HA 1.0 1.8 6.0 81 76 A 23 LEU HDx% A 21 LEU HBy 1.0 1.8 4.5 82 77 A 23 LEU HDx% A 21 LEU HBx 1.0 1.8 6.0 83 78 A 21 LEU HDx% A 23 LEU HDy% 1.0 1.8 6.0 84 79 A 21 LEU HDy% A 23 LEU HDy% 1.0 1.8 6.0 85 80 A 23 LEU HDy% A 21 LEU HG 1.0 1.8 6.0 86 81 A 23 LEU HG A 21 LEU HBy 1.0 1.8 6.0 87 82 A 23 LEU HG A 21 LEU HBx 1.0 1.8 6.0 88 83 A 21 LEU HDx% A 23 LEU HG 1.0 1.8 6.0 89 84 A 21 LEU HDy% A 23 LEU HG 1.0 1.8 6.0 90 85 A 23 LEU H A 21 LEU HBy 1.0 1.8 6.0 91 86 A 23 LEU H A 21 LEU HBx 1.0 1.8 6.0 92 87 A 23 LEU H A 22 ALA HB% 1.0 1.8 6.0 93 88 A 24 PRO HG2 A 23 LEU HB3 1.0 1.8 6.0 94 88 A 23 LEU HB3 A 24 PRO HG3 1.0 1.8 6.0 95 89 A 23 LEU HA A 24 PRO HDx 1.0 1.8 3.3 96 90 A 24 PRO HDx A 23 LEU HB3 1.0 1.8 4.5 97 91 A 23 LEU HDy% A 24 PRO HDx 1.0 1.8 6.0 98 92 A 24 PRO HDx A 27 LEU HBy 1.0 1.8 6.0 99 92 A 24 PRO HDx A 27 LEU HBx 1.0 1.8 6.0 100 93 A 23 LEU HA A 24 PRO HDy 1.0 1.8 4.5 101 94 A 24 PRO HDy A 23 LEU HB2 1.0 1.8 4.5 102 95 A 23 LEU HDy% A 24 PRO HDy 1.0 1.8 6.0 103 96 A 24 PRO HDy A 27 LEU HDy% 1.0 1.8 6.0 104 97 A 24 PRO HDx A 27 LEU HDy% 1.0 1.8 6.0 105 98 A 24 PRO HDy A 27 LEU HBy 1.0 1.8 6.0 106 98 A 27 LEU HBx A 24 PRO HDy 1.0 1.8 6.0 107 99 A 27 LEU HDy% A 24 PRO HG3 1.0 1.8 6.0 108 99 A 24 PRO HG2 A 27 LEU HDy% 1.0 1.8 6.0 109 100 A 24 PRO HG2 A 27 LEU HBy 1.0 1.8 6.0 110 100 A 24 PRO HG3 A 27 LEU HBy 1.0 1.8 6.0 111 101 A 24 PRO HG2 A 27 LEU HBx 1.0 1.8 6.0 112 101 A 27 LEU HBx A 24 PRO HG3 1.0 1.8 6.0 113 102 A 24 PRO HG2 A 25 GLU H 1.0 1.8 6.0 114 103 A 26 ASP H A 24 PRO HBx 1.0 1.8 6.0 115 104 A 26 ASP HA A 25 GLU HA 1.0 1.8 6.0 116 105 A 27 LEU HBx A 23 LEU HB3 1.0 1.8 6.0 117 106 A 27 LEU HDy% A 23 LEU HB3 1.0 1.8 4.5 118 107 A 23 LEU HDx% A 27 LEU HG 1.0 1.8 6.0 119 108 A 24 PRO HDx A 27 LEU HBy 1.0 1.8 6.0 120 109 A 24 PRO HG2 A 27 LEU HDx% 1.0 1.8 6.0 121 110 A 27 LEU H A 24 PRO HBy 1.0 1.8 6.0 122 111 A 27 LEU H A 24 PRO HBx 1.0 1.8 6.0 123 112 A 24 PRO HG2 A 27 LEU H 1.0 1.8 6.0 124 113 A 27 LEU HA A 26 ASP HBx 1.0 1.8 6.0 125 114 A 15 GLU HBx A 28 ILE HG2% 1.0 1.8 6.0 126 115 A 18 LEU HDx% A 28 ILE HA 1.0 1.8 6.0 127 116 A 18 LEU HBy A 28 ILE HD1% 1.0 1.8 6.0 128 117 A 18 LEU HBx A 28 ILE HG2% 1.0 1.8 6.0 129 118 A 18 LEU HDx% A 28 ILE HG2% 1.0 1.8 6.0 130 119 A 28 ILE HD1% A 23 LEU HB3 1.0 1.8 6.0 131 120 A 28 ILE HD1% A 23 LEU HB2 1.0 1.8 6.0 132 121 A 28 ILE H A 23 LEU HB3 1.0 1.8 6.0 133 122 A 28 ILE HD1% A 25 GLU HA 1.0 1.8 6.0 134 123 A 25 GLU HA A 28 ILE HG2% 1.0 1.8 6.0 135 124 A 28 ILE HG2% A 25 GLU HG2 1.0 1.8 6.0 136 125 A 27 LEU HA A 28 ILE H 1.0 1.8 4.5 137 126 A 27 LEU HBx A 28 ILE H 1.0 1.8 6.0 138 127 A 28 ILE HD1% A 29 LYS H 1.0 1.8 6.0 139 128 A 28 ILE HG2% A 29 LYS H 1.0 1.8 6.0 140 129 A 27 LEU HA A 30 MET HBy 1.0 1.8 6.0 141 130 A 27 LEU HDx% A 30 MET HBy 1.0 1.8 6.0 142 131 A 27 LEU HG A 30 MET HBy 1.0 1.8 6.0 143 132 A 27 LEU HA A 30 MET HBx 1.0 1.8 6.0 144 133 A 27 LEU HA A 30 MET HE% 1.0 1.8 6.0 145 134 A 27 LEU HA A 30 MET H 1.0 1.8 6.0 146 135 A 27 LEU HDx% A 30 MET H 1.0 1.8 6.0 147 136 A 30 MET HA A 29 LYS HB2 1.0 1.8 6.0 148 137 A 30 MET H A 29 LYS HA 1.0 1.8 6.0 149 138 A 18 LEU HDx% A 31 ALA HB% 1.0 1.8 6.0 150 139 A 28 ILE HA A 31 ALA HB% 1.0 1.8 6.0 151 140 A 30 MET HA A 31 ALA HB% 1.0 1.8 6.0 152 141 A 30 MET H A 31 ALA HB% 1.0 1.8 6.0 153 142 A 30 MET HA A 31 ALA H 1.0 1.8 6.0 154 143 A 31 ALA H A 30 MET HBy 1.0 1.8 6.0 155 144 A 31 ALA H A 30 MET HBx 1.0 1.8 6.0 156 145 A 29 LYS HA A 32 ARG HBx 1.0 1.8 6.0 157 146 A 29 LYS HA A 32 ARG HD3 1.0 1.8 6.0 158 147 A 30 MET HA A 32 ARG HGy 1.0 1.8 6.0 159 148 A 30 MET HA A 32 ARG H 1.0 1.8 6.0 160 149 A 31 ALA HA A 32 ARG HA 1.0 1.8 6.0 161 150 A 32 ARG H A 31 ALA HA 1.0 1.8 6.0 162 151 A 33 ASP H A 32 ARG HBx 1.0 1.8 6.0 163 152 A 33 ASP H A 32 ARG HGx 1.0 1.8 6.0 164 153 A 34 ILE HD1% A 30 MET HBy 1.0 1.8 6.0 165 154 A 33 ASP HA A 34 ILE H 1.0 1.8 6.0 166 155 A 9 TYR HA A 35 LYS HBy 1.0 1.8 6.0 167 156 A 33 ASP HA A 35 LYS HA 1.0 1.8 6.0 168 157 A 36 PRO HDy A 8 VAL HGy% 1.0 1.8 3.3 169 158 A 36 PRO HDy A 34 ILE HG2% 1.0 1.8 4.5 170 159 A 8 VAL HGy% A 36 PRO HG2 1.0 1.8 4.5 171 160 A 36 PRO HG2 A 8 VAL HB 1.0 1.8 6.0 172 161 A 35 LYS HA A 36 PRO HDx 1.0 1.8 6.0 173 162 A 35 LYS HA A 36 PRO HDy 1.0 1.8 4.5 174 163 A 35 LYS HA A 36 PRO HG2 1.0 1.8 6.0 175 164 A 7 GLN HA A 37 ILE HG12 1.0 1.8 6.0 176 165 A 7 GLN HBx A 37 ILE HG12 1.0 1.8 6.0 177 166 A 8 VAL H A 37 ILE HG12 1.0 1.8 6.0 178 167 A 27 LEU HDy% A 74 ASP HA 1.0 1.8 4.5 179 168 A 36 PRO HA A 53 THR HA 1.0 1.8 4.5 180 169 A 34 ILE HG2% A 36 PRO HA 1.0 1.8 6.0 181 170 A 36 PRO HA A 37 ILE HG13 1.0 1.8 4.5 182 171 A 36 PRO HDy A 37 ILE HG13 1.0 1.8 6.0 183 172 A 36 PRO HG2 A 37 ILE HG13 1.0 1.8 6.0 184 173 A 36 PRO HA A 37 ILE H 1.0 1.8 4.5 185 174 A 37 ILE H A 36 PRO HBy 1.0 1.8 6.0 186 175 A 38 VAL HB A 6 TRP HBx 1.0 1.8 6.0 187 176 A 38 VAL HB A 6 TRP HBy 1.0 1.8 6.0 188 177 A 38 VAL HGx% A 6 TRP HD1 1.0 1.8 6.0 189 178 A 7 GLN HA A 38 VAL H 1.0 1.8 4.5 190 179 A 36 PRO HG2 A 38 VAL HB 1.0 1.8 6.0 191 180 A 38 VAL H A 37 ILE HG13 1.0 1.8 6.0 192 181 A 5 THR HA A 39 GLU HA 1.0 1.8 6.0 193 182 A 5 THR HG2% A 39 GLU HA 1.0 1.8 6.0 194 183 A 40 ILE HD1% A 2 PHE HBy 1.0 1.8 6.0 195 184 A 40 ILE HD1% A 2 PHE HBx 1.0 1.8 6.0 196 185 A 40 ILE HG2% A 2 PHE HBy 1.0 1.8 6.0 197 186 A 40 ILE HG2% A 2 PHE HBx 1.0 1.8 6.0 198 187 A 3 SER HA A 40 ILE HG2% 1.0 1.8 6.0 199 188 A 4 GLY HAy A 40 ILE H 1.0 1.8 6.0 200 189 A 4 GLY HAx A 40 ILE H 1.0 1.8 6.0 201 190 A 6 TRP HE1 A 40 ILE HD1% 1.0 1.8 6.0 202 191 A 38 VAL HB A 40 ILE H 1.0 1.8 6.0 203 192 A 39 GLU HA A 40 ILE HA 1.0 1.8 4.5 204 193 A 39 GLU HA A 40 ILE HD1% 1.0 1.8 6.0 205 194 A 40 ILE HG2% A 41 GLN HA 1.0 1.8 6.0 206 195 A 41 GLN HBx A 48 VAL HGx% 1.0 1.8 6.0 207 196 A 40 ILE HA A 41 GLN HBy 1.0 1.8 6.0 208 197 A 48 VAL HGx% A 41 GLN HBy 1.0 1.8 6.0 209 198 A 48 VAL HGy% A 41 GLN HG3 1.0 1.8 6.0 210 198 A 41 GLN HG2 A 48 VAL HGy% 1.0 1.8 6.0 211 199 A 40 ILE HG2% A 41 GLN H 1.0 1.8 6.0 212 200 A 40 ILE HA A 42 GLN HA 1.0 1.8 6.5 213 201 A 41 GLN H A 42 GLN HA 1.0 1.8 6.0 214 202 A 41 GLN HA A 42 GLN HBx 1.0 1.8 6.0 215 203 A 42 GLN H A 41 GLN HA 1.0 1.8 4.5 216 204 A 42 GLN H A 41 GLN HBx 1.0 1.8 6.0 217 205 A 42 GLN H A 41 GLN HBy 1.0 1.8 6.0 218 206 A 42 GLN H A 41 GLN HG2 1.0 1.8 6.0 219 207 A 3 SER HA A 41 GLN HA 1.0 1.8 6.0 220 208 A 42 GLN HGx A 44 GLY H 1.0 1.8 6.0 221 209 A 43 LYS HA A 44 GLY HAy 1.0 1.8 6.0 222 210 A 43 LYS HA A 44 GLY HAx 1.0 1.8 6.0 223 211 A 44 GLY H A 43 LYS HA 1.0 1.8 6.0 224 212 A 43 LYS HBx A 45 ASP H 1.0 1.8 6.0 225 213 A 43 LYS HA A 46 ASP H 1.0 1.8 6.0 226 214 A 46 ASP H A 45 ASP HA 1.0 1.8 6.0 227 215 A 46 ASP H A 45 ASP HBy 1.0 1.8 6.0 228 216 A 40 ILE HG2% A 47 PHE HD2 1.0 1.8 6.0 229 217 A 42 GLN HA A 47 PHE HA 1.0 1.8 4.5 230 218 A 47 PHE HA A 43 LYS H 1.0 1.8 6.0 231 219 A 45 ASP HA A 64 LEU HG 1.0 1.8 6.0 232 220 A 64 LEU HG A 45 ASP HBy 1.0 1.8 6.0 233 221 A 64 LEU HG A 45 ASP HBx 1.0 1.8 6.0 234 222 A 64 LEU HBy A 45 ASP HBx 1.0 1.8 6.0 235 223 A 45 ASP HBy A 64 LEU HBx 1.0 1.8 4.5 236 224 A 45 ASP HBx A 64 LEU HBx 1.0 1.8 6.0 237 225 A 45 ASP HA A 47 PHE HD1 1.0 1.8 6.0 238 226 A 45 ASP HA A 47 PHE HEy 1.0 1.8 6.0 239 227 A 47 PHE HA A 46 ASP HA 1.0 1.8 4.5 240 228 A 46 ASP HA A 47 PHE HBy 1.0 1.8 6.0 241 229 A 48 VAL HGy% A 46 ASP HA 1.0 1.8 6.0 242 230 A 47 PHE HA A 48 VAL HB 1.0 1.8 6.0 243 231 A 48 VAL H A 47 PHE HBy 1.0 1.8 6.0 244 232 A 48 VAL H A 47 PHE HBx 1.0 1.8 6.0 245 233 A 49 VAL HA A 47 PHE HBy 1.0 1.8 6.0 246 234 A 49 VAL HGy% A 47 PHE HBy 1.0 1.8 6.0 247 235 A 49 VAL HGy% A 47 PHE HBx 1.0 1.8 6.0 248 236 A 48 VAL H A 49 VAL HGy% 1.0 1.8 6.0 249 237 A 50 THR HB A 39 GLU HBx 1.0 1.8 6.0 250 238 A 48 VAL HGx% A 50 THR HA 1.0 1.8 6.0 251 239 A 49 VAL HA A 50 THR HA 1.0 1.8 4.5 252 240 A 49 VAL HA A 50 THR HB 1.0 1.8 6.0 253 241 A 51 SER HA A 73 MET HE% 1.0 1.8 6.0 254 242 A 51 SER HA A 49 VAL HGx% 1.0 1.8 6.0 255 243 A 73 MET HE% A 51 SER HBx 1.0 1.8 4.5 256 244 A 50 THR HA A 51 SER HBx 1.0 1.8 6.0 257 245 A 50 THR HG2% A 52 LYS HBy 1.0 1.8 6.0 258 246 A 50 THR HG2% A 52 LYS HBx 1.0 1.8 6.0 259 247 A 50 THR HG2% A 52 LYS HE3 1.0 1.8 6.0 260 248 A 50 THR HG2% A 52 LYS HG3 1.0 1.8 6.0 261 249 A 50 THR HG2% A 52 LYS HG2 1.0 1.8 4.5 262 250 A 51 SER HA A 52 LYS HBy 1.0 1.8 6.0 263 251 A 52 LYS HBx A 51 SER HBy 1.0 1.8 6.0 264 252 A 58 VAL HB A 51 SER HBx 1.0 1.8 6.0 265 253 A 52 LYS H A 51 SER HBy 1.0 1.8 6.0 266 254 A 52 LYS H A 51 SER HBx 1.0 1.8 6.0 267 255 A 34 ILE HG2% A 53 THR HG2% 1.0 1.8 3.3 268 256 A 34 ILE HG2% A 53 THR H 1.0 1.8 6.0 269 257 A 36 PRO HA A 53 THR HG2% 1.0 1.8 6.0 270 258 A 53 THR HG2% A 36 PRO HBx 1.0 1.8 6.0 271 259 A 53 THR HG2% A 36 PRO HBy 1.0 1.8 4.5 272 260 A 53 THR HG2% A 36 PRO HG3 1.0 1.8 6.0 273 261 A 53 THR HA A 54 PRO HDy 1.0 1.8 4.5 274 262 A 53 THR HB A 54 PRO HDx 1.0 1.8 4.5 275 263 A 53 THR HA A 52 LYS HA 1.0 1.8 6.0 276 264 A 53 THR HB A 52 LYS HA 1.0 1.8 6.0 277 265 A 34 ILE HD1% A 54 PRO HDx 1.0 1.8 6.0 278 266 A 34 ILE HG2% A 54 PRO HDx 1.0 1.8 6.0 279 267 A 52 LYS HA A 57 THR HB 1.0 1.8 6.0 280 268 A 52 LYS HG2 A 57 THR HB 1.0 1.8 6.0 281 269 A 73 MET HE% A 52 LYS HA 1.0 1.8 6.0 282 270 A 53 THR HG2% A 54 PRO HDx 1.0 1.8 6.0 283 271 A 53 THR HB A 54 PRO HGy 1.0 1.8 6.0 284 272 A 53 THR HB A 54 PRO HGx 1.0 1.8 6.0 285 273 A 53 THR HA A 54 PRO HGx 1.0 1.8 6.0 286 274 A 52 LYS HA A 36 PRO HBx 1.0 1.8 6.0 287 275 A 54 PRO HA A 55 ARG H 1.0 1.8 6.0 288 276 A 55 ARG H A 54 PRO HBx 1.0 1.8 6.0 289 277 A 55 ARG H A 54 PRO HBy 1.0 1.8 6.0 290 278 A 53 THR HA A 54 PRO HGy 1.0 1.8 6.0 291 279 A 53 THR HA A 56 GLN HGx 1.0 1.8 6.0 292 280 A 54 PRO HA A 56 GLN HA 1.0 1.8 6.0 293 281 A 56 GLN H A 54 PRO HBx 1.0 1.8 6.0 294 281 A 54 PRO HBy A 56 GLN H 1.0 1.8 6.0 295 282 A 55 ARG H A 56 GLN HA 1.0 1.8 6.0 296 283 A 56 GLN H A 55 ARG HA 1.0 1.8 4.5 297 284 A 56 GLN H A 55 ARG HD2 1.0 1.8 6.0 298 285 A 57 THR HG2% A 52 LYS HBx 1.0 1.8 6.0 299 286 A 56 GLN HA A 57 THR HA 1.0 1.8 6.0 300 287 A 57 THR HA A 56 GLN HBy 1.0 1.8 6.0 301 288 A 57 THR HB A 56 GLN HA 1.0 1.8 6.0 302 289 A 56 GLN HA A 57 THR H 1.0 1.8 3.3 303 290 A 57 THR H A 56 GLN HBx 1.0 1.8 6.0 304 291 A 50 THR HG2% A 58 VAL HA 1.0 1.8 6.0 305 292 A 58 VAL HGy% A 51 SER HBx 1.0 1.8 6.0 306 293 A 58 VAL HB A 57 THR HA 1.0 1.8 6.0 307 294 A 57 THR H A 58 VAL HGy% 1.0 1.8 6.0 308 295 A 50 THR HA A 59 THR HA 1.0 1.8 6.0 309 296 A 57 THR HB A 59 THR HA 1.0 1.8 6.0 310 297 A 57 THR HA A 59 THR H 1.0 1.8 6.5 311 298 A 57 THR HB A 59 THR H 1.0 1.8 6.0 312 299 A 58 VAL HA A 59 THR HB 1.0 1.8 6.0 313 300 A 53 THR H A 57 THR HA 1.0 1.8 6.0 314 301 A 60 ASN HA A 59 THR HG2% 1.0 1.8 6.0 315 302 A 59 THR HB A 60 ASN H 1.0 1.8 6.0 316 303 A 48 VAL HGy% A 61 SER HA 1.0 1.8 6.0 317 304 A 48 VAL HA A 61 SER HB3 1.0 1.8 6.0 318 305 A 48 VAL HGy% A 61 SER HB3 1.0 1.8 6.0 319 306 A 61 SER HA A 49 VAL H 1.0 1.8 4.5 320 307 A 59 THR HG2% A 61 SER HA 1.0 1.8 6.0 321 308 A 60 ASN HA A 61 SER HA 1.0 1.8 6.0 322 309 A 60 ASN HA A 61 SER HB2 1.0 1.8 6.0 323 310 A 60 ASN H A 61 SER HB2 1.0 1.8 6.0 324 311 A 60 ASN HA A 61 SER H 1.0 1.8 3.3 325 312 A 61 SER H A 60 ASN HBx 1.0 1.8 6.0 326 313 A 61 SER H A 60 ASN HBy 1.0 1.8 6.0 327 314 A 62 PHE HD1 A 47 PHE HBy 1.0 1.8 6.0 328 315 A 60 ASN HA A 62 PHE H 1.0 1.8 6.0 329 316 A 62 PHE H A 60 ASN HBx 1.0 1.8 6.0 330 317 A 62 PHE H A 60 ASN HBy 1.0 1.8 6.0 331 318 A 61 SER HA A 62 PHE HA 1.0 1.8 6.0 332 319 A 62 PHE H A 61 SER HB2 1.0 1.8 4.5 333 320 A 63 THR HA A 45 ASP HBy 1.0 1.8 6.0 334 321 A 63 THR HA A 45 ASP HBx 1.0 1.8 6.0 335 322 A 46 ASP HA A 63 THR HA 1.0 1.8 4.5 336 323 A 62 PHE HA A 63 THR HA 1.0 1.8 6.0 337 324 A 62 PHE HA A 63 THR HB 1.0 1.8 6.0 338 325 A 62 PHE HA A 63 THR H 1.0 1.8 4.5 339 326 A 63 THR H A 62 PHE HBx 1.0 1.8 6.0 340 327 A 63 THR H A 62 PHE HBy 1.0 1.8 6.0 341 328 A 45 ASP HA A 64 LEU HDy% 1.0 1.8 6.0 342 329 A 45 ASP HA A 64 LEU HDx% 1.0 1.8 4.5 343 330 A 47 PHE HEy A 64 LEU HDy% 1.0 1.8 6.0 344 331 A 64 LEU HDx% A 47 PHE HEx 1.0 0.3 4.5 345 332 A 70 ILE HD1% A 62 PHE HBx 1.0 1.8 6.0 346 333 A 63 THR HG2% A 64 LEU H 1.0 1.8 6.0 347 334 A 64 LEU HA A 65 GLY HAy 1.0 1.8 6.0 348 335 A 65 GLY HAy A 64 LEU HBx 1.0 1.8 6.0 349 336 A 63 THR HG2% A 66 LYS HBy 1.0 1.8 6.0 350 337 A 63 THR HG2% A 66 LYS H 1.0 1.8 6.0 351 338 A 64 LEU HA A 66 LYS H 1.0 1.8 6.0 352 339 A 15 GLU H A 32 ARG HBy 1.0 1.8 6.0 353 339 A 15 GLU H A 32 ARG HBx 1.0 1.8 6.0 354 340 A 66 LYS HA A 67 GLU HA 1.0 1.8 6.0 355 341 A 61 SER H A 68 ALA HB% 1.0 1.8 6.0 356 342 A 62 PHE HA A 68 ALA HA 1.0 1.8 6.0 357 343 A 68 ALA HB% A 62 PHE HBx 1.0 1.8 6.0 358 344 A 68 ALA HB% A 62 PHE HBy 1.0 1.8 6.0 359 345 A 62 PHE HD1 A 68 ALA HB% 1.0 1.8 6.0 360 346 A 67 GLU HA A 68 ALA HA 1.0 1.8 6.0 361 347 A 68 ALA HA A 67 GLU HBx 1.0 1.8 6.0 362 348 A 68 ALA HA A 67 GLU HGx 1.0 1.8 6.0 363 349 A 67 GLU HA A 68 ALA HB% 1.0 1.8 6.0 364 350 A 67 GLU HBx A 68 ALA H 1.0 1.8 6.0 365 351 A 68 ALA H A 67 GLU HGx 1.0 1.8 6.0 366 352 A 33 ASP H A 32 ARG HBy 1.0 1.8 6.0 367 353 A 68 ALA HA A 69 ASP HA 1.0 1.8 6.0 368 354 A 68 ALA HA A 69 ASP HB2 1.0 1.8 6.0 369 355 A 68 ALA HA A 69 ASP H 1.0 1.8 3.3 370 356 A 68 ALA HB% A 69 ASP H 1.0 1.8 4.5 371 357 A 70 ILE HD1% A 60 ASN HBx 1.0 1.8 4.5 372 358 A 70 ILE HD1% A 60 ASN HBy 1.0 1.8 4.5 373 359 A 70 ILE HG13 A 60 ASN HBx 1.0 1.8 6.0 374 360 A 70 ILE HG13 A 60 ASN HBy 1.0 1.8 6.0 375 361 A 70 ILE HG2% A 60 ASN HBy 1.0 1.8 6.0 376 362 A 61 SER H A 70 ILE HG2% 1.0 1.8 6.0 377 363 A 70 ILE HD1% A 62 PHE HBy 1.0 1.8 6.0 378 364 A 70 ILE HD1% A 62 PHE HD2 1.0 1.8 6.0 379 365 A 70 ILE HD1% A 68 ALA HB% 1.0 1.8 6.0 380 366 A 68 ALA HA A 70 ILE H 1.0 1.8 6.0 381 367 A 68 ALA HB% A 70 ILE H 1.0 1.8 6.0 382 368 A 69 ASP HA A 70 ILE HA 1.0 1.8 6.0 383 369 A 69 ASP H A 70 ILE HA 1.0 1.8 6.0 384 370 A 69 ASP HA A 70 ILE HB 1.0 1.8 6.0 385 371 A 58 VAL HGy% A 71 THR HG2% 1.0 1.8 6.0 386 372 A 60 ASN HA A 71 THR H 1.0 1.8 6.0 387 373 A 70 ILE HA A 71 THR HA 1.0 1.8 6.0 388 374 A 70 ILE HD1% A 71 THR HA 1.0 1.8 6.0 389 375 A 70 ILE HG2% A 71 THR HA 1.0 1.8 6.0 390 376 A 70 ILE H A 71 THR HA 1.0 1.8 6.0 391 377 A 70 ILE HA A 71 THR HB 1.0 1.8 6.0 392 378 A 70 ILE HB A 71 THR H 1.0 1.8 6.0 393 379 A 70 ILE HD1% A 71 THR H 1.0 1.8 6.0 394 380 A 58 VAL HGx% A 72 THR HA 1.0 1.8 6.0 395 381 A 71 THR HA A 72 THR HG2% 1.0 1.8 6.0 396 382 A 73 MET HE% A 36 PRO HBx 1.0 1.8 6.0 397 383 A 73 MET HE% A 53 THR HG2% 1.0 1.8 4.5 398 384 A 73 MET HE% A 53 THR H 1.0 1.8 6.0 399 385 A 73 MET HE% A 57 THR HA 1.0 1.8 6.0 400 386 A 58 VAL HA A 73 MET HA 1.0 1.8 6.0 401 387 A 58 VAL HB A 73 MET HBy 1.0 1.8 4.5 402 388 A 58 VAL HGy% A 73 MET HBy 1.0 1.8 6.0 403 389 A 73 MET HE% A 58 VAL H 1.0 1.8 6.0 404 390 A 58 VAL HB A 73 MET HGx 1.0 1.8 6.0 405 391 A 58 VAL HGy% A 73 MET HGx 1.0 1.8 6.0 406 392 A 58 VAL HB A 73 MET HGy 1.0 1.8 6.0 407 393 A 58 VAL HGy% A 73 MET HGy 1.0 1.8 4.5 408 394 A 73 MET HA A 72 THR HB 1.0 1.8 6.0 409 395 A 72 THR HA A 73 MET HBy 1.0 1.8 6.0 410 396 A 72 THR HA A 73 MET HGx 1.0 1.8 6.0 411 397 A 23 LEU HDy% A 74 ASP HBy 1.0 1.8 6.0 412 398 A 58 VAL HGy% A 74 ASP H 1.0 1.8 6.0 413 399 A 73 MET HA A 74 ASP H 1.0 1.8 6.0 414 400 A 71 THR HG2% A 75 GLY H 1.0 1.8 6.0 415 401 A 73 MET HA A 75 GLY H 1.0 1.8 6.0 416 402 A 74 ASP HA A 75 GLY H 1.0 1.8 6.0 417 403 A 72 THR HG2% A 76 LYS HBx 1.0 1.8 6.0 418 404 A 72 THR HG2% A 76 LYS HBy 1.0 1.8 6.0 419 405 A 72 THR HG2% A 76 LYS HGy 1.0 1.8 6.0 420 406 A 72 THR HG2% A 76 LYS H 1.0 1.8 6.0 421 407 A 35 LYS HA A 36 PRO HA 1.0 1.8 6.0 422 408 A 27 LEU HBx A 74 ASP HBx 1.0 1.8 6.0 423 408 A 27 LEU HBy A 74 ASP HBx 1.0 1.8 6.0 424 409 A 74 ASP HBy A 27 LEU HBy 1.0 1.8 6.0 425 409 A 27 LEU HBx A 74 ASP HBy 1.0 1.8 6.0 426 410 A 27 LEU HG