data_nef_c15385_2jt0 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 MET start . . 2 A 2 ASP middle . . 3 A 3 ASP middle . . 4 A 4 ILE middle . . 5 A 5 TYR middle . . 6 A 6 LYS middle . . 7 A 7 ALA middle . . 8 A 8 ALA middle . . 9 A 9 VAL middle . . 10 A 10 GLU middle . . 11 A 11 GLN middle . . 12 A 12 LEU middle . . 13 A 13 THR middle . . 14 A 14 GLU middle . . 15 A 15 GLU middle . . 16 A 16 GLN middle . . 17 A 17 LYS middle . . 18 A 18 ASN middle . . 19 A 19 GLU middle . . 20 A 20 PHE middle . . 21 A 21 LYS middle . . 22 A 22 ALA middle . . 23 A 23 ALA middle . . 24 A 24 PHE middle . . 25 A 25 ASP middle . . 26 A 26 ILE middle . . 27 A 27 PHE middle . . 28 A 28 VAL middle . . 29 A 29 LEU middle . . 30 A 30 GLY middle . false 31 A 31 ALA middle . . 32 A 32 GLU middle . . 33 A 33 ASP middle . . 34 A 34 GLY middle . false 35 A 35 SER middle . . 36 A 36 ILE middle . . 37 A 37 SER middle . . 38 A 38 THR middle . . 39 A 39 LYS middle . . 40 A 40 GLU middle . . 41 A 41 LEU middle . . 42 A 42 GLY middle . false 43 A 43 LYS middle . . 44 A 44 VAL middle . . 45 A 45 MET middle . . 46 A 46 ARG middle . . 47 A 47 MET middle . . 48 A 48 LEU middle . . 49 A 49 GLY middle . false 50 A 50 GLN middle . . 51 A 51 ASN middle . . 52 A 52 PRO middle . false 53 A 53 THR middle . . 54 A 54 PRO middle . false 55 A 55 GLU middle . . 56 A 56 GLU middle . . 57 A 57 LEU middle . . 58 A 58 GLN middle . . 59 A 59 GLU middle . . 60 A 60 MET middle . . 61 A 61 ILE middle . . 62 A 62 ASP middle . . 63 A 63 GLU middle . . 64 A 64 VAL middle . . 65 A 65 ASP middle . . 66 A 66 GLU middle . . 67 A 67 ASP middle . . 68 A 68 GLY middle . false 69 A 69 SER middle . . 70 A 70 GLY middle . false 71 A 71 THR middle . . 72 A 72 VAL middle . . 73 A 73 ASP middle . . 74 A 74 PHE middle . . 75 A 75 ASP middle . . 76 A 76 GLU middle . . 77 A 77 PHE middle . . 78 A 78 LEU middle . . 79 A 79 VAL middle . . 80 A 80 MET middle . . 81 A 81 MET middle . . 82 A 82 VAL middle . . 83 A 83 ARG middle . . 84 A 84 SER middle . . 85 A 85 MET middle . . 86 A 86 LYS middle . . 87 A 87 ASP middle . . 88 A 88 ASP middle . . 89 A 89 SER middle . . 90 A 90 LYS middle . . 91 A 91 GLY middle . false 92 A 92 LYS middle . . 93 A 93 SER middle . . 94 A 94 GLU middle . . 95 A 95 GLU middle . . 96 A 96 GLU middle . . 97 A 97 LEU middle . . 98 A 98 SER middle . . 99 A 99 ASP middle . . 100 A 100 LEU middle . . 101 A 101 PHE middle . . 102 A 102 ARG middle . . 103 A 103 MET middle . . 104 A 104 TRP middle . . 105 A 105 ASP middle . . 106 A 106 LYS middle . . 107 A 107 ASN middle . . 108 A 108 ALA middle . . 109 A 109 ASP middle . . 110 A 110 GLY middle . false 111 A 111 TYR middle . . 112 A 112 ILE middle . . 113 A 113 ASP middle . . 114 A 114 LEU middle . . 115 A 115 ASP middle . . 116 A 116 GLU middle . . 117 A 117 LEU middle . . 118 A 118 LYS middle . . 119 A 119 ILE middle . . 120 A 120 MET middle . . 121 A 121 LEU middle . . 122 A 122 GLN middle . . 123 A 123 ALA middle . . 124 A 124 THR middle . . 125 A 125 GLY middle . false 126 A 126 GLU middle . . 127 A 127 THR middle . . 128 A 128 ILE middle . . 129 A 129 THR middle . . 130 A 130 GLU middle . . 131 A 131 ASP middle . . 132 A 132 ASP middle . . 133 A 133 ILE middle . . 134 A 134 GLU middle . . 135 A 135 GLU middle . . 136 A 136 LEU middle . . 137 A 137 MET middle . . 138 A 138 LYS middle . . 139 A 139 ASP middle . . 140 A 140 GLY middle . false 141 A 141 ASP middle . . 142 A 142 LYS middle . . 143 A 143 ASN middle . . 144 A 144 ASN middle . . 145 A 145 ASP middle . . 146 A 146 GLY middle . false 147 A 147 ARG middle . . 148 A 148 ILE middle . . 149 A 149 ASP middle . . 150 A 150 TYR middle . . 151 A 151 ASP middle . . 152 A 152 GLU middle . . 153 A 153 PHE middle . . 154 A 154 LEU middle . . 155 A 155 GLU middle . . 156 A 156 PHE middle . . 157 A 157 MET middle . . 158 A 158 LYS middle . . 159 A 159 GLY middle . false 160 A 160 VAL middle . . 161 A 161 GLU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 3 ASP H H 1 8.550 0.03 A 3 ASP HA H 1 4.461 0.03 A 3 ASP HBx H 1 2.653 0.03 A 3 ASP HBy H 1 2.697 0.03 A 3 ASP CA C 13 56.250 0.5 A 3 ASP CB C 13 41.220 0.5 A 3 ASP N N 15 122.990 0.4 A 4 ILE H H 1 8.270 0.03 A 4 ILE HA H 1 3.918 0.03 A 4 ILE HB H 1 1.651 0.03 A 4 ILE HD1% H 1 0.690 0.03 A 4 ILE HG12 H 1 0.948 0.03 A 4 ILE HG13 H 1 0.948 0.03 A 4 ILE HG2% H 1 0.568 0.03 A 4 ILE CA C 13 63.700 0.5 A 4 ILE CB C 13 37.700 0.5 A 4 ILE CD1 C 13 13.340 0.5 A 4 ILE CG1 C 13 27.090 0.5 A 4 ILE CG2 C 13 17.090 0.5 A 4 ILE N N 15 119.330 0.4 A 5 TYR H H 1 7.610 0.03 A 5 TYR HA H 1 4.484 0.03 A 5 TYR HBx H 1 2.885 0.03 A 5 TYR HBy H 1 3.109 0.03 A 5 TYR HDx H 1 7.078 0.03 A 5 TYR HEx H 1 6.809 0.03 A 5 TYR CA C 13 59.590 0.5 A 5 TYR CB C 13 37.860 0.5 A 5 TYR CDx C 13 132.610 0.5 A 5 TYR CEx C 13 118.550 0.5 A 5 TYR N N 15 120.760 0.4 A 6 LYS H H 1 7.860 0.03 A 6 LYS HA H 1 3.994 0.03 A 6 LYS HBx H 1 1.857 0.03 A 6 LYS HBy H 1 1.857 0.03 A 6 LYS HDx H 1 1.704 0.03 A 6 LYS HDy H 1 1.704 0.03 A 6 LYS HEx H 1 2.996 0.03 A 6 LYS HEy H 1 2.996 0.03 A 6 LYS HGx H 1 1.395 0.03 A 6 LYS HGy H 1 1.505 0.03 A 6 LYS CA C 13 59.570 0.5 A 6 LYS CB C 13 32.520 0.5 A 6 LYS CD C 13 29.340 0.5 A 6 LYS CE C 13 42.000 0.5 A 6 LYS CG C 13 25.210 0.5 A 6 LYS N N 15 120.700 0.4 A 7 ALA H H 1 7.930 0.03 A 7 ALA HA H 1 4.162 0.03 A 7 ALA HB% H 1 1.405 0.03 A 7 ALA CA C 13 54.500 0.5 A 7 ALA CB C 13 18.000 0.5 A 7 ALA N N 15 120.270 0.4 A 8 ALA H H 1 7.520 0.03 A 8 ALA HA H 1 4.190 0.03 A 8 ALA HB% H 1 1.559 0.03 A 8 ALA CA C 13 54.580 0.5 A 8 ALA CB C 13 18.440 0.5 A 8 ALA N N 15 119.950 0.4 A 9 VAL H H 1 8.110 0.03 A 9 VAL HA H 1 3.595 0.03 A 9 VAL HB H 1 2.207 0.03 A 9 VAL HGx% H 1 0.998 0.03 A 9 VAL HGy% H 1 0.938 0.03 A 9 VAL CA C 13 66.140 0.5 A 9 VAL CB C 13 31.870 0.5 A 9 VAL CGy C 13 23.350 0.5 A 9 VAL CGx C 13 22.010 0.5 A 9 VAL N N 15 119.080 0.4 A 10 GLU H H 1 7.810 0.03 A 10 GLU HA H 1 4.035 0.03 A 10 GLU HBx H 1 2.130 0.03 A 10 GLU HBy H 1 2.130 0.03 A 10 GLU HGx H 1 2.339 0.03 A 10 GLU HGy H 1 2.415 0.03 A 10 GLU CA C 13 58.220 0.5 A 10 GLU CB C 13 29.360 0.5 A 10 GLU CG C 13 36.490 0.5 A 10 GLU N N 15 118.660 0.4 A 11 GLN H H 1 7.370 0.03 A 11 GLN HA H 1 4.275 0.03 A 11 GLN HBy H 1 2.322 0.03 A 11 GLN HBx H 1 2.053 0.03 A 11 GLN HGx H 1 2.492 0.03 A 11 GLN HGy H 1 2.492 0.03 A 11 GLN CA C 13 55.610 0.5 A 11 GLN CB C 13 29.410 0.5 A 11 GLN CG C 13 34.180 0.5 A 11 GLN N N 15 114.850 0.4 A 12 LEU H H 1 7.340 0.03 A 12 LEU HA H 1 4.497 0.03 A 12 LEU HBy H 1 1.919 0.03 A 12 LEU HBx H 1 1.365 0.03 A 12 LEU HDx% H 1 0.976 0.03 A 12 LEU HDy% H 1 0.898 0.03 A 12 LEU HG H 1 2.115 0.03 A 12 LEU CA C 13 55.100 0.5 A 12 LEU CB C 13 43.130 0.5 A 12 LEU CDy C 13 27.400 0.5 A 12 LEU CDx C 13 23.080 0.5 A 12 LEU CG C 13 26.470 0.5 A 12 LEU N N 15 120.720 0.4 A 13 THR H H 1 8.900 0.03 A 13 THR HA H 1 4.419 0.03 A 13 THR HB H 1 4.813 0.03 A 13 THR HG2% H 1 1.391 0.03 A 13 THR CA C 13 60.690 0.5 A 13 THR CB C 13 71.060 0.5 A 13 THR CG2 C 13 21.930 0.5 A 13 THR N N 15 113.850 0.4 A 14 GLU H H 1 8.900 0.03 A 14 GLU HA H 1 3.964 0.03 A 14 GLU HBx H 1 2.078 0.03 A 14 GLU HBy H 1 2.078 0.03 A 14 GLU HGx H 1 2.360 0.03 A 14 GLU HGy H 1 2.360 0.03 A 14 GLU CA C 13 59.700 0.5 A 14 GLU CB C 13 29.300 0.5 A 14 GLU CG C 13 36.510 0.5 A 14 GLU N N 15 121.500 0.4 A 15 GLU H H 1 8.500 0.03 A 15 GLU HA H 1 4.028 0.03 A 15 GLU HBy H 1 2.052 0.03 A 15 GLU HBx H 1 1.934 0.03 A 15 GLU HGy H 1 2.461 0.03 A 15 GLU HGx H 1 2.273 0.03 A 15 GLU CA C 13 60.100 0.5 A 15 GLU CB C 13 29.200 0.5 A 15 GLU CG C 13 36.610 0.5 A 15 GLU N N 15 117.700 0.4 A 16 GLN H H 1 7.800 0.03 A 16 GLN HA H 1 3.791 0.03 A 16 GLN HBx H 1 1.483 0.03 A 16 GLN HBy H 1 1.483 0.03 A 16 GLN HGx H 1 2.207 0.03 A 16 GLN HGy H 1 2.286 0.03 A 16 GLN CA C 13 58.900 0.5 A 16 GLN CB C 13 29.600 0.5 A 16 GLN CG C 13 34.920 0.5 A 16 GLN N N 15 119.400 0.4 A 17 LYS H H 1 8.360 0.03 A 17 LYS HA H 1 3.847 0.03 A 17 LYS HBx H 1 1.974 0.03 A 17 LYS HBy H 1 1.974 0.03 A 17 LYS HDx H 1 1.691 0.03 A 17 LYS HDy H 1 1.760 0.03 A 17 LYS HEx H 1 2.859 0.03 A 17 LYS HEy H 1 2.859 0.03 A 17 LYS HGx H 1 1.419 0.03 A 17 LYS HGy H 1 1.419 0.03 A 17 LYS CA C 13 61.590 0.5 A 17 LYS CB C 13 32.020 0.5 A 17 LYS CD C 13 29.400 0.5 A 17 LYS CE C 13 42.050 0.5 A 17 LYS CG C 13 27.280 0.5 A 17 LYS N N 15 117.970 0.4 A 18 ASN H H 1 8.490 0.03 A 18 ASN HA H 1 4.527 0.03 A 18 ASN HBx H 1 2.802 0.03 A 18 ASN HBy H 1 2.956 0.03 A 18 ASN CA C 13 55.890 0.5 A 18 ASN CB C 13 37.790 0.5 A 18 ASN N N 15 117.440 0.4 A 19 GLU H H 1 8.010 0.03 A 19 GLU HA H 1 4.171 0.03 A 19 GLU HBx H 1 2.007 0.03 A 19 GLU HBy H 1 2.089 0.03 A 19 GLU HGy H 1 2.415 0.03 A 19 GLU HGx H 1 2.224 0.03 A 19 GLU CA C 13 59.460 0.5 A 19 GLU CB C 13 29.160 0.5 A 19 GLU CG C 13 36.020 0.5 A 19 GLU N N 15 123.290 0.4 A 20 PHE H H 1 8.490 0.03 A 20 PHE HA H 1 5.028 0.03 A 20 PHE HBx H 1 3.503 0.03 A 20 PHE HBy H 1 3.549 0.03 A 20 PHE HDx H 1 7.167 0.03 A 20 PHE HEx H 1 7.284 0.03 A 20 PHE CA C 13 58.270 0.5 A 20 PHE CB C 13 37.390 0.5 A 20 PHE CDx C 13 130.270 0.5 A 20 PHE CEx C 13 130.270 0.5 A 20 PHE N N 15 119.350 0.4 A 21 LYS H H 1 8.900 0.03 A 21 LYS HA H 1 3.945 0.03 A 21 LYS HBx H 1 1.775 0.03 A 21 LYS HBy H 1 1.980 0.03 A 21 LYS HDx H 1 0.651 0.03 A 21 LYS HDy H 1 1.372 0.03 A 21 LYS HEx H 1 2.688 0.03 A 21 LYS HEy H 1 2.688 0.03 A 21 LYS HGy H 1 1.242 0.03 A 21 LYS HGx H 1 1.020 0.03 A 21 LYS CA C 13 58.860 0.5 A 21 LYS CB C 13 32.250 0.5 A 21 LYS CD C 13 27.610 0.5 A 21 LYS CE C 13 42.090 0.5 A 21 LYS CG C 13 24.390 0.5 A 21 LYS N N 15 121.830 0.4 A 22 ALA H H 1 7.870 0.03 A 22 ALA HA H 1 4.160 0.03 A 22 ALA HB% H 1 1.520 0.03 A 22 ALA CA C 13 54.710 0.5 A 22 ALA CB C 13 17.910 0.5 A 22 ALA N N 15 120.120 0.4 A 23 ALA H H 1 7.460 0.03 A 23 ALA HA H 1 4.251 0.03 A 23 ALA HB% H 1 1.773 0.03 A 23 ALA CA C 13 54.700 0.5 A 23 ALA CB C 13 18.710 0.5 A 23 ALA N N 15 118.960 0.4 A 24 PHE H H 1 8.370 0.03 A 24 PHE HA H 1 3.609 0.03 A 24 PHE HBx H 1 2.770 0.03 A 24 PHE HBy H 1 3.181 0.03 A 24 PHE HDx H 1 6.595 0.03 A 24 PHE HEx H 1 7.159 0.03 A 24 PHE HZ H 1 7.542 0.03 A 24 PHE CA C 13 62.200 0.5 A 24 PHE CB C 13 40.360 0.5 A 24 PHE CDx C 13 132.050 0.5 A 24 PHE CEx C 13 131.505 0.5 A 24 PHE CZ C 13 130.211 0.5 A 24 PHE N N 15 119.340 0.4 A 25 ASP H H 1 8.730 0.03 A 25 ASP HA H 1 4.349 0.03 A 25 ASP HBy H 1 2.687 0.03 A 25 ASP HBx H 1 2.509 0.03 A 25 ASP CA C 13 56.690 0.5 A 25 ASP CB C 13 40.240 0.5 A 25 ASP N N 15 115.790 0.4 A 26 ILE H H 1 7.240 0.03 A 26 ILE HA H 1 3.662 0.03 A 26 ILE HB H 1 1.786 0.03 A 26 ILE HD1% H 1 0.809 0.03 A 26 ILE HG12 H 1 1.158 0.03 A 26 ILE HG13 H 1 1.610 0.03 A 26 ILE HG2% H 1 0.424 0.03 A 26 ILE CA C 13 63.890 0.5 A 26 ILE CB C 13 37.490 0.5 A 26 ILE CD1 C 13 12.870 0.5 A 26 ILE CG1 C 13 28.660 0.5 A 26 ILE CG2 C 13 16.850 0.5 A 26 ILE N N 15 119.090 0.4 A 27 PHE H H 1 7.530 0.03 A 27 PHE HA H 1 4.360 0.03 A 27 PHE HBy H 1 3.094 0.03 A 27 PHE HBx H 1 2.625 0.03 A 27 PHE HDx H 1 6.951 0.03 A 27 PHE HEx H 1 6.990 0.03 A 27 PHE CA C 13 59.440 0.5 A 27 PHE CB C 13 39.480 0.5 A 27 PHE CDx C 13 131.660 0.5 A 27 PHE CEx C 13 131.678 0.5 A 27 PHE N N 15 117.810 0.4 A 28 VAL H H 1 7.500 0.03 A 28 VAL HA H 1 3.925 0.03 A 28 VAL HB H 1 1.927 0.03 A 28 VAL HGx% H 1 0.518 0.03 A 28 VAL HGy% H 1 0.678 0.03 A 28 VAL CA C 13 62.540 0.5 A 28 VAL CB C 13 32.010 0.5 A 28 VAL CGy C 13 21.540 0.5 A 28 VAL CGx C 13 21.160 0.5 A 28 VAL N N 15 115.280 0.4 A 29 LEU H H 1 7.660 0.03 A 29 LEU HA H 1 4.100 0.03 A 29 LEU HBy H 1 1.757 0.03 A 29 LEU HBx H 1 1.596 0.03 A 29 LEU HDx% H 1 0.907 0.03 A 29 LEU HDy% H 1 0.856 0.03 A 29 LEU CA C 13 56.340 0.5 A 29 LEU CB C 13 41.000 0.5 A 29 LEU CDy C 13 24.950 0.5 A 29 LEU CDx C 13 23.640 0.5 A 29 LEU CG C 13 26.810 0.5 A 29 LEU N N 15 122.780 0.4 A 30 GLY H H 1 8.360 0.03 A 30 GLY HAy H 1 3.964 0.03 A 30 GLY HAx H 1 3.873 0.03 A 30 GLY CA C 13 45.400 0.5 A 30 GLY N N 15 108.420 0.4 A 31 ALA H H 1 7.780 0.03 A 31 ALA HA H 1 4.372 0.03 A 31 ALA HB% H 1 1.480 0.03 A 31 ALA CA C 13 52.380 0.5 A 31 ALA CB C 13 19.510 0.5 A 31 ALA N N 15 123.850 0.4 A 32 GLU H H 1 8.810 0.03 A 32 GLU HA H 1 4.387 0.03 A 32 GLU HBx H 1 2.032 0.03 A 32 GLU HBy H 1 2.032 0.03 A 32 GLU HGx H 1 2.260 0.03 A 32 GLU HGy H 1 2.260 0.03 A 32 GLU CA C 13 58.320 0.5 A 32 GLU CB C 13 29.760 0.5 A 32 GLU CG C 13 36.050 0.5 A 32 GLU N N 15 123.210 0.4 A 33 ASP H H 1 8.240 0.03 A 33 ASP HA H 1 4.676 0.03 A 33 ASP HBx H 1 2.684 0.03 A 33 ASP HBy H 1 2.873 0.03 A 33 ASP CA C 13 53.540 0.5 A 33 ASP CB C 13 40.780 0.5 A 33 ASP N N 15 117.330 0.4 A 34 GLY H H 1 7.940 0.03 A 34 GLY HAx H 1 3.969 0.03 A 34 GLY HAy H 1 3.969 0.03 A 34 GLY CA C 13 46.380 0.5 A 34 GLY N N 15 106.760 0.4 A 35 SER H H 1 7.740 0.03 A 35 SER HA H 1 5.023 0.03 A 35 SER HBx H 1 3.550 0.03 A 35 SER HBy H 1 3.721 0.03 A 35 SER CA C 13 57.390 0.5 A 35 SER CB C 13 65.760 0.5 A 35 SER N N 15 113.290 0.4 A 36 ILE H H 1 8.490 0.03 A 36 ILE HA H 1 4.345 0.03 A 36 ILE HB H 1 1.669 0.03 A 36 ILE HD1% H 1 0.479 0.03 A 36 ILE HG12 H 1 1.228 0.03 A 36 ILE HG13 H 1 1.279 0.03 A 36 ILE HG2% H 1 0.541 0.03 A 36 ILE CA C 13 61.560 0.5 A 36 ILE CB C 13 32.010 0.5 A 36 ILE CD1 C 13 14.540 0.5 A 36 ILE CG1 C 13 26.690 0.5 A 36 ILE CG2 C 13 17.080 0.5 A 36 ILE N N 15 117.380 0.4 A 37 SER H H 1 8.910 0.03 A 37 SER HA H 1 4.697 0.03 A 37 SER HBy H 1 4.232 0.03 A 37 SER HBx H 1 3.867 0.03 A 37 SER CA C 13 57.860 0.5 A 37 SER CB C 13 64.300 0.5 A 37 SER N N 15 120.670 0.4 A 38 THR H H 1 8.500 0.03 A 38 THR HA H 1 3.766 0.03 A 38 THR HB H 1 3.759 0.03 A 38 THR HG2% H 1 1.118 0.03 A 38 THR CA C 13 65.700 0.5 A 38 THR CB C 13 67.700 0.5 A 38 THR CG2 C 13 22.850 0.5 A 38 THR N N 15 116.500 0.4 A 39 LYS H H 1 8.000 0.03 A 39 LYS HA H 1 4.239 0.03 A 39 LYS HBx H 1 1.842 0.03 A 39 LYS HBy H 1 1.842 0.03 A 39 LYS HDx H 1 1.698 0.03 A 39 LYS HDy H 1 1.698 0.03 A 39 LYS HEx H 1 3.016 0.03 A 39 LYS HEy H 1 3.016 0.03 A 39 LYS HGx H 1 1.496 0.03 A 39 LYS HGy H 1 1.496 0.03 A 39 LYS CA C 13 58.400 0.5 A 39 LYS CB C 13 32.300 0.5 A 39 LYS CD C 13 28.960 0.5 A 39 LYS CE C 13 42.060 0.5 A 39 LYS CG C 13 24.920 0.5 A 39 LYS N N 15 120.300 0.4 A 40 GLU H H 1 7.600 0.03 A 40 GLU HA H 1 4.362 0.03 A 40 GLU HBy H 1 1.914 0.03 A 40 GLU HBx H 1 1.783 0.03 A 40 GLU HGx H 1 2.240 0.03 A 40 GLU CA C 13 56.600 0.5 A 40 GLU CB C 13 30.000 0.5 A 40 GLU CG C 13 36.410 0.5 A 40 GLU N N 15 117.300 0.4 A 41 LEU H H 1 7.600 0.03 A 41 LEU HA H 1 3.841 0.03 A 41 LEU HBx H 1 1.591 0.03 A 41 LEU HBy H 1 1.591 0.03 A 41 LEU HDx% H 1 0.904 0.03 A 41 LEU HDy% H 1 0.855 0.03 A 41 LEU HG H 1 1.624 0.03 A 41 LEU CA C 13 57.500 0.5 A 41 LEU CB C 13 42.200 0.5 A 41 LEU CDy C 13 24.950 0.5 A 41 LEU CDx C 13 24.410 0.5 A 41 LEU CG C 13 27.130 0.5 A 41 LEU N N 15 119.400 0.4 A 42 GLY H H 1 8.630 0.03 A 42 GLY HAx H 1 3.522 0.03 A 42 GLY HAy H 1 3.851 0.03 A 42 GLY CA C 13 47.780 0.5 A 42 GLY N N 15 106.570 0.4 A 43 LYS H H 1 7.340 0.03 A 43 LYS HA H 1 3.985 0.03 A 43 LYS HBx H 1 1.857 0.03 A 43 LYS HBy H 1 1.857 0.03 A 43 LYS HDx H 1 1.704 0.03 A 43 LYS HDy H 1 1.704 0.03 A 43 LYS HEx H 1 2.996 0.03 A 43 LYS HEy H 1 2.996 0.03 A 43 LYS HGy H 1 1.505 0.03 A 43 LYS HGx H 1 1.395 0.03 A 43 LYS CA C 13 59.490 0.5 A 43 LYS CB C 13 32.430 0.5 A 43 LYS CD C 13 29.390 0.5 A 43 LYS CE C 13 42.200 0.5 A 43 LYS CG C 13 25.360 0.5 A 43 LYS N N 15 121.090 0.4 A 44 VAL H H 1 7.470 0.03 A 44 VAL HA H 1 3.492 0.03 A 44 VAL HB H 1 1.957 0.03 A 44 VAL HGx% H 1 0.716 0.03 A 44 VAL HGy% H 1 0.635 0.03 A 44 VAL CA C 13 65.790 0.5 A 44 VAL CB C 13 31.440 0.5 A 44 VAL CGx C 13 21.740 0.5 A 44 VAL CGy C 13 22.370 0.5 A 44 VAL N N 15 119.970 0.4 A 45 MET H H 1 8.210 0.03 A 45 MET HA H 1 4.095 0.03 A 45 MET HBx H 1 1.878 0.03 A 45 MET HBy H 1 2.003 0.03 A 45 MET HE% H 1 1.823 0.03 A 45 MET HGx H 1 2.533 0.03 A 45 MET HGy H 1 2.849 0.03 A 45 MET CA C 13 58.660 0.5 A 45 MET CB C 13 31.260 0.5 A 45 MET CE C 13 17.610 0.5 A 45 MET CG C 13 33.260 0.5 A 45 MET N N 15 116.150 0.4 A 46 ARG H H 1 7.910 0.03 A 46 ARG HA H 1 4.595 0.03 A 46 ARG HBx H 1 1.931 0.03 A 46 ARG HBy H 1 1.931 0.03 A 46 ARG HDx H 1 3.198 0.03 A 46 ARG HDy H 1 3.267 0.03 A 46 ARG HGx H 1 1.725 0.03 A 46 ARG HGy H 1 1.911 0.03 A 46 ARG CA C 13 59.110 0.5 A 46 ARG CB C 13 29.990 0.5 A 46 ARG CD C 13 43.320 0.5 A 46 ARG CG C 13 28.250 0.5 A 46 ARG N N 15 118.980 0.4 A 47 MET H H 1 7.980 0.03 A 47 MET HA H 1 4.290 0.03 A 47 MET HBx H 1 2.471 0.03 A 47 MET HBy H 1 2.471 0.03 A 47 MET HE% H 1 2.220 0.03 A 47 MET HGx H 1 2.747 0.03 A 47 MET HGy H 1 2.892 0.03 A 47 MET CA C 13 58.960 0.5 A 47 MET CB C 13 32.500 0.5 A 47 MET CE C 13 17.310 0.5 A 47 MET CG C 13 32.510 0.5 A 47 MET N N 15 121.860 0.4 A 48 LEU H H 1 7.530 0.03 A 48 LEU HA H 1 4.541 0.03 A 48 LEU HBx H 1 1.863 0.03 A 48 LEU HBy H 1 1.922 0.03 A 48 LEU HDx% H 1 1.109 0.03 A 48 LEU HDy% H 1 1.031 0.03 A 48 LEU HG H 1 1.969 0.03 A 48 LEU CA C 13 54.490 0.5 A 48 LEU CB C 13 42.080 0.5 A 48 LEU CDx C 13 22.670 0.5 A 48 LEU CDy C 13 26.690 0.5 A 48 LEU CG C 13 26.600 0.5 A 48 LEU N N 15 117.910 0.4 A 49 GLY H H 1 7.840 0.03 A 49 GLY HAx H 1 3.822 0.03 A 49 GLY HAy H 1 4.263 0.03 A 49 GLY CA C 13 45.560 0.5 A 49 GLY N N 15 107.180 0.4 A 50 GLN H H 1 8.140 0.03 A 50 GLN HA H 1 4.508 0.03 A 50 GLN HBx H 1 1.607 0.03 A 50 GLN HBy H 1 1.642 0.03 A 50 GLN HGx H 1 2.171 0.03 A 50 GLN HGy H 1 2.171 0.03 A 50 GLN CA C 13 54.030 0.5 A 50 GLN CB C 13 30.900 0.5 A 50 GLN CG C 13 33.470 0.5 A 50 GLN N N 15 118.800 0.4 A 51 ASN H H 1 8.680 0.03 A 51 ASN HA H 1 5.125 0.03 A 51 ASN HBx H 1 2.501 0.03 A 51 ASN HBy H 1 2.747 0.03 A 51 ASN CA C 13 51.250 0.5 A 51 ASN CB C 13 39.490 0.5 A 51 ASN N N 15 116.900 0.4 A 52 PRO HA H 1 4.741 0.03 A 52 PRO HBx H 1 1.934 0.03 A 52 PRO HBy H 1 2.219 0.03 A 52 PRO HDy H 1 3.589 0.03 A 52 PRO HDx H 1 3.321 0.03 A 52 PRO HGx H 1 1.876 0.03 A 52 PRO HGy H 1 1.876 0.03 A 52 PRO CA C 13 62.440 0.5 A 52 PRO CB C 13 31.620 0.5 A 52 PRO CD C 13 49.770 0.5 A 52 PRO CG C 13 27.320 0.5 A 53 THR H H 1 8.777 0.03 A 53 THR HA H 1 4.610 0.03 A 53 THR HB H 1 4.412 0.03 A 53 THR HG2% H 1 1.394 0.03 A 53 THR CA C 