data_nef_c16297_2kiv 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 -12 MET start . . 2 A -11 HIS middle . . 3 A -10 HIS middle . . 4 A -9 HIS middle . . 5 A -8 HIS middle . . 6 A -7 HIS middle . . 7 A -6 HIS middle . . 8 A -5 LEU middle . . 9 A -4 VAL middle . . 10 A -3 PRO middle . false 11 A -2 ARG middle . . 12 A -1 GLY middle . false 13 A 0 SER middle . . 14 A 1 VAL middle . . 15 A 2 GLN middle . . 16 A 3 THR middle . . 17 A 4 VAL middle . . 18 A 5 GLY middle . false 19 A 6 GLN middle . . 20 A 7 TRP middle . . 21 A 8 LEU middle . . 22 A 9 GLU middle . . 23 A 10 SER middle . . 24 A 11 ILE middle . . 25 A 12 GLY middle . false 26 A 13 LEU middle . . 27 A 14 PRO middle . false 28 A 15 GLN middle . . 29 A 16 TYR middle . . 30 A 17 GLU middle . . 31 A 18 ASN middle . . 32 A 19 HIS middle . . 33 A 20 LEU middle . . 34 A 21 MET middle . . 35 A 22 ALA middle . . 36 A 23 ASN middle . . 37 A 24 GLY middle . false 38 A 25 PHE middle . . 39 A 26 ASP middle . . 40 A 27 ASN middle . . 41 A 28 VAL middle . . 42 A 29 GLN middle . . 43 A 30 ALA middle . . 44 A 31 MET middle . . 45 A 32 GLY middle . false 46 A 33 SER middle . . 47 A 34 ASN middle . . 48 A 35 VAL middle . . 49 A 36 MET middle . . 50 A 37 GLU middle . . 51 A 38 ASP middle . . 52 A 39 GLN middle . . 53 A 40 ASP middle . . 54 A 41 LEU middle . . 55 A 42 LEU middle . . 56 A 43 GLU middle . . 57 A 44 ILE middle . . 58 A 45 GLY middle . false 59 A 46 ILE middle . . 60 A 47 LEU middle . . 61 A 48 ASN middle . . 62 A 49 SER middle . . 63 A 50 GLY middle . false 64 A 51 HIS middle . . 65 A 52 ARG middle . . 66 A 53 GLN middle . . 67 A 54 ARG middle . . 68 A 55 ILE middle . . 69 A 56 LEU middle . . 70 A 57 GLN middle . . 71 A 58 ALA middle . . 72 A 59 ILE middle . . 73 A 60 GLN middle . . 74 A 61 LEU middle . . 75 A 62 LEU middle . . 76 A 63 PRO middle . false 77 A 64 LYS middle . . 78 A 65 MET middle . . 79 A 66 ARG middle . . 80 A 67 PRO middle . false 81 A 68 ILE middle . . 82 A 69 GLY middle . false 83 A 70 HIS middle . . 84 A 71 ASP middle . . 85 A 72 GLY middle . false 86 A 73 ALA middle . . 87 A 74 HIS middle . . 88 A 75 PRO middle . false 89 A 76 THR middle . . 90 A 77 SER middle . . 91 A 78 VAL middle . . 92 A 79 ALA middle . . 93 A 80 GLU middle . . 94 A 81 TRP middle . . 95 A 82 LEU middle . . 96 A 83 ASP middle . . 97 A 84 SER middle . . 98 A 85 ILE middle . . 99 A 86 GLU middle . . 100 A 87 LEU middle . . 101 A 88 GLY middle . false 102 A 89 ASP middle . . 103 A 90 TYR middle . . 104 A 91 THR middle . . 105 A 92 LYS middle . . 106 A 93 ALA middle . . 107 A 94 PHE middle . . 108 A 95 LEU middle . . 109 A 96 ILE middle . . 110 A 97 ASN middle . . 111 A 98 GLY middle . false 112 A 99 TYR middle . . 113 A 100 THR middle . . 114 A 101 SER middle . . 115 A 102 MET middle . . 116 A 103 ASP middle . . 117 A 104 LEU middle . . 118 A 105 LEU middle . . 119 A 106 LYS middle . . 120 A 107 LYS middle . . 121 A 108 ILE middle . . 122 A 109 ALA middle . . 123 A 110 GLU middle . . 124 A 111 VAL middle . . 125 A 112 GLU middle . . 126 A 113 LEU middle . . 127 A 114 ILE middle . . 128 A 115 ASN middle . . 129 A 116 VAL middle . . 130 A 117 LEU middle . . 131 A 118 LYS middle . . 132 A 119 ILE middle . . 133 A 120 ASN middle . . 134 A 121 LEU middle . . 135 A 122 ILE middle . . 136 A 123 GLY middle . false 137 A 124 HIS middle . . 138 A 125 ARG middle . . 139 A 126 LYS middle . . 140 A 127 ARG middle . . 141 A 128 ILE middle . . 142 A 129 LEU middle . . 143 A 130 ALA middle . . 144 A 131 SER middle . . 145 A 132 LEU middle . . 146 A 133 GLY middle . false 147 A 134 ASP middle . . 148 A 135 ARG end . . stop_ save_ save_assignments_aida6 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assignments_aida6 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 VAL HA H 1 4.140 . A 1 VAL HB H 1 2.076 . A 1 VAL HGx% H 1 0.930 . A 1 VAL HGy% H 1 0.915 . A 1 VAL C C 13 175.758 . A 1 VAL CA C 13 62.070 . A 1 VAL CB C 13 32.821 . A 1 VAL CG1 C 13 21.240 . A 1 VAL CG2 C 13 20.450 . A 2 GLN H H 1 8.439 . A 2 GLN HA H 1 4.594 . A 2 GLN HBx H 1 2.040 . A 2 GLN HBy H 1 2.180 . A 2 GLN HGx H 1 2.420 . A 2 GLN HGy H 1 2.420 . A 2 GLN C C 13 175.972 . A 2 GLN CA C 13 56.260 . A 2 GLN CB C 13 30.945 . A 2 GLN CG C 13 34.696 . A 2 GLN N N 15 124.997 . A 3 THR H H 1 8.347 . A 3 THR HA H 1 4.555 . A 3 THR HB H 1 4.810 . A 3 THR HG2% H 1 1.307 . A 3 THR C C 13 175.495 . A 3 THR CA C 13 60.010 . A 3 THR CB C 13 71.261 . A 3 THR N N 15 113.011 . A 4 VAL H H 1 8.895 . A 4 VAL HA H 1 3.670 . A 4 VAL HB H 1 2.270 . A 4 VAL HGx% H 1 1.123 . A 4 VAL HGy% H 1 1.030 . A 4 VAL C C 13 178.449 . A 4 VAL CA C 13 67.511 . A 4 VAL CB C 13 31.883 . A 4 VAL CG1 C 13 21.960 . A 4 VAL CG2 C 13 23.770 . A 4 VAL N N 15 121.854 . A 5 GLY H H 1 9.017 . A 5 GLY HAy H 1 3.940 . A 5 GLY HAx H 1 3.610 . A 5 GLY C C 13 176.186 . A 5 GLY CA C 13 47.822 . A 5 GLY N N 15 106.966 . A 6 GLN H H 1 8.072 . A 6 GLN HA H 1 4.037 . A 6 GLN HBx H 1 2.080 . A 6 GLN HBy H 1 2.370 . A 6 GLN HGy H 1 2.530 . A 6 GLN HGx H 1 2.420 . A 6 GLN C C 13 179.488 . A 6 GLN CA C 13 59.073 . A 6 GLN CB C 13 28.489 . A 6 GLN CG C 13 34.366 . A 6 GLN N N 15 122.431 . A 7 TRP H H 1 8.756 . A 7 TRP HA H 1 4.160 . A 7 TRP HBy H 1 3.530 . A 7 TRP HBx H 1 3.080 . A 7 TRP HD1 H 1 6.930 . A 7 TRP HE1 H 1 10.295 . A 7 TRP HE3 H 1 7.428 . A 7 TRP HH2 H 1 6.898 . A 7 TRP HZ2 H 1 6.945 . A 7 TRP HZ3 H 1 6.598 . A 7 TRP C C 13 179.620 . A 7 TRP CA C 13 61.886 . A 7 TRP CB C 13 28.133 . A 7 TRP CD1 C 13 125.690 . A 7 TRP CE3 C 13 119.144 . A 7 TRP CH2 C 13 123.510 . A 7 TRP CZ2 C 13 113.885 . A 7 TRP CZ3 C 13 120.885 . A 7 TRP N N 15 124.265 . A 7 TRP NE1 N 15 129.832 . A 8 LEU H H 1 9.148 . A 8 LEU HA H 1 3.440 . A 8 LEU HBx H 1 1.840 . A 8 LEU HBy H 1 1.840 . A 8 LEU HDx% H 1 0.639 . A 8 LEU HDy% H 1 0.889 . A 8 LEU C C 13 180.521 . A 8 LEU CA C 13 56.920 . A 8 LEU CB C 13 41.700 . A 8 LEU CD1 C 13 21.440 . A 8 LEU CD2 C 13 26.780 . A 8 LEU N N 15 120.548 . A 9 GLU H H 1 8.284 . A 9 GLU HA H 1 3.740 . A 9 GLU HBx H 1 2.170 . A 9 GLU HBy H 1 2.170 . A 9 GLU HGy H 1 2.260 . A 9 GLU HGx H 1 2.180 . A 9 GLU C C 13 179.960 . A 9 GLU CA C 13 60.010 . A 9 GLU CB C 13 29.070 . A 9 GLU CG C 13 36.040 . A 9 GLU N N 15 120.133 . A 10 SER H H 1 7.891 . A 10 SER HA H 1 4.250 . A 10 SER HBx H 1 3.990 . A 10 SER HBy H 1 3.990 . A 10 SER C C 13 175.346 . A 10 SER CA C 13 60.948 . A 10 SER CB C 13 63.280 . A 10 SER N N 15 117.044 . A 11 ILE H H 1 6.862 . A 11 ILE HA H 1 4.487 . A 11 ILE HB H 1 1.812 . A 11 ILE HD1% H 1 0.065 . A 11 ILE HG12 H 1 0.633 . A 11 ILE HG13 H 1 0.862 . A 11 ILE HG2% H 1 0.380 . A 11 ILE C C 13 175.812 . A 11 ILE CA C 13 60.948 . A 11 ILE CB C 13 38.250 . A 11 ILE CD1 C 13 14.820 . A 11 ILE CG1 C 13 26.200 . A 11 ILE CG2 C 13 16.730 . A 11 ILE N N 15 113.733 . A 12 GLY H H 1 7.628 . A 12 GLY HAy H 1 3.990 . A 12 GLY HAx H 1 3.800 . A 12 GLY C C 13 173.647 . A 12 GLY CA C 13 45.947 . A 12 GLY N N 15 109.763 . A 13 LEU H H 1 7.620 . A 13 LEU C C 13 176.186 . A 13 LEU CA C 13 52.700 . A 13 LEU CB C 13 43.134 . A 13 LEU N N 15 118.778 . A 14 PRO HA H 1 4.120 . A 14 PRO HBx H 1 1.900 . A 14 PRO HBy H 1 2.070 . A 14 PRO C C 13 177.955 . A 14 PRO CA C 13 64.698 . A 14 PRO CB C 13 31.883 . A 14 PRO CG C 13 27.195 . A 15 GLN H H 1 9.838 . A 15 GLN HA H 1 4.240 . A 15 GLN HBx H 1 1.720 . A 15 GLN HBy H 1 1.940 . A 15 GLN C C 13 176.836 . A 15 GLN CA C 13 58.135 . A 15 GLN CB C 13 27.195 . A 15 GLN CG C 13 30.945 . A 15 GLN N N 15 120.414 . A 16 TYR H H 1 6.810 . A 16 TYR HA H 1 5.720 . A 16 TYR HBy H 1 3.340 . A 16 TYR HBx H 1 2.310 . A 16 TYR HDx H 1 6.268 . A 16 TYR HEx H 1 6.630 . A 16 TYR C C 13 174.814 . A 16 TYR CA C 13 57.198 . A 16 TYR CB C 13 37.509 . A 16 TYR CD1 C 13 132.261 . A 16 TYR CE1 C 13 117.870 . A 16 TYR N N 15 119.718 . A 17 GLU H H 1 7.509 . A 17 GLU HA H 1 3.650 . A 17 GLU HBx H 1 2.147 . A 17 GLU HBy H 1 2.147 . A 17 GLU HGx H 1 2.240 . A 17 GLU C C 13 177.552 . A 17 GLU CA C 13 60.948 . A 17 GLU CB C 13 30.008 . A 17 GLU CG C 13 35.633 . A 17 GLU N N 15 122.417 . A 18 ASN H H 1 9.259 . A 18 ASN HA H 1 4.451 . A 18 ASN HBy H 1 2.820 . A 18 ASN HBx H 1 2.690 . A 18 ASN C C 13 176.868 . A 18 ASN CA C 13 57.198 . A 18 ASN CB C 13 38.446 . A 18 ASN N N 15 116.613 . A 19 HIS H H 1 8.898 . A 19 HIS HA H 1 4.140 . A 19 HIS HBy H 1 3.230 . A 19 HIS HBx H 1 3.060 . A 19 HIS HD2 H 1 7.293 . A 19 HIS C C 13 178.269 . A 19 HIS CA C 13 60.948 . A 19 HIS CB C 13 30.008 . A 19 HIS CD2 C 13 117.550 . A 19 HIS N N 15 118.926 . A 20 LEU H H 1 7.825 . A 20 LEU HA H 1 4.305 . A 20 LEU HBx H 1 2.600 . A 20 LEU HBy H 1 2.600 . A 20 LEU HDx% H 1 0.995 . A 20 LEU HDy% H 1 0.980 . A 20 LEU HG H 1 1.720 . A 20 LEU C C 13 179.190 . A 20 LEU CA C 13 60.010 . A 20 LEU CB C 13 40.321 . A 20 LEU CD1 C 13 25.960 . A 20 LEU CD2 C 13 25.960 . A 20 LEU CG C 13 30.650 . A 20 LEU N N 15 117.434 . A 21 MET H H 1 8.861 . A 21 MET HA H 1 3.980 . A 21 MET HBx H 1 2.180 . A 21 MET HBy H 1 2.320 . A 21 MET HE% H 1 2.240 . A 21 MET HGy H 1 2.176 . A 21 MET HGx H 1 1.971 . A 21 MET C C 13 180.340 . A 21 MET CA C 13 58.135 . A 21 MET CB C 13 30.945 . A 21 MET CE C 13 16.050 . A 21 MET N N 15 118.111 . A 22 ALA H H 1 9.015 . A 22 ALA HA H 1 4.239 . A 22 ALA HB% H 1 1.425 . A 22 ALA C C 13 178.058 . A 22 ALA CA C 13 53.800 . A 22 ALA CB C 13 18.397 . A 22 ALA N N 15 120.068 . A 23 ASN H H 1 7.143 . A 23 ASN HA H 1 4.959 . A 23 ASN HBy H 1 3.130 . A 23 ASN HBx H 1 2.950 . A 23 ASN HD2y H 1 9.320 . A 23 ASN