A 74 ASP HBx 1.0 1.8 6.0 427 411 A 27 LEU HG A 74 ASP HBy 1.0 1.8 6.0 428 412 A 74 ASP HBx A 76 LYS HGy 1.0 1.8 6.0 429 413 A 76 LYS HA A 75 GLY HAy 1.0 1.8 6.0 430 414 A 76 LYS HA A 77 LYS HA 1.0 1.8 6.0 431 415 A 77 LYS HA A 76 LYS HGx 1.0 1.8 6.0 432 416 A 70 ILE HB A 78 LEU HDx% 1.0 1.8 6.0 433 417 A 70 ILE HB A 78 LEU HG 1.0 1.8 6.0 434 418 A 70 ILE HG2% A 78 LEU HG 1.0 1.8 6.0 435 419 A 72 THR HG2% A 78 LEU HDx% 1.0 1.8 6.0 436 420 A 72 THR HG2% A 78 LEU HG 1.0 1.8 6.0 437 421 A 72 THR HG2% A 78 LEU H 1.0 1.8 6.0 438 422 A 78 LEU HBx A 76 LYS HBx 1.0 1.8 6.0 439 423 A 78 LEU HBy A 76 LYS HBx 1.0 1.8 6.0 440 424 A 78 LEU H A 77 LYS HBx 1.0 1.8 6.0 441 425 A 78 LEU H A 77 LYS HBy 1.0 1.8 6.0 442 426 A 78 LEU HA A 79 LYS HA 1.0 1.8 6.0 443 427 A 78 LEU HBy A 79 LYS HA 1.0 1.8 4.5 444 428 A 78 LEU HA A 79 LYS H 1.0 1.8 3.3 445 429 A 78 LEU HBx A 79 LYS H 1.0 1.8 6.0 446 430 A 78 LEU HBy A 79 LYS H 1.0 1.8 6.0 447 431 A 80 CYS HA A 67 GLU HGy 1.0 1.8 6.0 448 432 A 68 ALA H A 80 CYS HA 1.0 1.8 6.0 449 433 A 68 ALA HA A 80 CYS H 1.0 1.8 6.0 450 434 A 68 ALA HB% A 80 CYS H 1.0 1.8 6.0 451 435 A 80 CYS HBx A 70 ILE HG12 1.0 1.8 6.0 452 436 A 80 CYS HBy A 70 ILE HG12 1.0 1.8 6.0 453 437 A 80 CYS HA A 79 LYS HBy 1.0 1.8 6.0 454 438 A 80 CYS H A 79 LYS HGy 1.0 1.8 6.0 455 439 A 80 CYS H A 79 LYS HGx 1.0 1.8 6.0 456 440 A 65 GLY HAy A 81 THR HG2% 1.0 1.8 6.0 457 441 A 66 LYS HA A 81 THR HG2% 1.0 1.8 6.0 458 442 A 79 LYS HA A 81 THR H 1.0 1.8 6.0 459 443 A 81 THR H A 79 LYS HBy 1.0 1.8 6.0 460 444 A 81 THR H A 79 LYS HBx 1.0 1.8 6.0 461 445 A 80 CYS HA A 81 THR HA 1.0 1.8 6.0 462 446 A 80 CYS H A 81 THR HA 1.0 1.8 6.0 463 447 A 80 CYS HA A 81 THR HB 1.0 1.8 6.0 464 448 A 80 CYS HA A 81 THR H 1.0 1.8 3.3 465 449 A 82 VAL HB A 47 PHE HBx 1.0 1.8 6.0 466 450 A 62 PHE HD2 A 82 VAL HB 1.0 1.8 6.0 467 451 A 62 PHE HD2 A 82 VAL HGx% 1.0 1.8 6.0 468 452 A 62 PHE HD2 A 82 VAL HGy% 1.0 1.8 6.0 469 453 A 99 GLU HA A 91 THR H 1.0 1.8 6.0 470 454 A 64 LEU HA A 83 HIS HA 1.0 1.8 6.0 471 455 A 83 HIS HA A 64 LEU HBx 1.0 1.8 6.0 472 456 A 83 HIS HA A 64 LEU HBy 1.0 1.8 6.0 473 457 A 64 LEU HDy% A 89 LEU HA 1.0 1.8 6.0 474 458 A 64 LEU HDy% A 83 HIS HA 1.0 1.8 6.0 475 459 A 64 LEU HBx A 83 HIS HBy 1.0 1.8 6.0 476 460 A 83 HIS HBx A 64 LEU HBx 1.0 1.8 6.0 477 461 A 83 HIS HA A 65 GLY HAx 1.0 1.8 6.0 478 462 A 65 GLY HAx A 83 HIS HBy 1.0 1.8 6.0 479 463 A 81 THR HB A 83 HIS H 1.0 1.8 6.0 480 464 A 82 VAL HGx% A 83 HIS HA 1.0 1.8 6.0 481 465 A 82 VAL HB A 83 HIS H 1.0 1.8 6.0 482 466 A 64 LEU HDx% A 84 LEU HA 1.0 1.8 6.0 483 467 A 64 LEU HDx% A 84 LEU HBx 1.0 1.8 6.0 484 468 A 64 LEU HDy% A 84 LEU HBx 1.0 1.8 6.0 485 469 A 64 LEU HDx% A 84 LEU HBy 1.0 1.8 6.0 486 470 A 64 LEU HDy% A 84 LEU HBy 1.0 1.8 6.0 487 471 A 64 LEU HDx% A 84 LEU HDy% 1.0 1.8 6.0 488 472 A 64 LEU HDy% A 84 LEU HG 1.0 1.8 6.0 489 473 A 64 LEU HDx% A 84 LEU HG 1.0 1.8 6.0 490 474 A 64 LEU HDy% A 84 LEU H 1.0 1.8 6.0 491 475 A 64 LEU HDx% A 84 LEU H 1.0 1.8 6.0 492 476 A 82 VAL HGx% A 89 LEU HBx 1.0 1.8 6.0 493 477 A 84 LEU H A 83 HIS HBy 1.0 1.8 6.0 494 478 A 84 LEU H A 83 HIS HBx 1.0 1.8 4.5 495 479 A 85 ALA HB% A 83 HIS HBy 1.0 1.8 6.0 496 480 A 85 ALA HB% A 83 HIS HBx 1.0 1.8 6.0 497 481 A 83 HIS HA A 85 ALA H 1.0 1.8 6.0 498 482 A 84 LEU HA A 85 ALA HA 1.0 1.8 6.0 499 483 A 85 ALA HA A 84 LEU HBy 1.0 1.8 6.0 500 484 A 84 LEU HA A 85 ALA HB% 1.0 1.8 6.0 501 485 A 85 ALA H A 84 LEU HBx 1.0 1.8 6.0 502 486 A 85 ALA H A 84 LEU HBy 1.0 1.8 6.0 503 487 A 85 ALA HA A 86 ASN HA 1.0 1.8 4.5 504 488 A 85 ALA HA A 87 GLY H 1.0 1.8 6.0 505 489 A 85 ALA HB% A 87 GLY H 1.0 1.8 6.0 506 490 A 86 ASN HA A 87 GLY H 1.0 1.8 4.5 507 491 A 84 LEU HA A 88 LYS H 1.0 1.8 6.0 508 492 A 84 LEU HDy% A 88 LYS H 1.0 1.8 6.0 509 493 A 85 ALA HB% A 88 LYS H 1.0 1.8 6.0 510 494 A 88 LYS HG2 A 87 GLY HAx 1.0 1.8 6.0 511 495 A 47 PHE HEx A 89 LEU HDx% 1.0 1.8 6.0 512 496 A 89 LEU HDx% A 47 PHE HBy 1.0 1.8 6.0 513 497 A 64 LEU HDx% A 89 LEU HDx% 1.0 1.8 6.0 514 498 A 64 LEU HDy% A 89 LEU HDx% 1.0 1.8 6.0 515 499 A 82 VAL HGy% A 89 LEU HBx 1.0 1.8 6.0 516 500 A 82 VAL HGx% A 89 LEU HBy 1.0 1.8 6.0 517 501 A 82 VAL HGy% A 89 LEU HDy% 1.0 1.8 6.0 518 502 A 82 VAL HGy% A 89 LEU HDx% 1.0 1.8 6.0 519 503 A 89 LEU HA A 84 LEU HA 1.0 1.8 4.5 520 504 A 89 LEU HA A 84 LEU HDy% 1.0 1.8 6.0 521 505 A 84 LEU HDy% A 89 LEU HDx% 1.0 1.8 6.0 522 506 A 84 LEU HA A 89 LEU HDy% 1.0 1.8 6.0 523 507 A 84 LEU HDy% A 89 LEU HDy% 1.0 1.8 6.0 524 508 A 84 LEU HDy% A 89 LEU H 1.0 1.8 6.0 525 509 A 89 LEU HA A 88 LYS HA 1.0 1.8 6.0 526 510 A 89 LEU HBy A 88 LYS HA 1.0 1.8 6.0 527 511 A 89 LEU H A 88 LYS HG3 1.0 1.8 6.0 528 512 A 83 HIS H A 90 VAL HGx% 1.0 1.8 6.0 529 513 A 90 VAL H A 83 HIS HBy 1.0 1.8 6.0 530 514 A 90 VAL H A 83 HIS HBx 1.0 1.8 6.0 531 515 A 85 ALA HA A 90 VAL HGy% 1.0 1.8 6.0 532 516 A 85 ALA HB% A 90 VAL HGy% 1.0 1.8 6.0 533 517 A 89 LEU HBx A 90 VAL HA 1.0 1.8 6.0 534 518 A 89 LEU HA A 90 VAL HGy% 1.0 1.8 6.0 535 519 A 89 LEU HBy A 90 VAL H 1.0 1.8 6.0 536 520 A 80 CYS HA A 91 THR HA 1.0 1.8 6.0 537 521 A 80 CYS HA A 91 THR HG2% 1.0 1.8 6.0 538 522 A 80 CYS HBx A 91 THR HG2% 1.0 1.8 6.0 539 523 A 80 CYS HBy A 91 THR HG2% 1.0 1.8 6.0 540 524 A 81 THR H A 91 THR HG2% 1.0 1.8 6.0 541 525 A 91 THR HA A 82 VAL HA 1.0 1.8 6.0 542 526 A 91 THR HG2% A 82 VAL HA 1.0 1.8 6.0 543 527 A 82 VAL HGy% A 91 THR HG2% 1.0 1.8 6.0 544 528 A 83 HIS H A 91 THR HA 1.0 1.8 6.0 545 529 A 90 VAL HA A 91 THR HA 1.0 1.8 6.0 546 530 A 90 VAL HGx% A 91 THR HA 1.0 1.8 6.0 547 531 A 90 VAL HA A 92 LYS HA 1.0 1.8 6.0 548 532 A 108 VAL HA A 101 GLU HB2 1.0 1.8 6.0 549 532 A 101 GLU HB3 A 108 VAL HA 1.0 1.8 6.0 550 533 A 91 THR HA A 92 LYS HA 1.0 1.8 6.0 551 534 A 91 THR HG2% A 92 LYS HA 1.0 1.8 6.0 552 535 A 91 THR HG2% A 92 LYS H 1.0 1.8 6.0 553 536 A 92 LYS HA A 93 SER H 1.0 1.8 4.5 554 537 A 93 SER H A 92 LYS HBy 1.0 1.8 6.0 555 538 A 94 GLU HA A 92 LYS HBx 1.0 1.8 6.0 556 539 A 119 ILE HB A 12 GLU HGy 1.0 1.8 6.0 557 539 A 12 GLU HGx A 119 ILE HB 1.0 1.8 6.0 558 540 A 93 SER HA A 94 GLU H 1.0 1.8 6.0 559 541 A 93 SER HBy A 95 LYS HG3 1.0 1.8 6.0 560 542 A 95 LYS H A 93 SER HBx 1.0 1.8 6.0 561 543 A 85 ALA HB% A 86 ASN H 1.0 1.8 4.5 562 544 A 95 LYS H A 94 GLU HB2 1.0 1.8 6.0 563 545 A 96 PHE HA A 17 PHE HZ 1.0 1.8 6.0 564 546 A 17 PHE HZ A 96 PHE HBy 1.0 1.8 6.0 565 547 A 78 LEU HDx% A 96 PHE HZ 1.0 1.8 6.0 566 548 A 80 CYS HBx A 96 PHE HZ 1.0 1.8 6.0 567 549 A 80 CYS HBy A 96 PHE HZ 1.0 1.8 6.0 568 550 A 91 THR HG2% A 96 PHE HZ 1.0 1.8 4.5 569 551 A 92 LYS HA A 96 PHE HD1 1.0 1.8 6.0 570 552 A 96 PHE HD2 A 93 SER HBy 1.0 1.8 6.0 571 553 A 97 SER HA A 92 LYS HBx 1.0 1.8 6.0 572 554 A 97 SER HA A 92 LYS HBy 1.0 1.8 6.0 573 554 A 97 SER HA A 92 LYS HBx 1.0 1.8 6.0 574 555 A 97 SER H A 96 PHE HBx 1.0 1.8 6.0 575 556 A 97 SER H A 96 PHE HBy 1.0 1.8 6.0 576 557 A 91 THR HB A 98 HIS HBx 1.0 1.8 6.0 577 558 A 91 THR HG2% A 98 HIS HBx 1.0 1.8 6.0 578 559 A 91 THR HB A 98 HIS HBy 1.0 1.8 6.0 579 560 A 91 THR HG2% A 98 HIS HBy 1.0 1.8 6.0 580 561 A 98 HIS HBx A 96 PHE HE1 1.0 1.8 6.0 581 562 A 96 PHE HD1 A 98 HIS HBy 1.0 1.8 6.0 582 563 A 99 GLU HA A 90 VAL HGy% 1.0 1.8 6.0 583 564 A 90 VAL HGy% A 99 GLU HGy 1.0 1.8 6.0 584 565 A 98 HIS HA A 99 GLU HBy 1.0 1.8 6.0 585 566 A 98 HIS HBy A 99 GLU H 1.0 1.8 6.0 586 567 A 88 LYS HA A 100 GLN HBx 1.0 1.8 6.0 587 568 A 89 LEU HBx A 100 GLN HBx 1.0 1.8 6.0 588 569 A 89 LEU HBy A 100 GLN HBx 1.0 1.8 6.0 589 570 A 89 LEU HDy% A 100 GLN HBx 1.0 1.8 6.0 590 571 A 99 GLU HA A 100 GLN H 1.0 1.8 4.5 591 572 A 101 GLU HA A 2 PHE HZ 1.0 1.8 6.0 592 573 A 2 PHE HA A 102 VAL HGx% 1.0 1.8 6.0 593 574 A 102 VAL HGx% A 2 PHE HD2 1.0 1.8 6.0 594 575 A 2 PHE HA A 102 VAL HGy% 1.0 1.8 6.0 595 576 A 88 LYS HA A 102 VAL H 1.0 1.8 6.0 596 577 A 101 GLU HA A 102 VAL HA 1.0 1.8 4.5 597 578 A 102 VAL HA A 101 GLU HB2 1.0 1.8 6.0 598 579 A 101 GLU HA A 102 VAL HB 1.0 1.8 6.0 599 580 A 101 GLU HA A 102 VAL HGx% 1.0 1.8 6.0 600 581 A 103 LYS HG3 A 101 GLU HGy 1.0 1.8 6.0 601 582 A 102 VAL HGx% A 103 LYS H 1.0 1.8 6.0 602 583 A 102 VAL HA A 104 GLY H 1.0 1.8 6.0 603 584 A 102 VAL HGx% A 104 GLY H 1.0 1.8 6.0 604 585 A 104 GLY H A 103 LYS HA 1.0 1.8 6.0 605 586 A 105 ASN HBx A 6 TRP HH2 1.0 1.8 6.0 606 587 A 6 TRP HH2 A 105 ASN HBy 1.0 1.8 6.0 607 588 A 103 LYS HBx A 105 ASN H 1.0 1.8 6.0 608 589 A 9 TYR HEx A 106 GLU HBx 1.0 1.8 6.0 609 590 A 106 GLU HA A 105 ASN HA 1.0 1.8 6.0 610 591 A 105 ASN H A 106 GLU HGx 1.0 1.8 6.0 611 592 A 105 ASN HA A 106 GLU H 1.0 1.8 6.0 612 593 A 105 ASN HBx A 106 GLU H 1.0 1.8 6.0 613 594 A 105 ASN HBy A 106 GLU H 1.0 1.8 6.0 614 595 A 107 MET HE% A 2 PHE HBy 1.0 1.8 6.0 615 596 A 4 GLY HAy A 107 MET HE% 1.0 1.8 6.0 616 597 A 6 TRP HBy A 107 MET HE% 1.0 1.8 6.0 617 598 A 6 TRP HD1 A 107 MET HE% 1.0 1.8 6.0 618 599 A 6 TRP HE1 A 107 MET HE% 1.0 1.8 6.0 619 600 A 40 ILE HD1% A 107 MET HE% 1.0 1.8 4.5 620 601 A 107 MET HE% A 40 ILE HG12 1.0 1.8 6.0 621 602 A 102 VAL HA A 107 MET HA 1.0 1.8 4.5 622 603 A 102 VAL HB A 107 MET HE% 1.0 1.8 6.0 623 604 A 105 ASN HA A 124 ARG HBx 1.0 1.8 6.0 624 605 A 105 ASN HA A 124 ARG HBy 1.0 1.8 6.0 625 606 A 105 ASN HA A 124 ARG HGy 1.0 1.8 6.0 626 606 A 105 ASN HA A 124 ARG HGx 1.0 1.8 6.0 627 607 A 105 ASN HBx A 124 ARG HBx 1.0 1.8 6.0 628 608 A 105 ASN HBy A 124 ARG HBx 1.0 1.8 6.0 629 609 A 105 ASN HBx A 124 ARG HBy 1.0 1.8 6.0 630 610 A 105 ASN HBy A 124 ARG HBy 1.0 1.8 6.0 631 611 A 106 GLU HA A 107 MET HA 1.0 1.8 6.0 632 612 A 106 GLU HA A 107 MET HBx 1.0 1.8 6.0 633 613 A 106 GLU HA A 107 MET H 1.0 1.8 4.5 634 614 A 107 MET H A 106 GLU HBx 1.0 1.8 6.0 635 615 A 107 MET H A 106 GLU HBy 1.0 1.8 6.0 636 616 A 108 VAL HB A 101 GLU H 1.0 1.8 6.0 637 617 A 107 MET HA A 108 VAL HB 1.0 1.8 4.5 638 618 A 107 MET HA A 108 VAL H 1.0 1.8 4.5 639 619 A 109 GLU HG2 A 100 GLN HBx 1.0 1.8 4.5 640 620 A 11 GLN HA A 120 ARG HG3 1.0 1.8 6.0 641 620 A 11 GLN HA A 120 ARG HG2 1.0 1.8 6.0 642 621 A 107 MET HA A 109 GLU H 1.0 1.8 6.0 643 622 A 110 THR HA A 98 HIS HA 1.0 1.8 6.0 644 623 A 99 GLU H A 110 THR HG2% 1.0 1.8 6.0 645 624 A 111 ILE HG2% A 96 PHE HBx 1.0 1.8 6.0 646 625 A 111 ILE HD1% A 98 HIS HD2 1.0 1.8 4.5 647 626 A 98 HIS HA A 111 ILE HG13 1.0 1.8 6.0 648 627 A 98 HIS HA A 111 ILE HG12 1.0 1.8 6.0 649 628 A 98 HIS HA A 111 ILE HG2% 1.0 1.8 6.0 650 629 A 111 ILE HD1% A 109 GLU HBx 1.0 1.8 6.0 651 630 A 111 ILE HD1% A 109 GLU HG2 1.0 1.8 6.0 652 631 A 110 THR HA A 111 ILE HA 1.0 1.8 6.0 653 632 A 110 THR HA A 111 ILE HD1% 1.0 1.8 6.0 654 633 A 110 THR HA A 111 ILE HG12 1.0 1.8 6.0 655 634 A 110 THR HA A 111 ILE H 1.0 1.8 4.5 656 635 A 110 THR HG2% A 111 ILE H 1.0 1.8 6.0 657 636 A 97 SER H A 112 THR HG2% 1.0 1.8 6.0 658 637 A 97 SER H A 112 THR HB 1.0 1.8 6.0 659 638 A 110 THR HA A 119 ILE HG12 1.0 1.8 6.0 660 638 A 119 ILE HG13 A 110 THR HA 1.0 1.8 6.0 661 639 A 110 THR HB A 119 ILE HG12 1.0 1.8 6.0 662 639 A 119 ILE HG13 A 110 THR HB 1.0 1.8 6.0 663 640 A 111 ILE HA A 112 THR HA 1.0 1.8 6.0 664 641 A 111 ILE HG2% A 112 THR H 1.0 1.8 6.0 665 642 A 17 PHE HE1 A 113 PHE HBy 1.0 1.8 6.0 666 643 A 20 ALA HB% A 21 LEU H 1.0 1.8 6.0 667 644 A 21 LEU HDx% A 113 PHE HD2 1.0 1.8 6.0 668 645 A 96 PHE HA A 113 PHE HA 1.0 1.8 4.5 669 646 A 113 PHE HA A 96 PHE HBx 1.0 1.8 6.0 670 647 A 96 PHE HA A 113 PHE HBx 1.0 1.8 6.0 671 648 A 96 PHE HBx A 113 PHE HBx 1.0 1.8 6.0 672 649 A 96 PHE HBy A 113 PHE HBx 1.0 1.8 6.0 673 650 A 111 ILE HB A 113 PHE HBy 1.0 1.8 6.0 674 651 A 112 THR HB A 113 PHE H 1.0 1.8 6.0 675 652 A 112 THR HG2% A 113 PHE H 1.0 1.8 6.0 676 653 A 20 ALA HA A 114 GLY HA3 1.0 1.8 6.0 677 654 A 20 ALA HB% A 114 GLY HA3 1.0 1.8 6.0 678 655 A 114 GLY HA3 A 21 LEU HA 1.0 1.8 6.0 679 656 A 114 GLY HA3 A 113 PHE HE1 1.0 1.8 6.0 680 657 A 113 PHE HA A 114 GLY HA2 1.0 1.8 6.0 681 658 A 17 PHE HA A 116 VAL HGy% 1.0 1.8 6.0 682 659 A 116 VAL HGy% A 17 PHE HD1 1.0 1.8 6.0 683 660 A 20 ALA HB% A 116 VAL HGx% 1.0 1.8 6.0 684 661 A 20 ALA HA A 116 VAL HGy% 1.0 1.8 6.0 685 662 A 20 ALA HB% A 116 VAL H 1.0 1.8 6.0 686 663 A 112 THR HG2% A 116 VAL H 1.0 1.8 6.0 687 664 A 114 GLY HA3 A 116 VAL HGy% 1.0 1.8 6.0 688 665 A 114 GLY HA3 A 116 VAL H 1.0 1.8 6.0 689 666 A 116 VAL HB A 115 GLY H 1.0 1.8 6.0 690 667 A 110 THR HA A 117 THR HG2% 1.0 1.8 4.5 691 668 A 112 THR HA A 117 THR HA 1.0 1.8 4.5 692 669 A 112 THR HG2% A 117 THR HA 1.0 1.8 6.0 693 670 A 118 LEU HDy% A 11 GLN HB3 1.0 1.8 6.0 694 670 A 118 LEU HDy% A 11 GLN HB2 1.0 1.8 6.0 695 671 A 118 LEU HDx% A 11 GLN HB3 1.0 1.8 4.5 696 671 A 11 GLN HB2 A 118 LEU HDx% 1.0 1.8 4.5 697 672 A 14 TYR HA A 118 LEU HDy% 1.0 1.8 4.5 698 673 A 118 LEU HDy% A 14 TYR HBy 1.0 1.8 6.0 699 674 A 118 LEU HDy% A 14 TYR HBx 1.0 1.8 6.0 700 675 A 17 PHE HBy A 118 LEU HBy 1.0 1.8 6.0 701 676 A 118 LEU HBx A 17 PHE HBy 1.0 1.8 6.0 702 677 A 118 LEU HDx% A 17 PHE HBx 1.0 1.8 6.0 703 678 A 118 LEU HDx% A 17 PHE HBy 1.0 1.8 6.0 704 679 A 17 PHE HD2 A 118 LEU HDx% 1.0 1.8 6.0 705 680 A 111 ILE HB A 118 LEU HBy 1.0 1.8 6.0 706 681 A 111 ILE HB A 118 LEU HBx 1.0 1.8 6.0 707 682 A 111 ILE HD1% A 118 LEU HDx% 1.0 1.8 6.0 708 683 A 119 ILE HG2% A 12 GLU HBy 1.0 1.8 6.0 709 684 A 109 GLU H A 119 ILE HG2% 1.0 1.8 6.0 710 685 A 110 THR HA A 119 ILE HD1% 1.0 1.8 6.0 711 686 A 119 ILE HG13 A 111 ILE H 1.0 1.8 6.0 712 687 A 111 ILE H A 119 ILE HG12 1.0 1.8 6.0 713 688 A 111 ILE H A 119 ILE HG2% 1.0 1.8 6.0 714 689 A 117 THR HG2% A 119 ILE HD1% 1.0 1.8 6.0 715 690 A 119 ILE HG13 A 117 THR HA 1.0 1.8 6.0 716 691 A 119 ILE HB A 118 LEU HA 1.0 1.8 6.0 717 692 A 119 ILE HB A 118 LEU HDx% 1.0 1.8 4.5 718 693 A 118 LEU HA A 119 ILE H 1.0 1.8 4.5 719 694 A 119 ILE H A 118 LEU HBy 1.0 1.8 4.5 720 695 A 118 LEU HDx% A 120 ARG HA 1.0 1.8 4.5 721 696 A 120 ARG HA A 120 ARG HG3 1.0 1.8 6.0 722 697 A 9 TYR HEx A 121 ARG HBx 1.0 1.8 6.0 723 698 A 10 ALA H A 121 ARG HBy 1.0 1.8 6.0 724 699 A 10 ALA HB% A 121 ARG HDx 1.0 1.8 6.0 725 700 A 108 VAL HGx% A 121 ARG HGx 1.0 1.8 6.0 726 701 A 119 ILE HG2% A 121 ARG HGy 1.0 1.8 6.0 727 702 A 120 ARG HA A 121 ARG HBx 1.0 1.8 6.0 728 703 A 6 TRP HBx A 122 SER HBx 1.0 1.8 6.0 729 704 A 6 TRP HE3 A 122 SER HBx 1.0 1.8 6.0 730 705 A 6 TRP HBx A 122 SER HBy 1.0 1.8 6.0 731 706 A 8 VAL HA A 122 SER HBx 1.0 1.8 6.0 732 707 A 9 TYR HBx A 122 SER HA 1.0 1.8 6.0 733 708 A 122 SER HA A 9 TYR HD2 1.0 1.8 6.0 734 709 A 10 ALA H A 122 SER HA 1.0 1.8 6.0 735 710 A 106 GLU HA A 122 SER H 1.0 1.8 6.0 736 711 A 122 SER HBx A 107 MET HBx 1.0 1.8 6.0 737 712 A 107 MET HBx A 122 SER HBy 1.0 1.8 6.0 738 713 A 107 MET HBy A 122 SER HBy 1.0 1.8 6.0 739 714 A 99 GLU HBy A 110 THR HB 1.0 1.8 6.0 740 715 A 122 SER HA A 121 ARG HGx 1.0 1.8 6.0 741 716 A 121 ARG HA A 122 SER HBx 1.0 1.8 6.0 742 717 A 122 SER H A 121 ARG HBx 1.0 1.8 6.0 743 718 A 6 TRP HE3 A 123 LYS HA 1.0 1.8 6.0 744 719 A 123 LYS H A 6 TRP HA 1.0 1.8 6.0 745 720 A 9 TYR HEx A 123 LYS HA 1.0 1.8 6.0 746 721 A 123 LYS HB2 A 9 TYR HD2 1.0 1.8 6.0 747 722 A 123 LYS HB2 A 9 TYR HEx 1.0 1.8 6.0 748 723 A 9 TYR HD2 A 123 LYS HD2 1.0 1.8 6.0 749 724 A 9 TYR HD2 A 123 LYS HGx 1.0 1.8 6.0 750 725 A 106 GLU HA A 123 LYS HA 1.0 1.8 4.5 751 726 A 123 LYS HA A 106 GLU HBx 1.0 1.8 6.0 752 727 A 123 LYS HB2 A 106 GLU HA 1.0 1.8 6.0 753 728 A 107 MET H A 123 LYS HA 1.0 1.8 6.0 754 729 A 123 LYS HB2 A 122 SER HA 1.0 1.8 6.0 755 730 A 123 LYS H A 122 SER HBx 1.0 1.8 6.0 756 731 A 123 LYS H A 122 SER HBy 1.0 1.8 6.0 757 732 A 6 TRP HA A 124 ARG HA 1.0 1.8 4.5 758 733 A 6 TRP HA A 124 ARG HBx 1.0 1.8 6.0 759 734 A 6 TRP HE3 A 124 ARG HBx 1.0 1.8 6.0 760 735 A 6 TRP HE3 A 124 ARG HBy 1.0 1.8 6.0 761 736 A 124 ARG HDy A 6 TRP HZ3 1.0 1.8 6.0 762 737 A 6 TRP HZ3 A 124 ARG HDx 1.0 1.8 6.0 763 738 A 124 ARG HGx A 6 TRP HE3 1.0 1.8 6.0 764 739 A 123 LYS HA A 124 ARG