13 60.414 0.5 A 53 THR CB C 13 68.015 0.5 A 53 THR CG2 C 13 22.160 0.5 A 53 THR N N 15 114.390 0.4 A 54 PRO HA H 1 4.171 0.03 A 54 PRO HBx H 1 2.012 0.03 A 54 PRO HBy H 1 2.397 0.03 A 54 PRO HDx H 1 3.915 0.03 A 54 PRO HDy H 1 3.915 0.03 A 54 PRO HGx H 1 1.906 0.03 A 54 PRO HGy H 1 2.239 0.03 A 54 PRO CA C 13 66.110 0.5 A 54 PRO CB C 13 31.780 0.5 A 54 PRO CD C 13 50.080 0.5 A 54 PRO CG C 13 28.280 0.5 A 55 GLU H H 1 8.790 0.03 A 55 GLU HA H 1 4.024 0.03 A 55 GLU HBx H 1 1.935 0.03 A 55 GLU HBy H 1 2.047 0.03 A 55 GLU HGx H 1 2.289 0.03 A 55 GLU HGy H 1 2.289 0.03 A 55 GLU CA C 13 60.450 0.5 A 55 GLU CB C 13 28.800 0.5 A 55 GLU CG C 13 37.000 0.5 A 55 GLU N N 15 117.480 0.4 A 56 GLU H H 1 7.760 0.03 A 56 GLU HA H 1 4.009 0.03 A 56 GLU HBy H 1 2.052 0.03 A 56 GLU HBx H 1 1.934 0.03 A 56 GLU HGx H 1 2.316 0.03 A 56 GLU HGy H 1 2.316 0.03 A 56 GLU CA C 13 58.760 0.5 A 56 GLU CB C 13 30.070 0.5 A 56 GLU CG C 13 36.890 0.5 A 56 GLU N N 15 121.590 0.4 A 57 LEU H H 1 8.440 0.03 A 57 LEU HA H 1 4.027 0.03 A 57 LEU HBx H 1 1.690 0.03 A 57 LEU HBy H 1 1.690 0.03 A 57 LEU HDx% H 1 0.810 0.03 A 57 LEU HG H 1 1.571 0.03 A 57 LEU CA C 13 58.000 0.5 A 57 LEU CB C 13 41.990 0.5 A 57 LEU CDx C 13 24.600 0.5 A 57 LEU CG C 13 23.000 0.5 A 57 LEU N N 15 120.800 0.4 A 58 GLN H H 1 7.880 0.03 A 58 GLN HA H 1 3.829 0.03 A 58 GLN HBx H 1 2.130 0.03 A 58 GLN HBy H 1 2.130 0.03 A 58 GLN HGx H 1 2.390 0.03 A 58 GLN HGy H 1 2.390 0.03 A 58 GLN CA C 13 58.370 0.5 A 58 GLN CB C 13 28.370 0.5 A 58 GLN CG C 13 33.560 0.5 A 58 GLN N N 15 117.440 0.4 A 59 GLU H H 1 7.670 0.03 A 59 GLU HA H 1 4.073 0.03 A 59 GLU HBx H 1 2.091 0.03 A 59 GLU HBy H 1 2.091 0.03 A 59 GLU HGx H 1 2.226 0.03 A 59 GLU HGy H 1 2.226 0.03 A 59 GLU CA C 13 59.200 0.5 A 59 GLU CB C 13 29.360 0.5 A 59 GLU CG C 13 36.020 0.5 A 59 GLU N N 15 118.220 0.4 A 60 MET H H 1 7.860 0.03 A 60 MET HA H 1 3.993 0.03 A 60 MET HBx H 1 2.069 0.03 A 60 MET HBy H 1 2.227 0.03 A 60 MET HE% H 1 1.947 0.03 A 60 MET HGy H 1 2.628 0.03 A 60 MET HGx H 1 2.421 0.03 A 60 MET CA C 13 59.080 0.5 A 60 MET CB C 13 33.310 0.5 A 60 MET CE C 13 17.308 0.5 A 60 MET CG C 13 32.350 0.5 A 60 MET N N 15 117.700 0.4 A 61 ILE H H 1 8.240 0.03 A 61 ILE HA H 1 3.310 0.03 A 61 ILE HB H 1 1.880 0.03 A 61 ILE HD1% H 1 0.770 0.03 A 61 ILE HG12 H 1 0.770 0.03 A 61 ILE HG13 H 1 1.770 0.03 A 61 ILE HG2% H 1 0.860 0.03 A 61 ILE CA C 13 65.880 0.5 A 61 ILE CB C 13 37.870 0.5 A 61 ILE CD1 C 13 14.190 0.5 A 61 ILE CG1 C 13 30.050 0.5 A 61 ILE CG2 C 13 17.270 0.5 A 61 ILE N N 15 120.040 0.4 A 62 ASP H H 1 8.165 0.03 A 62 ASP HA H 1 4.300 0.03 A 62 ASP HBy H 1 2.780 0.03 A 62 ASP HBx H 1 2.650 0.03 A 62 ASP CA C 13 57.130 0.5 A 62 ASP CB C 13 40.390 0.5 A 62 ASP N N 15 118.180 0.4 A 63 GLU H H 1 7.520 0.03 A 63 GLU HA H 1 4.210 0.03 A 63 GLU HBx H 1 2.010 0.03 A 63 GLU HBy H 1 2.010 0.03 A 63 GLU HGx H 1 2.249 0.03 A 63 GLU HGy H 1 2.411 0.03 A 63 GLU CA C 13 57.800 0.5 A 63 GLU CB C 13 30.750 0.5 A 63 GLU CG C 13 35.900 0.5 A 63 GLU N N 15 116.000 0.4 A 64 VAL H H 1 8.000 0.03 A 64 VAL HA H 1 4.209 0.03 A 64 VAL HB H 1 2.239 0.03 A 64 VAL HGx% H 1 0.888 0.03 A 64 VAL HGy% H 1 0.888 0.03 A 64 VAL CA C 13 63.100 0.5 A 64 VAL CB C 13 32.300 0.5 A 64 VAL CGx C 13 21.460 0.5 A 64 VAL CGy C 13 21.460 0.5 A 64 VAL N N 15 114.000 0.4 A 65 ASP H H 1 8.150 0.03 A 65 ASP HA H 1 4.976 0.03 A 65 ASP HBx H 1 2.178 0.03 A 65 ASP HBy H 1 2.920 0.03 A 65 ASP CA C 13 52.790 0.5 A 65 ASP CB C 13 39.130 0.5 A 65 ASP N N 15 120.430 0.4 A 66 GLU H H 1 8.270 0.03 A 66 GLU HA H 1 4.051 0.03 A 66 GLU HBx H 1 2.415 0.03 A 66 GLU HBy H 1 2.415 0.03 A 66 GLU HGx H 1 2.415 0.03 A 66 GLU HGy H 1 2.415 0.03 A 66 GLU CA C 13 59.110 0.5 A 66 GLU CB C 13 30.410 0.5 A 66 GLU CG C 13 36.320 0.5 A 66 GLU N N 15 126.630 0.4 A 67 ASP H H 1 8.010 0.03 A 67 ASP HA H 1 4.647 0.03 A 67 ASP HBx H 1 2.746 0.03 A 67 ASP HBy H 1 3.096 0.03 A 67 ASP CA C 13 52.490 0.5 A 67 ASP CB C 13 39.800 0.5 A 67 ASP N N 15 114.010 0.4 A 68 GLY H H 1 7.900 0.03 A 68 GLY HAx H 1 3.840 0.03 A 68 GLY HAy H 1 3.840 0.03 A 68 GLY CA C 13 47.020 0.5 A 68 GLY N N 15 109.250 0.4 A 69 SER H H 1 8.420 0.03 A 69 SER HA H 1 4.208 0.03 A 69 SER HBx H 1 3.931 0.03 A 69 SER HBy H 1 3.931 0.03 A 69 SER CA C 13 60.070 0.5 A 69 SER CB C 13 64.720 0.5 A 69 SER N N 15 115.750 0.4 A 70 GLY H H 1 10.750 0.03 A 70 GLY HAy H 1 4.210 0.03 A 70 GLY HAx H 1 3.610 0.03 A 70 GLY CA C 13 45.780 0.5 A 70 GLY N N 15 116.260 0.4 A 71 THR H H 1 7.850 0.03 A 71 THR HA H 1 5.001 0.03 A 71 THR HB H 1 4.012 0.03 A 71 THR HG2% H 1 1.082 0.03 A 71 THR CA C 13 58.320 0.5 A 71 THR CB C 13 72.950 0.5 A 71 THR CG2 C 13 22.520 0.5 A 71 THR N N 15 110.000 0.4 A 72 VAL H H 1 9.680 0.03 A 72 VAL HA H 1 5.122 0.03 A 72 VAL HB H 1 2.163 0.03 A 72 VAL HGx% H 1 1.156 0.03 A 72 VAL HGy% H 1 0.861 0.03 A 72 VAL CA C 13 60.910 0.5 A 72 VAL CB C 13 33.690 0.5 A 72 VAL CGx C 13 21.690 0.5 A 72 VAL CGy C 13 21.850 0.5 A 72 VAL N N 15 126.310 0.4 A 73 ASP H H 1 8.630 0.03 A 73 ASP HA H 1 5.179 0.03 A 73 ASP HBx H 1 2.862 0.03 A 73 ASP HBy H 1 3.257 0.03 A 73 ASP CA C 13 52.510 0.5 A 73 ASP CB C 13 41.790 0.5 A 73 ASP N N 15 127.350 0.4 A 74 PHE H H 1 8.840 0.03 A 74 PHE HA H 1 3.418 0.03 A 74 PHE HBx H 1 2.510 0.03 A 74 PHE HBy H 1 2.637 0.03 A 74 PHE CA C 13 61.410 0.5 A 74 PHE CB C 13 38.600 0.5 A 74 PHE N N 15 118.600 0.4 A 75 ASP H H 1 7.800 0.03 A 75 ASP HA H 1 4.489 0.03 A 75 ASP HBx H 1 4.028 0.03 A 75 ASP HBy H 1 4.231 0.03 A 75 ASP CA C 13 57.940 0.5 A 75 ASP CB C 13 40.320 0.5 A 75 ASP N N 15 117.290 0.4 A 76 GLU H H 1 8.210 0.03 A 76 GLU HA H 1 4.106 0.03 A 76 GLU HBx H 1 2.053 0.03 A 76 GLU HBy H 1 2.142 0.03 A 76 GLU HGy H 1 2.415 0.03 A 76 GLU HGx H 1 2.309 0.03 A 76 GLU CA C 13 58.440 0.5 A 76 GLU CB C 13 30.030 0.5 A 76 GLU CG C 13 36.490 0.5 A 76 GLU N N 15 120.390 0.4 A 77 PHE H H 1 8.820 0.03 A 77 PHE HA H 1 3.917 0.03 A 77 PHE HBx H 1 3.076 0.03 A 77 PHE HBy H 1 3.076 0.03 A 77 PHE HDx H 1 6.625 0.03 A 77 PHE HEx H 1 7.169 0.03 A 77 PHE CA C 13 61.070 0.5 A 77 PHE CB C 13 39.720 0.5 A 77 PHE CDx C 13 132.110 0.5 A 77 PHE CEx C 13 130.311 0.5 A 77 PHE N N 15 121.610 0.4 A 78 LEU H H 1 8.080 0.03 A 78 LEU HA H 1 3.367 0.03 A 78 LEU HBx H 1 1.065 0.03 A 78 LEU HBy H 1 1.065 0.03 A 78 LEU HDx% H 1 0.685 0.03 A 78 LEU HDy% H 1 0.641 0.03 A 78 LEU HG H 1 1.809 0.03 A 78 LEU CA C 13 58.070 0.5 A 78 LEU CB C 13 41.530 0.5 A 78 LEU CDx C 13 23.960 0.5 A 78 LEU CDy C 13 25.810 0.5 A 78 LEU N N 15 118.580 0.4 A 79 VAL H H 1 7.080 0.03 A 79 VAL HA H 1 3.247 0.03 A 79 VAL HB H 1 2.213 0.03 A 79 VAL HGx% H 1 1.008 0.03 A 79 VAL HGy% H 1 0.638 0.03 A 79 VAL CA C 13 66.570 0.5 A 79 VAL CB C 13 30.910 0.5 A 79 VAL CGy C 13 23.380 0.5 A 79 VAL CGx C 13 21.780 0.5 A 79 VAL N N 15 117.820 0.4 A 80 MET H H 1 7.710 0.03 A 80 MET HA H 1 3.617 0.03 A 80 MET HBx H 1 1.922 0.03 A 80 MET HBy H 1 2.094 0.03 A 80 MET HE% H 1 1.798 0.03 A 80 MET HGx H 1 2.493 0.03 A 80 MET HGy H 1 2.493 0.03 A 80 MET CA C 13 59.160 0.5 A 80 MET CB C 13 32.680 0.5 A 80 MET CE C 13 17.930 0.5 A 80 MET CG C 13 32.220 0.5 A 80 MET N N 15 119.120 0.4 A 81 MET H H 1 8.000 0.03 A 81 MET HA H 1 4.017 0.03 A 81 MET HBx H 1 1.030 0.03 A 81 MET HBy H 1 1.520 0.03 A 81 MET HE% H 1 2.131 0.03 A 81 MET HGx H 1 1.230 0.03 A 81 MET HGy H 1 1.230 0.03 A 81 MET CA C 13 56.100 0.5 A 81 MET CB C 13 30.790 0.5 A 81 MET CE C 13 17.880 0.5 A 81 MET CG C 13 32.130 0.5 A 81 MET N N 15 117.460 0.4 A 82 VAL H H 1 8.060 0.03 A 82 VAL HA H 1 3.942 0.03 A 82 VAL HB H 1 2.207 0.03 A 82 VAL HGx% H 1 0.986 0.03 A 82 VAL HGy% H 1 1.116 0.03 A 82 VAL CA C 13 65.710 0.5 A 82 VAL CB C 13 31.230 0.5 A 82 VAL CGx C 13 21.810 0.5 A 82 VAL CGy C 13 21.810 0.5 A 82 VAL N N 15 117.340 0.4 A 83 ARG H H 1 8.080 0.03 A 83 ARG HA H 1 3.841 0.03 A 83 ARG HBx H 1 1.444 0.03 A 83 ARG HBy H 1 1.503 0.03 A 83 ARG HDx H 1 2.714 0.03 A 83 ARG HDy H 1 2.714 0.03 A 83 ARG HGx H 1 1.679 0.03 A 83 ARG HGy H 1 1.679 0.03 A 83 ARG CA C 13 58.980 0.5 A 83 ARG CB C 13 30.040 0.5 A 83 ARG CD C 13 43.720 0.5 A 83 ARG CG C 13 27.170 0.5 A 83 ARG N N 15 120.670 0.4 A 84 SER H H 1 7.710 0.03 A 84 SER HA H 1 4.260 0.03 A 84 SER HBx H 1 3.838 0.03 A 84 SER HBy H 1 3.838 0.03 A 84 SER CA C 13 60.250 0.5 A 84 SER CB C 13 63.580 0.5 A 84 SER N N 15 113.490 0.4 A 85 MET H H 1 7.650 0.03 A 85 MET HA H 1 4.308 0.03 A 85 MET HBy H 1 2.194 0.03 A 85 MET HBx H 1 2.096 0.03 A 85 MET HE% H 1 2.121 0.03 A 85 MET HGx H 1 2.558 0.03 A 85 MET HGy H 1 2.779 0.03 A 85 MET CA C 13 57.000 0.5 A 85 MET CB C 13 33.630 0.5 A 85 MET CE C 13 16.970 0.5 A 85 MET CG C 13 32.150 0.5 A 85 MET N N 15 119.980 0.4 A 86 LYS H H 1 7.830 0.03 A 86 LYS HA H 1 4.307 0.03 A 86 LYS HBx H 1 1.868 0.03 A 86 LYS HBy H 1 1.868 0.03 A 86 LYS HDx H 1 1.696 0.03 A 86 LYS HDy H 1 1.696 0.03 A 86 LYS HEx H 1 3.007 0.03 A 86 LYS HEy H 1 3.007 0.03 A 86 LYS HGx H 1 1.480 0.03 A 86 LYS HGy H 1 1.480 0.03 A 86 LYS CA C 13 56.630 0.5 A 86 LYS CB C 13 33.060 0.5 A 86 LYS CD C 13 29.120 0.5 A 86 LYS CE C 13 42.150 0.5 A 86 LYS CG C 13 24.500 0.5 A 86 LYS N N 15 120.730 0.4 A 87 ASP H H 1 8.250 0.03 A 87 ASP HA H 1 4.674 0.03 A 87 ASP HBx H 1 2.711 0.03 A 87 ASP HBy H 1 2.711 0.03 A 87 ASP CA C 13 54.330 0.5 A 87 ASP CB C 13 41.220 0.5 A 87 ASP N N 15 121.600 0.4 A 88 ASP H H 1 8.320 0.03 A 88 ASP HA H 1 4.669 0.03 A 88 ASP HBx H 1 2.688 0.03 A 88 ASP HBy H 1 2.688 0.03 A 88 ASP CA C 13 54.460 0.5 A 88 ASP CB C 13 41.130 0.5 A 88 ASP N N 15 122.400 0.4 A 89 SER H H 1 8.330 0.03 A 89 SER HA H 1 4.413 0.03 A 89 SER HBx H 1 3.934 0.03 A 89 SER HBy H 1 3.934 0.03 A 89 SER CA C 13 59.000 0.5 A 89 SER CB C 13 63.690 0.5 A 89 SER N N 15 116.180 0.4 A 90 LYS H H 1 8.200 0.03 A 90 LYS HA H 1 4.366 0.03 A 90 LYS HBy H 1 1.891 0.03 A 90 LYS HBx H 1 1.817 0.03 A 90 LYS HDx H 1 1.692 0.03 A 90 LYS HDy H 1 1.692 0.03 A 90 LYS HEx H 1 3.017 0.03 A 90 LYS HEy H 1 3.017 0.03 A 90 LYS HGx H 1 1.467 0.03 A 90 LYS HGy H 1 1.467 0.03 A 90 LYS CA C 13 56.530 0.5 A 90 LYS CB C 13 32.900 0.5 A 90 LYS CD C 13 28.960 0.5 A 90 LYS CE C 13 42.100 0.5 A 90 LYS CG C 13 24.640 0.5 A 90 LYS N N 15 122.820 0.4 A 91 GLY H H 1 8.340 0.03 A 91 GLY HAx H 1 3.987 0.03 A 91 GLY HAy H 1 3.987 0.03 A 91 GLY CA C 13 45.170 0.5 A 91 GLY N N 15 109.630 0.4 A 92 LYS H H 1 8.260 0.03 A 92 LYS HA H 1 4.434 0.03 A 92 LYS HBy H 1 1.802 0.03 A 92 LYS HBx H 1 1.716 0.03 A 92 LYS HDx H 1 1.614 0.03 A 92 LYS HDy H 1 1.614 0.03 A 92 LYS HEx H 1 2.994 0.03 A 92 LYS HEy H 1 2.994 0.03 A 92 LYS HGx H 1 1.456 0.03 A 92 LYS HGy H 1 1.456 0.03 A 92 LYS CA C 13 56.130 0.5 A 92 LYS CB C 13 33.770 0.5 A 92 LYS CD C 13 29.140 0.5 A 92 LYS CE C 13 42.140 0.5 A 92 LYS CG C 13 25.050 0.5 A 92 LYS N N 15 120.770 0.4 A 93 SER H H 1 8.670 0.03 A 93 SER HA H 1 4.492 0.03 A 93 SER HBy H 1 4.230 0.03 A 93 SER HBx H 1 4.027 0.03 A 93 SER CA C 13 58.050 0.5 A 93 SER CB C 13 64.670 0.5 A 93 SER N N 15 117.780 0.4 A 94 GLU H H 1 8.830 0.03 A 94 GLU HA H 1 4.082 0.03 A 94 GLU HBx H 1 2.091 0.03 A 94 GLU HBy H 1 2.091 0.03 A 94 GLU HGx H 1 2.226 0.03 A 94 GLU HGy H 1 2.226 0.03 A 94 GLU CA C 13 59.430 0.5 A 94 GLU CB C 13 29.370 0.5 A 94 GLU CG C 13 36.700 0.5 A 94 GLU N N 15 122.220 0.4 A 95 GLU H H 1 8.540 0.03 A 95 GLU HA H 1 4.133 0.03 A 95 GLU HBx H 1 2.046 0.03 A 95 GLU HBy H 1 2.046 0.03 A 95 GLU HGx H 1 2.331 0.03 A 95 GLU HGy H 1 2.331 0.03 A 95 GLU CA C 13 59.290 0.5 A 95 GLU CB C 13 29.480 0.5 A 95 GLU CG C 13 36.540 0.5 A 95 GLU N N 15 119.850 0.4 A 96 GLU H H 1 8.020 0.03 A 96 GLU HA H 1 4.240 0.03 A 96 GLU HBy H 1 2.244 0.03 A 96 GLU HBx H 1 2.084 0.03 A 96 GLU HGy H 1 2.402 0.03 A 96 GLU HGx H 1 2.334 0.03 A 96 GLU CA C 13 58.820 0.5 A 96 GLU CB C 13 30.070 0.5 A 96 GLU CG C 13 36.890 0.5 A 96 GLU N N 15 120.250 0.4 A 97 LEU H H 1 8.440 0.03 A 97 LEU HA H 1 4.351 0.03 A 97 LEU HBy H 1 2.096 0.03 A 97 LEU HBx H 1 1.566 0.03 A 97 LEU HDx% H 1 0.838 0.03 A 97 LEU HDy% H 1 0.838 0.03 A 97 LEU HG H 1 1.825 0.03 A 97 LEU CA C 13 58.040 0.5 A 97 LEU CB C 13 41.940 0.5 A 97 LEU CDy C 13 26.120 0.5 A 97 LEU CDx C 13 23.670 0.5 A 97 LEU CG C 13 27.160 0.5 A 97 LEU N N 15 120.800 0.4 A 98 SER H H 1 8.600 0.03 A 98 SER HA H 1 4.343 0.03 A 98 SER HBx H 1 4.092 0.03 A 98 SER HBy H 1 4.092 0.03 A 98 SER CA C 13 61.780 0.5 A 98 SER N N 15 116.050 0.4 A 99 ASP H H 1 7.870 0.03 A 99 ASP HA H 1 4.664 0.03 A 99 ASP HBx H 1 2.655 0.03 A 99 ASP HBy H 1 2.862 0.03 A 99 ASP CA C 13 57.330 0.5 A 99 ASP CB C 13 40.430 0.5 A 99 ASP N N 15 121.620 0.4 A 100 LEU H H 1 8.010 0.03 A 100 LEU HA H 1 4.136 0.03 A 100 LEU HBy H 1 2.112 0.03 A 100 LEU HBx H 1 1.908 0.03 A 100 LEU HDx% H 1 1.091 0.03 A 100 LEU HDy% H 1 1.161 0.03 A 100 LEU HG H 1 1.891 0.03 A 100 LEU CA C 13 57.930 0.5 A 100 LEU CB C 13 42.510 0.5 A 100 LEU CDx C 13 24.530 0.5 A 100 LEU CDy C 13 24.860 0.5 A 100 LEU CG C 13 27.150 0.5 A 100 LEU N N 15 122.000 0.4 A 101 PHE H H 1 8.400 0.03 A 101 PHE HA H 1 3.264 0.03 A 101 PHE HBx H 1 2.813 0.03 A 101 PHE HBy H 1 3.104 0.03 A 101 PHE HDx H 1 6.429 0.03 A 101 PHE HEx H 1 6.957 0.03 A 101 PHE HZ H 1 7.128 0.03 A 101 PHE CA C 13 62.130 0.5 A 101 PHE CB C 13 39.230 0.5 A 101 PHE CDx C 13 131.758 0.5 A 101 PHE CEx C 13 130.867 0.5 A 101 PHE CZ C 13 133.252 0.5 A 101 PHE N N 15 119.380 0.4 A 102 ARG H H 1 7.720 0.03 A 102 ARG HA H 1 3.930 0.03 A 102 ARG HBy H 1 1.940 0.03 A 102 ARG HBx H 1 1.898 0.03 A 102 ARG HDx H 1 3.244 0.03 A 102 ARG HDy H 1 3.244 0.03 A 102 ARG HGx H 1 1.908 0.03 A 102 ARG HGy H 1 1.908 0.03 A 102 ARG CA C 13 58.730 0.5 A 102 ARG CB C 13 30.280 0.5 A 102 ARG CD C 13 43.290 0.5 A 102 ARG CG C 13 28.210 0.5 A 102 ARG N N 15 114.040 0.4 A 103 MET H H 1 7.620 0.03 A 103 MET HA H 1 3.875 0.03 A 103 MET HBy H 1 1.969 0.03 A 103 MET HBx H 1 1.792 0.03 A 103 MET HE% H 1 1.946 0.03 A 103 MET HGx H 1 1.796 0.03 A 103 MET CA C 13 57.980 0.5 A 103 MET CB C 13 32.350 0.5 A 103 MET CE C 13 16.947 0.5 A 103 MET CG C 13 31.120 0.5 A 103 MET N N 15 117.630 0.4 A 104 TRP H H 1 7.370 0.03 A 104 TRP HA H 1 4.838 0.03 A 104 TRP HBx H 1 2.747 0.03 A 104 TRP HBy H 1 3.197 0.03 A 104 TRP HD1 H 1 7.226 0.03 A 104 TRP HE1 H 1 10.031 0.03 A 104 TRP HE3 H 1 7.854 0.03 A 104 TRP HH2 H 1 7.167 0.03 A 104 TRP HZ2 H 1 7.497 0.03 A 104 TRP HZ3 H 1 7.078 0.03 A 104 TRP CA C 13 56.960 0.5 A 104 TRP CB C 13 30.310 0.5 A 104 TRP CD1 C 13 128.140 0.5 A 104 TRP CE3 C 13 120.420 0.5 A 104 TRP CH2 C 13 124.640 0.5 A 104 TRP CZ2 C 13 114.800 0.5 A 104 TRP CZ3 C 13 121.590 0.5 A 104 TRP N N 15 117.250 0.4 A 104 TRP NE1 N 15 127.770 0.4 A 105 ASP H H 1 7.700 0.03 A 105 ASP HA H 1 4.519 0.03 A 105 ASP HBy H 1 2.436 0.03 A 105 ASP HBx H 1 1.542 0.03 A 105 ASP CA C 13 52.200 0.5 A 105 ASP CB C 13 37.980 0.5 A 105 ASP N N 15 119.830 0.4 A 106 LYS H H 1 7.460 0.03 A 106 LYS HA H 1 3.950 0.03 A 106 LYS HBx H 1 1.956 0.03 A 106 LYS HBy H 1 1.956 0.03 A 106 LYS HDx H 1 1.760 0.03 A 106 LYS HDy H 1 1.760 0.03 A 106 LYS HEx H 1 3.140 0.03 A 106 LYS HEy H 1 3.140 0.03 A 106 LYS HGx H 1 1.580 0.03 A 106 LYS HGy H 1 1.660 0.03 A 106 LYS CA C 13 58.480 0.5 A 106 LYS CB C 13 32.770 0.5 A 106 LYS CD C 13 28.600 0.5 A 106 LYS CE C 13 42.476 0.5 A 106 LYS CG C 13 24.680 0.5 A 106 LYS N N 15 125.030 0.4 A 107 ASN H H 1 7.960 0.03 A 107 ASN HA H 1 4.734 0.03 A 107 ASN CA C 13 51.620 0.5 A 107 ASN CB C 13 36.750 0.5 A 107 ASN N N 15 113.410 0.4 A 108 ALA H H 1 7.860 0.03 A 108 ALA HA H 1 4.034 0.03 A 108 ALA HB% H 1 1.353 0.03 A 108 ALA CA C 13 53.120 0.5 A 108 ALA CB C 13 16.980 0.5 A 108 ALA N N 15 121.620 0.4 A 109 ASP H H 1 8.440 0.03 A 109 ASP HA H 1 4.695 0.03 A 109 ASP HBy H 1 3.198 0.03 A 109 ASP HBx H 1 2.449 0.03 A 109 ASP CA C 13 53.170 0.5 A 109 ASP CB C 13 41.000 0.5 A 109 ASP N N 15 117.930 0.4 A 110 GLY H H 1 10.360 0.03 A 110 GLY HAy H 1 4.047 0.03 A 110 GLY HAx H 1 3.445 0.03 A 110 GLY CA C 13 45.010 0.5 A 110 GLY N N 15 112.110 0.4 A 111 TYR H H 1 7.970 0.03 A 111 TYR HA H 1 5.285 0.03 A 111 TYR HBy H 1 2.693 0.03 A 111 TYR HBx H 1 2.573 0.03 A 111 TYR HDx H 1 6.724 0.03 A 111 TYR HEx H 1 6.839 0.03 A 111 TYR CA C 13 56.020 0.5 A 111 TYR CB C 13 43.110 0.5 A 111 TYR CDx C 13 133.780 0.5 A 111 TYR CEx C 13 118.080 0.5 A 111 TYR N N 15 115.750 0.4 A 112 ILE H H 1 10.020 0.03 A 112 ILE HA H 1 4.925 0.03 A 112 ILE HB H 1 1.868 0.03 A 112 ILE HD1% H 1 0.398 0.03 A 112 ILE HG12 H 1 0.621 0.03 A 112 ILE HG13 H 1 1.030 0.03 A 112 ILE HG2% H 1 0.921 0.03 A 112 ILE CA C 13 60.010 0.5 A 112 ILE CB C 13 38.470 0.5 A 112 ILE CD1 C 13 13.440 0.5 A 112 ILE CG1 C 13 27.200 0.5 A 112 ILE CG2 C 13 17.440 0.5 A 112 ILE N N 15 126.240 0.4 A 113 ASP H H 1 8.900 0.03 A 113 ASP HA H 1 4.848 0.03 A 113 ASP HBx H 1 2.509 0.03 A 113 ASP HBy H 1 3.357 0.03 A 113 ASP CA C 13 51.980 0.5 A 113 ASP CB C 13 41.790 0.5 A 113 ASP N N 15 128.530 0.4 A 114 LEU H H 1 8.470 0.03 A 114 LEU HA H 1 3.948 0.03 A 114 LEU HBx H 1 1.702 0.03 A 114 LEU HBy H 1 1.702 0.03 A 114 LEU HDx% H 1 0.941 0.03 A 114 LEU HDy% H 1 0.954 0.03 A 114 LEU HG H 1 1.694 0.03 A 114 LEU CA C 13 58.990 0.5 A 114 LEU CB C 13 42.130 0.5 A 114 LEU CDy C 13 25.250 0.5 A 114 LEU CDx C 13 24.390 0.5 A 114 LEU CG C 13 27.230 0.5 A 114 LEU N N 15 118.050 0.4 A 115 ASP H H 1 7.840 0.03 A 115 ASP HA H 1 4.372 0.03 A 115 ASP HBx H 1 2.667 0.03 A 115 ASP HBy H 1 2.811 0.03 A 115 ASP CA C 13 57.680 0.5 A 115 ASP CB C 13 40.670 0.5 A 115 ASP N N 15 118.130 0.4 A 116 GLU H H 1 8.560 0.03 A 116 GLU HA H 1 4.106 0.03 A 116 GLU HBx H 1 2.309 0.03 A 116 GLU HBy H 1 2.309 0.03 A 116 GLU HGy H 1 2.400 0.03 A 116 GLU HGx H 1 2.300 0.03 A 116 GLU CA C 13 58.550 0.5 A 116 GLU CB C 13 30.090 0.5 A 116 GLU CG C 13 37.170 0.5 A 116 GLU N N 15 121.120 0.4 A 117 LEU H H 1 8.990 0.03 A 117 LEU HA H 1 3.892 0.03 A 117 LEU HBy H 1 1.913 0.03 A 117 LEU HBx H 1 1.818 0.03 A 117 LEU HDx% H 1 0.832 0.03 A 117 LEU HDy% H 1 0.838 0.03 A 117 LEU HG H 1 1.582 0.03 A 117 LEU CA C 13 57.680 0.5 A 117 LEU CB C 13 42.190 0.5 A 117 LEU CDy C 13 26.420 0.5 A 117 LEU CDx C 13 23.850 0.5 A 117 LEU CG C 13 31.350 0.5 A 117 LEU N N 15 122.790 0.4 A 118 LYS H H 1 8.060 0.03 A 118 LYS HA H 1 3.757 0.03 A 118 LYS HBx H 1 1.996 0.03 A 118 LYS HBy H 1 