HD2x H 1 7.490 . A 23 ASN C C 13 174.083 . A 23 ASN CA C 13 54.000 . A 23 ASN CB C 13 41.300 . A 23 ASN N N 15 111.560 . A 23 ASN ND2 N 15 118.810 . A 24 GLY H H 1 7.797 . A 24 GLY HAy H 1 3.430 . A 24 GLY HAx H 1 3.290 . A 24 GLY C C 13 173.163 . A 24 GLY CA C 13 45.947 . A 24 GLY N N 15 106.170 . A 25 PHE H H 1 8.191 . A 25 PHE HA H 1 4.910 . A 25 PHE HBy H 1 3.091 . A 25 PHE HBx H 1 2.813 . A 25 PHE HDx H 1 7.197 . A 25 PHE HEx H 1 7.166 . A 25 PHE C C 13 173.496 . A 25 PHE CA C 13 56.550 . A 25 PHE CB C 13 37.220 . A 25 PHE CDx C 13 130.950 . A 25 PHE CEx C 13 128.760 . A 25 PHE N N 15 122.454 . A 26 ASP H H 1 6.756 . A 26 ASP HA H 1 5.077 . A 26 ASP HBy H 1 3.208 . A 26 ASP HBx H 1 2.454 . A 26 ASP C C 13 177.463 . A 26 ASP CA C 13 53.447 . A 26 ASP CB C 13 42.580 . A 26 ASP N N 15 111.309 . A 27 ASN H H 1 7.495 . A 27 ASN HA H 1 4.820 . A 27 ASN HBy H 1 2.720 . A 27 ASN HBx H 1 2.560 . A 27 ASN C C 13 176.228 . A 27 ASN CA C 13 52.510 . A 27 ASN CB C 13 40.321 . A 27 ASN N N 15 118.385 . A 28 VAL H H 1 9.192 . A 28 VAL HA H 1 3.550 . A 28 VAL HB H 1 1.870 . A 28 VAL HGx% H 1 0.710 . A 28 VAL HGy% H 1 0.511 . A 28 VAL C C 13 176.429 . A 28 VAL CA C 13 65.636 . A 28 VAL CB C 13 31.883 . A 28 VAL CG1 C 13 21.080 . A 28 VAL CG2 C 13 21.170 . A 28 VAL N N 15 125.741 . A 29 GLN H H 1 8.203 . A 29 GLN HA H 1 4.129 . A 29 GLN HBx H 1 2.010 . A 29 GLN HBy H 1 2.140 . A 29 GLN HGy H 1 2.420 . A 29 GLN HGx H 1 2.298 . A 29 GLN C C 13 176.591 . A 29 GLN CA C 13 57.198 . A 29 GLN CB C 13 28.133 . A 29 GLN CG C 13 34.696 . A 29 GLN N N 15 116.452 . A 30 ALA H H 1 7.781 . A 30 ALA HA H 1 4.650 . A 30 ALA HB% H 1 1.270 . A 30 ALA C C 13 175.976 . A 30 ALA CA C 13 50.840 . A 30 ALA CB C 13 19.150 . A 30 ALA N N 15 122.150 . A 31 MET H H 1 7.739 . A 31 MET HE% H 1 1.430 . A 31 MET C C 13 178.275 . A 31 MET CA C 13 55.323 . A 31 MET CB C 13 34.696 . A 31 MET CE C 13 16.980 . A 31 MET N N 15 118.149 . A 32 GLY H H 1 7.611 . A 32 GLY N N 15 101.530 . A 34 ASN HA H 1 4.480 . A 34 ASN HBx H 1 2.750 . A 34 ASN HBy H 1 2.900 . A 34 ASN CA C 13 56.260 . A 34 ASN CB C 13 39.384 . A 36 MET HA H 1 4.646 . A 36 MET HBx H 1 1.530 . A 36 MET HBy H 1 1.830 . A 36 MET HE% H 1 1.288 . A 36 MET C C 13 173.651 . A 36 MET CA C 13 55.323 . A 36 MET CB C 13 35.633 . A 36 MET CE C 13 16.890 . A 36 MET CG C 13 31.750 . A 37 GLU H H 1 9.203 . A 37 GLU HA H 1 4.650 . A 37 GLU HBx H 1 1.880 . A 37 GLU HBy H 1 2.320 . A 37 GLU HGy H 1 2.228 . A 37 GLU HGx H 1 2.070 . A 37 GLU C C 13 177.008 . A 37 GLU CA C 13 54.385 . A 37 GLU CB C 13 33.758 . A 37 GLU CG C 13 36.880 . A 37 GLU N N 15 123.229 . A 38 ASP H H 1 9.032 . A 38 ASP HA H 1 4.149 . A 38 ASP HBy H 1 2.690 . A 38 ASP HBx H 1 2.570 . A 38 ASP C C 13 177.994 . A 38 ASP CA C 13 59.073 . A 38 ASP CB C 13 43.134 . A 38 ASP N N 15 122.717 . A 39 GLN H H 1 8.950 . A 39 GLN HA H 1 3.940 . A 39 GLN HBx H 1 1.960 . A 39 GLN HBy H 1 2.190 . A 39 GLN C C 13 177.817 . A 39 GLN CA C 13 59.073 . A 39 GLN CB C 13 28.133 . A 39 GLN N N 15 114.086 . A 40 ASP H H 1 7.214 . A 40 ASP HA H 1 4.370 . A 40 ASP HBy H 1 2.920 . A 40 ASP HBx H 1 2.670 . A 40 ASP C C 13 177.667 . A 40 ASP CA C 13 57.198 . A 40 ASP CB C 13 41.800 . A 40 ASP N N 15 118.734 . A 41 LEU H H 1 7.180 . A 41 LEU HA H 1 3.990 . A 41 LEU HBy H 1 2.060 . A 41 LEU HBx H 1 1.080 . A 41 LEU HDx% H 1 0.679 . A 41 LEU HDy% H 1 0.824 . A 41 LEU C C 13 178.204 . A 41 LEU CA C 13 56.260 . A 41 LEU CB C 13 41.259 . A 41 LEU CD1 C 13 22.360 . A 41 LEU CD2 C 13 26.870 . A 41 LEU N N 15 115.795 . A 42 LEU H H 1 7.823 . A 42 LEU HA H 1 3.920 . A 42 LEU HBy H 1 1.660 . A 42 LEU HBx H 1 1.483 . A 42 LEU HDx% H 1 0.851 . A 42 LEU HDy% H 1 0.852 . A 42 LEU C C 13 180.876 . A 42 LEU CA C 13 58.135 . A 42 LEU CB C 13 42.196 . A 42 LEU CD1 C 13 24.720 . A 42 LEU CD2 C 13 25.240 . A 42 LEU N N 15 120.499 . A 43 GLU H H 1 8.127 . A 43 GLU HA H 1 3.966 . A 43 GLU HBx H 1 2.191 . A 43 GLU HBy H 1 2.316 . A 43 GLU HGx H 1 2.200 . A 43 GLU HGy H 1 2.260 . A 43 GLU C C 13 178.801 . A 43 GLU CA C 13 60.010 . A 43 GLU CB C 13 29.070 . A 43 GLU CG C 13 36.571 . A 43 GLU N N 15 120.955 . A 44 ILE H H 1 7.504 . A 44 ILE HA H 1 4.524 . A 44 ILE HB H 1 2.554 . A 44 ILE HD1% H 1 0.887 . A 44 ILE HG12 H 1 1.390 . A 44 ILE HG13 H 1 1.870 . A 44 ILE HG21 H 1 1.083 . A 44 ILE HG22 H 1 1.083 . A 44 ILE HG23 H 1 1.083 . A 44 ILE C C 13 175.691 . A 44 ILE CA C 13 61.886 . A 44 ILE CB C 13 37.300 . A 44 ILE CD1 C 13 14.540 . A 44 ILE CG1 C 13 25.480 . A 44 ILE CG2 C 13 17.819 . A 44 ILE N N 15 109.594 . A 45 GLY H H 1 7.724 . A 45 GLY HAx H 1 3.650 . A 45 GLY HAy H 1 4.530 . A 45 GLY C C 13 174.613 . A 45 GLY CA C 13 45.947 . A 45 GLY N N 15 106.680 . A 46 ILE H H 1 8.180 . A 46 ILE HA H 1 3.907 . A 46 ILE HB H 1 1.510 . A 46 ILE HD1% H 1 0.260 . A 46 ILE HG12 H 1 1.190 . A 46 ILE HG13 H 1 1.190 . A 46 ILE HG2% H 1 0.188 . A 46 ILE C C 13 174.235 . A 46 ILE CA C 13 60.948 . A 46 ILE CB C 13 33.980 . A 46 ILE CD1 C 13 13.250 . A 46 ILE CG1 C 13 26.250 . A 46 ILE CG2 C 13 16.290 . A 46 ILE N N 15 122.454 . A 47 LEU H H 1 7.367 . A 47 LEU HA H 1 3.900 . A 47 LEU HBx H 1 1.640 . A 47 LEU HBy H 1 1.640 . A 47 LEU C C 13 177.753 . A 47 LEU CA C 13 56.260 . A 47 LEU CB C 13 42.196 . A 47 LEU N N 15 125.835 . A 50 GLY HAy H 1 3.980 . A 50 GLY HAx H 1 3.950 . A 50 GLY C C 13 177.130 . A 50 GLY CA C 13 46.884 . A 51 HIS H H 1 7.926 . A 51 HIS HA H 1 4.451 . A 51 HIS HBx H 1 2.850 . A 51 HIS HBy H 1 3.160 . A 51 HIS HD2 H 1 6.835 . A 51 HIS HE1 H 1 7.770 . A 51 HIS C C 13 177.613 . A 51 HIS CA C 13 57.198 . A 51 HIS CB C 13 30.945 . A 51 HIS CD2 C 13 116.510 . A 51 HIS CE1 C 13 138.550 . A 51 HIS N N 15 122.284 . A 52 ARG H H 1 8.105 . A 52 ARG HA H 1 3.685 . A 52 ARG HBx H 1 1.750 . A 52 ARG HBy H 1 2.030 . A 52 ARG HDy H 1 3.300 . A 52 ARG HDx H 1 3.100 . A 52 ARG HE H 1 8.460 . A 52 ARG HGx H 1 0.810 . A 52 ARG C C 13 177.769 . A 52 ARG CA C 13 61.886 . A 52 ARG CB C 13 30.945 . A 52 ARG CD C 13 44.180 . A 52 ARG N N 15 117.775 . A 52 ARG NE N 15 83.950 . A 53 GLN H H 1 8.090 . A 53 GLN HA H 1 3.940 . A 53 GLN HBx H 1 2.190 . A 53 GLN HBy H 1 2.190 . A 53 GLN HGy H 1 2.530 . A 53 GLN HGx H 1 2.390 . A 53 GLN C C 13 178.583 . A 53 GLN CA C 13 59.073 . A 53 GLN CB C 13 28.133 . A 53 GLN CG C 13 33.758 . A 53 GLN N N 15 116.452 . A 54 ARG H H 1 7.845 . A 54 ARG HA H 1 4.010 . A 54 ARG HBx H 1 1.950 . A 54 ARG HBy H 1 1.950 . A 54 ARG C C 13 179.766 . A 54 ARG CA C 13 59.073 . A 54 ARG CB C 13 30.720 . A 54 ARG CG C 13 27.100 . A 54 ARG N N 15 119.275 . A 55 ILE H H 1 8.032 . A 55 ILE HA H 1 3.495 . A 55 ILE HB H 1 1.760 . A 55 ILE HD1% H 1 0.580 . A 55 ILE HG12 H 1 0.560 . A 55 ILE HG13 H 1 1.770 . A 55 ILE HG2% H 1 0.900 . A 55 ILE C C 13 177.108 . A 55 ILE CA C 13 66.230 . A 55 ILE CB C 13 38.020 . A 55 ILE CD1 C 13 13.890 . A 55 ILE CG1 C 13 30.470 . A 55 ILE CG2 C 13 17.880 . A 55 ILE N N 15 121.152 . A 56 LEU H H 1 8.490 . A 56 LEU HA H 1 4.010 . A 56 LEU HBy H 1 1.840 . A 56 LEU HBx H 1 1.490 . A 56 LEU HDx% H 1 0.840 . A 56 LEU HDy% H 1 0.670 . A 56 LEU C C 13 179.917 . A 56 LEU CA C 13 58.135 . A 56 LEU CB C 13 41.259 . A 56 LEU CDy C 13 25.320 . A 56 LEU CDx C 13 22.760 . A 56 LEU N N 15 119.072 . A 57 GLN H H 1 8.327 . A 57 GLN HA H 1 4.100 . A 57 GLN HBx H 1 2.090 . A 57 GLN HBy H 1 2.180 . A 57 GLN HGy H 1 2.530 . A 57 GLN HGx H 1 2.380 . A 57 GLN C C 13 178.798 . A 57 GLN CA C 13 59.073 . A 57 GLN CB C 13 28.133 . A 57 GLN CG C 13 33.758 . A 57 GLN N N 15 118.172 . A 58 ALA H H 1 7.810 . A 58 ALA HA H 1 4.320 . A 58 ALA HB% H 1 1.710 . A 58 ALA C C 13 172.232 . A 58 ALA CA C 13 55.323 . A 58 ALA CB C 13 19.720 . A 58 ALA N N 15 122.536 . A 59 ILE H H 1 8.840 . A 59 ILE HA H 1 4.030 . A 59 ILE HB H 1 2.330 . A 59 ILE HD1% H 1 0.829 . A 59 ILE HG12 H 1 1.640 . A 59 ILE HG13 H 1 1.640 . A 59 ILE HG21 H 1 1.048 . A 59 ILE HG22 H 1 1.048 . A 59 ILE HG23 H 1 1.048 . A 59 ILE C C 13 178.678 . A 59 ILE CA C 13 64.698 . A 59 ILE CB C 13 37.850 . A 59 ILE CD1 C 13 15.010 . A 59 ILE CG1 C 13 28.300 . A 59 ILE CG2 C 13 18.210 . A 59 ILE N N 15 118.111 . A 60 GLN H H 1 7.547 . A 60 GLN HA H 1 4.121 . A 60 GLN HBy H 1 2.339 . A 60 GLN HBx H 1 2.210 . A 60 GLN HGy H 1 2.713 . A 60 GLN HGx H 1 2.667 . A 60 GLN C C 13 176.556 . A 60 GLN CA C 13 58.135 . A 60 GLN CB C 13 28.300 . A 60 GLN CG C 13 34.100 . A 60 GLN N N 15 119.094 . A 61 LEU H H 1 7.350 . A 61 LEU HA H 1 4.408 . A 61 LEU HBx H 1 1.810 . A 61 LEU HBy H 1 1.810 . A 61 LEU HDx% H 1 1.011 . A 61 LEU HD21 H 1 0.891 . A 61 LEU HDy% H 1 0.891 . A 61 LEU C C 13 177.960 . A 61 LEU CA C 13 54.900 . A 61 LEU CB C 13 42.196 . A 61 LEU CDy C 13 25.320 . A 61 LEU CDx C 13 22.507 . A 61 LEU N N 15 115.853 . A 62 LEU H H 1 7.358 . A 62 LEU HA H 1 4.530 . A 62 LEU HBx H 1 1.453 . A 62 LEU HBy H 1 1.809 . A 62 LEU HDx% H 1 0.353 . A 62 LEU HDy% H 1 0.639 . A 62 LEU C C 13 177.035 . A 62 LEU CA C 13 53.200 . A 62 LEU CB C 13 40.700 . A 62 LEU CD1 C 13 25.380 . A 62 LEU CD2 C 13 21.710 . A 62 LEU N N 15 121.010 . A 63 PRO HA H 1 4.382 . A 63 PRO HBx H 1 1.830 . A 63 PRO HBy H 1 2.310 . A 63 PRO HDx H 1 3.590 . A 63 PRO HDy H 1 3.590 . A 63 PRO HGx H 1 1.690 . A 63 PRO HGy H 1 1.690 . A 63 PRO CB C 13 31.883 . A 63 PRO CG C 13 28.860 . A 64 LYS H H 1 8.418 . A 64 LYS HA H 1 4.140 . A 64 LYS HBy H 1 1.690 . A 64 LYS HBx H 1 1.620 . A 64 LYS HDy H 1 1.550 . A 64 LYS HDx H 1 1.390 . A 64 LYS C C 13 177.122 . A 64 LYS CA C 13 56.260 . A 64 LYS CB C 13 33.340 . A 64 LYS CD C 13 25.970 . A 64 LYS CG