HBx 1.0 1.8 6.0 765 740 A 5 THR HG2% A 125 VAL HB 1.0 1.8 6.0 766 741 A 5 THR HG2% A 125 VAL HGy% 1.0 1.8 4.5 767 742 A 6 TRP HA A 125 VAL HGx% 1.0 1.8 6.0 768 743 A 6 TRP HA A 125 VAL HGy% 1.0 1.8 6.0 769 744 A 125 VAL HGx% A 37 ILE HG12 1.0 1.8 6.0 770 745 A 123 LYS HB2 A 124 ARG H 1.0 1.8 6.0 771 746 A 124 ARG HA A 125 VAL HGx% 1.0 1.8 6.0 772 747 A 124 ARG HDy A 125 VAL H 1.0 1.8 6.0 773 748 A 124 ARG HDx A 125 VAL H 1.0 1.8 6.0 774 749 A 125 VAL H A 124 ARG HGy 1.0 1.8 6.0 775 750 A 124 ARG HGx A 125 VAL H 1.0 1.8 6.0 776 751 A 20 ALA HA A 22 ALA H 1.0 1.8 4.5 777 752 A 21 LEU H A 22 ALA HA 1.0 1.8 6.0 778 753 A 21 LEU H A 22 ALA HB% 1.0 1.8 6.0 779 754 A 22 ALA HB% A 23 LEU HA 1.0 1.8 6.0 780 755 A 22 ALA HB% A 21 LEU HA 1.0 1.8 6.0 781 756 A 31 ALA HA A 34 ILE HD1% 1.0 1.8 4.5 782 757 A 31 ALA HA A 34 ILE HG12 1.0 1.8 4.5 783 757 A 31 ALA HA A 34 ILE HG13 1.0 1.8 4.5 784 758 A 31 ALA HA A 34 ILE HB 1.0 1.8 4.5 785 759 A 31 ALA HA A 34 ILE H 1.0 1.8 6.0 786 760 A 4 GLY HAy A 6 TRP HZ2 1.0 1.8 6.0 787 761 A 44 GLY HAy A 46 ASP H 1.0 1.8 4.5 788 762 A 44 GLY HAx A 46 ASP H 1.0 1.8 4.5 789 763 A 44 GLY HAy A 43 LYS HBx 1.0 1.8 6.0 790 764 A 81 THR HG2% A 65 GLY HAx 1.0 1.8 4.5 791 765 A 65 GLY HAy A 64 LEU HBx 1.0 1.8 6.0 792 765 A 65 GLY HAy A 64 LEU HBy 1.0 1.8 6.0 793 766 A 65 GLY HAx A 64 LEU HBx 1.0 1.8 6.0 794 766 A 65 GLY HAx A 64 LEU HBy 1.0 1.8 6.0 795 767 A 87 GLY HAy A 84 LEU HBx 1.0 1.8 6.0 796 767 A 87 GLY HAy A 84 LEU HBy 1.0 1.8 6.0 797 768 A 87 GLY HAx A 84 LEU HBx 1.0 1.8 6.0 798 768 A 87 GLY HAx A 84 LEU HBy 1.0 1.8 6.0 799 769 A 84 LEU HDy% A 87 GLY HAy 1.0 1.8 6.0 800 770 A 84 LEU HDy% A 87 GLY HAx 1.0 1.8 6.0 801 771 A 75 GLY HAy A 76 LYS HGy 1.0 1.8 6.0 802 771 A 75 GLY HAy A 76 LYS HGx 1.0 1.8 6.0 803 772 A 75 GLY HAx A 76 LYS HGy 1.0 1.8 6.0 804 772 A 76 LYS HGx A 75 GLY HAx 1.0 1.8 6.0 805 773 A 76 LYS H A 75 GLY HAy 1.0 1.8 4.5 806 774 A 74 ASP H A 75 GLY HAy 1.0 1.8 6.0 807 775 A 74 ASP H A 75 GLY HAx 1.0 1.8 6.0 808 776 A 105 ASN H A 104 GLY HAy 1.0 1.8 4.5 809 777 A 105 ASN H A 104 GLY HAx 1.0 1.8 4.5 810 778 A 106 GLU H A 104 GLY HAy 1.0 1.8 6.0 811 779 A 106 GLU H A 104 GLY HAx 1.0 1.8 6.0 812 780 A 105 ASN HA A 104 GLY HAy 1.0 1.8 6.0 813 781 A 105 ASN HA A 104 GLY HAx 1.0 1.8 6.0 814 782 A 103 LYS HA A 104 GLY HAy 1.0 1.8 6.0 815 783 A 103 LYS HA A 104 GLY HAx 1.0 1.8 6.0 816 784 A 114 GLY HA2 A 115 GLY HAx 1.0 1.8 6.0 817 785 A 113 PHE HD1 A 114 GLY HA3 1.0 1.8 4.5 818 786 A 14 TYR H A 13 ASN HBy 1.0 1.8 4.5 819 787 A 14 TYR H A 13 ASN HBx 1.0 1.8 4.5 820 788 A 118 LEU HA A 13 ASN HBy 1.0 1.8 4.5 821 789 A 118 LEU HA A 13 ASN HBx 1.0 1.8 4.5 822 790 A 13 ASN HBy A 16 GLU HBx 1.0 1.8 4.5 823 791 A 13 ASN HBx A 16 GLU HBx 1.0 1.8 4.5 824 792 A 118 LEU HBx A 13 ASN HBy 1.0 1.8 6.0 825 792 A 13 ASN HBy A 118 LEU HBy 1.0 1.8 6.0 826 793 A 118 LEU HBx A 13 ASN HBx 1.0 1.8 6.0 827 793 A 13 ASN HBx A 118 LEU HBy 1.0 1.8 6.0 828 794 A 116 VAL HGx% A 13 ASN HBy 1.0 1.8 6.0 829 795 A 116 VAL HGx% A 13 ASN HBx 1.0 1.8 6.0 830 796 A 27 LEU HA A 31 ALA H 1.0 1.8 6.0 831 797 A 27 LEU H A 26 ASP HBy 1.0 1.8 4.5 832 798 A 27 LEU H A 26 ASP HBx 1.0 1.8 4.5 833 799 A 28 ILE H A 26 ASP HBy 1.0 1.8 6.0 834 800 A 26 ASP HBx A 28 ILE H 1.0 1.8 6.0 835 801 A 26 ASP HBy A 24 PRO HBy 1.0 1.8 6.0 836 801 A 26 ASP HBy A 24 PRO HBx 1.0 1.8 6.0 837 802 A 26 ASP HBx A 24 PRO HBy 1.0 1.8 6.0 838 802 A 26 ASP HBx A 24 PRO HBx 1.0 1.8 6.0 839 803 A 26 ASP HBy A 25 GLU HB2 1.0 1.8 6.0 840 803 A 26 ASP HBy A 25 GLU HB3 1.0 1.8 6.0 841 804 A 26 ASP HBx A 25 GLU HB2 1.0 1.8 6.0 842 804 A 26 ASP HBx A 25 GLU HB3 1.0 1.8 6.0 843 805 A 43 LYS H A 46 ASP HBy 1.0 1.8 6.0 844 806 A 43 LYS H A 46 ASP HBx 1.0 1.8 6.0 845 807 A 47 PHE H A 46 ASP HBy 1.0 1.8 6.0 846 808 A 47 PHE H A 46 ASP HBx 1.0 1.8 6.0 847 809 A 63 THR HG2% A 45 ASP HBy 1.0 1.8 4.5 848 810 A 63 THR HG2% A 45 ASP HBx 1.0 1.8 4.5 849 811 A 64 LEU H A 45 ASP HBy 1.0 1.8 4.5 850 812 A 64 LEU H A 45 ASP HBx 1.0 1.8 4.5 851 813 A 33 ASP HBy A 32 ARG HGy 1.0 1.8 4.5 852 813 A 33 ASP HBy A 32 ARG HGx 1.0 1.8 4.5 853 814 A 33 ASP HBx A 32 ARG HGy 1.0 1.8 4.5 854 814 A 32 ARG HGx A 33 ASP HBx 1.0 1.8 4.5 855 815 A 69 ASP HA A 70 ILE HG12 1.0 1.8 4.5 856 815 A 69 ASP HA A 70 ILE HG13 1.0 1.8 4.5 857 816 A 70 ILE HD1% A 69 ASP HA 1.0 1.8 6.0 858 817 A 69 ASP HA A 79 LYS HA 1.0 1.8 3.3 859 818 A 69 ASP HA A 80 CYS H 1.0 1.8 6.0 860 819 A 8 VAL HGx% A 35 LYS HA 1.0 1.8 4.5 861 820 A 23 LEU HB3 A 74 ASP HBx 1.0 1.8 6.0 862 820 A 23 LEU HB2 A 74 ASP HBx 1.0 1.8 6.0 863 821 A 23 LEU HB2 A 74 ASP HBy 1.0 1.8 6.0 864 821 A 74 ASP HBy A 23 LEU HB3 1.0 1.8 6.0 865 822 A 76 LYS HGx A 74 ASP HBx 1.0 1.8 6.0 866 822 A 74 ASP HBx A 76 LYS HGy 1.0 1.8 6.0 867 823 A 76 LYS HGx A 74 ASP HBy 1.0 1.8 6.0 868 823 A 74 ASP HBy A 76 LYS HGy 1.0 1.8 6.0 869 824 A 27 LEU HDy% A 74 ASP HBx 1.0 1.8 4.5 870 825 A 27 LEU HDy% A 74 ASP HBy 1.0 1.8 4.5 871 826 A 23 LEU HDy% A 74 ASP HBx 1.0 1.8 6.0 872 827 A 88 LYS H A 86 ASN HBx 1.0 1.8 6.0 873 828 A 88 LYS H A 86 ASN HBy 1.0 1.8 6.0 874 829 A 87 GLY H A 86 ASN HBx 1.0 1.8 6.0 875 830 A 87 GLY H A 86 ASN HBy 1.0 1.8 6.0 876 831 A 99 GLU H A 111 ILE HA 1.0 1.8 4.5 877 832 A 12 GLU HA A 13 ASN H 1.0 1.8 3.3 878 833 A 12 GLU HA A 14 TYR H 1.0 1.8 4.5 879 834 A 17 PHE H A 16 GLU HA 1.0 1.8 6.0 880 835 A 19 LYS HD2 A 16 GLU HA 1.0 1.8 4.5 881 836 A 25 GLU HA A 28 ILE HG12 1.0 1.8 6.0 882 836 A 25 GLU HA A 28 ILE HG13 1.0 1.8 6.0 883 837 A 25 GLU HA A 28 ILE HB 1.0 1.8 3.3 884 838 A 25 GLU HA A 24 PRO HA 1.0 1.8 6.0 885 839 A 37 ILE HA A 7 GLN HBx 1.0 1.8 6.0 886 840 A 38 VAL H A 37 ILE HA 1.0 1.8 3.3 887 841 A 48 VAL HA A 61 SER HB2 1.0 1.8 6.0 888 841 A 48 VAL HA A 61 SER HB3 1.0 1.8 6.0 889 842 A 61 SER HA A 48 VAL HA 1.0 1.8 3.3 890 843 A 48 VAL HA A 62 PHE H 1.0 1.8 6.0 891 844 A 67 GLU HA A 80 CYS H 1.0 1.8 4.5 892 845 A 67 GLU HA A 79 LYS HBy 1.0 1.8 4.5 893 845 A 67 GLU HA A 79 LYS HBx 1.0 1.8 4.5 894 846 A 67 GLU HA A 81 THR HG2% 1.0 1.8 6.0 895 847 A 108 VAL HA A 121 ARG HA 1.0 1.8 4.5 896 848 A 111 ILE H A 119 ILE HA 1.0 1.8 4.5 897 849 A 119 ILE HA A 118 LEU HG 1.0 1.8 6.0 898 850 A 108 VAL HGx% A 119 ILE HA 1.0 1.8 4.5 899 851 A 109 GLU H A 119 ILE HA 1.0 1.8 4.5 900 852 A 125 VAL HGx% A 7 GLN HBx 1.0 1.8 4.5 901 853 A 125 VAL HGy% A 7 GLN HBx 1.0 1.8 4.5 902 854 A 50 THR HB A 39 GLU HBy 1.0 3.3 6.0 903 855 A 49 VAL HA A 39 GLU HBx 1.0 1.8 6.0 904 856 A 49 VAL HA A 39 GLU HBy 1.0 1.8 6.0 905 857 A 7 GLN HGy A 37 ILE HG12 1.0 1.8 6.0 906 857 A 7 GLN HGx A 37 ILE HG12 1.0 1.8 6.0 907 857 A 37 ILE HG13 A 7 GLN HGx 1.0 1.8 6.0 908 857 A 7 GLN HGy A 37 ILE HG13 1.0 1.8 6.0 909 858 A 7 GLN HGx A 35 LYS HBy 1.0 1.8 6.0 910 858 A 7 GLN HGy A 35 LYS HBy 1.0 1.8 6.0 911 858 A 35 LYS HBx A 7 GLN HGx 1.0 1.8 6.0 912 858 A 7 GLN HGy A 35 LYS HBx 1.0 1.8 6.0 913 859 A 50 THR HG2% A 52 LYS HBy 1.0 1.8 6.0 914 859 A 50 THR HG2% A 52 LYS HBx 1.0 1.8 6.0 915 860 A 12 GLU HA A 118 LEU HDx% 1.0 1.8 6.0 916 861 A 41 GLN HA A 3 SER HB2 1.0 1.8 4.5 917 861 A 41 GLN HA A 3 SER HB3 1.0 1.8 4.5 918 862 A 4 GLY H A 41 GLN HA 1.0 1.8 4.5 919 863 A 41 GLN HBx A 48 VAL H 1.0 1.8 4.5 920 864 A 41 GLN HBy A 48 VAL H 1.0 1.8 6.0 921 865 A 119 ILE H A 12 GLU HBy 1.0 1.8 4.5 922 866 A 119 ILE H A 12 GLU HBx 1.0 1.8 6.0 923 867 A 119 ILE HB A 12 GLU HBy 1.0 1.8 4.5 924 868 A 119 ILE HB A 12 GLU HBx 1.0 1.8 4.5 925 869 A 20 ALA HB% A 116 VAL HB 1.0 1.8 4.5 926 870 A 17 PHE HA A 116 VAL HB 1.0 1.8 4.5 927 871 A 17 PHE HD1 A 116 VAL HB 1.0 1.8 4.5 928 872 A 113 PHE H A 116 VAL HB 1.0 1.8 4.5 929 873 A 116 VAL HB A 117 THR H 1.0 1.8 4.5 930 874 A 34 ILE HG2% A 54 PRO HGx 1.0 1.8 6.0 931 875 A 13 ASN HA A 16 GLU HBx 1.0 1.8 4.5 932 875 A 13 ASN HA A 16 GLU HBy 1.0 1.8 4.5 933 876 A 27 LEU H A 25 GLU HB2 1.0 1.8 6.0 934 876 A 27 LEU H A 25 GLU HB3 1.0 1.8 6.0 935 877 A 50 THR H A 39 GLU HBx 1.0 1.8 4.5 936 878 A 50 THR H A 39 GLU HBy 1.0 1.8 6.0 937 879 A 50 THR HG2% A 39 GLU HBx 1.0 1.8 6.0 938 880 A 50 THR HG2% A 39 GLU HBy 1.0 1.8 6.0 939 881 A 7 GLN HBy A 37 ILE HG12 1.0 1.8 6.0 940 881 A 7 GLN HBx A 37 ILE HG12 1.0 1.8 6.0 941 881 A 37 ILE HG13 A 7 GLN HBy 1.0 1.8 6.0 942 881 A 37 ILE HG13 A 7 GLN HBx 1.0 1.8 6.0 943 882 A 40 ILE HA A 39 GLU HGx 1.0 1.8 4.5 944 882 A 40 ILE HA A 39 GLU HGy 1.0 1.8 4.5 945 883 A 5 THR HG2% A 39 GLU HGx 1.0 1.8 6.0 946 883 A 5 THR HG2% A 39 GLU HGy 1.0 1.8 6.0 947 884 A 99 GLU HA A 90 VAL HA 1.0 1.8 3.3 948 885 A 89 LEU HA A 90 VAL HA 1.0 1.8 6.0 949 886 A 70 ILE HG2% A 72 THR HA 1.0 1.8 6.0 950 887 A 27 LEU HDx% A 31 ALA HB% 1.0 1.8 6.0 951 888 A 31 ALA HB% A 34 ILE HD1% 1.0 1.8 6.0 952 889 A 36 PRO HDx A 34 ILE HB 1.0 1.8 4.5 953 890 A 36 PRO HDx A 35 LYS HG3 1.0 1.8 4.5 954 891 A 8 VAL HGy% A 36 PRO HBy 1.0 1.8 4.5 955 892 A 34 ILE HG2% A 36 PRO HBx 1.0 1.8 6.0 956 893 A 73 MET HE% A 53 THR HB 1.0 1.8 6.0 957 894 A 73 MET HE% A 58 VAL HB 1.0 1.8 6.0 958 895 A 73 MET HE% A 58 VAL HGy% 1.0 1.8 4.5 959 896 A 10 ALA HB% A 11 GLN HA 1.0 1.8 6.0 960 897 A 14 TYR HE1 A 118 LEU HDy% 1.0 1.8 4.5 961 898 A 9 TYR HEy A 121 ARG HDx 1.0 1.8 4.5 962 898 A 9 TYR HEy A 121 ARG HDy 1.0 1.8 4.5 963 898 A 9 TYR HEx A 121 ARG HDx 1.0 1.8 4.5 964 898 A 9 TYR HEx A 121 ARG HDy 1.0 1.8 4.5 965 899 A 17 PHE HE2 A 111 ILE HG2% 1.0 1.8 4.5 966 900 A 112 THR HA A 17 PHE HE1 1.0 1.8 6.0 967 901 A 47 PHE HD2 A 49 VAL HGy% 1.0 1.8 4.5 968 902 A 89 LEU HDy% A 47 PHE HZ 1.0 1.8 6.0 969 903 A 89 LEU HDx% A 47 PHE HZ 1.0 1.8 6.0 970 904 A 64 LEU HA A 62 PHE HD2 1.0 1.8 6.0 971 905 A 64 LEU HDy% A 62 PHE HE2 1.0 1.8 6.0 972 906 A 70 ILE HB A 78 LEU HDy% 1.0 1.8 4.5 973 907 A 79 LYS H A 78 LEU HDy% 1.0 1.8 4.5 974 908 A 118 LEU HDx% A 14 TYR HBy 1.0 1.8 6.0 975 909 A 118 LEU HDx% A 14 TYR HBx 1.0 1.8 4.5 976 910 A 14 TYR HE1 A 118 LEU HDx% 1.0 1.8 6.0 977 911 A 12 GLU H A 118 LEU HDx% 1.0 1.8 6.0 978 912 A 6 TRP HA A 122 SER HBy 1.0 1.8 6.0 979 912 A 6 TRP HA A 122 SER HBx 1.0 1.8 6.0 980 913 A 8 VAL HA A 122 SER HA 1.0 1.8 6.0 981 914 A 9 TYR H A 8 VAL HA 1.0 1.8 6.0 982 915 A 111 ILE HB A 118 LEU HDy% 1.0 1.8 6.0 983 916 A 47 PHE HEy A 84 LEU HDx% 1.0 1.8 6.0 984 917 A 40 ILE HD1% A 2 PHE HD1 1.0 1.8 6.0 985 918 A 8 VAL HGx% A 120 ARG HG3 1.0 1.8 6.0 986 919 A 8 VAL HGy% A 120 ARG HG2 1.0 1.8 6.0 987 920 A 8 VAL HGx% A 11 GLN HB3 1.0 1.8 4.5 988 921 A 8 VAL HGy% A 36 PRO HBx 1.0 1.8 6.0 989 921 A 8 VAL HGy% A 36 PRO HBy 1.0 1.8 6.0 990 922 A 8 VAL HGx% A 36 PRO HDx 1.0 1.8 6.0 991 923 A 8 VAL HGx% A 36 PRO HDy 1.0 1.8 6.0 992 924 A 8 VAL HGy% A 36 PRO HDx 1.0 1.8 6.0 993 925 A 11 GLN HA A 120 ARG HA 1.0 1.8 4.5 994 926 A 108 VAL HA A 109 GLU HG3 1.0 1.8 4.5 995 926 A 108 VAL HA A 109 GLU HG2 1.0 1.8 4.5 996 927 A 107 MET HBx A 109 GLU HG3 1.0 1.8 4.5 997 927 A 107 MET HBy A 109 GLU HG3 1.0 1.8 4.5 998 927 A 109 GLU HG2 A 107 MET HBx 1.0 1.8 4.5 999 927 A 109 GLU HG2 A 107 MET HBy 1.0 1.8 4.5 1000 928 A 89 LEU HDy% A 62 PHE HZ 1.0 1.8 6.0 1001 929 A 83 HIS H A 89 LEU HDx% 1.0 1.8 6.0 1002 930 A 84 LEU HA A 89 LEU HDx% 1.0 1.8 6.0 1003 931 A 21 LEU HDy% A 23 LEU HDx% 1.0 1.8 6.0 1004 932 A 23 LEU HDx% A 21 LEU HG 1.0 1.8 6.0 1005 933 A 23 LEU HDx% A 24 PRO HDy 1.0 1.8 6.0 1006 934 A 23 LEU HDy% A 74 ASP HBx 1.0 1.8 6.0 1007 934 A 23 LEU HDy% A 74 ASP HBy 1.0 1.8 6.0 1008 935 A 84 LEU HDy% A 47 PHE HZ 1.0 1.8 4.5 1009 936 A 64 LEU HDx% A 45 ASP HBy 1.0 1.8 6.0 1010 936 A 64 LEU HDx% A 45 ASP HBx 1.0 1.8 6.0 1011 937 A 58 VAL HGy% A 73 MET HA 1.0 1.8 3.3 1012 938 A 45 ASP HA A 64 LEU H 1.0 1.8 6.0 1013 939 A 2 PHE HA A 6 TRP HZ2 1.0 1.8 4.5 1014 940 A 6 TRP HZ2 A 2 PHE HBy 1.0 1.8 6.0 1015 941 A 6 TRP HD1 A 5 THR HA 1.0 1.8 4.5 1016 942 A 6 TRP HBx A 6 TRP HD1 1.0 1.8 4.5 1017 943 A 6 TRP HE1 A 6 TRP HD1 1.0 1.8 3.3 1018 944 A 6 TRP HA A 6 TRP HE3 1.0 1.8 4.5 1019 945 A 6 TRP HBx A 6 TRP HE3 1.0 1.8 4.5 1020 946 A 6 TRP HE1 A 6 TRP HH2 1.0 1.8 6.0 1021 947 A 6 TRP HD1 A 6 TRP H 1.0 1.8 3.3 1022 948 A 6 TRP HE1 A 6 TRP HZ2 1.0 1.8 4.5 1023 949 A 6 TRP HH2 A 6 TRP HZ2 1.0 1.8 3.3 1024 950 A 6 TRP HZ3 A 6 TRP HZ2 1.0 1.8 6.0 1025 951 A 7 GLN H A 6 TRP HE3 1.0 1.8 6.0 1026 952 A 9 TYR HEx A 8 VAL HA 1.0 1.8 6.0 1027 953 A 9 TYR H A 9 TYR HEx 1.0 1.8 6.0 1028 954 A 9 TYR HD1 A 10 ALA HB% 1.0 1.8 4.5 1029 955 A 11 GLN HB2 A 14 TYR HD1 1.0 1.8 4.5 1030 956 A 14 TYR H A 14 TYR HD1 1.0 1.8 4.5 1031 956 A 14 TYR H A 14 TYR HD2 1.0 1.8 4.5 1032 957 A 18 LEU HDx% A 14 TYR HE2 1.0 1.8 4.5 1033 958 A 18 LEU HDy% A 17 PHE HD2 1.0 1.8 6.0 1034 959 A 18 LEU HG A 17 PHE HD2 1.0 1.8 4.5 1035 960 A 21 LEU HDx% A 17 PHE HZ 1.0 1.8 6.0 1036 961 A 31 ALA HB% A 14 TYR HE2 1.0 1.8 4.5 1037 962 A 14 TYR HD2 A 32 ARG HA 1.0 1.8 4.5 1038 963 A 32 ARG HA A 14 TYR HE2 1.0 1.8 3.3 1039 964 A 14 TYR HD2 A 32 ARG HBx 1.0 1.8 6.0 1040 965 A 34 ILE HB A 14 TYR HE2 1.0 1.8 6.0 1041 966 A 6 TRP HD1 A 39 GLU HA 1.0 1.8 4.5 1042 967 A 6 TRP HD1 A 40 ILE HB 1.0 1.8 4.5 1043 968 A 6 TRP HD1 A 40 ILE HD1% 1.0 1.8 4.5 1044 969 A 6 TRP HD1 A 40 ILE HG13 1.0 1.8 4.5 1045 970 A 47 PHE HEx A 2 PHE HBy 1.0 1.8 6.0 1046 971 A 47 PHE HEx A 2 PHE HBx 1.0 1.8 6.0 1047 972 A 40 ILE HG2% A 47 PHE HEx 1.0 1.8 6.0 1048 973 A 42 GLN HA A 47 PHE HD1 1.0 1.8 6.0 1049 973 A 42 GLN HA A 47 PHE HD2 1.0 1.8 6.0 1050 974 A 47 PHE HEx A 42 GLN HBx 1.0 1.8 6.0 1051 975 A 47 PHE HD1 A 46 ASP HA 1.0 1.8 6.0 1052 976 A 47 PHE HD1 A 47 PHE H 1.0 1.8 4.5 1053 976 A 47 PHE HD2 A 47 PHE H 1.0 1.8 4.5 1054 977 A 47 PHE HD2 A 48 VAL H 1.0 1.8 6.0 1055 978 A 62 PHE HD2 A 47 PHE HBx 1.0 1.8 4.5 1056 979 A 62 PHE HE2 A 47 PHE HBx 1.0 1.8 4.5 1057 980 A 47 PHE HEy A 62 PHE HE2 1.0 1.8 6.0 1058 980 A 47 PHE HEx A 62 PHE HE2 1.0 1.8 6.0 1059 981 A 62 PHE HZ A 47 PHE HBy 1.0 1.8 6.0 1060 982 A 62 PHE HZ A 47 PHE HBx 1.0 1.8 6.0 1061 983 A 49 VAL HGy% A 62 PHE HE1 1.0 1.8 4.5 1062 984 A 49 VAL HGy% A 62 PHE HZ 1.0 1.8 6.0 1063 985 A 61 SER HA A 62 PHE HD1 1.0 1.8 4.5 1064 986 A 62 PHE HD1 A 62 PHE H 1.0 1.8 6.0 1065 986 A 62 PHE H A 62 PHE HD2 1.0 1.8 6.0 1066 987 A 47 PHE HD1 A 63 THR HA 1.0 1.8 6.0 1067 988 A 47 PHE HEy A 64 LEU HDx% 1.0 1.8 6.0 1068 989 A 64 LEU HG A 47 PHE HEy 1.0 1.8 4.5 1069 990 A 47 PHE HEy A 64 LEU H 1.0 1.8 6.0 1070 991 A 70 ILE HD1% A 62 PHE HE1 1.0 1.8 6.0 1071 992 A 62 PHE HD1 A 82 VAL HB 1.0 1.8 4.5 1072 992 A 62 PHE HD2 A 82 VAL HB 1.0 1.8 4.5 1073 993 A 82 VAL HB A 62 PHE HE1 1.0 1.8 4.5 1074 993 A 82 VAL HB A 62 PHE HE2 1.0 1.8 4.5 1075 994 A 62 PHE HD2 A 82 VAL HGx% 1.0 1.8 6.0 1076 994 A 62 PHE HD1 A 82 VAL HGx% 1.0 1.8 6.0 1077 995 A 82 VAL HGx% A 62 PHE HE1 1.0 1.8 6.0 1078 995 A 82 VAL HGx% A 62 PHE HE2 1.0 1.8 6.0 1079 996 A 82 VAL HGx% A 62 PHE HZ 1.0 1.8 6.0 1080 997 A 81 THR HB A 83 HIS HE1 1.0 1.8 6.0 1081 998 A 82 VAL HA A 83 HIS HE1 1.0 1.8 6.0 1082 999 A 83 HIS HD2 A 83 HIS HBy 1.0 1.8 4.5 1083 1000 A 83 HIS HD2 A 83 HIS HBx 1.0 1.8 4.5 1084 1001 A 83 HIS HE1 A 83 HIS HBx 1.0 1.8 6.0 1085 1002 A 83 HIS H A 83 HIS HD2 1.0 1.8 6.0 1086 1003 A 84 LEU HDx% A 2 PHE HE1 1.0 1.8 6.0 1087 1003 A 84 LEU HDx% A 2 PHE HE2 1.0 1.8 6.0 1088 1004 A 84 LEU HDy% A 2 PHE HE1 1.0 1.8 6.0 1089 1004 A 84 LEU HDy% A 2 PHE HE2 1.0 1.8 6.0 1090 1005 A 85 ALA HA A 83 HIS HD2 1.0 1.8 4.5 1091 1006 A 85 ALA HB% A 83 HIS HD2 1.0 1.8 6.0 1092 1007 A 88 LYS HA A 2 PHE HE1 1.0 1.8 4.5 1093 1007 A 88 LYS HA A 2 PHE HE2 1.0 1.8 4.5 1094 1008 A 88 LYS HA A 2 PHE HZ 1.0 1.8 3.3 1095 1009 A 89 LEU HBy A 2 PHE HZ 1.0 1.8 4.5 1096 1010 A 89 LEU HBx A 2 PHE HZ 1.0 1.8 6.0 1097 1011 A 89 LEU HDy% A 2 PHE HD1 1.0 1.8 6.0 1098 1011 A 89 LEU HDy% A 2 PHE HD2 1.0 1.8 6.0 1099 1012 A 89 LEU H A 2 PHE HZ 1.0 1.8 6.0 1100 1013 A 47 PHE HEy A 89 LEU HDx% 1.0 1.8 6.0 1101 1013 A 47 PHE HEx A 89 LEU HDx% 1.0 1.8 6.0 1102 1014 A 89 LEU HDx% A 62 PHE HE2 1.0 1.8 4.5 1103 1015 A 62 PHE HD2 A 