1.996 0.03 A 118 LYS HDx H 1 1.734 0.03 A 118 LYS HDy H 1 1.734 0.03 A 118 LYS HEx H 1 2.865 0.03 A 118 LYS HEy H 1 2.931 0.03 A 118 LYS HGy H 1 1.559 0.03 A 118 LYS HGx H 1 1.299 0.03 A 118 LYS CA C 13 60.620 0.5 A 118 LYS CB C 13 32.420 0.5 A 118 LYS CD C 13 29.770 0.5 A 118 LYS CE C 13 41.970 0.5 A 118 LYS CG C 13 25.790 0.5 A 118 LYS N N 15 117.850 0.4 A 119 ILE H H 1 7.420 0.03 A 119 ILE HA H 1 3.749 0.03 A 119 ILE HB H 1 1.996 0.03 A 119 ILE HD1% H 1 0.938 0.03 A 119 ILE HG12 H 1 1.794 0.03 A 119 ILE HG13 H 1 1.316 0.03 A 119 ILE HG2% H 1 1.100 0.03 A 119 ILE CA C 13 64.520 0.5 A 119 ILE CB C 13 37.940 0.5 A 119 ILE CD1 C 13 12.900 0.5 A 119 ILE CG1 C 13 28.950 0.5 A 119 ILE CG2 C 13 17.750 0.5 A 119 ILE N N 15 117.730 0.4 A 120 MET H H 1 7.650 0.03 A 120 MET HA H 1 4.484 0.03 A 120 MET HE% H 1 2.133 0.03 A 120 MET HGy H 1 1.859 0.03 A 120 MET HGx H 1 1.604 0.03 A 120 MET CA C 13 58.230 0.5 A 120 MET CB C 13 32.550 0.5 A 120 MET CG C 13 30.950 0.5 A 120 MET N N 15 120.680 0.4 A 121 LEU H H 1 8.240 0.03 A 121 LEU HA H 1 4.031 0.03 A 121 LEU HBx H 1 1.604 0.03 A 121 LEU HBy H 1 1.765 0.03 A 121 LEU HDx% H 1 0.815 0.03 A 121 LEU HDy% H 1 0.902 0.03 A 121 LEU HG H 1 1.401 0.03 A 121 LEU CA C 13 56.810 0.5 A 121 LEU CB C 13 41.320 0.5 A 121 LEU CDx C 13 26.740 0.5 A 121 LEU CDy C 13 26.740 0.5 A 121 LEU CG C 13 22.300 0.5 A 121 LEU N N 15 118.200 0.4 A 122 GLN H H 1 8.120 0.03 A 122 GLN HA H 1 4.228 0.03 A 122 GLN HBx H 1 2.170 0.03 A 122 GLN HBy H 1 2.170 0.03 A 122 GLN HGy H 1 2.605 0.03 A 122 GLN HGx H 1 2.404 0.03 A 122 GLN CA C 13 57.980 0.5 A 122 GLN CB C 13 28.500 0.5 A 122 GLN CG C 13 34.790 0.5 A 122 GLN N N 15 118.410 0.4 A 123 ALA H H 1 7.670 0.03 A 123 ALA HA H 1 4.323 0.03 A 123 ALA HB% H 1 1.628 0.03 A 123 ALA CA C 13 54.260 0.5 A 123 ALA CB C 13 19.280 0.5 A 123 ALA N N 15 121.900 0.4 A 124 THR H H 1 7.600 0.03 A 124 THR HA H 1 4.398 0.03 A 124 THR HB H 1 4.452 0.03 A 124 THR HG2% H 1 1.336 0.03 A 124 THR CA C 13 62.360 0.5 A 124 THR CB C 13 70.110 0.5 A 124 THR CG2 C 13 21.610 0.5 A 124 THR N N 15 107.350 0.4 A 125 GLY H H 1 7.850 0.03 A 125 GLY HAy H 1 4.192 0.03 A 125 GLY HAx H 1 3.891 0.03 A 125 GLY CA C 13 45.610 0.5 A 125 GLY N N 15 109.310 0.4 A 126 GLU H H 1 7.930 0.03 A 126 GLU HA H 1 4.388 0.03 A 126 GLU HBx H 1 1.826 0.03 A 126 GLU HBy H 1 2.032 0.03 A 126 GLU HGx H 1 2.221 0.03 A 126 GLU HGy H 1 2.259 0.03 A 126 GLU CA C 13 56.060 0.5 A 126 GLU CB C 13 30.520 0.5 A 126 GLU CG C 13 35.920 0.5 A 126 GLU N N 15 120.170 0.4 A 127 THR H H 1 8.540 0.03 A 127 THR HA H 1 4.294 0.03 A 127 THR HB H 1 4.158 0.03 A 127 THR HG2% H 1 1.179 0.03 A 127 THR CA C 13 62.490 0.5 A 127 THR CB C 13 68.980 0.5 A 127 THR CG2 C 13 21.650 0.5 A 127 THR N N 15 117.220 0.4 A 128 ILE H H 1 8.110 0.03 A 128 ILE HA H 1 4.601 0.03 A 128 ILE HB H 1 1.905 0.03 A 128 ILE HD1% H 1 0.755 0.03 A 128 ILE HG12 H 1 1.253 0.03 A 128 ILE HG13 H 1 1.410 0.03 A 128 ILE HG2% H 1 0.892 0.03 A 128 ILE CA C 13 59.500 0.5 A 128 ILE CB C 13 39.740 0.5 A 128 ILE CD1 C 13 13.160 0.5 A 128 ILE CG1 C 13 26.930 0.5 A 128 ILE CG2 C 13 17.770 0.5 A 128 ILE N N 15 125.250 0.4 A 129 THR H H 1 8.860 0.03 A 129 THR HA H 1 4.595 0.03 A 129 THR HB H 1 3.591 0.03 A 129 THR HG2% H 1 1.295 0.03 A 129 THR CA C 13 60.610 0.5 A 129 THR CB C 13 71.560 0.5 A 129 THR CG2 C 13 21.650 0.5 A 129 THR N N 15 117.270 0.4 A 130 GLU H H 1 8.900 0.03 A 130 GLU HA H 1 3.976 0.03 A 130 GLU HBx H 1 2.078 0.03 A 130 GLU HBy H 1 2.078 0.03 A 130 GLU HGx H 1 2.359 0.03 A 130 GLU HGy H 1 2.359 0.03 A 130 GLU CA C 13 60.050 0.5 A 130 GLU CB C 13 29.160 0.5 A 130 GLU CG C 13 36.510 0.5 A 130 GLU N N 15 120.610 0.4 A 131 ASP H H 1 8.170 0.03 A 131 ASP HA H 1 4.402 0.03 A 131 ASP HBx H 1 2.509 0.03 A 131 ASP HBy H 1 2.671 0.03 A 131 ASP CA C 13 57.060 0.5 A 131 ASP CB C 13 40.520 0.5 A 131 ASP N N 15 117.800 0.4 A 132 ASP H H 1 7.660 0.03 A 132 ASP HA H 1 4.350 0.03 A 132 ASP HBy H 1 3.080 0.03 A 132 ASP HBx H 1 2.625 0.03 A 132 ASP CA C 13 60.200 0.5 A 132 ASP CB C 13 40.640 0.5 A 132 ASP N N 15 120.020 0.4 A 133 ILE H H 1 7.860 0.03 A 133 ILE HA H 1 3.604 0.03 A 133 ILE HB H 1 1.975 0.03 A 133 ILE HD1% H 1 0.812 0.03 A 133 ILE HG12 H 1 1.036 0.03 A 133 ILE HG13 H 1 1.715 0.03 A 133 ILE HG2% H 1 0.896 0.03 A 133 ILE CA C 13 64.760 0.5 A 133 ILE CB C 13 37.580 0.5 A 133 ILE CD1 C 13 13.620 0.5 A 133 ILE CG1 C 13 28.940 0.5 A 133 ILE CG2 C 13 18.100 0.5 A 133 ILE N N 15 120.690 0.4 A 134 GLU H H 1 7.990 0.03 A 134 GLU HA H 1 3.881 0.03 A 134 GLU HBx H 1 2.102 0.03 A 134 GLU HBy H 1 2.168 0.03 A 134 GLU HGy H 1 2.477 0.03 A 134 GLU HGx H 1 2.249 0.03 A 134 GLU CA C 13 59.900 0.5 A 134 GLU CB C 13 29.240 0.5 A 134 GLU CG C 13 36.610 0.5 A 134 GLU N N 15 119.320 0.4 A 135 GLU H H 1 7.800 0.03 A 135 GLU HA H 1 4.073 0.03 A 135 GLU HBx H 1 2.145 0.03 A 135 GLU HBy H 1 2.145 0.03 A 135 GLU HGx H 1 2.401 0.03 A 135 GLU HGy H 1 2.401 0.03 A 135 GLU CA C 13 59.230 0.5 A 135 GLU CB C 13 29.350 0.5 A 135 GLU CG C 13 36.650 0.5 A 135 GLU N N 15 118.910 0.4 A 136 LEU H H 1 7.830 0.03 A 136 LEU HA H 1 4.166 0.03 A 136 LEU HBy H 1 1.899 0.03 A 136 LEU HBx H 1 1.760 0.03 A 136 LEU HDx% H 1 0.866 0.03 A 136 LEU HDy% H 1 0.866 0.03 A 136 LEU HG H 1 1.566 0.03 A 136 LEU CA C 13 58.150 0.5 A 136 LEU CB C 13 42.020 0.5 A 136 LEU CDy C 13 25.660 0.5 A 136 LEU CDx C 13 24.100 0.5 A 136 LEU CG C 13 29.400 0.5 A 136 LEU N N 15 121.180 0.4 A 137 MET H H 1 8.170 0.03 A 137 MET HA H 1 4.156 0.03 A 137 MET HBx H 1 2.176 0.03 A 137 MET HBy H 1 2.176 0.03 A 137 MET HE% H 1 1.968 0.03 A 137 MET HGx H 1 2.429 0.03 A 137 MET HGy H 1 2.556 0.03 A 137 MET CA C 13 57.440 0.5 A 137 MET CB C 13 31.140 0.5 A 137 MET CE C 13 17.830 0.5 A 137 MET CG C 13 32.140 0.5 A 137 MET N N 15 117.790 0.4 A 138 LYS H H 1 7.800 0.03 A 138 LYS HA H 1 4.056 0.03 A 138 LYS HBx H 1 1.914 0.03 A 138 LYS HBy H 1 1.914 0.03 A 138 LYS HDx H 1 1.694 0.03 A 138 LYS HDy H 1 1.694 0.03 A 138 LYS HEx H 1 2.961 0.03 A 138 LYS HEy H 1 2.961 0.03 A 138 LYS HGx H 1 1.469 0.03 A 138 LYS HGy H 1 1.620 0.03 A 138 LYS CA C 13 59.250 0.5 A 138 LYS CB C 13 32.140 0.5 A 138 LYS CD C 13 29.330 0.5 A 138 LYS CE C 13 42.030 0.5 A 138 LYS CG C 13 25.080 0.5 A 138 LYS N N 15 117.700 0.4 A 139 ASP H H 1 7.800 0.03 A 139 ASP HA H 1 4.506 0.03 A 139 ASP HBx H 1 2.800 0.03 A 139 ASP HBy H 1 2.855 0.03 A 139 ASP CA C 13 56.340 0.5 A 139 ASP CB C 13 41.260 0.5 A 139 ASP N N 15 117.130 0.4 A 140 GLY H H 1 8.130 0.03 A 140 GLY HAx H 1 3.128 0.03 A 140 GLY HAy H 1 4.128 0.03 A 140 GLY CA C 13 45.670 0.5 A 140 GLY N N 15 104.700 0.4 A 141 ASP H H 1 8.220 0.03 A 141 ASP HA H 1 4.618 0.03 A 141 ASP HBx H 1 2.436 0.03 A 141 ASP HBy H 1 2.990 0.03 A 141 ASP CA C 13 53.120 0.5 A 141 ASP CB C 13 39.600 0.5 A 141 ASP N N 15 120.260 0.4 A 142 LYS H H 1 7.810 0.03 A 142 LYS HA H 1 4.196 0.03 A 142 LYS HBx H 1 1.993 0.03 A 142 LYS HBy H 1 1.993 0.03 A 142 LYS HDx H 1 1.735 0.03 A 142 LYS HDy H 1 1.735 0.03 A 142 LYS HEx H 1 3.099 0.03 A 142 LYS HEy H 1 3.099 0.03 A 142 LYS HGy H 1 1.678 0.03 A 142 LYS HGx H 1 1.561 0.03 A 142 LYS CA C 13 57.630 0.5 A 142 LYS CB C 13 32.850 0.5 A 142 LYS CD C 13 28.350 0.5 A 142 LYS CE C 13 42.170 0.5 A 142 LYS CG C 13 24.690 0.5 A 142 LYS N N 15 125.660 0.4 A 143 ASN H H 1 8.120 0.03 A 143 ASN HA H 1 4.851 0.03 A 143 ASN HBx H 1 2.250 0.03 A 143 ASN HBy H 1 2.473 0.03 A 143 ASN CA C 13 51.610 0.5 A 143 ASN CB C 13 37.190 0.5 A 143 ASN N N 15 113.640 0.4 A 144 ASN H H 1 7.760 0.03 A 144 ASN HA H 1 4.492 0.03 A 144 ASN HBx H 1 2.670 0.03 A 144 ASN HBy H 1 3.072 0.03 A 144 ASN CA C 13 55.010 0.5 A 144 ASN CB C 13 37.700 0.5 A 144 ASN N N 15 115.570 0.4 A 145 ASP H H 1 8.580 0.03 A 145 ASP HA H 1 4.725 0.03 A 145 ASP HBx H 1 2.680 0.03 A 145 ASP HBy H 1 2.869 0.03 A 145 ASP CA C 13 52.990 0.5 A 145 ASP CB C 13 40.930 0.5 A 145 ASP N N 15 118.060 0.4 A 146 GLY H H 1 10.400 0.03 A 146 GLY HAy H 1 4.056 0.03 A 146 GLY HAx H 1 3.491 0.03 A 146 GLY CA C 13 45.810 0.5 A 146 GLY N N 15 113.040 0.4 A 147 ARG H H 1 7.730 0.03 A 147 ARG HA H 1 4.809 0.03 A 147 ARG HBx H 1 1.491 0.03 A 147 ARG HBy H 1 1.612 0.03 A 147 ARG HDx H 1 2.238 0.03 A 147 ARG HDy H 1 2.537 0.03 A 147 ARG HGx H 1 1.238 0.03 A 147 ARG HGy H 1 1.284 0.03 A 147 ARG CA C 13 54.020 0.5 A 147 ARG CB C 13 34.200 0.5 A 147 ARG CD C 13 43.000 0.5 A 147 ARG CG C 13 25.600 0.5 A 147 ARG N N 15 115.540 0.4 A 148 ILE H H 1 9.260 0.03 A 148 ILE HA H 1 5.260 0.03 A 148 ILE HB H 1 2.105 0.03 A 148 ILE HD1% H 1 0.565 0.03 A 148 ILE HG12 H 1 0.901 0.03 A 148 ILE HG13 H 1 1.485 0.03 A 148 ILE HG2% H 1 1.176 0.03 A 148 ILE CA C 13 59.490 0.5 A 148 ILE CB C 13 39.220 0.5 A 148 ILE CD1 C 13 12.310 0.5 A 148 ILE CG1 C 13 27.930 0.5 A 148 ILE CG2 C 13 17.720 0.5 A 148 ILE N N 15 125.900 0.4 A 149 ASP H H 1 9.260 0.03 A 149 ASP HA H 1 5.233 0.03 A 149 ASP HBx H 1 2.862 0.03 A 149 ASP HBy H 1 3.257 0.03 A 149 ASP CA C 13 52.370 0.5 A 149 ASP CB C 13 41.850 0.5 A 149 ASP N N 15 128.660 0.4 A 150 TYR H H 1 8.450 0.03 A 150 TYR HA H 1 3.331 0.03 A 150 TYR HBx H 1 2.153 0.03 A 150 TYR HBy H 1 2.464 0.03 A 150 TYR HDx H 1 6.423 0.03 A 150 TYR HEx H 1 6.601 0.03 A 150 TYR CA C 13 62.030 0.5 A 150 TYR CB C 13 38.160 0.5 A 150 TYR CDx C 13 132.840 0.5 A 150 TYR CEx C 13 117.840 0.5 A 150 TYR N N 15 118.640 0.4 A 151 ASP H H 1 7.740 0.03 A 151 ASP HA H 1 4.162 0.03 A 151 ASP HBx H 1 2.009 0.03 A 151 ASP HBy H 1 2.734 0.03 A 151 ASP CA C 13 57.860 0.5 A 151 ASP CB C 13 40.600 0.5 A 151 ASP N N 15 117.500 0.4 A 152 GLU H H 1 8.790 0.03 A 152 GLU HA H 1 4.123 0.03 A 152 GLU HBx H 1 2.309 0.03 A 152 GLU HGx H 1 3.016 0.03 A 152 GLU CA C 13 58.520 0.5 A 152 GLU CB C 13 30.080 0.5 A 152 GLU CG C 13 37.130 0.5 A 152 GLU N N 15 120.550 0.4 A 153 PHE H H 1 9.280 0.03 A 153 PHE HA H 1 4.084 0.03 A 153 PHE HBy H 1 3.391 0.03 A 153 PHE HBx H 1 3.302 0.03 A 153 PHE CA C 13 61.750 0.5 A 153 PHE CB C 13 39.880 0.5 A 153 PHE N N 15 124.510 0.4 A 154 LEU H H 1 8.110 0.03 A 154 LEU HA H 1 3.670 0.03 A 154 LEU HBy H 1 1.742 0.03 A 154 LEU HBx H 1 1.326 0.03 A 154 LEU HDx% H 1 0.743 0.03 A 154 LEU HDy% H 1 0.683 0.03 A 154 LEU HG H 1 1.390 0.03 A 154 LEU CA C 13 58.180 0.5 A 154 LEU CB C 13 41.630 0.5 A 154 LEU CDy C 13 25.110 0.5 A 154 LEU CDx C 13 23.420 0.5 A 154 LEU CG C 13 26.470 0.5 A 154 LEU N N 15 118.370 0.4 A 155 GLU H H 1 7.180 0.03 A 155 GLU HA H 1 4.037 0.03 A 155 GLU HBy H 1 2.120 0.03 A 155 GLU HBx H 1 2.080 0.03 A 155 GLU HGy H 1 2.420 0.03 A 155 GLU HGx H 1 2.233 0.03 A 155 GLU CA C 13 58.760 0.5 A 155 GLU CB C 13 29.760 0.5 A 155 GLU CG C 13 35.990 0.5 A 155 GLU N N 15 116.010 0.4 A 156 PHE H H 1 8.340 0.03 A 156 PHE HA H 1 4.377 0.03 A 156 PHE HBx H 1 3.094 0.03 A 156 PHE HBy H 1 3.309 0.03 A 156 PHE CA C 13 59.840 0.5 A 156 PHE CB C 13 39.960 0.5 A 156 PHE N N 15 121.090 0.4 A 157 MET H H 1 8.090 0.03 A 157 MET HA H 1 4.161 0.03 A 157 MET HBx H 1 2.170 0.03 A 157 MET HBy H 1 2.170 0.03 A 157 MET HE% H 1 2.153 0.03 A 157 MET HGy H 1 2.642 0.03 A 157 MET HGx H 1 2.569 0.03 A 157 MET CA C 13 54.700 0.5 A 157 MET CB C 13 31.010 0.5 A 157 MET CE C 13 15.130 0.5 A 157 MET CG C 13 31.670 0.5 A 157 MET N N 15 115.490 0.4 A 158 LYS H H 1 7.450 0.03 A 158 LYS HA H 1 4.075 0.03 A 158 LYS HBx H 1 1.868 0.03 A 158 LYS HBy H 1 1.868 0.03 A 158 LYS HDx H 1 1.653 0.03 A 158 LYS HDy H 1 1.653 0.03 A 158 LYS HEx H 1 2.918 0.03 A 158 LYS HEy H 1 2.918 0.03 A 158 LYS HGx H 1 1.411 0.03 A 158 LYS HGy H 1 1.563 0.03 A 158 LYS CA C 13 58.230 0.5 A 158 LYS CB C 13 32.470 0.5 A 158 LYS CD C 13 29.360 0.5 A 158 LYS CE C 13 41.930 0.5 A 158 LYS CG C 13 25.020 0.5 A 158 LYS N N 15 119.540 0.4 A 159 GLY H H 1 7.830 0.03 A 159 GLY HAy H 1 4.029 0.03 A 159 GLY HAx H 1 3.830 0.03 A 159 GLY CA C 13 45.320 0.5 A 159 GLY N N 15 107.090 0.4 A 160 VAL H H 1 7.450 0.03 A 160 VAL HA H 1 4.071 0.03 A 160 VAL HB H 1 2.025 0.03 A 160 VAL HGx% H 1 0.820 0.03 A 160 VAL HGy% H 1 0.761 0.03 A 160 VAL CA C 13 62.200 0.5 A 160 VAL CB C 13 32.720 0.5 A 160 VAL CGy C 13 21.190 0.5 A 160 VAL CGx C 13 20.550 0.5 A 160 VAL N N 15 118.920 0.4 A 161 GLU H H 1 7.860 0.03 A 161 GLU HA H 1 4.092 0.03 A 161 GLU HBy H 1 2.009 0.03 A 161 GLU HBx H 1 1.868 0.03 A 161 GLU HGx H 1 2.200 0.03 A 161 GLU HGy H 1 2.200 0.03 A 161 GLU CA C 13 58.060 0.5 A 161 GLU CB C 13 31.120 0.5 A 161 GLU CG C 13 36.560 0.5 A 161 GLU N N 15 129.180 0.4 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 31 ALA HB% A 34 GLY HAy 1.0 . 4.68 2 2 A 31 ALA HB% A 34 GLY HAx 1.0 . 4.68 3 3 A 139 ASP HA A 140 GLY HAy 1.0 . 4.59 4 4 A 140 GLY HAy A 148 ILE HD1% 1.0 . 4.20 5 5 A 48 LEU HA A 49 GLY HAx 1.0 . 5.36 6 6 A 50 GLN HA A 49 GLY HAx 1.0 . 5.74 7 7 A 48 LEU HA A 49 GLY HAy 1.0 . 5.36 8 8 A 50 GLN HA A 49 GLY HAy 1.0 . 5.74 9 9 A 31 ALA HA A 30 GLY HAx 1.0 . 5.40 10 10 A 31 ALA HA A 30 GLY HAy 1.0 . 5.40 11 11 A 90 LYS HA A 91 GLY HAy 1.0 . 5.66 12 12 A 90 LYS HA A 91 GLY HAx 1.0 . 5.66 13 13 A 102 ARG HA A 102 ARG HDx 1.0 . 5.09 14 14 A 102 ARG HA A 102 ARG HDy 1.0 . 5.09 15 15 A 13 THR H A 12 LEU HBx 1.0 . 4.58 16 16 A 147 ARG HBy A 147 ARG HDy 1.0 . 4.11 17 17 A 147 ARG HDx A 147 ARG HBy 1.0 . 4.11 18 18 A 147 ARG HDx A 147 ARG HBx 1.0 . 4.11 19 19 A 12 LEU H A 12 LEU HBy 1.0 . 3.92 20 20 A 116 GLU HBy A 117 LEU HBx 1.0 . 4.54 21 21 A 92 LYS HA A 92 LYS HEx 1.0 . 4.64 22 22 A 92 LYS HA A 92 LYS HEy 1.0 . 4.64 23 23 A 119 ILE HD1% A 118 LYS HEy 1.0 . 5.17 24 24 A 119 ILE HD1% A 118 LYS HEx 1.0 . 5.17 25 25 A 97 LEU H A 97 LEU HBy 1.0 . 4.10 26 26 A 117 LEU HBx A 117 LEU HG 1.0 . 2.80 27 27 A 48 LEU H A 48 LEU HBx 1.0 . 3.84 28 28 A 58 GLN H A 57 LEU HBx 1.0 . 4.37 29 29 A 150 TYR H A 149 ASP HBx 1.0 . 3.96 30 30 A 111 TYR HDx A 149 ASP HBx 1.0 . 4.18 31 31 A 114 LEU H A 113 ASP HBx 1.0 . 3.62 32 32 A 139 ASP HBx A 140 GLY HAx 1.0 . 4.46 33 33 A 139 ASP HBx A 139 ASP H 1.0 . 3.31 34 34 A 139 ASP HBx A 136 LEU HA 1.0 . 4.35 35 35 A 140 GLY HAy A 139 ASP HBx 1.0 . 4.92 36 36 A 136 LEU HA A 139 ASP HBy 1.0 . 3.80 37 37 A 33 ASP H A 33 ASP HBy 1.0 . 4.16 38 38 A 29 LEU H A 29 LEU HBx 1.0 . 4.00 39 39 A 24 PHE H A 24 PHE HBx 1.0 . 3.89 40 40 A 99 ASP H A 99 ASP HBx 1.0 . 3.60 41 41 A 62 ASP HBy A 63 GLU HA 1.0 . 4.20 42 42 A 131 ASP HBx A 132 ASP H 1.0 . 4.07 43 43 A 24 PHE HBy A 25 ASP H 1.0 . 4.09 44 44 A 24 PHE HBy A 21 LYS HA 1.0 . 4.02 45 45 A 24 PHE H A 24 PHE HBy 1.0 . 3.85 46 46 A 24 PHE HBx A 21 LYS HA 1.0 . 4.34 47 47 A 131 ASP H A 131 ASP HBy 1.0 . 3.34 48 48 A 100 LEU H A 99 ASP HBx 1.0 . 3.91 49 49 A 153 PHE H A 153 PHE HBy 1.0 . 3.83 50 50 A 154 LEU H A 153 PHE HBy 1.0 . 4.52 51 51 A 154 LEU H A 153 PHE HBx 1.0 . 4.52 52 52 A 77 PHE HBx A 78 LEU H 1.0 . 3.90 53 53 A 77 PHE HBx A 79 VAL H 1.0 . 5.05 54 54 A 141 ASP H A 141 ASP HBy 1.0 . 3.42 55 55 A 141 ASP H A 141 ASP HBx 1.0 . 3.42 56 56 A 128 ILE H A 128 ILE HB 1.0 . 3.69 57 57 A 36 ILE HD1% A 77 PHE HBy 1.0 . 4.92 58 58 A 148 ILE H A 148 ILE HB 1.0 . 3.39 59 59 A 65 ASP H A 65 ASP HBy 1.0 . 3.65 60 60 A 65 ASP H A 65 ASP HBx 1.0 . 3.65 61 61 A 148 ILE HB A 112 ILE HB 1.0 . 3.26 62 62 A 112 ILE HB A 148 ILE HG2% 1.0 . 4.07 63 63 A 150 TYR H A 150 TYR HBy 1.0 . 3.48 64 64 A 116 GLU HA A 119 ILE HB 1.0 . 4.03 65 65 A 61 ILE H A 61 ILE HB 1.0 . 3.41 66 66 A 5 TYR HBy A 79 VAL HGx% 1.0 . 5.27 67 67 A 144 ASN H A 144 ASN HBy 1.0 . 4.19 68 68 A 15 GLU HA A 18 ASN HBy 1.0 . 4.02 69 69 A 18 ASN H A 18 ASN HBx 1.0 . 3.54 70 70 A 19 GLU H A 18 ASN HBx 1.0 . 4.15 71 71 A 15 GLU HA A 18 ASN HBx 1.0 . 4.02 72 72 A 144 ASN H A 144 ASN HBx 1.0 . 4.19 73 73 A 133 ILE H A 133 ILE HB 1.0 . 3.28 74 74 A 133 ILE HB A 130 GLU HA 1.0 . 3.77 75 75 A 26 ILE HB A 26 ILE HD1% 1.0 . 3.48 76 76 A 26 ILE HB A 27 PHE H 1.0 . 3.90 77 77 A 26 ILE HB A 26 ILE H 1.0 . 3.19 78 78 A 26 ILE HB A 23 ALA HA 1.0 . 4.24 79 79 A 55 GLU H A 55 GLU HGy 1.0 . 4.49 80 80 A 55 GLU H A 55 GLU HGx 1.0 . 4.49 81 81 A 56 GLU H A 56 GLU HGx 1.0 . 4.32 82 82 A 56 GLU H A 56 GLU HGy 1.0 . 4.32 83 83 A 95 GLU H A 95 GLU HGy 1.0 . 4.68 84 84 A 134 GLU HA A 134 GLU HGy 1.0 . 3.84 85 85 A 66 GLU H A 66 GLU HGy 1.0 . 4.70 86 86 A 66 GLU H A 66 GLU HGx 1.0 . 4.70 87 87 A 130 GLU H A 130 GLU HGx 1.0 . 4.68 88 88 A 134 GLU H A 134 GLU HGx 1.0 . 3.91 89 89 A 134 GLU HA A 134 GLU HGx 1.0 . 3.84 90 90 A 161 GLU H A 161 GLU HGy 1.0 . 5.61 91 91 A 19 GLU HA A 19 GLU HGy 1.0 . 3.57 92 92 A 19 GLU HA A 19 GLU HGx 1.0 . 3.57 93 93 A 59 GLU H A 59 GLU HGx 1.0 . 4.47 94 94 A 59 GLU H A 59 GLU HGy 1.0 . 4.47 95 95 A 122 GLN HA A 122 GLN HGy 1.0 . 3.77 96 96 A 122 GLN H A 122 GLN HGx 1.0 . 4.30 97 97 A 122 GLN HA A 122 GLN HGx 1.0 . 3.77 98 98 A 16 GLN HA A 16 GLN HGy 1.0 . 3.75 99 99 A 16 GLN HA A 16 GLN HGx 1.0 . 3.75 100 100 A 16 GLN H A 16 GLN HGx 1.0 . 3.80 101 101 A 11 GLN HA A 11 GLN HGx 1.0 . 4.02 102 102 A 11 GLN HA A 11 GLN HGy 1.0 . 4.02 103 103 A 11 GLN H A 11 GLN HGx 1.0 . 4.18 104 104 A 11 GLN H A 11 GLN HGy 1.0 . 4.18 105 105 A 148 ILE H A 147 ARG HBy 1.0 . 4.18 106 106 A 147 ARG HBx A 147 ARG HDy 1.0 . 4.11 107 107 A 85 MET H A 85 MET HBy 1.0 . 4.02 108 108 A 72 VAL H A 72 VAL HB 1.0 . 3.67 109 109 A 92 LYS H A 92 LYS HBy 1.0 . 3.96 110 110 A 60 MET H A 60 MET HBy 1.0 . 3.97 111 111 A 50 GLN H A 50 GLN HGy 1.0 . 5.35 112 112 A 50 GLN H A 50 GLN HGx 1.0 . 5.35 113 113 A 50 GLN HA A 50 GLN HGx 1.0 . 4.22 114 114 A 50 GLN HA A 50 GLN HGy 1.0 . 4.22 115 115 A 60 MET H A 60 MET HBx 1.0 . 3.97 116 116 A 118 LYS HBy A 133 ILE HD1% 1.0 . 3.69 117 117 A 133 ILE HD1% A 118 LYS HBx 1.0 . 4.00 118 118 A 90 LYS H A 90 LYS HBy 1.0 . 4.12 119 119 A 47 MET H A 47 MET HGy 1.0 . 3.75 120 120 A 47 MET HA A 47 MET HGy 1.0 . 3.67 121 121 A 47 MET H A 47 MET HGx 1.0 . 3.75 122 122 A 47 MET HA A 47 MET HGx 1.0 . 3.67 123 123 A 60 MET H A 60 MET HGy 1.0 . 4.81 124 124 A 60 MET HA A 60 MET HGy 1.0 . 3.93 125 125 A 80 MET H A 80 MET HGx 1.0 . 4.84 126 126 A 80 MET H A 80 MET HGy 1.0 . 4.84 127 127 A 44 VAL HA A 47 MET HBy 1.0 . 4.10 128 128 A 60 MET H A 60 MET HGx 1.0 . 4.81 129 129 A 60 MET HA A 60 MET HGx 1.0 . 3.93 130 130 A 64 VAL H A 64 VAL HB 1.0 . 3.73 131 131 A 118 LYS HBx A 119 ILE H 1.0 . 4.20 132 132 A 118 LYS HBx A 115 ASP HA 1.0 . 