C 13 29.140 . A 64 LYS N N 15 121.932 . A 65 MET H H 1 8.550 . A 65 MET HA H 1 4.304 . A 65 MET HBx H 1 1.830 . A 65 MET HBy H 1 1.830 . A 65 MET HE% H 1 2.060 . A 65 MET C C 13 176.105 . A 65 MET CA C 13 56.260 . A 65 MET CB C 13 32.821 . A 65 MET CE C 13 17.100 . A 65 MET N N 15 123.498 . A 66 ARG H H 1 8.731 . A 66 ARG C C 13 173.577 . A 66 ARG CA C 13 53.447 . A 66 ARG CB C 13 30.008 . A 66 ARG N N 15 127.355 . A 67 PRO HA H 1 4.780 . A 67 PRO HBx H 1 1.855 . A 67 PRO HBy H 1 2.184 . A 67 PRO HDx H 1 3.500 . A 67 PRO HDy H 1 3.854 . A 67 PRO HGy H 1 1.945 . A 67 PRO HGx H 1 1.900 . A 67 PRO C C 13 177.043 . A 67 PRO CA C 13 61.886 . A 67 PRO CB C 13 32.821 . A 67 PRO CD C 13 50.635 . A 67 PRO CG C 13 27.195 . A 68 ILE H H 1 8.580 . A 68 ILE HA H 1 4.040 . A 68 ILE HB H 1 1.720 . A 68 ILE HD1% H 1 0.530 . A 68 ILE HG12 H 1 1.190 . A 68 ILE HG13 H 1 1.430 . A 68 ILE HG2% H 1 0.880 . A 68 ILE C C 13 176.831 . A 68 ILE CA C 13 62.823 . A 68 ILE CB C 13 38.580 . A 68 ILE CD1 C 13 13.890 . A 68 ILE CG1 C 13 26.580 . A 68 ILE CG2 C 13 18.020 . A 68 ILE N N 15 118.491 . A 69 GLY H H 1 8.602 . A 69 GLY CA C 13 45.009 . A 69 GLY N N 15 111.377 . A 70 HIS HD2 H 1 6.950 . A 70 HIS CD2 C 13 120.010 . A 71 ASP HA H 1 4.490 . A 71 ASP HBx H 1 2.610 . A 71 ASP HBy H 1 2.610 . A 71 ASP CA C 13 54.385 . A 71 ASP CB C 13 40.321 . A 72 GLY H H 1 8.054 . A 72 GLY HAy H 1 4.040 . A 72 GLY HAx H 1 3.750 . A 72 GLY C C 13 173.474 . A 72 GLY CA C 13 45.009 . A 72 GLY N N 15 108.038 . A 73 ALA H H 1 7.858 . A 73 ALA HA H 1 4.370 . A 73 ALA HB% H 1 1.280 . A 73 ALA CA C 13 51.990 . A 73 ALA CB C 13 19.220 . A 73 ALA N N 15 123.819 . A 74 HIS HD2 H 1 6.894 . A 74 HIS CD2 C 13 120.885 . A 77 SER H H 1 7.839 . A 77 SER HA H 1 4.770 . A 77 SER HBx H 1 4.000 . A 77 SER HBy H 1 4.310 . A 77 SER N N 15 115.163 . A 78 VAL H H 1 8.578 . A 78 VAL HA H 1 3.981 . A 78 VAL HB H 1 2.029 . A 78 VAL HGx% H 1 0.892 . A 78 VAL HGy% H 1 0.990 . A 78 VAL C C 13 177.480 . A 78 VAL CA C 13 67.060 . A 78 VAL CB C 13 32.500 . A 78 VAL CG1 C 13 21.870 . A 78 VAL CG2 C 13 20.390 . A 78 VAL N N 15 123.481 . A 79 ALA H H 1 8.607 . A 79 ALA HA H 1 4.113 . A 79 ALA HB% H 1 1.420 . A 79 ALA C C 13 179.868 . A 79 ALA CA C 13 54.890 . A 79 ALA CB C 13 18.790 . A 79 ALA N N 15 120.334 . A 80 GLU H H 1 7.886 . A 80 GLU HA H 1 4.010 . A 80 GLU HBx H 1 2.120 . A 80 GLU HBy H 1 2.120 . A 80 GLU HGy H 1 2.370 . A 80 GLU HGx H 1 2.280 . A 80 GLU C C 13 179.719 . A 80 GLU CA C 13 59.073 . A 80 GLU CB C 13 30.630 . A 80 GLU CG C 13 36.890 . A 80 GLU N N 15 117.643 . A 81 TRP H H 1 8.299 . A 81 TRP HA H 1 4.251 . A 81 TRP HBy H 1 3.640 . A 81 TRP HBx H 1 3.140 . A 81 TRP HD1 H 1 7.240 . A 81 TRP HE1 H 1 10.318 . A 81 TRP HE3 H 1 7.432 . A 81 TRP HH2 H 1 6.688 . A 81 TRP HZ2 H 1 7.098 . A 81 TRP HZ3 H 1 6.000 . A 81 TRP C C 13 178.772 . A 81 TRP CA C 13 60.010 . A 81 TRP CB C 13 27.650 . A 81 TRP CD1 C 13 126.140 . A 81 TRP CE3 C 13 120.758 . A 81 TRP CH2 C 13 123.073 . A 81 TRP CZ2 C 13 113.010 . A 81 TRP CZ3 C 13 121.760 . A 81 TRP N N 15 122.545 . A 81 TRP NE1 N 15 130.204 . A 82 LEU H H 1 8.505 . A 82 LEU HA H 1 2.880 . A 82 LEU HBx H 1 0.670 . A 82 LEU HBy H 1 1.490 . A 82 LEU HDx% H 1 0.415 . A 82 LEU HD21 H 1 -0.301 . A 82 LEU HDy% H 1 -0.301 . A 82 LEU C C 13 180.235 . A 82 LEU CA C 13 57.400 . A 82 LEU CB C 13 40.321 . A 82 LEU CD1 C 13 26.410 . A 82 LEU CD2 C 13 21.271 . A 82 LEU N N 15 121.110 . A 83 ASP H H 1 8.185 . A 83 ASP HA H 1 4.280 . A 83 ASP HBy H 1 2.680 . A 83 ASP HBx H 1 2.530 . A 83 ASP C C 13 175.224 . A 83 ASP CA C 13 57.310 . A 83 ASP CB C 13 40.321 . A 83 ASP N N 15 119.082 . A 84 SER H H 1 7.989 . A 84 SER HA H 1 4.250 . A 84 SER HBx H 1 3.980 . A 84 SER HBy H 1 3.980 . A 84 SER C C 13 175.346 . A 84 SER CA C 13 60.948 . A 84 SER CB C 13 63.370 . A 84 SER N N 15 117.579 . A 85 ILE H H 1 6.862 . A 85 ILE HA H 1 4.550 . A 85 ILE HB H 1 1.820 . A 85 ILE HD1% H 1 0.793 . A 85 ILE HG2% H 1 0.755 . A 85 ILE C C 13 173.308 . A 85 ILE CA C 13 60.948 . A 85 ILE CB C 13 37.760 . A 85 ILE CD1 C 13 14.530 . A 85 ILE CG2 C 13 17.340 . A 85 ILE N N 15 113.733 . A 86 GLU H H 1 7.705 . A 86 GLU HA H 1 4.280 . A 86 GLU HBy H 1 2.670 . A 86 GLU HBx H 1 2.540 . A 86 GLU C C 13 175.224 . A 86 GLU CA C 13 56.260 . A 86 GLU CB C 13 26.258 . A 86 GLU CG C 13 36.571 . A 86 GLU N N 15 115.493 . A 87 LEU H H 1 7.989 . A 87 LEU HA H 1 4.220 . A 87 LEU HBy H 1 1.770 . A 87 LEU HBx H 1 1.030 . A 87 LEU HDx% H 1 0.152 . A 87 LEU HDy% H 1 0.630 . A 87 LEU C C 13 176.965 . A 87 LEU CA C 13 52.510 . A 87 LEU CB C 13 42.196 . A 87 LEU CD1 C 13 20.900 . A 87 LEU CD2 C 13 27.370 . A 87 LEU N N 15 117.579 . A 88 GLY H H 1 8.503 . A 88 GLY CA C 13 46.884 . A 88 GLY N N 15 107.794 . A 89 ASP HA H 1 4.431 . A 89 ASP HBy H 1 2.410 . A 89 ASP HBx H 1 2.140 . A 89 ASP C C 13 178.075 . A 89 ASP CA C 13 57.198 . A 89 ASP CB C 13 40.321 . A 90 TYR H H 1 7.899 . A 90 TYR HA H 1 4.940 . A 90 TYR HBy H 1 3.650 . A 90 TYR HBx H 1 2.960 . A 90 TYR HDx H 1 7.206 . A 90 TYR HEx H 1 6.950 . A 90 TYR C C 13 175.527 . A 90 TYR CA C 13 58.135 . A 90 TYR CB C 13 38.446 . A 90 TYR CDx C 13 133.000 . A 90 TYR CEx C 13 118.690 . A 90 TYR N N 15 115.595 . A 91 THR H H 1 7.971 . A 91 THR HA H 1 4.234 . A 91 THR HB H 1 3.660 . A 91 THR HG2% H 1 1.170 . A 91 THR C C 13 175.905 . A 91 THR CA C 13 68.449 . A 91 THR CG2 C 13 22.210 . A 91 THR N N 15 118.867 . A 92 LYS H H 1 8.555 . A 92 LYS HA H 1 3.940 . A 92 LYS HBx H 1 1.890 . A 92 LYS HBy H 1 1.890 . A 92 LYS HDy H 1 1.550 . A 92 LYS HDx H 1 1.426 . A 92 LYS HGx H 1 1.714 . A 92 LYS C C 13 177.310 . A 92 LYS CA C 13 60.948 . A 92 LYS CB C 13 31.883 . A 92 LYS CD C 13 25.320 . A 92 LYS CG C 13 29.070 . A 92 LYS N N 15 119.259 . A 93 ALA H H 1 7.920 . A 93 ALA HA H 1 4.128 . A 93 ALA HB% H 1 1.587 . A 93 ALA C C 13 180.972 . A 93 ALA CA C 13 55.070 . A 93 ALA CB C 13 17.750 . A 93 ALA N N 15 120.398 . A 94 PHE H H 1 8.136 . A 94 PHE HA H 1 4.190 . A 94 PHE HBy H 1 3.439 . A 94 PHE HBx H 1 3.424 . A 94 PHE HDx H 1 7.494 . A 94 PHE HEx H 1 6.965 . A 94 PHE HZ H 1 6.966 . A 94 PHE C C 13 177.955 . A 94 PHE CA C 13 63.761 . A 94 PHE CB C 13 38.446 . A 94 PHE CD1 C 13 132.382 . A 94 PHE CE1 C 13 130.948 . A 94 PHE CZ C 13 128.323 . A 94 PHE N N 15 117.119 . A 95 LEU H H 1 8.351 . A 95 LEU HA H 1 3.889 . A 95 LEU HBx H 1 1.581 . A 95 LEU HBy H 1 1.938 . A 95 LEU HDx% H 1 0.956 . A 95 LEU HDy% H 1 0.989 . A 95 LEU C C 13 182.043 . A 95 LEU CA C 13 59.073 . A 95 LEU CB C 13 41.259 . A 95 LEU CD1 C 13 25.125 . A 95 LEU CDx C 13 22.507 . A 95 LEU CDy C 13 25.125 . A 95 LEU N N 15 118.450 . A 96 ILE H H 1 8.992 . A 96 ILE HA H 1 4.069 . A 96 ILE HB H 1 2.000 . A 96 ILE HD1% H 1 0.860 . A 96 ILE HG12 H 1 1.470 . A 96 ILE HG13 H 1 1.506 . A 96 ILE HG2% H 1 0.994 . A 96 ILE C C 13 177.094 . A 96 ILE CA C 13 63.761 . A 96 ILE CB C 13 37.509 . A 96 ILE CD1 C 13 13.770 . A 96 ILE CG1 C 13 28.170 . A 96 ILE CG2 C 13 17.550 . A 96 ILE N N 15 118.177 . A 97 ASN H H 1 7.067 . A 97 ASN HA H 1 4.797 . A 97 ASN HBy H 1 2.870 . A 97 ASN HBx H 1 2.660 . A 97 ASN HD2y H 1 8.480 . A 97 ASN HD2x H 1 7.170 . A 97 ASN C C 13 173.595 . A 97 ASN CA C 13 54.385 . A 97 ASN CB C 13 40.321 . A 97 ASN N N 15 116.407 . A 97 ASN ND2 N 15 117.450 . A 98 GLY H H 1 7.681 . A 98 GLY HAy H 1 4.080 . A 98 GLY HAx H 1 3.640 . A 98 GLY C C 13 174.552 . A 98 GLY CA C 13 45.947 . A 98 GLY N N 15 104.440 . A 99 TYR H H 1 8.427 . A 99 TYR HA H 1 4.661 . A 99 TYR HBy H 1 3.350 . A 99 TYR HBx H 1 2.973 . A 99 TYR HDx H 1 6.934 . A 99 TYR HEx H 1 6.664 . A 99 TYR C C 13 174.425 . A 99 TYR CA C 13 57.198 . A 99 TYR CB C 13 36.571 . A 99 TYR CD1 C 13 132.698 . A 99 TYR CE1 C 13 118.080 . A 99 TYR N N 15 122.830 . A 100 THR H H 1 7.166 . A 100 THR HA H 1 4.248 . A 100 THR HG2% H 1 1.233 . A 100 THR C C 13 174.897 . A 100 THR CA C 13 62.290 . A 100 THR CB C 13 68.970 . A 100 THR CG2 C 13 22.760 . A 100 THR N N 15 104.304 . A 101 SER H H 1 7.695 . A 101 SER C C 13 174.372 . A 101 SER CA C 13 56.260 . A 101 SER CB C 13 65.636 . A 101 SER N N 15 115.613 . A 102 MET HE% H 1 0.910 . A 102 MET CE C 13 14.610 . A 103 ASP HA H 1 4.260 . A 103 ASP HBx H 1 2.562 . A 103 ASP HBy H 1 2.562 . A 103 ASP CA C 13 57.198 . A 103 ASP CB C 13 40.321 . A 104 LEU H H 1 7.345 . A 104 LEU HA H 1 4.290 . A 104 LEU HBx H 1 1.700 . A 104 LEU HBy H 1 1.930 . A 104 LEU HDx% H 1 1.123 . A 104 LEU HDy% H 1 0.890 . A 104 LEU C C 13 178.488 . A 104 LEU CA C 13 56.260 . A 104 LEU CB C 13 42.196 . A 104 LEU CDy C 13 26.258 . A 104 LEU CDx C 13 22.460 . A 104 LEU N N 15 117.878 . A 105 LEU H H 1 7.514 . A 105 LEU HA H 1 4.210 . A 105 LEU HBx H 1 1.420 . A 105 LEU HBy H 1 1.587 . A 105 LEU HDx% H 1 0.504 . A 105 LEU HDy% H 1 0.674 . A 105 LEU C C 13 177.002 . A 105 LEU CA C 13 55.323 . A 105 LEU CB C 13 42.196 . A 105 LEU CD1 C 13 26.680 . A 105 LEU CD2 C 13 25.100 . A 105 LEU N N 15 119.094 . A 107 LYS HA H 1 4.340 . A 107 LYS HBx H 1 1.780 . A 107 LYS HBy H 1 2.050 . A 107 LYS C C 13 176.603 . A 107 LYS CA C 13 55.323 . A 107 LYS CB C 13 31.883 . A 107 LYS CD C 13 24.382 . A 107 LYS CG C 13 29.070 . A 108 ILE H H 1 7.539 . A 108 ILE HA H 1 3.987 . A 108 ILE HB H 1 1.720 . A 108 ILE HD1% H 1 0.352 . A 108 ILE HG12 H 1 1.490 . A 108 ILE HG13 H 1 1.140 . A 108 ILE HG2% H 1 0.735 . A 108 ILE C C 13 173.247 . A 108 ILE CA C 13 62.823 . A 108 ILE CB C 13 38.446 . A 108 ILE CD1 C 13 14.213 . A 108 ILE CG1 C 13 29.920 . A 108 ILE CG2 C 13 16.780 . A 108 ILE N N 15 122.417 . A 109 ALA H H 1 