89 LEU HDy% 1.0 1.8 6.0 1104 1016 A 89 LEU HDy% A 62 PHE HE2 1.0 1.8 6.0 1105 1017 A 90 VAL HGy% A 83 HIS HD2 1.0 1.8 6.0 1106 1018 A 96 PHE HD2 A 95 LYS HBx 1.0 1.8 4.5 1107 1019 A 96 PHE HA A 96 PHE HD1 1.0 1.8 4.5 1108 1019 A 96 PHE HA A 96 PHE HD2 1.0 1.8 4.5 1109 1020 A 96 PHE HD1 A 96 PHE HBy 1.0 1.8 3.3 1110 1020 A 96 PHE HD2 A 96 PHE HBy 1.0 1.8 3.3 1111 1021 A 96 PHE HD1 A 96 PHE HBx 1.0 1.8 3.3 1112 1021 A 96 PHE HD2 A 96 PHE HBx 1.0 1.8 3.3 1113 1022 A 96 PHE HD1 A 97 SER HA 1.0 1.8 4.5 1114 1023 A 96 PHE HD1 A 97 SER H 1.0 1.8 4.5 1115 1024 A 96 PHE HD1 A 98 HIS H 1.0 1.8 6.0 1116 1025 A 98 HIS HA A 98 HIS HD2 1.0 1.8 4.5 1117 1026 A 98 HIS HBx A 98 HIS HD2 1.0 1.8 4.5 1118 1027 A 98 HIS HBy A 98 HIS HD2 1.0 1.8 4.5 1119 1028 A 2 PHE HD1 A 100 GLN HBx 1.0 1.8 6.0 1120 1029 A 2 PHE HE1 A 100 GLN HBy 1.0 1.8 6.0 1121 1030 A 98 HIS HD2 A 100 GLN HBy 1.0 1.8 6.0 1122 1031 A 100 GLN H A 98 HIS HE1 1.0 1.8 6.0 1123 1032 A 102 VAL HB A 2 PHE HD1 1.0 1.8 4.5 1124 1033 A 102 VAL HB A 2 PHE HE1 1.0 1.8 4.5 1125 1034 A 102 VAL HGx% A 2 PHE HD1 1.0 1.8 6.0 1126 1035 A 102 VAL HB A 6 TRP HZ2 1.0 1.8 6.0 1127 1036 A 102 VAL HGy% A 6 TRP HH2 1.0 1.8 4.5 1128 1037 A 102 VAL HGy% A 6 TRP HZ2 1.0 1.8 4.5 1129 1038 A 103 LYS H A 6 TRP HH2 1.0 1.8 6.0 1130 1039 A 6 TRP HH2 A 105 ASN HA 1.0 1.8 6.0 1131 1040 A 105 ASN HA A 6 TRP HZ3 1.0 1.8 6.0 1132 1041 A 106 GLU HA A 6 TRP HE3 1.0 1.8 6.0 1133 1042 A 106 GLU HA A 6 TRP HZ3 1.0 1.8 4.5 1134 1043 A 6 TRP HZ3 A 106 GLU HBx 1.0 1.8 6.0 1135 1044 A 6 TRP HH2 A 106 GLU H 1.0 1.8 6.0 1136 1045 A 9 TYR HEy A 106 GLU HBx 1.0 1.8 6.0 1137 1045 A 9 TYR HEx A 106 GLU HBx 1.0 1.8 6.0 1138 1046 A 9 TYR HEx A 106 GLU HGx 1.0 1.8 4.5 1139 1047 A 107 MET HE% A 2 PHE HD1 1.0 1.8 6.0 1140 1048 A 6 TRP HE3 A 107 MET HBx 1.0 1.8 4.5 1141 1049 A 6 TRP HZ3 A 107 MET HBy 1.0 1.8 4.5 1142 1050 A 6 TRP HE3 A 107 MET HG2 1.0 1.8 4.5 1143 1051 A 109 GLU HA A 98 HIS HE1 1.0 1.8 6.0 1144 1052 A 98 HIS HE1 A 109 GLU HBy 1.0 1.8 6.0 1145 1053 A 109 GLU HG2 A 98 HIS HE1 1.0 1.8 3.3 1146 1054 A 98 HIS HE1 A 100 GLN HBx 1.0 1.8 3.3 1147 1054 A 98 HIS HE1 A 100 GLN HBy 1.0 1.8 3.3 1148 1055 A 17 PHE HZ A 111 ILE HB 1.0 1.8 4.5 1149 1056 A 17 PHE HZ A 111 ILE HG2% 1.0 1.8 4.5 1150 1057 A 98 HIS HE1 A 111 ILE HG12 1.0 1.8 6.0 1151 1058 A 17 PHE HZ A 112 THR HA 1.0 1.8 6.0 1152 1059 A 17 PHE HZ A 113 PHE HBx 1.0 1.8 4.5 1153 1060 A 17 PHE HZ A 113 PHE HBy 1.0 1.8 4.5 1154 1061 A 113 PHE H A 17 PHE HD1 1.0 1.8 6.0 1155 1062 A 17 PHE HZ A 113 PHE H 1.0 1.8 6.0 1156 1063 A 20 ALA HB% A 113 PHE HE1 1.0 1.8 6.0 1157 1064 A 113 PHE HD1 A 21 LEU HA 1.0 1.8 4.5 1158 1064 A 113 PHE HD2 A 21 LEU HA 1.0 1.8 4.5 1159 1065 A 113 PHE HD1 A 21 LEU HDx% 1.0 1.8 6.0 1160 1065 A 21 LEU HDx% A 113 PHE HD2 1.0 1.8 6.0 1161 1066 A 21 LEU HDx% A 113 PHE HE1 1.0 1.8 6.0 1162 1066 A 21 LEU HDx% A 113 PHE HE2 1.0 1.8 6.0 1163 1067 A 113 PHE HD2 A 95 LYS HBx 1.0 1.8 6.0 1164 1068 A 95 LYS HBx A 113 PHE HE2 1.0 1.8 4.5 1165 1069 A 96 PHE HA A 113 PHE HD2 1.0 1.8 6.0 1166 1070 A 113 PHE HD2 A 96 PHE HBx 1.0 1.8 4.5 1167 1071 A 113 PHE HE2 A 96 PHE HBx 1.0 1.8 6.0 1168 1072 A 113 PHE HD1 A 113 PHE HBx 1.0 1.8 4.5 1169 1072 A 113 PHE HD2 A 113 PHE HBx 1.0 1.8 4.5 1170 1073 A 113 PHE HD1 A 113 PHE HA 1.0 1.8 4.5 1171 1073 A 113 PHE HD2 A 113 PHE HA 1.0 1.8 4.5 1172 1074 A 113 PHE HD1 A 113 PHE HBy 1.0 1.8 4.5 1173 1074 A 113 PHE HD2 A 113 PHE HBy 1.0 1.8 4.5 1174 1075 A 113 PHE HE1 A 113 PHE HBy 1.0 1.8 4.5 1175 1075 A 113 PHE HE2 A 113 PHE HBy 1.0 1.8 4.5 1176 1076 A 113 PHE HA A 113 PHE HE1 1.0 1.8 4.5 1177 1076 A 113 PHE HA A 113 PHE HE2 1.0 1.8 4.5 1178 1077 A 118 LEU HDx% A 14 TYR HD1 1.0 1.8 4.5 1179 1078 A 118 LEU HDy% A 14 TYR HD1 1.0 1.8 6.0 1180 1079 A 17 PHE HD1 A 118 LEU HBy 1.0 1.8 4.5 1181 1079 A 17 PHE HD2 A 118 LEU HBy 1.0 1.8 4.5 1182 1080 A 17 PHE HD1 A 118 LEU HBx 1.0 1.8 4.5 1183 1080 A 17 PHE HD2 A 118 LEU HBx 1.0 1.8 4.5 1184 1081 A 9 TYR HEx A 121 ARG HBy 1.0 1.8 3.3 1185 1081 A 9 TYR HEy A 121 ARG HBy 1.0 1.8 3.3 1186 1082 A 6 TRP HE3 A 122 SER HBy 1.0 1.8 4.5 1187 1083 A 9 TYR HD1 A 122 SER HA 1.0 1.8 3.3 1188 1083 A 122 SER HA A 9 TYR HD2 1.0 1.8 3.3 1189 1084 A 9 TYR HEy A 122 SER HA 1.0 1.8 4.5 1190 1084 A 9 TYR HEx A 122 SER HA 1.0 1.8 4.5 1191 1085 A 123 LYS HA A 6 TRP HZ3 1.0 1.8 4.5 1192 1086 A 123 LYS HB2 A 6 TRP HZ3 1.0 1.8 6.5 1193 1087 A 123 LYS HB2 A 9 TYR HD2 1.0 1.8 4.5 1194 1087 A 123 LYS HB2 A 9 TYR HD1 1.0 1.8 4.5 1195 1088 A 123 LYS HB2 A 9 TYR HEx 1.0 1.8 3.3 1196 1088 A 123 LYS HB2 A 9 TYR HEy 1.0 1.8 3.3 1197 1089 A 9 TYR HD1 A 123 LYS HD2 1.0 1.8 4.5 1198 1089 A 9 TYR HD2 A 123 LYS HD2 1.0 1.8 4.5 1199 1090 A 9 TYR HEy A 123 LYS HD2 1.0 1.8 4.5 1200 1090 A 9 TYR HEx A 123 LYS HD2 1.0 1.8 4.5 1201 1091 A 123 LYS H A 9 TYR HD1 1.0 1.8 4.5 1202 1091 A 123 LYS H A 9 TYR HD2 1.0 1.8 4.5 1203 1092 A 123 LYS H A 9 TYR HEy 1.0 1.8 6.0 1204 1092 A 123 LYS H A 9 TYR HEx 1.0 1.8 6.0 1205 1093 A 6 TRP HE3 A 124 ARG HA 1.0 1.8 4.5 1206 1094 A 6 TRP HH2 A 124 ARG HBx 1.0 1.8 6.0 1207 1095 A 6 TRP HZ3 A 124 ARG HBx 1.0 1.8 6.0 1208 1096 A 6 TRP HH2 A 124 ARG HBy 1.0 1.8 4.5 1209 1097 A 6 TRP HZ3 A 124 ARG HBy 1.0 1.8 6.0 1210 1098 A 124 ARG HGx A 6 TRP HZ3 1.0 1.8 6.0 1211 1099 A 6 TRP HE3 A 124 ARG H 1.0 1.8 4.5 1212 1100 A 20 ALA HB% A 113 PHE HD1 1.0 1.8 3.3 1213 1101 A 98 HIS HD2 A 96 PHE HBx 1.0 1.8 6.0 1214 1101 A 98 HIS HD2 A 96 PHE HBy 1.0 1.8 6.0 1215 1102 A 98 HIS HD2 A 111 ILE HG13 1.0 1.8 6.0 1216 1103 A 98 HIS HD2 A 111 ILE HG12 1.0 1.8 4.5 1217 1104 A 111 ILE HD1% A 98 HIS HD2 1.0 1.8 4.5 1218 1105 A 111 ILE HG2% A 98 HIS HD2 1.0 1.8 4.5 1219 1106 A 3 SER H A 2 PHE HBy 1.0 1.8 4.5 1220 1106 A 3 SER H A 2 PHE HBx 1.0 1.8 4.5 1221 1107 A 3 SER HA A 4 GLY H 1.0 1.8 3.3 1222 1108 A 4 GLY H A 3 SER HB2 1.0 1.8 3.3 1223 1108 A 4 GLY H A 3 SER HB3 1.0 1.8 3.3 1224 1109 A 4 GLY H A 3 SER H 1.0 1.8 4.5 1225 1110 A 4 GLY HAy A 5 THR H 1.0 1.8 3.3 1226 1111 A 4 GLY H A 5 THR H 1.0 1.8 4.5 1227 1112 A 5 THR HA A 6 TRP H 1.0 1.8 3.3 1228 1113 A 5 THR HG2% A 6 TRP H 1.0 1.8 4.5 1229 1114 A 5 THR H A 6 TRP H 1.0 1.8 4.5 1230 1115 A 7 GLN HA A 8 VAL H 1.0 1.8 3.3 1231 1116 A 8 VAL HGx% A 9 TYR H 1.0 1.8 4.5 1232 1117 A 9 TYR H A 9 TYR HD2 1.0 1.8 3.3 1233 1118 A 8 VAL HGx% A 10 ALA H 1.0 1.8 4.5 1234 1119 A 9 TYR H A 10 ALA H 1.0 1.8 3.3 1235 1120 A 11 GLN H A 12 GLU HBx 1.0 1.8 6.0 1236 1120 A 11 GLN H A 12 GLU HBy 1.0 1.8 6.0 1237 1121 A 12 GLU H A 11 GLN HA 1.0 1.8 3.3 1238 1122 A 12 GLU H A 11 GLN HB3 1.0 1.8 3.3 1239 1122 A 12 GLU H A 11 GLN HB2 1.0 1.8 3.3 1240 1123 A 14 TYR H A 11 GLN HB3 1.0 1.8 4.5 1241 1123 A 14 TYR H A 11 GLN HB2 1.0 1.8 4.5 1242 1124 A 13 ASN HA A 14 TYR H 1.0 1.8 4.5 1243 1125 A 14 TYR H A 13 ASN H 1.0 1.8 3.3 1244 1126 A 15 GLU H A 14 TYR HBy 1.0 1.8 3.3 1245 1126 A 15 GLU H A 14 TYR HBx 1.0 1.8 3.3 1246 1127 A 15 GLU H A 14 TYR HD2 1.0 1.8 4.5 1247 1128 A 14 TYR H A 15 GLU H 1.0 1.8 3.3 1248 1129 A 16 GLU H A 17 PHE HBx 1.0 1.8 4.5 1249 1129 A 16 GLU H A 17 PHE HBy 1.0 1.8 4.5 1250 1130 A 17 PHE H A 16 GLU HBx 1.0 1.8 3.3 1251 1130 A 17 PHE H A 16 GLU HBy 1.0 1.8 3.3 1252 1131 A 17 PHE H A 16 GLU H 1.0 1.8 3.3 1253 1132 A 15 GLU HA A 18 LEU H 1.0 1.8 4.5 1254 1133 A 15 GLU H A 18 LEU H 1.0 1.8 4.5 1255 1134 A 18 LEU H A 16 GLU H 1.0 1.8 4.5 1256 1135 A 18 LEU H A 17 PHE HBx 1.0 1.8 3.3 1257 1135 A 18 LEU H A 17 PHE HBy 1.0 1.8 3.3 1258 1136 A 17 PHE HD2 A 18 LEU H 1.0 1.8 4.5 1259 1137 A 16 GLU H A 19 LYS HGy 1.0 1.8 6.0 1260 1137 A 16 GLU H A 19 LYS HGx 1.0 1.8 6.0 1261 1138 A 19 LYS H A 16 GLU H 1.0 1.8 4.5 1262 1139 A 19 LYS H A 18 LEU H 1.0 1.8 3.3 1263 1140 A 17 PHE HA A 20 ALA H 1.0 1.8 3.3 1264 1141 A 20 ALA H A 18 LEU H 1.0 1.8 4.5 1265 1142 A 19 LYS HA A 21 LEU H 1.0 1.8 4.5 1266 1143 A 19 LYS H A 21 LEU H 1.0 1.8 4.5 1267 1144 A 20 ALA H A 21 LEU H 1.0 1.8 3.3 1268 1145 A 22 ALA H A 21 LEU HA 1.0 1.8 3.3 1269 1146 A 22 ALA H A 21 LEU HBy 1.0 1.8 3.3 1270 1146 A 22 ALA H A 21 LEU HBx 1.0 1.8 3.3 1271 1147 A 21 LEU H A 22 ALA H 1.0 1.8 3.3 1272 1148 A 23 LEU H A 21 LEU HA 1.0 1.8 4.5 1273 1149 A 23 LEU H A 22 ALA HA 1.0 1.8 3.3 1274 1150 A 23 LEU H A 22 ALA H 1.0 1.8 3.3 1275 1151 A 25 GLU H A 24 PRO HA 1.0 1.8 3.3 1276 1152 A 25 GLU H A 24 PRO HBy 1.0 1.8 3.3 1277 1152 A 25 GLU H A 24 PRO HBx 1.0 1.8 3.3 1278 1153 A 26 ASP H A 24 PRO HBy 1.0 1.8 3.3 1279 1153 A 26 ASP H A 24 PRO HBx 1.0 1.8 3.3 1280 1154 A 26 ASP H A 25 GLU HA 1.0 1.8 4.5 1281 1155 A 27 LEU H A 24 PRO HBy 1.0 1.8 4.5 1282 1155 A 27 LEU H A 24 PRO HBx 1.0 1.8 4.5 1283 1156 A 25 GLU H A 27 LEU HBy 1.0 1.8 6.0 1284 1156 A 27 LEU HBx A 25 GLU H 1.0 1.8 6.0 1285 1157 A 25 GLU H A 27 LEU H 1.0 1.8 4.5 1286 1158 A 26 ASP H A 27 LEU H 1.0 1.8 3.3 1287 1159 A 19 LYS H A 28 ILE HD1% 1.0 1.8 4.5 1288 1160 A 28 ILE HD1% A 22 ALA H 1.0 1.8 4.5 1289 1161 A 23 LEU H A 28 ILE HD1% 1.0 1.8 4.5 1290 1162 A 25 GLU HA A 28 ILE H 1.0 1.8 4.5 1291 1163 A 26 ASP H A 28 ILE H 1.0 1.8 4.5 1292 1164 A 28 ILE H A 27 LEU HBy 1.0 1.8 3.3 1293 1164 A 27 LEU HBx A 28 ILE H 1.0 1.8 3.3 1294 1165 A 27 LEU H A 28 ILE H 1.0 1.8 3.3 1295 1166 A 26 ASP H A 29 LYS HGx 1.0 1.8 4.5 1296 1166 A 26 ASP H A 29 LYS HGy 1.0 1.8 4.5 1297 1167 A 28 ILE HA A 29 LYS H 1.0 1.8 4.5 1298 1168 A 29 LYS H A 28 ILE HB 1.0 1.8 3.3 1299 1169 A 30 MET H A 30 MET HGx 1.0 1.8 4.5 1300 1169 A 30 MET H A 30 MET HGy 1.0 1.8 4.5 1301 1170 A 30 MET H A 28 ILE HB 1.0 1.8 4.5 1302 1171 A 30 MET H A 29 LYS HGx 1.0 1.8 4.5 1303 1171 A 30 MET H A 29 LYS HGy 1.0 1.8 4.5 1304 1172 A 29 LYS H A 30 MET H 1.0 1.8 3.3 1305 1173 A 27 LEU HDx% A 31 ALA H 1.0 1.8 4.5 1306 1174 A 28 ILE HA A 31 ALA H 1.0 1.8 4.5 1307 1175 A 31 ALA H A 30 MET HBy 1.0 1.8 3.3 1308 1175 A 31 ALA H A 30 MET HBx 1.0 1.8 3.3 1309 1176 A 30 MET H A 31 ALA H 1.0 1.8 3.3 1310 1177 A 28 ILE HA A 32 ARG H 1.0 1.8 4.5 1311 1178 A 29 LYS HA A 32 ARG H 1.0 1.8 3.3 1312 1179 A 31 ALA H A 32 ARG HGy 1.0 1.8 4.5 1313 1179 A 31 ALA H A 32 ARG HGx 1.0 1.8 4.5 1314 1180 A 31 ALA HB% A 32 ARG H 1.0 1.8 4.5 1315 1181 A 31 ALA H A 32 ARG H 1.0 1.8 4.5 1316 1182 A 32 ARG HA A 33 ASP H 1.0 1.8 4.5 1317 1183 A 33 ASP H A 32 ARG HGy 1.0 1.8 4.5 1318 1183 A 33 ASP H A 32 ARG HGx 1.0 1.8 4.5 1319 1184 A 32 ARG H A 33 ASP H 1.0 1.8 4.5 1320 1185 A 34 ILE H A 14 TYR HE2 1.0 1.8 4.5 1321 1186 A 31 ALA HB% A 34 ILE H 1.0 1.8 4.5 1322 1187 A 33 ASP H A 34 ILE HD1% 1.0 1.8 6.0 1323 1188 A 33 ASP H A 34 ILE H 1.0 1.8 3.3 1324 1189 A 35 LYS H A 34 ILE HA 1.0 1.8 4.5 1325 1190 A 34 ILE HG2% A 35 LYS H 1.0 1.8 6.0 1326 1191 A 6 TRP H A 37 ILE HG2% 1.0 1.8 6.0 1327 1192 A 38 VAL HB A 6 TRP H 1.0 1.8 4.5 1328 1193 A 39 GLU H A 38 VAL HA 1.0 1.8 3.3 1329 1194 A 38 VAL HGx% A 39 GLU H 1.0 1.8 4.5 1330 1195 A 40 ILE HG2% A 3 SER H 1.0 1.8 4.5 1331 1196 A 4 GLY H A 40 ILE HB 1.0 1.8 3.3 1332 1197 A 4 GLY H A 40 ILE HG12 1.0 1.8 4.5 1333 1197 A 4 GLY H A 40 ILE HG13 1.0 1.8 4.5 1334 1198 A 4 GLY H A 40 ILE HG2% 1.0 1.8 4.5 1335 1199 A 4 GLY H A 40 ILE H 1.0 1.8 3.3 1336 1200 A 5 THR HA A 40 ILE H 1.0 1.8 3.3 1337 1201 A 39 GLU HA A 40 ILE H 1.0 1.8 3.3 1338 1202 A 40 ILE HA A 41 GLN H 1.0 1.8 3.3 1339 1203 A 41 GLN H A 40 ILE HG12 1.0 1.8 4.5 1340 1203 A 41 GLN H A 40 ILE HG13 1.0 1.8 4.5 1341 1204 A 40 ILE H A 41 GLN H 1.0 1.8 4.5 1342 1205 A 3 SER HA A 42 GLN H 1.0 1.8 3.3 1343 1206 A 42 GLN H A 3 SER HB2 1.0 1.8 4.5 1344 1206 A 42 GLN H A 3 SER HB3 1.0 1.8 4.5 1345 1207 A 42 GLN H A 40 ILE HG2% 1.0 1.8 4.5 1346 1208 A 42 GLN H A 41 GLN H 1.0 1.8 4.5 1347 1209 A 42 GLN HA A 43 LYS H 1.0 1.8 3.3 1348 1210 A 43 LYS H A 42 GLN HBy 1.0 1.8 4.5 1349 1210 A 43 LYS H A 42 GLN HBx 1.0 1.8 4.5 1350 1211 A 44 GLY H A 45 ASP HA 1.0 1.8 6.0 1351 1212 A 44 GLY HAy A 45 ASP H 1.0 1.8 3.3 1352 1213 A 44 GLY HAx A 45 ASP H 1.0 1.8 3.3 1353 1214 A 45 ASP H A 46 ASP H 1.0 1.8 3.3 1354 1215 A 46 ASP H A 46 ASP HBy 1.0 1.8 3.3 1355 1215 A 46 ASP H A 46 ASP HBx 1.0 1.8 3.3 1356 1216 A 46 ASP HA A 47 PHE H 1.0 1.8 3.3 1357 1217 A 47 PHE H A 46 ASP HBy 1.0 1.8 4.5 1358 1217 A 47 PHE H A 46 ASP HBx 1.0 1.8 4.5 1359 1218 A 41 GLN H A 48 VAL HA 1.0 1.8 4.5 1360 1219 A 41 GLN H A 48 VAL H 1.0 1.8 3.3 1361 1220 A 42 GLN HA A 48 VAL H 1.0 1.8 3.3 1362 1221 A 47 PHE HA A 48 VAL H 1.0 1.8 3.3 1363 1222 A 48 VAL H A 47 PHE HBy 1.0 1.8 3.3 1364 1222 A 48 VAL H A 47 PHE HBx 1.0 1.8 3.3 1365 1223 A 48 VAL HA A 49 VAL H 1.0 1.8 3.3 1366 1224 A 48 VAL HB A 49 VAL H 1.0 1.8 4.5 1367 1225 A 48 VAL HGx% A 49 VAL H 1.0 1.8 4.5 1368 1226 A 50 THR H A 39 GLU HBy 1.0 1.8 4.5 1369 1226 A 50 THR H A 39 GLU HBx 1.0 1.8 4.5 1370 1227 A 50 THR H A 39 GLU H 1.0 1.8 3.3 1371 1228 A 49 VAL HA A 50 THR H 1.0 1.8 3.3 1372 1229 A 49 VAL HGx% A 50 THR H 1.0 1.8 4.5 1373 1230 A 49 VAL H A 50 THR H 1.0 1.8 4.5 1374 1231 A 50 THR HA A 51 SER H 1.0 1.8 3.3 1375 1232 A 50 THR HG2% A 51 SER H 1.0 1.8 4.5 1376 1233 A 51 SER H A 51 SER HBx 1.0 1.8 3.3 1377 1233 A 51 SER H A 51 SER HBy 1.0 1.8 3.3 1378 1234 A 51 SER HA A 52 LYS H 1.0 1.8 3.3 1379 1235 A 52 LYS H A 51 SER HBx 1.0 1.8 4.5 1380 1235 A 52 LYS H A 51 SER HBy 1.0 1.8 4.5 1381 1236 A 53 THR H A 52 LYS HA 1.0 1.8 3.3 1382 1237 A 53 THR H A 52 LYS HBy 1.0 1.8 3.3 1383 1237 A 53 THR H A 52 LYS HBx 1.0 1.8 3.3 1384 1238 A 53 THR HB A 55 ARG H 1.0 1.8 3.3 1385 1239 A 53 THR HG2% A 55 ARG H 1.0 1.8 6.0 1386 1240 A 55 ARG H A 56 GLN H 1.0 1.8 3.3 1387 1241 A 57 THR H A 56 GLN HBx 1.0 1.8 3.3 1388 1241 A 57 THR H A 56 GLN HBy 1.0 1.8 3.3 1389 1242 A 50 THR HG2% A 58 VAL H 1.0 1.8 4.5 1390 1243 A 57 THR HA A 58 VAL H 1.0 1.8 3.3 1391 1244 A 59 THR H A 58 VAL HGx% 1.0 1.8 4.5 1392 1245 A 59 THR HA A 60 ASN H 1.0 1.8 3.3 1393 1246 A 59 THR HG2% A 60 ASN H 1.0 1.8 4.5 1394 1247 A 61 SER H A 60 ASN HBx 1.0 1.8 3.3 1395 1247 A 61 SER H A 60 ASN HBy 1.0 1.8 3.3 1396 1248 A 62 PHE H A 47 PHE H 1.0 1.8 4.5 1397 1249 A 61 SER HA A 62 PHE H 1.0 1.8 3.3 1398 1250 A 63 THR H A 62 PHE HBx 1.0 1.8 4.5 1399 1250 A 63 THR H A 62 PHE HBy 1.0 1.8 4.5 1400 1251 A 63 THR H A 62 PHE HD2 1.0 1.8 4.5 1401 1252 A 64 LEU H A 47 PHE H 1.0 1.8 4.5 1402 1253 A 63 THR HA A 64 LEU H 1.0 1.8 3.3 1403 1254 A 65 GLY H A 64 LEU HBx 1.0 1.8 4.5 1404 1254 A 64 LEU HBy A 65 GLY H 1.0 1.8 4.5 1405 1255 A 64 LEU HG A 65 GLY H 1.0 1.8 4.5 1406 1256 A 65 GLY HAy A 66 LYS H 1.0 1.8 4.5 1407 1257 A 66 LYS H A 65 GLY HAx 1.0 1.8 3.3 1408 1258 A 66 LYS H A 65 GLY H 1.0 1.8 3.3 1409 1259 A 66 LYS HA A 67 GLU H 1.0 1.8 3.3 1410 1260 A 67 GLU H A 66 LYS HBy 1.0 1.8 3.3 1411 1260 A 67 GLU H A 66 LYS HBx 1.0 1.8 3.3 1412 1261 A 67 GLU H A 66 LYS HG2 1.0 1.8 4.5 1413 1261 A 67 GLU H A 66 LYS HG3 1.0 1.8 4.5 1414 1262 A 67 GLU HA A 68 ALA H 1.0 1.8 3.3 1415 1263 A 68 ALA H A 67 GLU HGy 1.0 1.8 3.3 1416 1263 A 68 ALA H A 67 GLU HGx 1.0 1.8 3.3 1417 1264 A 68 ALA H A 67 GLU H 1.0 1.8 4.5 1418 1265 A 67 GLU HA A 69 ASP H 1.0 3.3 6.0 1419 1266 A 61 SER H A 70 ILE HD1% 1.0 1.8 4.5 1420 1267 A 70 ILE HD1% A 68 ALA H 1.0 1.8 6.0 1421 1268 A 70 ILE HD1% A 69 ASP H 1.0 1.8 6.0 1422 1269 A 69 ASP H A 70 ILE HG12 1.0 1.8 4.5 1423 1269 A 69 ASP H A 70 ILE HG13 1.0 1.8 4.5 1424 1270 A 69 ASP HA A 70 ILE H 1.0 1.8 3.3 1425 1271 A 70 ILE H A 69 ASP HB3 1.0 1.8 3.3 1426 1271 A 70 ILE H A 69 ASP HB2 1.0 1.8 3.3 1427 1272 A 69 ASP H A 70 ILE H 1.0 1.8 4.5 1428 1273 A 70 ILE HA A 71 THR H 1.0 1.8 3.3 1429 1274 A 70 ILE HG2% A 71 THR H 1.0 1.8 3.3 1430 1275 A 70 ILE H A 71 THR H 1.0 1.8 4.5 1431 1276 A 71 THR HA A 72 THR H 1.0 1.8 3.3 1432 1277 A 71 THR HG2% A 72 THR H 1.0 1.8 6.0 1433 1278 A 72 THR HA A 73 MET H 1.0 1.8 3.3 1434 1279 A 72 THR HG2% A 73 MET H 1.0 1.8 6.0 1435 1280 A 72 THR HB A 74 ASP H 1.0 1.8 3.3 1436 1281 A 72 THR HG2% A 74 ASP H 1.0 1.8 4.5 1437 1282 A 74 ASP H A 72 THR H 1.0 1.8 4.5 1438 1283 A 73 MET H A 74 ASP HBx 1.0 1.8 4.5 