3.81 133 133 A 85 MET H A 85 MET HGx 1.0 . 4.12 134 134 A 21 LYS H A 21 LYS HBy 1.0 . 3.59 135 135 A 18 ASN HA A 17 LYS HBy 1.0 . 5.41 136 136 A 18 ASN HA A 17 LYS HBx 1.0 . 5.41 137 137 A 18 ASN H A 17 LYS HBy 1.0 . 4.44 138 138 A 18 ASN H A 17 LYS HBx 1.0 . 4.44 139 139 A 29 LEU H A 28 VAL HB 1.0 . 4.17 140 140 A 9 VAL H A 9 VAL HB 1.0 . 3.13 141 141 A 9 VAL HB A 10 GLU H 1.0 . 4.23 142 142 A 28 VAL HB A 28 VAL H 1.0 . 4.03 143 143 A 8 ALA HB% A 82 VAL HB 1.0 . 3.84 144 144 A 80 MET H A 79 VAL HB 1.0 . 3.89 145 145 A 161 GLU H A 161 GLU HBy 1.0 . 4.17 146 146 A 102 ARG H A 102 ARG HBx 1.0 . 3.50 147 147 A 61 ILE H A 61 ILE HG13 1.0 . 4.21 148 148 A 61 ILE HG13 A 61 ILE HA 1.0 . 4.17 149 149 A 83 ARG H A 83 ARG HBy 1.0 . 4.10 150 150 A 61 ILE HA A 61 ILE HG12 1.0 . 4.17 151 151 A 61 ILE H A 61 ILE HG12 1.0 . 4.21 152 152 A 116 GLU HBy A 113 ASP H 1.0 . 4.11 153 153 A 116 GLU HBy A 116 GLU H 1.0 . 3.68 154 154 A 45 MET H A 46 ARG HBy 1.0 . 6.00 155 155 A 45 MET H A 46 ARG HBx 1.0 . 6.00 156 156 A 118 LYS HA A 118 LYS HDx 1.0 . 4.87 157 157 A 118 LYS HA A 118 LYS HDy 1.0 . 4.87 158 158 A 31 ALA HB% A 32 GLU HBy 1.0 . 6.00 159 159 A 31 ALA HB% A 32 GLU HBx 1.0 . 6.00 160 160 A 40 GLU HBy A 43 LYS H 1.0 . 4.72 161 161 A 13 THR H A 16 GLN HBy 1.0 . 5.91 162 162 A 13 THR H A 16 GLN HBx 1.0 . 5.91 163 163 A 17 LYS H A 16 GLN HBy 1.0 . 4.96 164 164 A 17 LYS H A 16 GLN HBx 1.0 . 4.96 165 165 A 11 GLN H A 11 GLN HBy 1.0 . 3.83 166 166 A 11 GLN H A 10 GLU HBy 1.0 . 4.74 167 167 A 11 GLN H A 10 GLU HBx 1.0 . 4.74 168 168 A 3 ASP HA A 6 LYS HDy 1.0 . 5.21 169 169 A 3 ASP HA A 6 LYS HDx 1.0 . 5.21 170 170 A 56 GLU H A 55 GLU HBx 1.0 . 4.52 171 171 A 133 ILE HA A 133 ILE HG12 1.0 . 4.05 172 172 A 86 LYS HA A 86 LYS HDx 1.0 . 4.52 173 173 A 86 LYS HA A 86 LYS HDy 1.0 . 4.52 174 174 A 92 LYS HA A 92 LYS HDx 1.0 . 4.88 175 175 A 92 LYS HA A 92 LYS HDy 1.0 . 4.88 176 176 A 133 ILE HA A 133 ILE HG13 1.0 . 3.95 177 177 A 55 GLU H A 55 GLU HBx 1.0 . 3.69 178 178 A 119 ILE HA A 119 ILE HG12 1.0 . 3.79 179 179 A 119 ILE H A 119 ILE HG13 1.0 . 3.93 180 180 A 119 ILE HA A 119 ILE HG13 1.0 . 3.79 181 181 A 26 ILE H A 26 ILE HG12 1.0 . 4.01 182 182 A 122 GLN H A 122 GLN HBy 1.0 . 4.10 183 183 A 122 GLN H A 122 GLN HBx 1.0 . 4.10 184 184 A 123 ALA H A 122 GLN HBy 1.0 . 4.10 185 185 A 123 ALA H A 122 GLN HBx 1.0 . 4.10 186 186 A 106 LYS HA A 106 LYS HDx 1.0 . 4.04 187 187 A 106 LYS HA A 106 LYS HDy 1.0 . 4.04 188 188 A 142 LYS HA A 142 LYS HDx 1.0 . 3.84 189 189 A 142 LYS HA A 142 LYS HDy 1.0 . 3.84 190 190 A 133 ILE HG12 A 132 ASP HBy 1.0 . 3.95 191 191 A 26 ILE HA A 26 ILE HG13 1.0 . 3.90 192 192 A 26 ILE HG12 A 26 ILE HA 1.0 . 3.90 193 193 A 58 GLN H A 58 GLN HBx 1.0 . 3.57 194 194 A 148 ILE H A 148 ILE HG13 1.0 . 4.41 195 195 A 148 ILE HA A 148 ILE HG12 1.0 . 4.16 196 196 A 148 ILE HG2% A 148 ILE HG12 1.0 . 3.86 197 197 A 148 ILE HG13 A 148 ILE HA 1.0 . 4.16 198 198 A 17 LYS HA A 17 LYS HGx 1.0 . 4.15 199 199 A 17 LYS HA A 17 LYS HGy 1.0 . 4.15 200 200 A 21 LYS HA A 21 LYS HDy 1.0 . 4.23 201 201 A 112 ILE H A 112 ILE HG13 1.0 . 4.55 202 202 A 112 ILE HG13 A 112 ILE HA 1.0 . 3.96 203 203 A 12 LEU HA A 12 LEU HDx% 1.0 . 4.36 204 204 A 12 LEU HDx% A 12 LEU HBy 1.0 . 3.73 205 205 A 12 LEU HDx% A 12 LEU HBx 1.0 . 3.73 206 206 A 21 LYS HA A 21 LYS HDx 1.0 . 4.23 207 207 A 112 ILE HA A 112 ILE HG12 1.0 . 3.96 208 208 A 100 LEU H A 100 LEU HG 1.0 . 4.24 209 209 A 97 LEU H A 97 LEU HG 1.0 . 3.81 210 210 A 114 LEU H A 114 LEU HG 1.0 . 4.05 211 211 A 114 LEU HG A 114 LEU HA 1.0 . 3.93 212 212 A 38 THR HA A 41 LEU HG 1.0 . 5.03 213 213 A 4 ILE H A 4 ILE HG12 1.0 . 4.07 214 214 A 4 ILE H A 4 ILE HG13 1.0 . 4.07 215 215 A 128 ILE H A 128 ILE HG12 1.0 . 4.20 216 216 A 128 ILE HG12 A 128 ILE HG2% 1.0 . 3.58 217 217 A 9 VAL HA A 12 LEU HG 1.0 . 3.95 218 218 A 48 LEU H A 48 LEU HG 1.0 . 4.35 219 219 A 128 ILE H A 128 ILE HG13 1.0 . 4.20 220 220 A 151 ASP HA A 154 LEU HG 1.0 . 4.28 221 221 A 48 LEU H A 48 LEU HDy% 1.0 . 4.28 222 222 A 48 LEU HA A 48 LEU HDy% 1.0 . 4.01 223 223 A 117 LEU HA A 117 LEU HDx% 1.0 . 3.62 224 224 A 118 LYS H A 118 LYS HGy 1.0 . 4.60 225 225 A 118 LYS HA A 118 LYS HGy 1.0 . 4.13 226 226 A 118 LYS HA A 118 LYS HGx 1.0 . 4.13 227 227 A 78 LEU H A 78 LEU HDy% 1.0 . 4.19 228 228 A 78 LEU HDy% A 78 LEU HA 1.0 . 4.05 229 229 A 78 LEU HDy% A 78 LEU HBy 1.0 . 3.73 230 230 A 78 LEU HDy% A 78 LEU HBx 1.0 . 3.73 231 231 A 147 ARG HA A 147 ARG HGy 1.0 . 4.24 232 232 A 147 ARG HA A 147 ARG HGx 1.0 . 4.24 233 233 A 136 LEU HA A 136 LEU HDx% 1.0 . 3.84 234 234 A 138 LYS HA A 138 LYS HGy 1.0 . 3.91 235 235 A 158 LYS HA A 158 LYS HGy 1.0 . 4.07 236 236 A 92 LYS H A 92 LYS HGy 1.0 . 5.13 237 237 A 92 LYS H A 92 LYS HGx 1.0 . 5.13 238 238 A 138 LYS HA A 138 LYS HGx 1.0 . 3.91 239 239 A 158 LYS HA A 158 LYS HGx 1.0 . 4.07 240 240 A 158 LYS H A 158 LYS HGx 1.0 . 4.07 241 241 A 100 LEU HDy% A 100 LEU HA 1.0 . 3.40 242 242 A 142 LYS H A 142 LYS HGy 1.0 . 4.10 243 243 A 106 LYS H A 106 LYS HGy 1.0 . 4.28 244 244 A 106 LYS H A 106 LYS HGx 1.0 . 4.28 245 245 A 100 LEU HDx% A 104 TRP HZ2 1.0 . 4.17 246 246 A 100 LEU HDx% A 104 TRP HD1 1.0 . 3.68 247 247 A 100 LEU HA A 100 LEU HDx% 1.0 . 3.40 248 248 A 136 LEU HA A 136 LEU HDy% 1.0 . 3.84 249 249 A 78 LEU HA A 78 LEU HDx% 1.0 . 4.05 250 250 A 78 LEU HDx% A 78 LEU HBy 1.0 . 3.73 251 251 A 78 LEU HDx% A 78 LEU HBx 1.0 . 3.73 252 252 A 97 LEU H A 97 LEU HDy% 1.0 . 4.20 253 253 A 117 LEU HA A 117 LEU HDy% 1.0 . 3.62 254 254 A 79 VAL HGx% A 80 MET H 1.0 . 4.28 255 255 A 9 VAL H A 9 VAL HGx% 1.0 . 3.79 256 256 A 10 GLU H A 9 VAL HGx% 1.0 . 4.77 257 257 A 79 VAL H A 79 VAL HGx% 1.0 . 4.21 258 258 A 9 VAL HA A 9 VAL HGx% 1.0 . 3.10 259 259 A 79 VAL HGx% A 79 VAL HA 1.0 . 3.30 260 260 A 79 VAL HGx% A 5 TYR HBx 1.0 . 4.92 261 261 A 12 LEU HA A 12 LEU HDy% 1.0 . 4.36 262 262 A 12 LEU HDy% A 12 LEU HBy 1.0 . 3.73 263 263 A 12 LEU HDy% A 12 LEU HBx 1.0 . 3.73 264 264 A 38 THR HG2% A 71 THR H 1.0 . 4.13 265 265 A 38 THR HG2% A 38 THR H 1.0 . 3.37 266 266 A 48 LEU H A 48 LEU HDx% 1.0 . 4.28 267 267 A 38 THR HG2% A 70 GLY HAy 1.0 . 4.06 268 268 A 38 THR HA A 38 THR HG2% 1.0 . 3.39 269 269 A 38 THR HG2% A 70 GLY HAx 1.0 . 4.06 270 270 A 41 LEU HG A 38 THR HG2% 1.0 . 5.25 271 271 A 38 THR HG2% A 61 ILE HG2% 1.0 . 3.34 272 272 A 48 LEU HA A 48 LEU HDx% 1.0 . 4.01 273 273 A 72 VAL H A 71 THR HG2% 1.0 . 4.17 274 274 A 71 THR H A 71 THR HG2% 1.0 . 4.00 275 275 A 71 THR HG2% A 71 THR HA 1.0 . 3.01 276 276 A 41 LEU HA A 44 VAL HGy% 1.0 . 4.01 277 277 A 53 THR HA A 53 THR HG2% 1.0 . 2.99 278 278 A 13 THR HG2% A 15 GLU HBx 1.0 . 4.82 279 279 A 43 LYS H A 44 VAL HGy% 1.0 . 4.29 280 280 A 44 VAL HA A 44 VAL HGy% 1.0 . 3.26 281 281 A 13 THR HG2% A 15 GLU HBy 1.0 . 4.82 282 282 A 13 THR H A 13 THR HG2% 1.0 . 2.99 283 283 A 16 GLN H A 13 THR HG2% 1.0 . 4.56 284 284 A 82 VAL HA A 82 VAL HGy% 1.0 . 3.30 285 285 A 82 VAL HGy% A 82 VAL H 1.0 . 3.66 286 286 A 83 ARG H A 82 VAL HGy% 1.0 . 3.87 287 287 A 82 VAL HGy% A 5 TYR HDx 1.0 . 3.68 288 288 A 9 VAL HA A 82 VAL HGy% 1.0 . 4.11 289 289 A 82 VAL H A 82 VAL HGx% 1.0 . 3.66 290 290 A 83 ARG H A 82 VAL HGx% 1.0 . 3.87 291 291 A 82 VAL HA A 82 VAL HGx% 1.0 . 3.30 292 292 A 9 VAL HA A 82 VAL HGx% 1.0 . 4.11 293 293 A 9 VAL H A 9 VAL HGy% 1.0 . 3.79 294 294 A 9 VAL HA A 9 VAL HGy% 1.0 . 3.10 295 295 A 72 VAL HA A 72 VAL HGy% 1.0 . 3.23 296 296 A 80 MET H A 79 VAL HGy% 1.0 . 4.28 297 297 A 79 VAL HA A 79 VAL HGy% 1.0 . 3.30 298 298 A 5 TYR HBy A 79 VAL HGy% 1.0 . 5.27 299 299 A 124 THR H A 124 THR HG2% 1.0 . 3.41 300 300 A 124 THR HG2% A 124 THR HA 1.0 . 2.96 301 301 A 124 THR HG2% A 121 LEU HA 1.0 . 3.94 302 302 A 129 THR HA A 129 THR HG2% 1.0 . 2.72 303 303 A 129 THR HG2% A 129 THR H 1.0 . 3.09 304 304 A 128 ILE HG2% A 129 THR HG2% 1.0 . 3.98 305 305 A 128 ILE H A 127 THR HG2% 1.0 . 3.76 306 306 A 127 THR HG2% A 127 THR HA 1.0 . 3.13 307 307 A 72 VAL HGx% A 73 ASP H 1.0 . 4.74 308 308 A 72 VAL HA A 72 VAL HGx% 1.0 . 3.23 309 309 A 72 VAL HGx% A 36 ILE HG2% 1.0 . 3.93 310 310 A 65 ASP H A 64 VAL HGx% 1.0 . 4.46 311 311 A 65 ASP H A 64 VAL HGy% 1.0 . 4.46 312 312 A 72 VAL HGy% A 80 MET HE% 1.0 . 4.14 313 313 A 43 LYS H A 44 VAL HGx% 1.0 . 4.29 314 314 A 41 LEU HA A 44 VAL HGx% 1.0 . 4.01 315 315 A 44 VAL HA A 44 VAL HGx% 1.0 . 3.26 316 316 A 5 TYR HBx A 79 VAL HGy% 1.0 . 4.92 317 317 A 29 LEU H A 28 VAL HGx% 1.0 . 4.37 318 318 A 28 VAL H A 28 VAL HGx% 1.0 . 3.60 319 319 A 28 VAL HGx% A 25 ASP HA 1.0 . 3.71 320 320 A 28 VAL HGx% A 28 VAL HA 1.0 . 3.23 321 321 A 160 VAL H A 160 VAL HGx% 1.0 . 4.29 322 322 A 160 VAL HGx% A 160 VAL HA 1.0 . 3.35 323 323 A 28 VAL HGy% A 31 ALA H 1.0 . 4.55 324 324 A 29 LEU H A 28 VAL HGy% 1.0 . 4.37 325 325 A 28 VAL H A 28 VAL HGy% 1.0 . 3.60 326 326 A 28 VAL HGy% A 24 PHE HEx 1.0 . 4.40 327 327 A 25 ASP HA A 28 VAL HGy% 1.0 . 3.71 328 328 A 28 VAL HA A 28 VAL HGy% 1.0 . 3.23 329 329 A 160 VAL H A 160 VAL HGy% 1.0 . 4.29 330 330 A 160 VAL HA A 160 VAL HGy% 1.0 . 3.35 331 331 A 31 ALA HB% A 32 GLU H 1.0 . 3.86 332 332 A 31 ALA HB% A 33 ASP H 1.0 . 3.84 333 333 A 31 ALA HB% A 34 GLY H 1.0 . 3.84 334 334 A 31 ALA HB% A 31 ALA H 1.0 . 2.94 335 335 A 31 ALA HB% A 28 VAL HA 1.0 . 3.34 336 336 A 31 ALA HB% A 32 GLU HGy 1.0 . 6.00 337 337 A 31 ALA HB% A 32 GLU HGx 1.0 . 6.00 338 338 A 31 ALA HB% A 28 VAL HB 1.0 . 3.62 339 339 A 31 ALA HB% A 28 VAL HGy% 1.0 . 3.80 340 340 A 31 ALA HB% A 28 VAL HGx% 1.0 . 3.80 341 341 A 123 ALA H A 123 ALA HB% 1.0 . 2.78 342 342 A 104 TRP HZ2 A 123 ALA HB% 1.0 . 3.76 343 343 A 123 ALA HB% A 104 TRP HH2 1.0 . 3.31 344 344 A 124 THR HG2% A 123 ALA HB% 1.0 . 4.25 345 345 A 123 ALA HB% A 119 ILE HG2% 1.0 . 4.02 346 346 A 24 PHE H A 23 ALA HB% 1.0 . 3.43 347 347 A 23 ALA HB% A 23 ALA H 1.0 . 3.05 348 348 A 26 ILE H A 23 ALA HB% 1.0 . 4.48 349 349 A 23 ALA HB% A 20 PHE HA 1.0 . 3.89 350 350 A 9 VAL H A 8 ALA HB% 1.0 . 3.35 351 351 A 8 ALA HB% A 8 ALA H 1.0 . 2.93 352 352 A 8 ALA HB% A 5 TYR HA 1.0 . 3.27 353 353 A 8 ALA HB% A 82 VAL HGy% 1.0 . 3.11 354 354 A 8 ALA HB% A 82 VAL HGx% 1.0 . 3.11 355 355 A 8 ALA HB% A 5 TYR H 1.0 . 5.20 356 356 A 134 GLU H A 133 ILE HG2% 1.0 . 3.85 357 357 A 118 LYS HA A 133 ILE HG2% 1.0 . 3.60 358 358 A 133 ILE HA A 133 ILE HG2% 1.0 . 3.14 359 359 A 118 LYS HBx A 133 ILE HG2% 1.0 . 3.21 360 360 A 137 MET HA A 137 MET HE% 1.0 . 3.43 361 361 A 80 MET HE% A 81 MET H 1.0 . 4.23 362 362 A 80 MET HE% A 81 MET HA 1.0 . 3.91 363 363 A 80 MET HE% A 80 MET HGy 1.0 . 4.04 364 364 A 80 MET HE% A 80 MET HGx 1.0 . 4.04 365 365 A 80 MET HE% A 80 MET HBy 1.0 . 3.10 366 366 A 80 MET HE% A 80 MET HBx 1.0 . 3.10 367 367 A 72 VAL HGx% A 80 MET HE% 1.0 . 4.14 368 368 A 22 ALA H A 22 ALA HB% 1.0 . 2.83 369 369 A 23 ALA H A 22 ALA HB% 1.0 . 3.28 370 370 A 6 LYS H A 7 ALA HB% 1.0 . 4.45 371 371 A 7 ALA HB% A 4 ILE HA 1.0 . 3.84 372 372 A 7 ALA HB% A 7 ALA H 1.0 . 2.82 373 373 A 8 ALA H A 7 ALA HB% 1.0 . 3.33 374 374 A 3 ASP HA A 7 ALA HB% 1.0 . 5.17 375 375 A 5 TYR HA A 7 ALA HB% 1.0 . 5.45 376 376 A 148 ILE HG2% A 148 ILE HG13 1.0 . 3.86 377 377 A 119 ILE HG2% A 120 MET H 1.0 . 3.98 378 378 A 119 ILE H A 119 ILE HG2% 1.0 . 3.96 379 379 A 119 ILE HG2% A 104 TRP HZ3 1.0 . 3.31 380 380 A 116 GLU HA A 119 ILE HG2% 1.0 . 4.73 381 381 A 119 ILE HA A 119 ILE HG2% 1.0 . 3.18 382 382 A 119 ILE HD1% A 119 ILE HG2% 1.0 . 2.78 383 383 A 133 ILE H A 133 ILE HG2% 1.0 . 3.82 384 384 A 128 ILE HG2% A 128 ILE HA 1.0 . 3.32 385 385 A 128 ILE HG2% A 132 ASP HBx 1.0 . 3.78 386 386 A 133 ILE HG12 A 133 ILE HG2% 1.0 . 3.24 387 387 A 128 ILE HG2% A 128 ILE HG13 1.0 . 3.58 388 388 A 133 ILE HG13 A 133 ILE HG2% 1.0 . 2.57 389 389 A 128 ILE HG2% A 128 ILE HD1% 1.0 . 2.42 390 390 A 148 ILE HG2% A 149 ASP H 1.0 . 3.40 391 391 A 153 PHE H A 148 ILE HG2% 1.0 . 3.68 392 392 A 148 ILE HG2% A 148 ILE HA 1.0 . 3.26 393 393 A 148 ILE HG2% A 153 PHE HA 1.0 . 3.24 394 394 A 148 ILE HD1% A 148 ILE HG2% 1.0 . 2.97 395 395 A 148 ILE HG2% A 112 ILE HD1% 1.0 . 4.21 396 396 A 119 ILE HG2% A 104 TRP HE3 1.0 . 3.98 397 397 A 119 ILE HG12 A 119 ILE HG2% 1.0 . 3.49 398 398 A 119 ILE HG13 A 119 ILE HG2% 1.0 . 3.49 399 399 A 112 ILE HG2% A 117 LEU H 1.0 . 3.69 400 400 A 113 ASP H A 112 ILE HG2% 1.0 . 3.59 401 401 A 112 ILE HA A 112 ILE HG2% 1.0 . 3.25 402 402 A 117 LEU HA A 112 ILE HG2% 1.0 . 3.54 403 403 A 116 GLU HBy A 112 ILE HG2% 1.0 . 3.52 404 404 A 112 ILE HD1% A 112 ILE HG2% 1.0 . 2.93 405 405 A 47 MET HA A 47 MET HE% 1.0 . 4.45 406 406 A 47 MET HE% A 47 MET HGy 1.0 . 4.03 407 407 A 47 MET HE% A 47 MET HGx 1.0 . 4.03 408 408 A 47 MET HE% A 47 MET HBx 1.0 . 3.80 409 409 A 47 MET HBy A 47 MET HE% 1.0 . 4.05 410 410 A 26 ILE HD1% A 47 MET HE% 1.0 . 3.45 411 411 A 47 MET HE% A 26 ILE HG2% 1.0 . 4.03 412 412 A 60 MET H A 60 MET HE% 1.0 . 4.23 413 413 A 59 GLU H A 60 MET HE% 1.0 . 4.46 414 414 A 60 MET HA A 60 MET HE% 1.0 . 3.19 415 415 A 60 MET HE% A 60 MET HGy 1.0 . 3.47 416 416 A 60 MET HE% A 60 MET HGx 1.0 . 3.47 417 417 A 107 ASN H A 108 ALA HB% 1.0 . 4.76 418 418 A 148 ILE HG2% A 112 ILE HG2% 1.0 . 4.31 419 419 A 61 ILE HG2% A 62 ASP HA 1.0 . 3.79 420 420 A 61 ILE HG2% A 58 GLN HA 1.0 . 5.00 421 421 A 61 ILE HA A 61 ILE HG2% 1.0 . 3.28 422 422 A 4 ILE H A 4 ILE HG2% 1.0 . 3.34 423 423 A 4 ILE HG2% A 4 ILE HD1% 1.0 . 2.66 424 424 A 36 ILE HG2% A 37 SER H 1.0 . 4.16 425 425 A 36 ILE HG2% A 36 ILE HA 1.0 . 3.29 426 426 A 36 ILE HG2% A 27 PHE HBy 1.0 . 4.52 427 427 A 36 ILE HG2% A 27 PHE HBx 1.0 . 4.52 428 428 A 72 VAL HGy% A 36 ILE HG2% 1.0 . 3.93 429 429 A 82 VAL HA A 85 MET HE% 1.0 . 3.53 430 430 A 85 MET HE% A 85 MET HGy 1.0 . 3.81 431 431 A 85 MET HE% A 85 MET HGx 1.0 . 3.81 432 432 A 82 VAL HB A 85 MET HE% 1.0 . 3.23 433 433 A 82 VAL HGy% A 85 MET HE% 1.0 . 4.36 434 434 A 12 LEU HDx% A 85 MET HE% 1.0 . 3.46 435 435 A 82 VAL HGx% A 85 MET HE% 1.0 . 4.36 436 436 A 12 LEU HDy% A 85 MET HE% 1.0 . 3.46 437 437 A 108 ALA HB% A 109 ASP H 1.0 . 4.21 438 438 A 108 ALA HB% A 108 ALA H 1.0 . 3.31 439 439 A 5 TYR H A 4 ILE HG2% 1.0 . 3.68 440 440 A 5 TYR HDx A 4 ILE HG2% 1.0 . 4.28 441 441 A 4 ILE HG2% A 5 TYR HEx 1.0 . 4.86 442 442 A 5 TYR HA A 4 ILE HG2% 1.0 . 4.04 443 443 A 4 ILE HA A 4 ILE HG2% 1.0 . 3.12 444 444 A 27 PHE H A 26 ILE HG2% 1.0 . 4.27 445 445 A 26 ILE H A 26 ILE HG2% 1.0 . 3.61 446 446 A 26 ILE HA A 26 ILE HG2% 1.0 . 3.32 447 447 A 26 ILE HG13 A 26 ILE HG2% 1.0 . 3.65 448 448 A 26 ILE HG12 A 26 ILE HG2% 1.0 . 3.65 449 449 A 26 ILE HG2% A 27 PHE HA 1.0 . 4.01 450 450 A 12 LEU HA A 85 MET HE% 1.0 . 4.48 451 451 A 157 MET HA A 157 MET HE% 1.0 . 3.26 452 452 A 36 ILE HD1% A 36 ILE HA 1.0 . 4.24 453 453 A 36 ILE HD1% A 77 PHE HEx 1.0 . 3.94 454 454 A 36 ILE HD1% A 27 PHE HBy 1.0 . 4.09 455 455 A 36 ILE HD1% A 27 PHE HBx 1.0 . 4.09 456 456 A 36 ILE HD1% A 72 VAL HB 1.0 . 4.56 457 457 A 36 ILE HD1% A 36 ILE HB 1.0 . 3.40 458 458 A 61 ILE H A 61 ILE HD1% 1.0 . 3.97 459 459 A 61 ILE HA A 61 ILE HD1% 1.0 . 3.81 460 460 A 61 ILE HB A 61 ILE HD1% 1.0 . 3.17 461 461 A 133 ILE HD1% A 118 LYS HA 1.0 . 3.64 462 462 A 133 ILE H A 133 ILE HD1% 1.0 . 4.09 463 463 A 130 GLU HA A 133 ILE HD1% 1.0 . 3.34 464 464 A 133 ILE HD1% A 133 ILE HA 1.0 . 3.70 465 465 A 133 ILE HB A 133 ILE HD1% 1.0 . 3.17 466 466 A 112 ILE HA A 112 ILE HD1% 1.0 . 3.65 467 467 A 112 ILE HD1% A 105 ASP HA 1.0 . 4.10 468 468 A 112 ILE HD1% A 104 TRP HBy 1.0 . 3.51 469 469 A 112 ILE HD1% A 104 TRP HBx 1.0 . 3.51 470 470 A 112 ILE HD1% A 105 ASP HBy 1.0 . 4.24 471 471 A 112 ILE HB A 112 ILE HD1% 1.0 . 3.38 472 472 A 112 ILE HD1% A 105 ASP HBx 1.0 . 4.24 473 473 A 128 ILE HA A 128 ILE HD1% 1.0 . 3.48 474 474 A 132 ASP HBx A 128 ILE HD1% 1.0 . 5.16 475 475 A 128 ILE HB A 128 ILE HD1% 1.0 . 3.58 476 476 A 4 ILE H A 4 ILE HD1% 1.0 . 4.14 477 477 A 4 ILE HD1% A 5 TYR HEx 1.0 . 4.27 478 478 A 4 ILE HA A 4 ILE HD1% 1.0 . 3.78 479 479 A 4 ILE HD1% A 4 ILE HB 1.0 . 3.31 480 480 A 119 ILE HD1% A 119 ILE H 1.0 . 4.19 481 481 A 119 ILE HD1% A 116 GLU HA 1.0 . 3.73 482 482 A 119 ILE HD1% A 119 ILE HA 1.0 . 3.78 483 483 A 119 ILE HD1% A 119 ILE HB 1.0 . 3.22 484 484 A 26 ILE HD1% A 26 ILE H 1.0 . 3.78 485 485 A 26 ILE HD1% A 23 ALA HA 1.0 . 3.40 486 486 A 26 ILE HD1% A 26 ILE HA 1.0 . 3.71 487 487 A 26 ILE HD1% A 26 ILE HG2% 1.0 . 2.98 488 488 A 148 ILE HD1% A 148 ILE H 1.0 . 4.13 489 489 A 148 ILE HD1% A 148 ILE HA 1.0 . 3.68 490 490 A 148 ILE HD1% A 141 ASP HA 1.0 . 4.09 491 491 A 148 ILE HD1% A 140 GLY HAx 1.0 . 3.53 492 492 A 148 ILE HD1% A 148 ILE HB 1.0 . 3.55 493 493 A 149 ASP H A 152 GLU H 1.0 . 4.83 494 494 A 148 ILE HA A 149 ASP H 1.0 . 3.10 495 495 A 161 GLU H A 160 VAL HA 1.0 . 3.29 496 496 A 161 GLU H A 161 GLU HGx 1.0 . 5.61 497 497 A 161 GLU H A 161 GLU HBx 1.0 . 4.17 498 498 A 113 ASP H A 116 GLU H 1.0 . 4.82 499 499 A 113 ASP H A 112 ILE HA 1.0 . 3.01 500 500 A 72 VAL HA A 73 ASP H 1.0 . 3.25 501 501 A 72 VAL HGy% A 73 ASP H 1.0 . 4.74 502 502 A 148 ILE H A 112 ILE H 1.0 . 4.07 503 503 A 72 VAL H A 36 ILE H 1.0 . 4.38 504 504 A 112 ILE H A 111 TYR HA 1.0 . 3.30 505 505 A 72 VAL H A 71 THR HA 1.0 . 3.48 506 506 A 66 GLU H A 65 ASP HA 1.0 . 3.24 507 507 A 148 ILE H A 147 ARG HA 1.0 . 3.28 508 508 A 142 LYS H A 141 ASP HA 1.0 . 3.13 509 509 A 72 VAL H A 71 THR HB 1.0 . 3.86 510 510 A 148 ILE HB A 112 ILE H 1.0 . 4.36 511 511 A 112 ILE HB A 112 ILE H 1.0 . 3.57 512 512 A 148 ILE H A 112 ILE HB 1.0 . 4.06 513 513 A 148 ILE H A 147 ARG HBx 1.0 . 4.18 514 514 A 142 LYS H A 142 LYS HGx 1.0 . 4.10 515 515 A 112 ILE H A 112 ILE HG12 1.0 . 4.55 516 516 A 72 VAL H A 38 THR HG2% 1.0 . 4.49 517 517 A 148 ILE H A 148 ILE HG2% 1.0 . 4.36 518 518 A 148 ILE H A 148 ILE HG12 1.0 . 4.41 519 519 A 153 PHE H A 154 LEU H 1.0 . 3.70 520 520 A 31 ALA H A 30 GLY H 1.0 . 3.76 521 521 A 128 ILE H A 127 THR HA 1.0 . 2.91 522 522 A 106 LYS H A 105 ASP HA 1.0 . 3.07 523 523 A 28 VAL HA A 31 ALA H 1.0 . 4.49 524 524 A 153 PHE H A 153 PHE HBx 1.0 . 3.83 525 525 A 128 ILE H A 128 ILE HG2% 1.0 . 4.05 526 526 A 28 VAL HGx% A 31 ALA H 1.0 . 4.55 527 527 A 95 GLU H A 94 GLU H 1.0 . 3.93 528 528 A 18 ASN H A 19 GLU H 1.0 . 3.41 529 529 A 31 ALA H A 32 GLU H 1.0 . 4.75 530 530 A 4 ILE H A 3 ASP H 1.0 . 