8.290 . A 109 ALA HA H 1 3.970 . A 109 ALA HB% H 1 1.600 . A 109 ALA C C 13 178.318 . A 109 ALA CA C 13 50.150 . A 109 ALA CB C 13 21.630 . A 109 ALA N N 15 127.784 . A 110 GLU HA H 1 3.707 . A 110 GLU HBx H 1 2.096 . A 110 GLU HBy H 1 2.123 . A 110 GLU HGx H 1 2.372 . A 110 GLU C C 13 178.290 . A 110 GLU CA C 13 60.948 . A 110 GLU CB C 13 29.070 . A 111 VAL H H 1 8.333 . A 111 VAL HA H 1 3.850 . A 111 VAL HB H 1 2.136 . A 111 VAL HGx% H 1 0.980 . A 111 VAL HG21 H 1 1.002 . A 111 VAL HGy% H 1 1.002 . A 111 VAL C C 13 177.406 . A 111 VAL CA C 13 65.636 . A 111 VAL CB C 13 30.730 . A 111 VAL CG1 C 13 20.540 . A 111 VAL CG2 C 13 20.400 . A 111 VAL N N 15 114.438 . A 112 GLU H H 1 7.442 . A 112 GLU HA H 1 4.152 . A 112 GLU HBx H 1 1.990 . A 112 GLU HBy H 1 2.380 . A 112 GLU HGy H 1 2.434 . A 112 GLU HGx H 1 2.259 . A 112 GLU C C 13 179.982 . A 112 GLU CA C 13 60.010 . A 112 GLU CB C 13 30.008 . A 112 GLU CG C 13 37.509 . A 112 GLU N N 15 121.032 . A 113 LEU H H 1 7.666 . A 113 LEU HA H 1 3.846 . A 113 LEU HBy H 1 2.300 . A 113 LEU HBx H 1 1.120 . A 113 LEU HDx% H 1 0.815 . A 113 LEU HDy% H 1 0.822 . A 113 LEU C C 13 176.991 . A 113 LEU CA C 13 58.135 . A 113 LEU CB C 13 41.259 . A 113 LEU CD1 C 13 23.600 . A 113 LEU CD2 C 13 27.070 . A 113 LEU N N 15 118.731 . A 114 ILE H H 1 7.781 . A 114 ILE HA H 1 3.502 . A 114 ILE HB H 1 1.602 . A 114 ILE HD1% H 1 0.790 . A 114 ILE HG2% H 1 0.815 . A 114 ILE C C 13 178.195 . A 114 ILE CA C 13 65.636 . A 114 ILE CB C 13 40.321 . A 114 ILE CD1 C 13 13.780 . A 114 ILE CG1 C 13 29.070 . A 114 ILE CG2 C 13 16.830 . A 114 ILE N N 15 115.084 . A 115 ASN H H 1 8.470 . A 115 ASN HA H 1 4.502 . A 115 ASN HBy H 1 2.920 . A 115 ASN HBx H 1 2.773 . A 115 ASN HD2y H 1 7.490 . A 115 ASN HD2x H 1 7.110 . A 115 ASN C C 13 176.295 . A 115 ASN CA C 13 56.260 . A 115 ASN CB C 13 39.384 . A 115 ASN N N 15 115.158 . A 115 ASN ND2 N 15 113.060 . A 116 VAL H H 1 8.116 . A 116 VAL HA H 1 4.090 . A 116 VAL HB H 1 2.300 . A 116 VAL HGx% H 1 1.005 . A 116 VAL HGy% H 1 1.080 . A 116 VAL C C 13 176.740 . A 116 VAL CA C 13 64.400 . A 116 VAL CB C 13 32.050 . A 116 VAL CG1 C 13 21.060 . A 116 VAL CG2 C 13 21.250 . A 116 VAL N N 15 118.698 . A 117 LEU H H 1 7.294 . A 117 LEU HA H 1 3.970 . A 117 LEU HBy H 1 1.770 . A 117 LEU HBx H 1 1.200 . A 117 LEU HDx% H 1 0.319 . A 117 LEU HDy% H 1 0.013 . A 117 LEU C C 13 175.127 . A 117 LEU CA C 13 56.260 . A 117 LEU CB C 13 41.259 . A 117 LEU CD1 C 13 24.130 . A 117 LEU CD2 C 13 24.750 . A 117 LEU N N 15 116.201 . A 118 LYS H H 1 6.594 . A 118 LYS HA H 1 3.980 . A 118 LYS HBy H 1 2.080 . A 118 LYS HBx H 1 1.830 . A 118 LYS HDx H 1 1.201 . A 118 LYS HGx H 1 1.825 . A 118 LYS C C 13 175.589 . A 118 LYS CA C 13 56.260 . A 118 LYS CB C 13 28.133 . A 118 LYS CG C 13 24.382 . A 118 LYS N N 15 111.172 . A 119 ILE H H 1 8.245 . A 119 ILE HA H 1 4.090 . A 119 ILE HB H 1 1.430 . A 119 ILE HD1% H 1 0.260 . A 119 ILE HG12 H 1 0.230 . A 119 ILE HG13 H 1 0.460 . A 119 ILE HG2% H 1 0.654 . A 119 ILE C C 13 175.161 . A 119 ILE CA C 13 60.010 . A 119 ILE CB C 13 35.633 . A 119 ILE CD1 C 13 13.131 . A 119 ILE CG1 C 13 26.240 . A 119 ILE CG2 C 13 17.690 . A 119 ILE N N 15 119.484 . A 120 ASN H H 1 8.054 . A 120 ASN HA H 1 4.350 . A 120 ASN HBx H 1 2.712 . A 120 ASN HBy H 1 2.769 . A 120 ASN C C 13 175.136 . A 120 ASN CA C 13 54.385 . A 120 ASN CB C 13 39.384 . A 120 ASN N N 15 124.670 . A 121 LEU H H 1 7.517 . A 121 LEU HA H 1 4.678 . A 121 LEU HBx H 1 1.330 . A 121 LEU HBy H 1 1.330 . A 121 LEU HDx% H 1 0.720 . A 121 LEU HDy% H 1 0.555 . A 121 LEU C C 13 178.051 . A 121 LEU CA C 13 53.447 . A 121 LEU CB C 13 41.259 . A 121 LEU CD1 C 13 23.460 . A 121 LEU CD2 C 13 25.310 . A 121 LEU N N 15 119.918 . A 122 ILE H H 1 9.389 . A 122 ILE HA H 1 3.540 . A 122 ILE HB H 1 1.883 . A 122 ILE HD1% H 1 1.062 . A 122 ILE HG12 H 1 1.650 . A 122 ILE HG13 H 1 1.650 . A 122 ILE HG2% H 1 1.100 . A 122 ILE C C 13 176.425 . A 122 ILE CA C 13 65.636 . A 122 ILE CB C 13 38.446 . A 122 ILE CD1 C 13 14.390 . A 122 ILE CG1 C 13 30.008 . A 122 ILE CG2 C 13 17.170 . A 122 ILE N N 15 129.949 . A 123 GLY H H 1 8.675 . A 123 GLY HAy H 1 2.650 . A 123 GLY HAx H 1 2.060 . A 123 GLY C C 13 176.854 . A 123 GLY CA C 13 45.500 . A 123 GLY N N 15 106.314 . A 124 HIS H H 1 6.869 . A 124 HIS HA H 1 4.558 . A 124 HIS HBy H 1 3.240 . A 124 HIS HBx H 1 2.870 . A 124 HIS HD2 H 1 7.140 . A 124 HIS HE1 H 1 7.850 . A 124 HIS C C 13 176.977 . A 124 HIS CA C 13 57.198 . A 124 HIS CB C 13 30.945 . A 124 HIS CD2 C 13 116.510 . A 124 HIS CE1 C 13 138.550 . A 124 HIS N N 15 118.865 . A 125 ARG H H 1 7.730 . A 125 ARG HA H 1 3.770 . A 125 ARG HBx H 1 1.575 . A 125 ARG HBy H 1 2.191 . A 125 ARG HDx H 1 2.920 . A 125 ARG HE H 1 9.020 . A 125 ARG HGy H 1 1.848 . A 125 ARG HGx H 1 1.500 . A 125 ARG C C 13 178.288 . A 125 ARG CA C 13 61.886 . A 125 ARG CB C 13 30.945 . A 125 ARG CD C 13 41.000 . A 125 ARG CG C 13 27.000 . A 125 ARG N N 15 118.149 . A 125 ARG NE N 15 81.990 . A 126 LYS H H 1 8.679 . A 126 LYS HA H 1 3.990 . A 126 LYS HBy H 1 2.250 . A 126 LYS HBx H 1 1.770 . A 126 LYS C C 13 179.184 . A 126 LYS CA C 13 58.135 . A 126 LYS CB C 13 30.945 . A 126 LYS CG C 13 26.258 . A 126 LYS N N 15 114.003 . A 127 ARG H H 1 7.248 . A 127 ARG HA H 1 3.870 . A 127 ARG HBx H 1 1.790 . A 127 ARG HBy H 1 1.910 . A 127 ARG HDx H 1 3.200 . A 127 ARG HDy H 1 3.200 . A 127 ARG HE H 1 7.420 . A 127 ARG HGx H 1 1.640 . A 127 ARG HGy H 1 1.680 . A 127 ARG C C 13 177.772 . A 127 ARG CA C 13 60.010 . A 127 ARG CB C 13 30.945 . A 127 ARG CD C 13 43.000 . A 127 ARG CG C 13 27.000 . A 127 ARG N N 15 120.072 . A 127 ARG NE N 15 80.430 . A 128 ILE H H 1 7.706 . A 128 ILE HA H 1 3.530 . A 128 ILE HB H 1 1.980 . A 128 ILE HD1% H 1 0.294 . A 128 ILE HG2% H 1 1.110 . A 128 ILE C C 13 177.669 . A 128 ILE CA C 13 65.636 . A 128 ILE CB C 13 38.680 . A 128 ILE CD1 C 13 14.480 . A 128 ILE CG2 C 13 17.170 . A 128 ILE N N 15 118.730 . A 129 LEU H H 1 8.194 . A 129 LEU HA H 1 3.950 . A 129 LEU HBy H 1 1.810 . A 129 LEU HBx H 1 1.540 . A 129 LEU HDx% H 1 0.815 . A 129 LEU HDy% H 1 0.800 . A 129 LEU C C 13 179.960 . A 129 LEU CA C 13 58.135 . A 129 LEU CB C 13 41.259 . A 129 LEU CD1 C 13 22.540 . A 129 LEU CD2 C 13 25.210 . A 129 LEU N N 15 117.675 . A 130 ALA H H 1 8.294 . A 130 ALA HA H 1 4.220 . A 130 ALA HB% H 1 1.440 . A 130 ALA C C 13 179.899 . A 130 ALA CA C 13 54.385 . A 130 ALA CB C 13 19.270 . A 130 ALA N N 15 121.096 . A 131 SER H H 1 7.813 . A 131 SER HA H 1 4.180 . A 131 SER HBx H 1 3.800 . A 131 SER HBy H 1 3.800 . A 131 SER C C 13 175.457 . A 131 SER CA C 13 60.948 . A 131 SER CB C 13 63.761 . A 131 SER N N 15 112.102 . A 132 LEU H H 1 7.747 . A 132 LEU HA H 1 4.140 . A 132 LEU HBy H 1 1.800 . A 132 LEU HBx H 1 1.440 . A 132 LEU HDx% H 1 0.741 . A 132 LEU HDy% H 1 0.122 . A 132 LEU C C 13 178.589 . A 132 LEU CA C 13 56.260 . A 132 LEU CB C 13 42.196 . A 132 LEU CDy C 13 26.258 . A 132 LEU CDx C 13 21.900 . A 132 LEU N N 15 117.536 . A 133 GLY H H 1 7.544 . A 133 GLY HAy H 1 3.950 . A 133 GLY HAx H 1 3.100 . A 133 GLY C C 13 173.372 . A 133 GLY CA C 13 45.947 . A 133 GLY N N 15 105.351 . A 134 ASP H H 1 8.342 . A 134 ASP HA H 1 4.650 . A 134 ASP HBy H 1 2.730 . A 134 ASP HBx H 1 2.610 . A 134 ASP C C 13 175.462 . A 134 ASP CA C 13 54.385 . A 134 ASP CB C 13 41.259 . A 134 ASP N N 15 120.133 . A 135 ARG H H 1 7.932 . A 135 ARG C C 13 180.835 . A 135 ARG CA C 13 57.198 . A 135 ARG CB C 13 31.883 . A 135 ARG N N 15 125.632 . stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _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 1 VAL HA A 2 GLN H 1.0 . 3.82 2 2 A 2 GLN H A 1 VAL HGx% 1.0 . 4.49 3 3 A 2 GLN HA A 3 THR H 1.0 . 4.34 4 4 A 3 THR H A 2 GLN HGy 1.0 . 4.12 5 5 A 3 THR H A 2 GLN HBx 1.0 . 4.67 6 6 A 4 VAL H A 28 VAL H 1.0 . 5.16 7 7 A 3 THR H A 4 VAL H 1.0 . 5.22 8 8 A 4 VAL H A 3 THR HA 1.0 . 4.09 9 9 A 4 VAL H A 3 THR HG2% 1.0 . 3.55 10 10 A 4 VAL H A 28 VAL HGx% 1.0 . 5.27 11 11 A 4 VAL H A 28 VAL HGy% 1.0 . 5.25 12 12 A 4 VAL HB A 5 GLY H 1.0 . 5.13 13 13 A 5 GLY H A 4 VAL HGx% 1.0 . 4.19 14 14 A 5 GLY H A 6 GLN H 1.0 . 3.54 15 15 A 3 THR HG2% A 6 GLN H 1.0 . 4.08 16 16 A 6 GLN H A 7 TRP H 1.0 . 3.65 17 17 A 7 TRP H A 4 VAL HA 1.0 . 3.85 18 18 A 7 TRP H A 6 GLN HBx 1.0 . 3.78 19 19 A 28 VAL HGx% A 7 TRP H 1.0 . 5.32 20 20 A 28 VAL HGy% A 7 TRP H 1.0 . 5.50 21 21 A 7 TRP H A 8 LEU H 1.0 . 3.53 22 22 A 8 LEU H A 7 TRP HE3 1.0 . 4.27 23 23 A 8 LEU H A 7 TRP HA 1.0 . 3.94 24 24 A 4 VAL HA A 8 LEU H 1.0 . 4.04 25 25 A 8 LEU H A 7 TRP HBx 1.0 . 4.07 26 26 A 8 LEU H A 9 GLU H 1.0 . 3.57 27 27 A 7 TRP H A 9 GLU H 1.0 . 4.32 28 28 A 9 GLU H A 10 SER H 1.0 . 3.30 29 29 A 9 GLU H A 11 ILE H 1.0 . 4.58 30 30 A 9 GLU H A 8 LEU HA 1.0 . 4.05 31 31 A 9 GLU H A 8 LEU HBy 1.0 . 4.82 32 32 A 9 GLU H A 11 ILE HG12 1.0 . 4.57 33 33 A 8 LEU H A 10 SER H 1.0 . 4.40 34 34 A 10 SER H A 9 GLU HA 1.0 . 4.09 35 35 A 10 SER H A 9 GLU HBy 1.0 . 3.87 36 36 A 10 SER H A 11 ILE HG12 1.0 . 5.18 37 37 A 10 SER H A 11 ILE HG2% 1.0 . 5.23 38 38 A 11 ILE H A 12 GLY H 1.0 . 2.80 39 39 A 10 SER H A 11 ILE H 1.0 . 3.32 40 40 A 11 ILE H A 8 LEU HA 1.0 . 4.10 41 41 A 10 SER H A 12 GLY H 1.0 . 4.13 42 42 A 12 GLY H A 11 ILE HA 1.0 . 4.08 43 43 A 8 LEU HA A 12 GLY H 1.0 . 4.61 44 44 A 12 GLY H A 11 ILE HB 1.0 . 4.93 45 45 A 12 GLY H A 11 ILE HG13 1.0 . 5.02 46 46 A 11 ILE HG12 A 12 GLY H 1.0 . 5.21 47 47 A 11 ILE HG2% A 12 GLY H 1.0 . 4.78 48 48 A 12 GLY H A 11 ILE HD1% 1.0 . 5.02 49 49 A 13 LEU H A 16 TYR HD% 1.0 . 