1439 1283 A 74 ASP HBy A 73 MET H 1.0 1.8 4.5 1440 1284 A 74 ASP H A 73 MET HBx 1.0 1.8 3.3 1441 1284 A 74 ASP H A 73 MET HBy 1.0 1.8 3.3 1442 1285 A 74 ASP H A 73 MET H 1.0 1.8 4.5 1443 1286 A 72 THR HB A 75 GLY H 1.0 1.8 4.5 1444 1287 A 74 ASP H A 75 GLY H 1.0 1.8 3.3 1445 1288 A 76 LYS H A 72 THR H 1.0 1.8 4.5 1446 1289 A 74 ASP H A 76 LYS HBx 1.0 1.8 4.5 1447 1289 A 74 ASP H A 76 LYS HBy 1.0 1.8 4.5 1448 1290 A 76 LYS H A 74 ASP HBx 1.0 1.8 4.5 1449 1290 A 76 LYS H A 74 ASP HBy 1.0 1.8 4.5 1450 1291 A 74 ASP H A 76 LYS H 1.0 1.8 4.5 1451 1292 A 75 GLY H A 76 LYS HBx 1.0 1.8 4.5 1452 1292 A 75 GLY H A 76 LYS HBy 1.0 1.8 4.5 1453 1293 A 75 GLY H A 76 LYS HGy 1.0 1.8 4.5 1454 1293 A 75 GLY H A 76 LYS HGx 1.0 1.8 4.5 1455 1294 A 76 LYS H A 75 GLY HAx 1.0 1.8 4.5 1456 1295 A 75 GLY H A 76 LYS H 1.0 1.8 3.3 1457 1296 A 76 LYS H A 77 LYS HA 1.0 1.8 6.0 1458 1297 A 76 LYS HA A 77 LYS H 1.0 1.8 3.3 1459 1298 A 77 LYS H A 76 LYS HBx 1.0 1.8 3.3 1460 1298 A 76 LYS HBy A 77 LYS H 1.0 1.8 3.3 1461 1299 A 77 LYS H A 76 LYS HGy 1.0 1.8 3.3 1462 1299 A 76 LYS HGx A 77 LYS H 1.0 1.8 3.3 1463 1300 A 77 LYS HA A 78 LEU H 1.0 1.8 3.3 1464 1301 A 78 LEU H A 79 LYS HGy 1.0 1.8 4.5 1465 1301 A 78 LEU H A 79 LYS HGx 1.0 1.8 4.5 1466 1302 A 78 LEU HDx% A 79 LYS H 1.0 1.8 4.5 1467 1303 A 79 LYS H A 79 LYS HGy 1.0 1.8 3.3 1468 1303 A 79 LYS H A 79 LYS HGx 1.0 1.8 3.3 1469 1304 A 68 ALA H A 80 CYS H 1.0 1.8 3.3 1470 1305 A 79 LYS HA A 80 CYS H 1.0 1.8 3.3 1471 1306 A 80 CYS H A 79 LYS HBy 1.0 1.8 3.3 1472 1306 A 80 CYS H A 79 LYS HBx 1.0 1.8 3.3 1473 1307 A 81 THR HG2% A 65 GLY H 1.0 1.8 4.5 1474 1308 A 66 LYS H A 81 THR HG2% 1.0 1.8 4.5 1475 1309 A 81 THR H A 67 GLU HGy 1.0 1.8 4.5 1476 1309 A 81 THR H A 67 GLU HGx 1.0 1.8 4.5 1477 1310 A 66 LYS H A 82 VAL HGy% 1.0 1.8 6.0 1478 1311 A 81 THR HA A 82 VAL H 1.0 1.8 3.3 1479 1312 A 83 HIS HA A 65 GLY H 1.0 1.8 4.5 1480 1313 A 83 HIS H A 82 VAL HA 1.0 1.8 3.3 1481 1314 A 82 VAL HGx% A 83 HIS H 1.0 1.8 4.5 1482 1315 A 83 HIS HA A 84 LEU H 1.0 1.8 3.3 1483 1316 A 84 LEU H A 83 HIS HBy 1.0 1.8 3.3 1484 1316 A 84 LEU H A 83 HIS HBx 1.0 1.8 3.3 1485 1317 A 84 LEU HA A 85 ALA H 1.0 1.8 3.3 1486 1318 A 85 ALA H A 84 LEU HBx 1.0 1.8 4.5 1487 1318 A 85 ALA H A 84 LEU HBy 1.0 1.8 4.5 1488 1319 A 84 LEU H A 85 ALA H 1.0 1.8 4.5 1489 1320 A 86 ASN HA A 86 ASN H 1.0 1.8 4.5 1490 1321 A 87 GLY H A 84 LEU HBx 1.0 1.8 4.5 1491 1321 A 87 GLY H A 84 LEU HBy 1.0 1.8 4.5 1492 1322 A 84 LEU HDy% A 87 GLY H 1.0 1.8 4.5 1493 1323 A 87 GLY H A 86 ASN HBx 1.0 1.8 4.5 1494 1323 A 87 GLY H A 86 ASN HBy 1.0 1.8 4.5 1495 1324 A 87 GLY H A 86 ASN H 1.0 1.8 3.3 1496 1325 A 85 ALA HA A 88 LYS H 1.0 1.8 4.5 1497 1326 A 85 ALA H A 88 LYS H 1.0 1.8 3.3 1498 1327 A 88 LYS H A 87 GLY HAy 1.0 1.8 4.5 1499 1328 A 88 LYS H A 87 GLY HAx 1.0 1.8 4.5 1500 1329 A 87 GLY H A 88 LYS H 1.0 1.8 3.3 1501 1330 A 83 HIS H A 89 LEU HG 1.0 1.8 4.5 1502 1331 A 89 LEU H A 88 LYS HA 1.0 1.8 3.3 1503 1332 A 89 LEU H A 88 LYS HBx 1.0 1.8 4.5 1504 1332 A 89 LEU H A 88 LYS HBy 1.0 1.8 4.5 1505 1333 A 83 HIS H A 90 VAL HB 1.0 1.8 4.5 1506 1334 A 83 HIS H A 90 VAL H 1.0 1.8 3.3 1507 1335 A 85 ALA H A 90 VAL HGy% 1.0 1.8 4.5 1508 1336 A 89 LEU HA A 90 VAL H 1.0 1.8 3.3 1509 1337 A 89 LEU HDy% A 90 VAL H 1.0 1.8 4.5 1510 1338 A 90 VAL H A 89 LEU HG 1.0 1.8 3.3 1511 1339 A 91 THR H A 90 VAL HA 1.0 1.8 3.3 1512 1340 A 92 LYS H A 91 THR HB 1.0 1.8 4.5 1513 1341 A 92 LYS H A 91 THR HG1 1.0 1.8 4.5 1514 1342 A 91 THR HA A 92 LYS H 1.0 1.8 3.3 1515 1343 A 92 LYS H A 93 SER HA 1.0 1.8 6.0 1516 1344 A 93 SER H A 92 LYS HBy 1.0 1.8 3.3 1517 1344 A 93 SER H A 92 LYS HBx 1.0 1.8 3.3 1518 1345 A 92 LYS H A 93 SER H 1.0 1.8 4.5 1519 1346 A 93 SER H A 95 LYS HG3 1.0 1.8 4.5 1520 1346 A 93 SER H A 95 LYS HG2 1.0 1.8 4.5 1521 1347 A 96 PHE H A 93 SER HBy 1.0 1.8 3.3 1522 1347 A 96 PHE H A 93 SER HBx 1.0 1.8 3.3 1523 1348 A 93 SER H A 96 PHE H 1.0 1.8 3.3 1524 1349 A 96 PHE HD2 A 95 LYS HDx 1.0 1.8 3.3 1525 1350 A 95 LYS H A 96 PHE H 1.0 1.8 3.3 1526 1351 A 93 SER H A 97 SER HA 1.0 1.8 4.5 1527 1352 A 96 PHE HA A 97 SER H 1.0 1.8 3.3 1528 1353 A 97 SER H A 96 PHE HBx 1.0 1.8 3.3 1529 1353 A 97 SER H A 96 PHE HBy 1.0 1.8 3.3 1530 1354 A 97 SER H A 96 PHE H 1.0 1.8 4.5 1531 1355 A 91 THR H A 98 HIS H 1.0 1.8 4.5 1532 1356 A 97 SER HA A 98 HIS H 1.0 1.8 3.3 1533 1357 A 98 HIS H A 97 SER HB2 1.0 1.8 4.5 1534 1357 A 98 HIS H A 97 SER HB3 1.0 1.8 4.5 1535 1358 A 98 HIS HA A 99 GLU H 1.0 1.8 3.3 1536 1359 A 99 GLU H A 98 HIS H 1.0 1.8 4.5 1537 1360 A 89 LEU H A 100 GLN H 1.0 1.8 4.5 1538 1361 A 101 GLU H A 88 LYS HBx 1.0 1.8 6.0 1539 1361 A 101 GLU H A 88 LYS HBy 1.0 1.8 6.0 1540 1362 A 101 GLU H A 100 GLN HA 1.0 1.8 3.3 1541 1363 A 102 VAL HGy% A 3 SER H 1.0 1.8 6.0 1542 1364 A 101 GLU HA A 102 VAL H 1.0 1.8 3.3 1543 1365 A 102 VAL H A 101 GLU HB2 1.0 1.8 3.3 1544 1365 A 101 GLU HB3 A 102 VAL H 1.0 1.8 3.3 1545 1366 A 102 VAL HA A 103 LYS H 1.0 1.8 3.3 1546 1367 A 102 VAL HGy% A 103 LYS H 1.0 1.8 4.5 1547 1368 A 107 MET H A 6 TRP HZ3 1.0 1.8 4.5 1548 1369 A 103 LYS H A 107 MET H 1.0 1.8 6.0 1549 1370 A 107 MET H A 106 GLU HBy 1.0 1.8 4.5 1550 1370 A 107 MET H A 106 GLU HBx 1.0 1.8 4.5 1551 1371 A 108 VAL H A 107 MET HG3 1.0 1.8 3.3 1552 1371 A 108 VAL H A 107 MET HG2 1.0 1.8 3.3 1553 1372 A 108 VAL HA A 109 GLU H 1.0 1.8 3.3 1554 1373 A 109 GLU H A 108 VAL HGx% 1.0 1.8 4.5 1555 1374 A 109 GLU HA A 110 THR H 1.0 1.8 3.3 1556 1375 A 97 SER H A 111 ILE HG2% 1.0 1.8 4.5 1557 1376 A 99 GLU H A 111 ILE HG12 1.0 1.8 4.5 1558 1376 A 99 GLU H A 111 ILE HG13 1.0 1.8 4.5 1559 1377 A 110 THR H A 111 ILE HG12 1.0 1.8 4.5 1560 1377 A 110 THR H A 111 ILE HG13 1.0 1.8 4.5 1561 1378 A 97 SER H A 112 THR H 1.0 1.8 4.5 1562 1379 A 111 ILE HA A 112 THR H 1.0 1.8 3.3 1563 1380 A 112 THR HA A 113 PHE H 1.0 1.8 3.3 1564 1381 A 96 PHE HA A 114 GLY H 1.0 1.8 4.5 1565 1382 A 113 PHE HA A 114 GLY H 1.0 1.8 3.3 1566 1383 A 114 GLY H A 113 PHE HBx 1.0 1.8 4.5 1567 1383 A 114 GLY H A 113 PHE HBy 1.0 1.8 4.5 1568 1384 A 113 PHE HD1 A 114 GLY H 1.0 1.8 4.5 1569 1385 A 112 THR HG2% A 115 GLY H 1.0 1.8 6.0 1570 1386 A 17 PHE H A 116 VAL HGx% 1.0 1.8 4.5 1571 1387 A 20 ALA H A 116 VAL HGx% 1.0 1.8 4.5 1572 1388 A 113 PHE H A 116 VAL H 1.0 1.8 3.3 1573 1389 A 116 VAL H A 115 GLY HAy 1.0 1.8 3.3 1574 1390 A 116 VAL H A 115 GLY HAx 1.0 1.8 3.3 1575 1391 A 116 VAL H A 115 GLY H 1.0 1.8 4.5 1576 1392 A 113 PHE H A 117 THR HA 1.0 1.8 3.3 1577 1393 A 117 THR H A 116 VAL HA 1.0 1.8 3.3 1578 1394 A 116 VAL HGx% A 117 THR H 1.0 1.8 4.5 1579 1395 A 111 ILE HB A 118 LEU H 1.0 1.8 4.5 1580 1396 A 112 THR HA A 118 LEU H 1.0 1.8 4.5 1581 1397 A 117 THR HA A 118 LEU H 1.0 1.8 3.3 1582 1398 A 12 GLU H A 119 ILE HG2% 1.0 1.8 4.5 1583 1399 A 12 GLU H A 119 ILE H 1.0 1.8 4.5 1584 1400 A 119 ILE H A 13 ASN HBx 1.0 1.8 4.5 1585 1400 A 119 ILE H A 13 ASN HBy 1.0 1.8 4.5 1586 1401 A 118 LEU HDx% A 119 ILE H 1.0 1.8 4.5 1587 1402 A 109 GLU H A 120 ARG HBx 1.0 1.8 3.3 1588 1402 A 109 GLU H A 120 ARG HBy 1.0 1.8 3.3 1589 1403 A 9 TYR H A 121 ARG HBx 1.0 1.8 4.5 1590 1403 A 9 TYR H A 121 ARG HBy 1.0 1.8 4.5 1591 1404 A 10 ALA H A 121 ARG HBx 1.0 1.8 3.3 1592 1404 A 10 ALA H A 121 ARG HBy 1.0 1.8 3.3 1593 1405 A 107 MET H A 121 ARG HA 1.0 1.8 4.5 1594 1406 A 120 ARG HA A 121 ARG H 1.0 1.8 3.3 1595 1407 A 9 TYR H A 122 SER HA 1.0 1.8 4.5 1596 1408 A 108 VAL HA A 122 SER H 1.0 1.8 4.5 1597 1409 A 122 SER H A 109 GLU HBy 1.0 1.8 6.0 1598 1409 A 122 SER H A 109 GLU HBx 1.0 1.8 6.0 1599 1410 A 109 GLU H A 122 SER H 1.0 1.8 4.5 1600 1411 A 122 SER H A 121 ARG HA 1.0 1.8 3.3 1601 1412 A 122 SER H A 121 ARG HGy 1.0 1.8 4.5 1602 1412 A 122 SER H A 121 ARG HGx 1.0 1.8 4.5 1603 1413 A 122 SER H A 121 ARG H 1.0 1.8 4.5 1604 1414 A 123 LYS H A 6 TRP HE3 1.0 1.8 4.5 1605 1415 A 123 LYS H A 7 GLN H 1.0 1.8 4.5 1606 1416 A 9 TYR H A 123 LYS HB3 1.0 1.8 6.0 1607 1416 A 123 LYS HB2 A 9 TYR H 1.0 1.8 6.0 1608 1417 A 123 LYS H A 122 SER HA 1.0 1.8 4.5 1609 1418 A 123 LYS H A 122 SER HBy 1.0 1.8 3.3 1610 1418 A 123 LYS H A 122 SER HBx 1.0 1.8 3.3 1611 1419 A 5 THR H A 124 ARG HGy 1.0 1.8 3.3 1612 1419 A 5 THR H A 124 ARG HGx 1.0 1.8 3.3 1613 1420 A 6 TRP HZ3 A 124 ARG H 1.0 1.8 4.5 1614 1421 A 123 LYS HA A 124 ARG H 1.0 1.8 3.3 1615 1422 A 124 ARG H A 123 LYS HB3 1.0 1.8 3.3 1616 1422 A 123 LYS HB2 A 124 ARG H 1.0 1.8 3.3 1617 1423 A 6 TRP HA A 125 VAL H 1.0 1.8 4.5 1618 1424 A 124 ARG HA A 125 VAL H 1.0 1.8 3.3 1619 1425 A 125 VAL H A 124 ARG HBx 1.0 1.8 4.5 1620 1425 A 125 VAL H A 124 ARG HBy 1.0 1.8 4.5 1621 1426 A 125 VAL H A 124 ARG HGy 1.0 1.8 3.3 1622 1426 A 124 ARG HGx A 125 VAL H 1.0 1.8 3.3 stop_ save_ save_CNS/XPLOR_distance_constraints_6 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_6 _nef_distance_restraint_list.restraint_origin undefined _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 B 1 JN3 C18 A 14 TYR CD1 1.0 3.0 6.5 2 2 B 1 JN3 C18 A 14 TYR CE2 1.0 2.0 5.5 3 3 B 1 JN3 C18 A 18 LEU CD1 1.0 2.0 4.5 4 4 B 1 JN3 C18 A 18 LEU CD2 1.0 2.0 4.5 5 5 B 1 JN3 C18 A 23 LEU CD1 1.0 2.0 5.5 6 6 B 1 JN3 C18 A 27 LEU CG 1.0 2.0 5.5 7 7 B 1 JN3 C18 A 27 LEU CD1 1.0 2.0 5.5 8 8 B 1 JN3 C18 A 27 LEU CD2 1.0 2.0 5.5 9 9 B 1 JN3 C18 A 31 ALA CA 1.0 2.0 5.5 10 10 B 1 JN3 C18 A 31 ALA CB 1.0 2.0 4.5 11 11 B 1 JN3 C18 A 34 ILE CD1 1.0 3.0 6.5 12 12 B 1 JN3 C18 A 34 ILE CG2 1.0 3.0 6.5 13 13 B 1 JN3 C18 A 36 PRO CG 1.0 3.0 6.5 14 14 B 1 JN3 C18 A 73 MET CE 1.0 3.0 6.5 15 15 B 1 JN3 C18 A 74 ASP CB 1.0 4.0 7.5 16 16 A 14 TYR CD1 B 1 JN3 C19 1.0 3.0 5.5 17 17 B 1 JN3 C19 A 14 TYR CE1 1.0 3.0 5.5 18 18 A 14 TYR CE2 B 1 JN3 C19 1.0 3.0 5.5 19 19 B 1 JN3 C19 A 17 PHE CD2 1.0 3.0 6.5 20 20 B 1 JN3 C19 A 17 PHE CE2 1.0 2.0 4.5 21 21 B 1 JN3 C19 A 17 PHE CZ 1.0 2.0 5.5 22 22 A 18 LEU CD2 B 1 JN3 C19 1.0 2.0 4.5 23 23 B 1 JN3 C19 A 21 LEU CD1 1.0 3.0 6.5 24 24 B 1 JN3 C19 A 21 LEU CD2 1.0 2.0 5.5 25 25 A 23 LEU CD1 B 1 JN3 C19 1.0 3.0 6.5 26 26 B 1 JN3 C19 A 111 ILE CD1 1.0 2.0 5.5 27 27 B 1 JN3 C19 A 118 LEU CD2 1.0 2.0 4.5 28 28 A 27 LEU CG B 1 JN3 C21 1.0 3.0 6.5 29 29 A 31 ALA CA B 1 JN3 C21 1.0 2.0 4.5 30 30 B 1 JN3 C21 A 34 ILE CA 1.0 3.0 5.5 31 31 B 1 JN3 C21 A 34 ILE CB 1.0 2.0 4.5 32 32 B 1 JN3 C21 A 34 ILE CG1 1.0 3.0 5.5 33 33 A 34 ILE CG2 B 1 JN3 C21 1.0 2.0 4.5 34 34 A 34 ILE CD1 B 1 JN3 C21 1.0 2.0 5.5 35 35 A 36 PRO CG B 1 JN3 C21 1.0 2.0 5.5 36 36 B 1 JN3 C21 A 53 THR CG2 1.0 2.0 4.5 37 37 B 1 JN3 C21 A 55 ARG CB 1.0 3.0 6.5 38 38 B 1 JN3 C21 A 73 MET CB 1.0 2.0 5.5 39 39 A 73 MET CE B 1 JN3 C21 1.0 2.0 4.5 40 40 A 36 PRO CG B 1 JN3 C1 1.0 3.0 6.5 41 41 A 111 ILE CD1 B 1 JN3 C1 1.0 2.0 4.5 42 42 A 118 LEU CD2 B 1 JN3 C1 1.0 2.0 5.5 43 43 A 118 LEU CD2 B 1 JN3 C2 1.0 3.0 6.5 44 44 A 111 ILE CD1 B 1 JN3 C3 1.0 2.0 4.5 45 45 B 1 JN3 C3 A 111 ILE CG2 1.0 2.0 5.5 46 46 A 111 ILE CG2 B 1 JN3 C4 1.0 3.0 6.5 47 47 A 111 ILE CD1 B 1 JN3 C4 1.0 2.0 4.5 48 48 A 17 PHE CE2 B 1 JN3 C5 1.0 3.0 5.5 49 49 A 21 LEU CD2 B 1 JN3 C5 1.0 3.0 5.5 50 50 A 111 ILE CG2 B 1 JN3 C5 1.0 3.0 6.5 51 51 A 111 ILE CD1 B 1 JN3 C5 1.0 2.0 5.5 52 52 A 17 PHE CE2 B 1 JN3 C6 1.0 2.0 5.5 53 53 A 17 PHE CZ B 1 JN3 C6 1.0 3.0 6.5 54 54 A 18 LEU CD2 B 1 JN3 C6 1.0 2.0 5.5 55 55 A 21 LEU CD1 B 1 JN3 C6 1.0 1.0 4.5 56 56 A 21 LEU CD2 B 1 JN3 C6 1.0 1.0 4.5 57 57 A 23 LEU CD1 B 1 JN3 C6 1.0 2.0 5.5 58 58 A 18 LEU CD2 B 1 JN3 C7 1.0 3.0 6.5 59 59 A 21 LEU CD1 B 1 JN3 C7 1.0 4.0 6.5 60 60 A 21 LEU CD2 B 1 JN3 C7 1.0 2.0 4.5 61 61 A 23 LEU CD1 B 1 JN3 C7 1.0 2.0 5.5 62 62 B 1 JN3 C7 A 23 LEU CD2 1.0 3.0 6.5 63 63 A 18 LEU CD2 B 1 JN3 C8 1.0 3.0 5.5 64 64 A 23 LEU CD1 B 1 JN3 C8 1.0 2.0 5.5 65 65 A 14 TYR CE1 B 1 JN3 C11 1.0 2.0 5.5 66 66 A 18 LEU CD2 B 1 JN3 C11 1.0 2.0 5.5 67 67 A 14 TYR CE1 B 1 JN3 C12 1.0 3.0 6.5 68 68 A 31 ALA CB B 1 JN3 C12 1.0 2.0 5.5 69 69 A 34 ILE CG2 B 1 JN3 C12 1.0 2.0 5.5 70 70 B 1 JN3 C12 A 36 PRO CB 1.0 2.0 5.5 71 71 A 36 PRO CG B 1 JN3 C12 1.0 2.0 5.5 72 72 A 73 MET CB B 1 JN3 C12 1.0 2.0 5.5 73 73 A 73 MET CE B 1 JN3 C12 1.0 2.0 5.5 74 74 A 23 LEU CD1 B 1 JN3 C14 1.0 2.0 5.5 75 75 A 73 MET CB B 1 JN3 C14 1.0 2.0 5.5 76 76 A 23 LEU CD1 B 1 JN3 C15 1.0 3.0 6.5 77 77 A 23 LEU CD2 B 1 JN3 C15 1.0 2.0 5.5 78 78 A 27 LEU CD1 B 1 JN3 C15 1.0 3.0 5.5 79 79 A 27 LEU CD2 B 1 JN3 C15 1.0 3.0 5.5 80 80 B 1 JN3 C15 A 72 THR CB 1.0 3.0 6.5 81 81 A 73 MET CB B 1 JN3 C15 1.0 1.0 4.5 82 82 B 1 JN3 C15 A 73 MET CG 1.0 2.0 5.5 83 83 A 73 MET CE B 1 JN3 C15 1.0 2.0 5.5 84 84 B 1 JN3 C15 A 74 ASP CA 1.0 2.0 4.5 85 85 A 74 ASP CB B 1 JN3 C15 1.0 2.0 4.5 86 86 A 23 LEU CD2 B 1 JN3 C16 1.0 3.0 6.5 87 87 A 27 LEU CD2 B 1 JN3 C16 1.0 2.0 5.5 88 88 B 1 JN3 C16 A 73 MET CA 1.0 3.0 6.5 89 89 A 73 MET CB B 1 JN3 C16 1.0 2.0 5.5 90 90 A 73 MET CG B 1 JN3 C16 1.0 2.0 5.5 91 91 A 73 MET CE B 1 JN3 C16 1.0 2.0 5.5 92 92 A 74 ASP CA B 1 JN3 C16 1.0 2.0 5.5 93 93 A 74 ASP CB B 1 JN3 C16 1.0 2.0 5.5 94 94 A 27 LEU CD1 B 1 JN3 C17 1.0 2.0 5.5 95 95 A 34 ILE CD1 B 1 JN3 C17 1.0 2.0 5.5 96 96 A 53 THR CG2 B 1 JN3 C17 1.0 3.0 6.5 97 97 A 73 MET CA B 1 JN3 C17 1.0 3.0 5.5 98 98 A 73 MET CB B 1 JN3 C17 1.0 2.0 4.5 99 99 A 73 MET CG B 1 JN3 C17 1.0 2.0 5.5 100 100 A 73 MET CE B 1 JN3 C17 1.0 3.0 5.5 101 101 A 74 ASP CB B 1 JN3 C17 1.0 2.0 5.5 102 102 A 27 LEU CD1 B 1 JN3 C20 1.0 2.0 5.5 103 103 A 31 ALA CB B 1 JN3 C20 1.0 2.0 5.5 104 104 A 34 ILE CD1 B 1 JN3 C20 1.0 3.0 6.5 105 105 A 73 MET CB B 1 JN3 C20 1.0 1.0 4.5 106 106 A 73 MET CE B 1 JN3 C20 1.0 2.0 5.5 107 107 A 74 ASP CA B 1 JN3 C20 1.0 2.0 5.5 108 108 A 27 LEU CD1 B 1 JN3 C22 1.0 2.0 4.5 109 109 A 27 LEU CD2 B 1 JN3 C22 1.0 2.0 5.5 110 110 B 1 JN3 C22 A 55 ARG CD 1.0 2.0 5.5 111 111 A 73 MET CB B 1 JN3 C22 1.0 2.0 5.5 112 112 A 73 MET CE B 1 JN3 C22 1.0 2.0 5.5 113 113 A 31 ALA CB B 1 JN3 C23 1.0 2.0 5.5 114 114 A 34 ILE CD1 B 1 JN3 C23 1.0 2.0 5.5 115 115 A 53 THR CG2 B 1 JN3 C23 1.0 3.0 6.5 116 116 A 55 ARG CD B 1 JN3 C23 1.0 4.0 7.5 117 117 A 27 LEU CD1 B 1 JN3 C23 1.0 2.0 5.5 118 118 3 1 JN3 C18 A 70 ILE CA 1.0 3.0 6.5 119 119 3 1 JN3 C18 A 70 ILE CB 1.0 3.0 6.5 120 120 3 1 JN3 C18 A 72 THR CG2 1.0 3.0 6.5 121 121 3 1 JN3 C18 A 78 LEU CB 1.0 3.0 6.5 122 122 3 1 JN3 C18 A 78 LEU CD1 1.0 2.0 4.5 123 123 3 1 JN3 C18 A 80 CYS CB 1.0 2.0 5.5 124 124 3 1 JN3 C18 A 91 THR CB 1.0 2.0 5.5 125 125 3 1 JN3 C18 A 91 THR CG2 1.0 2.0 4.5 126 126 3 1 JN3 C18 A 96 PHE CE2 1.0 2.0 4.5 127 127 3 1 JN3 C18 A 96 PHE CZ 1.0 3.0 6.5 128 128 3 1 JN3 C18 A 98 HIS CB 1.0 3.0 6.5 129 129 3 1 JN3 C19 A 68 ALA CB 1.0 3.0 6.5 130 130 3 1 JN3 C19 A 62 PHE CE1 1.0 3.0 6.5 131 131 3 1 JN3 C19 A 62 PHE CZ 1.0 3.0 6.5 132 132 A 70 ILE CB 3 1 JN3 C19 1.0 2.0 5.5 133 133 3 1 JN3 C19 A 70 ILE CG1 1.0 2.0 5.5 134 134 3 1 JN3 C19 A 70 ILE CG2 1.0 2.0 4.5 135 135 3 1 JN3 C19 A 70 ILE CD1 1.0 2.0 4.5 136 136 A 80 CYS CB 3 1 JN3 C19 1.0 2.0 5.5 137 137 3 1 JN3 C19 A 82 VAL CG1 1.0 2.0 5.5 138 138 3 1 JN3 C19 A 82 VAL CG2 1.0 2.0 4.5 139 139 A 91 THR CG2 3 1 JN3 C19 1.0 2.0 4.5 140 140 A 17 PHE CZ 3 1 JN3 C21 1.0 2.0 5.5 141 141 A 21 LEU CD1 3 1 JN3 C21 1.0 3.0 5.5 142 142 A 72 THR CG2 3 1 JN3 C21 1.0 3.0 6.5 143 143 A 78 LEU CD1 3 1 JN3 C21 1.0 2.0 5.5 144 144 3 1 JN3 C21 A 78 LEU CD2 1.0 3.0 6.5 145 145 A 91 THR CG2 3 1 JN3 C21 1.0 3.0 6.5 146 146 3 1 JN3 C21 A 96 PHE CB 1.0 2.0 5.5 147 147 A 96 PHE CE2 3 1 JN3 C21 1.0 2.0 4.5 148 148 3 1 JN3 C21 A 98 HIS CA 1.0 2.0 5.5 149 149 A 98 HIS CB 3 1 JN3 C21 1.0 2.0 5.5 150 150 3 1 JN3 C21 A 98 HIS CD2 1.0 2.0 5.5 151 151 A 111 ILE CG2 3 1 JN3 C21 1.0 2.0 4.5 152 152 A 111 ILE CD1 3 1 JN3 C21 1.0 3.0 5.5 153 153 3 1 JN3 C1 A 49 VAL CG2 1.0 3.0 5.5 154 154 A 62 PHE CZ 3 1 JN3 C1 1.0 3.0 5.5 155 155 A 62 PHE CE1 3 1 JN3 C1 1.0 3.0 5.5 156 156 A 82 VAL CG1 3 1 JN3 C1 1.0 3.0 5.5 157 157 A 82 VAL CG2 3 1 JN3 C1 1.0 2.0 4.5 158 158 A 91 THR CB 3 1 JN3 C1 1.0 2.0 4.5 