4.12 531 531 A 19 GLU H A 16 GLN H 1.0 . 5.16 532 532 A 29 LEU H A 30 GLY H 1.0 . 4.42 533 533 A 29 LEU H A 28 VAL H 1.0 . 3.76 534 534 A 31 ALA HA A 32 GLU H 1.0 . 3.54 535 535 A 90 LYS H A 89 SER HA 1.0 . 3.45 536 536 A 87 ASP HA A 88 ASP H 1.0 . 3.02 537 537 A 90 LYS H A 89 SER HBy 1.0 . 5.31 538 538 A 90 LYS H A 89 SER HBx 1.0 . 5.31 539 539 A 19 GLU H A 16 GLN HA 1.0 . 4.01 540 540 A 19 GLU H A 18 ASN HBy 1.0 . 4.15 541 541 A 32 GLU H A 32 GLU HGy 1.0 . 4.92 542 542 A 32 GLU H A 32 GLU HGx 1.0 . 4.92 543 543 A 116 GLU HBy A 117 LEU H 1.0 . 4.51 544 544 A 94 GLU H A 94 GLU HBy 1.0 . 3.90 545 545 A 94 GLU H A 94 GLU HBx 1.0 . 3.90 546 546 A 117 LEU HBx A 117 LEU H 1.0 . 3.57 547 547 A 90 LYS H A 90 LYS HBx 1.0 . 4.12 548 548 A 90 LYS H A 90 LYS HGy 1.0 . 5.56 549 549 A 90 LYS H A 90 LYS HGx 1.0 . 5.56 550 550 A 29 LEU H A 29 LEU HBy 1.0 . 4.00 551 551 A 153 PHE H A 152 GLU H 1.0 . 3.56 552 552 A 14 GLU H A 15 GLU H 1.0 . 3.86 553 553 A 116 GLU H A 117 LEU H 1.0 . 3.56 554 554 A 76 GLU H A 77 PHE H 1.0 . 3.76 555 555 A 73 ASP H A 76 GLU H 1.0 . 4.85 556 556 A 55 GLU H A 56 GLU H 1.0 . 3.53 557 557 A 109 ASP H A 108 ALA H 1.0 . 3.78 558 558 A 43 LYS H A 42 GLY H 1.0 . 3.76 559 559 A 86 LYS H A 87 ASP H 1.0 . 4.62 560 560 A 156 PHE H A 157 MET H 1.0 . 3.62 561 561 A 97 LEU H A 96 GLU H 1.0 . 3.56 562 562 A 58 GLN H A 57 LEU H 1.0 . 4.88 563 563 A 100 LEU H A 101 PHE H 1.0 . 3.55 564 564 A 5 TYR H A 6 LYS H 1.0 . 3.35 565 565 A 48 LEU H A 47 MET H 1.0 . 3.50 566 566 A 132 ASP H A 133 ILE H 1.0 . 3.90 567 567 A 5 TYR HDx A 5 TYR H 1.0 . 4.71 568 568 A 119 ILE H A 120 MET H 1.0 . 3.49 569 569 A 21 LYS H A 18 ASN HA 1.0 . 4.35 570 570 A 130 GLU H A 129 THR HA 1.0 . 3.01 571 571 A 86 LYS HA A 87 ASP H 1.0 . 3.20 572 572 A 100 LEU H A 97 LEU HA 1.0 . 4.03 573 573 A 3 ASP HA A 6 LYS H 1.0 . 3.65 574 574 A 77 PHE H A 74 PHE HA 1.0 . 4.41 575 575 A 153 PHE HA A 156 PHE H 1.0 . 4.12 576 576 A 97 LEU H A 94 GLU HA 1.0 . 4.21 577 577 A 47 MET H A 44 VAL HA 1.0 . 4.33 578 578 A 108 ALA H A 108 ALA HA 1.0 . 2.94 579 579 A 83 ARG H A 80 MET HA 1.0 . 4.76 580 580 A 117 LEU HA A 120 MET H 1.0 . 4.34 581 581 A 118 LYS HA A 120 MET H 1.0 . 4.86 582 582 A 77 PHE HBy A 77 PHE H 1.0 . 3.73 583 583 A 77 PHE HBx A 77 PHE H 1.0 . 4.05 584 584 A 156 PHE H A 156 PHE HBy 1.0 . 3.38 585 585 A 156 PHE H A 156 PHE HBx 1.0 . 3.38 586 586 A 100 LEU H A 99 ASP HBy 1.0 . 3.91 587 587 A 99 ASP H A 99 ASP HBy 1.0 . 3.60 588 588 A 5 TYR HBy A 5 TYR H 1.0 . 3.97 589 589 A 5 TYR HBx A 5 TYR H 1.0 . 3.65 590 590 A 130 GLU H A 130 GLU HGy 1.0 . 4.68 591 591 A 130 GLU H A 130 GLU HBy 1.0 . 3.79 592 592 A 130 GLU H A 130 GLU HBx 1.0 . 3.79 593 593 A 97 LEU H A 96 GLU HBy 1.0 . 4.16 594 594 A 97 LEU H A 96 GLU HBx 1.0 . 4.16 595 595 A 100 LEU H A 100 LEU HBy 1.0 . 3.41 596 596 A 47 MET H A 47 MET HBy 1.0 . 3.26 597 597 A 56 GLU H A 55 GLU HBy 1.0 . 4.52 598 598 A 82 VAL HB A 83 ARG H 1.0 . 4.15 599 599 A 12 LEU H A 12 LEU HG 1.0 . 3.67 600 600 A 119 ILE HB A 120 MET H 1.0 . 3.62 601 601 A 21 LYS H A 21 LYS HBx 1.0 . 3.59 602 602 A 37 SER H A 36 ILE HB 1.0 . 4.83 603 603 A 130 GLU H A 129 THR HG2% 1.0 . 4.49 604 604 A 87 ASP H A 86 LYS HBy 1.0 . 5.17 605 605 A 87 ASP H A 86 LYS HBx 1.0 . 5.17 606 606 A 87 ASP H A 86 LYS HGy 1.0 . 5.63 607 607 A 87 ASP H A 86 LYS HGx 1.0 . 5.63 608 608 A 92 LYS H A 92 LYS HBx 1.0 . 3.96 609 609 A 97 LEU H A 97 LEU HBx 1.0 . 4.10 610 610 A 100 LEU H A 100 LEU HBx 1.0 . 3.41 611 611 A 56 GLU H A 53 THR HG2% 1.0 . 5.42 612 612 A 136 LEU H A 136 LEU HG 1.0 . 4.41 613 613 A 133 ILE H A 133 ILE HG12 1.0 . 3.32 614 614 A 83 ARG H A 83 ARG HGy 1.0 . 5.28 615 615 A 83 ARG H A 83 ARG HGx 1.0 . 5.28 616 616 A 83 ARG H A 83 ARG HBx 1.0 . 4.10 617 617 A 5 TYR H A 4 ILE HB 1.0 . 4.00 618 618 A 12 LEU H A 12 LEU HBx 1.0 . 3.92 619 619 A 116 GLU H A 112 ILE HG2% 1.0 . 4.73 620 620 A 119 ILE HD1% A 116 GLU H 1.0 . 5.25 621 621 A 97 LEU H A 97 LEU HDx% 1.0 . 4.20 622 622 A 133 ILE H A 133 ILE HG13 1.0 . 3.96 623 623 A 21 LYS H A 20 PHE H 1.0 . 3.62 624 624 A 21 LYS H A 22 ALA H 1.0 . 3.72 625 625 A 38 THR H A 39 LYS H 1.0 . 3.85 626 626 A 13 THR H A 16 GLN H 1.0 . 4.75 627 627 A 16 GLN H A 14 GLU H 1.0 . 5.46 628 628 A 132 ASP H A 130 GLU H 1.0 . 5.38 629 629 A 25 ASP H A 26 ILE H 1.0 . 3.85 630 630 A 65 ASP H A 64 VAL H 1.0 . 4.40 631 631 A 141 ASP H A 142 LYS H 1.0 . 4.14 632 632 A 95 GLU H A 96 GLU H 1.0 . 3.64 633 633 A 17 LYS H A 20 PHE H 1.0 . 5.00 634 634 A 19 GLU H A 20 PHE H 1.0 . 3.53 635 635 A 99 ASP H A 101 PHE H 1.0 . 4.81 636 636 A 4 ILE H A 6 LYS H 1.0 . 4.78 637 637 A 10 GLU H A 7 ALA H 1.0 . 5.11 638 638 A 16 GLN H A 17 LYS H 1.0 . 3.58 639 639 A 134 GLU H A 135 GLU H 1.0 . 3.18 640 640 A 45 MET H A 46 ARG H 1.0 . 3.83 641 641 A 9 VAL H A 8 ALA H 1.0 . 3.40 642 642 A 158 LYS H A 157 MET H 1.0 . 3.47 643 643 A 24 PHE H A 23 ALA H 1.0 . 3.62 644 644 A 160 VAL H A 159 GLY H 1.0 . 3.67 645 645 A 161 GLU H A 160 VAL H 1.0 . 3.62 646 646 A 4 ILE H A 5 TYR H 1.0 . 3.55 647 647 A 104 TRP HD1 A 101 PHE H 1.0 . 4.83 648 648 A 20 PHE H A 20 PHE HDx 1.0 . 4.36 649 649 A 24 PHE H A 26 ILE H 1.0 . 4.64 650 650 A 8 ALA H A 7 ALA H 1.0 . 3.49 651 651 A 23 ALA H A 22 ALA H 1.0 . 3.60 652 652 A 132 ASP H A 134 GLU H 1.0 . 4.83 653 653 A 11 GLN H A 9 VAL H 1.0 . 4.76 654 654 A 79 VAL H A 80 MET H 1.0 . 3.70 655 655 A 46 ARG H A 44 VAL H 1.0 . 4.39 656 656 A 104 TRP H A 105 ASP H 1.0 . 3.39 657 657 A 101 PHE H A 101 PHE HDx 1.0 . 5.09 658 658 A 23 ALA H A 20 PHE HA 1.0 . 4.50 659 659 A 92 LYS HA A 95 GLU H 1.0 . 5.44 660 660 A 101 PHE H A 97 LEU HA 1.0 . 4.55 661 661 A 101 PHE H A 98 SER HA 1.0 . 4.82 662 662 A 134 GLU H A 131 ASP HA 1.0 . 4.24 663 663 A 135 GLU H A 131 ASP HA 1.0 . 4.67 664 664 A 8 ALA H A 5 TYR HA 1.0 . 4.13 665 665 A 19 GLU HA A 23 ALA H 1.0 . 4.57 666 666 A 26 ILE H A 23 ALA HA 1.0 . 4.16 667 667 A 24 PHE H A 21 LYS HA 1.0 . 4.56 668 668 A 17 LYS HA A 20 PHE H 1.0 . 4.27 669 669 A 9 VAL H A 6 LYS HA 1.0 . 4.49 670 670 A 80 MET H A 77 PHE HA 1.0 . 4.48 671 671 A 46 ARG H A 43 LYS HA 1.0 . 4.63 672 672 A 102 ARG HA A 105 ASP H 1.0 . 4.24 673 673 A 85 MET H A 84 SER HBy 1.0 . 4.58 674 674 A 85 MET H A 84 SER HBx 1.0 . 4.58 675 675 A 101 PHE H A 101 PHE HBx 1.0 . 3.47 676 676 A 101 PHE H A 101 PHE HBy 1.0 . 3.32 677 677 A 85 MET H A 85 MET HGy 1.0 . 4.12 678 678 A 105 ASP H A 101 PHE HA 1.0 . 5.28 679 679 A 26 ILE H A 25 ASP HBy 1.0 . 4.79 680 680 A 95 GLU H A 95 GLU HGx 1.0 . 4.68 681 681 A 101 PHE H A 100 LEU HBy 1.0 . 4.11 682 682 A 96 GLU H A 95 GLU HBy 1.0 . 3.94 683 683 A 96 GLU H A 95 GLU HBx 1.0 . 3.94 684 684 A 126 GLU H A 126 GLU HBy 1.0 . 3.97 685 685 A 16 GLN H A 16 GLN HGy 1.0 . 3.80 686 686 A 134 GLU H A 134 GLU HGy 1.0 . 3.91 687 687 A 133 ILE HB A 134 GLU H 1.0 . 3.51 688 688 A 80 MET H A 80 MET HBy 1.0 . 3.69 689 689 A 10 GLU H A 10 GLU HGx 1.0 . 4.36 690 690 A 132 ASP H A 132 ASP HBx 1.0 . 3.64 691 691 A 85 MET H A 85 MET HBx 1.0 . 4.02 692 692 A 105 ASP H A 105 ASP HBy 1.0 . 3.59 693 693 A 160 VAL H A 160 VAL HB 1.0 . 4.12 694 694 A 26 ILE H A 25 ASP HBx 1.0 . 4.79 695 695 A 101 PHE H A 100 LEU HBx 1.0 . 4.11 696 696 A 4 ILE H A 4 ILE HB 1.0 . 3.38 697 697 A 126 GLU H A 126 GLU HBx 1.0 . 3.97 698 698 A 134 GLU H A 133 ILE HG12 1.0 . 4.83 699 699 A 80 MET H A 80 MET HBx 1.0 . 3.69 700 700 A 46 ARG H A 46 ARG HBy 1.0 . 3.67 701 701 A 46 ARG H A 46 ARG HBx 1.0 . 3.67 702 702 A 44 VAL H A 44 VAL HB 1.0 . 3.81 703 703 A 132 ASP H A 128 ILE HB 1.0 . 6.00 704 704 A 105 ASP H A 105 ASP HBx 1.0 . 3.59 705 705 A 158 LYS H A 158 LYS HGy 1.0 . 4.07 706 706 A 40 GLU HBx A 41 LEU H 1.0 . 4.26 707 707 A 41 LEU H A 41 LEU HBy 1.0 . 4.00 708 708 A 41 LEU H A 41 LEU HBx 1.0 . 4.00 709 709 A 26 ILE H A 26 ILE HG13 1.0 . 4.01 710 710 A 148 ILE HD1% A 141 ASP H 1.0 . 4.81 711 711 A 112 ILE HD1% A 105 ASP H 1.0 . 4.73 712 712 A 145 ASP H A 146 GLY H 1.0 . 3.26 713 713 A 109 ASP H A 110 GLY H 1.0 . 3.28 714 714 A 131 ASP H A 130 GLU H 1.0 . 3.69 715 715 A 33 ASP H A 32 GLU H 1.0 . 3.99 716 716 A 78 LEU H A 77 PHE H 1.0 . 3.94 717 717 A 117 LEU H A 115 ASP H 1.0 . 4.67 718 718 A 116 GLU H A 115 ASP H 1.0 . 3.14 719 719 A 118 LYS H A 117 LEU H 1.0 . 3.70 720 720 A 152 GLU H A 151 ASP H 1.0 . 3.38 721 721 A 150 TYR H A 151 ASP H 1.0 . 3.77 722 722 A 74 PHE H A 75 ASP H 1.0 . 3.84 723 723 A 145 ASP H A 143 ASN H 1.0 . 4.53 724 724 A 92 LYS H A 93 SER H 1.0 . 4.70 725 725 A 128 ILE H A 129 THR H 1.0 . 4.80 726 726 A 50 GLN H A 49 GLY H 1.0 . 4.12 727 727 A 114 LEU H A 115 ASP H 1.0 . 4.20 728 728 A 136 LEU H A 137 MET H 1.0 . 3.44 729 729 A 137 MET H A 138 LYS H 1.0 . 3.65 730 730 A 64 VAL H A 62 ASP H 1.0 . 4.48 731 731 A 144 ASN H A 145 ASP H 1.0 . 3.45 732 732 A 18 ASN H A 17 LYS H 1.0 . 3.68 733 733 A 33 ASP H A 31 ALA H 1.0 . 5.20 734 734 A 33 ASP H A 35 SER H 1.0 . 5.87 735 735 A 33 ASP H A 34 GLY H 1.0 . 3.67 736 736 A 61 ILE H A 60 MET H 1.0 . 3.67 737 737 A 76 GLU H A 75 ASP H 1.0 . 3.55 738 738 A 80 MET H A 81 MET H 1.0 . 3.85 739 739 A 58 GLN H A 59 GLU H 1.0 . 3.67 740 740 A 59 GLU H A 60 MET H 1.0 . 3.86 741 741 A 48 LEU H A 49 GLY H 1.0 . 3.83 742 742 A 119 ILE H A 118 LYS H 1.0 . 3.70 743 743 A 78 LEU H A 79 VAL H 1.0 . 3.80 744 744 A 132 ASP H A 129 THR H 1.0 . 4.75 745 745 A 120 MET H A 121 LEU H 1.0 . 3.62 746 746 A 132 ASP H A 131 ASP H 1.0 . 3.29 747 747 A 132 ASP H A 135 GLU H 1.0 . 5.24 748 748 A 11 GLN H A 10 GLU H 1.0 . 3.48 749 749 A 122 GLN H A 123 ALA H 1.0 . 3.38 750 750 A 104 TRP H A 103 MET H 1.0 . 3.50 751 751 A 27 PHE H A 26 ILE H 1.0 . 3.54 752 752 A 92 LYS HA A 93 SER H 1.0 . 3.15 753 753 A 129 THR H A 128 ILE HA 1.0 . 3.28 754 754 A 114 LEU H A 113 ASP HA 1.0 . 3.51 755 755 A 115 ASP HA A 118 LYS H 1.0 . 4.17 756 756 A 118 LYS HA A 121 LEU H 1.0 . 4.41 757 757 A 119 ILE HA A 121 LEU H 1.0 . 5.09 758 758 A 109 ASP H A 108 ALA HA 1.0 . 3.52 759 759 A 116 GLU HA A 119 ILE H 1.0 . 4.51 760 760 A 150 TYR H A 149 ASP HBy 1.0 . 3.96 761 761 A 62 ASP H A 62 ASP HBx 1.0 . 3.59 762 762 A 114 LEU H A 113 ASP HBy 1.0 . 3.62 763 763 A 18 ASN H A 18 ASN HBy 1.0 . 3.54 764 764 A 115 ASP H A 115 ASP HBy 1.0 . 3.75 765 765 A 78 LEU HA A 81 MET H 1.0 . 4.39 766 766 A 79 VAL HA A 82 VAL H 1.0 . 4.53 767 767 A 74 PHE H A 74 PHE HBy 1.0 . 3.77 768 768 A 74 PHE H A 74 PHE HBx 1.0 . 3.77 769 769 A 55 GLU H A 55 GLU HBy 1.0 . 3.69 770 770 A 129 THR H A 132 ASP HBx 1.0 . 4.38 771 771 A 150 TYR H A 150 TYR HBx 1.0 . 3.50 772 772 A 131 ASP HBx A 131 ASP H 1.0 . 3.26 773 773 A 33 ASP H A 33 ASP HBx 1.0 . 4.16 774 774 A 33 ASP H A 32 GLU HBy 1.0 . 4.88 775 775 A 33 ASP H A 32 GLU HBx 1.0 . 4.88 776 776 A 10 GLU H A 10 GLU HGy 1.0 . 4.36 777 777 A 135 GLU H A 135 GLU HGy 1.0 . 4.86 778 778 A 135 GLU H A 135 GLU HGx 1.0 . 4.86 779 779 A 122 GLN H A 122 GLN HGy 1.0 . 4.30 780 780 A 115 ASP H A 115 ASP HBx 1.0 . 3.75 781 781 A 118 LYS HBx A 118 LYS H 1.0 . 3.04 782 782 A 151 ASP H A 150 TYR HBx 1.0 . 3.68 783 783 A 58 GLN H A 58 GLN HBy 1.0 . 3.57 784 784 A 150 TYR HBy A 151 ASP H 1.0 . 4.56 785 785 A 82 VAL HB A 82 VAL H 1.0 . 3.68 786 786 A 48 LEU H A 47 MET HBy 1.0 . 4.18 787 787 A 119 ILE HB A 119 ILE H 1.0 . 2.97 788 788 A 79 VAL H A 79 VAL HB 1.0 . 3.42 789 789 A 55 GLU H A 53 THR HG2% 1.0 . 5.15 790 790 A 128 ILE HB A 129 THR H 1.0 . 4.03 791 791 A 121 LEU H A 121 LEU HG 1.0 . 4.45 792 792 A 61 ILE HB A 62 ASP H 1.0 . 3.37 793 793 A 17 LYS H A 17 LYS HGy 1.0 . 4.70 794 794 A 17 LYS H A 17 LYS HGx 1.0 . 4.70 795 795 A 154 LEU H A 154 LEU HG 1.0 . 3.55 796 796 A 115 ASP H A 114 LEU HBy 1.0 . 4.06 797 797 A 115 ASP H A 114 LEU HBx 1.0 . 4.06 798 798 A 118 LYS H A 118 LYS HGx 1.0 . 4.60 799 799 A 138 LYS H A 138 LYS HBy 1.0 . 3.55 800 800 A 138 LYS H A 138 LYS HBx 1.0 . 3.55 801 801 A 82 VAL H A 81 MET HBy 1.0 . 4.07 802 802 A 58 GLN H A 57 LEU HBy 1.0 . 4.37 803 803 A 58 GLN H A 57 LEU HG 1.0 . 3.92 804 804 A 81 MET H A 81 MET HBy 1.0 . 3.72 805 805 A 48 LEU H A 48 LEU HBy 1.0 . 3.84 806 806 A 119 ILE H A 119 ILE HG12 1.0 . 3.93 807 807 A 40 GLU HBx A 40 GLU H 1.0 . 3.31 808 808 A 128 ILE HG2% A 129 THR H 1.0 . 4.13 809 809 A 114 LEU H A 114 LEU HDx% 1.0 . 5.51 810 810 A 114 LEU H A 114 LEU HDy% 1.0 . 5.51 811 811 A 61 ILE HG2% A 62 ASP H 1.0 . 3.79 812 812 A 10 GLU H A 9 VAL HGy% 1.0 . 4.77 813 813 A 78 LEU H A 78 LEU HDx% 1.0 . 4.19 814 814 A 118 LYS H A 133 ILE HG2% 1.0 . 4.12 815 815 A 81 MET H A 81 MET HGy 1.0 . 5.23 816 816 A 81 MET H A 81 MET HGx 1.0 . 5.23 817 817 A 81 MET H A 81 MET HBx 1.0 . 3.72 818 818 A 82 VAL H A 81 MET HBx 1.0 . 4.07 819 819 A 79 VAL H A 79 VAL HGy% 1.0 . 4.21 820 820 A 69 SER H A 70 GLY H 1.0 . 3.53 821 821 A 110 GLY H A 111 TYR H 1.0 . 3.33 822 822 A 148 ILE H A 147 ARG H 1.0 . 4.76 823 823 A 97 LEU H A 98 SER H 1.0 . 3.61 824 824 A 96 GLU H A 98 SER H 1.0 . 4.97 825 825 A 100 LEU H A 98 SER H 1.0 . 5.36 826 826 A 99 ASP H A 98 SER H 1.0 . 3.60 827 827 A 24 PHE H A 25 ASP H 1.0 . 3.82 828 828 A 128 ILE H A 127 THR H 1.0 . 4.60 829 829 A 69 SER H A 68 GLY H 1.0 . 3.60 830 830 A 109 ASP H A 111 TYR H 1.0 . 4.67 831 831 A 62 ASP H A 63 GLU H 1.0 . 3.67 832 832 A 64 VAL H A 63 GLU H 1.0 . 3.58 833 833 A 156 PHE H A 155 GLU H 1.0 . 3.48 834 834 A 154 LEU H A 155 GLU H 1.0 . 3.69 835 835 A 25 ASP H A 23 ALA H 1.0 . 4.79 836 836 A 45 MET H A 44 VAL H 1.0 . 3.56 837 837 A 104 TRP HD1 A 104 TRP H 1.0 . 4.18 838 838 A 25 ASP H A 24 PHE HDx 1.0 . 4.65 839 839 A 111 TYR HDx A 111 TYR H 1.0 . 4.63 840 840 A 50 GLN HA A 51 ASN H 1.0 . 3.41 841 841 A 25 ASP H A 22 ALA HA 1.0 . 4.58 842 842 A 127 THR H A 126 GLU HA 1.0 . 3.07 843 843 A 127 THR H A 127 THR HB 1.0 . 3.77 844 844 A 98 SER H A 98 SER HBy 1.0 . 3.87 845 845 A 98 SER H A 98 SER HBx 1.0 . 3.87 846 846 A 45 MET H A 41 LEU HA 1.0 . 5.57 847 847 A 24 PHE HBx A 25 ASP H 1.0 . 3.46 848 848 A 89 SER H A 88 ASP HBy 1.0 . 5.04 849 849 A 89 SER H A 88 ASP HBx 1.0 . 5.04 850 850 A 139 ASP H A 139 ASP HBy 1.0 . 3.12 851 851 A 62 ASP HBx A 63 GLU H 1.0 . 4.06 852 852 A 45 MET H A 44 VAL HB 1.0 . 3.95 853 853 A 62 ASP HBy A 63 GLU H 1.0 . 4.25 854 854 A 63 GLU H A 63 GLU HGy 1.0 . 4.01 855 855 A 63 GLU H A 63 GLU HGx 1.0 . 4.01 856 856 A 36 ILE H A 36 ILE HG13 1.0 . 5.24 857 857 A 36 ILE H A 36 ILE HG12 1.0 . 5.24 858 858 A 45 MET H A 80 MET HE% 1.0 . 4.31 859 859 A 100 LEU HG A 104 TRP H 1.0 . 5.54 860 860 A 155 GLU H A 154 LEU HBy 1.0 . 4.44 861 861 A 155 GLU H A 154 LEU HBx 1.0 . 4.44 862 862 A 146 GLY H A 147 ARG H 1.0 . 3.34 863 863 A 56 GLU H A 53 THR H 1.0 . 5.54 864 864 A 144 ASN H A 143 ASN H 1.0 . 3.31 865 865 A 69 SER H A 67 ASP H 1.0 . 4.61 866 866 A 102 ARG H A 101 PHE H 1.0 . 3.75 867 867 A 66 GLU H A 67 ASP H 1.0 . 3.53 868 868 A 26 ILE H A 28 VAL H 1.0 . 4.75 869 869 A 64 VAL H A 65 ASP HA 1.0 . 5.29 870 870 A 65 ASP HA A 67 ASP H 1.0 . 5.46 871 871 A 144 ASN H A 144 ASN HA 1.0 . 2.92 872 872 A 144 ASN H A 142 LYS HA 1.0 . 4.76 873 873 A 28 VAL H A 25 ASP HA 1.0 . 4.72 874 874 A 11 GLN H A 7 ALA HA 1.0 . 4.73 875 875 A 157 MET H A 154 LEU HA 1.0 . 4.60 876 876 A 102 ARG H A 101 PHE HBx 1.0 . 3.71 877 877 A 102 ARG H A 101 PHE HBy 1.0 . 4.46 878 878 A 67 ASP H A 66 GLU HBy 1.0 . 5.30 879 879 A 67 ASP H A 66 GLU HBx 1.0 . 5.30 880 880 A 11 GLN H A 11 GLN HBx 1.0 . 3.83 881 881 A 53 THR HG2% A 53 THR H 1.0 . 3.39 882 882 A 102 ARG H A 102 ARG HBy 1.0 . 3.50 883 883 A 142 LYS H A 143 ASN H 1.0 . 3.40 884 884 A 83 ARG H A 84 SER H 1.0 . 3.64 885 885 A 106 LYS H A 107 ASN H 1.0 . 3.61 886 886 A 146 GLY H A 144 ASN HA 1.0 . 4.74 887 887 A 13 THR H A 12 LEU HA 1.0 . 3.07 888 888 A 141 ASP HA A 143 ASN H 1.0 . 4.67 889 889 A 143 ASN H A 144 ASN HA 1.0 . 4.71 890 890 A 107 ASN H A 105 ASP HA 1.0 . 4.78 891 891 A 84 SER H A 84 SER HBy 1.0 . 3.70 892 892 A 84 SER H A 84 SER HBx 1.0 . 3.70 893 893 A 13 THR H A 12 LEU HBy 1.0 . 4.58 894 894 A 107 ASN H A 106 LYS HBy 1.0 . 5.00 895 895 A 107 ASN H A 106 LYS HBx 1.0 . 5.00 896 896 A 84 SER H A 83 ARG HBy 1.0 . 4.57 897 897 A 84 SER H A 83 ARG HBx 1.0 . 4.57 898 898 A 71 THR H A 70 GLY H 1.0 . 3.51 899 899 A 90 LYS H A 91 GLY H 1.0 . 4.52 900 900 A 124 THR H A 125 GLY H 1.0 . 3.47 901 901 A 90 LYS HA A 91 GLY H 1.0 . 3.37 902 902 A 68 GLY H A 66 GLU HA 1.0 . 5.04 903 903 A 30 GLY H A 29 LEU HA 1.0 . 3.54 904 904 A 34 GLY H A 35 SER H 1.0 . 4.22 905 905 A 42 GLY H A 41 LEU H 1.0 . 3.98 906 906 A 158 LYS H A 159 GLY H 1.0 . 3.72 907 907 A 124 THR H A 121 LEU HA 1.0 . 4.71 908 908 A 124 THR H A 123 ALA HB% 1.0 . 3.87 909 909 A 139 ASP H A 140 GLY H 1.0 . 3.39 910 910 A 139 ASP HBx A 140 GLY H 1.0 . 3.96 911 911 A 148 ILE HD1% A 140 GLY H 1.0 . 4.85 912 912 A 111 TYR HDx A 112 ILE H 1.0 . 4.43 913 913 A 111 TYR HDx A 148 ILE H 1.0 . 5.19 914 914 A 111 TYR HDx A 149 ASP H 1.0 . 5.37 915 915 A 150 TYR H A 111 TYR HDx 1.0 . 4.40 916 916 A 111 TYR HDx A 111 TYR HA 1.0 . 3.06 917 917 A 111 TYR HDx A 149 ASP HBy 1.0 . 4.18 918 918 A 151 ASP H A 150 TYR HDx 1.0 . 4.06 919 919 A 151 ASP HA A 150 TYR HDx 1.0 . 3.89 920 920 A 150 TYR HDx A 150 TYR HA 1.0 . 3.17 921 921 A 150 TYR HBx A 150 TYR HDx 1.0 . 2.88 922 922 A 154 LEU HG A 150 TYR HDx 1.0 . 4.46 923 923 A 5 TYR HDx A 5 TYR HA 1.0 . 2.95 924 924 A 5 TYR HDx A 83 ARG HA 1.0 . 4.11 925 925 A 5 TYR HBx A 5 TYR HDx 1.0 . 3.00 926 926 A 8 ALA HB% A 5 TYR HDx 1.0 . 3.96 927 927 A 5 TYR HDx A 82 VAL HGx% 1.0 . 3.68 928 928 A 22 ALA H A 24 PHE HDx 1.0 . 5.30 929 929 A 21 LYS HA A 24 PHE HDx 1.0 . 4.18 930 930 A 80 MET HE% A 77 PHE HDx 1.0 . 4.66 931 931 A 24 PHE HBy A 24 PHE HDx 1.0 . 3.72 932 932 A 28 VAL HGy% A 24 PHE HDx 1.0 . 4.56 933 933 A 24 PHE H A 24 PHE HDx 1.0 . 4.50 934 934 A 21 LYS HA A 24 PHE HEx 1.0 . 4.59 935 935 A 25 ASP HA A 24 PHE HDx 1.0 . 4.33 936 936 A 28 VAL HGx% A 24 PHE HDx 1.0 . 4.56 937 937 A 102 ARG H A 101 PHE HDx 1.0 . 4.38 938 938 A 102 ARG HA A 101 PHE HDx 1.0 . 4.48 939 939 A 101 PHE HDx A 101 PHE HBx 1.0 . 3.37 940 940 A 28 VAL HGx% A 24 PHE HEx 1.0 . 4.40 941 941 A 28 VAL HA A 27 PHE HDx 1.0 . 4.39 942 942 A 101 PHE HDx A 101 PHE HA 1.0 . 4.25 943 943 A 36 ILE HD1% A 27 PHE HDx 1.0 . 4.73 944 944 A 21 LYS H A 20 PHE HDx 1.0 . 4.49 945 945 A 21 LYS HA A 20 PHE HDx 1.0 . 