4.64 50 50 A 11 ILE HD1% A 13 LEU H 1.0 . 5.40 51 51 A 15 GLN H A 16 TYR H 1.0 . 3.49 52 52 A 15 GLN H A 14 PRO HA 1.0 . 4.38 53 53 A 16 TYR H A 17 GLU H 1.0 . 3.49 54 54 A 16 TYR H A 15 GLN HA 1.0 . 4.19 55 55 A 16 TYR H A 8 LEU HDx% 1.0 . 5.18 56 56 A 17 GLU H A 18 ASN H 1.0 . 4.46 57 57 A 17 GLU H A 16 TYR HA 1.0 . 3.86 58 58 A 17 GLU H A 8 LEU HDy% 1.0 . 3.61 59 59 A 20 LEU H A 21 MET H 1.0 . 3.28 60 60 A 20 LEU H A 19 HIS HA 1.0 . 3.90 61 61 A 20 LEU H A 17 GLU HA 1.0 . 4.37 62 62 A 20 LEU H A 19 HIS HBx 1.0 . 3.94 63 63 A 20 LEU H A 44 ILE HG21 1.0 . 4.86 64 64 A 7 TRP HZ2 A 59 ILE H 1.0 . 4.17 65 65 A 59 ILE H A 58 ALA HB% 1.0 . 4.67 66 66 A 59 ILE H A 62 LEU HDx% 1.0 . 5.15 67 67 A 21 MET H A 18 ASN HA 1.0 . 4.89 68 68 A 21 MET H A 20 LEU HA 1.0 . 3.97 69 69 A 21 MET H A 17 GLU HA 1.0 . 4.33 70 70 A 21 MET H A 22 ALA H 1.0 . 4.40 71 71 A 18 ASN HA A 22 ALA H 1.0 . 4.09 72 72 A 22 ALA H A 21 MET HA 1.0 . 4.44 73 73 A 22 ALA H A 21 MET HBx 1.0 . 4.07 74 74 A 7 TRP HE1 A 62 LEU HDy% 1.0 . 4.13 75 75 A 62 LEU HDx% A 7 TRP HE1 1.0 . 4.18 76 76 A 22 ALA H A 23 ASN H 1.0 . 3.80 77 77 A 21 MET H A 23 ASN H 1.0 . 4.52 78 78 A 23 ASN H A 25 PHE H 1.0 . 3.80 79 79 A 23 ASN H A 22 ALA HA 1.0 . 3.66 80 80 A 21 MET HA A 23 ASN H 1.0 . 4.24 81 81 A 23 ASN H A 22 ALA HB% 1.0 . 3.90 82 82 A 44 ILE HG21 A 23 ASN H 1.0 . 4.95 83 83 A 23 ASN H A 121 LEU HDx% 1.0 . 4.88 84 84 A 25 PHE H A 24 GLY H 1.0 . 3.32 85 85 A 25 PHE H A 26 ASP H 1.0 . 4.09 86 86 A 21 MET HA A 25 PHE H 1.0 . 4.74 87 87 A 25 PHE H A 23 ASN HBx 1.0 . 4.22 88 88 A 25 PHE H A 123 GLY HAy 1.0 . 4.43 89 89 A 42 LEU HDx% A 46 ILE H 1.0 . 5.17 90 90 A 26 ASP H A 25 PHE HA 1.0 . 4.45 91 91 A 21 MET HA A 26 ASP H 1.0 . 4.93 92 92 A 26 ASP H A 25 PHE HBx 1.0 . 4.75 93 93 A 28 VAL H A 27 ASN H 1.0 . 4.39 94 94 A 27 ASN H A 25 PHE HD% 1.0 . 4.66 95 95 A 26 ASP H A 27 ASN H 1.0 . 3.00 96 96 A 27 ASN H A 26 ASP HA 1.0 . 4.19 97 97 A 27 ASN H A 26 ASP HBy 1.0 . 4.52 98 98 A 23 ASN HD2x A 44 ILE HG12 1.0 . 5.09 99 99 A 27 ASN H A 4 VAL HGy% 1.0 . 4.98 100 100 A 23 ASN HD2x A 44 ILE HD1% 1.0 . 5.38 101 101 A 121 LEU HDx% A 23 ASN HD2x 1.0 . 5.50 102 102 A 28 VAL H A 29 GLN H 1.0 . 3.98 103 103 A 28 VAL H A 27 ASN HA 1.0 . 3.26 104 104 A 28 VAL H A 27 ASN HBy 1.0 . 4.77 105 105 A 28 VAL H A 27 ASN HBx 1.0 . 4.56 106 106 A 28 VAL H A 4 VAL HGy% 1.0 . 4.87 107 107 A 29 GLN H A 30 ALA H 1.0 . 4.18 108 108 A 29 GLN H A 28 VAL HA 1.0 . 4.76 109 109 A 29 GLN H A 28 VAL HB 1.0 . 4.36 110 110 A 28 VAL HGy% A 29 GLN H 1.0 . 5.25 111 111 A 30 ALA HA A 32 GLY H 1.0 . 4.76 112 112 A 36 MET HA A 37 GLU H 1.0 . 2.84 113 113 A 37 GLU H A 40 ASP HBy 1.0 . 3.88 114 114 A 37 GLU H A 40 ASP HBx 1.0 . 4.79 115 115 A 38 ASP H A 40 ASP H 1.0 . 4.73 116 116 A 38 ASP H A 37 GLU HA 1.0 . 3.26 117 117 A 38 ASP H A 37 GLU HBy 1.0 . 3.76 118 118 A 38 ASP H A 37 GLU HBx 1.0 . 4.73 119 119 A 38 ASP H A 56 LEU HDx% 1.0 . 4.96 120 120 A 38 ASP H A 56 LEU HDy% 1.0 . 4.61 121 121 A 40 ASP H A 39 GLN H 1.0 . 3.14 122 122 A 37 GLU HBy A 39 GLN H 1.0 . 3.44 123 123 A 37 GLU H A 40 ASP H 1.0 . 4.42 124 124 A 40 ASP H A 39 GLN HBx 1.0 . 4.37 125 125 A 37 GLU H A 41 LEU H 1.0 . 4.58 126 126 A 41 LEU H A 43 GLU H 1.0 . 4.65 127 127 A 41 LEU H A 42 LEU H 1.0 . 3.21 128 128 A 41 LEU H A 40 ASP HA 1.0 . 3.93 129 129 A 41 LEU H A 38 ASP HA 1.0 . 4.07 130 130 A 40 ASP HBy A 41 LEU H 1.0 . 3.53 131 131 A 40 ASP HBx A 41 LEU H 1.0 . 3.90 132 132 A 43 GLU H A 42 LEU H 1.0 . 3.54 133 133 A 42 LEU H A 40 ASP HA 1.0 . 4.72 134 134 A 42 LEU H A 38 ASP HA 1.0 . 4.58 135 135 A 42 LEU H A 41 LEU HDx% 1.0 . 4.80 136 136 A 43 GLU H A 44 ILE H 1.0 . 4.10 137 137 A 43 GLU H A 40 ASP HA 1.0 . 4.31 138 138 A 43 GLU H A 42 LEU HBy 1.0 . 4.67 139 139 A 43 GLU H A 42 LEU HBx 1.0 . 3.09 140 140 A 43 GLU H A 41 LEU HDx% 1.0 . 5.18 141 141 A 44 ILE H A 43 GLU HA 1.0 . 3.76 142 142 A 44 ILE H A 43 GLU HBy 1.0 . 4.05 143 143 A 44 ILE H A 43 GLU HBx 1.0 . 3.90 144 144 A 46 ILE H A 45 GLY H 1.0 . 3.39 145 145 A 44 ILE H A 45 GLY H 1.0 . 3.25 146 146 A 45 GLY H A 19 HIS HD2 1.0 . 4.81 147 147 A 45 GLY H A 44 ILE HB 1.0 . 5.14 148 148 A 44 ILE HG21 A 45 GLY H 1.0 . 4.68 149 149 A 42 LEU HDx% A 45 GLY H 1.0 . 5.11 150 150 A 45 GLY H A 46 ILE HD1% 1.0 . 5.15 151 151 A 16 TYR HE% A 47 LEU H 1.0 . 4.89 152 152 A 47 LEU H A 46 ILE HA 1.0 . 4.31 153 153 A 47 LEU H A 46 ILE HG2% 1.0 . 5.43 154 154 A 51 HIS H A 52 ARG H 1.0 . 3.32 155 155 A 52 ARG H A 51 HIS HA 1.0 . 4.05 156 156 A 52 ARG H A 51 HIS HBx 1.0 . 4.31 157 157 A 41 LEU HDx% A 52 ARG H 1.0 . 5.48 158 158 A 53 GLN H A 54 ARG H 1.0 . 3.61 159 159 A 51 HIS HA A 53 GLN H 1.0 . 4.54 160 160 A 53 GLN H A 52 ARG HA 1.0 . 4.09 161 161 A 54 ARG H A 55 ILE H 1.0 . 3.51 162 162 A 51 HIS HA A 55 ILE H 1.0 . 4.57 163 163 A 55 ILE H A 54 ARG HA 1.0 . 4.03 164 164 A 55 ILE H A 54 ARG HBy 1.0 . 3.53 165 165 A 11 ILE HD1% A 55 ILE H 1.0 . 4.86 166 166 A 56 LEU H A 57 GLN H 1.0 . 3.92 167 167 A 55 ILE H A 56 LEU H 1.0 . 3.62 168 168 A 56 LEU H A 58 ALA H 1.0 . 4.54 169 169 A 52 ARG HA A 56 LEU H 1.0 . 4.44 170 170 A 56 LEU H A 55 ILE HA 1.0 . 4.12 171 171 A 56 LEU H A 41 LEU HDy% 1.0 . 4.44 172 172 A 59 ILE H A 58 ALA H 1.0 . 3.45 173 173 A 57 GLN H A 58 ALA H 1.0 . 3.34 174 174 A 58 ALA H A 60 GLN H 1.0 . 4.04 175 175 A 58 ALA H A 57 GLN HA 1.0 . 4.37 176 176 A 58 ALA H A 55 ILE HA 1.0 . 4.02 177 177 A 59 ILE H A 60 GLN H 1.0 . 3.29 178 178 A 59 ILE H A 61 LEU H 1.0 . 4.38 179 179 A 60 GLN H A 61 LEU H 1.0 . 3.27 180 180 A 61 LEU H A 60 GLN HBy 1.0 . 4.35 181 181 A 61 LEU HA A 62 LEU H 1.0 . 3.83 182 182 A 23 ASN H A 24 GLY H 1.0 . 3.04 183 183 A 24 GLY H A 23 ASN HA 1.0 . 4.32 184 184 A 22 ALA HA A 24 GLY H 1.0 . 4.18 185 185 A 21 MET HA A 24 GLY H 1.0 . 4.66 186 186 A 24 GLY H A 23 ASN HBx 1.0 . 4.29 187 187 A 3 THR H A 6 GLN H 1.0 . 4.66 188 188 A 3 THR H A 7 TRP H 1.0 . 5.28 189 189 A 5 GLY H A 7 TRP H 1.0 . 4.88 190 190 A 5 GLY H A 3 THR HB 1.0 . 4.51 191 191 A 3 THR HA A 5 GLY H 1.0 . 4.39 192 192 A 4 VAL H A 6 GLN H 1.0 . 4.76 193 193 A 6 GLN H A 5 GLY HAy 1.0 . 4.12 194 194 A 28 VAL HGy% A 8 LEU H 1.0 . 5.16 195 195 A 8 LEU H A 11 ILE HD1% 1.0 . 5.50 196 196 A 9 GLU H A 8 LEU HDy% 1.0 . 4.81 197 197 A 9 GLU H A 12 GLY H 1.0 . 4.95 198 198 A 17 GLU H A 19 HIS H 1.0 . 4.94 199 199 A 20 LEU H A 19 HIS H 1.0 . 5.05 200 200 A 8 LEU HDx% A 20 LEU H 1.0 . 5.48 201 201 A 22 ALA H A 24 GLY H 1.0 . 4.37 202 202 A 22 ALA HB% A 24 GLY H 1.0 . 4.71 203 203 A 24 GLY H A 121 LEU HDy% 1.0 . 4.28 204 204 A 27 ASN H A 30 ALA HB% 1.0 . 4.56 205 205 A 28 VAL H A 30 ALA H 1.0 . 5.02 206 206 A 30 ALA H A 29 GLN HGy 1.0 . 4.73 207 207 A 58 ALA H A 57 GLN HBy 1.0 . 4.56 208 208 A 30 ALA H A 29 GLN HBx 1.0 . 4.79 209 209 A 30 ALA H A 28 VAL HA 1.0 . 4.53 210 210 A 119 ILE HG2% A 125 ARG H 1.0 . 5.11 211 211 A 125 ARG H A 124 HIS HBy 1.0 . 4.94 212 212 A 125 ARG H A 124 HIS HBx 1.0 . 4.88 213 213 A 37 GLU H A 59 ILE HG21 1.0 . 5.50 214 214 A 37 GLU H A 56 LEU HDy% 1.0 . 5.02 215 215 A 56 LEU HDy% A 39 GLN H 1.0 . 5.38 216 216 A 43 GLU H A 122 ILE HD1% 1.0 . 4.25 217 217 A 41 LEU HDx% A 44 ILE H 1.0 . 5.44 218 218 A 44 ILE H A 46 ILE HD1% 1.0 . 5.50 219 219 A 46 ILE H A 41 LEU HDx% 1.0 . 5.41 220 220 A 53 GLN H A 52 ARG HGy 1.0 . 4.66 221 221 A 54 ARG H A 56 LEU H 1.0 . 4.45 222 222 A 54 ARG H A 57 GLN H 1.0 . 5.02 223 223 A 51 HIS HA A 54 ARG H 1.0 . 4.20 224 224 A 54 ARG H A 52 ARG HA 1.0 . 4.88 225 225 A 54 ARG H A 53 GLN HBy 1.0 . 3.17 226 226 A 11 ILE HG2% A 58 ALA H 1.0 . 5.00 227 227 A 11 ILE HD1% A 58 ALA H 1.0 . 5.00 228 228 A 63 PRO HBx A 64 LYS H 1.0 . 5.07 229 229 A 65 MET H A 66 ARG H 1.0 . 4.71 230 230 A 64 LYS H A 65 MET H 1.0 . 4.88 231 231 A 66 ARG H A 65 MET HBx 1.0 . 4.70 232 232 A 68 ILE HA A 69 GLY H 1.0 . 3.97 233 233 A 69 GLY H A 68 ILE HB 1.0 . 5.50 234 234 A 69 GLY H A 68 ILE HG2% 1.0 . 4.97 235 235 A 77 SER H A 80 GLU HGy 1.0 . 4.74 236 236 A 77 SER H A 80 GLU HBx 1.0 . 3.98 237 237 A 77 SER HA A 78 VAL H 1.0 . 3.56 238 238 A 77 SER HBy A 79 ALA H 1.0 . 3.72 239 239 A 79 ALA H A 77 SER HBx 1.0 . 4.54 240 240 A 79 ALA H A 78 VAL HB 1.0 . 3.69 241 241 A 79 ALA H A 91 THR HG2% 1.0 . 4.93 242 242 A 79 ALA H A 78 VAL HGx% 1.0 . 4.32 243 243 A 79 ALA H A 82 LEU HDx% 1.0 . 5.50 244 244 A 79 ALA H A 80 GLU H 1.0 . 3.77 245 245 A 80 GLU H A 79 ALA HB% 1.0 . 3.68 246 246 A 80 GLU H A 81 TRP H 1.0 . 3.83 247 247 A 81 TRP H A 80 GLU HA 1.0 . 4.21 248 248 A 81 TRP H A 102 MET HE% 1.0 . 4.95 249 249 A 81 TRP H A 82 LEU H 1.0 . 3.63 250 250 A 82 LEU H A 83 ASP H 1.0 . 3.49 251 251 A 82 LEU H A 84 SER H 1.0 . 4.46 252 252 A 82 LEU H A 81 TRP HE3 1.0 . 3.87 253 253 A 82 LEU H A 78 VAL HA 1.0 . 3.92 254 254 A 82 LEU H A 81 TRP HBx 1.0 . 4.29 255 255 A 83 ASP H A 85 ILE H 1.0 . 4.86 256 256 A 83 ASP H A 82 LEU HA 1.0 . 4.06 257 257 A 83 ASP H A 82 LEU HBy 1.0 . 4.20 258 258 A 83 ASP H A 82 LEU HBx 1.0 . 3.72 259 259 A 83 ASP H A 84 SER H 1.0 . 3.33 260 260 A 84 SER H A 85 ILE H 1.0 . 3.67 261 261 A 86 GLU HA A 87 LEU H 1.0 . 3.59 262 262 A 84 SER H A 83 ASP HBy 1.0 . 4.27 263 263 A 84 SER H A 83 ASP HBx 1.0 . 4.05 264 264 A 87 LEU H A 82 LEU HDy% 1.0 . 4.43 265 265 A 85 ILE H A 86 GLU H 1.0 . 3.24 266 266 A 85 ILE H A 84 SER HA 1.0 . 4.02 267 267 A 85 ILE H A 82 LEU HA 1.0 . 4.23 268 268 A 85 ILE H A 82 LEU HDy% 1.0 . 5.23 269 269 A 87 LEU H A 86 GLU H 1.0 . 3.13 270 270 A 86 GLU H A 85 ILE HG2% 1.0 . 4.50 271 271 A 82 LEU HDy% A 88 GLY H 1.0 . 5.44 272 272 A 89 ASP HA A 90 TYR H 1.0 . 3.94 273 273 A 90 TYR H A 89 ASP HBy 1.0 . 4.71 274 274 A 90 TYR H A 89 ASP HBx 1.0 . 