159 159 A 91 THR CG2 3 1 JN3 C1 1.0 2.0 4.5 160 160 A 98 HIS CB 3 1 JN3 C1 1.0 3.0 5.5 161 161 A 98 HIS CD2 3 1 JN3 C1 1.0 3.0 5.5 162 162 A 49 VAL CG2 3 1 JN3 C2 1.0 3.0 5.5 163 163 A 82 VAL CG2 3 1 JN3 C2 1.0 3.0 5.5 164 164 3 1 JN3 C2 A 89 LEU CG 1.0 3.0 5.5 165 165 3 1 JN3 C2 A 89 LEU CD1 1.0 3.0 6.5 166 166 3 1 JN3 C2 A 89 LEU CD2 1.0 3.0 5.5 167 167 3 1 JN3 C2 A 98 HIS CE1 1.0 2.0 4.5 168 168 3 1 JN3 C3 A 49 VAL CB 1.0 3.0 6.5 169 169 3 1 JN3 C3 A 49 VAL CG1 1.0 2.0 4.5 170 170 A 49 VAL CG2 3 1 JN3 C3 1.0 2.0 4.5 171 171 A 62 PHE CE1 3 1 JN3 C3 1.0 3.0 6.5 172 172 A 62 PHE CZ 3 1 JN3 C3 1.0 2.0 4.5 173 173 A 82 VAL CG1 3 1 JN3 C3 1.0 2.0 5.5 174 174 A 82 VAL CG2 3 1 JN3 C3 1.0 4.0 7.5 175 175 A 89 LEU CD1 3 1 JN3 C3 1.0 3.0 6.5 176 176 A 89 LEU CD2 3 1 JN3 C3 1.0 2.0 5.5 177 177 A 70 ILE CG2 3 1 JN3 C7 1.0 2.0 4.5 178 178 A 70 ILE CD1 3 1 JN3 C7 1.0 2.0 4.5 179 179 3 1 JN3 C7 A 72 THR CA 1.0 3.0 6.5 180 180 A 72 THR CG2 3 1 JN3 C7 1.0 3.0 6.5 181 181 A 49 VAL CG1 3 1 JN3 C4 1.0 3.0 5.5 182 182 A 49 VAL CG2 3 1 JN3 C4 1.0 3.0 5.5 183 183 A 49 VAL CB 3 1 JN3 C5 1.0 3.0 5.5 184 184 A 49 VAL CG1 3 1 JN3 C5 1.0 3.0 5.5 185 185 A 49 VAL CG2 3 1 JN3 C5 1.0 3.0 5.5 186 186 A 49 VAL CB 3 1 JN3 C6 1.0 3.0 5.5 187 187 3 1 JN3 C6 A 60 ASN CB 1.0 3.0 5.5 188 188 A 70 ILE CG2 3 1 JN3 C6 1.0 3.0 5.5 189 189 A 70 ILE CD1 3 1 JN3 C6 1.0 2.0 4.5 190 190 A 70 ILE CG2 3 1 JN3 C8 1.0 3.0 5.5 191 191 A 70 ILE CD1 3 1 JN3 C8 1.0 3.0 5.5 192 192 A 82 VAL CG2 3 1 JN3 C11 1.0 3.0 5.5 193 193 A 89 LEU CD2 3 1 JN3 C11 1.0 3.0 5.5 194 194 A 91 THR CB 3 1 JN3 C11 1.0 2.0 4.5 195 195 A 91 THR CG2 3 1 JN3 C11 1.0 2.0 4.5 196 196 A 98 HIS CB 3 1 JN3 C11 1.0 2.0 4.5 197 197 A 98 HIS CD2 3 1 JN3 C11 1.0 3.0 5.5 198 198 A 111 ILE CD1 3 1 JN3 C11 1.0 3.0 6.5 199 199 3 1 JN3 C12 A 96 PHE CE1 1.0 3.0 5.5 200 200 A 111 ILE CD1 3 1 JN3 C12 1.0 3.0 5.5 201 201 A 70 ILE CG2 3 1 JN3 C15 1.0 2.0 4.5 202 202 A 70 ILE CD1 3 1 JN3 C15 1.0 3.0 5.5 203 203 A 72 THR CA 3 1 JN3 C15 1.0 3.0 5.5 204 204 A 72 THR CB 3 1 JN3 C15 1.0 3.0 5.5 205 205 A 72 THR CG2 3 1 JN3 C15 1.0 3.0 5.5 206 206 A 78 LEU CD1 3 1 JN3 C15 1.0 3.0 5.5 207 207 A 78 LEU CD2 3 1 JN3 C15 1.0 2.0 5.5 208 208 A 72 THR CB 3 1 JN3 C16 1.0 3.0 5.5 209 209 A 72 THR CG2 3 1 JN3 C16 1.0 2.0 4.5 210 210 A 78 LEU CD1 3 1 JN3 C16 1.0 3.0 5.5 211 211 A 78 LEU CD2 3 1 JN3 C16 1.0 3.0 5.5 212 212 A 96 PHE CE2 3 1 JN3 C16 1.0 3.0 5.5 213 213 3 1 JN3 C22 A 76 LYS CD 1.0 3.0 5.5 214 214 A 21 LEU CD1 3 1 JN3 C23 1.0 3.0 5.5 215 215 A 21 LEU CD2 3 1 JN3 C23 1.0 3.0 5.5 216 216 3 1 JN3 C23 A 96 PHE CD2 1.0 3.0 5.5 217 217 B 1 JN3 O3 3 1 JN3 O7 1.0 3.7 4.0 218 218 3 1 JN3 O26 A 76 LYS NZ 1.0 2.8 3.1 219 219 A 39 GLU OE2 A 52 LYS NZ 1.0 2.8 3.1 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _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 4 GLY H A 40 ILE O 1.0 1.82 2.02 2 2 A 40 ILE O A 4 GLY N 1.0 2.52 3.02 3 3 A 40 ILE H A 4 GLY O 1.0 1.90 2.10 4 4 A 4 GLY O A 40 ILE N 1.0 2.60 3.10 5 5 A 6 TRP H A 38 VAL O 1.0 1.70 1.90 6 6 A 38 VAL O A 6 TRP N 1.0 2.40 2.90 7 7 A 38 VAL H A 6 TRP O 1.0 1.64 1.84 8 8 A 6 TRP O A 38 VAL N 1.0 2.34 2.84 9 9 A 8 VAL H A 36 PRO O 1.0 2.20 2.40 10 10 A 36 PRO O A 8 VAL N 1.0 2.90 3.40 11 11 A 7 GLN H A 123 LYS O 1.0 1.78 1.98 12 12 A 123 LYS O A 7 GLN N 1.0 2.48 2.98 13 13 A 123 LYS H A 7 GLN O 1.0 2.05 2.25 14 14 A 7 GLN O A 123 LYS N 1.0 2.75 3.25 15 15 A 9 TYR H A 121 ARG O 1.0 1.75 1.95 16 16 A 121 ARG O A 9 TYR N 1.0 2.45 2.95 17 17 A 121 ARG H A 10 ALA O 1.0 1.70 1.90 18 18 A 10 ALA O A 121 ARG N 1.0 2.40 2.90 19 19 A 10 ALA H A 121 ARG O 1.0 2.60 2.80 20 20 A 121 ARG O A 10 ALA N 1.0 3.30 3.80 21 21 A 12 GLU H A 119 ILE O 1.0 2.84 3.04 22 22 A 119 ILE O A 12 GLU N 1.0 3.54 4.04 23 23 A 119 ILE H A 12 GLU O 1.0 3.20 3.40 24 24 A 12 GLU O A 119 ILE N 1.0 3.90 4.40 25 25 A 17 PHE H A 13 ASN O 1.0 2.25 2.45 26 26 A 13 ASN O A 17 PHE N 1.0 2.95 3.45 27 27 A 18 LEU H A 14 TYR O 1.0 1.88 2.08 28 28 A 14 TYR O A 18 LEU N 1.0 2.58 3.08 29 29 A 19 LYS H A 15 GLU O 1.0 1.76 1.96 30 30 A 15 GLU O A 19 LYS N 1.0 2.46 2.96 31 31 A 20 ALA H A 16 GLU O 1.0 1.84 2.04 32 32 A 16 GLU O A 20 ALA N 1.0 2.54 3.04 33 33 A 21 LEU H A 17 PHE O 1.0 1.98 2.18 34 34 A 17 PHE O A 21 LEU N 1.0 2.68 3.18 35 35 A 22 ALA H A 18 LEU O 1.0 2.58 2.78 36 36 A 18 LEU O A 22 ALA N 1.0 3.28 3.78 37 37 A 28 ILE H A 24 PRO O 1.0 1.87 2.07 38 38 A 24 PRO O A 28 ILE N 1.0 2.57 3.07 39 39 A 29 LYS H A 25 GLU O 1.0 1.87 2.07 40 40 A 25 GLU O A 29 LYS N 1.0 2.57 3.07 41 41 A 30 MET H A 26 ASP O 1.0 2.84 3.04 42 42 A 26 ASP O A 30 MET N 1.0 2.99 3.49 43 43 A 31 ALA H A 27 LEU O 1.0 1.99 2.19 44 44 A 27 LEU O A 31 ALA N 1.0 2.69 3.19 45 45 A 32 ARG H A 28 ILE O 1.0 1.88 2.08 46 46 A 28 ILE O A 32 ARG N 1.0 2.58 3.08 47 47 A 34 ILE H A 31 ALA O 1.0 2.00 2.20 48 48 A 31 ALA O A 34 ILE N 1.0 2.70 3.20 49 49 A 37 ILE H A 52 LYS O 1.0 2.12 2.32 50 50 A 52 LYS O A 37 ILE N 1.0 2.82 3.32 51 51 A 52 LYS H A 37 ILE O 1.0 1.90 2.10 52 52 A 37 ILE O A 52 LYS N 1.0 2.60 3.10 53 53 A 39 GLU H A 50 THR O 1.0 2.24 2.44 54 54 A 50 THR O A 39 GLU N 1.0 2.94 3.44 55 55 A 50 THR H A 39 GLU O 1.0 1.97 2.17 56 56 A 39 GLU O A 50 THR N 1.0 2.67 3.17 57 57 A 41 GLN H A 48 VAL O 1.0 2.36 2.56 58 58 A 48 VAL O A 41 GLN N 1.0 3.06 3.56 59 59 A 48 VAL H A 41 GLN O 1.0 2.40 2.60 60 60 A 41 GLN O A 48 VAL N 1.0 3.10 3.60 61 61 A 43 LYS H A 46 ASP O 1.0 1.90 2.10 62 62 A 46 ASP O A 43 LYS N 1.0 2.60 3.10 63 63 A 46 ASP H A 43 LYS O 1.0 2.28 2.48 64 64 A 43 LYS O A 46 ASP N 1.0 2.98 3.48 65 65 A 47 PHE H A 62 PHE O 1.0 1.77 1.97 66 66 A 62 PHE O A 47 PHE N 1.0 2.47 2.97 67 67 A 62 PHE H A 47 PHE O 1.0 2.13 2.33 68 68 A 47 PHE O A 62 PHE N 1.0 2.83 3.33 69 69 A 49 VAL H A 60 ASN O 1.0 2.25 2.45 70 70 A 60 ASN O A 49 VAL N 1.0 2.95 3.45 71 71 A 60 ASN H A 49 VAL O 1.0 1.66 1.86 72 72 A 49 VAL O A 60 ASN N 1.0 2.36 2.86 73 73 A 51 SER H A 58 VAL O 1.0 2.22 2.42 74 74 A 58 VAL O A 51 SER N 1.0 2.92 3.42 75 75 A 58 VAL H A 51 SER O 1.0 1.63 1.83 76 76 A 51 SER O A 58 VAL N 1.0 2.33 2.83 77 77 A 53 THR H A 56 GLN O 1.0 1.57 1.77 78 78 A 56 GLN O A 53 THR N 1.0 2.27 2.77 79 79 A 56 GLN H A 53 THR O 1.0 2.83 3.03 80 80 A 53 THR O A 56 GLN N 1.0 3.53 4.03 81 81 A 66 LYS H A 63 THR O 1.0 2.06 2.26 82 82 A 63 THR O A 66 LYS N 1.0 2.76 3.26 83 83 A 65 GLY H A 82 VAL O 1.0 2.06 2.26 84 84 A 82 VAL O A 65 GLY N 1.0 2.76 3.26 85 85 A 68 ALA H A 80 CYS O 1.0 2.02 2.22 86 86 A 80 CYS O A 68 ALA N 1.0 2.72 3.22 87 87 A 80 CYS H A 68 ALA O 1.0 2.29 2.49 88 88 A 68 ALA O A 80 CYS N 1.0 2.99 3.49 89 89 A 70 ILE H A 78 LEU O 1.0 1.47 1.67 90 90 A 78 LEU O A 70 ILE N 1.0 2.17 2.67 91 91 A 78 LEU H A 70 ILE O 1.0 2.00 2.20 92 92 A 70 ILE O A 78 LEU N 1.0 2.70 3.20 93 93 A 72 THR H A 76 LYS O 1.0 1.82 2.02 94 94 A 76 LYS O A 72 THR N 1.0 2.52 3.02 95 95 A 76 LYS H A 72 THR O 1.0 3.36 3.56 96 96 A 72 THR O A 76 LYS N 1.0 4.06 4.56 97 97 A 83 HIS H A 90 VAL O 1.0 2.09 2.29 98 98 A 90 VAL O A 83 HIS N 1.0 2.79 3.29 99 99 A 90 VAL H A 83 HIS O 1.0 1.87 2.07 100 100 A 83 HIS O A 90 VAL N 1.0 2.57 3.07 101 101 A 85 ALA H A 88 LYS O 1.0 1.62 1.82 102 102 A 88 LYS O A 85 ALA N 1.0 2.32 2.82 103 103 A 88 LYS H A 85 ALA O 1.0 2.08 2.28 104 104 A 85 ALA O A 88 LYS N 1.0 2.78 3.28 105 105 A 89 LEU H A 100 GLN O 1.0 1.88 2.08 106 106 A 100 GLN O A 89 LEU N 1.0 2.58 3.08 107 107 A 91 THR H A 98 HIS O 1.0 1.96 2.16 108 108 A 98 HIS O A 91 THR N 1.0 2.66 3.16 109 109 A 98 HIS H A 91 THR O 1.0 2.25 2.45 110 110 A 91 THR O A 98 HIS N 1.0 2.95 3.45 111 111 A 93 SER H A 96 PHE O 1.0 1.60 1.80 112 112 A 96 PHE O A 93 SER N 1.0 2.30 2.80 113 113 A 96 PHE H A 93 SER O 1.0 3.19 3.39 114 114 A 93 SER O A 96 PHE N 1.0 3.89 4.39 115 115 A 97 SER H A 112 THR O 1.0 2.11 2.31 116 116 A 112 THR O A 97 SER N 1.0 2.81 3.31 117 117 A 112 THR H A 97 SER O 1.0 1.92 2.12 118 118 A 97 SER O A 112 THR N 1.0 2.62 3.12 119 119 A 99 GLU H A 110 THR O 1.0 2.03 2.23 120 120 A 110 THR O A 99 GLU N 1.0 2.73 3.23 121 121 A 110 THR H A 99 GLU O 1.0 1.63 1.83 122 122 A 99 GLU O A 110 THR N 1.0 2.33 2.83 123 123 A 101 GLU H A 108 VAL O 1.0 1.85 2.05 124 124 A 108 VAL O A 101 GLU N 1.0 2.55 3.05 125 125 A 108 VAL H A 101 GLU O 1.0 1.86 2.06 126 126 A 101 GLU O A 108 VAL N 1.0 2.56 3.06 127 127 A 103 LYS H A 106 GLU O 1.0 1.71 1.91 128 128 A 106 GLU O A 103 LYS N 1.0 2.41 2.91 129 129 A 106 GLU H A 103 LYS O 1.0 2.10 2.30 130 130 A 103 LYS O A 106 GLU N 1.0 2.80 3.30 131 131 A 124 ARG H A 105 ASN O 1.0 1.96 2.16 132 132 A 105 ASN O A 124 ARG N 1.0 2.66 3.16 133 133 A 107 MET H A 122 SER O 1.0 1.66 1.86 134 134 A 122 SER O A 107 MET N 1.0 2.36 2.86 135 135 A 122 SER H A 107 MET O 1.0 1.67 1.87 136 136 A 107 MET O A 122 SER N 1.0 2.37 2.87 137 137 A 109 GLU H A 120 ARG O 1.0 1.62 1.82 138 138 A 120 ARG O A 109 GLU N 1.0 2.32 2.82 139 139 A 120 ARG H A 109 GLU O 1.0 1.75 1.95 140 140 A 109 GLU O A 120 ARG N 1.0 2.45 2.95 141 141 A 111 ILE H A 118 LEU O 1.0 1.90 2.10 142 142 A 118 LEU O A 111 ILE N 1.0 2.60 3.10 143 143 A 118 LEU H A 111 ILE O 1.0 1.53 1.73 144 144 A 111 ILE O A 118 LEU N 1.0 2.23 2.73 145 145 A 113 PHE H A 116 VAL O 1.0 1.71 1.91 146 146 A 116 VAL O A 113 PHE N 1.0 2.41 2.91 147 147 A 116 VAL H A 113 PHE O 1.0 2.08 2.28 148 148 A 113 PHE O A 116 VAL N 1.0 2.78 3.28 149 149 A 120 ARG HH2x A 109 GLU OE1 1.0 2.00 2.30 150 150 A 120 ARG HH2x A 109 GLU OE2 1.0 2.00 2.30 151 151 A 55 ARG HH1x B 1 JN3 O25 1.0 2.00 2.30 152 152 A 55 ARG HH1y B 1 JN3 O26 1.0 2.00 2.30 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _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 104 GLY N A 104 GLY CA A 104 GLY C A 105 ASN N 1.0 -134.000 -106.000 PSI 2 2 A 35 LYS C A 36 PRO N A 36 PRO CA A 36 PRO C 1.0 -180.000 0.000 PHI 3 3 A 103 LYS C A 104 GLY N A 104 GLY CA A 104 GLY C 1.0 62.000 74.000 PHI 4 4 A 2 PHE C A 3 SER N A 3 SER CA A 3 SER C 1.0 -83.000 -43.000 PHI 5 5 A 2 PHE C A 3 SER N A 3 SER CA A 3 SER C 1.0 -180.000 0.000 PHI 6 6 A 2 PHE N A 2 PHE CA A 2 PHE C A 3 SER N 1.0 -49.000 -9.000 PSI 7 7 A 4 GLY C A 5 THR N A 5 THR CA A 5 THR C 1.0 -143.000 -79.000 PHI 8 8 A 4 GLY N A 4 GLY CA A 4 GLY C A 5 THR N 1.0 41.000 221.000 PSI 9 9 A 5 THR C A 6 TRP N A 6 TRP CA A 6 TRP C 1.0 -141.000 -93.000 PHI 10 10 A 5 THR N A 5 THR CA A 5 THR C A 6 TRP N 1.0 107.000 151.000 PSI 11 11 A 6 TRP N A 6 TRP CA A 6 TRP C A 7 GLN N 1.0 116.000 164.000 PSI 12 12 A 6 TRP C A 7 GLN N A 7 GLN CA A 7 GLN C 1.0 -150.000 -82.000 PHI 13 13 A 7 GLN N A 7 GLN CA A 7 GLN C A 8 VAL N 1.0 97.000 157.000 PSI 14 14 A 8 VAL C A 9 TYR N A 9 TYR CA A 9 TYR C 1.0 -158.000 -82.000 PHI 15 15 A 8 VAL N A 8 VAL CA A 8 VAL C A 9 TYR N 1.0 108.000 176.000 PSI 16 16 A 10 ALA C A 11 GLN N A 11 GLN CA A 11 GLN C 1.0 -163.000 -87.000 PHI 17 17 A 10 ALA N A 10 ALA CA A 10 ALA C A 11 GLN N 1.0 102.000 178.000 PSI 18 18 A 11 GLN C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -196.000 -60.000 PHI 19 19 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 ASN N 1.0 101.000 173.000 PSI 20 20 A 13 ASN C A 14 TYR N A 14 TYR CA A 14 TYR C 1.0 -75.000 -55.000 PHI 21 21 A 14 TYR C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -67.000 -59.000 PHI 22 22 A 14 TYR N A 14 TYR CA A 14 TYR C A 15 GLU N 1.0 -52.000 -32.000 PSI 23 23 A 15 GLU C A 16 GLU N A 16 GLU CA A 16 GLU C 1.0 -72.000 -56.000 PHI 24 24 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 GLU N 1.0 -50.000 -30.000 PSI 25 25 A 16 GLU C A 17 PHE N A 17 PHE CA A 17 PHE C 1.0 -74.000 -54.000 PHI 26 26 A 16 GLU N A 16 GLU CA A 16 GLU C A 17 PHE N 1.0 -51.000 -31.000 PSI 27 27 A 17 PHE C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -73.000 -11.000 PHI 28 28 A 17 PHE N A 17 PHE CA A 17 PHE C A 18 LEU N 1.0 -58.000 -34.000 PSI 29 29 A 18 LEU C A 19 LYS N A 19 LYS CA A 19 LYS C 1.0 -75.000 -55.000 PHI 30 30 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 LYS N 1.0 -56.000 -28.000 PSI 31 31 A 19 LYS C A 20 ALA N A 20 ALA CA A 20 ALA C 1.0 -75.000 -55.000 PHI 32 32 A 19 LYS N A 19 LYS CA A 19 LYS C A 20 ALA N 1.0 -54.000 -26.000 PSI 33 33 A 20 ALA C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -115.000 -63.000 PHI 34 34 A 20 ALA N A 20 ALA CA A 20 ALA C A 21 LEU N 1.0 -56.000 -4.000 PSI 35 35 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 ALA N 1.0 -24.000 32.000 PSI 36 36 A 21 LEU C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 37.000 93.000 PHI 37 37 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 PRO N 1.0 94.000 178.000 PSI 38 38 A 22 ALA C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -164.000 -40.000 PHI 39 39 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 LEU N 1.0 5.000 61.000 PSI 40 40 A 23 LEU C A 24 PRO N A 24 PRO CA A 24 PRO C 1.0 -75.000 -47.000 PHI 41 41 A 24 PRO C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -72.000 -40.000 PHI 42 42 A 24 PRO N A 24 PRO CA A 24 PRO C A 25 GLU N 1.0 122.000 170.000 PSI 43 43 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 ASP N 1.0 -62.000 -6.000 PSI 44 44 A 25 GLU C A 26 ASP N A 26 ASP CA A 26 ASP C 1.0 -70.000 -50.000 PHI 45 45 A 26 ASP C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -88.000 -46.000 PHI 46 46 A 26 ASP N A 26 ASP CA A 26 ASP C A 27 LEU N 1.0 -51.000 -31.000 PSI 47 47 A 27 LEU C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -68.000 -56.000 PHI 48 48 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 ILE N 1.0 -53.000 -33.000 PSI 49 49 A 28 ILE C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -79.000 -37.000 PHI 50 50 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 LYS N 1.0 -53.000 -33.000 PSI 51 51 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 MET N 1.0 -82.000 0.000 PSI 52 52 A 29 LYS C A 30 MET N A 30 MET CA A 30 MET C 1.0 -104.000 -22.000 PHI 53 53 A 30 MET N A 30 MET CA A 30 MET C A 31 ALA N 1.0 -61.000 -19.000 PSI 54 54 A 31 ALA C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -85.000 -49.000 PHI 55 55 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 ARG N 1.0 -77.000 5.000 PSI 56 56 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 ASP N 1.0 -62.000 0.000 PSI 57 57 A 32 ARG C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -124.000 -60.000 PHI 58 58 A 33 ASP C A 34 ILE N A 34 ILE CA A 34 ILE C 1.0 -130.000 -42.000 PHI 59 59 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 ILE N 1.0 -48.000 32.000 PSI 60 60 A 34 ILE C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -129.000 -41.000 PHI 61 61 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 LYS N 1.0 110.000 150.000 PSI 62 62 A 36 PRO N A 36 PRO CA A 36 PRO C A 37 ILE N 1.0 80.000 180.000 PSI 63 63 A 36 PRO C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -146.000 -94.000 PHI 64 64 A 37 ILE C A 38 VAL N A 38 VAL CA A 38 VAL C 1.0 -138.000 -98.000 PHI 65 65 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 VAL N 1.0 99.000 163.000 PSI 66 66 A 38 VAL C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -147.000 -85.000 PHI 67 67 A 38 VAL N A 38 VAL CA A 38 VAL C A 39 GLU N 1.0 113.000 145.000 PSI 68 68 A 39 GLU C A 40 ILE N A 40 ILE CA A 40 ILE C 1.0 -140.000 -96.000 PHI 69 69 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 ILE N 1.0 107.000 147.000 PSI 70 70 A 40 ILE C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -145.000 -77.000 PHI 71 71 A 40 ILE N A 40 ILE CA A 40 ILE C A 41 GLN N 1.0 110.000 146.000 PSI 72 72 A 41 GLN C A 42 GLN N A 42 GLN CA A 42 GLN C 1.0 -157.000 -53.000 PHI 73 73 A 41 GLN N A 41 GLN CA A 41 GLN C A 42 GLN N 1.0 96.000 140.000 PSI 74 74 A 42 GLN C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -156.000 -64.000 PHI 75 75 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 GLY N 1.0 72.000 156.000 PSI 76 76 A 42 GLN N A 42 GLN CA A 