3.96 946 946 A 24 PHE HBx A 20 PHE HDx 1.0 . 5.24 947 947 A 104 TRP HD1 A 104 TRP HA 1.0 . 3.81 948 948 A 100 LEU HA A 104 TRP HD1 1.0 . 4.10 949 949 A 104 TRP HD1 A 104 TRP HBy 1.0 . 3.64 950 950 A 104 TRP HD1 A 104 TRP HBx 1.0 . 3.64 951 951 A 100 LEU HG A 104 TRP HD1 1.0 . 3.39 952 952 A 100 LEU HDy% A 104 TRP HD1 1.0 . 3.68 953 953 A 104 TRP HD1 A 112 ILE HD1% 1.0 . 4.56 954 954 A 104 TRP HH2 A 119 ILE HG2% 1.0 . 4.03 955 955 A 123 ALA HB% A 104 TRP HZ3 1.0 . 4.32 956 956 A 104 TRP HE3 A 112 ILE HG2% 1.0 . 4.29 957 957 A 112 ILE HD1% A 104 TRP HE3 1.0 . 4.77 958 958 A 104 TRP HE3 A 104 TRP HA 1.0 . 3.47 959 959 A 5 TYR HA A 5 TYR HEx 1.0 . 4.80 960 960 A 5 TYR HEx A 83 ARG HA 1.0 . 3.82 961 961 A 111 TYR HEx A 149 ASP HA 1.0 . 3.96 962 962 A 111 TYR HEx A 149 ASP HBy 1.0 . 3.79 963 963 A 111 TYR HEx A 149 ASP HBx 1.0 . 3.79 964 964 A 101 PHE H A 150 TYR HEx 1.0 . 5.29 965 965 A 101 PHE HBy A 150 TYR HEx 1.0 . 4.08 966 966 A 97 LEU HG A 150 TYR HEx 1.0 . 4.83 967 967 A 154 LEU HG A 150 TYR HEx 1.0 . 4.91 968 968 A 100 LEU HG A 104 TRP HZ2 1.0 . 3.96 969 969 A 100 LEU HDy% A 104 TRP HZ2 1.0 . 4.17 970 970 A 3 ASP H A 3 ASP HBx 1.0 . 3.16 971 970 A 3 ASP H A 3 ASP HBy 1.0 . 3.16 972 971 A 3 ASP HA A 6 LYS HBx 1.0 . 3.66 973 971 A 3 ASP HA A 6 LYS HBy 1.0 . 3.66 974 972 A 3 ASP HA A 6 LYS HDy 1.0 . 4.38 975 972 A 3 ASP HA A 6 LYS HDx 1.0 . 4.38 976 973 A 4 ILE H A 3 ASP HBx 1.0 . 3.70 977 973 A 4 ILE H A 3 ASP HBy 1.0 . 3.70 978 974 A 4 ILE HG2% A 3 ASP HBx 1.0 . 4.56 979 974 A 4 ILE HG2% A 3 ASP HBy 1.0 . 4.56 980 975 A 5 TYR H A 3 ASP HBx 1.0 . 5.07 981 975 A 5 TYR H A 3 ASP HBy 1.0 . 5.07 982 976 A 3 ASP HBy A 6 LYS HBx 1.0 . 4.28 983 976 A 3 ASP HBx A 6 LYS HBx 1.0 . 4.28 984 976 A 6 LYS HBy A 3 ASP HBx 1.0 . 4.28 985 976 A 3 ASP HBy A 6 LYS HBy 1.0 . 4.28 986 977 A 5 TYR H A 6 LYS HBx 1.0 . 4.86 987 977 A 5 TYR H A 6 LYS HBy 1.0 . 4.86 988 978 A 5 TYR HEx A 83 ARG HBx 1.0 . 4.67 989 978 A 5 TYR HEx A 83 ARG HBy 1.0 . 4.67 990 979 A 5 TYR HEx A 83 ARG HDx 1.0 . 4.03 991 979 A 5 TYR HEx A 83 ARG HDy 1.0 . 4.03 992 980 A 6 LYS H A 6 LYS HBx 1.0 . 3.07 993 980 A 6 LYS H A 6 LYS HBy 1.0 . 3.07 994 981 A 6 LYS H A 6 LYS HGx 1.0 . 4.16 995 981 A 6 LYS H A 6 LYS HGy 1.0 . 4.16 996 982 A 6 LYS HA A 6 LYS HGx 1.0 . 3.65 997 982 A 6 LYS HA A 6 LYS HGy 1.0 . 3.65 998 983 A 7 ALA H A 6 LYS HBx 1.0 . 3.37 999 983 A 7 ALA H A 6 LYS HBy 1.0 . 3.37 1000 984 A 6 LYS HEx A 6 LYS HGx 1.0 . 3.33 1001 984 A 6 LYS HEy A 6 LYS HGx 1.0 . 3.33 1002 984 A 6 LYS HGy A 6 LYS HEx 1.0 . 3.33 1003 984 A 6 LYS HGy A 6 LYS HEy 1.0 . 3.33 1004 985 A 10 GLU H A 10 GLU HBx 1.0 . 3.21 1005 985 A 10 GLU H A 10 GLU HBy 1.0 . 3.21 1006 986 A 10 GLU H A 10 GLU HGx 1.0 . 3.82 1007 986 A 10 GLU H A 10 GLU HGy 1.0 . 3.82 1008 987 A 11 GLN H A 10 GLU HBx 1.0 . 4.03 1009 987 A 11 GLN H A 10 GLU HBy 1.0 . 4.03 1010 988 A 11 GLN H A 10 GLU HGx 1.0 . 4.21 1011 988 A 11 GLN H A 10 GLU HGy 1.0 . 4.21 1012 989 A 11 GLN H A 11 GLN HBy 1.0 . 3.10 1013 989 A 11 GLN H A 11 GLN HBx 1.0 . 3.10 1014 990 A 11 GLN H A 11 GLN HGy 1.0 . 3.60 1015 990 A 11 GLN H A 11 GLN HGx 1.0 . 3.60 1016 991 A 11 GLN HA A 11 GLN HGy 1.0 . 3.50 1017 991 A 11 GLN HA A 11 GLN HGx 1.0 . 3.50 1018 992 A 12 LEU H A 12 LEU HBx 1.0 . 3.38 1019 992 A 12 LEU H A 12 LEU HBy 1.0 . 3.38 1020 993 A 13 THR H A 12 LEU HBx 1.0 . 3.98 1021 993 A 13 THR H A 12 LEU HBy 1.0 . 3.98 1022 994 A 12 LEU HBx A 16 GLN HBx 1.0 . 4.76 1023 994 A 12 LEU HBy A 16 GLN HBx 1.0 . 4.76 1024 994 A 16 GLN HBy A 12 LEU HBx 1.0 . 4.76 1025 994 A 12 LEU HBy A 16 GLN HBy 1.0 . 4.76 1026 995 A 12 LEU HBx A 16 GLN HGy 1.0 . 4.51 1027 995 A 12 LEU HBy A 16 GLN HGy 1.0 . 4.51 1028 995 A 16 GLN HGx A 12 LEU HBx 1.0 . 4.51 1029 995 A 12 LEU HBy A 16 GLN HGx 1.0 . 4.51 1030 996 A 85 MET HE% A 12 LEU HBx 1.0 . 4.48 1031 996 A 85 MET HE% A 12 LEU HBy 1.0 . 4.48 1032 997 A 12 LEU HG A 16 GLN HGy 1.0 . 4.36 1033 997 A 12 LEU HG A 16 GLN HGx 1.0 . 4.36 1034 998 A 13 THR H A 16 GLN HBx 1.0 . 5.06 1035 998 A 13 THR H A 16 GLN HBy 1.0 . 5.06 1036 999 A 13 THR H A 16 GLN HGy 1.0 . 3.58 1037 999 A 13 THR H A 16 GLN HGx 1.0 . 3.58 1038 1000 A 13 THR HG2% A 15 GLU HBy 1.0 . 4.05 1039 1000 A 13 THR HG2% A 15 GLU HBx 1.0 . 4.05 1040 1001 A 13 THR HG2% A 15 GLU HGy 1.0 . 4.35 1041 1001 A 13 THR HG2% A 15 GLU HGx 1.0 . 4.35 1042 1002 A 14 GLU H A 14 GLU HBx 1.0 . 3.43 1043 1002 A 14 GLU H A 14 GLU HBy 1.0 . 3.43 1044 1003 A 15 GLU H A 15 GLU HBy 1.0 . 3.60 1045 1003 A 15 GLU H A 15 GLU HBx 1.0 . 3.60 1046 1004 A 15 GLU HA A 15 GLU HGy 1.0 . 3.46 1047 1004 A 15 GLU HA A 15 GLU HGx 1.0 . 3.46 1048 1005 A 15 GLU HA A 18 ASN HBy 1.0 . 3.52 1049 1005 A 15 GLU HA A 18 ASN HBx 1.0 . 3.52 1050 1006 A 15 GLU HBx A 15 GLU HGy 1.0 . 2.37 1051 1006 A 15 GLU HBy A 15 GLU HGy 1.0 . 2.37 1052 1006 A 15 GLU HGx A 15 GLU HBy 1.0 . 2.37 1053 1006 A 15 GLU HBx A 15 GLU HGx 1.0 . 2.37 1054 1007 A 16 GLN H A 15 GLU HBy 1.0 . 4.12 1055 1007 A 16 GLN H A 15 GLU HBx 1.0 . 4.12 1056 1008 A 16 GLN H A 15 GLU HGy 1.0 . 4.08 1057 1008 A 16 GLN H A 15 GLU HGx 1.0 . 4.08 1058 1009 A 16 GLN H A 16 GLN HGy 1.0 . 3.05 1059 1009 A 16 GLN H A 16 GLN HGx 1.0 . 3.05 1060 1010 A 16 GLN HA A 19 GLU HBx 1.0 . 3.89 1061 1010 A 16 GLN HA A 19 GLU HBy 1.0 . 3.89 1062 1011 A 17 LYS H A 16 GLN HBx 1.0 . 4.12 1063 1011 A 17 LYS H A 16 GLN HBy 1.0 . 4.12 1064 1012 A 17 LYS H A 16 GLN HGy 1.0 . 3.69 1065 1012 A 17 LYS H A 16 GLN HGx 1.0 . 3.69 1066 1013 A 17 LYS H A 17 LYS HBx 1.0 . 3.27 1067 1013 A 17 LYS H A 17 LYS HBy 1.0 . 3.27 1068 1014 A 17 LYS H A 17 LYS HGy 1.0 . 4.02 1069 1014 A 17 LYS H A 17 LYS HGx 1.0 . 4.02 1070 1015 A 17 LYS H A 17 LYS HDx 1.0 . 4.23 1071 1015 A 17 LYS H A 17 LYS HDy 1.0 . 4.23 1072 1016 A 17 LYS HA A 17 LYS HGy 1.0 . 3.52 1073 1016 A 17 LYS HA A 17 LYS HGx 1.0 . 3.52 1074 1017 A 17 LYS HBx A 17 LYS HEx 1.0 . 4.34 1075 1017 A 17 LYS HBy A 17 LYS HEx 1.0 . 4.34 1076 1017 A 17 LYS HEy A 17 LYS HBx 1.0 . 4.34 1077 1017 A 17 LYS HBy A 17 LYS HEy 1.0 . 4.34 1078 1018 A 18 ASN H A 17 LYS HBx 1.0 . 3.69 1079 1018 A 18 ASN H A 17 LYS HBy 1.0 . 3.69 1080 1019 A 18 ASN HA A 17 LYS HBx 1.0 . 4.69 1081 1019 A 18 ASN HA A 17 LYS HBy 1.0 . 4.69 1082 1020 A 20 PHE HDx A 17 LYS HGy 1.0 . 5.60 1083 1020 A 20 PHE HDx A 17 LYS HGx 1.0 . 5.60 1084 1021 A 18 ASN H A 18 ASN HBy 1.0 . 3.08 1085 1021 A 18 ASN H A 18 ASN HBx 1.0 . 3.08 1086 1022 A 18 ASN HA A 21 LYS HBx 1.0 . 4.12 1087 1022 A 18 ASN HA A 21 LYS HBy 1.0 . 4.12 1088 1023 A 19 GLU H A 18 ASN HBy 1.0 . 3.61 1089 1023 A 19 GLU H A 18 ASN HBx 1.0 . 3.61 1090 1024 A 19 GLU H A 19 GLU HBx 1.0 . 3.15 1091 1024 A 19 GLU H A 19 GLU HBy 1.0 . 3.15 1092 1025 A 19 GLU H A 19 GLU HGy 1.0 . 4.21 1093 1025 A 19 GLU H A 19 GLU HGx 1.0 . 4.21 1094 1026 A 19 GLU HA A 19 GLU HGy 1.0 . 3.09 1095 1026 A 19 GLU HA A 19 GLU HGx 1.0 . 3.09 1096 1027 A 20 PHE H A 19 GLU HBx 1.0 . 3.74 1097 1027 A 20 PHE H A 19 GLU HBy 1.0 . 3.74 1098 1028 A 20 PHE H A 20 PHE HBx 1.0 . 3.46 1099 1028 A 20 PHE H A 20 PHE HBy 1.0 . 3.46 1100 1029 A 20 PHE HDx A 20 PHE HBx 1.0 . 3.05 1101 1029 A 20 PHE HDx A 20 PHE HBy 1.0 . 3.05 1102 1030 A 21 LYS H A 20 PHE HBx 1.0 . 3.98 1103 1030 A 21 LYS H A 20 PHE HBy 1.0 . 3.98 1104 1031 A 20 PHE HDx A 21 LYS HBx 1.0 . 3.73 1105 1031 A 20 PHE HDx A 21 LYS HBy 1.0 . 3.73 1106 1032 A 20 PHE HDx A 21 LYS HGy 1.0 . 3.29 1107 1032 A 20 PHE HDx A 21 LYS HGx 1.0 . 3.29 1108 1033 A 20 PHE HDx A 21 LYS HDy 1.0 . 5.81 1109 1033 A 20 PHE HDx A 21 LYS HDx 1.0 . 5.81 1110 1034 A 21 LYS HA A 21 LYS HGy 1.0 . 3.68 1111 1034 A 21 LYS HA A 21 LYS HGx 1.0 . 3.68 1112 1035 A 21 LYS HA A 21 LYS HDy 1.0 . 3.67 1113 1035 A 21 LYS HA A 21 LYS HDx 1.0 . 3.67 1114 1036 A 21 LYS HBy A 21 LYS HDy 1.0 . 3.32 1115 1036 A 21 LYS HBx A 21 LYS HDy 1.0 . 3.32 1116 1036 A 21 LYS HDx A 21 LYS HBx 1.0 . 3.32 1117 1036 A 21 LYS HBy A 21 LYS HDx 1.0 . 3.32 1118 1037 A 24 PHE HEx A 21 LYS HBx 1.0 . 4.20 1119 1037 A 24 PHE HEx A 21 LYS HBy 1.0 . 4.20 1120 1038 A 24 PHE HDx A 21 LYS HGy 1.0 . 4.19 1121 1038 A 24 PHE HDx A 21 LYS HGx 1.0 . 4.19 1122 1039 A 24 PHE HDx A 21 LYS HDy 1.0 . 4.61 1123 1039 A 24 PHE HDx A 21 LYS HDx 1.0 . 4.61 1124 1040 A 24 PHE HEx A 25 ASP HBx 1.0 . 5.28 1125 1040 A 24 PHE HEx A 25 ASP HBy 1.0 . 5.28 1126 1041 A 25 ASP H A 25 ASP HBx 1.0 . 3.64 1127 1041 A 25 ASP H A 25 ASP HBy 1.0 . 3.64 1128 1042 A 26 ILE H A 25 ASP HBx 1.0 . 4.01 1129 1042 A 26 ILE H A 25 ASP HBy 1.0 . 4.01 1130 1043 A 27 PHE H A 27 PHE HBx 1.0 . 3.56 1131 1043 A 27 PHE H A 27 PHE HBy 1.0 . 3.56 1132 1044 A 27 PHE HDx A 27 PHE HBx 1.0 . 3.23 1133 1044 A 27 PHE HDx A 27 PHE HBy 1.0 . 3.23 1134 1045 A 36 ILE HG2% A 27 PHE HBx 1.0 . 3.96 1135 1045 A 36 ILE HG2% A 27 PHE HBy 1.0 . 3.96 1136 1046 A 29 LEU H A 29 LEU HBx 1.0 . 3.42 1137 1046 A 29 LEU H A 29 LEU HBy 1.0 . 3.42 1138 1047 A 31 ALA HA A 30 GLY HAy 1.0 . 4.65 1139 1047 A 31 ALA HA A 30 GLY HAx 1.0 . 4.65 1140 1048 A 31 ALA HB% A 32 GLU HBx 1.0 . 5.27 1141 1048 A 31 ALA HB% A 32 GLU HBy 1.0 . 5.27 1142 1049 A 31 ALA HB% A 32 GLU HGx 1.0 . 5.24 1143 1049 A 31 ALA HB% A 32 GLU HGy 1.0 . 5.24 1144 1050 A 31 ALA HB% A 34 GLY HAx 1.0 . 4.03 1145 1050 A 31 ALA HB% A 34 GLY HAy 1.0 . 4.03 1146 1051 A 32 GLU H A 32 GLU HBx 1.0 . 3.64 1147 1051 A 32 GLU H A 32 GLU HBy 1.0 . 3.64 1148 1052 A 32 GLU H A 32 GLU HGx 1.0 . 4.18 1149 1052 A 32 GLU H A 32 GLU HGy 1.0 . 4.18 1150 1053 A 32 GLU HA A 32 GLU HGx 1.0 . 3.71 1151 1053 A 32 GLU HGy A 32 GLU HA 1.0 . 3.71 1152 1054 A 33 ASP H A 32 GLU HBx 1.0 . 4.07 1153 1054 A 33 ASP H A 32 GLU HBy 1.0 . 4.07 1154 1055 A 33 ASP H A 33 ASP HBy 1.0 . 3.63 1155 1055 A 33 ASP H A 33 ASP HBx 1.0 . 3.63 1156 1056 A 36 ILE H A 35 SER HBx 1.0 . 4.39 1157 1056 A 36 ILE H A 35 SER HBy 1.0 . 4.39 1158 1057 A 38 THR H A 37 SER HBy 1.0 . 3.94 1159 1057 A 38 THR H A 37 SER HBx 1.0 . 3.94 1160 1058 A 38 THR HG2% A 41 LEU HBy 1.0 . 4.18 1161 1058 A 38 THR HG2% A 41 LEU HBx 1.0 . 4.18 1162 1059 A 38 THR HG2% A 70 GLY HAy 1.0 . 3.34 1163 1059 A 38 THR HG2% A 70 GLY HAx 1.0 . 3.34 1164 1060 A 40 GLU H A 41 LEU HBy 1.0 . 4.65 1165 1060 A 40 GLU H A 41 LEU HBx 1.0 . 4.65 1166 1061 A 40 GLU HA A 40 GLU HGx 1.0 . 3.59 1167 1061 A 40 GLU HA A 40 GLU HGy 1.0 . 3.59 1168 1062 A 41 LEU H A 41 LEU HBy 1.0 . 3.30 1169 1062 A 41 LEU H A 41 LEU HBx 1.0 . 3.30 1170 1063 A 42 GLY H A 41 LEU HBy 1.0 . 4.05 1171 1063 A 42 GLY H A 41 LEU HBx 1.0 . 4.05 1172 1064 A 45 MET H A 42 GLY HAx 1.0 . 5.60 1173 1064 A 45 MET H A 42 GLY HAy 1.0 . 5.60 1174 1065 A 43 LYS H A 43 LYS HBx 1.0 . 3.05 1175 1065 A 43 LYS H A 43 LYS HBy 1.0 . 3.05 1176 1066 A 43 LYS H A 43 LYS HGy 1.0 . 4.09 1177 1066 A 43 LYS H A 43 LYS HGx 1.0 . 4.09 1178 1067 A 43 LYS HA A 43 LYS HGy 1.0 . 3.74 1179 1067 A 43 LYS HA A 43 LYS HGx 1.0 . 3.74 1180 1068 A 43 LYS HA A 43 LYS HDx 1.0 . 3.72 1181 1068 A 43 LYS HA A 43 LYS HDy 1.0 . 3.72 1182 1069 A 43 LYS HBx A 43 LYS HGy 1.0 . 2.21 1183 1069 A 43 LYS HBy A 43 LYS HGy 1.0 . 2.21 1184 1069 A 43 LYS HGx A 43 LYS HBx 1.0 . 2.21 1185 1069 A 43 LYS HBy A 43 LYS HGx 1.0 . 2.21 1186 1070 A 44 VAL H A 43 LYS HBx 1.0 . 3.04 1187 1070 A 44 VAL H A 43 LYS HBy 1.0 . 3.04 1188 1071 A 45 MET H A 45 MET HGx 1.0 . 3.60 1189 1071 A 45 MET H A 45 MET HGy 1.0 . 3.60 1190 1072 A 45 MET H A 46 ARG HBx 1.0 . 5.16 1191 1072 A 45 MET H A 46 ARG HBy 1.0 . 5.16 1192 1073 A 45 MET HA A 45 MET HGx 1.0 . 3.58 1193 1073 A 45 MET HA A 45 MET HGy 1.0 . 3.58 1194 1074 A 45 MET HE% A 45 MET HGx 1.0 . 3.12 1195 1074 A 45 MET HGy A 45 MET HE% 1.0 . 3.12 1196 1075 A 46 ARG H A 46 ARG HBx 1.0 . 3.14 1197 1075 A 46 ARG H A 46 ARG HBy 1.0 . 3.14 1198 1076 A 46 ARG H A 46 ARG HGx 1.0 . 4.21 1199 1076 A 46 ARG H A 46 ARG HGy 1.0 . 4.21 1200 1077 A 46 ARG HA A 46 ARG HGx 1.0 . 3.72 1201 1077 A 46 ARG HGy A 46 ARG HA 1.0 . 3.72 1202 1078 A 46 ARG HBy A 47 MET HGy 1.0 . 3.78 1203 1078 A 46 ARG HBx A 47 MET HGy 1.0 . 3.78 1204 1078 A 47 MET HGx A 46 ARG HBx 1.0 . 3.78 1205 1078 A 46 ARG HBy A 47 MET HGx 1.0 . 3.78 1206 1079 A 46 ARG HGx A 47 MET HGy 1.0 . 4.90 1207 1079 A 46 ARG HGy A 47 MET HGy 1.0 . 4.90 1208 1079 A 47 MET HGx A 46 ARG HGx 1.0 . 4.90 1209 1079 A 46 ARG HGy A 47 MET HGx 1.0 . 4.90 1210 1080 A 47 MET H A 47 MET HGy 1.0 . 3.28 1211 1080 A 47 MET H A 47 MET HGx 1.0 . 3.28 1212 1081 A 47 MET HA A 47 MET HGy 1.0 . 3.20 1213 1081 A 47 MET HA A 47 MET HGx 1.0 . 3.20 1214 1082 A 47 MET HBy A 47 MET HGy 1.0 . 2.43 1215 1082 A 47 MET HBy A 47 MET HGx 1.0 . 2.43 1216 1083 A 47 MET HBx A 47 MET HGy 1.0 . 2.51 1217 1083 A 47 MET HBx A 47 MET HGx 1.0 . 2.51 1218 1084 A 47 MET HE% A 47 MET HGy 1.0 . 3.48 1219 1084 A 47 MET HE% A 47 MET HGx 1.0 . 3.48 1220 1085 A 48 LEU HA A 49 GLY HAx 1.0 . 4.70 1221 1085 A 48 LEU HA A 49 GLY HAy 1.0 . 4.70 1222 1086 A 49 GLY H A 48 LEU HBy 1.0 . 4.35 1223 1086 A 49 GLY H A 48 LEU HBx 1.0 . 4.35 1224 1087 A 50 GLN HA A 49 GLY HAx 1.0 . 4.98 1225 1087 A 50 GLN HA A 49 GLY HAy 1.0 . 4.98 1226 1088 A 50 GLN H A 50 GLN HBx 1.0 . 3.62 1227 1088 A 50 GLN H A 50 GLN HBy 1.0 . 3.62 1228 1089 A 50 GLN H A 50 GLN HGy 1.0 . 4.58 1229 1089 A 50 GLN H A 50 GLN HGx 1.0 . 4.58 1230 1090 A 50 GLN HA A 50 GLN HGy 1.0 . 3.63 1231 1090 A 50 GLN HA A 50 GLN HGx 1.0 . 3.63 1232 1091 A 51 ASN H A 52 PRO HDy 1.0 . 4.87 1233 1091 A 51 ASN H A 52 PRO HDx 1.0 . 4.87 1234 1092 A 53 THR H A 52 PRO HGx 1.0 . 4.82 1235 1092 A 53 THR H A 52 PRO HGy 1.0 . 4.82 1236 1093 A 53 THR HG2% A 52 PRO HGx 1.0 . 4.74 1237 1093 A 53 THR HG2% A 52 PRO HGy 1.0 . 4.74 1238 1094 A 53 THR HG2% A 54 PRO HDx 1.0 . 3.91 1239 1094 A 53 THR HG2% A 54 PRO HDy 1.0 . 3.91 1240 1095 A 55 GLU H A 54 PRO HBx 1.0 . 3.91 1241 1095 A 55 GLU H A 54 PRO HBy 1.0 . 3.91 1242 1096 A 55 GLU H A 54 PRO HGx 1.0 . 3.73 1243 1096 A 55 GLU H A 54 PRO HGy 1.0 . 3.73 1244 1097 A 55 GLU H A 55 GLU HBx 1.0 . 3.12 1245 1097 A 55 GLU H A 55 GLU HBy 1.0 . 3.12 1246 1098 A 55 GLU H A 55 GLU HGx 1.0 . 3.80 1247 1098 A 55 GLU H A 55 GLU HGy 1.0 . 3.80 1248 1099 A 55 GLU HA A 55 GLU HGx 1.0 . 3.48 1249 1099 A 55 GLU HGy A 55 GLU HA 1.0 . 3.48 1250 1100 A 56 GLU H A 55 GLU HBx 1.0 . 3.87 1251 1100 A 56 GLU H A 55 GLU HBy 1.0 . 3.87 1252 1101 A 56 GLU H A 56 GLU HBy 1.0 . 3.49 1253 1101 A 56 GLU H A 56 GLU HBx 1.0 . 3.49 1254 1102 A 56 GLU H A 56 GLU HGx 1.0 . 3.60 1255 1102 A 56 GLU H A 56 GLU HGy 1.0 . 3.60 1256 1103 A 56 GLU HA A 56 GLU HGx 1.0 . 3.45 1257 1103 A 56 GLU HGy A 56 GLU HA 1.0 . 3.45 1258 1104 A 58 GLN H A 57 LEU HBy 1.0 . 3.79 1259 1104 A 58 GLN H A 57 LEU HBx 1.0 . 3.79 1260 1105 A 58 GLN H A 58 GLN HBx 1.0 . 3.11 1261 1105 A 58 GLN H A 58 GLN HBy 1.0 . 3.11 1262 1106 A 58 GLN H A 58 GLN HGx 1.0 . 4.90 1263 1106 A 58 GLN H A 58 GLN HGy 1.0 . 4.90 1264 1107 A 58 GLN HA A 58 GLN HGx 1.0 . 3.61 1265 1107 A 58 GLN HA A 58 GLN HGy 1.0 . 3.61 1266 1108 A 59 GLU H A 58 GLN HGx 1.0 . 4.18 1267 1108 A 59 GLU H A 58 GLN HGy 1.0 . 4.18 1268 1109 A 59 GLU HA A 58 GLN HGx 1.0 . 4.21 1269 1109 A 58 GLN HGy A 59 GLU HA 1.0 . 4.21 1270 1110 A 59 GLU H A 59 GLU HBx 1.0 . 3.54 1271 1110 A 59 GLU H A 59 GLU HBy 1.0 . 3.54 1272 1111 A 59 GLU H A 59 GLU HGx 1.0 . 3.87 1273 1111 A 59 GLU H A 59 GLU HGy 1.0 . 3.87 1274 1112 A 60 MET H A 60 MET HGx 1.0 . 3.98 1275 1112 A 60 MET H A 60 MET HGy 1.0 . 3.98 1276 1113 A 60 MET HA A 60 MET HGx 1.0 . 3.43 1277 1113 A 60 MET HA A 60 MET HGy 1.0 . 3.43 1278 1114 A 60 MET HE% A 60 MET HBy 1.0 . 2.47 1279 1114 A 60 MET HE% A 60 MET HBx 1.0 . 2.47 1280 1115 A 60 MET HE% A 60 MET HGx 1.0 . 3.02 1281 1115 A 60 MET HE% A 60 MET HGy 1.0 . 3.02 1282 1116 A 61 ILE HG2% A 65 ASP HBy 1.0 . 3.89 1283 1116 A 61 ILE HG2% A 65 ASP HBx 1.0 . 3.89 1284 1117 A 63 GLU H A 63 GLU HBx 1.0 . 3.14 1285 1117 A 63 GLU H A 63 GLU HBy 1.0 . 3.14 1286 1118 A 63 GLU H A 63 GLU HGx 1.0 . 3.52 1287 1118 A 63 GLU H A 63 GLU HGy 1.0 . 3.52 1288 1119 A 63 GLU HBy A 63 GLU HGx 1.0 . 2.30 1289 1119 A 63 GLU HBx A 63 GLU HGx 1.0 . 2.30 1290 1119 A 63 GLU HGy A 63 GLU HBx 1.0 . 2.30 1291 1119 A 63 GLU HBy A 63 GLU HGy 1.0 . 2.30 1292 1120 A 67 ASP H A 65 ASP HBy 1.0 . 4.45 1293 1120 A 67 ASP H A 65 ASP HBx 1.0 . 4.45 1294 1121 A 66 GLU H A 66 GLU HGx 1.0 . 4.04 1295 1121 A 66 GLU H A 66 GLU HGy 1.0 . 4.04 1296 1122 A 66 GLU HA A 66 GLU HGx 1.0 . 3.31 1297 1122 A 66 GLU HA A 66 GLU HGy 1.0 . 3.31 1298 1123 A 67 ASP H A 67 ASP HBx 1.0 . 3.58 1299 1123 A 67 ASP H A 67 ASP HBy 1.0 . 3.58 1300 1124 A 69 SER H A 69 SER HBx 1.0 . 3.34 1301 1124 A 69 SER H A 69 SER HBy 1.0 . 3.34 1302 1125 A 73 ASP H A 76 GLU HGy 1.0 . 3.74 1303 1125 A 73 ASP H A 76 GLU HGx 1.0 . 3.74 1304 1126 A 74 PHE H A 73 ASP HBx 1.0 . 3.53 1305 1126 A 74 PHE H A 73 ASP HBy 1.0 . 3.53 1306 1127 A 73 ASP HBy A 74 PHE HBy 1.0 . 4.05 1307 1127 A 73 ASP HBx A 74 PHE HBy 1.0 . 4.05 1308 1127 A 74 PHE HBx A 73 ASP HBx 1.0 . 4.05 1309 1127 A 73 ASP HBy A 74 PHE HBx 1.0 . 4.05 1310 1128 A 75 ASP H A 75 ASP HBx 1.0 . 3.47 1311 1128 A 75 ASP H A 75 ASP HBy 1.0 . 3.47 1312 1129 A 76 GLU H A 76 GLU HGy 1.0 . 3.47 1313 1129 A 76 GLU H A 76 GLU HGx 1.0 . 3.47 1314 1130 A 76 GLU HA A 76 GLU HGy 1.0 . 3.05 1315 1130 A 76 GLU HGx A 76 GLU HA 1.0 . 3.05 1316 1131 A 77 PHE H A 80 MET HBy 1.0 . 5.33 1317 1131 A 77 PHE H A 80 MET HBx 1.0 . 5.33 1318 1132 A 77 PHE HA A 80 MET HBy 1.0 . 3.78 1319 1132 A 77 PHE HA A 80 MET HBx 1.0 . 3.78 1320 1133 A 78 LEU H A 78 LEU HBy 1.0 . 3.28 1321 1133 A 78 LEU H A 78 LEU HBx 1.0 . 3.28 1322 1134 A 78 LEU HA A 81 MET HBy 1.0 . 4.12 1323 1134 A 78 LEU HA A 81 MET HBx 1.0 . 4.12 1324 1135 A 80 MET H A 80 MET HGy 1.0 . 4.17 1325 1135 A 80 MET H A 80 MET HGx 1.0 . 4.17 1326 1136 A 80 MET HA A 83 ARG HDx 1.0 . 4.72 1327 1136 A 80 MET HA A 83 ARG HDy 1.0 . 4.72 1328 1137 A 80 MET HE% A 80 MET HBy 1.0 . 2.45 1329 1137 A 80 MET HE% A 80 MET HBx 1.0 . 2.45 1330 1138 A 81 MET H A 80 MET HBy 1.0 . 3.84 1331 1138 A 81 MET H A 80 MET HBx 1.0 . 3.84 1332 1139 A 80 MET HBy A 81 MET HBy 1.0 . 4.37 1333 1139 A 80 MET HBx A 81 MET HBy 1.0 . 4.37 1334 1139 A 81 MET HBx A 80 MET HBy 1.0 . 4.37 1335 1139 A 80 MET HBx A 81 MET HBx 1.0 . 4.37 1336 1140 A 80 MET HE% A 80 MET HGy 1.0 . 3.51 1337 1140 A 80 MET HE% A 80 MET HGx 1.0 . 3.51 1338 1141 A 80 MET HE% A 81 MET HBy 1.0 . 