3.81 275 275 A 82 LEU HDx% A 90 TYR H 1.0 . 4.11 276 276 A 91 THR H A 92 LYS H 1.0 . 4.18 277 277 A 91 THR H A 90 TYR HA 1.0 . 4.21 278 278 A 89 ASP HA A 91 THR H 1.0 . 4.44 279 279 A 91 THR H A 90 TYR HBx 1.0 . 4.63 280 280 A 82 LEU HDx% A 91 THR H 1.0 . 4.59 281 281 A 82 LEU HDy% A 91 THR H 1.0 . 5.50 282 282 A 92 LYS H A 91 THR HA 1.0 . 4.03 283 283 A 92 LYS H A 93 ALA H 1.0 . 3.79 284 284 A 93 ALA H A 92 LYS HBy 1.0 . 3.45 285 285 A 93 ALA H A 96 ILE HD1% 1.0 . 5.15 286 286 A 93 ALA H A 117 LEU HDx% 1.0 . 5.08 287 287 A 94 PHE H A 96 ILE H 1.0 . 4.69 288 288 A 94 PHE H A 95 LEU H 1.0 . 3.16 289 289 A 93 ALA H A 94 PHE H 1.0 . 3.15 290 290 A 94 PHE H A 93 ALA HB% 1.0 . 3.84 291 291 A 82 LEU HDx% A 94 PHE H 1.0 . 4.72 292 292 A 96 ILE H A 95 LEU H 1.0 . 3.38 293 293 A 95 LEU H A 97 ASN H 1.0 . 4.25 294 294 A 95 LEU H A 94 PHE HBy 1.0 . 3.55 295 295 A 91 THR HG2% A 95 LEU H 1.0 . 3.74 296 296 A 96 ILE H A 95 LEU HA 1.0 . 3.85 297 297 A 96 ILE H A 97 ASN H 1.0 . 3.20 298 298 A 97 ASN H A 94 PHE HA 1.0 . 4.06 299 299 A 97 ASN H A 96 ILE HG12 1.0 . 3.78 300 300 A 96 ILE HD1% A 97 ASN H 1.0 . 4.44 301 301 A 96 ILE H A 98 GLY H 1.0 . 4.53 302 302 A 98 GLY H A 99 TYR H 1.0 . 3.33 303 303 A 97 ASN H A 98 GLY H 1.0 . 3.73 304 304 A 98 GLY H A 97 ASN HA 1.0 . 4.84 305 305 A 95 LEU HA A 98 GLY H 1.0 . 4.41 306 306 A 98 GLY H A 97 ASN HBy 1.0 . 4.45 307 307 A 98 GLY H A 97 ASN HBx 1.0 . 4.88 308 308 A 99 TYR H A 100 THR H 1.0 . 4.67 309 309 A 97 ASN H A 99 TYR H 1.0 . 4.20 310 310 A 95 LEU HA A 99 TYR H 1.0 . 3.63 311 311 A 99 TYR H A 97 ASN HBx 1.0 . 4.40 312 312 A 100 THR H A 101 SER H 1.0 . 3.44 313 313 A 100 THR H A 98 GLY HAy 1.0 . 4.93 314 314 A 100 THR H A 104 LEU HDx% 1.0 . 4.52 315 315 A 100 THR H A 78 VAL HGy% 1.0 . 4.78 316 316 A 100 THR H A 104 LEU HDy% 1.0 . 4.83 317 317 A 104 LEU H A 105 LEU H 1.0 . 2.89 318 318 A 104 LEU H A 103 ASP HBx 1.0 . 3.66 319 319 A 105 LEU H A 132 LEU HDy% 1.0 . 5.17 320 320 A 107 LYS HA A 108 ILE H 1.0 . 4.38 321 321 A 109 ALA H A 113 LEU H 1.0 . 4.48 322 322 A 109 ALA H A 112 GLU H 1.0 . 4.07 323 323 A 109 ALA H A 108 ILE HA 1.0 . 2.90 324 324 A 109 ALA H A 112 GLU HBy 1.0 . 3.72 325 325 A 109 ALA H A 112 GLU HGx 1.0 . 4.31 326 326 A 109 ALA H A 112 GLU HBx 1.0 . 4.76 327 327 A 109 ALA H A 108 ILE HB 1.0 . 4.15 328 328 A 109 ALA H A 111 VAL HGx% 1.0 . 5.26 329 329 A 109 ALA H A 108 ILE HG2% 1.0 . 4.34 330 330 A 109 ALA H A 108 ILE HD1% 1.0 . 4.39 331 331 A 112 GLU H A 111 VAL H 1.0 . 3.31 332 332 A 113 LEU H A 112 GLU H 1.0 . 3.05 333 333 A 112 GLU H A 111 VAL HGx% 1.0 . 3.54 334 334 A 112 GLU H A 114 ILE H 1.0 . 4.70 335 335 A 114 ILE H A 113 LEU HA 1.0 . 4.23 336 336 A 114 ILE H A 113 LEU HBx 1.0 . 3.92 337 337 A 115 ASN H A 116 VAL H 1.0 . 3.46 338 338 A 114 ILE H A 115 ASN H 1.0 . 3.51 339 339 A 113 LEU H A 115 ASN H 1.0 . 4.01 340 340 A 115 ASN H A 112 GLU HA 1.0 . 4.84 341 341 A 115 ASN H A 114 ILE HA 1.0 . 4.74 342 342 A 115 ASN H A 114 ILE HB 1.0 . 4.82 343 343 A 116 VAL H A 117 LEU H 1.0 . 2.90 344 344 A 116 VAL H A 118 LYS H 1.0 . 3.69 345 345 A 116 VAL H A 115 ASN HA 1.0 . 3.77 346 346 A 116 VAL H A 115 ASN HBy 1.0 . 3.55 347 347 A 30 ALA HB% A 127 ARG H 1.0 . 4.81 348 348 A 116 VAL H A 115 ASN HBx 1.0 . 4.63 349 349 A 115 ASN H A 117 LEU H 1.0 . 4.22 350 350 A 117 LEU H A 118 LYS H 1.0 . 3.47 351 351 A 117 LEU H A 116 VAL HB 1.0 . 4.42 352 352 A 115 ASN H A 118 LYS H 1.0 . 4.50 353 353 A 118 LYS H A 119 ILE H 1.0 . 3.08 354 354 A 114 ILE HA A 118 LYS H 1.0 . 3.87 355 355 A 117 LEU H A 119 ILE H 1.0 . 4.70 356 356 A 119 ILE H A 118 LYS HA 1.0 . 3.15 357 357 A 114 ILE HA A 119 ILE H 1.0 . 3.25 358 358 A 119 ILE H A 117 LEU HBx 1.0 . 3.89 359 359 A 119 ILE H A 117 LEU HDy% 1.0 . 5.22 360 360 A 120 ASN H A 121 LEU H 1.0 . 4.50 361 361 A 121 LEU H A 120 ASN HA 1.0 . 4.38 362 362 A 121 LEU H A 119 ILE HA 1.0 . 4.65 363 363 A 119 ILE HG2% A 121 LEU H 1.0 . 4.24 364 364 A 122 ILE H A 123 GLY H 1.0 . 3.82 365 365 A 25 PHE H A 123 GLY H 1.0 . 4.77 366 366 A 123 GLY H A 122 ILE HA 1.0 . 4.48 367 367 A 123 GLY H A 122 ILE HB 1.0 . 4.16 368 368 A 123 GLY H A 122 ILE HG2% 1.0 . 4.22 369 369 A 123 GLY H A 124 HIS H 1.0 . 3.67 370 370 A 125 ARG H A 124 HIS H 1.0 . 3.53 371 371 A 123 GLY HAy A 124 HIS H 1.0 . 4.89 372 372 A 121 LEU HDy% A 124 HIS H 1.0 . 4.84 373 373 A 125 ARG H A 126 LYS H 1.0 . 4.29 374 374 A 127 ARG H A 126 LYS H 1.0 . 3.65 375 375 A 126 LYS H A 125 ARG HA 1.0 . 4.21 376 376 A 122 ILE HA A 126 LYS H 1.0 . 4.51 377 377 A 126 LYS H A 125 ARG HBx 1.0 . 4.15 378 378 A 127 ARG H A 129 LEU H 1.0 . 4.49 379 379 A 127 ARG H A 128 ILE H 1.0 . 3.66 380 380 A 127 ARG H A 124 HIS HA 1.0 . 4.40 381 381 A 127 ARG H A 126 LYS HA 1.0 . 4.23 382 382 A 127 ARG H A 126 LYS HBx 1.0 . 3.74 383 383 A 129 LEU H A 131 SER H 1.0 . 4.47 384 384 A 125 ARG HA A 129 LEU H 1.0 . 4.51 385 385 A 129 LEU H A 128 ILE HA 1.0 . 4.30 386 386 A 129 LEU H A 128 ILE HB 1.0 . 5.46 387 387 A 129 LEU H A 128 ILE HG2% 1.0 . 3.98 388 388 A 131 SER H A 130 ALA H 1.0 . 3.07 389 389 A 130 ALA H A 129 LEU HBy 1.0 . 3.80 390 390 A 131 SER H A 133 GLY H 1.0 . 4.58 391 391 A 131 SER H A 128 ILE HA 1.0 . 4.29 392 392 A 131 SER H A 130 ALA HB% 1.0 . 3.65 393 393 A 131 SER H A 85 ILE HD1% 1.0 . 4.51 394 394 A 130 ALA H A 132 LEU H 1.0 . 4.73 395 395 A 133 GLY H A 132 LEU H 1.0 . 3.46 396 396 A 132 LEU H A 81 TRP HZ2 1.0 . 4.69 397 397 A 132 LEU H A 129 LEU HA 1.0 . 3.80 398 398 A 128 ILE HG2% A 132 LEU H 1.0 . 5.09 399 399 A 133 GLY H A 134 ASP H 1.0 . 4.38 400 400 A 133 GLY H A 130 ALA HA 1.0 . 4.08 401 401 A 6 GLN H A 8 LEU H 1.0 . 4.55 402 402 A 4 VAL HGx% A 8 LEU H 1.0 . 4.34 403 403 A 125 ARG H A 122 ILE HA 1.0 . 4.06 404 404 A 28 VAL HGx% A 4 VAL HA 1.0 . 3.90 405 405 A 28 VAL HGy% A 4 VAL HA 1.0 . 3.92 406 406 A 4 VAL HGx% A 7 TRP HE3 1.0 . 4.22 407 407 A 4 VAL HGx% A 7 TRP HZ3 1.0 . 4.32 408 408 A 4 VAL HGx% A 26 ASP HA 1.0 . 4.07 409 409 A 4 VAL HGx% A 7 TRP HBx 1.0 . 4.12 410 410 A 4 VAL HGx% A 20 LEU HBx 1.0 . 3.51 411 411 A 28 VAL HGy% A 4 VAL HGx% 1.0 . 4.06 412 412 A 4 VAL HGy% A 31 MET HE% 1.0 . 3.98 413 413 A 28 VAL HGy% A 4 VAL HGy% 1.0 . 3.73 414 414 A 128 ILE HA A 81 TRP HZ2 1.0 . 3.84 415 415 A 78 VAL HB A 94 PHE HBy 1.0 . 4.31 416 416 A 82 LEU HBx A 79 ALA HA 1.0 . 3.50 417 417 A 8 LEU HDy% A 17 GLU HA 1.0 . 4.07 418 418 A 8 LEU HDy% A 16 TYR HBx 1.0 . 3.53 419 419 A 11 ILE HB A 55 ILE HA 1.0 . 4.10 420 420 A 8 LEU HA A 11 ILE HG12 1.0 . 3.84 421 421 A 11 ILE HG2% A 7 TRP HZ2 1.0 . 4.14 422 422 A 11 ILE HG2% A 58 ALA HA 1.0 . 4.14 423 423 A 8 LEU HA A 11 ILE HG2% 1.0 . 4.18 424 424 A 11 ILE HG2% A 58 ALA HB% 1.0 . 2.91 425 425 A 11 ILE HD1% A 7 TRP HH2 1.0 . 3.61 426 426 A 11 ILE HD1% A 7 TRP HZ3 1.0 . 4.08 427 427 A 8 LEU HA A 11 ILE HD1% 1.0 . 3.10 428 428 A 11 ILE HD1% A 58 ALA HB% 1.0 . 2.92 429 429 A 20 LEU HA A 25 PHE HBx 1.0 . 3.71 430 430 A 7 TRP HZ3 A 20 LEU HDy% 1.0 . 3.79 431 431 A 17 GLU HA A 20 LEU HDy% 1.0 . 3.99 432 432 A 16 TYR HBy A 20 LEU HDx% 1.0 . 3.81 433 433 A 20 LEU HDx% A 19 HIS HBy 1.0 . 3.85 434 434 A 20 LEU HDy% A 25 PHE HBy 1.0 . 3.85 435 435 A 4 VAL HB A 20 LEU HDy% 1.0 . 4.17 436 436 A 20 LEU HDx% A 36 MET HE% 1.0 . 3.73 437 437 A 8 LEU HDx% A 20 LEU HDy% 1.0 . 3.29 438 438 A 20 LEU HDx% A 55 ILE HD1% 1.0 . 3.41 439 439 A 46 ILE HD1% A 20 LEU HDx% 1.0 . 3.31 440 440 A 21 MET HA A 26 ASP HBy 1.0 . 3.61 441 441 A 126 LYS HA A 125 ARG HDy 1.0 . 3.70 442 442 A 21 MET HA A 26 ASP HBx 1.0 . 3.32 443 443 A 21 MET HA A 26 ASP HA 1.0 . 3.58 444 444 A 26 ASP HA A 21 MET HE% 1.0 . 3.99 445 445 A 58 ALA HB% A 55 ILE HA 1.0 . 4.05 446 446 A 128 ILE HA A 85 ILE HD1% 1.0 . 3.55 447 447 A 28 VAL HGx% A 7 TRP HE3 1.0 . 4.17 448 448 A 28 VAL HGx% A 7 TRP HBy 1.0 . 3.81 449 449 A 28 VAL HGx% A 7 TRP HBx 1.0 . 3.71 450 450 A 28 VAL HGy% A 7 TRP HE3 1.0 . 4.13 451 451 A 28 VAL HGy% A 7 TRP HBx 1.0 . 4.17 452 452 A 2 GLN HGy A 28 VAL HGy% 1.0 . 4.20 453 453 A 7 TRP HE3 A 31 MET HE% 1.0 . 3.70 454 454 A 25 PHE HD% A 31 MET HE% 1.0 . 3.85 455 455 A 31 MET HE% A 7 TRP HH2 1.0 . 3.62 456 456 A 7 TRP HZ3 A 31 MET HE% 1.0 . 3.23 457 457 A 25 PHE HBx A 31 MET HE% 1.0 . 4.29 458 458 A 31 MET HE% A 20 LEU HDy% 1.0 . 3.31 459 459 A 113 LEU HDx% A 119 ILE HB 1.0 . 3.41 460 460 A 28 VAL HGy% A 31 MET HE% 1.0 . 3.80 461 461 A 62 LEU HDx% A 31 MET HE% 1.0 . 3.80 462 462 A 36 MET HE% A 25 PHE HE% 1.0 . 3.03 463 463 A 40 ASP HBy A 36 MET HE% 1.0 . 4.00 464 464 A 25 PHE HBx A 36 MET HE% 1.0 . 3.90 465 465 A 40 ASP HBx A 36 MET HE% 1.0 . 4.08 466 466 A 44 ILE HD1% A 36 MET HE% 1.0 . 3.02 467 467 A 37 GLU HA A 56 LEU HDy% 1.0 . 3.45 468 468 A 38 ASP HA A 41 LEU HDy% 1.0 . 3.91 469 469 A 56 LEU HDx% A 53 GLN HA 1.0 . 3.44 470 470 A 40 ASP HBx A 25 PHE HE% 1.0 . 3.78 471 471 A 40 ASP HBx A 122 ILE HG2% 1.0 . 4.32 472 472 A 114 ILE HA A 118 LYS HA 1.0 . 3.92 473 473 A 41 LEU HDx% A 46 ILE HG2% 1.0 . 3.45 474 474 A 56 LEU HDx% A 38 ASP HA 1.0 . 3.85 475 475 A 56 LEU HDx% A 38 ASP HBy 1.0 . 3.92 476 476 A 56 LEU HDx% A 38 ASP HBx 1.0 . 3.28 477 477 A 40 ASP HA A 43 GLU HBx 1.0 . 3.57 478 478 A 43 GLU HBx A 122 ILE HD1% 1.0 . 4.06 479 479 A 59 ILE HG21 A 36 MET HBy 1.0 . 4.07 480 480 A 44 ILE HG21 A 20 LEU HG 1.0 . 3.82 481 481 A 59 ILE HG21 A 36 MET HBx 1.0 . 3.51 482 482 A 56 LEU HDy% A 59 ILE HG21 1.0 . 3.90 483 483 A 7 TRP HH2 A 59 ILE HD1% 1.0 . 4.01 484 484 A 36 MET HBy A 59 ILE HD1% 1.0 . 3.83 485 485 A 36 MET HBx A 59 ILE HD1% 1.0 . 3.65 486 486 A 36 MET HE% A 59 ILE HD1% 1.0 . 4.20 487 487 A 7 TRP HZ2 A 58 ALA HB% 1.0 . 