42 GLN C A 43 LYS N 1.0 97.000 157.000 PSI 77 77 A 43 LYS C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 47.000 89.000 PHI 78 78 A 44 GLY C A 45 ASP N A 45 ASP CA A 45 ASP C 1.0 -113.000 -89.000 PHI 79 79 A 44 GLY N A 44 GLY CA A 44 GLY C A 45 ASP N 1.0 -134.000 -106.000 PSI 80 80 A 45 ASP N A 45 ASP CA A 45 ASP C A 46 ASP N 1.0 -27.000 25.000 PSI 81 81 A 45 ASP C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -148.000 -60.000 PHI 82 82 A 46 ASP C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -155.000 -75.000 PHI 83 83 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 PHE N 1.0 98.000 158.000 PSI 84 84 A 47 PHE C A 48 VAL N A 48 VAL CA A 48 VAL C 1.0 -136.000 -100.000 PHI 85 85 A 47 PHE N A 47 PHE CA A 47 PHE C A 48 VAL N 1.0 112.000 172.000 PSI 86 86 A 48 VAL C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -151.000 -89.000 PHI 87 87 A 49 VAL C A 50 THR N A 50 THR CA A 50 THR C 1.0 -143.000 -81.000 PHI 88 88 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 THR N 1.0 105.000 147.000 PSI 89 89 A 50 THR C A 51 SER N A 51 SER CA A 51 SER C 1.0 -154.000 -72.000 PHI 90 90 A 50 THR N A 50 THR CA A 50 THR C A 51 SER N 1.0 93.000 155.000 PSI 91 91 A 51 SER C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -138.000 -90.000 PHI 92 92 A 51 SER N A 51 SER CA A 51 SER C A 52 LYS N 1.0 101.000 141.000 PSI 93 93 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 THR N 1.0 106.000 170.000 PSI 94 94 A 52 LYS C A 53 THR N A 53 THR CA A 53 THR C 1.0 -167.000 -71.000 PHI 95 95 A 53 THR N A 53 THR CA A 53 THR C A 54 PRO N 1.0 91.000 191.000 PSI 96 96 A 53 THR C A 54 PRO N A 54 PRO CA A 54 PRO C 1.0 -76.000 -44.000 PHI 97 97 A 54 PRO C A 55 ARG N A 55 ARG CA A 55 ARG C 1.0 -132.000 -64.000 PHI 98 98 A 54 PRO N A 54 PRO CA A 54 PRO C A 55 ARG N 1.0 -39.000 -3.000 PSI 99 99 A 55 ARG C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -172.000 -116.000 PHI 100 100 A 55 ARG N A 55 ARG CA A 55 ARG C A 56 GLN N 1.0 -42.000 34.000 PSI 101 101 A 56 GLN C A 57 THR N A 57 THR CA A 57 THR C 1.0 -141.000 -81.000 PHI 102 102 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 THR N 1.0 110.000 172.000 PSI 103 103 A 57 THR C A 58 VAL N A 58 VAL CA A 58 VAL C 1.0 -151.000 -95.000 PHI 104 104 A 57 THR N A 57 THR CA A 57 THR C A 58 VAL N 1.0 108.000 148.000 PSI 105 105 A 58 VAL C A 59 THR N A 59 THR CA A 59 THR C 1.0 -133.000 -81.000 PHI 106 106 A 58 VAL N A 58 VAL CA A 58 VAL C A 59 THR N 1.0 109.000 141.000 PSI 107 107 A 59 THR C A 60 ASN N A 60 ASN CA A 60 ASN C 1.0 -175.000 -95.000 PHI 108 108 A 59 THR N A 59 THR CA A 59 THR C A 60 ASN N 1.0 116.000 144.000 PSI 109 109 A 60 ASN C A 61 SER N A 61 SER CA A 61 SER C 1.0 -156.000 -92.000 PHI 110 110 A 60 ASN N A 60 ASN CA A 60 ASN C A 61 SER N 1.0 134.000 166.000 PSI 111 111 A 61 SER C A 62 PHE N A 62 PHE CA A 62 PHE C 1.0 -165.000 -123.000 PHI 112 112 A 61 SER N A 61 SER CA A 61 SER C A 62 PHE N 1.0 111.000 171.000 PSI 113 113 A 62 PHE C A 63 THR N A 63 THR CA A 63 THR C 1.0 -132.000 -84.000 PHI 114 114 A 62 PHE N A 62 PHE CA A 62 PHE C A 63 THR N 1.0 120.000 184.000 PSI 115 115 A 63 THR C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -125.000 -33.000 PHI 116 116 A 63 THR N A 63 THR CA A 63 THR C A 64 LEU N 1.0 106.000 154.000 PSI 117 117 A 64 LEU C A 65 GLY N A 65 GLY CA A 65 GLY C 1.0 63.000 103.000 PHI 118 118 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 GLY N 1.0 84.000 176.000 PSI 119 119 A 65 GLY C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -138.000 -56.000 PHI 120 120 A 65 GLY N A 65 GLY CA A 65 GLY C A 66 LYS N 1.0 -37.000 27.000 PSI 121 121 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 GLU N 1.0 102.000 158.000 PSI 122 122 A 66 LYS C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -98.000 -54.000 PHI 123 123 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 ALA N 1.0 112.000 144.000 PSI 124 124 A 67 GLU C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -132.000 -70.000 PHI 125 125 A 68 ALA C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -145.000 -69.000 PHI 126 126 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 ASP N 1.0 108.000 168.000 PSI 127 127 A 69 ASP C A 70 ILE N A 70 ILE CA A 70 ILE C 1.0 -131.000 -91.000 PHI 128 128 A 69 ASP N A 69 ASP CA A 69 ASP C A 70 ILE N 1.0 110.000 146.000 PSI 129 129 A 70 ILE C A 71 THR N A 71 THR CA A 71 THR C 1.0 -134.000 -74.000 PHI 130 130 A 70 ILE N A 70 ILE CA A 70 ILE C A 71 THR N 1.0 92.000 154.000 PSI 131 131 A 71 THR C A 72 THR N A 72 THR CA A 72 THR C 1.0 -110.000 -70.000 PHI 132 132 A 71 THR N A 71 THR CA A 71 THR C A 72 THR N 1.0 93.000 153.000 PSI 133 133 A 72 THR N A 72 THR CA A 72 THR C A 73 MET N 1.0 153.000 181.000 PSI 134 134 A 72 THR C A 73 MET N A 73 MET CA A 73 MET C 1.0 -84.000 -42.000 PHI 135 135 A 73 MET C A 74 ASP N A 74 ASP CA A 74 ASP C 1.0 -122.000 -60.000 PHI 136 136 A 73 MET N A 73 MET CA A 73 MET C A 74 ASP N 1.0 -34.000 -6.000 PSI 137 137 A 74 ASP C A 75 GLY N A 75 GLY CA A 75 GLY C 1.0 62.000 114.000 PHI 138 138 A 74 ASP N A 74 ASP CA A 74 ASP C A 75 GLY N 1.0 -24.000 24.000 PSI 139 139 A 75 GLY C A 76 LYS N A 76 LYS CA A 76 LYS C 1.0 -153.000 -41.000 PHI 140 140 A 75 GLY N A 75 GLY CA A 75 GLY C A 76 LYS N 1.0 -36.000 48.000 PSI 141 141 A 76 LYS C A 77 LYS N A 77 LYS CA A 77 LYS C 1.0 -150.000 -82.000 PHI 142 142 A 76 LYS N A 76 LYS CA A 76 LYS C A 77 LYS N 1.0 126.000 174.000 PSI 143 143 A 77 LYS C A 78 LEU N A 78 LEU CA A 78 LEU C 1.0 -169.000 -87.000 PHI 144 144 A 77 LYS N A 77 LYS CA A 77 LYS C A 78 LEU N 1.0 106.000 170.000 PSI 145 145 A 78 LEU N A 78 LEU CA A 78 LEU C A 79 LYS N 1.0 123.000 171.000 PSI 146 146 A 78 LEU C A 79 LYS N A 79 LYS CA A 79 LYS C 1.0 -156.000 -64.000 PHI 147 147 A 79 LYS C A 80 CYS N A 80 CYS CA A 80 CYS C 1.0 -178.000 -110.000 PHI 148 148 A 79 LYS N A 79 LYS CA A 79 LYS C A 80 CYS N 1.0 120.000 168.000 PSI 149 149 A 80 CYS N A 80 CYS CA A 80 CYS C A 81 THR N 1.0 117.000 169.000 PSI 150 150 A 80 CYS C A 81 THR N A 81 THR CA A 81 THR C 1.0 -127.000 -63.000 PHI 151 151 A 81 THR C A 82 VAL N A 82 VAL CA A 82 VAL C 1.0 -151.000 -69.000 PHI 152 152 A 81 THR N A 81 THR CA A 81 THR C A 82 VAL N 1.0 91.000 153.000 PSI 153 153 A 82 VAL N A 82 VAL CA A 82 VAL C A 83 HIS N 1.0 111.000 143.000 PSI 154 154 A 82 VAL C A 83 HIS N A 83 HIS CA A 83 HIS C 1.0 -175.000 -79.000 PHI 155 155 A 83 HIS N A 83 HIS CA A 83 HIS C A 84 LEU N 1.0 119.000 179.000 PSI 156 156 A 83 HIS C A 84 LEU N A 84 LEU CA A 84 LEU C 1.0 -149.000 -73.000 PHI 157 157 A 84 LEU C A 85 ALA N A 85 ALA CA A 85 ALA C 1.0 -174.000 -78.000 PHI 158 158 A 85 ALA N A 85 ALA CA A 85 ALA C A 86 ASN N 1.0 89.000 157.000 PSI 159 159 A 84 LEU N A 84 LEU CA A 84 LEU C A 85 ALA N 1.0 100.000 156.000 PSI 160 160 A 85 ALA C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 38.000 70.000 PHI 161 161 A 87 GLY C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -147.000 -83.000 PHI 162 162 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 LEU N 1.0 117.000 185.000 PSI 163 163 A 89 LEU C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -146.000 -90.000 PHI 164 164 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 VAL N 1.0 97.000 153.000 PSI 165 165 A 90 VAL C A 91 THR N A 91 THR CA A 91 THR C 1.0 -150.000 -82.000 PHI 166 166 A 90 VAL N A 90 VAL CA A 90 VAL C A 91 THR N 1.0 105.000 145.000 PSI 167 167 A 91 THR C A 92 LYS N A 92 LYS CA A 92 LYS C 1.0 -149.000 -85.000 PHI 168 168 A 91 THR N A 91 THR CA A 91 THR C A 92 LYS N 1.0 88.000 170.000 PSI 169 169 A 92 LYS C A 93 SER N A 93 SER CA A 93 SER C 1.0 -168.000 -64.000 PHI 170 170 A 92 LYS N A 92 LYS CA A 92 LYS C A 93 SER N 1.0 98.000 186.000 PSI 171 171 A 93 SER C A 94 GLU N A 94 GLU CA A 94 GLU C 1.0 -91.000 -29.000 PHI 172 172 A 94 GLU C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -136.000 -84.000 PHI 173 173 A 94 GLU N A 94 GLU CA A 94 GLU C A 95 LYS N 1.0 -57.000 -5.000 PSI 174 174 A 95 LYS C A 96 PHE N A 96 PHE CA A 96 PHE C 1.0 -183.000 -99.000 PHI 175 175 A 95 LYS N A 95 LYS CA A 95 LYS C A 96 PHE N 1.0 -26.000 30.000 PSI 176 176 A 96 PHE N A 96 PHE CA A 96 PHE C A 97 SER N 1.0 123.000 175.000 PSI 177 177 A 96 PHE C A 97 SER N A 97 SER CA A 97 SER C 1.0 -154.000 -106.000 PHI 178 178 A 97 SER C A 98 HIS N A 98 HIS CA A 98 HIS C 1.0 -167.000 -95.000 PHI 179 179 A 97 SER N A 97 SER CA A 97 SER C A 98 HIS N 1.0 106.000 158.000 PSI 180 180 A 98 HIS N A 98 HIS CA A 98 HIS C A 99 GLU N 1.0 106.000 168.000 PSI 181 181 A 98 HIS C A 99 GLU N A 99 GLU CA A 99 GLU C 1.0 -151.000 -99.000 PHI 182 182 A 99 GLU C A 100 GLN N A 100 GLN CA A 100 GLN C 1.0 -158.000 -98.000 PHI 183 183 A 99 GLU N A 99 GLU CA A 99 GLU C A 100 GLN N 1.0 102.000 158.000 PSI 184 184 A 100 GLN C A 101 GLU N A 101 GLU CA A 101 GLU C 1.0 -137.000 -101.000 PHI 185 185 A 100 GLN N A 100 GLN CA A 100 GLN C A 101 GLU N 1.0 106.000 158.000 PSI 186 186 A 101 GLU C A 102 VAL N A 102 VAL CA A 102 VAL C 1.0 -133.000 -97.000 PHI 187 187 A 101 GLU N A 101 GLU CA A 101 GLU C A 102 VAL N 1.0 99.000 161.000 PSI 188 188 A 102 VAL C A 103 LYS N A 103 LYS CA A 103 LYS C 1.0 -165.000 -93.000 PHI 189 189 A 103 LYS N A 103 LYS CA A 103 LYS C A 104 GLY N 1.0 72.000 152.000 PSI 190 190 A 102 VAL N A 102 VAL CA A 102 VAL C A 103 LYS N 1.0 110.000 142.000 PSI 191 191 A 104 GLY C A 105 ASN N A 105 ASN CA A 105 ASN C 1.0 -120.000 -72.000 PHI 192 192 A 105 ASN C A 106 GLU N A 106 GLU CA A 106 GLU C 1.0 -164.000 -108.000 PHI 193 193 A 105 ASN N A 105 ASN CA A 105 ASN C A 106 GLU N 1.0 -17.000 19.000 PSI 194 194 A 106 GLU C A 107 MET N A 107 MET CA A 107 MET C 1.0 -155.000 -99.000 PHI 195 195 A 106 GLU N A 106 GLU CA A 106 GLU C A 107 MET N 1.0 109.000 177.000 PSI 196 196 A 107 MET N A 107 MET CA A 107 MET C A 108 VAL N 1.0 115.000 143.000 PSI 197 197 A 107 MET C A 108 VAL N A 108 VAL CA A 108 VAL C 1.0 -136.000 -96.000 PHI 198 198 A 108 VAL C A 109 GLU N A 109 GLU CA A 109 GLU C 1.0 -151.000 -87.000 PHI 199 199 A 108 VAL N A 108 VAL CA A 108 VAL C A 109 GLU N 1.0 116.000 140.000 PSI 200 200 A 109 GLU N A 109 GLU CA A 109 GLU C A 110 THR N 1.0 109.000 157.000 PSI 201 201 A 110 THR N A 110 THR CA A 110 THR C A 111 ILE N 1.0 89.000 151.000 PSI 202 202 A 110 THR C A 111 ILE N A 111 ILE CA A 111 ILE C 1.0 -130.009 -94.009 PHI 203 203 A 111 ILE N A 111 ILE CA A 111 ILE C A 112 THR N 1.0 108.000 136.000 PSI 204 204 A 111 ILE C A 112 THR N A 112 THR CA A 112 THR C 1.0 -139.000 -91.000 PHI 205 205 A 112 THR C A 113 PHE N A 113 PHE CA A 113 PHE C 1.0 -173.000 -91.000 PHI 206 206 A 112 THR N A 112 THR CA A 112 THR C A 113 PHE N 1.0 113.000 145.000 PSI 207 207 A 113 PHE C A 114 GLY N A 114 GLY CA A 114 GLY C 1.0 33.000 73.000 PHI 208 208 A 113 PHE N A 113 PHE CA A 113 PHE C A 114 GLY N 1.0 96.000 144.000 PSI 209 209 A 114 GLY C A 115 GLY N A 115 GLY CA A 115 GLY C 1.0 63.000 99.000 PHI 210 210 A 114 GLY N A 114 GLY CA A 114 GLY C A 115 GLY N 1.0 21.000 63.000 PSI 211 211 A 115 GLY C A 116 VAL N A 116 VAL CA A 116 VAL C 1.0 -147.000 -59.000 PHI 212 212 A 115 GLY N A 115 GLY CA A 115 GLY C A 116 VAL N 1.0 -22.000 22.000 PSI 213 213 A 116 VAL N A 116 VAL CA A 116 VAL C A 117 THR N 1.0 117.000 157.000 PSI 214 214 A 116 VAL C A 117 THR N A 117 THR CA A 117 THR C 1.0 -142.000 -86.000 PHI 215 215 A 117 THR C A 118 LEU N A 118 LEU CA A 118 LEU C 1.0 -151.000 -83.000 PHI 216 216 A 117 THR N A 117 THR CA A 117 THR C A 118 LEU N 1.0 110.000 138.000 PSI 217 217 A 118 LEU C A 119 ILE N A 119 ILE CA A 119 ILE C 1.0 -131.000 -87.000 PHI 218 218 A 118 LEU N A 118 LEU CA A 118 LEU C A 119 ILE N 1.0 106.000 150.000 PSI 219 219 A 119 ILE N A 119 ILE CA A 119 ILE C A 120 ARG N 1.0 105.000 141.000 PSI 220 220 A 119 ILE C A 120 ARG N A 120 ARG CA A 120 ARG C 1.0 -148.000 -92.000 PHI 221 221 A 120 ARG C A 121 ARG N A 121 ARG CA A 121 ARG C 1.0 -147.000 -91.000 PHI 222 222 A 120 ARG N A 120 ARG CA A 120 ARG C A 121 ARG N 1.0 113.000 145.000 PSI 223 223 A 121 ARG C A 122 SER N A 122 SER CA A 122 SER C 1.0 -171.000 -91.000 PHI 224 224 A 121 ARG N A 121 ARG CA A 121 ARG C A 122 SER N 1.0 103.000 151.000 PSI 225 225 A 122 SER C A 123 LYS N A 123 LYS CA A 123 LYS C 1.0 -166.000 -86.000 PHI 226 226 A 122 SER N A 122 SER CA A 122 SER C A 123 LYS N 1.0 116.000 176.000 PSI 227 227 A 123 LYS C A 124 ARG N A 124 ARG CA A 124 ARG C 1.0 -83.000 -55.000 PHI 228 228 A 123 LYS N A 123 LYS CA A 123 LYS C A 124 ARG N 1.0 100.000 172.000 PSI 229 229 A 124 ARG N A 124 ARG CA A 124 ARG C A 125 VAL N 1.0 116.000 160.000 PSI 230 230 A 124 ARG C A 125 VAL N A 125 VAL CA A 125 VAL C 1.0 -180.000 0.000 PHI stop_ save_ save_CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 2 PHE C A 3 SER H 1.0 . . . 2 2 A 5 THR C A 6 TRP H 1.0 . . . 3 3 A 7 GLN C A 8 VAL H 1.0 . . . 4 4 A 9 TYR C A 10 ALA H 1.0 . . . 5 5 A 10 ALA C A 11 GLN H 1.0 . . . 6 6 A 11 GLN C A 12 GLU H 1.0 . . . 7 7 A 12 GLU C A 13 ASN H 1.0 . . . 8 8 A 14 TYR C A 15 GLU H 1.0 . . . 9 9 A 15 GLU C A 16 GLU H 1.0 . . . 10 10 A 16 GLU C A 17 PHE H 1.0 . . . 11 11 A 17 PHE C A 18 LEU H 1.0 . . . 12 12 A 19 LYS C A 20 ALA H 1.0 . . . 13 13 A 20 ALA C A 21 LEU H 1.0 . . . 14 14 A 22 ALA C A 23 LEU H 1.0 . . . 15 15 A 24 PRO C A 25 GLU H 1.0 . . . 16 16 A 25 GLU C A 26 ASP H 1.0 . . . 17 17 A 26 ASP C A 27 LEU H 1.0 . . . 18 18 A 29 LYS C A 30 MET H 1.0 . . . 19 19 A 30 MET C A 31 ALA H 1.0 . . . 20 20 A 31 ALA C A 32 ARG H 1.0 . . . 21 21 A 32 ARG C A 33 ASP H 1.0 . . . 22 22 A 33 ASP C A 34 ILE H 1.0 . . . 23 23 A 34 ILE C A 35 LYS H 1.0 . . . 24 24 A 37 ILE C A 38 VAL H 1.0 . . . 25 25 A 40 ILE C A 41 GLN H 1.0 . . . 26 26 A 41 GLN C A 42 GLN H 1.0 . . . 27 27 A 42 GLN C A 43 LYS H 1.0 . . . 28 28 A 44 GLY C A 45 ASP H 1.0 . . . 29 29 A 45 ASP C A 46 ASP H 1.0 . . . 30 30 A 46 ASP C A 47 PHE H 1.0 . . . 31 31 A 47 PHE C A 48 VAL H 1.0 . . . 32 32 A 48 VAL C A 49 VAL H 1.0 . . . 33 33 A 49 VAL C A 50 THR H 1.0 . . . 34 34 A 50 THR C A 51 SER H 1.0 . . . 35 35 A 51 SER C A 52 LYS H 1.0 . . . 36 36 A 54 PRO C A 55 ARG H 1.0 . . . 37 37 A 56 GLN C A 57 THR H 1.0 . . . 38 38 A 57 THR C A 58 VAL H 1.0 . . . 39 39 A 58 VAL C A 59 THR H 1.0 . . . 40 40 A 59 THR C A 60 ASN H 1.0 . . . 41 41 A 60 ASN C A 61 SER H 1.0 . . . 42 42 A 61 SER C A 62 PHE H 1.0 . . . 43 43 A 62 PHE C A 63 THR H 1.0 . . . 44 44 A 63 THR C A 64 LEU H 1.0 . . . 45 45 A 64 LEU C A 65 GLY H 1.0 . . . 46 46 A 65 GLY C A 66 LYS H 1.0 . . . 47 47 A 66 LYS C A 67 GLU H 1.0 . . . 48 48 A 67 GLU C A 68 ALA H 1.0 . . . 49 49 A 68 ALA C A 69 ASP H 1.0 . . . 50 50 A 70 ILE C A 71 THR H 1.0 . . . 51 51 A 71 THR C A 72 THR H 1.0 . . . 52 52 A 72 THR C A 73 MET H 1.0 . . . 53 53 A 74 ASP C A 75 GLY H 1.0 . . . 54 54 A 76 LYS C A 77 LYS H 1.0 . . . 55 55 A 77 LYS C A 78 LEU H 1.0 . . . 56 56 A 78 LEU C A 79 LYS H 1.0 . . . 57 57 A 81 THR C A 82 VAL H 1.0 . . . 58 58 A 82 VAL C A 83 HIS H 1.0 . . . 59 59 A 83 HIS C A 84 LEU H 1.0 . . . 60 60 A 84 LEU C A 85 ALA H 1.0 . . . 61 61 A 86 ASN C A 87 GLY H 1.0 . . . 62 62 A 88 LYS C A 89 LEU H 1.0 . . . 63 63 A 89 LEU C A 90 VAL H 1.0 . . . 64 64 A 91 THR C A 92 LYS H 1.0 . . . 65 65 A 92 LYS C A 93 SER H 1.0 . . . 66 66 A 93 SER C A 94 GLU H 1.0 . . . 67 67 A 94 GLU C A 95 LYS H 1.0 . . . 68 68 A 95 LYS C A 96 PHE H 1.0 . . . 69 69 A 97 SER C A 98 HIS H 1.0 . . . 70 70 A 98 HIS C A 99 GLU H 1.0 . . . 71 71 A 101 GLU C A 102 VAL H 1.0 . . . 72 72 A 106 GLU C A 107 MET H 1.0 . . . 73 73 A 107 MET C A 108 VAL H 1.0 . . . 74 74 A 108 VAL C A 109 GLU H 1.0 . . . 75 75 A 109 GLU C A 110 THR H 1.0 . . . 76 76 A 110 THR C A 111 ILE H 1.0 . . . 77 77 A 113 PHE C A 114 GLY H 1.0 . . . 78 78 A 114 GLY C A 115 GLY H 1.0 . . . 79 79 A 115 GLY C A 116 VAL H 1.0 . . . 80 80 A 116 VAL C A 117 THR H 1.0 . . . 