4.65 1339 1141 A 80 MET HE% A 81 MET HBx 1.0 . 4.65 1340 1142 A 81 MET H A 81 MET HGy 1.0 . 4.48 1341 1142 A 81 MET H A 81 MET HGx 1.0 . 4.48 1342 1143 A 81 MET HE% A 81 MET HBy 1.0 . 3.75 1343 1143 A 81 MET HBx A 81 MET HE% 1.0 . 3.75 1344 1144 A 82 VAL H A 81 MET HBy 1.0 . 3.45 1345 1144 A 82 VAL H A 81 MET HBx 1.0 . 3.45 1346 1145 A 83 ARG H A 83 ARG HBx 1.0 . 3.49 1347 1145 A 83 ARG H A 83 ARG HBy 1.0 . 3.49 1348 1146 A 83 ARG H A 83 ARG HGy 1.0 . 4.55 1349 1146 A 83 ARG H A 83 ARG HGx 1.0 . 4.55 1350 1147 A 83 ARG HBy A 83 ARG HDx 1.0 . 3.14 1351 1147 A 83 ARG HBx A 83 ARG HDx 1.0 . 3.14 1352 1147 A 83 ARG HDy A 83 ARG HBx 1.0 . 3.14 1353 1147 A 83 ARG HBy A 83 ARG HDy 1.0 . 3.14 1354 1148 A 84 SER H A 83 ARG HBx 1.0 . 3.87 1355 1148 A 84 SER H A 83 ARG HBy 1.0 . 3.87 1356 1149 A 84 SER H A 83 ARG HGy 1.0 . 5.04 1357 1149 A 84 SER H A 83 ARG HGx 1.0 . 5.04 1358 1150 A 84 SER H A 84 SER HBx 1.0 . 3.15 1359 1150 A 84 SER H A 84 SER HBy 1.0 . 3.15 1360 1151 A 85 MET H A 84 SER HBx 1.0 . 3.99 1361 1151 A 85 MET H A 84 SER HBy 1.0 . 3.99 1362 1152 A 85 MET H A 85 MET HBx 1.0 . 3.23 1363 1152 A 85 MET H A 85 MET HBy 1.0 . 3.23 1364 1153 A 85 MET H A 85 MET HGy 1.0 . 3.49 1365 1153 A 85 MET H A 85 MET HGx 1.0 . 3.49 1366 1154 A 85 MET H A 86 LYS HBx 1.0 . 5.60 1367 1154 A 85 MET H A 86 LYS HBy 1.0 . 5.60 1368 1155 A 85 MET HA A 85 MET HGy 1.0 . 3.54 1369 1155 A 85 MET HGx A 85 MET HA 1.0 . 3.54 1370 1156 A 86 LYS H A 85 MET HBx 1.0 . 3.97 1371 1156 A 86 LYS H A 85 MET HBy 1.0 . 3.97 1372 1157 A 86 LYS H A 86 LYS HGy 1.0 . 4.94 1373 1157 A 86 LYS H A 86 LYS HGx 1.0 . 4.94 1374 1158 A 86 LYS HA A 86 LYS HGy 1.0 . 3.69 1375 1158 A 86 LYS HA A 86 LYS HGx 1.0 . 3.69 1376 1159 A 86 LYS HA A 86 LYS HDy 1.0 . 3.89 1377 1159 A 86 LYS HA A 86 LYS HDx 1.0 . 3.89 1378 1160 A 87 ASP H A 86 LYS HGy 1.0 . 4.80 1379 1160 A 87 ASP H A 86 LYS HGx 1.0 . 4.80 1380 1161 A 87 ASP H A 87 ASP HBx 1.0 . 3.70 1381 1161 A 87 ASP H A 87 ASP HBy 1.0 . 3.70 1382 1162 A 88 ASP H A 87 ASP HBx 1.0 . 4.02 1383 1162 A 88 ASP H A 87 ASP HBy 1.0 . 4.02 1384 1163 A 88 ASP H A 88 ASP HBy 1.0 . 3.59 1385 1163 A 88 ASP H A 88 ASP HBx 1.0 . 3.59 1386 1164 A 89 SER H A 88 ASP HBy 1.0 . 4.37 1387 1164 A 89 SER H A 88 ASP HBx 1.0 . 4.37 1388 1165 A 90 LYS H A 90 LYS HBy 1.0 . 3.43 1389 1165 A 90 LYS H A 90 LYS HBx 1.0 . 3.43 1390 1166 A 90 LYS H A 90 LYS HGy 1.0 . 4.76 1391 1166 A 90 LYS H A 90 LYS HGx 1.0 . 4.76 1392 1167 A 92 LYS H A 92 LYS HBy 1.0 . 3.19 1393 1167 A 92 LYS H A 92 LYS HBx 1.0 . 3.19 1394 1168 A 92 LYS H A 92 LYS HGy 1.0 . 4.38 1395 1168 A 92 LYS H A 92 LYS HGx 1.0 . 4.38 1396 1169 A 92 LYS HA A 92 LYS HDy 1.0 . 4.15 1397 1169 A 92 LYS HA A 92 LYS HDx 1.0 . 4.15 1398 1170 A 92 LYS HA A 92 LYS HEy 1.0 . 3.96 1399 1170 A 92 LYS HA A 92 LYS HEx 1.0 . 3.96 1400 1171 A 92 LYS HBy A 92 LYS HGy 1.0 . 2.28 1401 1171 A 92 LYS HBx A 92 LYS HGy 1.0 . 2.28 1402 1171 A 92 LYS HGx A 92 LYS HBy 1.0 . 2.28 1403 1171 A 92 LYS HBx A 92 LYS HGx 1.0 . 2.28 1404 1172 A 93 SER H A 92 LYS HBy 1.0 . 4.16 1405 1172 A 93 SER H A 92 LYS HBx 1.0 . 4.16 1406 1173 A 92 LYS HDy A 92 LYS HGy 1.0 . 2.34 1407 1173 A 92 LYS HDx A 92 LYS HGy 1.0 . 2.34 1408 1173 A 92 LYS HGx A 92 LYS HDy 1.0 . 2.34 1409 1173 A 92 LYS HGx A 92 LYS HDx 1.0 . 2.34 1410 1174 A 92 LYS HEx A 92 LYS HGy 1.0 . 3.17 1411 1174 A 92 LYS HEy A 92 LYS HGy 1.0 . 3.17 1412 1174 A 92 LYS HGx A 92 LYS HEy 1.0 . 3.17 1413 1174 A 92 LYS HGx A 92 LYS HEx 1.0 . 3.17 1414 1175 A 93 SER H A 93 SER HBy 1.0 . 3.49 1415 1175 A 93 SER H A 93 SER HBx 1.0 . 3.49 1416 1176 A 93 SER H A 94 GLU HBx 1.0 . 4.96 1417 1176 A 93 SER H A 94 GLU HBy 1.0 . 4.96 1418 1177 A 94 GLU H A 93 SER HBy 1.0 . 3.86 1419 1177 A 94 GLU H A 93 SER HBx 1.0 . 3.86 1420 1178 A 94 GLU H A 94 GLU HBx 1.0 . 3.19 1421 1178 A 94 GLU H A 94 GLU HBy 1.0 . 3.19 1422 1179 A 95 GLU H A 95 GLU HBx 1.0 . 2.94 1423 1179 A 95 GLU H A 95 GLU HBy 1.0 . 2.94 1424 1180 A 95 GLU H A 95 GLU HGx 1.0 . 3.92 1425 1180 A 95 GLU H A 95 GLU HGy 1.0 . 3.92 1426 1181 A 95 GLU HA A 95 GLU HBx 1.0 . 2.63 1427 1181 A 95 GLU HBy A 95 GLU HA 1.0 . 2.63 1428 1182 A 95 GLU HA A 95 GLU HGx 1.0 . 3.17 1429 1182 A 95 GLU HGy A 95 GLU HA 1.0 . 3.17 1430 1183 A 96 GLU H A 95 GLU HBx 1.0 . 3.34 1431 1183 A 96 GLU H A 95 GLU HBy 1.0 . 3.34 1432 1184 A 96 GLU H A 96 GLU HBy 1.0 . 3.26 1433 1184 A 96 GLU H A 96 GLU HBx 1.0 . 3.26 1434 1185 A 96 GLU H A 96 GLU HGy 1.0 . 3.66 1435 1185 A 96 GLU H A 96 GLU HGx 1.0 . 3.66 1436 1186 A 96 GLU HA A 96 GLU HGy 1.0 . 3.56 1437 1186 A 96 GLU HGx A 96 GLU HA 1.0 . 3.56 1438 1187 A 97 LEU H A 96 GLU HBy 1.0 . 3.63 1439 1187 A 97 LEU H A 96 GLU HBx 1.0 . 3.63 1440 1188 A 97 LEU H A 97 LEU HBx 1.0 . 3.43 1441 1188 A 97 LEU H A 97 LEU HBy 1.0 . 3.43 1442 1189 A 97 LEU HA A 100 LEU HBx 1.0 . 4.31 1443 1189 A 97 LEU HA A 100 LEU HBy 1.0 . 4.31 1444 1190 A 98 SER H A 97 LEU HBx 1.0 . 3.66 1445 1190 A 98 SER H A 97 LEU HBy 1.0 . 3.66 1446 1191 A 150 TYR HEx A 97 LEU HBx 1.0 . 4.27 1447 1191 A 150 TYR HEx A 97 LEU HBy 1.0 . 4.27 1448 1192 A 98 SER H A 98 SER HBx 1.0 . 3.35 1449 1192 A 98 SER H A 98 SER HBy 1.0 . 3.35 1450 1193 A 99 ASP H A 99 ASP HBy 1.0 . 3.05 1451 1193 A 99 ASP H A 99 ASP HBx 1.0 . 3.05 1452 1194 A 101 PHE H A 100 LEU HBx 1.0 . 3.54 1453 1194 A 101 PHE H A 100 LEU HBy 1.0 . 3.54 1454 1195 A 104 TRP HD1 A 100 LEU HBx 1.0 . 4.13 1455 1195 A 104 TRP HD1 A 100 LEU HBy 1.0 . 4.13 1456 1196 A 101 PHE HDx A 102 ARG HBy 1.0 . 4.51 1457 1196 A 101 PHE HDx A 102 ARG HBx 1.0 . 4.51 1458 1197 A 102 ARG H A 102 ARG HBy 1.0 . 2.96 1459 1197 A 102 ARG H A 102 ARG HBx 1.0 . 2.96 1460 1198 A 102 ARG H A 102 ARG HGx 1.0 . 4.57 1461 1198 A 102 ARG H A 102 ARG HGy 1.0 . 4.57 1462 1199 A 102 ARG HA A 102 ARG HDy 1.0 . 4.46 1463 1199 A 102 ARG HA A 102 ARG HDx 1.0 . 4.46 1464 1200 A 102 ARG HA A 105 ASP HBx 1.0 . 3.68 1465 1200 A 102 ARG HA A 105 ASP HBy 1.0 . 3.68 1466 1201 A 102 ARG HBy A 102 ARG HDy 1.0 . 3.31 1467 1201 A 102 ARG HBx A 102 ARG HDy 1.0 . 3.31 1468 1201 A 102 ARG HDx A 102 ARG HBy 1.0 . 3.31 1469 1201 A 102 ARG HBx A 102 ARG HDx 1.0 . 3.31 1470 1202 A 103 MET H A 102 ARG HBy 1.0 . 3.66 1471 1202 A 103 MET H A 102 ARG HBx 1.0 . 3.66 1472 1203 A 104 TRP H A 102 ARG HBy 1.0 . 5.81 1473 1203 A 104 TRP H A 102 ARG HBx 1.0 . 5.81 1474 1204 A 104 TRP H A 102 ARG HGx 1.0 . 5.81 1475 1204 A 104 TRP H A 102 ARG HGy 1.0 . 5.81 1476 1205 A 105 ASP H A 102 ARG HGx 1.0 . 5.46 1477 1205 A 105 ASP H A 102 ARG HGy 1.0 . 5.46 1478 1206 A 102 ARG HGy A 106 LYS HDy 1.0 . 2.35 1479 1206 A 106 LYS HDx A 102 ARG HGx 1.0 . 2.35 1480 1206 A 102 ARG HGy A 106 LYS HDx 1.0 . 2.35 1481 1206 A 102 ARG HGx A 106 LYS HDy 1.0 . 2.35 1482 1207 A 103 MET H A 103 MET HBy 1.0 . 3.39 1483 1207 A 103 MET H A 103 MET HBx 1.0 . 3.39 1484 1208 A 103 MET HBx A 103 MET HGx 1.0 . 2.29 1485 1208 A 103 MET HBy A 103 MET HGx 1.0 . 2.29 1486 1208 A 103 MET HGy A 103 MET HBy 1.0 . 2.29 1487 1208 A 103 MET HBx A 103 MET HGy 1.0 . 2.29 1488 1209 A 103 MET HE% A 103 MET HGx 1.0 . 3.00 1489 1209 A 103 MET HGy A 103 MET HE% 1.0 . 3.00 1490 1210 A 104 TRP H A 103 MET HGx 1.0 . 4.83 1491 1210 A 104 TRP H A 103 MET HGy 1.0 . 4.83 1492 1211 A 104 TRP HE3 A 103 MET HGx 1.0 . 5.07 1493 1211 A 104 TRP HE3 A 103 MET HGy 1.0 . 5.07 1494 1212 A 104 TRP HZ3 A 103 MET HGx 1.0 . 5.81 1495 1212 A 104 TRP HZ3 A 103 MET HGy 1.0 . 5.81 1496 1213 A 104 TRP H A 104 TRP HBx 1.0 . 3.55 1497 1213 A 104 TRP H A 104 TRP HBy 1.0 . 3.55 1498 1214 A 104 TRP HD1 A 104 TRP HBx 1.0 . 3.11 1499 1214 A 104 TRP HD1 A 104 TRP HBy 1.0 . 3.11 1500 1215 A 104 TRP HE3 A 104 TRP HBx 1.0 . 3.62 1501 1215 A 104 TRP HE3 A 104 TRP HBy 1.0 . 3.62 1502 1216 A 112 ILE HD1% A 104 TRP HBx 1.0 . 3.06 1503 1216 A 112 ILE HD1% A 104 TRP HBy 1.0 . 3.06 1504 1217 A 105 ASP H A 105 ASP HBx 1.0 . 3.10 1505 1217 A 105 ASP H A 105 ASP HBy 1.0 . 3.10 1506 1218 A 112 ILE HD1% A 105 ASP HBx 1.0 . 3.62 1507 1218 A 112 ILE HD1% A 105 ASP HBy 1.0 . 3.62 1508 1219 A 106 LYS H A 106 LYS HBx 1.0 . 3.14 1509 1219 A 106 LYS H A 106 LYS HBy 1.0 . 3.14 1510 1220 A 106 LYS H A 106 LYS HGy 1.0 . 3.65 1511 1220 A 106 LYS H A 106 LYS HGx 1.0 . 3.65 1512 1221 A 106 LYS HA A 106 LYS HDy 1.0 . 3.41 1513 1221 A 106 LYS HA A 106 LYS HDx 1.0 . 3.41 1514 1222 A 107 ASN H A 106 LYS HBx 1.0 . 4.19 1515 1222 A 107 ASN H A 106 LYS HBy 1.0 . 4.19 1516 1223 A 109 ASP H A 109 ASP HBy 1.0 . 3.65 1517 1223 A 109 ASP H A 109 ASP HBx 1.0 . 3.65 1518 1224 A 111 TYR HDx A 110 GLY HAy 1.0 . 5.16 1519 1224 A 111 TYR HDx A 110 GLY HAx 1.0 . 5.16 1520 1225 A 111 TYR H A 111 TYR HBy 1.0 . 3.63 1521 1225 A 111 TYR H A 111 TYR HBx 1.0 . 3.63 1522 1226 A 111 TYR HDx A 111 TYR HBy 1.0 . 3.23 1523 1226 A 111 TYR HDx A 111 TYR HBx 1.0 . 3.23 1524 1227 A 112 ILE H A 111 TYR HBy 1.0 . 4.13 1525 1227 A 112 ILE H A 111 TYR HBx 1.0 . 4.13 1526 1228 A 111 TYR HBx A 147 ARG HDy 1.0 . 3.91 1527 1228 A 111 TYR HBy A 147 ARG HDy 1.0 . 3.91 1528 1228 A 147 ARG HDx A 111 TYR HBy 1.0 . 3.91 1529 1228 A 111 TYR HBx A 147 ARG HDx 1.0 . 3.91 1530 1229 A 111 TYR HDx A 147 ARG HBx 1.0 . 4.78 1531 1229 A 111 TYR HDx A 147 ARG HBy 1.0 . 4.78 1532 1230 A 111 TYR HDx A 147 ARG HGy 1.0 . 4.27 1533 1230 A 111 TYR HDx A 147 ARG HGx 1.0 . 4.27 1534 1231 A 111 TYR HDx A 147 ARG HDy 1.0 . 4.15 1535 1231 A 111 TYR HDx A 147 ARG HDx 1.0 . 4.15 1536 1232 A 111 TYR HDx A 149 ASP HBy 1.0 . 3.65 1537 1232 A 111 TYR HDx A 149 ASP HBx 1.0 . 3.65 1538 1233 A 111 TYR HEx A 147 ARG HDy 1.0 . 4.71 1539 1233 A 111 TYR HEx A 147 ARG HDx 1.0 . 4.71 1540 1234 A 111 TYR HEx A 149 ASP HBy 1.0 . 3.24 1541 1234 A 111 TYR HEx A 149 ASP HBx 1.0 . 3.24 1542 1235 A 112 ILE HG2% A 116 GLU HGy 1.0 . 4.20 1543 1235 A 112 ILE HG2% A 116 GLU HGx 1.0 . 4.20 1544 1236 A 113 ASP H A 113 ASP HBy 1.0 . 3.67 1545 1236 A 113 ASP H A 113 ASP HBx 1.0 . 3.67 1546 1237 A 114 LEU H A 113 ASP HBy 1.0 . 3.09 1547 1237 A 114 LEU H A 113 ASP HBx 1.0 . 3.09 1548 1238 A 114 LEU H A 114 LEU HBy 1.0 . 3.08 1549 1238 A 114 LEU H A 114 LEU HBx 1.0 . 3.08 1550 1239 A 115 ASP H A 114 LEU HBy 1.0 . 3.36 1551 1239 A 115 ASP H A 114 LEU HBx 1.0 . 3.36 1552 1240 A 115 ASP H A 115 ASP HBy 1.0 . 3.02 1553 1240 A 115 ASP H A 115 ASP HBx 1.0 . 3.02 1554 1241 A 115 ASP HA A 118 LYS HDy 1.0 . 4.03 1555 1241 A 115 ASP HA A 118 LYS HDx 1.0 . 4.03 1556 1242 A 116 GLU H A 115 ASP HBy 1.0 . 3.16 1557 1242 A 116 GLU H A 115 ASP HBx 1.0 . 3.16 1558 1243 A 116 GLU HA A 115 ASP HBy 1.0 . 3.99 1559 1243 A 116 GLU HA A 115 ASP HBx 1.0 . 3.99 1560 1244 A 115 ASP HBy A 118 LYS HDy 1.0 . 5.02 1561 1244 A 115 ASP HBx A 118 LYS HDy 1.0 . 5.02 1562 1244 A 118 LYS HDx A 115 ASP HBy 1.0 . 5.02 1563 1244 A 115 ASP HBx A 118 LYS HDx 1.0 . 5.02 1564 1245 A 116 GLU H A 116 GLU HGy 1.0 . 3.30 1565 1245 A 116 GLU H A 116 GLU HGx 1.0 . 3.30 1566 1246 A 117 LEU H A 116 GLU HGy 1.0 . 4.32 1567 1246 A 117 LEU H A 116 GLU HGx 1.0 . 4.32 1568 1247 A 118 LYS H A 118 LYS HGx 1.0 . 3.86 1569 1247 A 118 LYS H A 118 LYS HGy 1.0 . 3.86 1570 1248 A 118 LYS H A 118 LYS HDy 1.0 . 4.45 1571 1248 A 118 LYS H A 118 LYS HDx 1.0 . 4.45 1572 1249 A 118 LYS HA A 118 LYS HGx 1.0 . 3.62 1573 1249 A 118 LYS HA A 118 LYS HGy 1.0 . 3.62 1574 1250 A 118 LYS HA A 118 LYS HDy 1.0 . 4.14 1575 1250 A 118 LYS HA A 118 LYS HDx 1.0 . 4.14 1576 1251 A 118 LYS HBy A 118 LYS HEy 1.0 . 4.58 1577 1251 A 118 LYS HBy A 118 LYS HEx 1.0 . 4.58 1578 1252 A 118 LYS HBx A 118 LYS HEy 1.0 . 4.84 1579 1252 A 118 LYS HBx A 118 LYS HEx 1.0 . 4.84 1580 1253 A 118 LYS HEx A 118 LYS HGx 1.0 . 3.24 1581 1253 A 118 LYS HEy A 118 LYS HGx 1.0 . 3.24 1582 1253 A 118 LYS HGy A 118 LYS HEy 1.0 . 3.24 1583 1253 A 118 LYS HGy A 118 LYS HEx 1.0 . 3.24 1584 1254 A 119 ILE H A 118 LYS HGx 1.0 . 3.94 1585 1254 A 119 ILE H A 118 LYS HGy 1.0 . 3.94 1586 1255 A 133 ILE HD1% A 118 LYS HGx 1.0 . 3.87 1587 1255 A 133 ILE HD1% A 118 LYS HGy 1.0 . 3.87 1588 1256 A 119 ILE HD1% A 118 LYS HEy 1.0 . 4.46 1589 1256 A 119 ILE HD1% A 118 LYS HEx 1.0 . 4.46 1590 1257 A 133 ILE HD1% A 118 LYS HEy 1.0 . 5.02 1591 1257 A 133 ILE HD1% A 118 LYS HEx 1.0 . 5.02 1592 1258 A 120 MET HE% A 120 MET HGy 1.0 . 2.81 1593 1258 A 120 MET HGx A 120 MET HE% 1.0 . 2.81 1594 1259 A 121 LEU H A 121 LEU HBx 1.0 . 2.92 1595 1259 A 121 LEU H A 121 LEU HBy 1.0 . 2.92 1596 1260 A 122 GLN H A 122 GLN HBx 1.0 . 3.50 1597 1260 A 122 GLN H A 122 GLN HBy 1.0 . 3.50 1598 1261 A 122 GLN H A 122 GLN HGx 1.0 . 3.45 1599 1261 A 122 GLN H A 122 GLN HGy 1.0 . 3.45 1600 1262 A 122 GLN HA A 122 GLN HGx 1.0 . 3.27 1601 1262 A 122 GLN HA A 122 GLN HGy 1.0 . 3.27 1602 1263 A 123 ALA H A 122 GLN HBx 1.0 . 3.46 1603 1263 A 123 ALA H A 122 GLN HBy 1.0 . 3.46 1604 1264 A 123 ALA H A 122 GLN HGx 1.0 . 4.54 1605 1264 A 123 ALA H A 122 GLN HGy 1.0 . 4.54 1606 1265 A 126 GLU HA A 125 GLY HAy 1.0 . 5.77 1607 1265 A 126 GLU HA A 125 GLY HAx 1.0 . 5.77 1608 1266 A 126 GLU H A 126 GLU HBx 1.0 . 3.36 1609 1266 A 126 GLU H A 126 GLU HBy 1.0 . 3.36 1610 1267 A 126 GLU H A 126 GLU HGx 1.0 . 3.91 1611 1267 A 126 GLU H A 126 GLU HGy 1.0 . 3.91 1612 1268 A 127 THR H A 126 GLU HBx 1.0 . 3.42 1613 1268 A 127 THR H A 126 GLU HBy 1.0 . 3.42 1614 1269 A 130 GLU H A 130 GLU HBx 1.0 . 3.16 1615 1269 A 130 GLU H A 130 GLU HBy 1.0 . 3.16 1616 1270 A 130 GLU H A 130 GLU HGx 1.0 . 4.11 1617 1270 A 130 GLU H A 130 GLU HGy 1.0 . 4.11 1618 1271 A 130 GLU HA A 130 GLU HGx 1.0 . 3.15 1619 1271 A 130 GLU HA A 130 GLU HGy 1.0 . 3.15 1620 1272 A 131 ASP H A 130 GLU HBx 1.0 . 3.26 1621 1272 A 131 ASP H A 130 GLU HBy 1.0 . 3.26 1622 1273 A 131 ASP HBy A 130 GLU HBx 1.0 . 4.69 1623 1273 A 131 ASP HBy A 130 GLU HBy 1.0 . 4.69 1624 1274 A 133 ILE HD1% A 130 GLU HGx 1.0 . 4.11 1625 1274 A 133 ILE HD1% A 130 GLU HGy 1.0 . 4.11 1626 1275 A 133 ILE HA A 136 LEU HBy 1.0 . 3.93 1627 1275 A 133 ILE HA A 136 LEU HBx 1.0 . 3.93 1628 1276 A 133 ILE HG2% A 134 GLU HBx 1.0 . 4.77 1629 1276 A 133 ILE HG2% A 134 GLU HBy 1.0 . 4.77 1630 1277 A 134 GLU H A 134 GLU HBx 1.0 . 3.08 1631 1277 A 134 GLU H A 134 GLU HBy 1.0 . 3.08 1632 1278 A 134 GLU HA A 134 GLU HGy 1.0 . 3.32 1633 1278 A 134 GLU HA A 134 GLU HGx 1.0 . 3.32 1634 1279 A 135 GLU H A 135 GLU HBx 1.0 . 2.90 1635 1279 A 135 GLU H A 135 GLU HBy 1.0 . 2.90 1636 1280 A 135 GLU H A 136 LEU HBy 1.0 . 4.67 1637 1280 A 135 GLU H A 136 LEU HBx 1.0 . 4.67 1638 1281 A 136 LEU H A 135 GLU HBx 1.0 . 4.39 1639 1281 A 136 LEU H A 135 GLU HBy 1.0 . 4.39 1640 1282 A 136 LEU H A 136 LEU HBy 1.0 . 3.11 1641 1282 A 136 LEU H A 136 LEU HBx 1.0 . 3.11 1642 1283 A 137 MET H A 136 LEU HBy 1.0 . 3.66 1643 1283 A 137 MET H A 136 LEU HBx 1.0 . 3.66 1644 1284 A 137 MET H A 137 MET HGx 1.0 . 4.25 1645 1284 A 137 MET H A 137 MET HGy 1.0 . 4.25 1646 1285 A 138 LYS H A 137 MET HBx 1.0 . 3.73 1647 1285 A 138 LYS H A 137 MET HBy 1.0 . 3.73 1648 1286 A 138 LYS H A 138 LYS HBx 1.0 . 3.03 1649 1286 A 138 LYS H A 138 LYS HBy 1.0 . 3.03 1650 1287 A 138 LYS H A 138 LYS HGy 1.0 . 3.97 1651 1287 A 138 LYS H A 138 LYS HGx 1.0 . 3.97 1652 1288 A 138 LYS HA A 138 LYS HGy 1.0 . 3.37 1653 1288 A 138 LYS HA A 138 LYS HGx 1.0 . 3.37 1654 1289 A 138 LYS HBy A 138 LYS HGy 1.0 . 2.31 1655 1289 A 138 LYS HBx A 138 LYS HGy 1.0 . 2.31 1656 1289 A 138 LYS HGx A 138 LYS HBx 1.0 . 2.31 1657 1289 A 138 LYS HBy A 138 LYS HGx 1.0 . 2.31 1658 1290 A 138 LYS HBx A 138 LYS HEx 1.0 . 4.51 1659 1290 A 138 LYS HBy A 138 LYS HEx 1.0 . 4.51 1660 1290 A 138 LYS HEy A 138 LYS HBx 1.0 . 4.51 1661 1290 A 138 LYS HBy A 138 LYS HEy 1.0 . 4.51 1662 1291 A 138 LYS HGy A 142 LYS HGx 1.0 . 2.18 1663 1291 A 138 LYS HGx A 142 LYS HGx 1.0 . 2.18 1664 1291 A 142 LYS HGy A 138 LYS HGy 1.0 . 2.18 1665 1291 A 138 LYS HGx A 142 LYS HGy 1.0 . 2.18 1666 1292 A 148 ILE HD1% A 141 ASP HBy 1.0 . 3.91 1667 1292 A 148 ILE HD1% A 141 ASP HBx 1.0 . 3.91 1668 1293 A 142 LYS H A 142 LYS HGx 1.0 . 3.53 1669 1293 A 142 LYS H A 142 LYS HGy 1.0 . 3.53 1670 1294 A 142 LYS H A 142 LYS HEx 1.0 . 4.77 1671 1294 A 142 LYS H A 142 LYS HEy 1.0 . 4.77 1672 1295 A 142 LYS HA A 142 LYS HGx 1.0 . 3.65 1673 1295 A 142 LYS HA A 142 LYS HGy 1.0 . 3.65 1674 1296 A 142 LYS HA A 142 LYS HDy 1.0 . 3.26 1675 1296 A 142 LYS HA A 142 LYS HDx 1.0 . 3.26 1676 1297 A 142 LYS HDx A 142 LYS HGx 1.0 . 2.37 1677 1297 A 142 LYS HDy A 142 LYS HGx 1.0 . 2.37 1678 1297 A 142 LYS HGy A 142 LYS HDy 1.0 . 2.37 1679 1297 A 142 LYS HGy A 142 LYS HDx 1.0 . 2.37 1680 1298 A 142 LYS HEx A 142 LYS HGx 1.0 . 3.08 1681 1298 A 142 LYS HGy A 142 LYS HEx 1.0 . 3.08 1682 1298 A 142 LYS HGy A 142 LYS HEy 1.0 . 3.08 1683 1298 A 142 LYS HEy A 142 LYS HGx 1.0 . 3.08 1684 1299 A 143 ASN H A 145 ASP HBx 1.0 . 4.36 1685 1299 A 143 ASN H A 145 ASP HBy 1.0 . 4.36 1686 1300 A 144 ASN H A 144 ASN HBy 1.0 . 3.67 1687 1300 A 144 ASN H A 144 ASN HBx 1.0 . 3.67 1688 1301 A 147 ARG H A 147 ARG HBx 1.0 . 3.66 1689 1301 A 147 ARG H A 147 ARG HBy 1.0 . 3.66 1690 1302 A 147 ARG H A 147 ARG HGy 1.0 . 3.88 1691 1302 A 147 ARG H A 147 ARG HGx 1.0 . 3.88 1692 1303 A 147 ARG HBx A 147 ARG HDy 1.0 . 3.08 1693 1303 A 147 ARG HBy A 147 ARG HDy 1.0 . 3.08 1694 1303 A 147 ARG HDx A 147 ARG HBx 1.0 . 3.08 1695 1303 A 147 ARG HDx A 147 ARG HBy 1.0 . 3.08 1696 1304 A 148 ILE H A 147 ARG HBx 1.0 . 3.64 1697 1304 A 148 ILE H A 147 ARG HBy 1.0 . 3.64 1698 1305 A 148 ILE HG2% A 152 GLU HBx 1.0 . 3.45 1699 1305 A 148 ILE HG2% A 152 GLU HBy 1.0 . 3.45 1700 1306 A 148 ILE HG2% A 153 PHE HBx 1.0 . 3.08 1701 1306 A 148 ILE HG2% A 153 PHE HBy 1.0 . 3.08 1702 1307 A 148 ILE HG2% A 156 PHE HBy 1.0 . 4.46 1703 1307 A 148 ILE HG2% A 156 PHE HBx 1.0 . 4.46 1704 1308 A 149 ASP H A 152 GLU HBx 1.0 . 3.94 1705 1308 A 149 ASP H A 152 GLU HBy 1.0 . 3.94 1706 1309 A 150 TYR H A 149 ASP HBy 1.0 . 3.16 1707 1309 A 150 TYR H A 149 ASP HBx 1.0 . 3.16 1708 1310 A 149 ASP HBy A 152 GLU HBx 1.0 . 4.14 1709 1310 A 149 ASP HBx A 152 GLU HBx 1.0 . 4.14 1710 1310 A 152 GLU HBy A 149 ASP HBy 1.0 . 4.14 1711 1310 A 149 ASP HBx A 152 GLU HBy 1.0 . 4.14 1712 1311 A 151 ASP H A 151 ASP HBx 1.0 . 3.20 1713 1311 A 151 ASP H A 151 ASP HBy 1.0 . 3.20 1714 1312 A 152 GLU H A 152 GLU HBx 1.0 . 3.29 1715 1312 A 152 GLU H A 152 GLU HBy 1.0 . 3.29 1716 1313 A 152 GLU H A 152 GLU HGx 1.0 . 