3.25 488 488 A 7 TRP HH2 A 55 ILE HG2% 1.0 . 3.44 489 489 A 81 TRP HE3 A 78 VAL HA 1.0 . 3.61 490 490 A 78 VAL HGx% A 81 TRP HE3 1.0 . 4.02 491 491 A 78 VAL HGx% A 91 THR HA 1.0 . 3.62 492 492 A 78 VAL HGx% A 79 ALA HA 1.0 . 4.32 493 493 A 81 TRP HE3 A 78 VAL HGy% 1.0 . 4.04 494 494 A 78 VAL HGy% A 99 TYR HD% 1.0 . 4.13 495 495 A 78 VAL HGy% A 81 TRP HZ3 1.0 . 4.34 496 496 A 111 VAL HGx% A 112 GLU HA 1.0 . 4.08 497 497 A 111 VAL HGx% A 109 ALA HB% 1.0 . 2.86 498 498 A 82 LEU HA A 85 ILE HD1% 1.0 . 4.14 499 499 A 82 LEU HDx% A 81 TRP HE3 1.0 . 3.71 500 500 A 82 LEU HDx% A 91 THR HA 1.0 . 4.35 501 501 A 82 LEU HDx% A 90 TYR HBy 1.0 . 3.11 502 502 A 82 LEU HDx% A 94 PHE HBx 1.0 . 4.27 503 503 A 82 LEU HDx% A 90 TYR HBx 1.0 . 4.28 504 504 A 81 TRP HE3 A 82 LEU HDy% 1.0 . 4.23 505 505 A 82 LEU HDy% A 90 TYR HD% 1.0 . 4.28 506 506 A 82 LEU HDy% A 81 TRP HZ3 1.0 . 4.17 507 507 A 82 LEU HDy% A 90 TYR HBx 1.0 . 4.08 508 508 A 80 GLU HA A 83 ASP HBx 1.0 . 3.42 509 509 A 25 PHE HE% A 59 ILE HD1% 1.0 . 4.39 510 510 A 85 ILE HD1% A 81 TRP HZ2 1.0 . 4.13 511 511 A 7 TRP HZ2 A 59 ILE HD1% 1.0 . 3.31 512 512 A 85 ILE HD1% A 131 SER HBy 1.0 . 3.73 513 513 A 82 LEU HDy% A 85 ILE HD1% 1.0 . 3.75 514 514 A 90 TYR HD% A 87 LEU HDx% 1.0 . 3.53 515 515 A 87 LEU HDy% A 124 HIS HD2 1.0 . 3.59 516 516 A 87 LEU HDy% A 90 TYR HE% 1.0 . 3.49 517 517 A 82 LEU HDy% A 87 LEU HDy% 1.0 . 3.69 518 518 A 90 TYR HA A 93 ALA HB% 1.0 . 3.61 519 519 A 91 THR HG2% A 82 LEU HDx% 1.0 . 3.61 520 520 A 91 THR HG2% A 79 ALA HA 1.0 . 2.94 521 521 A 16 TYR HE% A 46 ILE HA 1.0 . 3.93 522 522 A 96 ILE HD1% A 92 LYS HDy 1.0 . 4.16 523 523 A 93 ALA HB% A 94 PHE HD% 1.0 . 4.18 524 524 A 93 ALA HB% A 90 TYR HD% 1.0 . 4.33 525 525 A 90 TYR HBx A 93 ALA HB% 1.0 . 4.24 526 526 A 96 ILE HD1% A 93 ALA HB% 1.0 . 4.31 527 527 A 94 PHE HBy A 78 VAL HGy% 1.0 . 4.40 528 528 A 91 THR HA A 95 LEU HDx% 1.0 . 4.23 529 529 A 95 LEU HDx% A 91 THR HB 1.0 . 4.21 530 530 A 96 ILE HG12 A 93 ALA HA 1.0 . 3.93 531 531 A 93 ALA HA A 96 ILE HG2% 1.0 . 4.16 532 532 A 96 ILE HD1% A 93 ALA HA 1.0 . 3.91 533 533 A 94 PHE HD% A 99 TYR HBy 1.0 . 3.72 534 534 A 94 PHE HD% A 99 TYR HBx 1.0 . 3.88 535 535 A 95 LEU HDy% A 100 THR HG2% 1.0 . 3.14 536 536 A 104 LEU HDx% A 99 TYR HD% 1.0 . 4.07 537 537 A 104 LEU HDx% A 99 TYR HA 1.0 . 3.17 538 538 A 81 TRP HE3 A 105 LEU HDx% 1.0 . 3.88 539 539 A 105 LEU HDx% A 94 PHE HE% 1.0 . 3.66 540 540 A 105 LEU HDx% A 81 TRP HH2 1.0 . 4.26 541 541 A 81 TRP HZ3 A 105 LEU HDx% 1.0 . 4.27 542 542 A 78 VAL HGx% A 105 LEU HDx% 1.0 . 3.27 543 543 A 99 TYR HD% A 105 LEU HDy% 1.0 . 3.68 544 544 A 105 LEU HDy% A 99 TYR HE% 1.0 . 3.64 545 545 A 81 TRP HZ3 A 105 LEU HDy% 1.0 . 3.70 546 546 A 99 TYR HA A 105 LEU HDy% 1.0 . 4.03 547 547 A 78 VAL HA A 105 LEU HDy% 1.0 . 4.45 548 548 A 99 TYR HBy A 105 LEU HDy% 1.0 . 4.20 549 549 A 99 TYR HBx A 105 LEU HDy% 1.0 . 3.57 550 550 A 108 ILE HG2% A 99 TYR HE% 1.0 . 4.24 551 551 A 108 ILE HG2% A 105 LEU HA 1.0 . 3.78 552 552 A 112 GLU HBy A 108 ILE HG2% 1.0 . 3.88 553 553 A 112 GLU HBx A 108 ILE HG2% 1.0 . 3.93 554 554 A 108 ILE HD1% A 99 TYR HD% 1.0 . 3.98 555 555 A 108 ILE HD1% A 99 TYR HE% 1.0 . 4.18 556 556 A 108 ILE HD1% A 105 LEU HA 1.0 . 3.70 557 557 A 112 GLU HBy A 108 ILE HD1% 1.0 . 3.96 558 558 A 112 GLU HBx A 108 ILE HD1% 1.0 . 4.10 559 559 A 114 ILE HB A 111 VAL HA 1.0 . 3.35 560 560 A 111 VAL HA A 114 ILE HD1% 1.0 . 3.20 561 561 A 112 GLU HA A 116 VAL HGy% 1.0 . 3.55 562 562 A 113 LEU HA A 117 LEU HBy 1.0 . 3.42 563 563 A 113 LEU HA A 117 LEU HDy% 1.0 . 3.76 564 564 A 113 LEU HDx% A 94 PHE HZ 1.0 . 3.66 565 565 A 113 LEU HDx% A 128 ILE HD1% 1.0 . 3.68 566 566 A 99 TYR HD% A 116 VAL HGx% 1.0 . 4.14 567 567 A 99 TYR HE% A 116 VAL HGx% 1.0 . 4.14 568 568 A 97 ASN HBx A 116 VAL HGx% 1.0 . 3.60 569 569 A 117 LEU HDy% A 116 VAL HGx% 1.0 . 3.71 570 570 A 99 TYR HE% A 116 VAL HGy% 1.0 . 4.32 571 571 A 117 LEU HDx% A 94 PHE HD% 1.0 . 3.82 572 572 A 117 LEU HDx% A 99 TYR HD% 1.0 . 3.20 573 573 A 117 LEU HDx% A 99 TYR HE% 1.0 . 3.93 574 574 A 117 LEU HDx% A 97 ASN HBy 1.0 . 3.52 575 575 A 117 LEU HDx% A 93 ALA HB% 1.0 . 3.01 576 576 A 117 LEU HDy% A 99 TYR HE% 1.0 . 3.28 577 577 A 97 ASN HBy A 117 LEU HDy% 1.0 . 4.13 578 578 A 97 ASN HBx A 117 LEU HDy% 1.0 . 3.91 579 579 A 119 ILE HG2% A 90 TYR HE% 1.0 . 4.29 580 580 A 119 ILE HG2% A 125 ARG HA 1.0 . 4.42 581 581 A 119 ILE HG2% A 124 HIS HBx 1.0 . 4.05 582 582 A 119 ILE HG2% A 125 ARG HBx 1.0 . 4.25 583 583 A 90 TYR HD% A 119 ILE HD1% 1.0 . 4.28 584 584 A 46 ILE HD1% A 16 TYR HBy 1.0 . 4.31 585 585 A 117 LEU HBy A 119 ILE HD1% 1.0 . 3.41 586 586 A 117 LEU HBx A 119 ILE HD1% 1.0 . 2.85 587 587 A 113 LEU HDx% A 119 ILE HD1% 1.0 . 2.98 588 588 A 119 ILE HG2% A 120 ASN HA 1.0 . 4.09 589 589 A 40 ASP HBy A 122 ILE HG2% 1.0 . 3.74 590 590 A 122 ILE HA A 125 ARG HBy 1.0 . 3.73 591 591 A 85 ILE HD1% A 131 SER HA 1.0 . 4.06 592 592 A 119 ILE HG2% A 121 LEU HBy 1.0 . 3.95 593 593 A 23 ASN HA A 121 LEU HDy% 1.0 . 3.69 594 594 A 122 ILE HG2% A 25 PHE HE% 1.0 . 2.94 595 595 A 128 ILE HG2% A 94 PHE HZ 1.0 . 3.44 596 596 A 128 ILE HG2% A 81 TRP HH2 1.0 . 3.33 597 597 A 81 TRP HZ2 A 128 ILE HD1% 1.0 . 4.06 598 598 A 40 ASP HA A 122 ILE HD1% 1.0 . 3.77 599 599 A 40 ASP HBy A 122 ILE HD1% 1.0 . 4.08 600 600 A 40 ASP HBx A 122 ILE HD1% 1.0 . 3.97 601 601 A 43 GLU HBy A 122 ILE HD1% 1.0 . 3.65 602 602 A 19 HIS HA A 44 ILE HG21 1.0 . 4.42 603 603 A 81 TRP HH2 A 132 LEU HDx% 1.0 . 4.34 604 604 A 129 LEU HA A 132 LEU HDx% 1.0 . 3.73 605 605 A 132 LEU HDx% A 105 LEU HBy 1.0 . 4.28 606 606 A 132 LEU HDy% A 81 TRP HZ2 1.0 . 3.76 607 607 A 132 LEU HDy% A 81 TRP HH2 1.0 . 4.15 608 608 A 132 LEU HDy% A 105 LEU HBy 1.0 . 3.73 609 609 A 132 LEU HDy% A 105 LEU HBx 1.0 . 3.18 610 610 A 102 MET HE% A 132 LEU HDy% 1.0 . 3.05 611 611 A 132 LEU HDy% A 105 LEU HDx% 1.0 . 2.92 612 612 A 124 HIS HD2 A 24 GLY HAy 1.0 . 3.79 613 613 A 26 ASP HA A 4 VAL HGy% 1.0 . 3.19 614 614 A 4 VAL HGy% A 27 ASN HA 1.0 . 3.65 615 615 A 28 VAL HGx% A 2 GLN HGx 1.0 . 3.55 616 616 A 28 VAL HGx% A 2 GLN HBy 1.0 . 4.02 617 617 A 2 GLN HBx A 28 VAL HGx% 1.0 . 3.85 618 618 A 28 VAL HGy% A 2 GLN HBy 1.0 . 4.12 619 619 A 2 GLN HBx A 28 VAL HGy% 1.0 . 3.91 620 620 A 30 ALA HB% A 127 ARG HA 1.0 . 4.21 621 621 A 27 ASN HBx A 30 ALA HB% 1.0 . 3.41 622 622 A 123 GLY HAy A 30 ALA HB% 1.0 . 3.42 623 623 A 53 GLN HA A 56 LEU HBx 1.0 . 3.68 624 624 A 40 ASP HBy A 25 PHE HE% 1.0 . 3.84 625 625 A 52 ARG HA A 41 LEU HDy% 1.0 . 4.25 626 626 A 20 LEU HA A 44 ILE HD1% 1.0 . 4.24 627 627 A 44 ILE HD1% A 20 LEU HG 1.0 . 3.71 628 628 A 16 TYR HE% A 46 ILE HG2% 1.0 . 3.76 629 629 A 46 ILE HG2% A 52 ARG HA 1.0 . 3.87 630 630 A 46 ILE HG2% A 51 HIS HBy 1.0 . 3.90 631 631 A 46 ILE HG2% A 51 HIS HBx 1.0 . 3.83 632 632 A 46 ILE HG2% A 52 ARG HGy 1.0 . 3.52 633 633 A 46 ILE HG2% A 55 ILE HD1% 1.0 . 3.43 634 634 A 119 ILE HG2% A 124 HIS HA 1.0 . 4.31 635 635 A 119 ILE HG2% A 124 HIS HBy 1.0 . 3.83 636 636 A 119 ILE HG2% A 125 ARG HBy 1.0 . 4.34 637 637 A 120 ASN HA A 114 ILE HG2% 1.0 . 3.78 638 638 A 43 GLU HA A 122 ILE HD1% 1.0 . 4.19 639 639 A 121 LEU HDy% A 24 GLY HAy 1.0 . 3.50 640 640 A 121 LEU HDy% A 124 HIS HE1 1.0 . 3.46 641 641 A 121 LEU HDy% A 124 HIS HD2 1.0 . 4.29 642 642 A 121 LEU HDx% A 24 GLY HAy 1.0 . 4.06 643 643 A 40 ASP HA A 122 ILE HG2% 1.0 . 4.23 644 644 A 124 HIS HBx A 87 LEU HDy% 1.0 . 3.77 645 645 A 124 HIS HA A 87 LEU HDx% 1.0 . 3.70 646 646 A 124 HIS HBy A 87 LEU HDx% 1.0 . 4.13 647 647 A 124 HIS HBx A 87 LEU HDx% 1.0 . 3.77 648 648 A 82 LEU HDy% A 87 LEU HDx% 1.0 . 3.85 649 649 A 82 LEU HDx% A 94 PHE HE% 1.0 . 4.13 650 650 A 82 LEU HDx% A 79 ALA HA 1.0 . 4.15 651 651 A 82 LEU HDy% A 90 TYR HBy 1.0 . 4.20 652 652 A 82 LEU HDy% A 128 ILE HG2% 1.0 . 3.27 653 653 A 82 LEU HDy% A 85 ILE HG2% 1.0 . 3.66 654 654 A 82 LEU HDy% A 128 ILE HD1% 1.0 . 3.43 655 655 A 123 GLY HAy A 25 PHE HE% 1.0 . 3.90 656 656 A 123 GLY HAy A 126 LYS HBx 1.0 . 3.85 657 657 A 44 ILE HG21 A 23 ASN HBy 1.0 . 4.31 658 658 A 25 PHE HA A 30 ALA HB% 1.0 . 4.47 659 659 A 7 TRP HH2 A 36 MET HE% 1.0 . 3.98 660 660 A 25 PHE HBy A 36 MET HE% 1.0 . 3.98 661 661 A 55 ILE HD1% A 51 HIS HD2 1.0 . 4.44 662 662 A 7 TRP HZ3 A 55 ILE HD1% 1.0 . 4.37 663 663 A 16 TYR HD% A 55 ILE HD1% 1.0 . 4.19 664 664 A 52 ARG HA A 55 ILE HD1% 1.0 . 4.37 665 665 A 40 ASP HA A 43 GLU HBy 1.0 . 3.67 666 666 A 122 ILE HD1% A 25 PHE HE% 1.0 . 3.83 667 667 A 121 LEU HDx% A 23 ASN HA 1.0 . 2.86 668 668 A 94 PHE HD% A 105 LEU HDy% 1.0 . 3.28 669 669 A 117 LEU HDy% A 94 PHE HE% 1.0 . 4.07 670 670 A 7 TRP HZ2 A 62 LEU HDx% 1.0 . 4.03 671 671 A 85 ILE HG2% A 127 ARG HA 1.0 . 3.97 672 672 A 7 TRP HZ2 A 59 ILE HA 1.0 . 3.72 673 673 A 7 TRP HZ2 A 58 ALA HB% 1.0 . 3.04 674 674 A 7 TRP HZ2 A 55 ILE HG2% 1.0 . 4.08 675 675 A 7 TRP HZ2 A 59 ILE HD1% 1.0 . 4.08 676 676 A 7 TRP HZ2 A 62 LEU HDy% 1.0 . 4.18 677 677 A 7 TRP HZ2 A 62 LEU HDx% 1.0 . 3.76 678 678 A 11 ILE HD1% A 7 TRP HZ2 1.0 . 4.39 679 679 A 55 ILE HA A 7 TRP HH2 1.0 . 3.96 680 680 A 31 MET HE% A 7 TRP HH2 1.0 . 4.33 681 681 A 7 TRP HH2 A 36 MET HE% 1.0 . 4.40 682 682 A 7 TRP HH2 A 55 ILE HG2% 1.0 . 3.42 683 683 A 7 TRP HH2 A 59 ILE HD1% 1.0 . 3.98 684 684 A 7 TRP HH2 A 55 ILE HG12 1.0 . 4.40 685 685 A 62 LEU HDx% A 7 TRP HH2 1.0 . 4.36 686 686 A 11 ILE HD1% A 7 TRP HH2 1.0 . 4.20 687 687 A 7 TRP HZ3 A 31 MET HE% 1.0 . 3.72 688 688 A 4 VAL HGx% A 7 TRP HZ3 1.0 . 4.38 689 689 A 7 TRP HZ3 A 20 LEU HDy% 1.0 . 3.65 690 690 A 7 TRP HZ3 A 59 ILE HD1% 1.0 . 3.57 691 691 A 11 ILE HD1% A 7 TRP HZ3 1.0 . 