81 81 A 117 THR C A 118 LEU H 1.0 . . . 82 82 A 118 LEU C A 119 ILE H 1.0 . . . 83 83 A 121 ARG C A 122 SER H 1.0 . . . 84 84 A 2 PHE N A 2 PHE H 1.0 . . . 85 85 A 3 SER N A 3 SER H 1.0 . . . 86 86 A 4 GLY N A 4 GLY H 1.0 . . . 87 87 A 5 THR N A 5 THR H 1.0 . . . 88 88 A 6 TRP N A 6 TRP H 1.0 . . . 89 89 A 8 VAL N A 8 VAL H 1.0 . . . 90 90 A 10 ALA N A 10 ALA H 1.0 . . . 91 91 A 14 TYR N A 14 TYR H 1.0 . . . 92 92 A 15 GLU N A 15 GLU H 1.0 . . . 93 93 A 16 GLU N A 16 GLU H 1.0 . . . 94 94 A 17 PHE N A 17 PHE H 1.0 . . . 95 95 A 18 LEU N A 18 LEU H 1.0 . . . 96 96 A 19 LYS N A 19 LYS H 1.0 . . . 97 97 A 20 ALA N A 20 ALA H 1.0 . . . 98 98 A 21 LEU N A 21 LEU H 1.0 . . . 99 99 A 22 ALA N A 22 ALA H 1.0 . . . 100 100 A 23 LEU N A 23 LEU H 1.0 . . . 101 101 A 25 GLU N A 25 GLU H 1.0 . . . 102 102 A 26 ASP N A 26 ASP H 1.0 . . . 103 103 A 27 LEU N A 27 LEU H 1.0 . . . 104 104 A 28 ILE N A 28 ILE H 1.0 . . . 105 105 A 29 LYS N A 29 LYS H 1.0 . . . 106 106 A 30 MET N A 30 MET H 1.0 . . . 107 107 A 31 ALA N A 31 ALA H 1.0 . . . 108 108 A 32 ARG N A 32 ARG H 1.0 . . . 109 109 A 33 ASP N A 33 ASP H 1.0 . . . 110 110 A 34 ILE N A 34 ILE H 1.0 . . . 111 111 A 35 LYS N A 35 LYS H 1.0 . . . 112 112 A 38 VAL N A 38 VAL H 1.0 . . . 113 113 A 39 GLU N A 39 GLU H 1.0 . . . 114 114 A 40 ILE N A 40 ILE H 1.0 . . . 115 115 A 41 GLN N A 41 GLN H 1.0 . . . 116 116 A 42 GLN N A 42 GLN H 1.0 . . . 117 117 A 45 ASP N A 45 ASP H 1.0 . . . 118 118 A 46 ASP N A 46 ASP H 1.0 . . . 119 119 A 48 VAL N A 48 VAL H 1.0 . . . 120 120 A 49 VAL N A 49 VAL H 1.0 . . . 121 121 A 50 THR N A 50 THR H 1.0 . . . 122 122 A 51 SER N A 51 SER H 1.0 . . . 123 123 A 52 LYS N A 52 LYS H 1.0 . . . 124 124 A 55 ARG N A 55 ARG H 1.0 . . . 125 125 A 56 GLN N A 56 GLN H 1.0 . . . 126 126 A 57 THR N A 57 THR H 1.0 . . . 127 127 A 58 VAL N A 58 VAL H 1.0 . . . 128 128 A 59 THR N A 59 THR H 1.0 . . . 129 129 A 60 ASN N A 60 ASN H 1.0 . . . 130 130 A 61 SER N A 61 SER H 1.0 . . . 131 131 A 62 PHE N A 62 PHE H 1.0 . . . 132 132 A 63 THR N A 63 THR H 1.0 . . . 133 133 A 64 LEU N A 64 LEU H 1.0 . . . 134 134 A 65 GLY N A 65 GLY H 1.0 . . . 135 135 A 66 LYS N A 66 LYS H 1.0 . . . 136 136 A 67 GLU N A 67 GLU H 1.0 . . . 137 137 A 69 ASP N A 69 ASP H 1.0 . . . 138 138 A 70 ILE N A 70 ILE H 1.0 . . . 139 139 A 71 THR N A 71 THR H 1.0 . . . 140 140 A 72 THR N A 72 THR H 1.0 . . . 141 141 A 73 MET N A 73 MET H 1.0 . . . 142 142 A 74 ASP N A 74 ASP H 1.0 . . . 143 143 A 75 GLY N A 75 GLY H 1.0 . . . 144 144 A 76 LYS N A 76 LYS H 1.0 . . . 145 145 A 77 LYS N A 77 LYS H 1.0 . . . 146 146 A 78 LEU N A 78 LEU H 1.0 . . . 147 147 A 79 LYS N A 79 LYS H 1.0 . . . 148 148 A 80 CYS N A 80 CYS H 1.0 . . . 149 149 A 81 THR N A 81 THR H 1.0 . . . 150 150 A 82 VAL N A 82 VAL H 1.0 . . . 151 151 A 83 HIS N A 83 HIS H 1.0 . . . 152 152 A 84 LEU N A 84 LEU H 1.0 . . . 153 153 A 85 ALA N A 85 ALA H 1.0 . . . 154 154 A 88 LYS N A 88 LYS H 1.0 . . . 155 155 A 89 LEU N A 89 LEU H 1.0 . . . 156 156 A 90 VAL N A 90 VAL H 1.0 . . . 157 157 A 91 THR N A 91 THR H 1.0 . . . 158 158 A 92 LYS N A 92 LYS H 1.0 . . . 159 159 A 93 SER N A 93 SER H 1.0 . . . 160 160 A 95 LYS N A 95 LYS H 1.0 . . . 161 161 A 96 PHE N A 96 PHE H 1.0 . . . 162 162 A 97 SER N A 97 SER H 1.0 . . . 163 163 A 98 HIS N A 98 HIS H 1.0 . . . 164 164 A 99 GLU N A 99 GLU H 1.0 . . . 165 165 A 100 GLN N A 100 GLN H 1.0 . . . 166 166 A 101 GLU N A 101 GLU H 1.0 . . . 167 167 A 102 VAL N A 102 VAL H 1.0 . . . 168 168 A 103 LYS N A 103 LYS H 1.0 . . . 169 169 A 106 GLU N A 106 GLU H 1.0 . . . 170 170 A 107 MET N A 107 MET H 1.0 . . . 171 171 A 108 VAL N A 108 VAL H 1.0 . . . 172 172 A 109 GLU N A 109 GLU H 1.0 . . . 173 173 A 111 ILE N A 111 ILE H 1.0 . . . 174 174 A 112 THR N A 112 THR H 1.0 . . . 175 175 A 113 PHE N A 113 PHE H 1.0 . . . 176 176 A 114 GLY N A 114 GLY H 1.0 . . . 177 177 A 116 VAL N A 116 VAL H 1.0 . . . 178 178 A 117 THR N A 117 THR H 1.0 . . . 179 179 A 118 LEU N A 118 LEU H 1.0 . . . 180 180 A 119 ILE N A 119 ILE H 1.0 . . . 181 181 A 121 ARG N A 121 ARG H 1.0 . . . 182 182 A 122 SER N A 122 SER H 1.0 . . . 183 183 A 123 LYS N A 123 LYS H 1.0 . . . 184 184 A 124 ARG N A 124 ARG H 1.0 . . . 185 185 A 125 VAL N A 125 VAL H 1.0 . . . 186 186 A 5 THR HA A 5 THR CA 1.0 . . . 187 187 A 6 TRP HA A 6 TRP CA 1.0 . . . 188 188 A 9 TYR HA A 9 TYR CA 1.0 . . . 189 189 A 11 GLN HA A 11 GLN CA 1.0 . . . 190 190 A 12 GLU HA A 12 GLU CA 1.0 . . . 191 191 A 14 TYR HA A 14 TYR CA 1.0 . . . 192 192 A 15 GLU HA A 15 GLU CA 1.0 . . . 193 193 A 16 GLU HA A 16 GLU CA 1.0 . . . 194 194 A 17 PHE HA A 17 PHE CA 1.0 . . . 195 195 A 18 LEU HA A 18 LEU CA 1.0 . . . 196 196 A 19 LYS HA A 19 LYS CA 1.0 . . . 197 197 A 20 ALA HA A 20 ALA CA 1.0 . . . 198 198 A 21 LEU HA A 21 LEU CA 1.0 . . . 199 199 A 22 ALA HA A 22 ALA CA 1.0 . . . 200 200 A 23 LEU HA A 23 LEU CA 1.0 . . . 201 201 A 24 PRO HA A 24 PRO CA 1.0 . . . 202 202 A 25 GLU HA A 25 GLU CA 1.0 . . . 203 203 A 28 ILE HA A 28 ILE CA 1.0 . . . 204 204 A 29 LYS HA A 29 LYS CA 1.0 . . . 205 205 A 31 ALA HA A 31 ALA CA 1.0 . . . 206 206 A 32 ARG HA A 32 ARG CA 1.0 . . . 207 207 A 33 ASP HA A 33 ASP CA 1.0 . . . 208 208 A 34 ILE HA A 34 ILE CA 1.0 . . . 209 209 A 35 LYS HA A 35 LYS CA 1.0 . . . 210 210 A 37 ILE HA A 37 ILE CA 1.0 . . . 211 211 A 38 VAL HA A 38 VAL CA 1.0 . . . 212 212 A 39 GLU HA A 39 GLU CA 1.0 . . . 213 213 A 40 ILE HA A 40 ILE CA 1.0 . . . 214 214 A 41 GLN HA A 41 GLN CA 1.0 . . . 215 215 A 42 GLN HA A 42 GLN CA 1.0 . . . 216 216 A 43 LYS HA A 43 LYS CA 1.0 . . . 217 217 A 45 ASP HA A 45 ASP CA 1.0 . . . 218 218 A 46 ASP HA A 46 ASP CA 1.0 . . . 219 219 A 47 PHE HA A 47 PHE CA 1.0 . . . 220 220 A 48 VAL HA A 48 VAL CA 1.0 . . . 221 221 A 49 VAL HA A 49 VAL CA 1.0 . . . 222 222 A 50 THR HA A 50 THR CA 1.0 . . . 223 223 A 51 SER HA A 51 SER CA 1.0 . . . 224 224 A 52 LYS HA A 52 LYS CA 1.0 . . . 225 225 A 53 THR HA A 53 THR CA 1.0 . . . 226 226 A 54 PRO HA A 54 PRO CA 1.0 . . . 227 227 A 55 ARG HA A 55 ARG CA 1.0 . . . 228 228 A 56 GLN HA A 56 GLN CA 1.0 . . . 229 229 A 57 THR HA A 57 THR CA 1.0 . . . 230 230 A 58 VAL HA A 58 VAL CA 1.0 . . . 231 231 A 59 THR HA A 59 THR CA 1.0 . . . 232 232 A 60 ASN HA A 60 ASN CA 1.0 . . . 233 233 A 61 SER HA A 61 SER CA 1.0 . . . 234 234 A 62 PHE HA A 62 PHE CA 1.0 . . . 235 235 A 63 THR HA A 63 THR CA 1.0 . . . 236 236 A 67 GLU HA A 67 GLU CA 1.0 . . . 237 237 A 68 ALA HA A 68 ALA CA 1.0 . . . 238 238 A 69 ASP HA A 69 ASP CA 1.0 . . . 239 239 A 70 ILE HA A 70 ILE CA 1.0 . . . 240 240 A 71 THR HA A 71 THR CA 1.0 . . . 241 241 A 72 THR HA A 72 THR CA 1.0 . . . 242 242 A 73 MET HA A 73 MET CA 1.0 . . . 243 243 A 76 LYS HA A 76 LYS CA 1.0 . . . 244 244 A 77 LYS HA A 77 LYS CA 1.0 . . . 245 245 A 78 LEU HA A 78 LEU CA 1.0 . . . 246 246 A 79 LYS HA A 79 LYS CA 1.0 . . . 247 247 A 80 CYS HA A 80 CYS CA 1.0 . . . 248 248 A 81 THR HA A 81 THR CA 1.0 . . . 249 249 A 82 VAL HA A 82 VAL CA 1.0 . . . 250 250 A 83 HIS HA A 83 HIS CA 1.0 . . . 251 251 A 84 LEU HA A 84 LEU CA 1.0 . . . 252 252 A 85 ALA HA A 85 ALA CA 1.0 . . . 253 253 A 86 ASN HA A 86 ASN CA 1.0 . . . 254 254 A 88 LYS HA A 88 LYS CA 1.0 . . . 255 255 A 89 LEU HA A 89 LEU CA 1.0 . . . 256 256 A 90 VAL HA A 90 VAL CA 1.0 . . . 257 257 A 91 THR HA A 91 THR CA 1.0 . . . 258 258 A 92 LYS HA A 92 LYS CA 1.0 . . . 259 259 A 93 SER HA A 93 SER CA 1.0 . . . 260 260 A 94 GLU HA A 94 GLU CA 1.0 . . . 261 261 A 95 LYS HA A 95 LYS CA 1.0 . . . 262 262 A 96 PHE HA A 96 PHE CA 1.0 . . . 263 263 A 97 SER HA A 97 SER CA 1.0 . . . 264 264 A 98 HIS HA A 98 HIS CA 1.0 . . . 265 265 A 99 GLU HA A 99 GLU CA 1.0 . . . 266 266 A 100 GLN HA A 100 GLN CA 1.0 . . . 267 267 A 101 GLU HA A 101 GLU CA 1.0 . . . 268 268 A 102 VAL HA A 102 VAL CA 1.0 . . . 269 269 A 103 LYS HA A 103 LYS CA 1.0 . . . 270 270 A 105 ASN HA A 105 ASN CA 1.0 . . . 271 271 A 106 GLU HA A 106 GLU CA 1.0 . . . 272 272 A 107 MET HA A 107 MET CA 1.0 . . . 273 273 A 108 VAL HA A 108 VAL CA 1.0 . . . 274 274 A 110 THR HA A 110 THR CA 1.0 . . . 275 275 A 111 ILE HA A 111 ILE CA 1.0 . . . 276 276 A 112 THR HA A 112 THR CA 1.0 . . . 277 277 A 113 PHE HA A 113 PHE CA 1.0 . . . 278 278 A 116 VAL HA A 116 VAL CA 1.0 . . . 279 279 A 117 THR HA A 117 THR CA 1.0 . . . 280 280 A 118 LEU HA A 118 LEU CA 1.0 . . . 281 281 A 119 ILE HA A 119 ILE CA 1.0 . . . 282 282 A 121 ARG HA A 121 ARG CA 1.0 . . . 283 283 A 122 SER HA A 122 SER CA 1.0 . . . 284 284 A 123 LYS HA A 123 LYS CA 1.0 . . . 285 285 A 124 ARG HA A 124 ARG CA 1.0 . . . 286 286 A 2 PHE CA A 2 PHE C 1.0 . . . 287 287 A 4 GLY CA A 4 GLY C 1.0 . . . 288 288 A 5 THR CA A 5 THR C 1.0 . . . 289 289 A 9 TYR CA A 9 TYR C 1.0 . . . 290 290 A 13 ASN CA A 13 ASN C 1.0 . . . 291 291 A 14 TYR CA A 14 TYR C 1.0 . . . 292 292 A 15 GLU CA A 15 GLU C 1.0 . . . 293 293 A 16 GLU CA A 16 GLU C 1.0 . . . 294 294 A 17 PHE CA A 17 PHE C 1.0 . . . 295 295 A 18 LEU CA A 18 LEU C 1.0 . . . 296 296 A 19 LYS CA A 19 LYS C 1.0 . . . 297 297 A 20 ALA CA A 20 ALA C 1.0 . . . 298 298 A 21 LEU CA A 21 LEU C 1.0 . . . 299 299 A 22 ALA CA A 22 ALA C 1.0 . . . 300 300 A 24 PRO CA A 24 PRO C 1.0 . . . 301 301 A 25 GLU CA A 25 GLU C 1.0 . . . 302 302 A 26 ASP CA A 26 ASP C 1.0 . . . 303 303 A 27 LEU CA A 27 LEU C 1.0 . . . 304 304 A 28 ILE CA A 28 ILE C 1.0 . . . 305 305 A 29 LYS CA A 29 LYS C 1.0 . . . 306 306 A 30 MET CA A 30 MET C 1.0 . . . 307 307 A 31 ALA CA A 31 ALA C 1.0 . . . 308 308 A 33 ASP CA A 33 ASP C 1.0 . . . 309 309 A 34 ILE CA A 34 ILE C 1.0 . . . 310 310 A 37 ILE CA A 37 ILE C 1.0 . . . 311 311 A 38 VAL CA A 38 VAL C 1.0 . . . 312 312 A 39 GLU CA A 39 GLU C 1.0 . . . 313 313 A 40 ILE CA A 40 ILE C 1.0 . . . 314 314 A 41 GLN CA A 41 GLN C 1.0 . . . 315 315 A 44 GLY CA A 44 GLY C 1.0 . . . 316 316 A 45 ASP CA A 45 ASP C 1.0 . . . 317 317 A 47 PHE CA A 47 PHE C 1.0 . . . 318 318 A 48 VAL CA A 48 VAL C 1.0 . . . 319 319 A 49 VAL CA A 49 VAL C 1.0 . . . 320 320 A 50 THR CA A 50 THR C 1.0 . . . 321 321 A 51 SER CA A 51 SER C 1.0 . . . 322 322 A 54 PRO CA A 54 PRO C 1.0 . . . 323 323 A 55 ARG CA A 55 ARG C 1.0 . . . 324 324 A 56 GLN CA A 56 GLN C 1.0 . . . 325 325 A 57 THR CA A 57 THR C 1.0 . . . 326 326 A 59 THR CA A 59 THR C 1.0 . . . 327 327 A 60 ASN CA A 60 ASN C 1.0 . . . 328 328 A 61 SER CA A 61 SER C 1.0 . . . 329 329 A 62 PHE CA A 62 PHE C 1.0 . . . 330 330 A 63 THR CA A 63 THR C 1.0 . . . 331 331 A 64 LEU CA A 64 LEU C 1.0 . . . 332 332 A 66 LYS CA A 66 LYS C 1.0 . . . 333 333 A 69 ASP CA A 69 ASP C 1.0 . . . 334 334 A 70 ILE CA A 70 ILE C 1.0 . . . 335 335 A 72 THR CA A 72 THR C 1.0 . . . 336 336 A 73 MET CA A 73 MET C 1.0 . . . 337 337 A 74 ASP CA A 74 ASP C 1.0 . . . 338 338 A 75 GLY CA A 75 GLY C 1.0 . . . 339 339 A 76 LYS CA A 76 LYS C 1.0 . . . 340 340 A 77 LYS CA A 77 LYS C 1.0 . . . 341 341 A 78 LEU CA A 78 LEU C 1.0 . . . 342 342 A 79 LYS CA A 79 LYS C 1.0 . . . 343 343 A 80 CYS CA A 80 CYS C 1.0 . . . 344 344 A 81 THR CA A 81 THR C 1.0 . . . 345 345 A 84 LEU CA A 84 LEU C 1.0 . . . 346 346 A 87 GLY CA A 87 GLY C 1.0 . . . 347 347 A 88 LYS CA A 88 LYS C 1.0 . . . 348 348 A 89 LEU CA A 89 LEU C 1.0 . . . 349 349 A 91 THR CA A 91 THR C 1.0 . . . 350 350 A 92 LYS CA A 92 LYS C 1.0 . . . 351 351 A 94 GLU CA A 94 GLU C 1.0 . . . 352 352 A 95 LYS CA A 95 LYS C 1.0 . . . 353 353 A 97 SER CA A 97 SER C 1.0 . . . 354 354 A 98 HIS CA A 98 HIS C 1.0 . . . 355 355 A 100 GLN CA A 100 GLN C 1.0 . . . 356 356 A 101 GLU CA A 101 GLU C 1.0 . . . 357 357 A 102 VAL CA A 102 VAL C 1.0 . . . 358 358 A 105 ASN CA A 105 ASN C 1.0 . . . 359 359 A 106 GLU CA A 106 GLU C 1.0 . . . 360 360 A 107 MET CA A 107 MET C 1.0 . . . 361 361 A 108 VAL CA A 108 VAL C 1.0 . . . 362 362 A 110 THR CA A 110 THR C 1.0 . . . 363 363 A 111 ILE CA A 111 ILE C 1.0 . . . 364 364 A 112 THR CA A 112 THR C 1.0 . . . 365 365 A 113 PHE CA A 113 PHE C 1.0 . . . 366 366 A 115 GLY CA A 115 GLY C 1.0 . . . 367 367 A 117 THR CA A 117 THR C 1.0 . . . 368 368 A 118 LEU CA A 118 LEU C 1.0 . . . 369 369 A 121 ARG CA A 121 ARG C 1.0 . . . 370 370 A 122 SER CA A 122 SER C 1.0 . . . 371 371 A 123 LYS CA A 123 LYS C 1.0 . . . 372 372 A 2 PHE C A 3 SER N 1.0 . . . 373 373 A 3 SER C A 4 GLY N 1.0 . . . 374 374 A 5 THR C A 6 TRP N 1.0 . . . 375 375 A 7 GLN C A 8 VAL N 1.0 . . . 376 376 A 9 TYR C A 10 ALA N 1.0 . . . 377 377 A 10 ALA C A 11 GLN N 1.0 . . . 378 378 A 11 GLN C A 12 GLU N 1.0 . . . 379 379 A 12 GLU C A 13 ASN N 1.0 . . . 380 380 A 14 TYR C A 15 GLU N 1.0 . . . 381 381 A 15 GLU C A 16 GLU N 1.0 . . . 382 382 A 16 GLU C A 17 PHE N 1.0 . . . 383 383 A 17 PHE C A 18 LEU N 1.0 . . . 384 384 A 19 LYS C A 20 ALA N 1.0 . . . 385 385 A 20 ALA C A 21 LEU N 1.0 . . . 386 386 A 22 ALA C A 23 LEU N 1.0 . . . 387 387 A 24 PRO C A 25 GLU N 1.0 . . . 388 388 A 25 GLU C A 26 ASP N 1.0 . . . 389 389 A 26 ASP C A 27 LEU N 1.0 . . . 390 390 A 29 LYS C A 30 MET N 1.0 . . . 391 391 A 30 MET C A 31 ALA N 1.0 . . . 392 392 A 31 ALA C A 32 ARG N 1.0 . . . 393 393 A 32 ARG C A 33 ASP N 1.0 . . . 394 394 A 33 ASP C A 34 ILE N 1.0 . . . 395 395 A 34 ILE C A 35 LYS N 1.0 . . . 396 396 A 37 ILE C A 38 VAL N 1.0 . . . 397 397 A 38 VAL C A 39 GLU N 1.0 . . . 398 398 A 40 ILE C A 41 GLN N 1.0 . . . 399 399 A 41 GLN C A 42 GLN N 1.0 . . . 400 400 A 42 GLN C A 43 LYS N 1.0 . . . 401 401 A 44 GLY C A 45 ASP N 1.0 . . . 402 402 A 45 ASP C A 46 ASP N 1.0 . . . 403 403 A 46 ASP C A 47 PHE N 1.0 . . . 404 404 A 47 PHE C A 48 VAL N 1.0 . . . 405 405 A 48 VAL C A 49 VAL N 1.0 . . . 406 406 A 49 VAL C A 50 THR N 1.0 . . . 407 407 A 50 THR C A 51 SER N 1.0 . . . 408 408 A 51 SER C A 52 LYS N 1.0 . . . 409 409 A 54 PRO C A 55 ARG N 1.0 . . . 410 410 A 56 GLN C A 57 THR N 1.0 . . . 411 411 A 57 THR C A 58 VAL N 1.0 . . . 412 412 A 58 VAL C A 59 THR N 1.0 . . . 413 413 A 59 THR C A 60 ASN N 1.0 . . . 414 414 A 60 ASN C A 61 SER N 1.0 . . . 415 415 A 61 SER C A 62 PHE N 1.0 . . . 416 416 A 62 PHE C A 63 THR N 1.0 . . . 417 417 A 63 THR C A 64 LEU N 1.0 . . . 418 418 A 64 LEU C A 65 GLY N 1.0 . . . 419 419 A 65 GLY C A 66 LYS N 1.0 . . . 420 420 A 66 LYS C A 67 GLU N 1.0 . . . 421 421 A 67 GLU C A 68 ALA N 1.0 . . . 422 422 A 68 ALA C A 69 ASP N 1.0 . . . 423 423 A 69 ASP C A 70 ILE N 1.0 . . . 424 424 A 70 ILE C A 71 THR N 1.0 . . . 425 425 A 71 THR C A 72 THR N 1.0 . . . 426 426 A 74 ASP C A 75 GLY N 1.0 . . . 427 427 A 76 LYS C A 77 LYS N 1.0 . . . 428 428 A 77 LYS C A 78 LEU N 1.0 . . . 429 429 A 78 LEU C A 79 LYS N 1.0 . . . 430 430 A 81 THR C A 82 VAL N 1.0 . . . 431 431 A 82 VAL C A 83 HIS N 1.0 . . . 432 432 A 83 HIS C A 84 LEU N 1.0 . . . 433 433 A 84 LEU C A 85 ALA N 1.0 . . . 434 434 A 86 ASN C A 87 GLY N 1.0 . . . 435 435 A 88 LYS C A 89 LEU N 1.0 . . . 436 436 A 89 LEU C A 90 VAL N 1.0 . . . 437 437 A 90 VAL C A 91 THR N 1.0 . . . 438 438 A 91 THR C A 92 LYS N 1.0 . . . 439 439 A 92 LYS C A 93 SER N 1.0 . . . 440 440 A 94 GLU C A 95 LYS N 1.0 . . . 441 441 A 95 LYS C A 96 PHE N 1.0 . . . 442 442 A 97 SER C A 98 HIS N 1.0 . . . 443 443 A 98 HIS C A 99 GLU N 1.0 . . . 444 444 A 99 GLU C A 100 GLN N 1.0 . . . 445 445 A 100 GLN C A 101 GLU N 1.0 . . . 446 446 A 101 GLU C A 102 VAL N 1.0 . . . 447 447 A 102 VAL C A 103 LYS N 1.0 . . . 448 448 A 106 GLU C A 107 MET N 1.0 . . . 449 449 A 107 MET C A 108 VAL N 1.0 . . . 450 450 A 108 VAL C A 109 GLU N 1.0 . . . 451 451 A 109 GLU C A 110 THR N 1.0 . . . 452 452 A 110 THR C A 111 ILE N 1.0 . . . 453 453 A 113 PHE C A 114 GLY N 1.0 . . . 454 454 A 114 GLY C A 115 GLY N 1.0 . . . 455 455 A 115 GLY C A 116 VAL N 1.0 . . . 456 456 A 116 VAL C A 117 THR N 1.0 . . . 457 457 A 117 THR C A 118 LEU N 1.0 . . . 458 458 A 118 LEU C A 119 ILE N 1.0 . . . 459 459 A 121 ARG C A 122 SER N 1.0 . . . stop_ save_