3.61 1717 1313 A 152 GLU H A 152 GLU HGy 1.0 . 3.61 1718 1314 A 152 GLU HA A 152 GLU HGx 1.0 . 3.54 1719 1314 A 152 GLU HGy A 152 GLU HA 1.0 . 3.54 1720 1315 A 152 GLU HBx A 152 GLU HGx 1.0 . 2.30 1721 1315 A 152 GLU HBy A 152 GLU HGx 1.0 . 2.30 1722 1315 A 152 GLU HGy A 152 GLU HBx 1.0 . 2.30 1723 1315 A 152 GLU HBy A 152 GLU HGy 1.0 . 2.30 1724 1316 A 153 PHE H A 152 GLU HBx 1.0 . 4.35 1725 1316 A 153 PHE H A 152 GLU HBy 1.0 . 4.35 1726 1317 A 153 PHE H A 153 PHE HBx 1.0 . 3.13 1727 1317 A 153 PHE H A 153 PHE HBy 1.0 . 3.13 1728 1318 A 153 PHE HA A 156 PHE HBy 1.0 . 3.67 1729 1318 A 153 PHE HA A 156 PHE HBx 1.0 . 3.67 1730 1319 A 154 LEU H A 153 PHE HBx 1.0 . 3.89 1731 1319 A 154 LEU H A 153 PHE HBy 1.0 . 3.89 1732 1320 A 154 LEU H A 154 LEU HBx 1.0 . 3.18 1733 1320 A 154 LEU H A 154 LEU HBy 1.0 . 3.18 1734 1321 A 155 GLU H A 154 LEU HBx 1.0 . 3.58 1735 1321 A 155 GLU H A 154 LEU HBy 1.0 . 3.58 1736 1322 A 155 GLU H A 155 GLU HBy 1.0 . 3.15 1737 1322 A 155 GLU H A 155 GLU HBx 1.0 . 3.15 1738 1323 A 156 PHE H A 155 GLU HBy 1.0 . 3.75 1739 1323 A 156 PHE H A 155 GLU HBx 1.0 . 3.75 1740 1324 A 157 MET H A 156 PHE HBy 1.0 . 3.41 1741 1324 A 157 MET H A 156 PHE HBx 1.0 . 3.41 1742 1325 A 157 MET HBy A 161 GLU HBy 1.0 . 2.44 1743 1325 A 161 GLU HBx A 157 MET HBx 1.0 . 2.44 1744 1325 A 157 MET HBy A 161 GLU HBx 1.0 . 2.44 1745 1325 A 157 MET HBx A 161 GLU HBy 1.0 . 2.44 1746 1326 A 158 LYS H A 158 LYS HBx 1.0 . 3.44 1747 1326 A 158 LYS H A 158 LYS HBy 1.0 . 3.44 1748 1327 A 158 LYS H A 158 LYS HGy 1.0 . 3.35 1749 1327 A 158 LYS H A 158 LYS HGx 1.0 . 3.35 1750 1328 A 158 LYS HA A 158 LYS HGy 1.0 . 3.43 1751 1328 A 158 LYS HA A 158 LYS HGx 1.0 . 3.43 1752 1329 A 160 VAL H A 161 GLU HBy 1.0 . 4.51 1753 1329 A 160 VAL H A 161 GLU HBx 1.0 . 4.51 1754 1330 A 161 GLU H A 161 GLU HBy 1.0 . 3.58 1755 1330 A 161 GLU H A 161 GLU HBx 1.0 . 3.58 1756 1331 A 161 GLU H A 161 GLU HGy 1.0 . 4.77 1757 1331 A 161 GLU H A 161 GLU HGx 1.0 . 4.77 1758 1332 A 161 GLU HBx A 161 GLU HGy 1.0 . 2.21 1759 1332 A 161 GLU HBy A 161 GLU HGy 1.0 . 2.21 1760 1332 A 161 GLU HGx A 161 GLU HBy 1.0 . 2.21 1761 1332 A 161 GLU HBx A 161 GLU HGx 1.0 . 2.21 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 2 ASP C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -80.0 -56.0 PHI 2 2 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 ILE N 1.0 -55.0 -19.0 PSI 3 3 A 3 ASP C A 4 ILE N A 4 ILE CA A 4 ILE C 1.0 -89.8 -47.3 PHI 4 4 A 4 ILE N A 4 ILE CA A 4 ILE C A 5 TYR N 1.0 -50.0 -25.2 PSI 5 5 A 4 ILE C A 5 TYR N A 5 TYR CA A 5 TYR C 1.0 -89.0 -51.1 PHI 6 6 A 5 TYR N A 5 TYR CA A 5 TYR C A 6 LYS N 1.0 -65.1 -17.0 PSI 7 7 A 5 TYR C A 6 LYS N A 6 LYS CA A 6 LYS C 1.0 -71.4 -51.4 PHI 8 8 A 6 LYS N A 6 LYS CA A 6 LYS C A 7 ALA N 1.0 -52.9 -30.0 PSI 9 9 A 6 LYS C A 7 ALA N A 7 ALA CA A 7 ALA C 1.0 -74.0 -54.0 PHI 10 10 A 7 ALA N A 7 ALA CA A 7 ALA C A 8 ALA N 1.0 -63.0 -11.0 PSI 11 11 A 7 ALA C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -79.6 -57.4 PHI 12 12 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 VAL N 1.0 -46.6 -26.6 PSI 13 13 A 8 ALA C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -73.5 -53.5 PHI 14 14 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 GLU N 1.0 -57.7 -32.0 PSI 15 15 A 9 VAL C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -75.0 -47.0 PHI 16 16 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 GLN N 1.0 -44.0 -24.0 PSI 17 17 A 13 THR C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -67.7 -47.3 PHI 18 18 A 14 GLU N A 14 GLU CA A 14 GLU C A 15 GLU N 1.0 -55.1 -20.3 PSI 19 19 A 14 GLU C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -75.1 -55.1 PHI 20 20 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 GLN N 1.0 -51.8 -31.8 PSI 21 21 A 15 GLU C A 16 GLN N A 16 GLN CA A 16 GLN C 1.0 -73.5 -53.5 PHI 22 22 A 16 GLN N A 16 GLN CA A 16 GLN C A 17 LYS N 1.0 -53.2 -30.5 PSI 23 23 A 16 GLN C A 17 LYS N A 17 LYS CA A 17 LYS C 1.0 -73.2 -53.2 PHI 24 24 A 17 LYS N A 17 LYS CA A 17 LYS C A 18 ASN N 1.0 -52.9 -32.9 PSI 25 25 A 17 LYS C A 18 ASN N A 18 ASN CA A 18 ASN C 1.0 -74.2 -54.2 PHI 26 26 A 18 ASN N A 18 ASN CA A 18 ASN C A 19 GLU N 1.0 -53.8 -28.1 PSI 27 27 A 18 ASN C A 19 GLU N A 19 GLU CA A 19 GLU C 1.0 -75.9 -55.9 PHI 28 28 A 19 GLU N A 19 GLU CA A 19 GLU C A 20 PHE N 1.0 -55.8 -16.6 PSI 29 29 A 20 PHE C A 21 LYS N A 21 LYS CA A 21 LYS C 1.0 -83.0 -43.0 PHI 30 30 A 21 LYS N A 21 LYS CA A 21 LYS C A 22 ALA N 1.0 -60.0 -12.0 PSI 31 31 A 21 LYS C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -77.0 -49.0 PHI 32 32 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 ALA N 1.0 -52.0 -20.0 PSI 33 33 A 22 ALA C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -81.0 -53.0 PHI 34 34 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 PHE N 1.0 -56.0 -24.0 PSI 35 35 A 23 ALA C A 24 PHE N A 24 PHE CA A 24 PHE C 1.0 -82.2 -42.9 PHI 36 36 A 24 PHE N A 24 PHE CA A 24 PHE C A 25 ASP N 1.0 -54.3 -34.3 PSI 37 37 A 24 PHE C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -71.8 -50.4 PHI 38 38 A 25 ASP N A 25 ASP CA A 25 ASP C A 26 ILE N 1.0 -51.4 -16.3 PSI 39 39 A 25 ASP C A 26 ILE N A 26 ILE CA A 26 ILE C 1.0 -84.0 -48.0 PHI 40 40 A 26 ILE N A 26 ILE CA A 26 ILE C A 27 PHE N 1.0 -47.0 -27.0 PSI 41 41 A 26 ILE C A 27 PHE N A 27 PHE CA A 27 PHE C 1.0 -86.0 -46.0 PHI 42 42 A 27 PHE N A 27 PHE CA A 27 PHE C A 28 VAL N 1.0 -56.0 -12.0 PSI 43 43 A 35 SER C A 36 ILE N A 36 ILE CA A 36 ILE C 1.0 -167.2 -62.3 PHI 44 44 A 36 ILE N A 36 ILE CA A 36 ILE C A 37 SER N 1.0 107.2 163.3 PSI 45 45 A 36 ILE C A 37 SER N A 37 SER CA A 37 SER C 1.0 -115.0 -47.8 PHI 46 46 A 37 SER N A 37 SER CA A 37 SER C A 38 THR N 1.0 137.8 182.7 PSI 47 47 A 37 SER C A 38 THR N A 38 THR CA A 38 THR C 1.0 -70.5 -50.5 PHI 48 48 A 38 THR N A 38 THR CA A 38 THR C A 39 LYS N 1.0 -48.2 -20.4 PSI 49 49 A 38 THR C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -88.0 -52.2 PHI 50 50 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 GLU N 1.0 -50.4 -18.4 PSI 51 51 A 40 GLU C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -82.5 -49.8 PHI 52 52 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 GLY N 1.0 -62.5 0.0 PSI 53 53 A 41 LEU C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 -79.6 -52.0 PHI 54 54 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 LYS N 1.0 -59.5 -20.7 PSI 55 55 A 42 GLY C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -82.5 -50.3 PHI 56 56 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 VAL N 1.0 -54.9 -25.7 PSI 57 57 A 43 LYS C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -76.0 -56.0 PHI 58 58 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 MET N 1.0 -53.9 -33.9 PSI 59 59 A 44 VAL C A 45 MET N A 45 MET CA A 45 MET C 1.0 -70.3 -50.4 PHI 60 60 A 45 MET N A 45 MET CA A 45 MET C A 46 ARG N 1.0 -57.2 -26.1 PSI 61 61 A 45 MET C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -74.9 -54.9 PHI 62 62 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 MET N 1.0 -47.2 -27.2 PSI 63 63 A 46 ARG C A 47 MET N A 47 MET CA A 47 MET C 1.0 -82.0 -49.6 PHI 64 64 A 47 MET N A 47 MET CA A 47 MET C A 48 LEU N 1.0 -54.8 0.7 PSI 65 65 A 47 MET C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -106.0 -74.0 PHI 66 66 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 GLY N 1.0 -19.0 29.0 PSI 67 67 A 54 PRO C A 55 GLU N A 55 GLU CA A 55 GLU C 1.0 -74.0 -54.0 PHI 68 68 A 55 GLU N A 55 GLU CA A 55 GLU C A 56 GLU N 1.0 -54.0 -30.0 PSI 69 69 A 55 GLU C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -75.1 -54.6 PHI 70 70 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 LEU N 1.0 -55.2 -31.8 PSI 71 71 A 56 GLU C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -74.3 -54.3 PHI 72 72 A 57 LEU N A 57 LEU CA A 57 LEU C A 58 GLN N 1.0 -50.1 -27.2 PSI 73 73 A 57 LEU C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -74.7 -52.3 PHI 74 74 A 58 GLN N A 58 GLN CA A 58 GLN C A 59 GLU N 1.0 -56.1 -24.1 PSI 75 75 A 58 GLN C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -75.7 -52.4 PHI 76 76 A 59 GLU N A 59 GLU CA A 59 GLU C A 60 MET N 1.0 -49.2 -29.2 PSI 77 77 A 59 GLU C A 60 MET N A 60 MET CA A 60 MET C 1.0 -76.7 -52.1 PHI 78 78 A 60 MET N A 60 MET CA A 60 MET C A 61 ILE N 1.0 -61.2 -27.2 PSI 79 79 A 60 MET C A 61 ILE N A 61 ILE CA A 61 ILE C 1.0 -74.6 -54.6 PHI 80 80 A 61 ILE N A 61 ILE CA A 61 ILE C A 62 ASP N 1.0 -54.4 -34.4 PSI 81 81 A 61 ILE C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -72.4 -46.4 PHI 82 82 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 GLU N 1.0 -60.3 -15.0 PSI 83 83 A 62 ASP C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -88.0 -52.9 PHI 84 84 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 VAL N 1.0 -44.7 -15.8 PSI 85 85 A 69 SER C A 70 GLY N A 70 GLY CA A 70 GLY C 1.0 69.0 105.0 PHI 86 86 A 70 GLY N A 70 GLY CA A 70 GLY C A 71 THR N 1.0 -20.0 20.0 PSI 87 87 A 70 GLY C A 71 THR N A 71 THR CA A 71 THR C 1.0 -151.0 -121.6 PHI 88 88 A 71 THR N A 71 THR CA A 71 THR C A 72 VAL N 1.0 135.2 175.2 PSI 89 89 A 71 THR C A 72 VAL N A 72 VAL CA A 72 VAL C 1.0 -122.5 -89.1 PHI 90 90 A 72 VAL N A 72 VAL CA A 72 VAL C A 73 ASP N 1.0 107.7 135.9 PSI 91 91 A 73 ASP C A 74 PHE N A 74 PHE CA A 74 PHE C 1.0 -70.2 -44.6 PHI 92 92 A 74 PHE N A 74 PHE CA A 74 PHE C A 75 ASP N 1.0 -62.6 -24.1 PSI 93 93 A 74 PHE C A 75 ASP N A 75 ASP CA A 75 ASP C 1.0 -70.1 -49.0 PHI 94 94 A 75 ASP N A 75 ASP CA A 75 ASP C A 76 GLU N 1.0 -60.1 -15.2 PSI 95 95 A 75 ASP C A 76 GLU N A 76 GLU CA A 76 GLU C 1.0 -76.7 -56.7 PHI 96 96 A 76 GLU N A 76 GLU CA A 76 GLU C A 77 PHE N 1.0 -47.3 -26.7 PSI 97 97 A 76 GLU C A 77 PHE N A 77 PHE CA A 77 PHE C 1.0 -77.8 -52.6 PHI 98 98 A 77 PHE N A 77 PHE CA A 77 PHE C A 78 LEU N 1.0 -56.1 -34.1 PSI 99 99 A 77 PHE C A 78 LEU N A 78 LEU CA A 78 LEU C 1.0 -69.6 -49.6 PHI 100 100 A 78 LEU N A 78 LEU CA A 78 LEU C A 79 VAL N 1.0 -56.2 -29.3 PSI 101 101 A 78 LEU C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -75.1 -53.0 PHI 102 102 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 MET N 1.0 -54.5 -29.6 PSI 103 103 A 79 VAL C A 80 MET N A 80 MET CA A 80 MET C 1.0 -75.1 -48.1 PHI 104 104 A 80 MET N A 80 MET CA A 80 MET C A 81 MET N 1.0 -53.9 -27.4 PSI 105 105 A 80 MET C A 81 MET N A 81 MET CA A 81 MET C 1.0 -77.2 -52.5 PHI 106 106 A 81 MET N A 81 MET CA A 81 MET C A 82 VAL N 1.0 -49.9 -27.6 PSI 107 107 A 81 MET C A 82 VAL N A 82 VAL CA A 82 VAL C 1.0 -93.5 -48.8 PHI 108 108 A 82 VAL N A 82 VAL CA A 82 VAL C A 83 ARG N 1.0 -54.2 -27.6 PSI 109 109 A 82 VAL C A 83 ARG N A 83 ARG CA A 83 ARG C 1.0 -72.2 -50.8 PHI 110 110 A 83 ARG N A 83 ARG CA A 83 ARG C A 84 SER N 1.0 -48.4 -28.4 PSI 111 111 A 83 ARG C A 84 SER N A 84 SER CA A 84 SER C 1.0 -75.0 -51.0 PHI 112 112 A 84 SER N A 84 SER CA A 84 SER C A 85 MET N 1.0 -60.0 0.0 PSI 113 113 A 84 SER C A 85 MET N A 85 MET CA A 85 MET C 1.0 -97.0 -45.0 PHI 114 114 A 85 MET N A 85 MET CA A 85 MET C A 86 LYS N 1.0 -62.0 -2.0 PSI 115 115 A 93 SER C A 94 GLU N A 94 GLU CA A 94 GLU C 1.0 -68.0 -48.0 PHI 116 116 A 94 GLU N A 94 GLU CA A 94 GLU C A 95 GLU N 1.0 -52.0 -28.0 PSI 117 117 A 94 GLU C A 95 GLU N A 95 GLU CA A 95 GLU C 1.0 -80.7 -51.0 PHI 118 118 A 95 GLU N A 95 GLU CA A 95 GLU C A 96 GLU N 1.0 -56.6 -32.9 PSI 119 119 A 95 GLU C A 96 GLU N A 96 GLU CA A 96 GLU C 1.0 -77.9 -53.6 PHI 120 120 A 96 GLU N A 96 GLU CA A 96 GLU C A 97 LEU N 1.0 -56.3 -30.9 PSI 121 121 A 96 GLU C A 97 LEU N A 97 LEU CA A 97 LEU C 1.0 -76.0 -49.0 PHI 122 122 A 97 LEU N A 97 LEU CA A 97 LEU C A 98 SER N 1.0 -49.5 -29.5 PSI 123 123 A 97 LEU C A 98 SER N A 98 SER CA A 98 SER C 1.0 -78.6 -56.4 PHI 124 124 A 98 SER N A 98 SER CA A 98 SER C A 99 ASP N 1.0 -54.2 -28.3 PSI 125 125 A 98 SER C A 99 ASP N A 99 ASP CA A 99 ASP C 1.0 -76.8 -56.8 PHI 126 126 A 99 ASP N A 99 ASP CA A 99 ASP C A 100 LEU N 1.0 -59.0 -13.2 PSI 127 127 A 99 ASP C A 100 LEU N A 100 LEU CA A 100 LEU C 1.0 -80.8 -55.1 PHI 128 128 A 100 LEU N A 100 LEU CA A 100 LEU C A 101 PHE N 1.0 -57.2 -26.8 PSI 129 129 A 100 LEU C A 101 PHE N A 101 PHE CA A 101 PHE C 1.0 -79.0 -46.4 PHI 130 130 A 101 PHE N A 101 PHE CA A 101 PHE C A 102 ARG N 1.0 -54.0 -26.8 PSI 131 131 A 101 PHE C A 102 ARG N A 102 ARG CA A 102 ARG C 1.0 -72.3 -50.7 PHI 132 132 A 102 ARG N A 102 ARG CA A 102 ARG C A 103 MET N 1.0 -53.3 -14.4 PSI 133 133 A 102 ARG C A 103 MET N A 103 MET CA A 103 MET C 1.0 -80.0 -48.0 PHI 134 134 A 103 MET N A 103 MET CA A 103 MET C A 104 TRP N 1.0 -53.0 -9.0 PSI 135 135 A 110 GLY C A 111 TYR N A 111 TYR CA A 111 TYR C 1.0 -153.0 -121.0 PHI 136 136 A 111 TYR N A 111 TYR CA A 111 TYR C A 112 ILE N 1.0 132.0 176.0 PSI 137 137 A 111 TYR C A 112 ILE N A 112 ILE CA A 112 ILE C 1.0 -129.0 -85.0 PHI 138 138 A 112 ILE N A 112 ILE CA A 112 ILE C A 113 ASP N 1.0 110.0 134.0 PSI 139 139 A 112 ILE C A 113 ASP N A 113 ASP CA A 113 ASP C 1.0 -142.4 -42.5 PHI 140 140 A 113 ASP N A 113 ASP CA A 113 ASP C A 114 LEU N 1.0 151.1 186.2 PSI 141 141 A 113 ASP C A 114 LEU N A 114 LEU CA A 114 LEU C 1.0 -79.1 -42.4 PHI 142 142 A 114 LEU N A 114 LEU CA A 114 LEU C A 115 ASP N 1.0 -60.1 -17.9 PSI 143 143 A 114 LEU C A 115 ASP N A 115 ASP CA A 115 ASP C 1.0 -77.6 -52.1 PHI 144 144 A 115 ASP N A 115 ASP CA A 115 ASP C A 116 GLU N 1.0 -51.3 -31.3 PSI 145 145 A 115 ASP C A 116 GLU N A 116 GLU CA A 116 GLU C 1.0 -78.2 -58.2 PHI 146 146 A 116 GLU N A 116 GLU CA A 116 GLU C A 117 LEU N 1.0 -53.1 -21.2 PSI 147 147 A 116 GLU C A 117 LEU N A 117 LEU CA A 117 LEU C 1.0 -75.2 -52.3 PHI 148 148 A 117 LEU N A 117 LEU CA A 117 LEU C A 118 LYS N 1.0 -51.6 -31.6 PSI 149 149 A 117 LEU C A 118 LYS N A 118 LYS CA A 118 LYS C 1.0 -73.3 -53.3 PHI 150 150 A 118 LYS N A 118 LYS CA A 118 LYS C A 119 ILE N 1.0 -52.2 -28.1 PSI 151 151 A 118 LYS C A 119 ILE N A 119 ILE CA A 119 ILE C 1.0 -87.9 -46.0 PHI 152 152 A 119 ILE N A 119 ILE CA A 119 ILE C A 120 MET N 1.0 -55.6 -33.2 PSI 153 153 A 119 ILE C A 120 MET N A 120 MET CA A 120 MET C 1.0 -72.3 -49.4 PHI 154 154 A 120 MET N A 120 MET CA A 120 MET C A 121 LEU N 1.0 -54.7 -33.0 PSI 155 155 A 120 MET C A 121 LEU N A 121 LEU CA A 121 LEU C 1.0 -73.3 -45.9 PHI 156 156 A 121 LEU N A 121 LEU CA A 121 LEU C A 122 GLN N 1.0 -58.4 -9.3 PSI 157 157 A 121 LEU C A 122 GLN N A 122 GLN CA A 122 GLN C 1.0 -88.0 -45.6 PHI 158 158 A 122 GLN N A 122 GLN CA A 122 GLN C A 123 ALA N 1.0 -56.5 -20.8 PSI 159 159 A 122 GLN C A 123 ALA N A 123 ALA CA A 123 ALA C 1.0 -87.8 -48.8 PHI 160 160 A 123 ALA N A 123 ALA CA A 123 ALA C A 124 THR N 1.0 -59.2 -13.8 PSI 161 161 A 123 ALA C A 124 THR N A 124 THR CA A 124 THR C 1.0 -127.0 -75.0 PHI 162 162 A 124 THR N A 124 THR CA A 124 THR C A 125 GLY N 1.0 -24.0 28.0 PSI 163 163 A 129 THR C A 130 GLU N A 130 GLU CA A 130 GLU C 1.0 -68.0 -48.0 PHI 164 164 A 130 GLU N A 130 GLU CA A 130 GLU C A 131 ASP N 1.0 -51.0 -27.0 PSI 165 165 A 130 GLU C A 131 ASP N A 131 ASP CA A 131 ASP C 1.0 -75.2 -49.5 PHI 166 166 A 131 ASP N A 131 ASP CA A 131 ASP C A 132 ASP N 1.0 -56.2 -27.7 PSI 167 167 A 131 ASP C A 132 ASP N A 132 ASP CA A 132 ASP C 1.0 -78.6 -51.6 PHI 168 168 A 132 ASP N A 132 ASP CA A 132 ASP C A 133 ILE N 1.0 -51.6 -28.3 PSI 169 169 A 132 ASP C A 133 ILE N A 133 ILE CA A 133 ILE C 1.0 -72.7 -52.7 PHI 170 170 A 133 ILE N A 133 ILE CA A 133 ILE C A 134 GLU N 1.0 -54.5 -34.5 PSI 171 171 A 133 ILE C A 134 GLU N A 134 GLU CA A 134 GLU C 1.0 -73.4 -50.2 PHI 172 172 A 134 GLU N A 134 GLU CA A 134 GLU C A 135 GLU N 1.0 -53.5 -27.9 PSI 173 173 A 134 GLU C A 135 GLU N A 135 GLU CA A 135 GLU C 1.0 -76.6 -56.6 PHI 174 174 A 135 GLU N A 135 GLU CA A 135 GLU C A 136 LEU N 1.0 -53.8 -29.3 PSI 175 175 A 135 GLU C A 136 LEU N A 136 LEU CA A 136 LEU C 1.0 -74.5 -47.8 PHI 176 176 A 136 LEU N A 136 LEU CA A 136 LEU C A 137 MET N 1.0 -56.7 -31.8 PSI 177 177 A 136 LEU C A 137 MET N A 137 MET CA A 137 MET C 1.0 -80.0 -52.0 PHI 178 178 A 137 MET N A 137 MET CA A 137 MET C A 138 LYS N 1.0 -55.0 -31.0 PSI 179 179 A 137 MET C A 138 LYS N A 138 LYS CA A 138 LYS C 1.0 -78.8 -49.2 PHI 180 180 A 138 LYS N A 138 LYS CA A 138 LYS C A 139 ASP N 1.0 -56.5 -26.2 PSI 181 181 A 138 LYS C A 139 ASP N A 139 ASP CA A 139 ASP C 1.0 -87.0 -51.0 PHI 182 182 A 139 ASP N A 139 ASP CA A 139 ASP C A 140 GLY N 1.0 -43.0 -23.0 PSI 183 183 A 145 ASP C A 146 GLY N A 146 GLY CA A 146 GLY C 1.0 63.0 103.0 PHI 184 184 A 146 GLY N A 146 GLY CA A 146 GLY C A 147 ARG N 1.0 -27.0 25.0 PSI 185 185 A 146 GLY C A 147 ARG N A 147 ARG CA A 147 ARG C 1.0 -149.8 -116.3 PHI 186 186 A 147 ARG N A 147 ARG CA A 147 ARG C A 148 ILE N 1.0 130.9 186.2 PSI 187 187 A 147 ARG C A 148 ILE N A 148 ILE CA A 148 ILE C 1.0 -121.3 -85.8 PHI 188 188 A 148 ILE N A 148 ILE CA A 148 ILE C A 149 ASP N 1.0 108.2 134.3 PSI 189 189 A 148 ILE C A 149 ASP N A 149 ASP CA A 149 ASP C 1.0 -103.0 -79.6 PHI 190 190 A 149 ASP N A 149 ASP CA A 149 ASP C A 150 TYR N 1.0 164.8 184.8 PSI 191 191 A 149 ASP C A 150 TYR N A 150 TYR CA A 150 TYR C 1.0 -70.0 -45.7 PHI 192 192 A 150 TYR N A 150 TYR CA A 150 TYR C A 151 ASP N 1.0 -65.3 -20.1 PSI 193 193 A 150 TYR C A 151 ASP N A 151 ASP CA A 151 ASP C 1.0 -70.0 -50.0 PHI 194 194 A 151 ASP N A 151 ASP CA A 151 ASP C A 152 GLU N 1.0 -60.0 -16.0 PSI 195 195 A 151 ASP C A 152 GLU N A 152 GLU CA A 152 GLU C 1.0 -79.2 -55.6 PHI 196 196 A 152 GLU N A 152 GLU CA A 152 GLU C A 153 PHE N 1.0 -49.9 -26.7 PSI 197 197 A 152 GLU C A 153 PHE N A 153 PHE CA A 153 PHE C 1.0 -75.7 -55.7 PHI 198 198 A 153 PHE N A 153 PHE CA A 153 PHE C A 154 LEU N 1.0 -56.2 -33.5 PSI 199 199 A 153 PHE C A 154 LEU N A 154 LEU CA A 154 LEU C 1.0 -71.5 -51.5 PHI 200 200 A 154 LEU N A 154 LEU CA A 154 LEU C A 155 GLU N 1.0 -54.3 -33.8 PSI 201 201 A 154 LEU C A 155 GLU N A 155 GLU CA A 155 GLU C 1.0 -76.8 -52.5 PHI 202 202 A 155 GLU N A 155 GLU CA A 155 GLU C A 156 PHE N 1.0 -49.8 -29.8 PSI 203 203 A 155 GLU C A 156 PHE N A 156 PHE CA A 156 PHE C 1.0 -85.8 -51.4 PHI 204 204 A 156 PHE N A 156 PHE CA A 156 PHE C A 157 MET N 1.0 -50.6 -26.4 PSI 205 205 A 156 PHE C A 157 MET N A 157 MET CA A 157 MET C 1.0 -92.0 -44.0 PHI 206 206 A 157 MET N A 157 MET CA A 157 MET C A 158 LYS N 1.0 -53.0 -5.0 PSI stop_ save_