4.26 692 692 A 7 TRP HE3 A 31 MET HE% 1.0 . 4.25 693 693 A 4 VAL HGx% A 7 TRP HE3 1.0 . 4.10 694 694 A 7 TRP HE3 A 20 LEU HDy% 1.0 . 3.87 695 695 A 28 VAL HGy% A 7 TRP HE3 1.0 . 4.29 696 696 A 16 TYR HD% A 8 LEU HDx% 1.0 . 4.27 697 697 A 16 TYR HD% A 46 ILE HG2% 1.0 . 4.40 698 698 A 16 TYR HE% A 51 HIS HBy 1.0 . 3.96 699 699 A 99 TYR HE% A 116 VAL HGy% 1.0 . 4.17 700 700 A 16 TYR HE% A 46 ILE HG2% 1.0 . 3.67 701 701 A 23 ASN HBx A 25 PHE HD% 1.0 . 3.82 702 702 A 123 GLY HAy A 25 PHE HD% 1.0 . 3.87 703 703 A 25 PHE HD% A 30 ALA HB% 1.0 . 4.28 704 704 A 25 PHE HD% A 122 ILE HG2% 1.0 . 3.31 705 705 A 25 PHE HD% A 4 VAL HGy% 1.0 . 3.45 706 706 A 25 PHE HD% A 44 ILE HD1% 1.0 . 4.01 707 707 A 122 ILE HG2% A 25 PHE HE% 1.0 . 4.05 708 708 A 122 ILE HD1% A 25 PHE HE% 1.0 . 4.40 709 709 A 19 HIS HD2 A 45 GLY HAx 1.0 . 3.94 710 710 A 87 LEU HDy% A 124 HIS HD2 1.0 . 4.48 711 711 A 87 LEU HDx% A 124 HIS HD2 1.0 . 3.91 712 712 A 46 ILE HG2% A 51 HIS HD2 1.0 . 3.71 713 713 A 128 ILE HA A 81 TRP HZ2 1.0 . 3.92 714 714 A 128 ILE HG2% A 81 TRP HZ2 1.0 . 3.29 715 715 A 81 TRP HZ2 A 132 LEU HDx% 1.0 . 3.68 716 716 A 81 TRP HZ2 A 128 ILE HD1% 1.0 . 4.48 717 717 A 132 LEU HDy% A 81 TRP HZ2 1.0 . 3.85 718 718 A 81 TRP HH2 A 94 PHE HZ 1.0 . 3.52 719 719 A 128 ILE HG2% A 81 TRP HH2 1.0 . 4.50 720 720 A 81 TRP HH2 A 132 LEU HDx% 1.0 . 4.13 721 721 A 132 LEU HDy% A 81 TRP HH2 1.0 . 4.54 722 722 A 82 LEU HDy% A 81 TRP HH2 1.0 . 4.44 723 723 A 82 LEU HDy% A 81 TRP HZ3 1.0 . 4.47 724 724 A 81 TRP HE3 A 78 VAL HA 1.0 . 3.65 725 725 A 81 TRP HE3 A 78 VAL HGy% 1.0 . 3.62 726 726 A 78 VAL HGx% A 81 TRP HE3 1.0 . 3.95 727 727 A 81 TRP HE3 A 105 LEU HDy% 1.0 . 4.46 728 728 A 81 TRP HE3 A 105 LEU HDx% 1.0 . 4.53 729 729 A 82 LEU HDx% A 81 TRP HE3 1.0 . 4.38 730 730 A 81 TRP HE3 A 82 LEU HDy% 1.0 . 4.37 731 731 A 90 TYR HD% A 87 LEU HDy% 1.0 . 3.83 732 732 A 90 TYR HD% A 119 ILE HG12 1.0 . 4.10 733 733 A 90 TYR HD% A 87 LEU HDx% 1.0 . 3.90 734 734 A 82 LEU HDy% A 90 TYR HD% 1.0 . 4.33 735 735 A 119 ILE HA A 90 TYR HE% 1.0 . 3.66 736 736 A 124 HIS HBy A 90 TYR HE% 1.0 . 3.64 737 737 A 124 HIS HBx A 90 TYR HE% 1.0 . 3.03 738 738 A 119 ILE HG2% A 90 TYR HE% 1.0 . 3.67 739 739 A 90 TYR HE% A 119 ILE HG12 1.0 . 3.51 740 740 A 94 PHE HD% A 105 LEU HDy% 1.0 . 3.28 741 741 A 82 LEU HDx% A 94 PHE HD% 1.0 . 3.51 742 742 A 117 LEU HDy% A 94 PHE HD% 1.0 . 4.14 743 743 A 82 LEU HDy% A 94 PHE HD% 1.0 . 4.43 744 744 A 81 TRP HZ3 A 94 PHE HE% 1.0 . 3.88 745 745 A 90 TYR HBx A 94 PHE HE% 1.0 . 3.28 746 746 A 94 PHE HE% A 128 ILE HD1% 1.0 . 3.35 747 747 A 94 PHE HE% A 119 ILE HD1% 1.0 . 3.43 748 748 A 82 LEU HDy% A 94 PHE HE% 1.0 . 3.85 749 749 A 128 ILE HG2% A 94 PHE HZ 1.0 . 3.89 750 750 A 105 LEU HDy% A 94 PHE HZ 1.0 . 4.17 751 751 A 94 PHE HZ A 128 ILE HD1% 1.0 . 4.24 752 752 A 94 PHE HZ A 119 ILE HD1% 1.0 . 3.87 753 753 A 117 LEU HDy% A 94 PHE HZ 1.0 . 3.95 754 754 A 82 LEU HDy% A 94 PHE HZ 1.0 . 4.40 755 755 A 99 TYR HD% A 94 PHE HD% 1.0 . 3.49 756 756 A 94 PHE HA A 99 TYR HD% 1.0 . 3.45 757 757 A 104 LEU HDx% A 99 TYR HD% 1.0 . 3.59 758 758 A 99 TYR HD% A 116 VAL HGx% 1.0 . 3.69 759 759 A 99 TYR HD% A 105 LEU HDy% 1.0 . 3.40 760 760 A 117 LEU HDx% A 99 TYR HD% 1.0 . 3.27 761 761 A 117 LEU HDy% A 99 TYR HD% 1.0 . 4.03 762 762 A 97 ASN HBy A 99 TYR HE% 1.0 . 3.66 763 763 A 97 ASN HBx A 99 TYR HE% 1.0 . 3.77 764 764 A 99 TYR HE% A 116 VAL HGx% 1.0 . 3.10 765 765 A 105 LEU HDy% A 99 TYR HE% 1.0 . 3.54 766 766 A 117 LEU HDx% A 99 TYR HE% 1.0 . 3.01 767 767 A 117 LEU HDy% A 99 TYR HE% 1.0 . 3.48 768 768 A 94 PHE HE% A 81 TRP HH2 1.0 . 4.22 769 769 A 90 TYR HD% A 94 PHE HE% 1.0 . 3.99 770 770 A 117 LEU HDy% A 94 PHE HE% 1.0 . 3.67 771 771 A 122 ILE HB A 25 PHE HE% 1.0 . 4.46 772 772 A 20 LEU HDy% A 25 PHE HE% 1.0 . 4.43 773 773 A 93 ALA HB% A 94 PHE HD% 1.0 . 4.30 774 774 A 90 TYR HBx A 94 PHE HD% 1.0 . 3.43 775 775 A 97 ASN HBx A 99 TYR HD% 1.0 . 3.88 776 776 A 99 TYR HD% A 105 LEU HDx% 1.0 . 4.27 777 777 A 117 LEU HBx A 90 TYR HE% 1.0 . 3.54 778 778 A 87 LEU HDx% A 90 TYR HE% 1.0 . 3.08 779 779 A 82 LEU HDy% A 90 TYR HE% 1.0 . 4.60 780 780 A 94 PHE HA A 99 TYR HE% 1.0 . 3.51 781 781 A 16 TYR HE% A 15 GLN HBy 1.0 . 4.21 782 782 A 16 TYR HE% A 15 GLN HBx 1.0 . 3.74 783 783 A 40 ASP HBy A 25 PHE HE% 1.0 . 4.20 784 784 A 36 MET HE% A 25 PHE HE% 1.0 . 4.70 785 785 A 81 TRP HZ3 A 94 PHE HZ 1.0 . 4.09 786 786 A 124 HIS HD2 A 24 GLY HAy 1.0 . 3.35 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin undefined _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 81 TRP HE1 A 131 SER OG 1.0 . 2.0 2 2 A 131 SER OG A 81 TRP NE1 1.0 . 3.0 3 3 A 123 GLY H A 23 ASN O 1.0 . 2.0 4 4 A 23 ASN O A 123 GLY N 1.0 . 3.0 5 5 A 43 GLU OE1 A 125 ARG HH1% 1.0 . 2.0 6 6 A 43 GLU OE1 A 125 ARG HH1% 1.0 . 3.0 7 7 A 110 GLU OE1 A 125 ARG HH2% 1.0 . 2.0 8 8 A 110 GLU OE1 A 125 ARG HH2% 1.0 . 3.0 9 9 A 40 ASP OD1 A 126 LYS HZ% 1.0 . 2.0 10 10 A 40 ASP OD1 A 126 LYS HZ% 1.0 . 3.0 11 11 A 86 GLU OE1 A 127 ARG HH1% 1.0 . 2.0 12 12 A 86 GLU OE1 A 127 ARG HH1% 1.0 . 3.0 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 hbond _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 7 TRP H A 3 THR O 1.0 . 2.0 2 2 A 3 THR O A 7 TRP N 1.0 . 3.0 3 3 A 8 LEU H A 4 VAL O 1.0 . 2.0 4 4 A 4 VAL O A 8 LEU N 1.0 . 3.0 5 5 A 9 GLU H A 5 GLY O 1.0 . 2.0 6 6 A 5 GLY O A 9 GLU N 1.0 . 3.0 7 7 A 10 SER H A 6 GLN O 1.0 . 2.0 8 8 A 6 GLN O A 10 SER N 1.0 . 3.0 9 9 A 11 ILE H A 7 TRP O 1.0 . 2.0 10 10 A 7 TRP O A 11 ILE N 1.0 . 3.0 11 11 A 12 GLY H A 8 LEU O 1.0 . 2.0 12 12 A 8 LEU O A 12 GLY N 1.0 . 3.0 13 13 A 20 LEU H A 16 TYR O 1.0 . 2.0 14 14 A 16 TYR O A 20 LEU N 1.0 . 3.0 15 15 A 21 MET H A 17 GLU O 1.0 . 2.0 16 16 A 17 GLU O A 21 MET N 1.0 . 3.0 17 17 A 22 ALA H A 18 ASN O 1.0 . 2.0 18 18 A 18 ASN O A 22 ALA N 1.0 . 3.0 19 19 A 23 ASN H A 19 HIS O 1.0 . 2.0 20 20 A 19 HIS O A 23 ASN N 1.0 . 3.0 21 21 A 24 GLY H A 21 MET O 1.0 . 2.0 22 22 A 21 MET O A 24 GLY N 1.0 . 3.0 23 23 A 25 PHE H A 20 LEU O 1.0 . 2.0 24 24 A 20 LEU O A 25 PHE N 1.0 . 3.0 25 25 A 26 ASP H A 24 GLY O 1.0 . 2.0 26 26 A 24 GLY O A 26 ASP N 1.0 . 3.0 27 27 A 30 ALA H A 27 ASN O 1.0 . 2.0 28 28 A 27 ASN O A 30 ALA N 1.0 . 3.0 29 29 A 28 VAL O A 31 MET H 1.0 . 2.0 30 30 A 28 VAL O A 31 MET N 1.0 . 3.0 31 31 A 32 GLY H A 29 GLN O 1.0 . 2.0 32 32 A 29 GLN O A 32 GLY N 1.0 . 3.0 33 33 A 41 LEU H A 37 GLU O 1.0 . 2.0 34 34 A 37 GLU O A 41 LEU N 1.0 . 3.0 35 35 A 42 LEU H A 38 ASP O 1.0 . 2.0 36 36 A 38 ASP O A 42 LEU N 1.0 . 3.0 37 37 A 43 GLU H A 39 GLN O 1.0 . 2.0 38 38 A 39 GLN O A 43 GLU N 1.0 . 3.0 39 39 A 44 ILE H A 40 ASP O 1.0 . 2.0 40 40 A 40 ASP O A 44 ILE N 1.0 . 3.0 41 41 A 55 ILE H A 51 HIS O 1.0 . 2.0 42 42 A 51 HIS O A 55 ILE N 1.0 . 3.0 43 43 A 56 LEU H A 52 ARG O 1.0 . 2.0 44 44 A 52 ARG O A 56 LEU N 1.0 . 3.0 45 45 A 57 GLN H A 53 GLN O 1.0 . 2.0 46 46 A 53 GLN O A 57 GLN N 1.0 . 3.0 47 47 A 58 ALA H A 54 ARG O 1.0 . 2.0 48 48 A 54 ARG O A 58 ALA N 1.0 . 3.0 49 49 A 59 ILE H A 55 ILE O 1.0 . 2.0 50 50 A 55 ILE O A 59 ILE N 1.0 . 3.0 51 51 A 60 GLN H A 56 LEU O 1.0 . 2.0 52 52 A 56 LEU O A 60 GLN N 1.0 . 3.0 53 53 A 61 LEU H A 57 GLN O 1.0 . 2.0 54 54 A 57 GLN O A 61 LEU N 1.0 . 3.0 55 55 A 62 LEU H A 58 ALA O 1.0 . 2.0 56 56 A 58 ALA O A 62 LEU N 1.0 . 3.0 57 57 A 81 TRP H A 77 SER O 1.0 . 2.0 58 58 A 77 SER O A 81 TRP N 1.0 . 3.0 59 59 A 82 LEU H A 78 VAL O 1.0 . 2.0 60 60 A 78 VAL O A 82 LEU N 1.0 . 3.0 61 61 A 83 ASP H A 79 ALA O 1.0 . 2.0 62 62 A 79 ALA O A 83 ASP N 1.0 . 3.0 63 63 A 91 THR H A 88 GLY O 1.0 . 2.0 64 64 A 88 GLY O A 91 THR N 1.0 . 3.0 65 65 A 92 LYS H A 89 ASP O 1.0 . 2.0 66 66 A 89 ASP O A 92 LYS N 1.0 . 3.0 67 67 A 94 PHE H A 90 TYR O 1.0 . 2.0 68 68 A 90 TYR O A 94 PHE N 1.0 . 3.0 69 69 A 95 LEU H A 91 THR O 1.0 . 2.0 70 70 A 91 THR O A 95 LEU N 1.0 . 3.0 71 71 A 96 ILE H A 92 LYS O 1.0 . 2.0 72 72 A 92 LYS O A 96 ILE N 1.0 . 3.0 73 73 A 97 ASN H A 93 ALA O 1.0 . 2.0 74 74 A 93 ALA O A 97 ASN N 1.0 . 3.0 75 75 A 98 GLY H A 95 LEU O 1.0 . 2.0 76 76 A 95 LEU O A 98 GLY N 1.0 . 3.0 77 77 A 99 TYR H A 94 PHE O 1.0 . 2.0 78 78 A 94 PHE O A 99 TYR N 1.0 . 3.0 79 79 A 105 LEU H A 102 MET O 1.0 . 2.0 80 80 A 102 MET O A 105 LEU N 1.0 . 3.0 81 81 A 103 ASP O A 106 LYS H 1.0 . 2.0 82 82 A 103 ASP O A 106 LYS N 1.0 . 3.0 83 83 A 104 LEU O A 107 LYS H 1.0 . 2.0 84 84 A 104 LEU O A 107 LYS N 1.0 . 3.0 85 85 A 113 LEU H A 109 ALA O 1.0 . 2.0 86 86 A 109 ALA O A 113 LEU N 1.0 . 3.0 87 87 A 114 ILE H A 110 GLU O 1.0 . 2.0 88 88 A 110 GLU O A 114 ILE N 1.0 . 3.0 89 89 A 115 ASN H A 111 VAL O 1.0 . 2.0 90 90 A 111 VAL O A 115 ASN N 1.0 . 3.0 91 91 A 116 VAL H A 112 GLU O 1.0 . 2.0 92 92 A 112 GLU O A 116 VAL N 1.0 . 3.0 93 93 A 117 LEU H A 113 LEU O 1.0 . 2.0 94 94 A 113 LEU O A 117 LEU N 1.0 . 3.0 95 95 A 125 ARG H A 121 LEU O 1.0 . 2.0 96 96 A 121 LEU O A 125 ARG N 1.0 . 3.0 97 97 A 126 LYS H A 122 ILE O 1.0 . 2.0 98 98 A 122 ILE O A 126 LYS N 1.0 . 3.0 99 99 A 127 ARG H A 123 GLY O 1.0 . 2.0 100 100 A 123 GLY O A 127 ARG N 1.0 . 3.0 101 101 A 128 ILE H A 124 HIS O 1.0 . 2.0 102 102 A 124 HIS O A 128 ILE N 1.0 . 3.0 103 103 A 129 LEU H A 125 ARG O 1.0 . 2.0 104 104 A 125 ARG O A 129 LEU N 1.0 . 3.0 105 105 A 130 ALA H A 126 LYS O 1.0 . 2.0 106 106 A 126 LYS O A 130 ALA N 1.0 . 3.0 107 107 A 131 SER H A 127 ARG O 1.0 . 2.0 108 108 A 127 ARG O A 131 SER N 1.0 . 3.0 109 109 A 132 LEU H A 128 ILE O 1.0 . 2.0 110 110 A 128 ILE O A 132 LEU N 1.0 . 3.0 111 111 A 133 GLY H A 129 LEU O 1.0 . 2.0 112 112 A 129 LEU O A 133 GLY N 1.0 . 3.0 stop_ save_